A0A087YCB4_POEFO Loading...

Rho guanine nucleotide exchange factor 19

AlphaFold DB , UniProt , Accession A0A087YCB4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 972 aa.

						>A0A087YCB4_POEFO|A0A087YCB4
MLPGYGFSPFPDFHPHLHAFRCRGESPSMWIPGSGESHNPSESKEGRPLLHPIHPNHVAVCQQETLAFIELQQPAPSKLNGLGSQRQSSDSDAHSQPLNGLRQTLNELNDMQRGKHRTHTDHGMNVNTPSHAVDDAEVVQQNSTRTSWQDQNEKPRTVTTVCRPLHAALSLPLSFPLSSLYTNRDSWESQVPYSSSSPECPEFPGPHASQPQRRTSQASLKEKAIRRKVQVYSPDSPSDESLSSPILEADYIFPGPFASFLEEDLCGLSSLDAASTPSSTDGTPDLPSIGHGDIFNVQSEPLQIIEDSESGAEEEEGGGIVETSLHPGVSFLPRSRQTDQERRRFSASELISRLQLSQRKNSFTLRLGKSLSARAASRDKQSSNIMIRYDKYNSRHRSSGGSSDSGTYSPVGTGLPLPSGDNGMSSHRWSAKLGMRKKSIEEDSSIPSSFPTSNRLSRFLPSSILYQEYSDVAINREIQRQQGKDPGTEEEGLRDEGSDGTPSPSNLSPSSSFRSSRGSAFALWQDIPDVRMSGQLDTFSNEERKLQEAKFELVTSEASYIRSLTIAVDHFMLSQELTECLGAQEKQWLFSKLPEVKDVSERFLQDLEHRLEKDILRFDVCDIVLDHCPALRRVYLPYVTNQAYQEQTYQRLLQENPRFPGILARLEEDPICQRLPLTSFLILPFQRITRLKMLVENILKRTTPGSRDEDTATKAFNELKKIIKECNSSVQSMKRMEELIHLNKKINFEGKIFPLISQSRWLVKHGELLEVDTQMMSISGSKLKLPTKPVYLHLFNDCLLLSRRKDTWKFMVFVHAKIGELKVKDLSQKLQGISGFIFHLQLCEGQQLKHQILLKSHTESGKQRWITAMFPSDPFEDIEQASENDADISQVQCIKSYQAQEHDELTLEKADILHAKTITSDGWVEGIRLSDGERGWFPKTYVEEITSRSARLRNLRENIRIKCVTQKLKGED
					

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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	23.6	Very low	34.9	Very low	247 Å²	247	148.9 Å²	148.9	100%	1.217	83%	0.825	S	S	*	*				0	166.7	0	-60.8	174.1	87	0	0	107.8
2	L	32.7	Very low	34.1	Very low	168 Å²	168	149.7 Å²	149.7	88%	0.88	83%	0.827	S	S	*	*			trans	-71.8	174.2	175	-61.4	159	0	0	0	111
3	P	47.8	Very low	33.7	Very low	125 Å²	125	153 Å²	153	81%	0.812	83%	0.828	S	S	*	*			cis	-113.6	-156.8	-6.6	43.7	-30.3	0	0	0	111.1
4	G	30.6	Very low	33.2	Very low	58 Å²	58	155.3 Å²	155.3	60%	0.598	83%	0.83	S	S	*	*			cis	134.1	146.3	-13.2	0	0	0	0	0	115.2
5	Y	37.3	Very low	34.4	Very low	246 Å²	246	151.3 Å²	151.3	97%	0.965	82%	0.817	S	S	*	*			trans	69	156.7	178.4	-62	-92	0	0	0	117.3
6	G	27	Very low	33.9	Very low	66 Å²	66	154.2 Å²	154.2	68%	0.68	82%	0.823	S	S	*	*			cis	-168.5	-178.7	1.7	0	0	0	0	0	115.2
7	F	28	Very low	33.9	Very low	203 Å²	203	154.3 Å²	154.3	89%	0.89	82%	0.822	S	S	*	*			trans	-73.2	145.2	-173.6	-74.4	-99.2	0	0	0	114.3
8	S	29.1	Very low	33.6	Very low	100 Å²	100	156.3 Å²	156.3	70%	0.699	83%	0.826	S	S	*	*				70	163.9	82.4	103.1	0	0	0	0	115.5
9	P	47.8	Very low	33.3	Very low	119 Å²	119	152.1 Å²	152.1	77%	0.773	82%	0.815	S	S	*	*			cis	-133	-166.7	0.5	41.1	-22	0	0	0	115.8
10	F	37.8	Very low	33.1	Very low	200 Å²	200	153.1 Å²	153.1	88%	0.877	81%	0.812	S	S	*	*			trans	-88.8	179.7	166.4	-78.7	-101.3	0	0	0	112
11	P	42.4	Very low	32.8	Very low	106 Å²	106	156.5 Å²	156.5	69%	0.688	81%	0.814	S	S	*	*				-147.1	-178	99.5	42.8	-28.1	0	0	0	117.3
12	D	25.2	Very low	33	Very low	158 Å²	158	150.8 Å²	150.8	85%	0.845	80%	0.797	S	S	*	*			trans	87.2	136.9	154.4	-61	-27.1	0	0	0	124.1
13	F	28.5	Very low	32.7	Very low	193 Å²	193	154.3 Å²	154.3	85%	0.846	80%	0.798	S	S	*	*			trans	-138.4	130.6	-172.8	-123	-97.6	0	0	0	107.2
14	H	27	Very low	31.7	Very low	185 Å²	185	151.4 Å²	151.4	86%	0.856	79%	0.791	S	S	*	*				-178.5	162.2	127.1	-96.6	-36.5	0	0	0	112.1
15	P	51.4	Low	31.6	Very low	96 Å²	96	157.4 Å²	157.4	62%	0.623	80%	0.803	S	S	*	*			trans	-123.7	145.7	-155.8	39.6	-25.8	0	0	0	114.8
16	H	26	Very low	31.3	Very low	197 Å²	197	151 Å²	151	91%	0.912	80%	0.795	S	S	*	*			trans	-140.3	155.1	160	-82.3	-58.3	0	0	0	114.3
17	L	34.7	Very low	31.8	Very low	156 Å²	156	154.2 Å²	154.2	82%	0.817	80%	0.804	S	S	*	*			trans	-58.4	153.7	-177	-65.9	150.9	0	0	0	113.8
18	H	27.1	Very low	31.8	Very low	191 Å²	191	150.4 Å²	150.4	88%	0.884	80%	0.802	S	S	*	*			trans	-139.9	153.4	149.2	-106.6	-88.2	0	0	0	111.3
19	A	29	Very low	31.7	Very low	76 Å²	76	153.2 Å²	153.2	63%	0.628	81%	0.806	S	S	*	*			trans	-137	-161.2	-166.5	0	0	0	0	0	112.6
20	F	28.5	Very low	30.7	Very low	172 Å²	172	158.9 Å²	158.9	75%	0.754	81%	0.812	S	S	*	*			trans	82.4	145.1	175.6	-54.1	-74.8	0	0	0	116
21	R	27.2	Very low	30.4	Very low	225 Å²	225	156.3 Å²	156.3	85%	0.849	81%	0.806	S	S	*	*			cis	-153.3	179.1	-5.6	-137.2	162.4	-166.5	-176.6	6.1	112.6
22	C	28	Very low	30.1	Very low	126 Å²	126	157.5 Å²	157.5	85%	0.851	81%	0.814	S	S	*	*			trans	-104.8	155.8	-164.7	-39	0	0	0	0	116
23	R	25.9	Very low	30.1	Very low	243 Å²	243	153.8 Å²	153.8	92%	0.917	81%	0.813	S	S	*	*			trans	-174.5	138.9	143.5	-176.7	-176.1	-76.4	-122.1	6.1	108.1
24	G	26.7	Very low	30.1	Very low	64 Å²	64	150.9 Å²	150.9	66%	0.66	82%	0.816	S	S	*	*			cis	175.5	173.5	-8.2	0	0	0	0	0	112.3
25	E	28.2	Very low	30.1	Very low	183 Å²	183	145.8 Å²	145.8	86%	0.855	81%	0.814	S	S	*	*			trans	72.9	167.8	166.3	-69.7	166.5	-146.7	0	0	119.8
26	S	31.8	Very low	29	Very low	113 Å²	113	150.1 Å²	150.1	79%	0.79	83%	0.826	S	S	*	*			trans	-143.2	165.8	-140.1	-41.1	0	0	0	0	115.3
27	P	36.8	Very low	29.1	Very low	133 Å²	133	145.2 Å²	145.2	86%	0.864	81%	0.814	S	S	*	*			trans	-114.4	173.1	156.3	37.8	-28.2	0	0	0	113.7
28	S	28.7	Very low	28.8	Very low	122 Å²	122	146.4 Å²	146.4	85%	0.853	82%	0.815	S	S	*	*			trans	-119.4	170.1	-162.5	52.1	0	0	0	0	116
29	M	26.5	Very low	28.5	Very low	160 Å²	160	144.4 Å²	144.4	79%	0.788	81%	0.811	S	S	*	*			trans	-72.6	167.1	177.3	-57	173.1	-75.7	0	0	113.7
30	W	26.6	Very low	29.2	Very low	238 Å²	238	146.5 Å²	146.5	90%	0.902	82%	0.818	S	S	*	*				176.4	163	108	-100.6	80.7	0	0	0	111.9
31	I	31.3	Very low	29	Very low	146 Å²	146	143.6 Å²	143.6	75%	0.749	82%	0.819	S	S	*	*			trans	-129.8	152.4	175	-21	175.4	0	0	0	108
32	P	37.1	Very low	28.9	Very low	131 Å²	131	141.3 Å²	141.3	85%	0.851	82%	0.818	S	S	*	*				-157.4	-179.6	95.9	41.1	-22.2	0	0	0	115.7
33	G	25.9	Very low	28.7	Very low	80 Å²	80	139.7 Å²	139.7	83%	0.825	81%	0.808	S	S	*	*			trans	148.9	138.5	157.1	0	0	0	0	0	116.5
34	S	28.5	Very low	28.8	Very low	131 Å²	131	137.7 Å²	137.7	92%	0.916	81%	0.806	S	S	*	*			trans	-138.1	150.4	177.9	58	0	0	0	0	112.3
35	G	26.5	Very low	28.8	Very low	78 Å²	78	144.5 Å²	144.5	80%	0.804	82%	0.821	S	S	*	*			trans	-169.2	149.9	177.6	0	0	0	0	0	112.6
36	E	28.1	Very low	28.6	Very low	187 Å²	187	138.8 Å²	138.8	87%	0.874	81%	0.811	S	S	*	*			trans	-99.6	162	-159.5	-62.7	171	110.7	0	0	116
37	S	28.2	Very low	28.4	Very low	95 Å²	95	145 Å²	145	66%	0.664	82%	0.817	S	S	*	*			trans	55.7	121.3	148.2	60.1	0	0	0	0	121.5
38	H	27.8	Very low	28.3	Very low	181 Å²	181	144 Å²	144	84%	0.838	81%	0.811	S	S	*	*				-179.4	144.4	104.1	-97.9	-76.2	0	0	0	112.8
39	N	21.9	Very low	28.2	Very low	149 Å²	149	146.8 Å²	146.8	80%	0.797	82%	0.815	S	S	*	*			trans	-111.4	177	169.1	-84.2	-17.6	0	0	0	108.9
40	P	43.2	Very low	28.2	Very low	120 Å²	120	147.4 Å²	147.4	78%	0.779	82%	0.821	S	S	*	*			cis	-133.8	165.5	-48.3	39	-24.3	0	0	0	112.6
41	S	24.9	Very low	28.2	Very low	110 Å²	110	144.9 Å²	144.9	77%	0.769	82%	0.819	S	S	*	*			trans	-167.5	119.2	162.4	-172.7	0	0	0	0	108.5
42	E	24.7	Very low	28.5	Very low	177 Å²	177	142.9 Å²	142.9	83%	0.827	82%	0.815	S	S	*	*				102.6	114.2	55.7	-117.5	-165.7	170.3	0	0	114.7
43	S	24.3	Very low	28	Very low	93 Å²	93	144.5 Å²	144.5	65%	0.65	82%	0.815	S	S	*	*			trans	96.6	145	141.2	87.7	0	0	0	0	121.9
44	K	27.9	Very low	28.1	Very low	200 Å²	200	148.6 Å²	148.6	87%	0.87	81%	0.812	S	S	*	*			trans	70	94.1	156.7	-64.7	164.1	-172.5	165.9	0	118.8
45	E	25.4	Very low	28.2	Very low	207 Å²	207	146.7 Å²	146.7	97%	0.967	80%	0.797	S	S	*	*			trans	-117.8	147.3	145.7	-168.6	165.5	-125.6	0	0	108.9
46	G	24.6	Very low	28.4	Very low	64 Å²	64	149.6 Å²	149.6	66%	0.66	79%	0.794	S	S	*	*			trans	-163.5	90.9	-166.1	0	0	0	0	0	117.1
47	R	27.4	Very low	28.9	Very low	244 Å²	244	147.7 Å²	147.7	92%	0.921	79%	0.785	S	S	*	*			trans	67.8	175.1	166	-49.1	178.5	161.5	-168.8	-4.9	114.8
48	P	35.3	Very low	29.3	Very low	112 Å²	112	148.9 Å²	148.9	73%	0.727	79%	0.788	S	S	*	*				-132.9	157.6	-73.3	39.1	-24.4	0	0	0	112.8
49	L	25.9	Very low	29.8	Very low	180 Å²	180	142.1 Å²	142.1	94%	0.942	76%	0.763	S	S	*	*			trans	-135	160.3	169.3	-74.7	177.3	0	0	0	112.7
50	L	27.2	Very low	30.7	Very low	173 Å²	173	137.8 Å²	137.8	91%	0.906	74%	0.742	S	S	*	*			trans	-99.2	159.2	-157	-65.5	159.1	0	0	0	113.9
51	H	26.6	Very low	30.4	Very low	185 Å²	185	133.6 Å²	133.6	86%	0.856	72%	0.715	S	S	*	*			trans	-63.2	174.4	169.4	-79.3	-22.9	0	0	0	114.1
52	P	36.8	Very low	31	Very low	104 Å²	104	131.8 Å²	131.8	68%	0.675	69%	0.694	S	S	*	*			cis	-129.3	172.8	-4.9	32.8	-14.5	0	0	0	114.9
53	I	26	Very low	31.6	Very low	164 Å²	164	130.3 Å²	130.3	84%	0.841	69%	0.687	S	S	*	*			trans	-134.7	125.5	155.8	-62.8	-178	0	0	0	109.6
54	H	28.1	Very low	32.2	Very low	167 Å²	167	133.1 Å²	133.1	77%	0.773	69%	0.69	S	S	*	*			trans	-79.7	127.8	167.4	-79.4	-96.6	0	0	0	110.3	N56	H54-N56 PolarHBondContact O-N 3.21Å
55	P	32.4	Very low	32.6	Very low	91 Å²	91	126 Å²	126	59%	0.591	66%	0.664	S	S	*	*			trans	-82.3	107.2	173.2	32	-32.4	0	0	0	111	H57	P55-H57 VanDerWaalsContact C-N 3.28Å; P55-H57 PolarHBondContact O-N 3.29Å
56	N	29.4	Very low	32.9	Very low	139 Å²	139	121.5 Å²	121.5	74%	0.743	65%	0.645	S	S	*	*			trans	-70.9	80.1	170.8	-81.3	-20.1	0	0	0	110.9	H54 V58	H54-N56 PolarHBondContact O-N 3.21Å; N56-V58 PolarHBondContact O-N 3.28Å
57	H	39.1	Very low	33	Very low	147 Å²	147	122.4 Å²	122.4	68%	0.681	65%	0.647	S	S	*	*			trans	-77.4	98.3	173.6	-72.1	-58.2	0	0	0	111.1	P55 A59	P55-H57 VanDerWaalsContact C-N 3.28Å; P55-H57 PolarHBondContact O-N 3.29Å; H57-A59 PolarHBondContact O-N 3.32Å
58	V	35.7	Very low	33.2	Very low	120 Å²	120	120.1 Å²	120.1	73%	0.727	64%	0.644	S	S	*	*			trans	-68.1	118	170.1	179	0	0	0	0	109.2	N56	N56-V58 PolarHBondContact O-N 3.28Å
59	A	39.3	Very low	32.8	Very low	38 Å²	38	121.7 Å²	121.7	31%	0.314	65%	0.645	S	S	.	*			trans	-68.2	141.4	169.2	0	0	0	0	0	110	H57 C61	H57-A59 PolarHBondContact O-N 3.32Å; A59-C61 VanDerWaalsContact C-N 3.29Å; A59-C61 PolarHBondContact O-N 3.14Å
60	V	41.1	Very low	32.9	Very low	58 Å²	58	121.8 Å²	121.8	35%	0.352	64%	0.641	S	S	.	*			trans	-80	74.8	-170.7	-170.9	0	0	0	0	111.3
61	C	35.7	Very low	33	Very low	32 Å²	32	120.9 Å²	120.9	22%	0.216	64%	0.636	C	S	.	*			trans	-70	145.9	158.3	-159.5	0	0	0	0	109.1	A59 Q63 I740	A59-C61 VanDerWaalsContact C-N 3.29Å; A59-C61 PolarHBondContact O-N 3.14Å; C61-Q63 PolarHBondContact O-N 2.86Å; C61-Q63 VanDerWaalsContact O-N 3.17Å; C61-I740 HydrophobicContact CB-CD1 4.4Å
62	Q	37.6	Very low	32.9	Very low	72 Å²	72	121 Å²	121	34%	0.336	64%	0.637	S	S	.	*			trans	-43.4	116.6	-166.3	-72.4	178.3	-75.4	0	0	114.6	E64 T65	Q62-E64 PolarHBondContact NE2-OE2 2.84Å; Q62-E64 PolarHBondContact O-N 3.42Å; Q62-E64 VanDerWaalsContact O-N 3.17Å; Q62-T65 PolarHBondContact O-N 3.22Å
63	Q	38.1	Very low	32.4	Very low	147 Å²	147	124.4 Å²	124.4	69%	0.687	64%	0.644	S	S	*	*	G	3₁₀ helix	trans	-64.2	-21.5	178	-166.3	160	-5.6	0	0	112.8	C61 T65 L66	C61-Q63 PolarHBondContact O-N 2.86Å; C61-Q63 VanDerWaalsContact O-N 3.17Å; Q63-T65 PolarHBondContact O-N 2.82Å; Q63-T65 VanDerWaalsContact O-N 3.11Å; Q63-L66 PolarHBondContact O-N 3.28Å
64	E	37.4	Very low	32.5	Very low	151 Å²	151	122.8 Å²	122.8	71%	0.706	64%	0.644	S	S	*	*	G	3₁₀ helix	trans	-59.1	-15.4	169.6	-59.2	170.5	133.4	0	0	114	Q62	Q62-E64 PolarHBondContact NE2-OE2 2.84Å; Q62-E64 PolarHBondContact O-N 3.42Å; Q62-E64 VanDerWaalsContact O-N 3.17Å
65	T	35.4	Very low	32.6	Very low	52 Å²	52	119.1 Å²	119.1	32%	0.319	64%	0.642	S	S	.	*	G	3₁₀ helix	trans	-102.3	-7.7	175.9	-63	0	0	0	0	113.1	Q62 Q63 I740 K744	Q62-T65 PolarHBondContact O-N 3.22Å; Q63-T65 PolarHBondContact O-N 2.82Å; Q63-T65 VanDerWaalsContact O-N 3.11Å; T65-I740 HydrophobicContact CG2-CG2 3.81Å; T65-K744 PolarHBondContact OG1-NZ 2.88Å
66	L	32	Very low	32.4	Very low	111 Å²	111	120.6 Å²	120.6	58%	0.581	65%	0.652	S	S	*	*			trans	-115.7	50.9	-174.1	-67	-179.8	0	0	0	113.2	Q63	Q63-L66 PolarHBondContact O-N 3.28Å
67	A	25.9	Very low	32.3	Very low	84 Å²	84	119.5 Å²	119.5	69%	0.694	66%	0.655	S	S	*	*	S	Bend	trans	-81.4	118.4	158.5	0	0	0	0	0	109.7
68	F	31.4	Very low	31.6	Very low	195 Å²	195	122.2 Å²	122.2	86%	0.855	67%	0.665	S	S	*	*			trans	55.5	81.7	170	-66.6	-83.3	0	0	0	118.5
69	I	28.7	Very low	31.2	Very low	146 Å²	146	124.5 Å²	124.5	75%	0.749	67%	0.672	S	S	*	*			trans	-132.9	99.1	131	-54.9	-177.9	0	0	0	108.3	L71	I69-L71 HydrophobicContact CG2-CD2 3.79Å; I69-L71 HydrophobicContact CG2-CG 4.04Å; I69-L71 PolarHBondContact O-N 2.81Å
70	E	26.6	Very low	30.5	Very low	182 Å²	182	130.5 Å²	130.5	85%	0.85	70%	0.699	S	S	*	*			trans	-85.4	103.8	170.8	-171.5	169.2	-140.2	0	0	108.8	Q72	E70-Q72 PolarHBondContact O-N 2.85Å
71	L	29.3	Very low	29.9	Very low	154 Å²	154	131 Å²	131	81%	0.806	72%	0.717	S	S	*	*			trans	-77.5	90.4	-176.6	-73.5	176.2	0	0	0	111.3	I69 Q73	I69-L71 HydrophobicContact CG2-CD2 3.79Å; I69-L71 HydrophobicContact CG2-CG 4.04Å; I69-L71 PolarHBondContact O-N 2.81Å; L71-Q73 PolarHBondContact O-N 3.31Å
72	Q	24.8	Very low	29.4	Very low	187 Å²	187	138.4 Å²	138.4	87%	0.874	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-59.5	127.8	176.3	-162.9	172	38.2	0	0	111.6	E70	E70-Q72 PolarHBondContact O-N 2.85Å
73	Q	26.8	Very low	28.8	Very low	176 Å²	176	138.6 Å²	138.6	82%	0.822	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-70.3	142.5	177.9	-68.2	-177	-9.9	0	0	111.5	L71 A75	L71-Q73 PolarHBondContact O-N 3.31Å; Q73-A75 PolarHBondContact O-N 3Å
74	P	28.3	Very low	28.1	Very low	129 Å²	129	137 Å²	137	84%	0.838	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-72.5	116.1	178.4	29	-33.7	0	0	0	111.3
75	A	28.7	Very low	27.6	Very low	90 Å²	90	139.3 Å²	139.3	74%	0.744	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-73.5	144.3	171.7	0	0	0	0	0	111.5	Q73	Q73-A75 PolarHBondContact O-N 3Å
76	P	29.3	Very low	27.1	Very low	122 Å²	122	147.6 Å²	147.6	79%	0.792	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-69.3	133.1	177.9	28.2	-34.4	0	0	0	111.7	K78	P76-K78 PolarHBondContact O-N 3.02Å
77	S	26.8	Very low	26.7	Very low	117 Å²	117	151 Å²	151	82%	0.818	83%	0.829	S	S	*	*			trans	-72.4	107.1	-178.1	38.8	0	0	0	0	112.3
78	K	25.4	Very low	26.7	Very low	204 Å²	204	151.7 Å²	151.7	89%	0.887	83%	0.828	S	S	*	*			trans	-71.7	128.4	165.2	-69.8	-177.9	178	178.9	0	109.7	P76	P76-K78 PolarHBondContact O-N 3.02Å
79	L	26.6	Very low	26.4	Very low	168 Å²	168	146.7 Å²	146.7	88%	0.88	82%	0.817	S	S	*	*			trans	-102.6	102.4	-179.7	-152	111.1	0	0	0	110.8
80	N	25.5	Very low	26.2	Very low	163 Å²	163	146.4 Å²	146.4	87%	0.872	82%	0.817	S	S	*	*			trans	-111.9	146.8	162.4	-73.3	-3.8	0	0	0	108.2
81	G	28	Very low	26.2	Very low	70 Å²	70	142.3 Å²	142.3	72%	0.722	81%	0.809	S	S	*	*			cis	138.1	59.1	-0	0	0	0	0	0	113.5
82	L	25.2	Very low	26	Very low	187 Å²	187	142.1 Å²	142.1	98%	0.979	81%	0.809	S	S	*	*			trans	-164.9	139.1	174.7	-90.9	128.7	0	0	0	106.4
83	G	24.4	Very low	26	Very low	76 Å²	76	137.3 Å²	137.3	78%	0.784	80%	0.8	S	S	*	*			cis	174.7	176.9	-4.7	0	0	0	0	0	106.9
84	S	24.6	Very low	25.9	Very low	114 Å²	114	137.3 Å²	137.3	80%	0.797	80%	0.8	S	S	*	*			cis	-172.8	136.9	-7.7	173.2	0	0	0	0	108.2
85	Q	25.1	Very low	25.9	Very low	198 Å²	198	135.8 Å²	135.8	93%	0.925	79%	0.793	S	S	*	*			trans	-159.3	162	151.7	-122.4	170	-9.2	0	0	112.6
86	R	24.7	Very low	25.7	Very low	227 Å²	227	140.6 Å²	140.6	86%	0.857	80%	0.8	S	S	*	*			trans	-113.3	148.9	-167.5	-56.7	166.1	170.7	166.6	-6.3	111
87	Q	25.3	Very low	26.5	Very low	183 Å²	183	139.3 Å²	139.3	86%	0.855	79%	0.791	S	S	*	*				-179.3	163.4	106.8	-102.2	173.9	-30.3	0	0	115
88	S	25	Very low	26.5	Very low	98 Å²	98	140.5 Å²	140.5	69%	0.685	79%	0.788	S	S	*	*			trans	-25.4	159.2	163.3	35.6	0	0	0	0	119.7
89	S	26.2	Very low	26.5	Very low	90 Å²	90	138.1 Å²	138.1	63%	0.629	79%	0.785	S	S	*	*			cis	-170.3	175.7	-4.4	49.5	0	0	0	0	113.5
90	D	24.3	Very low	26.4	Very low	140 Å²	140	134 Å²	134	75%	0.749	78%	0.783	S	S	*	*			trans	76.7	133.3	150.1	-51.8	-38.9	0	0	0	123.5
91	S	27	Very low	26.5	Very low	95 Å²	95	133.7 Å²	133.7	66%	0.664	78%	0.78	S	S	*	*			trans	56.9	115.4	145.2	-74.9	0	0	0	0	121.2
92	D	23.8	Very low	26.6	Very low	151 Å²	151	141.1 Å²	141.1	81%	0.807	79%	0.786	S	S	*	*				91.6	146.3	76.7	-74.2	-46.4	0	0	0	112.7
93	A	25.5	Very low	26.8	Very low	85 Å²	85	140.1 Å²	140.1	70%	0.702	78%	0.777	S	S	*	*			cis	-160.4	168.9	-17.3	0	0	0	0	0	111.7
94	H	24.6	Very low	27.2	Very low	177 Å²	177	142.1 Å²	142.1	82%	0.819	77%	0.774	S	S	*	*			trans	-25.3	120.3	172.7	-74.2	-83	0	0	0	121.2
95	S	27.6	Very low	27.5	Very low	97 Å²	97	143.8 Å²	143.8	68%	0.678	77%	0.773	S	S	*	*				24.4	124.9	122	61.4	0	0	0	0	121.6
96	Q	24.4	Very low	27.8	Very low	190 Å²	190	140.7 Å²	140.7	89%	0.888	76%	0.763	S	S	*	*			trans	-166.9	179.9	144.7	-115.4	-169.4	35.9	0	0	112.9
97	P	45.8	Very low	28	Very low	95 Å²	95	137.7 Å²	137.7	62%	0.617	76%	0.759	S	S	*	*				-140	-179.2	-99.4	45	-24.9	0	0	0	118.8
98	L	27.7	Very low	28.3	Very low	143 Å²	143	135.1 Å²	135.1	75%	0.749	75%	0.75	S	S	*	*			trans	55.6	139.6	142.1	-79.6	164.3	0	0	0	124.5
99	N	25.7	Very low	28.5	Very low	154 Å²	154	136.2 Å²	136.2	82%	0.824	75%	0.748	S	S	*	*			trans	74.6	146	150.2	-67.1	-23	0	0	0	121.3
100	G	23.8	Very low	28.6	Very low	81 Å²	81	137.9 Å²	137.9	84%	0.835	75%	0.75	S	S	*	*			trans	149.4	127.1	166.2	0	0	0	0	0	114.2
101	L	27.1	Very low	29	Very low	157 Å²	157	138 Å²	138	82%	0.822	75%	0.748	S	S	*	*			trans	-134	125.9	-179.1	-109.7	168.4	0	0	0	111.7
102	R	31.6	Very low	29.2	Very low	225 Å²	225	140.4 Å²	140.4	85%	0.849	75%	0.749	S	S	*	*			trans	58	140.6	159	-68.6	174.1	168.9	-164.2	-3.6	119.5
103	Q	29.4	Very low	29.4	Very low	167 Å²	167	143.6 Å²	143.6	78%	0.78	75%	0.749	S	S	*	*				179.1	140.2	93.2	-92.7	-167.9	24	0	0	114.3
104	T	31.6	Very low	29.4	Very low	118 Å²	118	142.9 Å²	142.9	72%	0.724	75%	0.75	S	S	*	*			trans	62.4	162.5	149.5	54.3	0	0	0	0	119.6
105	L	30.9	Very low	29.7	Very low	148 Å²	148	143.4 Å²	143.4	78%	0.775	75%	0.75	S	S	*	*			cis	-138.5	-178.6	13.2	-161.1	59.1	0	0	0	112.7
106	N	30.9	Very low	29.8	Very low	134 Å²	134	146 Å²	146	72%	0.717	75%	0.752	S	S	*	*			trans	-75.3	-178.2	-173	-47.6	-30.5	0	0	0	113
107	E	30.2	Very low	29.8	Very low	164 Å²	164	147.5 Å²	147.5	77%	0.766	75%	0.749	S	S	*	*			cis	-157.6	167	36.6	-77.6	-158.7	149.7	0	0	110.6
108	L	31.1	Very low	29	Very low	129 Å²	129	148.6 Å²	148.6	68%	0.675	75%	0.754	S	S	*	*			cis	-160.4	-176.9	-6.6	-117.9	175.9	0	0	0	111.2
109	N	30.4	Very low	28.8	Very low	121 Å²	121	149.6 Å²	149.6	65%	0.647	75%	0.754	S	S	*	*			trans	55.8	132.3	166.8	-68.3	38.2	0	0	0	120.1
110	D	28.3	Very low	29	Very low	124 Å²	124	147.5 Å²	147.5	66%	0.663	75%	0.747	S	S	*	*			cis	-146	167.4	0.6	-129.9	-42.4	0	0	0	115.2
111	M	31.6	Very low	29	Very low	142 Å²	142	150.4 Å²	150.4	70%	0.7	74%	0.744	S	S	*	*			trans	-50.6	160.5	-169.6	-67.1	-164.7	-54.2	0	0	117.9
112	Q	32.2	Very low	29	Very low	146 Å²	146	151.4 Å²	151.4	68%	0.682	74%	0.744	S	S	*	*			cis	-173	165.2	-7.9	-100.9	178.3	21.7	0	0	107.2
113	R	28.1	Very low	28.7	Very low	218 Å²	218	144.6 Å²	144.6	82%	0.823	74%	0.743	S	S	*	*			cis	-171.5	123.9	-20.8	167.5	-177.3	-75.8	-144.5	-0.7	111.3
114	G	25.3	Very low	28.6	Very low	70 Å²	70	144.9 Å²	144.9	72%	0.722	75%	0.747	S	S	*	*			trans	80.7	171.8	157.2	0	0	0	0	0	118.1
115	K	30.2	Very low	28.3	Very low	188 Å²	188	146.2 Å²	146.2	82%	0.817	75%	0.75	S	S	*	*			cis	-164.7	142.8	-17.7	-137	-173.7	-176.1	-175.2	0	111.8
116	H	29.8	Very low	28.2	Very low	153 Å²	153	144.5 Å²	144.5	71%	0.708	75%	0.745	S	S	*	*			trans	31.6	137.8	149.2	-77.1	-43.2	0	0	0	125
117	R	24.9	Very low	27.9	Very low	221 Å²	221	144.5 Å²	144.5	83%	0.834	75%	0.745	S	S	*	*			trans	52.3	118.9	132	-79.8	-175.3	168.7	179.5	-4.8	121.6
118	T	27.8	Very low	27.8	Very low	117 Å²	117	142.6 Å²	142.6	72%	0.718	75%	0.745	S	S	*	*				29.4	144.3	119.1	63	0	0	0	0	122.2
119	H	23.9	Very low	28.5	Very low	164 Å²	164	142.1 Å²	142.1	76%	0.759	75%	0.749	S	S	*	*			trans	103.8	109.3	154.9	-96.8	-81.4	0	0	0	119.2
120	T	29.4	Very low	28.5	Very low	110 Å²	110	140.4 Å²	140.4	68%	0.675	75%	0.747	S	S	*	*			trans	31.6	119.9	138.2	51.8	0	0	0	0	119.8
121	D	24.2	Very low	28.6	Very low	143 Å²	143	143.3 Å²	143.3	77%	0.765	76%	0.756	S	S	*	*				-162.8	165.7	110.2	-118.6	-12.8	0	0	0	117.8
122	H	27.4	Very low	28.5	Very low	178 Å²	178	140.1 Å²	140.1	82%	0.824	75%	0.753	S	S	*	*			trans	-16.1	154.7	164.3	-68.5	64.2	0	0	0	121.5
123	G	24.3	Very low	28.4	Very low	81 Å²	81	138.8 Å²	138.8	84%	0.835	75%	0.754	S	S	*	*			trans	167.8	98.2	157.1	0	0	0	0	0	118.4
124	M	27.5	Very low	28.4	Very low	173 Å²	173	135.1 Å²	135.1	85%	0.852	75%	0.751	S	S	*	*			trans	-63.1	168.1	-179.9	-62.8	164.9	155.2	0	0	118.1
125	N	26.1	Very low	28.5	Very low	147 Å²	147	139 Å²	139	79%	0.786	76%	0.755	S	S	*	*			trans	74.4	151.5	144.6	-77.6	-2.1	0	0	0	120.7
126	V	28.4	Very low	28.4	Very low	112 Å²	112	133.8 Å²	133.8	68%	0.679	75%	0.747	S	S	*	*			cis	-166.8	168.2	-23.7	77.2	0	0	0	0	110.9
127	N	26	Very low	28.3	Very low	134 Å²	134	135 Å²	135	72%	0.717	75%	0.753	S	S	*	*			trans	78.9	108.8	164.8	-71.3	-7	0	0	0	122.1
128	T	26.9	Very low	28.4	Very low	123 Å²	123	130.1 Å²	130.1	76%	0.755	75%	0.747	S	S	*	*				-4.2	155.7	122.1	20.8	0	0	0	0	119.5
129	P	46.3	Very low	28.3	Very low	119 Å²	119	129.6 Å²	129.6	77%	0.773	74%	0.744	S	S	*	*				-141.2	-178.1	54.2	36.1	-15.1	0	0	0	115.4
130	S	29.9	Very low	28.4	Very low	86 Å²	86	128.5 Å²	128.5	60%	0.601	74%	0.739	S	S	*	*			cis	-176.3	164.5	-22.6	54.7	0	0	0	0	110.6
131	H	30	Very low	28.3	Very low	184 Å²	184	129.8 Å²	129.8	85%	0.852	74%	0.738	S	S	*	*			trans	67.7	149.4	168	-69.6	-70.8	0	0	0	117
132	A	29.3	Very low	28.4	Very low	76 Å²	76	129.7 Å²	129.7	63%	0.628	74%	0.737	S	S	*	*			cis	-162.6	136.6	-11	0	0	0	0	0	109.3
133	V	29.8	Very low	28.3	Very low	118 Å²	118	125.2 Å²	125.2	72%	0.715	73%	0.726	S	S	*	*				92.8	120.4	105.7	163.3	0	0	0	0	115.9
134	D	28.7	Very low	28.4	Very low	141 Å²	141	127.7 Å²	127.7	75%	0.754	73%	0.725	S	S	*	*			trans	52.5	156	142.4	-54.9	2.8	0	0	0	120.7
135	D	28.7	Very low	28.3	Very low	150 Å²	150	129.4 Å²	129.4	80%	0.802	72%	0.722	S	S	*	*			cis	-158.1	-177.2	-16.3	-142.3	-29.9	0	0	0	110.2
136	A	28.3	Very low	28.2	Very low	79 Å²	79	128.3 Å²	128.3	65%	0.653	72%	0.721	S	S	*	*			trans	55.5	124	149.9	0	0	0	0	0	120.5
137	E	26.7	Very low	28	Very low	178 Å²	178	127.1 Å²	127.1	83%	0.832	72%	0.717	S	S	*	*				94	154.8	66.1	-147.1	-163.1	-157	0	0	112.8
138	V	26.8	Very low	27.9	Very low	119 Å²	119	132.7 Å²	132.7	72%	0.721	73%	0.729	S	S	*	*			trans	69.9	145.7	163.7	168.9	0	0	0	0	118.1
139	V	26.2	Very low	27.8	Very low	107 Å²	107	134.8 Å²	134.8	65%	0.648	73%	0.73	S	S	*	*			cis	-166.3	168.4	-36.3	81.2	0	0	0	0	109.2
140	Q	26.1	Very low	26.9	Very low	141 Å²	141	134.9 Å²	134.9	66%	0.659	72%	0.724	S	S	*	*			trans	62.4	122.2	159.2	-75.4	173.4	-94.4	0	0	122.1
141	Q	27.9	Very low	26.6	Very low	137 Å²	137	138 Å²	138	64%	0.64	73%	0.729	S	S	*	*				47.3	117.9	117.6	-56	167.3	-21.3	0	0	119.8
142	N	26	Very low	26.5	Very low	141 Å²	141	135.8 Å²	135.8	75%	0.754	72%	0.723	S	S	*	*				-167.2	132.2	89.4	-90.6	-54.9	0	0	0	108.6
143	S	25.3	Very low	26.2	Very low	83 Å²	83	140.7 Å²	140.7	58%	0.58	73%	0.733	S	S	*	*				68.9	127.3	62.4	-53.7	0	0	0	0	113.3
144	T	25.5	Very low	26.2	Very low	133 Å²	133	144.3 Å²	144.3	82%	0.816	74%	0.739	S	S	*	*			trans	65.4	143.9	156	37.8	0	0	0	0	118.2
145	R	25.2	Very low	26.5	Very low	209 Å²	209	144 Å²	144	79%	0.789	75%	0.745	S	S	*	*			cis	-173.7	152.2	-12.5	-154.5	-172.2	-167.7	179.2	3.6	108
146	T	24.5	Very low	26.5	Very low	125 Å²	125	148 Å²	148	77%	0.767	75%	0.749	S	S	*	*			trans	57.6	164.7	152.3	40.7	0	0	0	0	118.3
147	S	25	Very low	26.3	Very low	87 Å²	87	151.3 Å²	151.3	61%	0.608	76%	0.761	S	S	*	*			cis	-178.9	122.3	-31.3	167.3	0	0	0	0	106.1
148	W	23.7	Very low	26.1	Very low	251 Å²	251	148.7 Å²	148.7	95%	0.951	76%	0.757	S	S	*	*			trans	-135.9	111.7	174.3	-80	100.8	0	0	0	113.6
149	Q	25.1	Very low	25.9	Very low	166 Å²	166	148.6 Å²	148.6	78%	0.776	76%	0.756	S	S	*	*			trans	-50.7	160.1	144.5	-82.9	171.4	-73.7	0	0	111.6
150	D	26.1	Very low	25.8	Very low	121 Å²	121	149.1 Å²	149.1	65%	0.647	76%	0.76	S	S	*	*			cis	-171.7	177.8	-4	174.9	30	0	0	0	108.4
151	Q	24.8	Very low	25.8	Very low	153 Å²	153	148.4 Å²	148.4	72%	0.715	77%	0.765	S	S	*	*			trans	81.1	102.1	158.2	-47.7	-156	5.8	0	0	121.8
152	N	26.3	Very low	25.6	Very low	136 Å²	136	147.8 Å²	147.8	73%	0.727	78%	0.775	S	S	*	*				58.7	115.6	107.7	-167.9	48.8	0	0	0	121.1
153	E	24	Very low	25.6	Very low	179 Å²	179	150.6 Å²	150.6	84%	0.836	78%	0.775	S	S	*	*				-174.1	-179.2	109.4	-94.6	-145.7	136.2	0	0	113.4
154	K	28.6	Very low	25.8	Very low	195 Å²	195	152.5 Å²	152.5	85%	0.848	79%	0.785	S	S	*	*			trans	-123.9	156.8	-173.3	-99.4	171.8	-176.7	164.9	0	109.5
155	P	36.5	Very low	25.9	Very low	134 Å²	134	151.1 Å²	151.1	87%	0.87	77%	0.772	S	S	*	*				-152.3	-156.4	69.8	41.2	-18.5	0	0	0	116.3
156	R	27.1	Very low	26.2	Very low	235 Å²	235	149 Å²	149	89%	0.887	77%	0.771	S	S	*	*			trans	-94.6	154.2	-163.5	-58.7	166.6	169.7	154.9	-7.3	114.9
157	T	24.2	Very low	26.4	Very low	148 Å²	148	146.7 Å²	146.7	91%	0.908	76%	0.764	S	S	*	*			trans	-146.9	168.3	145.3	-34.3	0	0	0	0	110.2
158	V	23	Very low	26.5	Very low	123 Å²	123	146.8 Å²	146.8	75%	0.745	77%	0.77	S	S	*	*			trans	-125.6	177.5	-166.8	171.3	0	0	0	0	110.7
159	T	22.9	Very low	26.8	Very low	116 Å²	116	142.5 Å²	142.5	71%	0.712	77%	0.765	S	S	*	*			trans	103	109.5	171.6	-33.4	0	0	0	0	110.8
160	T	24.2	Very low	26.8	Very low	118 Å²	118	139.4 Å²	139.4	72%	0.724	76%	0.762	S	S	*	*				59.2	151.1	59.9	73.5	0	0	0	0	112.9
161	V	25.3	Very low	26.9	Very low	126 Å²	126	141.3 Å²	141.3	76%	0.764	77%	0.771	S	S	*	*			cis	-138.3	165.5	11.8	-142.7	0	0	0	0	108.9
162	C	23.9	Very low	27.4	Very low	125 Å²	125	139.6 Å²	139.6	85%	0.845	77%	0.773	S	S	*	*				-177.9	158.2	88.9	-100.3	0	0	0	0	112.7
163	R	25.5	Very low	27.4	Very low	200 Å²	200	141.6 Å²	141.6	76%	0.755	78%	0.783	S	S	*	*			trans	-115.6	177.5	169.9	-69.2	178.3	168.5	163.3	-7.9	110.2	L165	R163-L165 HydrophobicContact CB-CD1 4.39Å; R163-L165 HydrophobicContact CB-CG 3.88Å
164	P	30	Very low	27.6	Very low	123 Å²	123	138.2 Å²	138.2	80%	0.799	78%	0.779	S	S	*	*				-121.2	157.6	91.4	-5.5	27.2	0	0	0	113
165	L	27.8	Very low	27.4	Very low	103 Å²	103	138.9 Å²	138.9	54%	0.539	78%	0.782	S	S	.	*			cis	76.1	141.7	22.4	-52.6	-176.8	0	0	0	114.2	R163	R163-L165 HydrophobicContact CB-CD1 4.39Å; R163-L165 HydrophobicContact CB-CG 3.88Å
166	H	31.4	Very low	27.4	Very low	166 Å²	166	137.3 Å²	137.3	77%	0.769	77%	0.772	S	S	*	*			cis	-154.9	-176.5	-0.9	-128.3	-20.5	0	0	0	108.6
167	A	29.9	Very low	27.5	Very low	75 Å²	75	134.7 Å²	134.7	62%	0.62	78%	0.775	S	S	*	*			cis	-161.7	-176.5	6.8	0	0	0	0	0	110.2
168	A	27	Very low	27.7	Very low	90 Å²	90	133 Å²	133	74%	0.744	77%	0.769	S	S	*	*			trans	72.3	160.7	160.2	0	0	0	0	0	117.1
169	L	28.3	Very low	27.8	Very low	161 Å²	161	132.7 Å²	132.7	84%	0.843	77%	0.772	S	S	*	*			cis	-164.6	165.4	-26	-103.7	178.3	0	0	0	106
170	S	26.1	Very low	28.1	Very low	100 Å²	100	134.6 Å²	134.6	70%	0.699	78%	0.777	S	S	*	*			cis	-126.8	-138.9	4	-62.1	0	0	0	0	110.9
171	L	27.9	Very low	28.4	Very low	162 Å²	162	139 Å²	139	85%	0.848	78%	0.782	S	S	*	*			trans	-138	159.2	176.4	-80.4	169.3	0	0	0	110.5
172	P	35.6	Very low	28.5	Very low	116 Å²	116	138 Å²	138	75%	0.753	78%	0.776	S	S	*	*			trans	-85.3	152.6	-179.5	34.4	-35.3	0	0	0	113.4
173	L	26	Very low	28.6	Very low	178 Å²	178	139 Å²	139	93%	0.932	77%	0.773	S	S	*	*			trans	-134.7	143	165.8	-73.9	174.8	0	0	0	110
174	S	28.1	Very low	28.8	Very low	108 Å²	108	139.2 Å²	139.2	76%	0.755	77%	0.774	S	S	*	*			trans	-95.4	149.3	179.7	-50.8	0	0	0	0	111.5
175	F	24.6	Very low	28.7	Very low	209 Å²	209	138.9 Å²	138.9	92%	0.917	77%	0.766	S	S	*	*			trans	-166.5	153.6	134.7	-90.9	-58.4	0	0	0	110.7
176	P	37.7	Very low	28.8	Very low	102 Å²	102	138 Å²	138	66%	0.662	77%	0.768	S	S	*	*			trans	-100.7	172.1	-178.7	39.9	-33.5	0	0	0	112.9
177	L	28.3	Very low	28.7	Very low	180 Å²	180	141.3 Å²	141.3	94%	0.942	77%	0.774	S	S	*	*			trans	-132.8	151.3	159.5	-77	177.6	0	0	0	111
178	S	27.4	Very low	28.6	Very low	113 Å²	113	145.4 Å²	145.4	79%	0.79	78%	0.78	S	S	*	*			trans	-107.9	162.1	-156.2	-50.4	0	0	0	0	114.5
179	S	26.1	Very low	28.6	Very low	115 Å²	115	145 Å²	145	80%	0.804	77%	0.772	S	S	*	*			trans	-67.7	150.2	157.5	54.6	0	0	0	0	111.4
180	L	29	Very low	28.4	Very low	157 Å²	157	146.4 Å²	146.4	82%	0.822	77%	0.774	S	S	*	*			trans	-69.1	141.4	173.1	-59.6	165.2	0	0	0	111.2
181	Y	29.7	Very low	28.8	Very low	209 Å²	209	147.9 Å²	147.9	82%	0.82	78%	0.779	S	S	*	*				174.2	109.7	117.1	-107.6	-87.9	0	0	0	113.4
182	T	28.3	Very low	29.6	Very low	105 Å²	105	145.5 Å²	145.5	64%	0.644	77%	0.773	S	S	*	*			trans	48	135.6	143.3	59.7	0	0	0	0	124.4
183	N	26.4	Very low	29.2	Very low	147 Å²	147	150.4 Å²	150.4	79%	0.786	78%	0.778	S	S	*	*			trans	73.3	151.4	149.5	-69.1	-28.8	0	0	0	119.7
184	R	29.6	Very low	29.3	Very low	204 Å²	204	147 Å²	147	77%	0.77	77%	0.769	S	S	*	*			cis	-169.7	144.7	-24.2	179.2	166.2	175.8	-158.8	-15	110.3
185	D	28.3	Very low	29.2	Very low	117 Å²	117	147.2 Å²	147.2	63%	0.626	77%	0.771	S	S	*	*			trans	30.4	123.3	162.2	-48.4	-11.8	0	0	0	121.5
186	S	28.6	Very low	29.3	Very low	83 Å²	83	143 Å²	143	58%	0.58	77%	0.767	S	S	*	*				141.2	139.1	101	-149.1	0	0	0	0	117
187	W	29	Very low	28.9	Very low	236 Å²	236	143.4 Å²	143.4	89%	0.894	77%	0.773	S	S	*	*			trans	58.1	166	160.7	-53.9	-35.5	0	0	0	119.9
188	E	27.8	Very low	30.2	Very low	161 Å²	161	140.4 Å²	140.4	75%	0.752	76%	0.764	S	S	*	*				-177.9	143.6	-58.4	-117	-158.8	94.2	0	0	107.8
189	S	27.5	Very low	30	Very low	83 Å²	83	144.6 Å²	144.6	58%	0.58	77%	0.771	S	S	*	*			trans	66.1	101.5	144.7	-67.1	0	0	0	0	123.3
190	Q	25.1	Very low	29.9	Very low	189 Å²	189	144.9 Å²	144.9	88%	0.883	77%	0.772	S	S	*	*				93.2	142.6	124.9	-62.5	-168.2	19.9	0	0	123.3
191	V	33.8	Very low	30.6	Very low	131 Å²	131	142.3 Å²	142.3	79%	0.794	77%	0.765	S	S	*	*			trans	-103.8	160.9	171	-153.3	0	0	0	0	108.3
192	P	45.1	Very low	30.5	Very low	112 Å²	112	139.8 Å²	139.8	73%	0.727	76%	0.76	S	S	*	*				-150.1	170.3	110.4	32.1	-12.2	0	0	0	117.4
193	Y	26.6	Very low	30.7	Very low	219 Å²	219	143.1 Å²	143.1	86%	0.859	77%	0.766	S	S	*	*			trans	-22.5	161.1	161.2	-52	-97	0	0	0	118.8
194	S	27.9	Very low	31.5	Very low	107 Å²	107	141.8 Å²	141.8	75%	0.748	77%	0.765	S	S	*	*			cis	-159.3	158.4	30.6	-47.2	0	0	0	0	116.6
195	S	26.9	Very low	31.3	Very low	113 Å²	113	135.4 Å²	135.4	79%	0.79	76%	0.763	S	S	*	*			trans	-13.8	151.5	154.4	59.1	0	0	0	0	124.5
196	S	26	Very low	32.6	Very low	120 Å²	120	135.1 Å²	135.1	84%	0.839	77%	0.768	S	S	*	*			trans	-152.4	176.9	134.3	66	0	0	0	0	111.2
197	S	29	Very low	32.6	Very low	111 Å²	111	139.6 Å²	139.6	78%	0.776	78%	0.779	S	S	*	*			trans	-133.6	-137.3	-161.5	-58.8	0	0	0	0	116.6
198	P	56.3	Low	32.7	Very low	117 Å²	117	132.4 Å²	132.4	76%	0.76	77%	0.77	S	S	*	*				-128.8	-180	-113.8	41.4	-24	0	0	0	115.8
199	E	23.9	Very low	32.7	Very low	200 Å²	200	130.8 Å²	130.8	94%	0.935	78%	0.776	S	S	*	*			trans	-161.9	169.8	143.1	-120	166.7	-172.5	0	0	114.5
200	C	23.2	Very low	33	Very low	121 Å²	121	135.7 Å²	135.7	82%	0.818	79%	0.79	S	S	*	*			trans	-124.7	-163.4	-175.4	-131.3	0	0	0	0	109.1
201	P	44.8	Very low	33.6	Very low	104 Å²	104	132.8 Å²	132.8	68%	0.675	79%	0.788	S	S	*	*			cis	-142.1	175.6	21.4	45.1	-25.1	0	0	0	118.1
202	E	26.9	Very low	33.3	Very low	155 Å²	155	135.3 Å²	135.3	72%	0.724	79%	0.791	S	S	*	*			trans	34.6	150.8	133.9	-63.5	-174.6	168.1	0	0	122.6
203	F	31.4	Very low	32.5	Very low	176 Å²	176	141.8 Å²	141.8	77%	0.772	80%	0.801	S	S	*	*			cis	-159.2	-162.2	-3.8	-120.3	-35.2	0	0	0	110.2
204	P	44.7	Very low	32.5	Very low	118 Å²	118	142.3 Å²	142.3	77%	0.766	80%	0.801	S	S	*	*			trans	-123.9	-173.5	-155.7	44.9	-26.6	0	0	0	115.7
205	G	24	Very low	32.4	Very low	71 Å²	71	143 Å²	143	73%	0.732	80%	0.801	S	S	*	*			trans	124	163.1	147.5	0	0	0	0	0	117.2
206	P	57.4	Low	32.7	Very low	110 Å²	110	142 Å²	142	71%	0.714	79%	0.794	S	S	*	*			trans	-124.3	163	-163.2	40.2	-25.9	0	0	0	115.9
207	H	28.6	Very low	33	Very low	178 Å²	178	144.4 Å²	144.4	82%	0.824	79%	0.792	S	S	*	*				172.9	135.5	120.2	-100	-77.2	0	0	0	115.2
208	A	30.3	Very low	33.1	Very low	85 Å²	85	143 Å²	143	70%	0.702	79%	0.787	S	S	*	*			trans	64.2	153.1	140	0	0	0	0	0	124.5
209	S	28.1	Very low	31.7	Very low	126 Å²	126	142.2 Å²	142.2	88%	0.881	79%	0.785	S	S	*	*			trans	90	143.5	159.9	77.4	0	0	0	0	120.9
210	Q	33.3	Very low	32.3	Very low	187 Å²	187	138.7 Å²	138.7	87%	0.874	77%	0.771	S	S	*	*			trans	-93	155.7	175.2	-106.1	-178.4	0.6	0	0	109.7
211	P	38.4	Very low	32.7	Very low	128 Å²	128	143.3 Å²	143.3	83%	0.831	78%	0.778	S	S	*	*				-155.1	-168	77.5	41.6	-20.4	0	0	0	116.6
212	Q	26.9	Very low	32.1	Very low	183 Å²	183	145.9 Å²	145.9	86%	0.855	78%	0.78	S	S	*	*			trans	-81.6	151.7	-179.7	-51.3	156.7	-74.7	0	0	113.9
213	R	27.4	Very low	32.3	Very low	249 Å²	249	148 Å²	148	94%	0.94	79%	0.787	S	S	*	*				-172.3	166.6	123.9	-107	173.8	-175.9	-161.1	2.3	116.1
214	R	26.2	Very low	32.3	Very low	229 Å²	229	142.9 Å²	142.9	86%	0.864	78%	0.777	S	S	*	*			trans	-54	158	177.4	-63.9	170.8	170.6	169.2	-5.7	113.5
215	T	27.6	Very low	31.8	Very low	123 Å²	123	143.7 Å²	143.7	76%	0.755	77%	0.774	S	S	*	*				-159.1	142.3	70.1	39.5	0	0	0	0	111.5
216	S	31.3	Very low	32.1	Very low	92 Å²	92	149.5 Å²	149.5	64%	0.643	77%	0.774	S	S	*	*				53.9	146.3	70.3	74	0	0	0	0	114.8
217	Q	33.4	Very low	30.8	Very low	170 Å²	170	154.8 Å²	154.8	79%	0.794	78%	0.779	S	S	*	*			cis	-153.5	-178.6	5.4	-137.4	167.5	-80	0	0	107.3
218	A	30	Very low	30.9	Very low	80 Å²	80	155 Å²	155	66%	0.661	78%	0.778	S	S	*	*			cis	-149	-154.6	8.5	0	0	0	0	0	108.2
219	S	28.3	Very low	30.8	Very low	102 Å²	102	156.6 Å²	156.6	71%	0.713	78%	0.779	S	S	*	*			cis	-154.6	121.7	3.9	-179.6	0	0	0	0	107.2
220	L	37	Very low	30.7	Very low	125 Å²	125	158.2 Å²	158.2	65%	0.654	77%	0.772	S	S	*	*				66.7	112.7	74.7	-77.3	174.6	0	0	0	116.9
221	K	29.7	Very low	30.4	Very low	219 Å²	219	154.6 Å²	154.6	95%	0.952	76%	0.763	S	S	*	*				-150	138.5	114.7	-108.4	173.2	-176.6	174.6	0	110.2
222	E	32.5	Very low	29.8	Very low	157 Å²	157	159 Å²	159	73%	0.734	76%	0.764	S	S	*	*			trans	-145.4	149.2	-172.3	-171.8	-155.7	152.5	0	0	109.5
223	K	31.1	Very low	29.9	Very low	200 Å²	200	155.4 Å²	155.4	87%	0.87	76%	0.759	S	S	*	*			trans	-164.6	120.7	145.6	-102.5	158.4	-177	-175.3	0	107.4
224	A	32.6	Very low	30.6	Very low	68 Å²	68	148.6 Å²	148.6	56%	0.562	75%	0.747	S	S	*	*				93.3	140.8	63.3	0	0	0	0	0	111.3
225	I	33.3	Very low	30.5	Very low	135 Å²	135	145 Å²	145	69%	0.692	75%	0.745	S	S	*	*			cis	-162.6	146.6	7.3	-126.6	170.4	0	0	0	113
226	R	30.1	Very low	30.6	Very low	193 Å²	193	144.6 Å²	144.6	73%	0.728	75%	0.747	S	S	*	*			trans	55.4	123	151.4	-65.6	169.9	-172.1	-160	1	120.5
227	R	31.2	Very low	30.9	Very low	221 Å²	221	145.7 Å²	145.7	83%	0.834	75%	0.752	S	S	*	*				71.2	143.1	77.6	-66.4	175.1	-172.9	154.4	1.2	113.4
228	K	30.3	Very low	30.5	Very low	183 Å²	183	142.5 Å²	142.5	80%	0.796	75%	0.749	S	S	*	*			cis	-174.4	150.5	44.6	-149	-173.5	-177	-168.4	0	112.9
229	V	27.4	Very low	30.3	Very low	119 Å²	119	146.3 Å²	146.3	72%	0.721	76%	0.758	S	S	*	*			trans	67.1	155	149.8	153.6	0	0	0	0	120.2
230	Q	26.4	Very low	30.2	Very low	160 Å²	160	149.1 Å²	149.1	75%	0.748	76%	0.76	S	S	*	*			cis	-174.2	161.3	-40.9	-154.8	179.6	-38.1	0	0	110.9
231	V	26.7	Very low	29.8	Very low	110 Å²	110	148.2 Å²	148.2	67%	0.667	76%	0.764	S	S	*	*			trans	79	143.4	160.1	-134	0	0	0	0	120.8
232	Y	27.2	Very low	29.6	Very low	222 Å²	222	145.9 Å²	145.9	87%	0.871	76%	0.761	S	S	*	*			trans	79	120.4	162	-78.1	-69.3	0	0	0	122.2
233	S	28.2	Very low	29.1	Very low	106 Å²	106	143.4 Å²	143.4	74%	0.741	76%	0.761	S	S	*	*			trans	-82.7	168	151.3	-44.7	0	0	0	0	109
234	P	41.1	Very low	28.7	Very low	106 Å²	106	139.3 Å²	139.3	69%	0.688	76%	0.757	S	S	*	*			cis	-147.4	-167.6	50	41.6	-19.2	0	0	0	117.5
235	D	24.6	Very low	28.5	Very low	155 Å²	155	142.4 Å²	142.4	83%	0.829	77%	0.772	S	S	*	*			trans	84	145.9	159.7	-57	-27.6	0	0	0	121.1
236	S	31	Very low	28	Very low	113 Å²	113	142.5 Å²	142.5	79%	0.79	77%	0.773	S	S	*	*			trans	-100.1	167.1	-171.4	-43.9	0	0	0	0	111.7
237	P	36.5	Very low	27.8	Very low	116 Å²	116	140.6 Å²	140.6	75%	0.753	78%	0.776	S	S	*	*				-154.1	-176.7	86.1	39	-18.6	0	0	0	116.9
238	S	26.1	Very low	27.3	Very low	103 Å²	103	137.8 Å²	137.8	72%	0.72	77%	0.772	S	S	*	*			trans	59.2	101.3	147.9	60.5	0	0	0	0	122.2
239	D	25.6	Very low	27.1	Very low	160 Å²	160	133.8 Å²	133.8	86%	0.856	77%	0.774	S	S	*	*				64.2	159.6	113.5	-124.1	-26.3	0	0	0	124.5
240	E	26.4	Very low	26.9	Very low	161 Å²	161	134.1 Å²	134.1	75%	0.752	77%	0.771	S	S	*	*			trans	63.9	97.8	168.4	-60.8	-140.3	92.4	0	0	121.6
241	S	27.2	Very low	27.1	Very low	106 Å²	106	135 Å²	135	74%	0.741	77%	0.769	S	S	*	*				48.2	116.5	111.1	-53.7	0	0	0	0	121
242	L	25.3	Very low	27.1	Very low	169 Å²	169	135.1 Å²	135.1	89%	0.885	76%	0.764	S	S	*	*			trans	-106.5	111.7	158.9	-79.8	175.7	0	0	0	112.6
243	S	22.6	Very low	27.6	Very low	106 Å²	106	132.7 Å²	132.7	74%	0.741	76%	0.759	S	S	*	*			trans	43	130.3	141.4	53	0	0	0	0	122.5
244	S	23.8	Very low	27.6	Very low	113 Å²	113	133.9 Å²	133.9	79%	0.79	76%	0.764	S	S	*	*			trans	-142	138.6	143.9	-72	0	0	0	0	108.3
245	P	27	Very low	26.8	Very low	133 Å²	133	132.1 Å²	132.1	86%	0.864	77%	0.765	S	S	*	*			trans	-80.2	167.3	-167.3	31.4	-35.9	0	0	0	114.7
246	I	24.3	Very low	27.7	Very low	138 Å²	138	130.4 Å²	130.4	71%	0.708	76%	0.763	S	S	*	*			trans	-108	163.6	-167.8	-64.9	166.7	0	0	0	111.1
247	L	24.4	Very low	27.2	Very low	153 Å²	153	134.3 Å²	134.3	80%	0.801	77%	0.765	S	S	*	*			trans	138.2	110.2	150.3	-73.8	168.8	0	0	0	108.4
248	E	22.1	Very low	26.6	Very low	161 Å²	161	132.5 Å²	132.5	75%	0.752	76%	0.761	S	S	*	*				55.6	108	54	-56.9	-166.8	134.2	0	0	111.5
249	A	26.4	Very low	26.4	Very low	100 Å²	100	132.4 Å²	132.4	83%	0.826	76%	0.76	S	S	*	*			cis	83.9	125.7	28.5	0	0	0	0	0	115.1
250	D	22	Very low	26.2	Very low	125 Å²	125	133.6 Å²	133.6	67%	0.668	76%	0.758	S	S	*	*			trans	-153.4	169	161.6	-145.4	-13.8	0	0	0	112.3	H326	D250-H326 IonicContact OD1-CE1 3.27Å; D250-H326 PolarHBondContact OD1-CE1 3.33Å; D250-H326 IonicContact OD1-NE2 3.98Å; D250-H326 PolarHBondContact OD1-NE2 3.01Å; D250-H326 IonicContact OD2-CE1 3.26Å; D250-H326 PolarHBondContact OD2-CE1 3.36Å; D250-H326 IonicContact OD2-ND1 2.97Å
251	Y	30.8	Very low	26.2	Very low	179 Å²	179	132.9 Å²	132.9	70%	0.702	76%	0.758	S	S	*	*			trans	-93.9	173.8	-158.1	-80.6	-93.5	0	0	0	115	F253	Y251-F253 HydrophobicContact CD1-CD2 4.47Å; Y251-F253 HydrophobicContact CD1-CE2 4.24Å; Y251-F253 HydrophobicContact CE1-CE2 4.18Å
252	I	27.3	Very low	26.3	Very low	112 Å²	112	136.3 Å²	136.3	57%	0.574	76%	0.763	S	S	*	*				-159.4	156	57	-77.3	167.2	0	0	0	113.6	H326 P327	I252-H326 WeakPolarHBondContact CD1-NE2 3.24Å; I252-P327 HydrophobicContact CD1-CB 3.66Å
253	F	36.9	Very low	26.3	Very low	172 Å²	172	136.3 Å²	136.3	75%	0.754	76%	0.758	S	S	*	*			trans	-62.5	159.8	176.3	-74.2	-96.3	0	0	0	116.2	Y251	Y251-F253 HydrophobicContact CD1-CD2 4.47Å; Y251-F253 HydrophobicContact CD1-CE2 4.24Å; Y251-F253 HydrophobicContact CE1-CE2 4.18Å
254	P	28.5	Very low	26.4	Very low	130 Å²	130	137.1 Å²	137.1	84%	0.844	75%	0.754	S	S	*	*				-149.9	-174.1	100.6	41.5	-25.5	0	0	0	115.8
255	G	25	Very low	26.4	Very low	69 Å²	69	140.1 Å²	140.1	71%	0.711	76%	0.76	S	S	*	*			trans	-161	-173.7	160.5	0	0	0	0	0	109
256	P	42	Very low	26.3	Very low	120 Å²	120	139.4 Å²	139.4	78%	0.779	76%	0.757	S	S	*	*			cis	-130.1	-157.3	-0.3	30.6	-6.1	0	0	0	113.2
257	F	21.7	Very low	26.2	Very low	194 Å²	194	136 Å²	136	85%	0.851	76%	0.756	S	S	*	*			trans	86	111.4	167.8	-90.1	-94.1	0	0	0	121.7
258	A	23.4	Very low	26.3	Very low	79 Å²	79	136.6 Å²	136.6	65%	0.653	76%	0.759	S	S	*	*				58.8	133.8	128	0	0	0	0	0	125.1
259	S	22.7	Very low	26.4	Very low	100 Å²	100	134.1 Å²	134.1	70%	0.699	76%	0.759	S	S	*	*			trans	92.7	145.8	140.1	78	0	0	0	0	120.9
260	F	21.6	Very low	26.4	Very low	185 Å²	185	133.8 Å²	133.8	81%	0.811	75%	0.751	S	S	*	*			trans	63.9	153.3	174.1	-70.9	-84	0	0	0	117.2
261	L	25.1	Very low	26.8	Very low	146 Å²	146	134.8 Å²	134.8	76%	0.764	76%	0.756	S	S	*	*			cis	-120.9	144.9	12.1	-71.5	157.8	0	0	0	114
262	E	28.9	Very low	26.5	Very low	179 Å²	179	133 Å²	133	84%	0.836	76%	0.759	S	S	*	*			trans	-99.5	136.3	137.3	-77.3	-172.6	120.5	0	0	107.8
263	E	26.6	Very low	26.6	Very low	168 Å²	168	132 Å²	132	79%	0.785	77%	0.766	S	S	*	*			trans	176.4	149.6	154.8	-101.3	165.1	173.9	0	0	105.8
264	D	23.8	Very low	26.2	Very low	124 Å²	124	128.3 Å²	128.3	66%	0.663	77%	0.768	S	S	*	*			cis	-125.4	151.8	14.1	-77.9	-65.9	0	0	0	112.9
265	L	24.4	Very low	26.2	Very low	175 Å²	175	127.1 Å²	127.1	92%	0.916	76%	0.763	S	S	*	*				-170.9	136.8	106.8	-101.4	169.9	0	0	0	112.7
266	C	24.4	Very low	26.3	Very low	118 Å²	118	130 Å²	130	80%	0.797	77%	0.767	S	S	*	*			trans	-84.9	152.3	-162.2	-55.7	0	0	0	0	116
267	G	23.2	Very low	26.6	Very low	66 Å²	66	129.7 Å²	129.7	68%	0.68	77%	0.765	S	S	*	*				122.6	112.9	119.5	0	0	0	0	0	117.9
268	L	25.7	Very low	26.9	Very low	167 Å²	167	125.4 Å²	125.4	87%	0.874	76%	0.759	S	S	*	*				-178.2	137.6	102.1	-92.3	167.5	0	0	0	112.8
269	S	25	Very low	27.3	Very low	108 Å²	108	126.2 Å²	126.2	76%	0.755	76%	0.76	S	S	*	*			trans	-1.6	151.2	140.6	-58.6	0	0	0	0	120
270	S	26.2	Very low	27.8	Very low	94 Å²	94	127.7 Å²	127.7	66%	0.657	77%	0.765	S	S	*	*			cis	177.6	154.8	0.7	165.4	0	0	0	0	112
271	L	29	Very low	28.2	Very low	146 Å²	146	126.7 Å²	126.7	76%	0.764	77%	0.768	S	S	*	*			trans	68.1	153.7	162.8	-101.8	65.5	0	0	0	117.4
272	D	26	Very low	28.4	Very low	142 Å²	142	123 Å²	123	76%	0.759	77%	0.765	S	S	*	*			cis	-148.6	179.7	3.4	-146.3	-18.3	0	0	0	114.1
273	A	29.5	Very low	28.6	Very low	89 Å²	89	121 Å²	121	74%	0.736	77%	0.766	S	S	*	*			trans	-69.7	-177.6	-171.4	0	0	0	0	0	116.4
274	A	28.3	Very low	29.7	Very low	96 Å²	96	117.8 Å²	117.8	79%	0.793	76%	0.759	S	S	*	*			cis	-154.8	-174.9	14.3	0	0	0	0	0	110.5
275	S	27.5	Very low	29.9	Very low	105 Å²	105	119.3 Å²	119.3	73%	0.734	77%	0.767	S	S	*	*			cis	-157	147.9	13.1	56.9	0	0	0	0	115.2
276	T	27.6	Very low	29.9	Very low	130 Å²	130	118.7 Å²	118.7	80%	0.798	76%	0.764	S	S	*	*			trans	-20.7	175	148.9	25.5	0	0	0	0	120.7
277	P	48.1	Very low	30.9	Very low	113 Å²	113	118.5 Å²	118.5	73%	0.734	76%	0.761	S	S	*	*			cis	-119.7	-165.2	19.5	42.7	-26.5	0	0	0	114
278	S	27.9	Very low	31	Very low	103 Å²	103	119.7 Å²	119.7	72%	0.72	76%	0.759	S	S	*	*			cis	-166.6	168.9	10	8.1	0	0	0	0	108.6
279	S	31.1	Very low	31.1	Very low	97 Å²	97	119.8 Å²	119.8	68%	0.678	76%	0.759	S	S	*	*			cis	-179.4	165.7	-22.8	55.8	0	0	0	0	109.3
280	T	33.9	Very low	31.2	Very low	131 Å²	131	117.7 Å²	117.7	80%	0.804	75%	0.754	S	S	*	*			trans	60.4	135.1	161.9	46	0	0	0	0	118.6
281	D	30.5	Very low	31.3	Very low	164 Å²	164	122.2 Å²	122.2	88%	0.877	76%	0.764	S	S	*	*			cis	-159	167.7	1.7	-158	-5.2	0	0	0	110.7
282	G	28	Very low	31.2	Very low	69 Å²	69	118.2 Å²	118.2	71%	0.711	76%	0.759	S	S	*	*			trans	127.7	112.1	163.5	0	0	0	0	0	118.9
283	T	34.4	Very low	31.2	Very low	137 Å²	137	118.2 Å²	118.2	84%	0.84	76%	0.759	S	S	*	*			trans	-101.8	-176.9	175.9	49.5	0	0	0	0	112.9
284	P	49.2	Very low	31.1	Very low	99 Å²	99	119.6 Å²	119.6	64%	0.643	75%	0.753	S	S	*	*			cis	-135.3	-173	-49	36.6	-17.2	0	0	0	113.4
285	D	27.3	Very low	31	Very low	157 Å²	157	124 Å²	124	84%	0.84	75%	0.754	S	S	*	*				147.5	160.2	128.8	-84.4	-27.6	0	0	0	118.3
286	L	25.6	Very low	30.8	Very low	162 Å²	162	125.1 Å²	125.1	85%	0.848	75%	0.752	S	S	*	*			trans	-115	-178.2	-174.6	-87.4	154.4	0	0	0	110.6
287	P	45.1	Very low	30.7	Very low	113 Å²	113	123.5 Å²	123.5	73%	0.734	74%	0.742	S	S	*	*			cis	-119.5	-127.7	-1.1	26.7	-0	0	0	0	111
288	S	25.9	Very low	29.5	Very low	92 Å²	92	126.1 Å²	126.1	64%	0.643	74%	0.744	S	S	*	*			cis	-166.9	152.9	-1.1	25.1	0	0	0	0	113.5
289	I	27.3	Very low	29.4	Very low	169 Å²	169	126.8 Å²	126.8	87%	0.867	75%	0.749	S	S	*	*			trans	22.5	136.9	132	-52	167.5	0	0	0	118.1
290	G	26.7	Very low	29.3	Very low	64 Å²	64	130.8 Å²	130.8	66%	0.66	76%	0.757	S	S	*	*			cis	160.7	-158	5.2	0	0	0	0	0	112.6
291	H	28.8	Very low	29.7	Very low	188 Å²	188	129.5 Å²	129.5	87%	0.87	75%	0.751	S	S	*	*			trans	-19.5	145.7	175.6	-64.2	-102.6	0	0	0	118.5
292	G	26.7	Very low	29.5	Very low	62 Å²	62	128.6 Å²	128.6	64%	0.639	75%	0.745	S	S	*	*			cis	138.6	169.9	9.3	0	0	0	0	0	110.9
293	D	26	Very low	29.4	Very low	143 Å²	143	132.8 Å²	132.8	77%	0.765	75%	0.746	S	S	*	*			trans	64.8	156.5	164.7	-62.9	-22	0	0	0	117.7
294	I	27.2	Very low	28.9	Very low	118 Å²	118	132.4 Å²	132.4	61%	0.605	74%	0.737	S	S	*	*			cis	-164.8	156.5	-15.9	-110.3	168.2	0	0	0	108.4
295	F	26.4	Very low	27.8	Very low	187 Å²	187	133.8 Å²	133.8	82%	0.82	74%	0.738	S	S	*	*			trans	65.6	157.6	162.8	-77.3	-30.2	0	0	0	119.8
296	N	23.6	Very low	27.8	Very low	130 Å²	130	134.1 Å²	134.1	70%	0.695	74%	0.735	S	S	*	*			cis	-165.7	169	-26.7	-155	1.6	0	0	0	111.6
297	V	24.7	Very low	27.8	Very low	96 Å²	96	133.1 Å²	133.1	58%	0.582	73%	0.73	S	S	*	*			trans	65.2	113.2	151.3	162.8	0	0	0	0	121.5
298	Q	23.8	Very low	26.9	Very low	167 Å²	167	131.8 Å²	131.8	78%	0.78	72%	0.724	S	S	*	*			trans	30.3	134.2	132.6	-44.3	169.6	-67	0	0	121.8
299	S	26.1	Very low	26.8	Very low	117 Å²	117	136.3 Å²	136.3	82%	0.818	74%	0.735	S	S	*	*				173.8	149	99.4	-69.9	0	0	0	0	114.5
300	E	29.1	Very low	26.7	Very low	182 Å²	182	133.8 Å²	133.8	85%	0.85	73%	0.732	S	S	*	*			trans	-74.4	170.5	158.4	-95	-176	169.9	0	0	110.7
301	P	41.4	Very low	26.5	Very low	104 Å²	104	134.4 Å²	134.4	68%	0.675	74%	0.738	S	S	*	*			cis	-158.2	172.5	41	45.3	-23	0	0	0	121.7
302	L	26.8	Very low	26.4	Very low	144 Å²	144	129.4 Å²	129.4	75%	0.754	73%	0.73	S	S	*	*			trans	54.8	147.4	136.4	-70.3	169.2	0	0	0	126.6
303	Q	25.1	Very low	26.4	Very low	158 Å²	158	135.3 Å²	135.3	74%	0.738	74%	0.741	S	S	*	*			trans	72.7	164.7	146.4	-77.1	165.7	-39	0	0	119.2
304	I	25	Very low	26.5	Very low	128 Å²	128	137.5 Å²	137.5	66%	0.656	75%	0.746	S	S	*	*			cis	-152.8	135.6	2	-122.6	151.9	0	0	0	107.2
305	I	25.8	Very low	26.5	Very low	128 Å²	128	140.4 Å²	140.4	66%	0.656	76%	0.757	S	S	*	*				89.8	150	81.7	-102.1	177.5	0	0	0	117.2
306	E	27.2	Very low	26.7	Very low	165 Å²	165	140.5 Å²	140.5	77%	0.771	76%	0.76	S	S	*	*			trans	66	158.4	162.4	-82.9	152.8	-144.3	0	0	120.7
307	D	24.8	Very low	26.7	Very low	140 Å²	140	138.2 Å²	138.2	75%	0.749	77%	0.767	S	S	*	*			cis	-171.3	168.7	-35.6	-129	39.1	0	0	0	114.8
308	S	27	Very low	26.7	Very low	86 Å²	86	138 Å²	138	60%	0.601	78%	0.784	S	S	*	*			trans	55.9	130.4	141.6	-70	0	0	0	0	126.1
309	E	23.8	Very low	26.8	Very low	187 Å²	187	133.7 Å²	133.7	87%	0.874	79%	0.785	S	S	*	*			trans	59.2	155.7	130.6	-63.3	-167.5	155.8	0	0	122.3
310	S	23.7	Very low	26.8	Very low	115 Å²	115	136.3 Å²	136.3	80%	0.804	79%	0.788	S	S	*	*			cis	-153.4	-171.9	-0.3	42.4	0	0	0	0	111.3
311	G	22.9	Very low	26.6	Very low	77 Å²	77	133.7 Å²	133.7	79%	0.794	78%	0.784	S	S	*	*			trans	-87.1	-157.5	-175.3	0	0	0	0	0	116.6
312	A	26.4	Very low	25.9	Very low	84 Å²	84	136.6 Å²	136.6	69%	0.694	79%	0.789	S	S	*	*			cis	-163.3	167.9	2.6	0	0	0	0	0	112.1
313	E	27.4	Very low	25.9	Very low	186 Å²	186	135 Å²	135	87%	0.869	79%	0.785	S	S	*	*			trans	57.9	144.4	156.6	-71.5	157.4	-161.2	0	0	120
314	E	29	Very low	25.8	Very low	188 Å²	188	131.9 Å²	131.9	88%	0.879	78%	0.781	S	S	*	*			cis	-117.4	-147.1	-1.3	-124.9	174.8	141.7	0	0	109.7
315	E	27.3	Very low	25.7	Very low	180 Å²	180	134.1 Å²	134.1	84%	0.841	79%	0.793	S	S	*	*			cis	-147.5	-135.1	7.7	-162.1	-168.5	-115.7	0	0	108.8
316	E	29	Very low	25.7	Very low	189 Å²	189	132.3 Å²	132.3	88%	0.883	78%	0.782	S	S	*	*			trans	-104.6	165.1	-177.1	-62.9	-166.2	131	0	0	114.7
317	G	24.8	Very low	26.1	Very low	82 Å²	82	129.3 Å²	129.3	85%	0.845	78%	0.776	S	S	*	*			trans	175.8	-49.3	169.2	0	0	0	0	0	119.4
318	G	25.1	Very low	26.1	Very low	90 Å²	90	126.1 Å²	126.1	93%	0.928	78%	0.776	S	S	*	*			trans	61.9	102.8	168.2	0	0	0	0	0	120.4
319	G	24	Very low	26.1	Very low	78 Å²	78	129 Å²	129	80%	0.804	79%	0.791	S	S	*	*			trans	168.4	139.4	162.9	0	0	0	0	0	114.1
320	I	26.6	Very low	26.2	Very low	172 Å²	172	125.7 Å²	125.7	88%	0.882	79%	0.788	S	S	*	*			trans	-132.7	142	-176.3	-62.3	177.9	0	0	0	110.9
321	V	25.9	Very low	26.2	Very low	127 Å²	127	130 Å²	130	77%	0.77	79%	0.792	S	S	*	*			trans	-138.8	165.4	-179.7	179.4	0	0	0	0	110.8
322	E	26.4	Very low	26.5	Very low	165 Å²	165	134.2 Å²	134.2	77%	0.771	80%	0.796	S	S	*	*			trans	-54.8	-175.6	-177.1	-50.6	166.1	123.4	0	0	115
323	T	25.8	Very low	26.5	Very low	110 Å²	110	136 Å²	136	68%	0.675	80%	0.8	S	S	*	*			cis	-175.3	148.3	37.9	-17.4	0	0	0	0	114.8
324	S	24.2	Very low	26.3	Very low	93 Å²	93	138.6 Å²	138.6	65%	0.65	80%	0.802	S	S	*	*			trans	54.2	131.4	133.4	69.5	0	0	0	0	127.9
325	L	23.2	Very low	26.1	Very low	174 Å²	174	135.3 Å²	135.3	91%	0.911	80%	0.799	S	S	*	*				94.2	153.5	123.4	-75.9	169.3	0	0	0	125.5
326	H	25	Very low	26	Very low	91 Å²	91	138.3 Å²	138.3	42%	0.421	80%	0.803	S	S	.	*			trans	-92.2	-167.5	-167.1	-119.4	-8.4	0	0	0	114.1	D250 I252	D250-H326 IonicContact OD1-CE1 3.27Å; D250-H326 PolarHBondContact OD1-CE1 3.33Å; D250-H326 IonicContact OD1-NE2 3.98Å; D250-H326 PolarHBondContact OD1-NE2 3.01Å; D250-H326 IonicContact OD2-CE1 3.26Å; D250-H326 PolarHBondContact OD2-CE1 3.36Å; D250-H326 IonicContact OD2-ND1 2.97Å; I252-H326 WeakPolarHBondContact CD1-NE2 3.24Å
327	P	35.6	Very low	25.8	Very low	101 Å²	101	138.5 Å²	138.5	66%	0.656	80%	0.804	S	S	*	*			cis	-139.2	-176.7	-19.2	38.6	-19.3	0	0	0	116.4	I252	I252-P327 HydrophobicContact CD1-CB 3.66Å
328	G	25.6	Very low	25.8	Very low	73 Å²	73	140.9 Å²	140.9	75%	0.753	80%	0.802	S	S	*	*			trans	162.9	99.4	155.8	0	0	0	0	0	123.3
329	V	26.3	Very low	25.8	Very low	148 Å²	148	142.8 Å²	142.8	90%	0.897	79%	0.791	S	S	*	*			trans	31.3	128.7	146.3	-167.9	0	0	0	0	123.6
330	S	26.8	Very low	25.8	Very low	116 Å²	116	147.9 Å²	147.9	81%	0.811	79%	0.794	S	S	*	*			trans	-166.6	-175.8	145.3	56.2	0	0	0	0	114.6
331	F	22.9	Very low	25.8	Very low	207 Å²	207	147.2 Å²	147.2	91%	0.908	79%	0.787	S	S	*	*			trans	-95.1	165.9	-163.8	-75.6	-107.6	0	0	0	116.6
332	L	28.8	Very low	26.1	Very low	164 Å²	164	151.6 Å²	151.6	86%	0.859	79%	0.79	S	S	*	*			trans	-88.2	159.2	169.4	-74.7	172.7	0	0	0	113
333	P	27.7	Very low	26.5	Very low	121 Å²	121	152.8 Å²	152.8	79%	0.786	79%	0.787	S	S	*	*				-148.4	142.3	99.6	36.5	-19.5	0	0	0	118.1
334	R	23.1	Very low	27.4	Very low	242 Å²	242	153.7 Å²	153.7	91%	0.913	78%	0.779	S	S	*	*			trans	64.9	112.8	138.7	-158.3	179.4	-154.2	166.2	7.9	121.1
335	S	24.6	Very low	27.9	Very low	118 Å²	118	153 Å²	153	83%	0.825	76%	0.764	S	S	*	*			trans	-128.3	173	151.1	72.5	0	0	0	0	110.9
336	R	24.6	Very low	28.6	Very low	244 Å²	244	147.2 Å²	147.2	92%	0.921	74%	0.738	S	S	*	*			trans	-96	135.2	-169.7	-67.8	175.4	174.7	156.3	-2.7	112.4
337	Q	24.9	Very low	29.2	Very low	192 Å²	192	143.3 Å²	143.3	90%	0.897	72%	0.722	S	S	*	*			trans	-78.8	151.7	166.2	-74.1	175.8	-42.5	0	0	111.7
338	T	24.5	Very low	29.2	Very low	132 Å²	132	141.8 Å²	141.8	81%	0.81	71%	0.713	S	S	*	*			trans	-120.3	140.8	159.1	43.2	0	0	0	0	108.5
339	D	25.1	Very low	29.9	Very low	130 Å²	130	140.2 Å²	140.2	70%	0.695	69%	0.686	S	S	*	*			trans	-67	133.1	-171.1	-64	-66.9	0	0	0	113.2
340	Q	24.8	Very low	30.8	Very low	186 Å²	186	136.9 Å²	136.9	87%	0.869	66%	0.663	S	S	*	*			trans	-97.6	94.2	163.6	-72.8	-168.9	-1.3	0	0	109.9	R342	Q340-R342 PolarHBondContact O-N 3.44Å
341	E	27	Very low	31.7	Very low	157 Å²	157	134.1 Å²	134.1	73%	0.734	64%	0.639	S	S	*	*			trans	-61.6	126.7	166.2	-72.3	-169.5	137.9	0	0	109.8	R343	E341-R343 PolarHBondContact O-N 3.43Å; E341-R343 VanDerWaalsContact O-N 3.09Å
342	R	31.6	Very low	32.4	Very low	220 Å²	220	125.1 Å²	125.1	83%	0.83	60%	0.601	S	S	*	*			trans	-71.1	106.5	-176.5	-66.8	-170.1	-176.9	-160.9	5.1	110.1	Q340 R344	Q340-R342 PolarHBondContact O-N 3.44Å; R342-R344 PolarHBondContact O-N 3.45Å
343	R	34.6	Very low	33	Very low	189 Å²	189	122.7 Å²	122.7	71%	0.713	58%	0.581	S	S	*	*	P	Polyproline II helix	trans	-56.4	132.9	-175.6	-57.2	-174.7	-168.5	-178.7	5.6	112.5	E341	E341-R343 PolarHBondContact O-N 3.43Å; E341-R343 VanDerWaalsContact O-N 3.09Å
344	R	44.1	Very low	33.7	Very low	130 Å²	130	119 Å²	119	49%	0.491	55%	0.554	S	S	.	*	P	Polyproline II helix	trans	-97.2	124.3	168.3	-68.3	173.4	170.9	151.8	-8	109.1	R342 E737 H741	R342-R344 PolarHBondContact O-N 3.45Å; R344-E737 IonicContact CZ-OE1 3.83Å; R344-E737 VanDerWaalsContact CZ-OE1 3.3Å; R344-E737 IonicContact CZ-OE2 3.81Å; R344-E737 IonicContact NE-OE2 2.91Å; R344-E737 VanDerWaalsContact NH1-CD 3.27Å; R344-E737 IonicContact NH1-OE1 3.86Å; R344-E737 IonicContact NH1-OE2 2.65Å; R344-E737 PolarHBondContact NH1-OE2 3.24Å; R344-E737 VanDerWaalsContact NH1-OE2 3.09Å; R344-E737 IonicContact NH2-OE1 2.72Å; R344-E737 PolarHBondContact NH2-OE1 3.03Å; R344-E737 IonicContact NH2-OE2 3.92Å; R344-E737 PolarHBondContact NH2-OE2 3.36Å; R344-H741 PolarHBondContact NH1-NE2 3.27Å; R344-H741 VanDerWaalsContact NH1-NE2 3.17Å; R344-H741 PolarHBondContact NH2-NE2 3.37Å
345	F	34.8	Very low	34.5	Very low	78 Å²	78	112.1 Å²	112.1	34%	0.342	53%	0.533	S	S	.	.	P	Polyproline II helix	trans	-71.1	144.1	-178.8	-55.5	-57.7	0	0	0	112.3	L350 K734	F345-L350 HydrophobicContact CB-CD2 4.3Å; F345-L350 HydrophobicContact CB-CG 4.05Å; F345-L350 HydrophobicContact CD2-CD2 4.49Å; F345-K734 PolarHBondContact O-NZ 3.35Å
346	S	38.2	Very low	34.9	Very low	52 Å²	52	110.5 Å²	110.5	36%	0.364	51%	0.514	S	S	.	.	P	Polyproline II helix	trans	-62.8	161.4	168.2	-178.9	0	0	0	0	111.2	S348 E349 L350	S346-S348 WeakPolarHBondContact CB-OG 3.24Å; S346-S348 PolarHBondContact OG-N 2.85Å; S346-S348 PolarHBondContact OG-OG 3.41Å; S346-E349 PolarHBondContact O-N 3.37Å; S346-L350 WeakPolarHBondContact O-CB 3.35Å; S346-L350 WeakPolarHBondContact O-CG 3.4Å; S346-L350 PolarHBondContact O-N 3.02Å
347	A	37.6	Very low	35.5	Very low	10 Å²	10	100.9 Å²	100.9	8%	0.083	48%	0.484	C	S	.	.	H	α-helix	trans	-69.4	-35.8	168.9	0	0	0	0	0	111.4	L350 I351 N727 V730	A347-L350 PolarHBondContact O-N 3.05Å; A347-I351 VanDerWaalsContact O-CG1 3.32Å; A347-I351 WeakPolarHBondContact O-CG1 3.36Å; A347-I351 PolarHBondContact O-N 2.82Å; A347-N727 WeakPolarHBondContact CB-OD1 3.25Å; A347-V730 HydrophobicContact CB-CG1 4.06Å
348	S	35.8	Very low	36.2	Very low	68 Å²	68	93.8 Å²	93.8	48%	0.476	45%	0.451	S	S	.	.	H	α-helix	trans	-60	-47.8	166.8	51.9	0	0	0	0	111.1	S346 L350 I351 S352	S346-S348 WeakPolarHBondContact CB-OG 3.24Å; S346-S348 PolarHBondContact OG-N 2.85Å; S346-S348 PolarHBondContact OG-OG 3.41Å; S348-L350 VanDerWaalsContact C-N 3.31Å; S348-L350 PolarHBondContact O-N 2.97Å; S348-I351 CarbonylContact O-C 3.58Å; S348-I351 WeakPolarHBondContact O-CB 3.37Å; S348-I351 PolarHBondContact O-N 3.08Å; S348-S352 PolarHBondContact O-N 2.91Å; S348-S352 PolarHBondContact O-OG 3.31Å
349	E	41.2	Very low	36.8	Very low	40 Å²	40	95.3 Å²	95.3	19%	0.187	44%	0.442	C	S	.	.	H	α-helix	trans	-65.8	-30	177.1	-167.5	179.1	173.4	0	0	112.9	S346 R353 Q898	S346-E349 PolarHBondContact O-N 3.37Å; E349-R353 HydrophobicContact CG-CG 4.18Å; E349-R353 WeakPolarHBondContact O-CA 3.3Å; E349-R353 WeakPolarHBondContact O-CB 3.39Å; E349-R353 WeakPolarHBondContact O-CG 3.47Å; E349-R353 PolarHBondContact O-N 3.05Å; E349-R353 IonicContact OE1-CZ 2.73Å; E349-R353 IonicContact OE1-NE 3.55Å; E349-R353 PolarHBondContact OE1-NE 2.84Å; E349-R353 IonicContact OE1-NH2 2.76Å; E349-R353 PolarHBondContact OE1-NH2 2.88Å; E349-Q898 VanDerWaalsContact CD-NE2 3.29Å; E349-Q898 PolarHBondContact OE1-NE2 2.65Å; E349-Q898 VanDerWaalsContact OE1-NE2 3.11Å; E349-Q898 PolarHBondContact OE2-NE2 3.13Å
350	L	44.3	Very low	37.2	Very low	79 Å²	79	96 Å²	96	41%	0.414	44%	0.439	S	S	.	.	H	α-helix	trans	-69.2	-35.7	170	-78.3	167.7	0	0	0	112	F345 S346 A347 S348 L354	F345-L350 HydrophobicContact CB-CD2 4.3Å; F345-L350 HydrophobicContact CB-CG 4.05Å; F345-L350 HydrophobicContact CD2-CD2 4.49Å; S346-L350 WeakPolarHBondContact O-CB 3.35Å; S346-L350 WeakPolarHBondContact O-CG 3.4Å; S346-L350 PolarHBondContact O-N 3.02Å; A347-L350 PolarHBondContact O-N 3.05Å; S348-L350 VanDerWaalsContact C-N 3.31Å; S348-L350 PolarHBondContact O-N 2.97Å; L350-L354 VanDerWaalsContact O-CB 3.23Å; L350-L354 WeakPolarHBondContact O-CB 3.29Å; L350-L354 PolarHBondContact O-N 3.35Å
351	I	45.5	Very low	37.8	Very low	58 Å²	58	91.1 Å²	91.1	30%	0.297	42%	0.419	S	S	.	.	H	α-helix	trans	-68.8	-50	173.8	-67.6	166.2	0	0	0	110.2	A347 S348 R353 L354 Q355 F685	A347-I351 VanDerWaalsContact O-CG1 3.32Å; A347-I351 WeakPolarHBondContact O-CG1 3.36Å; A347-I351 PolarHBondContact O-N 2.82Å; S348-I351 CarbonylContact O-C 3.58Å; S348-I351 WeakPolarHBondContact O-CB 3.37Å; S348-I351 PolarHBondContact O-N 3.08Å; I351-R353 VanDerWaalsContact C-N 3.32Å; I351-R353 PolarHBondContact O-N 3.37Å; I351-L354 WeakPolarHBondContact O-CB 3.27Å; I351-L354 PolarHBondContact O-N 2.84Å; I351-L354 VanDerWaalsContact O-N 3.12Å; I351-Q355 WeakPolarHBondContact O-CG 3.32Å; I351-Q355 PolarHBondContact O-N 3.49Å; I351-F685 HydrophobicContact CD1-CZ 4.3Å; I351-F685 HydrophobicContact CG1-CE1 4.35Å; I351-F685 HydrophobicContact CG1-CZ 3.74Å
352	S	38.6	Very low	38.2	Very low	18 Å²	18	86.9 Å²	86.9	13%	0.126	41%	0.406	C	S	.	.	H	α-helix	trans	-61.8	-38.4	175.7	-56.6	0	0	0	0	111.4	S348 Q355 L356 E908	S348-S352 PolarHBondContact O-N 2.91Å; S348-S352 PolarHBondContact O-OG 3.31Å; S352-Q355 PolarHBondContact O-N 3.37Å; S352-L356 WeakPolarHBondContact O-CB 3.18Å; S352-L356 WeakPolarHBondContact O-CD1 3.3Å; S352-L356 WeakPolarHBondContact O-CG 3.41Å; S352-L356 PolarHBondContact O-N 3.3Å; S352-E908 VanDerWaalsContact CB-OE1 3.23Å; S352-E908 WeakPolarHBondContact CB-OE1 3.38Å; S352-E908 PolarHBondContact OG-OE1 2.99Å
353	R	40.4	Very low	38.1	Very low	112 Å²	112	84.5 Å²	84.5	42%	0.423	40%	0.402	S	S	.	.	H	α-helix	trans	-71.4	-29.8	172.7	-74.6	176.1	-177.9	-117.5	-0.1	113.1	E349 I351 S357	E349-R353 HydrophobicContact CG-CG 4.18Å; E349-R353 WeakPolarHBondContact O-CA 3.3Å; E349-R353 WeakPolarHBondContact O-CB 3.39Å; E349-R353 WeakPolarHBondContact O-CG 3.47Å; E349-R353 PolarHBondContact O-N 3.05Å; E349-R353 IonicContact OE1-CZ 2.73Å; E349-R353 IonicContact OE1-NE 3.55Å; E349-R353 PolarHBondContact OE1-NE 2.84Å; E349-R353 IonicContact OE1-NH2 2.76Å; E349-R353 PolarHBondContact OE1-NH2 2.88Å; I351-R353 VanDerWaalsContact C-N 3.32Å; I351-R353 PolarHBondContact O-N 3.37Å; R353-S357 WeakPolarHBondContact O-CA 3.28Å; R353-S357 WeakPolarHBondContact O-CB 3.36Å; R353-S357 PolarHBondContact O-N 2.92Å
354	L	42.9	Very low	37.9	Very low	43 Å²	43	80.4 Å²	80.4	23%	0.225	40%	0.398	C	S	.	.	H	α-helix	trans	-67.5	-46.4	171.7	-165	78.6	0	0	0	109.9	L350 I351 L356 S357 Q358 Q686	L350-L354 VanDerWaalsContact O-CB 3.23Å; L350-L354 WeakPolarHBondContact O-CB 3.29Å; L350-L354 PolarHBondContact O-N 3.35Å; I351-L354 WeakPolarHBondContact O-CB 3.27Å; I351-L354 PolarHBondContact O-N 2.84Å; I351-L354 VanDerWaalsContact O-N 3.12Å; L354-L356 PolarHBondContact O-N 2.91Å; L354-S357 PolarHBondContact O-N 3.23Å; L354-Q358 WeakPolarHBondContact O-CB 3.23Å; L354-Q358 WeakPolarHBondContact O-CG 3.37Å; L354-Q358 PolarHBondContact O-N 2.9Å; L354-Q686 HydrophobicContact CD2-CG 4.35Å
355	Q	40.2	Very low	37.3	Very low	99 Å²	99	81.7 Å²	81.7	46%	0.463	41%	0.414	S	S	.	.	H	α-helix	trans	-64.6	-36.3	175.4	-67.5	172.7	3.2	0	0	112.6	I351 S352 R359	I351-Q355 WeakPolarHBondContact O-CG 3.32Å; I351-Q355 PolarHBondContact O-N 3.49Å; S352-Q355 PolarHBondContact O-N 3.37Å; Q355-R359 WeakPolarHBondContact O-CG 3.42Å; Q355-R359 PolarHBondContact O-N 2.8Å
356	L	33.3	Very low	37.2	Very low	83 Å²	83	89 Å²	89	44%	0.435	44%	0.439	S	S	.	.	H	α-helix	trans	-77.6	-27.9	174.4	-71.3	165.9	0	0	0	113	S352 L354 R359 K360	S352-L356 WeakPolarHBondContact O-CB 3.18Å; S352-L356 WeakPolarHBondContact O-CD1 3.3Å; S352-L356 WeakPolarHBondContact O-CG 3.41Å; S352-L356 PolarHBondContact O-N 3.3Å; L354-L356 PolarHBondContact O-N 2.91Å; L356-R359 CarbonylContact O-C 3.57Å; L356-R359 PolarHBondContact O-N 2.84Å; L356-K360 WeakPolarHBondContact O-CB 3.48Å; L356-K360 WeakPolarHBondContact O-CG 3.4Å; L356-K360 PolarHBondContact O-N 2.88Å; L356-K360 VanDerWaalsContact O-N 3.1Å
357	S	36.1	Very low	36.7	Very low	43 Å²	43	94.9 Å²	94.9	30%	0.301	47%	0.466	S	S	.	.	H	α-helix	trans	-72.9	-41.3	171.6	177	0	0	0	0	110.4	R353 L354 R359 K360 N361	R353-S357 WeakPolarHBondContact O-CA 3.28Å; R353-S357 WeakPolarHBondContact O-CB 3.36Å; R353-S357 PolarHBondContact O-N 2.92Å; L354-S357 PolarHBondContact O-N 3.23Å; S357-R359 PolarHBondContact O-N 2.98Å; S357-K360 PolarHBondContact O-N 2.81Å; S357-N361 WeakPolarHBondContact O-CB 3.39Å; S357-N361 PolarHBondContact O-N 2.74Å; S357-N361 PolarHBondContact O-OD1 2.7Å; S357-N361 VanDerWaalsContact O-OD1 3.06Å; S357-N361 VanDerWaalsContact OG-CG 3.32Å; S357-N361 PolarHBondContact OG-ND2 2.98Å; S357-N361 VanDerWaalsContact OG-ND2 3.12Å; S357-N361 PolarHBondContact OG-OD1 3.18Å
358	Q	39.7	Very low	36.2	Very low	42 Å²	42	97.8 Å²	97.8	20%	0.196	50%	0.497	C	S	.	.	H	α-helix	trans	-57.8	-29.4	169.1	-71.7	160.2	-0.3	0	0	112	L354 I474	L354-Q358 WeakPolarHBondContact O-CB 3.23Å; L354-Q358 WeakPolarHBondContact O-CG 3.37Å; L354-Q358 PolarHBondContact O-N 2.9Å; Q358-I474 HydrophobicContact CB-CG2 4.25Å; Q358-I474 HydrophobicContact CG-CD1 4.16Å; Q358-I474 HydrophobicContact CG-CG2 4.36Å; Q358-I474 VanDerWaalsContact NE2-CD1 3.34Å
359	R	36.7	Very low	35.9	Very low	165 Å²	165	104.4 Å²	104.4	62%	0.623	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.6	-11.5	171	-70.8	176.1	-177.3	177.3	3.4	115.5	Q355 L356 S357 S362	Q355-R359 WeakPolarHBondContact O-CG 3.42Å; Q355-R359 PolarHBondContact O-N 2.8Å; L356-R359 CarbonylContact O-C 3.57Å; L356-R359 PolarHBondContact O-N 2.84Å; S357-R359 PolarHBondContact O-N 2.98Å; R359-S362 PolarHBondContact O-OG 3.36Å
360	K	35	Very low	35.2	Very low	145 Å²	145	107.5 Å²	107.5	63%	0.63	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112	-34.9	-176.7	-78.3	-177.5	175.9	-172.3	0	113.9	L356 S357 S362 F363 T364	L356-K360 WeakPolarHBondContact O-CB 3.48Å; L356-K360 WeakPolarHBondContact O-CG 3.4Å; L356-K360 PolarHBondContact O-N 2.88Å; L356-K360 VanDerWaalsContact O-N 3.1Å; S357-K360 PolarHBondContact O-N 2.81Å; K360-S362 PolarHBondContact O-N 3.22Å; K360-F363 PolarHBondContact O-N 2.77Å; K360-T364 PolarHBondContact O-N 3.46Å
361	N	36.5	Very low	34.3	Very low	82 Å²	82	112 Å²	112	44%	0.439	57%	0.567	S	S	.	*	H	α-helix	trans	-64.3	-24.4	178.7	-62	10	0	0	0	111.5	S357 F363 T364	S357-N361 WeakPolarHBondContact O-CB 3.39Å; S357-N361 PolarHBondContact O-N 2.74Å; S357-N361 PolarHBondContact O-OD1 2.7Å; S357-N361 VanDerWaalsContact O-OD1 3.06Å; S357-N361 VanDerWaalsContact OG-CG 3.32Å; S357-N361 PolarHBondContact OG-ND2 2.98Å; S357-N361 VanDerWaalsContact OG-ND2 3.12Å; S357-N361 PolarHBondContact OG-OD1 3.18Å; N361-F363 PolarHBondContact O-N 2.83Å; N361-T364 WeakPolarHBondContact CA-OG1 3.06Å; N361-T364 PolarHBondContact O-N 3.49Å; N361-T364 PolarHBondContact O-OG1 2.8Å
362	S	34.8	Very low	33.4	Very low	68 Å²	68	114.7 Å²	114.7	48%	0.476	59%	0.591	S	S	.	*	H	α-helix	trans	-63.3	-19.8	170.3	53.8	0	0	0	0	114.4	R359 K360	R359-S362 PolarHBondContact O-OG 3.36Å; K360-S362 PolarHBondContact O-N 3.22Å
363	F	30	Very low	32.8	Very low	170 Å²	170	119 Å²	119	75%	0.746	63%	0.628	S	S	*	*	H	α-helix	trans	-101.7	-21.9	178.1	-86.6	-87.9	0	0	0	114	K360 N361 L365	K360-F363 PolarHBondContact O-N 2.77Å; N361-F363 PolarHBondContact O-N 2.83Å; F363-L365 VanDerWaalsContact C-N 3.28Å; F363-L365 PolarHBondContact O-N 2.87Å
364	T	30.2	Very low	32.2	Very low	103 Å²	103	124.7 Å²	124.7	63%	0.632	65%	0.649	S	S	*	*	H	α-helix	trans	-76	-9.6	-177.1	45.6	0	0	0	0	114.4	K360 N361 R366	K360-T364 PolarHBondContact O-N 3.46Å; N361-T364 WeakPolarHBondContact CA-OG1 3.06Å; N361-T364 PolarHBondContact O-N 3.49Å; N361-T364 PolarHBondContact O-OG1 2.8Å; T364-R366 PolarHBondContact O-N 3.04Å
365	L	31.1	Very low	31.4	Very low	158 Å²	158	127.5 Å²	127.5	83%	0.827	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.5	16.9	174.9	-64.7	178.8	0	0	0	114.2	F363	F363-L365 VanDerWaalsContact C-N 3.28Å; F363-L365 PolarHBondContact O-N 2.87Å
366	R	32.4	Very low	30.7	Very low	230 Å²	230	127.6 Å²	127.6	87%	0.868	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-134.2	50.5	174.5	-90.8	-161.7	171.4	-158.2	0.5	114.9	T364	T364-R366 PolarHBondContact O-N 3.04Å
367	L	28.5	Very low	30.3	Very low	177 Å²	177	129.2 Å²	129.2	93%	0.927	72%	0.715	S	S	*	*			trans	-145.9	153.6	153.7	-138.4	70.1	0	0	0	110
368	G	27	Very low	29.9	Very low	71 Å²	71	137.2 Å²	137.2	73%	0.732	74%	0.738	S	S	*	*			trans	102.1	52.5	176.1	0	0	0	0	0	117
369	K	30.3	Very low	29.3	Very low	206 Å²	206	141.2 Å²	141.2	90%	0.896	76%	0.761	S	S	*	*			trans	-92	138	145.8	-77.1	-174.9	177.4	-179	0	107.6
370	S	25.7	Very low	28.9	Very low	105 Å²	105	141.3 Å²	141.3	73%	0.734	77%	0.766	S	S	*	*			trans	62.6	149.3	-163.6	5.2	0	0	0	0	112.4
371	L	26.5	Very low	28.6	Very low	173 Å²	173	142 Å²	142	91%	0.906	77%	0.772	S	S	*	*			cis	-115.9	147.3	18	-66.6	160.5	0	0	0	112.8
372	S	25.7	Very low	28.1	Very low	116 Å²	116	142.9 Å²	142.9	81%	0.811	78%	0.784	S	S	*	*			trans	-117.3	105.1	164.5	-178.9	0	0	0	0	108.4	R374	S372-R374 PolarHBondContact O-N 3.23Å; S372-R374 VanDerWaalsContact O-N 3.13Å
373	A	26.5	Very low	27.7	Very low	108 Å²	108	144 Å²	144	89%	0.893	79%	0.792	S	S	*	*			trans	-84.9	77.9	-179.1	0	0	0	0	0	110.5
374	R	28.3	Very low	27.5	Very low	231 Å²	231	142.6 Å²	142.6	87%	0.872	79%	0.792	S	S	*	*			trans	-81.7	129.4	170.8	-152	174.8	-163.8	170.9	4.9	109.1	S372 A376	S372-R374 PolarHBondContact O-N 3.23Å; S372-R374 VanDerWaalsContact O-N 3.13Å; R374-A376 PolarHBondContact O-N 2.87Å
375	A	25.7	Very low	27.3	Very low	103 Å²	103	144.2 Å²	144.2	85%	0.851	80%	0.796	S	S	*	*			trans	-57.9	130.6	-176.4	0	0	0	0	0	112.2	S377	A375-S377 PolarHBondContact O-N 2.99Å
376	A	25.7	Very low	26.9	Very low	101 Å²	101	143.8 Å²	143.8	84%	0.835	79%	0.791	S	S	*	*			trans	-91.4	102.6	-179.1	0	0	0	0	0	111.2	R374 R378	R374-A376 PolarHBondContact O-N 2.87Å; A376-R378 PolarHBondContact O-N 2.79Å
377	S	24.2	Very low	26.6	Very low	117 Å²	117	138.9 Å²	138.9	82%	0.818	78%	0.781	S	S	*	*			trans	-79.7	103.3	156.6	-177.8	0	0	0	0	108.8	A375	A375-S377 PolarHBondContact O-N 2.99Å
378	R	27.7	Very low	26.4	Very low	211 Å²	211	139.5 Å²	139.5	80%	0.796	77%	0.771	S	S	*	*			trans	9.5	112.5	140.2	-180	-171.8	-176.1	164.8	5.9	115.4	A376	A376-R378 PolarHBondContact O-N 2.79Å
379	D	26.9	Very low	26.2	Very low	126 Å²	126	145.4 Å²	145.4	67%	0.674	77%	0.772	S	S	*	*				-166.9	-179.2	99.2	-124.8	-54.3	0	0	0	114.4
380	K	28.5	Very low	26	Very low	166 Å²	166	140.7 Å²	140.7	72%	0.722	76%	0.757	S	S	*	*			trans	-55.7	164.3	-165.4	-75.2	161.5	176.5	177	0	121.6
381	Q	28.2	Very low	26.1	Very low	161 Å²	161	142.8 Å²	142.8	75%	0.752	75%	0.753	S	S	*	*			trans	92.9	90.4	135.8	-90.7	163.6	-54.1	0	0	122
382	S	26.1	Very low	26.1	Very low	99 Å²	99	143.3 Å²	143.3	69%	0.692	74%	0.744	S	S	*	*				71.6	128.9	117	59.8	0	0	0	0	123.6
383	S	27	Very low	26.3	Very low	93 Å²	93	144.6 Å²	144.6	65%	0.65	74%	0.742	S	S	*	*			trans	79.3	103.8	137.5	60.7	0	0	0	0	122.4
384	N	25.3	Very low	26.3	Very low	140 Å²	140	143.6 Å²	143.6	75%	0.749	73%	0.728	S	S	*	*				87.8	123.6	115.6	-67	-3.9	0	0	0	123
385	I	26.1	Very low	26.2	Very low	137 Å²	137	143.7 Å²	143.7	70%	0.703	73%	0.729	S	S	*	*				63	104.3	128.1	-58.6	170.4	0	0	0	116.2
386	M	22.6	Very low	26.4	Very low	148 Å²	148	147.4 Å²	147.4	73%	0.729	73%	0.728	S	S	*	*				84.2	145.1	57.3	-170.2	-150.6	173.2	0	0	113.4
387	I	26	Very low	26.6	Very low	127 Å²	127	154.4 Å²	154.4	65%	0.651	73%	0.733	S	S	*	*			trans	84.4	140.6	170.3	-52.3	-173.4	0	0	0	116.2
388	R	23.7	Very low	26.9	Very low	190 Å²	190	154.1 Å²	154.1	72%	0.717	73%	0.731	S	S	*	*			cis	-166	159.4	-30.6	-98.4	-177.3	-163.5	172.3	3.7	108.8
389	Y	24.3	Very low	27.1	Very low	195 Å²	195	150.4 Å²	150.4	77%	0.765	74%	0.737	S	S	*	*			trans	60.6	118.6	146.9	-79.8	-53.6	0	0	0	125.3
390	D	25.9	Very low	27.3	Very low	108 Å²	108	147.8 Å²	147.8	58%	0.578	74%	0.74	S	S	*	*				67.2	111.4	123.1	-93.8	13	0	0	0	125.2
391	K	27.4	Very low	27.2	Very low	148 Å²	148	143.7 Å²	143.7	64%	0.643	75%	0.745	S	S	*	*				93.3	128.5	115.9	-84.8	174.9	-172.6	139	0	124.8
392	Y	26.3	Very low	27.4	Very low	185 Å²	185	141.2 Å²	141.2	73%	0.725	75%	0.745	S	S	*	*			trans	84.6	117.7	138.4	-79.1	-49	0	0	0	123.2
393	N	29.1	Very low	27.9	Very low	143 Å²	143	141.5 Å²	141.5	77%	0.765	75%	0.747	S	S	*	*			trans	57.9	139.1	139	-64.9	-8.9	0	0	0	119.2
394	S	26.8	Very low	28.1	Very low	86 Å²	86	144 Å²	144	60%	0.601	75%	0.754	S	S	*	*			cis	-172.5	174.5	43.7	69.8	0	0	0	0	115.1
395	R	27.6	Very low	28.5	Very low	234 Å²	234	143 Å²	143	88%	0.883	76%	0.757	S	S	*	*			trans	84.4	130.5	145.9	-77.3	167.8	-178.8	161.8	1.1	122.2
396	H	28.1	Very low	28.6	Very low	180 Å²	180	139.4 Å²	139.4	83%	0.833	75%	0.754	S	S	*	*			trans	-62.1	167.5	171.9	-65.6	-103	0	0	0	115.8
397	R	31.3	Very low	28.9	Very low	249 Å²	249	138.3 Å²	138.3	94%	0.94	76%	0.756	S	S	*	*			trans	-126.5	168.2	143.5	-79.5	-170.5	169.8	-155.4	-2.1	110.1
398	S	29.3	Very low	29.1	Very low	111 Å²	111	143.3 Å²	143.3	78%	0.776	77%	0.768	S	S	*	*			trans	-139.8	160.6	-163.5	-47.4	0	0	0	0	113.8
399	S	33.6	Very low	29.5	Very low	132 Å²	132	139.1 Å²	139.1	92%	0.923	77%	0.768	S	S	*	*			trans	73	141.3	160.9	-153.2	0	0	0	0	118.4
400	G	29.7	Very low	30.4	Very low	71 Å²	71	135.6 Å²	135.6	73%	0.732	77%	0.769	S	S	*	*			cis	163.5	148.1	-10.3	0	0	0	0	0	115.6
401	G	27.9	Very low	30.5	Very low	81 Å²	81	137.1 Å²	137.1	84%	0.835	78%	0.782	S	S	*	*			trans	77.9	165.7	167.8	0	0	0	0	0	117.9
402	S	31.9	Very low	30.4	Very low	108 Å²	108	133.6 Å²	133.6	76%	0.755	79%	0.788	S	S	*	*			cis	-169.8	145	-27.8	-167.7	0	0	0	0	111.5
403	S	35.7	Very low	30.4	Very low	106 Å²	106	131.5 Å²	131.5	74%	0.741	79%	0.794	S	S	*	*			trans	67	154.6	159.9	-45.1	0	0	0	0	117.6
404	D	32	Very low	30.4	Very low	146 Å²	146	128 Å²	128	78%	0.781	79%	0.793	S	S	*	*			cis	-157.9	170.5	-5.5	-140.9	-38.6	0	0	0	112.8
405	S	33.2	Very low	30.4	Very low	117 Å²	117	132.3 Å²	132.3	82%	0.818	81%	0.808	S	S	*	*			trans	66.4	156.2	165.3	75.8	0	0	0	0	119.7
406	G	27.9	Very low	30.7	Very low	62 Å²	62	126.5 Å²	126.5	64%	0.639	80%	0.8	S	S	*	*			cis	172.2	120.5	-12.4	0	0	0	0	0	116.5
407	T	30	Very low	30.5	Very low	126 Å²	126	125.3 Å²	125.3	77%	0.773	80%	0.799	S	S	*	*			trans	59.1	151.2	150.5	59.1	0	0	0	0	124.8
408	Y	30	Very low	30.8	Very low	231 Å²	231	119 Å²	119	91%	0.906	79%	0.79	S	S	*	*			trans	88	152.7	159.6	-70.4	-70.7	0	0	0	121.7
409	S	31.7	Very low	30.8	Very low	102 Å²	102	119 Å²	119	71%	0.713	79%	0.791	S	S	*	*			trans	-119.4	163.4	-177.8	-178.1	0	0	0	0	109.2
410	P	42.8	Very low	30.4	Very low	121 Å²	121	116.5 Å²	116.5	79%	0.786	79%	0.786	S	S	*	*				-151.9	166.6	108.3	38.9	-22	0	0	0	118
411	V	29.2	Very low	30.2	Very low	140 Å²	140	119.9 Å²	119.9	85%	0.848	79%	0.787	S	S	*	*			trans	-23.7	145.4	152.9	-177.6	0	0	0	0	116.9
412	G	25.2	Very low	30.4	Very low	74 Å²	74	123 Å²	123	76%	0.763	78%	0.784	S	S	*	*			trans	-176.8	100.3	164.7	0	0	0	0	0	118.3
413	T	26.1	Very low	30.1	Very low	141 Å²	141	121.3 Å²	121.3	87%	0.865	79%	0.785	S	S	*	*			trans	-44.8	133.1	174	-44	0	0	0	0	118.7
414	G	29.2	Very low	29.7	Very low	71 Å²	71	124.9 Å²	124.9	73%	0.732	79%	0.792	S	S	*	*			trans	39.8	128.3	139.1	0	0	0	0	0	123.6
415	L	25.5	Very low	29.4	Very low	175 Å²	175	123.5 Å²	123.5	92%	0.916	79%	0.793	S	S	*	*			trans	-136.7	164.5	167.5	-80.2	175.2	0	0	0	112.6
416	P	33.6	Very low	29.1	Very low	113 Å²	113	121.8 Å²	121.8	73%	0.734	78%	0.782	S	S	*	*			trans	-113.7	176.9	-156.5	42.9	-36.3	0	0	0	117
417	L	25.3	Very low	29	Very low	155 Å²	155	127.5 Å²	127.5	81%	0.812	79%	0.791	S	S	*	*			trans	-65.6	148	158.1	-75.3	162.3	0	0	0	110.7
418	P	37.7	Very low	28.6	Very low	115 Å²	115	132.9 Å²	132.9	75%	0.747	80%	0.797	S	S	*	*				-135.5	145	65.4	30.1	-9.8	0	0	0	114.6
419	S	27.9	Very low	28.3	Very low	113 Å²	113	133.3 Å²	133.3	79%	0.79	80%	0.797	S	S	*	*				95.1	129	69.8	-55.8	0	0	0	0	114.9
420	G	26.6	Very low	27.8	Very low	79 Å²	79	134.2 Å²	134.2	81%	0.814	80%	0.804	S	S	*	*			trans	120.2	135.9	169.5	0	0	0	0	0	114.1
421	D	26	Very low	27	Very low	142 Å²	142	133 Å²	133	76%	0.759	80%	0.803	S	S	*	*			cis	-161.2	157.4	-13.6	-164.5	12.8	0	0	0	110.9
422	N	30.7	Very low	26.9	Very low	145 Å²	145	136.1 Å²	136.1	78%	0.775	81%	0.806	S	S	*	*			trans	62.5	149	179.4	-52.8	-77.3	0	0	0	117
423	G	26.5	Very low	26.9	Very low	74 Å²	74	141.2 Å²	141.2	76%	0.763	81%	0.814	S	S	*	*			cis	139.3	143.2	-12.5	0	0	0	0	0	113.6
424	M	27.4	Very low	26.7	Very low	181 Å²	181	137.4 Å²	137.4	89%	0.892	80%	0.803	S	S	*	*			cis	-170.2	108.5	-15.7	178.4	171.4	61	0	0	112.3
425	S	25.5	Very low	26.6	Very low	116 Å²	116	143 Å²	143	81%	0.811	81%	0.813	S	S	*	*			trans	-161.1	136.4	157.5	54.5	0	0	0	0	110.9
426	S	26	Very low	26.6	Very low	82 Å²	82	146.3 Å²	146.3	57%	0.573	81%	0.813	S	S	*	*			cis	91.1	123.6	32.6	-71	0	0	0	0	113.5
427	H	26.3	Very low	26.3	Very low	181 Å²	181	149.8 Å²	149.8	84%	0.838	82%	0.816	S	S	*	*			cis	-161.5	158.4	-6.6	-76.8	-66.1	0	0	0	110
428	R	22.1	Very low	26.2	Very low	240 Å²	240	152.2 Å²	152.2	91%	0.906	82%	0.82	S	S	*	*				-166.8	156.3	118.6	-166.2	156.3	-77	-157.7	-1.8	111.5
429	W	22.9	Very low	25.6	Very low	240 Å²	240	151.1 Å²	151.1	91%	0.909	82%	0.816	S	S	*	*			trans	-72.4	151.2	-168.7	-84.2	-75.3	0	0	0	116.9
430	S	21.3	Very low	25.4	Very low	121 Å²	121	153.7 Å²	153.7	85%	0.846	82%	0.819	S	S	*	*			trans	-124.7	147.4	133.4	-176.4	0	0	0	0	108.1
431	A	25.7	Very low	25.4	Very low	94 Å²	94	158.6 Å²	158.6	78%	0.777	82%	0.821	S	S	*	*			trans	-121.4	129.6	-174.6	0	0	0	0	0	110.9
432	K	27.6	Very low	25.5	Very low	207 Å²	207	160.9 Å²	160.9	90%	0.9	83%	0.827	S	S	*	*			trans	-132.1	118.9	-176.8	-173	174.9	-175.1	173.7	0	109.6
433	L	24.9	Very low	25.1	Very low	180 Å²	180	161.6 Å²	161.6	94%	0.942	83%	0.83	S	S	*	*			trans	-117.9	134.8	166.8	-115.4	164.1	0	0	0	107.3
434	G	23.1	Very low	25	Very low	61 Å²	61	162.4 Å²	162.4	63%	0.629	83%	0.825	S	S	*	*			trans	-151.6	160.7	176	0	0	0	0	0	109.9
435	M	26.9	Very low	25	Very low	189 Å²	189	159.4 Å²	159.4	93%	0.931	82%	0.821	S	S	*	*			trans	171.8	120.5	154.8	-95.2	-52.9	173	0	0	107.7
436	R	25.4	Very low	25.1	Very low	244 Å²	244	161.3 Å²	161.3	92%	0.921	82%	0.821	S	S	*	*				166.4	135.4	100.6	-164.4	169.7	-167.5	-179.1	4.2	110.2
437	K	27.6	Very low	25.3	Very low	186 Å²	186	163.5 Å²	163.5	81%	0.809	83%	0.833	S	S	*	*			trans	-91.9	136.4	177	-176	-179.2	-178.4	-178.8	0	110.3
438	K	23	Very low	25.2	Very low	206 Å²	206	159 Å²	159	90%	0.896	82%	0.822	S	S	*	*			trans	-148.7	147	153.4	-148.4	-178.8	-177.1	-169	0	109
439	S	24	Very low	25.7	Very low	93 Å²	93	153.3 Å²	153.3	65%	0.65	82%	0.819	S	S	*	*			trans	-131.8	149.3	-172.2	48.3	0	0	0	0	110.7
440	I	24.8	Very low	25.9	Very low	166 Å²	166	149.8 Å²	149.8	85%	0.851	81%	0.81	S	S	*	*			trans	-162.3	159.2	160	-100.3	150.1	0	0	0	106
441	E	25.8	Very low	26.4	Very low	183 Å²	183	150 Å²	150	86%	0.855	81%	0.809	S	S	*	*			trans	-107.4	-177.5	-160.6	-66	162.5	115.7	0	0	113.7
442	E	28	Very low	26.6	Very low	190 Å²	190	150.5 Å²	150.5	89%	0.888	80%	0.802	S	S	*	*			trans	77.8	90.6	162	-59.6	-171.6	149.3	0	0	121
443	D	23.5	Very low	27	Very low	159 Å²	159	144.7 Å²	144.7	85%	0.85	79%	0.788	S	S	*	*				84.9	164	115.6	-146.6	9.8	0	0	0	122.4
444	S	23.5	Very low	27.7	Very low	92 Å²	92	143.5 Å²	143.5	64%	0.643	78%	0.782	S	S	*	*			trans	80.7	71.7	174.2	70.2	0	0	0	0	120.3
445	S	27.8	Very low	28.8	Very low	118 Å²	118	147.1 Å²	147.1	83%	0.825	78%	0.777	S	S	*	*			trans	37.1	88.9	130.6	64	0	0	0	0	121.4
446	I	26.8	Very low	30.2	Very low	156 Å²	156	144.5 Å²	144.5	80%	0.8	77%	0.766	S	S	*	*			trans	-142.1	124.2	146.5	-53.5	179.1	0	0	0	109.7	S448	I446-S448 PolarHBondContact O-N 3.46Å
447	P	30.3	Very low	31.7	Very low	128 Å²	128	134 Å²	134	83%	0.831	73%	0.73	S	S	*	*			trans	-82.8	104.4	170.4	31.4	-30.6	0	0	0	111.1
448	S	25	Very low	33.4	Very low	86 Å²	86	131.1 Å²	131.1	60%	0.601	71%	0.714	S	S	*	*			trans	-73.4	129.7	178.4	58.4	0	0	0	0	112.7	I446 F450	I446-S448 PolarHBondContact O-N 3.46Å; S448-F450 PolarHBondContact O-N 2.86Å
449	S	31.4	Very low	35.3	Very low	120 Å²	120	122.1 Å²	122.1	84%	0.839	68%	0.675	S	S	*	*			trans	-71.5	116.1	176.7	55.8	0	0	0	0	112.8
450	F	26.7	Very low	37.1	Very low	167 Å²	167	119.6 Å²	119.6	73%	0.732	65%	0.654	S	S	*	*			trans	-118.7	138	163.1	-74.3	-84.5	0	0	0	109.7	S448 T452	S448-F450 PolarHBondContact O-N 2.86Å; F450-T452 PolarHBondContact O-N 2.89Å; F450-T452 VanDerWaalsContact O-N 3.15Å
451	P	32.8	Very low	38.6	Very low	126 Å²	126	114.4 Å²	114.4	82%	0.818	63%	0.631	S	S	*	*			trans	-75.4	103.7	-178.3	29.7	-33.9	0	0	0	111.4	S453	P451-S453 PolarHBondContact O-N 2.8Å; P451-S453 VanDerWaalsContact O-N 3.09Å
452	T	29.8	Very low	40.1	Very low	104 Å²	104	109.6 Å²	109.6	64%	0.638	62%	0.618	S	S	*	*			trans	-82.5	82.4	178.6	52	0	0	0	0	111.6	F450 N454 R455	F450-T452 PolarHBondContact O-N 2.89Å; F450-T452 VanDerWaalsContact O-N 3.15Å; T452-N454 PolarHBondContact O-N 3.38Å; T452-R455 PolarHBondContact O-N 2.84Å
453	S	36.4	Very low	41.8	Very low	85 Å²	85	103.7 Å²	103.7	59%	0.594	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.4	13.9	179	-166.3	0	0	0	0	115.8	P451	P451-S453 PolarHBondContact O-N 2.8Å; P451-S453 VanDerWaalsContact O-N 3.09Å
454	N	39.2	Very low	44.5	Very low	154 Å²	154	96.6 Å²	96.6	82%	0.824	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-137.6	21.5	-176.3	-82.7	-38.2	0	0	0	112.5	T452 L456	T452-N454 PolarHBondContact O-N 3.38Å; N454-L456 PolarHBondContact O-N 2.82Å
455	R	46.9	Very low	47.3	Very low	137 Å²	137	92.2 Å²	92.2	52%	0.517	53%	0.529	S	S	.	.			trans	-72.5	90.4	174.7	-164.3	-171	-161.4	-118	9.6	109.5	T452 S457 E608 E612	T452-R455 PolarHBondContact O-N 2.84Å; R455-S457 PolarHBondContact O-N 3.11Å; R455-E608 IonicContact NH1-OE2 3.77Å; R455-E608 PolarHBondContact NH1-OE2 2.9Å; R455-E612 IonicContact CZ-OE1 2.81Å; R455-E612 VanDerWaalsContact CZ-OE1 3.3Å; R455-E612 IonicContact NH1-OE1 3.79Å; R455-E612 PolarHBondContact NH1-OE1 2.84Å; R455-E612 IonicContact NH2-OE1 3.7Å; R455-E612 PolarHBondContact NH2-OE1 2.83Å; R455-E612 IonicContact NH2-OE2 2.78Å
456	L	55.2	Low	50	Low	134 Å²	134	86.6 Å²	86.6	70%	0.702	49%	0.49	S	S	*	.			trans	-55.9	133.5	167.3	-68.8	173	0	0	0	109.3	N454 R458	N454-L456 PolarHBondContact O-N 2.82Å; L456-R458 PolarHBondContact O-N 3.17Å
457	S	57.5	Low	52.8	Low	24 Å²	24	80 Å²	80	17%	0.168	46%	0.455	C	S	.	.			trans	-54.6	122.5	179	176.6	0	0	0	0	110.9	R455 F459 L460 E608	R455-S457 PolarHBondContact O-N 3.11Å; S457-F459 PolarHBondContact O-N 3.01Å; S457-F459 PolarHBondContact OG-N 3.34Å; S457-L460 PolarHBondContact O-N 3Å; S457-E608 VanDerWaalsContact CA-OE1 3.3Å; S457-E608 WeakPolarHBondContact CA-OE1 3.2Å; S457-E608 WeakPolarHBondContact CB-OE1 3.39Å; S457-E608 PolarHBondContact OG-OE1 3.47Å
458	R	63	Low	55	Low	125 Å²	125	77.9 Å²	77.9	47%	0.472	44%	0.435	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-6.5	178.4	57.4	155.1	-72.6	168.4	-3.5	113.9	L456 D529 E612	L456-R458 PolarHBondContact O-N 3.17Å; R458-D529 IonicContact CZ-OD2 2.7Å; R458-D529 IonicContact NH2-OD2 2.62Å; R458-D529 PolarHBondContact NH2-OD2 3.42Å; R458-E612 WeakPolarHBondContact CD-OE1 3.44Å
459	F	62.2	Low	57.3	Low	17 Å²	17	74.5 Å²	74.5	8%	0.075	41%	0.408	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.8	-1	-177.3	-59	-73	0	0	0	113.9	S457 I527 F551 L611 E612	S457-F459 PolarHBondContact O-N 3.01Å; S457-F459 PolarHBondContact OG-N 3.34Å; F459-I527 HydrophobicContact CD1-CD1 4.46Å; F459-F551 HydrophobicContact CB-CE2 4.11Å; F459-F551 HydrophobicContact CB-CZ 4.27Å; F459-F551 HydrophobicContact CG-CE2 4.48Å; F459-L611 HydrophobicContact CD1-CD2 4.12Å; F459-L611 HydrophobicContact CD2-CD2 3.6Å; F459-L611 HydrophobicContact CD2-CG 4.43Å; F459-L611 HydrophobicContact CE1-CD2 4.08Å; F459-L611 HydrophobicContact CE1-CG 4.27Å; F459-L611 HydrophobicContact CE2-CB 4.38Å; F459-L611 HydrophobicContact CE2-CD2 3.56Å; F459-L611 HydrophobicContact CE2-CG 3.89Å; F459-L611 HydrophobicContact CG-CD2 3.89Å; F459-L611 HydrophobicContact CZ-CD2 3.8Å; F459-L611 HydrophobicContact CZ-CG 3.79Å; F459-E612 HydrophobicContact CE2-CG 3.95Å; F459-E612 HydrophobicContact CZ-CG 4.03Å
460	L	62.4	Low	59.3	Low	40 Å²	40	69.1 Å²	69.1	21%	0.209	37%	0.371	C	S	.	.	S	Bend	trans	-123.4	143.1	-179.9	-80.9	-168.6	0	0	0	114.4	S457 S462 T555 A558	S457-L460 PolarHBondContact O-N 3Å; L460-S462 PolarHBondContact O-N 2.82Å; L460-T555 HydrophobicContact CD2-CG2 3.76Å; L460-A558 HydrophobicContact CD1-CB 3.45Å; L460-A558 VanDerWaalsContact CD1-CB 3.45Å; L460-A558 HydrophobicContact CG-CB 4.23Å
461	P	57.1	Low	61.4	Low	57 Å²	57	64.8 Å²	64.8	37%	0.37	36%	0.355	S	S	.	.			trans	-60.8	129.8	160.4	-20.6	33.9	0	0	0	111.2	S463 I464	P461-S463 PolarHBondContact O-N 2.75Å; P461-I464 HydrophobicContact CB-CD1 4.37Å
462	S	56.6	Low	63.3	Low	83 Å²	83	61.4 Å²	61.4	58%	0.58	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73	30	-179.9	64.5	0	0	0	0	114.1	L460 R562	L460-S462 PolarHBondContact O-N 2.82Å; S462-R562 VanDerWaalsContact O-CZ 3.3Å; S462-R562 PolarHBondContact O-NH1 3.27Å; S462-R562 PolarHBondContact O-NH2 3.03Å
463	S	63.8	Low	65.1	Low	66 Å²	66	57 Å²	57	46%	0.462	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118	-23.3	-173.3	55.1	0	0	0	0	115.8	P461 R562 Q673	P461-S463 PolarHBondContact O-N 2.75Å; S463-R562 VanDerWaalsContact CA-NH1 3.29Å; S463-Q673 PolarHBondContact O-NE2 3.48Å
464	I	79.4	Confident	66.5	Low	10 Å²	10	54.1 Å²	54.1	5%	0.051	28%	0.284	C	S	.	.			trans	-95.1	150	-173.4	-64.4	132.9	0	0	0	112.9	P461 A520 F521 R562	P461-I464 HydrophobicContact CB-CD1 4.37Å; I464-A520 HydrophobicContact CD1-CB 3.74Å; I464-A520 WeakPolarHBondContact CD1-O 3.27Å; I464-A520 HydrophobicContact CG1-CB 4.09Å; I464-F521 HydrophobicContact CG2-CE1 3.91Å; I464-F521 HydrophobicContact CG2-CZ 4.4Å; I464-R562 WeakPolarHBondContact O-CD 3.32Å; I464-R562 PolarHBondContact O-NH1 2.93Å
465	L	83.7	Confident	67.9	Low	0 Å²	0	50 Å²	50	0%	0	26%	0.262	C	S	.	.			trans	-108.3	156.3	171.2	-63.2	-178.2	0	0	0	111.5	Q467 E468 Y469 R562 I566 Q673 L675 F680	L465-Q467 PolarHBondContact O-N 3.34Å; L465-E468 PolarHBondContact O-N 3.44Å; L465-Y469 PolarHBondContact O-N 3.29Å; L465-Y469 VanDerWaalsContact O-N 3.08Å; L465-R562 HydrophobicContact CD2-CG 4.39Å; L465-I566 HydrophobicContact CD2-CD1 3.41Å; L465-I566 VanDerWaalsContact CD2-CD1 3.41Å; L465-Q673 HydrophobicContact CD1-CB 3.89Å; L465-Q673 HydrophobicContact CD1-CG 3.77Å; L465-Q673 HydrophobicContact CG-CG 4.32Å; L465-L675 HydrophobicContact CD1-CD1 3.68Å; L465-F680 HydrophobicContact CD1-CE1 4.49Å; L465-F680 HydrophobicContact CD1-CZ 4.24Å
466	Y	84.6	Confident	68.8	Low	0 Å²	0	48.9 Å²	48.9	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-58	-32.2	178.4	-173.9	-96.4	0	0	0	114	Y469 S470 S556 S559 Y560 S563 L683 Q686 R687 R690	Y466-Y469 WeakPolarHBondContact O-CB 3.45Å; Y466-Y469 PolarHBondContact O-N 2.91Å; Y466-S470 WeakPolarHBondContact O-CB 3.38Å; Y466-S470 PolarHBondContact O-N 3.02Å; Y466-S556 WeakPolarHBondContact CD2-O 3.21Å; Y466-S559 PolarHBondContact N-O 2.72Å; Y466-Y560 HydrophobicContact CD1-CD2 4.35Å; Y466-Y560 HydrophobicContact CD2-CD2 4.17Å; Y466-Y560 HydrophobicContact CD2-CG 4.34Å; Y466-Y560 HydrophobicContact CE1-CD2 4.48Å; Y466-Y560 HydrophobicContact CE2-CD2 4.32Å; Y466-Y560 HydrophobicContact CG-CD2 4.16Å; Y466-S563 PolarHBondContact N-OG 3.28Å; Y466-L683 HydrophobicContact CD1-CD2 3.73Å; Y466-L683 HydrophobicContact CE1-CD2 4.39Å; Y466-Q686 HydrophobicContact CE1-CB 4.38Å; Y466-R687 WeakPolarHBondContact OH-CD 3.35Å; Y466-R690 WeakPolarHBondContact OH-CB 3.37Å; Y466-R690 WeakPolarHBondContact OH-CD 3.44Å
467	Q	85.1	Confident	68.9	Low	16 Å²	16	45.2 Å²	45.2	8%	0.075	24%	0.237	C	C	.	.	H	α-helix	trans	-61	-52.1	178.6	-66.5	91.3	-45	0	0	111	L465 S470 D471 S563 L675 S679 F680 L683	L465-Q467 PolarHBondContact O-N 3.34Å; Q467-S470 PolarHBondContact O-N 3.48Å; Q467-D471 PolarHBondContact O-N 3.2Å; Q467-S563 PolarHBondContact OE1-OG 3.42Å; Q467-L675 HydrophobicContact CB-CD1 3.71Å; Q467-L675 HydrophobicContact CG-CD1 3.79Å; Q467-S679 PolarHBondContact NE2-OG 3.24Å; Q467-F680 VanDerWaalsContact NE2-CD1 3.34Å; Q467-F680 VanDerWaalsContact NE2-CE1 3.32Å; Q467-L683 HydrophobicContact CG-CD2 4.06Å
468	E	76.8	Confident	68.9	Low	85 Å²	85	46.1 Å²	46.1	40%	0.397	24%	0.24	S	C	.	.	H	α-helix	trans	-61.6	-45	175.2	-179.9	-177.8	-147.5	0	0	111.6	L465 S470 D471 V472	L465-E468 PolarHBondContact O-N 3.44Å; E468-S470 VanDerWaalsContact C-N 3.32Å; E468-S470 PolarHBondContact O-N 2.88Å; E468-D471 PolarHBondContact O-N 3.33Å; E468-V472 WeakPolarHBondContact O-CG2 3.39Å; E468-V472 PolarHBondContact O-N 3.45Å
469	Y	73.3	Confident	68.8	Low	14 Å²	14	45.7 Å²	45.7	6%	0.055	24%	0.243	C	C	.	.	H	α-helix	trans	-53	-50.5	174.3	177.1	-75.9	0	0	0	111.6	L465 Y466 A473 F521 E552 S556	L465-Y469 PolarHBondContact O-N 3.29Å; L465-Y469 VanDerWaalsContact O-N 3.08Å; Y466-Y469 WeakPolarHBondContact O-CB 3.45Å; Y466-Y469 PolarHBondContact O-N 2.91Å; Y469-A473 HydrophobicContact CE1-CB 4.26Å; Y469-A473 WeakPolarHBondContact O-CB 3.44Å; Y469-A473 PolarHBondContact O-N 2.78Å; Y469-A473 VanDerWaalsContact O-N 3.14Å; Y469-F521 AromaticContact CD2-CD1 3.69Å; Y469-F521 HydrophobicContact CD2-CD1 3.69Å; Y469-F521 AromaticContact CD2-CE1 3.5Å; Y469-F521 HydrophobicContact CD2-CE1 3.5Å; Y469-F521 VanDerWaalsContact CD2-CE1 3.5Å; Y469-F521 HydrophobicContact CE2-CD1 4.02Å; Y469-F521 HydrophobicContact CE2-CE1 4.23Å; Y469-F521 HydrophobicContact CG-CE1 4.11Å; Y469-E552 WeakPolarHBondContact OH-CG 3.39Å; Y469-E552 PolarHBondContact OH-OE1 2.84Å; Y469-S556 VanDerWaalsContact CZ-CB 3.48Å
470	S	71.9	Confident	68.6	Low	7 Å²	7	50.6 Å²	50.6	5%	0.049	26%	0.261	C	S	.	.	H	α-helix	trans	-65.7	-48.1	-175.2	-168.7	0	0	0	0	110.5	Y466 Q467 E468 V472 A473 I474	Y466-S470 WeakPolarHBondContact O-CB 3.38Å; Y466-S470 PolarHBondContact O-N 3.02Å; Q467-S470 PolarHBondContact O-N 3.48Å; E468-S470 VanDerWaalsContact C-N 3.32Å; E468-S470 PolarHBondContact O-N 2.88Å; S470-V472 PolarHBondContact O-N 2.91Å; S470-A473 PolarHBondContact O-N 2.83Å; S470-I474 WeakPolarHBondContact O-CB 3.19Å; S470-I474 VanDerWaalsContact O-CD1 3.31Å; S470-I474 WeakPolarHBondContact O-CD1 3.49Å; S470-I474 WeakPolarHBondContact O-CG1 3.4Å; S470-I474 PolarHBondContact O-N 3.47Å; S470-I474 WeakPolarHBondContact OG-CD1 3.19Å
471	D	70.9	Confident	67.8	Low	76 Å²	76	55 Å²	55	41%	0.406	28%	0.281	S	S	.	.	H	α-helix	trans	-61.1	-43.5	-179.8	-78.9	-15.2	0	0	0	112.1	Q467 E468 A473 I474 N475	Q467-D471 PolarHBondContact O-N 3.2Å; E468-D471 PolarHBondContact O-N 3.33Å; D471-A473 VanDerWaalsContact C-N 3.35Å; D471-A473 PolarHBondContact O-N 2.78Å; D471-I474 PolarHBondContact O-N 3.26Å; D471-N475 WeakPolarHBondContact O-CB 3.45Å; D471-N475 PolarHBondContact O-N 3.23Å; D471-N475 PolarHBondContact O-ND2 3.11Å
472	V	73.5	Confident	67.5	Low	56 Å²	56	59 Å²	59	34%	0.339	29%	0.294	S	S	.	.	H	α-helix	trans	-61.6	-44.2	176.3	170.7	0	0	0	0	111.2	E468 S470 N475 R476 F521	E468-V472 WeakPolarHBondContact O-CG2 3.39Å; E468-V472 PolarHBondContact O-N 3.45Å; S470-V472 PolarHBondContact O-N 2.91Å; V472-N475 PolarHBondContact O-N 2.99Å; V472-R476 PolarHBondContact O-N 3.27Å; V472-F521 HydrophobicContact CB-CE2 3.96Å; V472-F521 HydrophobicContact CB-CZ 4.14Å; V472-F521 HydrophobicContact CG1-CD2 4.32Å; V472-F521 HydrophobicContact CG1-CE2 3.74Å; V472-F521 HydrophobicContact CG1-CZ 4.37Å; V472-F521 HydrophobicContact CG2-CE2 3.95Å; V472-F521 HydrophobicContact CG2-CZ 4.14Å
473	A	67.6	Low	66.9	Low	11 Å²	11	58 Å²	58	9%	0.091	30%	0.296	C	S	.	.	H	α-helix	trans	-76.6	-26.5	-178.2	0	0	0	0	0	113.4	Y469 S470 D471 E477	Y469-A473 HydrophobicContact CE1-CB 4.26Å; Y469-A473 WeakPolarHBondContact O-CB 3.44Å; Y469-A473 PolarHBondContact O-N 2.78Å; Y469-A473 VanDerWaalsContact O-N 3.14Å; S470-A473 PolarHBondContact O-N 2.83Å; D471-A473 VanDerWaalsContact C-N 3.35Å; D471-A473 PolarHBondContact O-N 2.78Å; A473-E477 PolarHBondContact O-N 2.82Å
474	I	65.8	Low	65.7	Low	25 Å²	25	63.2 Å²	63.2	13%	0.128	31%	0.311	C	S	.	.	H	α-helix	trans	-66.8	-47.3	168	-72.1	157.1	0	0	0	110.1	Q358 S470 D471 R476 E477 I478	Q358-I474 HydrophobicContact CB-CG2 4.25Å; Q358-I474 HydrophobicContact CG-CD1 4.16Å; Q358-I474 HydrophobicContact CG-CG2 4.36Å; Q358-I474 VanDerWaalsContact NE2-CD1 3.34Å; S470-I474 WeakPolarHBondContact O-CB 3.19Å; S470-I474 VanDerWaalsContact O-CD1 3.31Å; S470-I474 WeakPolarHBondContact O-CD1 3.49Å; S470-I474 WeakPolarHBondContact O-CG1 3.4Å; S470-I474 PolarHBondContact O-N 3.47Å; S470-I474 WeakPolarHBondContact OG-CD1 3.19Å; D471-I474 PolarHBondContact O-N 3.26Å; I474-R476 VanDerWaalsContact C-N 3.29Å; I474-R476 PolarHBondContact O-N 3.12Å; I474-E477 PolarHBondContact O-N 2.86Å; I474-I478 HydrophobicContact CG2-CD1 3.76Å; I474-I478 HydrophobicContact CG2-CG1 4.4Å; I474-I478 WeakPolarHBondContact O-CG1 3.45Å; I474-I478 PolarHBondContact O-N 2.86Å
475	N	68.6	Low	63.5	Low	66 Å²	66	68.6 Å²	68.6	35%	0.353	34%	0.34	S	S	.	.	H	α-helix	trans	-61	-37.9	177	-79.2	-67.1	0	0	0	112	D471 V472 I478 Q479	D471-N475 WeakPolarHBondContact O-CB 3.45Å; D471-N475 PolarHBondContact O-N 3.23Å; D471-N475 PolarHBondContact O-ND2 3.11Å; V472-N475 PolarHBondContact O-N 2.99Å; N475-I478 PolarHBondContact O-N 3.4Å; N475-Q479 VanDerWaalsContact O-CG 3.32Å; N475-Q479 WeakPolarHBondContact O-CG 3.37Å; N475-Q479 PolarHBondContact O-N 3.09Å
476	R	65.2	Low	61.5	Low	114 Å²	114	74.3 Å²	74.3	43%	0.43	38%	0.377	S	S	.	.	H	α-helix	trans	-60	-46.8	172.8	-168.7	-168.7	-65.9	-171.4	-0.2	112	V472 I474 Q479 R480	V472-R476 PolarHBondContact O-N 3.27Å; I474-R476 VanDerWaalsContact C-N 3.29Å; I474-R476 PolarHBondContact O-N 3.12Å; R476-Q479 PolarHBondContact O-N 3.3Å; R476-R480 PolarHBondContact O-N 2.89Å
477	E	58.6	Low	59.2	Low	57 Å²	57	77.6 Å²	77.6	27%	0.266	41%	0.411	S	S	.	.	H	α-helix	trans	-67.2	-36.9	178.4	176.7	57.5	-165.1	0	0	112.2	A473 I474 R480 Q481	A473-E477 PolarHBondContact O-N 2.82Å; I474-E477 PolarHBondContact O-N 2.86Å; E477-R480 PolarHBondContact O-N 3.2Å; E477-R480 IonicContact OE1-CZ 3.49Å; E477-R480 IonicContact OE1-NE 2.76Å; E477-R480 IonicContact OE1-NH2 3.96Å; E477-R480 PolarHBondContact OE1-NH2 2.88Å; E477-R480 IonicContact OE2-CZ 3.48Å; E477-R480 IonicContact OE2-NE 2.76Å; E477-R480 PolarHBondContact OE2-NE 3.08Å; E477-R480 IonicContact OE2-NH2 3.46Å; E477-R480 PolarHBondContact OE2-NH2 2.84Å; E477-Q481 WeakPolarHBondContact O-CG 3.39Å; E477-Q481 PolarHBondContact O-N 3.42Å; E477-Q481 PolarHBondContact OE1-NE2 3.1Å
478	I	56.4	Low	56.8	Low	43 Å²	43	83.3 Å²	83.3	22%	0.221	45%	0.447	C	S	.	.	H	α-helix	trans	-61.7	-44.3	173.1	-69.9	169.1	0	0	0	111	I474 N475 Q481 Q482	I474-I478 HydrophobicContact CG2-CD1 3.76Å; I474-I478 HydrophobicContact CG2-CG1 4.4Å; I474-I478 WeakPolarHBondContact O-CG1 3.45Å; I474-I478 PolarHBondContact O-N 2.86Å; N475-I478 PolarHBondContact O-N 3.4Å; I478-Q481 PolarHBondContact O-N 3.09Å; I478-Q482 WeakPolarHBondContact O-CG 3.45Å; I478-Q482 PolarHBondContact O-N 3.19Å; I478-Q482 VanDerWaalsContact O-N 3.08Å
479	Q	61	Low	54.9	Low	117 Å²	117	88.4 Å²	88.4	55%	0.547	47%	0.471	S	S	.	.	H	α-helix	trans	-63.7	-42	177.1	-72.2	170.5	8.4	0	0	111.9	N475 R476 Q481 Q482	N475-Q479 VanDerWaalsContact O-CG 3.32Å; N475-Q479 WeakPolarHBondContact O-CG 3.37Å; N475-Q479 PolarHBondContact O-N 3.09Å; R476-Q479 PolarHBondContact O-N 3.3Å; Q479-Q481 VanDerWaalsContact C-N 3.35Å; Q479-Q481 PolarHBondContact O-N 3.25Å; Q479-Q482 PolarHBondContact O-N 3.5Å; Q479-Q482 VanDerWaalsContact O-N 3.11Å
480	R	57.8	Low	53.3	Low	120 Å²	120	97.1 Å²	97.1	45%	0.453	51%	0.512	S	S	.	.	H	α-helix	trans	-61.2	-40.9	174.9	-163.5	-165.1	66	69.3	4.8	112.1	R476 E477 Q482 G483	R476-R480 PolarHBondContact O-N 2.89Å; E477-R480 PolarHBondContact O-N 3.2Å; E477-R480 IonicContact OE1-CZ 3.49Å; E477-R480 IonicContact OE1-NE 2.76Å; E477-R480 IonicContact OE1-NH2 3.96Å; E477-R480 PolarHBondContact OE1-NH2 2.88Å; E477-R480 IonicContact OE2-CZ 3.48Å; E477-R480 IonicContact OE2-NE 2.76Å; E477-R480 PolarHBondContact OE2-NE 3.08Å; E477-R480 IonicContact OE2-NH2 3.46Å; E477-R480 PolarHBondContact OE2-NH2 2.84Å; R480-Q482 VanDerWaalsContact C-N 3.26Å; R480-Q482 PolarHBondContact O-N 3.04Å; R480-G483 PolarHBondContact O-N 2.68Å
481	Q	45.5	Very low	51.6	Low	132 Å²	132	106.8 Å²	106.8	62%	0.617	56%	0.556	S	S	*	*	H	α-helix	trans	-70.1	-20.2	175.3	-71.2	179	16.6	0	0	113.6	E477 I478 Q479 G483	E477-Q481 WeakPolarHBondContact O-CG 3.39Å; E477-Q481 PolarHBondContact O-N 3.42Å; E477-Q481 PolarHBondContact OE1-NE2 3.1Å; I478-Q481 PolarHBondContact O-N 3.09Å; Q479-Q481 VanDerWaalsContact C-N 3.35Å; Q479-Q481 PolarHBondContact O-N 3.25Å; Q481-G483 VanDerWaalsContact C-N 3.32Å
482	Q	51.2	Low	49.8	Very low	142 Å²	142	106.2 Å²	106.2	66%	0.664	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.9	6.3	175.7	-71.7	175.4	13.5	0	0	113.7	I478 Q479 R480 K484	I478-Q482 WeakPolarHBondContact O-CG 3.45Å; I478-Q482 PolarHBondContact O-N 3.19Å; I478-Q482 VanDerWaalsContact O-N 3.08Å; Q479-Q482 PolarHBondContact O-N 3.5Å; Q479-Q482 VanDerWaalsContact O-N 3.11Å; R480-Q482 VanDerWaalsContact C-N 3.26Å; R480-Q482 PolarHBondContact O-N 3.04Å; Q482-K484 VanDerWaalsContact C-N 3.29Å; Q482-K484 PolarHBondContact O-N 3.2Å
483	G	43.7	Very low	48	Very low	60 Å²	60	111.1 Å²	111.1	62%	0.619	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	72	15	172.5	0	0	0	0	0	115.4	R480 Q481 D485	R480-G483 PolarHBondContact O-N 2.68Å; Q481-G483 VanDerWaalsContact C-N 3.32Å; G483-D485 VanDerWaalsContact C-N 3.25Å; G483-D485 PolarHBondContact O-N 2.63Å; G483-D485 VanDerWaalsContact O-N 3.12Å
484	K	39.4	Very low	46.5	Very low	177 Å²	177	121.5 Å²	121.5	77%	0.77	63%	0.629	S	S	*	*			trans	-85.4	62.5	173.9	-91.9	-170.4	169.3	-176.4	0	111.9	Q482	Q482-K484 VanDerWaalsContact C-N 3.29Å; Q482-K484 PolarHBondContact O-N 3.2Å
485	D	32.8	Very low	44.9	Very low	122 Å²	122	127.5 Å²	127.5	65%	0.652	66%	0.662	S	S	*	*			trans	-80.9	122.3	161.3	-80.1	-46.8	0	0	0	109.3	G483 G487	G483-D485 VanDerWaalsContact C-N 3.25Å; G483-D485 PolarHBondContact O-N 2.63Å; G483-D485 VanDerWaalsContact O-N 3.12Å; D485-G487 PolarHBondContact O-N 2.95Å
486	P	40.9	Very low	43.6	Very low	120 Å²	120	133.7 Å²	133.7	78%	0.779	69%	0.688	S	S	*	*	S	Bend	trans	-84.6	90.1	179.9	32.8	-33.1	0	0	0	111.1
487	G	37.3	Very low	42.2	Very low	70 Å²	70	131.7 Å²	131.7	72%	0.722	70%	0.704	S	S	*	*			trans	151.1	74.6	163.9	0	0	0	0	0	117.2	D485	D485-G487 PolarHBondContact O-N 2.95Å
488	T	34.4	Very low	41	Very low	136 Å²	136	134.8 Å²	134.8	83%	0.834	73%	0.731	S	S	*	*			trans	-145.3	25.5	164	-24.7	0	0	0	0	113.8
489	E	36.5	Very low	40.2	Very low	192 Å²	192	140.6 Å²	140.6	90%	0.897	76%	0.763	S	S	*	*			trans	-134.9	79.9	178.4	-71.9	-176	-148.3	0	0	111.2
490	E	40.3	Very low	38.8	Very low	197 Å²	197	138.2 Å²	138.2	92%	0.921	77%	0.77	S	S	*	*			trans	178.5	96.6	136.3	-102.4	-173.2	-178.4	0	0	111.4
491	E	36.3	Very low	37.6	Very low	209 Å²	209	138.6 Å²	138.6	98%	0.977	79%	0.786	S	S	*	*			trans	-130.5	106.7	145.4	-84.4	-159.8	143.8	0	0	106.6
492	G	32.3	Very low	36.9	Very low	65 Å²	65	138.5 Å²	138.5	67%	0.67	80%	0.796	S	S	*	*			trans	-166.4	52.5	-157.7	0	0	0	0	0	117.3
493	L	36.9	Very low	35.7	Very low	159 Å²	159	136.3 Å²	136.3	83%	0.832	80%	0.797	S	S	*	*			trans	78.5	150.9	167.2	-53.6	151.3	0	0	0	117.3
494	R	34.8	Very low	35.1	Very low	228 Å²	228	140 Å²	140	86%	0.86	81%	0.81	S	S	*	*			trans	80.8	141.4	170.1	-54.1	167.1	-166.3	-81	-1.4	115.1
495	D	32.7	Very low	34.9	Very low	152 Å²	152	135.9 Å²	135.9	81%	0.813	80%	0.804	S	S	*	*			cis	-157.9	168.4	-20.6	-155.7	-7.7	0	0	0	107.9
496	E	41.2	Very low	35	Very low	195 Å²	195	137.2 Å²	137.2	91%	0.911	81%	0.811	S	S	*	*			trans	-75.6	135.4	174.1	-77.8	-157.2	110.9	0	0	112.7
497	G	35.9	Very low	34.4	Very low	73 Å²	73	139.7 Å²	139.7	75%	0.753	82%	0.816	S	S	*	*			trans	157.2	132.2	157.3	0	0	0	0	0	118.3
498	S	32.7	Very low	33.9	Very low	121 Å²	121	139.8 Å²	139.8	85%	0.846	81%	0.806	S	S	*	*			trans	71.4	94.1	154.3	-163	0	0	0	0	120.1
499	D	40.3	Very low	33.9	Very low	165 Å²	165	138.8 Å²	138.8	88%	0.882	80%	0.802	S	S	*	*				35.4	117.7	129.4	-162.1	20.1	0	0	0	120.2
500	G	31.8	Very low	33.7	Very low	67 Å²	67	131.7 Å²	131.7	69%	0.691	77%	0.773	S	S	*	*			trans	177.3	130.3	172.4	0	0	0	0	0	113.6
501	T	32	Very low	33.3	Very low	129 Å²	129	126.6 Å²	126.6	79%	0.791	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-60.6	135.4	-177.1	45.3	0	0	0	0	114	S503	T501-S503 PolarHBondContact O-N 2.98Å
502	P	30.5	Very low	33.2	Very low	129 Å²	129	122 Å²	122	84%	0.838	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-72.8	117.2	179.5	29.2	-34.2	0	0	0	112.2
503	S	26.2	Very low	33.5	Very low	97 Å²	97	122.8 Å²	122.8	68%	0.678	74%	0.735	S	S	*	*	P	Polyproline II helix	trans	-100.4	124.1	167.7	-67.1	0	0	0	0	110.2	T501 S505	T501-S503 PolarHBondContact O-N 2.98Å; S503-S505 PolarHBondContact O-N 3.17Å; S503-S505 VanDerWaalsContact O-N 3.08Å
504	P	32.7	Very low	33.4	Very low	138 Å²	138	125.4 Å²	125.4	90%	0.896	73%	0.734	S	S	*	*			trans	-78.4	96.9	-173.9	30.6	-34.4	0	0	0	111.7
505	S	33.5	Very low	33.1	Very low	90 Å²	90	119.6 Å²	119.6	63%	0.629	73%	0.728	S	S	*	*			trans	-151.6	147.6	169.2	62.9	0	0	0	0	112.9	S503	S503-S505 PolarHBondContact O-N 3.17Å; S503-S505 VanDerWaalsContact O-N 3.08Å
506	N	34.7	Very low	33.3	Very low	150 Å²	150	117.9 Å²	117.9	80%	0.802	73%	0.729	S	S	*	*			trans	78.3	59.1	169.3	-47.5	-54.7	0	0	0	118.8
507	L	29.1	Very low	32.9	Very low	172 Å²	172	120.4 Å²	120.4	90%	0.901	73%	0.73	S	S	*	*			trans	-133.9	91.3	151.7	-75	179.5	0	0	0	111.4
508	S	27.7	Very low	33	Very low	72 Å²	72	120.4 Å²	120.4	50%	0.503	73%	0.729	S	S	.	*			trans	-172.6	126.9	162.1	-83.9	0	0	0	0	111.8	S510	S508-S510 PolarHBondContact O-N 3.11Å
509	P	32.9	Very low	33.5	Very low	114 Å²	114	117.1 Å²	117.1	74%	0.74	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.6	58.3	177.5	33.9	-36.2	0	0	0	112.4
510	S	33.4	Very low	33.9	Very low	44 Å²	44	110.9 Å²	110.9	31%	0.308	68%	0.678	S	S	.	*	T	Hydrogen-bonded Turn	trans	-128.8	10	175.3	-49.5	0	0	0	0	112.8	S508 S512 F513	S508-S510 PolarHBondContact O-N 3.11Å; S510-S512 VanDerWaalsContact C-N 3.26Å; S510-S512 PolarHBondContact O-N 2.98Å; S510-F513 PolarHBondContact O-N 3.17Å
511	S	32.6	Very low	35.2	Very low	90 Å²	90	109.2 Å²	109.2	63%	0.629	65%	0.652	S	S	*	*	G	3₁₀ helix	trans	-61.4	-26.7	-173.9	51.7	0	0	0	0	114.3	F513 R514	S511-F513 PolarHBondContact O-N 2.87Å; S511-F513 VanDerWaalsContact O-N 3.11Å; S511-R514 PolarHBondContact O-N 3.17Å
512	S	33.2	Very low	36.9	Very low	111 Å²	111	104.7 Å²	104.7	78%	0.776	63%	0.628	S	S	*	*	G	3₁₀ helix	trans	-62.4	-19.4	-179.1	-165.5	0	0	0	0	114.2	S510	S510-S512 VanDerWaalsContact C-N 3.26Å; S510-S512 PolarHBondContact O-N 2.98Å
513	F	39.7	Very low	39.4	Very low	82 Å²	82	99.8 Å²	99.8	36%	0.36	59%	0.594	S	S	.	*	G	3₁₀ helix	trans	-89.1	-1.4	174.9	-67.7	-78.4	0	0	0	114.3	S510 S511 S515	S510-F513 PolarHBondContact O-N 3.17Å; S511-F513 PolarHBondContact O-N 2.87Å; S511-F513 VanDerWaalsContact O-N 3.11Å; F513-S515 PolarHBondContact O-N 2.89Å
514	R	33.5	Very low	42.3	Very low	215 Å²	215	95.1 Å²	95.1	81%	0.811	56%	0.562	S	S	*	*			trans	-95.8	37.1	-176.2	-63.7	-171	174.7	-121.4	-3	114	S511	S511-R514 PolarHBondContact O-N 3.17Å
515	S	29.5	Very low	44.7	Very low	105 Å²	105	90.9 Å²	90.9	73%	0.734	53%	0.53	S	S	*	.	S	Bend	trans	-89.7	137.7	166.7	-159.3	0	0	0	0	110.3	F513	F513-S515 PolarHBondContact O-N 2.89Å
516	S	36.2	Very low	47	Very low	117 Å²	117	89.8 Å²	89.8	82%	0.818	52%	0.517	S	S	*	.	S	Bend	trans	-66.2	136.3	-163.5	-63.2	0	0	0	0	114.5
517	R	32.6	Very low	49.3	Very low	248 Å²	248	83.1 Å²	83.1	94%	0.936	48%	0.481	S	S	*	.	S	Bend	trans	82.7	82	-174.6	-60.3	179.3	166.1	177	-4.7	115.4
518	G	38.7	Very low	51.7	Low	72 Å²	72	79 Å²	79	74%	0.742	47%	0.465	S	S	*	.			trans	73.7	99.5	154.8	0	0	0	0	0	115.5	A520	G518-A520 PolarHBondContact O-N 3.34Å
519	S	42.8	Very low	54.3	Low	53 Å²	53	78.4 Å²	78.4	37%	0.371	46%	0.456	S	S	.	.			trans	-61.6	119.8	155.1	-176.7	0	0	0	0	107.7	F521	S519-F521 PolarHBondContact O-N 3.19Å; S519-F521 PolarHBondContact OG-O 2.99Å
520	A	48.9	Very low	56.7	Low	34 Å²	34	73 Å²	73	28%	0.281	42%	0.421	S	S	.	.	S	Bend	trans	-58.2	-43	176.4	0	0	0	0	0	110.6	I464 G518	I464-A520 HydrophobicContact CD1-CB 3.74Å; I464-A520 WeakPolarHBondContact CD1-O 3.27Å; I464-A520 HydrophobicContact CG1-CB 4.09Å; G518-A520 PolarHBondContact O-N 3.34Å
521	F	58.6	Low	59	Low	31 Å²	31	78.5 Å²	78.5	14%	0.136	44%	0.435	C	S	.	.	S	Bend	trans	-91.3	122.7	179.6	-47.3	-76.8	0	0	0	109.4	I464 Y469 V472 S519	I464-F521 HydrophobicContact CG2-CE1 3.91Å; I464-F521 HydrophobicContact CG2-CZ 4.4Å; Y469-F521 AromaticContact CD2-CD1 3.69Å; Y469-F521 HydrophobicContact CD2-CD1 3.69Å; Y469-F521 AromaticContact CD2-CE1 3.5Å; Y469-F521 HydrophobicContact CD2-CE1 3.5Å; Y469-F521 VanDerWaalsContact CD2-CE1 3.5Å; Y469-F521 HydrophobicContact CE2-CD1 4.02Å; Y469-F521 HydrophobicContact CE2-CE1 4.23Å; Y469-F521 HydrophobicContact CG-CE1 4.11Å; V472-F521 HydrophobicContact CB-CE2 3.96Å; V472-F521 HydrophobicContact CB-CZ 4.14Å; V472-F521 HydrophobicContact CG1-CD2 4.32Å; V472-F521 HydrophobicContact CG1-CE2 3.74Å; V472-F521 HydrophobicContact CG1-CZ 4.37Å; V472-F521 HydrophobicContact CG2-CE2 3.95Å; V472-F521 HydrophobicContact CG2-CZ 4.14Å; S519-F521 PolarHBondContact O-N 3.19Å; S519-F521 PolarHBondContact OG-O 2.99Å
522	A	68.1	Low	61.2	Low	35 Å²	35	81.1 Å²	81.1	29%	0.289	44%	0.439	S	S	.	.	P	Polyproline II helix	trans	-68	138.9	164.2	0	0	0	0	0	109.1	F551	A522-F551 HydrophobicContact CB-CE1 4.44Å
523	L	82	Confident	63.6	Low	25 Å²	25	77.7 Å²	77.7	13%	0.131	42%	0.415	C	S	.	.	P	Polyproline II helix	trans	-86.7	156.5	166	-58.2	177.7	0	0	0	109.3	Q525 D526 E548	L523-Q525 VanDerWaalsContact C-N 3.26Å; L523-Q525 HydrophobicContact CB-CG 3.91Å; L523-Q525 HydrophobicContact CD1-CG 4.3Å; L523-Q525 PolarHBondContact O-N 2.95Å; L523-D526 HydrophobicContact CB-CB 4.3Å; L523-D526 WeakPolarHBondContact CB-OD2 3.46Å; L523-D526 WeakPolarHBondContact O-CB 3.49Å; L523-D526 PolarHBondContact O-N 3.31Å; L523-E548 WeakPolarHBondContact CA-OE2 3.2Å
524	W	87.6	Confident	65.4	Low	0 Å²	0	76.5 Å²	76.5	0%	0	43%	0.426	C	S	.	.	G	3₁₀ helix	trans	-58.8	-41.9	173.3	166.6	84.4	0	0	0	111	D526 I527 V530 L536 F539 R544 Q547 E548 F551 I615 L616 F618	W524-D526 PolarHBondContact O-N 3.37Å; W524-I527 HydrophobicContact CG-CD1 4.48Å; W524-I527 WeakPolarHBondContact O-CB 3.46Å; W524-I527 VanDerWaalsContact O-CG1 3.29Å; W524-I527 WeakPolarHBondContact O-CG1 3.26Å; W524-I527 PolarHBondContact O-N 3.26Å; W524-V530 HydrophobicContact CD2-CG1 4.35Å; W524-V530 HydrophobicContact CE3-CG1 4.47Å; W524-V530 HydrophobicContact CH2-CG1 4.01Å; W524-V530 HydrophobicContact CZ2-CG1 3.86Å; W524-V530 HydrophobicContact CZ2-CG2 4.38Å; W524-V530 HydrophobicContact CZ3-CG1 4.31Å; W524-L536 HydrophobicContact CE3-CD2 4.45Å; W524-L536 HydrophobicContact CH2-CD2 3.98Å; W524-L536 HydrophobicContact CZ3-CD2 3.66Å; W524-F539 HydrophobicContact CH2-CD2 4.01Å; W524-F539 AromaticContact CH2-CE2 3.96Å; W524-F539 HydrophobicContact CH2-CE2 3.96Å; W524-F539 HydrophobicContact CH2-CG 4.47Å; W524-F539 HydrophobicContact CH2-CZ 4.34Å; W524-F539 HydrophobicContact CZ2-CE2 4.41Å; W524-R544 HydrophobicContact CZ3-CG 4.47Å; W524-Q547 HydrophobicContact CD2-CB 3.59Å; W524-Q547 HydrophobicContact CD2-CG 4.43Å; W524-Q547 HydrophobicContact CE3-CB 3.8Å; W524-Q547 HydrophobicContact CG-CB 4.07Å; W524-Q547 HydrophobicContact CH2-CB 4.18Å; W524-Q547 HydrophobicContact CH2-CG 4.13Å; W524-Q547 HydrophobicContact CZ2-CB 3.99Å; W524-Q547 HydrophobicContact CZ2-CG 3.91Å; W524-Q547 HydrophobicContact CZ3-CB 4.1Å; W524-Q547 HydrophobicContact CZ3-CG 4.49Å; W524-E548 WeakPolarHBondContact CB-OE1 3.31Å; W524-E548 VanDerWaalsContact N-CD 3.26Å; W524-E548 PolarHBondContact N-OE1 3.48Å; W524-E548 PolarHBondContact N-OE2 3.43Å; W524-F551 HydrophobicContact CB-CB 3.81Å; W524-F551 HydrophobicContact CB-CD1 3.8Å; W524-F551 HydrophobicContact CB-CG 3.9Å; W524-F551 HydrophobicContact CG-CB 4.49Å; W524-I615 PolarHBondContact NE1-O 3.39Å; W524-L616 HydrophobicContact CZ2-CD2 4.04Å; W524-F618 AromaticContact CD1-CE1 3.97Å; W524-F618 AromaticContact NE1-CE1 3.91Å
525	Q	83.7	Confident	67.4	Low	49 Å²	49	69.7 Å²	69.7	23%	0.229	40%	0.403	C	S	.	.	G	3₁₀ helix	trans	-65.9	-14.4	175.2	70.1	-177.2	-1.9	0	0	114.3	L523 R531 L536 E548	L523-Q525 VanDerWaalsContact C-N 3.26Å; L523-Q525 HydrophobicContact CB-CG 3.91Å; L523-Q525 HydrophobicContact CD1-CG 4.3Å; L523-Q525 PolarHBondContact O-N 2.95Å; Q525-R531 WeakPolarHBondContact O-CD 3.45Å; Q525-R531 WeakPolarHBondContact O-CG 3.42Å; Q525-L536 HydrophobicContact CB-CD2 3.96Å; Q525-E548 WeakPolarHBondContact CG-OE1 3.45Å; Q525-E548 PolarHBondContact N-OE1 2.91Å
526	D	82.4	Confident	69.8	Low	67 Å²	67	66.2 Å²	66.2	36%	0.358	38%	0.376	S	S	.	.	G	3₁₀ helix	trans	-88.7	-13.7	177.2	-75.6	-44	0	0	0	113	L523 W524	L523-D526 HydrophobicContact CB-CB 4.3Å; L523-D526 WeakPolarHBondContact CB-OD2 3.46Å; L523-D526 WeakPolarHBondContact O-CB 3.49Å; L523-D526 PolarHBondContact O-N 3.31Å; W524-D526 PolarHBondContact O-N 3.37Å
527	I	82.6	Confident	71.7	Confident	10 Å²	10	67.6 Å²	67.6	5%	0.051	37%	0.374	C	S	.	.	S	Bend	trans	-57.4	128.5	178.3	-61.6	171	0	0	0	109.4	F459 W524 D529 V530 R531 F551 I615	F459-I527 HydrophobicContact CD1-CD1 4.46Å; W524-I527 HydrophobicContact CG-CD1 4.48Å; W524-I527 WeakPolarHBondContact O-CB 3.46Å; W524-I527 VanDerWaalsContact O-CG1 3.29Å; W524-I527 WeakPolarHBondContact O-CG1 3.26Å; W524-I527 PolarHBondContact O-N 3.26Å; I527-D529 VanDerWaalsContact C-N 3.3Å; I527-D529 HydrophobicContact CG2-CB 4.23Å; I527-D529 PolarHBondContact O-N 3.01Å; I527-V530 HydrophobicContact CB-CB 4.13Å; I527-V530 HydrophobicContact CB-CG2 3.81Å; I527-V530 HydrophobicContact CD1-CG2 4.22Å; I527-V530 HydrophobicContact CG2-CG2 4.1Å; I527-V530 PolarHBondContact O-N 3.47Å; I527-V530 VanDerWaalsContact O-N 3.11Å; I527-R531 WeakPolarHBondContact O-CG 3.4Å; I527-R531 PolarHBondContact O-N 3.48Å; I527-F551 HydrophobicContact CD1-CD2 4.2Å; I527-F551 HydrophobicContact CD1-CE1 4.28Å; I527-F551 HydrophobicContact CD1-CE2 3.73Å; I527-F551 HydrophobicContact CD1-CZ 3.76Å; I527-F551 HydrophobicContact CG1-CE1 4.5Å; I527-F551 HydrophobicContact CG1-CZ 4.11Å; I527-I615 HydrophobicContact CD1-CG2 4.17Å; I527-I615 HydrophobicContact CG2-CG2 4.34Å
528	P	79.7	Confident	74.1	Confident	85 Å²	85	60.7 Å²	60.7	55%	0.552	36%	0.36	S	S	*	.	H	α-helix	trans	-53.4	-45.2	-178.9	-29	35.8	0	0	0	113.3	V530 R531 M532	P528-V530 VanDerWaalsContact C-N 3.34Å; P528-V530 PolarHBondContact O-N 3Å; P528-R531 PolarHBondContact O-N 3.3Å; P528-M532 HydrophobicContact CB-CE 4.2Å; P528-M532 WeakPolarHBondContact O-CB 3.41Å; P528-M532 VanDerWaalsContact O-CG 3.27Å; P528-M532 WeakPolarHBondContact O-CG 3.47Å; P528-M532 PolarHBondContact O-N 3.2Å
529	D	81	Confident	76.3	Confident	60 Å²	60	57.8 Å²	57.8	32%	0.321	33%	0.327	S	S	.	.	H	α-helix	trans	-62.9	-38.2	-179.1	-55.1	-26.2	0	0	0	112.1	R458 I527 S533 I615	R458-D529 IonicContact CZ-OD2 2.7Å; R458-D529 IonicContact NH2-OD2 2.62Å; R458-D529 PolarHBondContact NH2-OD2 3.42Å; I527-D529 VanDerWaalsContact C-N 3.3Å; I527-D529 HydrophobicContact CG2-CB 4.23Å; I527-D529 PolarHBondContact O-N 3.01Å; D529-S533 PolarHBondContact O-N 3.38Å; D529-S533 VanDerWaalsContact O-N 3.11Å; D529-I615 HydrophobicContact CB-CD1 3.54Å; D529-I615 WeakPolarHBondContact OD2-CD1 3.38Å
530	V	83.1	Confident	78.4	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-66.8	-44.5	174.7	177.8	0	0	0	0	110.4	W524 I527 P528 S533 L536 I615 L616	W524-V530 HydrophobicContact CD2-CG1 4.35Å; W524-V530 HydrophobicContact CE3-CG1 4.47Å; W524-V530 HydrophobicContact CH2-CG1 4.01Å; W524-V530 HydrophobicContact CZ2-CG1 3.86Å; W524-V530 HydrophobicContact CZ2-CG2 4.38Å; W524-V530 HydrophobicContact CZ3-CG1 4.31Å; I527-V530 HydrophobicContact CB-CB 4.13Å; I527-V530 HydrophobicContact CB-CG2 3.81Å; I527-V530 HydrophobicContact CD1-CG2 4.22Å; I527-V530 HydrophobicContact CG2-CG2 4.1Å; I527-V530 PolarHBondContact O-N 3.47Å; I527-V530 VanDerWaalsContact O-N 3.11Å; P528-V530 VanDerWaalsContact C-N 3.34Å; P528-V530 PolarHBondContact O-N 3Å; V530-S533 WeakPolarHBondContact O-CB 3.48Å; V530-S533 PolarHBondContact O-N 2.88Å; V530-S533 PolarHBondContact O-OG 2.84Å; V530-L536 HydrophobicContact CG1-CD1 4.22Å; V530-L536 HydrophobicContact CG1-CD2 3.64Å; V530-L536 HydrophobicContact CG1-CG 3.85Å; V530-I615 HydrophobicContact CG2-CB 4.44Å; V530-I615 HydrophobicContact CG2-CG2 3.47Å; V530-I615 VanDerWaalsContact CG2-CG2 3.47Å; V530-L616 HydrophobicContact CB-CD2 4.43Å; V530-L616 HydrophobicContact CG1-CD2 4.05Å; V530-L616 HydrophobicContact CG2-CD2 4.24Å
531	R	82.2	Confident	80.2	Confident	160 Å²	160	60 Å²	60	60%	0.604	33%	0.333	S	S	*	.	H	α-helix	trans	-67.4	-37.1	179.1	-67.9	179.7	59.8	-175.3	-2.4	113.1	Q525 I527 P528 S533 L536	Q525-R531 WeakPolarHBondContact O-CD 3.45Å; Q525-R531 WeakPolarHBondContact O-CG 3.42Å; I527-R531 WeakPolarHBondContact O-CG 3.4Å; I527-R531 PolarHBondContact O-N 3.48Å; P528-R531 PolarHBondContact O-N 3.3Å; R531-S533 VanDerWaalsContact C-N 3.3Å; R531-L536 HydrophobicContact CG-CD1 4.08Å
532	M	80.2	Confident	81.4	Confident	144 Å²	144	63.5 Å²	63.5	71%	0.709	35%	0.35	S	S	*	.	H	α-helix	trans	-74.5	-18.3	176.2	-69.2	-174.8	-59.6	0	0	112.9	P528 G534	P528-M532 HydrophobicContact CB-CE 4.2Å; P528-M532 WeakPolarHBondContact O-CB 3.41Å; P528-M532 VanDerWaalsContact O-CG 3.27Å; P528-M532 WeakPolarHBondContact O-CG 3.47Å; P528-M532 PolarHBondContact O-N 3.2Å; M532-G534 PolarHBondContact O-N 2.96Å
533	S	81.6	Confident	82.3	Confident	39 Å²	39	65.8 Å²	65.8	27%	0.273	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-19.9	179.8	77.9	0	0	0	0	114.9	D529 V530 R531 Q535	D529-S533 PolarHBondContact O-N 3.38Å; D529-S533 VanDerWaalsContact O-N 3.11Å; V530-S533 WeakPolarHBondContact O-CB 3.48Å; V530-S533 PolarHBondContact O-N 2.88Å; V530-S533 PolarHBondContact O-OG 2.84Å; R531-S533 VanDerWaalsContact C-N 3.3Å; S533-Q535 PolarHBondContact O-N 2.92Å; S533-Q535 PolarHBondContact OG-N 2.91Å
534	G	77.9	Confident	82.6	Confident	58 Å²	58	66.7 Å²	66.7	60%	0.598	36%	0.357	S	S	*	.	S	Bend	trans	67.1	-6.7	-172.5	0	0	0	0	0	115.5	M532	M532-G534 PolarHBondContact O-N 2.96Å
535	Q	76.4	Confident	82.6	Confident	72 Å²	72	71.5 Å²	71.5	34%	0.336	38%	0.378	S	S	.	.	G	3₁₀ helix	trans	-85.6	-4.4	-173.6	-76	175.7	63.7	0	0	114.5	S533 D537 T538 F539 L616	S533-Q535 PolarHBondContact O-N 2.92Å; S533-Q535 PolarHBondContact OG-N 2.91Å; Q535-D537 PolarHBondContact O-N 2.81Å; Q535-T538 WeakPolarHBondContact O-CA 3.42Å; Q535-T538 VanDerWaalsContact O-CB 3.28Å; Q535-T538 WeakPolarHBondContact O-CB 3.48Å; Q535-T538 PolarHBondContact O-N 2.71Å; Q535-T538 PolarHBondContact O-OG1 3.44Å; Q535-F539 HydrophobicContact CB-CE2 4.35Å; Q535-F539 VanDerWaalsContact O-CD2 3.24Å; Q535-F539 WeakPolarHBondContact O-CD2 3.49Å; Q535-L616 HydrophobicContact CB-CD1 4.23Å; Q535-L616 HydrophobicContact CG-CD1 4.49Å
536	L	78.9	Confident	82.9	Confident	32 Å²	32	70.2 Å²	70.2	17%	0.168	37%	0.372	C	S	.	.	G	3₁₀ helix	trans	-53.6	-41.8	-179.6	-86.6	171.8	0	0	0	112.3	W524 Q525 V530 R531 T538 F539 R544	W524-L536 HydrophobicContact CE3-CD2 4.45Å; W524-L536 HydrophobicContact CH2-CD2 3.98Å; W524-L536 HydrophobicContact CZ3-CD2 3.66Å; Q525-L536 HydrophobicContact CB-CD2 3.96Å; V530-L536 HydrophobicContact CG1-CD1 4.22Å; V530-L536 HydrophobicContact CG1-CD2 3.64Å; V530-L536 HydrophobicContact CG1-CG 3.85Å; R531-L536 HydrophobicContact CG-CD1 4.08Å; L536-T538 PolarHBondContact O-N 2.59Å; L536-F539 PolarHBondContact O-N 3.25Å; L536-R544 PolarHBondContact O-NE 3.37Å; L536-R544 PolarHBondContact O-NH2 2.92Å
537	D	76.8	Confident	83.3	Confident	145 Å²	145	67.6 Å²	67.6	78%	0.775	36%	0.358	S	S	*	.	G	3₁₀ helix	trans	-75.5	-6.7	179.2	-62.9	-43.1	0	0	0	114.2	Q535 R544	Q535-D537 PolarHBondContact O-N 2.81Å; D537-R544 IonicContact OD1-NH2 3.96Å; D537-R544 PolarHBondContact OD1-NH2 2.99Å
538	T	83.3	Confident	83.6	Confident	103 Å²	103	69.1 Å²	69.1	63%	0.632	37%	0.365	S	S	*	.	G	3₁₀ helix	trans	-86.7	-19.8	171.3	-37.6	0	0	0	0	112.6	Q535 L536	Q535-T538 WeakPolarHBondContact O-CA 3.42Å; Q535-T538 VanDerWaalsContact O-CB 3.28Å; Q535-T538 WeakPolarHBondContact O-CB 3.48Å; Q535-T538 PolarHBondContact O-N 2.71Å; Q535-T538 PolarHBondContact O-OG1 3.44Å; L536-T538 PolarHBondContact O-N 2.59Å
539	F	84.9	Confident	84.1	Confident	11 Å²	11	65.2 Å²	65.2	5%	0.048	34%	0.34	C	S	.	.	S	Bend	trans	-85.1	134.5	177.2	-71.2	-83.4	0	0	0	111.9	W524 Q535 L536 E543 R544 L616 R617	W524-F539 HydrophobicContact CH2-CD2 4.01Å; W524-F539 AromaticContact CH2-CE2 3.96Å; W524-F539 HydrophobicContact CH2-CE2 3.96Å; W524-F539 HydrophobicContact CH2-CG 4.47Å; W524-F539 HydrophobicContact CH2-CZ 4.34Å; W524-F539 HydrophobicContact CZ2-CE2 4.41Å; Q535-F539 HydrophobicContact CB-CE2 4.35Å; Q535-F539 VanDerWaalsContact O-CD2 3.24Å; Q535-F539 WeakPolarHBondContact O-CD2 3.49Å; L536-F539 PolarHBondContact O-N 3.25Å; F539-E543 HydrophobicContact CB-CB 4.38Å; F539-E543 HydrophobicContact CD1-CB 3.84Å; F539-R544 HydrophobicContact CB-CG 3.83Å; F539-R544 PolarHBondContact O-NE 2.77Å; F539-R544 VanDerWaalsContact O-NE 3.15Å; F539-L616 HydrophobicContact CE2-CD2 4.28Å; F539-L616 HydrophobicContact CZ-CB 4.17Å; F539-L616 WeakPolarHBondContact CZ-O 3.09Å; F539-R617 HydrophobicContact CZ-CG 4.45Å
540	S	87.6	Confident	84.7	Confident	48 Å²	48	62.7 Å²	62.7	34%	0.336	33%	0.326	S	S	.	.			trans	-62.2	161.1	167.3	64.8	0	0	0	0	111.9	E542 E543 R544	S540-E542 PolarHBondContact O-N 3.21Å; S540-E543 VanDerWaalsContact CB-OE2 3.26Å; S540-E543 WeakPolarHBondContact CB-OE2 3.33Å; S540-E543 PolarHBondContact N-OE2 3.4Å; S540-E543 PolarHBondContact O-N 3.16Å; S540-E543 VanDerWaalsContact OG-CG 3.28Å; S540-E543 WeakPolarHBondContact OG-CG 3.42Å; S540-E543 PolarHBondContact OG-N 3.37Å; S540-E543 VanDerWaalsContact OG-N 3.15Å; S540-E543 PolarHBondContact OG-OE2 3.21Å; S540-R544 WeakPolarHBondContact O-CB 3.23Å; S540-R544 VanDerWaalsContact O-CG 3.27Å; S540-R544 WeakPolarHBondContact O-CG 3.48Å; S540-R544 PolarHBondContact O-N 3.47Å
541	N	85.2	Confident	85.1	Confident	85 Å²	85	62.8 Å²	62.8	46%	0.455	33%	0.326	S	S	.	.	H	α-helix	trans	-60.9	-28.6	175.1	-73	-51.2	0	0	0	112.1	K545	N541-K545 WeakPolarHBondContact O-CB 3.35Å; N541-K545 WeakPolarHBondContact O-CD 3.44Å; N541-K545 WeakPolarHBondContact O-CG 3.21Å; N541-K545 PolarHBondContact O-N 3.36Å
542	E	83.6	Confident	85.5	Confident	105 Å²	105	56.5 Å²	56.5	49%	0.491	30%	0.304	S	S	.	.	H	α-helix	trans	-74.8	-44.5	-178.7	-73.7	46.9	-110.4	0	0	110.5	S540 K545 L546	S540-E542 PolarHBondContact O-N 3.21Å; E542-K545 PolarHBondContact O-N 2.92Å; E542-K545 IonicContact OE1-NZ 2.78Å; E542-K545 PolarHBondContact OE1-NZ 3.44Å; E542-L546 PolarHBondContact O-N 2.79Å
543	E	87.5	Confident	86.1	Confident	83 Å²	83	49.6 Å²	49.6	39%	0.388	27%	0.27	S	S	.	.	H	α-helix	trans	-65.9	-40.7	171.9	-67.3	162	110.5	0	0	112	F539 S540 K545 L546 Q547	F539-E543 HydrophobicContact CB-CB 4.38Å; F539-E543 HydrophobicContact CD1-CB 3.84Å; S540-E543 VanDerWaalsContact CB-OE2 3.26Å; S540-E543 WeakPolarHBondContact CB-OE2 3.33Å; S540-E543 PolarHBondContact N-OE2 3.4Å; S540-E543 PolarHBondContact O-N 3.16Å; S540-E543 VanDerWaalsContact OG-CG 3.28Å; S540-E543 WeakPolarHBondContact OG-CG 3.42Å; S540-E543 PolarHBondContact OG-N 3.37Å; S540-E543 VanDerWaalsContact OG-N 3.15Å; S540-E543 PolarHBondContact OG-OE2 3.21Å; E543-K545 PolarHBondContact O-N 3.17Å; E543-L546 WeakPolarHBondContact O-CB 3.5Å; E543-L546 PolarHBondContact O-N 3.22Å; E543-L546 VanDerWaalsContact O-N 3.11Å; E543-Q547 PolarHBondContact O-N 3.31Å
544	R	87.6	Confident	86.6	Confident	44 Å²	44	47.9 Å²	47.9	17%	0.166	26%	0.257	C	S	.	.	H	α-helix	trans	-57	-48.8	172.4	-69.6	170.4	-176.3	-173.8	-6.5	110.5	W524 L536 D537 F539 S540 L546 Q547 E548	W524-R544 HydrophobicContact CZ3-CG 4.47Å; L536-R544 PolarHBondContact O-NE 3.37Å; L536-R544 PolarHBondContact O-NH2 2.92Å; D537-R544 IonicContact OD1-NH2 3.96Å; D537-R544 PolarHBondContact OD1-NH2 2.99Å; F539-R544 HydrophobicContact CB-CG 3.83Å; F539-R544 PolarHBondContact O-NE 2.77Å; F539-R544 VanDerWaalsContact O-NE 3.15Å; S540-R544 WeakPolarHBondContact O-CB 3.23Å; S540-R544 VanDerWaalsContact O-CG 3.27Å; S540-R544 WeakPolarHBondContact O-CG 3.48Å; S540-R544 PolarHBondContact O-N 3.47Å; R544-L546 VanDerWaalsContact C-N 3.26Å; R544-L546 PolarHBondContact O-N 2.94Å; R544-Q547 PolarHBondContact O-N 2.79Å; R544-E548 WeakPolarHBondContact O-CG 3.23Å; R544-E548 PolarHBondContact O-N 2.67Å
545	K	87.4	Confident	87.2	Confident	101 Å²	101	45.7 Å²	45.7	44%	0.439	23%	0.233	S	C	.	.	H	α-helix	trans	-60.9	-32.1	175.4	-70.9	159.1	-164.7	168.6	0	112.8	N541 E542 E543 A549 R701	N541-K545 WeakPolarHBondContact O-CB 3.35Å; N541-K545 WeakPolarHBondContact O-CD 3.44Å; N541-K545 WeakPolarHBondContact O-CG 3.21Å; N541-K545 PolarHBondContact O-N 3.36Å; E542-K545 PolarHBondContact O-N 2.92Å; E542-K545 IonicContact OE1-NZ 2.78Å; E542-K545 PolarHBondContact OE1-NZ 3.44Å; E543-K545 PolarHBondContact O-N 3.17Å; K545-A549 WeakPolarHBondContact O-CB 3.34Å; K545-A549 PolarHBondContact O-N 2.78Å; K545-A549 VanDerWaalsContact O-N 3.16Å; K545-R701 WeakPolarHBondContact O-CD 3.39Å
546	L	90.3	Very high	87.8	Confident	22 Å²	22	42.3 Å²	42.3	12%	0.115	22%	0.217	C	C	.	.	H	α-helix	trans	-71.2	-45.7	175.1	178.6	60.8	0	0	0	111.2	E542 E543 R544 A549 K550 I698 R701	E542-L546 PolarHBondContact O-N 2.79Å; E543-L546 WeakPolarHBondContact O-CB 3.5Å; E543-L546 PolarHBondContact O-N 3.22Å; E543-L546 VanDerWaalsContact O-N 3.11Å; R544-L546 VanDerWaalsContact C-N 3.26Å; R544-L546 PolarHBondContact O-N 2.94Å; L546-A549 WeakPolarHBondContact O-CB 3.47Å; L546-A549 PolarHBondContact O-N 2.81Å; L546-A549 VanDerWaalsContact O-N 3.12Å; L546-K550 WeakPolarHBondContact O-CG 3.42Å; L546-K550 PolarHBondContact O-N 3.19Å; L546-I698 HydrophobicContact CD1-CG2 3.88Å; L546-R701 HydrophobicContact CB-CB 4.14Å; L546-R701 HydrophobicContact CD1-CB 3.89Å
547	Q	91.3	Very high	88.5	Confident	13 Å²	13	40.8 Å²	40.8	6%	0.061	21%	0.209	C	C	.	.	H	α-helix	trans	-65.5	-40.1	177	-65.5	-59	-5.2	0	0	112.4	W524 E543 R544 A549 K550 F551 L616	W524-Q547 HydrophobicContact CD2-CB 3.59Å; W524-Q547 HydrophobicContact CD2-CG 4.43Å; W524-Q547 HydrophobicContact CE3-CB 3.8Å; W524-Q547 HydrophobicContact CG-CB 4.07Å; W524-Q547 HydrophobicContact CH2-CB 4.18Å; W524-Q547 HydrophobicContact CH2-CG 4.13Å; W524-Q547 HydrophobicContact CZ2-CB 3.99Å; W524-Q547 HydrophobicContact CZ2-CG 3.91Å; W524-Q547 HydrophobicContact CZ3-CB 4.1Å; W524-Q547 HydrophobicContact CZ3-CG 4.49Å; E543-Q547 PolarHBondContact O-N 3.31Å; R544-Q547 PolarHBondContact O-N 2.79Å; Q547-A549 VanDerWaalsContact C-N 3.29Å; Q547-A549 PolarHBondContact O-N 2.75Å; Q547-K550 PolarHBondContact O-N 2.88Å; Q547-F551 WeakPolarHBondContact O-CB 3.36Å; Q547-F551 PolarHBondContact O-N 3.4Å; Q547-L616 PolarHBondContact NE2-O 2.78Å; Q547-L616 VanDerWaalsContact NE2-O 3.07Å
548	E	90.1	Very high	89.2	Confident	42 Å²	42	34.3 Å²	34.3	20%	0.196	18%	0.176	C	C	.	.	H	α-helix	trans	-58.7	-39.1	170	-67.9	-63.6	159.3	0	0	111.8	L523 W524 Q525 R544 F551 E552	L523-E548 WeakPolarHBondContact CA-OE2 3.2Å; W524-E548 WeakPolarHBondContact CB-OE1 3.31Å; W524-E548 VanDerWaalsContact N-CD 3.26Å; W524-E548 PolarHBondContact N-OE1 3.48Å; W524-E548 PolarHBondContact N-OE2 3.43Å; Q525-E548 WeakPolarHBondContact CG-OE1 3.45Å; Q525-E548 PolarHBondContact N-OE1 2.91Å; R544-E548 WeakPolarHBondContact O-CG 3.23Å; R544-E548 PolarHBondContact O-N 2.67Å; E548-F551 PolarHBondContact O-N 3.43Å; E548-E552 WeakPolarHBondContact O-CB 3.22Å; E548-E552 PolarHBondContact O-N 2.62Å
549	A	89.7	Confident	89.6	Confident	3 Å²	3	29.6 Å²	29.6	3%	0.025	15%	0.147	C	C	.	.	H	α-helix	trans	-71.2	-33.8	176.9	0	0	0	0	0	113.3	K545 L546 Q547 E552 L553 I698	K545-A549 WeakPolarHBondContact O-CB 3.34Å; K545-A549 PolarHBondContact O-N 2.78Å; K545-A549 VanDerWaalsContact O-N 3.16Å; L546-A549 WeakPolarHBondContact O-CB 3.47Å; L546-A549 PolarHBondContact O-N 2.81Å; L546-A549 VanDerWaalsContact O-N 3.12Å; Q547-A549 VanDerWaalsContact C-N 3.29Å; Q547-A549 PolarHBondContact O-N 2.75Å; A549-E552 WeakPolarHBondContact O-CB 3.37Å; A549-L553 PolarHBondContact O-N 2.69Å; A549-I698 HydrophobicContact CB-CG1 4.05Å
550	K	93.5	Very high	90	Very high	7 Å²	7	29.1 Å²	29.1	3%	0.03	15%	0.145	C	C	.	.	H	α-helix	trans	-69	-42.5	172.1	-67.3	-174.8	-176.9	-160.9	0	111.1	L546 Q547 L553 V554 F618 D619 V620 I698	L546-K550 WeakPolarHBondContact O-CG 3.42Å; L546-K550 PolarHBondContact O-N 3.19Å; Q547-K550 PolarHBondContact O-N 2.88Å; K550-L553 WeakPolarHBondContact O-CB 3.48Å; K550-L553 PolarHBondContact O-N 3.22Å; K550-V554 PolarHBondContact O-N 2.96Å; K550-F618 HydrophobicContact CB-CD2 4.38Å; K550-F618 HydrophobicContact CB-CE2 3.59Å; K550-F618 HydrophobicContact CB-CZ 3.73Å; K550-F618 VanDerWaalsContact CD-O 3.26Å; K550-F618 WeakPolarHBondContact CD-O 3.37Å; K550-F618 PolarHBondContact NZ-O 3.38Å; K550-D619 WeakPolarHBondContact CE-OD1 3.32Å; K550-D619 IonicContact NZ-OD1 3.34Å; K550-D619 PolarHBondContact NZ-OD1 2.89Å; K550-V620 HydrophobicContact CB-CG2 4.33Å; K550-V620 HydrophobicContact CG-CG2 4.27Å; K550-I698 HydrophobicContact CG-CD1 4.25Å; K550-I698 HydrophobicContact CG-CG1 4.29Å; K550-I698 HydrophobicContact CG-CG2 4.31Å
551	F	91.6	Very high	90.4	Very high	2 Å²	2	27.5 Å²	27.5	1%	0.009	13%	0.132	C	C	.	.	H	α-helix	trans	-68.7	-31.4	175.9	-170.3	-120.8	0	0	0	112.5	F459 A522 W524 I527 Q547 E548 L553 V554 T555 L611 F618	F459-F551 HydrophobicContact CB-CE2 4.11Å; F459-F551 HydrophobicContact CB-CZ 4.27Å; F459-F551 HydrophobicContact CG-CE2 4.48Å; A522-F551 HydrophobicContact CB-CE1 4.44Å; W524-F551 HydrophobicContact CB-CB 3.81Å; W524-F551 HydrophobicContact CB-CD1 3.8Å; W524-F551 HydrophobicContact CB-CG 3.9Å; W524-F551 HydrophobicContact CG-CB 4.49Å; I527-F551 HydrophobicContact CD1-CD2 4.2Å; I527-F551 HydrophobicContact CD1-CE1 4.28Å; I527-F551 HydrophobicContact CD1-CE2 3.73Å; I527-F551 HydrophobicContact CD1-CZ 3.76Å; I527-F551 HydrophobicContact CG1-CE1 4.5Å; I527-F551 HydrophobicContact CG1-CZ 4.11Å; Q547-F551 WeakPolarHBondContact O-CB 3.36Å; Q547-F551 PolarHBondContact O-N 3.4Å; E548-F551 PolarHBondContact O-N 3.43Å; F551-L553 PolarHBondContact O-N 2.9Å; F551-V554 PolarHBondContact O-N 3.38Å; F551-T555 HydrophobicContact CD1-CG2 3.85Å; F551-T555 HydrophobicContact CD2-CG2 4.06Å; F551-T555 HydrophobicContact CE1-CG2 3.49Å; F551-T555 VanDerWaalsContact CE1-CG2 3.49Å; F551-T555 HydrophobicContact CE2-CG2 3.7Å; F551-T555 HydrophobicContact CG-CG2 4.12Å; F551-T555 HydrophobicContact CZ-CG2 3.4Å; F551-T555 VanDerWaalsContact CZ-CG2 3.4Å; F551-T555 WeakPolarHBondContact O-CB 3.37Å; F551-T555 WeakPolarHBondContact O-CG2 3.44Å; F551-T555 PolarHBondContact O-N 3.42Å; F551-T555 PolarHBondContact O-OG1 3.41Å; F551-L611 HydrophobicContact CD2-CD2 3.94Å; F551-L611 HydrophobicContact CE2-CD2 3.84Å; F551-F618 HydrophobicContact CB-CZ 4.23Å
552	E	89.9	Confident	90.7	Very high	27 Å²	27	26.7 Å²	26.7	13%	0.126	12%	0.123	C	C	.	.	H	α-helix	trans	-54.2	-40.5	169.9	-164.7	-167.9	157.9	0	0	111.2	Y469 E548 A549 T555 S556 R690 L694 N697	Y469-E552 WeakPolarHBondContact OH-CG 3.39Å; Y469-E552 PolarHBondContact OH-OE1 2.84Å; E548-E552 WeakPolarHBondContact O-CB 3.22Å; E548-E552 PolarHBondContact O-N 2.62Å; A549-E552 WeakPolarHBondContact O-CB 3.37Å; E552-T555 WeakPolarHBondContact CA-OG1 3.28Å; E552-T555 PolarHBondContact O-OG1 2.86Å; E552-S556 WeakPolarHBondContact O-CB 3.21Å; E552-S556 PolarHBondContact O-N 2.92Å; E552-S556 PolarHBondContact O-OG 2.86Å; E552-R690 IonicContact OE1-CZ 3.01Å; E552-R690 IonicContact OE1-NH2 3.21Å; E552-R690 PolarHBondContact OE1-NH2 3.25Å; E552-L694 HydrophobicContact CB-CD2 4.18Å; E552-L694 HydrophobicContact CG-CD2 3.65Å; E552-L694 WeakPolarHBondContact OE1-CD2 3.45Å; E552-N697 PolarHBondContact OE2-ND2 3.29Å; E552-N697 VanDerWaalsContact OE2-ND2 3.11Å
553	L	93.1	Very high	91.2	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-66.9	-46.5	179.6	-167.4	153.9	0	0	0	111.8	A549 K550 F551 S556 E557 F603 L607 V620 V624 R687 L694 V695 I698	A549-L553 PolarHBondContact O-N 2.69Å; K550-L553 WeakPolarHBondContact O-CB 3.48Å; K550-L553 PolarHBondContact O-N 3.22Å; F551-L553 PolarHBondContact O-N 2.9Å; L553-S556 PolarHBondContact O-OG 3.23Å; L553-E557 PolarHBondContact O-N 3.35Å; L553-E557 VanDerWaalsContact O-N 3.12Å; L553-F603 HydrophobicContact CD2-CZ 4.06Å; L553-L607 HydrophobicContact CD2-CD1 3.61Å; L553-L607 HydrophobicContact CD2-CD2 3.9Å; L553-L607 HydrophobicContact CD2-CG 4.44Å; L553-V620 HydrophobicContact CD1-CG2 4.09Å; L553-V624 HydrophobicContact CD1-CG2 3.94Å; L553-V624 HydrophobicContact CD2-CG2 4.35Å; L553-R687 PolarHBondContact O-NH2 2.71Å; L553-L694 HydrophobicContact CD1-CB 4.22Å; L553-L694 HydrophobicContact CG-CB 4.45Å; L553-V695 HydrophobicContact CD1-CG2 4.13Å; L553-I698 HydrophobicContact CB-CD1 4.44Å; L553-I698 HydrophobicContact CD1-CD1 3.92Å
554	V	92.4	Very high	91.6	Very high	2 Å²	2	17.8 Å²	17.8	1%	0.012	8%	0.081	C	C	.	.	H	α-helix	trans	-66	-51.4	179.6	-172	0	0	0	0	111.5	K550 F551 S556 E557 A558 L604 L607 L611 F618 V620	K550-V554 PolarHBondContact O-N 2.96Å; F551-V554 PolarHBondContact O-N 3.38Å; V554-S556 VanDerWaalsContact C-N 3.29Å; V554-S556 PolarHBondContact O-N 3.46Å; V554-E557 PolarHBondContact O-N 3.09Å; V554-A558 PolarHBondContact O-N 2.89Å; V554-L604 HydrophobicContact CG1-CD1 4.5Å; V554-L607 HydrophobicContact CG1-CB 4.21Å; V554-L607 HydrophobicContact CG2-CB 4.18Å; V554-L607 HydrophobicContact CG2-CD2 4.42Å; V554-L611 HydrophobicContact CG1-CD2 4.26Å; V554-F618 HydrophobicContact CG2-CE2 4.33Å; V554-V620 HydrophobicContact CG2-CG1 4.18Å
555	T	89.3	Confident	91.9	Very high	13 Å²	13	17.7 Å²	17.7	8%	0.08	9%	0.086	C	C	.	.	H	α-helix	trans	-62.1	-34.9	179.8	51.6	0	0	0	0	112.6	L460 F551 E552 S559	L460-T555 HydrophobicContact CD2-CG2 3.76Å; F551-T555 HydrophobicContact CD1-CG2 3.85Å; F551-T555 HydrophobicContact CD2-CG2 4.06Å; F551-T555 HydrophobicContact CE1-CG2 3.49Å; F551-T555 VanDerWaalsContact CE1-CG2 3.49Å; F551-T555 HydrophobicContact CE2-CG2 3.7Å; F551-T555 HydrophobicContact CG-CG2 4.12Å; F551-T555 HydrophobicContact CZ-CG2 3.4Å; F551-T555 VanDerWaalsContact CZ-CG2 3.4Å; F551-T555 WeakPolarHBondContact O-CB 3.37Å; F551-T555 WeakPolarHBondContact O-CG2 3.44Å; F551-T555 PolarHBondContact O-N 3.42Å; F551-T555 PolarHBondContact O-OG1 3.41Å; E552-T555 WeakPolarHBondContact CA-OG1 3.28Å; E552-T555 PolarHBondContact O-OG1 2.86Å; T555-S559 WeakPolarHBondContact O-CB 3.41Å; T555-S559 PolarHBondContact O-N 3.06Å; T555-S559 VanDerWaalsContact O-N 3.1Å; T555-S559 PolarHBondContact O-OG 3.13Å
556	S	90.4	Very high	92.3	Very high	0 Å²	0	13.5 Å²	13.5	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-74.2	-25.7	174.5	65.3	0	0	0	0	113.7	Y466 Y469 E552 L553 V554 Y560 R687 L694	Y466-S556 WeakPolarHBondContact CD2-O 3.21Å; Y469-S556 VanDerWaalsContact CZ-CB 3.48Å; E552-S556 WeakPolarHBondContact O-CB 3.21Å; E552-S556 PolarHBondContact O-N 2.92Å; E552-S556 PolarHBondContact O-OG 2.86Å; L553-S556 PolarHBondContact O-OG 3.23Å; V554-S556 VanDerWaalsContact C-N 3.29Å; V554-S556 PolarHBondContact O-N 3.46Å; S556-Y560 VanDerWaalsContact O-CB 3.29Å; S556-Y560 WeakPolarHBondContact O-CB 3.13Å; S556-Y560 PolarHBondContact O-N 3.34Å; S556-R687 VanDerWaalsContact CB-NH1 3.31Å; S556-R687 PolarHBondContact OG-NH1 2.85Å; S556-R687 PolarHBondContact OG-NH2 2.86Å; S556-L694 WeakPolarHBondContact OG-CD1 3.23Å
557	E	93.7	Very high	92.5	Very high	0 Å²	0	12.5 Å²	12.5	0%	0	6%	0.062	C	C	.	.	H	α-helix	trans	-75.4	-42	173	-164.7	66	-147.7	0	0	111.6	L553 V554 S559 Y560 I561 S600 F603 L604 L607 R687	L553-E557 PolarHBondContact O-N 3.35Å; L553-E557 VanDerWaalsContact O-N 3.12Å; V554-E557 PolarHBondContact O-N 3.09Å; E557-S559 VanDerWaalsContact C-N 3.31Å; E557-S559 PolarHBondContact O-N 2.69Å; E557-Y560 WeakPolarHBondContact O-CA 3.38Å; E557-Y560 WeakPolarHBondContact O-CB 3.13Å; E557-Y560 PolarHBondContact O-N 3.08Å; E557-Y560 VanDerWaalsContact O-N 3.11Å; E557-Y560 WeakPolarHBondContact OE1-CD1 3.48Å; E557-I561 PolarHBondContact O-N 3.2Å; E557-S600 WeakPolarHBondContact OE1-CB 3.3Å; E557-S600 PolarHBondContact OE1-OG 2.95Å; E557-F603 VanDerWaalsContact CD-CD1 3.46Å; E557-F603 HydrophobicContact CG-CD1 3.79Å; E557-F603 HydrophobicContact CG-CE1 4.04Å; E557-F603 WeakPolarHBondContact OE2-CE1 3.29Å; E557-L604 HydrophobicContact CB-CD1 4.2Å; E557-L604 HydrophobicContact CG-CB 4Å; E557-L604 HydrophobicContact CG-CD1 4.38Å; E557-L607 HydrophobicContact CB-CD1 4.25Å; E557-L607 HydrophobicContact CG-CD1 4.43Å; E557-R687 IonicContact OE2-CZ 2.72Å; E557-R687 IonicContact OE2-NE 3.48Å; E557-R687 PolarHBondContact OE2-NE 3.17Å; E557-R687 IonicContact OE2-NH2 3.48Å; E557-R687 PolarHBondContact OE2-NH2 2.79Å
558	A	91.1	Very high	92.8	Very high	10 Å²	10	12.3 Å²	12.3	8%	0.083	6%	0.062	C	C	.	.	H	α-helix	trans	-64.4	-36.7	175.2	0	0	0	0	0	112.2	L460 V554 R562 L604	L460-A558 HydrophobicContact CD1-CB 3.45Å; L460-A558 VanDerWaalsContact CD1-CB 3.45Å; L460-A558 HydrophobicContact CG-CB 4.23Å; V554-A558 PolarHBondContact O-N 2.89Å; A558-R562 PolarHBondContact O-N 3.5Å; A558-R562 VanDerWaalsContact O-N 3.16Å; A558-L604 HydrophobicContact CB-CD1 3.81Å; A558-L604 HydrophobicContact CB-CD2 3.97Å
559	S	90.8	Very high	93	Very high	4 Å²	4	13.9 Å²	13.9	3%	0.028	7%	0.072	C	C	.	.	H	α-helix	trans	-64.7	-39	171	-56.4	0	0	0	0	112.1	Y466 T555 E557 S563	Y466-S559 PolarHBondContact N-O 2.72Å; T555-S559 WeakPolarHBondContact O-CB 3.41Å; T555-S559 PolarHBondContact O-N 3.06Å; T555-S559 VanDerWaalsContact O-N 3.1Å; T555-S559 PolarHBondContact O-OG 3.13Å; E557-S559 VanDerWaalsContact C-N 3.31Å; E557-S559 PolarHBondContact O-N 2.69Å; S559-S563 PolarHBondContact O-N 2.77Å
560	Y	94.6	Very high	93.2	Very high	0 Å²	0	15.3 Å²	15.3	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-65.4	-48.6	176.3	177	-107.3	0	0	0	112.3	Y466 S556 E557 R562 S563 L564 V596 S600 Y635 L683 P684 R687	Y466-Y560 HydrophobicContact CD1-CD2 4.35Å; Y466-Y560 HydrophobicContact CD2-CD2 4.17Å; Y466-Y560 HydrophobicContact CD2-CG 4.34Å; Y466-Y560 HydrophobicContact CE1-CD2 4.48Å; Y466-Y560 HydrophobicContact CE2-CD2 4.32Å; Y466-Y560 HydrophobicContact CG-CD2 4.16Å; S556-Y560 VanDerWaalsContact O-CB 3.29Å; S556-Y560 WeakPolarHBondContact O-CB 3.13Å; S556-Y560 PolarHBondContact O-N 3.34Å; E557-Y560 WeakPolarHBondContact O-CA 3.38Å; E557-Y560 WeakPolarHBondContact O-CB 3.13Å; E557-Y560 PolarHBondContact O-N 3.08Å; E557-Y560 VanDerWaalsContact O-N 3.11Å; E557-Y560 WeakPolarHBondContact OE1-CD1 3.48Å; Y560-R562 VanDerWaalsContact C-N 3.3Å; Y560-R562 PolarHBondContact O-N 2.92Å; Y560-S563 PolarHBondContact O-N 2.79Å; Y560-S563 VanDerWaalsContact O-N 3.11Å; Y560-L564 HydrophobicContact CD1-CD1 4.13Å; Y560-L564 HydrophobicContact CD1-CG 4.34Å; Y560-L564 HydrophobicContact CE1-CD1 3.39Å; Y560-L564 HydrophobicContact CE1-CG 3.91Å; Y560-L564 HydrophobicContact CE2-CD1 4.43Å; Y560-L564 HydrophobicContact CE2-CD2 4.19Å; Y560-L564 HydrophobicContact CE2-CG 4.2Å; Y560-L564 PolarHBondContact O-N 3.4Å; Y560-V596 WeakPolarHBondContact OH-CG1 3.47Å; Y560-S600 VanDerWaalsContact CE1-OG 3.32Å; Y560-S600 WeakPolarHBondContact CE1-OG 3.47Å; Y560-Y635 WeakPolarHBondContact CE1-OH 3.44Å; Y560-Y635 PolarHBondContact OH-OH 2.85Å; Y560-L683 HydrophobicContact CD2-CB 4.45Å; Y560-L683 HydrophobicContact CE2-CB 3.87Å; Y560-P684 WeakPolarHBondContact OH-CA 3.38Å; Y560-R687 HydrophobicContact CD1-CG 3.92Å; Y560-R687 HydrophobicContact CD2-CB 3.69Å; Y560-R687 HydrophobicContact CD2-CG 3.79Å; Y560-R687 HydrophobicContact CE1-CB 4.28Å; Y560-R687 HydrophobicContact CE1-CG 3.91Å; Y560-R687 HydrophobicContact CE2-CB 3.34Å; Y560-R687 HydrophobicContact CE2-CG 3.78Å; Y560-R687 HydrophobicContact CG-CB 4.29Å; Y560-R687 HydrophobicContact CG-CG 3.85Å
561	I	94.9	Very high	93.4	Very high	14 Å²	14	15 Å²	15	7%	0.072	8%	0.077	C	C	.	.	H	α-helix	trans	-59.1	-41.5	178	-83.9	-56.3	0	0	0	111.7	E557 S563 L564 T565 K597 S600 E601 L604	E557-I561 PolarHBondContact O-N 3.2Å; I561-S563 PolarHBondContact O-N 3.34Å; I561-L564 HydrophobicContact CD1-CD1 4.32Å; I561-L564 CarbonylContact O-C 3.44Å; I561-L564 PolarHBondContact O-N 2.8Å; I561-T565 PolarHBondContact O-N 3.11Å; I561-T565 PolarHBondContact O-OG1 2.7Å; I561-K597 HydrophobicContact CD1-CG 4.31Å; I561-S600 VanDerWaalsContact CD1-CB 3.45Å; I561-E601 HydrophobicContact CD1-CB 3.93Å; I561-E601 HydrophobicContact CG1-CB 4.45Å; I561-L604 HydrophobicContact CB-CD2 4.06Å; I561-L604 HydrophobicContact CG1-CB 4.49Å; I561-L604 HydrophobicContact CG1-CD2 4.11Å; I561-L604 HydrophobicContact CG2-CD2 4.16Å
562	R	91.8	Very high	93.5	Very high	69 Å²	69	16.1 Å²	16.1	26%	0.26	8%	0.083	S	C	.	.	H	α-helix	trans	-58.3	-47.9	173.7	-175.1	-160	177	145.4	16.8	112.7	S462 S463 I464 L465 A558 Y560 L564 T565 I566	S462-R562 VanDerWaalsContact O-CZ 3.3Å; S462-R562 PolarHBondContact O-NH1 3.27Å; S462-R562 PolarHBondContact O-NH2 3.03Å; S463-R562 VanDerWaalsContact CA-NH1 3.29Å; I464-R562 WeakPolarHBondContact O-CD 3.32Å; I464-R562 PolarHBondContact O-NH1 2.93Å; L465-R562 HydrophobicContact CD2-CG 4.39Å; A558-R562 PolarHBondContact O-N 3.5Å; A558-R562 VanDerWaalsContact O-N 3.16Å; Y560-R562 VanDerWaalsContact C-N 3.3Å; Y560-R562 PolarHBondContact O-N 2.92Å; R562-L564 VanDerWaalsContact C-N 3.27Å; R562-L564 PolarHBondContact O-N 2.85Å; R562-T565 PolarHBondContact O-N 2.96Å; R562-I566 HydrophobicContact CG-CD1 4.39Å; R562-I566 PolarHBondContact O-N 3.36Å
563	S	94.3	Very high	93.7	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-64	-33.4	178.2	-68.4	0	0	0	0	111.8	Y466 Q467 S559 Y560 I561 A567 F680	Y466-S563 PolarHBondContact N-OG 3.28Å; Q467-S563 PolarHBondContact OE1-OG 3.42Å; S559-S563 PolarHBondContact O-N 2.77Å; Y560-S563 PolarHBondContact O-N 2.79Å; Y560-S563 VanDerWaalsContact O-N 3.11Å; I561-S563 PolarHBondContact O-N 3.34Å; S563-A567 WeakPolarHBondContact O-CB 3.33Å; S563-A567 PolarHBondContact O-N 3.32Å; S563-A567 VanDerWaalsContact O-N 3.09Å; S563-F680 VanDerWaalsContact O-CD1 3.31Å; S563-F680 WeakPolarHBondContact O-CD1 3.26Å
564	L	95.7	Very high	93.8	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-67.9	-40.3	170.3	-68.9	-164.9	0	0	0	113	Y560 I561 R562 I566 A567 V568 L593 V596 K597	Y560-L564 HydrophobicContact CD1-CD1 4.13Å; Y560-L564 HydrophobicContact CD1-CG 4.34Å; Y560-L564 HydrophobicContact CE1-CD1 3.39Å; Y560-L564 HydrophobicContact CE1-CG 3.91Å; Y560-L564 HydrophobicContact CE2-CD1 4.43Å; Y560-L564 HydrophobicContact CE2-CD2 4.19Å; Y560-L564 HydrophobicContact CE2-CG 4.2Å; Y560-L564 PolarHBondContact O-N 3.4Å; I561-L564 HydrophobicContact CD1-CD1 4.32Å; I561-L564 CarbonylContact O-C 3.44Å; I561-L564 PolarHBondContact O-N 2.8Å; R562-L564 VanDerWaalsContact C-N 3.27Å; R562-L564 PolarHBondContact O-N 2.85Å; L564-I566 VanDerWaalsContact C-N 3.3Å; L564-I566 PolarHBondContact O-N 2.72Å; L564-A567 WeakPolarHBondContact O-CB 3.34Å; L564-A567 PolarHBondContact O-N 3.47Å; L564-A567 VanDerWaalsContact O-N 3.12Å; L564-V568 WeakPolarHBondContact O-CB 3.43Å; L564-V568 WeakPolarHBondContact O-CG2 3.44Å; L564-V568 PolarHBondContact O-N 2.97Å; L564-L593 HydrophobicContact CD2-CD1 3.8Å; L564-V596 HydrophobicContact CD1-CG1 4.01Å; L564-K597 HydrophobicContact CB-CB 4.27Å; L564-K597 HydrophobicContact CB-CG 4.33Å; L564-K597 HydrophobicContact CD1-CB 4.09Å
565	T	94.6	Very high	93.8	Very high	43 Å²	43	27.1 Å²	27.1	26%	0.264	14%	0.138	S	C	.	.	H	α-helix	trans	-60.7	-38.8	175.3	-60.3	0	0	0	0	111	I561 R562 D569 K597	I561-T565 PolarHBondContact O-N 3.11Å; I561-T565 PolarHBondContact O-OG1 2.7Å; R562-T565 PolarHBondContact O-N 2.96Å; T565-D569 HydrophobicContact CG2-CB 4.46Å; T565-D569 VanDerWaalsContact CG2-OD2 3.31Å; T565-D569 WeakPolarHBondContact CG2-OD2 3.42Å; T565-D569 WeakPolarHBondContact O-CA 3.2Å; T565-D569 WeakPolarHBondContact O-CB 3.28Å; T565-D569 PolarHBondContact O-N 3.16Å; T565-K597 VanDerWaalsContact OG1-CE 3.26Å; T565-K597 WeakPolarHBondContact OG1-CE 3.47Å
566	I	94.9	Very high	94	Very high	13 Å²	13	30.8 Å²	30.8	7%	0.067	15%	0.154	C	C	.	.	I	π-helix	trans	-64.8	-45.4	171.8	-67.7	158.9	0	0	0	110.8	L465 R562 L564 V568 H570 F571 I671 F680	L465-I566 HydrophobicContact CD2-CD1 3.41Å; L465-I566 VanDerWaalsContact CD2-CD1 3.41Å; R562-I566 HydrophobicContact CG-CD1 4.39Å; R562-I566 PolarHBondContact O-N 3.36Å; L564-I566 VanDerWaalsContact C-N 3.3Å; L564-I566 PolarHBondContact O-N 2.72Å; I566-V568 VanDerWaalsContact C-N 3.29Å; I566-V568 PolarHBondContact O-N 2.88Å; I566-H570 HydrophobicContact CG2-CB 4.3Å; I566-H570 VanDerWaalsContact O-CB 3.3Å; I566-H570 WeakPolarHBondContact O-CB 3.34Å; I566-H570 PolarHBondContact O-N 3.33Å; I566-H570 VanDerWaalsContact O-N 3.09Å; I566-F571 HydrophobicContact CG2-CD2 4.22Å; I566-F571 HydrophobicContact CG2-CE2 3.97Å; I566-F571 PolarHBondContact O-N 2.76Å; I566-I671 WeakPolarHBondContact CD1-O 3.44Å; I566-F680 HydrophobicContact CB-CE1 4.14Å; I566-F680 HydrophobicContact CD1-CE1 4.45Å; I566-F680 HydrophobicContact CG2-CE1 3.93Å; I566-F680 HydrophobicContact CG2-CE2 4.45Å; I566-F680 HydrophobicContact CG2-CZ 3.9Å
567	A	95.9	Very high	94.1	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.155	C	C	.	.	I	π-helix	trans	-61.8	-35	179.6	0	0	0	0	0	113.5	S563 L564 M572 L593 F680	S563-A567 WeakPolarHBondContact O-CB 3.33Å; S563-A567 PolarHBondContact O-N 3.32Å; S563-A567 VanDerWaalsContact O-N 3.09Å; L564-A567 WeakPolarHBondContact O-CB 3.34Å; L564-A567 PolarHBondContact O-N 3.47Å; L564-A567 VanDerWaalsContact O-N 3.12Å; A567-M572 PolarHBondContact O-N 2.76Å; A567-M572 VanDerWaalsContact O-N 3.14Å; A567-L593 HydrophobicContact CB-CD2 3.69Å; A567-F680 HydrophobicContact CB-CB 3.86Å; A567-F680 HydrophobicContact CB-CG 4.45Å
568	V	96	Very high	93.9	Very high	9 Å²	9	33.6 Å²	33.6	6%	0.055	17%	0.172	C	C	.	.	I	π-helix	trans	-84.6	-58.9	178	176.4	0	0	0	0	110.7	L564 I566 M572 L573 L593 K597	L564-V568 WeakPolarHBondContact O-CB 3.43Å; L564-V568 WeakPolarHBondContact O-CG2 3.44Å; L564-V568 PolarHBondContact O-N 2.97Å; I566-V568 VanDerWaalsContact C-N 3.29Å; I566-V568 PolarHBondContact O-N 2.88Å; V568-M572 HydrophobicContact CG1-CE 3.95Å; V568-M572 CarbonylContact O-C 3.52Å; V568-M572 WeakPolarHBondContact O-CA 3.37Å; V568-M572 VanDerWaalsContact O-CB 3.28Å; V568-M572 WeakPolarHBondContact O-CB 3.1Å; V568-M572 PolarHBondContact O-N 3.14Å; V568-M572 VanDerWaalsContact O-N 3.12Å; V568-L573 HydrophobicContact CG1-CD1 4.33Å; V568-L573 HydrophobicContact CG1-CG 4.45Å; V568-L573 WeakPolarHBondContact O-CG 3.44Å; V568-L573 PolarHBondContact O-N 3.07Å; V568-L593 HydrophobicContact CG2-CD2 4.35Å; V568-L593 HydrophobicContact CG2-CG 4.19Å; V568-K597 HydrophobicContact CB-CD 4.2Å; V568-K597 HydrophobicContact CG1-CD 4.45Å; V568-K597 HydrophobicContact CG2-CB 4.42Å; V568-K597 HydrophobicContact CG2-CD 4.03Å
569	D	94.8	Very high	93.9	Very high	76 Å²	76	39.8 Å²	39.8	41%	0.406	20%	0.199	S	C	.	.	I	π-helix	trans	-80.5	-37.2	-165.6	-58.6	6	0	0	0	112.6	T565	T565-D569 HydrophobicContact CG2-CB 4.46Å; T565-D569 VanDerWaalsContact CG2-OD2 3.31Å; T565-D569 WeakPolarHBondContact CG2-OD2 3.42Å; T565-D569 WeakPolarHBondContact O-CA 3.2Å; T565-D569 WeakPolarHBondContact O-CB 3.28Å; T565-D569 PolarHBondContact O-N 3.16Å
570	H	95.1	Very high	93.9	Very high	33 Å²	33	40.3 Å²	40.3	15%	0.153	20%	0.202	C	C	.	.	I	π-helix	trans	-86.4	-44.6	179.7	-174.2	71.2	0	0	0	112.6	I566 S574 L666 D669 I671 C672	I566-H570 HydrophobicContact CG2-CB 4.3Å; I566-H570 VanDerWaalsContact O-CB 3.3Å; I566-H570 WeakPolarHBondContact O-CB 3.34Å; I566-H570 PolarHBondContact O-N 3.33Å; I566-H570 VanDerWaalsContact O-N 3.09Å; H570-S574 VanDerWaalsContact O-CB 3.25Å; H570-S574 WeakPolarHBondContact O-CB 3.48Å; H570-L666 PolarHBondContact NE2-O 3.01Å; H570-D669 IonicContact CE1-OD2 3.33Å; H570-D669 PolarHBondContact CE1-OD2 2.81Å; H570-I671 HydrophobicContact CB-CD1 4Å; H570-C672 PolarHBondContact CD2-SG 2.78Å
571	F	95.7	Very high	93.8	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	21%	0.205	C	C	.	.	I	π-helix	trans	-89.1	-65.4	179.6	-66.8	-82.2	0	0	0	112.1	I566 L573 S574 L577 F590 L663 L666 E667 C672 L677 F680	I566-F571 HydrophobicContact CG2-CD2 4.22Å; I566-F571 HydrophobicContact CG2-CE2 3.97Å; I566-F571 PolarHBondContact O-N 2.76Å; F571-L573 VanDerWaalsContact C-N 3.32Å; F571-L573 PolarHBondContact O-N 2.93Å; F571-S574 WeakPolarHBondContact O-CB 3.47Å; F571-S574 PolarHBondContact O-N 3.4Å; F571-L577 WeakPolarHBondContact O-CD2 3.27Å; F571-F590 HydrophobicContact CB-CE1 4.12Å; F571-F590 HydrophobicContact CB-CZ 4.15Å; F571-L663 HydrophobicContact CD1-CD1 4.38Å; F571-L663 HydrophobicContact CE1-CD1 4.12Å; F571-L666 HydrophobicContact CD1-CB 3.95Å; F571-L666 HydrophobicContact CD1-CD1 4.15Å; F571-L666 HydrophobicContact CE1-CB 3.65Å; F571-E667 HydrophobicContact CE1-CG 3.95Å; F571-E667 HydrophobicContact CZ-CG 4.05Å; F571-C672 VanDerWaalsContact CE2-SG 3.59Å; F571-C672 VanDerWaalsContact CZ-SG 3.57Å; F571-L677 HydrophobicContact CB-CD1 3.91Å; F571-L677 HydrophobicContact CD1-CB 4.27Å; F571-L677 HydrophobicContact CD1-CD1 4.06Å; F571-L677 HydrophobicContact CD1-CD2 4.41Å; F571-L677 HydrophobicContact CD1-CG 4.47Å; F571-L677 HydrophobicContact CD2-CD1 4.1Å; F571-L677 HydrophobicContact CE1-CB 4.11Å; F571-L677 HydrophobicContact CG-CD1 3.78Å; F571-L677 HydrophobicContact CZ-CB 4.44Å; F571-F680 HydrophobicContact CE2-CD2 4.05Å; F571-F680 HydrophobicContact CE2-CE2 4.06Å
572	M	94.4	Very high	93.5	Very high	26 Å²	26	42 Å²	42	13%	0.128	22%	0.22	C	C	.	.	I	π-helix	trans	-65	-31.6	-172.3	-165.7	-161.4	75.2	0	0	113.6	A567 V568 K586 F590 P594	A567-M572 PolarHBondContact O-N 2.76Å; A567-M572 VanDerWaalsContact O-N 3.14Å; V568-M572 HydrophobicContact CG1-CE 3.95Å; V568-M572 CarbonylContact O-C 3.52Å; V568-M572 WeakPolarHBondContact O-CA 3.37Å; V568-M572 VanDerWaalsContact O-CB 3.28Å; V568-M572 WeakPolarHBondContact O-CB 3.1Å; V568-M572 PolarHBondContact O-N 3.14Å; V568-M572 VanDerWaalsContact O-N 3.12Å; M572-K586 WeakPolarHBondContact O-CE 3.31Å; M572-K586 PolarHBondContact O-NZ 3.42Å; M572-F590 HydrophobicContact CB-CD1 3.69Å; M572-F590 HydrophobicContact CB-CD2 4.26Å; M572-F590 HydrophobicContact CB-CE1 3.66Å; M572-F590 HydrophobicContact CB-CE2 4.23Å; M572-F590 HydrophobicContact CB-CG 4Å; M572-F590 HydrophobicContact CB-CZ 3.95Å; M572-F590 HydrophobicContact CG-CB 4.01Å; M572-F590 HydrophobicContact CG-CD1 3.82Å; M572-F590 HydrophobicContact CG-CD2 3.75Å; M572-F590 HydrophobicContact CG-CE1 4.19Å; M572-F590 HydrophobicContact CG-CE2 4.12Å; M572-F590 HydrophobicContact CG-CG 3.59Å; M572-F590 HydrophobicContact CG-CZ 4.33Å; M572-F590 HydrophobicContact SD-CB 4.05Å; M572-F590 HydrophobicContact SD-CG 4.26Å; M572-P594 HydrophobicContact CE-CG 3.65Å; M572-P594 HydrophobicContact SD-CG 3.58Å; M572-P594 VanDerWaalsContact SD-CG 3.58Å
573	L	94.4	Very high	93.4	Very high	103 Å²	103	42.8 Å²	42.8	54%	0.539	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.5	1.5	178.5	-62	-177.2	0	0	0	114	V568 F571 Q575	V568-L573 HydrophobicContact CG1-CD1 4.33Å; V568-L573 HydrophobicContact CG1-CG 4.45Å; V568-L573 WeakPolarHBondContact O-CG 3.44Å; V568-L573 PolarHBondContact O-N 3.07Å; F571-L573 VanDerWaalsContact C-N 3.32Å; F571-L573 PolarHBondContact O-N 2.93Å; L573-Q575 PolarHBondContact O-N 2.97Å
574	S	94.8	Very high	93.2	Very high	17 Å²	17	47.6 Å²	47.6	12%	0.119	26%	0.264	C	S	.	.			trans	-56.3	129.6	170.1	167.2	0	0	0	0	110.9	H570 F571 E576 L577 T578	H570-S574 VanDerWaalsContact O-CB 3.25Å; H570-S574 WeakPolarHBondContact O-CB 3.48Å; F571-S574 WeakPolarHBondContact O-CB 3.47Å; F571-S574 PolarHBondContact O-N 3.4Å; S574-E576 PolarHBondContact OG-N 2.52Å; S574-L577 PolarHBondContact O-N 3Å; S574-L577 PolarHBondContact OG-N 3.03Å; S574-T578 VanDerWaalsContact O-CB 3.24Å; S574-T578 WeakPolarHBondContact O-CB 3.38Å; S574-T578 PolarHBondContact O-N 3.2Å; S574-T578 PolarHBondContact O-OG1 2.82Å
575	Q	92.8	Very high	93	Very high	139 Å²	139	50.2 Å²	50.2	65%	0.65	28%	0.276	S	S	*	.	H	α-helix	trans	-62.6	-46.5	173.9	-178.5	175	-9.4	0	0	110.6	L573 L577 T578 E579	L573-Q575 PolarHBondContact O-N 2.97Å; Q575-L577 VanDerWaalsContact C-N 3.31Å; Q575-L577 PolarHBondContact O-N 3.03Å; Q575-T578 PolarHBondContact O-N 3.46Å; Q575-T578 VanDerWaalsContact O-N 3.14Å; Q575-E579 HydrophobicContact CG-CG 4.34Å; Q575-E579 VanDerWaalsContact CG-OE1 3.26Å; Q575-E579 WeakPolarHBondContact CG-OE1 3.41Å; Q575-E579 PolarHBondContact NE2-OE1 3.24Å; Q575-E579 WeakPolarHBondContact O-CG 3.35Å; Q575-E579 PolarHBondContact O-N 2.56Å
576	E	92.8	Very high	92.9	Very high	90 Å²	90	50.2 Å²	50.2	42%	0.421	27%	0.272	S	S	.	.	H	α-helix	trans	-59.2	-42.2	179.9	-58	-170.4	170.9	0	0	111.8	S574 C580 I662 R665	S574-E576 PolarHBondContact OG-N 2.52Å; E576-C580 VanDerWaalsContact O-CB 3.29Å; E576-C580 WeakPolarHBondContact O-CB 3.3Å; E576-C580 PolarHBondContact O-N 3.27Å; E576-I662 HydrophobicContact CB-CG2 3.89Å; E576-R665 IonicContact OE1-NH2 2.65Å; E576-R665 IonicContact OE2-CZ 2.71Å; E576-R665 IonicContact OE2-NE 2.72Å; E576-R665 PolarHBondContact OE2-NE 3.47Å; E576-R665 IonicContact OE2-NH2 3.88Å; E576-R665 PolarHBondContact OE2-NH2 3.28Å
577	L	92.3	Very high	92.7	Very high	3 Å²	3	55.5 Å²	55.5	2%	0.016	30%	0.297	C	S	.	.	H	α-helix	trans	-73.4	-34	178.1	-163.6	64.4	0	0	0	112	F571 S574 Q575 C580 L581 F590 F659 I662 L666	F571-L577 WeakPolarHBondContact O-CD2 3.27Å; S574-L577 PolarHBondContact O-N 3Å; S574-L577 PolarHBondContact OG-N 3.03Å; Q575-L577 VanDerWaalsContact C-N 3.31Å; Q575-L577 PolarHBondContact O-N 3.03Å; L577-C580 PolarHBondContact O-N 3.4Å; L577-L581 HydrophobicContact CD1-CD1 4.23Å; L577-L581 HydrophobicContact CD1-CG 4.46Å; L577-L581 HydrophobicContact CD2-CD1 4.46Å; L577-L581 HydrophobicContact CG-CD1 3.92Å; L577-L581 HydrophobicContact CG-CG 4.44Å; L577-L581 WeakPolarHBondContact O-CB 3.44Å; L577-L581 WeakPolarHBondContact O-CG 3.35Å; L577-L581 PolarHBondContact O-N 3.01Å; L577-L581 VanDerWaalsContact O-N 3.15Å; L577-F590 HydrophobicContact CD2-CE2 4.17Å; L577-F590 HydrophobicContact CD2-CZ 3.88Å; L577-F659 HydrophobicContact CD1-CD2 3.8Å; L577-F659 HydrophobicContact CD1-CE2 3.81Å; L577-I662 HydrophobicContact CB-CG2 4.36Å; L577-I662 HydrophobicContact CD1-CG2 4.1Å; L577-L666 HydrophobicContact CB-CD1 4.17Å; L577-L666 HydrophobicContact CD2-CD1 4.37Å
578	T	90.9	Very high	92.5	Very high	57 Å²	57	57.3 Å²	57.3	35%	0.35	30%	0.304	S	S	.	.	H	α-helix	trans	-71.9	-32.3	177.5	-58.3	0	0	0	0	112.6	S574 Q575 C580 K586	S574-T578 VanDerWaalsContact O-CB 3.24Å; S574-T578 WeakPolarHBondContact O-CB 3.38Å; S574-T578 PolarHBondContact O-N 3.2Å; S574-T578 PolarHBondContact O-OG1 2.82Å; Q575-T578 PolarHBondContact O-N 3.46Å; Q575-T578 VanDerWaalsContact O-N 3.14Å; T578-C580 VanDerWaalsContact C-N 3.3Å; T578-K586 HydrophobicContact CG2-CD 4.49Å; T578-K586 PolarHBondContact OG1-NZ 2.83Å
579	E	90.9	Very high	92.5	Very high	140 Å²	140	56.9 Å²	56.9	65%	0.654	30%	0.301	S	S	*	.	H	α-helix	trans	-77	-17.8	171.8	-70.5	177.8	-168.1	0	0	112.6	Q575	Q575-E579 HydrophobicContact CG-CG 4.34Å; Q575-E579 VanDerWaalsContact CG-OE1 3.26Å; Q575-E579 WeakPolarHBondContact CG-OE1 3.41Å; Q575-E579 PolarHBondContact NE2-OE1 3.24Å; Q575-E579 WeakPolarHBondContact O-CG 3.35Å; Q575-E579 PolarHBondContact O-N 2.56Å
580	C	91.3	Very high	92.4	Very high	14 Å²	14	53.4 Å²	53.4	10%	0.095	28%	0.282	C	S	.	.	H	α-helix	trans	-88.7	-20.6	177.6	-171.9	0	0	0	0	114.1	E576 L577 T578 N656 I662	E576-C580 VanDerWaalsContact O-CB 3.29Å; E576-C580 WeakPolarHBondContact O-CB 3.3Å; E576-C580 PolarHBondContact O-N 3.27Å; L577-C580 PolarHBondContact O-N 3.4Å; T578-C580 VanDerWaalsContact C-N 3.3Å; C580-N656 PolarHBondContact O-ND2 3.43Å; C580-I662 HydrophobicContact CB-CD1 3.54Å
581	L	92.3	Very high	92.3	Very high	13 Å²	13	53 Å²	53	7%	0.068	28%	0.283	C	S	.	.	S	Bend	trans	-116.8	132.2	-173.5	-64.2	-179.9	0	0	0	111.7	L577 E585 K586 L589 F590 L652 F659	L577-L581 HydrophobicContact CD1-CD1 4.23Å; L577-L581 HydrophobicContact CD1-CG 4.46Å; L577-L581 HydrophobicContact CD2-CD1 4.46Å; L577-L581 HydrophobicContact CG-CD1 3.92Å; L577-L581 HydrophobicContact CG-CG 4.44Å; L577-L581 WeakPolarHBondContact O-CB 3.44Å; L577-L581 WeakPolarHBondContact O-CG 3.35Å; L577-L581 PolarHBondContact O-N 3.01Å; L577-L581 VanDerWaalsContact O-N 3.15Å; L581-E585 HydrophobicContact CB-CB 4.49Å; L581-E585 HydrophobicContact CD2-CB 4.41Å; L581-K586 HydrophobicContact CB-CB 4.34Å; L581-L589 HydrophobicContact CD1-CD2 3.99Å; L581-F590 HydrophobicContact CD1-CE2 4.39Å; L581-L652 HydrophobicContact CD2-CD1 3.59Å; L581-L652 HydrophobicContact CD2-CD2 3.48Å; L581-L652 VanDerWaalsContact CD2-CD2 3.48Å; L581-L652 HydrophobicContact CD2-CG 4.16Å; L581-F659 HydrophobicContact CD1-CE2 4.42Å; L581-F659 HydrophobicContact CD2-CD2 3.82Å; L581-F659 HydrophobicContact CD2-CE2 4.08Å
582	G	88.8	Confident	92	Very high	36 Å²	36	56 Å²	56	37%	0.371	30%	0.296	S	S	.	.			trans	-61.3	150.4	165.7	0	0	0	0	0	111.3	Q584 E585 K586	G582-Q584 PolarHBondContact O-N 3.1Å; G582-Q584 VanDerWaalsContact O-N 3.11Å; G582-E585 PolarHBondContact N-OE2 2.61Å; G582-E585 WeakPolarHBondContact O-CB 3.42Å; G582-E585 PolarHBondContact O-N 2.78Å; G582-K586 PolarHBondContact O-N 2.82Å
583	A	89.6	Confident	92	Very high	86 Å²	86	54.8 Å²	54.8	71%	0.711	29%	0.29	S	S	*	.	H	α-helix	trans	-53.9	-37.2	-178.7	0	0	0	0	0	113	Q587	A583-Q587 WeakPolarHBondContact O-CB 3.15Å; A583-Q587 PolarHBondContact O-N 3.49Å
584	Q	89.9	Confident	92	Very high	101 Å²	101	51.8 Å²	51.8	47%	0.472	28%	0.277	S	S	.	.	H	α-helix	trans	-68.4	-40.6	175.5	-177.2	172.5	-11.6	0	0	112.8	G582 Q587 W588	G582-Q584 PolarHBondContact O-N 3.1Å; G582-Q584 VanDerWaalsContact O-N 3.11Å; Q584-Q587 PolarHBondContact O-N 3.21Å; Q584-W588 HydrophobicContact CG-CD2 4.04Å; Q584-W588 HydrophobicContact CG-CE3 4.15Å; Q584-W588 HydrophobicContact CG-CH2 4.12Å; Q584-W588 HydrophobicContact CG-CZ2 3.98Å; Q584-W588 HydrophobicContact CG-CZ3 4.16Å; Q584-W588 WeakPolarHBondContact O-CB 3.47Å; Q584-W588 VanDerWaalsContact O-CG 3.28Å; Q584-W588 PolarHBondContact O-N 3.11Å
585	E	91.1	Very high	92.1	Very high	55 Å²	55	54.5 Å²	54.5	26%	0.257	29%	0.288	S	S	.	.	H	α-helix	trans	-67.5	-41.4	176.2	-56.5	179.5	119.8	0	0	111.1	L581 G582 W588 L589 L652	L581-E585 HydrophobicContact CB-CB 4.49Å; L581-E585 HydrophobicContact CD2-CB 4.41Å; G582-E585 PolarHBondContact N-OE2 2.61Å; G582-E585 WeakPolarHBondContact O-CB 3.42Å; G582-E585 PolarHBondContact O-N 2.78Å; E585-W588 PolarHBondContact O-N 2.97Å; E585-L589 VanDerWaalsContact O-CB 3.28Å; E585-L589 WeakPolarHBondContact O-CB 3.5Å; E585-L589 PolarHBondContact O-N 2.95Å; E585-L652 WeakPolarHBondContact OE1-CD2 2.99Å
586	K	91.9	Very high	92.3	Very high	43 Å²	43	47.9 Å²	47.9	19%	0.187	26%	0.257	C	S	.	.	H	α-helix	trans	-60.4	-45.2	173.5	-172.9	172.1	-176.8	169.2	0	111.2	M572 T578 L581 G582 L589 F590	M572-K586 WeakPolarHBondContact O-CE 3.31Å; M572-K586 PolarHBondContact O-NZ 3.42Å; T578-K586 HydrophobicContact CG2-CD 4.49Å; T578-K586 PolarHBondContact OG1-NZ 2.83Å; L581-K586 HydrophobicContact CB-CB 4.34Å; G582-K586 PolarHBondContact O-N 2.82Å; K586-L589 PolarHBondContact O-N 2.87Å; K586-F590 HydrophobicContact CG-CD2 4.11Å; K586-F590 WeakPolarHBondContact O-CD2 3.41Å; K586-F590 PolarHBondContact O-N 3.23Å
587	Q	91.8	Very high	92.5	Very high	124 Å²	124	44.3 Å²	44.3	58%	0.579	24%	0.24	S	C	*	.	H	α-helix	trans	-64.2	-37.4	174.5	-177.2	179.2	-16.8	0	0	112.5	A583 Q584 S591	A583-Q587 WeakPolarHBondContact O-CB 3.15Å; A583-Q587 PolarHBondContact O-N 3.49Å; Q584-Q587 PolarHBondContact O-N 3.21Å; Q587-S591 WeakPolarHBondContact O-CA 3.36Å; Q587-S591 PolarHBondContact O-N 2.77Å
588	W	91.6	Very high	92.7	Very high	39 Å²	39	48 Å²	48	15%	0.148	26%	0.259	C	S	.	.	H	α-helix	trans	-73.5	-35.8	177.1	-75.3	-20.4	0	0	0	113.6	Q584 E585 Q645 T648	Q584-W588 HydrophobicContact CG-CD2 4.04Å; Q584-W588 HydrophobicContact CG-CE3 4.15Å; Q584-W588 HydrophobicContact CG-CH2 4.12Å; Q584-W588 HydrophobicContact CG-CZ2 3.98Å; Q584-W588 HydrophobicContact CG-CZ3 4.16Å; Q584-W588 WeakPolarHBondContact O-CB 3.47Å; Q584-W588 VanDerWaalsContact O-CG 3.28Å; Q584-W588 PolarHBondContact O-N 3.11Å; E585-W588 PolarHBondContact O-N 2.97Å; W588-Q645 WeakPolarHBondContact O-CG 3.46Å; W588-T648 HydrophobicContact CB-CG2 3.95Å
589	L	94.4	Very high	93.1	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-75.3	-47.8	179.8	-179.2	60.7	0	0	0	111.9	L581 E585 K586 Q645 T648 Y649 L652 F659 L677 L681	L581-L589 HydrophobicContact CD1-CD2 3.99Å; E585-L589 VanDerWaalsContact O-CB 3.28Å; E585-L589 WeakPolarHBondContact O-CB 3.5Å; E585-L589 PolarHBondContact O-N 2.95Å; K586-L589 PolarHBondContact O-N 2.87Å; L589-Q645 WeakPolarHBondContact O-CG 3.45Å; L589-Q645 PolarHBondContact O-NE2 2.96Å; L589-T648 HydrophobicContact CB-CG2 4.36Å; L589-Y649 HydrophobicContact CD1-CD2 4.19Å; L589-Y649 HydrophobicContact CD1-CG 4.49Å; L589-L652 HydrophobicContact CD2-CD1 4.12Å; L589-F659 HydrophobicContact CD2-CE2 4.06Å; L589-F659 HydrophobicContact CD2-CZ 4.17Å; L589-L677 HydrophobicContact CD2-CD2 4.36Å; L589-L681 HydrophobicContact CD1-CD1 3.72Å; L589-L681 HydrophobicContact CG-CD1 4.33Å
590	F	94.3	Very high	93.3	Very high	3 Å²	3	38.6 Å²	38.6	1%	0.013	21%	0.212	C	C	.	.	H	α-helix	trans	-95.1	-13.4	-175.8	-66.1	-83.3	0	0	0	113.9	F571 M572 L577 L581 K586 K592 L593 L677 L681	F571-F590 HydrophobicContact CB-CE1 4.12Å; F571-F590 HydrophobicContact CB-CZ 4.15Å; M572-F590 HydrophobicContact CB-CD1 3.69Å; M572-F590 HydrophobicContact CB-CD2 4.26Å; M572-F590 HydrophobicContact CB-CE1 3.66Å; M572-F590 HydrophobicContact CB-CE2 4.23Å; M572-F590 HydrophobicContact CB-CG 4Å; M572-F590 HydrophobicContact CB-CZ 3.95Å; M572-F590 HydrophobicContact CG-CB 4.01Å; M572-F590 HydrophobicContact CG-CD1 3.82Å; M572-F590 HydrophobicContact CG-CD2 3.75Å; M572-F590 HydrophobicContact CG-CE1 4.19Å; M572-F590 HydrophobicContact CG-CE2 4.12Å; M572-F590 HydrophobicContact CG-CG 3.59Å; M572-F590 HydrophobicContact CG-CZ 4.33Å; M572-F590 HydrophobicContact SD-CB 4.05Å; M572-F590 HydrophobicContact SD-CG 4.26Å; L577-F590 HydrophobicContact CD2-CE2 4.17Å; L577-F590 HydrophobicContact CD2-CZ 3.88Å; L581-F590 HydrophobicContact CD1-CE2 4.39Å; K586-F590 HydrophobicContact CG-CD2 4.11Å; K586-F590 WeakPolarHBondContact O-CD2 3.41Å; K586-F590 PolarHBondContact O-N 3.23Å; F590-K592 PolarHBondContact O-N 3.4Å; F590-L593 HydrophobicContact CD1-CD2 4.15Å; F590-L593 WeakPolarHBondContact O-CB 3.49Å; F590-L593 PolarHBondContact O-N 2.7Å; F590-L677 HydrophobicContact CE1-CD1 4.01Å; F590-L677 HydrophobicContact CZ-CD1 4.43Å; F590-L677 HydrophobicContact CZ-CD2 4.33Å; F590-L681 HydrophobicContact CD1-CD2 3.95Å; F590-L681 HydrophobicContact CE1-CD2 4.3Å
591	S	91.8	Very high	93.5	Very high	25 Å²	25	40 Å²	40	18%	0.175	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	50.4	-133.5	177.1	-161	0	0	0	0	112.1	Q587 N641	Q587-S591 WeakPolarHBondContact O-CA 3.36Å; Q587-S591 PolarHBondContact O-N 2.77Å; S591-N641 PolarHBondContact OG-ND2 2.93Å
592	K	89.4	Confident	93.8	Very high	62 Å²	62	44.1 Å²	44.1	27%	0.27	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.6	24.7	175.3	-72.7	-178.8	161.5	-75.3	0	114.4	F590 P594 E595 V596 P637	F590-K592 PolarHBondContact O-N 3.4Å; K592-P594 VanDerWaalsContact C-CD 3.44Å; K592-P594 VanDerWaalsContact C-N 3.33Å; K592-E595 HydrophobicContact CB-CB 4.42Å; K592-E595 WeakPolarHBondContact CG-OE1 3.24Å; K592-E595 IonicContact NZ-OE1 2.72Å; K592-E595 PolarHBondContact NZ-OE1 2.89Å; K592-E595 IonicContact NZ-OE2 2.66Å; K592-E595 PolarHBondContact NZ-OE2 3.38Å; K592-E595 PolarHBondContact O-N 3.41Å; K592-V596 PolarHBondContact O-N 3.39Å; K592-V596 VanDerWaalsContact O-N 3.13Å; K592-P637 HydrophobicContact CD-CB 4.11Å; K592-P637 HydrophobicContact CD-CG 3.69Å
593	L	94.9	Very high	94.2	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-52.8	-38.5	-175	-164.5	63	0	0	0	115	L564 A567 V568 F590 V596 K597 Y638 L681 P684	L564-L593 HydrophobicContact CD2-CD1 3.8Å; A567-L593 HydrophobicContact CB-CD2 3.69Å; V568-L593 HydrophobicContact CG2-CD2 4.35Å; V568-L593 HydrophobicContact CG2-CG 4.19Å; F590-L593 HydrophobicContact CD1-CD2 4.15Å; F590-L593 WeakPolarHBondContact O-CB 3.49Å; F590-L593 PolarHBondContact O-N 2.7Å; L593-V596 WeakPolarHBondContact O-CB 3.37Å; L593-V596 PolarHBondContact O-N 3.17Å; L593-K597 PolarHBondContact O-N 2.62Å; L593-Y638 HydrophobicContact CB-CE2 3.93Å; L593-Y638 HydrophobicContact CD1-CE2 3.81Å; L593-Y638 HydrophobicContact CG-CE2 4.46Å; L593-L681 HydrophobicContact CD2-CD2 4.3Å; L593-P684 HydrophobicContact CD1-CG 3.96Å
594	P	95	Very high	94.5	Very high	40 Å²	40	39 Å²	39	26%	0.26	18%	0.184	S	C	.	.	H	α-helix	trans	-63.3	-43.5	175.2	-24.6	37.1	0	0	0	112.8	M572 K592 V596 K597 D598	M572-P594 HydrophobicContact CE-CG 3.65Å; M572-P594 HydrophobicContact SD-CG 3.58Å; M572-P594 VanDerWaalsContact SD-CG 3.58Å; K592-P594 VanDerWaalsContact C-CD 3.44Å; K592-P594 VanDerWaalsContact C-N 3.33Å; P594-V596 PolarHBondContact O-N 3.31Å; P594-K597 WeakPolarHBondContact O-CB 3.36Å; P594-K597 PolarHBondContact O-N 3.35Å; P594-K597 VanDerWaalsContact O-N 3.09Å; P594-D598 VanDerWaalsContact O-CG 3.23Å; P594-D598 PolarHBondContact O-N 3.29Å
595	E	96.6	Very high	94.8	Very high	74 Å²	74	39.2 Å²	39.2	35%	0.346	19%	0.185	S	C	.	.	H	α-helix	trans	-63.4	-30.2	176.7	-63.7	171.9	-131.9	0	0	112.2	K592 V599 V634	K592-E595 HydrophobicContact CB-CB 4.42Å; K592-E595 WeakPolarHBondContact CG-OE1 3.24Å; K592-E595 IonicContact NZ-OE1 2.72Å; K592-E595 PolarHBondContact NZ-OE1 2.89Å; K592-E595 IonicContact NZ-OE2 2.66Å; K592-E595 PolarHBondContact NZ-OE2 3.38Å; K592-E595 PolarHBondContact O-N 3.41Å; E595-V599 VanDerWaalsContact O-CG2 3.31Å; E595-V599 WeakPolarHBondContact O-CG2 3.18Å; E595-V599 PolarHBondContact O-N 2.85Å; E595-V634 HydrophobicContact CB-CB 4.34Å; E595-V634 HydrophobicContact CB-CG1 3.86Å
596	V	97.3	Very high	95	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-68.8	-46.5	172.4	178.9	0	0	0	0	110.6	Y560 L564 K592 L593 P594 V599 S600 V634 Y635 Y638 P684	Y560-V596 WeakPolarHBondContact OH-CG1 3.47Å; L564-V596 HydrophobicContact CD1-CG1 4.01Å; K592-V596 PolarHBondContact O-N 3.39Å; K592-V596 VanDerWaalsContact O-N 3.13Å; L593-V596 WeakPolarHBondContact O-CB 3.37Å; L593-V596 PolarHBondContact O-N 3.17Å; P594-V596 PolarHBondContact O-N 3.31Å; V596-V599 PolarHBondContact O-N 3.04Å; V596-S600 PolarHBondContact O-N 3.42Å; V596-V634 HydrophobicContact CB-CG2 4.47Å; V596-V634 HydrophobicContact CG2-CB 4.09Å; V596-V634 HydrophobicContact CG2-CG2 4.05Å; V596-Y635 HydrophobicContact CG1-CD2 4.41Å; V596-Y635 HydrophobicContact CG1-CE1 4.24Å; V596-Y635 HydrophobicContact CG1-CE2 3.8Å; V596-Y638 HydrophobicContact CG2-CD2 4.2Å; V596-Y638 HydrophobicContact CG2-CG 4.3Å; V596-P684 HydrophobicContact CG1-CB 4.17Å; V596-P684 HydrophobicContact CG1-CG 4.05Å
597	K	96.9	Very high	95.2	Very high	16 Å²	16	38 Å²	38	7%	0.07	18%	0.182	C	C	.	.	H	α-helix	trans	-56.3	-53.5	173.7	-179.7	-177.2	174.1	-69.2	0	110.7	I561 L564 T565 V568 L593 P594 V599 S600 E601	I561-K597 HydrophobicContact CD1-CG 4.31Å; L564-K597 HydrophobicContact CB-CB 4.27Å; L564-K597 HydrophobicContact CB-CG 4.33Å; L564-K597 HydrophobicContact CD1-CB 4.09Å; T565-K597 VanDerWaalsContact OG1-CE 3.26Å; T565-K597 WeakPolarHBondContact OG1-CE 3.47Å; V568-K597 HydrophobicContact CB-CD 4.2Å; V568-K597 HydrophobicContact CG1-CD 4.45Å; V568-K597 HydrophobicContact CG2-CB 4.42Å; V568-K597 HydrophobicContact CG2-CD 4.03Å; L593-K597 PolarHBondContact O-N 2.62Å; P594-K597 WeakPolarHBondContact O-CB 3.36Å; P594-K597 PolarHBondContact O-N 3.35Å; P594-K597 VanDerWaalsContact O-N 3.09Å; K597-V599 VanDerWaalsContact C-N 3.27Å; K597-V599 PolarHBondContact O-N 2.85Å; K597-S600 PolarHBondContact O-N 3.08Å; K597-E601 IonicContact NZ-OE1 3.08Å; K597-E601 IonicContact NZ-OE2 3.64Å; K597-E601 PolarHBondContact NZ-OE2 3Å; K597-E601 VanDerWaalsContact O-CB 3.24Å; K597-E601 WeakPolarHBondContact O-CB 3.15Å; K597-E601 PolarHBondContact O-N 3.17Å
598	D	96.8	Very high	95.2	Very high	79 Å²	79	32.7 Å²	32.7	42%	0.422	16%	0.157	S	C	.	.	H	α-helix	trans	-59.4	-35.6	-176.1	-63.8	-15.8	0	0	0	113	P594 R602	P594-D598 VanDerWaalsContact O-CG 3.23Å; P594-D598 PolarHBondContact O-N 3.29Å; D598-R602 PolarHBondContact O-N 3.47Å; D598-R602 PolarHBondContact O-NE 3.05Å; D598-R602 VanDerWaalsContact O-NE 3.12Å; D598-R602 PolarHBondContact O-NH2 3.49Å
599	V	97.8	Very high	95.3	Very high	1 Å²	1	36.5 Å²	36.5	1%	0.006	18%	0.176	C	C	.	.	H	α-helix	trans	-72.6	-49.4	176.6	169.4	0	0	0	0	111	E595 V596 K597 E601 R602 F603 A630 L631 V634	E595-V599 VanDerWaalsContact O-CG2 3.31Å; E595-V599 WeakPolarHBondContact O-CG2 3.18Å; E595-V599 PolarHBondContact O-N 2.85Å; V596-V599 PolarHBondContact O-N 3.04Å; K597-V599 VanDerWaalsContact C-N 3.27Å; K597-V599 PolarHBondContact O-N 2.85Å; V599-E601 PolarHBondContact O-N 3.43Å; V599-R602 PolarHBondContact O-N 3.27Å; V599-F603 WeakPolarHBondContact O-CB 3.37Å; V599-F603 PolarHBondContact O-N 3.3Å; V599-A630 HydrophobicContact CG1-CB 3.87Å; V599-A630 HydrophobicContact CG2-CB 4.42Å; V599-L631 HydrophobicContact CG1-CD2 3.93Å; V599-L631 HydrophobicContact CG1-CG 4.4Å; V599-V634 HydrophobicContact CB-CG2 4.04Å; V599-V634 HydrophobicContact CG1-CG2 4.3Å; V599-V634 HydrophobicContact CG2-CG1 3.88Å; V599-V634 HydrophobicContact CG2-CG2 3.99Å
600	S	96.4	Very high	95.3	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-64.7	-27.1	177.8	-94.9	0	0	0	0	113.1	E557 Y560 I561 V596 K597 F603 L604 Y635	E557-S600 WeakPolarHBondContact OE1-CB 3.3Å; E557-S600 PolarHBondContact OE1-OG 2.95Å; Y560-S600 VanDerWaalsContact CE1-OG 3.32Å; Y560-S600 WeakPolarHBondContact CE1-OG 3.47Å; I561-S600 VanDerWaalsContact CD1-CB 3.45Å; V596-S600 PolarHBondContact O-N 3.42Å; K597-S600 PolarHBondContact O-N 3.08Å; S600-F603 PolarHBondContact O-N 3.02Å; S600-L604 WeakPolarHBondContact O-CB 3.21Å; S600-L604 PolarHBondContact O-N 3.18Å; S600-Y635 PolarHBondContact OG-OH 3.24Å
601	E	95.9	Very high	95.1	Very high	42 Å²	42	39.6 Å²	39.6	20%	0.196	19%	0.188	C	C	.	.	H	α-helix	trans	-75.6	-37.1	-178.9	-174.7	165.4	-166.4	0	0	110.9	I561 K597 V599 Q605	I561-E601 HydrophobicContact CD1-CB 3.93Å; I561-E601 HydrophobicContact CG1-CB 4.45Å; K597-E601 IonicContact NZ-OE1 3.08Å; K597-E601 IonicContact NZ-OE2 3.64Å; K597-E601 PolarHBondContact NZ-OE2 3Å; K597-E601 VanDerWaalsContact O-CB 3.24Å; K597-E601 WeakPolarHBondContact O-CB 3.15Å; K597-E601 PolarHBondContact O-N 3.17Å; V599-E601 PolarHBondContact O-N 3.43Å; E601-Q605 WeakPolarHBondContact O-CG 3.32Å; E601-Q605 PolarHBondContact O-N 3.22Å
602	R	97.1	Very high	95	Very high	101 Å²	101	41.5 Å²	41.5	38%	0.381	19%	0.194	S	C	.	.	H	α-helix	trans	-67.8	-42.4	168.3	-78	177.2	-83.2	95.8	1.8	112.2	D598 V599 L604 Q605 D606	D598-R602 PolarHBondContact O-N 3.47Å; D598-R602 PolarHBondContact O-NE 3.05Å; D598-R602 VanDerWaalsContact O-NE 3.12Å; D598-R602 PolarHBondContact O-NH2 3.49Å; V599-R602 PolarHBondContact O-N 3.27Å; R602-L604 VanDerWaalsContact C-N 3.31Å; R602-L604 PolarHBondContact O-N 3.37Å; R602-Q605 WeakPolarHBondContact O-CB 3.19Å; R602-Q605 PolarHBondContact O-N 2.65Å; R602-Q605 VanDerWaalsContact O-N 3.16Å; R602-D606 PolarHBondContact O-N 3.5Å
603	F	97.9	Very high	95.1	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-58.5	-43	174	174.3	-129.7	0	0	0	111.8	L553 E557 V599 S600 D606 L607 I623 V624 H627 L691	L553-F603 HydrophobicContact CD2-CZ 4.06Å; E557-F603 VanDerWaalsContact CD-CD1 3.46Å; E557-F603 HydrophobicContact CG-CD1 3.79Å; E557-F603 HydrophobicContact CG-CE1 4.04Å; E557-F603 WeakPolarHBondContact OE2-CE1 3.29Å; V599-F603 WeakPolarHBondContact O-CB 3.37Å; V599-F603 PolarHBondContact O-N 3.3Å; S600-F603 PolarHBondContact O-N 3.02Å; F603-D606 PolarHBondContact O-N 3.31Å; F603-L607 HydrophobicContact CD1-CD1 4.28Å; F603-L607 HydrophobicContact CD2-CD1 4.19Å; F603-L607 HydrophobicContact CD2-CG 4.3Å; F603-L607 HydrophobicContact CE1-CD1 3.93Å; F603-L607 HydrophobicContact CE2-CD1 3.83Å; F603-L607 HydrophobicContact CE2-CD2 4.27Å; F603-L607 HydrophobicContact CE2-CG 4.05Å; F603-L607 HydrophobicContact CG-CD1 4.4Å; F603-L607 HydrophobicContact CZ-CD1 3.69Å; F603-L607 HydrophobicContact CZ-CG 4.39Å; F603-L607 VanDerWaalsContact O-CG 3.28Å; F603-L607 WeakPolarHBondContact O-CG 3.49Å; F603-L607 PolarHBondContact O-N 3.46Å; F603-L607 VanDerWaalsContact O-N 3.1Å; F603-I623 HydrophobicContact CD2-CG2 3.94Å; F603-I623 HydrophobicContact CE2-CG2 4Å; F603-V624 HydrophobicContact CE2-CG2 3.95Å; F603-V624 HydrophobicContact CZ-CG2 3.82Å; F603-H627 VanDerWaalsContact CA-CE1 3.49Å; F603-H627 WeakPolarHBondContact CA-CE1 3.17Å; F603-H627 HydrophobicContact CD2-CB 3.88Å; F603-H627 AromaticContact CD2-CD2 3.76Å; F603-H627 AromaticContact CD2-CG 3.71Å; F603-H627 HydrophobicContact CE2-CB 4.47Å; F603-H627 HydrophobicContact CG-CB 4.4Å; F603-H627 PolarHBondContact N-CE1 3.46Å; F603-L691 HydrophobicContact CE1-CD2 4.06Å; F603-L691 HydrophobicContact CZ-CD2 4.32Å
604	L	95.9	Very high	94.9	Very high	15 Å²	15	49.8 Å²	49.8	8%	0.079	23%	0.234	C	C	.	.	H	α-helix	trans	-62.5	-44	172.7	176.9	60.5	0	0	0	112.4	V554 E557 A558 I561 S600 R602 D606 L607 E608	V554-L604 HydrophobicContact CG1-CD1 4.5Å; E557-L604 HydrophobicContact CB-CD1 4.2Å; E557-L604 HydrophobicContact CG-CB 4Å; E557-L604 HydrophobicContact CG-CD1 4.38Å; A558-L604 HydrophobicContact CB-CD1 3.81Å; A558-L604 HydrophobicContact CB-CD2 3.97Å; I561-L604 HydrophobicContact CB-CD2 4.06Å; I561-L604 HydrophobicContact CG1-CB 4.49Å; I561-L604 HydrophobicContact CG1-CD2 4.11Å; I561-L604 HydrophobicContact CG2-CD2 4.16Å; S600-L604 WeakPolarHBondContact O-CB 3.21Å; S600-L604 PolarHBondContact O-N 3.18Å; R602-L604 VanDerWaalsContact C-N 3.31Å; R602-L604 PolarHBondContact O-N 3.37Å; L604-D606 VanDerWaalsContact C-N 3.32Å; L604-D606 PolarHBondContact O-N 2.96Å; L604-L607 PolarHBondContact O-N 2.93Å; L604-E608 HydrophobicContact CD1-CG 3.88Å; L604-E608 HydrophobicContact CG-CG 4.26Å; L604-E608 WeakPolarHBondContact O-CG 3.29Å; L604-E608 PolarHBondContact O-N 3.32Å
605	Q	95.3	Very high	94.5	Very high	105 Å²	105	49.1 Å²	49.1	49%	0.491	23%	0.228	S	C	.	.	H	α-helix	trans	-59.5	-41.9	178.7	-74.9	161.9	14.2	0	0	112	E601 R602 E608 H609	E601-Q605 WeakPolarHBondContact O-CG 3.32Å; E601-Q605 PolarHBondContact O-N 3.22Å; R602-Q605 WeakPolarHBondContact O-CB 3.19Å; R602-Q605 PolarHBondContact O-N 2.65Å; R602-Q605 VanDerWaalsContact O-N 3.16Å; Q605-E608 PolarHBondContact O-N 3.45Å; Q605-H609 VanDerWaalsContact O-CB 3.26Å; Q605-H609 WeakPolarHBondContact O-CB 3.48Å; Q605-H609 PolarHBondContact O-N 3.42Å
606	D	96.3	Very high	94	Very high	73 Å²	73	46.6 Å²	46.6	39%	0.39	22%	0.216	S	C	.	.	H	α-helix	trans	-67.4	-40.9	176.8	-68	-34.2	0	0	0	111.9	R602 F603 L604 R610 I623 H627	R602-D606 PolarHBondContact O-N 3.5Å; F603-D606 PolarHBondContact O-N 3.31Å; L604-D606 VanDerWaalsContact C-N 3.32Å; L604-D606 PolarHBondContact O-N 2.96Å; D606-R610 VanDerWaalsContact O-CB 3.24Å; D606-R610 WeakPolarHBondContact O-CB 3.48Å; D606-R610 PolarHBondContact O-N 2.94Å; D606-I623 HydrophobicContact CB-CG2 3.8Å; D606-H627 IonicContact OD2-CD2 3.3Å; D606-H627 IonicContact OD2-CE1 3.05Å; D606-H627 PolarHBondContact OD2-CE1 3.17Å; D606-H627 IonicContact OD2-NE2 2.79Å; D606-H627 PolarHBondContact OD2-NE2 3.08Å
607	L	95.3	Very high	93.4	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-62.7	-45.6	173.9	-71.5	172.7	0	0	0	112.5	L553 V554 E557 F603 L604 R610 L611 V620 I623	L553-L607 HydrophobicContact CD2-CD1 3.61Å; L553-L607 HydrophobicContact CD2-CD2 3.9Å; L553-L607 HydrophobicContact CD2-CG 4.44Å; V554-L607 HydrophobicContact CG1-CB 4.21Å; V554-L607 HydrophobicContact CG2-CB 4.18Å; V554-L607 HydrophobicContact CG2-CD2 4.42Å; E557-L607 HydrophobicContact CB-CD1 4.25Å; E557-L607 HydrophobicContact CG-CD1 4.43Å; F603-L607 HydrophobicContact CD1-CD1 4.28Å; F603-L607 HydrophobicContact CD2-CD1 4.19Å; F603-L607 HydrophobicContact CD2-CG 4.3Å; F603-L607 HydrophobicContact CE1-CD1 3.93Å; F603-L607 HydrophobicContact CE2-CD1 3.83Å; F603-L607 HydrophobicContact CE2-CD2 4.27Å; F603-L607 HydrophobicContact CE2-CG 4.05Å; F603-L607 HydrophobicContact CG-CD1 4.4Å; F603-L607 HydrophobicContact CZ-CD1 3.69Å; F603-L607 HydrophobicContact CZ-CG 4.39Å; F603-L607 VanDerWaalsContact O-CG 3.28Å; F603-L607 WeakPolarHBondContact O-CG 3.49Å; F603-L607 PolarHBondContact O-N 3.46Å; F603-L607 VanDerWaalsContact O-N 3.1Å; L604-L607 PolarHBondContact O-N 2.93Å; L607-R610 PolarHBondContact O-N 3.29Å; L607-L611 WeakPolarHBondContact O-CB 3.38Å; L607-L611 PolarHBondContact O-N 3.37Å; L607-V620 HydrophobicContact CD2-CB 3.69Å; L607-V620 HydrophobicContact CD2-CG1 3.67Å; L607-I623 HydrophobicContact CD2-CB 4.32Å; L607-I623 HydrophobicContact CD2-CD1 4.27Å; L607-I623 HydrophobicContact CD2-CG2 4.12Å; L607-I623 HydrophobicContact CG-CG2 4.24Å
608	E	93.1	Very high	93.2	Very high	11 Å²	11	52.2 Å²	52.2	5%	0.051	24%	0.237	C	C	.	.	H	α-helix	trans	-65.5	-43.8	176.7	-73.9	-155.9	145.8	0	0	111.5	R455 S457 L604 Q605 R610 L611 E612	R455-E608 IonicContact NH1-OE2 3.77Å; R455-E608 PolarHBondContact NH1-OE2 2.9Å; S457-E608 VanDerWaalsContact CA-OE1 3.3Å; S457-E608 WeakPolarHBondContact CA-OE1 3.2Å; S457-E608 WeakPolarHBondContact CB-OE1 3.39Å; S457-E608 PolarHBondContact OG-OE1 3.47Å; L604-E608 HydrophobicContact CD1-CG 3.88Å; L604-E608 HydrophobicContact CG-CG 4.26Å; L604-E608 WeakPolarHBondContact O-CG 3.29Å; L604-E608 PolarHBondContact O-N 3.32Å; Q605-E608 PolarHBondContact O-N 3.45Å; E608-R610 VanDerWaalsContact C-N 3.31Å; E608-R610 PolarHBondContact O-N 2.71Å; E608-L611 PolarHBondContact O-N 2.93Å; E608-E612 WeakPolarHBondContact O-CB 3.31Å; E608-E612 WeakPolarHBondContact O-CG 3.45Å; E608-E612 PolarHBondContact O-N 3.46Å
609	H	93.6	Very high	92.9	Very high	119 Å²	119	49.4 Å²	49.4	55%	0.551	22%	0.222	S	C	*	.	H	α-helix	trans	-61.8	-40.6	178	178.4	60.4	0	0	0	111.8	Q605 K613	Q605-H609 VanDerWaalsContact O-CB 3.26Å; Q605-H609 WeakPolarHBondContact O-CB 3.48Å; Q605-H609 PolarHBondContact O-N 3.42Å; H609-K613 WeakPolarHBondContact O-CB 3.21Å; H609-K613 PolarHBondContact O-N 3.01Å
610	R	93.8	Very high	92.8	Very high	68 Å²	68	49.4 Å²	49.4	26%	0.257	22%	0.222	S	C	.	.	H	α-helix	trans	-64.3	-41.3	175.1	176.3	64.3	67.9	84.1	-4.7	112.4	D606 L607 E608 K613 D614 F618 D619 D622 I623	D606-R610 VanDerWaalsContact O-CB 3.24Å; D606-R610 WeakPolarHBondContact O-CB 3.48Å; D606-R610 PolarHBondContact O-N 2.94Å; L607-R610 PolarHBondContact O-N 3.29Å; E608-R610 VanDerWaalsContact C-N 3.31Å; E608-R610 PolarHBondContact O-N 2.71Å; R610-K613 PolarHBondContact O-N 3.38Å; R610-D614 PolarHBondContact O-N 2.92Å; R610-F618 HydrophobicContact CG-CB 4.17Å; R610-D619 WeakPolarHBondContact CG-O 3.49Å; R610-D619 PolarHBondContact NH1-O 3.12Å; R610-D622 IonicContact CZ-OD1 2.88Å; R610-D622 IonicContact CZ-OD2 3.25Å; R610-D622 VanDerWaalsContact CZ-OD2 3.25Å; R610-D622 IonicContact NH1-OD1 2.93Å; R610-D622 PolarHBondContact NH1-OD1 3.02Å; R610-D622 IonicContact NH1-OD2 3.82Å; R610-D622 PolarHBondContact NH1-OD2 3.02Å; R610-D622 IonicContact NH2-OD1 2.92Å; R610-D622 IonicContact NH2-OD2 2.83Å; R610-D622 PolarHBondContact NH2-OD2 2.98Å; R610-I623 HydrophobicContact CB-CD1 3.59Å; R610-I623 HydrophobicContact CG-CD1 3.74Å
611	L	90.8	Very high	92.8	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-68.2	-44.8	175.3	179.5	63.8	0	0	0	111.8	F459 F551 V554 L607 E608 K613 D614 I615 F618	F459-L611 HydrophobicContact CD1-CD2 4.12Å; F459-L611 HydrophobicContact CD2-CD2 3.6Å; F459-L611 HydrophobicContact CD2-CG 4.43Å; F459-L611 HydrophobicContact CE1-CD2 4.08Å; F459-L611 HydrophobicContact CE1-CG 4.27Å; F459-L611 HydrophobicContact CE2-CB 4.38Å; F459-L611 HydrophobicContact CE2-CD2 3.56Å; F459-L611 HydrophobicContact CE2-CG 3.89Å; F459-L611 HydrophobicContact CG-CD2 3.89Å; F459-L611 HydrophobicContact CZ-CD2 3.8Å; F459-L611 HydrophobicContact CZ-CG 3.79Å; F551-L611 HydrophobicContact CD2-CD2 3.94Å; F551-L611 HydrophobicContact CE2-CD2 3.84Å; V554-L611 HydrophobicContact CG1-CD2 4.26Å; L607-L611 WeakPolarHBondContact O-CB 3.38Å; L607-L611 PolarHBondContact O-N 3.37Å; E608-L611 PolarHBondContact O-N 2.93Å; L611-K613 PolarHBondContact O-N 3.06Å; L611-D614 CarbonylContact O-C 3.52Å; L611-D614 PolarHBondContact O-N 3.39Å; L611-I615 HydrophobicContact CD1-CG2 4.11Å; L611-I615 WeakPolarHBondContact O-CA 3.36Å; L611-I615 WeakPolarHBondContact O-CG1 3.21Å; L611-I615 PolarHBondContact O-N 3.26Å; L611-F618 HydrophobicContact CD1-CD1 3.71Å; L611-F618 HydrophobicContact CD1-CD2 4.15Å; L611-F618 HydrophobicContact CD1-CE1 3.55Å; L611-F618 HydrophobicContact CD1-CE2 3.98Å; L611-F618 HydrophobicContact CD1-CG 4.05Å; L611-F618 HydrophobicContact CD1-CZ 3.7Å
612	E	89.9	Confident	92.8	Very high	66 Å²	66	49.6 Å²	49.6	31%	0.308	23%	0.225	S	C	.	.	H	α-helix	trans	-58.4	-31.7	174.4	-77.1	-177.1	-175.8	0	0	112.3	R455 R458 F459 E608	R455-E612 IonicContact CZ-OE1 2.81Å; R455-E612 VanDerWaalsContact CZ-OE1 3.3Å; R455-E612 IonicContact NH1-OE1 3.79Å; R455-E612 PolarHBondContact NH1-OE1 2.84Å; R455-E612 IonicContact NH2-OE1 3.7Å; R455-E612 PolarHBondContact NH2-OE1 2.83Å; R455-E612 IonicContact NH2-OE2 2.78Å; R458-E612 WeakPolarHBondContact CD-OE1 3.44Å; F459-E612 HydrophobicContact CE2-CG 3.95Å; F459-E612 HydrophobicContact CZ-CG 4.03Å; E608-E612 WeakPolarHBondContact O-CB 3.31Å; E608-E612 WeakPolarHBondContact O-CG 3.45Å; E608-E612 PolarHBondContact O-N 3.46Å
613	K	90.9	Very high	92.8	Very high	165 Å²	165	45.3 Å²	45.3	72%	0.717	21%	0.209	S	C	*	.	H	α-helix	trans	-76.4	-39.5	-179.1	-176.8	179.4	178.2	-178.4	0	114.2	H609 R610 L611	H609-K613 WeakPolarHBondContact O-CB 3.21Å; H609-K613 PolarHBondContact O-N 3.01Å; R610-K613 PolarHBondContact O-N 3.38Å; L611-K613 PolarHBondContact O-N 3.06Å
614	D	89.8	Confident	92.8	Very high	71 Å²	71	45.3 Å²	45.3	38%	0.38	21%	0.209	S	C	.	.			trans	-148.5	87	175.8	-172.1	-17	0	0	0	110.8	R610 L611 L616 R617 F618	R610-D614 PolarHBondContact O-N 2.92Å; L611-D614 CarbonylContact O-C 3.52Å; L611-D614 PolarHBondContact O-N 3.39Å; D614-L616 PolarHBondContact O-N 2.81Å; D614-L616 VanDerWaalsContact O-N 3.09Å; D614-L616 PolarHBondContact OD1-N 3.05Å; D614-R617 PolarHBondContact OD1-N 2.73Å; D614-F618 VanDerWaalsContact O-CB 3.29Å; D614-F618 WeakPolarHBondContact O-CB 3.3Å; D614-F618 PolarHBondContact O-N 3.29Å; D614-F618 VanDerWaalsContact O-N 3.1Å
615	I	87.8	Confident	92.9	Very high	26 Å²	26	46.9 Å²	46.9	13%	0.133	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-18.1	-177.6	-45.5	170.3	0	0	0	111.4	W524 I527 D529 V530 L611	W524-I615 PolarHBondContact NE1-O 3.39Å; I527-I615 HydrophobicContact CD1-CG2 4.17Å; I527-I615 HydrophobicContact CG2-CG2 4.34Å; D529-I615 HydrophobicContact CB-CD1 3.54Å; D529-I615 WeakPolarHBondContact OD2-CD1 3.38Å; V530-I615 HydrophobicContact CG2-CB 4.44Å; V530-I615 HydrophobicContact CG2-CG2 3.47Å; V530-I615 VanDerWaalsContact CG2-CG2 3.47Å; L611-I615 HydrophobicContact CD1-CG2 4.11Å; L611-I615 WeakPolarHBondContact O-CA 3.36Å; L611-I615 WeakPolarHBondContact O-CG1 3.21Å; L611-I615 PolarHBondContact O-N 3.26Å
616	L	86.2	Confident	93	Very high	21 Å²	21	47.8 Å²	47.8	11%	0.11	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.7	-31.7	-175.1	-65.2	-178	0	0	0	114.3	W524 V530 Q535 F539 Q547 D614	W524-L616 HydrophobicContact CZ2-CD2 4.04Å; V530-L616 HydrophobicContact CB-CD2 4.43Å; V530-L616 HydrophobicContact CG1-CD2 4.05Å; V530-L616 HydrophobicContact CG2-CD2 4.24Å; Q535-L616 HydrophobicContact CB-CD1 4.23Å; Q535-L616 HydrophobicContact CG-CD1 4.49Å; F539-L616 HydrophobicContact CE2-CD2 4.28Å; F539-L616 HydrophobicContact CZ-CB 4.17Å; F539-L616 WeakPolarHBondContact CZ-O 3.09Å; Q547-L616 PolarHBondContact NE2-O 2.78Å; Q547-L616 VanDerWaalsContact NE2-O 3.07Å; D614-L616 PolarHBondContact O-N 2.81Å; D614-L616 VanDerWaalsContact O-N 3.09Å; D614-L616 PolarHBondContact OD1-N 3.05Å
617	R	84.8	Confident	93.1	Very high	130 Å²	130	45.3 Å²	45.3	49%	0.491	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-135.6	22.8	-172.6	-65.6	-175.9	171.3	80.4	5	114.5	F539 D614	F539-R617 HydrophobicContact CZ-CG 4.45Å; D614-R617 PolarHBondContact OD1-N 2.73Å
618	F	91.4	Very high	93.2	Very high	3 Å²	3	45.3 Å²	45.3	1%	0.013	21%	0.212	C	C	.	.			trans	-54.8	154.1	172.7	68.4	-68.4	0	0	0	114.2	W524 K550 F551 V554 R610 L611 D614 V620	W524-F618 AromaticContact CD1-CE1 3.97Å; W524-F618 AromaticContact NE1-CE1 3.91Å; K550-F618 HydrophobicContact CB-CD2 4.38Å; K550-F618 HydrophobicContact CB-CE2 3.59Å; K550-F618 HydrophobicContact CB-CZ 3.73Å; K550-F618 VanDerWaalsContact CD-O 3.26Å; K550-F618 WeakPolarHBondContact CD-O 3.37Å; K550-F618 PolarHBondContact NZ-O 3.38Å; F551-F618 HydrophobicContact CB-CZ 4.23Å; V554-F618 HydrophobicContact CG2-CE2 4.33Å; R610-F618 HydrophobicContact CG-CB 4.17Å; L611-F618 HydrophobicContact CD1-CD1 3.71Å; L611-F618 HydrophobicContact CD1-CD2 4.15Å; L611-F618 HydrophobicContact CD1-CE1 3.55Å; L611-F618 HydrophobicContact CD1-CE2 3.98Å; L611-F618 HydrophobicContact CD1-CG 4.05Å; L611-F618 HydrophobicContact CD1-CZ 3.7Å; D614-F618 VanDerWaalsContact O-CB 3.29Å; D614-F618 WeakPolarHBondContact O-CB 3.3Å; D614-F618 PolarHBondContact O-N 3.29Å; D614-F618 VanDerWaalsContact O-N 3.1Å; F618-V620 HydrophobicContact CD2-CG1 3.77Å; F618-V620 HydrophobicContact CE2-CG1 3.9Å
619	D	90.9	Very high	93.4	Very high	21 Å²	21	49 Å²	49	11%	0.112	24%	0.236	C	C	.	.			trans	-124.8	156.3	160.6	-169.5	50.1	0	0	0	111.2	K550 R610 C621	K550-D619 WeakPolarHBondContact CE-OD1 3.32Å; K550-D619 IonicContact NZ-OD1 3.34Å; K550-D619 PolarHBondContact NZ-OD1 2.89Å; R610-D619 WeakPolarHBondContact CG-O 3.49Å; R610-D619 PolarHBondContact NH1-O 3.12Å; D619-C621 PolarHBondContact OD2-N 3.07Å
620	V	95.8	Very high	93.6	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	22%	0.218	C	C	.	.			trans	-127.4	-10.8	-175.7	-61.2	0	0	0	0	113.4	K550 L553 V554 L607 F618 I623 V624 I698	K550-V620 HydrophobicContact CB-CG2 4.33Å; K550-V620 HydrophobicContact CG-CG2 4.27Å; L553-V620 HydrophobicContact CD1-CG2 4.09Å; V554-V620 HydrophobicContact CG2-CG1 4.18Å; L607-V620 HydrophobicContact CD2-CB 3.69Å; L607-V620 HydrophobicContact CD2-CG1 3.67Å; F618-V620 HydrophobicContact CD2-CG1 3.77Å; F618-V620 HydrophobicContact CE2-CG1 3.9Å; V620-I623 PolarHBondContact O-N 2.97Å; V620-V624 VanDerWaalsContact O-CG2 3.3Å; V620-V624 WeakPolarHBondContact O-CG2 3.36Å; V620-V624 PolarHBondContact O-N 3.12Å; V620-I698 HydrophobicContact CG2-CD1 3.67Å
621	C	96.1	Very high	93.7	Very high	0 Å²	0	41 Å²	41	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-77.1	-28.3	-171.4	-75.3	0	0	0	0	112.6	D619 L625 T711 A712 A715	D619-C621 PolarHBondContact OD2-N 3.07Å; C621-L625 PolarHBondContact O-N 2.92Å; C621-L625 VanDerWaalsContact O-N 3.14Å; C621-T711 HydrophobicContact CB-CG2 4.15Å; C621-A712 HydrophobicContact CB-CB 4.11Å; C621-A715 WeakPolarHBondContact O-CB 3.2Å
622	D	96.1	Very high	94	Very high	47 Å²	47	45.2 Å²	45.2	25%	0.251	22%	0.222	S	C	.	.	H	α-helix	trans	-63.7	-49	168.6	61	-23.4	0	0	0	111.4	R610 V624 L625 D626 T711	R610-D622 IonicContact CZ-OD1 2.88Å; R610-D622 IonicContact CZ-OD2 3.25Å; R610-D622 VanDerWaalsContact CZ-OD2 3.25Å; R610-D622 IonicContact NH1-OD1 2.93Å; R610-D622 PolarHBondContact NH1-OD1 3.02Å; R610-D622 IonicContact NH1-OD2 3.82Å; R610-D622 PolarHBondContact NH1-OD2 3.02Å; R610-D622 IonicContact NH2-OD1 2.92Å; R610-D622 IonicContact NH2-OD2 2.83Å; R610-D622 PolarHBondContact NH2-OD2 2.98Å; D622-V624 VanDerWaalsContact C-N 3.31Å; D622-V624 PolarHBondContact O-N 3.38Å; D622-L625 WeakPolarHBondContact O-CB 3.35Å; D622-L625 PolarHBondContact O-N 3.41Å; D622-D626 PolarHBondContact O-N 3.27Å; D622-T711 HydrophobicContact CB-CG2 3.98Å
623	I	97.8	Very high	94.3	Very high	11 Å²	11	49.3 Å²	49.3	6%	0.056	23%	0.234	C	C	.	.	H	α-helix	trans	-60.4	-40.8	178.1	-60.6	166.5	0	0	0	111	F603 D606 L607 R610 V620 L625 D626 H627	F603-I623 HydrophobicContact CD2-CG2 3.94Å; F603-I623 HydrophobicContact CE2-CG2 4Å; D606-I623 HydrophobicContact CB-CG2 3.8Å; L607-I623 HydrophobicContact CD2-CB 4.32Å; L607-I623 HydrophobicContact CD2-CD1 4.27Å; L607-I623 HydrophobicContact CD2-CG2 4.12Å; L607-I623 HydrophobicContact CG-CG2 4.24Å; R610-I623 HydrophobicContact CB-CD1 3.59Å; R610-I623 HydrophobicContact CG-CD1 3.74Å; V620-I623 PolarHBondContact O-N 2.97Å; I623-L625 VanDerWaalsContact C-N 3.34Å; I623-L625 PolarHBondContact O-N 2.85Å; I623-D626 PolarHBondContact O-N 2.76Å; I623-H627 PolarHBondContact O-CD2 3.12Å; I623-H627 VanDerWaalsContact O-CD2 3.29Å; I623-H627 PolarHBondContact O-N 3.11Å; I623-H627 VanDerWaalsContact O-N 3.07Å
624	V	97.8	Very high	94.5	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-59.6	-45	173.9	172.4	0	0	0	0	111.4	L553 F603 V620 D622 H627 C628 V695 A715 L719	L553-V624 HydrophobicContact CD1-CG2 3.94Å; L553-V624 HydrophobicContact CD2-CG2 4.35Å; F603-V624 HydrophobicContact CE2-CG2 3.95Å; F603-V624 HydrophobicContact CZ-CG2 3.82Å; V620-V624 VanDerWaalsContact O-CG2 3.3Å; V620-V624 WeakPolarHBondContact O-CG2 3.36Å; V620-V624 PolarHBondContact O-N 3.12Å; D622-V624 VanDerWaalsContact C-N 3.31Å; D622-V624 PolarHBondContact O-N 3.38Å; V624-H627 PolarHBondContact O-N 2.93Å; V624-C628 PolarHBondContact O-N 2.76Å; V624-C628 VanDerWaalsContact O-N 3.07Å; V624-C628 PolarHBondContact O-SG 2.83Å; V624-V695 HydrophobicContact CG1-CG2 4.07Å; V624-V695 HydrophobicContact CG2-CG2 4.3Å; V624-A715 HydrophobicContact CB-CB 4.28Å; V624-A715 HydrophobicContact CG1-CB 3.99Å; V624-L719 HydrophobicContact CG1-CD1 3.71Å; V624-L719 HydrophobicContact CG1-CG 4.22Å
625	L	96.9	Very high	94.8	Very high	48 Å²	48	38 Å²	38	25%	0.251	18%	0.182	S	C	.	.	H	α-helix	trans	-65.6	-42.7	-179.3	-177.9	60.3	0	0	0	111.8	C621 D622 I623 H627 C628 K714 A715 E718	C621-L625 PolarHBondContact O-N 2.92Å; C621-L625 VanDerWaalsContact O-N 3.14Å; D622-L625 WeakPolarHBondContact O-CB 3.35Å; D622-L625 PolarHBondContact O-N 3.41Å; I623-L625 VanDerWaalsContact C-N 3.34Å; I623-L625 PolarHBondContact O-N 2.85Å; L625-H627 VanDerWaalsContact C-N 3.3Å; L625-H627 PolarHBondContact O-N 3.36Å; L625-C628 WeakPolarHBondContact O-CB 3.44Å; L625-C628 PolarHBondContact O-N 3.08Å; L625-K714 HydrophobicContact CD1-CB 4.27Å; L625-K714 HydrophobicContact CD2-CB 3.81Å; L625-A715 HydrophobicContact CB-CB 4.24Å; L625-E718 HydrophobicContact CD1-CB 4.33Å; L625-E718 HydrophobicContact CD1-CG 4.08Å
626	D	97.9	Very high	95.1	Very high	124 Å²	124	38.8 Å²	38.8	66%	0.663	19%	0.186	S	C	*	.	H	α-helix	trans	-64.9	-32.7	177.5	-72.3	-21.4	0	0	0	112.4	D622 I623 P629	D622-D626 PolarHBondContact O-N 3.27Å; I623-D626 PolarHBondContact O-N 2.76Å; D626-P629 WeakPolarHBondContact O-CD 3.33Å
627	H	98.1	Very high	95.4	Very high	20 Å²	20	39.2 Å²	39.2	9%	0.093	19%	0.19	C	C	.	.	H	α-helix	trans	-84	-16.9	176.7	-82.9	-91.6	0	0	0	114.6	F603 D606 I623 V624 L625 P629 A630 L631	F603-H627 VanDerWaalsContact CA-CE1 3.49Å; F603-H627 WeakPolarHBondContact CA-CE1 3.17Å; F603-H627 HydrophobicContact CD2-CB 3.88Å; F603-H627 AromaticContact CD2-CD2 3.76Å; F603-H627 AromaticContact CD2-CG 3.71Å; F603-H627 HydrophobicContact CE2-CB 4.47Å; F603-H627 HydrophobicContact CG-CB 4.4Å; F603-H627 PolarHBondContact N-CE1 3.46Å; D606-H627 IonicContact OD2-CD2 3.3Å; D606-H627 IonicContact OD2-CE1 3.05Å; D606-H627 PolarHBondContact OD2-CE1 3.17Å; D606-H627 IonicContact OD2-NE2 2.79Å; D606-H627 PolarHBondContact OD2-NE2 3.08Å; I623-H627 PolarHBondContact O-CD2 3.12Å; I623-H627 VanDerWaalsContact O-CD2 3.29Å; I623-H627 PolarHBondContact O-N 3.11Å; I623-H627 VanDerWaalsContact O-N 3.07Å; V624-H627 PolarHBondContact O-N 2.93Å; L625-H627 VanDerWaalsContact C-N 3.3Å; L625-H627 PolarHBondContact O-N 3.36Å; H627-P629 VanDerWaalsContact C-CD 3.49Å; H627-A630 WeakPolarHBondContact O-CB 3.41Å; H627-A630 PolarHBondContact O-N 2.67Å; H627-L631 HydrophobicContact CB-CD1 4.32Å; H627-L631 HydrophobicContact CB-CG 4.44Å; H627-L631 WeakPolarHBondContact O-CG 3.47Å; H627-L631 PolarHBondContact O-N 2.94Å
628	C	97.8	Very high	95.8	Very high	1 Å²	1	33 Å²	33	1%	0.007	17%	0.166	C	C	.	.	H	α-helix	trans	-48.1	-44.7	179.2	-86.5	0	0	0	0	114.5	V624 L625 A630 L631 R632 E718 I722	V624-C628 PolarHBondContact O-N 2.76Å; V624-C628 VanDerWaalsContact O-N 3.07Å; V624-C628 PolarHBondContact O-SG 2.83Å; L625-C628 WeakPolarHBondContact O-CB 3.44Å; L625-C628 PolarHBondContact O-N 3.08Å; C628-A630 VanDerWaalsContact C-N 3.34Å; C628-A630 PolarHBondContact O-N 2.91Å; C628-L631 PolarHBondContact O-N 3.22Å; C628-R632 WeakPolarHBondContact O-CB 3.38Å; C628-R632 PolarHBondContact O-N 2.8Å; C628-E718 HydrophobicContact CB-CB 4.13Å; C628-I722 HydrophobicContact CB-CD1 4.03Å; C628-I722 WeakPolarHBondContact O-CD1 3.36Å
629	P	97.7	Very high	95.9	Very high	88 Å²	88	33.1 Å²	33.1	57%	0.571	17%	0.167	S	C	*	.	H	α-helix	trans	-63.6	-34.8	176.5	-23.3	35.1	0	0	0	114	D626 H627 R633	D626-P629 WeakPolarHBondContact O-CD 3.33Å; H627-P629 VanDerWaalsContact C-CD 3.49Å; P629-R633 PolarHBondContact O-N 2.86Å
630	A	97.2	Very high	95.8	Very high	20 Å²	20	32.4 Å²	32.4	17%	0.165	16%	0.164	C	C	.	.	H	α-helix	trans	-74.3	-43.1	177.3	0	0	0	0	0	111.4	V599 H627 C628 R633 V634	V599-A630 HydrophobicContact CG1-CB 3.87Å; V599-A630 HydrophobicContact CG2-CB 4.42Å; H627-A630 WeakPolarHBondContact O-CB 3.41Å; H627-A630 PolarHBondContact O-N 2.67Å; C628-A630 VanDerWaalsContact C-N 3.34Å; C628-A630 PolarHBondContact O-N 2.91Å; A630-R633 PolarHBondContact O-N 2.87Å; A630-V634 PolarHBondContact O-N 2.9Å
631	L	96.4	Very high	95.6	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-58.2	-51.8	173.1	-66.1	170.5	0	0	0	110.4	V599 H627 C628 R633 V634 Y635 L691	V599-L631 HydrophobicContact CG1-CD2 3.93Å; V599-L631 HydrophobicContact CG1-CG 4.4Å; H627-L631 HydrophobicContact CB-CD1 4.32Å; H627-L631 HydrophobicContact CB-CG 4.44Å; H627-L631 WeakPolarHBondContact O-CG 3.47Å; H627-L631 PolarHBondContact O-N 2.94Å; C628-L631 PolarHBondContact O-N 3.22Å; L631-R633 VanDerWaalsContact C-N 3.27Å; L631-R633 PolarHBondContact O-N 3.43Å; L631-V634 PolarHBondContact O-N 3.29Å; L631-Y635 HydrophobicContact CB-CD2 4.25Å; L631-Y635 HydrophobicContact CD2-CD2 4.05Å; L631-Y635 HydrophobicContact CD2-CE2 3.48Å; L631-Y635 VanDerWaalsContact CD2-CE2 3.48Å; L631-Y635 WeakPolarHBondContact O-CB 3.35Å; L631-Y635 VanDerWaalsContact O-CD2 3.3Å; L631-Y635 WeakPolarHBondContact O-CD2 3.33Å; L631-Y635 PolarHBondContact O-N 3.39Å; L631-L691 HydrophobicContact CD1-CD1 4.38Å
632	R	96.6	Very high	95.2	Very high	88 Å²	88	35 Å²	35	33%	0.332	18%	0.177	S	C	.	.	H	α-helix	trans	-47.4	-48.4	174.5	-178.8	-173.2	175.6	107.1	11	111.9	C628 V634 L636 I722 E725	C628-R632 WeakPolarHBondContact O-CB 3.38Å; C628-R632 PolarHBondContact O-N 2.8Å; R632-V634 PolarHBondContact O-N 2.82Å; R632-L636 WeakPolarHBondContact O-CB 3.49Å; R632-L636 PolarHBondContact O-N 2.98Å; R632-I722 HydrophobicContact CB-CD1 3.98Å; R632-I722 HydrophobicContact CB-CG1 3.94Å; R632-I722 HydrophobicContact CG-CG1 4.26Å; R632-E725 VanDerWaalsContact CZ-CD 3.42Å; R632-E725 IonicContact CZ-OE1 2.8Å; R632-E725 IonicContact CZ-OE2 2.69Å; R632-E725 IonicContact NE-OE2 3.74Å; R632-E725 IonicContact NH1-OE1 3.17Å; R632-E725 PolarHBondContact NH1-OE1 2.91Å; R632-E725 IonicContact NH1-OE2 3.69Å; R632-E725 PolarHBondContact NH1-OE2 2.67Å; R632-E725 IonicContact NH2-OE1 2.83Å; R632-E725 PolarHBondContact NH2-OE1 3.17Å; R632-E725 IonicContact NH2-OE2 2.89Å; R632-E725 PolarHBondContact NH2-OE2 3.29Å
633	R	96.3	Very high	94.7	Very high	151 Å²	151	35.3 Å²	35.3	57%	0.57	19%	0.186	S	C	*	.	H	α-helix	trans	-61.9	-36.7	-176.1	-170.7	-175.5	70.1	-151.5	0.6	113.7	P629 A630 L631 P637	P629-R633 PolarHBondContact O-N 2.86Å; A630-R633 PolarHBondContact O-N 2.87Å; L631-R633 VanDerWaalsContact C-N 3.27Å; L631-R633 PolarHBondContact O-N 3.43Å; R633-P637 WeakPolarHBondContact O-CD 3.48Å; R633-P637 VanDerWaalsContact O-CG 3.31Å; R633-P637 WeakPolarHBondContact O-CG 3.44Å
634	V	96.1	Very high	94.2	Very high	0 Å²	0	36 Å²	36	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-101.4	-37.5	-173.5	-56.2	0	0	0	0	113	E595 V596 V599 A630 L631 R632 Y638	E595-V634 HydrophobicContact CB-CB 4.34Å; E595-V634 HydrophobicContact CB-CG1 3.86Å; V596-V634 HydrophobicContact CB-CG2 4.47Å; V596-V634 HydrophobicContact CG2-CB 4.09Å; V596-V634 HydrophobicContact CG2-CG2 4.05Å; V599-V634 HydrophobicContact CB-CG2 4.04Å; V599-V634 HydrophobicContact CG1-CG2 4.3Å; V599-V634 HydrophobicContact CG2-CG1 3.88Å; V599-V634 HydrophobicContact CG2-CG2 3.99Å; A630-V634 PolarHBondContact O-N 2.9Å; L631-V634 PolarHBondContact O-N 3.29Å; R632-V634 PolarHBondContact O-N 2.82Å; V634-Y638 WeakPolarHBondContact O-CB 3.46Å; V634-Y638 PolarHBondContact O-N 3.46Å
635	Y	95.1	Very high	93.9	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-72.1	-38.6	179.1	-77.4	-106	0	0	0	112.4	Y560 V596 S600 L631 Y638 V639 P684 R687 I688	Y560-Y635 WeakPolarHBondContact CE1-OH 3.44Å; Y560-Y635 PolarHBondContact OH-OH 2.85Å; V596-Y635 HydrophobicContact CG1-CD2 4.41Å; V596-Y635 HydrophobicContact CG1-CE1 4.24Å; V596-Y635 HydrophobicContact CG1-CE2 3.8Å; S600-Y635 PolarHBondContact OG-OH 3.24Å; L631-Y635 HydrophobicContact CB-CD2 4.25Å; L631-Y635 HydrophobicContact CD2-CD2 4.05Å; L631-Y635 HydrophobicContact CD2-CE2 3.48Å; L631-Y635 VanDerWaalsContact CD2-CE2 3.48Å; L631-Y635 WeakPolarHBondContact O-CB 3.35Å; L631-Y635 VanDerWaalsContact O-CD2 3.3Å; L631-Y635 WeakPolarHBondContact O-CD2 3.33Å; L631-Y635 PolarHBondContact O-N 3.39Å; Y635-Y638 PolarHBondContact O-N 2.85Å; Y635-V639 WeakPolarHBondContact O-CB 3.41Å; Y635-V639 WeakPolarHBondContact O-CG2 3.35Å; Y635-V639 PolarHBondContact O-N 2.64Å; Y635-P684 HydrophobicContact CD1-CB 3.87Å; Y635-P684 VanDerWaalsContact CD1-O 3.28Å; Y635-P684 WeakPolarHBondContact CD1-O 3.27Å; Y635-P684 HydrophobicContact CE1-CB 3.77Å; Y635-P684 WeakPolarHBondContact CE1-O 3.45Å; Y635-R687 HydrophobicContact CE1-CB 4.36Å; Y635-I688 HydrophobicContact CD1-CB 3.77Å; Y635-I688 HydrophobicContact CD1-CG1 4.49Å; Y635-I688 HydrophobicContact CD1-CG2 4.2Å; Y635-I688 HydrophobicContact CE1-CB 4.12Å; Y635-I688 HydrophobicContact CG-CB 4.47Å
636	L	93.7	Very high	93.6	Very high	41 Å²	41	37.8 Å²	37.8	22%	0.215	20%	0.195	C	C	.	.	H	α-helix	trans	-57.3	-54.9	-179.3	179.2	60.1	0	0	0	113.1	R632 T640 E725 C726	R632-L636 WeakPolarHBondContact O-CB 3.49Å; R632-L636 PolarHBondContact O-N 2.98Å; L636-T640 VanDerWaalsContact O-CB 3.32Å; L636-T640 WeakPolarHBondContact O-CB 3.38Å; L636-T640 PolarHBondContact O-N 2.88Å; L636-T640 PolarHBondContact O-OG1 3.4Å; L636-E725 HydrophobicContact CD1-CB 4.37Å; L636-C726 HydrophobicContact CD1-CB 4.37Å
637	P	92.4	Very high	93.1	Very high	30 Å²	30	36 Å²	36	20%	0.195	18%	0.182	C	C	.	.	H	α-helix	trans	-68.2	-32.6	176.9	27.2	-35.5	0	0	0	113	K592 R633 N641	K592-P637 HydrophobicContact CD-CB 4.11Å; K592-P637 HydrophobicContact CD-CG 3.69Å; R633-P637 WeakPolarHBondContact O-CD 3.48Å; R633-P637 VanDerWaalsContact O-CG 3.31Å; R633-P637 WeakPolarHBondContact O-CG 3.44Å; P637-N641 VanDerWaalsContact O-CG 3.26Å; P637-N641 PolarHBondContact O-N 2.81Å; P637-N641 VanDerWaalsContact O-N 3.17Å; P637-N641 PolarHBondContact O-ND2 2.95Å; P637-N641 VanDerWaalsContact O-ND2 3.08Å
638	Y	94.6	Very high	92.9	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-62.7	-57.1	176.3	-173	-80.3	0	0	0	111.2	L593 V596 V634 Y635 T640 N641 Q642 Q645 L681 P684	L593-Y638 HydrophobicContact CB-CE2 3.93Å; L593-Y638 HydrophobicContact CD1-CE2 3.81Å; L593-Y638 HydrophobicContact CG-CE2 4.46Å; V596-Y638 HydrophobicContact CG2-CD2 4.2Å; V596-Y638 HydrophobicContact CG2-CG 4.3Å; V634-Y638 WeakPolarHBondContact O-CB 3.46Å; V634-Y638 PolarHBondContact O-N 3.46Å; Y635-Y638 PolarHBondContact O-N 2.85Å; Y638-T640 VanDerWaalsContact C-N 3.26Å; Y638-T640 PolarHBondContact O-N 3.27Å; Y638-N641 PolarHBondContact O-N 3.15Å; Y638-Q642 PolarHBondContact O-N 2.8Å; Y638-Q645 VanDerWaalsContact CZ-NE2 3.31Å; Y638-Q645 PolarHBondContact OH-NE2 3.12Å; Y638-L681 WeakPolarHBondContact CE1-O 3.39Å; Y638-L681 PolarHBondContact OH-O 2.82Å; Y638-P684 HydrophobicContact CD1-CB 3.67Å; Y638-P684 HydrophobicContact CD1-CG 3.81Å; Y638-P684 HydrophobicContact CE1-CB 3.82Å; Y638-P684 HydrophobicContact CE1-CG 3.51Å; Y638-P684 HydrophobicContact CE2-CG 4.41Å; Y638-P684 HydrophobicContact CG-CB 4.35Å; Y638-P684 HydrophobicContact CG-CG 4.39Å
639	V	92.1	Very high	92.7	Very high	5 Å²	5	36.2 Å²	36.2	3%	0.03	18%	0.183	C	C	.	.	H	α-helix	trans	-62	-34.4	-179.4	171.4	0	0	0	0	111.6	Y635 N641 Q642 F685 C726 V730	Y635-V639 WeakPolarHBondContact O-CB 3.41Å; Y635-V639 WeakPolarHBondContact O-CG2 3.35Å; Y635-V639 PolarHBondContact O-N 2.64Å; V639-N641 VanDerWaalsContact C-N 3.33Å; V639-N641 PolarHBondContact O-N 2.71Å; V639-Q642 WeakPolarHBondContact O-CB 3.29Å; V639-Q642 PolarHBondContact O-N 3.01Å; V639-F685 HydrophobicContact CG1-CD2 3.68Å; V639-F685 HydrophobicContact CG1-CE2 4.24Å; V639-F685 HydrophobicContact CG2-CB 4.22Å; V639-F685 HydrophobicContact CG2-CD2 4.24Å; V639-C726 HydrophobicContact CB-CB 4.43Å; V639-C726 HydrophobicContact CG1-CB 3.98Å; V639-V730 HydrophobicContact CG1-CG2 4.23Å; V639-V730 WeakPolarHBondContact O-CG2 3.32Å
640	T	90.2	Very high	92.6	Very high	7 Å²	7	35.9 Å²	35.9	4%	0.043	17%	0.174	C	C	.	.	H	α-helix	trans	-57.7	-46.5	172.3	-59.2	0	0	0	0	111.1	L636 Y638 Q642 S729 M733	L636-T640 VanDerWaalsContact O-CB 3.32Å; L636-T640 WeakPolarHBondContact O-CB 3.38Å; L636-T640 PolarHBondContact O-N 2.88Å; L636-T640 PolarHBondContact O-OG1 3.4Å; Y638-T640 VanDerWaalsContact C-N 3.26Å; Y638-T640 PolarHBondContact O-N 3.27Å; T640-Q642 VanDerWaalsContact C-N 3.34Å; T640-Q642 PolarHBondContact O-N 3.48Å; T640-S729 WeakPolarHBondContact CG2-OG 3.5Å; T640-S729 WeakPolarHBondContact OG1-CB 3.49Å; T640-S729 PolarHBondContact OG1-OG 3.42Å; T640-M733 HydrophobicContact CG2-CB 4.18Å; T640-M733 HydrophobicContact CG2-CG 4.41Å; T640-M733 HydrophobicContact CG2-SD 3.69Å; T640-M733 WeakPolarHBondContact O-CE 3.16Å
641	N	90.4	Very high	92.5	Very high	27 Å²	27	37.5 Å²	37.5	14%	0.144	18%	0.176	C	C	.	.	H	α-helix	trans	-79	-5.8	-176.7	-67.8	-29.5	0	0	0	115	S591 P637 Y638 V639 A643 Y644 Q645	S591-N641 PolarHBondContact OG-ND2 2.93Å; P637-N641 VanDerWaalsContact O-CG 3.26Å; P637-N641 PolarHBondContact O-N 2.81Å; P637-N641 VanDerWaalsContact O-N 3.17Å; P637-N641 PolarHBondContact O-ND2 2.95Å; P637-N641 VanDerWaalsContact O-ND2 3.08Å; Y638-N641 PolarHBondContact O-N 3.15Å; V639-N641 VanDerWaalsContact C-N 3.33Å; V639-N641 PolarHBondContact O-N 2.71Å; N641-A643 PolarHBondContact O-N 2.9Å; N641-Y644 WeakPolarHBondContact O-CA 3.14Å; N641-Y644 WeakPolarHBondContact O-CB 3.49Å; N641-Y644 PolarHBondContact O-N 2.89Å; N641-Q645 PolarHBondContact O-N 2.83Å
642	Q	88.5	Confident	92.4	Very high	28 Å²	28	37.6 Å²	37.6	13%	0.131	18%	0.176	C	C	.	.	H	α-helix	trans	-51.5	-36	-173.7	-170.1	79.3	63.2	0	0	113.7	Y638 V639 T640 Q645 E646 L681 I682	Y638-Q642 PolarHBondContact O-N 2.8Å; V639-Q642 WeakPolarHBondContact O-CB 3.29Å; V639-Q642 PolarHBondContact O-N 3.01Å; T640-Q642 VanDerWaalsContact C-N 3.34Å; T640-Q642 PolarHBondContact O-N 3.48Å; Q642-Q645 PolarHBondContact O-N 2.95Å; Q642-E646 PolarHBondContact O-N 3.42Å; Q642-L681 PolarHBondContact NE2-O 3.04Å; Q642-L681 VanDerWaalsContact NE2-O 3.12Å; Q642-L681 PolarHBondContact OE1-O 2.82Å; Q642-I682 HydrophobicContact CG-CD1 4.18Å
643	A	85.2	Confident	92.3	Very high	52 Å²	52	36.2 Å²	36.2	43%	0.43	18%	0.175	S	C	.	.	H	α-helix	trans	-68.2	-34.2	177.1	0	0	0	0	0	113.2	N641 Q647 M733	N641-A643 PolarHBondContact O-N 2.9Å; A643-Q647 WeakPolarHBondContact O-CB 3.43Å; A643-Q647 PolarHBondContact O-N 3.22Å; A643-M733 HydrophobicContact CB-CE 4.25Å
644	Y	87.1	Confident	92.2	Very high	27 Å²	27	35.1 Å²	35.1	11%	0.106	18%	0.176	C	C	.	.	H	α-helix	trans	-75.9	-32.3	174.1	-63.4	-47	0	0	0	112.1	N641 Q647 T648 M733	N641-Y644 WeakPolarHBondContact O-CA 3.14Å; N641-Y644 WeakPolarHBondContact O-CB 3.49Å; N641-Y644 PolarHBondContact O-N 2.89Å; Y644-Q647 PolarHBondContact O-N 3.28Å; Y644-T648 VanDerWaalsContact O-CB 3.26Å; Y644-T648 WeakPolarHBondContact O-CB 3.42Å; Y644-T648 PolarHBondContact O-N 3.27Å; Y644-T648 PolarHBondContact O-OG1 3.25Å; Y644-M733 HydrophobicContact CD2-CE 4.18Å; Y644-M733 HydrophobicContact CD2-SD 3.94Å; Y644-M733 HydrophobicContact CE2-CE 3.82Å; Y644-M733 HydrophobicContact CE2-CG 4.17Å; Y644-M733 HydrophobicContact CE2-SD 3.37Å; Y644-M733 WeakPolarHBondContact CE2-SD 3.38Å
645	Q	92.1	Very high	92.1	Very high	2 Å²	2	42 Å²	42	1%	0.009	21%	0.208	C	C	.	.	H	α-helix	trans	-60.8	-50.2	171.4	-62.8	-179.2	-95.2	0	0	110.7	W588 L589 Y638 N641 Q642 T648 Y649	W588-Q645 WeakPolarHBondContact O-CG 3.46Å; L589-Q645 WeakPolarHBondContact O-CG 3.45Å; L589-Q645 PolarHBondContact O-NE2 2.96Å; Y638-Q645 VanDerWaalsContact CZ-NE2 3.31Å; Y638-Q645 PolarHBondContact OH-NE2 3.12Å; N641-Q645 PolarHBondContact O-N 2.83Å; Q642-Q645 PolarHBondContact O-N 2.95Å; Q645-T648 PolarHBondContact O-N 3.3Å; Q645-Y649 WeakPolarHBondContact O-CB 3.38Å; Q645-Y649 PolarHBondContact O-N 3.13Å
646	E	89.4	Confident	92	Very high	82 Å²	82	43.3 Å²	43.3	38%	0.383	22%	0.215	S	C	.	.	H	α-helix	trans	-61.7	-46.4	176.3	-176.1	61.4	-140.8	0	0	111.6	Q642 T648 Y649 Q650	Q642-E646 PolarHBondContact O-N 3.42Å; E646-T648 VanDerWaalsContact C-N 3.29Å; E646-T648 PolarHBondContact O-N 3.43Å; E646-Y649 PolarHBondContact O-N 3.06Å; E646-Q650 HydrophobicContact CG-CG 4.47Å; E646-Q650 VanDerWaalsContact O-CG 3.29Å; E646-Q650 WeakPolarHBondContact O-CG 3.22Å; E646-Q650 PolarHBondContact O-N 3.22Å; E646-Q650 WeakPolarHBondContact OE1-CG 3.33Å; E646-Q650 PolarHBondContact OE1-NE2 2.86Å
647	Q	89.3	Confident	91.9	Very high	86 Å²	86	47.2 Å²	47.2	40%	0.402	24%	0.243	S	C	.	.	H	α-helix	trans	-61.1	-38.4	177.1	-171.5	-176	1.3	0	0	112.2	A643 Y644 R651	A643-Q647 WeakPolarHBondContact O-CB 3.43Å; A643-Q647 PolarHBondContact O-N 3.22Å; Y644-Q647 PolarHBondContact O-N 3.28Å; Q647-R651 WeakPolarHBondContact O-CB 3.36Å; Q647-R651 PolarHBondContact O-N 2.98Å
648	T	93.1	Very high	92.1	Very high	4 Å²	4	54.4 Å²	54.4	3%	0.025	27%	0.267	C	S	.	.	H	α-helix	trans	-68.3	-44	177.8	-57.6	0	0	0	0	110.8	W588 L589 Y644 Q645 E646 R651 L652	W588-T648 HydrophobicContact CB-CG2 3.95Å; L589-T648 HydrophobicContact CB-CG2 4.36Å; Y644-T648 VanDerWaalsContact O-CB 3.26Å; Y644-T648 WeakPolarHBondContact O-CB 3.42Å; Y644-T648 PolarHBondContact O-N 3.27Å; Y644-T648 PolarHBondContact O-OG1 3.25Å; Q645-T648 PolarHBondContact O-N 3.3Å; E646-T648 VanDerWaalsContact C-N 3.29Å; E646-T648 PolarHBondContact O-N 3.43Å; T648-R651 PolarHBondContact O-N 3.27Å; T648-L652 HydrophobicContact CG2-CD1 3.92Å; T648-L652 HydrophobicContact CG2-CG 4.42Å; T648-L652 WeakPolarHBondContact O-CB 3.42Å; T648-L652 VanDerWaalsContact O-CG 3.26Å; T648-L652 WeakPolarHBondContact O-CG 3.32Å; T648-L652 PolarHBondContact O-N 2.97Å
649	Y	94.5	Very high	92.1	Very high	22 Å²	22	54.4 Å²	54.4	9%	0.086	27%	0.267	C	S	.	.	H	α-helix	trans	-56.9	-50.8	173.2	177.8	-98.2	0	0	0	112	L589 Q645 E646 R651 L652 L653 F659 L663 T678	L589-Y649 HydrophobicContact CD1-CD2 4.19Å; L589-Y649 HydrophobicContact CD1-CG 4.49Å; Q645-Y649 WeakPolarHBondContact O-CB 3.38Å; Q645-Y649 PolarHBondContact O-N 3.13Å; E646-Y649 PolarHBondContact O-N 3.06Å; Y649-R651 VanDerWaalsContact C-N 3.31Å; Y649-R651 PolarHBondContact O-N 3.09Å; Y649-L652 PolarHBondContact O-N 2.9Å; Y649-L653 HydrophobicContact CD1-CD1 4.05Å; Y649-L653 HydrophobicContact CE1-CD1 3.43Å; Y649-L653 VanDerWaalsContact CE1-CD1 3.43Å; Y649-L653 HydrophobicContact CE1-CG 4.19Å; Y649-L653 WeakPolarHBondContact O-CG 3.43Å; Y649-L653 PolarHBondContact O-N 2.7Å; Y649-F659 HydrophobicContact CD2-CE1 4.07Å; Y649-F659 AromaticContact CD2-CZ 3.93Å; Y649-F659 HydrophobicContact CD2-CZ 3.93Å; Y649-F659 HydrophobicContact CE2-CE1 4.07Å; Y649-F659 HydrophobicContact CE2-CZ 4.12Å; Y649-L663 HydrophobicContact CE2-CD2 3.64Å; Y649-L663 WeakPolarHBondContact OH-CD2 3.49Å; Y649-T678 HydrophobicContact CD1-CG2 3.66Å; Y649-T678 HydrophobicContact CD2-CG2 4.19Å; Y649-T678 HydrophobicContact CE1-CG2 3.35Å; Y649-T678 HydrophobicContact CE2-CG2 3.9Å; Y649-T678 HydrophobicContact CG-CG2 4.08Å; Y649-T678 VanDerWaalsContact CZ-CG2 3.49Å
650	Q	94.6	Very high	92.3	Very high	82 Å²	82	56.4 Å²	56.4	38%	0.383	28%	0.28	S	S	.	.	H	α-helix	trans	-63.4	-36.2	178.1	-65.3	-64.1	-24.1	0	0	112.1	E646 Q654	E646-Q650 HydrophobicContact CG-CG 4.47Å; E646-Q650 VanDerWaalsContact O-CG 3.29Å; E646-Q650 WeakPolarHBondContact O-CG 3.22Å; E646-Q650 PolarHBondContact O-N 3.22Å; E646-Q650 WeakPolarHBondContact OE1-CG 3.33Å; E646-Q650 PolarHBondContact OE1-NE2 2.86Å; Q650-Q654 PolarHBondContact O-N 3.28Å; Q650-Q654 PolarHBondContact O-NE2 3.39Å
651	R	94.7	Very high	92.5	Very high	54 Å²	54	57.9 Å²	57.9	20%	0.204	30%	0.296	C	S	.	.	H	α-helix	trans	-63.7	-50.3	174	-167.2	-166.5	-58.2	142.2	4	111.1	Q647 T648 Y649 L653 Q654 E655	Q647-R651 WeakPolarHBondContact O-CB 3.36Å; Q647-R651 PolarHBondContact O-N 2.98Å; T648-R651 PolarHBondContact O-N 3.27Å; Y649-R651 VanDerWaalsContact C-N 3.31Å; Y649-R651 PolarHBondContact O-N 3.09Å; R651-L653 VanDerWaalsContact C-N 3.27Å; R651-L653 PolarHBondContact O-N 3.04Å; R651-Q654 PolarHBondContact O-N 3.38Å; R651-E655 WeakPolarHBondContact CD-OE2 3.2Å; R651-E655 HydrophobicContact CG-CB 4.49Å; R651-E655 HydrophobicContact CG-CG 4.11Å; R651-E655 WeakPolarHBondContact CG-OE1 3.39Å; R651-E655 WeakPolarHBondContact CG-OE2 3.43Å; R651-E655 PolarHBondContact O-N 2.84Å
652	L	94.4	Very high	92.8	Very high	2 Å²	2	57.4 Å²	57.4	1%	0.01	29%	0.293	C	S	.	.	H	α-helix	trans	-59	-36.7	179.7	-73	165.3	0	0	0	112.5	L581 E585 L589 T648 Y649 Q654 N656 F659	L581-L652 HydrophobicContact CD2-CD1 3.59Å; L581-L652 HydrophobicContact CD2-CD2 3.48Å; L581-L652 VanDerWaalsContact CD2-CD2 3.48Å; L581-L652 HydrophobicContact CD2-CG 4.16Å; E585-L652 WeakPolarHBondContact OE1-CD2 2.99Å; L589-L652 HydrophobicContact CD2-CD1 4.12Å; T648-L652 HydrophobicContact CG2-CD1 3.92Å; T648-L652 HydrophobicContact CG2-CG 4.42Å; T648-L652 WeakPolarHBondContact O-CB 3.42Å; T648-L652 VanDerWaalsContact O-CG 3.26Å; T648-L652 WeakPolarHBondContact O-CG 3.32Å; T648-L652 PolarHBondContact O-N 2.97Å; Y649-L652 PolarHBondContact O-N 2.9Å; L652-Q654 VanDerWaalsContact C-N 3.27Å; L652-Q654 PolarHBondContact O-N 3.29Å; L652-N656 HydrophobicContact CD2-CB 4.16Å; L652-N656 WeakPolarHBondContact O-CB 3.19Å; L652-N656 PolarHBondContact O-N 3.04Å; L652-N656 VanDerWaalsContact O-N 3.15Å; L652-F659 HydrophobicContact CB-CB 4.47Å; L652-F659 HydrophobicContact CB-CD1 3.57Å; L652-F659 HydrophobicContact CB-CD2 4.2Å; L652-F659 HydrophobicContact CB-CE1 3.69Å; L652-F659 HydrophobicContact CB-CE2 4.29Å; L652-F659 HydrophobicContact CB-CG 3.84Å; L652-F659 HydrophobicContact CB-CZ 4.06Å; L652-F659 HydrophobicContact CD1-CD2 4.33Å; L652-F659 HydrophobicContact CD1-CE2 3.95Å; L652-F659 HydrophobicContact CD1-CZ 4.09Å
653	L	94.2	Very high	93.1	Very high	58 Å²	58	56.3 Å²	56.3	30%	0.304	29%	0.288	S	S	.	.	H	α-helix	trans	-64.5	-26	173.3	-72.7	179.9	0	0	0	114.3	Y649 R651 F659 P660 L663	Y649-L653 HydrophobicContact CD1-CD1 4.05Å; Y649-L653 HydrophobicContact CE1-CD1 3.43Å; Y649-L653 VanDerWaalsContact CE1-CD1 3.43Å; Y649-L653 HydrophobicContact CE1-CG 4.19Å; Y649-L653 WeakPolarHBondContact O-CG 3.43Å; Y649-L653 PolarHBondContact O-N 2.7Å; R651-L653 VanDerWaalsContact C-N 3.27Å; R651-L653 PolarHBondContact O-N 3.04Å; L653-F659 HydrophobicContact CD2-CD1 3.95Å; L653-F659 HydrophobicContact CD2-CE1 3.91Å; L653-F659 HydrophobicContact CG-CD1 4.39Å; L653-F659 HydrophobicContact CG-CE1 4.15Å; L653-P660 HydrophobicContact CD2-CB 4.23Å; L653-P660 HydrophobicContact CD2-CG 3.95Å; L653-L663 HydrophobicContact CD2-CD2 4.3Å
654	Q	94.2	Very high	93.5	Very high	129 Å²	129	55.8 Å²	55.8	60%	0.603	28%	0.284	S	S	*	.	H	α-helix	trans	-98.7	-38.5	-177	-75.9	164.7	95.6	0	0	112.8	Q650 R651 L652	Q650-Q654 PolarHBondContact O-N 3.28Å; Q650-Q654 PolarHBondContact O-NE2 3.39Å; R651-Q654 PolarHBondContact O-N 3.38Å; L652-Q654 VanDerWaalsContact C-N 3.27Å; L652-Q654 PolarHBondContact O-N 3.29Å
655	E	93.9	Very high	93.8	Very high	143 Å²	143	60.4 Å²	60.4	67%	0.668	30%	0.302	S	S	*	.	H	α-helix	trans	-102.4	-24.9	-169.6	-66.6	173.4	-159.3	0	0	113.5	R651 P657	R651-E655 WeakPolarHBondContact CD-OE2 3.2Å; R651-E655 HydrophobicContact CG-CB 4.49Å; R651-E655 HydrophobicContact CG-CG 4.11Å; R651-E655 WeakPolarHBondContact CG-OE1 3.39Å; R651-E655 WeakPolarHBondContact CG-OE2 3.43Å; R651-E655 PolarHBondContact O-N 2.84Å; E655-P657 WeakPolarHBondContact O-CD 3.47Å
656	N	93.3	Very high	94	Very high	28 Å²	28	61.1 Å²	61.1	15%	0.15	31%	0.305	C	S	.	.			trans	-108.2	97.5	-179.6	-173.5	-25.6	0	0	0	110.8	C580 L652 R658 F659 P660	C580-N656 PolarHBondContact O-ND2 3.43Å; L652-N656 HydrophobicContact CD2-CB 4.16Å; L652-N656 WeakPolarHBondContact O-CB 3.19Å; L652-N656 PolarHBondContact O-N 3.04Å; L652-N656 VanDerWaalsContact O-N 3.15Å; N656-R658 PolarHBondContact O-N 2.92Å; N656-R658 PolarHBondContact OD1-N 3.35Å; N656-F659 HydrophobicContact CB-CB 4Å; N656-F659 PolarHBondContact O-N 2.88Å; N656-F659 VanDerWaalsContact O-N 3.09Å; N656-F659 PolarHBondContact OD1-N 3.49Å; N656-P660 WeakPolarHBondContact O-CD 3.3Å
657	P	92.7	Very high	94.2	Very high	123 Å²	123	59.1 Å²	59.1	80%	0.799	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-11.6	-173.6	27.6	-35.9	0	0	0	114.4	E655	E655-P657 WeakPolarHBondContact O-CD 3.47Å
658	R	94.9	Very high	94.5	Very high	182 Å²	182	62.5 Å²	62.5	69%	0.687	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.2	-32.1	174.1	-63.9	-177.9	179.1	-173.4	-0.1	112.2	N656 G661 I662	N656-R658 PolarHBondContact O-N 2.92Å; N656-R658 PolarHBondContact OD1-N 3.35Å; R658-G661 PolarHBondContact O-N 3Å; R658-I662 HydrophobicContact CB-CD1 4.14Å; R658-I662 PolarHBondContact O-N 3.48Å; R658-I662 VanDerWaalsContact O-N 3.08Å
659	F	95.9	Very high	94.5	Very high	0 Å²	0	64.9 Å²	64.9	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-60.8	-49.4	-171	176.2	-96.6	0	0	0	113.3	L577 L581 L589 Y649 L652 L653 N656 G661 I662 L663	L577-F659 HydrophobicContact CD1-CD2 3.8Å; L577-F659 HydrophobicContact CD1-CE2 3.81Å; L581-F659 HydrophobicContact CD1-CE2 4.42Å; L581-F659 HydrophobicContact CD2-CD2 3.82Å; L581-F659 HydrophobicContact CD2-CE2 4.08Å; L589-F659 HydrophobicContact CD2-CE2 4.06Å; L589-F659 HydrophobicContact CD2-CZ 4.17Å; Y649-F659 HydrophobicContact CD2-CE1 4.07Å; Y649-F659 AromaticContact CD2-CZ 3.93Å; Y649-F659 HydrophobicContact CD2-CZ 3.93Å; Y649-F659 HydrophobicContact CE2-CE1 4.07Å; Y649-F659 HydrophobicContact CE2-CZ 4.12Å; L652-F659 HydrophobicContact CB-CB 4.47Å; L652-F659 HydrophobicContact CB-CD1 3.57Å; L652-F659 HydrophobicContact CB-CD2 4.2Å; L652-F659 HydrophobicContact CB-CE1 3.69Å; L652-F659 HydrophobicContact CB-CE2 4.29Å; L652-F659 HydrophobicContact CB-CG 3.84Å; L652-F659 HydrophobicContact CB-CZ 4.06Å; L652-F659 HydrophobicContact CD1-CD2 4.33Å; L652-F659 HydrophobicContact CD1-CE2 3.95Å; L652-F659 HydrophobicContact CD1-CZ 4.09Å; L653-F659 HydrophobicContact CD2-CD1 3.95Å; L653-F659 HydrophobicContact CD2-CE1 3.91Å; L653-F659 HydrophobicContact CG-CD1 4.39Å; L653-F659 HydrophobicContact CG-CE1 4.15Å; N656-F659 HydrophobicContact CB-CB 4Å; N656-F659 PolarHBondContact O-N 2.88Å; N656-F659 VanDerWaalsContact O-N 3.09Å; N656-F659 PolarHBondContact OD1-N 3.49Å; F659-G661 VanDerWaalsContact C-N 3.3Å; F659-G661 PolarHBondContact O-N 2.9Å; F659-I662 PolarHBondContact O-N 3.47Å; F659-L663 HydrophobicContact CE1-CD2 4.1Å; F659-L663 HydrophobicContact CZ-CD2 4.38Å; F659-L663 VanDerWaalsContact O-CB 3.23Å; F659-L663 WeakPolarHBondContact O-CB 3.16Å; F659-L663 PolarHBondContact O-N 2.85Å
660	P	95.5	Very high	94.3	Very high	47 Å²	47	69.1 Å²	69.1	31%	0.305	36%	0.355	S	S	.	.	H	α-helix	trans	-57.9	-39.3	176.3	-23.5	31.6	0	0	0	113.7	L653 N656 A664	L653-P660 HydrophobicContact CD2-CB 4.23Å; L653-P660 HydrophobicContact CD2-CG 3.95Å; N656-P660 WeakPolarHBondContact O-CD 3.3Å; P660-A664 WeakPolarHBondContact O-CB 3.42Å; P660-A664 PolarHBondContact O-N 3.4Å
661	G	95.3	Very high	94.1	Very high	38 Å²	38	68.7 Å²	68.7	39%	0.392	35%	0.354	S	S	.	.	H	α-helix	trans	-74.4	-29.6	-177.1	0	0	0	0	0	113.8	R658 F659 R665	R658-G661 PolarHBondContact O-N 3Å; F659-G661 VanDerWaalsContact C-N 3.3Å; F659-G661 PolarHBondContact O-N 2.9Å; G661-R665 PolarHBondContact O-NH1 3.07Å
662	I	95.2	Very high	93.8	Very high	16 Å²	16	66.1 Å²	66.1	8%	0.082	34%	0.344	C	S	.	.	H	α-helix	trans	-75.8	-45.5	171.1	-68.4	159.7	0	0	0	109.8	E576 L577 C580 R658 F659 A664 R665 L666	E576-I662 HydrophobicContact CB-CG2 3.89Å; L577-I662 HydrophobicContact CB-CG2 4.36Å; L577-I662 HydrophobicContact CD1-CG2 4.1Å; C580-I662 HydrophobicContact CB-CD1 3.54Å; R658-I662 HydrophobicContact CB-CD1 4.14Å; R658-I662 PolarHBondContact O-N 3.48Å; R658-I662 VanDerWaalsContact O-N 3.08Å; F659-I662 PolarHBondContact O-N 3.47Å; I662-A664 PolarHBondContact O-N 3.23Å; I662-R665 PolarHBondContact O-N 3.38Å; I662-L666 HydrophobicContact CG2-CD1 4.04Å; I662-L666 PolarHBondContact O-N 3.29Å; I662-L666 VanDerWaalsContact O-N 3.16Å
663	L	95.2	Very high	93.5	Very high	5 Å²	5	69.5 Å²	69.5	3%	0.026	36%	0.36	C	S	.	.	H	α-helix	trans	-57.2	-47.7	179.6	-177.9	65	0	0	0	111.7	F571 Y649 L653 F659 R665 L666 E667 L677	F571-L663 HydrophobicContact CD1-CD1 4.38Å; F571-L663 HydrophobicContact CE1-CD1 4.12Å; Y649-L663 HydrophobicContact CE2-CD2 3.64Å; Y649-L663 WeakPolarHBondContact OH-CD2 3.49Å; L653-L663 HydrophobicContact CD2-CD2 4.3Å; F659-L663 HydrophobicContact CE1-CD2 4.1Å; F659-L663 HydrophobicContact CZ-CD2 4.38Å; F659-L663 VanDerWaalsContact O-CB 3.23Å; F659-L663 WeakPolarHBondContact O-CB 3.16Å; F659-L663 PolarHBondContact O-N 2.85Å; L663-R665 VanDerWaalsContact C-N 3.31Å; L663-R665 PolarHBondContact O-N 3.29Å; L663-L666 PolarHBondContact O-N 3.39Å; L663-E667 HydrophobicContact CD1-CG 4.11Å; L663-E667 WeakPolarHBondContact CD1-OE1 3.48Å; L663-E667 HydrophobicContact CG-CG 4.25Å; L663-E667 WeakPolarHBondContact CG-OE1 3Å; L663-E667 WeakPolarHBondContact O-CG 3.49Å; L663-E667 PolarHBondContact O-N 3.42Å; L663-L677 HydrophobicContact CD1-CB 3.76Å; L663-L677 HydrophobicContact CD1-CD2 3.86Å; L663-L677 HydrophobicContact CD1-CG 4.47Å
664	A	94.3	Very high	93.2	Very high	42 Å²	42	77.9 Å²	77.9	35%	0.347	39%	0.388	S	S	.	.	H	α-helix	trans	-55.7	-42.8	177.5	0	0	0	0	0	112.8	P660 I662 L666 E667 E668	P660-A664 WeakPolarHBondContact O-CB 3.42Å; P660-A664 PolarHBondContact O-N 3.4Å; I662-A664 PolarHBondContact O-N 3.23Å; A664-L666 VanDerWaalsContact C-N 3.34Å; A664-L666 PolarHBondContact O-N 3.07Å; A664-E667 PolarHBondContact O-N 2.91Å; A664-E668 WeakPolarHBondContact O-CB 3.26Å; A664-E668 VanDerWaalsContact O-CG 3.32Å; A664-E668 WeakPolarHBondContact O-CG 3.28Å; A664-E668 PolarHBondContact O-N 3.4Å
665	R	94.3	Very high	93	Very high	124 Å²	124	74 Å²	74	47%	0.468	37%	0.371	S	S	.	.	H	α-helix	trans	-64.1	-36.8	176.2	-69.2	-167.1	-56.9	-87.2	16.2	113	E576 G661 I662 L663	E576-R665 IonicContact OE1-NH2 2.65Å; E576-R665 IonicContact OE2-CZ 2.71Å; E576-R665 IonicContact OE2-NE 2.72Å; E576-R665 PolarHBondContact OE2-NE 3.47Å; E576-R665 IonicContact OE2-NH2 3.88Å; E576-R665 PolarHBondContact OE2-NH2 3.28Å; G661-R665 PolarHBondContact O-NH1 3.07Å; I662-R665 PolarHBondContact O-N 3.38Å; L663-R665 VanDerWaalsContact C-N 3.31Å; L663-R665 PolarHBondContact O-N 3.29Å
666	L	94.4	Very high	93	Very high	17 Å²	17	69.5 Å²	69.5	9%	0.089	35%	0.354	C	S	.	.	H	α-helix	trans	-73.9	-33.1	177.7	-63.6	173.3	0	0	0	111.7	H570 F571 L577 I662 L663 A664 C672	H570-L666 PolarHBondContact NE2-O 3.01Å; F571-L666 HydrophobicContact CD1-CB 3.95Å; F571-L666 HydrophobicContact CD1-CD1 4.15Å; F571-L666 HydrophobicContact CE1-CB 3.65Å; L577-L666 HydrophobicContact CB-CD1 4.17Å; L577-L666 HydrophobicContact CD2-CD1 4.37Å; I662-L666 HydrophobicContact CG2-CD1 4.04Å; I662-L666 PolarHBondContact O-N 3.29Å; I662-L666 VanDerWaalsContact O-N 3.16Å; L663-L666 PolarHBondContact O-N 3.39Å; A664-L666 VanDerWaalsContact C-N 3.34Å; A664-L666 PolarHBondContact O-N 3.07Å; L666-C672 PolarHBondContact O-SG 3.46Å
667	E	95.1	Very high	93	Very high	40 Å²	40	68.1 Å²	68.1	19%	0.187	35%	0.347	C	S	.	.	H	α-helix	trans	-78	-23.3	176.5	-67.3	-179.7	165.5	0	0	113.3	F571 L663 A664 D669 P676 L677	F571-E667 HydrophobicContact CE1-CG 3.95Å; F571-E667 HydrophobicContact CZ-CG 4.05Å; L663-E667 HydrophobicContact CD1-CG 4.11Å; L663-E667 WeakPolarHBondContact CD1-OE1 3.48Å; L663-E667 HydrophobicContact CG-CG 4.25Å; L663-E667 WeakPolarHBondContact CG-OE1 3Å; L663-E667 WeakPolarHBondContact O-CG 3.49Å; L663-E667 PolarHBondContact O-N 3.42Å; A664-E667 PolarHBondContact O-N 2.91Å; E667-D669 VanDerWaalsContact C-N 3.27Å; E667-D669 PolarHBondContact O-N 3.09Å; E667-P676 VanDerWaalsContact CD-CA 3.48Å; E667-P676 WeakPolarHBondContact OE1-CA 3.44Å; E667-P676 VanDerWaalsContact OE1-CB 3.27Å; E667-P676 WeakPolarHBondContact OE1-CB 3.45Å; E667-L677 PolarHBondContact OE1-N 3.4Å
668	E	93.9	Very high	93	Very high	156 Å²	156	64.2 Å²	64.2	73%	0.729	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.2	-17.7	171.2	-82.2	176.6	-176.9	0	0	113.7	A664	A664-E668 WeakPolarHBondContact O-CB 3.26Å; A664-E668 VanDerWaalsContact O-CG 3.32Å; A664-E668 WeakPolarHBondContact O-CG 3.28Å; A664-E668 PolarHBondContact O-N 3.4Å
669	D	93.3	Very high	92.9	Very high	55 Å²	55	56.7 Å²	56.7	29%	0.294	30%	0.296	S	S	.	.	S	Bend	trans	-62.7	130.6	-179.7	-165.7	-57.7	0	0	0	111.7	H570 E667 I671 C672	H570-D669 IonicContact CE1-OD2 3.33Å; H570-D669 PolarHBondContact CE1-OD2 2.81Å; E667-D669 VanDerWaalsContact C-N 3.27Å; E667-D669 PolarHBondContact O-N 3.09Å; D669-I671 HydrophobicContact CB-CG1 4.37Å; D669-I671 PolarHBondContact O-N 3.35Å; D669-I671 WeakPolarHBondContact OD1-CG1 3.32Å; D669-I671 WeakPolarHBondContact OD1-CG2 3.44Å; D669-I671 PolarHBondContact OD1-N 2.93Å; D669-C672 WeakPolarHBondContact O-CB 3.18Å; D669-C672 PolarHBondContact O-N 3.05Å
670	P	91.1	Very high	92.8	Very high	111 Å²	111	56.7 Å²	56.7	72%	0.721	30%	0.296	S	S	*	.	G	3₁₀ helix	trans	-50.2	-28.5	175.4	-30	36.7	0	0	0	115.8	C672 Q673	P670-C672 VanDerWaalsContact C-N 3.27Å; P670-C672 PolarHBondContact O-N 3.07Å; P670-Q673 WeakPolarHBondContact O-CG 3.2Å; P670-Q673 PolarHBondContact O-N 3.33Å
671	I	91	Very high	92.7	Very high	72 Å²	72	54.8 Å²	54.8	37%	0.369	28%	0.283	S	S	.	.	G	3₁₀ helix	trans	-68.1	-27.5	177.7	75.1	-175.1	0	0	0	112.7	I566 H570 D669 Q673	I566-I671 WeakPolarHBondContact CD1-O 3.44Å; H570-I671 HydrophobicContact CB-CD1 4Å; D669-I671 HydrophobicContact CB-CG1 4.37Å; D669-I671 PolarHBondContact O-N 3.35Å; D669-I671 WeakPolarHBondContact OD1-CG1 3.32Å; D669-I671 WeakPolarHBondContact OD1-CG2 3.44Å; D669-I671 PolarHBondContact OD1-N 2.93Å; I671-Q673 VanDerWaalsContact C-N 3.29Å
672	C	88.5	Confident	92.5	Very high	0 Å²	0	55 Å²	55	0%	0	28%	0.275	C	S	.	.	G	3₁₀ helix	trans	-77.8	-14.5	175.6	-63.7	0	0	0	0	112.6	H570 F571 L666 D669 P670 R674 L675	H570-C672 PolarHBondContact CD2-SG 2.78Å; F571-C672 VanDerWaalsContact CE2-SG 3.59Å; F571-C672 VanDerWaalsContact CZ-SG 3.57Å; L666-C672 PolarHBondContact O-SG 3.46Å; D669-C672 WeakPolarHBondContact O-CB 3.18Å; D669-C672 PolarHBondContact O-N 3.05Å; P670-C672 VanDerWaalsContact C-N 3.27Å; P670-C672 PolarHBondContact O-N 3.07Å; C672-R674 PolarHBondContact O-N 3.14Å; C672-R674 VanDerWaalsContact O-N 3.13Å; C672-L675 VanDerWaalsContact O-CB 3.27Å; C672-L675 WeakPolarHBondContact O-CB 3.22Å; C672-L675 PolarHBondContact O-N 3.32Å
673	Q	88	Confident	92.4	Very high	73 Å²	73	54.3 Å²	54.3	34%	0.341	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.1	31.8	178.2	-54.9	-174.5	-2.4	0	0	114.1	S463 L465 P670 I671 L675	S463-Q673 PolarHBondContact O-NE2 3.48Å; L465-Q673 HydrophobicContact CD1-CB 3.89Å; L465-Q673 HydrophobicContact CD1-CG 3.77Å; L465-Q673 HydrophobicContact CG-CG 4.32Å; P670-Q673 WeakPolarHBondContact O-CG 3.2Å; P670-Q673 PolarHBondContact O-N 3.33Å; I671-Q673 VanDerWaalsContact C-N 3.29Å; Q673-L675 PolarHBondContact O-N 2.96Å
674	R	88	Confident	92.4	Very high	235 Å²	235	54 Å²	54	89%	0.887	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.9	19.3	-174.3	-46.6	175.5	178.4	-177.4	-2.4	114.7	C672	C672-R674 PolarHBondContact O-N 3.14Å; C672-R674 VanDerWaalsContact O-N 3.13Å
675	L	89.6	Confident	92.2	Very high	47 Å²	47	53.4 Å²	53.4	25%	0.246	26%	0.259	C	S	.	.			trans	-88.8	131.3	172.3	-58.9	-179.4	0	0	0	109.9	L465 Q467 C672 Q673 S679 F680	L465-L675 HydrophobicContact CD1-CD1 3.68Å; Q467-L675 HydrophobicContact CB-CD1 3.71Å; Q467-L675 HydrophobicContact CG-CD1 3.79Å; C672-L675 VanDerWaalsContact O-CB 3.27Å; C672-L675 WeakPolarHBondContact O-CB 3.22Å; C672-L675 PolarHBondContact O-N 3.32Å; Q673-L675 PolarHBondContact O-N 2.96Å; L675-S679 WeakPolarHBondContact CB-OG 3.31Å; L675-F680 HydrophobicContact CB-CE2 3.9Å; L675-F680 HydrophobicContact CB-CZ 4.2Å; L675-F680 HydrophobicContact CD1-CZ 4.49Å
676	P	93.1	Very high	92	Very high	48 Å²	48	49 Å²	49	31%	0.312	24%	0.244	S	C	.	.			trans	-76.4	160.7	179.7	31.6	-35.9	0	0	0	112.2	E667 T678 S679 F680	E667-P676 VanDerWaalsContact CD-CA 3.48Å; E667-P676 WeakPolarHBondContact OE1-CA 3.44Å; E667-P676 VanDerWaalsContact OE1-CB 3.27Å; E667-P676 WeakPolarHBondContact OE1-CB 3.45Å; P676-T678 PolarHBondContact O-N 3.42Å; P676-T678 VanDerWaalsContact O-N 3.15Å; P676-S679 VanDerWaalsContact O-CB 3.28Å; P676-S679 WeakPolarHBondContact O-CB 3.19Å; P676-S679 PolarHBondContact O-N 3.32Å; P676-S679 PolarHBondContact O-OG 2.81Å; P676-F680 WeakPolarHBondContact O-CD2 3.44Å
677	L	93.9	Very high	92.1	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-52.2	-38.5	179.4	173.4	57.7	0	0	0	112.7	F571 L589 F590 L663 E667 S679 F680 L681	F571-L677 HydrophobicContact CB-CD1 3.91Å; F571-L677 HydrophobicContact CD1-CB 4.27Å; F571-L677 HydrophobicContact CD1-CD1 4.06Å; F571-L677 HydrophobicContact CD1-CD2 4.41Å; F571-L677 HydrophobicContact CD1-CG 4.47Å; F571-L677 HydrophobicContact CD2-CD1 4.1Å; F571-L677 HydrophobicContact CE1-CB 4.11Å; F571-L677 HydrophobicContact CG-CD1 3.78Å; F571-L677 HydrophobicContact CZ-CB 4.44Å; L589-L677 HydrophobicContact CD2-CD2 4.36Å; F590-L677 HydrophobicContact CE1-CD1 4.01Å; F590-L677 HydrophobicContact CZ-CD1 4.43Å; F590-L677 HydrophobicContact CZ-CD2 4.33Å; L663-L677 HydrophobicContact CD1-CB 3.76Å; L663-L677 HydrophobicContact CD1-CD2 3.86Å; L663-L677 HydrophobicContact CD1-CG 4.47Å; E667-L677 PolarHBondContact OE1-N 3.4Å; L677-S679 PolarHBondContact O-N 2.92Å; L677-F680 WeakPolarHBondContact O-CA 3.44Å; L677-F680 WeakPolarHBondContact O-CB 3.34Å; L677-F680 PolarHBondContact O-N 2.97Å; L677-L681 HydrophobicContact CD1-CD1 4.29Å; L677-L681 HydrophobicContact CD1-CD2 4.27Å; L677-L681 HydrophobicContact CD1-CG 3.96Å; L677-L681 HydrophobicContact CD2-CD1 4.44Å; L677-L681 HydrophobicContact CG-CD1 3.95Å; L677-L681 HydrophobicContact CG-CG 4.11Å; L677-L681 PolarHBondContact O-N 3.23Å
678	T	92.9	Very high	91.9	Very high	41 Å²	41	46.4 Å²	46.4	25%	0.252	23%	0.231	S	C	.	.	H	α-helix	trans	-58.4	-32.2	177	53.1	0	0	0	0	113.1	Y649 P676 F680 L681 I682	Y649-T678 HydrophobicContact CD1-CG2 3.66Å; Y649-T678 HydrophobicContact CD2-CG2 4.19Å; Y649-T678 HydrophobicContact CE1-CG2 3.35Å; Y649-T678 HydrophobicContact CE2-CG2 3.9Å; Y649-T678 HydrophobicContact CG-CG2 4.08Å; Y649-T678 VanDerWaalsContact CZ-CG2 3.49Å; P676-T678 PolarHBondContact O-N 3.42Å; P676-T678 VanDerWaalsContact O-N 3.15Å; T678-F680 VanDerWaalsContact C-N 3.26Å; T678-F680 PolarHBondContact O-N 3.32Å; T678-L681 PolarHBondContact O-N 3.42Å; T678-I682 WeakPolarHBondContact O-CG2 3.4Å; T678-I682 PolarHBondContact O-N 2.96Å
679	S	91.7	Very high	91.7	Very high	24 Å²	24	40.7 Å²	40.7	17%	0.168	21%	0.207	C	C	.	.	H	α-helix	trans	-69.7	-23	175.7	81	0	0	0	0	113.3	Q467 L675 P676 L677 I682 L683	Q467-S679 PolarHBondContact NE2-OG 3.24Å; L675-S679 WeakPolarHBondContact CB-OG 3.31Å; P676-S679 VanDerWaalsContact O-CB 3.28Å; P676-S679 WeakPolarHBondContact O-CB 3.19Å; P676-S679 PolarHBondContact O-N 3.32Å; P676-S679 PolarHBondContact O-OG 2.81Å; L677-S679 PolarHBondContact O-N 2.92Å; S679-I682 WeakPolarHBondContact O-CG2 3.29Å; S679-L683 WeakPolarHBondContact O-CD2 3.42Å; S679-L683 WeakPolarHBondContact O-CG 3.45Å
680	F	94.6	Very high	91.5	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-88	-39.4	174.8	-66.4	-83	0	0	0	111.3	L465 Q467 S563 I566 A567 F571 L675 P676 L677 T678 I682 L683	L465-F680 HydrophobicContact CD1-CE1 4.49Å; L465-F680 HydrophobicContact CD1-CZ 4.24Å; Q467-F680 VanDerWaalsContact NE2-CD1 3.34Å; Q467-F680 VanDerWaalsContact NE2-CE1 3.32Å; S563-F680 VanDerWaalsContact O-CD1 3.31Å; S563-F680 WeakPolarHBondContact O-CD1 3.26Å; I566-F680 HydrophobicContact CB-CE1 4.14Å; I566-F680 HydrophobicContact CD1-CE1 4.45Å; I566-F680 HydrophobicContact CG2-CE1 3.93Å; I566-F680 HydrophobicContact CG2-CE2 4.45Å; I566-F680 HydrophobicContact CG2-CZ 3.9Å; A567-F680 HydrophobicContact CB-CB 3.86Å; A567-F680 HydrophobicContact CB-CG 4.45Å; F571-F680 HydrophobicContact CE2-CD2 4.05Å; F571-F680 HydrophobicContact CE2-CE2 4.06Å; L675-F680 HydrophobicContact CB-CE2 3.9Å; L675-F680 HydrophobicContact CB-CZ 4.2Å; L675-F680 HydrophobicContact CD1-CZ 4.49Å; P676-F680 WeakPolarHBondContact O-CD2 3.44Å; L677-F680 WeakPolarHBondContact O-CA 3.44Å; L677-F680 WeakPolarHBondContact O-CB 3.34Å; L677-F680 PolarHBondContact O-N 2.97Å; T678-F680 VanDerWaalsContact C-N 3.26Å; T678-F680 PolarHBondContact O-N 3.32Å; F680-I682 VanDerWaalsContact C-N 3.26Å; F680-I682 PolarHBondContact O-N 2.9Å; F680-L683 HydrophobicContact CB-CD1 4.4Å; F680-L683 HydrophobicContact CD1-CD1 4.03Å; F680-L683 WeakPolarHBondContact O-CB 3.49Å; F680-L683 VanDerWaalsContact O-CG 3.25Å; F680-L683 WeakPolarHBondContact O-CG 3.42Å; F680-L683 PolarHBondContact O-N 3.43Å; F680-L683 VanDerWaalsContact O-N 3.17Å
681	L	94.1	Very high	91.6	Very high	7 Å²	7	34.6 Å²	34.6	4%	0.037	17%	0.166	C	C	.	.	H	α-helix	trans	-65.7	-23.5	179.1	-67.1	177.8	0	0	0	113.9	L589 F590 L593 Y638 Q642 L677 T678	L589-L681 HydrophobicContact CD1-CD1 3.72Å; L589-L681 HydrophobicContact CG-CD1 4.33Å; F590-L681 HydrophobicContact CD1-CD2 3.95Å; F590-L681 HydrophobicContact CE1-CD2 4.3Å; L593-L681 HydrophobicContact CD2-CD2 4.3Å; Y638-L681 WeakPolarHBondContact CE1-O 3.39Å; Y638-L681 PolarHBondContact OH-O 2.82Å; Q642-L681 PolarHBondContact NE2-O 3.04Å; Q642-L681 VanDerWaalsContact NE2-O 3.12Å; Q642-L681 PolarHBondContact OE1-O 2.82Å; L677-L681 HydrophobicContact CD1-CD1 4.29Å; L677-L681 HydrophobicContact CD1-CD2 4.27Å; L677-L681 HydrophobicContact CD1-CG 3.96Å; L677-L681 HydrophobicContact CD2-CD1 4.44Å; L677-L681 HydrophobicContact CG-CD1 3.95Å; L677-L681 HydrophobicContact CG-CG 4.11Å; L677-L681 PolarHBondContact O-N 3.23Å; T678-L681 PolarHBondContact O-N 3.42Å
682	I	91.1	Very high	91.6	Very high	43 Å²	43	33.1 Å²	33.1	22%	0.221	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84	-10.9	176.6	-167.5	56.5	0	0	0	113.5	Q642 T678 S679 F680 F685 Q686	Q642-I682 HydrophobicContact CG-CD1 4.18Å; T678-I682 WeakPolarHBondContact O-CG2 3.4Å; T678-I682 PolarHBondContact O-N 2.96Å; S679-I682 WeakPolarHBondContact O-CG2 3.29Å; F680-I682 VanDerWaalsContact C-N 3.26Å; F680-I682 PolarHBondContact O-N 2.9Å; I682-F685 HydrophobicContact CD1-CB 4.09Å; I682-F685 HydrophobicContact CD1-CD1 4.07Å; I682-F685 HydrophobicContact CD1-CG 4.42Å; I682-F685 PolarHBondContact O-N 2.7Å; I682-Q686 HydrophobicContact CG1-CG 4.38Å; I682-Q686 PolarHBondContact O-N 3.32Å
683	L	93.3	Very high	91.5	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-59.4	-39.6	-170.1	-66.7	179	0	0	0	115.1	Y466 Q467 Y560 S679 F680 F685 Q686 R687	Y466-L683 HydrophobicContact CD1-CD2 3.73Å; Y466-L683 HydrophobicContact CE1-CD2 4.39Å; Q467-L683 HydrophobicContact CG-CD2 4.06Å; Y560-L683 HydrophobicContact CD2-CB 4.45Å; Y560-L683 HydrophobicContact CE2-CB 3.87Å; S679-L683 WeakPolarHBondContact O-CD2 3.42Å; S679-L683 WeakPolarHBondContact O-CG 3.45Å; F680-L683 HydrophobicContact CB-CD1 4.4Å; F680-L683 HydrophobicContact CD1-CD1 4.03Å; F680-L683 WeakPolarHBondContact O-CB 3.49Å; F680-L683 VanDerWaalsContact O-CG 3.25Å; F680-L683 WeakPolarHBondContact O-CG 3.42Å; F680-L683 PolarHBondContact O-N 3.43Å; F680-L683 VanDerWaalsContact O-N 3.17Å; L683-F685 VanDerWaalsContact C-N 3.29Å; L683-F685 PolarHBondContact O-N 3.07Å; L683-Q686 PolarHBondContact O-N 3.19Å; L683-Q686 VanDerWaalsContact O-N 3.09Å; L683-R687 PolarHBondContact O-N 3.02Å
684	P	94.6	Very high	91.5	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-61.4	-36.5	179.5	-27.2	38.4	0	0	0	113.3	Y560 L593 V596 Y635 Y638 R687 I688	Y560-P684 WeakPolarHBondContact OH-CA 3.38Å; L593-P684 HydrophobicContact CD1-CG 3.96Å; V596-P684 HydrophobicContact CG1-CB 4.17Å; V596-P684 HydrophobicContact CG1-CG 4.05Å; Y635-P684 HydrophobicContact CD1-CB 3.87Å; Y635-P684 VanDerWaalsContact CD1-O 3.28Å; Y635-P684 WeakPolarHBondContact CD1-O 3.27Å; Y635-P684 HydrophobicContact CE1-CB 3.77Å; Y635-P684 WeakPolarHBondContact CE1-O 3.45Å; Y638-P684 HydrophobicContact CD1-CB 3.67Å; Y638-P684 HydrophobicContact CD1-CG 3.81Å; Y638-P684 HydrophobicContact CE1-CB 3.82Å; Y638-P684 HydrophobicContact CE1-CG 3.51Å; Y638-P684 HydrophobicContact CE2-CG 4.41Å; Y638-P684 HydrophobicContact CG-CB 4.35Å; Y638-P684 HydrophobicContact CG-CG 4.39Å; P684-R687 PolarHBondContact O-N 2.98Å; P684-I688 WeakPolarHBondContact O-CG2 3.28Å; P684-I688 PolarHBondContact O-N 3.09Å
685	F	90.6	Very high	91.7	Very high	29 Å²	29	22.5 Å²	22.5	13%	0.127	12%	0.118	C	C	.	.	H	α-helix	trans	-64.5	-40.5	174	-179.7	-110.3	0	0	0	112.2	I351 V639 I682 L683 T689	I351-F685 HydrophobicContact CD1-CZ 4.3Å; I351-F685 HydrophobicContact CG1-CE1 4.35Å; I351-F685 HydrophobicContact CG1-CZ 3.74Å; V639-F685 HydrophobicContact CG1-CD2 3.68Å; V639-F685 HydrophobicContact CG1-CE2 4.24Å; V639-F685 HydrophobicContact CG2-CB 4.22Å; V639-F685 HydrophobicContact CG2-CD2 4.24Å; I682-F685 HydrophobicContact CD1-CB 4.09Å; I682-F685 HydrophobicContact CD1-CD1 4.07Å; I682-F685 HydrophobicContact CD1-CG 4.42Å; I682-F685 PolarHBondContact O-N 2.7Å; L683-F685 VanDerWaalsContact C-N 3.29Å; L683-F685 PolarHBondContact O-N 3.07Å; F685-T689 PolarHBondContact O-OG1 2.91Å
686	Q	90.1	Very high	91.5	Very high	31 Å²	31	22 Å²	22	15%	0.145	12%	0.115	C	C	.	.	H	α-helix	trans	-70.2	-35.9	176.6	-60.4	-177.1	0.4	0	0	112.6	L354 Y466 I682 L683 T689 R690	L354-Q686 HydrophobicContact CD2-CG 4.35Å; Y466-Q686 HydrophobicContact CE1-CB 4.38Å; I682-Q686 HydrophobicContact CG1-CG 4.38Å; I682-Q686 PolarHBondContact O-N 3.32Å; L683-Q686 PolarHBondContact O-N 3.19Å; L683-Q686 VanDerWaalsContact O-N 3.09Å; Q686-T689 PolarHBondContact O-OG1 2.9Å; Q686-T689 VanDerWaalsContact O-OG1 3.09Å; Q686-R690 VanDerWaalsContact O-CB 3.31Å; Q686-R690 WeakPolarHBondContact O-CB 3.45Å; Q686-R690 PolarHBondContact O-N 2.91Å
687	R	94.9	Very high	91.2	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-72.6	-46.6	-177.4	-174	63.9	-175.7	161.1	-1.3	112.5	Y466 L553 S556 E557 Y560 Y635 L683 P684 T689 R690 L691	Y466-R687 WeakPolarHBondContact OH-CD 3.35Å; L553-R687 PolarHBondContact O-NH2 2.71Å; S556-R687 VanDerWaalsContact CB-NH1 3.31Å; S556-R687 PolarHBondContact OG-NH1 2.85Å; S556-R687 PolarHBondContact OG-NH2 2.86Å; E557-R687 IonicContact OE2-CZ 2.72Å; E557-R687 IonicContact OE2-NE 3.48Å; E557-R687 PolarHBondContact OE2-NE 3.17Å; E557-R687 IonicContact OE2-NH2 3.48Å; E557-R687 PolarHBondContact OE2-NH2 2.79Å; Y560-R687 HydrophobicContact CD1-CG 3.92Å; Y560-R687 HydrophobicContact CD2-CB 3.69Å; Y560-R687 HydrophobicContact CD2-CG 3.79Å; Y560-R687 HydrophobicContact CE1-CB 4.28Å; Y560-R687 HydrophobicContact CE1-CG 3.91Å; Y560-R687 HydrophobicContact CE2-CB 3.34Å; Y560-R687 HydrophobicContact CE2-CG 3.78Å; Y560-R687 HydrophobicContact CG-CB 4.29Å; Y560-R687 HydrophobicContact CG-CG 3.85Å; Y635-R687 HydrophobicContact CE1-CB 4.36Å; L683-R687 PolarHBondContact O-N 3.02Å; P684-R687 PolarHBondContact O-N 2.98Å; R687-T689 VanDerWaalsContact C-N 3.27Å; R687-T689 PolarHBondContact O-N 3.47Å; R687-R690 PolarHBondContact O-N 3.46Å; R687-L691 HydrophobicContact CG-CD1 4.16Å; R687-L691 HydrophobicContact CG-CG 4.31Å; R687-L691 WeakPolarHBondContact O-CB 3.27Å; R687-L691 WeakPolarHBondContact O-CG 3.36Å; R687-L691 PolarHBondContact O-N 3.13Å
688	I	92.8	Very high	91	Very high	2 Å²	2	21.3 Å²	21.3	1%	0.01	11%	0.108	C	C	.	.	H	α-helix	trans	-63.3	-36.2	-179.1	-167.1	62.4	0	0	0	111.9	Y635 P684 L719 I722 I723	Y635-I688 HydrophobicContact CD1-CB 3.77Å; Y635-I688 HydrophobicContact CD1-CG1 4.49Å; Y635-I688 HydrophobicContact CD1-CG2 4.2Å; Y635-I688 HydrophobicContact CE1-CB 4.12Å; Y635-I688 HydrophobicContact CG-CB 4.47Å; P684-I688 WeakPolarHBondContact O-CG2 3.28Å; P684-I688 PolarHBondContact O-N 3.09Å; I688-L719 HydrophobicContact CD1-CD2 3.87Å; I688-I722 HydrophobicContact CD1-CG2 4.01Å; I688-I722 HydrophobicContact CG1-CG2 3.96Å; I688-I723 HydrophobicContact CG1-CG1 4.21Å
689	T	88.1	Confident	90.5	Very high	37 Å²	37	21 Å²	21	23%	0.227	11%	0.105	C	C	.	.	H	α-helix	trans	-72	-38.6	174.7	51.3	0	0	0	0	112.5	F685 Q686 R687 I723	F685-T689 PolarHBondContact O-OG1 2.91Å; Q686-T689 PolarHBondContact O-OG1 2.9Å; Q686-T689 VanDerWaalsContact O-OG1 3.09Å; R687-T689 VanDerWaalsContact C-N 3.27Å; R687-T689 PolarHBondContact O-N 3.47Å; T689-I723 HydrophobicContact CG2-CD1 4.46Å; T689-I723 HydrophobicContact CG2-CG1 4.39Å; T689-I723 HydrophobicContact CG2-CG2 4.34Å
690	R	89.5	Confident	90.1	Very high	37 Å²	37	26.1 Å²	26.1	14%	0.14	12%	0.124	C	C	.	.	H	α-helix	trans	-69	-36.7	174.4	-169.6	175.8	-178.2	86.9	19.7	113	Y466 E552 Q686 R687 K692 M693 L694	Y466-R690 WeakPolarHBondContact OH-CB 3.37Å; Y466-R690 WeakPolarHBondContact OH-CD 3.44Å; E552-R690 IonicContact OE1-CZ 3.01Å; E552-R690 IonicContact OE1-NH2 3.21Å; E552-R690 PolarHBondContact OE1-NH2 3.25Å; Q686-R690 VanDerWaalsContact O-CB 3.31Å; Q686-R690 WeakPolarHBondContact O-CB 3.45Å; Q686-R690 PolarHBondContact O-N 2.91Å; R687-R690 PolarHBondContact O-N 3.46Å; R690-K692 VanDerWaalsContact C-N 3.3Å; R690-K692 PolarHBondContact O-N 3.26Å; R690-M693 WeakPolarHBondContact O-CA 3.21Å; R690-M693 WeakPolarHBondContact O-CB 3.45Å; R690-M693 PolarHBondContact O-N 2.95Å; R690-L694 HydrophobicContact CG-CD1 4.02Å; R690-L694 HydrophobicContact CG-CG 4.18Å; R690-L694 WeakPolarHBondContact O-CG 3.47Å; R690-L694 PolarHBondContact O-N 2.85Å
691	L	94.3	Very high	89.7	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-55.5	-44.1	177.6	-81.5	170.7	0	0	0	111.7	F603 L631 R687 M693 L694 V695 L719	F603-L691 HydrophobicContact CE1-CD2 4.06Å; F603-L691 HydrophobicContact CZ-CD2 4.32Å; L631-L691 HydrophobicContact CD1-CD1 4.38Å; R687-L691 HydrophobicContact CG-CD1 4.16Å; R687-L691 HydrophobicContact CG-CG 4.31Å; R687-L691 WeakPolarHBondContact O-CB 3.27Å; R687-L691 WeakPolarHBondContact O-CG 3.36Å; R687-L691 PolarHBondContact O-N 3.13Å; L691-M693 VanDerWaalsContact C-N 3.3Å; L691-M693 PolarHBondContact O-N 3.03Å; L691-L694 HydrophobicContact CD2-CD1 4.5Å; L691-L694 PolarHBondContact O-N 3.28Å; L691-V695 WeakPolarHBondContact O-CG2 3.25Å; L691-V695 PolarHBondContact O-N 2.89Å; L691-L719 HydrophobicContact CB-CD1 4.13Å; L691-L719 HydrophobicContact CB-CD2 4.18Å
692	K	90.7	Very high	89.3	Confident	41 Å²	41	30.6 Å²	30.6	18%	0.178	14%	0.142	C	C	.	.	H	α-helix	trans	-54.8	-46.8	172.2	178.6	-162.8	155.7	-70	0	111.3	R690 V695 E696 F716 L719 I723	R690-K692 VanDerWaalsContact C-N 3.3Å; R690-K692 PolarHBondContact O-N 3.26Å; K692-V695 PolarHBondContact O-N 2.88Å; K692-E696 IonicContact NZ-OE2 3.67Å; K692-E696 PolarHBondContact NZ-OE2 3.03Å; K692-E696 WeakPolarHBondContact O-CB 3.32Å; K692-E696 PolarHBondContact O-N 3.29Å; K692-F716 HydrophobicContact CD-CE2 4.16Å; K692-F716 VanDerWaalsContact CE-CE2 3.48Å; K692-F716 HydrophobicContact CG-CD2 3.88Å; K692-F716 HydrophobicContact CG-CE2 3.61Å; K692-L719 HydrophobicContact CB-CB 4.26Å; K692-I723 HydrophobicContact CB-CD1 3.64Å; K692-I723 HydrophobicContact CD-CD1 3.86Å; K692-I723 HydrophobicContact CG-CD1 4.26Å
693	M	85.6	Confident	89	Confident	84 Å²	84	33.4 Å²	33.4	41%	0.414	16%	0.161	S	C	.	.	H	α-helix	trans	-67.8	-34.2	-178.1	-61.1	-52.6	-57.9	0	0	112.6	R690 L691 E696 N697	R690-M693 WeakPolarHBondContact O-CA 3.21Å; R690-M693 WeakPolarHBondContact O-CB 3.45Å; R690-M693 PolarHBondContact O-N 2.95Å; L691-M693 VanDerWaalsContact C-N 3.3Å; L691-M693 PolarHBondContact O-N 3.03Å; M693-E696 PolarHBondContact O-N 2.94Å; M693-N697 WeakPolarHBondContact O-CB 3.4Å; M693-N697 PolarHBondContact O-N 2.93Å
694	L	89.2	Confident	88.3	Confident	1 Å²	1	38.4 Å²	38.4	1%	0.005	19%	0.194	C	C	.	.	H	α-helix	trans	-66	-47.3	174.8	-70.9	163	0	0	0	111.3	E552 L553 S556 R690 L691 E696 N697 I698	E552-L694 HydrophobicContact CB-CD2 4.18Å; E552-L694 HydrophobicContact CG-CD2 3.65Å; E552-L694 WeakPolarHBondContact OE1-CD2 3.45Å; L553-L694 HydrophobicContact CD1-CB 4.22Å; L553-L694 HydrophobicContact CG-CB 4.45Å; S556-L694 WeakPolarHBondContact OG-CD1 3.23Å; R690-L694 HydrophobicContact CG-CD1 4.02Å; R690-L694 HydrophobicContact CG-CG 4.18Å; R690-L694 WeakPolarHBondContact O-CG 3.47Å; R690-L694 PolarHBondContact O-N 2.85Å; L691-L694 HydrophobicContact CD2-CD1 4.5Å; L691-L694 PolarHBondContact O-N 3.28Å; L694-E696 VanDerWaalsContact C-N 3.32Å; L694-E696 PolarHBondContact O-N 2.82Å; L694-N697 WeakPolarHBondContact O-CA 3.44Å; L694-N697 VanDerWaalsContact O-CB 3.24Å; L694-N697 WeakPolarHBondContact O-CB 3.5Å; L694-N697 PolarHBondContact O-N 2.87Å; L694-I698 WeakPolarHBondContact O-CG1 3.26Å; L694-I698 PolarHBondContact O-N 3.25Å
695	V	92	Very high	87.5	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-64.6	-37.3	174.7	-179.9	0	0	0	0	111.3	L553 V624 L691 K692 N697 I698 L699 A712 A715 F716 L719	L553-V695 HydrophobicContact CD1-CG2 4.13Å; V624-V695 HydrophobicContact CG1-CG2 4.07Å; V624-V695 HydrophobicContact CG2-CG2 4.3Å; L691-V695 WeakPolarHBondContact O-CG2 3.25Å; L691-V695 PolarHBondContact O-N 2.89Å; K692-V695 PolarHBondContact O-N 2.88Å; V695-N697 VanDerWaalsContact C-N 3.25Å; V695-N697 PolarHBondContact O-N 3Å; V695-I698 PolarHBondContact O-N 3.42Å; V695-L699 VanDerWaalsContact O-CB 3.3Å; V695-L699 WeakPolarHBondContact O-CB 3.24Å; V695-L699 PolarHBondContact O-N 3.01Å; V695-A712 WeakPolarHBondContact CG1-O 3.49Å; V695-A715 HydrophobicContact CG1-CB 4.08Å; V695-F716 HydrophobicContact CG1-CB 3.99Å; V695-L719 HydrophobicContact CB-CD1 4.37Å; V695-L719 HydrophobicContact CG2-CD1 3.77Å
696	E	84.4	Confident	87.4	Confident	37 Å²	37	42.2 Å²	42.2	17%	0.173	24%	0.236	C	C	.	.	H	α-helix	trans	-63.3	-30.8	172.4	-157.8	-173.9	124	0	0	112.5	K692 M693 L694 K700 F716	K692-E696 IonicContact NZ-OE2 3.67Å; K692-E696 PolarHBondContact NZ-OE2 3.03Å; K692-E696 WeakPolarHBondContact O-CB 3.32Å; K692-E696 PolarHBondContact O-N 3.29Å; M693-E696 PolarHBondContact O-N 2.94Å; L694-E696 VanDerWaalsContact C-N 3.32Å; L694-E696 PolarHBondContact O-N 2.82Å; E696-K700 WeakPolarHBondContact O-CD 3.46Å; E696-K700 VanDerWaalsContact O-CG 3.23Å; E696-K700 WeakPolarHBondContact O-CG 3.22Å; E696-K700 PolarHBondContact O-N 2.94Å; E696-K700 WeakPolarHBondContact OE1-CE 3.33Å; E696-K700 IonicContact OE1-NZ 3.6Å; E696-K700 PolarHBondContact OE1-NZ 3.44Å; E696-F716 HydrophobicContact CB-CD2 3.97Å; E696-F716 HydrophobicContact CB-CE2 3.71Å; E696-F716 HydrophobicContact CG-CD2 4.25Å; E696-F716 HydrophobicContact CG-CE2 3.64Å; E696-F716 HydrophobicContact CG-CZ 4.24Å; E696-F716 VanDerWaalsContact OE2-CE2 3.28Å; E696-F716 WeakPolarHBondContact OE2-CE2 3.37Å
697	N	85.9	Confident	87.4	Confident	34 Å²	34	49.6 Å²	49.6	18%	0.182	26%	0.263	C	S	.	.	H	α-helix	trans	-72	-40.7	175.6	-154	33.1	0	0	0	111.1	E552 M693 L694 V695 R701	E552-N697 PolarHBondContact OE2-ND2 3.29Å; E552-N697 VanDerWaalsContact OE2-ND2 3.11Å; M693-N697 WeakPolarHBondContact O-CB 3.4Å; M693-N697 PolarHBondContact O-N 2.93Å; L694-N697 WeakPolarHBondContact O-CA 3.44Å; L694-N697 VanDerWaalsContact O-CB 3.24Å; L694-N697 WeakPolarHBondContact O-CB 3.5Å; L694-N697 PolarHBondContact O-N 2.87Å; V695-N697 VanDerWaalsContact C-N 3.25Å; V695-N697 PolarHBondContact O-N 3Å; N697-R701 PolarHBondContact O-NH1 3.36Å; N697-R701 VanDerWaalsContact OD1-CZ 3.27Å; N697-R701 PolarHBondContact OD1-NH1 2.96Å; N697-R701 PolarHBondContact OD1-NH2 3.22Å; N697-R701 VanDerWaalsContact OD1-NH2 3.1Å
698	I	89.8	Confident	87	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-65.8	-54.1	174.4	-65	165.3	0	0	0	109.9	L546 A549 K550 L553 V620 L694 V695 K700 R701 T702	L546-I698 HydrophobicContact CD1-CG2 3.88Å; A549-I698 HydrophobicContact CB-CG1 4.05Å; K550-I698 HydrophobicContact CG-CD1 4.25Å; K550-I698 HydrophobicContact CG-CG1 4.29Å; K550-I698 HydrophobicContact CG-CG2 4.31Å; L553-I698 HydrophobicContact CB-CD1 4.44Å; L553-I698 HydrophobicContact CD1-CD1 3.92Å; V620-I698 HydrophobicContact CG2-CD1 3.67Å; L694-I698 WeakPolarHBondContact O-CG1 3.26Å; L694-I698 PolarHBondContact O-N 3.25Å; V695-I698 PolarHBondContact O-N 3.42Å; I698-K700 VanDerWaalsContact C-N 3.27Å; I698-K700 PolarHBondContact O-N 2.9Å; I698-K700 VanDerWaalsContact O-N 3.17Å; I698-R701 CarbonylContact O-C 3.51Å; I698-R701 WeakPolarHBondContact O-CA 3.38Å; I698-R701 PolarHBondContact O-N 3.03Å; I698-T702 PolarHBondContact O-N 3.27Å; I698-T702 PolarHBondContact O-OG1 3.1Å; I698-T702 VanDerWaalsContact O-OG1 3.13Å
699	L	84.1	Confident	86.7	Confident	34 Å²	34	54.6 Å²	54.6	18%	0.178	29%	0.287	C	S	.	.	H	α-helix	trans	-51.9	-41.8	-178.7	179.4	60.8	0	0	0	112.9	V695 R701 T702 E709 A712 T713	V695-L699 VanDerWaalsContact O-CB 3.3Å; V695-L699 WeakPolarHBondContact O-CB 3.24Å; V695-L699 PolarHBondContact O-N 3.01Å; L699-R701 PolarHBondContact O-N 3Å; L699-R701 VanDerWaalsContact O-N 3.15Å; L699-T702 PolarHBondContact O-N 3.41Å; L699-E709 HydrophobicContact CD1-CG 3.69Å; L699-A712 HydrophobicContact CB-CB 4.12Å; L699-A712 HydrophobicContact CD1-CB 3.87Å; L699-T713 WeakPolarHBondContact CD1-OG1 3.26Å
700	K	82.5	Confident	86.7	Confident	132 Å²	132	57 Å²	57	57%	0.574	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-7.6	176.9	-74.3	169.8	-174	163.3	0	115.4	E696 I698	E696-K700 WeakPolarHBondContact O-CD 3.46Å; E696-K700 VanDerWaalsContact O-CG 3.23Å; E696-K700 WeakPolarHBondContact O-CG 3.22Å; E696-K700 PolarHBondContact O-N 2.94Å; E696-K700 WeakPolarHBondContact OE1-CE 3.33Å; E696-K700 IonicContact OE1-NZ 3.6Å; E696-K700 PolarHBondContact OE1-NZ 3.44Å; I698-K700 VanDerWaalsContact C-N 3.27Å; I698-K700 PolarHBondContact O-N 2.9Å; I698-K700 VanDerWaalsContact O-N 3.17Å
701	R	85.4	Confident	86.8	Confident	89 Å²	89	56.5 Å²	56.5	34%	0.336	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-121.5	-8.9	179.5	-68.3	170	-176.3	72.4	-10.7	112.9	K545 L546 N697 I698 L699	K545-R701 WeakPolarHBondContact O-CD 3.39Å; L546-R701 HydrophobicContact CB-CB 4.14Å; L546-R701 HydrophobicContact CD1-CB 3.89Å; N697-R701 PolarHBondContact O-NH1 3.36Å; N697-R701 VanDerWaalsContact OD1-CZ 3.27Å; N697-R701 PolarHBondContact OD1-NH1 2.96Å; N697-R701 PolarHBondContact OD1-NH2 3.22Å; N697-R701 VanDerWaalsContact OD1-NH2 3.1Å; I698-R701 CarbonylContact O-C 3.51Å; I698-R701 WeakPolarHBondContact O-CA 3.38Å; I698-R701 PolarHBondContact O-N 3.03Å; L699-R701 PolarHBondContact O-N 3Å; L699-R701 VanDerWaalsContact O-N 3.15Å
702	T	87.1	Confident	86.5	Confident	12 Å²	12	56.5 Å²	56.5	7%	0.074	30%	0.3	C	S	.	.	S	Bend	trans	-70.7	145.6	173.9	-55.6	0	0	0	0	110.2	I698 L699 P704 S706 D708 E709	I698-T702 PolarHBondContact O-N 3.27Å; I698-T702 PolarHBondContact O-OG1 3.1Å; I698-T702 VanDerWaalsContact O-OG1 3.13Å; L699-T702 PolarHBondContact O-N 3.41Å; T702-P704 WeakPolarHBondContact O-CD 3.27Å; T702-S706 WeakPolarHBondContact CG2-OG 3.24Å; T702-D708 HydrophobicContact CG2-CB 3.73Å; T702-E709 HydrophobicContact CG2-CB 4.1Å
703	T	84.6	Confident	86.4	Confident	101 Å²	101	56.7 Å²	56.7	62%	0.62	31%	0.305	S	S	*	.	P	Polyproline II helix	trans	-62.7	126.2	179.5	-49.1	0	0	0	0	111.2	S706	T703-S706 VanDerWaalsContact O-CB 3.23Å; T703-S706 WeakPolarHBondContact O-CB 3.34Å; T703-S706 PolarHBondContact O-N 2.75Å; T703-S706 PolarHBondContact O-OG 2.77Å
704	P	78.7	Confident	86.7	Confident	106 Å²	106	58.2 Å²	58.2	69%	0.688	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	141.1	177.8	-26.1	35.7	0	0	0	113.1	T702 S706 E709	T702-P704 WeakPolarHBondContact O-CD 3.27Å; P704-S706 VanDerWaalsContact C-N 3.29Å; P704-E709 VanDerWaalsContact CA-OE2 3.31Å; P704-E709 WeakPolarHBondContact CA-OE2 3.42Å
705	G	76.9	Confident	86.9	Confident	78 Å²	78	58.1 Å²	58.1	80%	0.804	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.7	16	-177	0	0	0	0	0	114.3	E709	G705-E709 PolarHBondContact N-OE2 3.34Å
706	S	89.1	Confident	86.9	Confident	30 Å²	30	59.6 Å²	59.6	21%	0.21	32%	0.315	C	S	.	.	S	Bend	trans	-97.8	152.1	177.2	71.9	0	0	0	0	112.5	T702 T703 P704 D708 E709 D710	T702-S706 WeakPolarHBondContact CG2-OG 3.24Å; T703-S706 VanDerWaalsContact O-CB 3.23Å; T703-S706 WeakPolarHBondContact O-CB 3.34Å; T703-S706 PolarHBondContact O-N 2.75Å; T703-S706 PolarHBondContact O-OG 2.77Å; P704-S706 VanDerWaalsContact C-N 3.29Å; S706-D708 PolarHBondContact O-N 2.71Å; S706-D708 VanDerWaalsContact O-N 3.14Å; S706-E709 WeakPolarHBondContact O-CA 3.47Å; S706-E709 VanDerWaalsContact O-CB 3.29Å; S706-E709 WeakPolarHBondContact O-CB 3.45Å; S706-E709 PolarHBondContact O-N 2.85Å; S706-E709 PolarHBondContact OG-N 3.14Å; S706-D710 PolarHBondContact O-N 3.5Å
707	R	89.6	Confident	87.1	Confident	187 Å²	187	60 Å²	60	71%	0.706	32%	0.319	S	S	*	.	H	α-helix	trans	-56.8	-28.6	173	-173.9	-158.9	63.2	-156	-10.9	112.5	E709 T711	R707-E709 VanDerWaalsContact C-N 3.35Å; R707-T711 WeakPolarHBondContact O-CB 3.46Å; R707-T711 PolarHBondContact O-N 2.93Å; R707-T711 PolarHBondContact O-OG1 3.06Å
708	D	86.4	Confident	87.6	Confident	46 Å²	46	60.9 Å²	60.9	25%	0.246	32%	0.321	C	S	.	.	H	α-helix	trans	-72.8	-30.4	177.4	-67.7	22.6	0	0	0	110.6	T702 S706 A712	T702-D708 HydrophobicContact CG2-CB 3.73Å; S706-D708 PolarHBondContact O-N 2.71Å; S706-D708 VanDerWaalsContact O-N 3.14Å; D708-A712 VanDerWaalsContact O-CB 3.26Å; D708-A712 WeakPolarHBondContact O-CB 3.29Å; D708-A712 PolarHBondContact O-N 3.31Å
709	E	87.6	Confident	87.7	Confident	60 Å²	60	60.9 Å²	60.9	28%	0.28	32%	0.321	S	S	.	.	H	α-helix	trans	-68.5	-45.3	170.9	-171.3	-173.9	-155.6	0	0	111.1	L699 T702 P704 G705 S706 R707 T711 A712 T713	L699-E709 HydrophobicContact CD1-CG 3.69Å; T702-E709 HydrophobicContact CG2-CB 4.1Å; P704-E709 VanDerWaalsContact CA-OE2 3.31Å; P704-E709 WeakPolarHBondContact CA-OE2 3.42Å; G705-E709 PolarHBondContact N-OE2 3.34Å; S706-E709 WeakPolarHBondContact O-CA 3.47Å; S706-E709 VanDerWaalsContact O-CB 3.29Å; S706-E709 WeakPolarHBondContact O-CB 3.45Å; S706-E709 PolarHBondContact O-N 2.85Å; S706-E709 PolarHBondContact OG-N 3.14Å; R707-E709 VanDerWaalsContact C-N 3.35Å; E709-T711 PolarHBondContact O-N 3.19Å; E709-A712 PolarHBondContact O-N 3.4Å; E709-T713 VanDerWaalsContact O-CB 3.25Å; E709-T713 WeakPolarHBondContact O-CB 3.3Å; E709-T713 PolarHBondContact O-N 3.37Å; E709-T713 PolarHBondContact O-OG1 2.93Å
710	D	86.3	Confident	87.8	Confident	89 Å²	89	62.9 Å²	62.9	48%	0.476	33%	0.329	S	S	.	.	H	α-helix	trans	-54.6	-44.6	173.6	-71.8	-39.3	0	0	0	111.2	S706 T713 K714	S706-D710 PolarHBondContact O-N 3.5Å; D710-T713 PolarHBondContact O-N 2.8Å; D710-K714 WeakPolarHBondContact O-CD 3.19Å; D710-K714 VanDerWaalsContact O-CG 3.27Å; D710-K714 WeakPolarHBondContact O-CG 3.47Å; D710-K714 PolarHBondContact O-N 3.39Å
711	T	92.1	Very high	88.3	Confident	25 Å²	25	60.1 Å²	60.1	15%	0.153	32%	0.317	C	S	.	.	H	α-helix	trans	-72.2	-45.4	-175.1	-54.1	0	0	0	0	110.9	C621 D622 R707 E709 T713 K714 A715	C621-T711 HydrophobicContact CB-CG2 4.15Å; D622-T711 HydrophobicContact CB-CG2 3.98Å; R707-T711 WeakPolarHBondContact O-CB 3.46Å; R707-T711 PolarHBondContact O-N 2.93Å; R707-T711 PolarHBondContact O-OG1 3.06Å; E709-T711 PolarHBondContact O-N 3.19Å; T711-T713 VanDerWaalsContact C-N 3.31Å; T711-T713 PolarHBondContact O-N 3.27Å; T711-K714 PolarHBondContact O-N 3.18Å; T711-A715 WeakPolarHBondContact O-CB 3.37Å; T711-A715 PolarHBondContact O-N 2.65Å
712	A	89	Confident	88.7	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-62	-36.4	172.9	0	0	0	0	0	112.5	C621 V695 L699 D708 E709 F716	C621-A712 HydrophobicContact CB-CB 4.11Å; V695-A712 WeakPolarHBondContact CG1-O 3.49Å; L699-A712 HydrophobicContact CB-CB 4.12Å; L699-A712 HydrophobicContact CD1-CB 3.87Å; D708-A712 VanDerWaalsContact O-CB 3.26Å; D708-A712 WeakPolarHBondContact O-CB 3.29Å; D708-A712 PolarHBondContact O-N 3.31Å; E709-A712 PolarHBondContact O-N 3.4Å; A712-F716 WeakPolarHBondContact O-CB 3.3Å; A712-F716 PolarHBondContact O-N 3.12Å
713	T	87.1	Confident	88.8	Confident	46 Å²	46	57.1 Å²	57.1	28%	0.282	31%	0.307	S	S	.	.	H	α-helix	trans	-66.2	-43.6	176	-61.7	0	0	0	0	111.8	L699 E709 D710 T711 F716 N717	L699-T713 WeakPolarHBondContact CD1-OG1 3.26Å; E709-T713 VanDerWaalsContact O-CB 3.25Å; E709-T713 WeakPolarHBondContact O-CB 3.3Å; E709-T713 PolarHBondContact O-N 3.37Å; E709-T713 PolarHBondContact O-OG1 2.93Å; D710-T713 PolarHBondContact O-N 2.8Å; T711-T713 VanDerWaalsContact C-N 3.31Å; T711-T713 PolarHBondContact O-N 3.27Å; T713-F716 PolarHBondContact O-N 3.14Å; T713-N717 WeakPolarHBondContact O-CB 3.42Å; T713-N717 PolarHBondContact O-N 3.3Å; T713-N717 PolarHBondContact O-ND2 3.46Å
714	K	92.5	Very high	88.9	Confident	115 Å²	115	59 Å²	59	50%	0.5	31%	0.306	S	S	.	.	H	α-helix	trans	-62.9	-48.3	175.1	-72.7	159.5	-177.6	159.5	0	111.6	L625 D710 T711 F716 N717 E718	L625-K714 HydrophobicContact CD1-CB 4.27Å; L625-K714 HydrophobicContact CD2-CB 3.81Å; D710-K714 WeakPolarHBondContact O-CD 3.19Å; D710-K714 VanDerWaalsContact O-CG 3.27Å; D710-K714 WeakPolarHBondContact O-CG 3.47Å; D710-K714 PolarHBondContact O-N 3.39Å; T711-K714 PolarHBondContact O-N 3.18Å; K714-F716 VanDerWaalsContact C-N 3.34Å; K714-F716 PolarHBondContact O-N 3.09Å; K714-N717 PolarHBondContact O-N 3.15Å; K714-E718 PolarHBondContact O-N 2.82Å
715	A	94.5	Very high	89.4	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-57.8	-44.4	175.6	0	0	0	0	0	112.3	C621 V624 L625 V695 T711 L719	C621-A715 WeakPolarHBondContact O-CB 3.2Å; V624-A715 HydrophobicContact CB-CB 4.28Å; V624-A715 HydrophobicContact CG1-CB 3.99Å; L625-A715 HydrophobicContact CB-CB 4.24Å; V695-A715 HydrophobicContact CG1-CB 4.08Å; T711-A715 WeakPolarHBondContact O-CB 3.37Å; T711-A715 PolarHBondContact O-N 2.65Å; A715-L719 WeakPolarHBondContact O-CB 3.29Å; A715-L719 WeakPolarHBondContact O-CG 3.36Å; A715-L719 PolarHBondContact O-N 2.72Å
716	F	92.3	Very high	90	Very high	30 Å²	30	52.8 Å²	52.8	13%	0.132	25%	0.247	C	C	.	.	H	α-helix	trans	-61.5	-43.5	176.2	175.3	-100.3	0	0	0	112.8	K692 V695 E696 A712 T713 K714 K720	K692-F716 HydrophobicContact CD-CE2 4.16Å; K692-F716 VanDerWaalsContact CE-CE2 3.48Å; K692-F716 HydrophobicContact CG-CD2 3.88Å; K692-F716 HydrophobicContact CG-CE2 3.61Å; V695-F716 HydrophobicContact CG1-CB 3.99Å; E696-F716 HydrophobicContact CB-CD2 3.97Å; E696-F716 HydrophobicContact CB-CE2 3.71Å; E696-F716 HydrophobicContact CG-CD2 4.25Å; E696-F716 HydrophobicContact CG-CE2 3.64Å; E696-F716 HydrophobicContact CG-CZ 4.24Å; E696-F716 VanDerWaalsContact OE2-CE2 3.28Å; E696-F716 WeakPolarHBondContact OE2-CE2 3.37Å; A712-F716 WeakPolarHBondContact O-CB 3.3Å; A712-F716 PolarHBondContact O-N 3.12Å; T713-F716 PolarHBondContact O-N 3.14Å; K714-F716 VanDerWaalsContact C-N 3.34Å; K714-F716 PolarHBondContact O-N 3.09Å; F716-K720 HydrophobicContact CE1-CD 4.32Å; F716-K720 VanDerWaalsContact O-CB 3.23Å; F716-K720 WeakPolarHBondContact O-CB 3.31Å; F716-K720 PolarHBondContact O-N 3.04Å
717	N	88.3	Confident	89.9	Confident	47 Å²	47	54.4 Å²	54.4	25%	0.251	25%	0.254	S	S	.	.	H	α-helix	trans	-69.4	-40.6	-179.2	-79	-29.4	0	0	0	112.6	T713 K714 K720 K721	T713-N717 WeakPolarHBondContact O-CB 3.42Å; T713-N717 PolarHBondContact O-N 3.3Å; T713-N717 PolarHBondContact O-ND2 3.46Å; K714-N717 PolarHBondContact O-N 3.15Å; N717-K720 WeakPolarHBondContact O-CB 3.26Å; N717-K720 PolarHBondContact O-N 3.38Å; N717-K721 WeakPolarHBondContact O-CB 3.44Å; N717-K721 PolarHBondContact O-N 3.39Å
718	E	95.4	Very high	89.7	Confident	51 Å²	51	48.1 Å²	48.1	24%	0.238	24%	0.239	C	C	.	.	H	α-helix	trans	-67.2	-41.4	173.7	-81.5	-62.6	136.5	0	0	112.3	L625 C628 K714 K720 K721 I722	L625-E718 HydrophobicContact CD1-CB 4.33Å; L625-E718 HydrophobicContact CD1-CG 4.08Å; C628-E718 HydrophobicContact CB-CB 4.13Å; K714-E718 PolarHBondContact O-N 2.82Å; E718-K720 VanDerWaalsContact C-N 3.32Å; E718-K720 PolarHBondContact O-N 3.2Å; E718-K721 WeakPolarHBondContact O-CB 3.24Å; E718-K721 PolarHBondContact O-N 2.76Å; E718-K721 VanDerWaalsContact O-N 3.12Å; E718-K721 WeakPolarHBondContact OE1-CD 3.33Å; E718-K721 WeakPolarHBondContact OE1-CE 3.12Å; E718-K721 IonicContact OE1-NZ 2.67Å; E718-K721 PolarHBondContact OE1-NZ 3.42Å; E718-I722 WeakPolarHBondContact O-CG1 3.44Å; E718-I722 PolarHBondContact O-N 2.77Å
719	L	92.6	Very high	89.8	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-59.8	-42	172.6	-74.1	172	0	0	0	112.1	V624 I688 L691 K692 V695 A715 K721 I722 I723	V624-L719 HydrophobicContact CG1-CD1 3.71Å; V624-L719 HydrophobicContact CG1-CG 4.22Å; I688-L719 HydrophobicContact CD1-CD2 3.87Å; L691-L719 HydrophobicContact CB-CD1 4.13Å; L691-L719 HydrophobicContact CB-CD2 4.18Å; K692-L719 HydrophobicContact CB-CB 4.26Å; V695-L719 HydrophobicContact CB-CD1 4.37Å; V695-L719 HydrophobicContact CG2-CD1 3.77Å; A715-L719 WeakPolarHBondContact O-CB 3.29Å; A715-L719 WeakPolarHBondContact O-CG 3.36Å; A715-L719 PolarHBondContact O-N 2.72Å; L719-K721 VanDerWaalsContact C-N 3.32Å; L719-K721 PolarHBondContact O-N 3.47Å; L719-I722 PolarHBondContact O-N 2.83Å; L719-I723 WeakPolarHBondContact O-CD1 3.49Å; L719-I723 VanDerWaalsContact O-CG1 3.27Å; L719-I723 WeakPolarHBondContact O-CG1 3.38Å; L719-I723 PolarHBondContact O-N 3Å
720	K	86.3	Confident	89.7	Confident	76 Å²	76	45.5 Å²	45.5	33%	0.33	23%	0.23	S	C	.	.	H	α-helix	trans	-61.8	-37.2	174.3	177	-172.4	175	-167.1	0	112.3	F716 N717 E718 K724	F716-K720 HydrophobicContact CE1-CD 4.32Å; F716-K720 VanDerWaalsContact O-CB 3.23Å; F716-K720 WeakPolarHBondContact O-CB 3.31Å; F716-K720 PolarHBondContact O-N 3.04Å; N717-K720 WeakPolarHBondContact O-CB 3.26Å; N717-K720 PolarHBondContact O-N 3.38Å; E718-K720 VanDerWaalsContact C-N 3.32Å; E718-K720 PolarHBondContact O-N 3.2Å; K720-K724 WeakPolarHBondContact O-CB 3.43Å; K720-K724 PolarHBondContact O-N 3.42Å
721	K	92.8	Very high	89.6	Confident	74 Å²	74	46 Å²	46	32%	0.322	23%	0.229	S	C	.	.	H	α-helix	trans	-66.4	-46.8	175.6	-168.4	175.9	-179.2	170.6	0	111.2	N717 E718 L719 I723 K724 E725	N717-K721 WeakPolarHBondContact O-CB 3.44Å; N717-K721 PolarHBondContact O-N 3.39Å; E718-K721 WeakPolarHBondContact O-CB 3.24Å; E718-K721 PolarHBondContact O-N 2.76Å; E718-K721 VanDerWaalsContact O-N 3.12Å; E718-K721 WeakPolarHBondContact OE1-CD 3.33Å; E718-K721 WeakPolarHBondContact OE1-CE 3.12Å; E718-K721 IonicContact OE1-NZ 2.67Å; E718-K721 PolarHBondContact OE1-NZ 3.42Å; L719-K721 VanDerWaalsContact C-N 3.32Å; L719-K721 PolarHBondContact O-N 3.47Å; K721-I723 PolarHBondContact O-N 3.16Å; K721-K724 WeakPolarHBondContact O-CB 3.34Å; K721-K724 PolarHBondContact O-N 3.04Å; K721-E725 WeakPolarHBondContact O-CG 3.4Å; K721-E725 PolarHBondContact O-N 2.98Å
722	I	94.4	Very high	89.4	Confident	1 Å²	1	46.9 Å²	46.9	1%	0.005	24%	0.236	C	C	.	.	H	α-helix	trans	-59.5	-46	175.3	-63.7	165.9	0	0	0	111.3	C628 R632 I688 E718 L719 K724 E725 C726	C628-I722 HydrophobicContact CB-CD1 4.03Å; C628-I722 WeakPolarHBondContact O-CD1 3.36Å; R632-I722 HydrophobicContact CB-CD1 3.98Å; R632-I722 HydrophobicContact CB-CG1 3.94Å; R632-I722 HydrophobicContact CG-CG1 4.26Å; I688-I722 HydrophobicContact CD1-CG2 4.01Å; I688-I722 HydrophobicContact CG1-CG2 3.96Å; E718-I722 WeakPolarHBondContact O-CG1 3.44Å; E718-I722 PolarHBondContact O-N 2.77Å; L719-I722 PolarHBondContact O-N 2.83Å; I722-K724 PolarHBondContact O-N 3.46Å; I722-E725 PolarHBondContact O-N 3.32Å; I722-C726 PolarHBondContact O-N 3.29Å; I722-C726 PolarHBondContact O-SG 3.1Å
723	I	87.8	Confident	89.3	Confident	38 Å²	38	47.6 Å²	47.6	20%	0.195	24%	0.24	C	C	.	.	H	α-helix	trans	-61.6	-43.9	178	-67.1	161.7	0	0	0	111.1	I688 T689 K692 L719 K721 E725 C726 N727	I688-I723 HydrophobicContact CG1-CG1 4.21Å; T689-I723 HydrophobicContact CG2-CD1 4.46Å; T689-I723 HydrophobicContact CG2-CG1 4.39Å; T689-I723 HydrophobicContact CG2-CG2 4.34Å; K692-I723 HydrophobicContact CB-CD1 3.64Å; K692-I723 HydrophobicContact CD-CD1 3.86Å; K692-I723 HydrophobicContact CG-CD1 4.26Å; L719-I723 WeakPolarHBondContact O-CD1 3.49Å; L719-I723 VanDerWaalsContact O-CG1 3.27Å; L719-I723 WeakPolarHBondContact O-CG1 3.38Å; L719-I723 PolarHBondContact O-N 3Å; K721-I723 PolarHBondContact O-N 3.16Å; I723-E725 PolarHBondContact O-N 2.61Å; I723-C726 PolarHBondContact O-N 3.12Å; I723-N727 PolarHBondContact O-N 3.38Å; I723-N727 VanDerWaalsContact O-N 3.08Å
724	K	86.6	Confident	89.2	Confident	140 Å²	140	47.6 Å²	47.6	61%	0.609	24%	0.236	S	C	*	.	H	α-helix	trans	-60	-45.7	176.7	-177.4	-168	173.6	-163	0	111.4	K720 K721 I722 N727 S728	K720-K724 WeakPolarHBondContact O-CB 3.43Å; K720-K724 PolarHBondContact O-N 3.42Å; K721-K724 WeakPolarHBondContact O-CB 3.34Å; K721-K724 PolarHBondContact O-N 3.04Å; I722-K724 PolarHBondContact O-N 3.46Å; K724-N727 WeakPolarHBondContact O-CB 3.28Å; K724-N727 PolarHBondContact O-N 3.18Å; K724-S728 PolarHBondContact O-N 3.4Å; K724-S728 PolarHBondContact O-OG 3.37Å
725	E	90.4	Very high	89	Confident	48 Å²	48	44.7 Å²	44.7	22%	0.224	22%	0.222	C	C	.	.	H	α-helix	trans	-65.6	-39.2	178.6	-71.5	172.4	175.9	0	0	112.7	R632 L636 K721 I722 I723 N727 S728 S729	R632-E725 VanDerWaalsContact CZ-CD 3.42Å; R632-E725 IonicContact CZ-OE1 2.8Å; R632-E725 IonicContact CZ-OE2 2.69Å; R632-E725 IonicContact NE-OE2 3.74Å; R632-E725 IonicContact NH1-OE1 3.17Å; R632-E725 PolarHBondContact NH1-OE1 2.91Å; R632-E725 IonicContact NH1-OE2 3.69Å; R632-E725 PolarHBondContact NH1-OE2 2.67Å; R632-E725 IonicContact NH2-OE1 2.83Å; R632-E725 PolarHBondContact NH2-OE1 3.17Å; R632-E725 IonicContact NH2-OE2 2.89Å; R632-E725 PolarHBondContact NH2-OE2 3.29Å; L636-E725 HydrophobicContact CD1-CB 4.37Å; K721-E725 WeakPolarHBondContact O-CG 3.4Å; K721-E725 PolarHBondContact O-N 2.98Å; I722-E725 PolarHBondContact O-N 3.32Å; I723-E725 PolarHBondContact O-N 2.61Å; E725-N727 VanDerWaalsContact C-N 3.32Å; E725-N727 PolarHBondContact O-N 3.2Å; E725-S728 PolarHBondContact O-N 3.06Å; E725-S729 VanDerWaalsContact O-CB 3.27Å; E725-S729 WeakPolarHBondContact O-CB 3.24Å; E725-S729 PolarHBondContact O-N 3.32Å
726	C	88.9	Confident	88.7	Confident	5 Å²	5	46.9 Å²	46.9	3%	0.034	23%	0.233	C	C	.	.	H	α-helix	trans	-58.7	-45.1	172.9	-67.6	0	0	0	0	111.2	L636 V639 I722 I723 S729 V730	L636-C726 HydrophobicContact CD1-CB 4.37Å; V639-C726 HydrophobicContact CB-CB 4.43Å; V639-C726 HydrophobicContact CG1-CB 3.98Å; I722-C726 PolarHBondContact O-N 3.29Å; I722-C726 PolarHBondContact O-SG 3.1Å; I723-C726 PolarHBondContact O-N 3.12Å; C726-S729 PolarHBondContact O-N 3.24Å; C726-V730 WeakPolarHBondContact O-CG2 3.32Å; C726-V730 PolarHBondContact O-N 3.05Å
727	N	86.3	Confident	88.5	Confident	65 Å²	65	46.1 Å²	46.1	35%	0.348	23%	0.229	S	C	.	.	H	α-helix	trans	-61.8	-48.4	175.6	-176.7	71.2	0	0	0	112.2	A347 I723 K724 E725 S729 V730 Q731	A347-N727 WeakPolarHBondContact CB-OD1 3.25Å; I723-N727 PolarHBondContact O-N 3.38Å; I723-N727 VanDerWaalsContact O-N 3.08Å; K724-N727 WeakPolarHBondContact O-CB 3.28Å; K724-N727 PolarHBondContact O-N 3.18Å; E725-N727 VanDerWaalsContact C-N 3.32Å; E725-N727 PolarHBondContact O-N 3.2Å; N727-S729 VanDerWaalsContact C-N 3.33Å; N727-S729 PolarHBondContact O-N 2.69Å; N727-V730 PolarHBondContact O-N 2.83Å; N727-Q731 WeakPolarHBondContact O-CB 3.06Å; N727-Q731 PolarHBondContact O-N 3.18Å
728	S	86.1	Confident	88.5	Confident	55 Å²	55	46.3 Å²	46.3	39%	0.385	23%	0.229	S	C	.	.	H	α-helix	trans	-63.6	-34.9	177.3	-66.6	0	0	0	0	113.1	K724 E725 Q731 S732	K724-S728 PolarHBondContact O-N 3.4Å; K724-S728 PolarHBondContact O-OG 3.37Å; E725-S728 PolarHBondContact O-N 3.06Å; S728-Q731 PolarHBondContact O-N 2.83Å; S728-S732 WeakPolarHBondContact O-CB 3.5Å; S728-S732 PolarHBondContact O-N 3.09Å
729	S	87.6	Confident	88.4	Confident	37 Å²	37	43.9 Å²	43.9	26%	0.259	22%	0.217	S	C	.	.	H	α-helix	trans	-67.9	-48.3	176.2	-173	0	0	0	0	111.6	T640 E725 C726 N727 Q731 S732 M733	T640-S729 WeakPolarHBondContact CG2-OG 3.5Å; T640-S729 WeakPolarHBondContact OG1-CB 3.49Å; T640-S729 PolarHBondContact OG1-OG 3.42Å; E725-S729 VanDerWaalsContact O-CB 3.27Å; E725-S729 WeakPolarHBondContact O-CB 3.24Å; E725-S729 PolarHBondContact O-N 3.32Å; C726-S729 PolarHBondContact O-N 3.24Å; N727-S729 VanDerWaalsContact C-N 3.33Å; N727-S729 PolarHBondContact O-N 2.69Å; S729-Q731 VanDerWaalsContact C-N 3.28Å; S729-Q731 PolarHBondContact O-N 2.89Å; S729-S732 PolarHBondContact O-N 2.83Å; S729-S732 VanDerWaalsContact O-N 3.13Å; S729-M733 WeakPolarHBondContact O-CB 3.37Å; S729-M733 PolarHBondContact O-N 2.8Å
730	V	86.3	Confident	88.2	Confident	13 Å²	13	44.8 Å²	44.8	8%	0.079	22%	0.222	C	C	.	.	H	α-helix	trans	-57.7	-40.5	173.2	170.8	0	0	0	0	111.4	A347 V639 C726 N727 K734	A347-V730 HydrophobicContact CB-CG1 4.06Å; V639-V730 HydrophobicContact CG1-CG2 4.23Å; V639-V730 WeakPolarHBondContact O-CG2 3.32Å; C726-V730 WeakPolarHBondContact O-CG2 3.32Å; C726-V730 PolarHBondContact O-N 3.05Å; N727-V730 PolarHBondContact O-N 2.83Å; V730-K734 HydrophobicContact CG1-CD 4.35Å; V730-K734 WeakPolarHBondContact O-CG 3.21Å; V730-K734 PolarHBondContact O-N 3.04Å
731	Q	84.9	Confident	88.3	Confident	101 Å²	101	45.4 Å²	45.4	47%	0.472	23%	0.226	S	C	.	.	H	α-helix	trans	-66.8	-43.1	175.3	-168.4	-178.2	25.1	0	0	111.7	N727 S728 S729 M733 K734 R735	N727-Q731 WeakPolarHBondContact O-CB 3.06Å; N727-Q731 PolarHBondContact O-N 3.18Å; S728-Q731 PolarHBondContact O-N 2.83Å; S729-Q731 VanDerWaalsContact C-N 3.28Å; S729-Q731 PolarHBondContact O-N 2.89Å; Q731-M733 PolarHBondContact O-N 2.84Å; Q731-K734 PolarHBondContact O-N 2.8Å; Q731-R735 VanDerWaalsContact O-CG 3.3Å; Q731-R735 WeakPolarHBondContact O-CG 3.28Å; Q731-R735 PolarHBondContact O-N 3Å; Q731-R735 VanDerWaalsContact O-N 3.11Å
732	S	87.1	Confident	88.2	Confident	42 Å²	42	42.7 Å²	42.7	29%	0.294	22%	0.215	S	C	.	.	H	α-helix	trans	-66.2	-37.6	178.3	-141.8	0	0	0	0	112.6	S728 S729 R735 M736	S728-S732 WeakPolarHBondContact O-CB 3.5Å; S728-S732 PolarHBondContact O-N 3.09Å; S729-S732 PolarHBondContact O-N 2.83Å; S729-S732 VanDerWaalsContact O-N 3.13Å; S732-R735 PolarHBondContact O-N 3.33Å; S732-R735 PolarHBondContact OG-NH2 3.09Å; S732-M736 WeakPolarHBondContact O-CB 3.36Å; S732-M736 PolarHBondContact O-N 2.76Å
733	M	86.4	Confident	88	Confident	16 Å²	16	45.8 Å²	45.8	8%	0.079	23%	0.231	C	C	.	.	H	α-helix	trans	-61.1	-44.2	174.1	-170	-175	80.3	0	0	111.9	T640 A643 Y644 S729 Q731 M736 E737	T640-M733 HydrophobicContact CG2-CB 4.18Å; T640-M733 HydrophobicContact CG2-CG 4.41Å; T640-M733 HydrophobicContact CG2-SD 3.69Å; T640-M733 WeakPolarHBondContact O-CE 3.16Å; A643-M733 HydrophobicContact CB-CE 4.25Å; Y644-M733 HydrophobicContact CD2-CE 4.18Å; Y644-M733 HydrophobicContact CD2-SD 3.94Å; Y644-M733 HydrophobicContact CE2-CE 3.82Å; Y644-M733 HydrophobicContact CE2-CG 4.17Å; Y644-M733 HydrophobicContact CE2-SD 3.37Å; Y644-M733 WeakPolarHBondContact CE2-SD 3.38Å; S729-M733 WeakPolarHBondContact O-CB 3.37Å; S729-M733 PolarHBondContact O-N 2.8Å; Q731-M733 PolarHBondContact O-N 2.84Å; M733-M736 PolarHBondContact O-N 2.83Å; M733-E737 WeakPolarHBondContact O-CB 3.39Å; M733-E737 PolarHBondContact O-N 3.11Å
734	K	85.6	Confident	88.1	Confident	46 Å²	46	49.4 Å²	49.4	20%	0.2	25%	0.246	C	C	.	.	H	α-helix	trans	-63.2	-42.4	177	-71.4	169.6	-172.4	176	0	112.3	F345 V730 Q731 E737 E738	F345-K734 PolarHBondContact O-NZ 3.35Å; V730-K734 HydrophobicContact CG1-CD 4.35Å; V730-K734 WeakPolarHBondContact O-CG 3.21Å; V730-K734 PolarHBondContact O-N 3.04Å; Q731-K734 PolarHBondContact O-N 2.8Å; K734-E737 PolarHBondContact O-N 2.7Å; K734-E738 WeakPolarHBondContact O-CB 3.48Å; K734-E738 PolarHBondContact O-N 2.95Å
735	R	88.6	Confident	88.2	Confident	54 Å²	54	46.2 Å²	46.2	20%	0.204	23%	0.232	C	C	.	.	H	α-helix	trans	-64.7	-40.2	175.9	-64.3	173.5	-40	156.5	7.6	111.5	Q731 S732 E738 L739 W761	Q731-R735 VanDerWaalsContact O-CG 3.3Å; Q731-R735 WeakPolarHBondContact O-CG 3.28Å; Q731-R735 PolarHBondContact O-N 3Å; Q731-R735 VanDerWaalsContact O-N 3.11Å; S732-R735 PolarHBondContact O-N 3.33Å; S732-R735 PolarHBondContact OG-NH2 3.09Å; R735-E738 PolarHBondContact O-N 3.47Å; R735-L739 WeakPolarHBondContact O-CG 3.4Å; R735-L739 PolarHBondContact O-N 3.42Å; R735-W761 HydrophobicContact CB-CB 3.79Å; R735-W761 VanDerWaalsContact CD-CB 3.49Å; R735-W761 HydrophobicContact CG-CB 3.81Å
736	M	88.5	Confident	88.2	Confident	46 Å²	46	44.3 Å²	44.3	23%	0.227	22%	0.223	C	C	.	.	H	α-helix	trans	-63.6	-45.5	174	178.9	58.3	61.6	0	0	112.1	S732 M733 E738 L739 I740 I756 S757 Q758	S732-M736 WeakPolarHBondContact O-CB 3.36Å; S732-M736 PolarHBondContact O-N 2.76Å; M733-M736 PolarHBondContact O-N 2.83Å; M736-E738 VanDerWaalsContact C-N 3.34Å; M736-E738 PolarHBondContact O-N 2.91Å; M736-L739 PolarHBondContact O-N 3.26Å; M736-I740 HydrophobicContact CG-CD1 4.14Å; M736-I740 WeakPolarHBondContact O-CG1 3.31Å; M736-I740 PolarHBondContact O-N 2.81Å; M736-I740 HydrophobicContact SD-CD1 4.36Å; M736-I756 HydrophobicContact CE-CG2 4.41Å; M736-I756 HydrophobicContact SD-CG2 3.61Å; M736-S757 WeakPolarHBondContact CE-O 3.23Å; M736-Q758 HydrophobicContact CE-CB 4.47Å; M736-Q758 HydrophobicContact CE-CG 4.16Å
737	E	87.4	Confident	88.1	Confident	14 Å²	14	47.6 Å²	47.6	7%	0.065	24%	0.24	C	C	.	.	H	α-helix	trans	-61.9	-41.5	177.6	-176.4	175.6	-147	0	0	111.9	R344 M733 K734 I740 H741	R344-E737 IonicContact CZ-OE1 3.83Å; R344-E737 VanDerWaalsContact CZ-OE1 3.3Å; R344-E737 IonicContact CZ-OE2 3.81Å; R344-E737 IonicContact NE-OE2 2.91Å; R344-E737 VanDerWaalsContact NH1-CD 3.27Å; R344-E737 IonicContact NH1-OE1 3.86Å; R344-E737 IonicContact NH1-OE2 2.65Å; R344-E737 PolarHBondContact NH1-OE2 3.24Å; R344-E737 VanDerWaalsContact NH1-OE2 3.09Å; R344-E737 IonicContact NH2-OE1 2.72Å; R344-E737 PolarHBondContact NH2-OE1 3.03Å; R344-E737 IonicContact NH2-OE2 3.92Å; R344-E737 PolarHBondContact NH2-OE2 3.36Å; M733-E737 WeakPolarHBondContact O-CB 3.39Å; M733-E737 PolarHBondContact O-N 3.11Å; K734-E737 PolarHBondContact O-N 2.7Å; E737-I740 PolarHBondContact O-N 2.89Å; E737-H741 VanDerWaalsContact CD-NE2 3.34Å; E737-H741 WeakPolarHBondContact CG-NE2 3.2Å; E737-H741 PolarHBondContact O-CD2 2.76Å; E737-H741 PolarHBondContact O-N 3.14Å; E737-H741 IonicContact OE1-NE2 3.25Å; E737-H741 PolarHBondContact OE1-NE2 3.03Å; E737-H741 VanDerWaalsContact OE1-NE2 3.08Å
738	E	89.4	Confident	88.2	Confident	50 Å²	50	46.5 Å²	46.5	23%	0.234	23%	0.232	C	C	.	.	H	α-helix	trans	-59.2	-47	170.6	171.9	172.2	-111.2	0	0	112.5	K734 R735 M736 I740 H741 L742 L762 H902	K734-E738 WeakPolarHBondContact O-CB 3.48Å; K734-E738 PolarHBondContact O-N 2.95Å; R735-E738 PolarHBondContact O-N 3.47Å; M736-E738 VanDerWaalsContact C-N 3.34Å; M736-E738 PolarHBondContact O-N 2.91Å; E738-I740 PolarHBondContact O-N 3.29Å; E738-H741 PolarHBondContact O-N 3.43Å; E738-L742 WeakPolarHBondContact O-CB 3.23Å; E738-L742 PolarHBondContact O-N 2.84Å; E738-L762 WeakPolarHBondContact OE2-CB 3.3Å; E738-H902 IonicContact OE1-CD2 2.7Å; E738-H902 IonicContact OE1-CE1 3.79Å; E738-H902 PolarHBondContact OE1-CE1 3.17Å; E738-H902 IonicContact OE1-NE2 3.12Å; E738-H902 PolarHBondContact OE1-NE2 3.37Å; E738-H902 IonicContact OE2-CD2 2.71Å; E738-H902 IonicContact OE2-NE2 3.47Å; E738-H902 PolarHBondContact OE2-NE2 3.34Å
739	L	91.5	Very high	87.9	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-59	-36.5	175.8	-70.4	-175.9	0	0	0	112.1	R735 M736 L742 N743 R760 F795	R735-L739 WeakPolarHBondContact O-CG 3.4Å; R735-L739 PolarHBondContact O-N 3.42Å; M736-L739 PolarHBondContact O-N 3.26Å; L739-L742 PolarHBondContact O-N 2.6Å; L739-N743 WeakPolarHBondContact O-CB 3.46Å; L739-N743 PolarHBondContact O-N 2.92Å; L739-R760 HydrophobicContact CD1-CB 3.88Å; L739-R760 HydrophobicContact CD1-CG 4.14Å; L739-R760 WeakPolarHBondContact CD1-O 3.5Å; L739-R760 HydrophobicContact CD2-CG 4.37Å; L739-F795 HydrophobicContact CD2-CD1 3.85Å; L739-F795 HydrophobicContact CD2-CE1 3.47Å; L739-F795 VanDerWaalsContact CD2-CE1 3.47Å
740	I	89	Confident	87.2	Confident	20 Å²	20	50.3 Å²	50.3	10%	0.103	26%	0.255	C	S	.	.	H	α-helix	trans	-67.1	-45.4	176.2	-68.3	163.4	0	0	0	110.9	C61 T65 M736 E737 E738 L742 N743 K744 I756	C61-I740 HydrophobicContact CB-CD1 4.4Å; T65-I740 HydrophobicContact CG2-CG2 3.81Å; M736-I740 HydrophobicContact CG-CD1 4.14Å; M736-I740 WeakPolarHBondContact O-CG1 3.31Å; M736-I740 PolarHBondContact O-N 2.81Å; M736-I740 HydrophobicContact SD-CD1 4.36Å; E737-I740 PolarHBondContact O-N 2.89Å; E738-I740 PolarHBondContact O-N 3.29Å; I740-L742 VanDerWaalsContact C-N 3.33Å; I740-L742 PolarHBondContact O-N 2.92Å; I740-N743 PolarHBondContact O-N 2.93Å; I740-K744 PolarHBondContact O-N 3.28Å; I740-I756 HydrophobicContact CG1-CD1 4.05Å
741	H	89.2	Confident	86.6	Confident	88 Å²	88	58.7 Å²	58.7	41%	0.407	29%	0.291	S	S	.	.	H	α-helix	trans	-62.3	-39.3	174.8	-73.4	-60.4	0	0	0	112.2	R344 E737 E738 K744	R344-H741 PolarHBondContact NH1-NE2 3.27Å; R344-H741 VanDerWaalsContact NH1-NE2 3.17Å; R344-H741 PolarHBondContact NH2-NE2 3.37Å; E737-H741 VanDerWaalsContact CD-NE2 3.34Å; E737-H741 WeakPolarHBondContact CG-NE2 3.2Å; E737-H741 PolarHBondContact O-CD2 2.76Å; E737-H741 PolarHBondContact O-N 3.14Å; E737-H741 IonicContact OE1-NE2 3.25Å; E737-H741 PolarHBondContact OE1-NE2 3.03Å; E737-H741 VanDerWaalsContact OE1-NE2 3.08Å; E738-H741 PolarHBondContact O-N 3.43Å; H741-K744 PolarHBondContact O-N 2.74Å
742	L	90.1	Very high	86.3	Confident	17 Å²	17	60.8 Å²	60.8	9%	0.089	30%	0.303	C	S	.	.	H	α-helix	trans	-73.3	-36.3	179.1	-173.5	57.8	0	0	0	112.3	E738 L739 I740 K744 K745 I746 L755 L762 F795	E738-L742 WeakPolarHBondContact O-CB 3.23Å; E738-L742 PolarHBondContact O-N 2.84Å; L739-L742 PolarHBondContact O-N 2.6Å; I740-L742 VanDerWaalsContact C-N 3.33Å; I740-L742 PolarHBondContact O-N 2.92Å; L742-K744 PolarHBondContact O-N 2.67Å; L742-K745 CarbonylContact O-C 3.46Å; L742-K745 WeakPolarHBondContact O-CA 3.07Å; L742-K745 PolarHBondContact O-N 3.31Å; L742-I746 HydrophobicContact CD1-CD1 3.89Å; L742-I746 HydrophobicContact CD1-CG1 4.05Å; L742-I746 HydrophobicContact CD2-CD1 4.17Å; L742-I746 HydrophobicContact CG-CD1 3.72Å; L742-I746 HydrophobicContact CG-CG1 4.21Å; L742-I746 PolarHBondContact O-N 2.6Å; L742-L755 HydrophobicContact CB-CD2 4.35Å; L742-L755 HydrophobicContact CD2-CD2 4.43Å; L742-L755 HydrophobicContact CG-CD2 4.11Å; L742-L762 HydrophobicContact CD2-CD1 4.13Å; L742-L762 HydrophobicContact CD2-CD2 4.26Å; L742-F795 HydrophobicContact CD2-CE1 3.94Å; L742-F795 HydrophobicContact CD2-CZ 3.65Å
743	N	89.9	Confident	85.9	Confident	66 Å²	66	60.1 Å²	60.1	35%	0.353	30%	0.296	S	S	.	.	H	α-helix	trans	-62.1	-29.1	174.5	-169	85.9	0	0	0	112.1	L739 I740 K745 L755 I756	L739-N743 WeakPolarHBondContact O-CB 3.46Å; L739-N743 PolarHBondContact O-N 2.92Å; I740-N743 PolarHBondContact O-N 2.93Å; N743-K745 VanDerWaalsContact C-N 3.3Å; N743-L755 HydrophobicContact CB-CD2 3.99Å; N743-L755 WeakPolarHBondContact OD1-CB 3.13Å; N743-I756 HydrophobicContact CB-CD1 4.02Å; N743-I756 HydrophobicContact CB-CG1 4.02Å
744	K	89.4	Confident	85.8	Confident	114 Å²	114	64 Å²	64	50%	0.496	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-18.9	171.5	-67.3	177.7	-178.6	-177.1	0	113.6	T65 I740 H741 L742	T65-K744 PolarHBondContact OG1-NZ 2.88Å; I740-K744 PolarHBondContact O-N 3.28Å; H741-K744 PolarHBondContact O-N 2.74Å; L742-K744 PolarHBondContact O-N 2.67Å
745	K	89.8	Confident	85.9	Confident	73 Å²	73	61.8 Å²	61.8	32%	0.317	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.7	-12.8	-179.8	-63.8	179.8	-177.6	179.4	0	113.7	L742 N743 K809 F810	L742-K745 CarbonylContact O-C 3.46Å; L742-K745 WeakPolarHBondContact O-CA 3.07Å; L742-K745 PolarHBondContact O-N 3.31Å; N743-K745 VanDerWaalsContact C-N 3.3Å; K745-K809 WeakPolarHBondContact O-CA 3.42Å; K745-F810 HydrophobicContact CB-CD2 4.24Å; K745-F810 PolarHBondContact O-N 2.96Å
746	I	90.2	Very high	85.9	Confident	9 Å²	9	62.5 Å²	62.5	5%	0.046	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	132.3	-177	-72.1	-175.8	0	0	0	111.9	L742 F748 L755 L800 F810 V812	L742-I746 HydrophobicContact CD1-CD1 3.89Å; L742-I746 HydrophobicContact CD1-CG1 4.05Å; L742-I746 HydrophobicContact CD2-CD1 4.17Å; L742-I746 HydrophobicContact CG-CD1 3.72Å; L742-I746 HydrophobicContact CG-CG1 4.21Å; L742-I746 PolarHBondContact O-N 2.6Å; I746-F748 HydrophobicContact CG2-CD2 4.44Å; I746-F748 HydrophobicContact CG2-CE1 4.23Å; I746-F748 HydrophobicContact CG2-CE2 3.82Å; I746-F748 HydrophobicContact CG2-CZ 3.68Å; I746-L755 HydrophobicContact CD1-CD2 4Å; I746-L800 HydrophobicContact CD1-CD1 4.02Å; I746-F810 HydrophobicContact CG1-CB 4.24Å; I746-V812 HydrophobicContact CG2-CG2 3.7Å
747	N	87.8	Confident	85.9	Confident	73 Å²	73	62 Å²	62	39%	0.39	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	156.5	167	-58.3	119.5	0	0	0	109.7	F810 M811 V812	N747-F810 PolarHBondContact N-O 3.31Å; N747-M811 HydrophobicContact CB-CE 4.48Å; N747-V812 PolarHBondContact O-N 2.99Å
748	F	87.1	Confident	85.8	Confident	42 Å²	42	68.2 Å²	68.2	18%	0.184	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	140.4	179.1	-61.8	-86.1	0	0	0	110.5	I746 G750 I752 F753 V812	I746-F748 HydrophobicContact CG2-CD2 4.44Å; I746-F748 HydrophobicContact CG2-CE1 4.23Å; I746-F748 HydrophobicContact CG2-CE2 3.82Å; I746-F748 HydrophobicContact CG2-CZ 3.68Å; F748-G750 PolarHBondContact O-N 3.29Å; F748-I752 HydrophobicContact CD2-CG2 4.28Å; F748-I752 HydrophobicContact CE2-CG2 4.49Å; F748-F753 HydrophobicContact CD1-CB 4.31Å; F748-F753 HydrophobicContact CE1-CB 3.62Å; F748-F753 WeakPolarHBondContact CE2-O 3.37Å; F748-F753 HydrophobicContact CZ-CB 3.74Å; F748-F753 HydrophobicContact CZ-CD1 4.47Å; F748-F753 WeakPolarHBondContact CZ-O 3.32Å; F748-V812 HydrophobicContact CD1-CB 3.6Å; F748-V812 HydrophobicContact CD1-CG1 3.67Å; F748-V812 HydrophobicContact CD1-CG2 4.26Å; F748-V812 HydrophobicContact CE1-CB 3.83Å; F748-V812 HydrophobicContact CE1-CG1 3.76Å; F748-V812 HydrophobicContact CE1-CG2 4.03Å; F748-V812 HydrophobicContact CG-CB 4.45Å
749	E	80.4	Confident	85.7	Confident	116 Å²	116	69.3 Å²	69.3	54%	0.542	36%	0.363	S	S	.	.	S	Bend	trans	-75.9	-9.8	175.5	-65.3	-175.1	162.6	0	0	113.5	M811 V812 F813	E749-M811 HydrophobicContact CG-CE 4.47Å; E749-M811 HydrophobicContact CG-CG 3.34Å; E749-M811 HydrophobicContact CG-SD 3.89Å; E749-M811 WeakPolarHBondContact OE1-CG 3.31Å; E749-V812 PolarHBondContact N-O 3.04Å; E749-F813 WeakPolarHBondContact OE2-CB 3.49Å
750	G	73.3	Confident	85.7	Confident	56 Å²	56	70.2 Å²	70.2	58%	0.577	37%	0.366	S	S	*	.	S	Bend	trans	-154.5	-121.3	-174.8	0	0	0	0	0	112.9	F748 I752	F748-G750 PolarHBondContact O-N 3.29Å; G750-I752 PolarHBondContact O-N 3.02Å
751	K	73.5	Confident	85.7	Confident	189 Å²	189	73.5 Å²	73.5	82%	0.822	38%	0.377	S	S	*	.	S	Bend	trans	-59.2	123	179.7	-68.1	-176.4	179.9	179.2	0	110.5	F753	K751-F753 PolarHBondContact O-N 3.41Å
752	I	77.1	Confident	85.9	Confident	145 Å²	145	69.8 Å²	69.8	74%	0.744	36%	0.36	S	S	*	.	P	Polyproline II helix	trans	-66.2	125.1	176.6	-57	175.1	0	0	0	108.7	F748 G750	F748-I752 HydrophobicContact CD2-CG2 4.28Å; F748-I752 HydrophobicContact CE2-CG2 4.49Å; G750-I752 PolarHBondContact O-N 3.02Å
753	F	80.6	Confident	85.9	Confident	29 Å²	29	70.7 Å²	70.7	13%	0.127	37%	0.367	C	S	.	.	P	Polyproline II helix	trans	-96.4	122.4	170.6	177.5	-96.8	0	0	0	109	F748 K751 L755 R760 C798 L800 H815	F748-F753 HydrophobicContact CD1-CB 4.31Å; F748-F753 HydrophobicContact CE1-CB 3.62Å; F748-F753 WeakPolarHBondContact CE2-O 3.37Å; F748-F753 HydrophobicContact CZ-CB 3.74Å; F748-F753 HydrophobicContact CZ-CD1 4.47Å; F748-F753 WeakPolarHBondContact CZ-O 3.32Å; K751-F753 PolarHBondContact O-N 3.41Å; F753-L755 HydrophobicContact CD1-CD1 4.37Å; F753-L755 HydrophobicContact CE1-CD1 4.38Å; F753-L755 PolarHBondContact O-N 2.79Å; F753-R760 VanDerWaalsContact CZ-NH2 3.34Å; F753-C798 HydrophobicContact CZ-CB 3.94Å; F753-C798 WeakPolarHBondContact CZ-SG 3.49Å; F753-L800 HydrophobicContact CD1-CD2 4.06Å; F753-L800 HydrophobicContact CE1-CD2 4.25Å; F753-H815 AromaticContact CD2-ND1 3.66Å
754	P	84.3	Confident	86	Confident	96 Å²	96	67.9 Å²	67.9	62%	0.623	35%	0.351	S	S	*	.			trans	-70.5	100.6	-178.9	27.9	-33.2	0	0	0	109.9	R760	P754-R760 PolarHBondContact O-NH1 2.82Å
755	L	87.2	Confident	86.2	Confident	1 Å²	1	65.8 Å²	65.8	1%	0.005	34%	0.343	C	S	.	.			trans	-72.7	-37.6	-171.8	-166.5	69.2	0	0	0	113.2	L742 N743 I746 F753 S757 R760 F795 L800	L742-L755 HydrophobicContact CB-CD2 4.35Å; L742-L755 HydrophobicContact CD2-CD2 4.43Å; L742-L755 HydrophobicContact CG-CD2 4.11Å; N743-L755 HydrophobicContact CB-CD2 3.99Å; N743-L755 WeakPolarHBondContact OD1-CB 3.13Å; I746-L755 HydrophobicContact CD1-CD2 4Å; F753-L755 HydrophobicContact CD1-CD1 4.37Å; F753-L755 HydrophobicContact CE1-CD1 4.38Å; F753-L755 PolarHBondContact O-N 2.79Å; L755-S757 PolarHBondContact O-N 3.31Å; L755-R760 VanDerWaalsContact C-NH1 3.27Å; L755-R760 WeakPolarHBondContact O-CD 3.49Å; L755-R760 PolarHBondContact O-NH1 2.91Å; L755-F795 HydrophobicContact CD1-CE1 4.21Å; L755-F795 HydrophobicContact CD1-CE2 3.99Å; L755-F795 HydrophobicContact CD1-CZ 3.64Å; L755-F795 HydrophobicContact CG-CZ 4.5Å; L755-L800 HydrophobicContact CD1-CD1 3.7Å
756	I	88.6	Confident	86.4	Confident	68 Å²	68	63 Å²	63	35%	0.349	34%	0.335	S	S	.	.			trans	-78.4	119.6	-177.3	-59.3	172	0	0	0	109.1	M736 I740 N743	M736-I756 HydrophobicContact CE-CG2 4.41Å; M736-I756 HydrophobicContact SD-CG2 3.61Å; I740-I756 HydrophobicContact CG1-CD1 4.05Å; N743-I756 HydrophobicContact CB-CD1 4.02Å; N743-I756 HydrophobicContact CB-CG1 4.02Å
757	S	88.6	Confident	86.5	Confident	36 Å²	36	66.2 Å²	66.2	25%	0.252	35%	0.35	S	S	.	.			trans	-150.3	143.7	174.3	174.2	0	0	0	0	110.4	M736 L755 S759 R760	M736-S757 WeakPolarHBondContact CE-O 3.23Å; L755-S757 PolarHBondContact O-N 3.31Å; S757-S759 PolarHBondContact O-N 2.88Å; S757-S759 PolarHBondContact OG-N 2.79Å; S757-S759 PolarHBondContact OG-OG 3.32Å; S757-R760 PolarHBondContact O-N 2.69Å
758	Q	83.9	Confident	86.8	Confident	144 Å²	144	62.9 Å²	62.9	67%	0.673	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-26.5	178	-64.8	179.2	-7.2	0	0	113.1	M736	M736-Q758 HydrophobicContact CE-CB 4.47Å; M736-Q758 HydrophobicContact CE-CG 4.16Å
759	S	87.6	Confident	87.1	Confident	74 Å²	74	62.4 Å²	62.4	52%	0.517	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.5	2.1	179.6	67.8	0	0	0	0	113.6	S757 W761 N796	S757-S759 PolarHBondContact O-N 2.88Å; S757-S759 PolarHBondContact OG-N 2.79Å; S757-S759 PolarHBondContact OG-OG 3.32Å; S759-W761 WeakPolarHBondContact O-CZ3 3.35Å; S759-N796 PolarHBondContact O-ND2 3.13Å
760	R	91.7	Very high	87.6	Confident	19 Å²	19	58.5 Å²	58.5	7%	0.072	31%	0.313	C	S	.	.			trans	-104.9	146.8	-177.5	-172.4	173.5	-63.1	128.9	2.3	111.4	L739 F753 P754 L755 S757 F795 N796 D797	L739-R760 HydrophobicContact CD1-CB 3.88Å; L739-R760 HydrophobicContact CD1-CG 4.14Å; L739-R760 WeakPolarHBondContact CD1-O 3.5Å; L739-R760 HydrophobicContact CD2-CG 4.37Å; F753-R760 VanDerWaalsContact CZ-NH2 3.34Å; P754-R760 PolarHBondContact O-NH1 2.82Å; L755-R760 VanDerWaalsContact C-NH1 3.27Å; L755-R760 WeakPolarHBondContact O-CD 3.49Å; L755-R760 PolarHBondContact O-NH1 2.91Å; S757-R760 PolarHBondContact O-N 2.69Å; R760-F795 HydrophobicContact CG-CB 3.83Å; R760-F795 HydrophobicContact CG-CD1 3.77Å; R760-F795 HydrophobicContact CG-CG 4.03Å; R760-N796 VanDerWaalsContact CA-OD1 3.26Å; R760-N796 WeakPolarHBondContact CA-OD1 3.26Å; R760-D797 WeakPolarHBondContact CD-OD1 3.28Å; R760-D797 WeakPolarHBondContact CG-OD1 3.3Å; R760-D797 IonicContact CZ-OD1 3.34Å; R760-D797 IonicContact CZ-OD2 3.12Å; R760-D797 IonicContact NE-OD1 3.18Å; R760-D797 PolarHBondContact NE-OD1 2.92Å; R760-D797 IonicContact NE-OD2 3.67Å; R760-D797 PolarHBondContact NE-OD2 2.97Å; R760-D797 IonicContact NH2-OD1 2.7Å; R760-D797 IonicContact NH2-OD2 2.64Å; R760-D797 PolarHBondContact NH2-OD2 2.95Å
761	W	90.6	Very high	88.3	Confident	88 Å²	88	56.2 Å²	56.2	33%	0.333	29%	0.288	S	S	.	.			trans	-150.8	155.5	166.2	61	95.2	0	0	0	110.5	R735 S759 F795 N796	R735-W761 HydrophobicContact CB-CB 3.79Å; R735-W761 VanDerWaalsContact CD-CB 3.49Å; R735-W761 HydrophobicContact CG-CB 3.81Å; S759-W761 WeakPolarHBondContact O-CZ3 3.35Å; W761-F795 WeakPolarHBondContact O-CA 3.48Å; W761-F795 WeakPolarHBondContact O-CB 3.25Å; W761-N796 HydrophobicContact CD2-CB 3.86Å; W761-N796 HydrophobicContact CE3-CB 4.21Å; W761-N796 VanDerWaalsContact CE3-CG 3.46Å; W761-N796 HydrophobicContact CG-CB 4.5Å; W761-N796 HydrophobicContact CH2-CB 3.98Å; W761-N796 HydrophobicContact CZ2-CB 3.59Å; W761-N796 HydrophobicContact CZ3-CB 4.27Å; W761-N796 WeakPolarHBondContact CZ3-ND2 3.26Å; W761-N796 PolarHBondContact N-OD1 3.48Å; W761-N796 PolarHBondContact O-N 3.4Å; W761-N796 PolarHBondContact O-OD1 2.94Å
762	L	91.9	Very high	88.7	Confident	10 Å²	10	48.6 Å²	48.6	5%	0.052	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	133.6	174.1	-164.3	64.7	0	0	0	109	E738 L742 H765 H793 L794 F795	E738-L762 WeakPolarHBondContact OE2-CB 3.3Å; L742-L762 HydrophobicContact CD2-CD1 4.13Å; L742-L762 HydrophobicContact CD2-CD2 4.26Å; L762-H765 HydrophobicContact CD1-CB 4.35Å; L762-H765 HydrophobicContact CD2-CB 4.15Å; L762-H765 VanDerWaalsContact CD2-CD2 3.44Å; L762-H765 WeakPolarHBondContact CD2-CD2 3.21Å; L762-H793 HydrophobicContact CD1-CB 4.28Å; L762-L794 WeakPolarHBondContact CD1-O 3.43Å; L762-F795 HydrophobicContact CB-CD1 4.28Å; L762-F795 HydrophobicContact CB-CE1 4.21Å; L762-F795 HydrophobicContact CD1-CD1 3.88Å; L762-F795 HydrophobicContact CD1-CE1 3.46Å; L762-F795 VanDerWaalsContact CD1-CE1 3.46Å; L762-F795 HydrophobicContact CD1-CE2 4.24Å; L762-F795 HydrophobicContact CD1-CG 4.42Å; L762-F795 HydrophobicContact CD1-CZ 3.66Å; L762-F795 HydrophobicContact CG-CE1 4.43Å
763	V	91.3	Very high	88.3	Confident	37 Å²	37	45.1 Å²	45.1	22%	0.224	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	-39.7	178.9	172.3	0	0	0	0	110.2	L794 N796 A868 H902	V763-L794 HydrophobicContact CB-CG 4.4Å; V763-L794 HydrophobicContact CG1-CD2 4.35Å; V763-L794 PolarHBondContact N-O 3.12Å; V763-N796 HydrophobicContact CG2-CB 4.07Å; V763-A868 HydrophobicContact CG1-CB 4.41Å; V763-H902 VanDerWaalsContact O-CB 3.28Å; V763-H902 WeakPolarHBondContact O-CB 3.23Å
764	K	92.1	Very high	87.6	Confident	6 Å²	6	52.5 Å²	52.5	3%	0.026	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.2	148.4	169.9	-166.2	173.6	180	70.5	0	110.6	L794 W865 A868 E901 D903	K764-L794 HydrophobicContact CB-CD2 4.48Å; K764-L794 PolarHBondContact N-O 3.18Å; K764-L794 VanDerWaalsContact N-O 3.11Å; K764-L794 WeakPolarHBondContact O-CA 3.37Å; K764-L794 WeakPolarHBondContact O-CB 3.42Å; K764-L794 PolarHBondContact O-N 3.17Å; K764-W865 HydrophobicContact CB-CE3 4.42Å; K764-W865 HydrophobicContact CB-CH2 4.06Å; K764-W865 HydrophobicContact CB-CZ3 3.88Å; K764-W865 HydrophobicContact CD-CD2 3.78Å; K764-W865 HydrophobicContact CD-CE3 3.85Å; K764-W865 HydrophobicContact CD-CG 4.36Å; K764-W865 HydrophobicContact CD-CH2 4.15Å; K764-W865 HydrophobicContact CD-CZ2 4.08Å; K764-W865 HydrophobicContact CD-CZ3 4.03Å; K764-W865 HydrophobicContact CG-CE3 4.31Å; K764-W865 HydrophobicContact CG-CH2 3.82Å; K764-W865 HydrophobicContact CG-CZ2 4.02Å; K764-W865 HydrophobicContact CG-CZ3 3.97Å; K764-A868 HydrophobicContact CB-CB 4.33Å; K764-A868 HydrophobicContact CD-CB 4.32Å; K764-E901 IonicContact NZ-OE2 2.68Å; K764-E901 PolarHBondContact NZ-OE2 2.94Å; K764-D903 IonicContact NZ-OD1 3.47Å; K764-D903 PolarHBondContact NZ-OD1 3.43Å; K764-D903 IonicContact NZ-OD2 2.75Å; K764-D903 PolarHBondContact NZ-OD2 3.21Å
765	H	93.2	Very high	86.3	Confident	71 Å²	71	54 Å²	54	33%	0.329	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	162	166.1	67.8	100.5	0	0	0	110.6	L762 Y791 L792	L762-H765 HydrophobicContact CD1-CB 4.35Å; L762-H765 HydrophobicContact CD2-CB 4.15Å; L762-H765 VanDerWaalsContact CD2-CD2 3.44Å; L762-H765 WeakPolarHBondContact CD2-CD2 3.21Å; H765-Y791 HydrophobicContact CB-CE1 4.12Å; H765-Y791 AromaticContact ND1-CZ 3.9Å; H765-Y791 PolarHBondContact ND1-OH 3.23Å; H765-L792 VanDerWaalsContact CA-O 3.23Å; H765-L792 WeakPolarHBondContact CA-O 3.43Å
766	G	92.6	Very high	84.9	Confident	14 Å²	14	60.1 Å²	60.1	14%	0.144	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	154.3	172.9	177.8	0	0	0	0	0	114.6	Y791 L792	G766-Y791 WeakPolarHBondContact O-CA 3.4Å; G766-L792 PolarHBondContact N-O 2.79Å; G766-L792 VanDerWaalsContact N-O 3.12Å; G766-L792 PolarHBondContact O-N 3.01Å
767	E	93.6	Very high	83.3	Confident	77 Å²	77	60.1 Å²	60.1	36%	0.36	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	136.8	-177.2	-154.9	170.7	107.1	0	0	111.8	P789 Y791 R804	E767-P789 HydrophobicContact CG-CB 4.24Å; E767-Y791 HydrophobicContact CB-CD2 3.72Å; E767-Y791 HydrophobicContact CB-CE2 4.11Å; E767-Y791 HydrophobicContact CG-CD2 4.06Å; E767-R804 WeakPolarHBondContact OE2-CD 3.3Å; E767-R804 IonicContact OE2-NH1 3.96Å; E767-R804 PolarHBondContact OE2-NH1 3.31Å
768	L	94.3	Very high	81.7	Confident	2 Å²	2	65.5 Å²	65.5	1%	0.01	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	164.9	173.3	-71.4	178.1	0	0	0	110	V790 L792 F838 L854 W865	L768-V790 PolarHBondContact N-O 3.42Å; L768-V790 PolarHBondContact O-N 2.84Å; L768-V790 VanDerWaalsContact O-O 3.07Å; L768-L792 HydrophobicContact CB-CD1 4.25Å; L768-L792 HydrophobicContact CD1-CD1 4.01Å; L768-L792 HydrophobicContact CD1-CD2 3.88Å; L768-L792 HydrophobicContact CG-CD1 4.38Å; L768-F838 HydrophobicContact CD1-CE1 3.83Å; L768-F838 HydrophobicContact CD1-CZ 3.66Å; L768-L854 HydrophobicContact CB-CD2 4.18Å; L768-L854 HydrophobicContact CD1-CB 4.22Å; L768-L854 HydrophobicContact CD1-CD1 4.13Å; L768-W865 HydrophobicContact CD1-CD2 4.27Å; L768-W865 HydrophobicContact CD1-CG 4.04Å
769	L	92.4	Very high	80	Confident	33 Å²	33	62.1 Å²	62.1	17%	0.173	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	112.1	177.7	-65.4	178.5	0	0	0	110.7	V771 T787 K855	L769-V771 PolarHBondContact O-N 3.22Å; L769-T787 HydrophobicContact CB-CG2 4.2Å; L769-T787 HydrophobicContact CD1-CG2 4.49Å; L769-K855 HydrophobicContact CB-CB 4.16Å; L769-K855 PolarHBondContact N-O 3.42Å; L769-K855 PolarHBondContact O-N 3.09Å
770	E	91.9	Very high	78.8	Confident	33 Å²	33	61.3 Å²	61.3	15%	0.154	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.4	118.9	163.8	172	174.8	-147.9	0	0	108.6	T787 K788 V790 R803 I852 L853	E770-T787 CarbonylContact O-C 3.58Å; E770-T787 WeakPolarHBondContact O-CA 3.33Å; E770-K788 HydrophobicContact CB-CB 4.24Å; E770-K788 WeakPolarHBondContact CB-O 3.45Å; E770-K788 PolarHBondContact N-O 3.09Å; E770-K788 PolarHBondContact O-N 3.26Å; E770-V790 HydrophobicContact CB-CB 4.39Å; E770-V790 HydrophobicContact CB-CG2 3.63Å; E770-V790 HydrophobicContact CG-CG2 4.45Å; E770-R803 IonicContact OE1-NH2 3.8Å; E770-R803 IonicContact OE2-CZ 3.92Å; E770-R803 IonicContact OE2-NH2 2.88Å; E770-R803 PolarHBondContact OE2-NH2 3.42Å; E770-I852 HydrophobicContact CB-CD1 4.05Å; E770-I852 HydrophobicContact CB-CG1 4.36Å; E770-I852 HydrophobicContact CG-CD1 3.9Å; E770-I852 HydrophobicContact CG-CG1 3.99Å; E770-L853 WeakPolarHBondContact CA-O 3.42Å
771	V	87.8	Confident	77	Confident	9 Å²	9	66.7 Å²	66.7	6%	0.055	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	113.6	178.6	-178.8	0	0	0	0	109.2	L769 T773 L785 T787 L853 K855	L769-V771 PolarHBondContact O-N 3.22Å; V771-T773 PolarHBondContact O-N 2.89Å; V771-L785 HydrophobicContact CG1-CB 3.88Å; V771-L785 HydrophobicContact CG1-CD1 3.59Å; V771-L785 HydrophobicContact CG1-CG 4.41Å; V771-T787 HydrophobicContact CG2-CG2 4.18Å; V771-L853 HydrophobicContact CB-CB 4.23Å; V771-L853 HydrophobicContact CB-CD2 3.95Å; V771-L853 HydrophobicContact CB-CG 4.09Å; V771-L853 HydrophobicContact CG1-CD2 3.98Å; V771-L853 PolarHBondContact N-O 3.16Å; V771-K855 HydrophobicContact CG2-CB 3.64Å; V771-K855 HydrophobicContact CG2-CD 4.46Å
772	D	81.1	Confident	75.5	Confident	28 Å²	28	70.1 Å²	70.1	15%	0.15	39%	0.391	C	S	.	.			trans	-79	108.9	177.8	-166.9	-42.4	0	0	0	110.2	Q774 M775 P786 K788	D772-Q774 PolarHBondContact OD1-N 3.32Å; D772-M775 PolarHBondContact OD1-N 3.08Å; D772-P786 HydrophobicContact CB-CG 4.08Å; D772-P786 WeakPolarHBondContact CB-O 3.31Å; D772-P786 PolarHBondContact N-O 2.76Å; D772-K788 IonicContact OD2-NZ 2.65Å; D772-K788 PolarHBondContact OD2-NZ 3.34Å
773	T	69.9	Low	74	Confident	73 Å²	73	73.6 Å²	73.6	45%	0.448	41%	0.409	S	S	.	.	S	Bend	trans	-87.1	-8.4	-179.6	55.2	0	0	0	0	113.7	V771 L853	V771-T773 PolarHBondContact O-N 2.89Å; T773-L853 HydrophobicContact CG2-CD2 3.59Å
774	Q	64.6	Low	72.6	Confident	183 Å²	183	78 Å²	78	86%	0.855	43%	0.425	S	S	*	.	S	Bend	trans	-90.1	-37.1	-177.4	-60.1	-176.1	7.9	0	0	111	D772 M776	D772-Q774 PolarHBondContact OD1-N 3.32Å; Q774-M776 PolarHBondContact O-N 3.25Å
775	M	57.6	Low	71.6	Confident	127 Å²	127	79 Å²	79	63%	0.626	43%	0.43	S	S	*	.	S	Bend	trans	-98.2	67.1	-174.9	-153.6	173.3	85.5	0	0	112.9	D772 S777 P786	D772-M775 PolarHBondContact OD1-N 3.08Å; M775-S777 PolarHBondContact O-N 3.3Å; M775-P786 HydrophobicContact CB-CG 4.1Å; M775-P786 HydrophobicContact CE-CG 4Å; M775-P786 WeakPolarHBondContact O-CD 3.46Å; M775-P786 VanDerWaalsContact O-CG 3.27Å; M775-P786 WeakPolarHBondContact O-CG 3.29Å
776	M	58.8	Low	71.1	Confident	130 Å²	130	77.4 Å²	77.4	64%	0.64	43%	0.427	S	S	*	.			trans	-66	124.3	178.4	-58	-164.5	-164.4	0	0	112.2	Q774 L783 L785	Q774-M776 PolarHBondContact O-N 3.25Å; M776-L783 HydrophobicContact CB-CD1 4.4Å; M776-L785 HydrophobicContact CB-CD2 4.34Å; M776-L785 HydrophobicContact CG-CD2 3.85Å
777	S	53.8	Low	70.7	Confident	68 Å²	68	79.9 Å²	79.9	48%	0.476	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	121.8	174.8	-173	0	0	0	0	111.5	M775 S779	M775-S777 PolarHBondContact O-N 3.3Å; S777-S779 PolarHBondContact O-N 3.15Å
778	I	56.3	Low	70.6	Confident	150 Å²	150	80.3 Å²	80.3	77%	0.769	44%	0.439	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.8	89.9	179.4	-55.6	178.4	0	0	0	108.8
779	S	48.1	Very low	70.5	Confident	73 Å²	73	83.8 Å²	83.8	51%	0.51	46%	0.462	S	S	.	.			trans	-102.2	71.6	177.2	-173.1	0	0	0	0	110.4	S777	S777-S779 PolarHBondContact O-N 3.15Å
780	G	61	Low	70.5	Confident	57 Å²	57	82.2 Å²	82.2	59%	0.588	45%	0.454	S	S	*	.	S	Bend	trans	73.9	-154.9	-175.6	0	0	0	0	0	113.5	K782	G780-K782 PolarHBondContact O-N 2.79Å
781	S	54.9	Low	70.7	Confident	131 Å²	131	82.3 Å²	82.3	92%	0.916	45%	0.453	S	S	*	.	S	Bend	trans	-75.8	18.4	-172.1	53.1	0	0	0	0	115.7
782	K	59.1	Low	71	Confident	160 Å²	160	81.9 Å²	81.9	70%	0.696	45%	0.451	S	S	*	.	S	Bend	trans	-136.3	117.1	174.2	-66.8	-176.1	-179.6	178.7	0	109.8	G780 K784	G780-K782 PolarHBondContact O-N 2.79Å; K782-K784 PolarHBondContact O-N 3.27Å
783	L	60.2	Low	71.7	Confident	83 Å²	83	80.6 Å²	80.6	44%	0.435	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.1	115.2	174.7	-178.1	64.7	0	0	0	109.6	M776	M776-L783 HydrophobicContact CB-CD1 4.4Å
784	K	62.3	Low	72.8	Confident	130 Å²	130	77.1 Å²	77.1	57%	0.565	42%	0.423	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.5	105.6	175.5	-73	-177	-179.9	176.2	0	108.9	K782	K782-K784 PolarHBondContact O-N 3.27Å
785	L	71.3	Confident	74.2	Confident	26 Å²	26	68.5 Å²	68.5	14%	0.136	38%	0.382	C	S	.	.			trans	-75.9	136.9	168.3	-62.8	179.5	0	0	0	109.5	V771 M776 I833	V771-L785 HydrophobicContact CG1-CB 3.88Å; V771-L785 HydrophobicContact CG1-CD1 3.59Å; V771-L785 HydrophobicContact CG1-CG 4.41Å; M776-L785 HydrophobicContact CB-CD2 4.34Å; M776-L785 HydrophobicContact CG-CD2 3.85Å; L785-I833 HydrophobicContact CD1-CD1 3.43Å; L785-I833 VanDerWaalsContact CD1-CD1 3.43Å; L785-I833 HydrophobicContact CD1-CG1 3.98Å; L785-I833 HydrophobicContact CD1-CG2 4.39Å
786	P	80.8	Confident	75.8	Confident	39 Å²	39	64.9 Å²	64.9	25%	0.253	37%	0.365	S	S	.	.			trans	-68.2	142	175	19.2	-17.5	0	0	0	110.3	D772 M775	D772-P786 HydrophobicContact CB-CG 4.08Å; D772-P786 WeakPolarHBondContact CB-O 3.31Å; D772-P786 PolarHBondContact N-O 2.76Å; M775-P786 HydrophobicContact CB-CG 4.1Å; M775-P786 HydrophobicContact CE-CG 4Å; M775-P786 WeakPolarHBondContact O-CD 3.46Å; M775-P786 VanDerWaalsContact O-CG 3.27Å; M775-P786 WeakPolarHBondContact O-CG 3.29Å
787	T	86	Confident	77.4	Confident	66 Å²	66	61.1 Å²	61.1	41%	0.405	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	140.7	-179.1	49.5	0	0	0	0	111.6	L769 E770 V771	L769-T787 HydrophobicContact CB-CG2 4.2Å; L769-T787 HydrophobicContact CD1-CG2 4.49Å; E770-T787 CarbonylContact O-C 3.58Å; E770-T787 WeakPolarHBondContact O-CA 3.33Å; V771-T787 HydrophobicContact CG2-CG2 4.18Å
788	K	89.8	Confident	79.3	Confident	85 Å²	85	58 Å²	58	37%	0.37	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	136.8	178.7	-66.3	152.5	-179.9	165.2	0	109.1	E770 D772 V790	E770-K788 HydrophobicContact CB-CB 4.24Å; E770-K788 WeakPolarHBondContact CB-O 3.45Å; E770-K788 PolarHBondContact N-O 3.09Å; E770-K788 PolarHBondContact O-N 3.26Å; D772-K788 IonicContact OD2-NZ 2.65Å; D772-K788 PolarHBondContact OD2-NZ 3.34Å; K788-V790 PolarHBondContact O-N 3.03Å
789	P	92.3	Very high	81.1	Confident	75 Å²	75	50.9 Å²	50.9	49%	0.487	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	129.5	176.5	28.6	-33.3	0	0	0	110.5	E767	E767-P789 HydrophobicContact CG-CB 4.24Å
790	V	94.1	Very high	83.2	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	128.6	175	172.3	0	0	0	0	108.5	L768 E770 K788 L792 L801 F813 I852	L768-V790 PolarHBondContact N-O 3.42Å; L768-V790 PolarHBondContact O-N 2.84Å; L768-V790 VanDerWaalsContact O-O 3.07Å; E770-V790 HydrophobicContact CB-CB 4.39Å; E770-V790 HydrophobicContact CB-CG2 3.63Å; E770-V790 HydrophobicContact CG-CG2 4.45Å; K788-V790 PolarHBondContact O-N 3.03Å; V790-L792 HydrophobicContact CG1-CD1 4.15Å; V790-L801 HydrophobicContact CG1-CB 4.45Å; V790-F813 HydrophobicContact CG1-CE1 4.05Å; V790-F813 HydrophobicContact CG1-CZ 3.91Å; V790-F813 HydrophobicContact CG2-CZ 4.28Å; V790-I852 HydrophobicContact CG1-CD1 4.34Å; V790-I852 HydrophobicContact CG2-CD1 4.35Å
791	Y	94.5	Very high	84.8	Confident	35 Å²	35	44.7 Å²	44.7	14%	0.137	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	126.8	-176	-156.8	-79.9	0	0	0	110.2	H765 G766 E767 H793 S802 F810	H765-Y791 HydrophobicContact CB-CE1 4.12Å; H765-Y791 AromaticContact ND1-CZ 3.9Å; H765-Y791 PolarHBondContact ND1-OH 3.23Å; G766-Y791 WeakPolarHBondContact O-CA 3.4Å; E767-Y791 HydrophobicContact CB-CD2 3.72Å; E767-Y791 HydrophobicContact CB-CE2 4.11Å; E767-Y791 HydrophobicContact CG-CD2 4.06Å; Y791-H793 AromaticContact CD1-CE1 3.42Å; Y791-H793 VanDerWaalsContact CD1-CE1 3.42Å; Y791-H793 WeakPolarHBondContact CD1-CE1 3.24Å; Y791-H793 AromaticContact CD1-ND1 3.99Å; Y791-H793 AromaticContact CD1-NE2 3.64Å; Y791-H793 AromaticContact CE1-CE1 3.79Å; Y791-H793 AromaticContact CE1-NE2 3.48Å; Y791-H793 WeakPolarHBondContact CE1-NE2 3.26Å; Y791-S802 PolarHBondContact N-O 3.49Å; Y791-S802 PolarHBondContact O-N 2.88Å; Y791-S802 PolarHBondContact O-OG 2.81Å; Y791-F810 AromaticContact CD1-CD1 3.91Å; Y791-F810 HydrophobicContact CD1-CD1 3.91Å; Y791-F810 AromaticContact CD1-CE1 3.51Å; Y791-F810 HydrophobicContact CD1-CE1 3.51Å; Y791-F810 HydrophobicContact CD1-CZ 4.11Å; Y791-F810 AromaticContact CD2-CE1 3.68Å; Y791-F810 HydrophobicContact CD2-CE1 3.68Å; Y791-F810 HydrophobicContact CD2-CZ 4.45Å; Y791-F810 HydrophobicContact CE1-CD1 4.44Å; Y791-F810 AromaticContact CE1-CE1 3.7Å; Y791-F810 HydrophobicContact CE1-CE1 3.7Å; Y791-F810 AromaticContact CE1-CZ 3.83Å; Y791-F810 HydrophobicContact CE1-CZ 3.83Å; Y791-F810 AromaticContact CE2-CE1 3.89Å; Y791-F810 HydrophobicContact CE2-CE1 3.89Å; Y791-F810 HydrophobicContact CE2-CZ 4.21Å; Y791-F810 AromaticContact CG-CD1 3.92Å; Y791-F810 HydrophobicContact CG-CD1 3.92Å; Y791-F810 AromaticContact CG-CE1 3.48Å; Y791-F810 HydrophobicContact CG-CE1 3.48Å; Y791-F810 VanDerWaalsContact CG-CE1 3.48Å; Y791-F810 HydrophobicContact CG-CZ 4.4Å; Y791-F810 AromaticContact CZ-CE1 3.89Å; Y791-F810 AromaticContact CZ-CZ 3.88Å
792	L	95.1	Very high	86.6	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	139.4	-176.8	-80	68.6	0	0	0	109.9	H765 G766 L768 V790 L799 L801 L854 W865 M869	H765-L792 VanDerWaalsContact CA-O 3.23Å; H765-L792 WeakPolarHBondContact CA-O 3.43Å; G766-L792 PolarHBondContact N-O 2.79Å; G766-L792 VanDerWaalsContact N-O 3.12Å; G766-L792 PolarHBondContact O-N 3.01Å; L768-L792 HydrophobicContact CB-CD1 4.25Å; L768-L792 HydrophobicContact CD1-CD1 4.01Å; L768-L792 HydrophobicContact CD1-CD2 3.88Å; L768-L792 HydrophobicContact CG-CD1 4.38Å; V790-L792 HydrophobicContact CG1-CD1 4.15Å; L792-L799 HydrophobicContact CB-CD1 4.23Å; L792-L799 HydrophobicContact CD2-CD1 4.24Å; L792-L799 HydrophobicContact CG-CD1 4.25Å; L792-L801 HydrophobicContact CD1-CD2 4.18Å; L792-L801 HydrophobicContact CD2-CD2 4.46Å; L792-L801 HydrophobicContact CG-CD2 3.8Å; L792-L854 HydrophobicContact CD1-CD1 4.45Å; L792-L854 HydrophobicContact CD2-CD1 4.2Å; L792-W865 HydrophobicContact CB-CH2 3.37Å; L792-W865 HydrophobicContact CB-CZ2 3.88Å; L792-W865 HydrophobicContact CB-CZ3 3.83Å; L792-W865 HydrophobicContact CD2-CD2 4.26Å; L792-W865 HydrophobicContact CD2-CE3 3.94Å; L792-W865 HydrophobicContact CD2-CH2 4.13Å; L792-W865 HydrophobicContact CD2-CZ2 4.43Å; L792-W865 HydrophobicContact CD2-CZ3 3.87Å; L792-W865 HydrophobicContact CG-CH2 4.39Å; L792-M869 HydrophobicContact CD2-CE 3.49Å; L792-M869 VanDerWaalsContact CD2-CE 3.49Å
793	H	94.6	Very high	88.2	Confident	1 Å²	1	35.5 Å²	35.5	1%	0.005	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	104.2	164.8	-56.3	89.3	0	0	0	108.1	L762 Y791 F795 L800 S802 F810	L762-H793 HydrophobicContact CD1-CB 4.28Å; Y791-H793 AromaticContact CD1-CE1 3.42Å; Y791-H793 VanDerWaalsContact CD1-CE1 3.42Å; Y791-H793 WeakPolarHBondContact CD1-CE1 3.24Å; Y791-H793 AromaticContact CD1-ND1 3.99Å; Y791-H793 AromaticContact CD1-NE2 3.64Å; Y791-H793 AromaticContact CE1-CE1 3.79Å; Y791-H793 AromaticContact CE1-NE2 3.48Å; Y791-H793 WeakPolarHBondContact CE1-NE2 3.26Å; H793-F795 HydrophobicContact CB-CE2 3.61Å; H793-F795 HydrophobicContact CB-CZ 3.91Å; H793-F795 WeakPolarHBondContact O-CD2 3.43Å; H793-F795 WeakPolarHBondContact O-CE2 3.23Å; H793-L800 HydrophobicContact CB-CB 4.27Å; H793-L800 PolarHBondContact N-O 3.15Å; H793-L800 PolarHBondContact O-N 2.77Å; H793-S802 PolarHBondContact CE1-OG 3.25Å; H793-F810 AromaticContact CE1-CD1 3.83Å; H793-F810 AromaticContact CE1-CD2 3.86Å; H793-F810 AromaticContact CE1-CG 3.6Å; H793-F810 AromaticContact NE2-CD2 3.83Å; H793-F810 AromaticContact NE2-CE2 3.92Å
794	L	94.5	Very high	89.5	Confident	1 Å²	1	37.6 Å²	37.6	1%	0.005	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	123.4	179.8	178.4	68	0	0	0	109.4	L762 V763 K764 L799 I818 W865 A868 M869	L762-L794 WeakPolarHBondContact CD1-O 3.43Å; V763-L794 HydrophobicContact CB-CG 4.4Å; V763-L794 HydrophobicContact CG1-CD2 4.35Å; V763-L794 PolarHBondContact N-O 3.12Å; K764-L794 HydrophobicContact CB-CD2 4.48Å; K764-L794 PolarHBondContact N-O 3.18Å; K764-L794 VanDerWaalsContact N-O 3.11Å; K764-L794 WeakPolarHBondContact O-CA 3.37Å; K764-L794 WeakPolarHBondContact O-CB 3.42Å; K764-L794 PolarHBondContact O-N 3.17Å; L794-L799 HydrophobicContact CB-CD1 3.97Å; L794-L799 HydrophobicContact CD1-CB 4.06Å; L794-L799 HydrophobicContact CD1-CD1 4.11Å; L794-I818 HydrophobicContact CD1-CD1 3.56Å; L794-W865 HydrophobicContact CB-CZ3 3.88Å; L794-W865 HydrophobicContact CD2-CZ3 4.29Å; L794-A868 HydrophobicContact CD2-CB 3.72Å; L794-A868 WeakPolarHBondContact CD2-O 3.24Å; L794-M869 HydrophobicContact CD1-CG 4.16Å; L794-M869 HydrophobicContact CD2-CG 3.83Å
795	F	93.8	Very high	90.2	Very high	2 Å²	2	38 Å²	38	1%	0.009	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	170.1	175.2	-54.1	-91.9	0	0	0	109.3	L739 L742 L755 R760 W761 L762 H793 D797 C798 L800	L739-F795 HydrophobicContact CD2-CD1 3.85Å; L739-F795 HydrophobicContact CD2-CE1 3.47Å; L739-F795 VanDerWaalsContact CD2-CE1 3.47Å; L742-F795 HydrophobicContact CD2-CE1 3.94Å; L742-F795 HydrophobicContact CD2-CZ 3.65Å; L755-F795 HydrophobicContact CD1-CE1 4.21Å; L755-F795 HydrophobicContact CD1-CE2 3.99Å; L755-F795 HydrophobicContact CD1-CZ 3.64Å; L755-F795 HydrophobicContact CG-CZ 4.5Å; R760-F795 HydrophobicContact CG-CB 3.83Å; R760-F795 HydrophobicContact CG-CD1 3.77Å; R760-F795 HydrophobicContact CG-CG 4.03Å; W761-F795 WeakPolarHBondContact O-CA 3.48Å; W761-F795 WeakPolarHBondContact O-CB 3.25Å; L762-F795 HydrophobicContact CB-CD1 4.28Å; L762-F795 HydrophobicContact CB-CE1 4.21Å; L762-F795 HydrophobicContact CD1-CD1 3.88Å; L762-F795 HydrophobicContact CD1-CE1 3.46Å; L762-F795 VanDerWaalsContact CD1-CE1 3.46Å; L762-F795 HydrophobicContact CD1-CE2 4.24Å; L762-F795 HydrophobicContact CD1-CG 4.42Å; L762-F795 HydrophobicContact CD1-CZ 3.66Å; L762-F795 HydrophobicContact CG-CE1 4.43Å; H793-F795 HydrophobicContact CB-CE2 3.61Å; H793-F795 HydrophobicContact CB-CZ 3.91Å; H793-F795 WeakPolarHBondContact O-CD2 3.43Å; H793-F795 WeakPolarHBondContact O-CE2 3.23Å; F795-D797 PolarHBondContact O-N 3.45Å; F795-C798 WeakPolarHBondContact CA-O 3.31Å; F795-C798 WeakPolarHBondContact CB-O 3.22Å; F795-C798 PolarHBondContact N-O 3.23Å; F795-L800 HydrophobicContact CD2-CG 4.44Å; F795-L800 HydrophobicContact CE2-CD1 3.73Å; F795-L800 HydrophobicContact CE2-CG 3.86Å; F795-L800 HydrophobicContact CZ-CD1 4.35Å
796	N	91.6	Very high	90.4	Very high	51 Å²	51	40.1 Å²	40.1	27%	0.273	19%	0.193	S	C	.	.	S	Bend	trans	-65.4	-18.4	178.2	64.7	-64.5	0	0	0	114.7	S759 R760 W761 V763	S759-N796 PolarHBondContact O-ND2 3.13Å; R760-N796 VanDerWaalsContact CA-OD1 3.26Å; R760-N796 WeakPolarHBondContact CA-OD1 3.26Å; W761-N796 HydrophobicContact CD2-CB 3.86Å; W761-N796 HydrophobicContact CE3-CB 4.21Å; W761-N796 VanDerWaalsContact CE3-CG 3.46Å; W761-N796 HydrophobicContact CG-CB 4.5Å; W761-N796 HydrophobicContact CH2-CB 3.98Å; W761-N796 HydrophobicContact CZ2-CB 3.59Å; W761-N796 HydrophobicContact CZ3-CB 4.27Å; W761-N796 WeakPolarHBondContact CZ3-ND2 3.26Å; W761-N796 PolarHBondContact N-OD1 3.48Å; W761-N796 PolarHBondContact O-N 3.4Å; W761-N796 PolarHBondContact O-OD1 2.94Å; V763-N796 HydrophobicContact CG2-CB 4.07Å
797	D	91.6	Very high	89.9	Confident	51 Å²	51	43 Å²	43	27%	0.273	21%	0.211	S	C	.	.	S	Bend	trans	-119.5	-17.7	-179.2	71.7	-34.9	0	0	0	114.2	R760 F795 K817 I818	R760-D797 WeakPolarHBondContact CD-OD1 3.28Å; R760-D797 WeakPolarHBondContact CG-OD1 3.3Å; R760-D797 IonicContact CZ-OD1 3.34Å; R760-D797 IonicContact CZ-OD2 3.12Å; R760-D797 IonicContact NE-OD1 3.18Å; R760-D797 PolarHBondContact NE-OD1 2.92Å; R760-D797 IonicContact NE-OD2 3.67Å; R760-D797 PolarHBondContact NE-OD2 2.97Å; R760-D797 IonicContact NH2-OD1 2.7Å; R760-D797 IonicContact NH2-OD2 2.64Å; R760-D797 PolarHBondContact NH2-OD2 2.95Å; F795-D797 PolarHBondContact O-N 3.45Å; D797-K817 VanDerWaalsContact O-CA 3.28Å; D797-K817 WeakPolarHBondContact O-CA 3.47Å; D797-I818 PolarHBondContact O-N 3.09Å
798	C	92.8	Very high	89.2	Confident	1 Å²	1	47.2 Å²	47.2	1%	0.007	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152	161.2	-177.4	68.9	0	0	0	0	114.8	F753 F795 A816	F753-C798 HydrophobicContact CZ-CB 3.94Å; F753-C798 WeakPolarHBondContact CZ-SG 3.49Å; F795-C798 WeakPolarHBondContact CA-O 3.31Å; F795-C798 WeakPolarHBondContact CB-O 3.22Å; F795-C798 PolarHBondContact N-O 3.23Å; C798-A816 CarbonylContact C-O 3.5Å; C798-A816 VanDerWaalsContact CA-O 3.23Å; C798-A816 WeakPolarHBondContact CA-O 3.49Å; C798-A816 VanDerWaalsContact CB-O 3.27Å; C798-A816 WeakPolarHBondContact CB-O 3.26Å
799	L	94.1	Very high	89.1	Confident	2 Å²	2	47.4 Å²	47.4	1%	0.01	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	134.1	169.4	174.7	63.3	0	0	0	109.8	L792 L794 L801 H815 A816 L821 L840 M869	L792-L799 HydrophobicContact CB-CD1 4.23Å; L792-L799 HydrophobicContact CD2-CD1 4.24Å; L792-L799 HydrophobicContact CG-CD1 4.25Å; L794-L799 HydrophobicContact CB-CD1 3.97Å; L794-L799 HydrophobicContact CD1-CB 4.06Å; L794-L799 HydrophobicContact CD1-CD1 4.11Å; L799-L801 HydrophobicContact CD1-CD2 4.44Å; L799-L801 HydrophobicContact CD2-CD2 4.15Å; L799-L801 HydrophobicContact CG-CD2 4.17Å; L799-H815 WeakPolarHBondContact O-CA 3.45Å; L799-A816 PolarHBondContact N-O 3.21Å; L799-A816 PolarHBondContact O-N 3.3Å; L799-L821 HydrophobicContact CB-CD1 4.28Å; L799-L821 HydrophobicContact CB-CD2 4.09Å; L799-L821 HydrophobicContact CD2-CD1 4.25Å; L799-L821 HydrophobicContact CD2-CD2 4.02Å; L799-L840 HydrophobicContact CD2-CD1 4.39Å; L799-L840 HydrophobicContact CD2-CD2 3.66Å; L799-M869 HydrophobicContact CD1-CE 4.46Å; L799-M869 HydrophobicContact CD2-CE 3.92Å; L799-M869 HydrophobicContact CD2-SD 4.28Å
800	L	93.8	Very high	89.1	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	133.1	170.2	-46.9	179.9	0	0	0	109.9	I746 F753 L755 H793 F795 V812 H815	I746-L800 HydrophobicContact CD1-CD1 4.02Å; F753-L800 HydrophobicContact CD1-CD2 4.06Å; F753-L800 HydrophobicContact CE1-CD2 4.25Å; L755-L800 HydrophobicContact CD1-CD1 3.7Å; H793-L800 HydrophobicContact CB-CB 4.27Å; H793-L800 PolarHBondContact N-O 3.15Å; H793-L800 PolarHBondContact O-N 2.77Å; F795-L800 HydrophobicContact CD2-CG 4.44Å; F795-L800 HydrophobicContact CE2-CD1 3.73Å; F795-L800 HydrophobicContact CE2-CG 3.86Å; F795-L800 HydrophobicContact CZ-CD1 4.35Å; L800-V812 HydrophobicContact CB-CG1 4.2Å; L800-V812 HydrophobicContact CB-CG2 4.17Å; L800-V812 HydrophobicContact CD1-CG2 4.25Å; L800-H815 HydrophobicContact CD2-CB 3.45Å; L800-H815 VanDerWaalsContact CD2-CB 3.45Å
801	L	93.8	Very high	89	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	126.8	169.2	-53.5	-175.6	0	0	0	108.9	V790 L792 L799 V812 F813 V814 L840 L842 I852	V790-L801 HydrophobicContact CG1-CB 4.45Å; L792-L801 HydrophobicContact CD1-CD2 4.18Å; L792-L801 HydrophobicContact CD2-CD2 4.46Å; L792-L801 HydrophobicContact CG-CD2 3.8Å; L799-L801 HydrophobicContact CD1-CD2 4.44Å; L799-L801 HydrophobicContact CD2-CD2 4.15Å; L799-L801 HydrophobicContact CG-CD2 4.17Å; L801-V812 WeakPolarHBondContact O-CA 3.49Å; L801-F813 HydrophobicContact CB-CE1 3.9Å; L801-F813 HydrophobicContact CB-CE2 4.15Å; L801-F813 HydrophobicContact CB-CZ 3.66Å; L801-F813 HydrophobicContact CD1-CZ 4.47Å; L801-F813 VanDerWaalsContact O-CD1 3.3Å; L801-F813 WeakPolarHBondContact O-CD1 3.43Å; L801-F813 PolarHBondContact O-N 3.01Å; L801-V814 HydrophobicContact CB-CB 4.28Å; L801-V814 HydrophobicContact CD1-CB 4.32Å; L801-V814 HydrophobicContact CD1-CG1 4.3Å; L801-V814 PolarHBondContact N-O 2.66Å; L801-V814 PolarHBondContact O-N 3.23Å; L801-L840 HydrophobicContact CD2-CD2 4.24Å; L801-L842 HydrophobicContact CD1-CD1 4.04Å; L801-I852 HydrophobicContact CD1-CG2 4.13Å
802	S	93.5	Very high	88.9	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	157.5	-175.3	61	0	0	0	0	113.1	Y791 H793 M811	Y791-S802 PolarHBondContact N-O 3.49Å; Y791-S802 PolarHBondContact O-N 2.88Å; Y791-S802 PolarHBondContact O-OG 2.81Å; H793-S802 PolarHBondContact CE1-OG 3.25Å; S802-M811 CarbonylContact C-O 3.51Å; S802-M811 WeakPolarHBondContact CA-O 3.18Å; S802-M811 WeakPolarHBondContact CB-O 3.44Å
803	R	91.4	Very high	88.7	Confident	97 Å²	97	47.4 Å²	47.4	37%	0.366	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	145.7	168.2	-71.1	173.4	175.7	146.2	1.3	108.6	E770 K805 M811 F813	E770-R803 IonicContact OE1-NH2 3.8Å; E770-R803 IonicContact OE2-CZ 3.92Å; E770-R803 IonicContact OE2-NH2 2.88Å; E770-R803 PolarHBondContact OE2-NH2 3.42Å; R803-K805 PolarHBondContact O-N 2.82Å; R803-M811 PolarHBondContact N-O 3.48Å; R803-M811 PolarHBondContact O-N 3.42Å; R803-F813 HydrophobicContact CG-CD1 4.11Å; R803-F813 HydrophobicContact CG-CE1 3.9Å
804	R	87.4	Confident	88.5	Confident	127 Å²	127	48.4 Å²	48.4	48%	0.479	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	126.1	173.4	-64.9	177.1	72.6	175	3.4	108	E767 T807 F810	E767-R804 WeakPolarHBondContact OE2-CD 3.3Å; E767-R804 IonicContact OE2-NH1 3.96Å; E767-R804 PolarHBondContact OE2-NH1 3.31Å; R804-T807 PolarHBondContact NH2-O 3.46Å; R804-F810 HydrophobicContact CG-CD1 3.92Å; R804-F810 HydrophobicContact CG-CE1 3.78Å
805	K	78.5	Confident	88.4	Confident	139 Å²	139	51 Å²	51	60%	0.604	23%	0.232	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-100.3	-54.7	178.4	-176.9	-179.6	177.8	175.8	0	110.8	R803 K809 M811	R803-K805 PolarHBondContact O-N 2.82Å; K805-K809 PolarHBondContact N-O 3.11Å; K805-M811 HydrophobicContact CB-CB 4.27Å; K805-M811 HydrophobicContact CD-CE 4.01Å; K805-M811 HydrophobicContact CD-SD 3.91Å
806	D	75.2	Confident	88.3	Confident	70 Å²	70	50.9 Å²	50.9	37%	0.374	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	169.8	172	-48.2	-28	0	0	0	108.3	W808 K809	D806-W808 PolarHBondContact O-N 3.41Å; D806-K809 HydrophobicContact CB-CB 4.13Å; D806-K809 HydrophobicContact CB-CG 4.28Å; D806-K809 PolarHBondContact O-N 3.45Å; D806-K809 VanDerWaalsContact OD2-CD 3.31Å; D806-K809 WeakPolarHBondContact OD2-CD 3.41Å; D806-K809 WeakPolarHBondContact OD2-CE 3.5Å; D806-K809 IonicContact OD2-NZ 3.69Å; D806-K809 PolarHBondContact OD2-NZ 3.31Å
807	T	70	Confident	88.2	Confident	101 Å²	101	54.5 Å²	54.5	62%	0.62	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-46	-38.1	-179.3	-32.6	0	0	0	0	113.6	R804	R804-T807 PolarHBondContact NH2-O 3.46Å
808	W	71.9	Confident	88.2	Confident	154 Å²	154	54.1 Å²	54.1	58%	0.583	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-123.4	10.3	-173.3	-59.2	115.2	0	0	0	114.8	D806	D806-W808 PolarHBondContact O-N 3.41Å
809	K	87.1	Confident	87.8	Confident	89 Å²	89	58 Å²	58	39%	0.387	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	132.3	-179.5	-61	-165	-158.6	123.9	0	113.2	K745 K805 D806	K745-K809 WeakPolarHBondContact O-CA 3.42Å; K805-K809 PolarHBondContact N-O 3.11Å; D806-K809 HydrophobicContact CB-CB 4.13Å; D806-K809 HydrophobicContact CB-CG 4.28Å; D806-K809 PolarHBondContact O-N 3.45Å; D806-K809 VanDerWaalsContact OD2-CD 3.31Å; D806-K809 WeakPolarHBondContact OD2-CD 3.41Å; D806-K809 WeakPolarHBondContact OD2-CE 3.5Å; D806-K809 IonicContact OD2-NZ 3.69Å; D806-K809 PolarHBondContact OD2-NZ 3.31Å
810	F	91.2	Very high	87.6	Confident	21 Å²	21	59.6 Å²	59.6	9%	0.092	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	126.9	179.4	-58.2	-78.5	0	0	0	110.6	K745 I746 N747 Y791 H793 R804	K745-F810 HydrophobicContact CB-CD2 4.24Å; K745-F810 PolarHBondContact O-N 2.96Å; I746-F810 HydrophobicContact CG1-CB 4.24Å; N747-F810 PolarHBondContact N-O 3.31Å; Y791-F810 AromaticContact CD1-CD1 3.91Å; Y791-F810 HydrophobicContact CD1-CD1 3.91Å; Y791-F810 AromaticContact CD1-CE1 3.51Å; Y791-F810 HydrophobicContact CD1-CE1 3.51Å; Y791-F810 HydrophobicContact CD1-CZ 4.11Å; Y791-F810 AromaticContact CD2-CE1 3.68Å; Y791-F810 HydrophobicContact CD2-CE1 3.68Å; Y791-F810 HydrophobicContact CD2-CZ 4.45Å; Y791-F810 HydrophobicContact CE1-CD1 4.44Å; Y791-F810 AromaticContact CE1-CE1 3.7Å; Y791-F810 HydrophobicContact CE1-CE1 3.7Å; Y791-F810 AromaticContact CE1-CZ 3.83Å; Y791-F810 HydrophobicContact CE1-CZ 3.83Å; Y791-F810 AromaticContact CE2-CE1 3.89Å; Y791-F810 HydrophobicContact CE2-CE1 3.89Å; Y791-F810 HydrophobicContact CE2-CZ 4.21Å; Y791-F810 AromaticContact CG-CD1 3.92Å; Y791-F810 HydrophobicContact CG-CD1 3.92Å; Y791-F810 AromaticContact CG-CE1 3.48Å; Y791-F810 HydrophobicContact CG-CE1 3.48Å; Y791-F810 VanDerWaalsContact CG-CE1 3.48Å; Y791-F810 HydrophobicContact CG-CZ 4.4Å; Y791-F810 AromaticContact CZ-CE1 3.89Å; Y791-F810 AromaticContact CZ-CZ 3.88Å; H793-F810 AromaticContact CE1-CD1 3.83Å; H793-F810 AromaticContact CE1-CD2 3.86Å; H793-F810 AromaticContact CE1-CG 3.6Å; H793-F810 AromaticContact NE2-CD2 3.83Å; H793-F810 AromaticContact NE2-CE2 3.92Å; R804-F810 HydrophobicContact CG-CD1 3.92Å; R804-F810 HydrophobicContact CG-CE1 3.78Å
811	M	92.1	Very high	87.5	Confident	41 Å²	41	59.9 Å²	59.9	20%	0.202	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	103.2	178.1	-179.4	147.4	-91.7	0	0	108.7	N747 E749 S802 R803 K805	N747-M811 HydrophobicContact CB-CE 4.48Å; E749-M811 HydrophobicContact CG-CE 4.47Å; E749-M811 HydrophobicContact CG-CG 3.34Å; E749-M811 HydrophobicContact CG-SD 3.89Å; E749-M811 WeakPolarHBondContact OE1-CG 3.31Å; S802-M811 CarbonylContact C-O 3.51Å; S802-M811 WeakPolarHBondContact CA-O 3.18Å; S802-M811 WeakPolarHBondContact CB-O 3.44Å; R803-M811 PolarHBondContact N-O 3.48Å; R803-M811 PolarHBondContact O-N 3.42Å; K805-M811 HydrophobicContact CB-CB 4.27Å; K805-M811 HydrophobicContact CD-CE 4.01Å; K805-M811 HydrophobicContact CD-SD 3.91Å
812	V	92.7	Very high	87.3	Confident	4 Å²	4	64.8 Å²	64.8	2%	0.024	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	119.8	-179.1	174.9	0	0	0	0	109.6	I746 N747 F748 E749 L800 L801	I746-V812 HydrophobicContact CG2-CG2 3.7Å; N747-V812 PolarHBondContact O-N 2.99Å; F748-V812 HydrophobicContact CD1-CB 3.6Å; F748-V812 HydrophobicContact CD1-CG1 3.67Å; F748-V812 HydrophobicContact CD1-CG2 4.26Å; F748-V812 HydrophobicContact CE1-CB 3.83Å; F748-V812 HydrophobicContact CE1-CG1 3.76Å; F748-V812 HydrophobicContact CE1-CG2 4.03Å; F748-V812 HydrophobicContact CG-CB 4.45Å; E749-V812 PolarHBondContact N-O 3.04Å; L800-V812 HydrophobicContact CB-CG1 4.2Å; L800-V812 HydrophobicContact CB-CG2 4.17Å; L800-V812 HydrophobicContact CD1-CG2 4.25Å; L801-V812 WeakPolarHBondContact O-CA 3.49Å
813	F	91.5	Very high	87.1	Confident	43 Å²	43	66.2 Å²	66.2	19%	0.189	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	-27.3	178.8	63	-85	0	0	0	112.2	E749 V790 L801 R803	E749-F813 WeakPolarHBondContact OE2-CB 3.49Å; V790-F813 HydrophobicContact CG1-CE1 4.05Å; V790-F813 HydrophobicContact CG1-CZ 3.91Å; V790-F813 HydrophobicContact CG2-CZ 4.28Å; L801-F813 HydrophobicContact CB-CE1 3.9Å; L801-F813 HydrophobicContact CB-CE2 4.15Å; L801-F813 HydrophobicContact CB-CZ 3.66Å; L801-F813 HydrophobicContact CD1-CZ 4.47Å; L801-F813 VanDerWaalsContact O-CD1 3.3Å; L801-F813 WeakPolarHBondContact O-CD1 3.43Å; L801-F813 PolarHBondContact O-N 3.01Å; R803-F813 HydrophobicContact CG-CD1 4.11Å; R803-F813 HydrophobicContact CG-CE1 3.9Å
814	V	90.8	Very high	86.9	Confident	22 Å²	22	66.6 Å²	66.6	13%	0.133	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	144.4	178.4	170.3	0	0	0	0	111.6	L801 L842 H850	L801-V814 HydrophobicContact CB-CB 4.28Å; L801-V814 HydrophobicContact CD1-CB 4.32Å; L801-V814 HydrophobicContact CD1-CG1 4.3Å; L801-V814 PolarHBondContact N-O 2.66Å; L801-V814 PolarHBondContact O-N 3.23Å; V814-L842 HydrophobicContact CG1-CD1 3.44Å; V814-L842 VanDerWaalsContact CG1-CD1 3.44Å; V814-H850 HydrophobicContact CG1-CB 4.19Å; V814-H850 HydrophobicContact CG2-CB 4.44Å
815	H	91.3	Very high	86.9	Confident	55 Å²	55	63.6 Å²	63.6	26%	0.255	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	150.4	170.6	72.7	99.7	0	0	0	112	F753 L799 L800 K849	F753-H815 AromaticContact CD2-ND1 3.66Å; L799-H815 WeakPolarHBondContact O-CA 3.45Å; L800-H815 HydrophobicContact CD2-CB 3.45Å; L800-H815 VanDerWaalsContact CD2-CB 3.45Å; H815-K849 PolarHBondContact O-NZ 2.82Å
816	A	91.4	Very high	87	Confident	1 Å²	1	58.9 Å²	58.9	1%	0.008	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	158.1	177.4	0	0	0	0	0	111.1	C798 L799 E820 L821 L842	C798-A816 CarbonylContact C-O 3.5Å; C798-A816 VanDerWaalsContact CA-O 3.23Å; C798-A816 WeakPolarHBondContact CA-O 3.49Å; C798-A816 VanDerWaalsContact CB-O 3.27Å; C798-A816 WeakPolarHBondContact CB-O 3.26Å; L799-A816 PolarHBondContact N-O 3.21Å; L799-A816 PolarHBondContact O-N 3.3Å; A816-E820 WeakPolarHBondContact CA-OE2 3.32Å; A816-E820 HydrophobicContact CB-CB 4.17Å; A816-L821 HydrophobicContact CB-CD2 4.03Å; A816-L842 HydrophobicContact CB-CB 4.24Å; A816-L842 HydrophobicContact CB-CD1 4.21Å; A816-L842 HydrophobicContact CB-CD2 4Å; A816-L842 HydrophobicContact CB-CG 4.39Å
817	K	90.9	Very high	86.4	Confident	127 Å²	127	57.8 Å²	57.8	55%	0.552	30%	0.299	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.4	162.3	171.4	-59.7	178	-164.5	148.2	0	111.7	D797 G819 E820 L821	D797-K817 VanDerWaalsContact O-CA 3.28Å; D797-K817 WeakPolarHBondContact O-CA 3.47Å; K817-G819 VanDerWaalsContact C-N 3.33Å; K817-G819 PolarHBondContact O-N 3.07Å; K817-E820 HydrophobicContact CB-CG 4.07Å; K817-E820 VanDerWaalsContact CD-OE1 3.25Å; K817-E820 WeakPolarHBondContact CD-OE1 3.35Å; K817-E820 WeakPolarHBondContact CG-OE1 3.25Å; K817-E820 PolarHBondContact N-OE2 3.26Å; K817-E820 IonicContact NZ-OE1 3.59Å; K817-E820 WeakPolarHBondContact O-CB 3.29Å; K817-E820 PolarHBondContact O-N 3.01Å; K817-L821 WeakPolarHBondContact O-CG 3.37Å; K817-L821 PolarHBondContact O-N 2.72Å
818	I	90.3	Very high	85.8	Confident	42 Å²	42	61.8 Å²	61.8	22%	0.215	31%	0.311	C	S	.	.	G	3₁₀ helix	trans	-57.5	-43.4	176.9	-59.2	-48.8	0	0	0	112.4	L794 D797 E820 L821	L794-I818 HydrophobicContact CD1-CD1 3.56Å; D797-I818 PolarHBondContact O-N 3.09Å; I818-E820 PolarHBondContact O-N 2.84Å; I818-E820 VanDerWaalsContact O-N 3.13Å; I818-L821 HydrophobicContact CD1-CD1 3.79Å; I818-L821 WeakPolarHBondContact O-CB 3.5Å; I818-L821 WeakPolarHBondContact O-CG 3.34Å; I818-L821 PolarHBondContact O-N 3.12Å; I818-L821 VanDerWaalsContact O-N 3.08Å
819	G	86.1	Confident	85	Confident	84 Å²	84	63 Å²	63	87%	0.866	32%	0.32	S	S	*	.	G	3₁₀ helix	trans	-68.1	-7	176	0	0	0	0	0	115.5	K817	K817-G819 VanDerWaalsContact C-N 3.33Å; K817-G819 PolarHBondContact O-N 3.07Å
820	E	89.1	Confident	83.5	Confident	34 Å²	34	61.8 Å²	61.8	16%	0.159	32%	0.318	C	S	.	.	G	3₁₀ helix	trans	-96.2	-9.2	175.2	-64.1	161.9	-165	0	0	111.3	A816 K817 I818 C843	A816-E820 WeakPolarHBondContact CA-OE2 3.32Å; A816-E820 HydrophobicContact CB-CB 4.17Å; K817-E820 HydrophobicContact CB-CG 4.07Å; K817-E820 VanDerWaalsContact CD-OE1 3.25Å; K817-E820 WeakPolarHBondContact CD-OE1 3.35Å; K817-E820 WeakPolarHBondContact CG-OE1 3.25Å; K817-E820 PolarHBondContact N-OE2 3.26Å; K817-E820 IonicContact NZ-OE1 3.59Å; K817-E820 WeakPolarHBondContact O-CB 3.29Å; K817-E820 PolarHBondContact O-N 3.01Å; I818-E820 PolarHBondContact O-N 2.84Å; I818-E820 VanDerWaalsContact O-N 3.13Å; E820-C843 VanDerWaalsContact CB-O 3.29Å; E820-C843 WeakPolarHBondContact CB-O 3.41Å; E820-C843 WeakPolarHBondContact CG-O 3.46Å; E820-C843 PolarHBondContact O-N 3.17Å
821	L	90.9	Very high	81.7	Confident	7 Å²	7	69.6 Å²	69.6	4%	0.037	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	145.9	180	-48.6	-174.9	0	0	0	111.9	L799 A816 K817 I818 L840 L842 M869 F870	L799-L821 HydrophobicContact CB-CD1 4.28Å; L799-L821 HydrophobicContact CB-CD2 4.09Å; L799-L821 HydrophobicContact CD2-CD1 4.25Å; L799-L821 HydrophobicContact CD2-CD2 4.02Å; A816-L821 HydrophobicContact CB-CD2 4.03Å; K817-L821 WeakPolarHBondContact O-CG 3.37Å; K817-L821 PolarHBondContact O-N 2.72Å; I818-L821 HydrophobicContact CD1-CD1 3.79Å; I818-L821 WeakPolarHBondContact O-CB 3.5Å; I818-L821 WeakPolarHBondContact O-CG 3.34Å; I818-L821 PolarHBondContact O-N 3.12Å; I818-L821 VanDerWaalsContact O-N 3.08Å; L821-L840 HydrophobicContact CB-CD1 4.49Å; L821-L840 HydrophobicContact CD2-CD1 4.47Å; L821-L842 HydrophobicContact CD2-CD2 3.27Å; L821-M869 HydrophobicContact CD1-CB 4.34Å; L821-M869 HydrophobicContact CD1-CG 4.34Å; L821-M869 HydrophobicContact CD1-SD 4.5Å; L821-F870 HydrophobicContact CB-CE2 4.28Å; L821-F870 HydrophobicContact CB-CZ 3.81Å
822	K	89.9	Confident	80	Confident	102 Å²	102	71 Å²	71	44%	0.443	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	118.4	163.2	-63.1	173	-172.2	156.7	0	109	Q841 C843	K822-Q841 HydrophobicContact CB-CB 4.31Å; K822-Q841 PolarHBondContact N-O 3.04Å; K822-Q841 PolarHBondContact O-N 3.13Å; K822-C843 PolarHBondContact NZ-SG 2.71Å
823	V	89.8	Confident	78.5	Confident	30 Å²	30	72.8 Å²	72.8	18%	0.182	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	142.8	177.9	165.6	0	0	0	0	110.9	F838 H839 L840 I866 M869 F870	V823-F838 HydrophobicContact CG1-CB 4.47Å; V823-F838 HydrophobicContact CG1-CD2 3.91Å; V823-F838 HydrophobicContact CG2-CD2 4.38Å; V823-H839 CarbonylContact C-O 3.59Å; V823-H839 WeakPolarHBondContact CA-O 3.33Å; V823-L840 HydrophobicContact CG2-CB 4.45Å; V823-L840 HydrophobicContact CG2-CD1 3.63Å; V823-I866 HydrophobicContact CG1-CG1 3.98Å; V823-I866 HydrophobicContact CG1-CG2 4.2Å; V823-M869 HydrophobicContact CG2-SD 3.72Å; V823-F870 HydrophobicContact CB-CD2 4.14Å; V823-F870 HydrophobicContact CB-CE2 3.68Å; V823-F870 HydrophobicContact CG2-CD2 4.36Å; V823-F870 HydrophobicContact CG2-CE2 3.71Å
824	K	87.5	Confident	77.3	Confident	106 Å²	106	75.6 Å²	75.6	46%	0.461	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	121.5	173	-68.5	166.5	-179.7	160.7	0	109.2	F838 H839	K824-F838 CarbonylContact O-C 3.57Å; K824-F838 WeakPolarHBondContact O-CA 3.46Å; K824-H839 PolarHBondContact N-O 2.8Å; K824-H839 PolarHBondContact O-N 3.45Å
825	D	86.5	Confident	76.6	Confident	63 Å²	63	75.7 Å²	75.7	34%	0.337	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70	130.2	168.9	-166.5	-31.3	0	0	0	109.8	S827 K862 I866	D825-S827 VanDerWaalsContact OD1-CB 3.22Å; D825-S827 WeakPolarHBondContact OD1-CB 3.44Å; D825-S827 PolarHBondContact OD1-N 2.74Å; D825-S827 PolarHBondContact OD1-OG 2.83Å; D825-K862 IonicContact OD1-NZ 2.77Å; D825-K862 IonicContact OD2-NZ 3.77Å; D825-K862 PolarHBondContact OD2-NZ 3.36Å; D825-I866 HydrophobicContact CB-CD1 4.14Å
826	L	80.6	Confident	76.5	Confident	40 Å²	40	76.4 Å²	76.4	21%	0.209	42%	0.422	C	S	.	.			trans	-125	12	-177.5	-63.9	-179.2	0	0	0	113.2	Q828 K829 L830 I837 H839 L853	L826-Q828 PolarHBondContact O-N 3.47Å; L826-K829 PolarHBondContact O-N 3.12Å; L826-L830 HydrophobicContact CB-CD1 4.17Å; L826-L830 HydrophobicContact CB-CG 4.4Å; L826-L830 HydrophobicContact CD1-CD1 3.66Å; L826-L830 HydrophobicContact CD1-CG 4.1Å; L826-I837 PolarHBondContact N-O 2.91Å; L826-I837 VanDerWaalsContact N-O 3.11Å; L826-H839 HydrophobicContact CD1-CB 3.56Å; L826-H839 HydrophobicContact CG-CB 4.33Å; L826-L853 HydrophobicContact CD1-CD1 3.93Å
827	S	63.5	Low	76.4	Confident	47 Å²	47	76.5 Å²	76.5	33%	0.329	42%	0.422	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50	-14.9	-173.1	46.1	0	0	0	0	117.7	D825 I837	D825-S827 VanDerWaalsContact OD1-CB 3.22Å; D825-S827 WeakPolarHBondContact OD1-CB 3.44Å; D825-S827 PolarHBondContact OD1-N 2.74Å; D825-S827 PolarHBondContact OD1-OG 2.83Å; S827-I837 PolarHBondContact N-O 2.93Å
828	Q	55.8	Low	76.3	Confident	185 Å²	185	70.4 Å²	70.4	86%	0.864	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-135.5	6.2	177.3	-60.7	-177.9	-6.4	0	0	114.3	L826	L826-Q828 PolarHBondContact O-N 3.47Å
829	K	55.1	Low	76.3	Confident	180 Å²	180	70 Å²	70	78%	0.783	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-122.3	-4.7	-162.3	-67.8	-176.4	-179.8	175	0	116.8	L826	L826-K829 PolarHBondContact O-N 3.12Å
830	L	56.3	Low	76.6	Confident	64 Å²	64	66 Å²	66	34%	0.335	35%	0.351	S	S	.	.	S	Bend	trans	-95	137	173.4	-83.5	169.6	0	0	0	111.9	L826 G832 I833 L853	L826-L830 HydrophobicContact CB-CD1 4.17Å; L826-L830 HydrophobicContact CB-CG 4.4Å; L826-L830 HydrophobicContact CD1-CD1 3.66Å; L826-L830 HydrophobicContact CD1-CG 4.1Å; L830-G832 PolarHBondContact O-N 2.87Å; L830-I833 HydrophobicContact CB-CB 4.35Å; L830-I833 HydrophobicContact CB-CD1 3.93Å; L830-I833 HydrophobicContact CB-CG1 4.26Å; L830-I833 HydrophobicContact CD1-CD1 4.16Å; L830-I833 PolarHBondContact O-N 3Å; L830-L853 HydrophobicContact CD1-CD1 3.88Å; L830-L853 HydrophobicContact CD1-CD2 3.8Å
831	Q	54	Low	76.7	Confident	184 Å²	184	65.8 Å²	65.8	86%	0.86	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.6	99.9	-172.7	-67.8	171.3	-26	0	0	112.7	I833	Q831-I833 VanDerWaalsContact C-N 3.25Å; Q831-I833 PolarHBondContact O-N 2.74Å
832	G	55.8	Low	76.7	Confident	72 Å²	72	65.5 Å²	65.5	74%	0.742	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.9	0.8	175.3	0	0	0	0	0	116.5	L830 S834	L830-G832 PolarHBondContact O-N 2.87Å; G832-S834 PolarHBondContact O-N 3.07Å
833	I	61.4	Low	76.6	Confident	40 Å²	40	61.3 Å²	61.3	21%	0.205	33%	0.333	C	S	.	.			trans	-91	100.9	-177.8	-42.4	173.6	0	0	0	110	L785 L830 Q831 I837	L785-I833 HydrophobicContact CD1-CD1 3.43Å; L785-I833 VanDerWaalsContact CD1-CD1 3.43Å; L785-I833 HydrophobicContact CD1-CG1 3.98Å; L785-I833 HydrophobicContact CD1-CG2 4.39Å; L830-I833 HydrophobicContact CB-CB 4.35Å; L830-I833 HydrophobicContact CB-CD1 3.93Å; L830-I833 HydrophobicContact CB-CG1 4.26Å; L830-I833 HydrophobicContact CD1-CD1 4.16Å; L830-I833 PolarHBondContact O-N 3Å; Q831-I833 VanDerWaalsContact C-N 3.25Å; Q831-I833 PolarHBondContact O-N 2.74Å; I833-I837 HydrophobicContact CB-CD1 4.35Å; I833-I837 HydrophobicContact CG2-CD1 3.41Å; I833-I837 VanDerWaalsContact CG2-CD1 3.41Å
834	S	65.6	Low	76.2	Confident	102 Å²	102	65.2 Å²	65.2	71%	0.713	35%	0.349	S	S	*	.			trans	-86.1	139.5	176.1	57.8	0	0	0	0	113.5	G832 K855	G832-S834 PolarHBondContact O-N 3.07Å; S834-K855 PolarHBondContact O-NZ 2.97Å
835	G	77.6	Confident	75.8	Confident	24 Å²	24	63.3 Å²	63.3	25%	0.247	36%	0.359	C	S	.	.	S	Bend	trans	138.1	179.1	172.9	0	0	0	0	0	113.9	I837	G835-I837 VanDerWaalsContact C-N 3.34Å; G835-I837 PolarHBondContact O-N 3.45Å
836	F	87.9	Confident	75.3	Confident	70 Å²	70	70 Å²	70	31%	0.307	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	77.8	-175	-45.3	-67.9	0	0	0	110.7	S856 T858 E859 K862	F836-S856 PolarHBondContact O-N 2.94Å; F836-T858 WeakPolarHBondContact CB-O 3.38Å; F836-T858 VanDerWaalsContact CD2-CA 3.49Å; F836-T858 VanDerWaalsContact CG-C 3.47Å; F836-T858 WeakPolarHBondContact CG-O 3.49Å; F836-E859 HydrophobicContact CD1-CB 3.75Å; F836-E859 HydrophobicContact CD1-CG 4.25Å; F836-E859 HydrophobicContact CE1-CB 3.62Å; F836-E859 HydrophobicContact CE1-CG 4.32Å; F836-E859 HydrophobicContact CG-CB 4.44Å; F836-E859 HydrophobicContact CZ-CB 4.21Å; F836-K862 HydrophobicContact CB-CB 3.73Å; F836-K862 HydrophobicContact CB-CD 4.35Å; F836-K862 HydrophobicContact CB-CG 4.33Å
837	I	88.8	Confident	75.4	Confident	3 Å²	3	75.4 Å²	75.4	2%	0.015	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	136.5	-168.8	-57.5	179.5	0	0	0	111.7	L826 S827 I833 G835 L853 L854 K855	L826-I837 PolarHBondContact N-O 2.91Å; L826-I837 VanDerWaalsContact N-O 3.11Å; S827-I837 PolarHBondContact N-O 2.93Å; I833-I837 HydrophobicContact CB-CD1 4.35Å; I833-I837 HydrophobicContact CG2-CD1 3.41Å; I833-I837 VanDerWaalsContact CG2-CD1 3.41Å; G835-I837 VanDerWaalsContact C-N 3.34Å; G835-I837 PolarHBondContact O-N 3.45Å; I837-L853 HydrophobicContact CG2-CD1 3.48Å; I837-L853 VanDerWaalsContact CG2-CD1 3.48Å; I837-L853 HydrophobicContact CG2-CD2 4.28Å; I837-L853 HydrophobicContact CG2-CG 3.72Å; I837-L854 WeakPolarHBondContact CA-O 3.18Å; I837-K855 HydrophobicContact CD1-CD 4.14Å; I837-K855 HydrophobicContact CG1-CB 3.92Å; I837-K855 HydrophobicContact CG1-CD 4.07Å; I837-K855 HydrophobicContact CG1-CG 3.92Å
838	F	90.7	Very high	76.4	Confident	0 Å²	0	77.1 Å²	77.1	0%	0	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	153.3	170.1	68.8	-80.6	0	0	0	110.9	L768 V823 K824 L840 L854 K862 W865 I866 M869	L768-F838 HydrophobicContact CD1-CE1 3.83Å; L768-F838 HydrophobicContact CD1-CZ 3.66Å; V823-F838 HydrophobicContact CG1-CB 4.47Å; V823-F838 HydrophobicContact CG1-CD2 3.91Å; V823-F838 HydrophobicContact CG2-CD2 4.38Å; K824-F838 CarbonylContact O-C 3.57Å; K824-F838 WeakPolarHBondContact O-CA 3.46Å; F838-L840 HydrophobicContact CE2-CB 4.48Å; F838-L854 HydrophobicContact CD1-CB 4.16Å; F838-L854 HydrophobicContact CD2-CB 4.48Å; F838-L854 HydrophobicContact CE1-CB 3.74Å; F838-L854 HydrophobicContact CE2-CB 4.1Å; F838-L854 HydrophobicContact CE2-CD1 3.75Å; F838-L854 HydrophobicContact CZ-CB 3.72Å; F838-L854 HydrophobicContact CZ-CD1 3.68Å; F838-L854 HydrophobicContact CZ-CG 4.36Å; F838-L854 PolarHBondContact N-O 3.31Å; F838-L854 PolarHBondContact O-N 3.19Å; F838-K862 HydrophobicContact CD1-CG 4.04Å; F838-W865 HydrophobicContact CE1-CB 4.25Å; F838-W865 HydrophobicContact CZ-CB 4.02Å; F838-I866 HydrophobicContact CB-CD1 4.13Å; F838-I866 HydrophobicContact CB-CG1 4.31Å; F838-I866 HydrophobicContact CD2-CG1 4.48Å; F838-I866 HydrophobicContact CG-CG1 4.26Å; F838-M869 HydrophobicContact CE2-CE 4.29Å
839	H	90.3	Very high	77.8	Confident	32 Å²	32	72.4 Å²	72.4	15%	0.148	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	125.8	177.3	-178.3	-129.1	0	0	0	110	V823 K824 L826 Q841 I852 L853	V823-H839 CarbonylContact C-O 3.59Å; V823-H839 WeakPolarHBondContact CA-O 3.33Å; K824-H839 PolarHBondContact N-O 2.8Å; K824-H839 PolarHBondContact O-N 3.45Å; L826-H839 HydrophobicContact CD1-CB 3.56Å; L826-H839 HydrophobicContact CG-CB 4.33Å; H839-Q841 VanDerWaalsContact CE1-CD 3.44Å; H839-Q841 WeakPolarHBondContact CE1-CG 3.24Å; H839-I852 PolarHBondContact CD2-O 3.05Å; H839-L853 HydrophobicContact CB-CD1 3.94Å
840	L	92.4	Very high	79.4	Confident	0 Å²	0	66 Å²	66	0%	0	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	121.7	178.3	171.6	65.8	0	0	0	108.9	L799 L801 L821 V823 F838 L842 Q851 I852 L854 M869	L799-L840 HydrophobicContact CD2-CD1 4.39Å; L799-L840 HydrophobicContact CD2-CD2 3.66Å; L801-L840 HydrophobicContact CD2-CD2 4.24Å; L821-L840 HydrophobicContact CB-CD1 4.49Å; L821-L840 HydrophobicContact CD2-CD1 4.47Å; V823-L840 HydrophobicContact CG2-CB 4.45Å; V823-L840 HydrophobicContact CG2-CD1 3.63Å; F838-L840 HydrophobicContact CE2-CB 4.48Å; L840-L842 HydrophobicContact CD1-CD2 3.82Å; L840-L842 HydrophobicContact CD2-CD2 4.24Å; L840-L842 HydrophobicContact CG-CD2 3.92Å; L840-L842 HydrophobicContact CG-CG 4.47Å; L840-Q851 WeakPolarHBondContact O-CA 3.18Å; L840-I852 HydrophobicContact CB-CG2 3.87Å; L840-I852 HydrophobicContact CD2-CG2 3.95Å; L840-I852 HydrophobicContact CG-CG2 4.15Å; L840-I852 PolarHBondContact N-O 3.47Å; L840-I852 PolarHBondContact O-N 3.44Å; L840-L854 HydrophobicContact CB-CD1 4.16Å; L840-L854 HydrophobicContact CD2-CD1 3.94Å; L840-M869 HydrophobicContact CD1-SD 4.09Å; L840-M869 HydrophobicContact CD2-CE 4.49Å
841	Q	91.3	Very high	81	Confident	30 Å²	30	67.9 Å²	67.9	14%	0.14	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	136.1	174.5	-55	-169.1	-92.4	0	0	109	K822 H839 L848 Q851	K822-Q841 HydrophobicContact CB-CB 4.31Å; K822-Q841 PolarHBondContact N-O 3.04Å; K822-Q841 PolarHBondContact O-N 3.13Å; H839-Q841 VanDerWaalsContact CE1-CD 3.44Å; H839-Q841 WeakPolarHBondContact CE1-CG 3.24Å; Q841-L848 HydrophobicContact CB-CD1 3.88Å; Q841-Q851 HydrophobicContact CG-CB 4.23Å
842	L	90.1	Very high	82.8	Confident	2 Å²	2	59.3 Å²	59.3	1%	0.01	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	112.6	-179.1	-53.3	-177.3	0	0	0	107.9	L801 V814 A816 L821 L840 K849 H850	L801-L842 HydrophobicContact CD1-CD1 4.04Å; V814-L842 HydrophobicContact CG1-CD1 3.44Å; V814-L842 VanDerWaalsContact CG1-CD1 3.44Å; A816-L842 HydrophobicContact CB-CB 4.24Å; A816-L842 HydrophobicContact CB-CD1 4.21Å; A816-L842 HydrophobicContact CB-CD2 4Å; A816-L842 HydrophobicContact CB-CG 4.39Å; L821-L842 HydrophobicContact CD2-CD2 3.27Å; L840-L842 HydrophobicContact CD1-CD2 3.82Å; L840-L842 HydrophobicContact CD2-CD2 4.24Å; L840-L842 HydrophobicContact CG-CD2 3.92Å; L840-L842 HydrophobicContact CG-CG 4.47Å; L842-K849 WeakPolarHBondContact O-CB 3.42Å; L842-K849 PolarHBondContact O-N 3.27Å; L842-H850 HydrophobicContact CB-CB 4.28Å; L842-H850 HydrophobicContact CD1-CB 4.15Å; L842-H850 HydrophobicContact CG-CB 4.48Å; L842-H850 PolarHBondContact N-O 3.45Å; L842-H850 PolarHBondContact O-N 2.85Å
843	C	86.9	Confident	84.5	Confident	14 Å²	14	56.6 Å²	56.6	10%	0.095	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	119	-172.2	-70.2	0	0	0	0	111.8	E820 K822 G845 Q847	E820-C843 VanDerWaalsContact CB-O 3.29Å; E820-C843 WeakPolarHBondContact CB-O 3.41Å; E820-C843 WeakPolarHBondContact CG-O 3.46Å; E820-C843 PolarHBondContact O-N 3.17Å; K822-C843 PolarHBondContact NZ-SG 2.71Å; C843-G845 PolarHBondContact O-N 3.36Å; C843-Q847 CarbonylContact C-O 3.45Å; C843-Q847 VanDerWaalsContact CA-O 3.24Å; C843-Q847 WeakPolarHBondContact CA-O 3.42Å
844	E	82.3	Confident	85.9	Confident	111 Å²	111	54.7 Å²	54.7	52%	0.519	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	91.2	170.7	-159.9	152.9	162.2	0	0	107.8	Q846 Q847 K849	E844-Q846 PolarHBondContact O-N 3.29Å; E844-Q847 PolarHBondContact N-O 3.15Å; E844-Q847 PolarHBondContact O-N 2.63Å; E844-Q847 VanDerWaalsContact O-N 3.14Å; E844-K849 HydrophobicContact CB-CB 4.41Å; E844-K849 VanDerWaalsContact OE2-CD 3.3Å; E844-K849 WeakPolarHBondContact OE2-CD 3.39Å; E844-K849 VanDerWaalsContact OE2-CE 3.24Å; E844-K849 WeakPolarHBondContact OE2-CE 3.47Å; E844-K849 IonicContact OE2-NZ 2.88Å; E844-K849 PolarHBondContact OE2-NZ 2.87Å
845	G	79.9	Confident	87.1	Confident	66 Å²	66	52.8 Å²	52.8	68%	0.68	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.6	-117.2	-168.3	0	0	0	0	0	111.9	C843	C843-G845 PolarHBondContact O-N 3.36Å
846	Q	76	Confident	87.8	Confident	203 Å²	203	52 Å²	52	95%	0.949	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.2	-17	174.8	-67.6	-174.1	-1.8	0	0	113.5	E844	E844-Q846 PolarHBondContact O-N 3.29Å
847	Q	81.2	Confident	87.9	Confident	155 Å²	155	55 Å²	55	72%	0.724	28%	0.277	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.1	141.5	-176.7	-65.5	-167	-2.7	0	0	111.7	C843 E844 K849	C843-Q847 CarbonylContact C-O 3.45Å; C843-Q847 VanDerWaalsContact CA-O 3.24Å; C843-Q847 WeakPolarHBondContact CA-O 3.42Å; E844-Q847 PolarHBondContact N-O 3.15Å; E844-Q847 PolarHBondContact O-N 2.63Å; E844-Q847 VanDerWaalsContact O-N 3.14Å; Q847-K849 PolarHBondContact O-N 2.67Å
848	L	85.3	Confident	88	Confident	82 Å²	82	57.4 Å²	57.4	43%	0.429	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	108.2	174.2	-176.3	69.7	0	0	0	109.4	Q841 H850 Q851	Q841-L848 HydrophobicContact CB-CD1 3.88Å; L848-H850 WeakPolarHBondContact CD1-O 3.29Å; L848-Q851 HydrophobicContact CD1-CB 4.34Å; L848-Q851 HydrophobicContact CD2-CB 4.21Å; L848-Q851 HydrophobicContact CD2-CG 4.13Å
849	K	85	Confident	88	Confident	86 Å²	86	60 Å²	60	37%	0.374	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	-40.1	179.7	-175.2	-175.3	-168	161.2	0	111.9	H815 L842 E844 Q847	H815-K849 PolarHBondContact O-NZ 2.82Å; L842-K849 WeakPolarHBondContact O-CB 3.42Å; L842-K849 PolarHBondContact O-N 3.27Å; E844-K849 HydrophobicContact CB-CB 4.41Å; E844-K849 VanDerWaalsContact OE2-CD 3.3Å; E844-K849 WeakPolarHBondContact OE2-CD 3.39Å; E844-K849 VanDerWaalsContact OE2-CE 3.24Å; E844-K849 WeakPolarHBondContact OE2-CE 3.47Å; E844-K849 IonicContact OE2-NZ 2.88Å; E844-K849 PolarHBondContact OE2-NZ 2.87Å; Q847-K849 PolarHBondContact O-N 2.67Å
850	H	88.7	Confident	88	Confident	47 Å²	47	58.7 Å²	58.7	22%	0.218	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.1	154.1	-179.9	-173.2	72.3	0	0	0	110.1	V814 L842 L848	V814-H850 HydrophobicContact CG1-CB 4.19Å; V814-H850 HydrophobicContact CG2-CB 4.44Å; L842-H850 HydrophobicContact CB-CB 4.28Å; L842-H850 HydrophobicContact CD1-CB 4.15Å; L842-H850 HydrophobicContact CG-CB 4.48Å; L842-H850 PolarHBondContact N-O 3.45Å; L842-H850 PolarHBondContact O-N 2.85Å; L848-H850 WeakPolarHBondContact CD1-O 3.29Å
851	Q	90.6	Very high	88	Confident	102 Å²	102	59.3 Å²	59.3	48%	0.477	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	142.5	169.3	65	-177.9	0.9	0	0	110	L840 Q841 L848	L840-Q851 WeakPolarHBondContact O-CA 3.18Å; Q841-Q851 HydrophobicContact CG-CB 4.23Å; L848-Q851 HydrophobicContact CD1-CB 4.34Å; L848-Q851 HydrophobicContact CD2-CB 4.21Å; L848-Q851 HydrophobicContact CD2-CG 4.13Å
852	I	90.9	Very high	88	Confident	5 Å²	5	58.3 Å²	58.3	3%	0.026	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	136.3	-173.5	-171.6	165.3	0	0	0	110.1	E770 V790 L801 H839 L840 L854	E770-I852 HydrophobicContact CB-CD1 4.05Å; E770-I852 HydrophobicContact CB-CG1 4.36Å; E770-I852 HydrophobicContact CG-CD1 3.9Å; E770-I852 HydrophobicContact CG-CG1 3.99Å; V790-I852 HydrophobicContact CG1-CD1 4.34Å; V790-I852 HydrophobicContact CG2-CD1 4.35Å; L801-I852 HydrophobicContact CD1-CG2 4.13Å; H839-I852 PolarHBondContact CD2-O 3.05Å; L840-I852 HydrophobicContact CB-CG2 3.87Å; L840-I852 HydrophobicContact CD2-CG2 3.95Å; L840-I852 HydrophobicContact CG-CG2 4.15Å; L840-I852 PolarHBondContact N-O 3.47Å; L840-I852 PolarHBondContact O-N 3.44Å; I852-L854 HydrophobicContact CD1-CD2 3.93Å; I852-L854 HydrophobicContact CG1-CD2 3.96Å; I852-L854 HydrophobicContact CG1-CG 4.22Å; I852-L854 HydrophobicContact CG2-CD1 4.16Å; I852-L854 HydrophobicContact CG2-CG 4.14Å
853	L	90.9	Very high	88	Confident	15 Å²	15	60.1 Å²	60.1	8%	0.079	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	115.4	175.8	-171.5	65.9	0	0	0	108.1	E770 V771 T773 L826 L830 I837 H839	E770-L853 WeakPolarHBondContact CA-O 3.42Å; V771-L853 HydrophobicContact CB-CB 4.23Å; V771-L853 HydrophobicContact CB-CD2 3.95Å; V771-L853 HydrophobicContact CB-CG 4.09Å; V771-L853 HydrophobicContact CG1-CD2 3.98Å; V771-L853 PolarHBondContact N-O 3.16Å; T773-L853 HydrophobicContact CG2-CD2 3.59Å; L826-L853 HydrophobicContact CD1-CD1 3.93Å; L830-L853 HydrophobicContact CD1-CD1 3.88Å; L830-L853 HydrophobicContact CD1-CD2 3.8Å; I837-L853 HydrophobicContact CG2-CD1 3.48Å; I837-L853 VanDerWaalsContact CG2-CD1 3.48Å; I837-L853 HydrophobicContact CG2-CD2 4.28Å; I837-L853 HydrophobicContact CG2-CG 3.72Å; H839-L853 HydrophobicContact CB-CD1 3.94Å
854	L	92.2	Very high	88.3	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	129.4	-171.9	-68.2	171.2	0	0	0	110.7	L768 L792 I837 F838 L840 I852	L768-L854 HydrophobicContact CB-CD2 4.18Å; L768-L854 HydrophobicContact CD1-CB 4.22Å; L768-L854 HydrophobicContact CD1-CD1 4.13Å; L792-L854 HydrophobicContact CD1-CD1 4.45Å; L792-L854 HydrophobicContact CD2-CD1 4.2Å; I837-L854 WeakPolarHBondContact CA-O 3.18Å; F838-L854 HydrophobicContact CD1-CB 4.16Å; F838-L854 HydrophobicContact CD2-CB 4.48Å; F838-L854 HydrophobicContact CE1-CB 3.74Å; F838-L854 HydrophobicContact CE2-CB 4.1Å; F838-L854 HydrophobicContact CE2-CD1 3.75Å; F838-L854 HydrophobicContact CZ-CB 3.72Å; F838-L854 HydrophobicContact CZ-CD1 3.68Å; F838-L854 HydrophobicContact CZ-CG 4.36Å; F838-L854 PolarHBondContact N-O 3.31Å; F838-L854 PolarHBondContact O-N 3.19Å; L840-L854 HydrophobicContact CB-CD1 4.16Å; L840-L854 HydrophobicContact CD2-CD1 3.94Å; I852-L854 HydrophobicContact CD1-CD2 3.93Å; I852-L854 HydrophobicContact CG1-CD2 3.96Å; I852-L854 HydrophobicContact CG1-CG 4.22Å; I852-L854 HydrophobicContact CG2-CD1 4.16Å; I852-L854 HydrophobicContact CG2-CG 4.14Å
855	K	90.8	Very high	88.8	Confident	61 Å²	61	55.1 Å²	55.1	27%	0.265	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	130.1	176.3	177.7	166.5	178.9	161.5	0	110.3	L769 V771 S834 I837	L769-K855 HydrophobicContact CB-CB 4.16Å; L769-K855 PolarHBondContact N-O 3.42Å; L769-K855 PolarHBondContact O-N 3.09Å; V771-K855 HydrophobicContact CG2-CB 3.64Å; V771-K855 HydrophobicContact CG2-CD 4.46Å; S834-K855 PolarHBondContact O-NZ 2.97Å; I837-K855 HydrophobicContact CD1-CD 4.14Å; I837-K855 HydrophobicContact CG1-CB 3.92Å; I837-K855 HydrophobicContact CG1-CD 4.07Å; I837-K855 HydrophobicContact CG1-CG 3.92Å
856	S	92	Very high	89.3	Confident	8 Å²	8	53.3 Å²	53.3	6%	0.056	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	159.5	167.3	-166.5	0	0	0	0	111.6	F836 T858 G861 K862	F836-S856 PolarHBondContact O-N 2.94Å; S856-T858 PolarHBondContact OG-O 3.43Å; S856-G861 WeakPolarHBondContact OG-CA 3.4Å; S856-K862 PolarHBondContact OG-N 2.83Å
857	H	89.4	Confident	89.9	Confident	133 Å²	133	44.5 Å²	44.5	62%	0.616	22%	0.217	S	C	*	.	S	Bend	trans	-74.9	-28	172.9	-63.8	104.5	0	0	0	112.4
858	T	91.1	Very high	90.3	Very high	53 Å²	53	37.8 Å²	37.8	33%	0.325	19%	0.189	S	C	.	.	S	Bend	trans	-133.4	163.2	-175.6	68.4	0	0	0	0	112.5	F836 S856 S860 G861 K862 D921	F836-T858 WeakPolarHBondContact CB-O 3.38Å; F836-T858 VanDerWaalsContact CD2-CA 3.49Å; F836-T858 VanDerWaalsContact CG-C 3.47Å; F836-T858 WeakPolarHBondContact CG-O 3.49Å; S856-T858 PolarHBondContact OG-O 3.43Å; T858-S860 PolarHBondContact OG1-OG 2.89Å; T858-G861 PolarHBondContact O-N 2.92Å; T858-G861 PolarHBondContact OG1-N 2.79Å; T858-K862 PolarHBondContact O-N 3.43Å; T858-K862 VanDerWaalsContact O-N 3.17Å; T858-D921 VanDerWaalsContact CB-OD2 3.24Å; T858-D921 WeakPolarHBondContact CB-OD2 3.37Å; T858-D921 PolarHBondContact OG1-OD2 3.08Å
859	E	90.1	Very high	90.5	Very high	55 Å²	55	34 Å²	34	26%	0.257	17%	0.169	S	C	.	.	H	α-helix	trans	-67.1	-47.8	176.1	-173.9	170.8	-137.1	0	0	111.3	F836 G861 K862 Q863 T919 S920	F836-E859 HydrophobicContact CD1-CB 3.75Å; F836-E859 HydrophobicContact CD1-CG 4.25Å; F836-E859 HydrophobicContact CE1-CB 3.62Å; F836-E859 HydrophobicContact CE1-CG 4.32Å; F836-E859 HydrophobicContact CG-CB 4.44Å; F836-E859 HydrophobicContact CZ-CB 4.21Å; E859-G861 VanDerWaalsContact C-N 3.29Å; E859-G861 PolarHBondContact O-N 3.25Å; E859-K862 PolarHBondContact O-N 3.21Å; E859-Q863 PolarHBondContact O-N 3.16Å; E859-T919 HydrophobicContact CG-CG2 3.97Å; E859-S920 VanDerWaalsContact OE2-CB 3.29Å; E859-S920 WeakPolarHBondContact OE2-CB 3.47Å; E859-S920 PolarHBondContact OE2-N 3.13Å; E859-S920 PolarHBondContact OE2-OG 3.22Å
860	S	91.1	Very high	90.4	Very high	5 Å²	5	34.1 Å²	34.1	4%	0.035	17%	0.169	C	C	.	.	H	α-helix	trans	-51.9	-48	172	60.2	0	0	0	0	111.3	T858 K862 Q863 R864 D921 W923	T858-S860 PolarHBondContact OG1-OG 2.89Å; S860-K862 PolarHBondContact O-N 3.31Å; S860-Q863 PolarHBondContact O-N 2.67Å; S860-Q863 VanDerWaalsContact O-N 3.16Å; S860-R864 WeakPolarHBondContact O-CB 3.17Å; S860-R864 WeakPolarHBondContact O-CG 3.2Å; S860-R864 PolarHBondContact O-N 2.53Å; S860-D921 WeakPolarHBondContact CB-OD1 3.07Å; S860-D921 WeakPolarHBondContact CB-OD2 3.41Å; S860-D921 PolarHBondContact N-OD1 3.32Å; S860-D921 PolarHBondContact N-OD2 3.27Å; S860-D921 PolarHBondContact OG-OD2 3.2Å; S860-W923 VanDerWaalsContact CB-CD1 3.45Å
861	G	91.6	Very high	89.5	Confident	13 Å²	13	36.3 Å²	36.3	13%	0.134	19%	0.188	C	C	.	.	H	α-helix	trans	-59.8	-42.9	-179.5	0	0	0	0	0	112.7	S856 T858 E859 W865	S856-G861 WeakPolarHBondContact OG-CA 3.4Å; T858-G861 PolarHBondContact O-N 2.92Å; T858-G861 PolarHBondContact OG1-N 2.79Å; E859-G861 VanDerWaalsContact C-N 3.29Å; E859-G861 PolarHBondContact O-N 3.25Å; G861-W865 PolarHBondContact O-N 3.04Å
862	K	91.9	Very high	88.3	Confident	8 Å²	8	33.6 Å²	33.6	4%	0.035	18%	0.18	C	C	.	.	H	α-helix	trans	-61.9	-52.1	172.8	178.5	-140.8	62.3	163.6	0	110.6	D825 F836 F838 S856 T858 E859 S860 R864 W865 I866	D825-K862 IonicContact OD1-NZ 2.77Å; D825-K862 IonicContact OD2-NZ 3.77Å; D825-K862 PolarHBondContact OD2-NZ 3.36Å; F836-K862 HydrophobicContact CB-CB 3.73Å; F836-K862 HydrophobicContact CB-CD 4.35Å; F836-K862 HydrophobicContact CB-CG 4.33Å; F838-K862 HydrophobicContact CD1-CG 4.04Å; S856-K862 PolarHBondContact OG-N 2.83Å; T858-K862 PolarHBondContact O-N 3.43Å; T858-K862 VanDerWaalsContact O-N 3.17Å; E859-K862 PolarHBondContact O-N 3.21Å; S860-K862 PolarHBondContact O-N 3.31Å; K862-R864 PolarHBondContact O-N 3.29Å; K862-W865 PolarHBondContact O-N 3.11Å; K862-I866 HydrophobicContact CD-CD1 4.06Å; K862-I866 HydrophobicContact CG-CD1 3.91Å; K862-I866 WeakPolarHBondContact O-CG1 3.47Å; K862-I866 PolarHBondContact O-N 3.49Å; K862-I866 VanDerWaalsContact O-N 3.09Å
863	Q	90.6	Very high	87.1	Confident	40 Å²	40	37 Å²	37	19%	0.187	20%	0.199	C	C	.	.	H	α-helix	trans	-66.5	-41.4	-173.1	-163.1	62	24.5	0	0	112.1	E859 S860 W865 I866 T867 T917 T919 W936	E859-Q863 PolarHBondContact O-N 3.16Å; S860-Q863 PolarHBondContact O-N 2.67Å; S860-Q863 VanDerWaalsContact O-N 3.16Å; Q863-W865 PolarHBondContact O-N 3.05Å; Q863-I866 PolarHBondContact O-N 3.03Å; Q863-T867 WeakPolarHBondContact O-CB 3.26Å; Q863-T867 PolarHBondContact O-N 2.78Å; Q863-T867 PolarHBondContact O-OG1 2.91Å; Q863-T917 HydrophobicContact CG-CG2 4.36Å; Q863-T919 HydrophobicContact CB-CG2 4.37Å; Q863-W936 HydrophobicContact CB-CH2 3.78Å; Q863-W936 HydrophobicContact CB-CZ2 4.1Å; Q863-W936 HydrophobicContact CG-CH2 3.54Å; Q863-W936 HydrophobicContact CG-CZ2 3.79Å
864	R	92.4	Very high	85.5	Confident	10 Å²	10	38.2 Å²	38.2	4%	0.038	21%	0.207	C	C	.	.	H	α-helix	trans	-54.6	-47	172.3	-76.8	173.5	69.6	167.5	-4.7	112.4	S860 K862 A868 E901 D903 E904 W923 W936	S860-R864 WeakPolarHBondContact O-CB 3.17Å; S860-R864 WeakPolarHBondContact O-CG 3.2Å; S860-R864 PolarHBondContact O-N 2.53Å; K862-R864 PolarHBondContact O-N 3.29Å; R864-A868 WeakPolarHBondContact O-CB 3.47Å; R864-A868 PolarHBondContact O-N 3.37Å; R864-E901 IonicContact CZ-OE2 3.13Å; R864-E901 IonicContact NH2-OE2 3.08Å; R864-E901 PolarHBondContact NH2-OE2 2.73Å; R864-D903 WeakPolarHBondContact CB-OD2 3.16Å; R864-D903 IonicContact CZ-OD1 3.69Å; R864-D903 IonicContact CZ-OD2 2.6Å; R864-D903 IonicContact NE-OD1 2.79Å; R864-D903 IonicContact NE-OD2 3.33Å; R864-D903 PolarHBondContact NE-OD2 3.36Å; R864-D903 IonicContact NH2-OD1 2.69Å; R864-D903 PolarHBondContact NH2-OD1 3.21Å; R864-D903 IonicContact NH2-OD2 3.66Å; R864-D903 PolarHBondContact NH2-OD2 3.32Å; R864-E904 IonicContact CZ-OE1 2.78Å; R864-E904 IonicContact NH1-OE1 2.75Å; R864-E904 PolarHBondContact NH1-OE1 3.41Å; R864-E904 VanDerWaalsContact NH2-CD 3.33Å; R864-E904 IonicContact NH2-OE1 2.81Å; R864-E904 PolarHBondContact NH2-OE1 3.1Å; R864-W923 VanDerWaalsContact NH1-CH2 3.28Å; R864-W923 VanDerWaalsContact NH1-CZ3 3.34Å; R864-W936 HydrophobicContact CG-CB 4.32Å; R864-W936 HydrophobicContact CG-CD2 3.39Å; R864-W936 VanDerWaalsContact CG-CE2 3.45Å; R864-W936 HydrophobicContact CG-CE3 3.93Å; R864-W936 HydrophobicContact CG-CG 3.57Å; R864-W936 HydrophobicContact CG-CH2 4.48Å; R864-W936 HydrophobicContact CG-CZ2 4.02Å; R864-W936 HydrophobicContact CG-CZ3 4.44Å
865	W	93	Very high	83.9	Confident	10 Å²	10	44.2 Å²	44.2	4%	0.038	23%	0.234	C	C	.	.	H	α-helix	trans	-65.1	-40.1	175.8	-85.3	115.2	0	0	0	113.4	K764 L768 L792 L794 F838 G861 K862 Q863 M869	K764-W865 HydrophobicContact CB-CE3 4.42Å; K764-W865 HydrophobicContact CB-CH2 4.06Å; K764-W865 HydrophobicContact CB-CZ3 3.88Å; K764-W865 HydrophobicContact CD-CD2 3.78Å; K764-W865 HydrophobicContact CD-CE3 3.85Å; K764-W865 HydrophobicContact CD-CG 4.36Å; K764-W865 HydrophobicContact CD-CH2 4.15Å; K764-W865 HydrophobicContact CD-CZ2 4.08Å; K764-W865 HydrophobicContact CD-CZ3 4.03Å; K764-W865 HydrophobicContact CG-CE3 4.31Å; K764-W865 HydrophobicContact CG-CH2 3.82Å; K764-W865 HydrophobicContact CG-CZ2 4.02Å; K764-W865 HydrophobicContact CG-CZ3 3.97Å; L768-W865 HydrophobicContact CD1-CD2 4.27Å; L768-W865 HydrophobicContact CD1-CG 4.04Å; L792-W865 HydrophobicContact CB-CH2 3.37Å; L792-W865 HydrophobicContact CB-CZ2 3.88Å; L792-W865 HydrophobicContact CB-CZ3 3.83Å; L792-W865 HydrophobicContact CD2-CD2 4.26Å; L792-W865 HydrophobicContact CD2-CE3 3.94Å; L792-W865 HydrophobicContact CD2-CH2 4.13Å; L792-W865 HydrophobicContact CD2-CZ2 4.43Å; L792-W865 HydrophobicContact CD2-CZ3 3.87Å; L792-W865 HydrophobicContact CG-CH2 4.39Å; L794-W865 HydrophobicContact CB-CZ3 3.88Å; L794-W865 HydrophobicContact CD2-CZ3 4.29Å; F838-W865 HydrophobicContact CE1-CB 4.25Å; F838-W865 HydrophobicContact CZ-CB 4.02Å; G861-W865 PolarHBondContact O-N 3.04Å; K862-W865 PolarHBondContact O-N 3.11Å; Q863-W865 PolarHBondContact O-N 3.05Å; W865-M869 HydrophobicContact CE3-CE 3.87Å; W865-M869 HydrophobicContact CZ3-CE 4.42Å; W865-M869 WeakPolarHBondContact O-CG 3.47Å; W865-M869 PolarHBondContact O-N 2.78Å
866	I	90.4	Very high	82.5	Confident	28 Å²	28	46.9 Å²	46.9	14%	0.144	25%	0.247	C	C	.	.	H	α-helix	trans	-64.4	-51.3	176.3	-63.3	169	0	0	0	110.2	V823 D825 F838 K862 Q863 A868 M869 F870	V823-I866 HydrophobicContact CG1-CG1 3.98Å; V823-I866 HydrophobicContact CG1-CG2 4.2Å; D825-I866 HydrophobicContact CB-CD1 4.14Å; F838-I866 HydrophobicContact CB-CD1 4.13Å; F838-I866 HydrophobicContact CB-CG1 4.31Å; F838-I866 HydrophobicContact CD2-CG1 4.48Å; F838-I866 HydrophobicContact CG-CG1 4.26Å; K862-I866 HydrophobicContact CD-CD1 4.06Å; K862-I866 HydrophobicContact CG-CD1 3.91Å; K862-I866 WeakPolarHBondContact O-CG1 3.47Å; K862-I866 PolarHBondContact O-N 3.49Å; K862-I866 VanDerWaalsContact O-N 3.09Å; Q863-I866 PolarHBondContact O-N 3.03Å; I866-A868 VanDerWaalsContact C-N 3.34Å; I866-A868 PolarHBondContact O-N 3.27Å; I866-M869 PolarHBondContact O-N 3.2Å; I866-F870 PolarHBondContact O-N 3.43Å; I866-F870 VanDerWaalsContact O-N 3.09Å
867	T	89.1	Confident	81	Confident	18 Å²	18	47.5 Å²	47.5	11%	0.11	25%	0.249	C	C	.	.	H	α-helix	trans	-59	-41.4	178.3	-68.7	0	0	0	0	111.9	Q863 F870 P871 E925	Q863-T867 WeakPolarHBondContact O-CB 3.26Å; Q863-T867 PolarHBondContact O-N 2.78Å; Q863-T867 PolarHBondContact O-OG1 2.91Å; T867-F870 CarbonylContact O-C 3.58Å; T867-F870 PolarHBondContact O-N 2.92Å; T867-P871 WeakPolarHBondContact O-CA 3.39Å; T867-P871 VanDerWaalsContact O-N 3.08Å; T867-E925 WeakPolarHBondContact CG2-OE1 3.44Å; T867-E925 PolarHBondContact OG1-OE2 3.46Å
868	A	89.3	Confident	79.6	Confident	15 Å²	15	42 Å²	42	12%	0.124	23%	0.225	C	C	.	.	H	α-helix	trans	-68.5	-34.1	179.7	0	0	0	0	0	113	V763 K764 L794 R864 I866	V763-A868 HydrophobicContact CG1-CB 4.41Å; K764-A868 HydrophobicContact CB-CB 4.33Å; K764-A868 HydrophobicContact CD-CB 4.32Å; L794-A868 HydrophobicContact CD2-CB 3.72Å; L794-A868 WeakPolarHBondContact CD2-O 3.24Å; R864-A868 WeakPolarHBondContact O-CB 3.47Å; R864-A868 PolarHBondContact O-N 3.37Å; I866-A868 VanDerWaalsContact C-N 3.34Å; I866-A868 PolarHBondContact O-N 3.27Å
869	M	89.1	Confident	78.2	Confident	1 Å²	1	45.2 Å²	45.2	1%	0.005	24%	0.236	C	C	.	.	H	α-helix	trans	-75.5	-29	176.1	-69.4	-177.8	-166	0	0	113	L792 L794 L799 L821 V823 F838 L840 W865 I866	L792-M869 HydrophobicContact CD2-CE 3.49Å; L792-M869 VanDerWaalsContact CD2-CE 3.49Å; L794-M869 HydrophobicContact CD1-CG 4.16Å; L794-M869 HydrophobicContact CD2-CG 3.83Å; L799-M869 HydrophobicContact CD1-CE 4.46Å; L799-M869 HydrophobicContact CD2-CE 3.92Å; L799-M869 HydrophobicContact CD2-SD 4.28Å; L821-M869 HydrophobicContact CD1-CB 4.34Å; L821-M869 HydrophobicContact CD1-CG 4.34Å; L821-M869 HydrophobicContact CD1-SD 4.5Å; V823-M869 HydrophobicContact CG2-SD 3.72Å; F838-M869 HydrophobicContact CE2-CE 4.29Å; L840-M869 HydrophobicContact CD1-SD 4.09Å; L840-M869 HydrophobicContact CD2-CE 4.49Å; W865-M869 HydrophobicContact CE3-CE 3.87Å; W865-M869 HydrophobicContact CZ3-CE 4.42Å; W865-M869 WeakPolarHBondContact O-CG 3.47Å; W865-M869 PolarHBondContact O-N 2.78Å; I866-M869 PolarHBondContact O-N 3.2Å
870	F	82.6	Confident	76.7	Confident	89 Å²	89	47.8 Å²	47.8	39%	0.39	25%	0.248	S	C	.	.	S	Bend	trans	-132.4	69.7	-179.9	-66.1	-86.2	0	0	0	110.8	L821 V823 I866 T867 S872	L821-F870 HydrophobicContact CB-CE2 4.28Å; L821-F870 HydrophobicContact CB-CZ 3.81Å; V823-F870 HydrophobicContact CB-CD2 4.14Å; V823-F870 HydrophobicContact CB-CE2 3.68Å; V823-F870 HydrophobicContact CG2-CD2 4.36Å; V823-F870 HydrophobicContact CG2-CE2 3.71Å; I866-F870 PolarHBondContact O-N 3.43Å; I866-F870 VanDerWaalsContact O-N 3.09Å; T867-F870 CarbonylContact O-C 3.58Å; T867-F870 PolarHBondContact O-N 2.92Å; F870-S872 PolarHBondContact O-N 3.34Å
871	P	69.7	Low	75	Confident	93 Å²	93	48.4 Å²	48.4	60%	0.604	25%	0.253	S	S	*	.	P	Polyproline II helix	trans	-64.7	119.7	175.3	27.2	-33.4	0	0	0	109.1	T867	T867-P871 WeakPolarHBondContact O-CA 3.39Å; T867-P871 VanDerWaalsContact O-N 3.08Å
872	S	66.8	Low	73.2	Confident	46 Å²	46	50.4 Å²	50.4	32%	0.322	27%	0.265	S	S	.	.	P	Polyproline II helix	trans	-66.3	151.4	168.6	-16.4	0	0	0	0	108.9	F870 P874 K916 R934	F870-S872 PolarHBondContact O-N 3.34Å; S872-P874 WeakPolarHBondContact O-CD 3.14Å; S872-K916 PolarHBondContact OG-NZ 3.03Å; S872-K916 VanDerWaalsContact OG-NZ 3.1Å; S872-R934 PolarHBondContact O-NH1 2.78Å; S872-R934 PolarHBondContact OG-NH1 3.27Å; S872-R934 PolarHBondContact OG-NH2 2.8Å; S872-R934 VanDerWaalsContact OG-NH2 3.08Å
873	D	64.6	Low	71.5	Confident	77 Å²	77	58 Å²	58	41%	0.412	30%	0.301	S	S	.	.	P	Polyproline II helix	trans	-67.4	123.4	177.3	-165.8	-51	0	0	0	109.9	F875 E876 D877	D873-F875 PolarHBondContact O-N 3.12Å; D873-F875 WeakPolarHBondContact OD1-CB 3.21Å; D873-F875 WeakPolarHBondContact OD1-CD2 3.48Å; D873-F875 PolarHBondContact OD1-N 3.01Å; D873-E876 HydrophobicContact CB-CB 4.11Å; D873-E876 HydrophobicContact CB-CG 3.98Å; D873-E876 PolarHBondContact O-N 3.4Å; D873-D877 WeakPolarHBondContact O-CB 3.45Å; D873-D877 PolarHBondContact O-N 3Å
874	P	58.4	Low	69.7	Low	39 Å²	39	60.9 Å²	60.9	25%	0.253	32%	0.318	S	S	.	.	H	α-helix	trans	-60.7	-24.4	178	-23.6	35.1	0	0	0	114	S872 I878 I927	S872-P874 WeakPolarHBondContact O-CD 3.14Å; P874-I878 WeakPolarHBondContact O-CB 3.45Å; P874-I878 VanDerWaalsContact O-CD1 3.3Å; P874-I878 WeakPolarHBondContact O-CD1 3.48Å; P874-I878 WeakPolarHBondContact O-CG1 3.41Å; P874-I878 PolarHBondContact O-N 3.44Å; P874-I927 HydrophobicContact CB-CD1 4.36Å
875	F	57.4	Low	67.9	Low	127 Å²	127	64 Å²	64	56%	0.557	34%	0.335	S	S	*	.	H	α-helix	trans	-76	-48.5	175.9	-63.4	-77.6	0	0	0	111.1	D873 D877 I878 E879	D873-F875 PolarHBondContact O-N 3.12Å; D873-F875 WeakPolarHBondContact OD1-CB 3.21Å; D873-F875 WeakPolarHBondContact OD1-CD2 3.48Å; D873-F875 PolarHBondContact OD1-N 3.01Å; F875-D877 VanDerWaalsContact C-N 3.31Å; F875-D877 PolarHBondContact O-N 2.84Å; F875-I878 PolarHBondContact O-N 3.09Å; F875-E879 WeakPolarHBondContact O-CB 3.4Å; F875-E879 WeakPolarHBondContact O-CG 3.37Å; F875-E879 PolarHBondContact O-N 3.1Å
876	E	62.4	Low	65.8	Low	117 Å²	117	68 Å²	68	55%	0.547	37%	0.37	S	S	.	.	H	α-helix	trans	-58.5	-43.4	173.5	-67.8	-172	159.2	0	0	111.4	D873 I878 E879 Q880	D873-E876 HydrophobicContact CB-CB 4.11Å; D873-E876 HydrophobicContact CB-CG 3.98Å; D873-E876 PolarHBondContact O-N 3.4Å; E876-I878 PolarHBondContact O-N 3.27Å; E876-E879 PolarHBondContact O-N 3.48Å; E876-Q880 VanDerWaalsContact O-CB 3.28Å; E876-Q880 WeakPolarHBondContact O-CB 3.47Å; E876-Q880 WeakPolarHBondContact O-CG 3.36Å; E876-Q880 PolarHBondContact O-N 2.82Å
877	D	60.3	Low	64.2	Low	20 Å²	20	73.1 Å²	73.1	11%	0.107	40%	0.398	C	S	.	.	H	α-helix	trans	-57.5	-45.1	176.6	-81	-19.9	0	0	0	112.2	D873 F875 A881 K916 I927 R934	D873-D877 WeakPolarHBondContact O-CB 3.45Å; D873-D877 PolarHBondContact O-N 3Å; F875-D877 VanDerWaalsContact C-N 3.31Å; F875-D877 PolarHBondContact O-N 2.84Å; D877-A881 VanDerWaalsContact O-CB 3.29Å; D877-A881 WeakPolarHBondContact O-CB 3.23Å; D877-A881 PolarHBondContact O-N 2.74Å; D877-A881 VanDerWaalsContact O-N 3.1Å; D877-K916 IonicContact OD1-NZ 3.44Å; D877-K916 PolarHBondContact OD1-NZ 2.77Å; D877-K916 IonicContact OD2-NZ 3.85Å; D877-K916 PolarHBondContact OD2-NZ 3.31Å; D877-I927 HydrophobicContact CB-CD1 3.9Å; D877-R934 IonicContact OD2-CZ 3.8Å; D877-R934 IonicContact OD2-NH1 2.71Å; D877-R934 PolarHBondContact OD2-NH1 2.93Å; D877-R934 IonicContact OD2-NH2 3.92Å
878	I	60	Low	63	Low	19 Å²	19	73 Å²	73	10%	0.097	40%	0.396	C	S	.	.	H	α-helix	trans	-77	-34.6	-178.2	-66.9	164.4	0	0	0	111.9	P874 F875 E876 A881 S882 I927	P874-I878 WeakPolarHBondContact O-CB 3.45Å; P874-I878 VanDerWaalsContact O-CD1 3.3Å; P874-I878 WeakPolarHBondContact O-CD1 3.48Å; P874-I878 WeakPolarHBondContact O-CG1 3.41Å; P874-I878 PolarHBondContact O-N 3.44Å; F875-I878 PolarHBondContact O-N 3.09Å; E876-I878 PolarHBondContact O-N 3.27Å; I878-A881 PolarHBondContact O-N 3.48Å; I878-S882 WeakPolarHBondContact O-CB 3.42Å; I878-S882 PolarHBondContact O-N 2.84Å; I878-I927 HydrophobicContact CD1-CD1 4.42Å; I878-I927 HydrophobicContact CD1-CG2 3.91Å; I878-I927 HydrophobicContact CG1-CD1 4.15Å
879	E	62	Low	62.7	Low	120 Å²	120	74.2 Å²	74.2	56%	0.561	40%	0.404	S	S	*	.	H	α-helix	trans	-70.4	-44.4	177.3	-71.9	-179.1	178.3	0	0	111	F875 E876 A881 S882 E883	F875-E879 WeakPolarHBondContact O-CB 3.4Å; F875-E879 WeakPolarHBondContact O-CG 3.37Å; F875-E879 PolarHBondContact O-N 3.1Å; E876-E879 PolarHBondContact O-N 3.48Å; E879-A881 VanDerWaalsContact C-N 3.31Å; E879-A881 PolarHBondContact O-N 3.21Å; E879-S882 WeakPolarHBondContact O-CA 3.4Å; E879-S882 WeakPolarHBondContact O-CB 3.39Å; E879-S882 PolarHBondContact O-N 2.71Å; E879-S882 PolarHBondContact O-OG 3.27Å; E879-E883 PolarHBondContact O-N 3.5Å
880	Q	57.2	Low	62.7	Low	108 Å²	108	74.3 Å²	74.3	51%	0.505	40%	0.404	S	S	.	.	H	α-helix	trans	-61.3	-37.4	172.4	-69.6	171.7	34.1	0	0	112.4	E876 S882 N884	E876-Q880 VanDerWaalsContact O-CB 3.28Å; E876-Q880 WeakPolarHBondContact O-CB 3.47Å; E876-Q880 WeakPolarHBondContact O-CG 3.36Å; E876-Q880 PolarHBondContact O-N 2.82Å; Q880-S882 VanDerWaalsContact C-N 3.29Å; Q880-S882 PolarHBondContact O-N 3.36Å; Q880-N884 PolarHBondContact O-N 3.23Å; Q880-N884 PolarHBondContact O-ND2 3.45Å
881	A	55.3	Low	63.2	Low	18 Å²	18	70.6 Å²	70.6	15%	0.149	39%	0.389	C	S	.	.	H	α-helix	trans	-66.1	-29.5	172	0	0	0	0	0	112.8	D877 I878 E879 I888	D877-A881 VanDerWaalsContact O-CB 3.29Å; D877-A881 WeakPolarHBondContact O-CB 3.23Å; D877-A881 PolarHBondContact O-N 2.74Å; D877-A881 VanDerWaalsContact O-N 3.1Å; I878-A881 PolarHBondContact O-N 3.48Å; E879-A881 VanDerWaalsContact C-N 3.31Å; E879-A881 PolarHBondContact O-N 3.21Å; A881-I888 WeakPolarHBondContact O-CD1 3.16Å; A881-I888 VanDerWaalsContact O-CG1 3.32Å; A881-I888 WeakPolarHBondContact O-CG1 3.32Å
882	S	55.2	Low	64.2	Low	56 Å²	56	69.9 Å²	69.9	39%	0.392	38%	0.378	S	S	.	.	H	α-helix	trans	-75.6	-27.9	179.9	79.9	0	0	0	0	114.1	I878 E879 Q880	I878-S882 WeakPolarHBondContact O-CB 3.42Å; I878-S882 PolarHBondContact O-N 2.84Å; E879-S882 WeakPolarHBondContact O-CA 3.4Å; E879-S882 WeakPolarHBondContact O-CB 3.39Å; E879-S882 PolarHBondContact O-N 2.71Å; E879-S882 PolarHBondContact O-OG 3.27Å; Q880-S882 VanDerWaalsContact C-N 3.29Å; Q880-S882 PolarHBondContact O-N 3.36Å
883	E	54.9	Low	65.3	Low	166 Å²	166	67.8 Å²	67.8	78%	0.776	36%	0.363	S	S	*	.	H	α-helix	trans	-77.3	-28.9	173.3	-62.4	-167.3	143.4	0	0	112.2	E879 D885	E879-E883 PolarHBondContact O-N 3.5Å; E883-D885 PolarHBondContact O-N 3.06Å
884	N	54.4	Low	66.6	Low	102 Å²	102	66.9 Å²	66.9	55%	0.545	36%	0.357	S	S	.	.			trans	-100.3	66.3	-175.9	-67.2	-78	0	0	0	112.4	Q880 A886 D887	Q880-N884 PolarHBondContact O-N 3.23Å; Q880-N884 PolarHBondContact O-ND2 3.45Å; N884-A886 PolarHBondContact O-N 2.79Å; N884-D887 PolarHBondContact O-N 2.9Å
885	D	54	Low	68.1	Low	75 Å²	75	70.6 Å²	70.6	40%	0.401	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.7	2.1	-175.6	-175	55.9	0	0	0	116.7	E883 R948	E883-D885 PolarHBondContact O-N 3.06Å; D885-R948 IonicContact OD2-CZ 3.45Å; D885-R948 IonicContact OD2-NE 3.64Å; D885-R948 IonicContact OD2-NH2 2.62Å; D885-R948 PolarHBondContact OD2-NH2 3.47Å
886	A	49.5	Very low	69.6	Low	93 Å²	93	68.3 Å²	68.3	77%	0.769	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.6	-39.3	174.9	0	0	0	0	0	113.7	N884	N884-A886 PolarHBondContact O-N 2.79Å
887	D	56.5	Low	71	Confident	136 Å²	136	63.3 Å²	63.3	73%	0.727	35%	0.345	S	S	*	.			trans	-112.6	12	-156.2	-135.1	9.6	0	0	0	114.3	N884 S889	N884-D887 PolarHBondContact O-N 2.9Å; D887-S889 VanDerWaalsContact C-N 3.3Å; D887-S889 PolarHBondContact O-N 2.89Å
888	I	64.4	Low	72.4	Confident	16 Å²	16	65.5 Å²	65.5	8%	0.082	36%	0.355	C	S	.	.			trans	-74.1	78.8	-178	-44.3	178.6	0	0	0	110.6	A881 Q890 R951 L955	A881-I888 WeakPolarHBondContact O-CD1 3.16Å; A881-I888 VanDerWaalsContact O-CG1 3.32Å; A881-I888 WeakPolarHBondContact O-CG1 3.32Å; I888-Q890 HydrophobicContact CG2-CG 4.06Å; I888-Q890 PolarHBondContact O-N 2.79Å; I888-R951 WeakPolarHBondContact O-CD 3.44Å; I888-R951 PolarHBondContact O-NH1 3.1Å; I888-L955 HydrophobicContact CD1-CD2 3.96Å
889	S	83	Confident	73.8	Confident	40 Å²	40	66.1 Å²	66.1	28%	0.28	36%	0.363	S	S	.	.			trans	-60.8	120.8	166	-71.8	0	0	0	0	109.5	D887 H914 A915	D887-S889 VanDerWaalsContact C-N 3.3Å; D887-S889 PolarHBondContact O-N 2.89Å; S889-H914 PolarHBondContact O-ND1 2.98Å; S889-A915 PolarHBondContact O-N 2.85Å
890	Q	89.3	Confident	75	Confident	4 Å²	4	68.1 Å²	68.1	2%	0.019	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	144	171.3	-63.6	-177.9	11.3	0	0	109.3	I888 L913 I945 R951 N954	I888-Q890 HydrophobicContact CG2-CG 4.06Å; I888-Q890 PolarHBondContact O-N 2.79Å; Q890-L913 CarbonylContact C-O 3.56Å; Q890-L913 VanDerWaalsContact CA-O 3.26Å; Q890-L913 WeakPolarHBondContact CA-O 3.31Å; Q890-I945 HydrophobicContact CB-CB 4.2Å; Q890-I945 HydrophobicContact CB-CD1 3.99Å; Q890-I945 HydrophobicContact CB-CG1 4.3Å; Q890-I945 PolarHBondContact O-N 3.19Å; Q890-R951 HydrophobicContact CB-CG 4.03Å; Q890-R951 HydrophobicContact CG-CB 4.45Å; Q890-R951 HydrophobicContact CG-CG 4.04Å; Q890-R951 PolarHBondContact NE2-O 3.46Å; Q890-N954 PolarHBondContact OE1-ND2 3.07Å
891	V	91.1	Very high	76.4	Confident	10 Å²	10	67.1 Å²	67.1	6%	0.061	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	146.9	176.2	-60.3	0	0	0	0	110.3	L913 A915 F937 V942 E943	V891-L913 HydrophobicContact CG2-CB 3.98Å; V891-L913 HydrophobicContact CG2-CD1 4.37Å; V891-L913 PolarHBondContact N-O 2.87Å; V891-L913 PolarHBondContact O-N 3.48Å; V891-A915 HydrophobicContact CG1-CB 4.15Å; V891-A915 HydrophobicContact CG2-CB 4.49Å; V891-F937 HydrophobicContact CG2-CE2 4.04Å; V891-F937 HydrophobicContact CG2-CZ 4.16Å; V891-V942 HydrophobicContact CB-CB 4Å; V891-V942 HydrophobicContact CB-CG2 4.12Å; V891-V942 HydrophobicContact CG1-CG2 4.39Å; V891-V942 HydrophobicContact CG2-CB 4.06Å; V891-V942 HydrophobicContact CG2-CG1 4.21Å; V891-V942 HydrophobicContact CG2-CG2 4.14Å; V891-E943 CarbonylContact C-O 3.57Å; V891-E943 WeakPolarHBondContact CA-O 3.28Å; V891-E943 WeakPolarHBondContact CB-O 3.27Å
892	Q	91	Very high	77.8	Confident	79 Å²	79	70.4 Å²	70.4	37%	0.369	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	133.8	172.7	-179.8	163	40.3	0	0	109.9	I894 D911 I912 V942 E943 I945	Q892-I894 PolarHBondContact O-N 3.25Å; Q892-D911 CarbonylContact C-O 3.55Å; Q892-D911 WeakPolarHBondContact CA-O 3.4Å; Q892-I912 HydrophobicContact CB-CD1 3.91Å; Q892-I912 HydrophobicContact CG-CD1 3.76Å; Q892-V942 CarbonylContact O-C 3.57Å; Q892-V942 VanDerWaalsContact O-CA 3.24Å; Q892-V942 WeakPolarHBondContact O-CA 3.42Å; Q892-E943 PolarHBondContact N-O 2.86Å; Q892-E943 PolarHBondContact O-N 3.24Å; Q892-I945 HydrophobicContact CB-CD1 4.1Å; Q892-I945 HydrophobicContact CB-CG1 4.15Å
893	C	91	Very high	79.3	Confident	1 Å²	1	68.6 Å²	68.6	1%	0.007	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	116	173.1	-179.3	0	0	0	0	110.9	K895 L907 E908 A910 D911	C893-K895 VanDerWaalsContact SG-C 3.56Å; C893-K895 PolarHBondContact SG-O 3.38Å; C893-L907 HydrophobicContact CB-CB 4.27Å; C893-L907 HydrophobicContact CB-CD1 4.35Å; C893-L907 VanDerWaalsContact SG-CB 3.59Å; C893-E908 WeakPolarHBondContact CB-O 2.92Å; C893-E908 PolarHBondContact SG-O 3.36Å; C893-A910 WeakPolarHBondContact O-CA 3.36Å; C893-A910 PolarHBondContact O-N 2.95Å; C893-D911 HydrophobicContact CB-CB 3.89Å; C893-D911 PolarHBondContact N-O 2.87Å
894	I	91.8	Very high	81.1	Confident	59 Å²	59	61.6 Å²	61.6	30%	0.303	33%	0.333	S	S	.	.	S	Bend	trans	-92.7	-21.7	179.3	55.5	165	0	0	0	112.7	Q892 K909 Y941 E943	Q892-I894 PolarHBondContact O-N 3.25Å; I894-K909 WeakPolarHBondContact O-CE 3.43Å; I894-Y941 VanDerWaalsContact CG1-O 3.26Å; I894-Y941 WeakPolarHBondContact CG1-O 3.48Å; I894-Y941 PolarHBondContact N-O 2.86Å; I894-E943 HydrophobicContact CG2-CB 3.73Å
895	K	89	Confident	82.8	Confident	117 Å²	117	57.1 Å²	57.1	51%	0.509	31%	0.309	S	S	.	.	S	Bend	trans	-142.2	129.9	-178.6	-63.4	166	-171.2	162.6	0	108.8	C893 Y941	C893-K895 VanDerWaalsContact SG-C 3.56Å; C893-K895 PolarHBondContact SG-O 3.38Å; K895-Y941 HydrophobicContact CB-CD1 3.8Å; K895-Y941 HydrophobicContact CB-CE1 4.44Å; K895-Y941 PolarHBondContact N-O 2.91Å; K895-Y941 WeakPolarHBondContact O-CD1 3.44Å
896	S	89.2	Confident	84.5	Confident	78 Å²	78	56.7 Å²	56.7	55%	0.545	31%	0.309	S	S	.	.			trans	-58.3	140.9	176.2	-51.9	0	0	0	0	111.6	L907 K909	S896-L907 CarbonylContact C-O 3.17Å; S896-L907 WeakPolarHBondContact CA-O 3.34Å; S896-L907 WeakPolarHBondContact CB-O 3.48Å; S896-K909 PolarHBondContact OG-N 3.12Å
897	Y	91.3	Very high	86.4	Confident	13 Å²	13	52.4 Å²	52.4	5%	0.051	27%	0.273	C	S	.	.	B	Isolated β-bridge	trans	-128	130.2	-179.8	177.4	-108.3	0	0	0	109.6	E904 T906 L907 W923 F937 P938 Y941	Y897-E904 HydrophobicContact CE1-CB 4.45Å; Y897-E904 PolarHBondContact OH-OE2 2.93Å; Y897-E904 VanDerWaalsContact OH-OE2 3.07Å; Y897-T906 CarbonylContact O-C 3.54Å; Y897-T906 WeakPolarHBondContact O-CA 3.48Å; Y897-T906 WeakPolarHBondContact O-CG2 3.19Å; Y897-L907 PolarHBondContact N-O 2.71Å; Y897-L907 PolarHBondContact O-N 2.77Å; Y897-W923 WeakPolarHBondContact OH-CH2 3.27Å; Y897-F937 HydrophobicContact CD1-CB 4.34Å; Y897-P938 HydrophobicContact CD2-CG 4.23Å; Y897-P938 HydrophobicContact CE1-CG 4.44Å; Y897-P938 HydrophobicContact CE2-CG 3.69Å; Y897-Y941 HydrophobicContact CD2-CD1 4.08Å; Y897-Y941 HydrophobicContact CD2-CD2 4.12Å; Y897-Y941 AromaticContact CD2-CE1 3.9Å; Y897-Y941 HydrophobicContact CD2-CE1 3.9Å; Y897-Y941 AromaticContact CD2-CE2 3.95Å; Y897-Y941 HydrophobicContact CD2-CE2 3.95Å; Y897-Y941 HydrophobicContact CD2-CG 4.19Å; Y897-Y941 AromaticContact CD2-CZ 3.83Å; Y897-Y941 HydrophobicContact CE2-CE2 4.39Å; Y897-Y941 HydrophobicContact CG-CD1 4.35Å; Y897-Y941 HydrophobicContact CG-CG 4.42Å
898	Q	89.7	Confident	87.8	Confident	66 Å²	66	50.5 Å²	50.5	31%	0.308	26%	0.26	S	S	.	.			trans	-100.2	123.9	174.3	-179.4	167	56.3	0	0	108.7	E349	E349-Q898 VanDerWaalsContact CD-NE2 3.29Å; E349-Q898 PolarHBondContact OE1-NE2 2.65Å; E349-Q898 VanDerWaalsContact OE1-NE2 3.11Å; E349-Q898 PolarHBondContact OE2-NE2 3.13Å
899	A	89.6	Confident	88.7	Confident	31 Å²	31	57 Å²	57	26%	0.256	29%	0.288	S	S	.	.			trans	-56.2	139.6	175.2	0	0	0	0	0	111.5	E904 T906	A899-E904 HydrophobicContact CB-CB 3.75Å; A899-E904 WeakPolarHBondContact CB-O 3.42Å; A899-T906 VanDerWaalsContact CB-OG1 3.29Å; A899-T906 WeakPolarHBondContact CB-OG1 3.14Å; A899-T906 PolarHBondContact N-OG1 3.34Å; A899-T906 VanDerWaalsContact N-OG1 3.09Å
900	Q	87.2	Confident	88.8	Confident	163 Å²	163	57.8 Å²	57.8	76%	0.762	30%	0.296	S	S	*	.	S	Bend	trans	-110	-32.3	177.7	-54.6	-172.4	6.3	0	0	111.4	E904	Q900-E904 WeakPolarHBondContact CA-OE2 3.2Å; Q900-E904 WeakPolarHBondContact CB-OE2 3.38Å; Q900-E904 PolarHBondContact N-OE2 3.16Å
901	E	86.3	Confident	88.7	Confident	87 Å²	87	58.8 Å²	58.8	41%	0.407	30%	0.302	S	S	.	.	S	Bend	trans	-117.5	157	172.1	-59.3	-174.4	-174.3	0	0	111.8	K764 R864 D903 E904	K764-E901 IonicContact NZ-OE2 2.68Å; K764-E901 PolarHBondContact NZ-OE2 2.94Å; R864-E901 IonicContact CZ-OE2 3.13Å; R864-E901 IonicContact NH2-OE2 3.08Å; R864-E901 PolarHBondContact NH2-OE2 2.73Å; E901-D903 WeakPolarHBondContact CB-OD1 3.4Å; E901-D903 PolarHBondContact O-N 2.91Å; E901-D903 VanDerWaalsContact O-N 3.16Å; E901-E904 HydrophobicContact CB-CG 4.21Å; E901-E904 PolarHBondContact N-OE2 3.11Å; E901-E904 VanDerWaalsContact O-CB 3.31Å; E901-E904 WeakPolarHBondContact O-CB 3.07Å; E901-E904 PolarHBondContact O-N 3.11Å
902	H	85	Confident	88.6	Confident	86 Å²	86	60 Å²	60	40%	0.398	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-19.6	-171	-65.2	31.9	0	0	0	115.8	E738 V763	E738-H902 IonicContact OE1-CD2 2.7Å; E738-H902 IonicContact OE1-CE1 3.79Å; E738-H902 PolarHBondContact OE1-CE1 3.17Å; E738-H902 IonicContact OE1-NE2 3.12Å; E738-H902 PolarHBondContact OE1-NE2 3.37Å; E738-H902 IonicContact OE2-CD2 2.71Å; E738-H902 IonicContact OE2-NE2 3.47Å; E738-H902 PolarHBondContact OE2-NE2 3.34Å; V763-H902 VanDerWaalsContact O-CB 3.28Å; V763-H902 WeakPolarHBondContact O-CB 3.23Å
903	D	88	Confident	88.5	Confident	19 Å²	19	56.2 Å²	56.2	10%	0.102	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.6	4.8	175.2	62.1	-40.9	0	0	0	113	K764 R864 E901 G935 W936	K764-D903 IonicContact NZ-OD1 3.47Å; K764-D903 PolarHBondContact NZ-OD1 3.43Å; K764-D903 IonicContact NZ-OD2 2.75Å; K764-D903 PolarHBondContact NZ-OD2 3.21Å; R864-D903 WeakPolarHBondContact CB-OD2 3.16Å; R864-D903 IonicContact CZ-OD1 3.69Å; R864-D903 IonicContact CZ-OD2 2.6Å; R864-D903 IonicContact NE-OD1 2.79Å; R864-D903 IonicContact NE-OD2 3.33Å; R864-D903 PolarHBondContact NE-OD2 3.36Å; R864-D903 IonicContact NH2-OD1 2.69Å; R864-D903 PolarHBondContact NH2-OD1 3.21Å; R864-D903 IonicContact NH2-OD2 3.66Å; R864-D903 PolarHBondContact NH2-OD2 3.32Å; E901-D903 WeakPolarHBondContact CB-OD1 3.4Å; E901-D903 PolarHBondContact O-N 2.91Å; E901-D903 VanDerWaalsContact O-N 3.16Å; D903-G935 WeakPolarHBondContact O-CA 3.3Å; D903-W936 PolarHBondContact O-N 3.17Å
904	E	91.9	Very high	88.4	Confident	19 Å²	19	57.3 Å²	57.3	9%	0.089	30%	0.295	C	S	.	.	B	Isolated β-bridge	trans	-95.7	142.8	178.3	-60.3	174.7	174	0	0	112.4	R864 Y897 A899 Q900 E901 W923 W936	R864-E904 IonicContact CZ-OE1 2.78Å; R864-E904 IonicContact NH1-OE1 2.75Å; R864-E904 PolarHBondContact NH1-OE1 3.41Å; R864-E904 VanDerWaalsContact NH2-CD 3.33Å; R864-E904 IonicContact NH2-OE1 2.81Å; R864-E904 PolarHBondContact NH2-OE1 3.1Å; Y897-E904 HydrophobicContact CE1-CB 4.45Å; Y897-E904 PolarHBondContact OH-OE2 2.93Å; Y897-E904 VanDerWaalsContact OH-OE2 3.07Å; A899-E904 HydrophobicContact CB-CB 3.75Å; A899-E904 WeakPolarHBondContact CB-O 3.42Å; Q900-E904 WeakPolarHBondContact CA-OE2 3.2Å; Q900-E904 WeakPolarHBondContact CB-OE2 3.38Å; Q900-E904 PolarHBondContact N-OE2 3.16Å; E901-E904 HydrophobicContact CB-CG 4.21Å; E901-E904 PolarHBondContact N-OE2 3.11Å; E901-E904 VanDerWaalsContact O-CB 3.31Å; E901-E904 WeakPolarHBondContact O-CB 3.07Å; E901-E904 PolarHBondContact O-N 3.11Å; E904-W923 HydrophobicContact CG-CH2 4.42Å; E904-W923 HydrophobicContact CG-CZ3 4.08Å; E904-W923 WeakPolarHBondContact OE1-CH2 3.43Å; E904-W936 CarbonylContact C-O 3.54Å; E904-W936 WeakPolarHBondContact CA-O 3.44Å; E904-W936 WeakPolarHBondContact CB-O 3.15Å
905	L	89.9	Confident	88.3	Confident	7 Å²	7	54.9 Å²	54.9	4%	0.037	28%	0.283	C	S	.	.	P	Polyproline II helix	trans	-96.1	118	-178.1	-170.3	56.1	0	0	0	110.1	L907 L913 R928 E933 W936 F937	L905-L907 HydrophobicContact CB-CD2 4.28Å; L905-L907 HydrophobicContact CD2-CD2 4.09Å; L905-L907 HydrophobicContact CG-CD2 3.86Å; L905-L907 PolarHBondContact O-N 2.7Å; L905-L913 HydrophobicContact CD2-CD2 3.45Å; L905-L913 VanDerWaalsContact CD2-CD2 3.45Å; L905-R928 HydrophobicContact CD2-CB 4.14Å; L905-E933 HydrophobicContact CD1-CB 3.62Å; L905-E933 WeakPolarHBondContact CD2-O 3.43Å; L905-W936 PolarHBondContact N-O 3.1Å; L905-F937 HydrophobicContact CB-CD1 4.24Å; L905-F937 HydrophobicContact CD2-CD1 4.47Å; L905-F937 HydrophobicContact CD2-CE1 4.49Å
906	T	90.5	Very high	88.1	Confident	67 Å²	67	53 Å²	53	41%	0.411	28%	0.275	S	S	.	.	P	Polyproline II helix	trans	-70.4	121.8	172.1	-69.3	0	0	0	0	109.2	Y897 A899 R928	Y897-T906 CarbonylContact O-C 3.54Å; Y897-T906 WeakPolarHBondContact O-CA 3.48Å; Y897-T906 WeakPolarHBondContact O-CG2 3.19Å; A899-T906 VanDerWaalsContact CB-OG1 3.29Å; A899-T906 WeakPolarHBondContact CB-OG1 3.14Å; A899-T906 PolarHBondContact N-OG1 3.34Å; A899-T906 VanDerWaalsContact N-OG1 3.09Å; T906-R928 PolarHBondContact O-NH1 2.76Å
907	L	89.6	Confident	87.9	Confident	2 Å²	2	51.7 Å²	51.7	1%	0.01	26%	0.264	C	S	.	.	B	Isolated β-bridge	trans	-108.2	135.4	-176	-51.6	-176.1	0	0	0	111.4	C893 S896 Y897 L905 L913 F937 V942	C893-L907 HydrophobicContact CB-CB 4.27Å; C893-L907 HydrophobicContact CB-CD1 4.35Å; C893-L907 VanDerWaalsContact SG-CB 3.59Å; S896-L907 CarbonylContact C-O 3.17Å; S896-L907 WeakPolarHBondContact CA-O 3.34Å; S896-L907 WeakPolarHBondContact CB-O 3.48Å; Y897-L907 PolarHBondContact N-O 2.71Å; Y897-L907 PolarHBondContact O-N 2.77Å; L905-L907 HydrophobicContact CB-CD2 4.28Å; L905-L907 HydrophobicContact CD2-CD2 4.09Å; L905-L907 HydrophobicContact CG-CD2 3.86Å; L905-L907 PolarHBondContact O-N 2.7Å; L907-L913 HydrophobicContact CD1-CD1 4.49Å; L907-L913 HydrophobicContact CD2-CD1 4.08Å; L907-L913 HydrophobicContact CD2-CD2 3.54Å; L907-L913 HydrophobicContact CD2-CG 4.43Å; L907-F937 HydrophobicContact CD1-CB 3.89Å; L907-F937 HydrophobicContact CD1-CD1 4.49Å; L907-F937 HydrophobicContact CD1-CD2 3.94Å; L907-F937 HydrophobicContact CD1-CG 3.86Å; L907-F937 HydrophobicContact CD2-CD1 4.4Å; L907-F937 HydrophobicContact CG-CB 4.36Å; L907-V942 HydrophobicContact CD1-CG1 3.83Å
908	E	85.5	Confident	87.7	Confident	97 Å²	97	54.9 Å²	54.9	45%	0.453	28%	0.281	S	S	.	.			trans	-97.5	149.6	164.8	-64.5	-158.8	176	0	0	111.3	S352 C893 A910 D911	S352-E908 VanDerWaalsContact CB-OE1 3.23Å; S352-E908 WeakPolarHBondContact CB-OE1 3.38Å; S352-E908 PolarHBondContact OG-OE1 2.99Å; C893-E908 WeakPolarHBondContact CB-O 2.92Å; C893-E908 PolarHBondContact SG-O 3.36Å; E908-A910 PolarHBondContact O-N 2.93Å; E908-D911 PolarHBondContact N-OD2 3.04Å; E908-D911 VanDerWaalsContact O-CB 3.24Å; E908-D911 WeakPolarHBondContact O-CB 3.46Å; E908-D911 PolarHBondContact O-N 3.42Å
909	K	83	Confident	87.7	Confident	153 Å²	153	52.2 Å²	52.2	67%	0.665	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	132.2	179.8	-175.6	177.7	-178.6	-178.1	0	110.6	I894 S896	I894-K909 WeakPolarHBondContact O-CE 3.43Å; S896-K909 PolarHBondContact OG-N 3.12Å
910	A	84.1	Confident	87.6	Confident	55 Å²	55	55.6 Å²	55.6	46%	0.455	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.1	4.7	-171.9	0	0	0	0	0	116.7	C893 E908 I912	C893-A910 WeakPolarHBondContact O-CA 3.36Å; C893-A910 PolarHBondContact O-N 2.95Å; E908-A910 PolarHBondContact O-N 2.93Å; A910-I912 PolarHBondContact O-N 3.19Å
911	D	87.3	Confident	87.7	Confident	26 Å²	26	50.7 Å²	50.7	14%	0.139	27%	0.27	C	S	.	.			trans	-50.6	137.2	164.4	-88.8	-17.4	0	0	0	110.8	Q892 C893 E908 L913 R928	Q892-D911 CarbonylContact C-O 3.55Å; Q892-D911 WeakPolarHBondContact CA-O 3.4Å; C893-D911 HydrophobicContact CB-CB 3.89Å; C893-D911 PolarHBondContact N-O 2.87Å; E908-D911 PolarHBondContact N-OD2 3.04Å; E908-D911 VanDerWaalsContact O-CB 3.24Å; E908-D911 WeakPolarHBondContact O-CB 3.46Å; E908-D911 PolarHBondContact O-N 3.42Å; D911-L913 HydrophobicContact CB-CD1 4.1Å; D911-R928 WeakPolarHBondContact OD1-CD 3.34Å; D911-R928 VanDerWaalsContact OD2-CD 3.27Å; D911-R928 WeakPolarHBondContact OD2-CD 3.42Å; D911-R928 IonicContact OD2-CZ 3.09Å; D911-R928 IonicContact OD2-NE 3.3Å; D911-R928 IonicContact OD2-NH1 2.69Å; D911-R928 PolarHBondContact OD2-NH1 2.77Å
912	I	88.8	Confident	88	Confident	35 Å²	35	47.9 Å²	47.9	18%	0.179	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	127	175.6	-50.5	-61.2	0	0	0	108.8	Q892 A910 L929 I945 N954	Q892-I912 HydrophobicContact CB-CD1 3.91Å; Q892-I912 HydrophobicContact CG-CD1 3.76Å; A910-I912 PolarHBondContact O-N 3.19Å; I912-L929 HydrophobicContact CB-CD1 4.28Å; I912-L929 HydrophobicContact CG2-CD1 3.66Å; I912-L929 HydrophobicContact CG2-CG 4.32Å; I912-L929 PolarHBondContact O-N 2.95Å; I912-I945 HydrophobicContact CD1-CD1 3.95Å; I912-I945 HydrophobicContact CG2-CD1 3.87Å; I912-N954 HydrophobicContact CG2-CB 4.35Å
913	L	90.4	Very high	88.4	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	145.1	-177.6	-53	99.3	0	0	0	111.1	Q890 V891 L905 L907 D911 I927 R928 F937	Q890-L913 CarbonylContact C-O 3.56Å; Q890-L913 VanDerWaalsContact CA-O 3.26Å; Q890-L913 WeakPolarHBondContact CA-O 3.31Å; V891-L913 HydrophobicContact CG2-CB 3.98Å; V891-L913 HydrophobicContact CG2-CD1 4.37Å; V891-L913 PolarHBondContact N-O 2.87Å; V891-L913 PolarHBondContact O-N 3.48Å; L905-L913 HydrophobicContact CD2-CD2 3.45Å; L905-L913 VanDerWaalsContact CD2-CD2 3.45Å; L907-L913 HydrophobicContact CD1-CD1 4.49Å; L907-L913 HydrophobicContact CD2-CD1 4.08Å; L907-L913 HydrophobicContact CD2-CD2 3.54Å; L907-L913 HydrophobicContact CD2-CG 4.43Å; D911-L913 HydrophobicContact CB-CD1 4.1Å; L913-I927 CarbonylContact C-O 3.58Å; L913-I927 WeakPolarHBondContact CA-O 3.37Å; L913-R928 HydrophobicContact CD2-CB 3.88Å; L913-R928 HydrophobicContact CG-CB 4.13Å; L913-F937 HydrophobicContact CB-CZ 4.28Å; L913-F937 HydrophobicContact CD2-CD1 4.3Å; L913-F937 HydrophobicContact CD2-CE1 3.67Å; L913-F937 HydrophobicContact CD2-CZ 3.97Å
914	H	88.8	Confident	88.6	Confident	24 Å²	24	45.2 Å²	45.2	11%	0.111	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	124.8	163	179.3	35.2	0	0	0	108.4	S889 G926 I927 L929	S889-H914 PolarHBondContact O-ND1 2.98Å; H914-G926 CarbonylContact O-C 3.44Å; H914-G926 WeakPolarHBondContact O-CA 3.35Å; H914-I927 PolarHBondContact N-O 3.42Å; H914-I927 PolarHBondContact O-N 2.93Å; H914-L929 HydrophobicContact CB-CD2 4.38Å
915	A	88.8	Confident	88.6	Confident	8 Å²	8	44.5 Å²	44.5	7%	0.066	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	121.1	178.4	0	0	0	0	0	109.8	S889 V891 V924	S889-A915 PolarHBondContact O-N 2.85Å; V891-A915 HydrophobicContact CG1-CB 4.15Å; V891-A915 HydrophobicContact CG2-CB 4.49Å; A915-V924 HydrophobicContact CB-CG1 3.78Å
916	K	84.4	Confident	88.6	Confident	76 Å²	76	44.2 Å²	44.2	33%	0.33	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	-33.5	-175.3	-172.7	176.8	-172.1	177.9	0	113.1	S872 D877 E925	S872-K916 PolarHBondContact OG-NZ 3.03Å; S872-K916 VanDerWaalsContact OG-NZ 3.1Å; D877-K916 IonicContact OD1-NZ 3.44Å; D877-K916 PolarHBondContact OD1-NZ 2.77Å; D877-K916 IonicContact OD2-NZ 3.85Å; D877-K916 PolarHBondContact OD2-NZ 3.31Å; K916-E925 PolarHBondContact N-O 2.88Å
917	T	85.5	Confident	88.5	Confident	51 Å²	51	41 Å²	41	31%	0.313	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	139.8	-179.7	-74.6	0	0	0	0	109.3	Q863 T919 V924 E925 W936	Q863-T917 HydrophobicContact CG-CG2 4.36Å; T917-T919 HydrophobicContact CG2-CG2 4.43Å; T917-V924 CarbonylContact O-C 3.6Å; T917-V924 WeakPolarHBondContact O-CA 3.49Å; T917-E925 PolarHBondContact N-O 3.14Å; T917-E925 PolarHBondContact O-N 2.99Å; T917-W936 HydrophobicContact CG2-CH2 4.28Å
918	I	88.5	Confident	88.4	Confident	81 Å²	81	42 Å²	42	42%	0.415	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	124.1	176	-55.6	-179.1	0	0	0	107.1	W923 V924 K939	I918-W923 WeakPolarHBondContact CA-O 3.39Å; I918-V924 HydrophobicContact CG1-CG1 4.23Å; I918-V924 HydrophobicContact CG1-CG2 4.2Å; I918-V924 HydrophobicContact CG2-CG2 4.37Å; I918-K939 HydrophobicContact CG2-CD 4.05Å
919	T	89.2	Confident	88.3	Confident	9 Å²	9	38.2 Å²	38.2	6%	0.055	21%	0.211	C	C	.	.			trans	-94.1	156.2	179.4	60	0	0	0	0	111.5	E859 Q863 T917 D921 G922 W923 W936	E859-T919 HydrophobicContact CG-CG2 3.97Å; Q863-T919 HydrophobicContact CB-CG2 4.37Å; T917-T919 HydrophobicContact CG2-CG2 4.43Å; T919-D921 WeakPolarHBondContact CB-OD1 3.18Å; T919-D921 PolarHBondContact O-N 2.72Å; T919-D921 PolarHBondContact OG1-OD1 3.06Å; T919-G922 PolarHBondContact O-N 3.06Å; T919-W923 PolarHBondContact N-O 2.79Å; T919-W923 PolarHBondContact OG1-N 3.42Å; T919-W923 PolarHBondContact OG1-O 2.91Å; T919-W936 HydrophobicContact CG2-CH2 4.23Å; T919-W936 HydrophobicContact CG2-CZ3 4.04Å
920	S	87.1	Confident	87.9	Confident	103 Å²	103	34.8 Å²	34.8	72%	0.72	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-25.6	-177.3	56.9	0	0	0	0	113.9	E859 G922	E859-S920 VanDerWaalsContact OE2-CB 3.29Å; E859-S920 WeakPolarHBondContact OE2-CB 3.47Å; E859-S920 PolarHBondContact OE2-N 3.13Å; E859-S920 PolarHBondContact OE2-OG 3.22Å; S920-G922 PolarHBondContact O-N 3.46Å
921	D	89.4	Confident	87.4	Confident	60 Å²	60	36.2 Å²	36.2	32%	0.321	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.4	12	172.9	65.5	-27.6	0	0	0	113.9	T858 S860 T919	T858-D921 VanDerWaalsContact CB-OD2 3.24Å; T858-D921 WeakPolarHBondContact CB-OD2 3.37Å; T858-D921 PolarHBondContact OG1-OD2 3.08Å; S860-D921 WeakPolarHBondContact CB-OD1 3.07Å; S860-D921 WeakPolarHBondContact CB-OD2 3.41Å; S860-D921 PolarHBondContact N-OD1 3.32Å; S860-D921 PolarHBondContact N-OD2 3.27Å; S860-D921 PolarHBondContact OG-OD2 3.2Å; T919-D921 WeakPolarHBondContact CB-OD1 3.18Å; T919-D921 PolarHBondContact O-N 2.72Å; T919-D921 PolarHBondContact OG1-OD1 3.06Å
922	G	91.6	Very high	87	Confident	27 Å²	27	36.1 Å²	36.1	28%	0.278	21%	0.212	S	C	.	.	S	Bend	trans	83.9	20.7	165.7	0	0	0	0	0	115.5	T919 S920 K939	T919-G922 PolarHBondContact O-N 3.06Å; S920-G922 PolarHBondContact O-N 3.46Å; G922-K939 WeakPolarHBondContact O-CB 3.44Å; G922-K939 PolarHBondContact O-N 3.14Å
923	W	93.9	Very high	86.7	Confident	49 Å²	49	39.2 Å²	39.2	19%	0.186	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	154.1	167.7	-72.3	81.5	0	0	0	111.6	S860 R864 Y897 E904 I918 T919 W936 F937 P938	S860-W923 VanDerWaalsContact CB-CD1 3.45Å; R864-W923 VanDerWaalsContact NH1-CH2 3.28Å; R864-W923 VanDerWaalsContact NH1-CZ3 3.34Å; Y897-W923 WeakPolarHBondContact OH-CH2 3.27Å; E904-W923 HydrophobicContact CG-CH2 4.42Å; E904-W923 HydrophobicContact CG-CZ3 4.08Å; E904-W923 WeakPolarHBondContact OE1-CH2 3.43Å; I918-W923 WeakPolarHBondContact CA-O 3.39Å; T919-W923 PolarHBondContact N-O 2.79Å; T919-W923 PolarHBondContact OG1-N 3.42Å; T919-W923 PolarHBondContact OG1-O 2.91Å; W923-W936 HydrophobicContact CB-CE3 4.04Å; W923-W936 HydrophobicContact CB-CZ3 4.28Å; W923-W936 HydrophobicContact CE3-CB 4.21Å; W923-F937 VanDerWaalsContact CE3-C 3.5Å; W923-P938 HydrophobicContact CE3-CG 4.36Å; W923-P938 HydrophobicContact CH2-CG 3.98Å; W923-P938 HydrophobicContact CZ2-CG 4.34Å; W923-P938 HydrophobicContact CZ3-CG 3.98Å
924	V	92.8	Very high	86.5	Confident	1 Å²	1	41.7 Å²	41.7	1%	0.006	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	129.9	177	-175.9	0	0	0	0	108.5	A915 T917 I918 W936 F937 K939	A915-V924 HydrophobicContact CB-CG1 3.78Å; T917-V924 CarbonylContact O-C 3.6Å; T917-V924 WeakPolarHBondContact O-CA 3.49Å; I918-V924 HydrophobicContact CG1-CG1 4.23Å; I918-V924 HydrophobicContact CG1-CG2 4.2Å; I918-V924 HydrophobicContact CG2-CG2 4.37Å; V924-W936 WeakPolarHBondContact O-CA 3.49Å; V924-F937 HydrophobicContact CB-CD2 3.92Å; V924-F937 HydrophobicContact CB-CE2 3.54Å; V924-F937 HydrophobicContact CB-CZ 3.96Å; V924-F937 HydrophobicContact CG1-CD2 4.42Å; V924-F937 HydrophobicContact CG1-CE1 4.45Å; V924-F937 HydrophobicContact CG1-CE2 3.57Å; V924-F937 HydrophobicContact CG1-CZ 3.58Å; V924-F937 HydrophobicContact CG2-CE2 4.27Å; V924-F937 PolarHBondContact N-O 2.96Å; V924-F937 PolarHBondContact O-N 3.21Å; V924-K939 HydrophobicContact CG2-CB 3.78Å; V924-K939 HydrophobicContact CG2-CG 4.07Å
925	E	91.9	Very high	86.6	Confident	4 Å²	4	40.8 Å²	40.8	2%	0.019	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	131.8	161.3	-169.5	179.5	166.8	0	0	108.5	T867 K916 T917 R934 W936	T867-E925 WeakPolarHBondContact CG2-OE1 3.44Å; T867-E925 PolarHBondContact OG1-OE2 3.46Å; K916-E925 PolarHBondContact N-O 2.88Å; T917-E925 PolarHBondContact N-O 3.14Å; T917-E925 PolarHBondContact O-N 2.99Å; E925-R934 IonicContact OE1-CZ 3.37Å; E925-R934 IonicContact OE1-NE 2.59Å; E925-R934 PolarHBondContact OE1-NE 3.29Å; E925-R934 IonicContact OE1-NH2 2.81Å; E925-R934 PolarHBondContact OE1-NH2 3.47Å; E925-W936 HydrophobicContact CB-CD2 3.93Å; E925-W936 HydrophobicContact CB-CE3 4Å; E925-W936 HydrophobicContact CB-CH2 3.75Å; E925-W936 HydrophobicContact CB-CZ2 3.67Å; E925-W936 HydrophobicContact CB-CZ3 3.92Å; E925-W936 HydrophobicContact CG-CD2 4.3Å; E925-W936 HydrophobicContact CG-CZ2 3.97Å; E925-W936 WeakPolarHBondContact OE2-CZ2 3.43Å
926	G	89.6	Confident	86.8	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157	171.6	175.1	0	0	0	0	0	114.8	H914 R934 G935	H914-G926 CarbonylContact O-C 3.44Å; H914-G926 WeakPolarHBondContact O-CA 3.35Å; G926-R934 WeakPolarHBondContact O-CA 3.37Å; G926-G935 PolarHBondContact N-O 3.34Å; G926-G935 PolarHBondContact O-N 3.34Å
927	I	88.4	Confident	87.3	Confident	1 Å²	1	37 Å²	37	1%	0.005	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	120.4	179	-47.4	176.1	0	0	0	107.7	P874 D877 I878 L913 H914 E933 R934	P874-I927 HydrophobicContact CB-CD1 4.36Å; D877-I927 HydrophobicContact CB-CD1 3.9Å; I878-I927 HydrophobicContact CD1-CD1 4.42Å; I878-I927 HydrophobicContact CD1-CG2 3.91Å; I878-I927 HydrophobicContact CG1-CD1 4.15Å; L913-I927 CarbonylContact C-O 3.58Å; L913-I927 WeakPolarHBondContact CA-O 3.37Å; H914-I927 PolarHBondContact N-O 3.42Å; H914-I927 PolarHBondContact O-N 2.93Å; I927-E933 CarbonylContact C-O 3.51Å; I927-E933 WeakPolarHBondContact CA-O 3.49Å; I927-R934 HydrophobicContact CG1-CB 4.08Å; I927-R934 HydrophobicContact CG1-CG 4.03Å
928	R	87.9	Confident	87.7	Confident	22 Å²	22	35.4 Å²	35.4	8%	0.083	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	133.2	175.4	175.7	164.9	62.9	-139.8	-9	109.8	L905 T906 D911 L913 S930 D931 G932 E933	L905-R928 HydrophobicContact CD2-CB 4.14Å; T906-R928 PolarHBondContact O-NH1 2.76Å; D911-R928 WeakPolarHBondContact OD1-CD 3.34Å; D911-R928 VanDerWaalsContact OD2-CD 3.27Å; D911-R928 WeakPolarHBondContact OD2-CD 3.42Å; D911-R928 IonicContact OD2-CZ 3.09Å; D911-R928 IonicContact OD2-NE 3.3Å; D911-R928 IonicContact OD2-NH1 2.69Å; D911-R928 PolarHBondContact OD2-NH1 2.77Å; L913-R928 HydrophobicContact CD2-CB 3.88Å; L913-R928 HydrophobicContact CG-CB 4.13Å; R928-S930 VanDerWaalsContact CD-OG 3.26Å; R928-S930 WeakPolarHBondContact CD-OG 3.41Å; R928-S930 VanDerWaalsContact CG-OG 3.24Å; R928-S930 WeakPolarHBondContact CG-OG 3.28Å; R928-D931 IonicContact CZ-OD1 3.27Å; R928-D931 IonicContact CZ-OD2 3.36Å; R928-D931 VanDerWaalsContact CZ-OD2 3.26Å; R928-D931 IonicContact NE-OD1 3.9Å; R928-D931 PolarHBondContact NE-OD1 3.48Å; R928-D931 VanDerWaalsContact NE-OD1 3.12Å; R928-D931 IonicContact NE-OD2 2.67Å; R928-D931 PolarHBondContact NE-OD2 3.47Å; R928-D931 IonicContact NH2-OD1 3.5Å; R928-D931 IonicContact NH2-OD2 3.35Å; R928-D931 PolarHBondContact NH2-OD2 3.31Å; R928-G932 WeakPolarHBondContact O-CA 3.33Å; R928-G932 PolarHBondContact O-N 2.92Å; R928-E933 IonicContact CZ-OE2 2.63Å; R928-E933 PolarHBondContact N-O 3.41Å; R928-E933 IonicContact NH2-OE2 2.74Å; R928-E933 PolarHBondContact NH2-OE2 3.41Å
929	L	82.4	Confident	87.9	Confident	17 Å²	17	36.4 Å²	36.4	9%	0.089	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-37.1	-175.3	-63.9	-174.4	0	0	0	112.8	I912 H914 D931 N954 N958	I912-L929 HydrophobicContact CB-CD1 4.28Å; I912-L929 HydrophobicContact CG2-CD1 3.66Å; I912-L929 HydrophobicContact CG2-CG 4.32Å; I912-L929 PolarHBondContact O-N 2.95Å; H914-L929 HydrophobicContact CB-CD2 4.38Å; L929-D931 VanDerWaalsContact C-N 3.3Å; L929-D931 PolarHBondContact O-N 3.23Å; L929-N954 HydrophobicContact CD1-CB 4.2Å; L929-N958 PolarHBondContact O-ND2 3.19Å
930	S	74.8	Confident	88.2	Confident	82 Å²	82	40.7 Å²	40.7	57%	0.573	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-32.1	-170.7	47.5	0	0	0	0	114.6	R928	R928-S930 VanDerWaalsContact CD-OG 3.26Å; R928-S930 WeakPolarHBondContact CD-OG 3.41Å; R928-S930 VanDerWaalsContact CG-OG 3.24Å; R928-S930 WeakPolarHBondContact CG-OG 3.28Å
931	D	73.9	Confident	88.4	Confident	85 Å²	85	39.6 Å²	39.6	46%	0.455	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-129.8	-21.6	-176.4	50	14.4	0	0	0	114.3	R928 L929 E933	R928-D931 IonicContact CZ-OD1 3.27Å; R928-D931 IonicContact CZ-OD2 3.36Å; R928-D931 VanDerWaalsContact CZ-OD2 3.26Å; R928-D931 IonicContact NE-OD1 3.9Å; R928-D931 PolarHBondContact NE-OD1 3.48Å; R928-D931 VanDerWaalsContact NE-OD1 3.12Å; R928-D931 IonicContact NE-OD2 2.67Å; R928-D931 PolarHBondContact NE-OD2 3.47Å; R928-D931 IonicContact NH2-OD1 3.5Å; R928-D931 IonicContact NH2-OD2 3.35Å; R928-D931 PolarHBondContact NH2-OD2 3.31Å; L929-D931 VanDerWaalsContact C-N 3.3Å; L929-D931 PolarHBondContact O-N 3.23Å; D931-E933 HydrophobicContact CB-CG 4.49Å; D931-E933 PolarHBondContact OD1-N 2.99Å
932	G	79	Confident	88.5	Confident	23 Å²	23	37.4 Å²	37.4	24%	0.237	20%	0.201	C	C	.	.			trans	87.5	11.9	-173.5	0	0	0	0	0	114.1	R928 R934	R928-G932 WeakPolarHBondContact O-CA 3.33Å; R928-G932 PolarHBondContact O-N 2.92Å; G932-R934 PolarHBondContact O-N 3Å
933	E	82.2	Confident	88.6	Confident	101 Å²	101	42.2 Å²	42.2	47%	0.472	22%	0.217	S	C	.	.			trans	-67	128.2	176.3	-72	-168	163.7	0	0	110.8	L905 I927 R928 D931	L905-E933 HydrophobicContact CD1-CB 3.62Å; L905-E933 WeakPolarHBondContact CD2-O 3.43Å; I927-E933 CarbonylContact C-O 3.51Å; I927-E933 WeakPolarHBondContact CA-O 3.49Å; R928-E933 IonicContact CZ-OE2 2.63Å; R928-E933 PolarHBondContact N-O 3.41Å; R928-E933 IonicContact NH2-OE2 2.74Å; R928-E933 PolarHBondContact NH2-OE2 3.41Å; D931-E933 HydrophobicContact CB-CG 4.49Å; D931-E933 PolarHBondContact OD1-N 2.99Å
934	R	86.3	Confident	88.4	Confident	52 Å²	52	44.9 Å²	44.9	20%	0.196	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	138.8	178.9	177.4	178.3	178	167.2	4.4	110.2	S872 D877 E925 G926 I927 G932	S872-R934 PolarHBondContact O-NH1 2.78Å; S872-R934 PolarHBondContact OG-NH1 3.27Å; S872-R934 PolarHBondContact OG-NH2 2.8Å; S872-R934 VanDerWaalsContact OG-NH2 3.08Å; D877-R934 IonicContact OD2-CZ 3.8Å; D877-R934 IonicContact OD2-NH1 2.71Å; D877-R934 PolarHBondContact OD2-NH1 2.93Å; D877-R934 IonicContact OD2-NH2 3.92Å; E925-R934 IonicContact OE1-CZ 3.37Å; E925-R934 IonicContact OE1-NE 2.59Å; E925-R934 PolarHBondContact OE1-NE 3.29Å; E925-R934 IonicContact OE1-NH2 2.81Å; E925-R934 PolarHBondContact OE1-NH2 3.47Å; G926-R934 WeakPolarHBondContact O-CA 3.37Å; I927-R934 HydrophobicContact CG1-CB 4.08Å; I927-R934 HydrophobicContact CG1-CG 4.03Å; G932-R934 PolarHBondContact O-N 3Å
935	G	90.3	Very high	88.1	Confident	5 Å²	5	45.8 Å²	45.8	5%	0.052	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	178.1	-172.3	171.9	0	0	0	0	0	113.1	D903 G926	D903-G935 WeakPolarHBondContact O-CA 3.3Å; G926-G935 PolarHBondContact N-O 3.34Å; G926-G935 PolarHBondContact O-N 3.34Å
936	W	93.4	Very high	87.9	Confident	4 Å²	4	51 Å²	51	2%	0.015	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	143.4	-176	-70	83.3	0	0	0	112.5	Q863 R864 D903 E904 L905 T917 T919 W923 V924 E925	Q863-W936 HydrophobicContact CB-CH2 3.78Å; Q863-W936 HydrophobicContact CB-CZ2 4.1Å; Q863-W936 HydrophobicContact CG-CH2 3.54Å; Q863-W936 HydrophobicContact CG-CZ2 3.79Å; R864-W936 HydrophobicContact CG-CB 4.32Å; R864-W936 HydrophobicContact CG-CD2 3.39Å; R864-W936 VanDerWaalsContact CG-CE2 3.45Å; R864-W936 HydrophobicContact CG-CE3 3.93Å; R864-W936 HydrophobicContact CG-CG 3.57Å; R864-W936 HydrophobicContact CG-CH2 4.48Å; R864-W936 HydrophobicContact CG-CZ2 4.02Å; R864-W936 HydrophobicContact CG-CZ3 4.44Å; D903-W936 PolarHBondContact O-N 3.17Å; E904-W936 CarbonylContact C-O 3.54Å; E904-W936 WeakPolarHBondContact CA-O 3.44Å; E904-W936 WeakPolarHBondContact CB-O 3.15Å; L905-W936 PolarHBondContact N-O 3.1Å; T917-W936 HydrophobicContact CG2-CH2 4.28Å; T919-W936 HydrophobicContact CG2-CH2 4.23Å; T919-W936 HydrophobicContact CG2-CZ3 4.04Å; W923-W936 HydrophobicContact CB-CE3 4.04Å; W923-W936 HydrophobicContact CB-CZ3 4.28Å; W923-W936 HydrophobicContact CE3-CB 4.21Å; V924-W936 WeakPolarHBondContact O-CA 3.49Å; E925-W936 HydrophobicContact CB-CD2 3.93Å; E925-W936 HydrophobicContact CB-CE3 4Å; E925-W936 HydrophobicContact CB-CH2 3.75Å; E925-W936 HydrophobicContact CB-CZ2 3.67Å; E925-W936 HydrophobicContact CB-CZ3 3.92Å; E925-W936 HydrophobicContact CG-CD2 4.3Å; E925-W936 HydrophobicContact CG-CZ2 3.97Å; E925-W936 WeakPolarHBondContact OE2-CZ2 3.43Å
937	F	94.6	Very high	87.6	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	153.2	177.9	47.7	-88.1	0	0	0	111.3	V891 Y897 L905 L907 L913 W923 V924 V942	V891-F937 HydrophobicContact CG2-CE2 4.04Å; V891-F937 HydrophobicContact CG2-CZ 4.16Å; Y897-F937 HydrophobicContact CD1-CB 4.34Å; L905-F937 HydrophobicContact CB-CD1 4.24Å; L905-F937 HydrophobicContact CD2-CD1 4.47Å; L905-F937 HydrophobicContact CD2-CE1 4.49Å; L907-F937 HydrophobicContact CD1-CB 3.89Å; L907-F937 HydrophobicContact CD1-CD1 4.49Å; L907-F937 HydrophobicContact CD1-CD2 3.94Å; L907-F937 HydrophobicContact CD1-CG 3.86Å; L907-F937 HydrophobicContact CD2-CD1 4.4Å; L907-F937 HydrophobicContact CG-CB 4.36Å; L913-F937 HydrophobicContact CB-CZ 4.28Å; L913-F937 HydrophobicContact CD2-CD1 4.3Å; L913-F937 HydrophobicContact CD2-CE1 3.67Å; L913-F937 HydrophobicContact CD2-CZ 3.97Å; W923-F937 VanDerWaalsContact CE3-C 3.5Å; V924-F937 HydrophobicContact CB-CD2 3.92Å; V924-F937 HydrophobicContact CB-CE2 3.54Å; V924-F937 HydrophobicContact CB-CZ 3.96Å; V924-F937 HydrophobicContact CG1-CD2 4.42Å; V924-F937 HydrophobicContact CG1-CE1 4.45Å; V924-F937 HydrophobicContact CG1-CE2 3.57Å; V924-F937 HydrophobicContact CG1-CZ 3.58Å; V924-F937 HydrophobicContact CG2-CE2 4.27Å; V924-F937 PolarHBondContact N-O 2.96Å; V924-F937 PolarHBondContact O-N 3.21Å; F937-V942 HydrophobicContact CD2-CG1 3.78Å; F937-V942 HydrophobicContact CD2-CG2 4.34Å; F937-V942 HydrophobicContact CE2-CB 4.49Å; F937-V942 HydrophobicContact CE2-CG1 3.73Å; F937-V942 HydrophobicContact CE2-CG2 4.05Å
938	P	94.6	Very high	87.1	Confident	17 Å²	17	60.6 Å²	60.6	11%	0.11	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	136.1	-180	-9.8	25.4	0	0	0	111.2	Y897 W923 T940 Y941	Y897-P938 HydrophobicContact CD2-CG 4.23Å; Y897-P938 HydrophobicContact CE1-CG 4.44Å; Y897-P938 HydrophobicContact CE2-CG 3.69Å; W923-P938 HydrophobicContact CE3-CG 4.36Å; W923-P938 HydrophobicContact CH2-CG 3.98Å; W923-P938 HydrophobicContact CZ2-CG 4.34Å; W923-P938 HydrophobicContact CZ3-CG 3.98Å; P938-T940 PolarHBondContact O-N 3.34Å; P938-Y941 HydrophobicContact CB-CD2 3.96Å; P938-Y941 HydrophobicContact CB-CE2 4.3Å; P938-Y941 HydrophobicContact CG-CD2 4.03Å; P938-Y941 HydrophobicContact CG-CE2 4.16Å; P938-Y941 PolarHBondContact O-N 3.08Å; P938-Y941 VanDerWaalsContact O-N 3.13Å
939	K	93.3	Very high	86.5	Confident	103 Å²	103	63.1 Å²	63.1	45%	0.448	33%	0.334	S	S	.	.	G	3₁₀ helix	trans	-56.4	-25.3	-178.9	-170.3	170.5	-179.3	174.3	0	113.2	I918 G922 V924 Y941 V942	I918-K939 HydrophobicContact CG2-CD 4.05Å; G922-K939 WeakPolarHBondContact O-CB 3.44Å; G922-K939 PolarHBondContact O-N 3.14Å; V924-K939 HydrophobicContact CG2-CB 3.78Å; V924-K939 HydrophobicContact CG2-CG 4.07Å; K939-Y941 PolarHBondContact O-N 3.33Å; K939-V942 WeakPolarHBondContact O-CG2 3.29Å; K939-V942 PolarHBondContact O-N 3.01Å; K939-V942 VanDerWaalsContact O-O 3.05Å
940	T	94.3	Very high	86.4	Confident	99 Å²	99	63.1 Å²	63.1	61%	0.607	34%	0.336	S	S	*	.	G	3₁₀ helix	trans	-71.2	-7.3	-179.5	52.1	0	0	0	0	115.3	P938	P938-T940 PolarHBondContact O-N 3.34Å
941	Y	92.1	Very high	86.7	Confident	79 Å²	79	61.6 Å²	61.6	31%	0.31	32%	0.318	S	S	.	.	G	3₁₀ helix	trans	-102.4	-4.2	176.4	-69.9	-102.7	0	0	0	113.2	I894 K895 Y897 P938 K939	I894-Y941 VanDerWaalsContact CG1-O 3.26Å; I894-Y941 WeakPolarHBondContact CG1-O 3.48Å; I894-Y941 PolarHBondContact N-O 2.86Å; K895-Y941 HydrophobicContact CB-CD1 3.8Å; K895-Y941 HydrophobicContact CB-CE1 4.44Å; K895-Y941 PolarHBondContact N-O 2.91Å; K895-Y941 WeakPolarHBondContact O-CD1 3.44Å; Y897-Y941 HydrophobicContact CD2-CD1 4.08Å; Y897-Y941 HydrophobicContact CD2-CD2 4.12Å; Y897-Y941 AromaticContact CD2-CE1 3.9Å; Y897-Y941 HydrophobicContact CD2-CE1 3.9Å; Y897-Y941 AromaticContact CD2-CE2 3.95Å; Y897-Y941 HydrophobicContact CD2-CE2 3.95Å; Y897-Y941 HydrophobicContact CD2-CG 4.19Å; Y897-Y941 AromaticContact CD2-CZ 3.83Å; Y897-Y941 HydrophobicContact CE2-CE2 4.39Å; Y897-Y941 HydrophobicContact CG-CD1 4.35Å; Y897-Y941 HydrophobicContact CG-CG 4.42Å; P938-Y941 HydrophobicContact CB-CD2 3.96Å; P938-Y941 HydrophobicContact CB-CE2 4.3Å; P938-Y941 HydrophobicContact CG-CD2 4.03Å; P938-Y941 HydrophobicContact CG-CE2 4.16Å; P938-Y941 PolarHBondContact O-N 3.08Å; P938-Y941 VanDerWaalsContact O-N 3.13Å; K939-Y941 PolarHBondContact O-N 3.33Å
942	V	92.5	Very high	86.9	Confident	14 Å²	14	59.9 Å²	59.9	9%	0.085	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	157.9	-176.3	-58.9	0	0	0	0	112.5	V891 Q892 L907 F937 K939	V891-V942 HydrophobicContact CB-CB 4Å; V891-V942 HydrophobicContact CB-CG2 4.12Å; V891-V942 HydrophobicContact CG1-CG2 4.39Å; V891-V942 HydrophobicContact CG2-CB 4.06Å; V891-V942 HydrophobicContact CG2-CG1 4.21Å; V891-V942 HydrophobicContact CG2-CG2 4.14Å; Q892-V942 CarbonylContact O-C 3.57Å; Q892-V942 VanDerWaalsContact O-CA 3.24Å; Q892-V942 WeakPolarHBondContact O-CA 3.42Å; L907-V942 HydrophobicContact CD1-CG1 3.83Å; F937-V942 HydrophobicContact CD2-CG1 3.78Å; F937-V942 HydrophobicContact CD2-CG2 4.34Å; F937-V942 HydrophobicContact CE2-CB 4.49Å; F937-V942 HydrophobicContact CE2-CG1 3.73Å; F937-V942 HydrophobicContact CE2-CG2 4.05Å; K939-V942 WeakPolarHBondContact O-CG2 3.29Å; K939-V942 PolarHBondContact O-N 3.01Å; K939-V942 VanDerWaalsContact O-O 3.05Å
943	E	91.7	Very high	86.8	Confident	129 Å²	129	66.2 Å²	66.2	60%	0.603	33%	0.325	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.4	147.7	175.4	-174.5	170.8	-170.5	0	0	110.3	V891 Q892 I894	V891-E943 CarbonylContact C-O 3.57Å; V891-E943 WeakPolarHBondContact CA-O 3.28Å; V891-E943 WeakPolarHBondContact CB-O 3.27Å; Q892-E943 PolarHBondContact N-O 2.86Å; Q892-E943 PolarHBondContact O-N 3.24Å; I894-E943 HydrophobicContact CG2-CB 3.73Å
944	E	90.5	Very high	86.7	Confident	105 Å²	105	63.4 Å²	63.4	49%	0.491	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	131.5	-174.5	-167.8	-176.4	151.6	0	0	112.8	T946	E944-T946 VanDerWaalsContact C-N 3.26Å; E944-T946 PolarHBondContact O-N 3.15Å
945	I	87.6	Confident	86.1	Confident	20 Å²	20	62.1 Å²	62.1	10%	0.103	31%	0.31	C	S	.	.			trans	-81.6	75	178	-49.6	-177.9	0	0	0	109.4	Q890 Q892 I912 S947 A950 R951	Q890-I945 HydrophobicContact CB-CB 4.2Å; Q890-I945 HydrophobicContact CB-CD1 3.99Å; Q890-I945 HydrophobicContact CB-CG1 4.3Å; Q890-I945 PolarHBondContact O-N 3.19Å; Q892-I945 HydrophobicContact CB-CD1 4.1Å; Q892-I945 HydrophobicContact CB-CG1 4.15Å; I912-I945 HydrophobicContact CD1-CD1 3.95Å; I912-I945 HydrophobicContact CG2-CD1 3.87Å; I945-S947 PolarHBondContact O-N 2.61Å; I945-A950 HydrophobicContact CG2-CB 3.73Å; I945-R951 HydrophobicContact CB-CG 4.07Å; I945-R951 HydrophobicContact CG2-CG 3.86Å; I945-R951 VanDerWaalsContact O-CD 3.3Å; I945-R951 WeakPolarHBondContact O-CD 3.46Å; I945-R951 VanDerWaalsContact O-CG 3.31Å; I945-R951 WeakPolarHBondContact O-CG 3.45Å; I945-R951 PolarHBondContact O-NE 3.49Å
946	T	85.7	Confident	85.3	Confident	112 Å²	112	70.4 Å²	70.4	69%	0.687	34%	0.34	S	S	*	.			trans	-53.1	-39.6	-179.5	56.3	0	0	0	0	112.8	E944 R948	E944-T946 VanDerWaalsContact C-N 3.26Å; E944-T946 PolarHBondContact O-N 3.15Å; T946-R948 PolarHBondContact O-N 2.65Å; T946-R948 VanDerWaalsContact O-N 3.1Å
947	S	83.6	Confident	84.3	Confident	59 Å²	59	74 Å²	74	41%	0.413	36%	0.357	S	S	.	.			trans	-65.6	105.6	-178.9	-174.8	0	0	0	0	112.8	I945 S949 A950 R951	I945-S947 PolarHBondContact O-N 2.61Å; S947-S949 PolarHBondContact O-N 3.42Å; S947-A950 WeakPolarHBondContact O-CA 3.42Å; S947-A950 WeakPolarHBondContact O-CB 3.4Å; S947-A950 PolarHBondContact O-N 3.31Å; S947-A950 PolarHBondContact OG-N 2.83Å; S947-R951 PolarHBondContact O-N 3.44Å
948	R	78.4	Confident	83.2	Confident	145 Å²	145	74.4 Å²	74.4	55%	0.547	36%	0.359	S	S	.	.	H	α-helix	trans	-53.3	-37.8	173.2	-174.1	177.4	176.1	-146.7	1.4	112.2	D885 T946 A950 R951 L952	D885-R948 IonicContact OD2-CZ 3.45Å; D885-R948 IonicContact OD2-NE 3.64Å; D885-R948 IonicContact OD2-NH2 2.62Å; D885-R948 PolarHBondContact OD2-NH2 3.47Å; T946-R948 PolarHBondContact O-N 2.65Å; T946-R948 VanDerWaalsContact O-N 3.1Å; R948-A950 VanDerWaalsContact C-N 3.31Å; R948-A950 PolarHBondContact O-N 3.34Å; R948-R951 PolarHBondContact O-N 3.48Å; R948-L952 HydrophobicContact CG-CD1 3.98Å; R948-L952 HydrophobicContact CG-CG 4.36Å; R948-L952 WeakPolarHBondContact O-CB 3.42Å; R948-L952 WeakPolarHBondContact O-CG 3.34Å; R948-L952 PolarHBondContact O-N 3.25Å
949	S	76.3	Confident	82.1	Confident	75 Å²	75	77.4 Å²	77.4	52%	0.524	37%	0.374	S	S	.	.	H	α-helix	trans	-66	-30.2	176.5	-54.4	0	0	0	0	113.3	S947 R953	S947-S949 PolarHBondContact O-N 3.42Å; S949-R953 WeakPolarHBondContact O-CG 3.32Å; S949-R953 PolarHBondContact O-N 3.19Å; S949-R953 PolarHBondContact O-NH1 3.11Å
950	A	79	Confident	81	Confident	16 Å²	16	79.8 Å²	79.8	13%	0.132	38%	0.38	C	S	.	.	H	α-helix	trans	-74	-47.2	170.3	0	0	0	0	0	110.9	I945 S947 R948 L952 R953 N954	I945-A950 HydrophobicContact CG2-CB 3.73Å; S947-A950 WeakPolarHBondContact O-CA 3.42Å; S947-A950 WeakPolarHBondContact O-CB 3.4Å; S947-A950 PolarHBondContact O-N 3.31Å; S947-A950 PolarHBondContact OG-N 2.83Å; R948-A950 VanDerWaalsContact C-N 3.31Å; R948-A950 PolarHBondContact O-N 3.34Å; A950-L952 VanDerWaalsContact C-N 3.3Å; A950-L952 PolarHBondContact O-N 2.82Å; A950-R953 PolarHBondContact O-N 3.41Å; A950-N954 PolarHBondContact O-N 3.42Å; A950-N954 PolarHBondContact O-OD1 3.31Å
951	R	82.5	Confident	79.5	Confident	51 Å²	51	78.8 Å²	78.8	19%	0.192	37%	0.37	C	S	.	.	H	α-helix	trans	-54.3	-43.9	177.3	-68.1	-164.9	-99	152.8	-2.6	113	I888 Q890 I945 S947 R948 N954 L955	I888-R951 WeakPolarHBondContact O-CD 3.44Å; I888-R951 PolarHBondContact O-NH1 3.1Å; Q890-R951 HydrophobicContact CB-CG 4.03Å; Q890-R951 HydrophobicContact CG-CB 4.45Å; Q890-R951 HydrophobicContact CG-CG 4.04Å; Q890-R951 PolarHBondContact NE2-O 3.46Å; I945-R951 HydrophobicContact CB-CG 4.07Å; I945-R951 HydrophobicContact CG2-CG 3.86Å; I945-R951 VanDerWaalsContact O-CD 3.3Å; I945-R951 WeakPolarHBondContact O-CD 3.46Å; I945-R951 VanDerWaalsContact O-CG 3.31Å; I945-R951 WeakPolarHBondContact O-CG 3.45Å; I945-R951 PolarHBondContact O-NE 3.49Å; S947-R951 PolarHBondContact O-N 3.44Å; R948-R951 PolarHBondContact O-N 3.48Å; R951-N954 PolarHBondContact O-N 3.2Å; R951-L955 WeakPolarHBondContact O-CB 3.24Å; R951-L955 PolarHBondContact O-N 3.33Å
952	L	76.1	Confident	78	Confident	48 Å²	48	77.5 Å²	77.5	25%	0.251	37%	0.366	S	S	.	.	H	α-helix	trans	-67.1	-35.2	176.1	-74.2	169.4	0	0	0	113.3	R948 A950 R956	R948-L952 HydrophobicContact CG-CD1 3.98Å; R948-L952 HydrophobicContact CG-CG 4.36Å; R948-L952 WeakPolarHBondContact O-CB 3.42Å; R948-L952 WeakPolarHBondContact O-CG 3.34Å; R948-L952 PolarHBondContact O-N 3.25Å; A950-L952 VanDerWaalsContact C-N 3.3Å; A950-L952 PolarHBondContact O-N 2.82Å; L952-R956 WeakPolarHBondContact O-CB 3.5Å; L952-R956 WeakPolarHBondContact O-CG 3.27Å; L952-R956 PolarHBondContact O-N 2.64Å
953	R	77.6	Confident	76.2	Confident	157 Å²	157	79.9 Å²	79.9	59%	0.592	38%	0.383	S	S	*	.	H	α-helix	trans	-67.6	-45.3	173.3	-76.2	-171.4	-51.3	-100.4	3.9	111.4	S949 A950 L955 R956 E957	S949-R953 WeakPolarHBondContact O-CG 3.32Å; S949-R953 PolarHBondContact O-N 3.19Å; S949-R953 PolarHBondContact O-NH1 3.11Å; A950-R953 PolarHBondContact O-N 3.41Å; R953-L955 VanDerWaalsContact C-N 3.31Å; R953-L955 PolarHBondContact O-N 3.2Å; R953-R956 PolarHBondContact O-N 3.27Å; R953-E957 PolarHBondContact O-N 3.11Å
954	N	81.3	Confident	74.3	Confident	42 Å²	42	77.5 Å²	77.5	23%	0.225	38%	0.377	C	S	.	.	H	α-helix	trans	-57.9	-45.8	177.7	-61.3	-13.4	0	0	0	110.8	Q890 I912 L929 A950 R951 N958	Q890-N954 PolarHBondContact OE1-ND2 3.07Å; I912-N954 HydrophobicContact CG2-CB 4.35Å; L929-N954 HydrophobicContact CD1-CB 4.2Å; A950-N954 PolarHBondContact O-N 3.42Å; A950-N954 PolarHBondContact O-OD1 3.31Å; R951-N954 PolarHBondContact O-N 3.2Å; N954-N958 VanDerWaalsContact O-CB 3.3Å; N954-N958 WeakPolarHBondContact O-CB 3.08Å; N954-N958 PolarHBondContact O-N 3Å
955	L	72.9	Confident	72.4	Confident	25 Å²	25	75.4 Å²	75.4	13%	0.131	37%	0.371	C	S	.	.	H	α-helix	trans	-65.1	-43.3	177.2	-176.8	60.4	0	0	0	112.1	I888 R951 R953 N958 I959	I888-L955 HydrophobicContact CD1-CD2 3.96Å; R951-L955 WeakPolarHBondContact O-CB 3.24Å; R951-L955 PolarHBondContact O-N 3.33Å; R953-L955 VanDerWaalsContact C-N 3.31Å; R953-L955 PolarHBondContact O-N 3.2Å; L955-N958 WeakPolarHBondContact O-CB 3.39Å; L955-N958 PolarHBondContact O-N 3.11Å; L955-I959 HydrophobicContact CD1-CD1 4.13Å; L955-I959 HydrophobicContact CD1-CG1 4.39Å; L955-I959 HydrophobicContact CG-CD1 3.94Å; L955-I959 VanDerWaalsContact O-CG1 3.3Å; L955-I959 WeakPolarHBondContact O-CG1 3.32Å; L955-I959 PolarHBondContact O-N 3.02Å
956	R	73.5	Confident	70.5	Confident	178 Å²	178	79.9 Å²	79.9	67%	0.672	39%	0.392	S	S	*	.	H	α-helix	trans	-62.7	-44	177.5	-76.9	171.6	-177.4	-167.7	0.6	112.7	L952 R953 N958 I959 R960	L952-R956 WeakPolarHBondContact O-CB 3.5Å; L952-R956 WeakPolarHBondContact O-CG 3.27Å; L952-R956 PolarHBondContact O-N 2.64Å; R953-R956 PolarHBondContact O-N 3.27Å; R956-N958 VanDerWaalsContact C-N 3.33Å; R956-I959 PolarHBondContact O-N 2.92Å; R956-R960 WeakPolarHBondContact O-CB 3.26Å; R956-R960 PolarHBondContact O-N 2.76Å
957	E	71.5	Confident	68.6	Low	79 Å²	79	82.2 Å²	82.2	37%	0.369	39%	0.392	S	S	.	.	H	α-helix	trans	-69.7	-34.5	177.1	-171.1	58	-161.7	0	0	111.3	R953 R960 I961	R953-E957 PolarHBondContact O-N 3.11Å; E957-R960 VanDerWaalsContact CD-NE 3.34Å; E957-R960 PolarHBondContact O-N 3.04Å; E957-R960 IonicContact OE1-CZ 2.77Å; E957-R960 IonicContact OE1-NE 3.89Å; E957-R960 PolarHBondContact OE1-NE 3.32Å; E957-R960 VanDerWaalsContact OE1-NE 3.13Å; E957-R960 IonicContact OE1-NH2 2.7Å; E957-R960 PolarHBondContact OE1-NH2 3.26Å; E957-R960 IonicContact OE2-CZ 3.15Å; E957-R960 IonicContact OE2-NE 3.36Å; E957-R960 PolarHBondContact OE2-NE 3.15Å; E957-R960 IonicContact OE2-NH2 2.79Å; E957-I961 HydrophobicContact CG-CD1 4.01Å; E957-I961 WeakPolarHBondContact O-CB 3.22Å; E957-I961 VanDerWaalsContact O-CG1 3.29Å; E957-I961 WeakPolarHBondContact O-CG1 2.97Å; E957-I961 PolarHBondContact O-N 3.33Å
958	N	73.1	Confident	66.7	Low	10 Å²	10	82.4 Å²	82.4	5%	0.053	39%	0.388	C	S	.	.	H	α-helix	trans	-61	-46.4	171.6	-171.6	-117	0	0	0	112.5	L929 N954 L955 R956 R960 I961 K962	L929-N958 PolarHBondContact O-ND2 3.19Å; N954-N958 VanDerWaalsContact O-CB 3.3Å; N954-N958 WeakPolarHBondContact O-CB 3.08Å; N954-N958 PolarHBondContact O-N 3Å; L955-N958 WeakPolarHBondContact O-CB 3.39Å; L955-N958 PolarHBondContact O-N 3.11Å; R956-N958 VanDerWaalsContact C-N 3.33Å; N958-R960 VanDerWaalsContact C-N 3.34Å; N958-I961 PolarHBondContact O-N 3.19Å; N958-K962 WeakPolarHBondContact O-CB 3.27Å; N958-K962 WeakPolarHBondContact O-CG 3.39Å; N958-K962 PolarHBondContact O-N 2.92Å; N958-K962 WeakPolarHBondContact OD1-CE 3.38Å; N958-K962 PolarHBondContact OD1-NZ 3.19Å
959	I	70.3	Confident	64.9	Low	80 Å²	80	82.6 Å²	82.6	41%	0.41	39%	0.393	S	S	.	.	H	α-helix	trans	-62.1	-42.1	174.5	-68.4	165.5	0	0	0	110.3	L955 R956 I961 K962 C963	L955-I959 HydrophobicContact CD1-CD1 4.13Å; L955-I959 HydrophobicContact CD1-CG1 4.39Å; L955-I959 HydrophobicContact CG-CD1 3.94Å; L955-I959 VanDerWaalsContact O-CG1 3.3Å; L955-I959 WeakPolarHBondContact O-CG1 3.32Å; L955-I959 PolarHBondContact O-N 3.02Å; R956-I959 PolarHBondContact O-N 2.92Å; I959-I961 PolarHBondContact O-N 3.4Å; I959-K962 PolarHBondContact O-N 3.22Å; I959-C963 PolarHBondContact O-N 3.27Å; I959-C963 PolarHBondContact O-SG 3.12Å
960	R	71.2	Confident	62.8	Low	152 Å²	152	82.2 Å²	82.2	57%	0.574	40%	0.401	S	S	*	.	H	α-helix	trans	-60.2	-46.6	177.3	-160.7	-179.5	76.8	90.5	4.4	111.8	R956 E957 N958 V964	R956-R960 WeakPolarHBondContact O-CB 3.26Å; R956-R960 PolarHBondContact O-N 2.76Å; E957-R960 VanDerWaalsContact CD-NE 3.34Å; E957-R960 PolarHBondContact O-N 3.04Å; E957-R960 IonicContact OE1-CZ 2.77Å; E957-R960 IonicContact OE1-NE 3.89Å; E957-R960 PolarHBondContact OE1-NE 3.32Å; E957-R960 VanDerWaalsContact OE1-NE 3.13Å; E957-R960 IonicContact OE1-NH2 2.7Å; E957-R960 PolarHBondContact OE1-NH2 3.26Å; E957-R960 IonicContact OE2-CZ 3.15Å; E957-R960 IonicContact OE2-NE 3.36Å; E957-R960 PolarHBondContact OE2-NE 3.15Å; E957-R960 IonicContact OE2-NH2 2.79Å; N958-R960 VanDerWaalsContact C-N 3.34Å; R960-V964 WeakPolarHBondContact O-CG2 3.37Å; R960-V964 PolarHBondContact O-N 3.2Å; R960-V964 VanDerWaalsContact O-N 3.12Å
961	I	61.9	Low	60.7	Low	79 Å²	79	89.6 Å²	89.6	41%	0.405	43%	0.433	S	S	.	.	H	α-helix	trans	-64.5	-40.5	175.8	-68.1	166.5	0	0	0	111	E957 N958 I959 V964 T965	E957-I961 HydrophobicContact CG-CD1 4.01Å; E957-I961 WeakPolarHBondContact O-CB 3.22Å; E957-I961 VanDerWaalsContact O-CG1 3.29Å; E957-I961 WeakPolarHBondContact O-CG1 2.97Å; E957-I961 PolarHBondContact O-N 3.33Å; N958-I961 PolarHBondContact O-N 3.19Å; I959-I961 PolarHBondContact O-N 3.4Å; I961-V964 PolarHBondContact O-N 3.27Å; I961-T965 WeakPolarHBondContact O-CB 3.49Å; I961-T965 WeakPolarHBondContact O-CG2 3.39Å; I961-T965 PolarHBondContact O-N 3.36Å; I961-T965 PolarHBondContact O-OG1 3.11Å
962	K	60.6	Low	58.2	Low	52 Å²	52	96.4 Å²	96.4	23%	0.226	47%	0.473	C	S	.	.	H	α-helix	trans	-62.6	-48.9	175	-80.4	171.4	171.1	167.4	0	112.5	N958 I959 V964 T965 Q966	N958-K962 WeakPolarHBondContact O-CB 3.27Å; N958-K962 WeakPolarHBondContact O-CG 3.39Å; N958-K962 PolarHBondContact O-N 2.92Å; N958-K962 WeakPolarHBondContact OD1-CE 3.38Å; N958-K962 PolarHBondContact OD1-NZ 3.19Å; I959-K962 PolarHBondContact O-N 3.22Å; K962-V964 VanDerWaalsContact C-N 3.31Å; K962-V964 PolarHBondContact O-N 3.38Å; K962-T965 WeakPolarHBondContact CA-OG1 3.06Å; K962-T965 CarbonylContact O-C 3.48Å; K962-T965 PolarHBondContact O-N 3.22Å; K962-T965 VanDerWaalsContact O-N 3.11Å; K962-T965 PolarHBondContact O-OG1 2.75Å; K962-Q966 WeakPolarHBondContact O-CB 3.48Å; K962-Q966 WeakPolarHBondContact O-CG 3.42Å; K962-Q966 PolarHBondContact O-N 2.86Å
963	C	55.9	Low	57.3	Low	64 Å²	64	98.9 Å²	98.9	43%	0.432	48%	0.484	S	S	.	.	H	α-helix	trans	-61.6	-38.5	177.6	-65.1	0	0	0	0	112.3	I959 K967	I959-C963 PolarHBondContact O-N 3.27Å; I959-C963 PolarHBondContact O-SG 3.12Å; C963-K967 WeakPolarHBondContact O-CG 3.44Å; C963-K967 PolarHBondContact O-N 3.5Å; C963-K967 VanDerWaalsContact O-N 3.08Å
964	V	51.1	Low	56.3	Low	79 Å²	79	95.8 Å²	95.8	48%	0.479	48%	0.478	S	S	.	.	H	α-helix	trans	-65.9	-39.7	174	170.9	0	0	0	0	111.5	R960 I961 K962 L968	R960-V964 WeakPolarHBondContact O-CG2 3.37Å; R960-V964 PolarHBondContact O-N 3.2Å; R960-V964 VanDerWaalsContact O-N 3.12Å; I961-V964 PolarHBondContact O-N 3.27Å; K962-V964 VanDerWaalsContact C-N 3.31Å; K962-V964 PolarHBondContact O-N 3.38Å; V964-L968 WeakPolarHBondContact O-CG 3.49Å; V964-L968 PolarHBondContact O-N 3.35Å
965	T	51.3	Low	54.9	Low	61 Å²	61	98.8 Å²	98.8	37%	0.374	49%	0.492	S	S	.	.	H	α-helix	trans	-82.9	-17.7	-180	51	0	0	0	0	114.8	I961 K962	I961-T965 WeakPolarHBondContact O-CB 3.49Å; I961-T965 WeakPolarHBondContact O-CG2 3.39Å; I961-T965 PolarHBondContact O-N 3.36Å; I961-T965 PolarHBondContact O-OG1 3.11Å; K962-T965 WeakPolarHBondContact CA-OG1 3.06Å; K962-T965 CarbonylContact O-C 3.48Å; K962-T965 PolarHBondContact O-N 3.22Å; K962-T965 VanDerWaalsContact O-N 3.11Å; K962-T965 PolarHBondContact O-OG1 2.75Å
966	Q	47.5	Very low	53.8	Low	114 Å²	114	103.1 Å²	103.1	53%	0.533	51%	0.514	S	S	.	.	H	α-helix	trans	-80.4	-37.4	169	-80.8	176	-33.9	0	0	112	K962 L968 K969 G970	K962-Q966 WeakPolarHBondContact O-CB 3.48Å; K962-Q966 WeakPolarHBondContact O-CG 3.42Å; K962-Q966 PolarHBondContact O-N 2.86Å; Q966-L968 VanDerWaalsContact C-N 3.27Å; Q966-L968 PolarHBondContact O-N 3.38Å; Q966-K969 CarbonylContact O-C 3.52Å; Q966-K969 WeakPolarHBondContact O-CA 3.28Å; Q966-K969 WeakPolarHBondContact O-CB 3.49Å; Q966-K969 PolarHBondContact O-N 3.13Å; Q966-G970 PolarHBondContact O-N 3.08Å
967	K	44.8	Very low	52.6	Low	160 Å²	160	98.4 Å²	98.4	70%	0.696	50%	0.504	S	S	*	.	H	α-helix	trans	-57.1	-44.1	169.8	-76.7	-173.6	174.2	-164.8	0	111	C963 K969 G970	C963-K967 WeakPolarHBondContact O-CG 3.44Å; C963-K967 PolarHBondContact O-N 3.5Å; C963-K967 VanDerWaalsContact O-N 3.08Å; K967-K969 PolarHBondContact O-N 2.98Å; K967-G970 PolarHBondContact O-N 3.3Å; K967-G970 VanDerWaalsContact O-N 3.14Å
968	L	43	Very low	51.3	Low	64 Å²	64	99.7 Å²	99.7	34%	0.335	51%	0.513	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70	18.9	171.4	-62.7	171.2	0	0	0	115.3	V964 Q966	V964-L968 WeakPolarHBondContact O-CG 3.49Å; V964-L968 PolarHBondContact O-N 3.35Å; Q966-L968 VanDerWaalsContact C-N 3.27Å; Q966-L968 PolarHBondContact O-N 3.38Å
969	K	40.7	Very low	49.8	Very low	149 Å²	149	106.1 Å²	106.1	65%	0.648	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	-138.4	-8.4	172.1	-76.3	-178.2	176.6	-179.2	0	113.2	Q966 K967	Q966-K969 CarbonylContact O-C 3.52Å; Q966-K969 WeakPolarHBondContact O-CA 3.28Å; Q966-K969 WeakPolarHBondContact O-CB 3.49Å; Q966-K969 PolarHBondContact O-N 3.13Å; K967-K969 PolarHBondContact O-N 2.98Å
970	G	32.8	Very low	48.2	Very low	67 Å²	67	108.2 Å²	108.2	69%	0.691	56%	0.556	S	S	*	*	S	Bend	trans	-97.6	11.4	-178.8	0	0	0	0	0	113.7	Q966 K967	Q966-G970 PolarHBondContact O-N 3.08Å; K967-G970 PolarHBondContact O-N 3.3Å; K967-G970 VanDerWaalsContact O-N 3.14Å
971	E	35.1	Very low	46.3	Very low	170 Å²	170	104.5 Å²	104.5	79%	0.794	56%	0.555	S	S	*	*			trans	-123.5	6.8	-177.6	-62.4	179	162.1	0	0	112.1
972	D	31	Very low	44.9	Very low	195 Å²	195	106.8 Å²	106.8	100%	1.043	57%	0.568	S	S	*	*			trans	-90.6	0	168.7	-86.6	-38	0	0	0	110.2

Retrieved 972 of 972 residues in 280.6 ms (Link to these results)

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