A0A3Q0KBB9_SCHMA Loading...

Ecdysone-induced protein E78; Nuclear hormone receptor superfamily protein-related

AlphaFold DB , UniProt , Accession A0A3Q0KBB9, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,086 aa.

						>A0A3Q0KBB9_SCHMA|A0A3Q0KBB9
MAISPESNFDLKADPGSASFSDSGVSSSFSLKTNASASVSIIPSPPLSGFPGCTDSNGSPSLDQPYLNFPNKTYPGFSDCSNLPMSANHPYPLPSRHSFPQGFLPSPPSAYASNYTSSHGVSNSFYQRQVPSTICSAPNSNYGLSQIFPHDMLQNSMLVNRDQHNGSVSSLEGHFSQHPDHGQFPYSDPFHPSDLRPLHITTSPRQLGPHNSHTNMGDVTCTDSIVKISPRGSPNGVPDHSITPCGTVSSGPGSMVNCRSSRTIERGSEVSAADSNSNVGSIKATFTPCKVCGDKASGYHYGVISCEGCKGFFRRSIQKQIEYKCLRDGKCLVIRLNRNRCQYCRFRKCLAAGMSKDSVRYGRMPRRTRGSDCGRDGSDQLMSMQHNSSTNSVRIDSTIGNGSGHVSAFIPPPSCTSELSGNSAVVGAAVATTTTTTNMTTGRYGVCSRPGNDHLGLYETILTISQAYQNFSPYTDEKIKVMRCRPITLSNVTREFWPEKVDEHRLRMHEELSQLLAPCIQHVVEFAKRIPEFSSLGQPDQLVLIKAAFFEVWLVQASRLISTNDRKITLADGKQITKQELDFIYSPSVVCSIFSFSENFNSLVLNDTEVALCCAAVITKPNRYGLIEPNKVAIIQDHHLAALRMQLERNRPREATLIGQVRNVINQVTTVGDEVQLCIRWYRENWYRTRLAPLYAETYDIPHEDTSTVPISNQGALTPLPNPSQHTGNSYPICPNISSVCPQAIPYGDVTNTTPLNYGSSTVSIPQAVHHHYPNQSINRSDISNMIPSCSINENMIYCNNSNNSNGNRIQTGNIDHCSSDGQIHDVTQKQNSQHQIHQQSHLIPDSSHMRGSYSSTTNLTSNSDSPLNNQSHPFSGQFNYHDNSITYNPSNSNAYSNSRDCSPSSTQMLSTNYLVPSPQQQQQRSQVSALQSSQYSCSSAITSPQRQVTSSVQSTGIISTQNQNDHMNLNKSIISVKNHSSRSNTPTSYNNNIIHPSSTNESLPPLWTNMNPDSNNNNGNNGLNDHTISSNGGTPEIQQQSHHQQYHTSPISQSDLMNTTPDTNHNLNALSSPINETLSCEQQDA
					

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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	35.8	Very low	35.5	Very low	214 Å²	214	132.2 Å²	132.2	100%	1.054	72%	0.721	S	S	*	*				0	138.3	0	-69.2	170.1	165.2	0	0	107.5	Q946	M1-Q946 WeakPolarHBondContact O-CG 3.33Å; M1-Q946 PolarHBondContact O-NE2 3.33Å; M1-Q946 PolarHBondContact O-OE1 2.82Å
2	A	29.4	Very low	35.6	Very low	55 Å²	55	137.7 Å²	137.7	46%	0.455	73%	0.732	S	S	.	*			trans	58.3	97.8	-170.1	0	0	0	0	0	113.5	Q946	A2-Q946 VanDerWaalsContact O-CD 3.23Å; A2-Q946 PolarHBondContact O-NE2 3.45Å; A2-Q946 PolarHBondContact O-OE1 3.16Å; A2-Q946 VanDerWaalsContact O-OE1 3.08Å
3	I	28.2	Very low	35.7	Very low	151 Å²	151	133.4 Å²	133.4	77%	0.774	73%	0.728	S	S	*	*			cis	71.4	128	39.6	-43.4	166	0	0	0	111.6
4	S	44.7	Very low	35.7	Very low	92 Å²	92	134.6 Å²	134.6	64%	0.643	73%	0.734	S	S	*	*			trans	-69.8	-177.7	173.5	-50.4	0	0	0	0	111.5
5	P	41.3	Very low	35.9	Very low	106 Å²	106	133.3 Å²	133.3	69%	0.688	74%	0.735	S	S	*	*				-129.2	165	94.5	42.8	-35.3	0	0	0	110.5
6	E	36.9	Very low	35.9	Very low	178 Å²	178	129.6 Å²	129.6	83%	0.832	74%	0.736	S	S	*	*			cis	62.7	143.3	40.8	-61.4	-158.6	148.5	0	0	112.4
7	S	35.1	Very low	35.6	Very low	83 Å²	83	129.2 Å²	129.2	58%	0.58	74%	0.743	S	S	*	*			cis	-158.1	165.9	-12.6	48	0	0	0	0	108.9
8	N	33.9	Very low	35.7	Very low	147 Å²	147	127.2 Å²	127.2	79%	0.786	75%	0.745	S	S	*	*			trans	159.2	113.2	144.5	-79.2	-16.8	0	0	0	107.3
9	F	34.2	Very low	35.5	Very low	168 Å²	168	125.6 Å²	125.6	74%	0.737	74%	0.741	S	S	*	*				57.4	117.8	57.5	-79.9	-79.5	0	0	0	114.9	L11	F9-L11 HydrophobicContact CD1-CD1 4.02Å; F9-L11 HydrophobicContact CD1-CG 4.31Å; F9-L11 HydrophobicContact CE1-CD1 4.02Å
10	D	36.7	Very low	35.4	Very low	153 Å²	153	129 Å²	129	82%	0.818	75%	0.746	S	S	*	*				-150.5	169.1	115.2	-143.2	-32.1	0	0	0	110.7
11	L	34.5	Very low	35.3	Very low	107 Å²	107	127.3 Å²	127.3	56%	0.56	74%	0.742	S	S	*	*			trans	-139.5	143.2	-160.8	-83.9	162.5	0	0	0	115.3	F9	F9-L11 HydrophobicContact CD1-CD1 4.02Å; F9-L11 HydrophobicContact CD1-CG 4.31Å; F9-L11 HydrophobicContact CE1-CD1 4.02Å
12	K	36.5	Very low	35.3	Very low	198 Å²	198	124 Å²	124	86%	0.861	73%	0.729	S	S	*	*			trans	179.2	136.9	151.1	-102.3	146.6	-173	163.6	0	109.6
13	A	36.9	Very low	35.5	Very low	82 Å²	82	126.6 Å²	126.6	68%	0.678	74%	0.744	S	S	*	*			cis	68.5	133.5	40.7	0	0	0	0	0	112.4
14	D	35.9	Very low	35.9	Very low	151 Å²	151	122.8 Å²	122.8	81%	0.807	74%	0.742	S	S	*	*			cis	-164.8	-156	7.3	-123.6	-33.9	0	0	0	107.4
15	P	39.1	Very low	35.3	Very low	115 Å²	115	125.2 Å²	125.2	75%	0.747	75%	0.753	S	S	*	*				-131.1	172	-54.7	38.7	-23.3	0	0	0	115.1
16	G	35.3	Very low	34.9	Very low	73 Å²	73	126 Å²	126	75%	0.753	76%	0.761	S	S	*	*			trans	77.6	175.6	150.7	0	0	0	0	0	120.1
17	S	31.5	Very low	34.9	Very low	123 Å²	123	123.4 Å²	123.4	86%	0.86	76%	0.762	S	S	*	*			cis	179.5	93.1	-27.8	50.4	0	0	0	0	112.5
18	A	36.2	Very low	34.8	Very low	93 Å²	93	124.2 Å²	124.2	77%	0.769	77%	0.768	S	S	*	*			trans	-171.2	129.9	160.7	0	0	0	0	0	108.5
19	S	32	Very low	34.9	Very low	97 Å²	97	127 Å²	127	68%	0.678	77%	0.773	S	S	*	*			cis	99.7	133.5	26.6	80.8	0	0	0	0	114.4
20	F	33.6	Very low	34.8	Very low	193 Å²	193	123.7 Å²	123.7	85%	0.846	77%	0.771	S	S	*	*			trans	64.4	145.9	178	-65.4	-95.1	0	0	0	117.7
21	S	34	Very low	34.8	Very low	95 Å²	95	123 Å²	123	66%	0.664	77%	0.766	S	S	*	*			cis	-171.4	155.5	-22.2	49.1	0	0	0	0	111.8
22	D	34.6	Very low	34.8	Very low	144 Å²	144	126 Å²	126	77%	0.77	78%	0.775	S	S	*	*			trans	30.9	119.8	133.3	-157.9	24.4	0	0	0	118.3
23	S	35.2	Very low	34.8	Very low	109 Å²	109	121.9 Å²	121.9	76%	0.762	77%	0.766	S	S	*	*				164.9	167.8	79	47.7	0	0	0	0	109.1
24	G	35.7	Very low	34.5	Very low	72 Å²	72	125 Å²	125	74%	0.742	77%	0.772	S	S	*	*			cis	-176.7	173.1	-2.9	0	0	0	0	0	112.6
25	V	31.8	Very low	34.5	Very low	143 Å²	143	122 Å²	122	87%	0.867	77%	0.767	S	S	*	*			trans	-90.1	142.4	175.2	-76.7	0	0	0	0	112.1
26	S	32.3	Very low	34.1	Very low	123 Å²	123	122.6 Å²	122.6	86%	0.86	78%	0.775	S	S	*	*			trans	170.1	156.6	152.3	-84.9	0	0	0	0	109.6
27	S	38.3	Very low	34.2	Very low	122 Å²	122	123.3 Å²	123.3	85%	0.853	77%	0.774	S	S	*	*			cis	-140.5	174.4	25.6	55	0	0	0	0	114.1
28	S	32.5	Very low	34.1	Very low	100 Å²	100	122.5 Å²	122.5	70%	0.699	77%	0.768	S	S	*	*			trans	-121.2	147.1	-165.7	51.6	0	0	0	0	114.2
29	F	35.5	Very low	34	Very low	207 Å²	207	124.2 Å²	124.2	91%	0.908	77%	0.769	S	S	*	*			trans	-148.7	103.8	155.3	-98.4	-86.9	0	0	0	105.6
30	S	32.8	Very low	33.9	Very low	98 Å²	98	124.4 Å²	124.4	69%	0.685	77%	0.77	S	S	*	*			cis	90.4	145.3	39.5	-163.9	0	0	0	0	113.1
31	L	36.3	Very low	33.8	Very low	138 Å²	138	122 Å²	122	72%	0.723	76%	0.764	S	S	*	*			trans	80.4	134.2	-172.2	-49.8	166.9	0	0	0	115.7
32	K	35.9	Very low	33.9	Very low	170 Å²	170	124.6 Å²	124.6	74%	0.739	77%	0.769	S	S	*	*			cis	-172.5	143.7	-24.2	-125.6	-177.5	-165.1	172.5	0	110
33	T	35.4	Very low	34.1	Very low	111 Å²	111	123.3 Å²	123.3	68%	0.681	77%	0.769	S	S	*	*			trans	59.4	156.3	153	55.2	0	0	0	0	119.8
34	N	31.6	Very low	34.3	Very low	148 Å²	148	122.9 Å²	122.9	79%	0.791	77%	0.766	S	S	*	*			cis	-165.7	167.4	-22	-104.3	0.4	0	0	0	109.6
35	A	35.8	Very low	34.7	Very low	87 Å²	87	125.6 Å²	125.6	72%	0.719	77%	0.77	S	S	*	*			trans	65.4	105.6	150.1	0	0	0	0	0	121.9
36	S	30.9	Very low	35.2	Very low	128 Å²	128	124.2 Å²	124.2	90%	0.895	76%	0.764	S	S	*	*				39.1	101.6	112.5	-46.2	0	0	0	0	122.4
37	A	35.4	Very low	35.4	Very low	89 Å²	89	126 Å²	126	74%	0.736	76%	0.763	S	S	*	*			trans	-170.4	145.9	137.6	0	0	0	0	0	107
38	S	30.1	Very low	35.3	Very low	106 Å²	106	125.3 Å²	125.3	74%	0.741	76%	0.758	S	S	*	*			cis	67.7	141.8	34	74.2	0	0	0	0	115.4
39	V	34.2	Very low	35.3	Very low	129 Å²	129	123.8 Å²	123.8	78%	0.782	76%	0.759	S	S	*	*			trans	72.3	118.6	-167.1	-168.2	0	0	0	0	112.2
40	S	29.8	Very low	35.3	Very low	101 Å²	101	123.8 Å²	123.8	71%	0.706	76%	0.759	S	S	*	*			cis	103.9	148	27.1	-64.7	0	0	0	0	113.5
41	I	32.9	Very low	35.6	Very low	141 Å²	141	124.6 Å²	124.6	72%	0.723	76%	0.762	S	S	*	*			trans	77.3	108.2	163.9	-64.7	154.4	0	0	0	114.7
42	I	34	Very low	35.5	Very low	150 Å²	150	121.3 Å²	121.3	77%	0.769	76%	0.761	S	S	*	*				75.5	149.8	79.9	-71.8	165.9	0	0	0	112.1
43	P	39.8	Very low	35.2	Very low	117 Å²	117	117.7 Å²	117.7	76%	0.76	76%	0.756	S	S	*	*			cis	-128.1	179.6	4.6	39	-21.8	0	0	0	117
44	S	38.8	Very low	35.2	Very low	101 Å²	101	116 Å²	116	71%	0.706	75%	0.746	S	S	*	*			trans	-80	167.5	160.8	-35.1	0	0	0	0	113.3
45	P	45.5	Very low	35.3	Very low	128 Å²	128	113 Å²	113	83%	0.831	73%	0.73	S	S	*	*			trans	-86.2	126.7	156.1	33	-29.5	0	0	0	111.6
46	P	40.5	Very low	35.3	Very low	114 Å²	114	112.7 Å²	112.7	74%	0.74	72%	0.722	S	S	*	*			trans	-102.6	174	174.3	39.6	-34.6	0	0	0	112.9
47	L	36.9	Very low	35.3	Very low	160 Å²	160	114.2 Å²	114.2	84%	0.838	72%	0.72	S	S	*	*			trans	167.3	98.6	146.6	-91.5	160	0	0	0	108
48	S	36.9	Very low	35.2	Very low	108 Å²	108	113.9 Å²	113.9	76%	0.755	73%	0.725	S	S	*	*				85	119.3	95	67.7	0	0	0	0	114.6
49	G	33.2	Very low	35.3	Very low	68 Å²	68	114.5 Å²	114.5	70%	0.701	73%	0.729	S	S	*	*			cis	-179.2	160.6	-6	0	0	0	0	0	114.4
50	F	34.6	Very low	35.5	Very low	207 Å²	207	113.7 Å²	113.7	91%	0.908	73%	0.727	S	S	*	*			trans	10.7	162.4	149.9	-59.1	-77.3	0	0	0	123
51	P	39.1	Very low	35.7	Very low	116 Å²	116	113.9 Å²	113.9	75%	0.753	73%	0.728	S	S	*	*			cis	-129.3	167.7	-33.1	36.6	-19.9	0	0	0	112.4
52	G	33.1	Very low	35.6	Very low	68 Å²	68	114.8 Å²	114.8	70%	0.701	73%	0.734	S	S	*	*				99.1	161.1	99.1	0	0	0	0	0	112.3
53	C	30.8	Very low	35.7	Very low	95 Å²	95	115.1 Å²	115.1	64%	0.642	74%	0.737	S	S	*	*			cis	-157.4	-166.8	-13.6	-94.8	0	0	0	0	110.2	L1024	C53-L1024 WeakPolarHBondContact CB-O 2.96Å
54	T	35.4	Very low	35.4	Very low	76 Å²	76	118 Å²	118	47%	0.466	74%	0.74	S	S	.	*			trans	-80.6	-171.6	-163.8	13.1	0	0	0	0	115.6	G1023 L1024 N1025	T54-G1023 VanDerWaalsContact OG1-CA 3.29Å; T54-G1023 WeakPolarHBondContact OG1-CA 3.04Å; T54-G1023 PolarHBondContact OG1-N 3.46Å; T54-L1024 CarbonylContact O-C 3.3Å; T54-L1024 WeakPolarHBondContact O-CA 3.45Å; T54-L1024 PolarHBondContact O-N 3.5Å; T54-L1024 VanDerWaalsContact O-N 3.09Å; T54-N1025 WeakPolarHBondContact O-CA 3.38Å; T54-N1025 PolarHBondContact O-N 3Å
55	D	32.6	Very low	35.3	Very low	85 Å²	85	118 Å²	118	46%	0.455	74%	0.738	S	S	.	*			cis	-158.3	164.6	20.1	-137.6	-41.4	0	0	0	116.1	G1023	D55-G1023 VanDerWaalsContact OD2-CA 3.24Å; D55-G1023 WeakPolarHBondContact OD2-CA 3.17Å
56	S	35.7	Very low	34.7	Very low	79 Å²	79	121.7 Å²	121.7	55%	0.552	74%	0.737	S	S	*	*			trans	48.1	118.2	140.3	-76.9	0	0	0	0	125.8
57	N	32.6	Very low	34.2	Very low	161 Å²	161	122.5 Å²	122.5	86%	0.861	73%	0.734	S	S	*	*				58.3	123	119.8	-61	-46	0	0	0	122.5
58	G	33.1	Very low	33.9	Very low	81 Å²	81	120.5 Å²	120.5	84%	0.835	72%	0.724	S	S	*	*			trans	-175.2	72.6	168.2	0	0	0	0	0	116.2
59	S	31.5	Very low	33.8	Very low	119 Å²	119	124.1 Å²	124.1	83%	0.832	73%	0.727	S	S	*	*			trans	-81.2	164	166.7	-55.7	0	0	0	0	110.9
60	P	39.4	Very low	34.1	Very low	113 Å²	113	125.6 Å²	125.6	73%	0.734	72%	0.724	S	S	*	*			cis	-145.4	-176	19.7	43.1	-23.1	0	0	0	118.3
61	S	32.5	Very low	34	Very low	105 Å²	105	122.4 Å²	122.4	73%	0.734	72%	0.717	S	S	*	*			trans	73.6	134	149.3	59	0	0	0	0	122.4
62	L	32.5	Very low	33.7	Very low	159 Å²	159	126.6 Å²	126.6	83%	0.832	72%	0.723	S	S	*	*			trans	54.6	104.2	163.5	-96.5	65.3	0	0	0	118.8
63	D	35.4	Very low	33.7	Very low	158 Å²	158	129.1 Å²	129.1	85%	0.845	73%	0.725	S	S	*	*				-173.6	180	98.8	-98.6	-24.1	0	0	0	112.6
64	Q	34	Very low	33.8	Very low	177 Å²	177	134.7 Å²	134.7	83%	0.827	73%	0.734	S	S	*	*			trans	-95.1	-178.6	-178.7	-58.3	-173.6	-11.4	0	0	112.5
65	P	36.4	Very low	33.8	Very low	101 Å²	101	136.9 Å²	136.9	66%	0.656	75%	0.749	S	S	*	*				-121.1	-148.8	-63.8	38	-23.5	0	0	0	110.6
66	Y	31.4	Very low	33.8	Very low	205 Å²	205	135.3 Å²	135.3	80%	0.804	75%	0.753	S	S	*	*			trans	97.4	123	169.1	-70.7	-81.6	0	0	0	120.5
67	L	32	Very low	33.9	Very low	132 Å²	132	135.5 Å²	135.5	69%	0.691	74%	0.744	S	S	*	*			trans	76	104.8	139.5	-59.4	166.3	0	0	0	123.5
68	N	30.1	Very low	34	Very low	117 Å²	117	131.5 Å²	131.5	63%	0.626	73%	0.729	S	S	*	*				91.8	153.6	114.4	-74	-2.2	0	0	0	124.3
69	F	34	Very low	34	Very low	184 Å²	184	134.5 Å²	134.5	81%	0.807	73%	0.726	S	S	*	*			trans	83.8	142.7	160.7	-58	-70.5	0	0	0	118.6
70	P	39.1	Very low	34	Very low	100 Å²	100	135.5 Å²	135.5	65%	0.649	73%	0.731	S	S	*	*			cis	-144.1	159.7	-31.5	38.3	-21.5	0	0	0	117.9
71	N	33.4	Very low	33.7	Very low	140 Å²	140	134.6 Å²	134.6	75%	0.749	73%	0.727	S	S	*	*			trans	58.2	113.5	140.8	-69.9	-24.7	0	0	0	122.3
72	K	32.1	Very low	33.8	Very low	204 Å²	204	135.8 Å²	135.8	89%	0.887	73%	0.726	S	S	*	*				-150.6	85.5	114	-115	173	-172.4	171.3	0	111.4
73	T	33	Very low	33.8	Very low	120 Å²	120	135.5 Å²	135.5	74%	0.736	72%	0.724	S	S	*	*			trans	-114	140.7	178.4	-48.2	0	0	0	0	109.8
74	Y	33.1	Very low	33.9	Very low	213 Å²	213	133.1 Å²	133.1	84%	0.835	72%	0.717	S	S	*	*			trans	-113.3	150.5	169.3	-91	-93.4	0	0	0	110.4
75	P	36.4	Very low	33.7	Very low	121 Å²	121	132.7 Å²	132.7	79%	0.786	72%	0.717	S	S	*	*			trans	-103.1	166.7	-142.7	38.4	-37.8	0	0	0	116.1
76	G	33	Very low	33.7	Very low	52 Å²	52	133 Å²	133	54%	0.536	72%	0.722	S	S	.	*			trans	-150.2	170.4	163.4	0	0	0	0	0	111.6
77	F	36	Very low	33.8	Very low	84 Å²	84	126.6 Å²	126.6	37%	0.368	71%	0.712	S	S	.	*			trans	-160.7	164.1	160.8	42	116	0	0	0	105.9	P1051 I1052 S1053 Q1054	F77-P1051 HydrophobicContact CE2-CG 4.48Å; F77-P1051 HydrophobicContact CZ-CG 4.31Å; F77-I1052 HydrophobicContact CE1-CB 4.42Å; F77-I1052 HydrophobicContact CE1-CG1 3.83Å; F77-I1052 HydrophobicContact CZ-CG1 4.37Å; F77-S1053 WeakPolarHBondContact CD1-OG 3.44Å; F77-S1053 WeakPolarHBondContact CG-OG 3.3Å; F77-S1053 WeakPolarHBondContact O-CB 3.25Å; F77-S1053 PolarHBondContact O-OG 2.78Å; F77-Q1054 WeakPolarHBondContact O-CB 3.17Å; F77-Q1054 PolarHBondContact O-N 2.86Å
78	S	35	Very low	33.9	Very low	77 Å²	77	127.1 Å²	127.1	54%	0.538	72%	0.715	S	S	.	*			cis	97	129	20.4	-41.6	0	0	0	0	115.8	Q1054	S78-Q1054 PolarHBondContact N-O 3.19Å
79	D	33.1	Very low	34.3	Very low	143 Å²	143	129.5 Å²	129.5	77%	0.765	72%	0.722	S	S	*	*			trans	75	113.6	152.4	-51.9	-39.9	0	0	0	123.4
80	C	31.7	Very low	34.6	Very low	140 Å²	140	124.7 Å²	124.7	95%	0.946	71%	0.709	S	S	*	*				-146.3	143.9	125.6	-104.5	0	0	0	0	108.9
81	S	34.3	Very low	34.5	Very low	94 Å²	94	129.9 Å²	129.9	66%	0.657	72%	0.717	S	S	*	*			trans	-146.7	168	-170.9	57	0	0	0	0	113.9
82	N	33.8	Very low	34.8	Very low	130 Å²	130	129.1 Å²	129.1	70%	0.695	72%	0.72	S	S	*	*			trans	92.8	102.7	170.9	-52.1	-70.5	0	0	0	119.5
83	L	33.5	Very low	35.1	Very low	154 Å²	154	126.8 Å²	126.8	81%	0.806	72%	0.716	S	S	*	*				58.9	167.4	117	-68.1	167.8	0	0	0	121.1
84	P	36.6	Very low	35.5	Very low	108 Å²	108	126.4 Å²	126.4	70%	0.701	72%	0.716	S	S	*	*			cis	-132.1	160.5	-7	25.5	-2.5	0	0	0	117.6
85	M	30.6	Very low	35.7	Very low	168 Å²	168	121.4 Å²	121.4	83%	0.828	71%	0.712	S	S	*	*			trans	54	147	141	-65.4	-168.1	74.7	0	0	125.9
86	S	34.7	Very low	35.6	Very low	107 Å²	107	126 Å²	126	75%	0.748	71%	0.713	S	S	*	*			trans	74.9	154	153	-75.4	0	0	0	0	121.2
87	A	34.5	Very low	35.9	Very low	71 Å²	71	131.7 Å²	131.7	59%	0.587	73%	0.726	S	S	*	*			cis	-177.3	142.8	-32.5	0	0	0	0	0	110.4
88	N	33.1	Very low	35.9	Very low	142 Å²	142	131.8 Å²	131.8	76%	0.759	74%	0.737	S	S	*	*			trans	64.5	163.6	161.5	-56.8	-25.8	0	0	0	116.2
89	H	38.7	Very low	35.9	Very low	168 Å²	168	137.3 Å²	137.3	78%	0.778	75%	0.752	S	S	*	*			cis	-152.2	-172.1	-6.4	-123.4	-16.4	0	0	0	110.4
90	P	41.7	Very low	36.3	Very low	83 Å²	83	135.4 Å²	135.4	54%	0.539	75%	0.747	S	S	.	*			trans	-137.5	-174.7	-138.4	45.5	-26.2	0	0	0	119.2
91	Y	36	Very low	36.6	Very low	209 Å²	209	138.1 Å²	138.1	82%	0.82	75%	0.746	S	S	*	*			trans	71	169.1	152.9	-71.8	-43.1	0	0	0	118.4
92	P	39.7	Very low	36.6	Very low	123 Å²	123	137 Å²	137	80%	0.799	75%	0.749	S	S	*	*			cis	-134.4	-175.6	14	43.5	-25.4	0	0	0	118.9
93	L	38.9	Very low	36.8	Very low	155 Å²	155	141 Å²	141	81%	0.812	76%	0.761	S	S	*	*			trans	-112.4	162.7	175.7	-78.6	162.7	0	0	0	112.4
94	P	41.8	Very low	36.9	Very low	113 Å²	113	141.2 Å²	141.2	73%	0.734	76%	0.762	S	S	*	*				-129.9	146.2	129.2	8.7	13.7	0	0	0	112.1
95	S	37.1	Very low	37	Very low	107 Å²	107	141 Å²	141	75%	0.748	76%	0.76	S	S	*	*				72.3	139.6	58.5	-65.2	0	0	0	0	114.1
96	R	34.1	Very low	37.4	Very low	217 Å²	217	138.1 Å²	138.1	82%	0.819	76%	0.757	S	S	*	*			cis	-165.4	-169.2	4.9	-129.9	-179.7	179.4	-167.2	0.1	112.4
97	H	37.9	Very low	37.9	Very low	173 Å²	173	138.7 Å²	138.7	80%	0.801	76%	0.758	S	S	*	*			trans	85.6	160.1	169.3	-53.2	-74.8	0	0	0	117.3
98	S	36.1	Very low	38.3	Very low	85 Å²	85	141.5 Å²	141.5	59%	0.594	77%	0.77	S	S	*	*			cis	174.1	160.1	-38.2	-90.3	0	0	0	0	107.1
99	F	36.8	Very low	38.5	Very low	194 Å²	194	140.4 Å²	140.4	85%	0.851	77%	0.774	S	S	*	*			cis	-152.5	-166.3	-2	-116	-29.5	0	0	0	109.6
100	P	41.2	Very low	38.4	Very low	103 Å²	103	136.7 Å²	136.7	67%	0.669	77%	0.772	S	S	*	*			trans	-128.1	-175.1	-143.8	47.8	-34.9	0	0	0	119.4
101	Q	37.4	Very low	38.3	Very low	196 Å²	196	143.4 Å²	143.4	92%	0.916	79%	0.788	S	S	*	*			trans	78.4	135.2	157.9	-68.9	-176.1	-9.1	0	0	120.7
102	G	34.2	Very low	38.4	Very low	70 Å²	70	137.4 Å²	137.4	72%	0.722	78%	0.781	S	S	*	*			trans	166.7	64.7	170.5	0	0	0	0	0	120.2
103	F	37.2	Very low	38.3	Very low	216 Å²	216	136.4 Å²	136.4	95%	0.947	78%	0.778	S	S	*	*			trans	58.7	166.7	152.7	-73.1	-84.9	0	0	0	123.9
104	L	36.4	Very low	38.1	Very low	157 Å²	157	135.9 Å²	135.9	82%	0.822	78%	0.775	S	S	*	*			trans	-98.3	-175.8	-170.2	-72.3	161.1	0	0	0	112.1
105	P	39.5	Very low	37.9	Very low	103 Å²	103	141.2 Å²	141.2	67%	0.669	78%	0.783	S	S	*	*			cis	-138.8	177.8	-41.9	35.7	-17.9	0	0	0	115.2
106	S	38.7	Very low	37.9	Very low	108 Å²	108	142.2 Å²	142.2	76%	0.755	78%	0.784	S	S	*	*			trans	70.7	151.9	154.9	33.5	0	0	0	0	120.6
107	P	44	Very low	38	Very low	120 Å²	120	137.3 Å²	137.3	78%	0.779	78%	0.783	S	S	*	*			trans	-97	156.1	-173.6	38.3	-35.5	0	0	0	114.4
108	P	44.2	Very low	38	Very low	129 Å²	129	132.8 Å²	132.8	84%	0.838	77%	0.771	S	S	*	*			trans	-93.8	153	174.4	36.4	-33.7	0	0	0	113.7
109	S	37.4	Very low	38.1	Very low	120 Å²	120	137.5 Å²	137.5	84%	0.839	78%	0.783	S	S	*	*			trans	-134.7	124.5	163.6	58.4	0	0	0	0	110.2
110	A	37	Very low	38.1	Very low	89 Å²	89	131.6 Å²	131.6	74%	0.736	78%	0.777	S	S	*	*			trans	-162.1	131.8	173.9	0	0	0	0	0	112.7
111	Y	38	Very low	37.9	Very low	225 Å²	225	133.4 Å²	133.4	88%	0.882	79%	0.786	S	S	*	*			trans	160.6	88.8	136.5	-92.8	-68.4	0	0	0	106.4
112	A	37.7	Very low	37.8	Very low	82 Å²	82	128.4 Å²	128.4	68%	0.678	77%	0.772	S	S	*	*				80.6	138.2	94.2	0	0	0	0	0	112.4
113	S	38.3	Very low	37.8	Very low	103 Å²	103	131.9 Å²	131.9	72%	0.72	77%	0.774	S	S	*	*			cis	-148.5	146.4	33.3	-54.8	0	0	0	0	115.2
114	N	35.4	Very low	37.7	Very low	143 Å²	143	125 Å²	125	77%	0.765	75%	0.753	S	S	*	*			trans	28.1	125.3	145	-53.9	-8.4	0	0	0	121.1
115	Y	36.5	Very low	37.5	Very low	226 Å²	226	125.1 Å²	125.1	89%	0.886	75%	0.747	S	S	*	*				-160.2	160.8	92.8	-111.8	-81.2	0	0	0	112.3
116	T	37.8	Very low	37.2	Very low	127 Å²	127	129.3 Å²	129.3	78%	0.779	75%	0.751	S	S	*	*			trans	-80.6	165.2	-173.9	47.3	0	0	0	0	114
117	S	36.5	Very low	36.9	Very low	114 Å²	114	130.5 Å²	130.5	80%	0.797	75%	0.745	S	S	*	*			cis	-138.2	-116.4	27.5	60.8	0	0	0	0	117.6
118	S	36.8	Very low	36.2	Very low	78 Å²	78	133.8 Å²	133.8	55%	0.545	74%	0.742	S	S	.	*			trans	-162.4	172.9	-145.5	53	0	0	0	0	116.5
119	H	39.2	Very low	35.6	Very low	185 Å²	185	135.1 Å²	135.1	86%	0.856	74%	0.737	S	S	*	*			trans	74	146.7	177.9	-41.5	-73.8	0	0	0	115
120	G	36.8	Very low	35.4	Very low	69 Å²	69	135.6 Å²	135.6	71%	0.711	73%	0.734	S	S	*	*			cis	157.7	161.2	1.3	0	0	0	0	0	108.4
121	V	36.7	Very low	35.3	Very low	142 Å²	142	136.7 Å²	136.7	86%	0.861	73%	0.734	S	S	*	*			cis	-147.5	167.4	2.2	177.8	0	0	0	0	108.2
122	S	34.8	Very low	35	Very low	90 Å²	90	130.5 Å²	130.5	63%	0.629	72%	0.724	S	S	*	*			trans	-87.1	167.7	-173.1	57.2	0	0	0	0	116.5
123	N	34.6	Very low	34.7	Very low	143 Å²	143	132.4 Å²	132.4	77%	0.765	73%	0.727	S	S	*	*				159.7	160.2	125.7	-79	-10.5	0	0	0	112.5
124	S	34.9	Very low	34.2	Very low	72 Å²	72	134.7 Å²	134.7	50%	0.503	73%	0.73	S	S	.	*			cis	167.6	169.5	-46.9	50.8	0	0	0	0	109.9
125	F	33	Very low	33.8	Very low	160 Å²	160	133 Å²	133	70%	0.702	73%	0.728	S	S	*	*			trans	72.8	150.5	173.4	-56.9	-71.7	0	0	0	118.1
126	Y	33	Very low	33.5	Very low	190 Å²	190	127.9 Å²	127.9	75%	0.745	73%	0.725	S	S	*	*			cis	-139.6	162.7	-17.6	-86.8	-65.7	0	0	0	106.2
127	Q	32.1	Very low	33.2	Very low	133 Å²	133	126.6 Å²	126.6	62%	0.621	73%	0.727	S	S	*	*			cis	111.5	134.6	10.3	-151.8	-160.6	89.5	0	0	114.1
128	R	29.8	Very low	33.4	Very low	190 Å²	190	127.3 Å²	127.3	72%	0.717	73%	0.729	S	S	*	*			trans	78.5	149.1	172.1	-60.4	170.9	-179.5	-98.3	2.7	116.2
129	Q	32.6	Very low	33.1	Very low	157 Å²	157	130.8 Å²	130.8	73%	0.734	74%	0.742	S	S	*	*			cis	-154.6	161.6	-9.3	-121	165.4	-75.3	0	0	112.4
130	V	32	Very low	32.8	Very low	130 Å²	130	127.2 Å²	127.2	79%	0.788	74%	0.737	S	S	*	*			trans	-87.1	171.4	168.1	-105.3	0	0	0	0	110.8
131	P	34.9	Very low	32.5	Very low	111 Å²	111	129.3 Å²	129.3	72%	0.721	73%	0.732	S	S	*	*			cis	-152.6	176.6	36.4	46	-24.7	0	0	0	120.7
132	S	30.9	Very low	32.4	Very low	96 Å²	96	132.7 Å²	132.7	67%	0.671	73%	0.731	S	S	*	*			trans	21.6	136	146.7	64.8	0	0	0	0	123.3
133	T	32.1	Very low	32.3	Very low	121 Å²	121	131.5 Å²	131.5	74%	0.742	73%	0.733	S	S	*	*				-177.7	136.9	103.2	33.7	0	0	0	0	115.6
134	I	28.6	Very low	32.1	Very low	152 Å²	152	133.1 Å²	133.1	78%	0.779	74%	0.74	S	S	*	*			trans	67.4	134.1	133.3	-62.1	169.2	0	0	0	122.6
135	C	25.7	Very low	32	Very low	107 Å²	107	134.8 Å²	134.8	72%	0.723	75%	0.752	S	S	*	*			trans	-12.7	140.4	162.7	-49.6	0	0	0	0	120.9
136	S	30.5	Very low	31.9	Very low	119 Å²	119	135.9 Å²	135.9	83%	0.832	76%	0.76	S	S	*	*				178	155.8	97.7	-73.5	0	0	0	0	112.1
137	A	32	Very low	31.9	Very low	99 Å²	99	134.4 Å²	134.4	82%	0.818	76%	0.763	S	S	*	*			trans	-107.7	137	171	0	0	0	0	0	111.1
138	P	41	Very low	31.8	Very low	130 Å²	130	137.7 Å²	137.7	84%	0.844	78%	0.775	S	S	*	*			trans	-93.5	159.5	160.4	35.6	-30.1	0	0	0	111.3
139	N	29	Very low	32.3	Very low	151 Å²	151	134.4 Å²	134.4	81%	0.807	78%	0.779	S	S	*	*			trans	-126	168.5	179.5	-168.5	5	0	0	0	109.2
140	S	34.5	Very low	32.2	Very low	110 Å²	110	134.9 Å²	134.9	77%	0.769	78%	0.781	S	S	*	*			trans	69.1	159.3	172.2	79.6	0	0	0	0	117.2
141	N	30.7	Very low	32.4	Very low	112 Å²	112	134.7 Å²	134.7	60%	0.599	78%	0.775	S	S	*	*			cis	-171.1	167.3	-32.4	-172.6	15.6	0	0	0	108.1
142	Y	33.9	Very low	32.5	Very low	213 Å²	213	137.2 Å²	137.2	84%	0.835	78%	0.779	S	S	*	*			trans	68.1	151.9	174.7	-42	-78	0	0	0	116
143	G	31.6	Very low	32.8	Very low	65 Å²	65	138.4 Å²	138.4	67%	0.67	78%	0.778	S	S	*	*			cis	158.9	143.3	-11.1	0	0	0	0	0	113.1
144	L	31.1	Very low	32.8	Very low	177 Å²	177	139.9 Å²	139.9	93%	0.927	78%	0.776	S	S	*	*			trans	65.4	159.4	175.4	-68.6	158.7	0	0	0	115.3
145	S	33.4	Very low	33.1	Very low	108 Å²	108	139.5 Å²	139.5	76%	0.755	78%	0.776	S	S	*	*			cis	-152.2	172.8	1	19.5	0	0	0	0	112.4
146	Q	31.4	Very low	33.5	Very low	182 Å²	182	139 Å²	139	85%	0.85	77%	0.774	S	S	*	*			trans	-40.1	153	176.6	-57.3	167.8	-13.9	0	0	117.7
147	I	32.4	Very low	33.3	Very low	159 Å²	159	141.4 Å²	141.4	82%	0.815	77%	0.774	S	S	*	*				-178.3	139.6	121	-92	153.5	0	0	0	110.5
148	F	29.5	Very low	33.4	Very low	202 Å²	202	143.9 Å²	143.9	89%	0.886	77%	0.772	S	S	*	*			trans	-110.7	151.1	166	-94.7	-81.2	0	0	0	109.8
149	P	39.8	Very low	32.8	Very low	121 Å²	121	143.5 Å²	143.5	79%	0.786	77%	0.767	S	S	*	*			trans	-124.9	175	139.3	5.2	17.2	0	0	0	113.3
150	H	31.7	Very low	33	Very low	168 Å²	168	144.2 Å²	144.2	78%	0.778	77%	0.771	S	S	*	*			trans	-122.5	-172.2	-171.6	-159.5	-99.8	0	0	0	111.3
151	D	35	Very low	32.7	Very low	126 Å²	126	148.5 Å²	148.5	67%	0.674	77%	0.77	S	S	*	*			trans	72.8	127.2	168.3	-51.1	-40.9	0	0	0	116.9
152	M	37.1	Very low	32.9	Very low	163 Å²	163	149.2 Å²	149.2	80%	0.803	77%	0.774	S	S	*	*				-152.4	138.2	61.3	-76.6	-162.3	84.1	0	0	110.7
153	L	36.9	Very low	32.7	Very low	122 Å²	122	146.5 Å²	146.5	64%	0.639	77%	0.769	S	S	*	*				62.2	133.3	78.5	-64.9	169.3	0	0	0	113.7
154	Q	32.4	Very low	33	Very low	152 Å²	152	152.4 Å²	152.4	71%	0.71	78%	0.779	S	S	*	*			cis	-165.5	178.3	-0.9	-169.5	62.5	-22.4	0	0	110.1
155	N	34.8	Very low	32.9	Very low	144 Å²	144	151.9 Å²	151.9	77%	0.77	78%	0.777	S	S	*	*			trans	83.4	140.1	166.3	-57.1	-16.7	0	0	0	116.6
156	S	33.9	Very low	33	Very low	97 Å²	97	150.2 Å²	150.2	68%	0.678	78%	0.777	S	S	*	*			cis	163.8	116.7	-20.9	48.6	0	0	0	0	104.8
157	M	28.1	Very low	33	Very low	169 Å²	169	146.7 Å²	146.7	83%	0.833	77%	0.773	S	S	*	*				73.3	150.5	79.5	-80.2	-73.3	-80.5	0	0	115.6
158	L	33.6	Very low	32.9	Very low	150 Å²	150	145.5 Å²	145.5	79%	0.785	77%	0.772	S	S	*	*			trans	75.6	120.5	-172.2	-47.5	179	0	0	0	113.1
159	V	29	Very low	32.9	Very low	122 Å²	122	141 Å²	141	74%	0.739	77%	0.766	S	S	*	*			cis	67.8	101.6	39.1	-171.1	0	0	0	0	113
160	N	32.7	Very low	32.4	Very low	166 Å²	166	139.7 Å²	139.7	89%	0.888	76%	0.76	S	S	*	*			trans	-159.3	162.7	133	-109.2	-27	0	0	0	112.4
161	R	28.3	Very low	32.5	Very low	201 Å²	201	138.7 Å²	138.7	76%	0.758	76%	0.759	S	S	*	*			trans	-121.4	162.2	175.6	110.5	-171.8	-175.9	-174.5	1.4	108.7
162	D	34.9	Very low	32.2	Very low	126 Å²	126	141.7 Å²	141.7	67%	0.674	77%	0.769	S	S	*	*			trans	138.3	121.7	162.3	-70.8	-17.9	0	0	0	108.3
163	Q	30.2	Very low	32	Very low	156 Å²	156	137.3 Å²	137.3	73%	0.729	77%	0.766	S	S	*	*				71.6	95.7	61.8	-70.2	-164.8	-17.8	0	0	114.3
164	H	38	Very low	31.8	Very low	189 Å²	189	139.5 Å²	139.5	88%	0.875	77%	0.773	S	S	*	*			trans	-170.4	108.2	142.5	-91.4	-67.3	0	0	0	106.8
165	N	28.7	Very low	31.6	Very low	166 Å²	166	140.4 Å²	140.4	89%	0.888	78%	0.775	S	S	*	*				58.4	116.5	75	-91.2	0.9	0	0	0	116
166	G	34.9	Very low	31.5	Very low	73 Å²	73	137.1 Å²	137.1	75%	0.753	76%	0.763	S	S	*	*			trans	147.6	131.6	166	0	0	0	0	0	115.1
167	S	31.4	Very low	31.5	Very low	109 Å²	109	140.3 Å²	140.3	76%	0.762	77%	0.767	S	S	*	*			cis	-177.6	126.6	-43.9	-101.3	0	0	0	0	110.9
168	V	29.3	Very low	31.8	Very low	134 Å²	134	140.6 Å²	140.6	81%	0.812	77%	0.766	S	S	*	*			trans	49.6	144.5	156.1	-85.6	0	0	0	0	124.3
169	S	30	Very low	32.6	Very low	107 Å²	107	137.7 Å²	137.7	75%	0.748	76%	0.756	S	S	*	*			trans	77.3	152.3	141	-79.1	0	0	0	0	120.7
170	S	30	Very low	32.9	Very low	94 Å²	94	137.7 Å²	137.7	66%	0.657	75%	0.752	S	S	*	*			cis	-168.2	173.5	-10.2	-108.7	0	0	0	0	112.9
171	L	33.2	Very low	33.1	Very low	146 Å²	146	137.7 Å²	137.7	76%	0.764	75%	0.746	S	S	*	*			trans	71.9	103.2	151.6	-100.3	70.7	0	0	0	121.8
172	E	28.6	Very low	33.4	Very low	189 Å²	189	131 Å²	131	88%	0.883	74%	0.739	S	S	*	*				16.3	141.5	121.6	-58.7	176.4	109.1	0	0	123
173	G	34	Very low	33.4	Very low	72 Å²	72	133.2 Å²	133.2	74%	0.742	75%	0.746	S	S	*	*			trans	124.9	155.2	143.8	0	0	0	0	0	116.6
174	H	31.5	Very low	33.5	Very low	168 Å²	168	135 Å²	135	78%	0.778	75%	0.751	S	S	*	*			cis	-172.4	158.6	-21.6	-138.8	-1.8	0	0	0	109.2
175	F	29.8	Very low	33.7	Very low	171 Å²	171	130.1 Å²	130.1	75%	0.75	74%	0.737	S	S	*	*			trans	66.7	154.1	165.9	-79.4	-120.8	0	0	0	117.7
176	S	30.8	Very low	33.9	Very low	75 Å²	75	132.7 Å²	132.7	52%	0.524	74%	0.736	S	S	.	*			cis	-167.8	160.7	-20.8	-114.2	0	0	0	0	113.8
177	Q	33.8	Very low	33.9	Very low	163 Å²	163	134.2 Å²	134.2	76%	0.762	73%	0.734	S	S	*	*			trans	67.7	128.6	146	-70.4	157.7	-7.4	0	0	119.8
178	H	35.7	Very low	34.1	Very low	176 Å²	176	136 Å²	136	82%	0.815	74%	0.735	S	S	*	*				86.9	153.1	53.5	-92	-95	0	0	0	113.7
179	P	49.2	Very low	34.5	Very low	89 Å²	89	134 Å²	134	58%	0.578	73%	0.726	S	S	*	*			cis	-147	-148.1	-45	38.3	-15.4	0	0	0	113.4
180	D	36.1	Very low	34.6	Very low	122 Å²	122	137.9 Å²	137.9	65%	0.652	73%	0.729	S	S	*	*			trans	73.4	151.9	155.6	-64.9	-20.5	0	0	0	119.7
181	H	37.2	Very low	35	Very low	166 Å²	166	140.8 Å²	140.8	77%	0.769	73%	0.732	S	S	*	*			cis	-155.8	166.9	-9.4	-102.3	-2.5	0	0	0	106.2
182	G	34.8	Very low	35.2	Very low	59 Å²	59	139.1 Å²	139.1	61%	0.608	73%	0.73	S	S	*	*			cis	167.8	163.3	-3.2	0	0	0	0	0	112.2
183	Q	34.2	Very low	35.5	Very low	174 Å²	174	133.6 Å²	133.6	81%	0.813	71%	0.712	S	S	*	*			trans	65.6	135.5	162.6	-67.8	146	-9.1	0	0	120
184	F	31.7	Very low	35.3	Very low	192 Å²	192	137.4 Å²	137.4	84%	0.842	72%	0.715	S	S	*	*			cis	80.8	159.5	38.3	-77.1	-60.6	0	0	0	114.7
185	P	43.3	Very low	35.4	Very low	88 Å²	88	137.5 Å²	137.5	57%	0.571	72%	0.721	S	S	*	*			cis	-138.7	-170.8	-10.8	22.1	4.9	0	0	0	115.7
186	Y	33	Very low	35.8	Very low	220 Å²	220	140.3 Å²	140.3	86%	0.863	73%	0.727	S	S	*	*			trans	71.1	150.3	156.1	-64.7	-55.3	0	0	0	119.5
187	S	33.5	Very low	36.2	Very low	104 Å²	104	141.8 Å²	141.8	73%	0.727	74%	0.735	S	S	*	*			cis	-161.4	156.3	-13.7	51.9	0	0	0	0	112.9
188	D	35.4	Very low	36.1	Very low	146 Å²	146	142.1 Å²	142.1	78%	0.781	74%	0.74	S	S	*	*			trans	-53.6	177.7	151.3	-105.4	-51.7	0	0	0	112.3
189	P	38.6	Very low	36	Very low	94 Å²	94	141 Å²	141	61%	0.61	74%	0.735	S	S	*	*			cis	-144.1	-173.7	22	19.6	10.2	0	0	0	117.7
190	F	31.7	Very low	35.3	Very low	187 Å²	187	144.2 Å²	144.2	82%	0.82	75%	0.746	S	S	*	*			trans	119.1	123.8	140.1	-76.4	-66.3	0	0	0	120.5
191	H	38.8	Very low	35	Very low	155 Å²	155	142.9 Å²	142.9	72%	0.718	74%	0.742	S	S	*	*			trans	-81.6	144.9	159.7	-150.4	-94.4	0	0	0	109.5	S193	H191-S193 PolarHBondContact CE1-OG 2.85Å; H191-S193 PolarHBondContact ND1-N 3.05Å; H191-S193 PolarHBondContact ND1-OG 3.24Å
192	P	37.9	Very low	35	Very low	112 Å²	112	141.2 Å²	141.2	73%	0.727	74%	0.744	S	S	*	*				-137.6	153.2	107.9	38.6	-27.4	0	0	0	111.5
193	S	34.1	Very low	35	Very low	72 Å²	72	143.6 Å²	143.6	50%	0.503	75%	0.752	S	S	.	*			cis	73.4	129.8	44	-53.5	0	0	0	0	114.4	H191	H191-S193 PolarHBondContact CE1-OG 2.85Å; H191-S193 PolarHBondContact ND1-N 3.05Å; H191-S193 PolarHBondContact ND1-OG 3.24Å
194	D	29.4	Very low	35.3	Very low	152 Å²	152	140.4 Å²	140.4	81%	0.813	75%	0.746	S	S	*	*			trans	60.8	127.5	170.8	-54.8	-58	0	0	0	117.2
195	L	35.3	Very low	35.3	Very low	171 Å²	171	141.5 Å²	141.5	90%	0.895	74%	0.744	S	S	*	*				-161.6	147.6	67.3	-89.5	166.5	0	0	0	114.3
196	R	36.4	Very low	34.9	Very low	229 Å²	229	145.7 Å²	145.7	86%	0.864	76%	0.756	S	S	*	*			trans	-86.8	179.5	158.5	-109.4	-173.6	174.6	-166.9	1.6	109.6
197	P	40.8	Very low	35.1	Very low	107 Å²	107	143.4 Å²	143.4	70%	0.695	76%	0.758	S	S	*	*				-117.6	-162.6	-53.4	39.2	-23.8	0	0	0	108.8
198	L	30.6	Very low	35.1	Very low	169 Å²	169	141.4 Å²	141.4	89%	0.885	75%	0.753	S	S	*	*			trans	-171.8	173.3	130.4	-106.5	167.1	0	0	0	113.2
199	H	33.9	Very low	35.5	Very low	153 Å²	153	139.4 Å²	139.4	71%	0.708	75%	0.748	S	S	*	*			trans	-149.6	113.3	-158.6	171	-71.5	0	0	0	111.3
200	I	35.3	Very low	35.1	Very low	157 Å²	157	142.2 Å²	142.2	81%	0.805	75%	0.753	S	S	*	*			trans	-136	97.8	177	-61.3	179.4	0	0	0	104.8
201	T	28.5	Very low	35.1	Very low	93 Å²	93	139.8 Å²	139.8	57%	0.571	75%	0.749	S	S	*	*				52.8	132.4	79.2	74.2	0	0	0	0	112.1
202	T	37.1	Very low	34.7	Very low	132 Å²	132	136.7 Å²	136.7	81%	0.81	75%	0.745	S	S	*	*			cis	-143.4	149	42	43.6	0	0	0	0	114.6
203	S	36.1	Very low	34.4	Very low	109 Å²	109	139.2 Å²	139.2	76%	0.762	75%	0.747	S	S	*	*			trans	-84.2	-166.4	159.6	-45.6	0	0	0	0	108.8
204	P	39.1	Very low	34.3	Very low	106 Å²	106	141.3 Å²	141.3	69%	0.688	76%	0.756	S	S	*	*			cis	-146	-165.8	4.9	45.2	-24.9	0	0	0	116.6
205	R	32.4	Very low	34.4	Very low	216 Å²	216	140.5 Å²	140.5	82%	0.815	75%	0.752	S	S	*	*			trans	72.5	125.3	160.6	-71.5	168.9	171.1	-112.8	-2.4	115.9
206	Q	34.7	Very low	34.2	Very low	176 Å²	176	140.9 Å²	140.9	82%	0.822	75%	0.751	S	S	*	*				65.1	111.8	51	-69.4	-163.4	-12.3	0	0	115.1
207	L	36.6	Very low	34	Very low	172 Å²	172	133.5 Å²	133.5	90%	0.901	75%	0.746	S	S	*	*				-164	147.2	129	-101.1	155.4	0	0	0	108.3
208	G	34.7	Very low	33.5	Very low	61 Å²	61	135.5 Å²	135.5	63%	0.629	75%	0.752	S	S	*	*			trans	-109.1	-133.7	162.7	0	0	0	0	0	108.4
209	P	42.7	Very low	33.6	Very low	104 Å²	104	132.9 Å²	132.9	68%	0.675	74%	0.742	S	S	*	*			cis	-138.9	-163.1	-21.8	19.1	8.1	0	0	0	111.4
210	H	30.8	Very low	33.5	Very low	153 Å²	153	131.1 Å²	131.1	71%	0.708	74%	0.742	S	S	*	*			trans	73.5	132.8	149.5	-78.2	-57.9	0	0	0	122.4
211	N	30.9	Very low	33.2	Very low	136 Å²	136	128.7 Å²	128.7	73%	0.727	74%	0.738	S	S	*	*			trans	72.8	156.6	132.4	-64.9	11.5	0	0	0	118.1
212	S	31.1	Very low	33.4	Very low	91 Å²	91	130 Å²	130	64%	0.636	75%	0.746	S	S	*	*			cis	-166.4	150.8	-3.8	30.7	0	0	0	0	113.6
213	H	32.2	Very low	33.3	Very low	165 Å²	165	130 Å²	130	76%	0.764	74%	0.741	S	S	*	*			trans	70.6	128.4	135.8	-75.7	-144.5	0	0	0	123.2
214	T	32	Very low	33.4	Very low	115 Å²	115	129 Å²	129	71%	0.706	73%	0.734	S	S	*	*			trans	69.5	158.9	135.5	62.5	0	0	0	0	119.4
215	N	30.8	Very low	33.4	Very low	136 Å²	136	131.1 Å²	131.1	73%	0.727	74%	0.738	S	S	*	*			cis	-151.6	162.8	-3.4	-129.4	-3.5	0	0	0	114.3
216	M	30.6	Very low	33.7	Very low	178 Å²	178	126.3 Å²	126.3	88%	0.877	73%	0.732	S	S	*	*			trans	0.3	154	150.3	-60.7	-63	-173.8	0	0	123.2
217	G	34	Very low	33.7	Very low	74 Å²	74	126.5 Å²	126.5	76%	0.763	73%	0.731	S	S	*	*			trans	129.3	94.1	166.4	0	0	0	0	0	112.1
218	D	29.2	Very low	33.7	Very low	150 Å²	150	126.4 Å²	126.4	80%	0.802	73%	0.729	S	S	*	*			cis	93.4	155.2	30.8	-155.9	10.8	0	0	0	114.1
219	V	33	Very low	33.9	Very low	113 Å²	113	128.7 Å²	128.7	69%	0.685	74%	0.736	S	S	*	*			trans	70.2	100.8	-179.8	-170.9	0	0	0	0	114.6
220	T	30.8	Very low	34.1	Very low	117 Å²	117	128.8 Å²	128.8	72%	0.718	74%	0.736	S	S	*	*				82.6	162.4	56	71.3	0	0	0	0	116.6
221	C	30.5	Very low	34.4	Very low	105 Å²	105	133.7 Å²	133.7	71%	0.709	75%	0.749	S	S	*	*			trans	91.8	110.8	177.2	-59.7	0	0	0	0	116.5
222	T	33.1	Very low	34.7	Very low	121 Å²	121	130.7 Å²	130.7	74%	0.742	75%	0.75	S	S	*	*				79.7	140.4	59.5	66	0	0	0	0	113.1
223	D	34.1	Very low	35	Very low	132 Å²	132	132.1 Å²	132.1	71%	0.706	76%	0.76	S	S	*	*			cis	-162.8	177.1	4.6	-145.8	-73.9	0	0	0	111.7
224	S	38.9	Very low	35.7	Very low	89 Å²	89	129 Å²	129	62%	0.622	75%	0.754	S	S	*	*			trans	68.3	163	145.6	-74.6	0	0	0	0	118
225	I	37.4	Very low	35.9	Very low	149 Å²	149	131.3 Å²	131.3	76%	0.764	76%	0.762	S	S	*	*			cis	-161.3	153.7	-5.2	-117.2	170.2	0	0	0	106.7
226	V	38.7	Very low	36.2	Very low	115 Å²	115	128.5 Å²	128.5	70%	0.697	77%	0.765	S	S	*	*			cis	-161	-166.9	-4.8	72.2	0	0	0	0	111.4
227	K	35.9	Very low	36.7	Very low	181 Å²	181	126.7 Å²	126.7	79%	0.787	76%	0.764	S	S	*	*			trans	-50.2	161.7	173	-66.1	158.2	173.2	167.9	0	115.9
228	I	37.2	Very low	37.1	Very low	169 Å²	169	129.3 Å²	129.3	87%	0.867	77%	0.767	S	S	*	*				-154.3	173.8	76.7	-84.5	165	0	0	0	112
229	S	37.8	Very low	37.3	Very low	110 Å²	110	128.6 Å²	128.6	77%	0.769	76%	0.764	S	S	*	*			trans	-135.8	-162.1	-161.1	-139.5	0	0	0	0	113.8
230	P	47.1	Very low	37.8	Very low	106 Å²	106	132.3 Å²	132.3	69%	0.688	77%	0.773	S	S	*	*				-130.7	-179.7	-127.7	41.2	-21.2	0	0	0	117
231	R	37.5	Very low	37.9	Very low	255 Å²	255	131.7 Å²	131.7	96%	0.962	77%	0.774	S	S	*	*			trans	169	154	142.2	-93.4	154.6	-167.8	-116.3	3.9	112.8
232	G	36.8	Very low	38.3	Very low	73 Å²	73	134.2 Å²	134.2	75%	0.753	78%	0.779	S	S	*	*			trans	158.2	135.2	168	0	0	0	0	0	115.1
233	S	37.7	Very low	38.6	Very low	122 Å²	122	134.5 Å²	134.5	85%	0.853	78%	0.78	S	S	*	*			trans	-176.5	167.2	-178.6	-84	0	0	0	0	109.7
234	P	46.4	Very low	38.9	Very low	99 Å²	99	134.1 Å²	134.1	64%	0.643	79%	0.785	S	S	*	*			cis	-138.1	-165.9	-26	38.4	-19.2	0	0	0	113.3
235	N	36.5	Very low	38.7	Very low	164 Å²	164	136.2 Å²	136.2	88%	0.877	80%	0.798	S	S	*	*			trans	74.3	136.8	156.2	-61.7	-10.8	0	0	0	120.9
236	G	38.1	Very low	38.7	Very low	76 Å²	76	131.9 Å²	131.9	78%	0.784	79%	0.79	S	S	*	*			trans	157.4	124.7	165.2	0	0	0	0	0	113.3
237	V	40.6	Very low	38.7	Very low	140 Å²	140	133 Å²	133	85%	0.848	80%	0.797	S	S	*	*			trans	-141.7	144.9	170.2	-153.5	0	0	0	0	107.6
238	P	41.7	Very low	38.9	Very low	129 Å²	129	130.2 Å²	130.2	84%	0.838	80%	0.795	S	S	*	*				-142	179.2	112.8	36.9	-21.9	0	0	0	114.2
239	D	34.5	Very low	39	Very low	136 Å²	136	127 Å²	127	73%	0.727	79%	0.787	S	S	*	*			trans	-104.4	160.9	-173.6	-178.9	22	0	0	0	111.8
240	H	42.2	Very low	39.2	Very low	191 Å²	191	127.8 Å²	127.8	88%	0.884	79%	0.793	S	S	*	*			trans	-173.9	154.9	156.1	-85.9	-31.2	0	0	0	112.5
241	S	33.5	Very low	38.9	Very low	104 Å²	104	126.3 Å²	126.3	73%	0.727	80%	0.797	S	S	*	*			trans	-125.3	171.4	-164.4	57.8	0	0	0	0	114.3
242	I	39.2	Very low	39.4	Very low	158 Å²	158	120.9 Å²	120.9	81%	0.81	80%	0.795	S	S	*	*			trans	169.7	127.8	139.8	-89.6	157.3	0	0	0	115.2
243	T	38	Very low	39.4	Very low	126 Å²	126	121.1 Å²	121.1	77%	0.773	80%	0.797	S	S	*	*			trans	44.7	133.7	146.5	-50.8	0	0	0	0	125.5
244	P	41.2	Very low	39.6	Very low	125 Å²	125	120.3 Å²	120.3	81%	0.812	79%	0.792	S	S	*	*			trans	-124.3	172.8	169.8	43.4	-32.2	0	0	0	117.1
245	C	34.6	Very low	39.1	Very low	132 Å²	132	122.3 Å²	122.3	89%	0.892	79%	0.794	S	S	*	*			trans	-170.4	158	165.6	-165.1	0	0	0	0	109.9
246	G	37.8	Very low	39.2	Very low	58 Å²	58	118.3 Å²	118.3	60%	0.598	78%	0.775	S	S	*	*			cis	157.8	157.1	-12.6	0	0	0	0	0	113.7
247	T	38.9	Very low	39.1	Very low	138 Å²	138	118.2 Å²	118.2	85%	0.847	76%	0.757	S	S	*	*			trans	65.7	155.3	174.9	24.8	0	0	0	0	118.3
248	V	39.2	Very low	38.6	Very low	123 Å²	123	114.4 Å²	114.4	75%	0.745	74%	0.736	S	S	*	*			cis	-150.1	146	11.1	-115.4	0	0	0	0	114.2
249	S	40.2	Very low	38.1	Very low	101 Å²	101	116.5 Å²	116.5	71%	0.706	73%	0.727	S	S	*	*			trans	50.6	125.9	136.2	-51.7	0	0	0	0	127.6
250	S	41.4	Very low	38.2	Very low	128 Å²	128	115.3 Å²	115.3	90%	0.895	73%	0.73	S	S	*	*				53.2	149.7	129.7	-48.8	0	0	0	0	123.1
251	G	41.4	Very low	37.8	Very low	74 Å²	74	111.6 Å²	111.6	76%	0.763	73%	0.725	S	S	*	*			cis	-174.6	177.5	1.5	0	0	0	0	0	112.9
252	P	47.7	Very low	37.9	Very low	141 Å²	141	117.9 Å²	117.9	92%	0.916	73%	0.733	S	S	*	*			trans	-126.2	177.1	-152	43.1	-32.3	0	0	0	119.4
253	G	37.5	Very low	37.7	Very low	78 Å²	78	116 Å²	116	80%	0.804	73%	0.729	S	S	*	*			trans	176.3	127.3	161	0	0	0	0	0	121.5
254	S	40.3	Very low	37.8	Very low	106 Å²	106	116.9 Å²	116.9	74%	0.741	73%	0.727	S	S	*	*			trans	80.8	110.8	141.4	-145.6	0	0	0	0	126.7
255	M	36.9	Very low	37.7	Very low	140 Å²	140	119.7 Å²	119.7	69%	0.69	73%	0.73	S	S	*	*			trans	57.7	166.7	135.7	-57.1	175.6	63.8	0	0	120.9	Q1083	M255-Q1083 PolarHBondContact O-NE2 2.97Å
256	V	39	Very low	37.7	Very low	80 Å²	80	125.3 Å²	125.3	49%	0.485	73%	0.732	S	S	.	*			cis	-135.1	-131.2	19.5	-173.7	0	0	0	0	112.7	Q1083 Q1084	V256-Q1083 WeakPolarHBondContact O-CG 3.46Å; V256-Q1084 VanDerWaalsContact CA-OE1 3.31Å
257	N	36.1	Very low	37.7	Very low	74 Å²	74	126 Å²	126	40%	0.396	74%	0.739	S	S	.	*			trans	-139.4	140.4	-144.8	148.6	87	0	0	0	119.8	Q1084 D1085 A1086	N257-Q1084 VanDerWaalsContact C-CA 3.46Å; N257-D1085 CarbonylContact O-C 3.57Å; N257-D1085 VanDerWaalsContact O-CA 3.32Å; N257-D1085 WeakPolarHBondContact O-CA 3.37Å; N257-D1085 PolarHBondContact O-N 2.97Å; N257-A1086 PolarHBondContact ND2-OXT 3.33Å; N257-A1086 PolarHBondContact O-N 3.11Å
258	C	28.8	Very low	37.8	Very low	60 Å²	60	125.2 Å²	125.2	41%	0.405	74%	0.739	S	S	.	*	B	Isolated β-bridge	trans	106	-140.2	154.8	-95.5	0	0	0	0	128.5	Q1084 D1085 A1086	C258-Q1084 VanDerWaalsContact C-C 3.42Å; C258-Q1084 CarbonylContact C-O 3.56Å; C258-Q1084 CarbonylContact O-C 3.57Å; C258-D1085 CarbonylContact C-O 3.56Å; C258-A1086 VanDerWaalsContact CB-O 3.28Å; C258-A1086 WeakPolarHBondContact CB-O 3.36Å; C258-A1086 WeakPolarHBondContact CB-OXT 3.34Å
259	R	32.5	Very low	37.7	Very low	174 Å²	174	127.9 Å²	127.9	66%	0.657	74%	0.744	S	S	*	*			trans	-115.4	150.7	-135.6	-58.7	167	179	126.9	-8.1	118.7	D1085 A1086	R259-D1085 CarbonylContact C-O 3.59Å; R259-D1085 WeakPolarHBondContact CA-O 3.29Å; R259-D1085 PolarHBondContact N-O 3.06Å; R259-A1086 WeakPolarHBondContact CD-O 3.32Å; R259-A1086 WeakPolarHBondContact CG-O 3.23Å; R259-A1086 PolarHBondContact NH1-O 2.82Å
260	S	35.4	Very low	38	Very low	111 Å²	111	130.4 Å²	130.4	78%	0.776	75%	0.754	S	S	*	*				151.5	114	114.2	-69.7	0	0	0	0	118.9
261	S	33.9	Very low	37.9	Very low	113 Å²	113	130 Å²	130	79%	0.79	75%	0.752	S	S	*	*			trans	8	150.4	145.3	-55.3	0	0	0	0	125.3
262	R	36.4	Very low	37.7	Very low	236 Å²	236	131.4 Å²	131.4	89%	0.891	76%	0.756	S	S	*	*			trans	108.8	139.7	152.7	-61.9	-176.1	-163.9	-161.5	6.3	116.3
263	T	35.3	Very low	37.5	Very low	117 Å²	117	128.8 Å²	128.8	72%	0.718	75%	0.747	S	S	*	*			cis	-169.2	177.3	-16.6	23.5	0	0	0	0	110.8
264	I	38.6	Very low	37.8	Very low	146 Å²	146	132.9 Å²	132.9	75%	0.749	75%	0.75	S	S	*	*			trans	89.1	142.6	154	-19.9	179.9	0	0	0	119.2
265	E	39.6	Very low	38	Very low	184 Å²	184	133.4 Å²	133.4	86%	0.86	75%	0.753	S	S	*	*			trans	78.8	139.6	163.4	-52.2	-156.2	161.1	0	0	120.4
266	R	35.6	Very low	38.5	Very low	249 Å²	249	134.8 Å²	134.8	94%	0.94	76%	0.764	S	S	*	*				169.3	130.4	-58.5	170.5	-173.8	-95	-142.7	0.4	108.9
267	G	37.8	Very low	38.8	Very low	73 Å²	73	135.8 Å²	135.8	75%	0.753	77%	0.774	S	S	*	*			trans	100.3	156.9	164.6	0	0	0	0	0	115.2
268	S	40.7	Very low	38.9	Very low	121 Å²	121	139.3 Å²	139.3	85%	0.846	79%	0.793	S	S	*	*			cis	-154.8	157.9	-11.6	-171	0	0	0	0	110.8
269	E	35.8	Very low	39.7	Very low	180 Å²	180	142.9 Å²	142.9	84%	0.841	81%	0.813	S	S	*	*			trans	-75.4	152	175.9	-53.7	171.2	157.1	0	0	112.5
270	V	46.9	Very low	39.9	Very low	153 Å²	153	137.7 Å²	137.7	93%	0.927	81%	0.813	S	S	*	*			trans	-156.2	154	150.9	-108.8	0	0	0	0	112.6
271	S	39.2	Very low	39.9	Very low	120 Å²	120	138.7 Å²	138.7	84%	0.839	82%	0.82	S	S	*	*			trans	-90.6	168.5	-169.1	-58.3	0	0	0	0	114.9
272	A	38.5	Very low	40.6	Very low	104 Å²	104	140.6 Å²	140.6	86%	0.86	82%	0.82	S	S	*	*			trans	-73.6	141.7	169.6	0	0	0	0	0	112.7
273	A	43.3	Very low	41.3	Very low	86 Å²	86	139.3 Å²	139.3	71%	0.711	82%	0.821	S	S	*	*			trans	-149.4	133.8	164.8	0	0	0	0	0	112.4
274	D	43.2	Very low	42.1	Very low	163 Å²	163	138.2 Å²	138.2	87%	0.872	82%	0.823	S	S	*	*			trans	61.1	159.5	146.5	-59.4	-24.5	0	0	0	123.1
275	S	44.8	Very low	43.3	Very low	117 Å²	117	137.3 Å²	137.3	82%	0.818	83%	0.825	S	S	*	*			trans	-120.5	141.1	-178.1	-58.3	0	0	0	0	109.1
276	N	46.7	Very low	45.3	Very low	169 Å²	169	134.4 Å²	134.4	90%	0.904	81%	0.81	S	S	*	*			trans	-147.7	159.6	141.9	-127.1	-24.7	0	0	0	112.4
277	S	45.6	Very low	47.9	Very low	102 Å²	102	126.2 Å²	126.2	71%	0.713	79%	0.787	S	S	*	*			trans	-104.7	158.8	-170.3	61.1	0	0	0	0	113.2
278	N	38.5	Very low	50.6	Low	148 Å²	148	126 Å²	126	79%	0.791	77%	0.773	S	S	*	*			trans	104.2	149.2	149	-154.4	18.5	0	0	0	118.2
279	V	45.9	Very low	53.4	Low	135 Å²	135	120.4 Å²	120.4	82%	0.818	73%	0.734	S	S	*	*			trans	68.2	143.4	172.3	-162.9	0	0	0	0	116.6
280	G	36	Very low	56.3	Low	64 Å²	64	118.5 Å²	118.5	66%	0.66	72%	0.722	S	S	*	*			trans	123.2	83.1	165	0	0	0	0	0	115.7	I282	G280-I282 PolarHBondContact O-N 3.46Å
281	S	36.2	Very low	58.7	Low	132 Å²	132	111.2 Å²	111.2	92%	0.923	68%	0.678	S	S	*	*			trans	-69.1	90.4	179	171.5	0	0	0	0	113.5
282	I	49.2	Very low	61.5	Low	153 Å²	153	105.7 Å²	105.7	79%	0.785	64%	0.64	S	S	*	*			trans	-109.3	149.5	163.8	-59.2	177.5	0	0	0	108.7	G280 A284	G280-I282 PolarHBondContact O-N 3.46Å; I282-A284 PolarHBondContact O-N 3.43Å
283	K	49.6	Very low	64.2	Low	210 Å²	210	102.8 Å²	102.8	91%	0.913	62%	0.62	S	S	*	*			trans	-67.4	72.4	-176.4	-68.3	-179.8	-179.7	174.2	0	112.6	T285	K283-T285 PolarHBondContact O-N 2.78Å
284	A	52.2	Low	66.8	Low	93 Å²	93	99.7 Å²	99.7	77%	0.769	59%	0.592	S	S	*	*			trans	-61.9	117	176.9	0	0	0	0	0	110.7	I282 F286	I282-A284 PolarHBondContact O-N 3.43Å; A284-F286 PolarHBondContact O-N 3.2Å
285	T	64.9	Low	69.2	Low	127 Å²	127	98.7 Å²	98.7	78%	0.779	58%	0.579	S	S	*	*			trans	-57.2	132.2	174.5	40	0	0	0	0	110.1	K283 T287	K283-T285 PolarHBondContact O-N 2.78Å; T285-T287 PolarHBondContact O-N 2.75Å
286	F	81.3	Confident	71.7	Confident	124 Å²	124	93.9 Å²	93.9	54%	0.544	55%	0.547	S	S	.	.			trans	-72.3	103.2	-175.7	-178.8	-83.2	0	0	0	109.9	A284 P288 K295	A284-F286 PolarHBondContact O-N 3.2Å; F286-P288 HydrophobicContact CE1-CB 4.19Å; F286-P288 VanDerWaalsContact O-CD 3.32Å; F286-P288 WeakPolarHBondContact O-CD 3.12Å; F286-K295 HydrophobicContact CD2-CB 4.34Å; F286-K295 HydrophobicContact CD2-CD 4.21Å; F286-K295 HydrophobicContact CD2-CG 3.96Å; F286-K295 HydrophobicContact CE2-CB 3.45Å; F286-K295 VanDerWaalsContact CE2-CB 3.45Å; F286-K295 HydrophobicContact CE2-CD 4Å; F286-K295 HydrophobicContact CE2-CG 3.57Å; F286-K295 VanDerWaalsContact CZ-CA 3.42Å; F286-K295 HydrophobicContact CZ-CB 3.7Å; F286-K295 HydrophobicContact CZ-CG 4.18Å
287	T	90.2	Very high	73.9	Confident	76 Å²	76	88.7 Å²	88.7	47%	0.466	52%	0.524	S	S	.	.	P	Polyproline II helix	trans	-79.9	117.8	171.9	-29.5	0	0	0	0	109.9	T285 A296 I304	T285-T287 PolarHBondContact O-N 2.75Å; T287-A296 WeakPolarHBondContact O-CB 3.49Å; T287-A296 PolarHBondContact O-N 3.17Å; T287-I304 HydrophobicContact CG2-CD1 4.18Å; T287-I304 HydrophobicContact CG2-CG2 3.73Å
288	P	95.3	Very high	76.1	Confident	70 Å²	70	85.3 Å²	85.3	46%	0.455	51%	0.505	S	S	.	.	B	Isolated β-bridge	trans	-78.3	146.3	-179.7	31.3	-34.6	0	0	0	111.8	F286 K290	F286-P288 HydrophobicContact CE1-CB 4.19Å; F286-P288 VanDerWaalsContact O-CD 3.32Å; F286-P288 WeakPolarHBondContact O-CD 3.12Å; P288-K290 PolarHBondContact O-N 3.29Å
289	C	98	Very high	78.7	Confident	3 Å²	3	86.4 Å²	86.4	2%	0.02	50%	0.499	C	S	.	.	P	Polyproline II helix	trans	-65.2	117.7	171.1	170.8	0	0	0	0	111	V291 C292 G293 D294 S305 C306	C289-V291 PolarHBondContact O-N 3.49Å; C289-C292 PolarHBondContact O-N 3.4Å; C289-C292 VanDerWaalsContact O-N 3.08Å; C289-G293 PolarHBondContact O-N 3.34Å; C289-D294 WeakPolarHBondContact CB-O 3.23Å; C289-D294 PolarHBondContact N-O 3.49Å; C289-S305 VanDerWaalsContact SG-CA 3.59Å; C289-C306 HydrophobicContact CB-CB 3.94Å; C289-C306 PolarHBondContact SG-N 3.46Å; C289-C306 VanDerWaalsContact SG-N 3.38Å
290	K	96.5	Very high	81	Confident	139 Å²	139	81.3 Å²	81.3	60%	0.604	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.5	-23.3	-178.7	-67.6	-164.8	176.9	-173.2	0	114.1	P288 V303 I304 A352	P288-K290 PolarHBondContact O-N 3.29Å; K290-V303 HydrophobicContact CB-CG1 4Å; K290-V303 HydrophobicContact CD-CG1 4.2Å; K290-V303 HydrophobicContact CG-CG1 4.34Å; K290-I304 PolarHBondContact N-O 3.47Å; K290-I304 VanDerWaalsContact N-O 3.13Å; K290-A352 HydrophobicContact CB-CB 4.22Å
291	V	97.8	Very high	83.8	Confident	0 Å²	0	80.1 Å²	80.1	0%	0	44%	0.442	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.9	-40.9	177.9	-175.5	0	0	0	0	113.1	C289 C309 V333 K348 A352 M354	C289-V291 PolarHBondContact O-N 3.49Å; V291-C309 HydrophobicContact CB-CB 4.29Å; V291-C309 HydrophobicContact CG1-CB 4.49Å; V291-C309 HydrophobicContact CG2-CB 4.47Å; V291-V333 HydrophobicContact CG1-CG1 4.33Å; V291-K348 HydrophobicContact CG1-CB 4.38Å; V291-K348 HydrophobicContact CG1-CG 4.39Å; V291-K348 VanDerWaalsContact O-CD 3.23Å; V291-K348 WeakPolarHBondContact O-CD 3.02Å; V291-K348 WeakPolarHBondContact O-CE 3.49Å; V291-K348 PolarHBondContact O-NZ 3.07Å; V291-A352 HydrophobicContact CG2-CB 3.94Å; V291-M354 HydrophobicContact CG2-CE 3.87Å; V291-M354 HydrophobicContact CG2-SD 4.26Å
292	C	97.8	Very high	86.4	Confident	4 Å²	4	76.5 Å²	76.5	3%	0.027	43%	0.426	C	S	.	.	T	Hydrogen-bonded Turn	trans	-143.4	6.6	-169.5	73.1	0	0	0	0	116.9	C289 D294 C306 V333 I334 R335 R338	C289-C292 PolarHBondContact O-N 3.4Å; C289-C292 VanDerWaalsContact O-N 3.08Å; C292-D294 PolarHBondContact O-N 2.86Å; C292-D294 VanDerWaalsContact O-N 3.08Å; C292-C306 VanDerWaalsContact SG-SG 3.61Å; C292-V333 HydrophobicContact CB-CG1 4.15Å; C292-I334 CarbonylContact O-C 3.52Å; C292-I334 WeakPolarHBondContact O-CA 3.35Å; C292-R335 PolarHBondContact O-N 3.43Å; C292-R338 HydrophobicContact CB-CB 4.33Å; C292-R338 PolarHBondContact SG-NH1 3.48Å; C292-R338 VanDerWaalsContact SG-NH1 3.39Å
293	G	96	Very high	88.5	Confident	43 Å²	43	69.6 Å²	69.6	44%	0.443	39%	0.391	S	S	.	.	S	Bend	trans	74.4	-12.7	178	0	0	0	0	0	116.1	C289	C289-G293 PolarHBondContact O-N 3.34Å
294	D	96.6	Very high	90.7	Very high	22 Å²	22	61 Å²	61	12%	0.118	35%	0.354	C	S	.	.	S	Bend	trans	-64	159.4	174.3	-160.9	25.5	0	0	0	111.9	C289 C292 A296 C306 R335 R338	C289-D294 WeakPolarHBondContact CB-O 3.23Å; C289-D294 PolarHBondContact N-O 3.49Å; C292-D294 PolarHBondContact O-N 2.86Å; C292-D294 VanDerWaalsContact O-N 3.08Å; D294-A296 PolarHBondContact O-N 2.78Å; D294-C306 HydrophobicContact CB-CB 4.22Å; D294-R335 HydrophobicContact CB-CB 4.11Å; D294-R335 HydrophobicContact CB-CG 4.09Å; D294-R335 WeakPolarHBondContact OD1-CD 3.41Å; D294-R335 IonicContact OD1-CZ 3.76Å; D294-R335 IonicContact OD1-NE 3.95Å; D294-R335 IonicContact OD1-NH1 2.78Å; D294-R335 PolarHBondContact OD1-NH1 3.38Å; D294-R338 IonicContact OD2-CZ 3.18Å; D294-R338 IonicContact OD2-NH1 2.7Å; D294-R338 PolarHBondContact OD2-NH1 3.06Å; D294-R338 IonicContact OD2-NH2 2.82Å; D294-R338 PolarHBondContact OD2-NH2 2.88Å
295	K	95.4	Very high	92.8	Very high	141 Å²	141	56.5 Å²	56.5	61%	0.613	32%	0.318	S	S	*	.	B	Isolated β-bridge	trans	-55	122.5	-173.9	-168.8	172.1	-179.5	178.1	0	111.7	F286 C306	F286-K295 HydrophobicContact CD2-CB 4.34Å; F286-K295 HydrophobicContact CD2-CD 4.21Å; F286-K295 HydrophobicContact CD2-CG 3.96Å; F286-K295 HydrophobicContact CE2-CB 3.45Å; F286-K295 VanDerWaalsContact CE2-CB 3.45Å; F286-K295 HydrophobicContact CE2-CD 4Å; F286-K295 HydrophobicContact CE2-CG 3.57Å; F286-K295 VanDerWaalsContact CZ-CA 3.42Å; F286-K295 HydrophobicContact CZ-CB 3.7Å; F286-K295 HydrophobicContact CZ-CG 4.18Å; K295-C306 WeakPolarHBondContact O-CA 3.42Å; K295-C306 WeakPolarHBondContact O-CB 3.01Å
296	A	95.6	Very high	94.4	Very high	17 Å²	17	50.6 Å²	50.6	14%	0.14	28%	0.282	C	S	.	.	P	Polyproline II helix	trans	-68.8	141.7	173	0	0	0	0	0	110.7	T287 D294 I304 S305	T287-A296 WeakPolarHBondContact O-CB 3.49Å; T287-A296 PolarHBondContact O-N 3.17Å; D294-A296 PolarHBondContact O-N 2.78Å; A296-I304 HydrophobicContact CB-CG2 3.52Å; A296-S305 WeakPolarHBondContact CA-O 3.49Å
297	S	94.4	Very high	95.1	Very high	60 Å²	60	49.3 Å²	49.3	42%	0.42	28%	0.277	S	S	.	.			trans	-101.7	3.2	172.7	50.7	0	0	0	0	112.4	H300 S305 E307	S297-H300 PolarHBondContact OG-NE2 2.73Å; S297-S305 PolarHBondContact N-O 2.83Å; S297-S305 PolarHBondContact OG-O 2.9Å; S297-E307 VanDerWaalsContact CB-OE1 3.3Å; S297-E307 WeakPolarHBondContact CB-OE1 2.97Å; S297-E307 PolarHBondContact OG-N 2.88Å; S297-E307 PolarHBondContact OG-OE1 3.2Å
298	G	91.1	Very high	95.5	Very high	31 Å²	31	47 Å²	47	32%	0.32	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	137.3	-166.2	-178.4	0	0	0	0	0	112	H300 I304 S305	G298-H300 PolarHBondContact O-CD2 3.38Å; G298-I304 WeakPolarHBondContact O-CA 2.99Å; G298-S305 PolarHBondContact O-N 3.1Å
299	Y	92.7	Very high	95.6	Very high	171 Å²	171	43.7 Å²	43.7	67%	0.671	25%	0.247	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-82	127.8	168.4	-73	-99.6	0	0	0	109.8	I304	Y299-I304 HydrophobicContact CD1-CG1 3.9Å; Y299-I304 HydrophobicContact CD2-CG1 4.23Å; Y299-I304 HydrophobicContact CE1-CD1 4.15Å; Y299-I304 HydrophobicContact CE1-CG1 3.51Å; Y299-I304 HydrophobicContact CE2-CD1 4.3Å; Y299-I304 HydrophobicContact CE2-CG1 3.87Å; Y299-I304 HydrophobicContact CG-CG1 4.24Å
300	H	94.9	Very high	95.5	Very high	28 Å²	28	45.9 Å²	45.9	13%	0.13	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	128	171.9	-52.4	-76.6	0	0	0	108.7	S297 G298 G302 V303 S305 E307 K310	S297-H300 PolarHBondContact OG-NE2 2.73Å; G298-H300 PolarHBondContact O-CD2 3.38Å; H300-G302 PolarHBondContact O-N 3.47Å; H300-V303 PolarHBondContact N-O 3.39Å; H300-V303 PolarHBondContact O-N 2.82Å; H300-S305 PolarHBondContact CD2-O 2.7Å; H300-S305 PolarHBondContact CD2-OG 3.08Å; H300-E307 IonicContact CE1-OE1 3.75Å; H300-E307 IonicContact NE2-OE1 3.99Å; H300-K310 HydrophobicContact CB-CB 3.92Å; H300-K310 HydrophobicContact CB-CD 4.4Å; H300-K310 HydrophobicContact CB-CG 3.83Å; H300-K310 VanDerWaalsContact CE1-CE 3.47Å; H300-K310 WeakPolarHBondContact CE1-CE 3.49Å; H300-K310 PolarHBondContact CE1-NZ 3.41Å; H300-K310 VanDerWaalsContact ND1-CD 3.35Å; H300-K310 WeakPolarHBondContact ND1-CD 3.31Å; H300-K310 WeakPolarHBondContact ND1-CE 3.17Å
301	Y	94.2	Very high	95.5	Very high	39 Å²	39	39.9 Å²	39.9	15%	0.153	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.2	37.2	-179.6	-46	-60.6	0	0	0	113.6	K310 F313 R314 M354 S355 V359	Y301-K310 HydrophobicContact CE2-CG 4.03Å; Y301-F313 AromaticContact CD2-CD1 3.52Å; Y301-F313 HydrophobicContact CD2-CD1 3.52Å; Y301-F313 HydrophobicContact CD2-CE1 4.21Å; Y301-F313 HydrophobicContact CD2-CG 4.41Å; Y301-F313 HydrophobicContact CE2-CD1 4.12Å; Y301-F313 AromaticContact CG-CD1 3.82Å; Y301-F313 HydrophobicContact CG-CD1 3.82Å; Y301-F313 HydrophobicContact CG-CE1 4.03Å; Y301-R314 HydrophobicContact CE2-CB 4.25Å; Y301-R314 WeakPolarHBondContact OH-CB 3.43Å; Y301-R314 WeakPolarHBondContact OH-CD 3.16Å; Y301-R314 WeakPolarHBondContact OH-CG 3.28Å; Y301-M354 CarbonylContact O-C 3.08Å; Y301-M354 WeakPolarHBondContact O-CA 3.49Å; Y301-S355 PolarHBondContact O-N 3.16Å; Y301-V359 HydrophobicContact CD1-CB 4.43Å; Y301-V359 HydrophobicContact CD1-CG2 3.66Å; Y301-V359 HydrophobicContact CE1-CB 4.21Å; Y301-V359 HydrophobicContact CE1-CG1 4.37Å; Y301-V359 HydrophobicContact CE1-CG2 3.74Å; Y301-V359 HydrophobicContact CG-CG2 4.19Å
302	G	91.2	Very high	95.5	Very high	56 Å²	56	40.3 Å²	40.3	58%	0.577	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	91	-12.1	-176.5	0	0	0	0	0	115.4	H300	H300-G302 PolarHBondContact O-N 3.47Å
303	V	93.3	Very high	95.5	Very high	7 Å²	7	40.1 Å²	40.1	4%	0.042	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	133.2	-168.1	-169.9	0	0	0	0	113.6	K290 H300 S305 A352 G353 M354	K290-V303 HydrophobicContact CB-CG1 4Å; K290-V303 HydrophobicContact CD-CG1 4.2Å; K290-V303 HydrophobicContact CG-CG1 4.34Å; H300-V303 PolarHBondContact N-O 3.39Å; H300-V303 PolarHBondContact O-N 2.82Å; V303-S305 WeakPolarHBondContact O-CB 3.13Å; V303-S305 PolarHBondContact O-N 2.87Å; V303-S305 PolarHBondContact O-OG 3.08Å; V303-A352 HydrophobicContact CG1-CB 4.16Å; V303-A352 WeakPolarHBondContact CG1-O 3.48Å; V303-A352 WeakPolarHBondContact CG2-O 3.23Å; V303-G353 VanDerWaalsContact CG2-O 3.28Å; V303-G353 WeakPolarHBondContact CG2-O 3.32Å; V303-M354 HydrophobicContact CB-CE 4.17Å; V303-M354 HydrophobicContact CB-CG 3.92Å; V303-M354 HydrophobicContact CG2-CB 4.31Å; V303-M354 HydrophobicContact CG2-CG 3.61Å; V303-M354 VanDerWaalsContact CG2-N 3.35Å
304	I	94.8	Very high	95.5	Very high	29 Å²	29	43.2 Å²	43.2	15%	0.149	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-54.1	108.9	167.3	-58.8	175.6	0	0	0	109.7	T287 K290 A296 G298 Y299	T287-I304 HydrophobicContact CG2-CD1 4.18Å; T287-I304 HydrophobicContact CG2-CG2 3.73Å; K290-I304 PolarHBondContact N-O 3.47Å; K290-I304 VanDerWaalsContact N-O 3.13Å; A296-I304 HydrophobicContact CB-CG2 3.52Å; G298-I304 WeakPolarHBondContact O-CA 2.99Å; Y299-I304 HydrophobicContact CD1-CG1 3.9Å; Y299-I304 HydrophobicContact CD2-CG1 4.23Å; Y299-I304 HydrophobicContact CE1-CD1 4.15Å; Y299-I304 HydrophobicContact CE1-CG1 3.51Å; Y299-I304 HydrophobicContact CE2-CD1 4.3Å; Y299-I304 HydrophobicContact CE2-CG1 3.87Å; Y299-I304 HydrophobicContact CG-CG1 4.24Å
305	S	96.4	Very high	95.4	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	161.4	-171.1	57.4	0	0	0	0	114.1	C289 A296 S297 G298 H300 V303 M354	C289-S305 VanDerWaalsContact SG-CA 3.59Å; A296-S305 WeakPolarHBondContact CA-O 3.49Å; S297-S305 PolarHBondContact N-O 2.83Å; S297-S305 PolarHBondContact OG-O 2.9Å; G298-S305 PolarHBondContact O-N 3.1Å; H300-S305 PolarHBondContact CD2-O 2.7Å; H300-S305 PolarHBondContact CD2-OG 3.08Å; V303-S305 WeakPolarHBondContact O-CB 3.13Å; V303-S305 PolarHBondContact O-N 2.87Å; V303-S305 PolarHBondContact O-OG 3.08Å; S305-M354 VanDerWaalsContact OG-CE 3.27Å; S305-M354 WeakPolarHBondContact OG-CE 3.42Å
306	C	98.1	Very high	95.4	Very high	3 Å²	3	41.8 Å²	41.8	2%	0.02	22%	0.222	C	C	.	.			trans	-86.3	155.1	177	65.4	0	0	0	0	111.2	C289 C292 D294 K295 G308 C309 K310 R338	C289-C306 HydrophobicContact CB-CB 3.94Å; C289-C306 PolarHBondContact SG-N 3.46Å; C289-C306 VanDerWaalsContact SG-N 3.38Å; C292-C306 VanDerWaalsContact SG-SG 3.61Å; D294-C306 HydrophobicContact CB-CB 4.22Å; K295-C306 WeakPolarHBondContact O-CA 3.42Å; K295-C306 WeakPolarHBondContact O-CB 3.01Å; C306-G308 PolarHBondContact O-N 3.05Å; C306-C309 PolarHBondContact O-N 2.74Å; C306-C309 VanDerWaalsContact SG-SG 3.7Å; C306-K310 PolarHBondContact O-N 2.7Å; C306-R338 PolarHBondContact SG-NH1 3.1Å; C306-R338 VanDerWaalsContact SG-NH1 3.38Å
307	E	97.1	Very high	95.3	Very high	97 Å²	97	41.5 Å²	41.5	45%	0.453	22%	0.218	S	C	.	.	H	α-helix	trans	-48.4	-37.8	174.6	-68.2	-56.6	114.4	0	0	113.2	S297 H300 C309 K310 G311	S297-E307 VanDerWaalsContact CB-OE1 3.3Å; S297-E307 WeakPolarHBondContact CB-OE1 2.97Å; S297-E307 PolarHBondContact OG-N 2.88Å; S297-E307 PolarHBondContact OG-OE1 3.2Å; H300-E307 IonicContact CE1-OE1 3.75Å; H300-E307 IonicContact NE2-OE1 3.99Å; E307-C309 VanDerWaalsContact C-N 3.3Å; E307-C309 PolarHBondContact O-N 2.96Å; E307-K310 VanDerWaalsContact OE1-CD 3.29Å; E307-K310 WeakPolarHBondContact OE1-CD 3.35Å; E307-K310 IonicContact OE1-NZ 2.72Å; E307-K310 PolarHBondContact OE1-NZ 3.05Å; E307-K310 VanDerWaalsContact OE2-CD 3.24Å; E307-K310 WeakPolarHBondContact OE2-CD 3.31Å; E307-K310 WeakPolarHBondContact OE2-CE 3.29Å; E307-K310 IonicContact OE2-NZ 2.72Å; E307-K310 PolarHBondContact OE2-NZ 2.89Å; E307-G311 PolarHBondContact O-N 3.29Å
308	G	97.5	Very high	95.1	Very high	27 Å²	27	42.1 Å²	42.1	28%	0.278	21%	0.214	S	C	.	.	H	α-helix	trans	-63.2	-28.3	177.2	0	0	0	0	0	114.8	C306 F312 R345	C306-G308 PolarHBondContact O-N 3.05Å; G308-F312 VanDerWaalsContact O-CB 3.31Å; G308-F312 WeakPolarHBondContact O-CB 3.3Å; G308-R345 PolarHBondContact O-NH2 3.29Å
309	C	98.3	Very high	95	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-93.2	-41.3	177.9	-70.9	0	0	0	0	111.4	V291 C306 E307 G311 F312 F313 M354	V291-C309 HydrophobicContact CB-CB 4.29Å; V291-C309 HydrophobicContact CG1-CB 4.49Å; V291-C309 HydrophobicContact CG2-CB 4.47Å; C306-C309 PolarHBondContact O-N 2.74Å; C306-C309 VanDerWaalsContact SG-SG 3.7Å; E307-C309 VanDerWaalsContact C-N 3.3Å; E307-C309 PolarHBondContact O-N 2.96Å; C309-G311 PolarHBondContact O-N 3.26Å; C309-F312 PolarHBondContact O-N 2.88Å; C309-F313 WeakPolarHBondContact O-CB 3.37Å; C309-F313 PolarHBondContact O-N 3.3Å; C309-M354 HydrophobicContact CB-CE 4.4Å
310	K	96.6	Very high	94.8	Very high	50 Å²	50	48.4 Å²	48.4	22%	0.217	24%	0.238	C	C	.	.	H	α-helix	trans	-47.5	-57.9	166.3	170.9	-160.1	-167.5	179.2	0	111.9	H300 Y301 C306 E307 F312 F313 R314	H300-K310 HydrophobicContact CB-CB 3.92Å; H300-K310 HydrophobicContact CB-CD 4.4Å; H300-K310 HydrophobicContact CB-CG 3.83Å; H300-K310 VanDerWaalsContact CE1-CE 3.47Å; H300-K310 WeakPolarHBondContact CE1-CE 3.49Å; H300-K310 PolarHBondContact CE1-NZ 3.41Å; H300-K310 VanDerWaalsContact ND1-CD 3.35Å; H300-K310 WeakPolarHBondContact ND1-CD 3.31Å; H300-K310 WeakPolarHBondContact ND1-CE 3.17Å; Y301-K310 HydrophobicContact CE2-CG 4.03Å; C306-K310 PolarHBondContact O-N 2.7Å; E307-K310 VanDerWaalsContact OE1-CD 3.29Å; E307-K310 WeakPolarHBondContact OE1-CD 3.35Å; E307-K310 IonicContact OE1-NZ 2.72Å; E307-K310 PolarHBondContact OE1-NZ 3.05Å; E307-K310 VanDerWaalsContact OE2-CD 3.24Å; E307-K310 WeakPolarHBondContact OE2-CD 3.31Å; E307-K310 WeakPolarHBondContact OE2-CE 3.29Å; E307-K310 IonicContact OE2-NZ 2.72Å; E307-K310 PolarHBondContact OE2-NZ 2.89Å; K310-F312 VanDerWaalsContact C-N 3.31Å; K310-F312 PolarHBondContact O-N 3.33Å; K310-F313 PolarHBondContact O-N 2.96Å; K310-R314 WeakPolarHBondContact O-CB 3.42Å; K310-R314 PolarHBondContact O-N 2.85Å
311	G	96.3	Very high	94.6	Very high	12 Å²	12	50 Å²	50	12%	0.124	25%	0.247	C	C	.	.	H	α-helix	trans	-67.3	-28.3	-178.4	0	0	0	0	0	113.9	E307 C309 R315	E307-G311 PolarHBondContact O-N 3.29Å; C309-G311 PolarHBondContact O-N 3.26Å; G311-R315 WeakPolarHBondContact O-CG 3.35Å; G311-R315 PolarHBondContact O-N 2.81Å; G311-R315 PolarHBondContact O-NE 3.45Å; G311-R315 PolarHBondContact O-NH1 3.17Å
312	F	98	Very high	94.6	Very high	9 Å²	9	54.8 Å²	54.8	4%	0.039	27%	0.271	C	S	.	.	H	α-helix	trans	-70.9	-52.3	173	171.2	-95.1	0	0	0	111.5	G308 C309 K310 R314 R315 S316 Y323 Q342 R345 F346	G308-F312 VanDerWaalsContact O-CB 3.31Å; G308-F312 WeakPolarHBondContact O-CB 3.3Å; C309-F312 PolarHBondContact O-N 2.88Å; K310-F312 VanDerWaalsContact C-N 3.31Å; K310-F312 PolarHBondContact O-N 3.33Å; F312-R314 PolarHBondContact O-N 3.35Å; F312-R315 PolarHBondContact O-N 3.18Å; F312-S316 PolarHBondContact O-N 2.83Å; F312-S316 PolarHBondContact O-OG 2.86Å; F312-Y323 HydrophobicContact CE2-CE2 4.18Å; F312-Y323 HydrophobicContact CZ-CD2 4.42Å; F312-Y323 AromaticContact CZ-CE2 3.65Å; F312-Y323 HydrophobicContact CZ-CE2 3.65Å; F312-Y323 AromaticContact CZ-CZ 3.97Å; F312-Q342 HydrophobicContact CE2-CB 4.22Å; F312-Q342 HydrophobicContact CE2-CG 4.24Å; F312-Q342 HydrophobicContact CZ-CB 4.27Å; F312-R345 VanDerWaalsContact CD1-CD 3.49Å; F312-R345 HydrophobicContact CD1-CG 3.98Å; F312-R345 HydrophobicContact CE1-CB 4.08Å; F312-R345 HydrophobicContact CE1-CG 3.82Å; F312-R345 HydrophobicContact CZ-CB 4.19Å; F312-R345 HydrophobicContact CZ-CG 4.28Å; F312-F346 HydrophobicContact CE1-CB 3.79Å; F312-F346 HydrophobicContact CE1-CD2 4.15Å; F312-F346 HydrophobicContact CE1-CG 4.46Å; F312-F346 HydrophobicContact CZ-CB 4.01Å
313	F	97.2	Very high	94.8	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-58.3	-47.5	179.4	-174.5	-101.9	0	0	0	111.1	Y301 C309 K310 R315 S316 I317 F346 C349 L350 M354 S355 V359	Y301-F313 AromaticContact CD2-CD1 3.52Å; Y301-F313 HydrophobicContact CD2-CD1 3.52Å; Y301-F313 HydrophobicContact CD2-CE1 4.21Å; Y301-F313 HydrophobicContact CD2-CG 4.41Å; Y301-F313 HydrophobicContact CE2-CD1 4.12Å; Y301-F313 AromaticContact CG-CD1 3.82Å; Y301-F313 HydrophobicContact CG-CD1 3.82Å; Y301-F313 HydrophobicContact CG-CE1 4.03Å; C309-F313 WeakPolarHBondContact O-CB 3.37Å; C309-F313 PolarHBondContact O-N 3.3Å; K310-F313 PolarHBondContact O-N 2.96Å; F313-R315 VanDerWaalsContact C-N 3.33Å; F313-R315 PolarHBondContact O-N 3.34Å; F313-S316 WeakPolarHBondContact O-CB 3.4Å; F313-S316 PolarHBondContact O-N 2.74Å; F313-S316 VanDerWaalsContact O-N 3.07Å; F313-I317 HydrophobicContact CD1-CG1 4.19Å; F313-I317 HydrophobicContact CD2-CG1 4.5Å; F313-I317 HydrophobicContact CE1-CG1 3.81Å; F313-I317 HydrophobicContact CE2-CD1 4.17Å; F313-I317 HydrophobicContact CE2-CG1 4.14Å; F313-I317 HydrophobicContact CZ-CD1 4.04Å; F313-I317 HydrophobicContact CZ-CG1 3.78Å; F313-I317 PolarHBondContact O-N 3.32Å; F313-F346 HydrophobicContact CD2-CD2 4.12Å; F313-F346 AromaticContact CD2-CE2 3.73Å; F313-F346 HydrophobicContact CD2-CE2 3.73Å; F313-F346 HydrophobicContact CE2-CD2 4.49Å; F313-F346 AromaticContact CE2-CE2 3.78Å; F313-F346 HydrophobicContact CE2-CE2 3.78Å; F313-F346 HydrophobicContact CE2-CZ 4.48Å; F313-C349 HydrophobicContact CD2-CB 3.65Å; F313-C349 HydrophobicContact CE2-CB 4.26Å; F313-L350 HydrophobicContact CE2-CD2 3.9Å; F313-L350 HydrophobicContact CE2-CG 4.46Å; F313-L350 HydrophobicContact CZ-CD2 4.35Å; F313-M354 HydrophobicContact CB-SD 3.97Å; F313-M354 HydrophobicContact CD1-CB 4.23Å; F313-M354 HydrophobicContact CD1-SD 4.48Å; F313-M354 HydrophobicContact CD2-CB 3.96Å; F313-M354 HydrophobicContact CD2-SD 4.12Å; F313-M354 HydrophobicContact CE1-CB 3.97Å; F313-M354 HydrophobicContact CE2-CB 3.69Å; F313-M354 HydrophobicContact CG-CB 4.21Å; F313-M354 HydrophobicContact CG-SD 3.94Å; F313-M354 HydrophobicContact CZ-CB 3.7Å; F313-M354 WeakPolarHBondContact CZ-O 3.23Å; F313-S355 WeakPolarHBondContact CE1-O 3.43Å; F313-V359 HydrophobicContact CD1-CG2 3.92Å; F313-V359 HydrophobicContact CE1-CG2 3.56Å
314	R	95.2	Very high	94.8	Very high	109 Å²	109	61.1 Å²	61.1	41%	0.411	28%	0.281	S	S	.	.	H	α-helix	trans	-52.8	-47.2	176	-165.3	-175	80	-161.6	1.2	112.6	Y301 K310 F312 Q318 V359	Y301-R314 HydrophobicContact CE2-CB 4.25Å; Y301-R314 WeakPolarHBondContact OH-CB 3.43Å; Y301-R314 WeakPolarHBondContact OH-CD 3.16Å; Y301-R314 WeakPolarHBondContact OH-CG 3.28Å; K310-R314 WeakPolarHBondContact O-CB 3.42Å; K310-R314 PolarHBondContact O-N 2.85Å; F312-R314 PolarHBondContact O-N 3.35Å; R314-Q318 HydrophobicContact CG-CG 4.29Å; R314-Q318 VanDerWaalsContact O-CB 3.24Å; R314-Q318 WeakPolarHBondContact O-CB 3.38Å; R314-Q318 VanDerWaalsContact O-CG 3.22Å; R314-Q318 WeakPolarHBondContact O-CG 3.36Å; R314-Q318 PolarHBondContact O-N 3.05Å; R314-V359 HydrophobicContact CG-CG1 4.09Å
315	R	95.5	Very high	94.9	Very high	131 Å²	131	61.2 Å²	61.2	49%	0.494	28%	0.284	S	S	.	.	H	α-helix	trans	-67.4	-37.6	178.4	-73.5	-174.3	-58.6	-100.2	3.1	112.7	G311 F312 F313 K319	G311-R315 WeakPolarHBondContact O-CG 3.35Å; G311-R315 PolarHBondContact O-N 2.81Å; G311-R315 PolarHBondContact O-NE 3.45Å; G311-R315 PolarHBondContact O-NH1 3.17Å; F312-R315 PolarHBondContact O-N 3.18Å; F313-R315 VanDerWaalsContact C-N 3.33Å; F313-R315 PolarHBondContact O-N 3.34Å; R315-K319 WeakPolarHBondContact O-CB 3.47Å; R315-K319 PolarHBondContact O-N 2.86Å; R315-K319 VanDerWaalsContact O-N 3.16Å
316	S	95.8	Very high	94.8	Very high	2 Å²	2	69.5 Å²	69.5	1%	0.014	33%	0.328	C	S	.	.	H	α-helix	trans	-63.2	-46.2	179.2	-49.2	0	0	0	0	110.7	F312 F313 Q320 I321 Y323 F346	F312-S316 PolarHBondContact O-N 2.83Å; F312-S316 PolarHBondContact O-OG 2.86Å; F313-S316 WeakPolarHBondContact O-CB 3.4Å; F313-S316 PolarHBondContact O-N 2.74Å; F313-S316 VanDerWaalsContact O-N 3.07Å; S316-Q320 WeakPolarHBondContact O-CA 3.37Å; S316-Q320 PolarHBondContact O-N 2.96Å; S316-Q320 VanDerWaalsContact O-N 3.16Å; S316-I321 PolarHBondContact O-N 2.58Å; S316-Y323 PolarHBondContact OG-OH 2.94Å; S316-F346 VanDerWaalsContact CB-CE2 3.47Å
317	I	92.2	Very high	94.5	Very high	11 Å²	11	76.8 Å²	76.8	6%	0.056	36%	0.355	C	S	.	.	H	α-helix	trans	-70.5	-51.3	177.2	-58.8	-51	0	0	0	111.7	F313 K319 Q320 F346 K356 V359	F313-I317 HydrophobicContact CD1-CG1 4.19Å; F313-I317 HydrophobicContact CD2-CG1 4.5Å; F313-I317 HydrophobicContact CE1-CG1 3.81Å; F313-I317 HydrophobicContact CE2-CD1 4.17Å; F313-I317 HydrophobicContact CE2-CG1 4.14Å; F313-I317 HydrophobicContact CZ-CD1 4.04Å; F313-I317 HydrophobicContact CZ-CG1 3.78Å; F313-I317 PolarHBondContact O-N 3.32Å; I317-K319 PolarHBondContact O-N 3.05Å; I317-Q320 PolarHBondContact O-N 3.38Å; I317-F346 HydrophobicContact CD1-CE2 3.83Å; I317-F346 HydrophobicContact CD1-CZ 3.64Å; I317-K356 HydrophobicContact CD1-CB 4.39Å; I317-K356 HydrophobicContact CD1-CG 4.11Å; I317-K356 HydrophobicContact CG2-CG 3.99Å; I317-V359 HydrophobicContact CB-CB 4.45Å; I317-V359 HydrophobicContact CB-CG1 4.36Å; I317-V359 HydrophobicContact CB-CG2 4.16Å; I317-V359 HydrophobicContact CG1-CG2 4.09Å; I317-V359 HydrophobicContact CG2-CB 4.03Å; I317-V359 HydrophobicContact CG2-CG1 4.22Å; I317-V359 HydrophobicContact CG2-CG2 4.13Å
318	Q	90	Very high	94.3	Very high	73 Å²	73	77.1 Å²	77.1	34%	0.341	36%	0.36	S	S	.	.	H	α-helix	trans	-62.8	-27.2	-174.9	-75	179.2	-28.4	0	0	114.2	R314 V359	R314-Q318 HydrophobicContact CG-CG 4.29Å; R314-Q318 VanDerWaalsContact O-CB 3.24Å; R314-Q318 WeakPolarHBondContact O-CB 3.38Å; R314-Q318 VanDerWaalsContact O-CG 3.22Å; R314-Q318 WeakPolarHBondContact O-CG 3.36Å; R314-Q318 PolarHBondContact O-N 3.05Å; Q318-V359 HydrophobicContact CG-CG1 4.08Å
319	K	90.5	Very high	94	Very high	168 Å²	168	76.3 Å²	76.3	73%	0.73	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.5	7.4	175.5	-69.1	-168.8	171.4	-160.2	0	113.5	R315 I317 I321	R315-K319 WeakPolarHBondContact O-CB 3.47Å; R315-K319 PolarHBondContact O-N 2.86Å; R315-K319 VanDerWaalsContact O-N 3.16Å; I317-K319 PolarHBondContact O-N 3.05Å; K319-I321 VanDerWaalsContact C-N 3.25Å; K319-I321 HydrophobicContact CB-CD1 3.88Å; K319-I321 HydrophobicContact CB-CG1 3.55Å; K319-I321 HydrophobicContact CD-CD1 4.33Å; K319-I321 PolarHBondContact O-N 2.72Å
320	Q	87.9	Confident	93.8	Very high	166 Å²	166	83.5 Å²	83.5	78%	0.776	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.1	45.4	-177.7	-57.6	-174.1	2.3	0	0	113.5	S316 I317 E322	S316-Q320 WeakPolarHBondContact O-CA 3.37Å; S316-Q320 PolarHBondContact O-N 2.96Å; S316-Q320 VanDerWaalsContact O-N 3.16Å; I317-Q320 PolarHBondContact O-N 3.38Å; Q320-E322 PolarHBondContact O-N 3.35Å
321	I	91.6	Very high	93.8	Very high	60 Å²	60	82.1 Å²	82.1	31%	0.308	38%	0.379	S	S	.	.			trans	-79.2	112.6	-170.7	-47.6	178.6	0	0	0	110.4	S316 K319 Y323	S316-I321 PolarHBondContact O-N 2.58Å; K319-I321 VanDerWaalsContact C-N 3.25Å; K319-I321 HydrophobicContact CB-CD1 3.88Å; K319-I321 HydrophobicContact CB-CG1 3.55Å; K319-I321 HydrophobicContact CD-CD1 4.33Å; K319-I321 PolarHBondContact O-N 2.72Å; I321-Y323 HydrophobicContact CB-CE1 4.18Å; I321-Y323 HydrophobicContact CB-CE2 4.47Å; I321-Y323 HydrophobicContact CG2-CD1 3.87Å; I321-Y323 HydrophobicContact CG2-CE1 3.42Å; I321-Y323 VanDerWaalsContact CG2-CE1 3.42Å; I321-Y323 HydrophobicContact CG2-CE2 4.48Å
322	E	92.5	Very high	93.7	Very high	141 Å²	141	88.2 Å²	88.2	66%	0.659	41%	0.408	S	S	*	.			trans	-74.5	132	161.8	-169.2	-179.4	-149.5	0	0	110.1	Q320	Q320-E322 PolarHBondContact O-N 3.35Å
323	Y	96.2	Very high	93.6	Very high	28 Å²	28	88.2 Å²	88.2	11%	0.11	41%	0.409	C	S	.	.			trans	-110.6	145.7	172.9	-60.1	-62.9	0	0	0	110.1	F312 S316 I321 Q342 Y343 F346	F312-Y323 HydrophobicContact CE2-CE2 4.18Å; F312-Y323 HydrophobicContact CZ-CD2 4.42Å; F312-Y323 AromaticContact CZ-CE2 3.65Å; F312-Y323 HydrophobicContact CZ-CE2 3.65Å; F312-Y323 AromaticContact CZ-CZ 3.97Å; S316-Y323 PolarHBondContact OG-OH 2.94Å; I321-Y323 HydrophobicContact CB-CE1 4.18Å; I321-Y323 HydrophobicContact CB-CE2 4.47Å; I321-Y323 HydrophobicContact CG2-CD1 3.87Å; I321-Y323 HydrophobicContact CG2-CE1 3.42Å; I321-Y323 VanDerWaalsContact CG2-CE1 3.42Å; I321-Y323 HydrophobicContact CG2-CE2 4.48Å; Y323-Q342 HydrophobicContact CD1-CB 3.51Å; Y323-Q342 HydrophobicContact CD1-CG 4.43Å; Y323-Q342 VanDerWaalsContact CD1-OE1 3.29Å; Y323-Q342 HydrophobicContact CD2-CB 4.23Å; Y323-Q342 HydrophobicContact CE1-CB 3.69Å; Y323-Q342 HydrophobicContact CE1-CG 4.27Å; Y323-Q342 HydrophobicContact CE2-CB 4.37Å; Y323-Q342 HydrophobicContact CG-CB 3.81Å; Y323-Y343 VanDerWaalsContact O-CD2 3.23Å; Y323-Y343 WeakPolarHBondContact O-CD2 3.28Å; Y323-F346 HydrophobicContact CD2-CB 3.78Å; Y323-F346 HydrophobicContact CD2-CD1 4.3Å; Y323-F346 HydrophobicContact CD2-CG 4.1Å; Y323-F346 HydrophobicContact CE2-CB 3.98Å; Y323-F346 HydrophobicContact CE2-CG 4.14Å
324	K	93.9	Very high	93.6	Very high	167 Å²	167	92.3 Å²	92.3	73%	0.726	43%	0.43	S	S	*	.			trans	-110	152.3	169.1	-63.3	-178.3	-179.7	-180	0	110
325	C	96.9	Very high	93.6	Very high	31 Å²	31	94.5 Å²	94.5	21%	0.209	44%	0.438	C	S	.	.			trans	-92.9	143.8	171.7	-157.3	0	0	0	0	109.9	R327 C341 Y343 C344	C325-R327 VanDerWaalsContact C-N 3.29Å; C325-R327 WeakPolarHBondContact CB-O 3.27Å; C325-R327 PolarHBondContact SG-O 3.13Å; C325-C341 PolarHBondContact SG-SG 3.36Å; C325-Y343 HydrophobicContact CB-CD1 3.61Å; C325-Y343 HydrophobicContact CB-CE1 4.22Å; C325-Y343 HydrophobicContact CB-CG 4.12Å; C325-C344 VanDerWaalsContact SG-SG 3.66Å
326	L	93.9	Very high	93.6	Very high	175 Å²	175	95.6 Å²	95.6	92%	0.916	45%	0.453	S	S	*	.	S	Bend	trans	-98.6	26.2	171.5	-55	178.8	0	0	0	111.5
327	R	92.2	Very high	93.4	Very high	155 Å²	155	98.1 Å²	98.1	59%	0.585	47%	0.466	S	S	*	.	S	Bend	trans	-159.6	-179.6	-178.1	-62.2	-168	-175	162	-9	108.9	C325 G329	C325-R327 VanDerWaalsContact C-N 3.29Å; C325-R327 WeakPolarHBondContact CB-O 3.27Å; C325-R327 PolarHBondContact SG-O 3.13Å; R327-G329 PolarHBondContact O-N 2.91Å
328	D	92	Very high	93.6	Very high	105 Å²	105	99.7 Å²	99.7	56%	0.561	47%	0.472	S	S	*	.	S	Bend	trans	-42.1	-1	170.6	76.3	-20.6	0	0	0	119.9	K330	D328-K330 VanDerWaalsContact C-N 3.28Å; D328-K330 HydrophobicContact CB-CG 4.48Å; D328-K330 PolarHBondContact O-N 3.17Å; D328-K330 PolarHBondContact OD1-N 2.8Å; D328-K330 VanDerWaalsContact OD2-CB 3.23Å; D328-K330 WeakPolarHBondContact OD2-CB 3.46Å; D328-K330 WeakPolarHBondContact OD2-CD 3.18Å; D328-K330 VanDerWaalsContact OD2-CG 3.29Å; D328-K330 WeakPolarHBondContact OD2-CG 3.47Å
329	G	92.1	Very high	93.8	Very high	10 Å²	10	102.1 Å²	102.1	10%	0.103	49%	0.487	C	S	.	.	S	Bend	trans	75.9	2	-176.4	0	0	0	0	0	115.7	R327 C344 R347	R327-G329 PolarHBondContact O-N 2.91Å; G329-C344 PolarHBondContact O-SG 3.48Å; G329-R347 PolarHBondContact O-NE 3.03Å; G329-R347 PolarHBondContact O-NH2 2.96Å
330	K	93.3	Very high	94.1	Very high	151 Å²	151	103.5 Å²	103.5	66%	0.657	49%	0.487	S	S	*	.			trans	-107.6	8.9	-173.8	-44.3	175.6	-169.1	169.5	0	114.4	D328 L332	D328-K330 VanDerWaalsContact C-N 3.28Å; D328-K330 HydrophobicContact CB-CG 4.48Å; D328-K330 PolarHBondContact O-N 3.17Å; D328-K330 PolarHBondContact OD1-N 2.8Å; D328-K330 VanDerWaalsContact OD2-CB 3.23Å; D328-K330 WeakPolarHBondContact OD2-CB 3.46Å; D328-K330 WeakPolarHBondContact OD2-CD 3.18Å; D328-K330 VanDerWaalsContact OD2-CG 3.29Å; D328-K330 WeakPolarHBondContact OD2-CG 3.47Å; K330-L332 PolarHBondContact O-N 3.21Å
331	C	96	Very high	94.5	Very high	20 Å²	20	96.4 Å²	96.4	14%	0.135	46%	0.456	C	S	.	.			trans	-43.8	122.4	179.8	-58.2	0	0	0	0	113.1	V333 C341 C344	C331-V333 WeakPolarHBondContact O-CG2 3.24Å; C331-V333 PolarHBondContact O-N 3.42Å; C331-C341 HydrophobicContact CB-CB 3.93Å; C331-C344 HydrophobicContact CB-CB 3.84Å; C331-C344 VanDerWaalsContact CB-SG 3.53Å
332	L	94.8	Very high	94.8	Very high	141 Å²	141	98.6 Å²	98.6	74%	0.738	47%	0.465	S	S	*	.			trans	-56.3	135.1	176.3	-63.7	174.7	0	0	0	111.4	K330 N337	K330-L332 PolarHBondContact O-N 3.21Å; L332-N337 VanDerWaalsContact O-CG 3.28Å; L332-N337 PolarHBondContact O-ND2 2.97Å; L332-N337 PolarHBondContact O-OD1 3.4Å; L332-N337 VanDerWaalsContact O-OD1 3.05Å
333	V	96.8	Very high	95	Very high	9 Å²	9	95.4 Å²	95.4	6%	0.055	45%	0.447	C	S	.	.			trans	-119.7	101.6	-179.8	179.9	0	0	0	0	109.4	V291 C292 C331 R338 C344 R345 K348	V291-V333 HydrophobicContact CG1-CG1 4.33Å; C292-V333 HydrophobicContact CB-CG1 4.15Å; C331-V333 WeakPolarHBondContact O-CG2 3.24Å; C331-V333 PolarHBondContact O-N 3.42Å; V333-R338 HydrophobicContact CG1-CB 4.07Å; V333-C344 HydrophobicContact CG2-CB 4.17Å; V333-R345 HydrophobicContact CG1-CB 4.38Å; V333-R345 HydrophobicContact CG1-CG 4.15Å; V333-R345 HydrophobicContact CG2-CB 4.43Å; V333-K348 HydrophobicContact CB-CD 3.88Å; V333-K348 HydrophobicContact CG1-CD 4.38Å; V333-K348 HydrophobicContact CG2-CD 4.41Å; V333-K348 PolarHBondContact O-NZ 3.29Å; V333-K348 VanDerWaalsContact O-NZ 3.1Å
334	I	95.9	Very high	95.1	Very high	86 Å²	86	94.3 Å²	94.3	44%	0.441	44%	0.444	S	S	.	.			trans	-129.8	167.3	175.8	59.7	162.9	0	0	0	110.6	C292 L336 N337 R338	C292-I334 CarbonylContact O-C 3.52Å; C292-I334 WeakPolarHBondContact O-CA 3.35Å; I334-L336 HydrophobicContact CD1-CB 4.42Å; I334-L336 PolarHBondContact O-N 3.29Å; I334-N337 HydrophobicContact CG1-CB 4.41Å; I334-N337 WeakPolarHBondContact CG1-OD1 3.28Å; I334-N337 PolarHBondContact N-OD1 2.85Å; I334-N337 PolarHBondContact O-N 2.93Å; I334-N337 VanDerWaalsContact O-N 3.11Å; I334-N337 PolarHBondContact O-OD1 3.37Å; I334-R338 VanDerWaalsContact O-CB 3.3Å; I334-R338 WeakPolarHBondContact O-CB 3.16Å; I334-R338 PolarHBondContact O-N 3.23Å
335	R	96	Very high	95.3	Very high	154 Å²	154	86.9 Å²	86.9	58%	0.581	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-42.1	-45.2	-178.5	174.1	-179.2	151.2	86.8	1.5	113.9	C292 D294 R338	C292-R335 PolarHBondContact O-N 3.43Å; D294-R335 HydrophobicContact CB-CB 4.11Å; D294-R335 HydrophobicContact CB-CG 4.09Å; D294-R335 WeakPolarHBondContact OD1-CD 3.41Å; D294-R335 IonicContact OD1-CZ 3.76Å; D294-R335 IonicContact OD1-NE 3.95Å; D294-R335 IonicContact OD1-NH1 2.78Å; D294-R335 PolarHBondContact OD1-NH1 3.38Å; R335-R338 PolarHBondContact O-NE 3Å
336	L	94.6	Very high	95.4	Very high	154 Å²	154	87.1 Å²	87.1	81%	0.806	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.2	-46.1	-177.8	-62.2	172.5	0	0	0	113.1	I334	I334-L336 HydrophobicContact CD1-CB 4.42Å; I334-L336 PolarHBondContact O-N 3.29Å
337	N	92.8	Very high	95.5	Very high	56 Å²	56	84.5 Å²	84.5	30%	0.299	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.4	1.3	-167.5	75.7	-1.3	0	0	0	114.5	L332 I334 N339 R340	L332-N337 VanDerWaalsContact O-CG 3.28Å; L332-N337 PolarHBondContact O-ND2 2.97Å; L332-N337 PolarHBondContact O-OD1 3.4Å; L332-N337 VanDerWaalsContact O-OD1 3.05Å; I334-N337 HydrophobicContact CG1-CB 4.41Å; I334-N337 WeakPolarHBondContact CG1-OD1 3.28Å; I334-N337 PolarHBondContact N-OD1 2.85Å; I334-N337 PolarHBondContact O-N 2.93Å; I334-N337 VanDerWaalsContact O-N 3.11Å; I334-N337 PolarHBondContact O-OD1 3.37Å; N337-N339 PolarHBondContact O-N 3.03Å; N337-R340 VanDerWaalsContact O-CB 3.25Å; N337-R340 WeakPolarHBondContact O-CB 3.46Å; N337-R340 PolarHBondContact O-N 3.09Å
338	R	95.3	Very high	95.7	Very high	44 Å²	44	80.9 Å²	80.9	17%	0.166	38%	0.375	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.2	-15.9	-176.2	60	-178	175.4	-167.7	-8.1	116	C292 D294 C306 V333 I334 R335 R345	C292-R338 HydrophobicContact CB-CB 4.33Å; C292-R338 PolarHBondContact SG-NH1 3.48Å; C292-R338 VanDerWaalsContact SG-NH1 3.39Å; D294-R338 IonicContact OD2-CZ 3.18Å; D294-R338 IonicContact OD2-NH1 2.7Å; D294-R338 PolarHBondContact OD2-NH1 3.06Å; D294-R338 IonicContact OD2-NH2 2.82Å; D294-R338 PolarHBondContact OD2-NH2 2.88Å; C306-R338 PolarHBondContact SG-NH1 3.1Å; C306-R338 VanDerWaalsContact SG-NH1 3.38Å; V333-R338 HydrophobicContact CG1-CB 4.07Å; I334-R338 VanDerWaalsContact O-CB 3.3Å; I334-R338 WeakPolarHBondContact O-CB 3.16Å; I334-R338 PolarHBondContact O-N 3.23Å; R335-R338 PolarHBondContact O-NE 3Å; R338-R345 VanDerWaalsContact C-NH1 3.3Å; R338-R345 VanDerWaalsContact O-CD 3.32Å; R338-R345 WeakPolarHBondContact O-CD 3.46Å; R338-R345 PolarHBondContact O-NH1 2.91Å
339	N	95.8	Very high	96	Very high	123 Å²	123	75.9 Å²	75.9	66%	0.658	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.4	-14.9	175.3	-66.2	-6.5	0	0	0	113.3	N337 C341 R345	N337-N339 PolarHBondContact O-N 3.03Å; N339-C341 PolarHBondContact O-N 3.16Å; N339-R345 PolarHBondContact OD1-NH1 3.4Å
340	R	95.3	Very high	96.2	Very high	197 Å²	197	78 Å²	78	74%	0.743	36%	0.357	S	S	*	.	S	Bend	trans	-70.3	-25.6	-170.6	-174.4	61.3	-175.1	-145.5	6.3	114.5	N337	N337-R340 VanDerWaalsContact O-CB 3.25Å; N337-R340 WeakPolarHBondContact O-CB 3.46Å; N337-R340 PolarHBondContact O-N 3.09Å
341	C	97.3	Very high	96.4	Very high	17 Å²	17	74.8 Å²	74.8	12%	0.115	36%	0.359	C	S	.	.			trans	-144.1	111.1	171.2	-176.8	0	0	0	0	110.4	C325 C331 N339 C344 R345	C325-C341 PolarHBondContact SG-SG 3.36Å; C331-C341 HydrophobicContact CB-CB 3.93Å; N339-C341 PolarHBondContact O-N 3.16Å; C341-C344 HydrophobicContact CB-CB 4.15Å; C341-C344 PolarHBondContact SG-N 3.27Å; C341-C344 PolarHBondContact SG-SG 3.43Å; C341-R345 PolarHBondContact O-N 3.42Å
342	Q	97.3	Very high	96.3	Very high	107 Å²	107	75.1 Å²	75.1	50%	0.5	36%	0.363	S	S	.	.	H	α-helix	trans	-67.9	-38.6	-180	-65.3	176.1	-17.1	0	0	111.6	F312 Y323 R345 F346	F312-Q342 HydrophobicContact CE2-CB 4.22Å; F312-Q342 HydrophobicContact CE2-CG 4.24Å; F312-Q342 HydrophobicContact CZ-CB 4.27Å; Y323-Q342 HydrophobicContact CD1-CB 3.51Å; Y323-Q342 HydrophobicContact CD1-CG 4.43Å; Y323-Q342 VanDerWaalsContact CD1-OE1 3.29Å; Y323-Q342 HydrophobicContact CD2-CB 4.23Å; Y323-Q342 HydrophobicContact CE1-CB 3.69Å; Y323-Q342 HydrophobicContact CE1-CG 4.27Å; Y323-Q342 HydrophobicContact CE2-CB 4.37Å; Y323-Q342 HydrophobicContact CG-CB 3.81Å; Q342-R345 PolarHBondContact O-N 3.27Å; Q342-F346 WeakPolarHBondContact O-CB 3.24Å; Q342-F346 PolarHBondContact O-N 3.2Å
343	Y	97.8	Very high	96.3	Very high	74 Å²	74	70.6 Å²	70.6	29%	0.29	35%	0.35	S	S	.	.	H	α-helix	trans	-57.1	-54.8	174.7	172.4	-96.5	0	0	0	112.3	Y323 C325 R345 F346 R347	Y323-Y343 VanDerWaalsContact O-CD2 3.23Å; Y323-Y343 WeakPolarHBondContact O-CD2 3.28Å; C325-Y343 HydrophobicContact CB-CD1 3.61Å; C325-Y343 HydrophobicContact CB-CE1 4.22Å; C325-Y343 HydrophobicContact CB-CG 4.12Å; Y343-R345 VanDerWaalsContact C-N 3.28Å; Y343-R345 PolarHBondContact O-N 3.02Å; Y343-F346 PolarHBondContact O-N 2.95Å; Y343-F346 VanDerWaalsContact O-N 3.17Å; Y343-R347 WeakPolarHBondContact O-CB 3.22Å; Y343-R347 PolarHBondContact O-N 2.9Å
344	C	97.8	Very high	96.2	Very high	5 Å²	5	70.4 Å²	70.4	3%	0.034	35%	0.349	C	S	.	.	H	α-helix	trans	-64.1	-34.4	-178.9	-61	0	0	0	0	112.1	C325 G329 C331 V333 C341 K348	C325-C344 VanDerWaalsContact SG-SG 3.66Å; G329-C344 PolarHBondContact O-SG 3.48Å; C331-C344 HydrophobicContact CB-CB 3.84Å; C331-C344 VanDerWaalsContact CB-SG 3.53Å; V333-C344 HydrophobicContact CG2-CB 4.17Å; C341-C344 HydrophobicContact CB-CB 4.15Å; C341-C344 PolarHBondContact SG-N 3.27Å; C341-C344 PolarHBondContact SG-SG 3.43Å; C344-K348 VanDerWaalsContact O-CB 3.31Å; C344-K348 WeakPolarHBondContact O-CB 3.33Å; C344-K348 PolarHBondContact O-N 3.16Å
345	R	98.1	Very high	95.9	Very high	11 Å²	11	67.9 Å²	67.9	4%	0.042	34%	0.339	C	S	.	.	H	α-helix	trans	-65.1	-45.1	173.1	-170.3	-165.9	-168.3	143	-12.4	112	G308 F312 V333 R338 N339 C341 Q342 Y343 K348 C349	G308-R345 PolarHBondContact O-NH2 3.29Å; F312-R345 VanDerWaalsContact CD1-CD 3.49Å; F312-R345 HydrophobicContact CD1-CG 3.98Å; F312-R345 HydrophobicContact CE1-CB 4.08Å; F312-R345 HydrophobicContact CE1-CG 3.82Å; F312-R345 HydrophobicContact CZ-CB 4.19Å; F312-R345 HydrophobicContact CZ-CG 4.28Å; V333-R345 HydrophobicContact CG1-CB 4.38Å; V333-R345 HydrophobicContact CG1-CG 4.15Å; V333-R345 HydrophobicContact CG2-CB 4.43Å; R338-R345 VanDerWaalsContact C-NH1 3.3Å; R338-R345 VanDerWaalsContact O-CD 3.32Å; R338-R345 WeakPolarHBondContact O-CD 3.46Å; R338-R345 PolarHBondContact O-NH1 2.91Å; N339-R345 PolarHBondContact OD1-NH1 3.4Å; C341-R345 PolarHBondContact O-N 3.42Å; Q342-R345 PolarHBondContact O-N 3.27Å; Y343-R345 VanDerWaalsContact C-N 3.28Å; Y343-R345 PolarHBondContact O-N 3.02Å; R345-K348 CarbonylContact O-C 3.4Å; R345-K348 PolarHBondContact O-N 3.16Å; R345-C349 PolarHBondContact O-N 2.7Å; R345-C349 PolarHBondContact O-SG 3.45Å
346	F	97.8	Very high	95.4	Very high	36 Å²	36	64.6 Å²	64.6	16%	0.158	33%	0.329	C	S	.	.	H	α-helix	trans	-68.4	-42.6	179.2	-172.6	-115	0	0	0	111.8	F312 F313 S316 I317 Y323 Q342 Y343 K348 C349 L350	F312-F346 HydrophobicContact CE1-CB 3.79Å; F312-F346 HydrophobicContact CE1-CD2 4.15Å; F312-F346 HydrophobicContact CE1-CG 4.46Å; F312-F346 HydrophobicContact CZ-CB 4.01Å; F313-F346 HydrophobicContact CD2-CD2 4.12Å; F313-F346 AromaticContact CD2-CE2 3.73Å; F313-F346 HydrophobicContact CD2-CE2 3.73Å; F313-F346 HydrophobicContact CE2-CD2 4.49Å; F313-F346 AromaticContact CE2-CE2 3.78Å; F313-F346 HydrophobicContact CE2-CE2 3.78Å; F313-F346 HydrophobicContact CE2-CZ 4.48Å; S316-F346 VanDerWaalsContact CB-CE2 3.47Å; I317-F346 HydrophobicContact CD1-CE2 3.83Å; I317-F346 HydrophobicContact CD1-CZ 3.64Å; Y323-F346 HydrophobicContact CD2-CB 3.78Å; Y323-F346 HydrophobicContact CD2-CD1 4.3Å; Y323-F346 HydrophobicContact CD2-CG 4.1Å; Y323-F346 HydrophobicContact CE2-CB 3.98Å; Y323-F346 HydrophobicContact CE2-CG 4.14Å; Q342-F346 WeakPolarHBondContact O-CB 3.24Å; Q342-F346 PolarHBondContact O-N 3.2Å; Y343-F346 PolarHBondContact O-N 2.95Å; Y343-F346 VanDerWaalsContact O-N 3.17Å; F346-K348 VanDerWaalsContact C-N 3.27Å; F346-K348 PolarHBondContact O-N 3.19Å; F346-C349 WeakPolarHBondContact O-CB 3.15Å; F346-C349 PolarHBondContact O-N 2.93Å; F346-C349 VanDerWaalsContact O-N 3.09Å; F346-L350 HydrophobicContact CD1-CD1 4.18Å; F346-L350 HydrophobicContact CE1-CD1 3.78Å; F346-L350 HydrophobicContact CE1-CG 4.46Å; F346-L350 HydrophobicContact CZ-CD1 4.12Å; F346-L350 HydrophobicContact CZ-CG 4.39Å; F346-L350 PolarHBondContact O-N 2.74Å
347	R	96.6	Very high	94.7	Very high	119 Å²	119	62.9 Å²	62.9	45%	0.449	32%	0.321	S	S	.	.	H	α-helix	trans	-55.7	-41.5	170.4	-169	170.8	75.8	84	-8.2	111.6	G329 Y343 A351	G329-R347 PolarHBondContact O-NE 3.03Å; G329-R347 PolarHBondContact O-NH2 2.96Å; Y343-R347 WeakPolarHBondContact O-CB 3.22Å; Y343-R347 PolarHBondContact O-N 2.9Å; R347-A351 VanDerWaalsContact O-CB 3.28Å; R347-A351 WeakPolarHBondContact O-CB 3.35Å; R347-A351 PolarHBondContact O-N 3.02Å
348	K	97.4	Very high	93.8	Very high	80 Å²	80	63 Å²	63	35%	0.348	33%	0.326	S	S	.	.	H	α-helix	trans	-76.7	-24.5	176.2	-162.8	177.6	177.1	-166.4	0	114	V291 V333 C344 R345 F346 A352	V291-K348 HydrophobicContact CG1-CB 4.38Å; V291-K348 HydrophobicContact CG1-CG 4.39Å; V291-K348 VanDerWaalsContact O-CD 3.23Å; V291-K348 WeakPolarHBondContact O-CD 3.02Å; V291-K348 WeakPolarHBondContact O-CE 3.49Å; V291-K348 PolarHBondContact O-NZ 3.07Å; V333-K348 HydrophobicContact CB-CD 3.88Å; V333-K348 HydrophobicContact CG1-CD 4.38Å; V333-K348 HydrophobicContact CG2-CD 4.41Å; V333-K348 PolarHBondContact O-NZ 3.29Å; V333-K348 VanDerWaalsContact O-NZ 3.1Å; C344-K348 VanDerWaalsContact O-CB 3.31Å; C344-K348 WeakPolarHBondContact O-CB 3.33Å; C344-K348 PolarHBondContact O-N 3.16Å; R345-K348 CarbonylContact O-C 3.4Å; R345-K348 PolarHBondContact O-N 3.16Å; F346-K348 VanDerWaalsContact C-N 3.27Å; F346-K348 PolarHBondContact O-N 3.19Å; K348-A352 WeakPolarHBondContact O-CB 3.37Å; K348-A352 PolarHBondContact O-N 2.98Å
349	C	97.8	Very high	92.4	Very high	0 Å²	0	61.1 Å²	61.1	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-62.9	-52.1	167.2	-78.5	0	0	0	0	110.5	F313 R345 F346 A352 M354	F313-C349 HydrophobicContact CD2-CB 3.65Å; F313-C349 HydrophobicContact CE2-CB 4.26Å; R345-C349 PolarHBondContact O-N 2.7Å; R345-C349 PolarHBondContact O-SG 3.45Å; F346-C349 WeakPolarHBondContact O-CB 3.15Å; F346-C349 PolarHBondContact O-N 2.93Å; F346-C349 VanDerWaalsContact O-N 3.09Å; C349-A352 PolarHBondContact O-N 3.49Å; C349-M354 HydrophobicContact CB-CB 4.39Å; C349-M354 HydrophobicContact CB-CG 4.35Å; C349-M354 HydrophobicContact CB-SD 3.6Å; C349-M354 VanDerWaalsContact CB-SD 3.6Å; C349-M354 VanDerWaalsContact O-CB 3.28Å; C349-M354 WeakPolarHBondContact O-CB 3.39Å; C349-M354 WeakPolarHBondContact O-CG 3.32Å; C349-M354 PolarHBondContact O-N 3.06Å; C349-M354 VanDerWaalsContact O-N 3.1Å
350	L	96.1	Very high	90.8	Very high	53 Å²	53	66.2 Å²	66.2	28%	0.277	33%	0.329	S	S	.	.	H	α-helix	trans	-60.5	-50.6	177.4	-66.1	170.4	0	0	0	111.2	F313 F346 A352 G353	F313-L350 HydrophobicContact CE2-CD2 3.9Å; F313-L350 HydrophobicContact CE2-CG 4.46Å; F313-L350 HydrophobicContact CZ-CD2 4.35Å; F346-L350 HydrophobicContact CD1-CD1 4.18Å; F346-L350 HydrophobicContact CE1-CD1 3.78Å; F346-L350 HydrophobicContact CE1-CG 4.46Å; F346-L350 HydrophobicContact CZ-CD1 4.12Å; F346-L350 HydrophobicContact CZ-CG 4.39Å; F346-L350 PolarHBondContact O-N 2.74Å; L350-A352 PolarHBondContact O-N 2.92Å; L350-A352 VanDerWaalsContact O-N 3.16Å; L350-G353 WeakPolarHBondContact O-CA 3.35Å; L350-G353 PolarHBondContact O-N 3.14Å
351	A	96.2	Very high	88.8	Confident	85 Å²	85	63.7 Å²	63.7	70%	0.702	32%	0.321	S	S	*	.	H	α-helix	trans	-65.7	-16.6	179.2	0	0	0	0	0	114.7	R347 G353	R347-A351 VanDerWaalsContact O-CB 3.28Å; R347-A351 WeakPolarHBondContact O-CB 3.35Å; R347-A351 PolarHBondContact O-N 3.02Å; A351-G353 VanDerWaalsContact C-N 3.31Å
352	A	95.3	Very high	86.1	Confident	26 Å²	26	65.8 Å²	65.8	22%	0.215	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-2.9	170.8	0	0	0	0	0	113.3	K290 V291 V303 K348 C349 L350	K290-A352 HydrophobicContact CB-CB 4.22Å; V291-A352 HydrophobicContact CG2-CB 3.94Å; V303-A352 HydrophobicContact CG1-CB 4.16Å; V303-A352 WeakPolarHBondContact CG1-O 3.48Å; V303-A352 WeakPolarHBondContact CG2-O 3.23Å; K348-A352 WeakPolarHBondContact O-CB 3.37Å; K348-A352 PolarHBondContact O-N 2.98Å; C349-A352 PolarHBondContact O-N 3.49Å; L350-A352 PolarHBondContact O-N 2.92Å; L350-A352 VanDerWaalsContact O-N 3.16Å
353	G	94.6	Very high	83.6	Confident	46 Å²	46	72.4 Å²	72.4	47%	0.474	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	100.1	16.8	178.8	0	0	0	0	0	115.7	V303 L350 A351 S355	V303-G353 VanDerWaalsContact CG2-O 3.28Å; V303-G353 WeakPolarHBondContact CG2-O 3.32Å; L350-G353 WeakPolarHBondContact O-CA 3.35Å; L350-G353 PolarHBondContact O-N 3.14Å; A351-G353 VanDerWaalsContact C-N 3.31Å; G353-S355 PolarHBondContact O-N 2.96Å; G353-S355 VanDerWaalsContact O-N 3.14Å
354	M	95.3	Very high	80.6	Confident	5 Å²	5	77.4 Å²	77.4	3%	0.025	39%	0.394	C	S	.	.			trans	-73.2	106.8	-177.6	-69.7	-174.1	164	0	0	111.5	V291 Y301 V303 S305 C309 F313 C349	V291-M354 HydrophobicContact CG2-CE 3.87Å; V291-M354 HydrophobicContact CG2-SD 4.26Å; Y301-M354 CarbonylContact O-C 3.08Å; Y301-M354 WeakPolarHBondContact O-CA 3.49Å; V303-M354 HydrophobicContact CB-CE 4.17Å; V303-M354 HydrophobicContact CB-CG 3.92Å; V303-M354 HydrophobicContact CG2-CB 4.31Å; V303-M354 HydrophobicContact CG2-CG 3.61Å; V303-M354 VanDerWaalsContact CG2-N 3.35Å; S305-M354 VanDerWaalsContact OG-CE 3.27Å; S305-M354 WeakPolarHBondContact OG-CE 3.42Å; C309-M354 HydrophobicContact CB-CE 4.4Å; F313-M354 HydrophobicContact CB-SD 3.97Å; F313-M354 HydrophobicContact CD1-CB 4.23Å; F313-M354 HydrophobicContact CD1-SD 4.48Å; F313-M354 HydrophobicContact CD2-CB 3.96Å; F313-M354 HydrophobicContact CD2-SD 4.12Å; F313-M354 HydrophobicContact CE1-CB 3.97Å; F313-M354 HydrophobicContact CE2-CB 3.69Å; F313-M354 HydrophobicContact CG-CB 4.21Å; F313-M354 HydrophobicContact CG-SD 3.94Å; F313-M354 HydrophobicContact CZ-CB 3.7Å; F313-M354 WeakPolarHBondContact CZ-O 3.23Å; C349-M354 HydrophobicContact CB-CB 4.39Å; C349-M354 HydrophobicContact CB-CG 4.35Å; C349-M354 HydrophobicContact CB-SD 3.6Å; C349-M354 VanDerWaalsContact CB-SD 3.6Å; C349-M354 VanDerWaalsContact O-CB 3.28Å; C349-M354 WeakPolarHBondContact O-CB 3.39Å; C349-M354 WeakPolarHBondContact O-CG 3.32Å; C349-M354 PolarHBondContact O-N 3.06Å; C349-M354 VanDerWaalsContact O-N 3.1Å
355	S	89.4	Confident	78	Confident	34 Å²	34	82.7 Å²	82.7	24%	0.238	43%	0.428	C	S	.	.			trans	-70.9	128.2	179.1	153.3	0	0	0	0	111.6	Y301 F313 G353 D357 S358	Y301-S355 PolarHBondContact O-N 3.16Å; F313-S355 WeakPolarHBondContact CE1-O 3.43Å; G353-S355 PolarHBondContact O-N 2.96Å; G353-S355 VanDerWaalsContact O-N 3.14Å; S355-D357 VanDerWaalsContact C-N 3.27Å; S355-D357 PolarHBondContact O-N 2.95Å; S355-D357 PolarHBondContact OG-N 2.79Å; S355-D357 PolarHBondContact OG-OD2 3.4Å; S355-S358 WeakPolarHBondContact CB-OG 3.24Å; S355-S358 PolarHBondContact OG-N 3.08Å; S355-S358 PolarHBondContact OG-OG 3.08Å; S355-S358 VanDerWaalsContact OG-OG 3.06Å
356	K	84.9	Confident	75.2	Confident	85 Å²	85	92.8 Å²	92.8	37%	0.37	47%	0.467	S	S	.	.	S	Bend	trans	-61.2	-37.8	172.3	175.7	-177	172.6	-161.8	0	111.6	I317 V359 N452	I317-K356 HydrophobicContact CD1-CB 4.39Å; I317-K356 HydrophobicContact CD1-CG 4.11Å; I317-K356 HydrophobicContact CG2-CG 3.99Å; K356-V359 VanDerWaalsContact O-CB 3.23Å; K356-V359 WeakPolarHBondContact O-CB 3.43Å; K356-V359 WeakPolarHBondContact O-CG2 3.4Å; K356-V359 PolarHBondContact O-N 2.98Å; K356-V359 VanDerWaalsContact O-N 3.08Å; K356-N452 HydrophobicContact CD-CB 4.33Å
357	D	79.4	Confident	72.6	Confident	118 Å²	118	102.4 Å²	102.4	63%	0.631	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.8	-30.6	-171.4	-23.8	-75.7	0	0	0	111.2	S355 V359	S355-D357 VanDerWaalsContact C-N 3.27Å; S355-D357 PolarHBondContact O-N 2.95Å; S355-D357 PolarHBondContact OG-N 2.79Å; S355-D357 PolarHBondContact OG-OD2 3.4Å; D357-V359 PolarHBondContact O-N 3.02Å; D357-V359 VanDerWaalsContact O-N 3.17Å
358	S	74.3	Confident	69.9	Low	59 Å²	59	103.2 Å²	103.2	41%	0.413	52%	0.52	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-13.5	169.1	-61.9	0	0	0	0	113.1	S355 R360	S355-S358 WeakPolarHBondContact CB-OG 3.24Å; S355-S358 PolarHBondContact OG-N 3.08Å; S355-S358 PolarHBondContact OG-OG 3.08Å; S355-S358 VanDerWaalsContact OG-OG 3.06Å; S358-R360 VanDerWaalsContact C-N 3.26Å; S358-R360 PolarHBondContact O-N 3.39Å
359	V	65.9	Low	66.9	Low	4 Å²	4	110 Å²	110	2%	0.024	54%	0.543	C	S	.	.			trans	-82.2	69.8	175	-167	0	0	0	0	110.1	Y301 F313 R314 I317 Q318 K356 D357 Y361	Y301-V359 HydrophobicContact CD1-CB 4.43Å; Y301-V359 HydrophobicContact CD1-CG2 3.66Å; Y301-V359 HydrophobicContact CE1-CB 4.21Å; Y301-V359 HydrophobicContact CE1-CG1 4.37Å; Y301-V359 HydrophobicContact CE1-CG2 3.74Å; Y301-V359 HydrophobicContact CG-CG2 4.19Å; F313-V359 HydrophobicContact CD1-CG2 3.92Å; F313-V359 HydrophobicContact CE1-CG2 3.56Å; R314-V359 HydrophobicContact CG-CG1 4.09Å; I317-V359 HydrophobicContact CB-CB 4.45Å; I317-V359 HydrophobicContact CB-CG1 4.36Å; I317-V359 HydrophobicContact CB-CG2 4.16Å; I317-V359 HydrophobicContact CG1-CG2 4.09Å; I317-V359 HydrophobicContact CG2-CB 4.03Å; I317-V359 HydrophobicContact CG2-CG1 4.22Å; I317-V359 HydrophobicContact CG2-CG2 4.13Å; Q318-V359 HydrophobicContact CG-CG1 4.08Å; K356-V359 VanDerWaalsContact O-CB 3.23Å; K356-V359 WeakPolarHBondContact O-CB 3.43Å; K356-V359 WeakPolarHBondContact O-CG2 3.4Å; K356-V359 PolarHBondContact O-N 2.98Å; K356-V359 VanDerWaalsContact O-N 3.08Å; D357-V359 PolarHBondContact O-N 3.02Å; D357-V359 VanDerWaalsContact O-N 3.17Å; V359-Y361 PolarHBondContact O-N 3.3Å; V359-Y361 VanDerWaalsContact O-N 3.08Å
360	R	62.5	Low	64	Low	229 Å²	229	113.1 Å²	113.1	86%	0.864	58%	0.576	S	S	*	*	P	Polyproline II helix	trans	-50.1	119.4	170.7	-74.5	-174.4	175.2	178.2	-1	110	S358 G362	S358-R360 VanDerWaalsContact C-N 3.26Å; S358-R360 PolarHBondContact O-N 3.39Å; R360-G362 PolarHBondContact O-N 2.9Å
361	Y	53.4	Low	61.1	Low	144 Å²	144	115.8 Å²	115.8	57%	0.565	60%	0.599	S	S	*	*	P	Polyproline II helix	trans	-62.4	130.5	175.6	-72.2	-92	0	0	0	109.4	V359	V359-Y361 PolarHBondContact O-N 3.3Å; V359-Y361 VanDerWaalsContact O-N 3.08Å
362	G	40.3	Very low	58.3	Low	62 Å²	62	118.9 Å²	118.9	64%	0.639	60%	0.603	S	S	*	*	P	Polyproline II helix	trans	-75.5	133.7	-167.7	0	0	0	0	0	112.4	R360	R360-G362 PolarHBondContact O-N 2.9Å
363	R	45.6	Very low	55.5	Low	245 Å²	245	123.2 Å²	123.2	93%	0.925	63%	0.631	S	S	*	*			trans	33.5	91.8	165	-62.4	-178.8	-173.7	165.2	1	114.3
364	M	33	Very low	52.5	Low	179 Å²	179	124.4 Å²	124.4	88%	0.882	64%	0.643	S	S	*	*			trans	-46.8	128.5	162.8	-154	-177.3	-155.6	0	0	108.9	R366	M364-R366 PolarHBondContact O-N 3.15Å; M364-R366 VanDerWaalsContact O-N 3.11Å
365	P	45.1	Very low	49.7	Very low	116 Å²	116	135.6 Å²	135.6	75%	0.753	69%	0.685	S	S	*	*			trans	-54.7	122.9	171.3	-23.7	33.6	0	0	0	107.8	R367	P365-R367 PolarHBondContact O-N 3.3Å
366	R	37.5	Very low	47.1	Very low	224 Å²	224	141 Å²	141	85%	0.845	71%	0.711	S	S	*	*			trans	-59.9	115.2	171.2	-86.7	-173.2	170.7	-106.5	0.3	106	M364 T368	M364-R366 PolarHBondContact O-N 3.15Å; M364-R366 VanDerWaalsContact O-N 3.11Å; R366-T368 PolarHBondContact O-N 2.76Å; R366-T368 VanDerWaalsContact O-N 3.11Å
367	R	44.6	Very low	44.7	Very low	238 Å²	238	139.9 Å²	139.9	90%	0.898	72%	0.724	S	S	*	*			trans	-45.3	123.8	166.2	-80.8	-178.2	168.8	172.4	-4.5	106.8	P365 R369	P365-R367 PolarHBondContact O-N 3.3Å; R367-R369 PolarHBondContact O-N 3.06Å
368	T	38.8	Very low	42.5	Very low	136 Å²	136	139.3 Å²	139.3	83%	0.834	73%	0.729	S	S	*	*			trans	-54.3	108.2	177.2	-44	0	0	0	0	107.1	R366 G370	R366-T368 PolarHBondContact O-N 2.76Å; R366-T368 VanDerWaalsContact O-N 3.11Å; T368-G370 PolarHBondContact O-N 3.04Å; T368-G370 VanDerWaalsContact O-N 3.17Å
369	R	34	Very low	40.7	Very low	222 Å²	222	143 Å²	143	84%	0.838	74%	0.744	S	S	*	*	P	Polyproline II helix	trans	-62.8	117	158.6	-77.8	-176.2	171.2	-179.3	-6	103.8	R367 S371	R367-R369 PolarHBondContact O-N 3.06Å; R369-S371 PolarHBondContact O-N 2.73Å
370	G	38.2	Very low	39.5	Very low	66 Å²	66	150.6 Å²	150.6	68%	0.68	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-52.8	135.4	164.4	0	0	0	0	0	107.5	T368 D372	T368-G370 PolarHBondContact O-N 3.04Å; T368-G370 VanDerWaalsContact O-N 3.17Å; G370-D372 PolarHBondContact O-N 3.22Å
371	S	34	Very low	38.3	Very low	108 Å²	108	146.3 Å²	146.3	76%	0.755	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-50.6	138.8	168.2	-52.8	0	0	0	0	108.1	R369	R369-S371 PolarHBondContact O-N 2.73Å
372	D	39.1	Very low	37.6	Very low	150 Å²	150	147.2 Å²	147.2	80%	0.802	79%	0.785	S	S	*	*				-143.9	-173	74.8	-86.8	-36.4	0	0	0	115.5	G370	G370-D372 PolarHBondContact O-N 3.22Å
373	C	35.1	Very low	37.4	Very low	118 Å²	118	148.4 Å²	148.4	80%	0.797	78%	0.783	S	S	*	*			trans	-41.3	149.2	177.3	44.4	0	0	0	0	114
374	G	32	Very low	37	Very low	70 Å²	70	143.9 Å²	143.9	72%	0.722	77%	0.774	S	S	*	*				78.2	114.4	51.8	0	0	0	0	0	107.7
375	R	35.9	Very low	37.1	Very low	240 Å²	240	142.4 Å²	142.4	91%	0.906	77%	0.765	S	S	*	*				-169.1	168.3	80.4	-178	169.2	173.6	173.2	-4.5	111.1
376	D	36.3	Very low	36.7	Very low	147 Å²	147	144.4 Å²	144.4	79%	0.786	76%	0.764	S	S	*	*			trans	-60.9	161	175.9	-47.8	-93.7	0	0	0	114.7
377	G	33.6	Very low	36.6	Very low	63 Å²	63	140.3 Å²	140.3	65%	0.649	76%	0.759	S	S	*	*				79.1	115.9	121.1	0	0	0	0	0	119.1
378	S	33.8	Very low	36.2	Very low	105 Å²	105	133.4 Å²	133.4	73%	0.734	75%	0.747	S	S	*	*			trans	41.7	116.6	135.6	56.9	0	0	0	0	120
379	D	36.8	Very low	36.3	Very low	137 Å²	137	131.5 Å²	131.5	73%	0.733	74%	0.74	S	S	*	*			trans	80.1	129.1	142	-66.3	-57.5	0	0	0	121.5
380	Q	40.7	Very low	36.6	Very low	164 Å²	164	126.8 Å²	126.8	77%	0.766	74%	0.735	S	S	*	*			trans	71.7	100.4	142	-68.2	172.9	56.6	0	0	120.9
381	L	36.2	Very low	36.6	Very low	139 Å²	139	130.3 Å²	130.3	73%	0.728	74%	0.739	S	S	*	*				80.9	125	106.4	-170.2	64.2	0	0	0	119.5
382	M	38.9	Very low	36.7	Very low	163 Å²	163	129.9 Å²	129.9	80%	0.803	74%	0.736	S	S	*	*			trans	64	153.9	166.7	-63.8	-81.3	179.9	0	0	116.6
383	S	36.1	Very low	36.7	Very low	87 Å²	87	128.7 Å²	128.7	61%	0.608	73%	0.733	S	S	*	*			cis	-170	134.3	-31.8	52	0	0	0	0	109.7
384	M	37.5	Very low	36.5	Very low	150 Å²	150	133.5 Å²	133.5	74%	0.739	74%	0.735	S	S	*	*			trans	51	129.3	142.6	-74.2	167.9	59.2	0	0	123.2
385	Q	34.3	Very low	36.7	Very low	148 Å²	148	136.8 Å²	136.8	69%	0.692	74%	0.735	S	S	*	*			trans	92.3	147.4	130.5	-79.8	176.6	-27.2	0	0	123.2
386	H	37.8	Very low	36.3	Very low	157 Å²	157	132.1 Å²	132.1	73%	0.727	73%	0.728	S	S	*	*			trans	58.8	121	171	-64.9	-70.8	0	0	0	118.6
387	N	35.8	Very low	36.2	Very low	138 Å²	138	129.2 Å²	129.2	74%	0.738	72%	0.719	S	S	*	*			cis	97.6	146.9	28.5	-168.3	36.4	0	0	0	113.8
388	S	36.3	Very low	36.2	Very low	93 Å²	93	132 Å²	132	65%	0.65	72%	0.723	S	S	*	*			trans	71.5	140.9	174.3	-56.5	0	0	0	0	115.8
389	S	39.1	Very low	36.2	Very low	97 Å²	97	135.2 Å²	135.2	68%	0.678	73%	0.73	S	S	*	*			cis	-167	174.3	2.2	-100	0	0	0	0	112.2
390	T	40.2	Very low	36.1	Very low	122 Å²	122	132.2 Å²	132.2	75%	0.748	73%	0.732	S	S	*	*			trans	72.7	144.3	164.7	75.4	0	0	0	0	118.6
391	N	39	Very low	35.8	Very low	141 Å²	141	132.9 Å²	132.9	75%	0.754	74%	0.741	S	S	*	*			cis	-155.4	149	-18.5	-111.1	-11.8	0	0	0	112.8
392	S	37.3	Very low	35.6	Very low	99 Å²	99	129.9 Å²	129.9	69%	0.692	74%	0.743	S	S	*	*			trans	12	156.1	145.2	68.9	0	0	0	0	122.2
393	V	38	Very low	35.6	Very low	124 Å²	124	128.4 Å²	128.4	75%	0.752	75%	0.749	S	S	*	*			cis	-146	119.5	17.3	-179	0	0	0	0	106.6
394	R	31.9	Very low	35.6	Very low	220 Å²	220	127.9 Å²	127.9	83%	0.83	76%	0.757	S	S	*	*				62.1	127.9	87.7	-92.1	-171.4	-173	-156.1	4.3	118.5
395	I	35	Very low	35.7	Very low	139 Å²	139	129.3 Å²	129.3	71%	0.713	76%	0.762	S	S	*	*			trans	85.7	96.8	142.5	-65.1	170	0	0	0	119.4
396	D	28.6	Very low	35.9	Very low	142 Å²	142	127.7 Å²	127.7	76%	0.759	76%	0.762	S	S	*	*				83.5	145.4	116.4	-150.4	-6.6	0	0	0	122.5
397	S	33.3	Very low	36.1	Very low	86 Å²	86	125.4 Å²	125.4	60%	0.601	76%	0.764	S	S	*	*			trans	81.8	131.8	150.1	-80.1	0	0	0	0	123.8
398	T	34.7	Very low	36.1	Very low	120 Å²	120	122.3 Å²	122.3	74%	0.736	76%	0.757	S	S	*	*			trans	67.8	122.2	151	51.6	0	0	0	0	122.3
399	I	33.2	Very low	36.2	Very low	173 Å²	173	127.2 Å²	127.2	89%	0.887	77%	0.767	S	S	*	*			trans	53.1	110.1	131.4	-51.8	167.8	0	0	0	118
400	G	34.5	Very low	36.1	Very low	75 Å²	75	128.3 Å²	128.3	77%	0.773	76%	0.764	S	S	*	*			trans	-172.4	126.9	164.4	0	0	0	0	0	114.7
401	N	33.3	Very low	36.2	Very low	178 Å²	178	128 Å²	128	95%	0.952	76%	0.764	S	S	*	*			trans	-72.8	151.2	172.3	-68.7	-39.2	0	0	0	111.5
402	G	33.1	Very low	36.9	Very low	75 Å²	75	127 Å²	127	77%	0.773	77%	0.765	S	S	*	*			trans	-174.8	56.8	179.5	0	0	0	0	0	118.9
403	S	37.8	Very low	37	Very low	132 Å²	132	128.3 Å²	128.3	92%	0.923	77%	0.771	S	S	*	*			trans	12.1	125.1	152.9	-52.8	0	0	0	0	121.3
404	G	36.5	Very low	36.7	Very low	76 Å²	76	128 Å²	128	78%	0.784	78%	0.775	S	S	*	*			trans	-172.9	87.5	167.4	0	0	0	0	0	116.1
405	H	40.2	Very low	36.7	Very low	180 Å²	180	123 Å²	123	83%	0.833	77%	0.772	S	S	*	*			trans	23	131.7	130.6	-117.7	-132	0	0	0	118.4
406	V	38	Very low	36.6	Very low	114 Å²	114	122.8 Å²	122.8	69%	0.691	78%	0.778	S	S	*	*			cis	-159.7	169.9	14.8	-125.4	0	0	0	0	108.4
407	S	42.1	Very low	37.1	Very low	110 Å²	110	121.8 Å²	121.8	77%	0.769	78%	0.782	S	S	*	*			cis	-153.4	178.4	-0.2	-163.4	0	0	0	0	109.8
408	A	35.3	Very low	37.2	Very low	72 Å²	72	126.3 Å²	126.3	60%	0.595	79%	0.793	S	S	*	*			trans	-149.4	155.8	176.2	0	0	0	0	0	114
409	F	38.7	Very low	37.3	Very low	196 Å²	196	127.7 Å²	127.7	86%	0.86	80%	0.795	S	S	*	*			trans	-138.4	98.1	161.2	-100.3	-94.1	0	0	0	106.9
410	I	38	Very low	37.5	Very low	121 Å²	121	124.7 Å²	124.7	62%	0.621	79%	0.79	S	S	*	*				70.3	102.6	75	-60.3	163.6	0	0	0	112.1
411	P	42.3	Very low	37.5	Very low	115 Å²	115	124.7 Å²	124.7	75%	0.747	79%	0.79	S	S	*	*			trans	-80	142.1	150.7	33.8	-30.2	0	0	0	110
412	P	54.2	Low	37.8	Very low	119 Å²	119	123.9 Å²	123.9	77%	0.773	79%	0.785	S	S	*	*			trans	-78	145.9	-175.7	30.9	-35.2	0	0	0	113.2
413	P	38.2	Very low	38.1	Very low	127 Å²	127	125.4 Å²	125.4	83%	0.825	78%	0.784	S	S	*	*			trans	-83.5	176.9	172.3	35.9	-35.8	0	0	0	112.9
414	S	32	Very low	38	Very low	118 Å²	118	123.1 Å²	123.1	83%	0.825	77%	0.774	S	S	*	*			trans	-91	143.6	-172.5	53	0	0	0	0	115.2
415	C	31.3	Very low	38.1	Very low	115 Å²	115	125.6 Å²	125.6	78%	0.777	77%	0.773	S	S	*	*			trans	-152.3	130.6	156.8	45.8	0	0	0	0	114
416	T	33.2	Very low	38	Very low	135 Å²	135	124 Å²	124	83%	0.828	78%	0.776	S	S	*	*			trans	44.2	108.1	144.5	58.6	0	0	0	0	121.4
417	S	38.8	Very low	37.8	Very low	120 Å²	120	121.9 Å²	121.9	84%	0.839	78%	0.777	S	S	*	*				-162.4	144.8	109.3	46.6	0	0	0	0	113.8
418	E	35.5	Very low	37.4	Very low	182 Å²	182	121.5 Å²	121.5	85%	0.85	78%	0.781	S	S	*	*			trans	-20.6	151.8	167.2	-62.7	157.4	-170.5	0	0	117.9
419	L	37	Very low	37.5	Very low	148 Å²	148	122.7 Å²	122.7	78%	0.775	79%	0.79	S	S	*	*			cis	-163.5	152.6	39.4	-167.3	70.6	0	0	0	113.1
420	S	37.2	Very low	37.4	Very low	110 Å²	110	120 Å²	120	77%	0.769	79%	0.79	S	S	*	*			trans	51.7	123	157	59.8	0	0	0	0	121.7
421	G	35.2	Very low	37.4	Very low	75 Å²	75	119.1 Å²	119.1	77%	0.773	80%	0.8	S	S	*	*			trans	159.1	77.7	163.6	0	0	0	0	0	116.7
422	N	39.5	Very low	37	Very low	161 Å²	161	119.5 Å²	119.5	86%	0.861	80%	0.8	S	S	*	*			trans	-66.4	157.9	176.8	-46	-11.5	0	0	0	111.1
423	S	39.6	Very low	36.2	Very low	107 Å²	107	120.4 Å²	120.4	75%	0.748	80%	0.804	S	S	*	*			cis	-146	152.7	12.7	-103.7	0	0	0	0	109
424	A	36.1	Very low	36	Very low	85 Å²	85	119.7 Å²	119.7	70%	0.702	80%	0.797	S	S	*	*				59	141.1	79.4	0	0	0	0	0	113.9
425	V	38.5	Very low	36.2	Very low	127 Å²	127	119.1 Å²	119.1	77%	0.77	79%	0.789	S	S	*	*			cis	-154.3	140.7	25.7	-176.4	0	0	0	0	110.8
426	V	37.2	Very low	36.4	Very low	147 Å²	147	119.5 Å²	119.5	89%	0.891	79%	0.788	S	S	*	*			trans	46.4	141.1	157	175.2	0	0	0	0	119.6
427	G	35	Very low	36.6	Very low	69 Å²	69	118.1 Å²	118.1	71%	0.711	78%	0.78	S	S	*	*			cis	160.9	-178.6	-1.2	0	0	0	0	0	108.7
428	A	33.6	Very low	36.5	Very low	103 Å²	103	118.7 Å²	118.7	85%	0.851	77%	0.773	S	S	*	*			cis	163.9	82.6	-22.9	0	0	0	0	0	108.2
429	A	37.1	Very low	36.6	Very low	96 Å²	96	117.4 Å²	117.4	79%	0.793	77%	0.769	S	S	*	*			trans	-163.9	107.3	165.6	0	0	0	0	0	108
430	V	36.2	Very low	36.5	Very low	141 Å²	141	115.8 Å²	115.8	86%	0.855	77%	0.766	S	S	*	*				76.9	97	53.8	-176	0	0	0	0	113.3
431	A	37	Very low	36.6	Very low	101 Å²	101	117.4 Å²	117.4	84%	0.835	77%	0.771	S	S	*	*			trans	-157.3	95.9	155.3	0	0	0	0	0	108.8
432	T	33.5	Very low	36.5	Very low	123 Å²	123	116.7 Å²	116.7	76%	0.755	76%	0.763	S	S	*	*			trans	-124.8	107.9	-175.5	-58.1	0	0	0	0	110.7
433	T	38.7	Very low	36.4	Very low	139 Å²	139	121 Å²	121	85%	0.853	77%	0.768	S	S	*	*			trans	-145.8	102.7	166	-7.9	0	0	0	0	113.2
434	T	34.2	Very low	36	Very low	111 Å²	111	126.8 Å²	126.8	68%	0.681	78%	0.775	S	S	*	*			trans	-30.1	156.1	136.6	-4.7	0	0	0	0	112.5
435	T	36.7	Very low	36.1	Very low	107 Å²	107	126 Å²	126	66%	0.656	78%	0.775	S	S	*	*			cis	-171.1	150.1	34.9	-22.7	0	0	0	0	111.8
436	T	34.3	Very low	36.4	Very low	123 Å²	123	126.2 Å²	126.2	76%	0.755	78%	0.777	S	S	*	*			trans	58.2	156.9	147.8	45.7	0	0	0	0	120.4
437	T	38	Very low	36.2	Very low	106 Å²	106	124.6 Å²	124.6	65%	0.65	77%	0.77	S	S	*	*			cis	-157.7	157.2	6.4	-4.6	0	0	0	0	112.8
438	N	35.4	Very low	36.2	Very low	131 Å²	131	127 Å²	127	70%	0.701	78%	0.777	S	S	*	*			trans	74.3	161.8	145.7	-66.7	-16.8	0	0	0	122.9
439	M	37.8	Very low	36.9	Very low	155 Å²	155	131.9 Å²	131.9	76%	0.764	77%	0.773	S	S	*	*			trans	67.5	89	172.8	-50.5	-46	175.5	0	0	116.5
440	T	35.9	Very low	37.3	Very low	115 Å²	115	132.8 Å²	132.8	71%	0.706	77%	0.771	S	S	*	*				87.3	147.3	77.3	52.6	0	0	0	0	115.6
441	T	39.4	Very low	37.9	Very low	143 Å²	143	128.7 Å²	128.7	88%	0.877	76%	0.757	S	S	*	*			trans	64.4	138.3	169.3	43	0	0	0	0	119.8
442	G	32	Very low	38.8	Very low	60 Å²	60	126.7 Å²	126.7	62%	0.619	73%	0.732	S	S	*	*			trans	101.2	9.9	140.3	0	0	0	0	0	121.4	Y444	G442-Y444 WeakPolarHBondContact O-CD2 3.28Å; G442-Y444 PolarHBondContact O-N 3.17Å
443	R	37.5	Very low	40.8	Very low	251 Å²	251	124.8 Å²	124.8	95%	0.947	72%	0.718	S	S	*	*			trans	-87.3	89.2	177	-74.7	-166.5	177.5	-171.2	-0.4	114
444	Y	32.3	Very low	43	Very low	229 Å²	229	123.4 Å²	123.4	90%	0.898	70%	0.701	S	S	*	*			trans	-58.1	130.2	158.1	-57.7	-90.4	0	0	0	109.2	G442	G442-Y444 WeakPolarHBondContact O-CD2 3.28Å; G442-Y444 PolarHBondContact O-N 3.17Å
445	G	37.2	Very low	45.6	Very low	69 Å²	69	123.5 Å²	123.5	71%	0.711	70%	0.697	S	S	*	*			trans	-139	93.3	-156.1	0	0	0	0	0	116.3
446	V	45.5	Very low	48.2	Very low	132 Å²	132	119.3 Å²	119.3	80%	0.8	68%	0.675	S	S	*	*			trans	51	104.4	144	-170.2	0	0	0	0	118.2	S448	V446-S448 PolarHBondContact O-N 3.21Å
447	C	32.3	Very low	51.2	Low	112 Å²	112	114.1 Å²	114.1	76%	0.757	64%	0.643	S	S	*	*			trans	25.5	85.5	143.8	-53	0	0	0	0	118
448	S	36.6	Very low	53.9	Low	121 Å²	121	113.2 Å²	113.2	85%	0.846	63%	0.628	S	S	*	*			trans	-78.2	133.8	163.5	-77.7	0	0	0	0	111.4	V446	V446-S448 PolarHBondContact O-N 3.21Å
449	R	46.5	Very low	56.8	Low	204 Å²	204	112 Å²	112	77%	0.77	62%	0.618	S	S	*	*			trans	-64	148.3	178.9	-78.2	176	155.4	-165.3	-8.6	112.3	G451	R449-G451 PolarHBondContact O-N 2.98Å
450	P	46.2	Very low	59.6	Low	116 Å²	116	105 Å²	105	75%	0.753	58%	0.584	S	S	*	*	S	Bend	trans	-69.4	17.2	-167.4	-21.1	34.6	0	0	0	118
451	G	49.8	Very low	62.6	Low	55 Å²	55	99.9 Å²	99.9	57%	0.567	55%	0.552	S	S	*	*	S	Bend	trans	-105.5	17.4	-167.9	0	0	0	0	0	116.2	R449	R449-G451 PolarHBondContact O-N 2.98Å
452	N	54.1	Low	65.4	Low	58 Å²	58	98.2 Å²	98.2	31%	0.31	54%	0.537	S	S	.	.	S	Bend	trans	-157.9	12.8	-174.6	-104	-54.8	0	0	0	115.5	K356	K356-N452 HydrophobicContact CD-CB 4.33Å
453	D	76.1	Confident	68.5	Low	84 Å²	84	98 Å²	98	45%	0.449	52%	0.524	S	S	.	.			trans	-120.2	47.9	177.4	-166.9	22.4	0	0	0	112.8	L455 G456 L457	D453-L455 PolarHBondContact O-N 3.22Å; D453-G456 PolarHBondContact O-N 3.36Å; D453-G456 WeakPolarHBondContact OD1-CA 3.37Å; D453-G456 PolarHBondContact OD1-N 2.8Å; D453-L457 VanDerWaalsContact O-CG 3.29Å; D453-L457 WeakPolarHBondContact O-CG 3.49Å; D453-L457 PolarHBondContact O-N 2.95Å; D453-L457 VanDerWaalsContact O-N 3.11Å
454	H	84.5	Confident	71.4	Confident	109 Å²	109	86 Å²	86	51%	0.505	48%	0.479	S	S	.	.	H	α-helix	trans	-59.3	-30.6	173.5	-71.2	-70.3	0	0	0	112.2	Y458 M645	H454-Y458 HydrophobicContact CB-CD2 4.49Å; H454-Y458 HydrophobicContact CB-CE2 4.42Å; H454-Y458 WeakPolarHBondContact O-CB 3.41Å; H454-Y458 WeakPolarHBondContact O-CD2 3.43Å; H454-Y458 PolarHBondContact O-N 3Å; H454-M645 HydrophobicContact CB-SD 4.42Å; H454-M645 PolarHBondContact ND1-SD 3.3Å
455	L	89.3	Confident	74.5	Confident	113 Å²	113	76.1 Å²	76.1	59%	0.592	44%	0.443	S	S	*	.	H	α-helix	trans	-70.8	-49.1	179.6	-173.7	60.3	0	0	0	111.6	D453 L457 Y458 E459	D453-L455 PolarHBondContact O-N 3.22Å; L455-L457 VanDerWaalsContact C-N 3.26Å; L455-L457 PolarHBondContact O-N 2.89Å; L455-Y458 PolarHBondContact O-N 3.37Å; L455-Y458 VanDerWaalsContact O-N 3.08Å; L455-E459 WeakPolarHBondContact O-CG 3.31Å; L455-E459 PolarHBondContact O-N 3.34Å
456	G	92.3	Very high	77.4	Confident	19 Å²	19	79 Å²	79	20%	0.196	44%	0.438	C	S	.	.	H	α-helix	trans	-58.8	-38.3	174.2	0	0	0	0	0	112.5	D453 T460	D453-G456 PolarHBondContact O-N 3.36Å; D453-G456 WeakPolarHBondContact OD1-CA 3.37Å; D453-G456 PolarHBondContact OD1-N 2.8Å; G456-T460 VanDerWaalsContact O-CB 3.27Å; G456-T460 WeakPolarHBondContact O-CB 3.34Å; G456-T460 PolarHBondContact O-N 3.37Å; G456-T460 PolarHBondContact O-OG1 2.88Å
457	L	96	Very high	79.9	Confident	15 Å²	15	73 Å²	73	8%	0.079	40%	0.402	C	S	.	.	H	α-helix	trans	-65.5	-39.7	172.7	-66.4	172.2	0	0	0	112.7	D453 L455 T460 I461 A641 A642 M645	D453-L457 VanDerWaalsContact O-CG 3.29Å; D453-L457 WeakPolarHBondContact O-CG 3.49Å; D453-L457 PolarHBondContact O-N 2.95Å; D453-L457 VanDerWaalsContact O-N 3.11Å; L455-L457 VanDerWaalsContact C-N 3.26Å; L455-L457 PolarHBondContact O-N 2.89Å; L457-T460 WeakPolarHBondContact O-CB 3.43Å; L457-T460 PolarHBondContact O-N 3.27Å; L457-I461 VanDerWaalsContact O-CG1 3.26Å; L457-I461 WeakPolarHBondContact O-CG1 3.05Å; L457-I461 PolarHBondContact O-N 3.37Å; L457-A641 HydrophobicContact CD1-CB 4.39Å; L457-A641 HydrophobicContact CD2-CB 3.84Å; L457-A642 HydrophobicContact CD2-CB 4.01Å; L457-M645 HydrophobicContact CB-CE 3.53Å; L457-M645 HydrophobicContact CB-SD 4.16Å; L457-M645 HydrophobicContact CD1-SD 4.27Å
458	Y	95.7	Very high	83.1	Confident	86 Å²	86	67.6 Å²	67.6	34%	0.337	37%	0.366	S	S	.	.	H	α-helix	trans	-66.9	-44.1	175.8	-82.9	-57.6	0	0	0	112.7	H454 L455 T460 I461 L462 M645	H454-Y458 HydrophobicContact CB-CD2 4.49Å; H454-Y458 HydrophobicContact CB-CE2 4.42Å; H454-Y458 WeakPolarHBondContact O-CB 3.41Å; H454-Y458 WeakPolarHBondContact O-CD2 3.43Å; H454-Y458 PolarHBondContact O-N 3Å; L455-Y458 PolarHBondContact O-N 3.37Å; L455-Y458 VanDerWaalsContact O-N 3.08Å; Y458-T460 VanDerWaalsContact C-N 3.25Å; Y458-T460 PolarHBondContact O-N 3.35Å; Y458-I461 HydrophobicContact CD1-CD1 4.36Å; Y458-I461 PolarHBondContact O-N 3.5Å; Y458-L462 WeakPolarHBondContact O-CG 3.47Å; Y458-L462 PolarHBondContact O-N 2.91Å; Y458-M645 HydrophobicContact CD1-CE 3.62Å; Y458-M645 HydrophobicContact CD2-CE 3.89Å; Y458-M645 HydrophobicContact CE1-CE 3.65Å; Y458-M645 HydrophobicContact CE2-CE 3.91Å; Y458-M645 HydrophobicContact CE2-SD 4.24Å; Y458-M645 HydrophobicContact CG-CE 3.73Å
459	E	95.9	Very high	86	Confident	106 Å²	106	64.8 Å²	64.8	50%	0.495	34%	0.339	S	S	.	.	H	α-helix	trans	-60.9	-36.8	173.7	-64.8	-59.1	144.9	0	0	111.4	L455 L462 T463	L455-E459 WeakPolarHBondContact O-CG 3.31Å; L455-E459 PolarHBondContact O-N 3.34Å; E459-L462 PolarHBondContact O-N 3.38Å; E459-T463 VanDerWaalsContact O-CB 3.31Å; E459-T463 WeakPolarHBondContact O-CB 3.42Å; E459-T463 PolarHBondContact O-N 3.23Å; E459-T463 PolarHBondContact O-OG1 3Å
460	T	97.2	Very high	88.4	Confident	9 Å²	9	59.7 Å²	59.7	6%	0.055	33%	0.327	C	S	.	.	H	α-helix	trans	-64.3	-46.4	175.1	-61.9	0	0	0	0	111.7	G456 L457 Y458 T463 I464 P531 H638 A642	G456-T460 VanDerWaalsContact O-CB 3.27Å; G456-T460 WeakPolarHBondContact O-CB 3.34Å; G456-T460 PolarHBondContact O-N 3.37Å; G456-T460 PolarHBondContact O-OG1 2.88Å; L457-T460 WeakPolarHBondContact O-CB 3.43Å; L457-T460 PolarHBondContact O-N 3.27Å; Y458-T460 VanDerWaalsContact C-N 3.25Å; Y458-T460 PolarHBondContact O-N 3.35Å; T460-T463 PolarHBondContact O-N 3.11Å; T460-I464 HydrophobicContact CG2-CD1 3.69Å; T460-I464 WeakPolarHBondContact O-CB 3.4Å; T460-I464 WeakPolarHBondContact O-CG1 3.47Å; T460-I464 PolarHBondContact O-N 3.25Å; T460-P531 HydrophobicContact CG2-CG 4.23Å; T460-H638 PolarHBondContact OG1-NE2 3.13Å; T460-A642 HydrophobicContact CG2-CB 4.01Å
461	I	98.1	Very high	90.8	Very high	7 Å²	7	56.3 Å²	56.3	4%	0.036	30%	0.301	C	S	.	.	H	α-helix	trans	-59.4	-47.5	174.8	-68.5	164.6	0	0	0	111	L457 Y458 S465 T608 L612 A642 M645 Q646	L457-I461 VanDerWaalsContact O-CG1 3.26Å; L457-I461 WeakPolarHBondContact O-CG1 3.05Å; L457-I461 PolarHBondContact O-N 3.37Å; Y458-I461 HydrophobicContact CD1-CD1 4.36Å; Y458-I461 PolarHBondContact O-N 3.5Å; I461-S465 WeakPolarHBondContact O-CB 3.23Å; I461-S465 PolarHBondContact O-N 2.87Å; I461-T608 HydrophobicContact CG2-CG2 3.68Å; I461-L612 HydrophobicContact CG1-CD1 4.02Å; I461-L612 HydrophobicContact CG1-CD2 4.34Å; I461-L612 HydrophobicContact CG2-CD1 4.31Å; I461-A642 HydrophobicContact CG1-CB 3.96Å; I461-M645 HydrophobicContact CD1-CE 3.53Å; I461-Q646 HydrophobicContact CD1-CB 4.13Å
462	L	97.5	Very high	93	Very high	108 Å²	108	53.8 Å²	53.8	57%	0.565	28%	0.275	S	S	*	.	H	α-helix	trans	-64	-45.8	-179.1	-70.1	172.5	0	0	0	111.7	Y458 E459 S465 Q466	Y458-L462 WeakPolarHBondContact O-CG 3.47Å; Y458-L462 PolarHBondContact O-N 2.91Å; E459-L462 PolarHBondContact O-N 3.38Å; L462-S465 PolarHBondContact O-N 3.13Å; L462-Q466 WeakPolarHBondContact O-CB 3.3Å; L462-Q466 PolarHBondContact O-N 2.89Å
463	T	98	Very high	95	Very high	54 Å²	54	51.9 Å²	51.9	33%	0.331	27%	0.265	S	S	.	.	H	α-helix	trans	-62	-48.1	179	-56.8	0	0	0	0	111.5	E459 T460 Q466 A467 P531	E459-T463 VanDerWaalsContact O-CB 3.31Å; E459-T463 WeakPolarHBondContact O-CB 3.42Å; E459-T463 PolarHBondContact O-N 3.23Å; E459-T463 PolarHBondContact O-OG1 3Å; T460-T463 PolarHBondContact O-N 3.11Å; T463-Q466 PolarHBondContact O-N 3.16Å; T463-A467 WeakPolarHBondContact O-CB 3.44Å; T463-A467 PolarHBondContact O-N 3.07Å; T463-P531 HydrophobicContact CG2-CG 4.05Å
464	I	98.5	Very high	95.9	Very high	0 Å²	0	48 Å²	48	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-66.2	-40.4	179.6	-69.8	170	0	0	0	111.1	T460 A467 Y468 F526 P531 A611 L612 A615	T460-I464 HydrophobicContact CG2-CD1 3.69Å; T460-I464 WeakPolarHBondContact O-CB 3.4Å; T460-I464 WeakPolarHBondContact O-CG1 3.47Å; T460-I464 PolarHBondContact O-N 3.25Å; I464-A467 PolarHBondContact O-N 3.42Å; I464-Y468 WeakPolarHBondContact O-CB 3.29Å; I464-Y468 PolarHBondContact O-N 2.9Å; I464-F526 HydrophobicContact CG2-CE2 4.49Å; I464-F526 HydrophobicContact CG2-CZ 4.24Å; I464-P531 HydrophobicContact CG1-CG 4.44Å; I464-A611 HydrophobicContact CG2-CB 3.79Å; I464-A611 WeakPolarHBondContact CG2-O 3.34Å; I464-L612 HydrophobicContact CB-CD2 4.31Å; I464-L612 HydrophobicContact CD1-CD2 3.89Å; I464-L612 HydrophobicContact CG2-CD2 4.11Å; I464-L612 HydrophobicContact CG2-CG 4.3Å; I464-A615 HydrophobicContact CD1-CB 3.85Å; I464-A615 HydrophobicContact CG1-CB 4.46Å; I464-A615 HydrophobicContact CG2-CB 4.14Å
465	S	98.1	Very high	96.5	Very high	22 Å²	22	42.8 Å²	42.8	15%	0.154	22%	0.22	C	C	.	.	H	α-helix	trans	-63.5	-45.7	175.8	-171.1	0	0	0	0	112.1	I461 L462 Y468 Q469 T608	I461-S465 WeakPolarHBondContact O-CB 3.23Å; I461-S465 PolarHBondContact O-N 2.87Å; L462-S465 PolarHBondContact O-N 3.13Å; S465-Y468 PolarHBondContact O-N 3.49Å; S465-Q469 WeakPolarHBondContact O-CG 3.49Å; S465-Q469 PolarHBondContact O-N 2.93Å; S465-T608 PolarHBondContact OG-OG1 2.8Å
466	Q	97.9	Very high	96.8	Very high	130 Å²	130	40 Å²	40	61%	0.607	21%	0.206	S	C	*	.	H	α-helix	trans	-64.8	-41.3	177.3	-170.3	-179.5	20.3	0	0	111.9	L462 T463 Y468 Q469 N470	L462-Q466 WeakPolarHBondContact O-CB 3.3Å; L462-Q466 PolarHBondContact O-N 2.89Å; T463-Q466 PolarHBondContact O-N 3.16Å; Q466-Y468 VanDerWaalsContact C-N 3.32Å; Q466-Y468 PolarHBondContact O-N 2.86Å; Q466-Q469 PolarHBondContact O-N 3.43Å; Q466-N470 VanDerWaalsContact O-CG 3.23Å; Q466-N470 PolarHBondContact O-N 3.42Å; Q466-N470 PolarHBondContact O-ND2 3.17Å
467	A	98.2	Very high	96.9	Very high	4 Å²	4	46 Å²	46	3%	0.033	23%	0.229	C	C	.	.	H	α-helix	trans	-59.1	-43.4	173.9	0	0	0	0	0	111.8	T463 I464 N470 F471 F526 R529	T463-A467 WeakPolarHBondContact O-CB 3.44Å; T463-A467 PolarHBondContact O-N 3.07Å; I464-A467 PolarHBondContact O-N 3.42Å; A467-N470 PolarHBondContact O-N 3.48Å; A467-F471 WeakPolarHBondContact O-CD2 3.02Å; A467-F471 PolarHBondContact O-N 3.11Å; A467-F526 HydrophobicContact CB-CD2 3.86Å; A467-F526 HydrophobicContact CB-CE2 3.98Å; A467-R529 HydrophobicContact CB-CB 3.54Å; A467-R529 HydrophobicContact CB-CG 4.18Å
468	Y	98.3	Very high	96.9	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-64.9	-45.7	177.7	-172.2	-95	0	0	0	112.1	I464 S465 Q466 N470 F471 S472 Y474 T475 F526 Q556 D607 V610 A611	I464-Y468 WeakPolarHBondContact O-CB 3.29Å; I464-Y468 PolarHBondContact O-N 2.9Å; S465-Y468 PolarHBondContact O-N 3.49Å; Q466-Y468 VanDerWaalsContact C-N 3.32Å; Q466-Y468 PolarHBondContact O-N 2.86Å; Y468-N470 VanDerWaalsContact C-N 3.28Å; Y468-N470 PolarHBondContact O-N 3.3Å; Y468-F471 PolarHBondContact O-N 3.46Å; Y468-S472 VanDerWaalsContact O-CB 3.28Å; Y468-S472 WeakPolarHBondContact O-CB 3.34Å; Y468-S472 PolarHBondContact O-N 3.5Å; Y468-S472 PolarHBondContact OH-OG 3.27Å; Y468-Y474 PolarHBondContact OH-O 3.48Å; Y468-T475 HydrophobicContact CD1-CG2 3.93Å; Y468-T475 HydrophobicContact CE1-CG2 3.8Å; Y468-F526 HydrophobicContact CD2-CE2 4.26Å; Y468-F526 HydrophobicContact CD2-CZ 4.49Å; Y468-Q556 HydrophobicContact CE2-CG 3.9Å; Y468-D607 HydrophobicContact CD1-CB 4.23Å; Y468-D607 HydrophobicContact CE1-CB 4.17Å; Y468-V610 HydrophobicContact CE2-CG1 4.12Å; Y468-V610 WeakPolarHBondContact OH-CG1 3.19Å; Y468-A611 HydrophobicContact CD1-CB 4.23Å; Y468-A611 HydrophobicContact CD2-CB 3.78Å; Y468-A611 HydrophobicContact CG-CB 3.55Å
469	Q	97.4	Very high	96.9	Very high	62 Å²	62	46.3 Å²	46.3	29%	0.29	23%	0.233	S	C	.	.	H	α-helix	trans	-61	-37.5	177.4	-70.2	-62.5	-4.2	0	0	112.6	S465 Q466 T475 K478 D607	S465-Q469 WeakPolarHBondContact O-CG 3.49Å; S465-Q469 PolarHBondContact O-N 2.93Å; Q466-Q469 PolarHBondContact O-N 3.43Å; Q469-T475 VanDerWaalsContact OE1-CB 3.24Å; Q469-T475 VanDerWaalsContact OE1-CG2 3.25Å; Q469-T475 PolarHBondContact OE1-OG1 2.91Å; Q469-K478 WeakPolarHBondContact O-CE 3.19Å; Q469-K478 PolarHBondContact O-NZ 2.78Å; Q469-D607 PolarHBondContact NE2-OD2 3.27Å
470	N	96.8	Very high	96.8	Very high	97 Å²	97	48.5 Å²	48.5	52%	0.519	24%	0.24	S	C	.	.	H	α-helix	trans	-66.8	-57.5	174.6	-68.3	-21.3	0	0	0	111.4	Q466 A467 Y468 K478	Q466-N470 VanDerWaalsContact O-CG 3.23Å; Q466-N470 PolarHBondContact O-N 3.42Å; Q466-N470 PolarHBondContact O-ND2 3.17Å; A467-N470 PolarHBondContact O-N 3.48Å; Y468-N470 VanDerWaalsContact C-N 3.28Å; Y468-N470 PolarHBondContact O-N 3.3Å; N470-K478 PolarHBondContact O-NZ 3.11Å
471	F	96.8	Very high	96.7	Very high	44 Å²	44	53.5 Å²	53.5	19%	0.193	27%	0.271	C	S	.	.	H	α-helix	trans	-100.3	-24.8	-162.4	-63	-69.8	0	0	0	115.9	A467 Y468 H522 E525 F526 R529	A467-F471 WeakPolarHBondContact O-CD2 3.02Å; A467-F471 PolarHBondContact O-N 3.11Å; Y468-F471 PolarHBondContact O-N 3.46Å; F471-H522 WeakPolarHBondContact O-CB 3.43Å; F471-H522 PolarHBondContact O-CD2 3.23Å; F471-E525 HydrophobicContact CD1-CB 3.49Å; F471-E525 VanDerWaalsContact CD1-CB 3.49Å; F471-E525 HydrophobicContact CD1-CG 4.35Å; F471-E525 HydrophobicContact CD2-CB 4.46Å; F471-E525 HydrophobicContact CE1-CB 3.69Å; F471-E525 HydrophobicContact CE1-CG 4.21Å; F471-E525 HydrophobicContact CG-CB 3.92Å; F471-E525 HydrophobicContact CZ-CB 4.27Å; F471-F526 HydrophobicContact CB-CB 4.22Å; F471-R529 HydrophobicContact CD2-CG 4.24Å; F471-R529 HydrophobicContact CE2-CG 3.79Å
472	S	96.8	Very high	96.5	Very high	3 Å²	3	54.9 Å²	54.9	2%	0.021	28%	0.278	C	S	.	.			trans	-74.3	135.1	175.2	-176.3	0	0	0	0	110.8	Y468 Y474 T475 K478 Q556	Y468-S472 VanDerWaalsContact O-CB 3.28Å; Y468-S472 WeakPolarHBondContact O-CB 3.34Å; Y468-S472 PolarHBondContact O-N 3.5Å; Y468-S472 PolarHBondContact OH-OG 3.27Å; S472-Y474 VanDerWaalsContact C-N 3.32Å; S472-Y474 PolarHBondContact OG-N 3.01Å; S472-Y474 VanDerWaalsContact OG-N 3.12Å; S472-T475 WeakPolarHBondContact O-CG2 3.4Å; S472-K478 VanDerWaalsContact O-CD 3.29Å; S472-K478 WeakPolarHBondContact O-CD 3.17Å; S472-K478 PolarHBondContact O-NZ 2.96Å; S472-Q556 PolarHBondContact OG-OE1 3.27Å
473	P	94.9	Very high	96.3	Very high	17 Å²	17	60.5 Å²	60.5	11%	0.11	29%	0.291	C	S	.	.	S	Bend	trans	-81.4	-10.1	168.8	30.4	-30	0	0	0	113.2	K478 A571	P473-K478 WeakPolarHBondContact O-CB 3.41Å; P473-A571 HydrophobicContact CB-CB 3.71Å; P473-A571 HydrophobicContact CG-CB 3.44Å; P473-A571 VanDerWaalsContact CG-CB 3.44Å
474	Y	96.6	Very high	96.1	Very high	2 Å²	2	61.2 Å²	61.2	1%	0.008	30%	0.298	C	S	.	.			trans	-104	39.2	-175.2	-55.5	-85.9	0	0	0	112.8	Y468 S472 Q556 A557 R559 L560 A571	Y468-Y474 PolarHBondContact OH-O 3.48Å; S472-Y474 VanDerWaalsContact C-N 3.32Å; S472-Y474 PolarHBondContact OG-N 3.01Å; S472-Y474 VanDerWaalsContact OG-N 3.12Å; Y474-Q556 WeakPolarHBondContact CB-O 3.32Å; Y474-Q556 HydrophobicContact CD2-CB 3.53Å; Y474-Q556 HydrophobicContact CE2-CB 4.21Å; Y474-Q556 HydrophobicContact CG-CB 4.05Å; Y474-A557 HydrophobicContact CE1-CB 4.07Å; Y474-A557 HydrophobicContact CE2-CB 4.37Å; Y474-R559 PolarHBondContact O-NH1 3.31Å; Y474-L560 HydrophobicContact CD1-CD1 3.84Å; Y474-L560 HydrophobicContact CD1-CG 4.34Å; Y474-L560 HydrophobicContact CE1-CD1 4.01Å; Y474-A571 HydrophobicContact CE2-CB 4.33Å; Y474-A571 PolarHBondContact OH-N 3.02Å; Y474-A571 VanDerWaalsContact OH-N 3.12Å
475	T	97.1	Very high	96	Very high	0 Å²	0	67.2 Å²	67.2	0%	0	32%	0.321	C	S	.	.	S	Bend	trans	-83.2	158	172.9	73.8	0	0	0	0	110.7	Y468 Q469 S472 E477 K478 I479 D607	Y468-T475 HydrophobicContact CD1-CG2 3.93Å; Y468-T475 HydrophobicContact CE1-CG2 3.8Å; Q469-T475 VanDerWaalsContact OE1-CB 3.24Å; Q469-T475 VanDerWaalsContact OE1-CG2 3.25Å; Q469-T475 PolarHBondContact OE1-OG1 2.91Å; S472-T475 WeakPolarHBondContact O-CG2 3.4Å; T475-E477 PolarHBondContact O-N 3.06Å; T475-E477 VanDerWaalsContact O-N 3.15Å; T475-K478 HydrophobicContact CG2-CD 4.31Å; T475-K478 PolarHBondContact O-N 2.67Å; T475-K478 WeakPolarHBondContact OG1-CG 3.32Å; T475-K478 PolarHBondContact OG1-N 3.14Å; T475-I479 WeakPolarHBondContact O-CB 3.39Å; T475-I479 VanDerWaalsContact O-CG1 3.3Å; T475-I479 WeakPolarHBondContact O-CG1 3.44Å; T475-I479 PolarHBondContact O-N 3.16Å; T475-D607 WeakPolarHBondContact CA-OD1 3.22Å
476	D	95.5	Very high	95.8	Very high	54 Å²	54	71.3 Å²	71.3	29%	0.289	35%	0.346	S	S	.	.	H	α-helix	trans	-55	-34	-179.6	-107.9	-78.6	0	0	0	113.4	K480 R559 D607	D476-K480 WeakPolarHBondContact O-CD 3.38Å; D476-K480 VanDerWaalsContact O-CE 3.24Å; D476-K480 WeakPolarHBondContact O-CE 3.25Å; D476-K480 WeakPolarHBondContact O-CG 3.37Å; D476-K480 PolarHBondContact O-NZ 2.72Å; D476-K480 IonicContact OD1-NZ 2.76Å; D476-K480 PolarHBondContact OD1-NZ 3.06Å; D476-R559 IonicContact OD1-NH2 2.71Å; D476-R559 IonicContact OD2-CZ 3.73Å; D476-R559 IonicContact OD2-NH1 3.39Å; D476-R559 IonicContact OD2-NH2 3.76Å; D476-R559 PolarHBondContact OD2-NH2 3.44Å; D476-D607 WeakPolarHBondContact CB-OD2 3.44Å; D476-D607 PolarHBondContact N-OD1 2.96Å; D476-D607 VanDerWaalsContact N-OD1 3.09Å; D476-D607 PolarHBondContact N-OD2 3.13Å
477	E	94.5	Very high	95.6	Very high	146 Å²	146	67 Å²	67	68%	0.682	33%	0.327	S	S	*	.	H	α-helix	trans	-76.9	-47.8	179.2	-175	172.7	-162.4	0	0	111.7	T475 I479 K480	T475-E477 PolarHBondContact O-N 3.06Å; T475-E477 VanDerWaalsContact O-N 3.15Å; E477-I479 VanDerWaalsContact C-N 3.35Å; E477-I479 PolarHBondContact O-N 3Å; E477-K480 PolarHBondContact O-N 2.81Å
478	K	95	Very high	95.3	Very high	70 Å²	70	70.7 Å²	70.7	30%	0.304	35%	0.349	S	S	.	.	H	α-helix	trans	-67.2	-36.2	-178.5	-65.7	172.5	-165.3	174	0	111.8	Q469 N470 S472 P473 T475 V481 M482	Q469-K478 WeakPolarHBondContact O-CE 3.19Å; Q469-K478 PolarHBondContact O-NZ 2.78Å; N470-K478 PolarHBondContact O-NZ 3.11Å; S472-K478 VanDerWaalsContact O-CD 3.29Å; S472-K478 WeakPolarHBondContact O-CD 3.17Å; S472-K478 PolarHBondContact O-NZ 2.96Å; P473-K478 WeakPolarHBondContact O-CB 3.41Å; T475-K478 HydrophobicContact CG2-CD 4.31Å; T475-K478 PolarHBondContact O-N 2.67Å; T475-K478 WeakPolarHBondContact OG1-CG 3.32Å; T475-K478 PolarHBondContact OG1-N 3.14Å; K478-V481 WeakPolarHBondContact O-CG2 2.86Å; K478-V481 PolarHBondContact O-N 2.81Å; K478-M482 PolarHBondContact O-N 3.33Å
479	I	95.5	Very high	95	Very high	37 Å²	37	70.8 Å²	70.8	19%	0.19	35%	0.35	C	S	.	.	H	α-helix	trans	-59.9	-46.4	173.4	-75.8	171	0	0	0	111.4	T475 E477 V481 M482 R559 L560	T475-I479 WeakPolarHBondContact O-CB 3.39Å; T475-I479 VanDerWaalsContact O-CG1 3.3Å; T475-I479 WeakPolarHBondContact O-CG1 3.44Å; T475-I479 PolarHBondContact O-N 3.16Å; E477-I479 VanDerWaalsContact C-N 3.35Å; E477-I479 PolarHBondContact O-N 3Å; I479-V481 PolarHBondContact O-N 3.08Å; I479-V481 VanDerWaalsContact O-N 3.17Å; I479-M482 WeakPolarHBondContact O-CB 3.48Å; I479-M482 PolarHBondContact O-N 2.73Å; I479-R559 HydrophobicContact CD1-CB 4.07Å; I479-L560 HydrophobicContact CD1-CD2 4.28Å; I479-L560 HydrophobicContact CD1-CG 4.37Å; I479-L560 HydrophobicContact CG1-CD1 4.24Å; I479-L560 HydrophobicContact CG1-CD2 4.13Å; I479-L560 HydrophobicContact CG1-CG 4.33Å; I479-L560 HydrophobicContact CG2-CD2 3.82Å
480	K	94.5	Very high	94.4	Very high	152 Å²	152	69.3 Å²	69.3	66%	0.661	35%	0.347	S	S	*	.	H	α-helix	trans	-64.7	-21.6	-175.6	-74.5	164.1	-165.6	139.2	0	114.1	D476 E477	D476-K480 WeakPolarHBondContact O-CD 3.38Å; D476-K480 VanDerWaalsContact O-CE 3.24Å; D476-K480 WeakPolarHBondContact O-CE 3.25Å; D476-K480 WeakPolarHBondContact O-CG 3.37Å; D476-K480 PolarHBondContact O-NZ 2.72Å; D476-K480 IonicContact OD1-NZ 2.76Å; D476-K480 PolarHBondContact OD1-NZ 3.06Å; E477-K480 PolarHBondContact O-N 2.81Å
481	V	94.4	Very high	93	Very high	115 Å²	115	70.6 Å²	70.6	70%	0.697	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.1	-0.3	176.5	-59.3	0	0	0	0	113.5	K478 I479 R483	K478-V481 WeakPolarHBondContact O-CG2 2.86Å; K478-V481 PolarHBondContact O-N 2.81Å; I479-V481 PolarHBondContact O-N 3.08Å; I479-V481 VanDerWaalsContact O-N 3.17Å; V481-R483 PolarHBondContact O-N 3.09Å
482	M	93.9	Very high	91.3	Very high	36 Å²	36	72 Å²	72	18%	0.177	37%	0.365	C	S	.	.			trans	-71.8	120.4	-176	-171.5	179.7	-70.5	0	0	111.7	K478 I479 C484 L560 T569	K478-M482 PolarHBondContact O-N 3.33Å; I479-M482 WeakPolarHBondContact O-CB 3.48Å; I479-M482 PolarHBondContact O-N 2.73Å; M482-C484 PolarHBondContact O-N 3.19Å; M482-L560 HydrophobicContact CE-CD1 3.88Å; M482-L560 HydrophobicContact SD-CD1 3.52Å; M482-L560 VanDerWaalsContact SD-CD1 3.52Å; M482-T569 HydrophobicContact SD-CG2 3.94Å
483	R	94	Very high	89.2	Confident	225 Å²	225	78 Å²	78	85%	0.849	40%	0.402	S	S	*	.			trans	-86	97.8	175.3	-66.1	-176.9	-176.3	167	1.8	110.3	V481	V481-R483 PolarHBondContact O-N 3.09Å
484	C	94.3	Very high	87.1	Confident	70 Å²	70	89.3 Å²	89.3	47%	0.473	44%	0.443	S	S	.	.			trans	-62.5	135.2	175.2	-65.8	0	0	0	0	111.3	M482 G573 Q575	M482-C484 PolarHBondContact O-N 3.19Å; C484-G573 CarbonylContact C-O 3.53Å; C484-G573 VanDerWaalsContact CA-O 3.3Å; C484-G573 WeakPolarHBondContact CA-O 3.19Å; C484-Q575 HydrophobicContact CB-CG 4.32Å
485	R	95.3	Very high	85.1	Confident	126 Å²	126	96 Å²	96	48%	0.475	47%	0.474	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	131.3	173.7	64.2	-173.1	-179.7	117.5	-16.4	110.6	D572 G573 K574 Q575	R485-D572 IonicContact NH2-OD2 2.72Å; R485-G573 PolarHBondContact N-O 3.4Å; R485-K574 HydrophobicContact CG-CG 4.48Å; R485-K574 CarbonylContact O-C 3.51Å; R485-K574 WeakPolarHBondContact O-CA 3.43Å; R485-Q575 PolarHBondContact O-N 2.91Å
486	P	93.7	Very high	83.4	Confident	107 Å²	107	101.6 Å²	101.6	70%	0.695	50%	0.498	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64	145.7	170.8	29	-34.2	0	0	0	110.4
487	I	94.1	Very high	81.8	Confident	41 Å²	41	106 Å²	106	21%	0.21	51%	0.511	C	S	.	.			trans	-124.8	176.9	161.8	57.3	156.5	0	0	0	108.7	L489 L515 K574 Q575 I576	I487-L489 HydrophobicContact CD1-CD2 3.93Å; I487-L515 HydrophobicContact CD1-CD1 3.53Å; I487-K574 HydrophobicContact CD1-CB 4.13Å; I487-K574 HydrophobicContact CD1-CD 4.14Å; I487-K574 HydrophobicContact CD1-CG 4.45Å; I487-K574 HydrophobicContact CG1-CB 4.14Å; I487-K574 HydrophobicContact CG2-CB 4.07Å; I487-K574 HydrophobicContact CG2-CD 4.13Å; I487-K574 HydrophobicContact CG2-CG 3.7Å; I487-Q575 WeakPolarHBondContact CG1-O 3.4Å; I487-Q575 PolarHBondContact N-O 3.42Å; I487-I576 HydrophobicContact CD1-CD1 4.31Å; I487-I576 HydrophobicContact CD1-CG1 3.73Å; I487-I576 HydrophobicContact CG1-CG1 3.97Å
488	T	92.4	Very high	80.5	Confident	80 Å²	80	103.8 Å²	103.8	49%	0.491	51%	0.51	S	S	.	.			trans	-124.4	152.4	153.5	-176.7	0	0	0	0	109.6	S490 E580	T488-S490 VanDerWaalsContact C-N 3.35Å; T488-S490 WeakPolarHBondContact CG2-O 3.47Å; T488-S490 PolarHBondContact OG1-N 3.34Å; T488-S490 VanDerWaalsContact OG1-N 3.08Å; T488-E580 WeakPolarHBondContact CA-OE1 3.42Å; T488-E580 VanDerWaalsContact CB-OE1 3.29Å; T488-E580 WeakPolarHBondContact CB-OE1 3.47Å; T488-E580 PolarHBondContact OG1-OE1 3.09Å
489	L	91.9	Very high	79.2	Confident	3 Å²	3	109.1 Å²	109.1	2%	0.016	54%	0.536	C	S	.	.	S	Bend	trans	-88	-6.9	168.7	-56.3	177.5	0	0	0	112	I487 M508 E511 L512 L515 I576 E580 I584	I487-L489 HydrophobicContact CD1-CD2 3.93Å; L489-M508 HydrophobicContact CB-CB 4.13Å; L489-M508 HydrophobicContact CB-CE 4.02Å; L489-M508 HydrophobicContact CB-CG 4.17Å; L489-M508 WeakPolarHBondContact O-CG 3.26Å; L489-E511 HydrophobicContact CD2-CB 3.98Å; L489-L512 HydrophobicContact CD1-CB 4.26Å; L489-L515 HydrophobicContact CD2-CD1 3.7Å; L489-I576 HydrophobicContact CD1-CD1 4.21Å; L489-I576 HydrophobicContact CD1-CG1 4.5Å; L489-I576 HydrophobicContact CD1-CG2 3.84Å; L489-I576 HydrophobicContact CD2-CD1 4.15Å; L489-I576 HydrophobicContact CD2-CG1 4.37Å; L489-I576 HydrophobicContact CG-CD1 4.46Å; L489-I576 HydrophobicContact CG-CG1 4.42Å; L489-I576 HydrophobicContact CG-CG2 4.23Å; L489-E580 HydrophobicContact CD1-CB 4.48Å; L489-E580 PolarHBondContact N-OE1 2.68Å; L489-I584 HydrophobicContact CD1-CD1 3.56Å
490	S	84	Confident	78.5	Confident	31 Å²	31	113.3 Å²	113.3	22%	0.217	55%	0.552	C	S	.	*			trans	-102.1	111.2	-178.5	-177.2	0	0	0	0	112.1	T488 V492 H504	T488-S490 VanDerWaalsContact C-N 3.35Å; T488-S490 WeakPolarHBondContact CG2-O 3.47Å; T488-S490 PolarHBondContact OG1-N 3.34Å; T488-S490 VanDerWaalsContact OG1-N 3.08Å; S490-V492 VanDerWaalsContact C-N 3.28Å; S490-V492 PolarHBondContact OG-N 2.95Å; S490-H504 PolarHBondContact OG-CE1 3.21Å; S490-H504 PolarHBondContact OG-NE2 2.91Å
491	N	68.3	Low	78.2	Confident	124 Å²	124	108.3 Å²	108.3	66%	0.663	53%	0.534	S	S	*	.			trans	-85.4	6.1	170.3	-65.8	-38.6	0	0	0	112.9	E511	N491-E511 PolarHBondContact ND2-OE1 3Å
492	V	61.3	Low	78.1	Confident	73 Å²	73	105.9 Å²	105.9	44%	0.442	52%	0.518	S	S	.	.			trans	-95.4	105.4	-169.8	-179.9	0	0	0	0	111.8	S490 R494 H504	S490-V492 VanDerWaalsContact C-N 3.28Å; S490-V492 PolarHBondContact OG-N 2.95Å; V492-R494 PolarHBondContact O-N 3.43Å; V492-H504 WeakPolarHBondContact CG2-ND1 3.48Å
493	T	52.2	Low	77.9	Confident	129 Å²	129	107.5 Å²	107.5	79%	0.791	52%	0.524	S	S	*	.			trans	-82.4	108	174.1	38.5	0	0	0	0	112.3	E495	T493-E495 VanDerWaalsContact C-N 3.32Å; T493-E495 PolarHBondContact O-N 2.93Å
494	R	51.4	Low	77.7	Confident	255 Å²	255	97.9 Å²	97.9	96%	0.962	49%	0.489	S	S	*	.	S	Bend	trans	66.4	-18	159.9	-74.8	-176.1	162.1	-170.9	-6.8	120.6	V492 F496	V492-R494 PolarHBondContact O-N 3.43Å; R494-F496 PolarHBondContact O-N 3.43Å
495	E	54.9	Low	77.7	Confident	141 Å²	141	96.7 Å²	96.7	66%	0.659	48%	0.475	S	S	*	.			trans	-98.2	74.8	177.4	-74.6	-163.9	-144.5	0	0	113.7	T493 W497	T493-E495 VanDerWaalsContact C-N 3.32Å; T493-E495 PolarHBondContact O-N 2.93Å; E495-W497 PolarHBondContact O-N 2.92Å; E495-W497 PolarHBondContact OE2-NE1 3.41Å
496	F	61.3	Low	77.6	Confident	119 Å²	119	90.7 Å²	90.7	52%	0.522	45%	0.452	S	S	.	.			trans	-89.7	95.6	176.7	-166.9	-93.6	0	0	0	111.6	R494 V501 F583	R494-F496 PolarHBondContact O-N 3.43Å; F496-V501 HydrophobicContact CE1-CG2 3.93Å; F496-V501 HydrophobicContact CZ-CG2 3.69Å; F496-F583 HydrophobicContact CE2-CZ 4.3Å; F496-F583 HydrophobicContact CZ-CE2 4.38Å; F496-F583 HydrophobicContact CZ-CZ 4.41Å
497	W	61.6	Low	77.6	Confident	145 Å²	145	91.5 Å²	91.5	55%	0.549	44%	0.442	S	S	.	.			trans	-92.9	132.6	174.4	-65.5	90.4	0	0	0	110.3	E495 E499 K500	E495-W497 PolarHBondContact O-N 2.92Å; E495-W497 PolarHBondContact OE2-NE1 3.41Å; W497-E499 PolarHBondContact O-N 3.06Å; W497-E499 VanDerWaalsContact O-N 3.13Å; W497-K500 PolarHBondContact O-N 3.46Å
498	P	67	Low	77.6	Confident	101 Å²	101	89.9 Å²	89.9	66%	0.656	43%	0.433	S	S	*	.	G	3₁₀ helix	trans	-55.2	-33.4	-176.5	-29.3	36.2	0	0	0	114.9	K500 V501	P498-K500 PolarHBondContact O-N 3.48Å; P498-K500 VanDerWaalsContact O-N 3.16Å; P498-V501 WeakPolarHBondContact O-CG2 3.44Å; P498-V501 PolarHBondContact O-N 2.87Å
499	E	66.8	Low	77.8	Confident	182 Å²	182	86.1 Å²	86.1	85%	0.85	41%	0.41	S	S	*	.	G	3₁₀ helix	trans	-64.9	-15.8	177.4	-60	176.5	163.2	0	0	113.7	W497	W497-E499 PolarHBondContact O-N 3.06Å; W497-E499 VanDerWaalsContact O-N 3.13Å
500	K	81.8	Confident	78	Confident	125 Å²	125	87 Å²	87	54%	0.543	41%	0.414	S	S	.	.	G	3₁₀ helix	trans	-107	9.9	-177.4	-63.4	-179.6	-178.8	172.1	0	113.5	W497 P498 D502 E503 H504	W497-K500 PolarHBondContact O-N 3.46Å; P498-K500 PolarHBondContact O-N 3.48Å; P498-K500 VanDerWaalsContact O-N 3.16Å; K500-D502 PolarHBondContact O-N 2.98Å; K500-E503 PolarHBondContact O-N 3.11Å; K500-H504 WeakPolarHBondContact O-CB 3.42Å; K500-H504 PolarHBondContact O-N 3.36Å
501	V	88.3	Confident	78.5	Confident	47 Å²	47	89.3 Å²	89.3	29%	0.285	42%	0.421	S	S	.	.	H	α-helix	trans	-55.8	-49.3	177.4	170.2	0	0	0	0	111.3	F496 P498 H504 R505 F583	F496-V501 HydrophobicContact CE1-CG2 3.93Å; F496-V501 HydrophobicContact CZ-CG2 3.69Å; P498-V501 WeakPolarHBondContact O-CG2 3.44Å; P498-V501 PolarHBondContact O-N 2.87Å; V501-H504 PolarHBondContact O-N 3.46Å; V501-R505 WeakPolarHBondContact O-CB 3.49Å; V501-R505 PolarHBondContact O-N 3.29Å; V501-F583 HydrophobicContact CG1-CE2 4.15Å; V501-F583 HydrophobicContact CG1-CZ 4.05Å
502	D	91	Very high	79.8	Confident	64 Å²	64	83.5 Å²	83.5	34%	0.342	39%	0.39	S	S	.	.	H	α-helix	trans	-63.7	-45.8	179.7	-77.1	-0.4	0	0	0	112.6	K500 H504 R505 L506 W681 R688	K500-D502 PolarHBondContact O-N 2.98Å; D502-H504 VanDerWaalsContact C-N 3.28Å; D502-H504 PolarHBondContact O-N 2.88Å; D502-R505 PolarHBondContact O-N 3.49Å; D502-L506 WeakPolarHBondContact O-CD1 3.38Å; D502-L506 VanDerWaalsContact O-CG 3.28Å; D502-L506 WeakPolarHBondContact O-CG 3.48Å; D502-L506 PolarHBondContact O-N 3.43Å; D502-W681 HydrophobicContact CB-CH2 4.01Å; D502-W681 HydrophobicContact CB-CZ2 3.95Å; D502-R688 IonicContact OD2-NH1 3.86Å
503	E	90.3	Very high	81.5	Confident	69 Å²	69	80 Å²	80	32%	0.322	37%	0.369	S	S	.	.	H	α-helix	trans	-58.2	-43.2	174.8	-73.2	-62.5	129.5	0	0	110.7	K500 R505 L506 R507 R688	K500-E503 PolarHBondContact O-N 3.11Å; E503-R505 PolarHBondContact O-N 3.23Å; E503-L506 PolarHBondContact O-N 3.06Å; E503-R507 WeakPolarHBondContact O-CG 3.48Å; E503-R507 PolarHBondContact O-N 3.24Å; E503-R688 IonicContact OE1-CZ 3.97Å; E503-R688 VanDerWaalsContact OE1-CZ 3.24Å; E503-R688 IonicContact OE1-NE 3.9Å; E503-R688 PolarHBondContact OE1-NE 3.35Å; E503-R688 IonicContact OE1-NH2 2.7Å; E503-R688 PolarHBondContact OE1-NH2 2.89Å
504	H	90.4	Very high	83.5	Confident	23 Å²	23	78.7 Å²	78.7	11%	0.106	35%	0.354	C	S	.	.	H	α-helix	trans	-64.6	-41.3	177.4	-165	37.4	0	0	0	112.2	S490 V492 K500 V501 D502 L506 R507 M508 F583	S490-H504 PolarHBondContact OG-CE1 3.21Å; S490-H504 PolarHBondContact OG-NE2 2.91Å; V492-H504 WeakPolarHBondContact CG2-ND1 3.48Å; K500-H504 WeakPolarHBondContact O-CB 3.42Å; K500-H504 PolarHBondContact O-N 3.36Å; V501-H504 PolarHBondContact O-N 3.46Å; D502-H504 VanDerWaalsContact C-N 3.28Å; D502-H504 PolarHBondContact O-N 2.88Å; H504-L506 VanDerWaalsContact C-N 3.3Å; H504-L506 PolarHBondContact O-N 3.47Å; H504-R507 PolarHBondContact O-N 2.73Å; H504-M508 WeakPolarHBondContact O-CG 3.48Å; H504-M508 PolarHBondContact O-N 2.71Å; H504-F583 HydrophobicContact CB-CE1 4.12Å; H504-F583 HydrophobicContact CB-CZ 4.31Å; H504-F583 AromaticContact CD2-CE1 3.68Å
505	R	93.7	Very high	85.7	Confident	45 Å²	45	67.7 Å²	67.7	17%	0.17	31%	0.314	C	S	.	.	H	α-helix	trans	-66.1	-31.1	177.6	178.7	171.3	-177.7	-136.5	-1.9	112.8	V501 D502 E503 H509 F583 I584 W681 Y682	V501-R505 WeakPolarHBondContact O-CB 3.49Å; V501-R505 PolarHBondContact O-N 3.29Å; D502-R505 PolarHBondContact O-N 3.49Å; E503-R505 PolarHBondContact O-N 3.23Å; R505-H509 WeakPolarHBondContact O-CB 3.49Å; R505-H509 PolarHBondContact O-N 3.14Å; R505-F583 HydrophobicContact CB-CD1 4.17Å; R505-F583 HydrophobicContact CB-CE1 3.71Å; R505-F583 HydrophobicContact CB-CZ 4.28Å; R505-F583 VanDerWaalsContact CD-O 3.28Å; R505-F583 WeakPolarHBondContact CD-O 3.37Å; R505-F583 WeakPolarHBondContact CG-O 3.15Å; R505-F583 PolarHBondContact NE-O 2.79Å; R505-F583 VanDerWaalsContact NE-O 3.17Å; R505-I584 PolarHBondContact NE-O 2.81Å; R505-I584 VanDerWaalsContact NE-O 3.15Å; R505-I584 PolarHBondContact NH2-O 3.49Å; R505-W681 HydrophobicContact CG-CZ3 4.29Å; R505-Y682 WeakPolarHBondContact CG-OH 3.33Å; R505-Y682 PolarHBondContact NE-OH 2.82Å; R505-Y682 PolarHBondContact O-OH 3.39Å
506	L	93.8	Very high	87.7	Confident	1 Å²	1	61 Å²	61	1%	0.005	28%	0.283	C	S	.	.	H	α-helix	trans	-69.7	-47.3	170.4	-70.7	159.7	0	0	0	110.9	D502 E503 H504 M508 H509 E510 W681 Y682 N685 R688 T689	D502-L506 WeakPolarHBondContact O-CD1 3.38Å; D502-L506 VanDerWaalsContact O-CG 3.28Å; D502-L506 WeakPolarHBondContact O-CG 3.48Å; D502-L506 PolarHBondContact O-N 3.43Å; E503-L506 PolarHBondContact O-N 3.06Å; H504-L506 VanDerWaalsContact C-N 3.3Å; H504-L506 PolarHBondContact O-N 3.47Å; L506-M508 PolarHBondContact O-N 3.01Å; L506-H509 CarbonylContact O-C 3.59Å; L506-H509 WeakPolarHBondContact O-CB 3.36Å; L506-H509 PolarHBondContact O-N 2.86Å; L506-H509 VanDerWaalsContact O-N 3.1Å; L506-E510 PolarHBondContact O-N 3.07Å; L506-W681 HydrophobicContact CD1-CH2 4.18Å; L506-W681 HydrophobicContact CD2-CH2 4.12Å; L506-W681 HydrophobicContact CD2-CZ3 3.81Å; L506-W681 HydrophobicContact CG-CH2 3.87Å; L506-W681 HydrophobicContact CG-CZ3 3.96Å; L506-Y682 HydrophobicContact CD2-CD1 3.88Å; L506-Y682 HydrophobicContact CD2-CE1 4.1Å; L506-N685 HydrophobicContact CD2-CB 4.09Å; L506-R688 HydrophobicContact CD1-CB 3.66Å; L506-R688 HydrophobicContact CD1-CG 4.45Å; L506-T689 HydrophobicContact CD2-CG2 4.11Å
507	R	93.2	Very high	89.4	Confident	124 Å²	124	56 Å²	56	47%	0.468	26%	0.263	S	S	.	.	H	α-helix	trans	-61.2	-41.9	177.2	-64.7	-51.2	179.9	179.1	-8.1	113.7	E503 H504 H509 E510 E511	E503-R507 WeakPolarHBondContact O-CG 3.48Å; E503-R507 PolarHBondContact O-N 3.24Å; H504-R507 PolarHBondContact O-N 2.73Å; R507-H509 PolarHBondContact O-N 2.81Å; R507-E510 WeakPolarHBondContact CD-OE2 3.45Å; R507-E510 IonicContact CZ-OE1 3.78Å; R507-E510 IonicContact CZ-OE2 3.59Å; R507-E510 IonicContact NE-OE2 2.68Å; R507-E510 VanDerWaalsContact NH1-CD 3.28Å; R507-E510 IonicContact NH1-OE1 2.74Å; R507-E510 PolarHBondContact NH1-OE1 2.93Å; R507-E510 IonicContact NH1-OE2 3.03Å; R507-E510 PolarHBondContact NH1-OE2 3.07Å; R507-E510 WeakPolarHBondContact O-CB 3.31Å; R507-E510 PolarHBondContact O-N 2.95Å; R507-E511 PolarHBondContact O-N 2.81Å
508	M	95.1	Very high	91	Very high	7 Å²	7	52 Å²	52	3%	0.034	26%	0.256	C	S	.	.	H	α-helix	trans	-66.2	-28	176	-68	179.6	68.2	0	0	112.4	L489 H504 L506 L512 E580 F583 I584	L489-M508 HydrophobicContact CB-CB 4.13Å; L489-M508 HydrophobicContact CB-CE 4.02Å; L489-M508 HydrophobicContact CB-CG 4.17Å; L489-M508 WeakPolarHBondContact O-CG 3.26Å; H504-M508 WeakPolarHBondContact O-CG 3.48Å; H504-M508 PolarHBondContact O-N 2.71Å; L506-M508 PolarHBondContact O-N 3.01Å; M508-L512 WeakPolarHBondContact O-CB 3.27Å; M508-L512 PolarHBondContact O-N 2.77Å; M508-E580 HydrophobicContact CE-CB 3.64Å; M508-E580 HydrophobicContact CE-CG 3.81Å; M508-F583 HydrophobicContact CE-CD1 4.31Å; M508-F583 HydrophobicContact SD-CD1 3.44Å; M508-F583 WeakPolarHBondContact SD-CD1 3.41Å; M508-F583 HydrophobicContact SD-CE1 3.85Å; M508-F583 HydrophobicContact SD-CG 4.39Å; M508-I584 HydrophobicContact CB-CD1 3.99Å; M508-I584 HydrophobicContact CB-CG1 4.01Å; M508-I584 WeakPolarHBondContact O-CD1 3.45Å
509	H	95.5	Very high	92.4	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-79.3	-34.2	174.4	-176.2	-116.2	0	0	0	113	R505 L506 R507 L512 S513 I584 Y682 L691 Y695	R505-H509 WeakPolarHBondContact O-CB 3.49Å; R505-H509 PolarHBondContact O-N 3.14Å; L506-H509 CarbonylContact O-C 3.59Å; L506-H509 WeakPolarHBondContact O-CB 3.36Å; L506-H509 PolarHBondContact O-N 2.86Å; L506-H509 VanDerWaalsContact O-N 3.1Å; R507-H509 PolarHBondContact O-N 2.81Å; H509-L512 PolarHBondContact O-N 3.28Å; H509-S513 WeakPolarHBondContact O-CB 3.47Å; H509-S513 PolarHBondContact O-N 3.07Å; H509-I584 HydrophobicContact CB-CG2 4.48Å; H509-Y682 HydrophobicContact CB-CD1 4.13Å; H509-Y682 HydrophobicContact CB-CE1 3.37Å; H509-Y682 AromaticContact CE1-CD1 3.75Å; H509-Y682 AromaticContact CE1-CG 3.83Å; H509-Y682 AromaticContact CG-CD1 3.71Å; H509-Y682 AromaticContact CG-CE1 3.39Å; H509-Y682 AromaticContact CG-CZ 3.74Å; H509-Y682 AromaticContact ND1-CD1 3.21Å; H509-Y682 WeakPolarHBondContact ND1-CD1 3.21Å; H509-Y682 AromaticContact ND1-CE1 3.42Å; H509-Y682 WeakPolarHBondContact ND1-CE1 3.32Å; H509-Y682 AromaticContact ND1-CG 3.77Å; H509-L691 WeakPolarHBondContact ND1-CD2 3.17Å; H509-Y695 AromaticContact CE1-CE1 3.69Å; H509-Y695 AromaticContact NE2-CE1 3.55Å; H509-Y695 AromaticContact NE2-CZ 3.57Å; H509-Y695 PolarHBondContact NE2-OH 3.11Å
510	E	95.4	Very high	93.9	Very high	22 Å²	22	38.9 Å²	38.9	10%	0.103	19%	0.187	C	C	.	.	H	α-helix	trans	-54.8	-55.7	168.5	-72.2	177.4	158.8	0	0	110.7	L506 R507 L512 S513 Q514 T689 R690 L691	L506-E510 PolarHBondContact O-N 3.07Å; R507-E510 WeakPolarHBondContact CD-OE2 3.45Å; R507-E510 IonicContact CZ-OE1 3.78Å; R507-E510 IonicContact CZ-OE2 3.59Å; R507-E510 IonicContact NE-OE2 2.68Å; R507-E510 VanDerWaalsContact NH1-CD 3.28Å; R507-E510 IonicContact NH1-OE1 2.74Å; R507-E510 PolarHBondContact NH1-OE1 2.93Å; R507-E510 IonicContact NH1-OE2 3.03Å; R507-E510 PolarHBondContact NH1-OE2 3.07Å; R507-E510 WeakPolarHBondContact O-CB 3.31Å; R507-E510 PolarHBondContact O-N 2.95Å; E510-L512 PolarHBondContact O-N 3.31Å; E510-S513 WeakPolarHBondContact O-CB 3.36Å; E510-S513 PolarHBondContact O-N 3.46Å; E510-S513 VanDerWaalsContact O-N 3.09Å; E510-S513 PolarHBondContact O-OG 3.36Å; E510-Q514 WeakPolarHBondContact O-CG 3.47Å; E510-Q514 PolarHBondContact O-N 3.39Å; E510-T689 WeakPolarHBondContact CG-OG1 3.47Å; E510-T689 WeakPolarHBondContact OE1-CA 3.44Å; E510-R690 PolarHBondContact OE1-N 3.21Å; E510-L691 HydrophobicContact CG-CD2 4.21Å
511	E	95.2	Very high	94.6	Very high	79 Å²	79	38.6 Å²	38.6	37%	0.369	19%	0.187	S	C	.	.	H	α-helix	trans	-56.4	-48.8	177.6	-68.6	-70.3	179.5	0	0	111	L489 N491 R507 S513 Q514 L515	L489-E511 HydrophobicContact CD2-CB 3.98Å; N491-E511 PolarHBondContact ND2-OE1 3Å; R507-E511 PolarHBondContact O-N 2.81Å; E511-S513 VanDerWaalsContact C-N 3.28Å; E511-S513 PolarHBondContact O-N 2.93Å; E511-Q514 PolarHBondContact O-N 2.96Å; E511-L515 WeakPolarHBondContact O-CG 3.49Å; E511-L515 PolarHBondContact O-N 3.1Å; E511-L515 VanDerWaalsContact O-N 3.14Å
512	L	95.9	Very high	95	Very high	3 Å²	3	39.8 Å²	39.8	2%	0.016	19%	0.189	C	C	.	.	H	α-helix	trans	-59.4	-36	177.4	-175.5	61.1	0	0	0	112.9	L489 M508 H509 E510 L515 L516 I576 L581 I584 Y585	L489-L512 HydrophobicContact CD1-CB 4.26Å; M508-L512 WeakPolarHBondContact O-CB 3.27Å; M508-L512 PolarHBondContact O-N 2.77Å; H509-L512 PolarHBondContact O-N 3.28Å; E510-L512 PolarHBondContact O-N 3.31Å; L512-L515 PolarHBondContact O-N 3.29Å; L512-L516 HydrophobicContact CD1-CD1 3.95Å; L512-L516 HydrophobicContact CD1-CG 4.07Å; L512-L516 HydrophobicContact CD2-CD1 4.37Å; L512-L516 HydrophobicContact CG-CD1 3.83Å; L512-L516 HydrophobicContact CG-CG 4.32Å; L512-L516 WeakPolarHBondContact O-CB 3.36Å; L512-L516 WeakPolarHBondContact O-CG 3.28Å; L512-L516 PolarHBondContact O-N 3.28Å; L512-I576 HydrophobicContact CD1-CD1 3.84Å; L512-L581 HydrophobicContact CD2-CD2 4.29Å; L512-I584 HydrophobicContact CB-CD1 4.26Å; L512-I584 HydrophobicContact CD2-CD1 3.82Å; L512-I584 HydrophobicContact CD2-CG2 4.18Å; L512-Y585 HydrophobicContact CD2-CE2 3.68Å
513	S	96.3	Very high	95.3	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-64.7	-39.9	177.8	79.9	0	0	0	0	112.3	H509 E510 E511 L515 L516 A517 L691 A692	H509-S513 WeakPolarHBondContact O-CB 3.47Å; H509-S513 PolarHBondContact O-N 3.07Å; E510-S513 WeakPolarHBondContact O-CB 3.36Å; E510-S513 PolarHBondContact O-N 3.46Å; E510-S513 VanDerWaalsContact O-N 3.09Å; E510-S513 PolarHBondContact O-OG 3.36Å; E511-S513 VanDerWaalsContact C-N 3.28Å; E511-S513 PolarHBondContact O-N 2.93Å; S513-L515 VanDerWaalsContact C-N 3.31Å; S513-L515 PolarHBondContact O-N 3.27Å; S513-L516 PolarHBondContact O-N 2.68Å; S513-A517 WeakPolarHBondContact O-CB 3.48Å; S513-A517 PolarHBondContact O-N 3.08Å; S513-L691 WeakPolarHBondContact OG-CA 3.16Å; S513-A692 PolarHBondContact OG-N 2.93Å
514	Q	95.7	Very high	95.7	Very high	101 Å²	101	35.1 Å²	35.1	47%	0.472	17%	0.168	S	C	.	.	H	α-helix	trans	-66	-36.2	176	-58.7	-63.6	-15	0	0	111.3	E510 E511 P518	E510-Q514 WeakPolarHBondContact O-CG 3.47Å; E510-Q514 PolarHBondContact O-N 3.39Å; E511-Q514 PolarHBondContact O-N 2.96Å; Q514-P518 WeakPolarHBondContact O-CD 3.5Å
515	L	95.9	Very high	96	Very high	24 Å²	24	36.8 Å²	36.8	13%	0.126	18%	0.176	C	C	.	.	H	α-helix	trans	-71.6	-32.1	176.9	-61.8	-179.2	0	0	0	113.5	I487 L489 E511 L512 S513 L570 K574 I576	I487-L515 HydrophobicContact CD1-CD1 3.53Å; L489-L515 HydrophobicContact CD2-CD1 3.7Å; E511-L515 WeakPolarHBondContact O-CG 3.49Å; E511-L515 PolarHBondContact O-N 3.1Å; E511-L515 VanDerWaalsContact O-N 3.14Å; L512-L515 PolarHBondContact O-N 3.29Å; S513-L515 VanDerWaalsContact C-N 3.31Å; S513-L515 PolarHBondContact O-N 3.27Å; L515-L570 HydrophobicContact CB-CD1 3.66Å; L515-L570 HydrophobicContact CD1-CD1 3.9Å; L515-L570 HydrophobicContact CG-CD1 4.31Å; L515-K574 HydrophobicContact CD1-CD 4.34Å; L515-K574 HydrophobicContact CD2-CD 3.41Å; L515-K574 VanDerWaalsContact CD2-CD 3.41Å; L515-K574 HydrophobicContact CG-CD 4.49Å; L515-I576 HydrophobicContact CD1-CD1 4.07Å
516	L	96.7	Very high	96.2	Very high	1 Å²	1	34.7 Å²	34.7	1%	0.005	17%	0.168	C	C	.	.	H	α-helix	trans	-88.7	-23.1	-178.9	-69.2	176.9	0	0	0	113.7	L512 S513 C519 I520 W553 L570 Y695	L512-L516 HydrophobicContact CD1-CD1 3.95Å; L512-L516 HydrophobicContact CD1-CG 4.07Å; L512-L516 HydrophobicContact CD2-CD1 4.37Å; L512-L516 HydrophobicContact CG-CD1 3.83Å; L512-L516 HydrophobicContact CG-CG 4.32Å; L512-L516 WeakPolarHBondContact O-CB 3.36Å; L512-L516 WeakPolarHBondContact O-CG 3.28Å; L512-L516 PolarHBondContact O-N 3.28Å; S513-L516 PolarHBondContact O-N 2.68Å; L516-C519 WeakPolarHBondContact O-CA 3.23Å; L516-C519 VanDerWaalsContact O-CB 3.27Å; L516-C519 WeakPolarHBondContact O-CB 3.42Å; L516-C519 PolarHBondContact O-N 3.38Å; L516-I520 PolarHBondContact O-N 2.94Å; L516-W553 HydrophobicContact CD2-CD2 4.26Å; L516-W553 HydrophobicContact CD2-CZ2 3.72Å; L516-L570 HydrophobicContact CD2-CD2 4.41Å; L516-Y695 HydrophobicContact CB-CD2 4.07Å; L516-Y695 HydrophobicContact CB-CE2 4.17Å; L516-Y695 HydrophobicContact CD1-CE2 3.9Å
517	A	96.7	Very high	96.4	Very high	13 Å²	13	34.6 Å²	34.6	11%	0.107	17%	0.168	C	C	.	.	H	α-helix	trans	-54.5	-41	-179.1	0	0	0	0	0	114.9	S513 C519 I520 Q521 A692	S513-A517 WeakPolarHBondContact O-CB 3.48Å; S513-A517 PolarHBondContact O-N 3.08Å; A517-C519 VanDerWaalsContact C-N 3.28Å; A517-C519 PolarHBondContact O-N 3.34Å; A517-I520 WeakPolarHBondContact O-CB 3.47Å; A517-I520 PolarHBondContact O-N 3.14Å; A517-Q521 PolarHBondContact O-N 2.96Å; A517-A692 HydrophobicContact CB-CB 3.82Å
518	P	96.2	Very high	96.6	Very high	60 Å²	60	33.3 Å²	33.3	39%	0.39	17%	0.165	S	C	.	.	H	α-helix	trans	-64.3	-29.5	172.6	-22.6	34.6	0	0	0	113.3	Q514 I520 Q521 H522	Q514-P518 WeakPolarHBondContact O-CD 3.5Å; P518-I520 VanDerWaalsContact C-N 3.34Å; P518-Q521 PolarHBondContact O-N 3.26Å; P518-H522 PolarHBondContact O-N 3.38Å; P518-H522 PolarHBondContact O-ND1 2.87Å
519	C	96.8	Very high	96.7	Very high	7 Å²	7	39 Å²	39	5%	0.047	19%	0.186	C	C	.	.	H	α-helix	trans	-68.4	-34.6	176.6	-61.8	0	0	0	0	111.5	L516 A517 Q521 H522 V523 F549	L516-C519 WeakPolarHBondContact O-CA 3.23Å; L516-C519 VanDerWaalsContact O-CB 3.27Å; L516-C519 WeakPolarHBondContact O-CB 3.42Å; L516-C519 PolarHBondContact O-N 3.38Å; A517-C519 VanDerWaalsContact C-N 3.28Å; A517-C519 PolarHBondContact O-N 3.34Å; C519-Q521 VanDerWaalsContact C-N 3.35Å; C519-Q521 PolarHBondContact O-N 2.85Å; C519-H522 PolarHBondContact O-N 3.36Å; C519-V523 WeakPolarHBondContact O-CG2 3.28Å; C519-V523 PolarHBondContact O-N 3.43Å; C519-V523 VanDerWaalsContact O-N 3.07Å; C519-F549 HydrophobicContact CB-CE2 4.14Å; C519-F549 HydrophobicContact CB-CZ 4.41Å
520	I	97.5	Very high	96.8	Very high	1 Å²	1	39.2 Å²	39.2	1%	0.005	19%	0.187	C	C	.	.	H	α-helix	trans	-60.2	-46.4	175.1	-55.9	169.1	0	0	0	110	L516 A517 P518 H522 V523 V524 F549 L694 Y695 T698	L516-I520 PolarHBondContact O-N 2.94Å; A517-I520 WeakPolarHBondContact O-CB 3.47Å; A517-I520 PolarHBondContact O-N 3.14Å; P518-I520 VanDerWaalsContact C-N 3.34Å; I520-H522 VanDerWaalsContact C-N 3.34Å; I520-H522 PolarHBondContact O-N 3.06Å; I520-V523 PolarHBondContact O-N 3.01Å; I520-V523 VanDerWaalsContact O-N 3.15Å; I520-V524 HydrophobicContact CG2-CG2 4.33Å; I520-V524 WeakPolarHBondContact O-CG2 3.19Å; I520-V524 PolarHBondContact O-N 3.44Å; I520-F549 HydrophobicContact CB-CD2 4.29Å; I520-F549 HydrophobicContact CB-CE2 4.15Å; I520-F549 HydrophobicContact CD1-CE1 4.2Å; I520-F549 HydrophobicContact CD1-CZ 4.32Å; I520-F549 HydrophobicContact CG1-CD1 4.02Å; I520-F549 HydrophobicContact CG1-CD2 3.83Å; I520-F549 HydrophobicContact CG1-CE1 3.66Å; I520-F549 HydrophobicContact CG1-CE2 3.48Å; I520-F549 VanDerWaalsContact CG1-CE2 3.48Å; I520-F549 HydrophobicContact CG1-CG 4.11Å; I520-F549 HydrophobicContact CG1-CZ 3.39Å; I520-L694 HydrophobicContact CB-CD2 3.98Å; I520-L694 HydrophobicContact CB-CG 4.19Å; I520-L694 HydrophobicContact CD1-CG 4.17Å; I520-L694 HydrophobicContact CG2-CD1 4.15Å; I520-L694 HydrophobicContact CG2-CD2 3.96Å; I520-L694 HydrophobicContact CG2-CG 3.89Å; I520-Y695 HydrophobicContact CD1-CD2 4.32Å; I520-T698 HydrophobicContact CD1-CG2 4.36Å
521	Q	96.9	Very high	96.9	Very high	119 Å²	119	39.4 Å²	39.4	56%	0.556	19%	0.191	S	C	*	.	H	α-helix	trans	-59.7	-42.2	179	-62.6	-179.5	-12.9	0	0	112.4	A517 P518 C519 V524 E525 L694	A517-Q521 PolarHBondContact O-N 2.96Å; P518-Q521 PolarHBondContact O-N 3.26Å; C519-Q521 VanDerWaalsContact C-N 3.35Å; C519-Q521 PolarHBondContact O-N 2.85Å; Q521-V524 PolarHBondContact O-N 3.42Å; Q521-E525 PolarHBondContact O-N 3.32Å; Q521-L694 HydrophobicContact CG-CD2 3.45Å; Q521-L694 VanDerWaalsContact CG-CD2 3.45Å
522	H	96.9	Very high	96.9	Very high	72 Å²	72	40.4 Å²	40.4	33%	0.333	20%	0.196	S	C	.	.	H	α-helix	trans	-63.4	-40	175	-68.5	114.1	0	0	0	112.8	F471 P518 C519 I520 F526	F471-H522 WeakPolarHBondContact O-CB 3.43Å; F471-H522 PolarHBondContact O-CD2 3.23Å; P518-H522 PolarHBondContact O-N 3.38Å; P518-H522 PolarHBondContact O-ND1 2.87Å; C519-H522 PolarHBondContact O-N 3.36Å; I520-H522 VanDerWaalsContact C-N 3.34Å; I520-H522 PolarHBondContact O-N 3.06Å; H522-F526 WeakPolarHBondContact O-CB 3.2Å; H522-F526 PolarHBondContact O-N 2.97Å
523	V	97.7	Very high	96.9	Very high	4 Å²	4	40.3 Å²	40.3	2%	0.024	20%	0.195	C	C	.	.	H	α-helix	trans	-68.1	-39	175.9	173.8	0	0	0	0	111.6	C519 I520 F526 A527 F549 V552	C519-V523 WeakPolarHBondContact O-CG2 3.28Å; C519-V523 PolarHBondContact O-N 3.43Å; C519-V523 VanDerWaalsContact O-N 3.07Å; I520-V523 PolarHBondContact O-N 3.01Å; I520-V523 VanDerWaalsContact O-N 3.15Å; V523-F526 PolarHBondContact O-N 3.36Å; V523-A527 WeakPolarHBondContact O-CB 3.49Å; V523-A527 PolarHBondContact O-N 3.08Å; V523-F549 HydrophobicContact CB-CD2 4.33Å; V523-F549 HydrophobicContact CG2-CD2 4.16Å; V523-F549 HydrophobicContact CG2-CE2 4.47Å; V523-V552 HydrophobicContact CG1-CB 4.22Å; V523-V552 HydrophobicContact CG1-CG1 4.09Å; V523-V552 HydrophobicContact CG1-CG2 4.44Å; V523-V552 HydrophobicContact CG2-CB 4.27Å; V523-V552 HydrophobicContact CG2-CG1 3.78Å
524	V	97.4	Very high	96.8	Very high	32 Å²	32	43.9 Å²	43.9	19%	0.194	22%	0.22	C	C	.	.	H	α-helix	trans	-61.9	-47.8	174.5	168.6	0	0	0	0	111.5	I520 Q521 A527 K528 I545	I520-V524 HydrophobicContact CG2-CG2 4.33Å; I520-V524 WeakPolarHBondContact O-CG2 3.19Å; I520-V524 PolarHBondContact O-N 3.44Å; Q521-V524 PolarHBondContact O-N 3.42Å; V524-A527 PolarHBondContact O-N 2.91Å; V524-K528 HydrophobicContact CG1-CD 4.4Å; V524-K528 WeakPolarHBondContact O-CG 3.24Å; V524-K528 PolarHBondContact O-N 3.09Å; V524-K528 VanDerWaalsContact O-N 3.15Å; V524-I545 HydrophobicContact CG2-CG2 3.84Å
525	E	97.5	Very high	96.8	Very high	57 Å²	57	42.1 Å²	42.1	27%	0.266	22%	0.219	S	C	.	.	H	α-helix	trans	-69.5	-31.8	177.9	-76.5	-56.1	123.1	0	0	113	F471 Q521 K528 R529	F471-E525 HydrophobicContact CD1-CB 3.49Å; F471-E525 VanDerWaalsContact CD1-CB 3.49Å; F471-E525 HydrophobicContact CD1-CG 4.35Å; F471-E525 HydrophobicContact CD2-CB 4.46Å; F471-E525 HydrophobicContact CE1-CB 3.69Å; F471-E525 HydrophobicContact CE1-CG 4.21Å; F471-E525 HydrophobicContact CG-CB 3.92Å; F471-E525 HydrophobicContact CZ-CB 4.27Å; Q521-E525 PolarHBondContact O-N 3.32Å; E525-K528 WeakPolarHBondContact OE1-CD 3.29Å; E525-K528 WeakPolarHBondContact OE1-CE 3.36Å; E525-K528 IonicContact OE1-NZ 3.29Å; E525-K528 PolarHBondContact OE1-NZ 3.09Å; E525-R529 WeakPolarHBondContact O-CG 3.47Å; E525-R529 IonicContact OE2-NH2 3.69Å; E525-R529 PolarHBondContact OE2-NH2 3.39Å
526	F	98.2	Very high	96.8	Very high	1 Å²	1	41.3 Å²	41.3	0%	0.004	21%	0.214	C	C	.	.	H	α-helix	trans	-62.7	-49.5	169.2	175.2	-110.9	0	0	0	111.4	I464 A467 Y468 F471 H522 V523 K528 R529 I530 C614 I618	I464-F526 HydrophobicContact CG2-CE2 4.49Å; I464-F526 HydrophobicContact CG2-CZ 4.24Å; A467-F526 HydrophobicContact CB-CD2 3.86Å; A467-F526 HydrophobicContact CB-CE2 3.98Å; Y468-F526 HydrophobicContact CD2-CE2 4.26Å; Y468-F526 HydrophobicContact CD2-CZ 4.49Å; F471-F526 HydrophobicContact CB-CB 4.22Å; H522-F526 WeakPolarHBondContact O-CB 3.2Å; H522-F526 PolarHBondContact O-N 2.97Å; V523-F526 PolarHBondContact O-N 3.36Å; F526-K528 VanDerWaalsContact C-N 3.34Å; F526-K528 PolarHBondContact O-N 2.76Å; F526-R529 PolarHBondContact O-N 3.01Å; F526-I530 HydrophobicContact CD1-CD1 4.22Å; F526-I530 HydrophobicContact CE1-CD1 3.87Å; F526-I530 HydrophobicContact CE1-CG1 4.32Å; F526-I530 HydrophobicContact CZ-CD1 4.39Å; F526-I530 HydrophobicContact CZ-CG1 4.43Å; F526-I530 PolarHBondContact O-N 2.99Å; F526-C614 HydrophobicContact CE1-CB 3.66Å; F526-C614 HydrophobicContact CZ-CB 4.05Å; F526-I618 HydrophobicContact CD1-CD1 3.76Å; F526-I618 HydrophobicContact CE1-CD1 3.82Å
527	A	98.1	Very high	96.8	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-57.7	-42.4	-178.5	0	0	0	0	0	112.8	V523 V524 R529 I530 F533 I545 I618	V523-A527 WeakPolarHBondContact O-CB 3.49Å; V523-A527 PolarHBondContact O-N 3.08Å; V524-A527 PolarHBondContact O-N 2.91Å; A527-R529 PolarHBondContact O-N 3.11Å; A527-I530 WeakPolarHBondContact O-CB 3.24Å; A527-I530 PolarHBondContact O-N 2.93Å; A527-F533 HydrophobicContact CB-CD1 4.41Å; A527-F533 HydrophobicContact CB-CE1 4.07Å; A527-F533 HydrophobicContact CB-CZ 4.18Å; A527-F533 WeakPolarHBondContact O-CD1 3.33Å; A527-I545 HydrophobicContact CB-CD1 4.07Å; A527-I545 HydrophobicContact CB-CG1 4.11Å; A527-I618 HydrophobicContact CB-CD1 4.33Å
528	K	97.2	Very high	96.8	Very high	97 Å²	97	49.8 Å²	49.8	42%	0.422	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-13.8	176	-71	170.8	-172.7	172.2	0	115	V524 E525 F526 S534	V524-K528 HydrophobicContact CG1-CD 4.4Å; V524-K528 WeakPolarHBondContact O-CG 3.24Å; V524-K528 PolarHBondContact O-N 3.09Å; V524-K528 VanDerWaalsContact O-N 3.15Å; E525-K528 WeakPolarHBondContact OE1-CD 3.29Å; E525-K528 WeakPolarHBondContact OE1-CE 3.36Å; E525-K528 IonicContact OE1-NZ 3.29Å; E525-K528 PolarHBondContact OE1-NZ 3.09Å; F526-K528 VanDerWaalsContact C-N 3.34Å; F526-K528 PolarHBondContact O-N 2.76Å; K528-S534 PolarHBondContact O-OG 3.35Å
529	R	97.4	Very high	96.8	Very high	126 Å²	126	50.3 Å²	50.3	48%	0.475	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.7	-7.6	178.2	-51	-60.4	167.8	165.2	-4.9	113.5	A467 F471 E525 F526 A527	A467-R529 HydrophobicContact CB-CB 3.54Å; A467-R529 HydrophobicContact CB-CG 4.18Å; F471-R529 HydrophobicContact CD2-CG 4.24Å; F471-R529 HydrophobicContact CE2-CG 3.79Å; E525-R529 WeakPolarHBondContact O-CG 3.47Å; E525-R529 IonicContact OE2-NH2 3.69Å; E525-R529 PolarHBondContact OE2-NH2 3.39Å; F526-R529 PolarHBondContact O-N 3.01Å; A527-R529 PolarHBondContact O-N 3.11Å
530	I	97.8	Very high	96.9	Very high	4 Å²	4	50 Å²	50	2%	0.021	26%	0.261	C	S	.	.	S	Bend	trans	-66.9	130.3	176.5	-64.5	177.3	0	0	0	108.4	F526 A527 E532 F533 A615 I618 H639	F526-I530 HydrophobicContact CD1-CD1 4.22Å; F526-I530 HydrophobicContact CE1-CD1 3.87Å; F526-I530 HydrophobicContact CE1-CG1 4.32Å; F526-I530 HydrophobicContact CZ-CD1 4.39Å; F526-I530 HydrophobicContact CZ-CG1 4.43Å; F526-I530 PolarHBondContact O-N 2.99Å; A527-I530 WeakPolarHBondContact O-CB 3.24Å; A527-I530 PolarHBondContact O-N 2.93Å; I530-E532 PolarHBondContact O-N 2.9Å; I530-F533 HydrophobicContact CB-CB 3.95Å; I530-F533 HydrophobicContact CG2-CB 4.21Å; I530-F533 WeakPolarHBondContact O-CB 3.19Å; I530-F533 PolarHBondContact O-N 3.17Å; I530-A615 HydrophobicContact CD1-CB 4.07Å; I530-A615 HydrophobicContact CG1-CB 4.49Å; I530-A615 HydrophobicContact CG2-CB 4.46Å; I530-I618 HydrophobicContact CD1-CB 4.3Å; I530-I618 HydrophobicContact CD1-CD1 3.61Å; I530-I618 HydrophobicContact CD1-CG2 4.29Å; I530-H639 WeakPolarHBondContact CG2-NE2 3.48Å
531	P	96.8	Very high	96.9	Very high	27 Å²	27	52 Å²	52	18%	0.175	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.8	138.1	176.3	-29.5	37.4	0	0	0	112.4	T460 T463 I464 F533	T460-P531 HydrophobicContact CG2-CG 4.23Å; T463-P531 HydrophobicContact CG2-CG 4.05Å; I464-P531 HydrophobicContact CG1-CG 4.44Å; P531-F533 PolarHBondContact O-N 3.15Å
532	E	95.3	Very high	96.9	Very high	100 Å²	100	50 Å²	50	47%	0.467	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.6	-13.2	-178.9	-59.1	-179	-100.2	0	0	117	I530 S534 S535 I635	I530-E532 PolarHBondContact O-N 2.9Å; E532-S534 VanDerWaalsContact C-N 3.34Å; E532-S534 PolarHBondContact O-N 3.01Å; E532-S535 VanDerWaalsContact O-CB 3.28Å; E532-S535 WeakPolarHBondContact O-CB 3.49Å; E532-S535 PolarHBondContact O-N 3.09Å; E532-S535 PolarHBondContact O-OG 3.23Å; E532-I635 HydrophobicContact CB-CD1 3.88Å; E532-I635 HydrophobicContact CB-CG1 3.92Å; E532-I635 HydrophobicContact CB-CG2 4.39Å
533	F	96.7	Very high	96.9	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	26%	0.257	C	S	.	.	G	3₁₀ helix	trans	-54.8	-47.7	178.5	-176.6	-91.6	0	0	0	112.3	A527 I530 P531 S535 L536 Q541 L544 I545 I618 T619	A527-F533 HydrophobicContact CB-CD1 4.41Å; A527-F533 HydrophobicContact CB-CE1 4.07Å; A527-F533 HydrophobicContact CB-CZ 4.18Å; A527-F533 WeakPolarHBondContact O-CD1 3.33Å; I530-F533 HydrophobicContact CB-CB 3.95Å; I530-F533 HydrophobicContact CG2-CB 4.21Å; I530-F533 WeakPolarHBondContact O-CB 3.19Å; I530-F533 PolarHBondContact O-N 3.17Å; P531-F533 PolarHBondContact O-N 3.15Å; F533-S535 PolarHBondContact O-N 3.1Å; F533-L536 HydrophobicContact CD2-CD1 4.27Å; F533-L536 WeakPolarHBondContact O-CB 3.42Å; F533-L536 PolarHBondContact O-N 2.81Å; F533-L536 VanDerWaalsContact O-N 3.09Å; F533-Q541 HydrophobicContact CD1-CG 4.27Å; F533-Q541 HydrophobicContact CE1-CB 3.84Å; F533-Q541 HydrophobicContact CE1-CG 3.74Å; F533-Q541 HydrophobicContact CZ-CB 3.86Å; F533-Q541 HydrophobicContact CZ-CG 4.03Å; F533-L544 HydrophobicContact CD2-CD1 4.44Å; F533-L544 HydrophobicContact CE2-CB 4.11Å; F533-L544 HydrophobicContact CE2-CD1 3.87Å; F533-I545 HydrophobicContact CE1-CD1 4.08Å; F533-I545 HydrophobicContact CZ-CD1 3.87Å; F533-I545 HydrophobicContact CZ-CG1 3.91Å; F533-I618 HydrophobicContact CD2-CG2 4.02Å; F533-I618 HydrophobicContact CE2-CG2 3.64Å; F533-T619 HydrophobicContact CD2-CG2 4.41Å
534	S	94.5	Very high	96.9	Very high	76 Å²	76	48 Å²	48	53%	0.531	26%	0.256	S	S	.	.	G	3₁₀ helix	trans	-68.5	1.4	177.7	-50.1	0	0	0	0	114.6	K528 E532	K528-S534 PolarHBondContact O-OG 3.35Å; E532-S534 VanDerWaalsContact C-N 3.34Å; E532-S534 PolarHBondContact O-N 3.01Å
535	S	94.8	Very high	96.9	Very high	63 Å²	63	47.4 Å²	47.4	44%	0.441	25%	0.252	S	S	.	.	G	3₁₀ helix	trans	-96	-10.8	172.3	81.2	0	0	0	0	113.7	E532 F533 K631	E532-S535 VanDerWaalsContact O-CB 3.28Å; E532-S535 WeakPolarHBondContact O-CB 3.49Å; E532-S535 PolarHBondContact O-N 3.09Å; E532-S535 PolarHBondContact O-OG 3.23Å; F533-S535 PolarHBondContact O-N 3.1Å; S535-K631 WeakPolarHBondContact O-CE 3.49Å; S535-K631 PolarHBondContact O-NZ 2.83Å
536	L	96.4	Very high	96.9	Very high	7 Å²	7	46.3 Å²	46.3	4%	0.037	25%	0.246	C	C	.	.	S	Bend	trans	-70.3	154.5	170.3	-64.2	170.5	0	0	0	110.2	F533 D540 Q541 L544 K631 V632 I635	F533-L536 HydrophobicContact CD2-CD1 4.27Å; F533-L536 WeakPolarHBondContact O-CB 3.42Å; F533-L536 PolarHBondContact O-N 2.81Å; F533-L536 VanDerWaalsContact O-N 3.09Å; L536-D540 HydrophobicContact CB-CB 4.3Å; L536-Q541 HydrophobicContact CB-CG 3.96Å; L536-Q541 PolarHBondContact O-NE2 2.99Å; L536-L544 HydrophobicContact CD1-CD1 3.58Å; L536-K631 HydrophobicContact CD2-CB 4.38Å; L536-K631 HydrophobicContact CD2-CD 3.9Å; L536-K631 HydrophobicContact CD2-CG 3.88Å; L536-V632 HydrophobicContact CD1-CG2 4.08Å; L536-V632 HydrophobicContact CD2-CG2 3.74Å; L536-I635 HydrophobicContact CD1-CD1 4.25Å; L536-I635 HydrophobicContact CD2-CD1 3.92Å; L536-I635 HydrophobicContact CG-CD1 4Å
537	G	95.6	Very high	96.8	Very high	30 Å²	30	48 Å²	48	31%	0.309	26%	0.259	S	S	.	.			trans	-59	148.1	170.9	0	0	0	0	0	111.8	P539 D540 Q541	G537-P539 VanDerWaalsContact C-N 3.3Å; G537-D540 PolarHBondContact O-N 3.19Å; G537-Q541 PolarHBondContact O-N 2.89Å
538	Q	96.7	Very high	96.8	Very high	163 Å²	163	48 Å²	48	76%	0.762	26%	0.259	S	S	*	.	H	α-helix	trans	-53.7	-37.8	177.8	-170.5	-179	15.6	0	0	113.9	Q541 L542	Q538-Q541 PolarHBondContact O-N 3.37Å; Q538-L542 PolarHBondContact O-N 2.84Å
539	P	97	Very high	96.8	Very high	70 Å²	70	43.4 Å²	43.4	46%	0.455	24%	0.24	S	C	.	.	H	α-helix	trans	-60.4	-45.8	173.5	-24.2	35.5	0	0	0	112.6	G537 L542 V543 I627	G537-P539 VanDerWaalsContact C-N 3.3Å; P539-L542 PolarHBondContact O-N 3.29Å; P539-V543 WeakPolarHBondContact O-CG2 3.49Å; P539-V543 PolarHBondContact O-N 3.15Å; P539-I627 HydrophobicContact CB-CD1 3.85Å; P539-I627 HydrophobicContact CG-CD1 4Å
540	D	98	Very high	96.8	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-65.2	-41.6	179.1	-74	14.1	0	0	0	111.3	L536 G537 L542 V543 L544 L626 I627 E628	L536-D540 HydrophobicContact CB-CB 4.3Å; G537-D540 PolarHBondContact O-N 3.19Å; D540-L542 VanDerWaalsContact C-N 3.29Å; D540-L542 PolarHBondContact O-N 3.26Å; D540-V543 PolarHBondContact O-N 3.17Å; D540-L544 WeakPolarHBondContact O-CB 3.45Å; D540-L544 VanDerWaalsContact O-CG 3.27Å; D540-L544 WeakPolarHBondContact O-CG 3.21Å; D540-L544 PolarHBondContact O-N 3.14Å; D540-L626 HydrophobicContact CB-CD2 4Å; D540-I627 WeakPolarHBondContact OD1-CB 3.24Å; D540-I627 WeakPolarHBondContact OD1-CG1 3.1Å; D540-I627 PolarHBondContact OD1-N 3.49Å; D540-I627 PolarHBondContact OD2-N 3.37Å; D540-E628 PolarHBondContact OD2-N 3.04Å
541	Q	97.7	Very high	96.8	Very high	43 Å²	43	37.8 Å²	37.8	20%	0.201	22%	0.219	C	C	.	.	H	α-helix	trans	-57.6	-42.8	174	-67.1	-177.9	37.2	0	0	111.6	F533 L536 G537 Q538 I545	F533-Q541 HydrophobicContact CD1-CG 4.27Å; F533-Q541 HydrophobicContact CE1-CB 3.84Å; F533-Q541 HydrophobicContact CE1-CG 3.74Å; F533-Q541 HydrophobicContact CZ-CB 3.86Å; F533-Q541 HydrophobicContact CZ-CG 4.03Å; L536-Q541 HydrophobicContact CB-CG 3.96Å; L536-Q541 PolarHBondContact O-NE2 2.99Å; G537-Q541 PolarHBondContact O-N 2.89Å; Q538-Q541 PolarHBondContact O-N 3.37Å; Q541-I545 WeakPolarHBondContact O-CB 3.37Å; Q541-I545 VanDerWaalsContact O-CG1 3.31Å; Q541-I545 WeakPolarHBondContact O-CG1 3.32Å; Q541-I545 PolarHBondContact O-N 3.41Å; Q541-I545 VanDerWaalsContact O-N 3.09Å
542	L	96.9	Very high	96.9	Very high	79 Å²	79	36.5 Å²	36.5	41%	0.414	21%	0.21	S	C	.	.	H	α-helix	trans	-67.6	-46.6	178.4	-175.3	62.8	0	0	0	111.8	Q538 P539 D540 L544 I545 K546	Q538-L542 PolarHBondContact O-N 2.84Å; P539-L542 PolarHBondContact O-N 3.29Å; D540-L542 VanDerWaalsContact C-N 3.29Å; D540-L542 PolarHBondContact O-N 3.26Å; L542-L544 PolarHBondContact O-N 2.99Å; L542-I545 PolarHBondContact O-N 2.79Å; L542-K546 HydrophobicContact CD1-CG 4.22Å; L542-K546 HydrophobicContact CG-CG 4.45Å; L542-K546 WeakPolarHBondContact O-CG 3.41Å; L542-K546 PolarHBondContact O-N 3.04Å
543	V	97.3	Very high	97	Very high	33 Å²	33	32.5 Å²	32.5	20%	0.2	19%	0.191	C	C	.	.	H	α-helix	trans	-58.2	-46.6	177	166.2	0	0	0	0	111.4	P539 D540 A547 R623 Y624 L626	P539-V543 WeakPolarHBondContact O-CG2 3.49Å; P539-V543 PolarHBondContact O-N 3.15Å; D540-V543 PolarHBondContact O-N 3.17Å; V543-A547 VanDerWaalsContact O-CB 3.29Å; V543-A547 WeakPolarHBondContact O-CB 3.43Å; V543-A547 PolarHBondContact O-N 2.92Å; V543-R623 HydrophobicContact CG1-CB 4Å; V543-Y624 WeakPolarHBondContact CG1-O 3.41Å; V543-L626 HydrophobicContact CB-CD2 4.04Å; V543-L626 HydrophobicContact CG1-CD2 3.63Å; V543-L626 HydrophobicContact CG1-CG 3.99Å
544	L	98.1	Very high	97.1	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-62.5	-43.4	177.5	-68.8	-177.9	0	0	0	111.8	F533 L536 D540 L542 A548 I618 K620 R623 L626 V632	F533-L544 HydrophobicContact CD2-CD1 4.44Å; F533-L544 HydrophobicContact CE2-CB 4.11Å; F533-L544 HydrophobicContact CE2-CD1 3.87Å; L536-L544 HydrophobicContact CD1-CD1 3.58Å; D540-L544 WeakPolarHBondContact O-CB 3.45Å; D540-L544 VanDerWaalsContact O-CG 3.27Å; D540-L544 WeakPolarHBondContact O-CG 3.21Å; D540-L544 PolarHBondContact O-N 3.14Å; L542-L544 PolarHBondContact O-N 2.99Å; L544-A548 WeakPolarHBondContact O-CB 3.5Å; L544-A548 PolarHBondContact O-N 3.16Å; L544-I618 WeakPolarHBondContact CD2-O 3.33Å; L544-K620 WeakPolarHBondContact CD2-O 3.34Å; L544-R623 HydrophobicContact CD2-CB 4.4Å; L544-R623 HydrophobicContact CD2-CG 3.77Å; L544-L626 HydrophobicContact CD2-CD1 4Å; L544-L626 HydrophobicContact CD2-CD2 3.74Å; L544-L626 HydrophobicContact CD2-CG 4.44Å; L544-L626 HydrophobicContact CG-CD2 3.89Å; L544-V632 HydrophobicContact CD1-CG1 4.04Å; L544-V632 HydrophobicContact CD1-CG2 4.13Å; L544-V632 HydrophobicContact CD2-CG1 4.03Å
545	I	97.7	Very high	97.3	Very high	20 Å²	20	29 Å²	29	10%	0.103	17%	0.167	C	C	.	.	H	α-helix	trans	-66.2	-49.6	179.3	-74.6	168	0	0	0	111.6	V524 A527 F533 Q541 L542 A547 A548 F549	V524-I545 HydrophobicContact CG2-CG2 3.84Å; A527-I545 HydrophobicContact CB-CD1 4.07Å; A527-I545 HydrophobicContact CB-CG1 4.11Å; F533-I545 HydrophobicContact CE1-CD1 4.08Å; F533-I545 HydrophobicContact CZ-CD1 3.87Å; F533-I545 HydrophobicContact CZ-CG1 3.91Å; Q541-I545 WeakPolarHBondContact O-CB 3.37Å; Q541-I545 VanDerWaalsContact O-CG1 3.31Å; Q541-I545 WeakPolarHBondContact O-CG1 3.32Å; Q541-I545 PolarHBondContact O-N 3.41Å; Q541-I545 VanDerWaalsContact O-N 3.09Å; L542-I545 PolarHBondContact O-N 2.79Å; I545-A547 PolarHBondContact O-N 3.33Å; I545-A548 PolarHBondContact O-N 2.69Å; I545-F549 WeakPolarHBondContact O-CB 3.3Å; I545-F549 PolarHBondContact O-N 3.03Å
546	K	96.9	Very high	97.4	Very high	34 Å²	34	26.3 Å²	26.3	15%	0.148	15%	0.147	C	C	.	.	H	α-helix	trans	-59.5	-46.3	179.7	-70.1	-161.5	-172	-162.1	0	111.5	L542 E697 D700	L542-K546 HydrophobicContact CD1-CG 4.22Å; L542-K546 HydrophobicContact CG-CG 4.45Å; L542-K546 WeakPolarHBondContact O-CG 3.41Å; L542-K546 PolarHBondContact O-N 3.04Å; K546-E697 VanDerWaalsContact CE-O 3.31Å; K546-E697 WeakPolarHBondContact CE-O 3.45Å; K546-E697 PolarHBondContact NZ-O 3.24Å; K546-D700 IonicContact NZ-OD1 3.58Å; K546-D700 PolarHBondContact NZ-OD1 3.1Å
547	A	96.3	Very high	97.5	Very high	35 Å²	35	26 Å²	26	29%	0.289	15%	0.145	S	C	.	.	H	α-helix	trans	-72.7	-31	-178.9	0	0	0	0	0	113.7	V543 I545 R623	V543-A547 VanDerWaalsContact O-CB 3.29Å; V543-A547 WeakPolarHBondContact O-CB 3.43Å; V543-A547 PolarHBondContact O-N 2.92Å; I545-A547 PolarHBondContact O-N 3.33Å; A547-R623 HydrophobicContact CB-CB 4.31Å; A547-R623 HydrophobicContact CB-CG 3.87Å
548	A	97.4	Very high	97.6	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-92.3	-15.8	-177.7	0	0	0	0	0	114.7	L544 I545 F550 E551 V552 V617 I618	L544-A548 WeakPolarHBondContact O-CB 3.5Å; L544-A548 PolarHBondContact O-N 3.16Å; I545-A548 PolarHBondContact O-N 2.69Å; A548-F550 PolarHBondContact O-N 3.25Å; A548-E551 PolarHBondContact O-N 2.7Å; A548-E551 VanDerWaalsContact O-N 3.08Å; A548-V552 HydrophobicContact CB-CG2 4.27Å; A548-V552 WeakPolarHBondContact O-CG2 3.46Å; A548-V552 PolarHBondContact O-N 2.94Å; A548-V617 HydrophobicContact CB-CG1 4.46Å; A548-I618 HydrophobicContact CB-CB 4.48Å; A548-I618 HydrophobicContact CB-CG1 4.12Å
549	F	97.8	Very high	97.5	Very high	1 Å²	1	19.4 Å²	19.4	0%	0.004	10%	0.104	C	C	.	.	H	α-helix	trans	-48.7	-53.4	-173.6	163.2	-115.3	0	0	0	113	C519 I520 V523 I545 E551 V552 W553 T698 Y699	C519-F549 HydrophobicContact CB-CE2 4.14Å; C519-F549 HydrophobicContact CB-CZ 4.41Å; I520-F549 HydrophobicContact CB-CD2 4.29Å; I520-F549 HydrophobicContact CB-CE2 4.15Å; I520-F549 HydrophobicContact CD1-CE1 4.2Å; I520-F549 HydrophobicContact CD1-CZ 4.32Å; I520-F549 HydrophobicContact CG1-CD1 4.02Å; I520-F549 HydrophobicContact CG1-CD2 3.83Å; I520-F549 HydrophobicContact CG1-CE1 3.66Å; I520-F549 HydrophobicContact CG1-CE2 3.48Å; I520-F549 VanDerWaalsContact CG1-CE2 3.48Å; I520-F549 HydrophobicContact CG1-CG 4.11Å; I520-F549 HydrophobicContact CG1-CZ 3.39Å; V523-F549 HydrophobicContact CB-CD2 4.33Å; V523-F549 HydrophobicContact CG2-CD2 4.16Å; V523-F549 HydrophobicContact CG2-CE2 4.47Å; I545-F549 WeakPolarHBondContact O-CB 3.3Å; I545-F549 PolarHBondContact O-N 3.03Å; F549-E551 PolarHBondContact O-N 3.09Å; F549-V552 PolarHBondContact O-N 2.97Å; F549-W553 HydrophobicContact CE2-CB 4.04Å; F549-W553 HydrophobicContact CZ-CB 4.34Å; F549-W553 WeakPolarHBondContact O-CB 3.42Å; F549-W553 PolarHBondContact O-N 3.45Å; F549-T698 HydrophobicContact CB-CG2 3.98Å; F549-T698 HydrophobicContact CD1-CG2 3.8Å; F549-T698 HydrophobicContact CG-CG2 4.07Å; F549-Y699 HydrophobicContact CD1-CE2 4.1Å; F549-Y699 AromaticContact CD1-CZ 3.97Å; F549-Y699 WeakPolarHBondContact CD1-OH 3.42Å; F549-Y699 HydrophobicContact CE1-CE2 4.1Å
550	F	97.7	Very high	97.5	Very high	10 Å²	10	17.5 Å²	17.5	4%	0.044	9%	0.09	C	C	.	.	H	α-helix	trans	-63.3	-43	-178.9	-176.6	-92.8	0	0	0	112.2	A548 V552 W553 L554 I593 V671 V675	A548-F550 PolarHBondContact O-N 3.25Å; F550-V552 PolarHBondContact O-N 3.14Å; F550-W553 AromaticContact CD2-CE3 3.97Å; F550-W553 HydrophobicContact CD2-CE3 3.97Å; F550-W553 HydrophobicContact CD2-CZ3 4.25Å; F550-W553 AromaticContact CE2-CE3 3.69Å; F550-W553 HydrophobicContact CE2-CE3 3.69Å; F550-W553 AromaticContact CE2-CZ3 3.52Å; F550-W553 HydrophobicContact CE2-CZ3 3.52Å; F550-W553 HydrophobicContact CZ-CE3 4.26Å; F550-W553 AromaticContact CZ-CZ3 3.98Å; F550-W553 HydrophobicContact CZ-CZ3 3.98Å; F550-W553 PolarHBondContact O-N 3.07Å; F550-L554 HydrophobicContact CE1-CB 4.16Å; F550-L554 HydrophobicContact CE1-CD2 3.73Å; F550-L554 HydrophobicContact CZ-CB 4.41Å; F550-L554 HydrophobicContact CZ-CD2 4.18Å; F550-L554 VanDerWaalsContact O-CB 3.31Å; F550-L554 WeakPolarHBondContact O-CB 3Å; F550-L554 PolarHBondContact O-N 3.39Å; F550-I593 HydrophobicContact CZ-CD1 3.92Å; F550-I593 HydrophobicContact CZ-CG1 4.18Å; F550-V671 HydrophobicContact CE1-CG1 4.21Å; F550-V675 HydrophobicContact CD1-CB 4.39Å; F550-V675 HydrophobicContact CD1-CG2 4.36Å; F550-V675 HydrophobicContact CD2-CG1 4.03Å; F550-V675 HydrophobicContact CE1-CB 4.3Å; F550-V675 HydrophobicContact CE1-CG2 3.78Å; F550-V675 HydrophobicContact CE2-CG1 4.13Å; F550-V675 HydrophobicContact CE2-CG2 4.04Å; F550-V675 HydrophobicContact CG-CG1 4.28Å; F550-V675 HydrophobicContact CZ-CB 4.4Å; F550-V675 HydrophobicContact CZ-CG1 4.48Å; F550-V675 HydrophobicContact CZ-CG2 3.62Å
551	E	98.1	Very high	97.5	Very high	2 Å²	2	18 Å²	18	1%	0.009	9%	0.092	C	C	.	.	H	α-helix	trans	-62.5	-43.7	179.5	-61.7	-175	-162.2	0	0	111.7	A548 F549 L554 V555 V617 K620 R623 V668 T669	A548-E551 PolarHBondContact O-N 2.7Å; A548-E551 VanDerWaalsContact O-N 3.08Å; F549-E551 PolarHBondContact O-N 3.09Å; E551-L554 PolarHBondContact O-N 3.25Å; E551-V555 WeakPolarHBondContact O-CB 3.17Å; E551-V555 VanDerWaalsContact O-CG2 3.32Å; E551-V555 WeakPolarHBondContact O-CG2 3.35Å; E551-V555 PolarHBondContact O-N 3.02Å; E551-V617 HydrophobicContact CB-CG1 3.5Å; E551-V617 WeakPolarHBondContact OE2-CG1 3.42Å; E551-K620 IonicContact OE2-NZ 2.76Å; E551-K620 PolarHBondContact OE2-NZ 3.22Å; E551-R623 IonicContact OE1-CZ 3.46Å; E551-R623 VanDerWaalsContact OE1-CZ 3.32Å; E551-R623 IonicContact OE1-NH1 2.81Å; E551-R623 PolarHBondContact OE1-NH1 2.92Å; E551-R623 IonicContact OE1-NH2 3.24Å; E551-R623 PolarHBondContact OE1-NH2 3.32Å; E551-R623 IonicContact OE2-CZ 3.74Å; E551-R623 IonicContact OE2-NH1 3.06Å; E551-R623 IonicContact OE2-NH2 2.66Å; E551-R623 PolarHBondContact OE2-NH2 3.28Å; E551-V668 HydrophobicContact CB-CG1 4.12Å; E551-V668 HydrophobicContact CB-CG2 3.84Å; E551-V668 HydrophobicContact CG-CG1 4.32Å; E551-V668 HydrophobicContact CG-CG2 4.19Å; E551-T669 VanDerWaalsContact OE1-CA 3.3Å; E551-T669 WeakPolarHBondContact OE1-CA 3.41Å; E551-T669 WeakPolarHBondContact OE1-CB 3.37Å; E551-T669 PolarHBondContact OE1-OG1 2.73Å; E551-T669 PolarHBondContact OE2-OG1 3.44Å
552	V	98.3	Very high	97.3	Very high	0 Å²	0	17.4 Å²	17.4	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-66	-45.2	176.9	178.5	0	0	0	0	110.7	V523 A548 F549 F550 L554 V555 Q556 C614 V617 I618	V523-V552 HydrophobicContact CG1-CB 4.22Å; V523-V552 HydrophobicContact CG1-CG1 4.09Å; V523-V552 HydrophobicContact CG1-CG2 4.44Å; V523-V552 HydrophobicContact CG2-CB 4.27Å; V523-V552 HydrophobicContact CG2-CG1 3.78Å; A548-V552 HydrophobicContact CB-CG2 4.27Å; A548-V552 WeakPolarHBondContact O-CG2 3.46Å; A548-V552 PolarHBondContact O-N 2.94Å; F549-V552 PolarHBondContact O-N 2.97Å; F550-V552 PolarHBondContact O-N 3.14Å; V552-L554 VanDerWaalsContact C-N 3.34Å; V552-L554 PolarHBondContact O-N 3.17Å; V552-V555 PolarHBondContact O-N 3.33Å; V552-Q556 VanDerWaalsContact O-CG 3.3Å; V552-Q556 WeakPolarHBondContact O-CG 3.38Å; V552-Q556 PolarHBondContact O-N 2.96Å; V552-C614 HydrophobicContact CG1-CB 4.17Å; V552-V617 HydrophobicContact CG2-CG1 3.7Å; V552-I618 HydrophobicContact CG2-CD1 3.9Å; V552-I618 HydrophobicContact CG2-CG1 3.49Å; V552-I618 VanDerWaalsContact CG2-CG1 3.49Å
553	W	97.9	Very high	97	Very high	16 Å²	16	15.9 Å²	15.9	6%	0.061	9%	0.087	C	C	.	.	H	α-helix	trans	-60	-44.4	177	171.9	81.6	0	0	0	111.4	L516 F549 F550 Q556 A557 I568 L570	L516-W553 HydrophobicContact CD2-CD2 4.26Å; L516-W553 HydrophobicContact CD2-CZ2 3.72Å; F549-W553 HydrophobicContact CE2-CB 4.04Å; F549-W553 HydrophobicContact CZ-CB 4.34Å; F549-W553 WeakPolarHBondContact O-CB 3.42Å; F549-W553 PolarHBondContact O-N 3.45Å; F550-W553 AromaticContact CD2-CE3 3.97Å; F550-W553 HydrophobicContact CD2-CE3 3.97Å; F550-W553 HydrophobicContact CD2-CZ3 4.25Å; F550-W553 AromaticContact CE2-CE3 3.69Å; F550-W553 HydrophobicContact CE2-CE3 3.69Å; F550-W553 AromaticContact CE2-CZ3 3.52Å; F550-W553 HydrophobicContact CE2-CZ3 3.52Å; F550-W553 HydrophobicContact CZ-CE3 4.26Å; F550-W553 AromaticContact CZ-CZ3 3.98Å; F550-W553 HydrophobicContact CZ-CZ3 3.98Å; F550-W553 PolarHBondContact O-N 3.07Å; W553-Q556 PolarHBondContact O-N 3.16Å; W553-A557 HydrophobicContact CZ2-CB 4.35Å; W553-A557 WeakPolarHBondContact O-CB 3.32Å; W553-A557 PolarHBondContact O-N 2.65Å; W553-I568 HydrophobicContact CH2-CG2 4.46Å; W553-I568 HydrophobicContact CZ2-CG2 4.44Å; W553-L570 HydrophobicContact CZ2-CD2 3.79Å
554	L	98.4	Very high	96.8	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-67	-41.7	178.4	178.5	55.9	0	0	0	112.3	F550 E551 V552 Q556 S558 I561 I593 F596 V668 V671	F550-L554 HydrophobicContact CE1-CB 4.16Å; F550-L554 HydrophobicContact CE1-CD2 3.73Å; F550-L554 HydrophobicContact CZ-CB 4.41Å; F550-L554 HydrophobicContact CZ-CD2 4.18Å; F550-L554 VanDerWaalsContact O-CB 3.31Å; F550-L554 WeakPolarHBondContact O-CB 3Å; F550-L554 PolarHBondContact O-N 3.39Å; E551-L554 PolarHBondContact O-N 3.25Å; V552-L554 VanDerWaalsContact C-N 3.34Å; V552-L554 PolarHBondContact O-N 3.17Å; L554-Q556 VanDerWaalsContact C-N 3.28Å; L554-Q556 PolarHBondContact O-N 3.48Å; L554-S558 WeakPolarHBondContact O-CB 3.45Å; L554-S558 PolarHBondContact O-N 2.94Å; L554-I561 HydrophobicContact CD1-CD1 3.88Å; L554-I593 HydrophobicContact CD1-CG2 3.89Å; L554-I593 HydrophobicContact CD2-CG1 4.35Å; L554-F596 HydrophobicContact CD1-CD1 4.06Å; L554-F596 HydrophobicContact CD1-CE1 4.46Å; L554-F596 HydrophobicContact CD2-CD1 3.76Å; L554-F596 HydrophobicContact CD2-CE1 4.22Å; L554-F596 HydrophobicContact CD2-CG 4.36Å; L554-F596 HydrophobicContact CG-CD1 3.64Å; L554-F596 HydrophobicContact CG-CE1 3.78Å; L554-V668 HydrophobicContact CB-CG2 4.44Å; L554-V668 HydrophobicContact CD2-CG2 4.15Å; L554-V668 HydrophobicContact CG-CG2 4.43Å; L554-V671 HydrophobicContact CD2-CB 4.19Å; L554-V671 HydrophobicContact CD2-CG1 3.77Å
555	V	98.4	Very high	96.6	Very high	4 Å²	4	26.1 Å²	26.1	2%	0.024	14%	0.141	C	C	.	.	H	α-helix	trans	-57.2	-42.1	172.7	163.3	0	0	0	0	111.2	E551 V552 S558 F596 F600 V610 V668	E551-V555 WeakPolarHBondContact O-CB 3.17Å; E551-V555 VanDerWaalsContact O-CG2 3.32Å; E551-V555 WeakPolarHBondContact O-CG2 3.35Å; E551-V555 PolarHBondContact O-N 3.02Å; V552-V555 PolarHBondContact O-N 3.33Å; V555-S558 PolarHBondContact O-OG 3.41Å; V555-F596 HydrophobicContact CG2-CZ 4.06Å; V555-F600 HydrophobicContact CG1-CE2 4.04Å; V555-F600 HydrophobicContact CG1-CZ 3.8Å; V555-F600 HydrophobicContact CG2-CE2 4.47Å; V555-V610 HydrophobicContact CG1-CG1 4.05Å; V555-V668 HydrophobicContact CG2-CG2 4.13Å
556	Q	97.4	Very high	96.6	Very high	6 Å²	6	33.3 Å²	33.3	3%	0.028	17%	0.167	C	C	.	.	H	α-helix	trans	-75.7	-45.7	-179.7	-67.6	-177.1	22.3	0	0	113	Y468 S472 Y474 V552 W553 L554 S558	Y468-Q556 HydrophobicContact CE2-CG 3.9Å; S472-Q556 PolarHBondContact OG-OE1 3.27Å; Y474-Q556 WeakPolarHBondContact CB-O 3.32Å; Y474-Q556 HydrophobicContact CD2-CB 3.53Å; Y474-Q556 HydrophobicContact CE2-CB 4.21Å; Y474-Q556 HydrophobicContact CG-CB 4.05Å; V552-Q556 VanDerWaalsContact O-CG 3.3Å; V552-Q556 WeakPolarHBondContact O-CG 3.38Å; V552-Q556 PolarHBondContact O-N 2.96Å; W553-Q556 PolarHBondContact O-N 3.16Å; L554-Q556 VanDerWaalsContact C-N 3.28Å; L554-Q556 PolarHBondContact O-N 3.48Å; Q556-S558 VanDerWaalsContact C-N 3.31Å; Q556-S558 PolarHBondContact O-N 3.49Å
557	A	97	Very high	96.6	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-71.4	-24	-177	0	0	0	0	0	113.2	Y474 W553 R559 L560 I561	Y474-A557 HydrophobicContact CE1-CB 4.07Å; Y474-A557 HydrophobicContact CE2-CB 4.37Å; W553-A557 HydrophobicContact CZ2-CB 4.35Å; W553-A557 WeakPolarHBondContact O-CB 3.32Å; W553-A557 PolarHBondContact O-N 2.65Å; A557-R559 PolarHBondContact O-N 3.23Å; A557-L560 CarbonylContact O-C 3.58Å; A557-L560 PolarHBondContact O-N 2.9Å; A557-I561 PolarHBondContact O-N 2.99Å
558	S	97.8	Very high	96.6	Very high	0 Å²	0	33 Å²	33	0%	0	16%	0.159	C	C	.	.	G	3₁₀ helix	trans	-42.2	-41.5	177.2	63.2	0	0	0	0	113.6	L554 V555 Q556 L560 I561 F600 N601	L554-S558 WeakPolarHBondContact O-CB 3.45Å; L554-S558 PolarHBondContact O-N 2.94Å; V555-S558 PolarHBondContact O-OG 3.41Å; Q556-S558 VanDerWaalsContact C-N 3.31Å; Q556-S558 PolarHBondContact O-N 3.49Å; S558-L560 PolarHBondContact O-N 2.74Å; S558-L560 VanDerWaalsContact O-N 3.09Å; S558-I561 PolarHBondContact O-N 2.91Å; S558-F600 WeakPolarHBondContact OG-CD1 3.43Å; S558-F600 WeakPolarHBondContact OG-CE1 3.48Å; S558-N601 PolarHBondContact O-ND2 3.45Å
559	R	95.7	Very high	96.6	Very high	54 Å²	54	33.3 Å²	33.3	20%	0.204	16%	0.161	C	C	.	.	G	3₁₀ helix	trans	-60.5	-18.8	-179.5	-49.8	-176.9	78.5	-171.5	12.9	114.1	Y474 D476 I479 A557 D607	Y474-R559 PolarHBondContact O-NH1 3.31Å; D476-R559 IonicContact OD1-NH2 2.71Å; D476-R559 IonicContact OD2-CZ 3.73Å; D476-R559 IonicContact OD2-NH1 3.39Å; D476-R559 IonicContact OD2-NH2 3.76Å; D476-R559 PolarHBondContact OD2-NH2 3.44Å; I479-R559 HydrophobicContact CD1-CB 4.07Å; A557-R559 PolarHBondContact O-N 3.23Å; R559-D607 IonicContact CZ-OD1 2.72Å; R559-D607 IonicContact NH1-OD1 2.67Å; R559-D607 PolarHBondContact NH1-OD1 3.38Å; R559-D607 IonicContact NH2-OD1 2.91Å
560	L	96.5	Very high	96.5	Very high	30 Å²	30	33.4 Å²	33.4	16%	0.157	16%	0.161	C	C	.	.	G	3₁₀ helix	trans	-123.6	16.1	178.2	-54.3	-179.4	0	0	0	113.4	Y474 I479 M482 A557 S558 T569	Y474-L560 HydrophobicContact CD1-CD1 3.84Å; Y474-L560 HydrophobicContact CD1-CG 4.34Å; Y474-L560 HydrophobicContact CE1-CD1 4.01Å; I479-L560 HydrophobicContact CD1-CD2 4.28Å; I479-L560 HydrophobicContact CD1-CG 4.37Å; I479-L560 HydrophobicContact CG1-CD1 4.24Å; I479-L560 HydrophobicContact CG1-CD2 4.13Å; I479-L560 HydrophobicContact CG1-CG 4.33Å; I479-L560 HydrophobicContact CG2-CD2 3.82Å; M482-L560 HydrophobicContact CE-CD1 3.88Å; M482-L560 HydrophobicContact SD-CD1 3.52Å; M482-L560 VanDerWaalsContact SD-CD1 3.52Å; A557-L560 CarbonylContact O-C 3.58Å; A557-L560 PolarHBondContact O-N 2.9Å; S558-L560 PolarHBondContact O-N 2.74Å; S558-L560 VanDerWaalsContact O-N 3.09Å; L560-T569 HydrophobicContact CD1-CG2 4.26Å; L560-T569 PolarHBondContact O-N 3.28Å; L560-T569 PolarHBondContact O-OG1 2.94Å
561	I	97.4	Very high	96.2	Very high	10 Å²	10	34.3 Å²	34.3	5%	0.051	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	112.3	166.6	-60.8	-177.4	0	0	0	107.5	L554 A557 S558 I568 I593 F594 S597	L554-I561 HydrophobicContact CD1-CD1 3.88Å; A557-I561 PolarHBondContact O-N 2.99Å; S558-I561 PolarHBondContact O-N 2.91Å; I561-I568 HydrophobicContact CD1-CD1 3.83Å; I561-I568 HydrophobicContact CD1-CG1 4.16Å; I561-I568 HydrophobicContact CG1-CB 4.36Å; I561-I568 HydrophobicContact CG1-CD1 4.16Å; I561-I568 HydrophobicContact CG1-CG1 3.92Å; I561-I568 HydrophobicContact CG1-CG2 4.07Å; I561-I568 HydrophobicContact CG2-CG1 4.21Å; I561-I593 HydrophobicContact CD1-CG2 4.11Å; I561-F594 HydrophobicContact CG2-CD1 3.72Å; I561-F594 HydrophobicContact CG2-CD2 4.4Å; I561-F594 HydrophobicContact CG2-CE1 3.64Å; I561-F594 HydrophobicContact CG2-CE2 4.36Å; I561-F594 HydrophobicContact CG2-CG 4.12Å; I561-F594 HydrophobicContact CG2-CZ 3.99Å; I561-S597 VanDerWaalsContact CG2-OG 3.3Å; I561-S597 WeakPolarHBondContact CG2-OG 3.08Å
562	S	93.7	Very high	95.9	Very high	32 Å²	32	37.9 Å²	37.9	22%	0.224	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	107	175.6	179.8	0	0	0	0	109.4	N564 D565 R566 K567	S562-N564 VanDerWaalsContact C-N 3.28Å; S562-D565 WeakPolarHBondContact CB-OD2 3.32Å; S562-D565 WeakPolarHBondContact OG-CB 3.31Å; S562-D565 PolarHBondContact OG-N 3.22Å; S562-D565 PolarHBondContact OG-OD2 2.97Å; S562-R566 WeakPolarHBondContact O-CA 3.37Å; S562-R566 PolarHBondContact O-N 3.38Å; S562-K567 PolarHBondContact N-O 3.38Å; S562-K567 PolarHBondContact O-N 3.48Å; S562-K567 VanDerWaalsContact O-N 3.1Å
563	T	91.9	Very high	95.8	Very high	47 Å²	47	37.9 Å²	37.9	29%	0.288	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-40.2	171.4	50.1	0	0	0	0	111.3	R566 F594 E598	T563-R566 WeakPolarHBondContact O-CG 3.37Å; T563-R566 PolarHBondContact O-N 3.01Å; T563-F594 HydrophobicContact CG2-CD1 4.27Å; T563-E598 HydrophobicContact CG2-CB 4.28Å
564	N	92.7	Very high	95.7	Very high	149 Å²	149	39 Å²	39	80%	0.797	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-52.7	178.6	-67	-32.2	0	0	0	112.4	S562 R566	S562-N564 VanDerWaalsContact C-N 3.28Å; N564-R566 PolarHBondContact O-N 3Å
565	D	94.1	Very high	95.6	Very high	98 Å²	98	40.8 Å²	40.8	52%	0.524	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.5	-10.7	178.9	-61.8	-79.6	0	0	0	113.2	S562 K567	S562-D565 WeakPolarHBondContact CB-OD2 3.32Å; S562-D565 WeakPolarHBondContact OG-CB 3.31Å; S562-D565 PolarHBondContact OG-N 3.22Å; S562-D565 PolarHBondContact OG-OD2 2.97Å; D565-K567 HydrophobicContact CB-CB 4.4Å; D565-K567 HydrophobicContact CB-CD 3.95Å; D565-K567 HydrophobicContact CB-CG 4.27Å
566	R	96.5	Very high	95.5	Very high	171 Å²	171	40.7 Å²	40.7	65%	0.645	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.4	51.4	-171.9	-58.1	-179.5	178.3	-169.8	-1.8	111.9	S562 T563 N564 K578	S562-R566 WeakPolarHBondContact O-CA 3.37Å; S562-R566 PolarHBondContact O-N 3.38Å; T563-R566 WeakPolarHBondContact O-CG 3.37Å; T563-R566 PolarHBondContact O-N 3.01Å; N564-R566 PolarHBondContact O-N 3Å; R566-K578 HydrophobicContact CB-CB 3.99Å; R566-K578 WeakPolarHBondContact O-CB 3.12Å; R566-K578 PolarHBondContact O-N 2.68Å
567	K	97	Very high	95.5	Very high	59 Å²	59	42.5 Å²	42.5	26%	0.257	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	150.3	-176.9	-69.7	166.7	-162.1	160	0	112.6	S562 D565 Q575 I576	S562-K567 PolarHBondContact N-O 3.38Å; S562-K567 PolarHBondContact O-N 3.48Å; S562-K567 VanDerWaalsContact O-N 3.1Å; D565-K567 HydrophobicContact CB-CB 4.4Å; D565-K567 HydrophobicContact CB-CD 3.95Å; D565-K567 HydrophobicContact CB-CG 4.27Å; K567-Q575 HydrophobicContact CD-CB 4.46Å; K567-I576 VanDerWaalsContact CA-O 3.28Å; K567-I576 WeakPolarHBondContact CA-O 3.43Å
568	I	97.5	Very high	95.5	Very high	4 Å²	4	43.9 Å²	43.9	2%	0.021	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	131.7	165.4	-57.4	-164.9	0	0	0	108.3	W553 I561 L570 Q575 I576 L581 I593 F594	W553-I568 HydrophobicContact CH2-CG2 4.46Å; W553-I568 HydrophobicContact CZ2-CG2 4.44Å; I561-I568 HydrophobicContact CD1-CD1 3.83Å; I561-I568 HydrophobicContact CD1-CG1 4.16Å; I561-I568 HydrophobicContact CG1-CB 4.36Å; I561-I568 HydrophobicContact CG1-CD1 4.16Å; I561-I568 HydrophobicContact CG1-CG1 3.92Å; I561-I568 HydrophobicContact CG1-CG2 4.07Å; I561-I568 HydrophobicContact CG2-CG1 4.21Å; I568-L570 HydrophobicContact CG2-CD2 4.33Å; I568-Q575 WeakPolarHBondContact O-CA 3.45Å; I568-I576 PolarHBondContact N-O 2.9Å; I568-I576 PolarHBondContact O-N 2.93Å; I568-L581 HydrophobicContact CB-CD1 4.26Å; I568-L581 HydrophobicContact CD1-CD1 3.49Å; I568-L581 VanDerWaalsContact CD1-CD1 3.49Å; I568-L581 HydrophobicContact CG1-CD1 3.71Å; I568-I593 HydrophobicContact CD1-CG2 3.88Å; I568-F594 HydrophobicContact CD1-CE2 4.04Å; I568-F594 HydrophobicContact CG1-CE2 3.89Å; I568-F594 HydrophobicContact CG1-CZ 3.91Å
569	T	97	Very high	95.4	Very high	6 Å²	6	51.3 Å²	51.3	4%	0.037	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	129.1	171.8	-42.9	0	0	0	0	110.2	M482 L560 K574 Q575	M482-T569 HydrophobicContact SD-CG2 3.94Å; L560-T569 HydrophobicContact CD1-CG2 4.26Å; L560-T569 PolarHBondContact O-N 3.28Å; L560-T569 PolarHBondContact O-OG1 2.94Å; T569-K574 CarbonylContact C-O 3.49Å; T569-K574 WeakPolarHBondContact CA-O 3.28Å; T569-Q575 HydrophobicContact CG2-CG 3.87Å; T569-Q575 PolarHBondContact OG1-NE2 2.89Å; T569-Q575 VanDerWaalsContact OG1-NE2 3.12Å
570	L	95.7	Very high	95.4	Very high	3 Å²	3	49.8 Å²	49.8	2%	0.016	25%	0.25	C	S	.	.			trans	-88	168.8	177.9	-57.7	-172.7	0	0	0	112.4	L515 L516 W553 I568 D572 G573 K574 I576	L515-L570 HydrophobicContact CB-CD1 3.66Å; L515-L570 HydrophobicContact CD1-CD1 3.9Å; L515-L570 HydrophobicContact CG-CD1 4.31Å; L516-L570 HydrophobicContact CD2-CD2 4.41Å; W553-L570 HydrophobicContact CZ2-CD2 3.79Å; I568-L570 HydrophobicContact CG2-CD2 4.33Å; L570-D572 PolarHBondContact O-N 3.05Å; L570-G573 PolarHBondContact O-N 2.9Å; L570-K574 PolarHBondContact N-O 3.27Å; L570-I576 HydrophobicContact CD1-CD1 3.77Å; L570-I576 HydrophobicContact CG-CD1 4.2Å
571	A	91.9	Very high	95.4	Very high	30 Å²	30	48.8 Å²	48.8	25%	0.248	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54	-23.5	-178.3	0	0	0	0	0	115.8	P473 Y474	P473-A571 HydrophobicContact CB-CB 3.71Å; P473-A571 HydrophobicContact CG-CB 3.44Å; P473-A571 VanDerWaalsContact CG-CB 3.44Å; Y474-A571 HydrophobicContact CE2-CB 4.33Å; Y474-A571 PolarHBondContact OH-N 3.02Å; Y474-A571 VanDerWaalsContact OH-N 3.12Å
572	D	92.1	Very high	95.4	Very high	77 Å²	77	49.9 Å²	49.9	41%	0.412	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.8	15.3	177.3	77.2	-24.8	0	0	0	113.5	R485 L570 K574	R485-D572 IonicContact NH2-OD2 2.72Å; L570-D572 PolarHBondContact O-N 3.05Å; D572-K574 VanDerWaalsContact C-N 3.28Å; D572-K574 PolarHBondContact O-N 2.69Å; D572-K574 VanDerWaalsContact OD1-CB 3.32Å; D572-K574 WeakPolarHBondContact OD1-CB 3.31Å; D572-K574 WeakPolarHBondContact OD1-CD 3.21Å; D572-K574 WeakPolarHBondContact OD1-CG 3.28Å; D572-K574 PolarHBondContact OD1-N 3.46Å; D572-K574 WeakPolarHBondContact OD2-CD 3.36Å; D572-K574 WeakPolarHBondContact OD2-CE 3.3Å; D572-K574 IonicContact OD2-NZ 2.94Å; D572-K574 PolarHBondContact OD2-NZ 3.19Å
573	G	94.7	Very high	95.4	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	25%	0.253	C	S	.	.	S	Bend	trans	79.2	-2.5	-179.3	0	0	0	0	0	115.1	C484 R485 L570 Q575	C484-G573 CarbonylContact C-O 3.53Å; C484-G573 VanDerWaalsContact CA-O 3.3Å; C484-G573 WeakPolarHBondContact CA-O 3.19Å; R485-G573 PolarHBondContact N-O 3.4Å; L570-G573 PolarHBondContact O-N 2.9Å; G573-Q575 PolarHBondContact O-N 3.46Å
574	K	96.4	Very high	95.6	Very high	40 Å²	40	49 Å²	49	17%	0.174	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.5	131.4	174.9	-71.4	171.2	178.3	135.3	0	110.9	R485 I487 L515 T569 L570 D572	R485-K574 HydrophobicContact CG-CG 4.48Å; R485-K574 CarbonylContact O-C 3.51Å; R485-K574 WeakPolarHBondContact O-CA 3.43Å; I487-K574 HydrophobicContact CD1-CB 4.13Å; I487-K574 HydrophobicContact CD1-CD 4.14Å; I487-K574 HydrophobicContact CD1-CG 4.45Å; I487-K574 HydrophobicContact CG1-CB 4.14Å; I487-K574 HydrophobicContact CG2-CB 4.07Å; I487-K574 HydrophobicContact CG2-CD 4.13Å; I487-K574 HydrophobicContact CG2-CG 3.7Å; L515-K574 HydrophobicContact CD1-CD 4.34Å; L515-K574 HydrophobicContact CD2-CD 3.41Å; L515-K574 VanDerWaalsContact CD2-CD 3.41Å; L515-K574 HydrophobicContact CG-CD 4.49Å; T569-K574 CarbonylContact C-O 3.49Å; T569-K574 WeakPolarHBondContact CA-O 3.28Å; L570-K574 PolarHBondContact N-O 3.27Å; D572-K574 VanDerWaalsContact C-N 3.28Å; D572-K574 PolarHBondContact O-N 2.69Å; D572-K574 VanDerWaalsContact OD1-CB 3.32Å; D572-K574 WeakPolarHBondContact OD1-CB 3.31Å; D572-K574 WeakPolarHBondContact OD1-CD 3.21Å; D572-K574 WeakPolarHBondContact OD1-CG 3.28Å; D572-K574 PolarHBondContact OD1-N 3.46Å; D572-K574 WeakPolarHBondContact OD2-CD 3.36Å; D572-K574 WeakPolarHBondContact OD2-CE 3.3Å; D572-K574 IonicContact OD2-NZ 2.94Å; D572-K574 PolarHBondContact OD2-NZ 3.19Å
575	Q	97.1	Very high	95.7	Very high	37 Å²	37	42.2 Å²	42.2	17%	0.173	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	127.5	175.2	-64	-169	-35.7	0	0	110.9	C484 R485 I487 K567 I568 T569 G573	C484-Q575 HydrophobicContact CB-CG 4.32Å; R485-Q575 PolarHBondContact O-N 2.91Å; I487-Q575 WeakPolarHBondContact CG1-O 3.4Å; I487-Q575 PolarHBondContact N-O 3.42Å; K567-Q575 HydrophobicContact CD-CB 4.46Å; I568-Q575 WeakPolarHBondContact O-CA 3.45Å; T569-Q575 HydrophobicContact CG2-CG 3.87Å; T569-Q575 PolarHBondContact OG1-NE2 2.89Å; T569-Q575 VanDerWaalsContact OG1-NE2 3.12Å; G573-Q575 PolarHBondContact O-N 3.46Å
576	I	96.6	Very high	95.7	Very high	2 Å²	2	39.6 Å²	39.6	1%	0.01	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	140.8	175.5	-59.9	163.2	0	0	0	108.1	I487 L489 L512 L515 K567 I568 L570 E580 L581	I487-I576 HydrophobicContact CD1-CD1 4.31Å; I487-I576 HydrophobicContact CD1-CG1 3.73Å; I487-I576 HydrophobicContact CG1-CG1 3.97Å; L489-I576 HydrophobicContact CD1-CD1 4.21Å; L489-I576 HydrophobicContact CD1-CG1 4.5Å; L489-I576 HydrophobicContact CD1-CG2 3.84Å; L489-I576 HydrophobicContact CD2-CD1 4.15Å; L489-I576 HydrophobicContact CD2-CG1 4.37Å; L489-I576 HydrophobicContact CG-CD1 4.46Å; L489-I576 HydrophobicContact CG-CG1 4.42Å; L489-I576 HydrophobicContact CG-CG2 4.23Å; L512-I576 HydrophobicContact CD1-CD1 3.84Å; L515-I576 HydrophobicContact CD1-CD1 4.07Å; K567-I576 VanDerWaalsContact CA-O 3.28Å; K567-I576 WeakPolarHBondContact CA-O 3.43Å; I568-I576 PolarHBondContact N-O 2.9Å; I568-I576 PolarHBondContact O-N 2.93Å; L570-I576 HydrophobicContact CD1-CD1 3.77Å; L570-I576 HydrophobicContact CG-CD1 4.2Å; I576-E580 HydrophobicContact CG2-CB 3.97Å; I576-L581 HydrophobicContact CG2-CD1 4.4Å; I576-L581 HydrophobicContact CG2-CD2 4.09Å; I576-L581 HydrophobicContact CG2-CG 3.89Å
577	T	96.8	Very high	95.7	Very high	43 Å²	43	35.2 Å²	35.2	26%	0.264	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	154.3	178.7	67.9	0	0	0	0	112.4	Q579 E580 L581	T577-Q579 PolarHBondContact O-N 3.02Å; T577-E580 WeakPolarHBondContact CB-OE2 3.02Å; T577-E580 PolarHBondContact N-OE2 2.77Å; T577-E580 PolarHBondContact O-N 3.07Å; T577-E580 VanDerWaalsContact OG1-CG 3.3Å; T577-E580 WeakPolarHBondContact OG1-CG 3.43Å; T577-E580 PolarHBondContact OG1-N 3.09Å; T577-E580 PolarHBondContact OG1-OE2 3.4Å; T577-L581 PolarHBondContact O-N 2.72Å
578	K	97	Very high	95.7	Very high	30 Å²	30	36.3 Å²	36.3	13%	0.13	20%	0.201	C	C	.	.	H	α-helix	trans	-55.5	-39.2	171.7	-168.1	-165.3	-179.8	-63.1	0	111.2	R566 E580 L581 D582 V590 C591 F594	R566-K578 HydrophobicContact CB-CB 3.99Å; R566-K578 WeakPolarHBondContact O-CB 3.12Å; R566-K578 PolarHBondContact O-N 2.68Å; K578-E580 VanDerWaalsContact C-N 3.34Å; K578-E580 PolarHBondContact O-N 2.85Å; K578-L581 CarbonylContact O-C 3.6Å; K578-L581 PolarHBondContact O-N 3.15Å; K578-D582 IonicContact NZ-OD1 2.73Å; K578-D582 PolarHBondContact NZ-OD1 3.18Å; K578-D582 IonicContact NZ-OD2 3.75Å; K578-D582 PolarHBondContact NZ-OD2 3.33Å; K578-D582 WeakPolarHBondContact O-CB 3.47Å; K578-D582 PolarHBondContact O-N 2.77Å; K578-V590 HydrophobicContact CD-CG1 4.39Å; K578-V590 HydrophobicContact CG-CG1 3.52Å; K578-C591 PolarHBondContact NZ-SG 3.01Å; K578-C591 VanDerWaalsContact NZ-SG 3.44Å; K578-F594 HydrophobicContact CB-CE2 4.12Å; K578-F594 HydrophobicContact CB-CZ 3.91Å; K578-F594 HydrophobicContact CG-CD2 4.25Å; K578-F594 HydrophobicContact CG-CE2 3.81Å; K578-F594 HydrophobicContact CG-CZ 4.06Å
579	Q	95.3	Very high	95.7	Very high	156 Å²	156	36.5 Å²	36.5	73%	0.729	20%	0.202	S	C	*	.	H	α-helix	trans	-64	-36.4	-177.8	-69	176.8	-40.4	0	0	112.9	T577 F583	T577-Q579 PolarHBondContact O-N 3.02Å; Q579-F583 PolarHBondContact O-N 2.65Å
580	E	95.7	Very high	95.7	Very high	21 Å²	21	36.2 Å²	36.2	10%	0.098	20%	0.2	C	C	.	.	H	α-helix	trans	-71.3	-36	174.9	-68.6	164.5	111.7	0	0	112	T488 L489 M508 I576 T577 K578 F583 I584	T488-E580 WeakPolarHBondContact CA-OE1 3.42Å; T488-E580 VanDerWaalsContact CB-OE1 3.29Å; T488-E580 WeakPolarHBondContact CB-OE1 3.47Å; T488-E580 PolarHBondContact OG1-OE1 3.09Å; L489-E580 HydrophobicContact CD1-CB 4.48Å; L489-E580 PolarHBondContact N-OE1 2.68Å; M508-E580 HydrophobicContact CE-CB 3.64Å; M508-E580 HydrophobicContact CE-CG 3.81Å; I576-E580 HydrophobicContact CG2-CB 3.97Å; T577-E580 WeakPolarHBondContact CB-OE2 3.02Å; T577-E580 PolarHBondContact N-OE2 2.77Å; T577-E580 PolarHBondContact O-N 3.07Å; T577-E580 VanDerWaalsContact OG1-CG 3.3Å; T577-E580 WeakPolarHBondContact OG1-CG 3.43Å; T577-E580 PolarHBondContact OG1-N 3.09Å; T577-E580 PolarHBondContact OG1-OE2 3.4Å; K578-E580 VanDerWaalsContact C-N 3.34Å; K578-E580 PolarHBondContact O-N 2.85Å; E580-F583 PolarHBondContact O-N 3.24Å; E580-I584 WeakPolarHBondContact O-CG1 3.48Å; E580-I584 PolarHBondContact O-N 2.68Å
581	L	96.6	Very high	95.8	Very high	10 Å²	10	39.3 Å²	39.3	5%	0.052	22%	0.222	C	C	.	.	H	α-helix	trans	-70.7	-37.5	174.3	-64.7	169.2	0	0	0	111.9	L512 I568 I576 T577 K578 F583 I584 Y585 V590	L512-L581 HydrophobicContact CD2-CD2 4.29Å; I568-L581 HydrophobicContact CB-CD1 4.26Å; I568-L581 HydrophobicContact CD1-CD1 3.49Å; I568-L581 VanDerWaalsContact CD1-CD1 3.49Å; I568-L581 HydrophobicContact CG1-CD1 3.71Å; I576-L581 HydrophobicContact CG2-CD1 4.4Å; I576-L581 HydrophobicContact CG2-CD2 4.09Å; I576-L581 HydrophobicContact CG2-CG 3.89Å; T577-L581 PolarHBondContact O-N 2.72Å; K578-L581 CarbonylContact O-C 3.6Å; K578-L581 PolarHBondContact O-N 3.15Å; L581-F583 PolarHBondContact O-N 3.45Å; L581-I584 PolarHBondContact O-N 3.09Å; L581-Y585 HydrophobicContact CD2-CD2 4.47Å; L581-Y585 HydrophobicContact CD2-CE2 4.35Å; L581-Y585 PolarHBondContact O-N 2.9Å; L581-V590 HydrophobicContact CB-CG1 4.07Å; L581-V590 HydrophobicContact CB-CG2 3.88Å; L581-V590 WeakPolarHBondContact O-CG2 3.31Å
582	D	96.3	Very high	96.1	Very high	33 Å²	33	39.2 Å²	39.2	18%	0.176	22%	0.219	C	C	.	.	H	α-helix	trans	-58	-34	176.5	-73.9	-17.5	0	0	0	111	K578 S586 P587 V590	K578-D582 IonicContact NZ-OD1 2.73Å; K578-D582 PolarHBondContact NZ-OD1 3.18Å; K578-D582 IonicContact NZ-OD2 3.75Å; K578-D582 PolarHBondContact NZ-OD2 3.33Å; K578-D582 WeakPolarHBondContact O-CB 3.47Å; K578-D582 PolarHBondContact O-N 2.77Å; D582-S586 CarbonylContact O-C 3.59Å; D582-S586 VanDerWaalsContact O-C 3.3Å; D582-S586 WeakPolarHBondContact O-CA 3.29Å; D582-S586 PolarHBondContact O-N 3.05Å; D582-S586 VanDerWaalsContact O-N 3.13Å; D582-P587 HydrophobicContact CB-CB 4.48Å; D582-P587 HydrophobicContact CB-CG 4.24Å; D582-V590 WeakPolarHBondContact OD1-CB 3.36Å; D582-V590 WeakPolarHBondContact OD1-CG1 3.36Å
583	F	94.3	Very high	96.4	Very high	60 Å²	60	35.8 Å²	35.8	26%	0.263	20%	0.2	S	C	.	.	H	α-helix	trans	-75.6	-28.8	176.1	-166	-106.7	0	0	0	113.3	F496 V501 H504 R505 M508 Q579 E580 L581	F496-F583 HydrophobicContact CE2-CZ 4.3Å; F496-F583 HydrophobicContact CZ-CE2 4.38Å; F496-F583 HydrophobicContact CZ-CZ 4.41Å; V501-F583 HydrophobicContact CG1-CE2 4.15Å; V501-F583 HydrophobicContact CG1-CZ 4.05Å; H504-F583 HydrophobicContact CB-CE1 4.12Å; H504-F583 HydrophobicContact CB-CZ 4.31Å; H504-F583 AromaticContact CD2-CE1 3.68Å; R505-F583 HydrophobicContact CB-CD1 4.17Å; R505-F583 HydrophobicContact CB-CE1 3.71Å; R505-F583 HydrophobicContact CB-CZ 4.28Å; R505-F583 VanDerWaalsContact CD-O 3.28Å; R505-F583 WeakPolarHBondContact CD-O 3.37Å; R505-F583 WeakPolarHBondContact CG-O 3.15Å; R505-F583 PolarHBondContact NE-O 2.79Å; R505-F583 VanDerWaalsContact NE-O 3.17Å; M508-F583 HydrophobicContact CE-CD1 4.31Å; M508-F583 HydrophobicContact SD-CD1 3.44Å; M508-F583 WeakPolarHBondContact SD-CD1 3.41Å; M508-F583 HydrophobicContact SD-CE1 3.85Å; M508-F583 HydrophobicContact SD-CG 4.39Å; Q579-F583 PolarHBondContact O-N 2.65Å; E580-F583 PolarHBondContact O-N 3.24Å; L581-F583 PolarHBondContact O-N 3.45Å
584	I	95.8	Very high	96.6	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-82.5	-56.8	178.3	-65.6	170.5	0	0	0	110.9	L489 R505 M508 H509 L512 E580 L581 Y682	L489-I584 HydrophobicContact CD1-CD1 3.56Å; R505-I584 PolarHBondContact NE-O 2.81Å; R505-I584 VanDerWaalsContact NE-O 3.15Å; R505-I584 PolarHBondContact NH2-O 3.49Å; M508-I584 HydrophobicContact CB-CD1 3.99Å; M508-I584 HydrophobicContact CB-CG1 4.01Å; M508-I584 WeakPolarHBondContact O-CD1 3.45Å; H509-I584 HydrophobicContact CB-CG2 4.48Å; L512-I584 HydrophobicContact CB-CD1 4.26Å; L512-I584 HydrophobicContact CD2-CD1 3.82Å; L512-I584 HydrophobicContact CD2-CG2 4.18Å; E580-I584 WeakPolarHBondContact O-CG1 3.48Å; E580-I584 PolarHBondContact O-N 2.68Å; L581-I584 PolarHBondContact O-N 3.09Å; I584-Y682 PolarHBondContact O-OH 3.46Å
585	Y	95.7	Very high	96.6	Very high	7 Å²	7	37.4 Å²	37.4	3%	0.027	22%	0.215	C	C	.	.	H	α-helix	trans	-101	4.1	-170.1	-64.1	-66.7	0	0	0	114.8	L512 L581 V675 C678 I679	L512-Y585 HydrophobicContact CD2-CE2 3.68Å; L581-Y585 HydrophobicContact CD2-CD2 4.47Å; L581-Y585 HydrophobicContact CD2-CE2 4.35Å; L581-Y585 PolarHBondContact O-N 2.9Å; Y585-V675 HydrophobicContact CD1-CG1 4.25Å; Y585-V675 HydrophobicContact CE1-CG1 3.89Å; Y585-C678 HydrophobicContact CD1-CB 4.48Å; Y585-C678 PolarHBondContact O-SG 2.96Å; Y585-I679 HydrophobicContact CE1-CG1 4.48Å
586	S	94	Very high	96.7	Very high	43 Å²	43	35.8 Å²	35.8	30%	0.301	21%	0.208	S	C	.	.			trans	71.1	150.8	-165.1	85.5	0	0	0	0	114.3	D582 S588 V590	D582-S586 CarbonylContact O-C 3.59Å; D582-S586 VanDerWaalsContact O-C 3.3Å; D582-S586 WeakPolarHBondContact O-CA 3.29Å; D582-S586 PolarHBondContact O-N 3.05Å; D582-S586 VanDerWaalsContact O-N 3.13Å; S586-S588 VanDerWaalsContact C-N 3.26Å; S586-S588 PolarHBondContact O-N 3.09Å; S586-V590 WeakPolarHBondContact O-CG2 3.48Å; S586-V590 PolarHBondContact O-N 3.45Å
587	P	96.7	Very high	96.7	Very high	78 Å²	78	35.7 Å²	35.7	51%	0.506	21%	0.207	S	C	.	.	H	α-helix	trans	-61.4	-29	-178	-24.2	33.4	0	0	0	114.9	D582 C591	D582-P587 HydrophobicContact CB-CB 4.48Å; D582-P587 HydrophobicContact CB-CG 4.24Å; P587-C591 WeakPolarHBondContact O-CB 3.42Å; P587-C591 PolarHBondContact O-N 3.27Å; P587-C591 PolarHBondContact O-SG 2.64Å
588	S	97.1	Very high	96.7	Very high	83 Å²	83	39.1 Å²	39.1	58%	0.58	22%	0.22	S	C	*	.	H	α-helix	trans	-66.3	-55.5	-177	-166	0	0	0	0	111	S586 V590 C591 S592	S586-S588 VanDerWaalsContact C-N 3.26Å; S586-S588 PolarHBondContact O-N 3.09Å; S588-V590 PolarHBondContact O-N 3.47Å; S588-C591 WeakPolarHBondContact O-CA 3.27Å; S588-C591 WeakPolarHBondContact O-CB 3.36Å; S588-C591 PolarHBondContact O-N 2.91Å; S588-S592 PolarHBondContact O-N 3.38Å; S588-S592 PolarHBondContact O-OG 3.28Å
589	V	97.2	Very high	96.7	Very high	8 Å²	8	40.7 Å²	40.7	5%	0.048	23%	0.23	C	C	.	.	H	α-helix	trans	-62	-34.9	-178.5	-177.6	0	0	0	0	111.5	S592 I593 E674 V675	V589-S592 WeakPolarHBondContact O-CB 3.07Å; V589-S592 PolarHBondContact O-N 2.93Å; V589-I593 HydrophobicContact CG1-CD1 4.36Å; V589-I593 VanDerWaalsContact O-CG1 3.31Å; V589-I593 WeakPolarHBondContact O-CG1 3.43Å; V589-I593 PolarHBondContact O-N 2.92Å; V589-E674 HydrophobicContact CB-CB 4.44Å; V589-E674 HydrophobicContact CG1-CB 3.92Å; V589-E674 HydrophobicContact CG2-CB 3.86Å; V589-E674 HydrophobicContact CG2-CG 4.5Å; V589-V675 HydrophobicContact CG1-CB 4.46Å; V589-V675 HydrophobicContact CG1-CG2 3.41Å; V589-V675 VanDerWaalsContact CG1-CG2 3.41Å
590	V	98	Very high	96.8	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-72.7	-33.7	175.3	-178.9	0	0	0	0	111.9	K578 L581 D582 S586 S588 S592 I593 F594	K578-V590 HydrophobicContact CD-CG1 4.39Å; K578-V590 HydrophobicContact CG-CG1 3.52Å; L581-V590 HydrophobicContact CB-CG1 4.07Å; L581-V590 HydrophobicContact CB-CG2 3.88Å; L581-V590 WeakPolarHBondContact O-CG2 3.31Å; D582-V590 WeakPolarHBondContact OD1-CB 3.36Å; D582-V590 WeakPolarHBondContact OD1-CG1 3.36Å; S586-V590 WeakPolarHBondContact O-CG2 3.48Å; S586-V590 PolarHBondContact O-N 3.45Å; S588-V590 PolarHBondContact O-N 3.47Å; V590-S592 VanDerWaalsContact C-N 3.33Å; V590-I593 PolarHBondContact O-N 3.19Å; V590-F594 HydrophobicContact CG1-CD2 3.84Å; V590-F594 HydrophobicContact CG1-CE2 3.85Å; V590-F594 VanDerWaalsContact O-CD2 3.28Å; V590-F594 WeakPolarHBondContact O-CD2 3.28Å; V590-F594 PolarHBondContact O-N 3.14Å
591	C	97.4	Very high	96.9	Very high	68 Å²	68	35.4 Å²	35.4	46%	0.459	21%	0.207	S	C	.	.	H	α-helix	trans	-63.2	-39.3	167.9	-73.8	0	0	0	0	111.6	K578 P587 S588 F594 S595	K578-C591 PolarHBondContact NZ-SG 3.01Å; K578-C591 VanDerWaalsContact NZ-SG 3.44Å; P587-C591 WeakPolarHBondContact O-CB 3.42Å; P587-C591 PolarHBondContact O-N 3.27Å; P587-C591 PolarHBondContact O-SG 2.64Å; S588-C591 WeakPolarHBondContact O-CA 3.27Å; S588-C591 WeakPolarHBondContact O-CB 3.36Å; S588-C591 PolarHBondContact O-N 2.91Å; C591-F594 PolarHBondContact O-N 3.4Å; C591-S595 WeakPolarHBondContact O-CB 3.38Å; C591-S595 PolarHBondContact O-N 3.35Å
592	S	97.7	Very high	96.9	Very high	28 Å²	28	38.9 Å²	38.9	20%	0.196	23%	0.232	C	C	.	.	H	α-helix	trans	-60.4	-45.3	172.3	-48.2	0	0	0	0	112.1	S588 V589 V590 F594 S595 F596 E674	S588-S592 PolarHBondContact O-N 3.38Å; S588-S592 PolarHBondContact O-OG 3.28Å; V589-S592 WeakPolarHBondContact O-CB 3.07Å; V589-S592 PolarHBondContact O-N 2.93Å; V590-S592 VanDerWaalsContact C-N 3.33Å; S592-F594 PolarHBondContact O-N 3.28Å; S592-S595 PolarHBondContact O-N 3.31Å; S592-F596 VanDerWaalsContact O-CB 3.28Å; S592-F596 WeakPolarHBondContact O-CB 3.34Å; S592-F596 PolarHBondContact O-N 2.94Å; S592-E674 WeakPolarHBondContact CB-OE2 3.44Å; S592-E674 PolarHBondContact OG-OE2 2.99Å
593	I	98.2	Very high	96.9	Very high	4 Å²	4	37.9 Å²	37.9	2%	0.021	23%	0.227	C	C	.	.	H	α-helix	trans	-57.1	-48.4	175	-73.8	165.4	0	0	0	111.6	F550 L554 I561 I568 V589 V590 S597 V671 V675	F550-I593 HydrophobicContact CZ-CD1 3.92Å; F550-I593 HydrophobicContact CZ-CG1 4.18Å; L554-I593 HydrophobicContact CD1-CG2 3.89Å; L554-I593 HydrophobicContact CD2-CG1 4.35Å; I561-I593 HydrophobicContact CD1-CG2 4.11Å; I568-I593 HydrophobicContact CD1-CG2 3.88Å; V589-I593 HydrophobicContact CG1-CD1 4.36Å; V589-I593 VanDerWaalsContact O-CG1 3.31Å; V589-I593 WeakPolarHBondContact O-CG1 3.43Å; V589-I593 PolarHBondContact O-N 2.92Å; V590-I593 PolarHBondContact O-N 3.19Å; I593-S597 PolarHBondContact O-N 3.2Å; I593-V671 HydrophobicContact CB-CG1 4.47Å; I593-V671 HydrophobicContact CG1-CG1 3.52Å; I593-V675 HydrophobicContact CD1-CG2 4.3Å
594	F	98.1	Very high	97	Very high	15 Å²	15	40.4 Å²	40.4	7%	0.066	25%	0.247	C	C	.	.	H	α-helix	trans	-69.8	-42.7	-178.8	-86.6	-107.1	0	0	0	111.9	I561 T563 I568 K578 V590 C591 S592 S597 E598	I561-F594 HydrophobicContact CG2-CD1 3.72Å; I561-F594 HydrophobicContact CG2-CD2 4.4Å; I561-F594 HydrophobicContact CG2-CE1 3.64Å; I561-F594 HydrophobicContact CG2-CE2 4.36Å; I561-F594 HydrophobicContact CG2-CG 4.12Å; I561-F594 HydrophobicContact CG2-CZ 3.99Å; T563-F594 HydrophobicContact CG2-CD1 4.27Å; I568-F594 HydrophobicContact CD1-CE2 4.04Å; I568-F594 HydrophobicContact CG1-CE2 3.89Å; I568-F594 HydrophobicContact CG1-CZ 3.91Å; K578-F594 HydrophobicContact CB-CE2 4.12Å; K578-F594 HydrophobicContact CB-CZ 3.91Å; K578-F594 HydrophobicContact CG-CD2 4.25Å; K578-F594 HydrophobicContact CG-CE2 3.81Å; K578-F594 HydrophobicContact CG-CZ 4.06Å; V590-F594 HydrophobicContact CG1-CD2 3.84Å; V590-F594 HydrophobicContact CG1-CE2 3.85Å; V590-F594 VanDerWaalsContact O-CD2 3.28Å; V590-F594 WeakPolarHBondContact O-CD2 3.28Å; V590-F594 PolarHBondContact O-N 3.14Å; C591-F594 PolarHBondContact O-N 3.4Å; S592-F594 PolarHBondContact O-N 3.28Å; F594-S597 PolarHBondContact O-N 3.19Å; F594-S597 VanDerWaalsContact O-N 3.15Å; F594-S597 PolarHBondContact O-OG 2.94Å; F594-E598 PolarHBondContact O-N 2.92Å; F594-E598 VanDerWaalsContact O-N 3.08Å
595	S	97.4	Very high	97	Very high	59 Å²	59	41 Å²	41	41%	0.413	25%	0.25	S	S	.	.	H	α-helix	trans	-64.4	-40.4	176.3	-178.1	0	0	0	0	112.3	C591 S592 S597 E598 N599	C591-S595 WeakPolarHBondContact O-CB 3.38Å; C591-S595 PolarHBondContact O-N 3.35Å; S592-S595 PolarHBondContact O-N 3.31Å; S595-S597 VanDerWaalsContact C-N 3.32Å; S595-S597 PolarHBondContact O-N 2.91Å; S595-E598 PolarHBondContact O-N 3.08Å; S595-N599 PolarHBondContact O-N 2.94Å; S595-N599 PolarHBondContact O-ND2 3.36Å
596	F	98.3	Very high	97.1	Very high	4 Å²	4	43.3 Å²	43.3	2%	0.018	26%	0.263	C	S	.	.	H	α-helix	trans	-58.2	-44.1	170.9	171.2	-94.3	0	0	0	111.7	L554 V555 S592 E598 N599 F600 V664 Q667 V668 V671	L554-F596 HydrophobicContact CD1-CD1 4.06Å; L554-F596 HydrophobicContact CD1-CE1 4.46Å; L554-F596 HydrophobicContact CD2-CD1 3.76Å; L554-F596 HydrophobicContact CD2-CE1 4.22Å; L554-F596 HydrophobicContact CD2-CG 4.36Å; L554-F596 HydrophobicContact CG-CD1 3.64Å; L554-F596 HydrophobicContact CG-CE1 3.78Å; V555-F596 HydrophobicContact CG2-CZ 4.06Å; S592-F596 VanDerWaalsContact O-CB 3.28Å; S592-F596 WeakPolarHBondContact O-CB 3.34Å; S592-F596 PolarHBondContact O-N 2.94Å; F596-E598 VanDerWaalsContact C-N 3.33Å; F596-E598 PolarHBondContact O-N 3.44Å; F596-N599 PolarHBondContact O-N 3.05Å; F596-F600 HydrophobicContact CE1-CB 4.15Å; F596-F600 HydrophobicContact CE1-CG 4.42Å; F596-F600 HydrophobicContact CZ-CB 4.08Å; F596-F600 AromaticContact CZ-CD2 3.91Å; F596-F600 HydrophobicContact CZ-CD2 3.91Å; F596-F600 HydrophobicContact CZ-CG 4.21Å; F596-F600 VanDerWaalsContact O-CB 3.31Å; F596-F600 WeakPolarHBondContact O-CB 3.43Å; F596-F600 PolarHBondContact O-N 3.39Å; F596-V664 HydrophobicContact CE2-CB 3.98Å; F596-V664 WeakPolarHBondContact CE2-O 3.48Å; F596-Q667 HydrophobicContact CD2-CB 4.06Å; F596-Q667 HydrophobicContact CE2-CB 4.47Å; F596-V668 HydrophobicContact CD2-CB 4.32Å; F596-V668 HydrophobicContact CE1-CG2 4.19Å; F596-V668 HydrophobicContact CE2-CB 3.65Å; F596-V668 HydrophobicContact CE2-CG2 4.17Å; F596-V668 HydrophobicContact CZ-CB 3.79Å; F596-V668 HydrophobicContact CZ-CG2 3.87Å; F596-V671 HydrophobicContact CB-CG2 4.22Å
597	S	97.9	Very high	97.3	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-63.6	-38	-179.3	77.7	0	0	0	0	112.8	I561 I593 F594 S595 N601	I561-S597 VanDerWaalsContact CG2-OG 3.3Å; I561-S597 WeakPolarHBondContact CG2-OG 3.08Å; I593-S597 PolarHBondContact O-N 3.2Å; F594-S597 PolarHBondContact O-N 3.19Å; F594-S597 VanDerWaalsContact O-N 3.15Å; F594-S597 PolarHBondContact O-OG 2.94Å; S595-S597 VanDerWaalsContact C-N 3.32Å; S595-S597 PolarHBondContact O-N 2.91Å; S597-N601 VanDerWaalsContact O-CB 3.23Å; S597-N601 WeakPolarHBondContact O-CB 3.42Å; S597-N601 PolarHBondContact O-N 3.49Å; S597-N601 PolarHBondContact O-ND2 2.91Å; S597-N601 VanDerWaalsContact O-ND2 3.11Å
598	E	96.7	Very high	97.3	Very high	115 Å²	115	39.4 Å²	39.4	54%	0.537	24%	0.235	S	C	.	.	H	α-helix	trans	-66.2	-49.1	175.1	-174	166	-147.2	0	0	111.3	T563 F594 S595 F596 F600 N601 S602	T563-E598 HydrophobicContact CG2-CB 4.28Å; F594-E598 PolarHBondContact O-N 2.92Å; F594-E598 VanDerWaalsContact O-N 3.08Å; S595-E598 PolarHBondContact O-N 3.08Å; F596-E598 VanDerWaalsContact C-N 3.33Å; F596-E598 PolarHBondContact O-N 3.44Å; E598-F600 VanDerWaalsContact C-N 3.34Å; E598-F600 PolarHBondContact O-N 3.03Å; E598-N601 PolarHBondContact O-N 2.85Å; E598-S602 WeakPolarHBondContact O-CB 3.31Å; E598-S602 PolarHBondContact O-N 3.25Å
599	N	96.7	Very high	97.4	Very high	62 Å²	62	35.4 Å²	35.4	33%	0.332	21%	0.207	S	C	.	.	H	α-helix	trans	-56.5	-45.8	174.7	-72.2	-18.9	0	0	0	111.9	S595 F596 S602 V664 Q667	S595-N599 PolarHBondContact O-N 2.94Å; S595-N599 PolarHBondContact O-ND2 3.36Å; F596-N599 PolarHBondContact O-N 3.05Å; N599-S602 PolarHBondContact O-OG 3.48Å; N599-V664 HydrophobicContact CB-CG1 4.41Å; N599-Q667 PolarHBondContact ND2-OE1 3.05Å
600	F	98.1	Very high	97.4	Very high	6 Å²	6	35.1 Å²	35.1	3%	0.026	21%	0.205	C	C	.	.	H	α-helix	trans	-68.4	-46	-178.9	-174.6	-90.2	0	0	0	112.2	V555 S558 F596 E598 S602 L603 L605 V610 V664	V555-F600 HydrophobicContact CG1-CE2 4.04Å; V555-F600 HydrophobicContact CG1-CZ 3.8Å; V555-F600 HydrophobicContact CG2-CE2 4.47Å; S558-F600 WeakPolarHBondContact OG-CD1 3.43Å; S558-F600 WeakPolarHBondContact OG-CE1 3.48Å; F596-F600 HydrophobicContact CE1-CB 4.15Å; F596-F600 HydrophobicContact CE1-CG 4.42Å; F596-F600 HydrophobicContact CZ-CB 4.08Å; F596-F600 AromaticContact CZ-CD2 3.91Å; F596-F600 HydrophobicContact CZ-CD2 3.91Å; F596-F600 HydrophobicContact CZ-CG 4.21Å; F596-F600 VanDerWaalsContact O-CB 3.31Å; F596-F600 WeakPolarHBondContact O-CB 3.43Å; F596-F600 PolarHBondContact O-N 3.39Å; E598-F600 VanDerWaalsContact C-N 3.34Å; E598-F600 PolarHBondContact O-N 3.03Å; F600-S602 PolarHBondContact O-N 2.94Å; F600-L603 WeakPolarHBondContact O-CB 3.34Å; F600-L603 PolarHBondContact O-N 2.91Å; F600-L603 VanDerWaalsContact O-N 3.14Å; F600-L605 HydrophobicContact CE2-CD1 4.09Å; F600-L605 HydrophobicContact CZ-CD1 4Å; F600-V610 HydrophobicContact CE1-CG2 4.31Å; F600-V610 HydrophobicContact CZ-CG1 4.43Å; F600-V610 HydrophobicContact CZ-CG2 4.15Å; F600-V664 HydrophobicContact CD2-CB 4.32Å; F600-V664 HydrophobicContact CD2-CG2 3.96Å; F600-V664 HydrophobicContact CE2-CG2 4.43Å
601	N	96.7	Very high	97.5	Very high	60 Å²	60	35.1 Å²	35.1	32%	0.321	21%	0.205	S	C	.	.	H	α-helix	trans	-63.8	-30.5	178.7	-73.3	-27.7	0	0	0	112.1	S558 S597 E598 L603 V604	S558-N601 PolarHBondContact O-ND2 3.45Å; S597-N601 VanDerWaalsContact O-CB 3.23Å; S597-N601 WeakPolarHBondContact O-CB 3.42Å; S597-N601 PolarHBondContact O-N 3.49Å; S597-N601 PolarHBondContact O-ND2 2.91Å; S597-N601 VanDerWaalsContact O-ND2 3.11Å; E598-N601 PolarHBondContact O-N 2.85Å; N601-L603 PolarHBondContact O-N 3.42Å; N601-L603 VanDerWaalsContact O-N 3.13Å; N601-V604 PolarHBondContact O-N 3.35Å; N601-V604 VanDerWaalsContact O-N 3.1Å
602	S	96.6	Very high	97.5	Very high	83 Å²	83	31.9 Å²	31.9	58%	0.58	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-20.3	175.4	82	0	0	0	0	114.3	E598 N599 F600 V604	E598-S602 WeakPolarHBondContact O-CB 3.31Å; E598-S602 PolarHBondContact O-N 3.25Å; N599-S602 PolarHBondContact O-OG 3.48Å; F600-S602 PolarHBondContact O-N 2.94Å; S602-V604 VanDerWaalsContact C-N 3.32Å
603	L	96.5	Very high	97.5	Very high	12 Å²	12	30.6 Å²	30.6	6%	0.063	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82	-9.4	179.2	-51.6	-175.6	0	0	0	113.4	F600 N601 L605 L657 Q660 V661 V664	F600-L603 WeakPolarHBondContact O-CB 3.34Å; F600-L603 PolarHBondContact O-N 2.91Å; F600-L603 VanDerWaalsContact O-N 3.14Å; N601-L603 PolarHBondContact O-N 3.42Å; N601-L603 VanDerWaalsContact O-N 3.13Å; L603-L605 VanDerWaalsContact C-N 3.26Å; L603-L605 HydrophobicContact CB-CD1 4.46Å; L603-L605 HydrophobicContact CB-CD2 4.08Å; L603-L605 HydrophobicContact CB-CG 3.89Å; L603-L605 PolarHBondContact O-N 3.5Å; L603-L605 VanDerWaalsContact O-N 3.16Å; L603-L657 HydrophobicContact CB-CD1 4.19Å; L603-L657 HydrophobicContact CD2-CD1 4.17Å; L603-Q660 HydrophobicContact CD2-CB 3.76Å; L603-V661 HydrophobicContact CD1-CG2 3.96Å; L603-V664 HydrophobicContact CD1-CG1 4.08Å; L603-V664 HydrophobicContact CD1-CG2 3.7Å
604	V	95.9	Very high	97.6	Very high	114 Å²	114	30.4 Å²	30.4	69%	0.691	17%	0.174	S	C	*	.			trans	46.3	48	176.6	-159.9	0	0	0	0	112.6	N601 S602 R651	N601-V604 PolarHBondContact O-N 3.35Å; N601-V604 VanDerWaalsContact O-N 3.1Å; S602-V604 VanDerWaalsContact C-N 3.32Å; V604-R651 PolarHBondContact O-NH2 2.82Å
605	L	96.8	Very high	97.6	Very high	13 Å²	13	29.7 Å²	29.7	7%	0.068	17%	0.17	C	C	.	.			trans	-74.6	140.8	-178	-60.2	-176.5	0	0	0	111.6	F600 L603 E609 V610 L647 V661	F600-L605 HydrophobicContact CE2-CD1 4.09Å; F600-L605 HydrophobicContact CZ-CD1 4Å; L603-L605 VanDerWaalsContact C-N 3.26Å; L603-L605 HydrophobicContact CB-CD1 4.46Å; L603-L605 HydrophobicContact CB-CD2 4.08Å; L603-L605 HydrophobicContact CB-CG 3.89Å; L603-L605 PolarHBondContact O-N 3.5Å; L603-L605 VanDerWaalsContact O-N 3.16Å; L605-E609 WeakPolarHBondContact CA-OE2 3.34Å; L605-E609 HydrophobicContact CB-CB 3.98Å; L605-E609 HydrophobicContact CD2-CB 4.15Å; L605-E609 HydrophobicContact CG-CB 4.44Å; L605-V610 HydrophobicContact CB-CG2 3.87Å; L605-L647 HydrophobicContact CD2-CD2 4.16Å; L605-V661 HydrophobicContact CD1-CG2 4.34Å; L605-V661 HydrophobicContact CD2-CG2 4.14Å
606	N	96.8	Very high	97.6	Very high	55 Å²	55	26.9 Å²	26.9	29%	0.294	15%	0.151	S	C	.	.			trans	-84.2	164.4	172.8	62	64.2	0	0	0	112	T608 E609 V610	N606-T608 PolarHBondContact O-N 3.02Å; N606-T608 WeakPolarHBondContact OD1-CB 3.13Å; N606-T608 PolarHBondContact OD1-N 2.62Å; N606-T608 VanDerWaalsContact OD1-N 3.15Å; N606-E609 PolarHBondContact N-OE2 2.98Å; N606-E609 VanDerWaalsContact N-OE2 3.09Å; N606-E609 PolarHBondContact ND2-OE1 2.81Å; N606-E609 VanDerWaalsContact ND2-OE1 3.08Å; N606-E609 PolarHBondContact ND2-OE2 3.26Å; N606-E609 VanDerWaalsContact ND2-OE2 3.09Å; N606-E609 WeakPolarHBondContact O-CA 3.39Å; N606-E609 WeakPolarHBondContact O-CB 3.49Å; N606-E609 PolarHBondContact O-N 3.42Å; N606-E609 PolarHBondContact OD1-N 3.29Å; N606-V610 WeakPolarHBondContact O-CG2 3.46Å; N606-V610 PolarHBondContact O-N 3.46Å
607	D	97.8	Very high	97.6	Very high	13 Å²	13	26.7 Å²	26.7	7%	0.07	15%	0.15	C	C	.	.	H	α-helix	trans	-46.5	-36.7	-179.8	-78.9	-16.3	0	0	0	114.4	Y468 Q469 T475 D476 R559 A611	Y468-D607 HydrophobicContact CD1-CB 4.23Å; Y468-D607 HydrophobicContact CE1-CB 4.17Å; Q469-D607 PolarHBondContact NE2-OD2 3.27Å; T475-D607 WeakPolarHBondContact CA-OD1 3.22Å; D476-D607 WeakPolarHBondContact CB-OD2 3.44Å; D476-D607 PolarHBondContact N-OD1 2.96Å; D476-D607 VanDerWaalsContact N-OD1 3.09Å; D476-D607 PolarHBondContact N-OD2 3.13Å; R559-D607 IonicContact CZ-OD1 2.72Å; R559-D607 IonicContact NH1-OD1 2.67Å; R559-D607 PolarHBondContact NH1-OD1 3.38Å; R559-D607 IonicContact NH2-OD1 2.91Å; D607-A611 WeakPolarHBondContact O-CB 3.3Å; D607-A611 PolarHBondContact O-N 3.31Å
608	T	98.1	Very high	97.6	Very high	25 Å²	25	26.7 Å²	26.7	15%	0.153	15%	0.15	C	C	.	.	H	α-helix	trans	-73.7	-37.4	179.5	-60.3	0	0	0	0	112.2	I461 S465 N606 L612 Q646	I461-T608 HydrophobicContact CG2-CG2 3.68Å; S465-T608 PolarHBondContact OG-OG1 2.8Å; N606-T608 PolarHBondContact O-N 3.02Å; N606-T608 WeakPolarHBondContact OD1-CB 3.13Å; N606-T608 PolarHBondContact OD1-N 2.62Å; N606-T608 VanDerWaalsContact OD1-N 3.15Å; T608-L612 HydrophobicContact CG2-CD1 4.03Å; T608-L612 WeakPolarHBondContact O-CB 3.45Å; T608-L612 WeakPolarHBondContact O-CD1 3.49Å; T608-L612 VanDerWaalsContact O-CG 3.28Å; T608-L612 WeakPolarHBondContact O-CG 3.33Å; T608-L612 PolarHBondContact O-N 3.47Å; T608-Q646 HydrophobicContact CG2-CG 4.19Å
609	E	98	Very high	97.7	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-70.2	-40.4	175.7	-69.4	160.7	177.6	0	0	111	L605 N606 L612 C613 Q646 L647 N650 R651	L605-E609 WeakPolarHBondContact CA-OE2 3.34Å; L605-E609 HydrophobicContact CB-CB 3.98Å; L605-E609 HydrophobicContact CD2-CB 4.15Å; L605-E609 HydrophobicContact CG-CB 4.44Å; N606-E609 PolarHBondContact N-OE2 2.98Å; N606-E609 VanDerWaalsContact N-OE2 3.09Å; N606-E609 PolarHBondContact ND2-OE1 2.81Å; N606-E609 VanDerWaalsContact ND2-OE1 3.08Å; N606-E609 PolarHBondContact ND2-OE2 3.26Å; N606-E609 VanDerWaalsContact ND2-OE2 3.09Å; N606-E609 WeakPolarHBondContact O-CA 3.39Å; N606-E609 WeakPolarHBondContact O-CB 3.49Å; N606-E609 PolarHBondContact O-N 3.42Å; N606-E609 PolarHBondContact OD1-N 3.29Å; E609-L612 PolarHBondContact O-N 3.03Å; E609-C613 PolarHBondContact O-N 3.43Å; E609-C613 PolarHBondContact O-SG 3.44Å; E609-Q646 HydrophobicContact CG-CG 4.01Å; E609-L647 HydrophobicContact CG-CD2 4Å; E609-N650 PolarHBondContact OE1-ND2 3.29Å; E609-R651 IonicContact OE1-CZ 2.77Å; E609-R651 IonicContact OE1-NH1 3.57Å; E609-R651 PolarHBondContact OE1-NH1 3.28Å; E609-R651 IonicContact OE1-NH2 2.68Å; E609-R651 IonicContact OE2-CZ 2.62Å; E609-R651 IonicContact OE2-NH1 3.19Å; E609-R651 PolarHBondContact OE2-NH1 2.78Å; E609-R651 IonicContact OE2-NH2 2.88Å; E609-R651 PolarHBondContact OE2-NH2 3.46Å
610	V	98.3	Very high	97.6	Very high	1 Å²	1	18.7 Å²	18.7	1%	0.006	11%	0.11	C	C	.	.	H	α-helix	trans	-62.4	-43.7	172.6	179.7	0	0	0	0	110.9	Y468 V555 F600 L605 N606 L612 C613 C614	Y468-V610 HydrophobicContact CE2-CG1 4.12Å; Y468-V610 WeakPolarHBondContact OH-CG1 3.19Å; V555-V610 HydrophobicContact CG1-CG1 4.05Å; F600-V610 HydrophobicContact CE1-CG2 4.31Å; F600-V610 HydrophobicContact CZ-CG1 4.43Å; F600-V610 HydrophobicContact CZ-CG2 4.15Å; L605-V610 HydrophobicContact CB-CG2 3.87Å; N606-V610 WeakPolarHBondContact O-CG2 3.46Å; N606-V610 PolarHBondContact O-N 3.46Å; V610-L612 PolarHBondContact O-N 2.92Å; V610-C613 WeakPolarHBondContact O-CB 3.36Å; V610-C613 PolarHBondContact O-N 2.88Å; V610-C614 PolarHBondContact O-N 3.34Å; V610-C614 PolarHBondContact O-SG 3.22Å
611	A	98.5	Very high	97.6	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-59.3	-44.1	175.9	0	0	0	0	0	112.9	I464 Y468 D607 C614 A615	I464-A611 HydrophobicContact CG2-CB 3.79Å; I464-A611 WeakPolarHBondContact CG2-O 3.34Å; Y468-A611 HydrophobicContact CD1-CB 4.23Å; Y468-A611 HydrophobicContact CD2-CB 3.78Å; Y468-A611 HydrophobicContact CG-CB 3.55Å; D607-A611 WeakPolarHBondContact O-CB 3.3Å; D607-A611 PolarHBondContact O-N 3.31Å; A611-C614 WeakPolarHBondContact O-CB 3.48Å; A611-C614 PolarHBondContact O-N 2.86Å; A611-A615 PolarHBondContact O-N 2.95Å
612	L	98.5	Very high	97.5	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-68.8	-34.6	177.8	-73.2	162.5	0	0	0	112.1	I461 I464 T608 E609 V610 A615 A616 A642 L643 Q646	I461-L612 HydrophobicContact CG1-CD1 4.02Å; I461-L612 HydrophobicContact CG1-CD2 4.34Å; I461-L612 HydrophobicContact CG2-CD1 4.31Å; I464-L612 HydrophobicContact CB-CD2 4.31Å; I464-L612 HydrophobicContact CD1-CD2 3.89Å; I464-L612 HydrophobicContact CG2-CD2 4.11Å; I464-L612 HydrophobicContact CG2-CG 4.3Å; T608-L612 HydrophobicContact CG2-CD1 4.03Å; T608-L612 WeakPolarHBondContact O-CB 3.45Å; T608-L612 WeakPolarHBondContact O-CD1 3.49Å; T608-L612 VanDerWaalsContact O-CG 3.28Å; T608-L612 WeakPolarHBondContact O-CG 3.33Å; T608-L612 PolarHBondContact O-N 3.47Å; E609-L612 PolarHBondContact O-N 3.03Å; V610-L612 PolarHBondContact O-N 2.92Å; L612-A615 PolarHBondContact O-N 3.04Å; L612-A616 PolarHBondContact O-N 3.39Å; L612-A642 HydrophobicContact CD2-CB 3.94Å; L612-L643 HydrophobicContact CB-CB 4.02Å; L612-L643 HydrophobicContact CB-CD1 3.76Å; L612-L643 HydrophobicContact CB-CG 4.39Å; L612-Q646 HydrophobicContact CD1-CB 3.85Å; L612-Q646 HydrophobicContact CD1-CG 4.02Å
613	C	98.3	Very high	97.4	Very high	1 Å²	1	20 Å²	20	1%	0.007	11%	0.111	C	C	.	.	H	α-helix	trans	-63.3	-45.1	169.1	-65.2	0	0	0	0	111.5	E609 V610 A615 A616 V617 I665	E609-C613 PolarHBondContact O-N 3.43Å; E609-C613 PolarHBondContact O-SG 3.44Å; V610-C613 WeakPolarHBondContact O-CB 3.36Å; V610-C613 PolarHBondContact O-N 2.88Å; C613-A615 VanDerWaalsContact C-N 3.32Å; C613-A615 PolarHBondContact O-N 3.36Å; C613-A616 PolarHBondContact O-N 3.12Å; C613-V617 WeakPolarHBondContact O-CB 3.28Å; C613-V617 VanDerWaalsContact O-CG2 3.32Å; C613-V617 WeakPolarHBondContact O-CG2 3.47Å; C613-V617 PolarHBondContact O-N 3.49Å; C613-I665 HydrophobicContact CB-CD1 4.46Å
614	C	98.5	Very high	97.2	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-58.7	-43.2	175.9	-65.5	0	0	0	0	111.8	F526 V552 V610 A611 V617 I618	F526-C614 HydrophobicContact CE1-CB 3.66Å; F526-C614 HydrophobicContact CZ-CB 4.05Å; V552-C614 HydrophobicContact CG1-CB 4.17Å; V610-C614 PolarHBondContact O-N 3.34Å; V610-C614 PolarHBondContact O-SG 3.22Å; A611-C614 WeakPolarHBondContact O-CB 3.48Å; A611-C614 PolarHBondContact O-N 2.86Å; C614-V617 PolarHBondContact O-N 2.76Å; C614-I618 WeakPolarHBondContact O-CG1 3.28Å; C614-I618 PolarHBondContact O-N 3.35Å
615	A	98.5	Very high	97.2	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-63.8	-46.2	178.2	0	0	0	0	0	112.2	I464 I530 A611 L612 C613 V617 I618 T619	I464-A615 HydrophobicContact CD1-CB 3.85Å; I464-A615 HydrophobicContact CG1-CB 4.46Å; I464-A615 HydrophobicContact CG2-CB 4.14Å; I530-A615 HydrophobicContact CD1-CB 4.07Å; I530-A615 HydrophobicContact CG1-CB 4.49Å; I530-A615 HydrophobicContact CG2-CB 4.46Å; A611-A615 PolarHBondContact O-N 2.95Å; L612-A615 PolarHBondContact O-N 3.04Å; C613-A615 VanDerWaalsContact C-N 3.32Å; C613-A615 PolarHBondContact O-N 3.36Å; A615-V617 PolarHBondContact O-N 2.96Å; A615-I618 PolarHBondContact O-N 3.1Å; A615-T619 PolarHBondContact O-N 2.95Å; A615-T619 VanDerWaalsContact O-N 3.09Å; A615-T619 PolarHBondContact O-OG1 3.37Å; A615-T619 VanDerWaalsContact O-OG1 3.07Å
616	A	98.1	Very high	97.2	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-67	-21.6	176.4	0	0	0	0	0	114	L612 C613 Q636 L640	L612-A616 PolarHBondContact O-N 3.39Å; C613-A616 PolarHBondContact O-N 3.12Å; A616-Q636 PolarHBondContact O-NE2 3.06Å; A616-L640 HydrophobicContact CB-CD2 3.77Å; A616-L640 HydrophobicContact CB-CG 4.19Å
617	V	98.1	Very high	97.2	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-78	-38.7	173	156.5	0	0	0	0	112.2	A548 E551 V552 C613 C614 A615 R623 I665 V668	A548-V617 HydrophobicContact CB-CG1 4.46Å; E551-V617 HydrophobicContact CB-CG1 3.5Å; E551-V617 WeakPolarHBondContact OE2-CG1 3.42Å; V552-V617 HydrophobicContact CG2-CG1 3.7Å; C613-V617 WeakPolarHBondContact O-CB 3.28Å; C613-V617 VanDerWaalsContact O-CG2 3.32Å; C613-V617 WeakPolarHBondContact O-CG2 3.47Å; C613-V617 PolarHBondContact O-N 3.49Å; C614-V617 PolarHBondContact O-N 2.76Å; A615-V617 PolarHBondContact O-N 2.96Å; V617-R623 PolarHBondContact O-NH2 3.23Å; V617-R623 VanDerWaalsContact O-NH2 3.14Å; V617-I665 HydrophobicContact CG2-CG2 4.33Å; V617-V668 HydrophobicContact CG2-CG1 4.01Å
618	I	98.2	Very high	97.1	Very high	1 Å²	1	28.9 Å²	28.9	1%	0.005	15%	0.153	C	C	.	.	H	α-helix	trans	-66.8	-46	175.6	-70.9	163.6	0	0	0	110.6	F526 A527 I530 F533 L544 A548 V552 C614 A615 K620	F526-I618 HydrophobicContact CD1-CD1 3.76Å; F526-I618 HydrophobicContact CE1-CD1 3.82Å; A527-I618 HydrophobicContact CB-CD1 4.33Å; I530-I618 HydrophobicContact CD1-CB 4.3Å; I530-I618 HydrophobicContact CD1-CD1 3.61Å; I530-I618 HydrophobicContact CD1-CG2 4.29Å; F533-I618 HydrophobicContact CD2-CG2 4.02Å; F533-I618 HydrophobicContact CE2-CG2 3.64Å; L544-I618 WeakPolarHBondContact CD2-O 3.33Å; A548-I618 HydrophobicContact CB-CB 4.48Å; A548-I618 HydrophobicContact CB-CG1 4.12Å; V552-I618 HydrophobicContact CG2-CD1 3.9Å; V552-I618 HydrophobicContact CG2-CG1 3.49Å; V552-I618 VanDerWaalsContact CG2-CG1 3.49Å; C614-I618 WeakPolarHBondContact O-CG1 3.28Å; C614-I618 PolarHBondContact O-N 3.35Å; A615-I618 PolarHBondContact O-N 3.1Å; I618-K620 PolarHBondContact O-N 3.24Å; I618-K620 VanDerWaalsContact O-N 3.14Å
619	T	97.6	Very high	97	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.4	28.5	-173.4	57.8	0	0	0	0	114.3	F533 A615 P621 V632 I635 Q636 H639	F533-T619 HydrophobicContact CD2-CG2 4.41Å; A615-T619 PolarHBondContact O-N 2.95Å; A615-T619 VanDerWaalsContact O-N 3.09Å; A615-T619 PolarHBondContact O-OG1 3.37Å; A615-T619 VanDerWaalsContact O-OG1 3.07Å; T619-P621 WeakPolarHBondContact O-CD 3.34Å; T619-V632 WeakPolarHBondContact O-CG1 3.38Å; T619-I635 HydrophobicContact CG2-CG2 3.85Å; T619-Q636 VanDerWaalsContact O-CB 3.25Å; T619-Q636 WeakPolarHBondContact O-CB 3.44Å; T619-Q636 WeakPolarHBondContact O-CG 3.32Å; T619-Q636 WeakPolarHBondContact OG1-CA 3.47Å; T619-H639 PolarHBondContact OG1-CD2 2.91Å
620	K	96.4	Very high	97	Very high	8 Å²	8	36.4 Å²	36.4	4%	0.035	19%	0.194	C	C	.	.			trans	-65.9	120.9	176.7	-84.1	172	179.3	172.3	0	111.5	L544 E551 I618 N622 R623 Q636 I665 T669	L544-K620 WeakPolarHBondContact CD2-O 3.34Å; E551-K620 IonicContact OE2-NZ 2.76Å; E551-K620 PolarHBondContact OE2-NZ 3.22Å; I618-K620 PolarHBondContact O-N 3.24Å; I618-K620 VanDerWaalsContact O-N 3.14Å; K620-N622 VanDerWaalsContact C-N 3.29Å; K620-N622 PolarHBondContact O-N 3.36Å; K620-R623 WeakPolarHBondContact O-CG 3.35Å; K620-Q636 VanDerWaalsContact CG-NE2 3.29Å; K620-I665 WeakPolarHBondContact CE-O 3.3Å; K620-I665 PolarHBondContact NZ-O 3.15Å; K620-T669 PolarHBondContact NZ-OG1 2.94Å
621	P	96.9	Very high	96.9	Very high	37 Å²	37	39.3 Å²	39.3	24%	0.24	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-5.3	-175.9	32.7	-37.4	0	0	0	114.6	T619 P629 V632 A633	T619-P621 WeakPolarHBondContact O-CD 3.34Å; P621-P629 WeakPolarHBondContact CB-O 3.45Å; P621-V632 HydrophobicContact CB-CB 4.25Å; P621-V632 HydrophobicContact CB-CG1 4.05Å; P621-A633 HydrophobicContact CB-CB 3.73Å; P621-A633 HydrophobicContact CG-CB 3.85Å
622	N	94.1	Very high	96.9	Very high	115 Å²	115	39.3 Å²	39.3	62%	0.615	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94.1	14.3	179.3	68.4	-44.5	0	0	0	113.6	K620	K620-N622 VanDerWaalsContact C-N 3.29Å; K620-N622 PolarHBondContact O-N 3.36Å
623	R	94.7	Very high	96.8	Very high	25 Å²	25	40.6 Å²	40.6	9%	0.094	22%	0.217	C	C	.	.			trans	-68.2	137	169.8	-54.5	-45.9	-170.9	172.7	-5.9	109.7	V543 L544 A547 E551 V617 K620 L626	V543-R623 HydrophobicContact CG1-CB 4Å; L544-R623 HydrophobicContact CD2-CB 4.4Å; L544-R623 HydrophobicContact CD2-CG 3.77Å; A547-R623 HydrophobicContact CB-CB 4.31Å; A547-R623 HydrophobicContact CB-CG 3.87Å; E551-R623 IonicContact OE1-CZ 3.46Å; E551-R623 VanDerWaalsContact OE1-CZ 3.32Å; E551-R623 IonicContact OE1-NH1 2.81Å; E551-R623 PolarHBondContact OE1-NH1 2.92Å; E551-R623 IonicContact OE1-NH2 3.24Å; E551-R623 PolarHBondContact OE1-NH2 3.32Å; E551-R623 IonicContact OE2-CZ 3.74Å; E551-R623 IonicContact OE2-NH1 3.06Å; E551-R623 IonicContact OE2-NH2 2.66Å; E551-R623 PolarHBondContact OE2-NH2 3.28Å; V617-R623 PolarHBondContact O-NH2 3.23Å; V617-R623 VanDerWaalsContact O-NH2 3.14Å; K620-R623 WeakPolarHBondContact O-CG 3.35Å; R623-L626 HydrophobicContact CB-CD1 3.97Å; R623-L626 HydrophobicContact CB-CG 4.14Å
624	Y	93.9	Very high	96.8	Very high	128 Å²	128	45.2 Å²	45.2	50%	0.502	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.7	142.3	171.1	-179.1	-80.2	0	0	0	110.3	V543 Y773 P774	V543-Y624 WeakPolarHBondContact CG1-O 3.41Å; Y624-Y773 AromaticContact CD1-CD1 3.61Å; Y624-Y773 HydrophobicContact CD1-CD1 3.61Å; Y624-Y773 AromaticContact CD1-CE1 3.06Å; Y624-Y773 HydrophobicContact CD1-CE1 3.06Å; Y624-Y773 AromaticContact CD1-CZ 3.59Å; Y624-Y773 AromaticContact CE1-CD1 3.55Å; Y624-Y773 HydrophobicContact CE1-CD1 3.55Å; Y624-Y773 HydrophobicContact CE1-CD2 4.42Å; Y624-Y773 AromaticContact CE1-CE1 3.41Å; Y624-Y773 HydrophobicContact CE1-CE1 3.41Å; Y624-Y773 VanDerWaalsContact CE1-CE1 3.41Å; Y624-Y773 HydrophobicContact CE1-CE2 4.28Å; Y624-Y773 HydrophobicContact CE1-CG 4.07Å; Y624-Y773 AromaticContact CE1-CZ 3.79Å; Y624-Y773 HydrophobicContact CE2-CD1 4.47Å; Y624-Y773 HydrophobicContact CG-CD1 4.12Å; Y624-Y773 AromaticContact CG-CE1 3.73Å; Y624-Y773 HydrophobicContact CG-CE1 3.73Å; Y624-P774 HydrophobicContact CE2-CG 4.3Å; Y624-P774 WeakPolarHBondContact OH-CD 3.44Å
625	G	94.5	Very high	96.7	Very high	42 Å²	42	45.3 Å²	45.3	43%	0.433	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	91.7	0.8	173.1	0	0	0	0	0	116.1
626	L	96.9	Very high	96.7	Very high	24 Å²	24	46.7 Å²	46.7	13%	0.126	25%	0.248	C	C	.	.			trans	-70.6	136	175.5	-64.8	173.5	0	0	0	112.5	D540 V543 L544 R623 P629 V632	D540-L626 HydrophobicContact CB-CD2 4Å; V543-L626 HydrophobicContact CB-CD2 4.04Å; V543-L626 HydrophobicContact CG1-CD2 3.63Å; V543-L626 HydrophobicContact CG1-CG 3.99Å; L544-L626 HydrophobicContact CD2-CD1 4Å; L544-L626 HydrophobicContact CD2-CD2 3.74Å; L544-L626 HydrophobicContact CD2-CG 4.44Å; L544-L626 HydrophobicContact CG-CD2 3.89Å; R623-L626 HydrophobicContact CB-CD1 3.97Å; R623-L626 HydrophobicContact CB-CG 4.14Å; L626-P629 HydrophobicContact CB-CB 4.18Å; L626-P629 HydrophobicContact CD1-CB 4.34Å; L626-V632 HydrophobicContact CD1-CG1 4.41Å; L626-V632 HydrophobicContact CD1-CG2 4.3Å; L626-V632 HydrophobicContact CD2-CG2 4.42Å
627	I	97.1	Very high	96.6	Very high	124 Å²	124	52 Å²	52	64%	0.636	28%	0.277	S	S	*	.	S	Bend	trans	-86.4	-41.2	176.3	-56	175.2	0	0	0	110.7	P539 D540 P629	P539-I627 HydrophobicContact CB-CD1 3.85Å; P539-I627 HydrophobicContact CG-CD1 4Å; D540-I627 WeakPolarHBondContact OD1-CB 3.24Å; D540-I627 WeakPolarHBondContact OD1-CG1 3.1Å; D540-I627 PolarHBondContact OD1-N 3.49Å; D540-I627 PolarHBondContact OD2-N 3.37Å; I627-P629 VanDerWaalsContact O-CD 3.24Å; I627-P629 WeakPolarHBondContact O-CD 3.31Å
628	E	95.7	Very high	96.6	Very high	75 Å²	75	53.9 Å²	53.9	35%	0.35	29%	0.285	S	S	.	.			trans	-114	51.8	-179.1	-57	-173.5	91.6	0	0	113.5	D540 N630 K631 V632	D540-E628 PolarHBondContact OD2-N 3.04Å; E628-N630 PolarHBondContact O-N 2.97Å; E628-K631 HydrophobicContact CB-CB 3.88Å; E628-K631 HydrophobicContact CB-CD 4.11Å; E628-K631 VanDerWaalsContact CD-CD 3.42Å; E628-K631 HydrophobicContact CG-CD 4.41Å; E628-K631 WeakPolarHBondContact O-CA 3.2Å; E628-K631 WeakPolarHBondContact O-CB 3.36Å; E628-K631 PolarHBondContact O-N 3.21Å; E628-K631 WeakPolarHBondContact OE1-CD 3.41Å; E628-K631 IonicContact OE1-NZ 2.64Å; E628-K631 PolarHBondContact OE1-NZ 3.27Å; E628-K631 WeakPolarHBondContact OE2-CD 3.27Å; E628-K631 IonicContact OE2-NZ 3.98Å; E628-K631 PolarHBondContact OE2-NZ 3.09Å; E628-V632 PolarHBondContact O-N 2.58Å; E628-V632 VanDerWaalsContact O-N 3.15Å
629	P	96.9	Very high	96.5	Very high	46 Å²	46	53.9 Å²	53.9	30%	0.299	29%	0.285	S	S	.	.	H	α-helix	trans	-59.4	-28.8	-173.1	24.4	-34.5	0	0	0	113.9	P621 L626 I627 K631 V632 A633	P621-P629 WeakPolarHBondContact CB-O 3.45Å; L626-P629 HydrophobicContact CB-CB 4.18Å; L626-P629 HydrophobicContact CD1-CB 4.34Å; I627-P629 VanDerWaalsContact O-CD 3.24Å; I627-P629 WeakPolarHBondContact O-CD 3.31Å; P629-K631 VanDerWaalsContact C-N 3.33Å; P629-K631 PolarHBondContact O-N 3.04Å; P629-V632 PolarHBondContact O-N 3.44Å; P629-A633 WeakPolarHBondContact O-CB 3.37Å; P629-A633 PolarHBondContact O-N 3.45Å
630	N	97.2	Very high	96.5	Very high	137 Å²	137	56.3 Å²	56.3	73%	0.733	30%	0.298	S	S	*	.	H	α-helix	trans	-66.1	-32.8	173.7	-67	-53.9	0	0	0	113.2	E628 I634	E628-N630 PolarHBondContact O-N 2.97Å; N630-I634 WeakPolarHBondContact O-CG1 3.28Å; N630-I634 PolarHBondContact O-N 3.06Å
631	K	96.6	Very high	96.5	Very high	62 Å²	62	57.3 Å²	57.3	27%	0.27	31%	0.308	S	S	.	.	H	α-helix	trans	-75.6	-42.2	177.1	-177.5	180	169.8	-174.2	0	110.2	S535 L536 E628 P629 A633 I634 I635	S535-K631 WeakPolarHBondContact O-CE 3.49Å; S535-K631 PolarHBondContact O-NZ 2.83Å; L536-K631 HydrophobicContact CD2-CB 4.38Å; L536-K631 HydrophobicContact CD2-CD 3.9Å; L536-K631 HydrophobicContact CD2-CG 3.88Å; E628-K631 HydrophobicContact CB-CB 3.88Å; E628-K631 HydrophobicContact CB-CD 4.11Å; E628-K631 VanDerWaalsContact CD-CD 3.42Å; E628-K631 HydrophobicContact CG-CD 4.41Å; E628-K631 WeakPolarHBondContact O-CA 3.2Å; E628-K631 WeakPolarHBondContact O-CB 3.36Å; E628-K631 PolarHBondContact O-N 3.21Å; E628-K631 WeakPolarHBondContact OE1-CD 3.41Å; E628-K631 IonicContact OE1-NZ 2.64Å; E628-K631 PolarHBondContact OE1-NZ 3.27Å; E628-K631 WeakPolarHBondContact OE2-CD 3.27Å; E628-K631 IonicContact OE2-NZ 3.98Å; E628-K631 PolarHBondContact OE2-NZ 3.09Å; P629-K631 VanDerWaalsContact C-N 3.33Å; P629-K631 PolarHBondContact O-N 3.04Å; K631-A633 VanDerWaalsContact C-N 3.29Å; K631-A633 PolarHBondContact O-N 3.04Å; K631-I634 PolarHBondContact O-N 2.9Å; K631-I635 WeakPolarHBondContact O-CG1 3.45Å; K631-I635 PolarHBondContact O-N 3.07Å
632	V	97.9	Very high	96.5	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-55.8	-44	170.2	178.3	0	0	0	0	111	L536 L544 T619 P621 L626 E628 P629 I634 I635 Q636	L536-V632 HydrophobicContact CD1-CG2 4.08Å; L536-V632 HydrophobicContact CD2-CG2 3.74Å; L544-V632 HydrophobicContact CD1-CG1 4.04Å; L544-V632 HydrophobicContact CD1-CG2 4.13Å; L544-V632 HydrophobicContact CD2-CG1 4.03Å; T619-V632 WeakPolarHBondContact O-CG1 3.38Å; P621-V632 HydrophobicContact CB-CB 4.25Å; P621-V632 HydrophobicContact CB-CG1 4.05Å; L626-V632 HydrophobicContact CD1-CG1 4.41Å; L626-V632 HydrophobicContact CD1-CG2 4.3Å; L626-V632 HydrophobicContact CD2-CG2 4.42Å; E628-V632 PolarHBondContact O-N 2.58Å; E628-V632 VanDerWaalsContact O-N 3.15Å; P629-V632 PolarHBondContact O-N 3.44Å; V632-I634 PolarHBondContact O-N 3.37Å; V632-I635 PolarHBondContact O-N 3.2Å; V632-Q636 PolarHBondContact O-N 2.77Å
633	A	97.7	Very high	96.7	Very high	27 Å²	27	50.3 Å²	50.3	22%	0.223	27%	0.268	C	S	.	.	H	α-helix	trans	-61.3	-41.3	178.7	0	0	0	0	0	113.1	P621 P629 K631 I635 Q636 D637	P621-A633 HydrophobicContact CB-CB 3.73Å; P621-A633 HydrophobicContact CG-CB 3.85Å; P629-A633 WeakPolarHBondContact O-CB 3.37Å; P629-A633 PolarHBondContact O-N 3.45Å; K631-A633 VanDerWaalsContact C-N 3.29Å; K631-A633 PolarHBondContact O-N 3.04Å; A633-I635 VanDerWaalsContact C-N 3.35Å; A633-I635 PolarHBondContact O-N 3.29Å; A633-Q636 WeakPolarHBondContact O-CB 3.36Å; A633-Q636 PolarHBondContact O-N 2.89Å; A633-D637 PolarHBondContact O-N 3.15Å
634	I	97.1	Very high	96.8	Very high	98 Å²	98	55.6 Å²	55.6	50%	0.503	29%	0.288	S	S	.	.	H	α-helix	trans	-62.5	-42.5	176.7	-68.7	163.8	0	0	0	111	N630 K631 V632 Q636 D637 H638	N630-I634 WeakPolarHBondContact O-CG1 3.28Å; N630-I634 PolarHBondContact O-N 3.06Å; K631-I634 PolarHBondContact O-N 2.9Å; V632-I634 PolarHBondContact O-N 3.37Å; I634-Q636 VanDerWaalsContact C-N 3.34Å; I634-D637 PolarHBondContact O-N 3.33Å; I634-H638 PolarHBondContact O-N 2.95Å; I634-H638 VanDerWaalsContact O-N 3.14Å
635	I	97	Very high	96.9	Very high	3 Å²	3	50.4 Å²	50.4	2%	0.015	27%	0.269	C	S	.	.	H	α-helix	trans	-65.1	-39.8	176	-60.1	169.9	0	0	0	110.2	E532 L536 T619 K631 V632 A633 H638 H639	E532-I635 HydrophobicContact CB-CD1 3.88Å; E532-I635 HydrophobicContact CB-CG1 3.92Å; E532-I635 HydrophobicContact CB-CG2 4.39Å; L536-I635 HydrophobicContact CD1-CD1 4.25Å; L536-I635 HydrophobicContact CD2-CD1 3.92Å; L536-I635 HydrophobicContact CG-CD1 4Å; T619-I635 HydrophobicContact CG2-CG2 3.85Å; K631-I635 WeakPolarHBondContact O-CG1 3.45Å; K631-I635 PolarHBondContact O-N 3.07Å; V632-I635 PolarHBondContact O-N 3.2Å; A633-I635 VanDerWaalsContact C-N 3.35Å; A633-I635 PolarHBondContact O-N 3.29Å; I635-H638 PolarHBondContact O-N 3.41Å; I635-H639 WeakPolarHBondContact CG2-NE2 3.47Å; I635-H639 VanDerWaalsContact O-CG 3.32Å; I635-H639 PolarHBondContact O-N 2.87Å; I635-H639 PolarHBondContact O-ND1 3.28Å
636	Q	97.4	Very high	97	Very high	28 Å²	28	49.1 Å²	49.1	13%	0.131	25%	0.251	C	S	.	.	H	α-helix	trans	-63.1	-47.6	175.7	-151	-166	21.6	0	0	112.6	A616 T619 K620 V632 A633 I634 H638 H639 L640	A616-Q636 PolarHBondContact O-NE2 3.06Å; T619-Q636 VanDerWaalsContact O-CB 3.25Å; T619-Q636 WeakPolarHBondContact O-CB 3.44Å; T619-Q636 WeakPolarHBondContact O-CG 3.32Å; T619-Q636 WeakPolarHBondContact OG1-CA 3.47Å; K620-Q636 VanDerWaalsContact CG-NE2 3.29Å; V632-Q636 PolarHBondContact O-N 2.77Å; A633-Q636 WeakPolarHBondContact O-CB 3.36Å; A633-Q636 PolarHBondContact O-N 2.89Å; I634-Q636 VanDerWaalsContact C-N 3.34Å; Q636-H638 PolarHBondContact O-N 3.37Å; Q636-H639 PolarHBondContact O-N 2.81Å; Q636-H639 VanDerWaalsContact O-N 3.11Å; Q636-L640 HydrophobicContact CG-CD1 4.11Å; Q636-L640 HydrophobicContact CG-CG 4.41Å; Q636-L640 WeakPolarHBondContact O-CB 3.4Å; Q636-L640 WeakPolarHBondContact O-CG 3.34Å; Q636-L640 PolarHBondContact O-N 3.15Å
637	D	97.1	Very high	97	Very high	112 Å²	112	48.2 Å²	48.2	60%	0.599	25%	0.247	S	C	*	.	H	α-helix	trans	-58.4	-37.9	178.3	-88.9	-18.6	0	0	0	111.3	A633 I634 L640 A641	A633-D637 PolarHBondContact O-N 3.15Å; I634-D637 PolarHBondContact O-N 3.33Å; D637-L640 PolarHBondContact O-N 3.35Å; D637-A641 VanDerWaalsContact O-CB 3.3Å; D637-A641 WeakPolarHBondContact O-CB 3.33Å; D637-A641 PolarHBondContact O-N 3.17Å
638	H	96.8	Very high	96.9	Very high	40 Å²	40	46.2 Å²	46.2	19%	0.185	24%	0.235	C	C	.	.	H	α-helix	trans	-66	-43.2	174.6	-172.9	61.1	0	0	0	112.4	T460 I634 I635 Q636 A641 A642	T460-H638 PolarHBondContact OG1-NE2 3.13Å; I634-H638 PolarHBondContact O-N 2.95Å; I634-H638 VanDerWaalsContact O-N 3.14Å; I635-H638 PolarHBondContact O-N 3.41Å; Q636-H638 PolarHBondContact O-N 3.37Å; H638-A641 PolarHBondContact O-N 3.49Å; H638-A642 WeakPolarHBondContact O-CB 3.37Å; H638-A642 PolarHBondContact O-N 3.48Å
639	H	97.1	Very high	96.8	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-67.9	-37.2	175.5	-62.6	-0.1	0	0	0	112.7	I530 T619 I635 Q636 A642 L643	I530-H639 WeakPolarHBondContact CG2-NE2 3.48Å; T619-H639 PolarHBondContact OG1-CD2 2.91Å; I635-H639 WeakPolarHBondContact CG2-NE2 3.47Å; I635-H639 VanDerWaalsContact O-CG 3.32Å; I635-H639 PolarHBondContact O-N 2.87Å; I635-H639 PolarHBondContact O-ND1 3.28Å; Q636-H639 PolarHBondContact O-N 2.81Å; Q636-H639 VanDerWaalsContact O-N 3.11Å; H639-A642 PolarHBondContact O-N 3.07Å; H639-L643 WeakPolarHBondContact O-CB 3.43Å; H639-L643 PolarHBondContact O-N 3.37Å
640	L	97.1	Very high	96.6	Very high	51 Å²	51	50.6 Å²	50.6	27%	0.267	25%	0.247	S	C	.	.	H	α-helix	trans	-68.1	-35.9	174.4	-71.5	170.8	0	0	0	111.6	A616 Q636 D637 L643 R644 I665	A616-L640 HydrophobicContact CB-CD2 3.77Å; A616-L640 HydrophobicContact CB-CG 4.19Å; Q636-L640 HydrophobicContact CG-CD1 4.11Å; Q636-L640 HydrophobicContact CG-CG 4.41Å; Q636-L640 WeakPolarHBondContact O-CB 3.4Å; Q636-L640 WeakPolarHBondContact O-CG 3.34Å; Q636-L640 PolarHBondContact O-N 3.15Å; D637-L640 PolarHBondContact O-N 3.35Å; L640-L643 HydrophobicContact CD2-CD2 4.49Å; L640-R644 VanDerWaalsContact O-CB 3.24Å; L640-R644 WeakPolarHBondContact O-CB 3.29Å; L640-R644 PolarHBondContact O-N 2.9Å; L640-I665 HydrophobicContact CD2-CD1 4.46Å
641	A	97.1	Very high	96.4	Very high	29 Å²	29	46.9 Å²	46.9	24%	0.24	22%	0.223	C	C	.	.	H	α-helix	trans	-65.9	-38.9	170.9	0	0	0	0	0	112.1	L457 D637 H638 R644 M645	L457-A641 HydrophobicContact CD1-CB 4.39Å; L457-A641 HydrophobicContact CD2-CB 3.84Å; D637-A641 VanDerWaalsContact O-CB 3.3Å; D637-A641 WeakPolarHBondContact O-CB 3.33Å; D637-A641 PolarHBondContact O-N 3.17Å; H638-A641 PolarHBondContact O-N 3.49Å; A641-R644 PolarHBondContact O-N 2.9Å; A641-M645 WeakPolarHBondContact O-CB 3.29Å; A641-M645 PolarHBondContact O-N 3.35Å
642	A	97.6	Very high	96.1	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-66.3	-46.7	175.7	0	0	0	0	0	111.7	L457 T460 I461 L612 H638 H639 R644 M645 Q646	L457-A642 HydrophobicContact CD2-CB 4.01Å; T460-A642 HydrophobicContact CG2-CB 4.01Å; I461-A642 HydrophobicContact CG1-CB 3.96Å; L612-A642 HydrophobicContact CD2-CB 3.94Å; H638-A642 WeakPolarHBondContact O-CB 3.37Å; H638-A642 PolarHBondContact O-N 3.48Å; H639-A642 PolarHBondContact O-N 3.07Å; A642-R644 PolarHBondContact O-N 3.41Å; A642-M645 PolarHBondContact O-N 3.43Å; A642-Q646 PolarHBondContact O-N 3.35Å
643	L	97.7	Very high	95.7	Very high	6 Å²	6	60.7 Å²	60.7	3%	0.031	29%	0.286	C	S	.	.	H	α-helix	trans	-56.1	-49.2	172.4	178.2	55.5	0	0	0	111.3	L612 H639 L640 M645 Q646 L647 V661 I665	L612-L643 HydrophobicContact CB-CB 4.02Å; L612-L643 HydrophobicContact CB-CD1 3.76Å; L612-L643 HydrophobicContact CB-CG 4.39Å; H639-L643 WeakPolarHBondContact O-CB 3.43Å; H639-L643 PolarHBondContact O-N 3.37Å; L640-L643 HydrophobicContact CD2-CD2 4.49Å; L643-M645 PolarHBondContact O-N 3.28Å; L643-Q646 PolarHBondContact O-N 2.77Å; L643-L647 HydrophobicContact CD1-CD1 4Å; L643-L647 HydrophobicContact CD1-CG 4.16Å; L643-L647 HydrophobicContact CG-CD1 4.07Å; L643-L647 WeakPolarHBondContact O-CG 3.36Å; L643-L647 PolarHBondContact O-N 2.86Å; L643-V661 HydrophobicContact CD1-CG1 4.44Å; L643-V661 HydrophobicContact CD2-CG1 3.83Å; L643-V661 HydrophobicContact CG-CG1 4.39Å; L643-I665 HydrophobicContact CD2-CD1 3.7Å
644	R	96.6	Very high	95.3	Very high	136 Å²	136	63 Å²	63	51%	0.513	29%	0.292	S	S	.	.	H	α-helix	trans	-58.2	-48.5	177	179.5	-179.3	172.5	164.5	6.3	111.9	L640 A641 A642 Q646 L647 E648 I658	L640-R644 VanDerWaalsContact O-CB 3.24Å; L640-R644 WeakPolarHBondContact O-CB 3.29Å; L640-R644 PolarHBondContact O-N 2.9Å; A641-R644 PolarHBondContact O-N 2.9Å; A642-R644 PolarHBondContact O-N 3.41Å; R644-Q646 VanDerWaalsContact C-N 3.28Å; R644-Q646 PolarHBondContact O-N 3.15Å; R644-L647 PolarHBondContact O-N 2.96Å; R644-E648 HydrophobicContact CG-CG 4.26Å; R644-E648 IonicContact CZ-OE1 3.62Å; R644-E648 IonicContact NE-OE1 2.74Å; R644-E648 PolarHBondContact NE-OE1 2.97Å; R644-E648 IonicContact NE-OE2 2.7Å; R644-E648 IonicContact NH2-OE1 3.57Å; R644-E648 PolarHBondContact NH2-OE1 3.03Å; R644-E648 WeakPolarHBondContact O-CB 3.46Å; R644-E648 WeakPolarHBondContact O-CG 3.4Å; R644-E648 PolarHBondContact O-N 2.96Å; R644-I658 HydrophobicContact CG-CD1 4.39Å; R644-I658 HydrophobicContact CG-CG2 4.49Å
645	M	95.5	Very high	94.8	Very high	19 Å²	19	62.5 Å²	62.5	9%	0.094	30%	0.303	C	S	.	.	H	α-helix	trans	-61.9	-37.3	180	-171.8	175.2	73.6	0	0	111.8	H454 L457 Y458 I461 A641 A642 L643 R649	H454-M645 HydrophobicContact CB-SD 4.42Å; H454-M645 PolarHBondContact ND1-SD 3.3Å; L457-M645 HydrophobicContact CB-CE 3.53Å; L457-M645 HydrophobicContact CB-SD 4.16Å; L457-M645 HydrophobicContact CD1-SD 4.27Å; Y458-M645 HydrophobicContact CD1-CE 3.62Å; Y458-M645 HydrophobicContact CD2-CE 3.89Å; Y458-M645 HydrophobicContact CE1-CE 3.65Å; Y458-M645 HydrophobicContact CE2-CE 3.91Å; Y458-M645 HydrophobicContact CE2-SD 4.24Å; Y458-M645 HydrophobicContact CG-CE 3.73Å; I461-M645 HydrophobicContact CD1-CE 3.53Å; A641-M645 WeakPolarHBondContact O-CB 3.29Å; A641-M645 PolarHBondContact O-N 3.35Å; A642-M645 PolarHBondContact O-N 3.43Å; L643-M645 PolarHBondContact O-N 3.28Å; M645-R649 WeakPolarHBondContact O-CB 3.38Å; M645-R649 PolarHBondContact O-N 3.5Å
646	Q	96.4	Very high	94.7	Very high	14 Å²	14	66.9 Å²	66.9	7%	0.065	33%	0.33	C	S	.	.	H	α-helix	trans	-67.9	-43.6	176.1	-176.6	66.7	-3.6	0	0	112	I461 T608 E609 L612 A642 L643 R644 R649 N650	I461-Q646 HydrophobicContact CD1-CB 4.13Å; T608-Q646 HydrophobicContact CG2-CG 4.19Å; E609-Q646 HydrophobicContact CG-CG 4.01Å; L612-Q646 HydrophobicContact CD1-CB 3.85Å; L612-Q646 HydrophobicContact CD1-CG 4.02Å; A642-Q646 PolarHBondContact O-N 3.35Å; L643-Q646 PolarHBondContact O-N 2.77Å; R644-Q646 VanDerWaalsContact C-N 3.28Å; R644-Q646 PolarHBondContact O-N 3.15Å; Q646-R649 PolarHBondContact O-N 3.38Å; Q646-N650 PolarHBondContact NE2-ND2 3.29Å; Q646-N650 VanDerWaalsContact NE2-ND2 3.11Å; Q646-N650 WeakPolarHBondContact O-CB 3.36Å; Q646-N650 PolarHBondContact O-N 3.41Å; Q646-N650 PolarHBondContact O-ND2 3.27Å
647	L	96.6	Very high	94.6	Very high	6 Å²	6	65.7 Å²	65.7	3%	0.031	33%	0.325	C	S	.	.	H	α-helix	trans	-65	-47.3	176.8	-67.4	170.4	0	0	0	112	L605 E609 L643 R644 R649 N650 R651 L657 I658 V661	L605-L647 HydrophobicContact CD2-CD2 4.16Å; E609-L647 HydrophobicContact CG-CD2 4Å; L643-L647 HydrophobicContact CD1-CD1 4Å; L643-L647 HydrophobicContact CD1-CG 4.16Å; L643-L647 HydrophobicContact CG-CD1 4.07Å; L643-L647 WeakPolarHBondContact O-CG 3.36Å; L643-L647 PolarHBondContact O-N 2.86Å; R644-L647 PolarHBondContact O-N 2.96Å; L647-R649 VanDerWaalsContact C-N 3.25Å; L647-R649 PolarHBondContact O-N 3.42Å; L647-N650 PolarHBondContact O-N 3.18Å; L647-R651 PolarHBondContact O-N 3.18Å; L647-L657 HydrophobicContact CD2-CD2 3.91Å; L647-L657 HydrophobicContact CD2-CG 4.3Å; L647-I658 HydrophobicContact CB-CG1 4.41Å; L647-I658 HydrophobicContact CD1-CG1 4.48Å; L647-V661 HydrophobicContact CD1-CB 4.11Å; L647-V661 HydrophobicContact CD1-CG1 4.12Å; L647-V661 HydrophobicContact CD1-CG2 3.95Å; L647-V661 HydrophobicContact CD2-CG2 4.39Å
648	E	94.7	Very high	94.5	Very high	81 Å²	81	62.9 Å²	62.9	38%	0.379	31%	0.309	S	S	.	.	H	α-helix	trans	-61.7	-32.9	176.6	-73	179.3	162.3	0	0	112.1	R644 P652 I658	R644-E648 HydrophobicContact CG-CG 4.26Å; R644-E648 IonicContact CZ-OE1 3.62Å; R644-E648 IonicContact NE-OE1 2.74Å; R644-E648 PolarHBondContact NE-OE1 2.97Å; R644-E648 IonicContact NE-OE2 2.7Å; R644-E648 IonicContact NH2-OE1 3.57Å; R644-E648 PolarHBondContact NH2-OE1 3.03Å; R644-E648 WeakPolarHBondContact O-CB 3.46Å; R644-E648 WeakPolarHBondContact O-CG 3.4Å; R644-E648 PolarHBondContact O-N 2.96Å; E648-P652 WeakPolarHBondContact O-CA 3.42Å; E648-P652 WeakPolarHBondContact O-CB 3.39Å; E648-I658 HydrophobicContact CG-CD1 3.63Å
649	R	93.8	Very high	94.4	Very high	150 Å²	150	62.7 Å²	62.7	57%	0.566	32%	0.318	S	S	*	.	H	α-helix	trans	-71	-42.3	174.5	179.7	-177.1	-178.8	-165.2	3	112.8	M645 Q646 L647	M645-R649 WeakPolarHBondContact O-CB 3.38Å; M645-R649 PolarHBondContact O-N 3.5Å; Q646-R649 PolarHBondContact O-N 3.38Å; L647-R649 VanDerWaalsContact C-N 3.25Å; L647-R649 PolarHBondContact O-N 3.42Å
650	N	93.7	Very high	94.4	Very high	64 Å²	64	66.3 Å²	66.3	34%	0.342	34%	0.335	S	S	.	.	H	α-helix	trans	-85.5	-40.8	-171.1	-67.4	-15.2	0	0	0	113.1	E609 Q646 L647 P652	E609-N650 PolarHBondContact OE1-ND2 3.29Å; Q646-N650 PolarHBondContact NE2-ND2 3.29Å; Q646-N650 VanDerWaalsContact NE2-ND2 3.11Å; Q646-N650 WeakPolarHBondContact O-CB 3.36Å; Q646-N650 PolarHBondContact O-N 3.41Å; Q646-N650 PolarHBondContact O-ND2 3.27Å; L647-N650 PolarHBondContact O-N 3.18Å; N650-P652 VanDerWaalsContact C-CD 3.43Å
651	R	93.3	Very high	94.4	Very high	58 Å²	58	64 Å²	64	22%	0.219	32%	0.323	C	S	.	.			trans	-128.6	59.3	-177.9	-59.5	-176.1	-152.9	65.5	-6.2	111.7	V604 E609 L647 R653 E654 L657	V604-R651 PolarHBondContact O-NH2 2.82Å; E609-R651 IonicContact OE1-CZ 2.77Å; E609-R651 IonicContact OE1-NH1 3.57Å; E609-R651 PolarHBondContact OE1-NH1 3.28Å; E609-R651 IonicContact OE1-NH2 2.68Å; E609-R651 IonicContact OE2-CZ 2.62Å; E609-R651 IonicContact OE2-NH1 3.19Å; E609-R651 PolarHBondContact OE2-NH1 2.78Å; E609-R651 IonicContact OE2-NH2 2.88Å; E609-R651 PolarHBondContact OE2-NH2 3.46Å; L647-R651 PolarHBondContact O-N 3.18Å; R651-R653 PolarHBondContact O-N 3.12Å; R651-E654 HydrophobicContact CB-CB 4.09Å; R651-E654 WeakPolarHBondContact CD-OE2 3.41Å; R651-E654 PolarHBondContact O-N 2.75Å; R651-L657 HydrophobicContact CB-CD2 4.28Å; R651-L657 HydrophobicContact CG-CD2 4.47Å
652	P	89.5	Confident	94.4	Very high	102 Å²	102	70.7 Å²	70.7	66%	0.662	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-10.1	-174.5	23.8	-35.1	0	0	0	115.8	E648 N650	E648-P652 WeakPolarHBondContact O-CA 3.42Å; E648-P652 WeakPolarHBondContact O-CB 3.39Å; N650-P652 VanDerWaalsContact C-CD 3.43Å
653	R	89.1	Confident	94.3	Very high	250 Å²	250	75 Å²	75	94%	0.943	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.6	-12.2	175.5	-64.5	-178.4	179.4	173.9	-0.2	113.1	R651	R651-R653 PolarHBondContact O-N 3.12Å
654	E	90.1	Very high	94.3	Very high	75 Å²	75	75.1 Å²	75.1	35%	0.35	37%	0.366	S	S	.	.			trans	-108.5	63.6	-166.6	-159.1	-176.8	165.2	0	0	111.2	R651 T656 L657	R651-E654 HydrophobicContact CB-CB 4.09Å; R651-E654 WeakPolarHBondContact CD-OE2 3.41Å; R651-E654 PolarHBondContact O-N 2.75Å; E654-T656 PolarHBondContact O-N 3.03Å; E654-L657 HydrophobicContact CB-CB 4.32Å; E654-L657 HydrophobicContact CG-CB 3.94Å; E654-L657 VanDerWaalsContact O-CB 3.31Å; E654-L657 WeakPolarHBondContact O-CB 3.48Å; E654-L657 PolarHBondContact O-N 2.9Å
655	A	87.4	Confident	94.3	Very high	89 Å²	89	69 Å²	69	74%	0.736	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-22.5	-173.6	0	0	0	0	0	114.2
656	T	93.9	Very high	94.3	Very high	95 Å²	95	72.4 Å²	72.4	58%	0.583	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	-29.2	175.2	49.5	0	0	0	0	113.3	E654 I658 G659 Q660	E654-T656 PolarHBondContact O-N 3.03Å; T656-I658 VanDerWaalsContact C-N 3.28Å; T656-I658 PolarHBondContact O-N 2.75Å; T656-G659 WeakPolarHBondContact O-CA 3.21Å; T656-G659 PolarHBondContact O-N 3.46Å; T656-Q660 PolarHBondContact O-N 3.17Å; T656-Q660 PolarHBondContact O-OE1 2.97Å; T656-Q660 PolarHBondContact OG1-OE1 2.97Å
657	L	95.4	Very high	94.3	Very high	2 Å²	2	75.1 Å²	75.1	1%	0.01	37%	0.374	C	S	.	.	H	α-helix	trans	-60	-37	-171.8	-178.2	61.3	0	0	0	112.4	L603 L647 R651 E654 G659 Q660 V661	L603-L657 HydrophobicContact CB-CD1 4.19Å; L603-L657 HydrophobicContact CD2-CD1 4.17Å; L647-L657 HydrophobicContact CD2-CD2 3.91Å; L647-L657 HydrophobicContact CD2-CG 4.3Å; R651-L657 HydrophobicContact CB-CD2 4.28Å; R651-L657 HydrophobicContact CG-CD2 4.47Å; E654-L657 HydrophobicContact CB-CB 4.32Å; E654-L657 HydrophobicContact CG-CB 3.94Å; E654-L657 VanDerWaalsContact O-CB 3.31Å; E654-L657 WeakPolarHBondContact O-CB 3.48Å; E654-L657 PolarHBondContact O-N 2.9Å; L657-G659 VanDerWaalsContact C-N 3.26Å; L657-G659 PolarHBondContact O-N 3.24Å; L657-Q660 PolarHBondContact O-N 2.96Å; L657-V661 HydrophobicContact CD1-CG2 3.91Å; L657-V661 HydrophobicContact CG-CG2 4.12Å; L657-V661 WeakPolarHBondContact O-CB 3.5Å; L657-V661 VanDerWaalsContact O-CG2 3.28Å; L657-V661 WeakPolarHBondContact O-CG2 3.31Å; L657-V661 PolarHBondContact O-N 3.12Å
658	I	95	Very high	94.4	Very high	54 Å²	54	74.8 Å²	74.8	28%	0.277	37%	0.373	S	S	.	.	H	α-helix	trans	-62.7	-36.7	177.8	-55.5	167.3	0	0	0	110.7	R644 L647 E648 T656 R662	R644-I658 HydrophobicContact CG-CD1 4.39Å; R644-I658 HydrophobicContact CG-CG2 4.49Å; L647-I658 HydrophobicContact CB-CG1 4.41Å; L647-I658 HydrophobicContact CD1-CG1 4.48Å; E648-I658 HydrophobicContact CG-CD1 3.63Å; T656-I658 VanDerWaalsContact C-N 3.28Å; T656-I658 PolarHBondContact O-N 2.75Å; I658-R662 WeakPolarHBondContact O-CB 3.42Å; I658-R662 PolarHBondContact O-N 3.46Å; I658-R662 VanDerWaalsContact O-N 3.15Å
659	G	95.6	Very high	94.5	Very high	36 Å²	36	71.9 Å²	71.9	37%	0.371	36%	0.361	S	S	.	.	H	α-helix	trans	-70.9	-44	173.4	0	0	0	0	0	112.3	T656 L657 R662 N663	T656-G659 WeakPolarHBondContact O-CA 3.21Å; T656-G659 PolarHBondContact O-N 3.46Å; L657-G659 VanDerWaalsContact C-N 3.26Å; L657-G659 PolarHBondContact O-N 3.24Å; G659-R662 PolarHBondContact O-N 3.29Å; G659-N663 WeakPolarHBondContact O-CB 3.39Å; G659-N663 PolarHBondContact O-N 3.07Å; G659-N663 PolarHBondContact O-OD1 2.93Å
660	Q	96.7	Very high	94.6	Very high	75 Å²	75	68.6 Å²	68.6	35%	0.35	36%	0.357	S	S	.	.	H	α-helix	trans	-63	-44.3	178.1	-67.2	163.1	-77.3	0	0	111.9	L603 T656 L657 N663 V664	L603-Q660 HydrophobicContact CD2-CB 3.76Å; T656-Q660 PolarHBondContact O-N 3.17Å; T656-Q660 PolarHBondContact O-OE1 2.97Å; T656-Q660 PolarHBondContact OG1-OE1 2.97Å; L657-Q660 PolarHBondContact O-N 2.96Å; Q660-N663 WeakPolarHBondContact O-CB 3.34Å; Q660-N663 PolarHBondContact O-N 3.42Å; Q660-N663 VanDerWaalsContact O-N 3.16Å; Q660-V664 PolarHBondContact O-N 3.05Å
661	V	97	Very high	94.8	Very high	3 Å²	3	66 Å²	66	2%	0.018	34%	0.344	C	S	.	.	H	α-helix	trans	-61.6	-43.1	174.4	171.6	0	0	0	0	111.2	L603 L605 L643 L647 L657 N663 V664 I665	L603-V661 HydrophobicContact CD1-CG2 3.96Å; L605-V661 HydrophobicContact CD1-CG2 4.34Å; L605-V661 HydrophobicContact CD2-CG2 4.14Å; L643-V661 HydrophobicContact CD1-CG1 4.44Å; L643-V661 HydrophobicContact CD2-CG1 3.83Å; L643-V661 HydrophobicContact CG-CG1 4.39Å; L647-V661 HydrophobicContact CD1-CB 4.11Å; L647-V661 HydrophobicContact CD1-CG1 4.12Å; L647-V661 HydrophobicContact CD1-CG2 3.95Å; L647-V661 HydrophobicContact CD2-CG2 4.39Å; L657-V661 HydrophobicContact CD1-CG2 3.91Å; L657-V661 HydrophobicContact CG-CG2 4.12Å; L657-V661 WeakPolarHBondContact O-CB 3.5Å; L657-V661 VanDerWaalsContact O-CG2 3.28Å; L657-V661 WeakPolarHBondContact O-CG2 3.31Å; L657-V661 PolarHBondContact O-N 3.12Å; V661-N663 VanDerWaalsContact C-N 3.3Å; V661-N663 PolarHBondContact O-N 2.96Å; V661-V664 VanDerWaalsContact O-CG2 3.23Å; V661-V664 WeakPolarHBondContact O-CG2 3.26Å; V661-V664 PolarHBondContact O-N 3.15Å; V661-I665 HydrophobicContact CG1-CD1 3.99Å; V661-I665 WeakPolarHBondContact O-CG1 3.42Å; V661-I665 PolarHBondContact O-N 3.06Å; V661-I665 VanDerWaalsContact O-N 3.07Å
662	R	96	Very high	95	Very high	170 Å²	170	63.5 Å²	63.5	64%	0.642	34%	0.337	S	S	*	.	H	α-helix	trans	-62.7	-37.7	174	-170.7	177.2	-173.9	179.1	2.9	112.1	I658 G659 I665 N666	I658-R662 WeakPolarHBondContact O-CB 3.42Å; I658-R662 PolarHBondContact O-N 3.46Å; I658-R662 VanDerWaalsContact O-N 3.15Å; G659-R662 PolarHBondContact O-N 3.29Å; R662-I665 PolarHBondContact O-N 2.64Å; R662-N666 PolarHBondContact O-N 2.9Å; R662-N666 VanDerWaalsContact O-N 3.17Å
663	N	96.5	Very high	95.2	Very high	90 Å²	90	62.9 Å²	62.9	48%	0.481	33%	0.328	S	S	.	.	H	α-helix	trans	-66.5	-43.1	178.3	-71.2	-9.3	0	0	0	111.9	G659 Q660 V661 N666 Q667	G659-N663 WeakPolarHBondContact O-CB 3.39Å; G659-N663 PolarHBondContact O-N 3.07Å; G659-N663 PolarHBondContact O-OD1 2.93Å; Q660-N663 WeakPolarHBondContact O-CB 3.34Å; Q660-N663 PolarHBondContact O-N 3.42Å; Q660-N663 VanDerWaalsContact O-N 3.16Å; V661-N663 VanDerWaalsContact C-N 3.3Å; V661-N663 PolarHBondContact O-N 2.96Å; N663-N666 WeakPolarHBondContact O-CB 3.15Å; N663-N666 PolarHBondContact O-N 3.47Å; N663-N666 VanDerWaalsContact O-N 3.13Å; N663-Q667 WeakPolarHBondContact O-CG 3.17Å; N663-Q667 PolarHBondContact O-N 3.39Å
664	V	96.6	Very high	95.6	Very high	8 Å²	8	53.6 Å²	53.6	5%	0.048	30%	0.295	C	S	.	.	H	α-helix	trans	-68.4	-33.2	175.6	-63	0	0	0	0	112.6	F596 N599 F600 L603 Q660 V661 N666 Q667 V668	F596-V664 HydrophobicContact CE2-CB 3.98Å; F596-V664 WeakPolarHBondContact CE2-O 3.48Å; N599-V664 HydrophobicContact CB-CG1 4.41Å; F600-V664 HydrophobicContact CD2-CB 4.32Å; F600-V664 HydrophobicContact CD2-CG2 3.96Å; F600-V664 HydrophobicContact CE2-CG2 4.43Å; L603-V664 HydrophobicContact CD1-CG1 4.08Å; L603-V664 HydrophobicContact CD1-CG2 3.7Å; Q660-V664 PolarHBondContact O-N 3.05Å; V661-V664 VanDerWaalsContact O-CG2 3.23Å; V661-V664 WeakPolarHBondContact O-CG2 3.26Å; V661-V664 PolarHBondContact O-N 3.15Å; V664-N666 PolarHBondContact O-N 3.27Å; V664-Q667 PolarHBondContact O-N 3.17Å; V664-V668 PolarHBondContact O-N 3.23Å
665	I	96.8	Very high	95.9	Very high	9 Å²	9	50 Å²	50	5%	0.046	28%	0.278	C	S	.	.	H	α-helix	trans	-61.8	-28.2	171.5	-71.2	169	0	0	0	111.9	C613 V617 K620 L640 L643 V661 R662 V668	C613-I665 HydrophobicContact CB-CD1 4.46Å; V617-I665 HydrophobicContact CG2-CG2 4.33Å; K620-I665 WeakPolarHBondContact CE-O 3.3Å; K620-I665 PolarHBondContact NZ-O 3.15Å; L640-I665 HydrophobicContact CD2-CD1 4.46Å; L643-I665 HydrophobicContact CD2-CD1 3.7Å; V661-I665 HydrophobicContact CG1-CD1 3.99Å; V661-I665 WeakPolarHBondContact O-CG1 3.42Å; V661-I665 PolarHBondContact O-N 3.06Å; V661-I665 VanDerWaalsContact O-N 3.07Å; R662-I665 PolarHBondContact O-N 2.64Å; I665-V668 WeakPolarHBondContact O-CG1 3.32Å
666	N	95.8	Very high	96.3	Very high	89 Å²	89	48.3 Å²	48.3	48%	0.476	26%	0.255	S	S	.	.	H	α-helix	trans	-81.4	-47.8	171.7	-66.1	-17	0	0	0	111.9	R662 N663 V664 V668 T669 T670	R662-N666 PolarHBondContact O-N 2.9Å; R662-N666 VanDerWaalsContact O-N 3.17Å; N663-N666 WeakPolarHBondContact O-CB 3.15Å; N663-N666 PolarHBondContact O-N 3.47Å; N663-N666 VanDerWaalsContact O-N 3.13Å; V664-N666 PolarHBondContact O-N 3.27Å; N666-V668 VanDerWaalsContact C-N 3.26Å; N666-V668 PolarHBondContact O-N 3.3Å; N666-T669 PolarHBondContact O-N 2.87Å; N666-T670 PolarHBondContact O-N 3.24Å
667	Q	97	Very high	96.3	Very high	71 Å²	71	48.2 Å²	48.2	33%	0.332	25%	0.251	S	S	.	.	H	α-helix	trans	-54.7	-40.1	-179.8	-73	176	7.3	0	0	112.2	F596 N599 N663 V664 T669 T670 V671	F596-Q667 HydrophobicContact CD2-CB 4.06Å; F596-Q667 HydrophobicContact CE2-CB 4.47Å; N599-Q667 PolarHBondContact ND2-OE1 3.05Å; N663-Q667 WeakPolarHBondContact O-CG 3.17Å; N663-Q667 PolarHBondContact O-N 3.39Å; V664-Q667 PolarHBondContact O-N 3.17Å; Q667-T669 PolarHBondContact O-N 3.33Å; Q667-T670 WeakPolarHBondContact O-CB 3.47Å; Q667-T670 PolarHBondContact O-N 3.02Å; Q667-V671 PolarHBondContact O-N 3.08Å; Q667-V671 VanDerWaalsContact O-N 3.1Å
668	V	97.9	Very high	96.3	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-62.9	-28.7	179.9	76.3	0	0	0	0	112.8	E551 L554 V555 F596 V617 V664 I665 N666 G672	E551-V668 HydrophobicContact CB-CG1 4.12Å; E551-V668 HydrophobicContact CB-CG2 3.84Å; E551-V668 HydrophobicContact CG-CG1 4.32Å; E551-V668 HydrophobicContact CG-CG2 4.19Å; L554-V668 HydrophobicContact CB-CG2 4.44Å; L554-V668 HydrophobicContact CD2-CG2 4.15Å; L554-V668 HydrophobicContact CG-CG2 4.43Å; V555-V668 HydrophobicContact CG2-CG2 4.13Å; F596-V668 HydrophobicContact CD2-CB 4.32Å; F596-V668 HydrophobicContact CE1-CG2 4.19Å; F596-V668 HydrophobicContact CE2-CB 3.65Å; F596-V668 HydrophobicContact CE2-CG2 4.17Å; F596-V668 HydrophobicContact CZ-CB 3.79Å; F596-V668 HydrophobicContact CZ-CG2 3.87Å; V617-V668 HydrophobicContact CG2-CG1 4.01Å; V664-V668 PolarHBondContact O-N 3.23Å; I665-V668 WeakPolarHBondContact O-CG1 3.32Å; N666-V668 VanDerWaalsContact C-N 3.26Å; N666-V668 PolarHBondContact O-N 3.3Å; V668-G672 PolarHBondContact O-N 2.67Å
669	T	96.4	Very high	96.4	Very high	19 Å²	19	46.7 Å²	46.7	12%	0.117	25%	0.245	C	C	.	.	H	α-helix	trans	-68.6	-42.8	171.6	-74.8	0	0	0	0	111.5	E551 K620 N666 Q667 V671 G672 D673	E551-T669 VanDerWaalsContact OE1-CA 3.3Å; E551-T669 WeakPolarHBondContact OE1-CA 3.41Å; E551-T669 WeakPolarHBondContact OE1-CB 3.37Å; E551-T669 PolarHBondContact OE1-OG1 2.73Å; E551-T669 PolarHBondContact OE2-OG1 3.44Å; K620-T669 PolarHBondContact NZ-OG1 2.94Å; N666-T669 PolarHBondContact O-N 2.87Å; Q667-T669 PolarHBondContact O-N 3.33Å; T669-V671 VanDerWaalsContact C-N 3.3Å; T669-V671 PolarHBondContact O-N 3.18Å; T669-G672 CarbonylContact O-C 3.42Å; T669-G672 WeakPolarHBondContact O-CA 3.43Å; T669-G672 PolarHBondContact O-N 2.66Å; T669-D673 VanDerWaalsContact CG2-OD2 3.32Å; T669-D673 WeakPolarHBondContact CG2-OD2 3.44Å; T669-D673 WeakPolarHBondContact O-CB 3.46Å; T669-D673 VanDerWaalsContact O-CG 3.31Å; T669-D673 PolarHBondContact O-N 3.41Å
670	T	96.6	Very high	96.3	Very high	81 Å²	81	51.7 Å²	51.7	50%	0.497	25%	0.252	S	S	.	.	H	α-helix	trans	-57.3	-43.6	175.3	-49.1	0	0	0	0	111.7	N666 Q667 D673 E674	N666-T670 PolarHBondContact O-N 3.24Å; Q667-T670 WeakPolarHBondContact O-CB 3.47Å; Q667-T670 PolarHBondContact O-N 3.02Å; T670-D673 PolarHBondContact O-N 3.2Å; T670-E674 WeakPolarHBondContact O-CG 3.5Å; T670-E674 PolarHBondContact O-N 2.93Å
671	V	97.8	Very high	96.3	Very high	9 Å²	9	50.8 Å²	50.8	6%	0.055	25%	0.246	C	C	.	.	H	α-helix	trans	-68	-35.2	175.4	-170.9	0	0	0	0	112	F550 L554 I593 F596 Q667 T669 V675	F550-V671 HydrophobicContact CE1-CG1 4.21Å; L554-V671 HydrophobicContact CD2-CB 4.19Å; L554-V671 HydrophobicContact CD2-CG1 3.77Å; I593-V671 HydrophobicContact CB-CG1 4.47Å; I593-V671 HydrophobicContact CG1-CG1 3.52Å; F596-V671 HydrophobicContact CB-CG2 4.22Å; Q667-V671 PolarHBondContact O-N 3.08Å; Q667-V671 VanDerWaalsContact O-N 3.1Å; T669-V671 VanDerWaalsContact C-N 3.3Å; T669-V671 PolarHBondContact O-N 3.18Å; V671-V675 WeakPolarHBondContact O-CG2 3.27Å; V671-V675 PolarHBondContact O-N 2.89Å
672	G	97	Very high	96.2	Very high	7 Å²	7	50.7 Å²	50.7	7%	0.072	25%	0.245	C	C	.	.	H	α-helix	trans	-65.9	-40.5	174.2	0	0	0	0	0	113.4	V668 T669 V675 Q676	V668-G672 PolarHBondContact O-N 2.67Å; T669-G672 CarbonylContact O-C 3.42Å; T669-G672 WeakPolarHBondContact O-CA 3.43Å; T669-G672 PolarHBondContact O-N 2.66Å; G672-V675 PolarHBondContact O-N 3.25Å; G672-Q676 WeakPolarHBondContact O-CG 3.49Å; G672-Q676 PolarHBondContact O-N 3.24Å
673	D	95.5	Very high	96.1	Very high	89 Å²	89	45.5 Å²	45.5	48%	0.476	23%	0.225	S	C	.	.	H	α-helix	trans	-67	-43.3	175.9	-68.3	-32.6	0	0	0	110.7	T669 T670 V675 Q676 L677	T669-D673 VanDerWaalsContact CG2-OD2 3.32Å; T669-D673 WeakPolarHBondContact CG2-OD2 3.44Å; T669-D673 WeakPolarHBondContact O-CB 3.46Å; T669-D673 VanDerWaalsContact O-CG 3.31Å; T669-D673 PolarHBondContact O-N 3.41Å; T670-D673 PolarHBondContact O-N 3.2Å; D673-V675 PolarHBondContact O-N 3.46Å; D673-Q676 PolarHBondContact O-N 3.33Å; D673-L677 WeakPolarHBondContact O-CG 3.39Å; D673-L677 PolarHBondContact O-N 3.28Å
674	E	96.9	Very high	96	Very high	54 Å²	54	47.3 Å²	47.3	25%	0.252	23%	0.231	S	C	.	.	H	α-helix	trans	-55.4	-46.4	171.4	-79.9	176.9	-158.1	0	0	112.2	V589 S592 T670 L677 C678	V589-E674 HydrophobicContact CB-CB 4.44Å; V589-E674 HydrophobicContact CG1-CB 3.92Å; V589-E674 HydrophobicContact CG2-CB 3.86Å; V589-E674 HydrophobicContact CG2-CG 4.5Å; S592-E674 WeakPolarHBondContact CB-OE2 3.44Å; S592-E674 PolarHBondContact OG-OE2 2.99Å; T670-E674 WeakPolarHBondContact O-CG 3.5Å; T670-E674 PolarHBondContact O-N 2.93Å; E674-L677 WeakPolarHBondContact O-CB 3.3Å; E674-L677 PolarHBondContact O-N 3.46Å; E674-C678 PolarHBondContact O-N 2.99Å; E674-C678 VanDerWaalsContact O-N 3.14Å
675	V	96.8	Very high	95.9	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-65	-40.5	175.7	168.3	0	0	0	0	111.8	F550 Y585 V589 I593 V671 G672 D673 L677 C678 I679	F550-V675 HydrophobicContact CD1-CB 4.39Å; F550-V675 HydrophobicContact CD1-CG2 4.36Å; F550-V675 HydrophobicContact CD2-CG1 4.03Å; F550-V675 HydrophobicContact CE1-CB 4.3Å; F550-V675 HydrophobicContact CE1-CG2 3.78Å; F550-V675 HydrophobicContact CE2-CG1 4.13Å; F550-V675 HydrophobicContact CE2-CG2 4.04Å; F550-V675 HydrophobicContact CG-CG1 4.28Å; F550-V675 HydrophobicContact CZ-CB 4.4Å; F550-V675 HydrophobicContact CZ-CG1 4.48Å; F550-V675 HydrophobicContact CZ-CG2 3.62Å; Y585-V675 HydrophobicContact CD1-CG1 4.25Å; Y585-V675 HydrophobicContact CE1-CG1 3.89Å; V589-V675 HydrophobicContact CG1-CB 4.46Å; V589-V675 HydrophobicContact CG1-CG2 3.41Å; V589-V675 VanDerWaalsContact CG1-CG2 3.41Å; I593-V675 HydrophobicContact CD1-CG2 4.3Å; V671-V675 WeakPolarHBondContact O-CG2 3.27Å; V671-V675 PolarHBondContact O-N 2.89Å; G672-V675 PolarHBondContact O-N 3.25Å; D673-V675 PolarHBondContact O-N 3.46Å; V675-L677 VanDerWaalsContact C-N 3.29Å; V675-L677 PolarHBondContact O-N 3.17Å; V675-C678 PolarHBondContact O-N 2.78Å; V675-I679 HydrophobicContact CG1-CD1 3.69Å; V675-I679 HydrophobicContact CG1-CG1 4.34Å; V675-I679 VanDerWaalsContact O-CG1 3.31Å; V675-I679 WeakPolarHBondContact O-CG1 3.37Å; V675-I679 PolarHBondContact O-N 3.42Å
676	Q	94.4	Very high	95.8	Very high	53 Å²	53	50.9 Å²	50.9	25%	0.248	24%	0.244	C	C	.	.	H	α-helix	trans	-64.1	-31.4	175.3	-79.2	-74.6	2.4	0	0	113	G672 D673 R680 R683	G672-Q676 WeakPolarHBondContact O-CG 3.49Å; G672-Q676 PolarHBondContact O-N 3.24Å; D673-Q676 PolarHBondContact O-N 3.33Å; Q676-R680 PolarHBondContact O-N 3.36Å; Q676-R683 PolarHBondContact O-NH2 3.39Å
677	L	95.5	Very high	95.6	Very high	94 Å²	94	53.7 Å²	53.7	49%	0.492	25%	0.249	S	C	.	.	H	α-helix	trans	-64.6	-49.5	170.1	-68.6	175.7	0	0	0	110.9	D673 E674 V675 I679 R680	D673-L677 WeakPolarHBondContact O-CG 3.39Å; D673-L677 PolarHBondContact O-N 3.28Å; E674-L677 WeakPolarHBondContact O-CB 3.3Å; E674-L677 PolarHBondContact O-N 3.46Å; V675-L677 VanDerWaalsContact C-N 3.29Å; V675-L677 PolarHBondContact O-N 3.17Å; L677-I679 PolarHBondContact O-N 3.28Å; L677-R680 VanDerWaalsContact CD2-CZ 3.48Å; L677-R680 VanDerWaalsContact O-CB 3.27Å; L677-R680 WeakPolarHBondContact O-CB 3.29Å; L677-R680 WeakPolarHBondContact O-CG 3.07Å; L677-R680 PolarHBondContact O-N 2.63Å
678	C	94.9	Very high	95.5	Very high	24 Å²	24	53.4 Å²	53.4	16%	0.162	25%	0.245	C	C	.	.	H	α-helix	trans	-62.1	-31.5	178	-66.2	0	0	0	0	113.2	Y585 E674 V675 R680	Y585-C678 HydrophobicContact CD1-CB 4.48Å; Y585-C678 PolarHBondContact O-SG 2.96Å; E674-C678 PolarHBondContact O-N 2.99Å; E674-C678 VanDerWaalsContact O-N 3.14Å; V675-C678 PolarHBondContact O-N 2.78Å; C678-R680 VanDerWaalsContact C-N 3.25Å; C678-R680 PolarHBondContact O-N 3.23Å
679	I	95.6	Very high	95.1	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-71.2	-14.8	176.2	-70.8	173.7	0	0	0	112.9	Y585 V675 L677 W681 Y682 R683 Y699 I701	Y585-I679 HydrophobicContact CE1-CG1 4.48Å; V675-I679 HydrophobicContact CG1-CD1 3.69Å; V675-I679 HydrophobicContact CG1-CG1 4.34Å; V675-I679 VanDerWaalsContact O-CG1 3.31Å; V675-I679 WeakPolarHBondContact O-CG1 3.37Å; V675-I679 PolarHBondContact O-N 3.42Å; L677-I679 PolarHBondContact O-N 3.28Å; I679-W681 PolarHBondContact O-N 3.04Å; I679-Y682 PolarHBondContact O-N 2.67Å; I679-R683 PolarHBondContact O-N 2.87Å; I679-Y699 HydrophobicContact CD1-CD1 3.45Å; I679-Y699 VanDerWaalsContact CD1-CD1 3.45Å; I679-Y699 HydrophobicContact CD1-CD2 4.4Å; I679-Y699 HydrophobicContact CD1-CE1 3.35Å; I679-Y699 HydrophobicContact CD1-CE2 4.33Å; I679-Y699 HydrophobicContact CD1-CG 4Å; I679-Y699 HydrophobicContact CG2-CD1 4.14Å; I679-Y699 HydrophobicContact CG2-CG 4.26Å; I679-I701 HydrophobicContact CG2-CD1 4.24Å
680	R	95.3	Very high	94.9	Very high	141 Å²	141	59 Å²	59	53%	0.532	27%	0.265	S	S	.	.	H	α-helix	trans	-58.8	-45.5	173.1	-65.1	-178.6	179.4	-174.8	0.9	112.5	Q676 L677 C678 Y682 R683 E684	Q676-R680 PolarHBondContact O-N 3.36Å; L677-R680 VanDerWaalsContact CD2-CZ 3.48Å; L677-R680 VanDerWaalsContact O-CB 3.27Å; L677-R680 WeakPolarHBondContact O-CB 3.29Å; L677-R680 WeakPolarHBondContact O-CG 3.07Å; L677-R680 PolarHBondContact O-N 2.63Å; C678-R680 VanDerWaalsContact C-N 3.25Å; C678-R680 PolarHBondContact O-N 3.23Å; R680-Y682 PolarHBondContact O-N 3.03Å; R680-R683 WeakPolarHBondContact O-CA 3.37Å; R680-R683 WeakPolarHBondContact O-CB 3.3Å; R680-R683 PolarHBondContact O-N 3.36Å; R680-E684 WeakPolarHBondContact O-CG 3.36Å; R680-E684 PolarHBondContact O-N 2.82Å
681	W	95.1	Very high	94.9	Very high	56 Å²	56	55.7 Å²	55.7	21%	0.212	24%	0.244	C	C	.	.	H	α-helix	trans	-60.1	-35.5	177.5	-177.2	85.4	0	0	0	112.5	D502 R505 L506 I679 E684 N685	D502-W681 HydrophobicContact CB-CH2 4.01Å; D502-W681 HydrophobicContact CB-CZ2 3.95Å; R505-W681 HydrophobicContact CG-CZ3 4.29Å; L506-W681 HydrophobicContact CD1-CH2 4.18Å; L506-W681 HydrophobicContact CD2-CH2 4.12Å; L506-W681 HydrophobicContact CD2-CZ3 3.81Å; L506-W681 HydrophobicContact CG-CH2 3.87Å; L506-W681 HydrophobicContact CG-CZ3 3.96Å; I679-W681 PolarHBondContact O-N 3.04Å; W681-E684 PolarHBondContact O-N 2.77Å; W681-N685 PolarHBondContact NE1-ND2 2.72Å; W681-N685 WeakPolarHBondContact O-CB 3.35Å; W681-N685 PolarHBondContact O-N 2.97Å; W681-N685 PolarHBondContact O-ND2 2.83Å
682	Y	95.5	Very high	94.8	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-73.4	-34	175	-69.7	-80.1	0	0	0	112.9	R505 L506 H509 I584 I679 R680 E684 N685 W686	R505-Y682 WeakPolarHBondContact CG-OH 3.33Å; R505-Y682 PolarHBondContact NE-OH 2.82Å; R505-Y682 PolarHBondContact O-OH 3.39Å; L506-Y682 HydrophobicContact CD2-CD1 3.88Å; L506-Y682 HydrophobicContact CD2-CE1 4.1Å; H509-Y682 HydrophobicContact CB-CD1 4.13Å; H509-Y682 HydrophobicContact CB-CE1 3.37Å; H509-Y682 AromaticContact CE1-CD1 3.75Å; H509-Y682 AromaticContact CE1-CG 3.83Å; H509-Y682 AromaticContact CG-CD1 3.71Å; H509-Y682 AromaticContact CG-CE1 3.39Å; H509-Y682 AromaticContact CG-CZ 3.74Å; H509-Y682 AromaticContact ND1-CD1 3.21Å; H509-Y682 WeakPolarHBondContact ND1-CD1 3.21Å; H509-Y682 AromaticContact ND1-CE1 3.42Å; H509-Y682 WeakPolarHBondContact ND1-CE1 3.32Å; H509-Y682 AromaticContact ND1-CG 3.77Å; I584-Y682 PolarHBondContact O-OH 3.46Å; I679-Y682 PolarHBondContact O-N 2.67Å; R680-Y682 PolarHBondContact O-N 3.03Å; Y682-E684 VanDerWaalsContact C-N 3.32Å; Y682-N685 PolarHBondContact O-N 3.08Å; Y682-W686 PolarHBondContact O-N 3.44Å; Y682-W686 VanDerWaalsContact O-N 3.15Å
683	R	95	Very high	94.8	Very high	62 Å²	62	58.6 Å²	58.6	23%	0.234	26%	0.262	C	S	.	.	H	α-helix	trans	-63.9	-35.8	168.6	-79.2	-178.1	-80.4	-115.7	-3	112	Q676 I679 R680 W686 Y699 I701	Q676-R683 PolarHBondContact O-NH2 3.39Å; I679-R683 PolarHBondContact O-N 2.87Å; R680-R683 WeakPolarHBondContact O-CA 3.37Å; R680-R683 WeakPolarHBondContact O-CB 3.3Å; R680-R683 PolarHBondContact O-N 3.36Å; R683-W686 VanDerWaalsContact O-CD1 3.27Å; R683-Y699 WeakPolarHBondContact CD-O 3.47Å; R683-Y699 PolarHBondContact NH1-O 3.04Å; R683-I701 HydrophobicContact CG-CB 4.34Å; R683-I701 HydrophobicContact CG-CG1 3.61Å
684	E	94.4	Very high	94.8	Very high	127 Å²	127	56.6 Å²	56.6	59%	0.593	25%	0.251	S	S	*	.	H	α-helix	trans	-73.3	-36.6	176.8	-70.3	155.7	-163.1	0	0	112.2	R680 W681 Y682	R680-E684 WeakPolarHBondContact O-CG 3.36Å; R680-E684 PolarHBondContact O-N 2.82Å; W681-E684 PolarHBondContact O-N 2.77Å; Y682-E684 VanDerWaalsContact C-N 3.32Å
685	N	94.1	Very high	94.8	Very high	18 Å²	18	54 Å²	54	10%	0.096	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.6	15.5	-179.5	-74.9	-95.2	0	0	0	114.2	L506 W681 Y682 Y687 R688	L506-N685 HydrophobicContact CD2-CB 4.09Å; W681-N685 PolarHBondContact NE1-ND2 2.72Å; W681-N685 WeakPolarHBondContact O-CB 3.35Å; W681-N685 PolarHBondContact O-N 2.97Å; W681-N685 PolarHBondContact O-ND2 2.83Å; Y682-N685 PolarHBondContact O-N 3.08Å; N685-Y687 PolarHBondContact O-N 3.12Å; N685-Y687 VanDerWaalsContact O-N 3.08Å; N685-R688 WeakPolarHBondContact O-CB 3.42Å; N685-R688 PolarHBondContact O-N 3.1Å; N685-R688 WeakPolarHBondContact OD1-CD 3.39Å; N685-R688 PolarHBondContact OD1-NH1 2.91Å
686	W	93.6	Very high	94.8	Very high	75 Å²	75	54 Å²	54	28%	0.284	24%	0.239	S	C	.	.	G	3₁₀ helix	trans	-52.2	-37.8	-170.9	73.9	-90.4	0	0	0	114.1	Y682 R683 R688 T689 I701 P702	Y682-W686 PolarHBondContact O-N 3.44Å; Y682-W686 VanDerWaalsContact O-N 3.15Å; R683-W686 VanDerWaalsContact O-CD1 3.27Å; W686-R688 PolarHBondContact O-N 3.21Å; W686-R688 VanDerWaalsContact O-N 3.1Å; W686-T689 VanDerWaalsContact O-CG2 3.3Å; W686-T689 WeakPolarHBondContact O-CG2 3.3Å; W686-T689 PolarHBondContact O-N 2.94Å; W686-T689 VanDerWaalsContact O-N 3.12Å; W686-I701 HydrophobicContact CB-CG2 3.8Å; W686-P702 HydrophobicContact CD2-CB 3.69Å; W686-P702 HydrophobicContact CD2-CG 4.22Å; W686-P702 HydrophobicContact CE3-CB 3.92Å; W686-P702 VanDerWaalsContact CE3-O 3.27Å; W686-P702 HydrophobicContact CG-CB 4Å; W686-P702 HydrophobicContact CG-CG 4.06Å; W686-P702 HydrophobicContact CZ2-CB 4.45Å; W686-P702 HydrophobicContact CZ3-CB 4.39Å
687	Y	93.3	Very high	94.9	Very high	148 Å²	148	55.9 Å²	55.9	58%	0.58	25%	0.248	S	C	*	.	G	3₁₀ helix	trans	-66.8	-10.2	-178.3	65.1	-85	0	0	0	114	N685	N685-Y687 PolarHBondContact O-N 3.12Å; N685-Y687 VanDerWaalsContact O-N 3.08Å
688	R	92.9	Very high	95	Very high	65 Å²	65	51.7 Å²	51.7	25%	0.245	23%	0.226	C	C	.	.	G	3₁₀ helix	trans	-98	-4.1	177.5	-57.2	167.8	67.9	-179.5	5.5	113.1	D502 E503 L506 N685 W686	D502-R688 IonicContact OD2-NH1 3.86Å; E503-R688 IonicContact OE1-CZ 3.97Å; E503-R688 VanDerWaalsContact OE1-CZ 3.24Å; E503-R688 IonicContact OE1-NE 3.9Å; E503-R688 PolarHBondContact OE1-NE 3.35Å; E503-R688 IonicContact OE1-NH2 2.7Å; E503-R688 PolarHBondContact OE1-NH2 2.89Å; L506-R688 HydrophobicContact CD1-CB 3.66Å; L506-R688 HydrophobicContact CD1-CG 4.45Å; N685-R688 WeakPolarHBondContact O-CB 3.42Å; N685-R688 PolarHBondContact O-N 3.1Å; N685-R688 WeakPolarHBondContact OD1-CD 3.39Å; N685-R688 PolarHBondContact OD1-NH1 2.91Å; W686-R688 PolarHBondContact O-N 3.21Å; W686-R688 VanDerWaalsContact O-N 3.1Å
689	T	91.2	Very high	95	Very high	8 Å²	8	50.7 Å²	50.7	5%	0.049	22%	0.219	C	C	.	.			trans	-133.8	148.9	-169.4	178.1	0	0	0	0	113.4	L506 E510 W686 L691	L506-T689 HydrophobicContact CD2-CG2 4.11Å; E510-T689 WeakPolarHBondContact CG-OG1 3.47Å; E510-T689 WeakPolarHBondContact OE1-CA 3.44Å; W686-T689 VanDerWaalsContact O-CG2 3.3Å; W686-T689 WeakPolarHBondContact O-CG2 3.3Å; W686-T689 PolarHBondContact O-N 2.94Å; W686-T689 VanDerWaalsContact O-N 3.12Å; T689-L691 HydrophobicContact CG2-CD1 4.48Å; T689-L691 HydrophobicContact CG2-CD2 4.37Å; T689-L691 HydrophobicContact CG2-CG 4.12Å; T689-L691 WeakPolarHBondContact OG1-CD2 3.28Å
690	R	92.3	Very high	95	Very high	128 Å²	128	54.7 Å²	54.7	48%	0.483	24%	0.241	S	C	.	.			trans	-118.7	68.2	179.4	-60.7	-54.6	-165.1	-149.2	14.4	110.8	E510 E704	E510-R690 PolarHBondContact OE1-N 3.21Å; R690-E704 IonicContact CZ-OE1 2.81Å; R690-E704 IonicContact CZ-OE2 3.49Å; R690-E704 VanDerWaalsContact NH1-CD 3.33Å; R690-E704 IonicContact NH1-OE1 3.32Å; R690-E704 PolarHBondContact NH1-OE1 3.32Å; R690-E704 IonicContact NH1-OE2 3.03Å; R690-E704 IonicContact NH2-OE1 3.15Å; R690-E704 PolarHBondContact NH2-OE1 3.09Å; R690-E704 IonicContact NH2-OE2 3.67Å; R690-E704 PolarHBondContact NH2-OE2 3.16Å
691	L	94.9	Very high	94.9	Very high	12 Å²	12	48.2 Å²	48.2	6%	0.063	22%	0.217	C	C	.	.			trans	-65.9	159.2	177.8	-53.6	-177.4	0	0	0	112.4	H509 E510 S513 T689 Y695 A696 I701	H509-L691 WeakPolarHBondContact ND1-CD2 3.17Å; E510-L691 HydrophobicContact CG-CD2 4.21Å; S513-L691 WeakPolarHBondContact OG-CA 3.16Å; T689-L691 HydrophobicContact CG2-CD1 4.48Å; T689-L691 HydrophobicContact CG2-CD2 4.37Å; T689-L691 HydrophobicContact CG2-CG 4.12Å; T689-L691 WeakPolarHBondContact OG1-CD2 3.28Å; L691-Y695 HydrophobicContact CD1-CD1 4.14Å; L691-Y695 HydrophobicContact CD1-CE1 4.25Å; L691-A696 HydrophobicContact CB-CB 4.29Å; L691-I701 HydrophobicContact CD1-CB 4.39Å; L691-I701 HydrophobicContact CD1-CD1 3.44Å; L691-I701 VanDerWaalsContact CD1-CD1 3.44Å; L691-I701 HydrophobicContact CD1-CG1 4.48Å; L691-I701 HydrophobicContact CD1-CG2 3.98Å
692	A	96.2	Very high	94.7	Very high	3 Å²	3	48.3 Å²	48.3	3%	0.025	22%	0.224	C	C	.	.			trans	-59.5	128.4	169.6	0	0	0	0	0	110.6	S513 A517 L694 Y695 A696	S513-A692 PolarHBondContact OG-N 2.93Å; A517-A692 HydrophobicContact CB-CB 3.82Å; A692-L694 PolarHBondContact O-N 3.13Å; A692-Y695 WeakPolarHBondContact O-CA 3.43Å; A692-Y695 WeakPolarHBondContact O-CB 3.41Å; A692-Y695 PolarHBondContact O-N 2.91Å; A692-A696 PolarHBondContact O-N 3.39Å
693	P	96.5	Very high	94.2	Very high	74 Å²	74	51.2 Å²	51.2	48%	0.481	24%	0.238	S	C	.	.	H	α-helix	trans	-52.1	-46.3	-173	-33.2	37.6	0	0	0	114.8	Y695 A696 E697	P693-Y695 VanDerWaalsContact C-N 3.3Å; P693-Y695 PolarHBondContact O-N 3.4Å; P693-A696 PolarHBondContact O-N 3.45Å; P693-E697 WeakPolarHBondContact O-CB 3.35Å; P693-E697 PolarHBondContact O-N 2.99Å
694	L	96.3	Very high	93.2	Very high	46 Å²	46	54 Å²	54	24%	0.241	25%	0.253	C	S	.	.	H	α-helix	trans	-64.9	-31.1	177.5	-179.2	61.7	0	0	0	113.1	I520 Q521 A692 T698	I520-L694 HydrophobicContact CB-CD2 3.98Å; I520-L694 HydrophobicContact CB-CG 4.19Å; I520-L694 HydrophobicContact CD1-CG 4.17Å; I520-L694 HydrophobicContact CG2-CD1 4.15Å; I520-L694 HydrophobicContact CG2-CD2 3.96Å; I520-L694 HydrophobicContact CG2-CG 3.89Å; Q521-L694 HydrophobicContact CG-CD2 3.45Å; Q521-L694 VanDerWaalsContact CG-CD2 3.45Å; A692-L694 PolarHBondContact O-N 3.13Å; L694-T698 VanDerWaalsContact O-CB 3.26Å; L694-T698 WeakPolarHBondContact O-CB 3.39Å; L694-T698 PolarHBondContact O-N 3.32Å; L694-T698 PolarHBondContact O-OG1 3.26Å
695	Y	97.4	Very high	91.5	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-71.8	-45	173.7	-178.2	-79	0	0	0	110.5	H509 L516 I520 L691 A692 P693 T698 Y699 I701	H509-Y695 AromaticContact CE1-CE1 3.69Å; H509-Y695 AromaticContact NE2-CE1 3.55Å; H509-Y695 AromaticContact NE2-CZ 3.57Å; H509-Y695 PolarHBondContact NE2-OH 3.11Å; L516-Y695 HydrophobicContact CB-CD2 4.07Å; L516-Y695 HydrophobicContact CB-CE2 4.17Å; L516-Y695 HydrophobicContact CD1-CE2 3.9Å; I520-Y695 HydrophobicContact CD1-CD2 4.32Å; L691-Y695 HydrophobicContact CD1-CD1 4.14Å; L691-Y695 HydrophobicContact CD1-CE1 4.25Å; A692-Y695 WeakPolarHBondContact O-CA 3.43Å; A692-Y695 WeakPolarHBondContact O-CB 3.41Å; A692-Y695 PolarHBondContact O-N 2.91Å; P693-Y695 VanDerWaalsContact C-N 3.3Å; P693-Y695 PolarHBondContact O-N 3.4Å; Y695-T698 PolarHBondContact O-N 2.87Å; Y695-Y699 AromaticContact CD1-CD2 3.94Å; Y695-Y699 HydrophobicContact CD1-CD2 3.94Å; Y695-Y699 HydrophobicContact CD1-CE2 4.43Å; Y695-Y699 HydrophobicContact CD2-CD2 4.21Å; Y695-Y699 AromaticContact CD2-CE2 3.93Å; Y695-Y699 HydrophobicContact CD2-CE2 3.93Å; Y695-Y699 AromaticContact CE1-CD2 3.64Å; Y695-Y699 HydrophobicContact CE1-CD2 3.64Å; Y695-Y699 HydrophobicContact CE1-CE2 4.01Å; Y695-Y699 AromaticContact CE2-CD2 3.95Å; Y695-Y699 HydrophobicContact CE2-CD2 3.95Å; Y695-Y699 AromaticContact CE2-CE2 3.47Å; Y695-Y699 HydrophobicContact CE2-CE2 3.47Å; Y695-Y699 VanDerWaalsContact CE2-CE2 3.47Å; Y695-Y699 HydrophobicContact CG-CD2 4.2Å; Y695-Y699 HydrophobicContact CG-CE2 4.39Å; Y695-Y699 AromaticContact CZ-CD2 3.64Å; Y695-Y699 AromaticContact CZ-CE2 3.5Å; Y695-Y699 VanDerWaalsContact CZ-CE2 3.5Å; Y695-Y699 WeakPolarHBondContact O-CD2 3.45Å; Y695-Y699 PolarHBondContact O-N 3.45Å; Y695-I701 HydrophobicContact CE1-CD1 4.23Å
696	A	96.8	Very high	89.3	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-59.5	-47.8	176.3	0	0	0	0	0	111.3	L691 A692 P693 T698 Y699 D700 I701 H703	L691-A696 HydrophobicContact CB-CB 4.29Å; A692-A696 PolarHBondContact O-N 3.39Å; P693-A696 PolarHBondContact O-N 3.45Å; A696-T698 PolarHBondContact O-N 2.91Å; A696-Y699 PolarHBondContact O-N 3.48Å; A696-D700 PolarHBondContact O-N 2.87Å; A696-D700 VanDerWaalsContact O-N 3.08Å; A696-I701 HydrophobicContact CB-CB 4.27Å; A696-I701 PolarHBondContact O-N 3.36Å; A696-H703 HydrophobicContact CB-CB 4.1Å; A696-H703 WeakPolarHBondContact CB-ND1 3.5Å
697	E	96.3	Very high	86.6	Confident	92 Å²	92	60.3 Å²	60.3	43%	0.43	31%	0.309	S	S	.	.	H	α-helix	trans	-57.4	-46.5	173.3	-167.6	-159.3	152.3	0	0	111.8	K546 P693 Y699 D700	K546-E697 VanDerWaalsContact CE-O 3.31Å; K546-E697 WeakPolarHBondContact CE-O 3.45Å; K546-E697 PolarHBondContact NZ-O 3.24Å; P693-E697 WeakPolarHBondContact O-CB 3.35Å; P693-E697 PolarHBondContact O-N 2.99Å; E697-Y699 PolarHBondContact O-N 3.19Å; E697-D700 PolarHBondContact O-N 3.31Å; E697-D700 VanDerWaalsContact O-N 3.17Å
698	T	96.4	Very high	83.7	Confident	7 Å²	7	59.6 Å²	59.6	4%	0.043	32%	0.32	C	S	.	.	H	α-helix	trans	-62.3	-29.1	-177	-64.8	0	0	0	0	113.3	I520 F549 L694 Y695 A696	I520-T698 HydrophobicContact CD1-CG2 4.36Å; F549-T698 HydrophobicContact CB-CG2 3.98Å; F549-T698 HydrophobicContact CD1-CG2 3.8Å; F549-T698 HydrophobicContact CG-CG2 4.07Å; L694-T698 VanDerWaalsContact O-CB 3.26Å; L694-T698 WeakPolarHBondContact O-CB 3.39Å; L694-T698 PolarHBondContact O-N 3.32Å; L694-T698 PolarHBondContact O-OG1 3.26Å; Y695-T698 PolarHBondContact O-N 2.87Å; A696-T698 PolarHBondContact O-N 2.91Å
699	Y	96	Very high	80.9	Confident	2 Å²	2	62.5 Å²	62.5	1%	0.008	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.8	8.5	178.7	-71.9	-72.7	0	0	0	114.2	F549 I679 R683 Y695 A696 E697 I701	F549-Y699 HydrophobicContact CD1-CE2 4.1Å; F549-Y699 AromaticContact CD1-CZ 3.97Å; F549-Y699 WeakPolarHBondContact CD1-OH 3.42Å; F549-Y699 HydrophobicContact CE1-CE2 4.1Å; I679-Y699 HydrophobicContact CD1-CD1 3.45Å; I679-Y699 VanDerWaalsContact CD1-CD1 3.45Å; I679-Y699 HydrophobicContact CD1-CD2 4.4Å; I679-Y699 HydrophobicContact CD1-CE1 3.35Å; I679-Y699 HydrophobicContact CD1-CE2 4.33Å; I679-Y699 HydrophobicContact CD1-CG 4Å; I679-Y699 HydrophobicContact CG2-CD1 4.14Å; I679-Y699 HydrophobicContact CG2-CG 4.26Å; R683-Y699 WeakPolarHBondContact CD-O 3.47Å; R683-Y699 PolarHBondContact NH1-O 3.04Å; Y695-Y699 AromaticContact CD1-CD2 3.94Å; Y695-Y699 HydrophobicContact CD1-CD2 3.94Å; Y695-Y699 HydrophobicContact CD1-CE2 4.43Å; Y695-Y699 HydrophobicContact CD2-CD2 4.21Å; Y695-Y699 AromaticContact CD2-CE2 3.93Å; Y695-Y699 HydrophobicContact CD2-CE2 3.93Å; Y695-Y699 AromaticContact CE1-CD2 3.64Å; Y695-Y699 HydrophobicContact CE1-CD2 3.64Å; Y695-Y699 HydrophobicContact CE1-CE2 4.01Å; Y695-Y699 AromaticContact CE2-CD2 3.95Å; Y695-Y699 HydrophobicContact CE2-CD2 3.95Å; Y695-Y699 AromaticContact CE2-CE2 3.47Å; Y695-Y699 HydrophobicContact CE2-CE2 3.47Å; Y695-Y699 VanDerWaalsContact CE2-CE2 3.47Å; Y695-Y699 HydrophobicContact CG-CD2 4.2Å; Y695-Y699 HydrophobicContact CG-CE2 4.39Å; Y695-Y699 AromaticContact CZ-CD2 3.64Å; Y695-Y699 AromaticContact CZ-CE2 3.5Å; Y695-Y699 VanDerWaalsContact CZ-CE2 3.5Å; Y695-Y699 WeakPolarHBondContact O-CD2 3.45Å; Y695-Y699 PolarHBondContact O-N 3.45Å; A696-Y699 PolarHBondContact O-N 3.48Å; E697-Y699 PolarHBondContact O-N 3.19Å; Y699-I701 PolarHBondContact O-N 3.45Å
700	D	94.8	Very high	78	Confident	85 Å²	85	67 Å²	67	46%	0.455	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.6	41.6	-174.8	-58	-56.5	0	0	0	112.4	K546 A696 E697	K546-D700 IonicContact NZ-OD1 3.58Å; K546-D700 PolarHBondContact NZ-OD1 3.1Å; A696-D700 PolarHBondContact O-N 2.87Å; A696-D700 VanDerWaalsContact O-N 3.08Å; E697-D700 PolarHBondContact O-N 3.31Å; E697-D700 VanDerWaalsContact O-N 3.17Å
701	I	94.4	Very high	75.2	Confident	5 Å²	5	68.1 Å²	68.1	3%	0.026	39%	0.388	C	S	.	.			trans	-89.7	122.5	171.1	-56.3	167.1	0	0	0	107.5	I679 R683 W686 L691 Y695 A696 Y699	I679-I701 HydrophobicContact CG2-CD1 4.24Å; R683-I701 HydrophobicContact CG-CB 4.34Å; R683-I701 HydrophobicContact CG-CG1 3.61Å; W686-I701 HydrophobicContact CB-CG2 3.8Å; L691-I701 HydrophobicContact CD1-CB 4.39Å; L691-I701 HydrophobicContact CD1-CD1 3.44Å; L691-I701 VanDerWaalsContact CD1-CD1 3.44Å; L691-I701 HydrophobicContact CD1-CG1 4.48Å; L691-I701 HydrophobicContact CD1-CG2 3.98Å; Y695-I701 HydrophobicContact CE1-CD1 4.23Å; A696-I701 HydrophobicContact CB-CB 4.27Å; A696-I701 PolarHBondContact O-N 3.36Å; Y699-I701 PolarHBondContact O-N 3.45Å
702	P	91.2	Very high	72.4	Confident	57 Å²	57	72.4 Å²	72.4	37%	0.37	42%	0.419	S	S	.	.			trans	-61.1	141.3	175.1	-19	30.7	0	0	0	110.8	W686	W686-P702 HydrophobicContact CD2-CB 3.69Å; W686-P702 HydrophobicContact CD2-CG 4.22Å; W686-P702 HydrophobicContact CE3-CB 3.92Å; W686-P702 VanDerWaalsContact CE3-O 3.27Å; W686-P702 HydrophobicContact CG-CB 4Å; W686-P702 HydrophobicContact CG-CG 4.06Å; W686-P702 HydrophobicContact CZ2-CB 4.45Å; W686-P702 HydrophobicContact CZ3-CB 4.39Å
703	H	84	Confident	69.4	Low	62 Å²	62	79.7 Å²	79.7	29%	0.287	46%	0.458	S	S	.	.			trans	-143.9	161.8	174.9	61.6	-76	0	0	0	109.8	A696 D705	A696-H703 HydrophobicContact CB-CB 4.1Å; A696-H703 WeakPolarHBondContact CB-ND1 3.5Å; H703-D705 PolarHBondContact O-N 3.02Å
704	E	74.6	Confident	66.6	Low	119 Å²	119	85.1 Å²	85.1	56%	0.556	48%	0.477	S	S	*	.			trans	-74.6	110.6	173.8	-78.7	162.4	-137.3	0	0	109.1	R690 T706	R690-E704 IonicContact CZ-OE1 2.81Å; R690-E704 IonicContact CZ-OE2 3.49Å; R690-E704 VanDerWaalsContact NH1-CD 3.33Å; R690-E704 IonicContact NH1-OE1 3.32Å; R690-E704 PolarHBondContact NH1-OE1 3.32Å; R690-E704 IonicContact NH1-OE2 3.03Å; R690-E704 IonicContact NH2-OE1 3.15Å; R690-E704 PolarHBondContact NH2-OE1 3.09Å; R690-E704 IonicContact NH2-OE2 3.67Å; R690-E704 PolarHBondContact NH2-OE2 3.16Å; E704-T706 PolarHBondContact O-N 2.65Å
705	D	59.3	Low	63.7	Low	122 Å²	122	86.4 Å²	86.4	65%	0.652	50%	0.502	S	S	*	.			trans	-59.2	118.7	174	-76.6	-49.3	0	0	0	110.3	H703 S707	H703-D705 PolarHBondContact O-N 3.02Å; D705-S707 PolarHBondContact O-N 2.85Å
706	T	46.9	Very low	60.5	Low	141 Å²	141	91.2 Å²	91.2	87%	0.865	54%	0.541	S	S	*	.			trans	-74.2	47.8	164.7	-45.8	0	0	0	0	110.5	E704	E704-T706 PolarHBondContact O-N 2.65Å
707	S	37.6	Very low	57.6	Low	90 Å²	90	98.7 Å²	98.7	63%	0.629	58%	0.58	S	S	*	*			trans	-77.2	124.7	174.3	-79.9	0	0	0	0	109.4	D705 V709	D705-S707 PolarHBondContact O-N 2.85Å; S707-V709 PolarHBondContact O-N 3.27Å; S707-V709 VanDerWaalsContact O-N 3.07Å
708	T	32.6	Very low	54.8	Low	134 Å²	134	99 Å²	99	82%	0.822	59%	0.589	S	S	*	*			trans	-64.1	107.8	-170.6	50.3	0	0	0	0	112.7	P710	T708-P710 WeakPolarHBondContact O-CD 3.49Å
709	V	33.2	Very low	51.6	Low	126 Å²	126	105 Å²	105	76%	0.764	63%	0.628	S	S	*	*			trans	-76.8	116.8	155.5	-178.2	0	0	0	0	107.5	S707 I711	S707-V709 PolarHBondContact O-N 3.27Å; S707-V709 VanDerWaalsContact O-N 3.07Å; V709-I711 PolarHBondContact O-N 3.41Å
710	P	30.2	Very low	48.7	Very low	101 Å²	101	112 Å²	112	66%	0.656	67%	0.665	S	S	*	*			trans	-68.8	123.1	172.7	28.6	-32.4	0	0	0	109.1	T708 S712	T708-P710 WeakPolarHBondContact O-CD 3.49Å; P710-S712 VanDerWaalsContact C-N 3.33Å; P710-S712 PolarHBondContact O-N 3.2Å
711	I	33.6	Very low	45.8	Very low	152 Å²	152	113.7 Å²	113.7	78%	0.779	68%	0.68	S	S	*	*			trans	-73.4	91.4	174.5	-59.9	178.1	0	0	0	108.2	V709 N713	V709-I711 PolarHBondContact O-N 3.41Å; I711-N713 PolarHBondContact O-N 3.48Å; I711-N713 VanDerWaalsContact O-N 3.16Å
712	S	36.6	Very low	42.9	Very low	103 Å²	103	120.6 Å²	120.6	72%	0.72	72%	0.717	S	S	*	*			trans	-71.9	101	173.2	-67	0	0	0	0	110.2	P710 Q714	P710-S712 VanDerWaalsContact C-N 3.33Å; P710-S712 PolarHBondContact O-N 3.2Å; S712-Q714 PolarHBondContact O-N 3.38Å
713	N	33	Very low	40.1	Very low	155 Å²	155	123.9 Å²	123.9	83%	0.829	74%	0.738	S	S	*	*			trans	-63.8	95.6	178.3	-90.2	-13.1	0	0	0	112.5	I711	I711-N713 PolarHBondContact O-N 3.48Å; I711-N713 VanDerWaalsContact O-N 3.16Å
714	Q	38	Very low	37.7	Very low	188 Å²	188	125.5 Å²	125.5	88%	0.879	76%	0.757	S	S	*	*			trans	-142	133.3	153.4	-64.4	-170.4	7.4	0	0	108.1	S712	S712-Q714 PolarHBondContact O-N 3.38Å
715	G	34.1	Very low	35.9	Very low	74 Å²	74	128.4 Å²	128.4	76%	0.763	77%	0.77	S	S	*	*			cis	-151.4	176.5	-7.2	0	0	0	0	0	110.3
716	A	30.2	Very low	34.7	Very low	101 Å²	101	130.7 Å²	130.7	84%	0.835	78%	0.777	S	S	*	*			trans	-70.4	145.6	178.7	0	0	0	0	0	111.9
717	L	37.1	Very low	34.1	Very low	156 Å²	156	130.5 Å²	130.5	82%	0.817	78%	0.775	S	S	*	*			trans	-167.4	127.9	134.4	-103.4	167.4	0	0	0	111.6
718	T	36.9	Very low	34	Very low	99 Å²	99	129.9 Å²	129.9	61%	0.607	78%	0.784	S	S	*	*			trans	32.6	119.6	154.7	52.3	0	0	0	0	120.9
719	P	30	Very low	34.1	Very low	134 Å²	134	131.1 Å²	131.1	87%	0.87	79%	0.785	S	S	*	*			trans	-72.7	128.7	161	31.7	-32	0	0	0	110.7
720	L	33.5	Very low	34.3	Very low	148 Å²	148	128.6 Å²	128.6	78%	0.775	77%	0.773	S	S	*	*			trans	-112.6	154.2	167.8	-100.4	80.3	0	0	0	111.3
721	P	34.4	Very low	34.6	Very low	120 Å²	120	134 Å²	134	78%	0.779	78%	0.782	S	S	*	*			trans	-90.4	178.9	-160.8	36.7	-38.2	0	0	0	115
722	N	33.2	Very low	34.8	Very low	150 Å²	150	131.8 Å²	131.8	80%	0.802	78%	0.778	S	S	*	*			trans	-51.5	147.9	177.9	-92.8	-19.9	0	0	0	114.1	S724	N722-S724 PolarHBondContact O-N 3.34Å
723	P	34	Very low	34.8	Very low	126 Å²	126	134.3 Å²	134.3	82%	0.818	78%	0.782	S	S	*	*			trans	-78.1	112.4	-177.4	30.9	-34.4	0	0	0	112.5
724	S	33.5	Very low	34.7	Very low	96 Å²	96	132.3 Å²	132.3	67%	0.671	78%	0.778	S	S	*	*			trans	-153.7	128.9	167.3	60.2	0	0	0	0	112.3	N722	N722-S724 PolarHBondContact O-N 3.34Å
725	Q	35.9	Very low	35	Very low	180 Å²	180	129.2 Å²	129.2	84%	0.841	77%	0.774	S	S	*	*			trans	69	107.4	170.6	-54.7	174.5	16.4	0	0	113.7
726	H	33.5	Very low	35.2	Very low	171 Å²	171	132.6 Å²	132.6	79%	0.792	78%	0.775	S	S	*	*				99.2	128	69.1	-106.8	-96.2	0	0	0	112.8
727	T	35.9	Very low	35.6	Very low	136 Å²	136	134.3 Å²	134.3	83%	0.834	77%	0.769	S	S	*	*			trans	58	126.4	158	56	0	0	0	0	120.6
728	G	34.7	Very low	35.5	Very low	78 Å²	78	131.8 Å²	131.8	80%	0.804	76%	0.764	S	S	*	*			trans	157.8	83.8	159.3	0	0	0	0	0	118.5
729	N	35.3	Very low	35.5	Very low	159 Å²	159	132 Å²	132	85%	0.85	77%	0.77	S	S	*	*			trans	-49.3	162	166.3	-60.1	-7.6	0	0	0	113.7
730	S	36.8	Very low	35.6	Very low	74 Å²	74	131.7 Å²	131.7	52%	0.517	77%	0.765	S	S	.	*			cis	-175	164.6	16.2	-134.6	0	0	0	0	115.6
731	Y	36.2	Very low	35.3	Very low	213 Å²	213	131 Å²	131	84%	0.835	77%	0.771	S	S	*	*			trans	71.9	155.9	148.6	-62.2	-37.1	0	0	0	122.1
732	P	38.8	Very low	35.3	Very low	106 Å²	106	130.1 Å²	130.1	69%	0.688	77%	0.766	S	S	*	*			cis	-144.4	-179.1	-25.8	35.1	-13.6	0	0	0	117.9
733	I	36.3	Very low	35.2	Very low	157 Å²	157	132.4 Å²	132.4	81%	0.805	77%	0.771	S	S	*	*			trans	91.3	134.1	158.1	-48	-172.2	0	0	0	119.4
734	C	30.7	Very low	34.9	Very low	113 Å²	113	131.1 Å²	131.1	76%	0.764	77%	0.771	S	S	*	*			trans	-133.7	175.6	174.8	-50.7	0	0	0	0	110.7
735	P	44.6	Very low	34.9	Very low	122 Å²	122	134.3 Å²	134.3	79%	0.792	78%	0.779	S	S	*	*				-134.1	139.1	96.5	10	12.8	0	0	0	114
736	N	38.1	Very low	34.8	Very low	145 Å²	145	130.6 Å²	130.6	78%	0.775	77%	0.771	S	S	*	*				85.8	138.7	78.2	-145.3	17.3	0	0	0	111.2
737	I	37.4	Very low	34.6	Very low	137 Å²	137	133.7 Å²	133.7	70%	0.703	78%	0.777	S	S	*	*			cis	-147.5	146.2	33.8	-67.8	161.6	0	0	0	113.3
738	S	36.5	Very low	34.4	Very low	104 Å²	104	130.9 Å²	130.9	73%	0.727	78%	0.775	S	S	*	*			trans	65	147.2	159.7	66.6	0	0	0	0	120.8
739	S	35.7	Very low	34.2	Very low	103 Å²	103	135 Å²	135	72%	0.72	78%	0.778	S	S	*	*			cis	-160.1	103.2	-23.7	50.6	0	0	0	0	112.6
740	V	31.8	Very low	34.1	Very low	127 Å²	127	134 Å²	134	77%	0.77	78%	0.778	S	S	*	*				49.2	116	121	-178.4	0	0	0	0	120.1	P742	V740-P742 HydrophobicContact CG1-CG 4.11Å
741	C	27.8	Very low	33.9	Very low	134 Å²	134	136 Å²	136	91%	0.905	79%	0.787	S	S	*	*			trans	-114.7	139.6	144.2	-68.6	0	0	0	0	109
742	P	35.6	Very low	33.7	Very low	102 Å²	102	132.6 Å²	132.6	66%	0.662	78%	0.783	S	S	*	*			trans	-130	121.5	170.7	34.4	-17.8	0	0	0	115.5	V740	V740-P742 HydrophobicContact CG1-CG 4.11Å
743	Q	31	Very low	33.4	Very low	198 Å²	198	134 Å²	134	93%	0.925	79%	0.79	S	S	*	*				58.3	135.2	129.6	-62.2	-178.9	-8.9	0	0	122.8
744	A	27.8	Very low	33.4	Very low	98 Å²	98	133 Å²	133	81%	0.81	79%	0.791	S	S	*	*			trans	-71.2	162.1	178.8	0	0	0	0	0	116.3
745	I	33.1	Very low	33.6	Very low	164 Å²	164	132.8 Å²	132.8	84%	0.841	79%	0.788	S	S	*	*			trans	-134.2	142.8	157.5	-61.5	-177.6	0	0	0	107.7
746	P	33.2	Very low	32.8	Very low	102 Å²	102	134.1 Å²	134.1	66%	0.662	79%	0.788	S	S	*	*			trans	-108.7	-176.2	-169.3	39.8	-32.9	0	0	0	116.1
747	Y	28.6	Very low	32.4	Very low	236 Å²	236	134.4 Å²	134.4	93%	0.925	79%	0.79	S	S	*	*			trans	86.4	135.8	174.6	-71.9	-82	0	0	0	119
748	G	32.6	Very low	32.1	Very low	76 Å²	76	138.8 Å²	138.8	78%	0.784	80%	0.799	S	S	*	*			trans	141.2	92.5	169.5	0	0	0	0	0	113.8
749	D	29.8	Very low	32	Very low	165 Å²	165	137 Å²	137	88%	0.882	80%	0.797	S	S	*	*			trans	-70.6	147.1	169	-73.7	-71	0	0	0	112
750	V	32.8	Very low	31.8	Very low	139 Å²	139	137.7 Å²	137.7	84%	0.842	80%	0.802	S	S	*	*				-173.7	141.3	122	146.1	0	0	0	0	110.4
751	T	32.6	Very low	31.7	Very low	114 Å²	114	137.2 Å²	137.2	70%	0.699	80%	0.804	S	S	*	*			trans	-58	136.4	-173.1	51.7	0	0	0	0	116.8
752	N	32	Very low	31.9	Very low	143 Å²	143	137.1 Å²	137.1	77%	0.765	80%	0.8	S	S	*	*				-175.8	123.8	105.7	-93.7	-18.7	0	0	0	115.6
753	T	34.4	Very low	31.8	Very low	134 Å²	134	138.3 Å²	138.3	82%	0.822	81%	0.805	S	S	*	*			trans	31.4	113	149.9	54.8	0	0	0	0	121.7
754	T	35.5	Very low	31.9	Very low	137 Å²	137	134.3 Å²	134.3	84%	0.84	80%	0.798	S	S	*	*			trans	-84.6	-172.9	171.5	36.1	0	0	0	0	114.2
755	P	34	Very low	32.1	Very low	108 Å²	108	136.8 Å²	136.8	70%	0.701	80%	0.796	S	S	*	*			cis	-128.8	173.1	-39.8	38.8	-22.8	0	0	0	111.4
756	L	29	Very low	32.2	Very low	151 Å²	151	134.5 Å²	134.5	79%	0.791	79%	0.792	S	S	*	*			cis	65.5	95.2	40.1	-66.5	177.6	0	0	0	115.5
757	N	29.9	Very low	32.2	Very low	151 Å²	151	138.9 Å²	138.9	81%	0.807	80%	0.804	S	S	*	*				59.4	106.8	92.3	-166	25.1	0	0	0	114.2
758	Y	31	Very low	32.6	Very low	229 Å²	229	131 Å²	131	90%	0.898	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-95.3	125.7	178	-114.1	-91.1	0	0	0	111.3
759	G	33.5	Very low	32.7	Very low	66 Å²	66	133.4 Å²	133.4	68%	0.68	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-83.1	163.8	-175.9	0	0	0	0	0	115.2
760	S	31	Very low	32.9	Very low	117 Å²	117	133.3 Å²	133.3	82%	0.818	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-70.2	144.5	-175.4	-47.4	0	0	0	0	114.6
761	S	31.5	Very low	33	Very low	118 Å²	118	134.5 Å²	134.5	83%	0.825	78%	0.777	S	S	*	*			trans	-112.9	108.3	155.6	-70.8	0	0	0	0	108.8	V763	S761-V763 PolarHBondContact O-N 3.4Å
762	T	31.3	Very low	33.1	Very low	132 Å²	132	136.8 Å²	136.8	81%	0.81	78%	0.779	S	S	*	*			trans	-78.9	117.6	-178	49.2	0	0	0	0	111.5
763	V	33.5	Very low	33.1	Very low	127 Å²	127	136.6 Å²	136.6	77%	0.77	77%	0.769	S	S	*	*			trans	-96.9	124.3	167.8	179.4	0	0	0	0	108.8	S761 I765	S761-V763 PolarHBondContact O-N 3.4Å; V763-I765 PolarHBondContact O-N 2.99Å
764	S	32.1	Very low	33	Very low	113 Å²	113	134.3 Å²	134.3	79%	0.79	76%	0.756	S	S	*	*			trans	-72.9	106.8	-178.4	-56.2	0	0	0	0	111.5
765	I	33.3	Very low	32.8	Very low	150 Å²	150	135.5 Å²	135.5	77%	0.769	76%	0.757	S	S	*	*			trans	-79.4	129.2	174.2	-57.4	174.1	0	0	0	109	V763	V763-I765 PolarHBondContact O-N 2.99Å
766	P	34.1	Very low	32.8	Very low	116 Å²	116	138.2 Å²	138.2	75%	0.753	76%	0.761	S	S	*	*			trans	-61.2	136.7	171.9	-21.8	33.5	0	0	0	111.5	A768	P766-A768 PolarHBondContact O-N 2.96Å
767	Q	34.2	Very low	32.7	Very low	194 Å²	194	136.7 Å²	136.7	91%	0.907	76%	0.763	S	S	*	*			trans	-67.1	107.2	177.5	-69.3	-176.9	-62.2	0	0	110.5
768	A	36.7	Very low	32.8	Very low	70 Å²	70	134.4 Å²	134.4	58%	0.579	75%	0.75	S	S	*	*			trans	-65.5	136.2	173.1	0	0	0	0	0	110.7	P766 H770	P766-A768 PolarHBondContact O-N 2.96Å; A768-H770 PolarHBondContact O-N 2.96Å
769	V	34.7	Very low	32.6	Very low	127 Å²	127	128.6 Å²	128.6	77%	0.77	73%	0.734	S	S	*	*			trans	-72.5	102.5	-178.1	-179.8	0	0	0	0	109.8	H771	V769-H771 PolarHBondContact O-N 3.18Å
770	H	33.2	Very low	32.5	Very low	164 Å²	164	136.6 Å²	136.6	76%	0.759	74%	0.744	S	S	*	*			trans	-68.2	93.4	174.9	-96.9	-74	0	0	0	111.5	A768 H772	A768-H770 PolarHBondContact O-N 2.96Å; H770-H772 PolarHBondContact O-N 3.17Å; H770-H772 VanDerWaalsContact O-N 3.09Å
771	H	36.2	Very low	32.7	Very low	164 Å²	164	133.8 Å²	133.8	76%	0.759	72%	0.724	S	S	*	*			trans	-65.8	106.4	157.2	-87	-74.5	0	0	0	109.2	V769 Y773	V769-H771 PolarHBondContact O-N 3.18Å; H771-Y773 PolarHBondContact O-N 3.14Å
772	H	33.1	Very low	32.9	Very low	161 Å²	161	132.4 Å²	132.4	75%	0.745	71%	0.707	S	S	*	*			trans	-66.2	102.9	178.5	-81.5	7.4	0	0	0	111.8	H770	H770-H772 PolarHBondContact O-N 3.17Å; H770-H772 VanDerWaalsContact O-N 3.09Å
773	Y	31.9	Very low	33.2	Very low	139 Å²	139	131.4 Å²	131.4	55%	0.545	70%	0.696	S	S	.	*			trans	-73.5	130.5	139.8	-82	-116.8	0	0	0	107.2	Y624 H771 N775	Y624-Y773 AromaticContact CD1-CD1 3.61Å; Y624-Y773 HydrophobicContact CD1-CD1 3.61Å; Y624-Y773 AromaticContact CD1-CE1 3.06Å; Y624-Y773 HydrophobicContact CD1-CE1 3.06Å; Y624-Y773 AromaticContact CD1-CZ 3.59Å; Y624-Y773 AromaticContact CE1-CD1 3.55Å; Y624-Y773 HydrophobicContact CE1-CD1 3.55Å; Y624-Y773 HydrophobicContact CE1-CD2 4.42Å; Y624-Y773 AromaticContact CE1-CE1 3.41Å; Y624-Y773 HydrophobicContact CE1-CE1 3.41Å; Y624-Y773 VanDerWaalsContact CE1-CE1 3.41Å; Y624-Y773 HydrophobicContact CE1-CE2 4.28Å; Y624-Y773 HydrophobicContact CE1-CG 4.07Å; Y624-Y773 AromaticContact CE1-CZ 3.79Å; Y624-Y773 HydrophobicContact CE2-CD1 4.47Å; Y624-Y773 HydrophobicContact CG-CD1 4.12Å; Y624-Y773 AromaticContact CG-CE1 3.73Å; Y624-Y773 HydrophobicContact CG-CE1 3.73Å; H771-Y773 PolarHBondContact O-N 3.14Å; Y773-N775 PolarHBondContact O-N 3.41Å
774	P	34	Very low	33.1	Very low	87 Å²	87	129.4 Å²	129.4	57%	0.565	69%	0.687	S	S	*	*			trans	-68.3	121.2	176.4	28.3	-32.3	0	0	0	108.7	Y624 Q776	Y624-P774 HydrophobicContact CE2-CG 4.3Å; Y624-P774 WeakPolarHBondContact OH-CD 3.44Å; P774-Q776 PolarHBondContact O-N 3.08Å
775	N	31	Very low	33.3	Very low	161 Å²	161	130.7 Å²	130.7	86%	0.861	69%	0.685	S	S	*	*			trans	-59.4	109.4	167.6	-78.1	-42.8	0	0	0	108.5	Y773 S777	Y773-N775 PolarHBondContact O-N 3.41Å; N775-S777 PolarHBondContact O-N 3.42Å; N775-S777 VanDerWaalsContact O-N 3.09Å
776	Q	33	Very low	33.3	Very low	166 Å²	166	132 Å²	132	78%	0.776	69%	0.69	S	S	*	*			trans	-64	111.7	157.3	-73.6	-170.5	1.4	0	0	106.8	P774 I778	P774-Q776 PolarHBondContact O-N 3.08Å; Q776-I778 HydrophobicContact CB-CG1 4.22Å; Q776-I778 PolarHBondContact O-N 2.67Å
777	S	27.3	Very low	33.2	Very low	119 Å²	119	132.3 Å²	132.3	83%	0.832	68%	0.684	S	S	*	*			trans	-70.5	69.4	168.3	56.5	0	0	0	0	109.2	N775 N779	N775-S777 PolarHBondContact O-N 3.42Å; N775-S777 VanDerWaalsContact O-N 3.09Å; S777-N779 PolarHBondContact O-N 2.73Å
778	I	31.3	Very low	33.2	Very low	103 Å²	103	128.4 Å²	128.4	53%	0.528	68%	0.676	S	S	.	*			trans	-57.9	128.2	167.3	-63.1	177.5	0	0	0	106.3	Q776 D782 I783	Q776-I778 HydrophobicContact CB-CG1 4.22Å; Q776-I778 PolarHBondContact O-N 2.67Å; I778-D782 HydrophobicContact CG2-CB 4.09Å; I778-I783 HydrophobicContact CG2-CG1 4.41Å
779	N	27	Very low	32.8	Very low	107 Å²	107	130.4 Å²	130.4	57%	0.572	69%	0.685	S	S	*	*			trans	-68.9	145.4	-169.2	-153	-9.2	0	0	0	109.5	S777 S781 D782	S777-N779 PolarHBondContact O-N 2.73Å; N779-S781 PolarHBondContact O-N 3.25Å; N779-D782 WeakPolarHBondContact CB-OD2 3.45Å; N779-D782 PolarHBondContact O-N 2.78Å
780	R	32.8	Very low	32.4	Very low	234 Å²	234	129.8 Å²	129.8	88%	0.883	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.5	-7	-171.6	-125.2	179.4	-175.3	-177.1	0.7	113.5
781	S	35.4	Very low	32.1	Very low	57 Å²	57	127.4 Å²	127.4	40%	0.399	69%	0.687	S	S	.	*	T	Hydrogen-bonded Turn	trans	-78.8	-29.8	170.8	47.8	0	0	0	0	114.9	N779 S784	N779-S781 PolarHBondContact O-N 3.25Å; S781-S784 PolarHBondContact O-N 3.23Å
782	D	34.8	Very low	31.9	Very low	89 Å²	89	127 Å²	127	48%	0.476	69%	0.689	S	S	.	*	G	3₁₀ helix	trans	-87	-21.9	-159.7	-54.3	-20.7	0	0	0	112	I778 N779 S784	I778-D782 HydrophobicContact CG2-CB 4.09Å; N779-D782 WeakPolarHBondContact CB-OD2 3.45Å; N779-D782 PolarHBondContact O-N 2.78Å; D782-S784 PolarHBondContact O-N 2.72Å
783	I	37	Very low	31.6	Very low	112 Å²	112	126.2 Å²	126.2	57%	0.574	69%	0.691	S	S	*	*	G	3₁₀ helix	trans	-70.3	-22.6	174.2	-63.2	173	0	0	0	111.3	I778 N785	I778-I783 HydrophobicContact CG2-CG1 4.41Å; I783-N785 VanDerWaalsContact C-N 3.3Å; I783-N785 PolarHBondContact O-N 3.03Å
784	S	32.7	Very low	31.5	Very low	84 Å²	84	128.5 Å²	128.5	59%	0.587	71%	0.706	S	S	*	*	G	3₁₀ helix	trans	-73.2	-15.4	-176.6	-56.4	0	0	0	0	114.8	S781 D782	S781-S784 PolarHBondContact O-N 3.23Å; D782-S784 PolarHBondContact O-N 2.72Å
785	N	35.8	Very low	31.4	Very low	140 Å²	140	130.9 Å²	130.9	75%	0.749	71%	0.714	S	S	*	*	G	3₁₀ helix	trans	-109.8	8.7	-169.1	-70.6	-40	0	0	0	115	I783	I783-N785 VanDerWaalsContact C-N 3.3Å; I783-N785 PolarHBondContact O-N 3.03Å
786	M	33	Very low	31.3	Very low	178 Å²	178	130.7 Å²	130.7	88%	0.877	71%	0.71	S	S	*	*	S	Bend	trans	-121.9	14.4	175.8	-77.3	-164.4	161.8	0	0	114.4	P788	M786-P788 WeakPolarHBondContact O-CD 3.48Å
787	I	33.1	Very low	31.2	Very low	123 Å²	123	129.5 Å²	129.5	63%	0.631	71%	0.707	S	S	*	*			trans	-100.3	113.8	173.4	-58.9	175.9	0	0	0	109	S789	I787-S789 PolarHBondContact O-N 3.26Å
788	P	33.8	Very low	31.2	Very low	111 Å²	111	133.5 Å²	133.5	72%	0.721	71%	0.706	S	S	*	*			trans	-61.5	120.5	163.7	-18.7	32.2	0	0	0	108.9	M786 C790	M786-P788 WeakPolarHBondContact O-CD 3.48Å; P788-C790 VanDerWaalsContact C-N 3.32Å; P788-C790 PolarHBondContact O-N 3.24Å
789	S	27.3	Very low	30.9	Very low	112 Å²	112	134.1 Å²	134.1	78%	0.783	72%	0.718	S	S	*	*			trans	-74	76.5	-168.1	59.9	0	0	0	0	113.4	I787	I787-S789 PolarHBondContact O-N 3.26Å
790	C	27.3	Very low	31	Very low	115 Å²	115	137 Å²	137	78%	0.777	73%	0.733	S	S	*	*			trans	-88.3	97.1	165.2	-77.6	0	0	0	0	109.7	P788 I792	P788-C790 VanDerWaalsContact C-N 3.32Å; P788-C790 PolarHBondContact O-N 3.24Å; C790-I792 PolarHBondContact O-N 2.97Å
791	S	25.7	Very low	30.6	Very low	113 Å²	113	132.9 Å²	132.9	79%	0.79	73%	0.729	S	S	*	*			trans	-61.8	107.7	-179.3	-52.2	0	0	0	0	112.3
792	I	31.9	Very low	30.5	Very low	155 Å²	155	135.4 Å²	135.4	80%	0.795	75%	0.746	S	S	*	*			trans	-107.2	125.3	160.4	-60.3	179.4	0	0	0	106.3	C790 E794	C790-I792 PolarHBondContact O-N 2.97Å; I792-E794 PolarHBondContact O-N 3.39Å; I792-E794 VanDerWaalsContact O-N 3.16Å
793	N	28.5	Very low	30.3	Very low	146 Å²	146	137.5 Å²	137.5	78%	0.781	76%	0.758	S	S	*	*			trans	-68	113.3	-171.1	-65.2	-25.9	0	0	0	111.7	N795	N793-N795 VanDerWaalsContact C-N 3.28Å; N793-N795 PolarHBondContact O-N 3.47Å
794	E	29.3	Very low	30	Very low	187 Å²	187	139.6 Å²	139.6	87%	0.874	77%	0.77	S	S	*	*			trans	-66.4	88.9	157	-69.1	-170.9	134.5	0	0	109.1	I792	I792-E794 PolarHBondContact O-N 3.39Å; I792-E794 VanDerWaalsContact O-N 3.16Å
795	N	32	Very low	29.9	Very low	137 Å²	137	139.7 Å²	139.7	73%	0.733	77%	0.77	S	S	*	*			trans	-167	88.1	157.6	-101.9	-47.8	0	0	0	111.1	N793	N793-N795 VanDerWaalsContact C-N 3.28Å; N793-N795 PolarHBondContact O-N 3.47Å
796	M	28.7	Very low	29.7	Very low	157 Å²	157	140.8 Å²	140.8	77%	0.773	78%	0.776	S	S	*	*			trans	-128.2	32.7	160.2	-117.7	-64.9	-174.3	0	0	110.9	Y798	M796-Y798 HydrophobicContact CE-CE2 4.32Å; M796-Y798 PolarHBondContact O-N 3.2Å; M796-Y798 HydrophobicContact SD-CD2 4.14Å; M796-Y798 HydrophobicContact SD-CE2 3.79Å
797	I	31.3	Very low	29.6	Very low	140 Å²	140	135.4 Å²	135.4	72%	0.718	77%	0.767	S	S	*	*			trans	-77.8	115.4	162.3	-64.1	178.8	0	0	0	107	C799	I797-C799 PolarHBondContact O-N 2.74Å
798	Y	26	Very low	29.6	Very low	204 Å²	204	137.3 Å²	137.3	80%	0.8	78%	0.778	S	S	*	*			trans	-68.8	99.4	170.4	-93.2	-99.5	0	0	0	110.3	M796	M796-Y798 HydrophobicContact CE-CE2 4.32Å; M796-Y798 PolarHBondContact O-N 3.2Å; M796-Y798 HydrophobicContact SD-CD2 4.14Å; M796-Y798 HydrophobicContact SD-CE2 3.79Å
799	C	26.1	Very low	29.3	Very low	115 Å²	115	141.8 Å²	141.8	78%	0.777	78%	0.781	S	S	*	*			trans	-150.5	139.4	156.2	-100.6	0	0	0	0	110.3	I797 N801	I797-C799 PolarHBondContact O-N 2.74Å; C799-N801 PolarHBondContact O-N 2.81Å
800	N	27.9	Very low	29.6	Very low	168 Å²	168	144.3 Å²	144.3	90%	0.898	78%	0.784	S	S	*	*			trans	-66	126.5	-176.9	-82.4	-33.4	0	0	0	111.4
801	N	26	Very low	29.7	Very low	147 Å²	147	144.7 Å²	144.7	79%	0.786	77%	0.774	S	S	*	*			trans	-93.7	105.4	174.7	-154.3	-0.8	0	0	0	109.6	C799	C799-N801 PolarHBondContact O-N 2.81Å
802	S	31.9	Very low	30	Very low	111 Å²	111	146.1 Å²	146.1	78%	0.776	78%	0.778	S	S	*	*			trans	-122.9	120.8	172.5	-78	0	0	0	0	108.9
803	N	30.9	Very low	30	Very low	133 Å²	133	141.9 Å²	141.9	71%	0.711	77%	0.773	S	S	*	*			trans	-75.8	165.8	-166.1	-72.5	-58	0	0	0	114.8
804	N	30.6	Very low	30.2	Very low	156 Å²	156	141.6 Å²	141.6	83%	0.834	77%	0.771	S	S	*	*			trans	75.4	144.5	159	-78.4	-22.5	0	0	0	116.9
805	S	31.9	Very low	30.4	Very low	85 Å²	85	139 Å²	139	59%	0.594	76%	0.762	S	S	*	*			cis	-167.4	161.9	4.1	37	0	0	0	0	113.4
806	N	30	Very low	30.4	Very low	163 Å²	163	138.8 Å²	138.8	87%	0.872	76%	0.761	S	S	*	*			trans	59.1	126.9	149.7	-61.2	-19.5	0	0	0	120.5
807	G	31.7	Very low	30.6	Very low	66 Å²	66	139.2 Å²	139.2	68%	0.68	76%	0.761	S	S	*	*			trans	163.5	99.5	153.4	0	0	0	0	0	116.9
808	N	33.8	Very low	30.6	Very low	163 Å²	163	137.8 Å²	137.8	87%	0.872	76%	0.762	S	S	*	*			trans	55	127.8	155.9	-51.1	-29	0	0	0	118.7
809	R	26	Very low	31	Very low	205 Å²	205	133 Å²	133	77%	0.774	76%	0.759	S	S	*	*			cis	84.8	70.1	28.7	-156.6	-162.8	-167.3	-143.1	4.7	116.8
810	I	33.4	Very low	31.4	Very low	165 Å²	165	132.4 Å²	132.4	85%	0.846	76%	0.755	S	S	*	*			trans	-147.2	129.4	147.9	-54.4	-179	0	0	0	106.1
811	Q	31.3	Very low	31.7	Very low	123 Å²	123	131.8 Å²	131.8	58%	0.575	75%	0.752	S	S	*	*			cis	107.4	122.1	-2.2	-155.5	178.5	-56.2	0	0	116.3
812	T	31.1	Very low	32.1	Very low	142 Å²	142	128 Å²	128	87%	0.871	75%	0.747	S	S	*	*			trans	65.8	150.7	-177.4	62.4	0	0	0	0	116.3
813	G	32	Very low	32.2	Very low	66 Å²	66	130.9 Å²	130.9	68%	0.68	75%	0.748	S	S	*	*			cis	-164.8	178	-2.5	0	0	0	0	0	108.1
814	N	33.5	Very low	32.3	Very low	140 Å²	140	130.4 Å²	130.4	75%	0.749	75%	0.745	S	S	*	*			cis	-162	148.6	23.1	-88.9	-11.2	0	0	0	108.8
815	I	32.1	Very low	32.5	Very low	132 Å²	132	130.6 Å²	130.6	68%	0.677	74%	0.74	S	S	*	*				63.4	131.4	99	-50.2	169	0	0	0	112.6
816	D	32.9	Very low	32.4	Very low	134 Å²	134	132.4 Å²	132.4	72%	0.717	74%	0.743	S	S	*	*			cis	-126.9	148.1	32.6	-86.8	-66.8	0	0	0	113.3
817	H	33.1	Very low	32.6	Very low	166 Å²	166	131.2 Å²	131.2	77%	0.769	74%	0.742	S	S	*	*				69.6	137.5	73.8	-70.8	-16.1	0	0	0	115.3
818	C	30.7	Very low	32.5	Very low	110 Å²	110	133 Å²	133	74%	0.743	74%	0.739	S	S	*	*			cis	-139	151.5	26.4	-78.6	0	0	0	0	116.3
819	S	33.6	Very low	32.5	Very low	104 Å²	104	133.4 Å²	133.4	73%	0.727	74%	0.736	S	S	*	*			trans	52.7	151.5	133.4	-50.6	0	0	0	0	122.3
820	S	36.1	Very low	32.8	Very low	101 Å²	101	132.3 Å²	132.3	71%	0.706	74%	0.737	S	S	*	*			cis	-163.6	129.6	4.3	17.2	0	0	0	0	107.7
821	D	32.8	Very low	33	Very low	156 Å²	156	132.4 Å²	132.4	83%	0.834	73%	0.734	S	S	*	*				103.7	146.1	78.5	-80.6	-60.3	0	0	0	114.4
822	G	34.7	Very low	32.9	Very low	66 Å²	66	134 Å²	134	68%	0.68	75%	0.746	S	S	*	*			trans	105.4	96.2	179.8	0	0	0	0	0	113.8
823	Q	33.7	Very low	33.1	Very low	172 Å²	172	132.4 Å²	132.4	80%	0.804	74%	0.741	S	S	*	*				60.4	139	59.5	-56.3	-168.4	0	0	0	113.1
824	I	32.7	Very low	33.3	Very low	124 Å²	124	137.1 Å²	137.1	64%	0.636	75%	0.745	S	S	*	*			cis	-162.9	163.9	24.9	-143.4	158.6	0	0	0	112.7
825	H	35.8	Very low	33.4	Very low	159 Å²	159	138 Å²	138	74%	0.736	75%	0.745	S	S	*	*			trans	54.8	134.5	169	-65.6	-52.2	0	0	0	120
826	D	29	Very low	33.6	Very low	124 Å²	124	138.5 Å²	138.5	66%	0.663	74%	0.744	S	S	*	*			cis	77.6	108.1	18.6	-169.7	25.9	0	0	0	118.2
827	V	33.9	Very low	33.7	Very low	138 Å²	138	139.2 Å²	139.2	84%	0.836	75%	0.746	S	S	*	*			trans	-149.2	139.5	139.2	171.6	0	0	0	0	109.5
828	T	29.8	Very low	33.7	Very low	102 Å²	102	138.2 Å²	138.2	63%	0.626	74%	0.742	S	S	*	*			trans	-118.7	134.1	178.7	-65.8	0	0	0	0	113.4
829	Q	35.2	Very low	33.8	Very low	172 Å²	172	139.9 Å²	139.9	80%	0.804	74%	0.739	S	S	*	*			trans	-172.2	138.3	150.8	-105.2	147.9	97.7	0	0	110.7
830	K	32.4	Very low	33.7	Very low	182 Å²	182	142.2 Å²	142.2	79%	0.791	74%	0.738	S	S	*	*			cis	106	144.5	12	-167.1	176.6	-177.3	179.3	0	114.1
831	Q	36.2	Very low	33.4	Very low	167 Å²	167	142.2 Å²	142.2	78%	0.78	74%	0.738	S	S	*	*			trans	86.6	126.3	-175.2	-50.5	179.9	23.4	0	0	113.3
832	N	29.2	Very low	33.4	Very low	156 Å²	156	143.2 Å²	143.2	83%	0.834	74%	0.737	S	S	*	*			cis	84.7	107.2	33.7	-74.9	5.1	0	0	0	116.1
833	S	36.7	Very low	33.4	Very low	109 Å²	109	146.2 Å²	146.2	76%	0.762	74%	0.737	S	S	*	*			trans	-173.8	119.6	135.6	-78.9	0	0	0	0	107.8
834	Q	35.9	Very low	33.3	Very low	166 Å²	166	145.3 Å²	145.3	78%	0.776	74%	0.736	S	S	*	*				63.9	110.9	84.2	-75	-172.6	-9.9	0	0	112.3
835	H	35.1	Very low	33.5	Very low	159 Å²	159	143.9 Å²	143.9	74%	0.736	74%	0.735	S	S	*	*				72.8	141.9	97.7	-77.2	-8	0	0	0	113
836	Q	35	Very low	33.2	Very low	142 Å²	142	143 Å²	143	66%	0.664	74%	0.735	S	S	*	*			cis	-163	170.9	3.3	-129	178.6	14.1	0	0	108.7
837	I	35	Very low	33	Very low	149 Å²	149	141.7 Å²	141.7	76%	0.764	74%	0.736	S	S	*	*			trans	67.5	148.7	150.6	-72.9	164.3	0	0	0	117.4
838	H	33.8	Very low	32.8	Very low	145 Å²	145	139.6 Å²	139.6	67%	0.671	73%	0.728	S	S	*	*			cis	-172.6	144.2	-30.8	-164.6	58.7	0	0	0	107.5
839	Q	33.8	Very low	32.8	Very low	145 Å²	145	142.5 Å²	142.5	68%	0.678	73%	0.734	S	S	*	*			trans	62.6	154.7	165.2	-76.7	175.5	27.2	0	0	117.8
840	Q	31.7	Very low	32.6	Very low	152 Å²	152	141.7 Å²	141.7	71%	0.71	73%	0.732	S	S	*	*			cis	-156.8	155.2	-29.5	-140.2	165.7	4.1	0	0	110
841	S	28.8	Very low	32.6	Very low	101 Å²	101	144.4 Å²	144.4	71%	0.706	74%	0.737	S	S	*	*			trans	42.3	92.3	156.9	57	0	0	0	0	119.8
842	H	33.3	Very low	32.4	Very low	178 Å²	178	139.8 Å²	139.8	82%	0.824	73%	0.734	S	S	*	*			trans	-121.5	162.6	148.1	-85.9	-103	0	0	0	108.5
843	L	33.6	Very low	32.7	Very low	129 Å²	129	136.8 Å²	136.8	68%	0.675	73%	0.726	S	S	*	*			cis	152.8	113.4	-27.9	-100.3	170.6	0	0	0	107.3
844	I	33.1	Very low	32.5	Very low	152 Å²	152	141.5 Å²	141.5	78%	0.779	73%	0.728	S	S	*	*			trans	64	-171.3	160.1	-7.9	-177	0	0	0	116.2
845	P	35.4	Very low	32.3	Very low	95 Å²	95	138.5 Å²	138.5	62%	0.617	73%	0.725	S	S	*	*				-132.9	-158.3	-124.2	47.1	-26.6	0	0	0	115.8
846	D	29.2	Very low	32.2	Very low	139 Å²	139	135.1 Å²	135.1	74%	0.743	72%	0.72	S	S	*	*			trans	52.3	110.7	148.1	-64.7	-38.8	0	0	0	122.1
847	S	26.7	Very low	32.1	Very low	97 Å²	97	134.6 Å²	134.6	68%	0.678	73%	0.726	S	S	*	*				44.9	129.7	130	71.5	0	0	0	0	122.8
848	S	27.8	Very low	32	Very low	95 Å²	95	132.5 Å²	132.5	66%	0.664	72%	0.721	S	S	*	*			trans	75.3	-179.5	145	83.7	0	0	0	0	118.5
849	H	30.7	Very low	31.8	Very low	163 Å²	163	132.1 Å²	132.1	76%	0.755	72%	0.723	S	S	*	*			trans	68.4	142.4	174.2	-75.5	-49.2	0	0	0	116.8
850	M	30.9	Very low	31.8	Very low	155 Å²	155	131.8 Å²	131.8	76%	0.764	73%	0.726	S	S	*	*			cis	-139.3	179.7	-11	-61.9	-154.5	175.3	0	0	108.2
851	R	32.6	Very low	31.8	Very low	239 Å²	239	130.4 Å²	130.4	90%	0.902	73%	0.728	S	S	*	*			cis	-139.6	155.4	16	-60.7	174.1	177	-159	-4.5	107.1
852	G	33	Very low	32.1	Very low	69 Å²	69	129.5 Å²	129.5	71%	0.711	72%	0.722	S	S	*	*			cis	106.1	136.9	42.7	0	0	0	0	0	108.4
853	S	33.6	Very low	32.1	Very low	94 Å²	94	128.2 Å²	128.2	66%	0.657	72%	0.721	S	S	*	*			cis	-161	170.2	9.2	-63.5	0	0	0	0	111.3
854	Y	33.1	Very low	32.2	Very low	208 Å²	208	126.1 Å²	126.1	82%	0.816	72%	0.717	S	S	*	*			trans	72.4	123.3	169	-52.6	-62.5	0	0	0	115.2
855	S	32.2	Very low	32.3	Very low	102 Å²	102	126 Å²	126	71%	0.713	72%	0.718	S	S	*	*				71.9	134.2	62.2	-60.8	0	0	0	0	112.4
856	S	32.3	Very low	32.3	Very low	89 Å²	89	126.7 Å²	126.7	62%	0.622	73%	0.725	S	S	*	*			cis	-169.9	160	-4.4	-92.5	0	0	0	0	108.5
857	T	32.6	Very low	33.1	Very low	131 Å²	131	125.2 Å²	125.2	80%	0.804	72%	0.723	S	S	*	*			trans	61.4	158.6	156	51.1	0	0	0	0	117.2
858	T	34	Very low	33.6	Very low	105 Å²	105	127.1 Å²	127.1	64%	0.644	73%	0.725	S	S	*	*			cis	-164	150	-15.9	22.9	0	0	0	0	109.4
859	N	29.4	Very low	33.9	Very low	136 Å²	136	128.6 Å²	128.6	73%	0.727	73%	0.725	S	S	*	*			trans	65.1	143.2	138.5	-71.3	-4.3	0	0	0	123.8
860	L	33.5	Very low	34.1	Very low	138 Å²	138	126 Å²	126	72%	0.723	72%	0.717	S	S	*	*			trans	73.1	120.1	138.7	-72.8	164.6	0	0	0	120.7
861	T	31.9	Very low	34.4	Very low	123 Å²	123	126.5 Å²	126.5	76%	0.755	72%	0.717	S	S	*	*			trans	65.2	150.2	135.1	55.4	0	0	0	0	120
862	S	35.6	Very low	34.5	Very low	83 Å²	83	120 Å²	120	58%	0.58	71%	0.709	S	S	*	*			cis	-177.8	154.5	-17.2	51.7	0	0	0	0	108.2
863	N	32.9	Very low	34.7	Very low	151 Å²	151	125.1 Å²	125.1	81%	0.807	71%	0.714	S	S	*	*			trans	66	159	159.1	-60.5	-6.2	0	0	0	114.9
864	S	35	Very low	35.1	Very low	85 Å²	85	125.3 Å²	125.3	59%	0.594	71%	0.713	S	S	*	*			cis	-161.4	-176.8	-18.5	42.1	0	0	0	0	109.5
865	D	36.3	Very low	35	Very low	148 Å²	148	124 Å²	124	79%	0.791	71%	0.712	S	S	*	*			trans	76.4	112.3	152.1	-51.8	-44.4	0	0	0	120.9
866	S	34.3	Very low	35	Very low	111 Å²	111	124.8 Å²	124.8	78%	0.776	72%	0.717	S	S	*	*			trans	-76.8	-162.3	155.3	-30.2	0	0	0	0	110.2
867	P	46.3	Very low	35	Very low	108 Å²	108	124.3 Å²	124.3	70%	0.701	73%	0.726	S	S	*	*			cis	-135.6	-153.5	-16	24.6	2.6	0	0	0	112.2
868	L	36.8	Very low	34.9	Very low	137 Å²	137	126.8 Å²	126.8	72%	0.717	73%	0.729	S	S	*	*			trans	99.2	107.7	143.9	-73.5	162.1	0	0	0	122.2
869	N	34.8	Very low	34.7	Very low	125 Å²	125	132 Å²	132	67%	0.668	74%	0.742	S	S	*	*				92.7	134.3	120.2	-97.2	0.5	0	0	0	124.8
870	N	34.9	Very low	34.7	Very low	108 Å²	108	132.2 Å²	132.2	58%	0.578	74%	0.744	S	S	*	*			trans	83.3	120.1	134.1	-76.4	-26.1	0	0	0	123.1
871	Q	36.6	Very low	34.6	Very low	166 Å²	166	135.6 Å²	135.6	78%	0.776	75%	0.748	S	S	*	*				71.4	147.9	128.9	-63.1	166.7	31.3	0	0	118.3
872	S	35.8	Very low	34.8	Very low	103 Å²	103	136.5 Å²	136.5	72%	0.72	74%	0.744	S	S	*	*			cis	-163.5	149.8	-10.9	46.3	0	0	0	0	113.3
873	H	36.2	Very low	34.6	Very low	177 Å²	177	138.7 Å²	138.7	82%	0.819	75%	0.749	S	S	*	*			trans	-20.2	168	148	-76.6	-60.8	0	0	0	119.9
874	P	42	Very low	34.6	Very low	97 Å²	97	138.5 Å²	138.5	63%	0.63	75%	0.748	S	S	*	*			cis	-147.3	-144.9	-43.5	42.7	-20.9	0	0	0	112.8
875	F	31.9	Very low	34.3	Very low	182 Å²	182	139.2 Å²	139.2	80%	0.798	75%	0.753	S	S	*	*			trans	97.8	110.9	162.1	-84.7	-81.8	0	0	0	122.6
876	S	32.4	Very low	34.1	Very low	117 Å²	117	140.1 Å²	140.1	82%	0.818	76%	0.756	S	S	*	*			trans	56.4	138.6	133.4	-68.3	0	0	0	0	125.3
877	G	32.1	Very low	33.8	Very low	79 Å²	79	140.9 Å²	140.9	81%	0.814	76%	0.756	S	S	*	*			trans	173.2	112.4	159.5	0	0	0	0	0	113.2
878	Q	29.4	Very low	33	Very low	184 Å²	184	145.7 Å²	145.7	86%	0.86	76%	0.762	S	S	*	*			trans	-81.5	160	175.4	-60.6	165	-51.2	0	0	111.6
879	F	31	Very low	32.7	Very low	213 Å²	213	145.5 Å²	145.5	93%	0.934	76%	0.762	S	S	*	*				-169.1	157.9	130	-98	-62.1	0	0	0	111.6
880	N	28.3	Very low	32.8	Very low	141 Å²	141	145.1 Å²	145.1	75%	0.754	77%	0.766	S	S	*	*			trans	-92.3	164.3	178.1	-61.1	-33.7	0	0	0	111.3
881	Y	32.9	Very low	32.7	Very low	210 Å²	210	145.6 Å²	145.6	82%	0.824	78%	0.778	S	S	*	*				-177	160	107.2	-106.7	-80.9	0	0	0	113.8
882	H	35.1	Very low	32.3	Very low	141 Å²	141	145.3 Å²	145.3	65%	0.653	78%	0.781	S	S	*	*			trans	-48.3	153.2	-174.4	-86.4	-103.3	0	0	0	120.8
883	D	31.4	Very low	32.2	Very low	129 Å²	129	146.1 Å²	146.1	69%	0.69	79%	0.787	S	S	*	*			trans	59.8	156.8	136.8	-54.3	-19.2	0	0	0	120
884	N	32.7	Very low	31.9	Very low	148 Å²	148	145 Å²	145	79%	0.791	79%	0.788	S	S	*	*			cis	-147.4	172.5	12.5	-139	-27.5	0	0	0	112.2
885	S	29.4	Very low	31.6	Very low	100 Å²	100	145.2 Å²	145.2	70%	0.699	80%	0.797	S	S	*	*			trans	-92.1	143.7	-176.4	57.6	0	0	0	0	115
886	I	31.2	Very low	31.6	Very low	166 Å²	166	146.8 Å²	146.8	85%	0.851	80%	0.799	S	S	*	*			trans	-139.6	136.4	156.3	-62.7	-174.9	0	0	0	109.3
887	T	28.2	Very low	31.7	Very low	128 Å²	128	146 Å²	146	79%	0.785	79%	0.794	S	S	*	*			trans	-107.6	136.2	177	-52.1	0	0	0	0	109.8
888	Y	30.8	Very low	31.6	Very low	208 Å²	208	149 Å²	149	82%	0.816	79%	0.791	S	S	*	*			trans	-153	157.4	159.5	-119.1	-79.6	0	0	0	114.7
889	N	30.6	Very low	31.8	Very low	134 Å²	134	145.5 Å²	145.5	72%	0.717	79%	0.787	S	S	*	*			trans	-27.5	152	-171.4	-75	-24.8	0	0	0	122
890	P	35.5	Very low	31.9	Very low	116 Å²	116	146.5 Å²	146.5	75%	0.753	79%	0.785	S	S	*	*			trans	-84.5	142.1	162.8	35.7	-33.1	0	0	0	112.8
891	S	32.8	Very low	32.1	Very low	119 Å²	119	147.1 Å²	147.1	83%	0.832	79%	0.788	S	S	*	*			trans	-170.6	138.1	156.1	-85.8	0	0	0	0	112.4
892	N	28.7	Very low	32	Very low	159 Å²	159	143.5 Å²	143.5	85%	0.85	79%	0.792	S	S	*	*			trans	28.8	113.1	159.7	-73.2	-18.4	0	0	0	120.6
893	S	34	Very low	31.9	Very low	120 Å²	120	142.2 Å²	142.2	84%	0.839	80%	0.799	S	S	*	*			trans	-143.5	113.6	142.9	62.2	0	0	0	0	111.1
894	N	29.6	Very low	32.3	Very low	155 Å²	155	141.6 Å²	141.6	83%	0.829	80%	0.802	S	S	*	*			trans	-77.3	138.1	172	-78	-48	0	0	0	110.7
895	A	35.7	Very low	32.4	Very low	101 Å²	101	140 Å²	140	84%	0.835	80%	0.803	S	S	*	*			trans	-139.7	108.3	165.4	0	0	0	0	0	110.2
896	Y	32.7	Very low	32.5	Very low	214 Å²	214	141.1 Å²	141.1	84%	0.839	81%	0.81	S	S	*	*			trans	-70.3	145.1	174.7	-90.1	-116.3	0	0	0	111.3
897	S	33.2	Very low	32.7	Very low	100 Å²	100	139.9 Å²	139.9	70%	0.699	81%	0.811	S	S	*	*				172.4	114.7	111.6	-76.7	0	0	0	0	114.8
898	N	30.7	Very low	33	Very low	143 Å²	143	142.7 Å²	142.7	77%	0.765	82%	0.815	S	S	*	*			trans	51.3	108.4	139.6	-55.6	-22.1	0	0	0	121
899	S	33.5	Very low	32.8	Very low	111 Å²	111	141 Å²	141	78%	0.776	82%	0.817	S	S	*	*				-161.3	104.4	121	-87.9	0	0	0	0	115.3
900	R	33.5	Very low	32.9	Very low	233 Å²	233	142.5 Å²	142.5	88%	0.879	82%	0.824	S	S	*	*			trans	63.4	101.3	140.1	-61.1	-179.5	178	170.7	0.8	119
901	D	32.1	Very low	32.7	Very low	154 Å²	154	141.7 Å²	141.7	82%	0.824	82%	0.82	S	S	*	*			trans	-65.7	151.7	167.3	-45.8	-98.5	0	0	0	114
902	C	31.6	Very low	32.7	Very low	134 Å²	134	142.1 Å²	142.1	91%	0.905	82%	0.818	S	S	*	*			trans	-134.4	98.5	161	-83.8	0	0	0	0	110.2
903	S	31.9	Very low	33	Very low	114 Å²	114	141.3 Å²	141.3	80%	0.797	81%	0.814	S	S	*	*			trans	-89.7	147	174.6	-42.5	0	0	0	0	111.9
904	P	39.2	Very low	32.7	Very low	116 Å²	116	146.8 Å²	146.8	75%	0.753	82%	0.818	S	S	*	*			trans	-112.8	117.2	155.6	33.3	-24.1	0	0	0	112.6
905	S	35.2	Very low	32.9	Very low	116 Å²	116	146.8 Å²	146.8	81%	0.811	82%	0.817	S	S	*	*			trans	52	101.8	140.5	-53.1	0	0	0	0	120.1
906	S	32.9	Very low	32.8	Very low	123 Å²	123	148.1 Å²	148.1	86%	0.86	82%	0.815	S	S	*	*			trans	-55	142.2	164.1	-42.9	0	0	0	0	113.1
907	T	34.8	Very low	33	Very low	140 Å²	140	143.6 Å²	143.6	86%	0.859	81%	0.811	S	S	*	*			trans	-133.4	149.9	155	-65.6	0	0	0	0	108.1
908	Q	33.1	Very low	32.9	Very low	187 Å²	187	144.1 Å²	144.1	87%	0.874	82%	0.815	S	S	*	*			trans	-79.4	148.9	-153.5	-66.3	179.2	-7.1	0	0	115
909	M	28.6	Very low	33.1	Very low	173 Å²	173	142.9 Å²	142.9	85%	0.852	82%	0.815	S	S	*	*			trans	-64.2	139.1	169.5	-73.1	-81.8	174.6	0	0	111.5
910	L	31.6	Very low	33.2	Very low	165 Å²	165	145.7 Å²	145.7	86%	0.864	82%	0.816	S	S	*	*			trans	-134.8	91.5	163.1	-110.6	156	0	0	0	108.6	T912	L910-T912 PolarHBondContact O-N 2.81Å
911	S	30.8	Very low	33.4	Very low	98 Å²	98	142.6 Å²	142.6	69%	0.685	81%	0.811	S	S	*	*			trans	-79.4	104.4	-180	-53.1	0	0	0	0	110.6	N913	S911-N913 PolarHBondContact O-N 3.07Å
912	T	33.5	Very low	33.5	Very low	129 Å²	129	142.2 Å²	142.2	79%	0.791	81%	0.805	S	S	*	*			trans	-86.1	97.2	170.3	39.3	0	0	0	0	110.8	L910	L910-T912 PolarHBondContact O-N 2.81Å
913	N	34.4	Very low	33.8	Very low	142 Å²	142	143.4 Å²	143.4	76%	0.759	80%	0.797	S	S	*	*			trans	-61.2	140.1	169.2	-76.9	-24.3	0	0	0	110.9	S911 L915	S911-N913 PolarHBondContact O-N 3.07Å; N913-L915 PolarHBondContact O-N 3.31Å
914	Y	29	Very low	34	Very low	234 Å²	234	145.4 Å²	145.4	92%	0.918	79%	0.793	S	S	*	*			trans	-66.2	129.5	165	-78.9	-102	0	0	0	109.7
915	L	34	Very low	33.7	Very low	155 Å²	155	150.6 Å²	150.6	81%	0.812	80%	0.798	S	S	*	*			trans	-142.8	127.3	168.6	-109	140.8	0	0	0	109.5	N913	N913-L915 PolarHBondContact O-N 3.31Å
916	V	31.6	Very low	33.8	Very low	129 Å²	129	148.6 Å²	148.6	78%	0.782	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-88.7	129.5	-176.3	177.7	0	0	0	0	109.6
917	P	38.2	Very low	33.9	Very low	119 Å²	119	151.4 Å²	151.4	77%	0.773	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-93.9	116.3	167.7	8.4	10.6	0	0	0	110.8
918	S	31.8	Very low	34.1	Very low	111 Å²	111	151.1 Å²	151.1	78%	0.776	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-77.8	146.4	164	-57.5	0	0	0	0	110.7
919	P	33.1	Very low	34.2	Very low	117 Å²	117	147.1 Å²	147.1	76%	0.76	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-93.5	135.5	-173.6	34.4	-33.3	0	0	0	113.4
920	Q	36.3	Very low	34.5	Very low	171 Å²	171	143 Å²	143	80%	0.799	77%	0.767	S	S	*	*			trans	-168.6	144.1	149.2	-114	168	59.5	0	0	114.5
921	Q	37.5	Very low	34.7	Very low	167 Å²	167	142.9 Å²	142.9	78%	0.78	77%	0.767	S	S	*	*			trans	67	154	159.3	-59.1	175.7	30.9	0	0	120.1
922	Q	35.3	Very low	34.8	Very low	147 Å²	147	146.7 Å²	146.7	69%	0.687	77%	0.774	S	S	*	*				-173.8	128.6	-51.3	159.3	170.1	-17.5	0	0	111
923	Q	36.1	Very low	34.6	Very low	158 Å²	158	145.5 Å²	145.5	74%	0.738	77%	0.771	S	S	*	*			trans	63.1	152.5	167.9	-71	162.1	-28.2	0	0	115.5
924	Q	36.1	Very low	34.3	Very low	156 Å²	156	142.5 Å²	142.5	73%	0.729	76%	0.761	S	S	*	*			cis	-165.7	145.4	34.5	-151.1	175.7	97.7	0	0	112.3
925	R	34.4	Very low	34.3	Very low	226 Å²	226	138.3 Å²	138.3	85%	0.853	75%	0.75	S	S	*	*			trans	58.1	151	156.8	-81	177.7	173.7	-160.5	-2.4	121.3
926	S	35.7	Very low	34.2	Very low	74 Å²	74	140.4 Å²	140.4	52%	0.517	75%	0.748	S	S	.	*			cis	178.1	150.9	-28.5	46.6	0	0	0	0	111.3
927	Q	37	Very low	34.2	Very low	182 Å²	182	138.5 Å²	138.5	85%	0.85	74%	0.74	S	S	*	*			trans	65.9	148.9	164.3	-65.7	157.4	-65.1	0	0	115.9
928	V	37.9	Very low	33.5	Very low	133 Å²	133	139.1 Å²	139.1	81%	0.806	75%	0.746	S	S	*	*			cis	-142.2	169	-17.9	-113.7	0	0	0	0	106.4
929	S	35.9	Very low	33.5	Very low	104 Å²	104	139.2 Å²	139.2	73%	0.727	75%	0.747	S	S	*	*			cis	-141.6	163.9	9.9	-98.6	0	0	0	0	108.1
930	A	33.8	Very low	33.2	Very low	85 Å²	85	139.8 Å²	139.8	70%	0.702	75%	0.753	S	S	*	*			cis	89.8	78.8	36	0	0	0	0	0	115.9
931	L	35.4	Very low	32.9	Very low	164 Å²	164	136.3 Å²	136.3	86%	0.859	75%	0.754	S	S	*	*				-159.7	148.8	120.6	-106.4	169.4	0	0	0	112.3
932	Q	34.5	Very low	32.5	Very low	177 Å²	177	136.2 Å²	136.2	83%	0.827	76%	0.757	S	S	*	*			trans	-59.9	132.7	-155.7	-83.5	148.6	-53.4	0	0	119.3
933	S	27.9	Very low	32.4	Very low	104 Å²	104	135.6 Å²	135.6	73%	0.727	76%	0.764	S	S	*	*			trans	-78.6	-175.5	138.4	64.8	0	0	0	0	109.3
934	S	28.5	Very low	32.1	Very low	79 Å²	79	133.4 Å²	133.4	55%	0.552	77%	0.766	S	S	*	*			cis	-177.1	-172	26.4	34.7	0	0	0	0	109.1
935	Q	29	Very low	32.2	Very low	147 Å²	147	131.5 Å²	131.5	69%	0.687	77%	0.767	S	S	*	*			trans	77.7	149.9	161.8	-38.2	-168.2	18.7	0	0	114.2
936	Y	32	Very low	32.1	Very low	199 Å²	199	126.8 Å²	126.8	78%	0.78	76%	0.755	S	S	*	*			cis	-127.1	122.3	20.8	-75.5	-94	0	0	0	110.2
937	S	31.6	Very low	31.8	Very low	88 Å²	88	133.4 Å²	133.4	62%	0.615	77%	0.768	S	S	*	*				76.3	115.6	76.5	79.9	0	0	0	0	114.5
938	C	22.9	Very low	31.5	Very low	133 Å²	133	131.5 Å²	131.5	90%	0.899	76%	0.76	S	S	*	*			trans	-83	134.6	173.4	-61.8	0	0	0	0	111
939	S	32.1	Very low	31.1	Very low	113 Å²	113	130.9 Å²	130.9	79%	0.79	76%	0.755	S	S	*	*			trans	-134	106	168.1	-68.8	0	0	0	0	109.9	A941	S939-A941 PolarHBondContact O-N 2.92Å
940	S	27.2	Very low	30.9	Very low	128 Å²	128	131.4 Å²	131.4	90%	0.895	76%	0.755	S	S	*	*			trans	-77.7	114.4	171.6	-59	0	0	0	0	109.7
941	A	30.6	Very low	30.6	Very low	98 Å²	98	132.1 Å²	132.1	81%	0.81	76%	0.755	S	S	*	*			trans	-118.4	119.6	172.5	0	0	0	0	0	109.9	S939	S939-A941 PolarHBondContact O-N 2.92Å
942	I	29.2	Very low	30.3	Very low	165 Å²	165	129.1 Å²	129.1	85%	0.846	75%	0.747	S	S	*	*			trans	-83	119	179.9	-62.2	163.9	0	0	0	109
943	T	31.8	Very low	30	Very low	135 Å²	135	126.2 Å²	126.2	83%	0.828	74%	0.741	S	S	*	*			trans	-168.5	155.3	146.3	8	0	0	0	0	111.3
944	S	29.6	Very low	30	Very low	111 Å²	111	129.5 Å²	129.5	78%	0.776	75%	0.745	S	S	*	*			trans	-136	177.2	179.3	-51.7	0	0	0	0	109.2
945	P	40	Very low	30.1	Very low	117 Å²	117	131.8 Å²	131.8	76%	0.76	76%	0.761	S	S	*	*				-128.1	161.9	-65.9	37.4	-24.6	0	0	0	111.8
946	Q	31.3	Very low	30.1	Very low	127 Å²	127	130.8 Å²	130.8	59%	0.593	77%	0.765	S	S	*	*			trans	-150.9	163.1	173.3	-109.8	-58.2	-52.1	0	0	113.8	M1 A2	M1-Q946 WeakPolarHBondContact O-CG 3.33Å; M1-Q946 PolarHBondContact O-NE2 3.33Å; M1-Q946 PolarHBondContact O-OE1 2.82Å; A2-Q946 VanDerWaalsContact O-CD 3.23Å; A2-Q946 PolarHBondContact O-NE2 3.45Å; A2-Q946 PolarHBondContact O-OE1 3.16Å; A2-Q946 VanDerWaalsContact O-OE1 3.08Å
947	R	29.9	Very low	30.2	Very low	212 Å²	212	124.8 Å²	124.8	80%	0.8	76%	0.764	S	S	*	*			trans	-129.8	133	-162.9	-112.7	-170	177.4	-167.4	1.4	112.5
948	Q	30.1	Very low	30.1	Very low	143 Å²	143	127.5 Å²	127.5	67%	0.668	77%	0.77	S	S	*	*			trans	172.9	130.1	146.4	-97.9	162.1	27.2	0	0	106.1
949	V	30.4	Very low	30.6	Very low	119 Å²	119	128.9 Å²	128.9	72%	0.721	77%	0.767	S	S	*	*			cis	64.3	111	25.3	-160.2	0	0	0	0	110.2
950	T	30.3	Very low	30.8	Very low	116 Å²	116	128.8 Å²	128.8	71%	0.712	77%	0.766	S	S	*	*			cis	-140.2	177.4	46.1	51.7	0	0	0	0	114.9
951	S	29	Very low	30.9	Very low	100 Å²	100	129 Å²	129	70%	0.699	76%	0.762	S	S	*	*			trans	56.2	142.3	139.8	58	0	0	0	0	121.8
952	S	28.3	Very low	31.1	Very low	101 Å²	101	132.5 Å²	132.5	71%	0.706	76%	0.762	S	S	*	*			cis	-174.8	150.3	-7.2	46.2	0	0	0	0	111.8
953	V	28.2	Very low	31.2	Very low	115 Å²	115	131.1 Å²	131.1	70%	0.697	76%	0.756	S	S	*	*			trans	59.6	108.6	143.2	175.5	0	0	0	0	119.3
954	Q	28.2	Very low	31.4	Very low	174 Å²	174	133.1 Å²	133.1	81%	0.813	76%	0.756	S	S	*	*			trans	44.9	124.9	135	-55.8	169.7	-13	0	0	120.8
955	S	30	Very low	31.5	Very low	126 Å²	126	135 Å²	135	88%	0.881	76%	0.758	S	S	*	*				-160.8	158.5	111.2	-87	0	0	0	0	113.4
956	T	29.6	Very low	31.4	Very low	126 Å²	126	137.7 Å²	137.7	77%	0.773	77%	0.765	S	S	*	*			trans	-99.3	149.6	-165	49.1	0	0	0	0	115
957	G	33.5	Very low	31.4	Very low	73 Å²	73	138.9 Å²	138.9	75%	0.753	77%	0.771	S	S	*	*			trans	-155.5	99.6	151.1	0	0	0	0	0	107.7
958	I	29.3	Very low	31.7	Very low	145 Å²	145	137.2 Å²	137.2	74%	0.744	77%	0.774	S	S	*	*				58.2	90.7	67.5	-50.4	178.2	0	0	0	112.1
959	I	34.6	Very low	31.9	Very low	162 Å²	162	136.3 Å²	136.3	83%	0.831	77%	0.774	S	S	*	*			trans	-135.3	124.3	139.3	-68.6	-168.6	0	0	0	109
960	S	34.8	Very low	31.9	Very low	111 Å²	111	138.2 Å²	138.2	78%	0.776	78%	0.779	S	S	*	*			trans	37	114.3	156.7	-53.7	0	0	0	0	122.1
961	T	29.9	Very low	32.1	Very low	134 Å²	134	140.3 Å²	140.3	82%	0.822	79%	0.786	S	S	*	*			trans	-75.9	160.8	151.2	50.9	0	0	0	0	111.7
962	Q	34.3	Very low	32.3	Very low	170 Å²	170	144.4 Å²	144.4	79%	0.794	79%	0.791	S	S	*	*				-178.7	131.6	124.4	-103.5	175	2	0	0	113.6
963	N	32.7	Very low	32.7	Very low	136 Å²	136	145.5 Å²	145.5	73%	0.727	80%	0.799	S	S	*	*			trans	59.5	150.8	155.7	-64.9	-25	0	0	0	118.8
964	Q	36.4	Very low	32.8	Very low	177 Å²	177	146.8 Å²	146.8	83%	0.827	80%	0.801	S	S	*	*			cis	-139	151.7	12.2	-136.9	150.8	19.9	0	0	110.4
965	N	30.9	Very low	33.1	Very low	152 Å²	152	147 Å²	147	81%	0.813	81%	0.805	S	S	*	*			trans	-79.5	150.4	173.2	-66.5	-48.3	0	0	0	110.6
966	D	37	Very low	33.1	Very low	172 Å²	172	145.2 Å²	145.2	92%	0.92	79%	0.793	S	S	*	*			trans	-143.3	149.5	142.6	-128	-33.3	0	0	0	111.5
967	H	32.8	Very low	33.2	Very low	152 Å²	152	144.7 Å²	144.7	70%	0.704	79%	0.789	S	S	*	*			trans	-130.3	126.6	-156.6	-152.1	-72.7	0	0	0	111.1
968	M	36.4	Very low	33.2	Very low	178 Å²	178	148.8 Å²	148.8	88%	0.877	79%	0.786	S	S	*	*			trans	-140.8	143.9	167.6	-101.3	-60.1	179.3	0	0	113.1
969	N	33	Very low	33.1	Very low	123 Å²	123	149.5 Å²	149.5	66%	0.658	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-89.8	144	-156.6	-69.5	-69.9	0	0	0	114.9
970	L	30.6	Very low	33.3	Very low	160 Å²	160	149.1 Å²	149.1	84%	0.838	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-71.3	120.9	151.2	-82.6	78.9	0	0	0	109.2
971	N	34.8	Very low	33	Very low	160 Å²	160	149.4 Å²	149.4	86%	0.856	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-89.3	116	161.6	-95.6	-30.9	0	0	0	110
972	K	32.8	Very low	33.2	Very low	185 Å²	185	148.9 Å²	148.9	80%	0.804	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-82.7	127.7	170.9	-70.2	176.5	177.6	174	0	109.8
973	S	36.4	Very low	33.1	Very low	125 Å²	125	152.1 Å²	152.1	87%	0.874	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-98.3	128.7	164	-63	0	0	0	0	109.4
974	I	31	Very low	33.2	Very low	142 Å²	142	150.9 Å²	150.9	73%	0.728	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-100.8	128.4	-172.9	-62.2	167.2	0	0	0	110.1
975	I	34.7	Very low	32.9	Very low	177 Å²	177	149.5 Å²	149.5	91%	0.908	80%	0.795	S	S	*	*			trans	-125.6	143.8	144.4	-60.7	-176.6	0	0	0	106.6
976	S	29.5	Very low	33.1	Very low	89 Å²	89	148.1 Å²	148.1	62%	0.622	79%	0.792	S	S	*	*			trans	-136.2	-176.3	-161	-175	0	0	0	0	111.1
977	V	32	Very low	33	Very low	116 Å²	116	144.9 Å²	144.9	70%	0.703	78%	0.781	S	S	*	*			trans	74.9	122.6	167.6	-172	0	0	0	0	113.5
978	K	32.9	Very low	32.9	Very low	158 Å²	158	143.7 Å²	143.7	69%	0.687	78%	0.784	S	S	*	*			cis	-152.1	143.7	2.4	-125.3	160.9	-166.3	173.4	0	109.5	H980	K978-H980 WeakPolarHBondContact CD-NE2 3.4Å; K978-H980 VanDerWaalsContact CE-NE2 3.29Å; K978-H980 WeakPolarHBondContact CE-NE2 3.34Å
979	N	28.5	Very low	32.7	Very low	160 Å²	160	139.9 Å²	139.9	86%	0.856	78%	0.775	S	S	*	*			trans	-130.3	113.5	160.6	-145.8	-1.9	0	0	0	107.6
980	H	37.3	Very low	32.6	Very low	155 Å²	155	143.5 Å²	143.5	72%	0.718	78%	0.781	S	S	*	*			trans	-98.7	97.3	-174.9	-93.8	-73.3	0	0	0	110.7	K978	K978-H980 WeakPolarHBondContact CD-NE2 3.4Å; K978-H980 VanDerWaalsContact CE-NE2 3.29Å; K978-H980 WeakPolarHBondContact CE-NE2 3.34Å
981	S	28.9	Very low	32.5	Very low	116 Å²	116	142.5 Å²	142.5	81%	0.811	78%	0.776	S	S	*	*			trans	-96.9	133.6	162.2	-60.7	0	0	0	0	109.8
982	S	35	Very low	32.4	Very low	123 Å²	123	140.4 Å²	140.4	86%	0.86	77%	0.765	S	S	*	*			trans	-127.7	125.6	169.5	49.5	0	0	0	0	109.6
983	R	30.6	Very low	32.2	Very low	239 Å²	239	138.5 Å²	138.5	90%	0.902	76%	0.764	S	S	*	*			trans	-75.5	160.9	-174	-72.7	168.5	155.2	172.1	-9.4	113.2
984	S	34.6	Very low	31.9	Very low	109 Å²	109	139.6 Å²	139.6	76%	0.762	76%	0.758	S	S	*	*			trans	136.1	142.6	136.8	59.3	0	0	0	0	113.1
985	N	32.2	Very low	31.7	Very low	148 Å²	148	139.1 Å²	139.1	79%	0.791	76%	0.756	S	S	*	*			cis	-151.4	167.3	-14.1	-107.1	-4.5	0	0	0	111.3
986	T	34.9	Very low	31.6	Very low	124 Å²	124	139 Å²	139	76%	0.761	75%	0.751	S	S	*	*			trans	-62.4	177.8	174.1	51.6	0	0	0	0	114.2
987	P	34.2	Very low	32.1	Very low	104 Å²	104	140 Å²	140	68%	0.675	76%	0.755	S	S	*	*			cis	-147.7	172.7	19.1	43.9	-23.2	0	0	0	120.4
988	T	30.9	Very low	32	Very low	126 Å²	126	139.9 Å²	139.9	77%	0.773	76%	0.76	S	S	*	*			trans	34.2	137.2	145.7	57.3	0	0	0	0	121.9
989	S	32.3	Very low	31.7	Very low	99 Å²	99	137.2 Å²	137.2	69%	0.692	76%	0.761	S	S	*	*				-165.4	136.7	62.2	177.3	0	0	0	0	110.7
990	Y	29.5	Very low	32	Very low	198 Å²	198	136 Å²	136	78%	0.776	76%	0.76	S	S	*	*				38.6	136.8	94.5	-76.4	-87.5	0	0	0	116.1
991	N	29.8	Very low	31.5	Very low	139 Å²	139	134.4 Å²	134.4	74%	0.743	76%	0.757	S	S	*	*			cis	-147.6	-172.8	23.4	-154.8	-3.4	0	0	0	114.9
992	N	31.4	Very low	31.6	Very low	117 Å²	117	137.4 Å²	137.4	63%	0.626	76%	0.758	S	S	*	*			trans	-105.9	172.8	-161.8	-57.7	-82.7	0	0	0	117
993	N	28.9	Very low	31.6	Very low	145 Å²	145	136.9 Å²	136.9	78%	0.775	75%	0.754	S	S	*	*			trans	134.1	122.8	147.6	-65.7	-13.4	0	0	0	111.3
994	I	31.2	Very low	31.6	Very low	147 Å²	147	133.6 Å²	133.6	75%	0.754	75%	0.754	S	S	*	*				69.2	114.8	50.5	-51.4	170.3	0	0	0	110.9
995	I	27.5	Very low	31.8	Very low	132 Å²	132	133.4 Å²	133.4	68%	0.677	75%	0.749	S	S	*	*				-162.9	162.4	98.4	-86.8	172.5	0	0	0	111.5
996	H	32.3	Very low	32	Very low	176 Å²	176	132.3 Å²	132.3	82%	0.815	75%	0.75	S	S	*	*			trans	-100.5	-146.8	-177.2	-122	-110.7	0	0	0	111.7
997	P	39.7	Very low	31.6	Very low	108 Å²	108	133.9 Å²	133.9	70%	0.701	75%	0.753	S	S	*	*				-122.6	172.7	-95.7	36.6	-17.6	0	0	0	116.4
998	S	28.8	Very low	31.5	Very low	114 Å²	114	140.3 Å²	140.3	80%	0.797	76%	0.764	S	S	*	*			trans	-179.2	161.5	154.2	25.6	0	0	0	0	109.3
999	S	27.9	Very low	31.4	Very low	102 Å²	102	139.5 Å²	139.5	71%	0.713	76%	0.759	S	S	*	*			cis	163.7	91.3	-35.7	54.1	0	0	0	0	107.1
1000	T	34.2	Very low	31.1	Very low	135 Å²	135	141.4 Å²	141.4	83%	0.828	76%	0.762	S	S	*	*			trans	-168.4	151.1	169.2	28.7	0	0	0	0	106.4
1001	N	27.9	Very low	31.3	Very low	122 Å²	122	141 Å²	141	65%	0.652	77%	0.77	S	S	*	*			cis	177.9	138.5	-25	-127.8	25.3	0	0	0	102.9
1002	E	31	Very low	31.2	Very low	179 Å²	179	141.4 Å²	141.4	84%	0.836	77%	0.772	S	S	*	*			trans	66.6	150	163.5	-52.5	172.8	139.2	0	0	115.4
1003	S	33.9	Very low	31.4	Very low	112 Å²	112	140.7 Å²	140.7	78%	0.783	77%	0.773	S	S	*	*			cis	-135.6	158.7	4.5	-60.9	0	0	0	0	111.6
1004	L	30.3	Very low	31.7	Very low	170 Å²	170	141.1 Å²	141.1	89%	0.89	78%	0.775	S	S	*	*			trans	-83.6	167.7	168.5	-86.3	171.3	0	0	0	112
1005	P	38.3	Very low	31.6	Very low	104 Å²	104	137.8 Å²	137.8	68%	0.675	77%	0.765	S	S	*	*			trans	-95	166.4	-152.2	37.6	-38.9	0	0	0	115.5	L1007	P1005-L1007 PolarHBondContact O-N 2.94Å
1006	P	37.9	Very low	31.8	Very low	125 Å²	125	137.6 Å²	137.6	81%	0.812	77%	0.766	S	S	*	*			trans	-78.9	102.8	165	32.6	-32.2	0	0	0	111.6
1007	L	26.1	Very low	31.7	Very low	158 Å²	158	135.3 Å²	135.3	83%	0.827	76%	0.759	S	S	*	*			trans	-69.6	127.2	137.1	-88.6	163.8	0	0	0	107.4	P1005	P1005-L1007 PolarHBondContact O-N 2.94Å
1008	W	31.5	Very low	31.4	Very low	238 Å²	238	136.3 Å²	136.3	90%	0.902	76%	0.759	S	S	*	*			trans	-170.1	111.1	153.8	-89.9	-0.1	0	0	0	106.8
1009	T	28.5	Very low	31.5	Very low	109 Å²	109	138 Å²	138	67%	0.669	76%	0.759	S	S	*	*				71.7	128.3	71.6	62.6	0	0	0	0	115.8
1010	N	27.2	Very low	31.8	Very low	140 Å²	140	136.2 Å²	136.2	75%	0.749	76%	0.757	S	S	*	*			trans	63.1	94.4	155.2	-61	-13.9	0	0	0	119.9
1011	M	32.4	Very low	31.7	Very low	190 Å²	190	136.8 Å²	136.8	94%	0.936	76%	0.755	S	S	*	*				-142	111.9	107.8	-65	-164	174.2	0	0	105.5
1012	N	29	Very low	31.9	Very low	147 Å²	147	137.3 Å²	137.3	79%	0.786	76%	0.758	S	S	*	*			cis	69.2	132.9	45.5	-142.7	50.4	0	0	0	112.4
1013	P	36.2	Very low	32	Very low	101 Å²	101	129.6 Å²	129.6	66%	0.656	73%	0.726	S	S	*	*			trans	-101.7	153.2	-149.4	37.9	-35.9	0	0	0	115.4
1014	D	34	Very low	32.1	Very low	154 Å²	154	130.1 Å²	130.1	82%	0.824	72%	0.719	S	S	*	*			trans	-123.4	123.3	145.5	-88.3	-55.9	0	0	0	107.4
1015	S	28.8	Very low	32.3	Very low	77 Å²	77	126.7 Å²	126.7	54%	0.538	70%	0.702	S	S	.	*			cis	93.5	147.3	40.3	92.5	0	0	0	0	113
1016	N	32.8	Very low	32	Very low	129 Å²	129	127.2 Å²	127.2	69%	0.69	70%	0.699	S	S	*	*			trans	67.8	117.5	-171.5	-65.9	-67.2	0	0	0	115
1017	N	29.6	Very low	31.8	Very low	128 Å²	128	128.3 Å²	128.3	68%	0.684	69%	0.693	S	S	*	*				66.7	125.2	69.1	-65.3	-36	0	0	0	110.5
1018	N	32.9	Very low	32	Very low	128 Å²	128	125.6 Å²	125.6	68%	0.684	68%	0.683	S	S	*	*			cis	-156.7	174.2	32.6	-105.3	-39.2	0	0	0	112.3
1019	N	32.1	Very low	31.9	Very low	149 Å²	149	121 Å²	121	80%	0.797	68%	0.675	S	S	*	*			trans	19.8	136.6	141	-46.5	-28.1	0	0	0	118.7
1020	G	34.1	Very low	32	Very low	65 Å²	65	121 Å²	121	67%	0.67	68%	0.679	S	S	*	*			cis	171.2	153	13.4	0	0	0	0	0	109.7
1021	N	30.8	Very low	32.2	Very low	148 Å²	148	118.4 Å²	118.4	79%	0.791	67%	0.672	S	S	*	*				70.2	127.5	90.4	-101.4	27.1	0	0	0	115.5
1022	N	32.4	Very low	32.1	Very low	133 Å²	133	117.3 Å²	117.3	71%	0.711	67%	0.67	S	S	*	*			trans	73	133.3	159.5	-45.4	-12.3	0	0	0	115.7
1023	G	33.5	Very low	32.3	Very low	17 Å²	17	114.2 Å²	114.2	18%	0.175	67%	0.673	C	S	.	*			cis	150.8	-175.1	7.8	0	0	0	0	0	110.8	T54 D55	T54-G1023 VanDerWaalsContact OG1-CA 3.29Å; T54-G1023 WeakPolarHBondContact OG1-CA 3.04Å; T54-G1023 PolarHBondContact OG1-N 3.46Å; D55-G1023 VanDerWaalsContact OD2-CA 3.24Å; D55-G1023 WeakPolarHBondContact OD2-CA 3.17Å
1024	L	35.8	Very low	32.2	Very low	122 Å²	122	112.9 Å²	112.9	64%	0.639	68%	0.678	S	S	*	*			trans	60.4	133	161	-45.8	170.1	0	0	0	116.8	C53 T54	C53-L1024 WeakPolarHBondContact CB-O 2.96Å; T54-L1024 CarbonylContact O-C 3.3Å; T54-L1024 WeakPolarHBondContact O-CA 3.45Å; T54-L1024 PolarHBondContact O-N 3.5Å; T54-L1024 VanDerWaalsContact O-N 3.09Å
1025	N	35.5	Very low	32.2	Very low	98 Å²	98	112.1 Å²	112.1	52%	0.524	68%	0.679	S	S	.	*			cis	-168.7	144.5	-5.9	-112.1	10.5	0	0	0	104.1	T54	T54-N1025 WeakPolarHBondContact O-CA 3.38Å; T54-N1025 PolarHBondContact O-N 3Å
1026	D	30.4	Very low	32.8	Very low	115 Å²	115	114.1 Å²	114.1	62%	0.615	69%	0.69	S	S	*	*				68.5	157.1	84.1	-156.1	-1.5	0	0	0	114.2
1027	H	34.7	Very low	32.8	Very low	148 Å²	148	116 Å²	116	69%	0.685	69%	0.694	S	S	*	*			trans	72.1	151.7	162.8	-72.9	17.9	0	0	0	118.8
1028	T	30.2	Very low	32.9	Very low	102 Å²	102	115.8 Å²	115.8	63%	0.626	69%	0.692	S	S	*	*			cis	-167.7	172.6	-41.9	13.8	0	0	0	0	109.3
1029	I	28.9	Very low	33	Very low	140 Å²	140	117.2 Å²	117.2	72%	0.718	70%	0.695	S	S	*	*			trans	46	103.8	142.3	-60.5	156.9	0	0	0	118.3
1030	S	31.9	Very low	33.1	Very low	110 Å²	110	117.1 Å²	117.1	77%	0.769	69%	0.689	S	S	*	*				-177.5	135.1	113.6	-80.4	0	0	0	0	110.4
1031	S	29.8	Very low	33	Very low	86 Å²	86	121.6 Å²	121.6	60%	0.601	69%	0.693	S	S	*	*			cis	91.9	113	38.4	-64.3	0	0	0	0	113.5
1032	N	31.3	Very low	33.1	Very low	166 Å²	166	119.1 Å²	119.1	89%	0.888	69%	0.687	S	S	*	*			trans	67.7	147.1	164.5	-45.6	-32.9	0	0	0	115.3
1033	G	32.7	Very low	33.2	Very low	82 Å²	82	121.8 Å²	121.8	85%	0.845	70%	0.695	S	S	*	*			cis	129	133.2	10.6	0	0	0	0	0	109
1034	G	33.9	Very low	33.1	Very low	73 Å²	73	128.4 Å²	128.4	75%	0.753	72%	0.721	S	S	*	*			cis	-169.8	-145.4	1.3	0	0	0	0	0	112.6
1035	T	34.9	Very low	33.1	Very low	139 Å²	139	131.4 Å²	131.4	85%	0.853	73%	0.732	S	S	*	*			trans	-23.3	151.3	167.9	46.9	0	0	0	0	118.1
1036	P	40.6	Very low	32.8	Very low	119 Å²	119	134 Å²	134	77%	0.773	74%	0.741	S	S	*	*			cis	-124.6	-172.9	37.2	11.9	14	0	0	0	113.9
1037	E	32.7	Very low	32.9	Very low	167 Å²	167	140.1 Å²	140.1	78%	0.78	76%	0.757	S	S	*	*			cis	153.3	164.2	-19.4	-162.1	-160.3	139.6	0	0	106.7
1038	I	32.8	Very low	32.7	Very low	125 Å²	125	140.7 Å²	140.7	64%	0.641	76%	0.76	S	S	*	*			trans	84	113.8	160.2	-57.3	-174.3	0	0	0	120.5
1039	Q	34.4	Very low	32.9	Very low	158 Å²	158	142.8 Å²	142.8	74%	0.738	77%	0.772	S	S	*	*			trans	74.4	100.2	146.6	-82.5	155.7	2.9	0	0	125.3
1040	Q	33.4	Very low	33	Very low	146 Å²	146	140.8 Å²	140.8	68%	0.682	77%	0.771	S	S	*	*				88.2	146.8	108.8	-85.6	-174.7	30.3	0	0	123.7
1041	Q	33.6	Very low	33.5	Very low	160 Å²	160	140.4 Å²	140.4	75%	0.748	77%	0.766	S	S	*	*			trans	62.8	92.6	158.8	-66.5	170.4	53.4	0	0	117.1
1042	S	31.2	Very low	33.6	Very low	96 Å²	96	144 Å²	144	67%	0.671	78%	0.777	S	S	*	*				81.3	110.6	64.9	72.8	0	0	0	0	115.9
1043	H	35.1	Very low	33.8	Very low	188 Å²	188	138.5 Å²	138.5	87%	0.87	75%	0.751	S	S	*	*				-171.5	161.3	118.2	-112.3	-85.9	0	0	0	113.1
1044	H	32.1	Very low	33.9	Very low	156 Å²	156	141.8 Å²	141.8	72%	0.722	75%	0.745	S	S	*	*			trans	-77.6	150	-177.3	-74.7	-60.3	0	0	0	115.3
1045	Q	34.3	Very low	33.8	Very low	186 Å²	186	142.6 Å²	142.6	87%	0.869	74%	0.739	S	S	*	*				-172.3	98.7	115.2	-97.3	158.4	38.6	0	0	109.3
1046	Q	29.8	Very low	33.8	Very low	153 Å²	153	142.5 Å²	142.5	72%	0.715	73%	0.733	S	S	*	*				45.8	104.9	94.5	-82.3	-165.3	-19.5	0	0	115.8
1047	Y	32.7	Very low	33.4	Very low	243 Å²	243	143.9 Å²	143.9	95%	0.953	73%	0.733	S	S	*	*				-152.2	103.9	128.2	-100	-66.7	0	0	0	110.4
1048	H	31.1	Very low	33.4	Very low	160 Å²	160	143.6 Å²	143.6	74%	0.741	73%	0.734	S	S	*	*			trans	-85.9	144	165.8	-85.5	-102.9	0	0	0	110.2
1049	T	34.9	Very low	33.2	Very low	145 Å²	145	145.1 Å²	145.1	89%	0.89	74%	0.743	S	S	*	*			trans	-145.5	127.7	135.8	41.5	0	0	0	0	109.3
1050	S	30.5	Very low	33.2	Very low	98 Å²	98	143.7 Å²	143.7	69%	0.685	75%	0.746	S	S	*	*			trans	-126.3	167.9	177.6	-56.8	0	0	0	0	108.8
1051	P	41.2	Very low	33.4	Very low	102 Å²	102	143.5 Å²	143.5	66%	0.662	76%	0.755	S	S	*	*			trans	-91.8	171	-159.5	35.1	-33.4	0	0	0	114.7	F77	F77-P1051 HydrophobicContact CE2-CG 4.48Å; F77-P1051 HydrophobicContact CZ-CG 4.31Å
1052	I	32.5	Very low	33.8	Very low	162 Å²	162	141.1 Å²	141.1	83%	0.831	75%	0.753	S	S	*	*			trans	-157.2	169.9	167.1	-99.4	150	0	0	0	108.5	F77	F77-I1052 HydrophobicContact CE1-CB 4.42Å; F77-I1052 HydrophobicContact CE1-CG1 3.83Å; F77-I1052 HydrophobicContact CZ-CG1 4.37Å
1053	S	35.3	Very low	33.9	Very low	51 Å²	51	143.3 Å²	143.3	36%	0.357	76%	0.757	S	S	.	*			trans	-145.1	-146.7	-142.3	60.5	0	0	0	0	115.1	F77	F77-S1053 WeakPolarHBondContact CD1-OG 3.44Å; F77-S1053 WeakPolarHBondContact CG-OG 3.3Å; F77-S1053 WeakPolarHBondContact O-CB 3.25Å; F77-S1053 PolarHBondContact O-OG 2.78Å
1054	Q	34.3	Very low	34.1	Very low	150 Å²	150	140.4 Å²	140.4	70%	0.701	75%	0.753	S	S	*	*			trans	-82.3	138.9	-175	-57.6	171.1	-57.9	0	0	113.3	F77 S78	F77-Q1054 WeakPolarHBondContact O-CB 3.17Å; F77-Q1054 PolarHBondContact O-N 2.86Å; S78-Q1054 PolarHBondContact N-O 3.19Å
1055	S	32.8	Very low	34.1	Very low	90 Å²	90	139.2 Å²	139.2	63%	0.629	75%	0.752	S	S	*	*			trans	-157.4	165	140	79	0	0	0	0	111.1
1056	D	34	Very low	34.3	Very low	137 Å²	137	139.2 Å²	139.2	73%	0.733	75%	0.751	S	S	*	*			trans	55	127	150	-45	-37.8	0	0	0	119.7
1057	L	33.7	Very low	34.4	Very low	149 Å²	149	138.2 Å²	138.2	78%	0.78	75%	0.751	S	S	*	*			cis	71.2	136.1	28.5	-142.6	82.7	0	0	0	114.9
1058	M	31.9	Very low	34.6	Very low	160 Å²	160	134.8 Å²	134.8	79%	0.788	75%	0.748	S	S	*	*			trans	63	120.4	171.4	-56.1	-152.6	-180	0	0	120.4	T1060	M1058-T1060 PolarHBondContact O-N 3.47Å
1059	N	29	Very low	34.8	Very low	157 Å²	157	134 Å²	134	84%	0.84	75%	0.749	S	S	*	*			trans	18.6	95.5	132.3	-57.5	-8.8	0	0	0	119.8
1060	T	34.8	Very low	34.9	Very low	129 Å²	129	131.3 Å²	131.3	79%	0.791	74%	0.742	S	S	*	*			trans	-148.9	112.3	132.6	53	0	0	0	0	111.6	M1058	M1058-T1060 PolarHBondContact O-N 3.47Å
1061	T	36.9	Very low	35.2	Very low	142 Å²	142	134.8 Å²	134.8	87%	0.871	75%	0.752	S	S	*	*			trans	-113.3	102.1	142.9	46.7	0	0	0	0	106.5
1062	P	42.2	Very low	34.9	Very low	109 Å²	109	134.4 Å²	134.4	71%	0.708	75%	0.752	S	S	*	*			trans	-72.9	164.4	176.8	32.3	-35.2	0	0	0	110.9
1063	D	33.9	Very low	35	Very low	143 Å²	143	132 Å²	132	77%	0.765	75%	0.749	S	S	*	*			trans	-58	147.6	178.2	-52.3	-94.7	0	0	0	113
1064	T	39.1	Very low	35	Very low	127 Å²	127	135.6 Å²	135.6	78%	0.779	77%	0.771	S	S	*	*				-171	120.6	100.9	20.5	0	0	0	0	112.9
1065	N	31.8	Very low	35	Very low	130 Å²	130	135.2 Å²	135.2	70%	0.695	77%	0.773	S	S	*	*			trans	16	121.2	139.7	-59.2	-36.7	0	0	0	118.3
1066	H	37.6	Very low	34.9	Very low	187 Å²	187	138.8 Å²	138.8	87%	0.866	79%	0.785	S	S	*	*				-154.4	139.5	89.5	-104.6	-74.7	0	0	0	113.1
1067	N	33.2	Very low	35	Very low	131 Å²	131	139.6 Å²	139.6	70%	0.701	78%	0.784	S	S	*	*			trans	-49.7	148.8	176.5	-85	-46.2	0	0	0	114.6
1068	L	36.7	Very low	34.9	Very low	172 Å²	172	139.4 Å²	139.4	90%	0.901	79%	0.79	S	S	*	*				-159.3	145.2	111.7	-103.7	166.9	0	0	0	111.4
1069	N	34.4	Very low	35	Very low	142 Å²	142	138.2 Å²	138.2	76%	0.759	79%	0.785	S	S	*	*			trans	-87.5	143.8	-164.2	-62.9	-44.1	0	0	0	114.2
1070	A	37.3	Very low	35	Very low	90 Å²	90	136.3 Å²	136.3	74%	0.744	78%	0.784	S	S	*	*			trans	-159.3	113.3	148.1	0	0	0	0	0	112.1
1071	L	36.4	Very low	34.8	Very low	170 Å²	170	135.7 Å²	135.7	89%	0.89	78%	0.784	S	S	*	*			trans	22	136.7	136.3	-60.6	154.6	0	0	0	119.2
1072	S	36.2	Very low	34.6	Very low	94 Å²	94	137.4 Å²	137.4	66%	0.657	78%	0.782	S	S	*	*			cis	-172.3	146.2	0.1	46.4	0	0	0	0	112.9
1073	S	34.4	Very low	34.3	Very low	111 Å²	111	138.3 Å²	138.3	78%	0.776	78%	0.777	S	S	*	*			trans	51.1	119.1	148.1	-51.7	0	0	0	0	121.4
1074	P	34.4	Very low	34.1	Very low	127 Å²	127	135.5 Å²	135.5	83%	0.825	76%	0.759	S	S	*	*			trans	-87.8	157.4	164.4	37	-33.4	0	0	0	112.3
1075	I	34.6	Very low	33.9	Very low	142 Å²	142	134.7 Å²	134.7	73%	0.728	75%	0.75	S	S	*	*			trans	-131.9	124.7	167.3	-65.1	-180	0	0	0	109	E1077	I1075-E1077 HydrophobicContact CG2-CB 4.26Å
1076	N	31.4	Very low	33.9	Very low	165 Å²	165	132.8 Å²	132.8	88%	0.882	75%	0.753	S	S	*	*			trans	-79.9	127.3	158.4	-83.1	-20	0	0	0	107.5
1077	E	34.3	Very low	33.7	Very low	154 Å²	154	130.1 Å²	130.1	72%	0.72	75%	0.747	S	S	*	*			trans	-145.5	102.6	161.4	-136.4	159.1	-140.6	0	0	112	I1075 L1079	I1075-E1077 HydrophobicContact CG2-CB 4.26Å; E1077-L1079 HydrophobicContact CG-CD1 4.08Å; E1077-L1079 HydrophobicContact CG-CG 4.39Å; E1077-L1079 PolarHBondContact O-N 3.08Å
1078	T	32.1	Very low	33.7	Very low	146 Å²	146	130.1 Å²	130.1	90%	0.896	75%	0.75	S	S	*	*			trans	-74	106.3	161.5	43.9	0	0	0	0	108.6
1079	L	34	Very low	33.5	Very low	134 Å²	134	127.7 Å²	127.7	70%	0.702	74%	0.741	S	S	*	*			trans	-128.3	94.9	171.3	-93.3	167.5	0	0	0	111	E1077	E1077-L1079 HydrophobicContact CG-CD1 4.08Å; E1077-L1079 HydrophobicContact CG-CG 4.39Å; E1077-L1079 PolarHBondContact O-N 3.08Å
1080	S	30.5	Very low	33.5	Very low	117 Å²	117	126.9 Å²	126.9	82%	0.818	74%	0.74	S	S	*	*			trans	-71.9	129.6	160.2	49.5	0	0	0	0	109.7
1081	C	30.2	Very low	33.2	Very low	116 Å²	116	129.2 Å²	129.2	78%	0.784	74%	0.74	S	S	*	*			trans	-139.2	95.6	173.8	-132.5	0	0	0	0	110.3
1082	E	32	Very low	33	Very low	179 Å²	179	126.5 Å²	126.5	84%	0.836	73%	0.73	S	S	*	*			trans	-93.4	121.8	161.3	-73.2	-177.8	87.9	0	0	108.7
1083	Q	35.2	Very low	32.8	Very low	128 Å²	128	128.8 Å²	128.8	60%	0.598	74%	0.735	S	S	*	*			trans	-176.4	147.9	167	-100.7	172.5	-15.1	0	0	106.8	M255 V256	M255-Q1083 PolarHBondContact O-NE2 2.97Å; V256-Q1083 WeakPolarHBondContact O-CG 3.46Å
1084	Q	30.9	Very low	32.7	Very low	84 Å²	84	130.2 Å²	130.2	39%	0.393	73%	0.732	S	S	.	*			cis	-160.8	163.9	-19.3	176.3	156.1	-22.7	0	0	110.5	V256 N257 C258	V256-Q1084 VanDerWaalsContact CA-OE1 3.31Å; N257-Q1084 VanDerWaalsContact C-CA 3.46Å; C258-Q1084 VanDerWaalsContact C-C 3.42Å; C258-Q1084 CarbonylContact C-O 3.56Å; C258-Q1084 CarbonylContact O-C 3.57Å
1085	D	34.5	Very low	32.5	Very low	109 Å²	109	130.4 Å²	130.4	58%	0.583	72%	0.724	S	S	*	*	B	Isolated β-bridge	trans	110.5	80.9	165	-64.5	-35.4	0	0	0	119.9	N257 C258 R259	N257-D1085 CarbonylContact O-C 3.57Å; N257-D1085 VanDerWaalsContact O-CA 3.32Å; N257-D1085 WeakPolarHBondContact O-CA 3.37Å; N257-D1085 PolarHBondContact O-N 2.97Å; C258-D1085 CarbonylContact C-O 3.56Å; R259-D1085 CarbonylContact C-O 3.59Å; R259-D1085 WeakPolarHBondContact CA-O 3.29Å; R259-D1085 PolarHBondContact N-O 3.06Å
1086	A	31	Very low	32.4	Very low	91 Å²	91	129.4 Å²	129.4	75%	0.752	72%	0.724	S	S	*	*			trans	103.5	0	160.7	0	0	0	0	0	117.6	N257 C258 R259	N257-A1086 PolarHBondContact ND2-OXT 3.33Å; N257-A1086 PolarHBondContact O-N 3.11Å; C258-A1086 VanDerWaalsContact CB-O 3.28Å; C258-A1086 WeakPolarHBondContact CB-O 3.36Å; C258-A1086 WeakPolarHBondContact CB-OXT 3.34Å; R259-A1086 WeakPolarHBondContact CD-O 3.32Å; R259-A1086 WeakPolarHBondContact CG-O 3.23Å; R259-A1086 PolarHBondContact NH1-O 2.82Å

Retrieved 1,086 of 1,086 residues in 1490.1 ms (Link to these results)

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