A0A3Q0KPS7_SCHMA Loading...

Putative f-box/leucine rich repeat protein AlphaSync

AlphaFold DB , UniProt , Accession A0A3Q0KPS7, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,008 aa.

						>A0A3Q0KPS7_SCHMA|A0A3Q0KPS7
MDGNLSILYPDCNILPFDSVNGNLMNYSRLYSNSCGLTSSAYLDEFQNMKEDSQDFTQKHMSGRKTFMCPKCNSFYSEGSNWCSSCGELLIGADVCSPGEPKFIANEVSKTQTNMMDSSKPLSNLSSSVPVGFNMSCENATRSPNLVAYPRHPILPVATDAAFSLPSCIASKFSQGNLNAQHSEWSNLSFSPSKQFDQLRHNKANIPFCVPVDPSFSRYKNFGILQNVSTDQKQHQVVKNNEYTDPCNFKLLYPKENGFTQSILWNSKHFNDNKSCSQFSHPFNNVSDYRHRRTSGPGMQNKLTSDHSSLENVYHANSVPSSYLTINTSPINSLIDTSQGQYTFSDNWWDNPSASQIVADLLRETQLSVSANTSIPPKSALYQPWQYQEMIPSASKSPSASRKSVRIRGGYCRRKHPSECSRTQLNNLTTFQNPAICRARSFSSDFEDNNNSGVDSSKLQPNFNWQSSRTAWSAHDPAVLKKKPAAYLRASYSQGNVAFVQLESNSNMKPNNSNNQLDKSQQSPLPCSNSKSCNQKVKSNDTTGSSPDNRSEWNNTHAKSNRCHHPPRRNRRYISKSLSVCMDGTTTNNPVTGILKEGISINLHTNKINEPKNEFITSNWLLLPDELWLEVLRYLSPVDRVRVAQTCRHLSRLSMDRSLWRVIHLHRQHHLTDADLVRIGNLKPKELRFTYCRGDSLTATGLKRMFLVCGPGLQKLSLIGCTKGPFDQDLPLRIVADYCRNLQHVNASYTQSVRDQTVIALARSATHLISVKLNGAQQISNAAIQQLVHYHQNTLERLELFGCFRLNSSILALLGQCQELRALAFGHLHHLSSDGLLELVSKLPHLSSLDLRGTQTFSDDNNLSQLAAKCPHLEEVVLANMHSLKRETGIAQMLRRLPRLRVLDLCGLAAVGDLTMEVLATSCPQLEELDVSCTSVTQKGLFHLTNAPAVCLKCLRISHCREITSDVLEKLIEACPKLTLLYAYGFVSINDWGFLQKIRPTLLVEKGI
					

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	33.5	Very low	32.5	Very low	226 Å²	226	144.5 Å²	144.5	100%	1.113	79%	0.787	S	S	*	*				0	124.1	0	-79.8	166.3	169.8	0	0	105.9
2	D	32.2	Very low	32.5	Very low	162 Å²	162	142.5 Å²	142.5	87%	0.866	79%	0.79	S	S	*	*			trans	56.8	147.8	151.1	-37.1	-37.4	0	0	0	119.2
3	G	28.5	Very low	32.3	Very low	64 Å²	64	141.2 Å²	141.2	66%	0.66	78%	0.781	S	S	*	*			cis	144	107.3	-4.7	0	0	0	0	0	111.6
4	N	31.5	Very low	32.2	Very low	163 Å²	163	143 Å²	143	87%	0.872	79%	0.786	S	S	*	*			trans	58.8	127	172	-59.5	-19.6	0	0	0	118.2
5	L	35.3	Very low	32.1	Very low	164 Å²	164	143.4 Å²	143.4	86%	0.859	79%	0.786	S	S	*	*				-165.6	127.9	124.8	-109.5	163.9	0	0	0	111.3
6	S	29.8	Very low	32.5	Very low	106 Å²	106	140 Å²	140	74%	0.741	77%	0.773	S	S	*	*			trans	-148.3	119.9	176.9	55.6	0	0	0	0	108.8
7	I	33.4	Very low	32.4	Very low	142 Å²	142	143.1 Å²	143.1	73%	0.728	78%	0.777	S	S	*	*			trans	-159.7	114.7	176.6	-108.2	140.5	0	0	0	113.4
8	L	30.8	Very low	32.3	Very low	131 Å²	131	141.4 Å²	141.4	69%	0.686	77%	0.767	S	S	*	*			trans	66.2	110.4	135.5	-43.7	179.3	0	0	0	124.3
9	Y	31.7	Very low	32.3	Very low	203 Å²	203	139.1 Å²	139.1	80%	0.796	76%	0.763	S	S	*	*				66.2	171.2	115.4	-72.2	-57.5	0	0	0	122.4
10	P	36.6	Very low	32.3	Very low	106 Å²	106	138 Å²	138	69%	0.688	76%	0.76	S	S	*	*			cis	-135.7	162.9	14	28.2	-2.8	0	0	0	122.1
11	D	34.2	Very low	32.2	Very low	122 Å²	122	139 Å²	139	65%	0.652	77%	0.765	S	S	*	*			trans	57.7	119.1	139.4	-56.1	-17.2	0	0	0	126.3
12	C	32.7	Very low	32	Very low	121 Å²	121	131.8 Å²	131.8	82%	0.818	75%	0.747	S	S	*	*				169	93.1	102.4	-99.6	0	0	0	0	111
13	N	29.8	Very low	31.8	Very low	125 Å²	125	131.3 Å²	131.3	67%	0.668	75%	0.745	S	S	*	*				72.5	113.4	82.5	-78.9	-30.5	0	0	0	117.3
14	I	31.6	Very low	31.7	Very low	167 Å²	167	135.1 Å²	135.1	86%	0.856	75%	0.749	S	S	*	*				170.6	132.1	129.9	-86.3	152.9	0	0	0	108.6
15	L	30.3	Very low	31.4	Very low	149 Å²	149	134.3 Å²	134.3	78%	0.78	74%	0.742	S	S	*	*			cis	-148	158.9	-34.7	-99.8	-177.7	0	0	0	106.6
16	P	37.8	Very low	31	Very low	89 Å²	89	132.5 Å²	132.5	58%	0.578	73%	0.734	S	S	*	*			trans	-110.2	-179.1	-163.6	42.9	-36.5	0	0	0	115.1
17	F	30.9	Very low	30.8	Very low	192 Å²	192	137.5 Å²	137.5	84%	0.842	74%	0.737	S	S	*	*				-171.7	99.9	128.5	-96.1	-70.7	0	0	0	106.2
18	D	31.3	Very low	30.5	Very low	114 Å²	114	135 Å²	135	61%	0.61	73%	0.733	S	S	*	*				78	112.2	96	-81.3	-61.5	0	0	0	113.6
19	S	31.7	Very low	30.3	Very low	97 Å²	97	139.4 Å²	139.4	68%	0.678	74%	0.74	S	S	*	*				81.6	141.8	69.5	83.3	0	0	0	0	111.6
20	V	32.9	Very low	30.1	Very low	117 Å²	117	134 Å²	134	71%	0.709	72%	0.724	S	S	*	*			cis	-146.6	154	41.7	168.7	0	0	0	0	113.5
21	N	30.3	Very low	29.8	Very low	160 Å²	160	138.5 Å²	138.5	86%	0.856	73%	0.729	S	S	*	*			trans	-8.6	148.1	162.6	-49.9	-31.7	0	0	0	121.8
22	G	28.1	Very low	29.7	Very low	73 Å²	73	135.9 Å²	135.9	75%	0.753	72%	0.721	S	S	*	*			trans	172	88.1	152.9	0	0	0	0	0	119
23	N	28.3	Very low	29.5	Very low	153 Å²	153	135.2 Å²	135.2	82%	0.818	71%	0.709	S	S	*	*			trans	42.5	125.3	149.6	-69.4	-16.8	0	0	0	123.7
24	L	26.2	Very low	29.5	Very low	143 Å²	143	134.7 Å²	134.7	75%	0.749	72%	0.715	S	S	*	*			trans	54.6	132.2	130.3	-75.4	154.4	0	0	0	123
25	M	26.5	Very low	29.3	Very low	146 Å²	146	133.2 Å²	133.2	72%	0.719	72%	0.718	S	S	*	*			trans	74.3	103.7	150.6	-65.2	-66.1	-174.6	0	0	121
26	N	25.5	Very low	29.2	Very low	127 Å²	127	129.8 Å²	129.8	68%	0.679	72%	0.718	S	S	*	*			trans	75.4	149.1	133.3	-62.7	-19.9	0	0	0	122.6
27	Y	26.5	Very low	28.6	Very low	210 Å²	210	133.9 Å²	133.9	82%	0.824	74%	0.735	S	S	*	*			trans	61.3	79.6	161.6	-64.4	-62.9	0	0	0	121.6
28	S	26.5	Very low	28.5	Very low	90 Å²	90	131.2 Å²	131.2	63%	0.629	74%	0.735	S	S	*	*				39.9	132.6	116.4	65.6	0	0	0	0	123.1
29	R	27.3	Very low	28.2	Very low	223 Å²	223	131.3 Å²	131.3	84%	0.842	74%	0.744	S	S	*	*			trans	71.3	137.6	142.3	-78.3	-172.6	179	-169.8	2	117.3
30	L	27.7	Very low	28.1	Very low	89 Å²	89	131.5 Å²	131.5	47%	0.466	75%	0.745	S	S	.	*			cis	-159.3	151.6	6.4	-84.7	134.9	0	0	0	109.5
31	Y	29.5	Very low	27.9	Very low	201 Å²	201	129.8 Å²	129.8	79%	0.788	74%	0.743	S	S	*	*			trans	59.3	155.7	142.8	-80.2	-126	0	0	0	119.9
32	S	31.3	Very low	27.8	Very low	68 Å²	68	132.2 Å²	132.2	48%	0.476	74%	0.742	S	S	.	*			cis	-175.1	144.7	-20.6	50	0	0	0	0	111.3
33	N	30.5	Very low	27.7	Very low	106 Å²	106	135.3 Å²	135.3	57%	0.567	74%	0.741	S	S	*	*			trans	62.8	160.2	160.7	-60.3	-29.6	0	0	0	116.8	Q54	N33-Q54 PolarHBondContact ND2-NE2 2.71Å; N33-Q54 PolarHBondContact ND2-OE1 3.14Å
34	S	29.9	Very low	27.7	Very low	114 Å²	114	134.8 Å²	134.8	80%	0.797	74%	0.738	S	S	*	*			cis	-139.8	172.4	3.2	58.4	0	0	0	0	113
35	C	26.7	Very low	28.1	Very low	137 Å²	137	136.7 Å²	136.7	93%	0.926	74%	0.743	S	S	*	*			trans	-44.5	138.1	-178.3	-57.4	0	0	0	0	117.2
36	G	27.5	Very low	28.1	Very low	76 Å²	76	139.3 Å²	139.3	78%	0.784	75%	0.751	S	S	*	*			trans	-166.5	102.6	164.6	0	0	0	0	0	111.6	T38	G36-T38 PolarHBondContact O-N 3.14Å
37	L	25.9	Very low	28.4	Very low	175 Å²	175	141.2 Å²	141.2	92%	0.916	76%	0.755	S	S	*	*			trans	-78.9	114.2	175.5	-76.6	161.6	0	0	0	110.1
38	T	27.5	Very low	28.6	Very low	137 Å²	137	136.8 Å²	136.8	84%	0.84	75%	0.746	S	S	*	*				178	144.8	115.8	34.4	0	0	0	0	112.1	G36 S40	G36-T38 PolarHBondContact O-N 3.14Å; T38-S40 PolarHBondContact O-N 3.37Å
39	S	27	Very low	28.7	Very low	115 Å²	115	139.3 Å²	139.3	80%	0.804	75%	0.749	S	S	*	*			trans	-40.1	128	163	159	0	0	0	0	112.5
40	S	27.8	Very low	28.6	Very low	101 Å²	101	134.8 Å²	134.8	71%	0.706	74%	0.736	S	S	*	*				-172.5	174.6	64.8	54.5	0	0	0	0	113.5	T38	T38-S40 PolarHBondContact O-N 3.37Å
41	A	28.4	Very low	28.7	Very low	81 Å²	81	139.4 Å²	139.4	67%	0.669	76%	0.755	S	S	*	*			trans	62.1	113.8	147.6	0	0	0	0	0	121.6
42	Y	29	Very low	28.6	Very low	211 Å²	211	137 Å²	137	83%	0.827	76%	0.756	S	S	*	*			trans	65.6	126.2	143.2	-76.6	-100.2	0	0	0	121.6
43	L	26.9	Very low	28.4	Very low	139 Å²	139	137.9 Å²	137.9	73%	0.728	76%	0.762	S	S	*	*			trans	9.8	132.2	136.4	-66.2	145.7	0	0	0	116.8
44	D	28.4	Very low	28.5	Very low	141 Å²	141	140.4 Å²	140.4	75%	0.754	77%	0.771	S	S	*	*				-159.4	167.7	61.6	-112.5	-35.2	0	0	0	117
45	E	33.3	Very low	28.3	Very low	183 Å²	183	142 Å²	142	86%	0.855	77%	0.77	S	S	*	*			trans	63.1	160.3	158.3	-66.5	-165.1	132.8	0	0	123.3
46	F	27.6	Very low	28.3	Very low	202 Å²	202	144.5 Å²	144.5	89%	0.886	77%	0.766	S	S	*	*			trans	-107.9	152.7	-172.8	-82	-127.5	0	0	0	111.8
47	Q	31.9	Very low	28.5	Very low	167 Å²	167	147.4 Å²	147.4	78%	0.78	77%	0.768	S	S	*	*				170.1	129.6	105.3	-88.6	-174.8	38.6	0	0	115.4
48	N	29.8	Very low	28.5	Very low	117 Å²	117	148.1 Å²	148.1	63%	0.626	77%	0.767	S	S	*	*			trans	56.6	115.5	144.4	-65.1	-39.6	0	0	0	123.5
49	M	28	Very low	28.5	Very low	142 Å²	142	150.9 Å²	150.9	70%	0.7	77%	0.767	S	S	*	*				48.8	146.4	122.7	-62.3	-158.4	-75.4	0	0	121.7
50	K	26.8	Very low	28.5	Very low	128 Å²	128	154.3 Å²	154.3	56%	0.557	77%	0.77	S	S	*	*			cis	-175.5	135.8	-13.2	-110.9	176.9	-170.9	154.7	0	106.7
51	E	28.3	Very low	28.6	Very low	186 Å²	186	159 Å²	159	87%	0.869	78%	0.783	S	S	*	*			trans	168.7	164.2	130.8	-96.1	172.8	174.9	0	0	112.3
52	D	27.7	Very low	28.8	Very low	150 Å²	150	160.7 Å²	160.7	80%	0.802	79%	0.791	S	S	*	*			trans	67.1	154.9	168.7	-77.4	-11.6	0	0	0	123.4
53	S	28.3	Very low	29	Very low	88 Å²	88	154.8 Å²	154.8	62%	0.615	79%	0.794	S	S	*	*			trans	71.7	109	-177	77.4	0	0	0	0	117.8
54	Q	31.3	Very low	29.6	Very low	159 Å²	159	158.1 Å²	158.1	74%	0.743	80%	0.797	S	S	*	*				-168.1	128.4	91.9	-100.8	179.2	-12.9	0	0	112.3	N33	N33-Q54 PolarHBondContact ND2-NE2 2.71Å; N33-Q54 PolarHBondContact ND2-OE1 3.14Å
55	D	26.5	Very low	30.7	Very low	147 Å²	147	157.5 Å²	157.5	79%	0.786	79%	0.787	S	S	*	*			trans	-87.7	115.2	172.1	175.2	19.3	0	0	0	110.1
56	F	27.3	Very low	32.4	Very low	189 Å²	189	153.5 Å²	153.5	83%	0.829	78%	0.776	S	S	*	*			trans	-162.6	149.1	158.5	-122.7	-85.2	0	0	0	110.6
57	T	30.3	Very low	34.7	Very low	137 Å²	137	146.4 Å²	146.4	84%	0.84	75%	0.745	S	S	*	*			trans	75.7	45.1	172	70.1	0	0	0	0	119.5
58	Q	26.6	Very low	36.9	Very low	190 Å²	190	143.3 Å²	143.3	89%	0.888	73%	0.731	S	S	*	*			trans	-102.7	83.8	163	-161.2	177.2	77	0	0	113.3
59	K	28.2	Very low	39	Very low	195 Å²	195	137.8 Å²	137.8	85%	0.848	70%	0.702	S	S	*	*	S	Bend	trans	-141.4	107.1	163.4	-77.3	-167	176.3	178.3	0	112.5
60	H	27.1	Very low	41	Very low	188 Å²	188	133.8 Å²	133.8	87%	0.87	69%	0.686	S	S	*	*			trans	43	91.2	162.9	-65.7	-89.2	0	0	0	119.1
61	M	28.4	Very low	42.5	Very low	199 Å²	199	130.6 Å²	130.6	98%	0.98	67%	0.673	S	S	*	*			trans	-139.7	128	139.2	-74.3	-156	-176.9	0	0	110.8
62	S	32.3	Very low	44.8	Very low	117 Å²	117	124.3 Å²	124.3	82%	0.818	65%	0.648	S	S	*	*			trans	-76.5	144.9	176	-53	0	0	0	0	111.3	R64	S62-R64 PolarHBondContact O-N 3Å
63	G	33.8	Very low	47	Very low	87 Å²	87	122.4 Å²	122.4	90%	0.897	64%	0.638	S	S	*	*			trans	-58.2	108.4	-172	0	0	0	0	0	114.7
64	R	40.4	Very low	49.1	Very low	208 Å²	208	119.3 Å²	119.3	79%	0.785	62%	0.617	S	S	*	*			trans	-130	129.6	163.4	-72.3	-176.7	173.2	-177.6	-1.7	108.3	S62	S62-R64 PolarHBondContact O-N 3Å
65	K	50.8	Low	51.3	Low	128 Å²	128	118.2 Å²	118.2	56%	0.557	61%	0.609	S	S	*	*			trans	-68.5	139.8	173	-57.8	-179.8	-147.7	152.7	0	109.8	F67 E78	K65-F67 HydrophobicContact CB-CD2 4.36Å; K65-F67 HydrophobicContact CB-CE2 3.63Å; K65-F67 HydrophobicContact CB-CZ 4.23Å; K65-F67 HydrophobicContact CD-CZ 4.39Å; K65-E78 HydrophobicContact CB-CB 4.49Å; K65-E78 WeakPolarHBondContact CB-OE2 3.4Å; K65-E78 WeakPolarHBondContact CD-OE1 3.3Å; K65-E78 VanDerWaalsContact CD-OE2 3.3Å; K65-E78 WeakPolarHBondContact CD-OE2 3.43Å; K65-E78 WeakPolarHBondContact CE-OE1 3.4Å; K65-E78 WeakPolarHBondContact CE-OE2 3.43Å; K65-E78 VanDerWaalsContact CG-OE2 3.32Å; K65-E78 WeakPolarHBondContact CG-OE2 3.43Å; K65-E78 IonicContact NZ-OE1 2.67Å; K65-E78 PolarHBondContact NZ-OE1 3.46Å; K65-E78 IonicContact NZ-OE2 3.64Å; K65-E78 PolarHBondContact O-N 3.11Å
66	T	68.3	Low	53.5	Low	100 Å²	100	112.3 Å²	112.3	61%	0.613	58%	0.577	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-114.2	141.5	173.2	52.1	0	0	0	0	109.6	Y76	T66-Y76 WeakPolarHBondContact CA-O 3.33Å
67	F	77	Confident	55.4	Low	53 Å²	53	105.9 Å²	105.9	23%	0.232	56%	0.555	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-129.3	154	-173.6	-64.4	-107.9	0	0	0	109.1	K65 F75 Y76 E78 D94	K65-F67 HydrophobicContact CB-CD2 4.36Å; K65-F67 HydrophobicContact CB-CE2 3.63Å; K65-F67 HydrophobicContact CB-CZ 4.23Å; K65-F67 HydrophobicContact CD-CZ 4.39Å; F67-F75 CarbonylContact O-C 3.54Å; F67-F75 VanDerWaalsContact O-CA 3.25Å; F67-F75 WeakPolarHBondContact O-CA 3.5Å; F67-Y76 HydrophobicContact CB-CD1 4.04Å; F67-Y76 HydrophobicContact CB-CD2 3.84Å; F67-Y76 HydrophobicContact CB-CE1 3.59Å; F67-Y76 HydrophobicContact CB-CE2 3.39Å; F67-Y76 HydrophobicContact CB-CG 4.17Å; F67-Y76 HydrophobicContact CD2-CE2 4.23Å; F67-Y76 HydrophobicContact CG-CD2 4.49Å; F67-Y76 AromaticContact CG-CE2 3.87Å; F67-Y76 HydrophobicContact CG-CE2 3.87Å; F67-Y76 PolarHBondContact N-O 3.36Å; F67-Y76 VanDerWaalsContact O-CD1 3.26Å; F67-Y76 WeakPolarHBondContact O-CD1 3.3Å; F67-Y76 PolarHBondContact O-N 2.79Å; F67-E78 HydrophobicContact CE2-CB 3.73Å; F67-E78 HydrophobicContact CE2-CG 3.77Å; F67-E78 HydrophobicContact CZ-CG 4.1Å; F67-D94 WeakPolarHBondContact CE1-OD1 3.14Å
68	M	78.5	Confident	56.7	Low	102 Å²	102	103.8 Å²	103.8	50%	0.502	54%	0.536	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	130.2	179.7	-70.5	-177.4	71.6	0	0	112.3	P70 N73 F75 Y76	M68-P70 WeakPolarHBondContact O-CD 3.26Å; M68-N73 HydrophobicContact CE-CB 3.77Å; M68-N73 WeakPolarHBondContact CE-O 3.46Å; M68-F75 HydrophobicContact CE-CZ 4.47Å; M68-F75 HydrophobicContact CG-CD1 3.74Å; M68-F75 HydrophobicContact CG-CE1 3.41Å; M68-F75 VanDerWaalsContact CG-CE1 3.41Å; M68-F75 HydrophobicContact CG-CZ 4.01Å; M68-F75 HydrophobicContact SD-CE1 3.91Å; M68-F75 HydrophobicContact SD-CZ 4.04Å; M68-Y76 VanDerWaalsContact C-CE1 3.48Å; M68-Y76 WeakPolarHBondContact O-CE1 3.45Å
69	C	73.4	Confident	58.1	Low	0 Å²	0	98 Å²	98	0%	0	53%	0.527	C	S	.	.			trans	-69.5	117.4	178.9	170.2	0	0	0	0	112	K71 C72 N73 S74 Y76 C83	C69-K71 PolarHBondContact O-N 3.29Å; C69-C72 PolarHBondContact O-N 3.49Å; C69-C72 VanDerWaalsContact SG-SG 3.64Å; C69-N73 WeakPolarHBondContact O-CA 3.34Å; C69-N73 PolarHBondContact O-N 3.06Å; C69-S74 WeakPolarHBondContact CB-O 3.48Å; C69-S74 PolarHBondContact N-O 3.01Å; C69-Y76 HydrophobicContact CB-CD1 4.11Å; C69-Y76 HydrophobicContact CB-CE1 4.41Å; C69-C83 HydrophobicContact CB-CB 3.85Å; C69-C83 WeakPolarHBondContact CB-SG 3.33Å; C69-C83 WeakPolarHBondContact SG-CB 3.45Å; C69-C83 CovalentContact SG-SG 2.03Å; C69-C83 PolarHBondContact SG-SG 3Å
70	P	69.4	Low	59.5	Low	58 Å²	58	90 Å²	90	38%	0.377	50%	0.495	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.6	22.9	-167.6	32.7	-38.9	0	0	0	115.1	M68	M68-P70 WeakPolarHBondContact O-CD 3.26Å
71	K	59.4	Low	61.4	Low	62 Å²	62	83.1 Å²	83.1	27%	0.27	47%	0.465	S	S	.	.	T	Hydrogen-bonded Turn	trans	-135.6	-23.2	-179.4	179.4	174.8	176.6	-169.3	0	113.4	C69 E88	C69-K71 PolarHBondContact O-N 3.29Å; K71-E88 HydrophobicContact CB-CB 4.38Å; K71-E88 HydrophobicContact CB-CG 4.27Å; K71-E88 HydrophobicContact CD-CB 4Å; K71-E88 HydrophobicContact CD-CG 3.95Å; K71-E88 WeakPolarHBondContact CD-OE2 3.39Å; K71-E88 WeakPolarHBondContact CE-OE2 3.16Å; K71-E88 IonicContact NZ-OE2 3.07Å; K71-E88 PolarHBondContact NZ-OE2 3.46Å
72	C	76	Confident	63.1	Low	53 Å²	53	74.4 Å²	74.4	36%	0.358	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	trans	-146.3	14.1	177.9	73.8	0	0	0	0	114	C69 S74 C83 C86	C69-C72 PolarHBondContact O-N 3.49Å; C69-C72 VanDerWaalsContact SG-SG 3.64Å; C72-S74 PolarHBondContact O-N 2.96Å; C72-S74 PolarHBondContact SG-OG 2.96Å; C72-S74 VanDerWaalsContact SG-OG 3.36Å; C72-C83 VanDerWaalsContact SG-SG 3.68Å; C72-C86 HydrophobicContact CB-CB 3.95Å; C72-C86 PolarHBondContact SG-SG 2.84Å
73	N	74.7	Confident	64.8	Low	110 Å²	110	68.9 Å²	68.9	59%	0.588	38%	0.383	S	S	*	.			trans	55.1	11	175.8	-62.8	-1.4	0	0	0	116.4	M68 C69	M68-N73 HydrophobicContact CE-CB 3.77Å; M68-N73 WeakPolarHBondContact CE-O 3.46Å; C69-N73 WeakPolarHBondContact O-CA 3.34Å; C69-N73 PolarHBondContact O-N 3.06Å
74	S	71.6	Confident	66.1	Low	24 Å²	24	66.7 Å²	66.7	17%	0.168	35%	0.353	C	S	.	.			trans	-73.3	137.2	176.7	64.7	0	0	0	0	111.2	C69 C72 S85	C69-S74 WeakPolarHBondContact CB-O 3.48Å; C69-S74 PolarHBondContact N-O 3.01Å; C72-S74 PolarHBondContact O-N 2.96Å; C72-S74 PolarHBondContact SG-OG 2.96Å; C72-S74 VanDerWaalsContact SG-OG 3.36Å; S74-S85 WeakPolarHBondContact CB-OG 3.36Å; S74-S85 WeakPolarHBondContact OG-CB 3.1Å; S74-S85 PolarHBondContact OG-OG 3.02Å
75	F	77.2	Confident	67	Low	135 Å²	135	58.1 Å²	58.1	59%	0.592	33%	0.325	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66	142.1	174.1	-64.5	-81.4	0	0	0	112.1	F67 M68	F67-F75 CarbonylContact O-C 3.54Å; F67-F75 VanDerWaalsContact O-CA 3.25Å; F67-F75 WeakPolarHBondContact O-CA 3.5Å; M68-F75 HydrophobicContact CE-CZ 4.47Å; M68-F75 HydrophobicContact CG-CD1 3.74Å; M68-F75 HydrophobicContact CG-CE1 3.41Å; M68-F75 VanDerWaalsContact CG-CE1 3.41Å; M68-F75 HydrophobicContact CG-CZ 4.01Å; M68-F75 HydrophobicContact SD-CE1 3.91Å; M68-F75 HydrophobicContact SD-CZ 4.04Å
76	Y	72.5	Confident	67.6	Low	24 Å²	24	52.1 Å²	52.1	9%	0.094	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	161.7	172.9	67.5	-95.9	0	0	0	110.4	T66 F67 M68 C69 S80 L90	T66-Y76 WeakPolarHBondContact CA-O 3.33Å; F67-Y76 HydrophobicContact CB-CD1 4.04Å; F67-Y76 HydrophobicContact CB-CD2 3.84Å; F67-Y76 HydrophobicContact CB-CE1 3.59Å; F67-Y76 HydrophobicContact CB-CE2 3.39Å; F67-Y76 HydrophobicContact CB-CG 4.17Å; F67-Y76 HydrophobicContact CD2-CE2 4.23Å; F67-Y76 HydrophobicContact CG-CD2 4.49Å; F67-Y76 AromaticContact CG-CE2 3.87Å; F67-Y76 HydrophobicContact CG-CE2 3.87Å; F67-Y76 PolarHBondContact N-O 3.36Å; F67-Y76 VanDerWaalsContact O-CD1 3.26Å; F67-Y76 WeakPolarHBondContact O-CD1 3.3Å; F67-Y76 PolarHBondContact O-N 2.79Å; M68-Y76 VanDerWaalsContact C-CE1 3.48Å; M68-Y76 WeakPolarHBondContact O-CE1 3.45Å; C69-Y76 HydrophobicContact CB-CD1 4.11Å; C69-Y76 HydrophobicContact CB-CE1 4.41Å; Y76-S80 VanDerWaalsContact CD2-OG 3.27Å; Y76-S80 WeakPolarHBondContact CD2-OG 3.49Å; Y76-L90 HydrophobicContact CD1-CD1 3.65Å; Y76-L90 HydrophobicContact CD1-CD2 4.35Å; Y76-L90 HydrophobicContact CD2-CD1 3.62Å; Y76-L90 HydrophobicContact CE1-CD1 3.68Å; Y76-L90 HydrophobicContact CE1-CD2 3.71Å; Y76-L90 HydrophobicContact CE1-CG 4.31Å; Y76-L90 HydrophobicContact CE2-CD1 3.65Å; Y76-L90 HydrophobicContact CG-CD1 3.61Å
77	S	67.3	Low	67.1	Low	53 Å²	53	48.2 Å²	48.2	37%	0.371	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	149.3	178.7	59.6	0	0	0	0	112.1	G79 S80	S77-G79 PolarHBondContact O-N 2.9Å; S77-S80 PolarHBondContact O-N 2.9Å; S77-S80 VanDerWaalsContact O-N 3.16Å; S77-S80 PolarHBondContact O-OG 2.73Å
78	E	57.2	Low	66.3	Low	94 Å²	94	46.4 Å²	46.4	44%	0.439	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-42.7	133.6	169.4	-154	157.8	-161	0	0	112	K65 F67	K65-E78 HydrophobicContact CB-CB 4.49Å; K65-E78 WeakPolarHBondContact CB-OE2 3.4Å; K65-E78 WeakPolarHBondContact CD-OE1 3.3Å; K65-E78 VanDerWaalsContact CD-OE2 3.3Å; K65-E78 WeakPolarHBondContact CD-OE2 3.43Å; K65-E78 WeakPolarHBondContact CE-OE1 3.4Å; K65-E78 WeakPolarHBondContact CE-OE2 3.43Å; K65-E78 VanDerWaalsContact CG-OE2 3.32Å; K65-E78 WeakPolarHBondContact CG-OE2 3.43Å; K65-E78 IonicContact NZ-OE1 2.67Å; K65-E78 PolarHBondContact NZ-OE1 3.46Å; K65-E78 IonicContact NZ-OE2 3.64Å; K65-E78 PolarHBondContact O-N 3.11Å; F67-E78 HydrophobicContact CE2-CB 3.73Å; F67-E78 HydrophobicContact CE2-CG 3.77Å; F67-E78 HydrophobicContact CZ-CG 4.1Å
79	G	57.3	Low	65.4	Low	68 Å²	68	44.9 Å²	44.9	70%	0.701	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.5	7.2	-178.7	0	0	0	0	0	116.8	S77	S77-G79 PolarHBondContact O-N 2.9Å
80	S	57.1	Low	65	Low	27 Å²	27	45.2 Å²	45.2	19%	0.189	27%	0.266	C	S	.	.			trans	-87.3	111.2	171.6	53.5	0	0	0	0	112	Y76 S77 W82 L90	Y76-S80 VanDerWaalsContact CD2-OG 3.27Å; Y76-S80 WeakPolarHBondContact CD2-OG 3.49Å; S77-S80 PolarHBondContact O-N 2.9Å; S77-S80 VanDerWaalsContact O-N 3.16Å; S77-S80 PolarHBondContact O-OG 2.73Å; S80-W82 PolarHBondContact O-N 3.39Å; S80-W82 VanDerWaalsContact O-N 3.15Å; S80-L90 WeakPolarHBondContact O-CB 3.46Å; S80-L90 WeakPolarHBondContact O-CD1 3.13Å
81	N	65.9	Low	64.3	Low	43 Å²	43	46.8 Å²	46.8	23%	0.23	27%	0.271	C	S	.	.	S	Bend	trans	-68.2	-11.3	-175.7	-72.9	13.2	0	0	0	114.6	L90 I91 Q777	N81-L90 PolarHBondContact O-N 3.26Å; N81-I91 HydrophobicContact CB-CD1 4.02Å; N81-I91 HydrophobicContact CB-CG1 3.73Å; N81-Q777 PolarHBondContact ND2-NE2 3.41Å
82	W	65.3	Low	63.6	Low	17 Å²	17	45.5 Å²	45.5	6%	0.064	28%	0.275	C	S	.	.	B	Isolated β-bridge	trans	-150.2	152.4	174.9	61.9	90.2	0	0	0	113.4	S80 S84 E88 L90 Y749 Q751 G775	S80-W82 PolarHBondContact O-N 3.39Å; S80-W82 VanDerWaalsContact O-N 3.15Å; W82-S84 PolarHBondContact O-N 2.88Å; W82-E88 CarbonylContact C-O 3.32Å; W82-E88 WeakPolarHBondContact CA-O 3.41Å; W82-E88 WeakPolarHBondContact CB-O 3.2Å; W82-L90 VanDerWaalsContact C-CD1 3.4Å; W82-Y749 HydrophobicContact CE3-CD1 4.32Å; W82-Y749 WeakPolarHBondContact CZ2-O 3.23Å; W82-Y749 PolarHBondContact NE1-O 3.25Å; W82-Y749 VanDerWaalsContact NE1-O 3.16Å; W82-Q751 HydrophobicContact CZ2-CG 3.62Å; W82-G775 VanDerWaalsContact CH2-O 3.26Å; W82-G775 WeakPolarHBondContact CH2-O 3.33Å
83	C	67.2	Low	61.9	Low	1 Å²	1	44.3 Å²	44.3	1%	0.007	27%	0.269	C	S	.	.			trans	-77.9	108.5	-177.7	170.3	0	0	0	0	111.4	C69 C72 S85 C86 G87 E88 L90	C69-C83 HydrophobicContact CB-CB 3.85Å; C69-C83 WeakPolarHBondContact CB-SG 3.33Å; C69-C83 WeakPolarHBondContact SG-CB 3.45Å; C69-C83 CovalentContact SG-SG 2.03Å; C69-C83 PolarHBondContact SG-SG 3Å; C72-C83 VanDerWaalsContact SG-SG 3.68Å; C83-S85 PolarHBondContact O-N 2.86Å; C83-C86 PolarHBondContact O-N 2.99Å; C83-C86 PolarHBondContact SG-SG 3.35Å; C83-G87 WeakPolarHBondContact O-CA 3.22Å; C83-G87 PolarHBondContact O-N 2.93Å; C83-E88 HydrophobicContact CB-CB 4Å; C83-E88 PolarHBondContact N-O 2.76Å; C83-L90 HydrophobicContact CB-CD1 3.99Å; C83-L90 HydrophobicContact CB-CD2 4.21Å; C83-L90 HydrophobicContact CB-CG 4.15Å
84	S	62	Low	60	Low	40 Å²	40	44.5 Å²	44.5	28%	0.28	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-15.8	-173.1	57.6	0	0	0	0	116.1	W82 T722	W82-S84 PolarHBondContact O-N 2.88Å; S84-T722 PolarHBondContact O-OG1 3.42Å
85	S	57.8	Low	58	Low	28 Å²	28	47.3 Å²	47.3	20%	0.196	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.9	-20.2	-178	-56.4	0	0	0	0	114.6	S74 C83	S74-S85 WeakPolarHBondContact CB-OG 3.36Å; S74-S85 WeakPolarHBondContact OG-CB 3.1Å; S74-S85 PolarHBondContact OG-OG 3.02Å; C83-S85 PolarHBondContact O-N 2.86Å
86	C	64.6	Low	55.6	Low	3 Å²	3	45.1 Å²	45.1	2%	0.02	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-141.4	8	179.3	75.3	0	0	0	0	115.7	C72 C83 E88	C72-C86 HydrophobicContact CB-CB 3.95Å; C72-C86 PolarHBondContact SG-SG 2.84Å; C83-C86 PolarHBondContact O-N 2.99Å; C83-C86 PolarHBondContact SG-SG 3.35Å; C86-E88 VanDerWaalsContact C-N 3.29Å; C86-E88 PolarHBondContact O-N 3.09Å
87	G	57	Low	53.4	Low	17 Å²	17	49.3 Å²	49.3	18%	0.175	32%	0.319	C	S	.	.			trans	78.4	3.1	173.7	0	0	0	0	0	116	C83	C83-G87 WeakPolarHBondContact O-CA 3.22Å; C83-G87 PolarHBondContact O-N 2.93Å
88	E	59.8	Low	51.6	Low	16 Å²	16	52.6 Å²	52.6	8%	0.075	34%	0.339	C	S	.	.			trans	-68.6	135.4	-172.2	-160.5	67	163.5	0	0	112.8	K71 W82 C83 C86 L90 K483	K71-E88 HydrophobicContact CB-CB 4.38Å; K71-E88 HydrophobicContact CB-CG 4.27Å; K71-E88 HydrophobicContact CD-CB 4Å; K71-E88 HydrophobicContact CD-CG 3.95Å; K71-E88 WeakPolarHBondContact CD-OE2 3.39Å; K71-E88 WeakPolarHBondContact CE-OE2 3.16Å; K71-E88 IonicContact NZ-OE2 3.07Å; K71-E88 PolarHBondContact NZ-OE2 3.46Å; W82-E88 CarbonylContact C-O 3.32Å; W82-E88 WeakPolarHBondContact CA-O 3.41Å; W82-E88 WeakPolarHBondContact CB-O 3.2Å; C83-E88 HydrophobicContact CB-CB 4Å; C83-E88 PolarHBondContact N-O 2.76Å; C86-E88 VanDerWaalsContact C-N 3.29Å; C86-E88 PolarHBondContact O-N 3.09Å; E88-L90 PolarHBondContact O-N 3.29Å; E88-K483 VanDerWaalsContact OE1-CE 3.28Å; E88-K483 WeakPolarHBondContact OE1-CE 3.42Å; E88-K483 IonicContact OE1-NZ 3.25Å; E88-K483 PolarHBondContact OE1-NZ 3.48Å
89	L	59.9	Low	50.2	Low	69 Å²	69	51.7 Å²	51.7	36%	0.361	36%	0.355	S	S	.	.	B	Isolated β-bridge	trans	-66.8	128.5	172.7	-160.8	74.6	0	0	0	110	I91 Y487	L89-I91 HydrophobicContact CD1-CD1 4.02Å; L89-I91 HydrophobicContact CD1-CG1 4.13Å; L89-I91 HydrophobicContact CD2-CB 4.32Å; L89-I91 HydrophobicContact CG-CB 4.21Å; L89-I91 HydrophobicContact CG-CD1 4.41Å; L89-I91 HydrophobicContact CG-CG1 4.16Å; L89-Y487 PolarHBondContact O-OH 2.69Å
90	L	66.1	Low	48.7	Very low	7 Å²	7	57 Å²	57	4%	0.037	36%	0.362	C	S	.	.			trans	-107.2	-8.1	-179.2	-63	174.1	0	0	0	112.6	Y76 S80 N81 W82 C83 E88 G92 A93	Y76-L90 HydrophobicContact CD1-CD1 3.65Å; Y76-L90 HydrophobicContact CD1-CD2 4.35Å; Y76-L90 HydrophobicContact CD2-CD1 3.62Å; Y76-L90 HydrophobicContact CE1-CD1 3.68Å; Y76-L90 HydrophobicContact CE1-CD2 3.71Å; Y76-L90 HydrophobicContact CE1-CG 4.31Å; Y76-L90 HydrophobicContact CE2-CD1 3.65Å; Y76-L90 HydrophobicContact CG-CD1 3.61Å; S80-L90 WeakPolarHBondContact O-CB 3.46Å; S80-L90 WeakPolarHBondContact O-CD1 3.13Å; N81-L90 PolarHBondContact O-N 3.26Å; W82-L90 VanDerWaalsContact C-CD1 3.4Å; C83-L90 HydrophobicContact CB-CD1 3.99Å; C83-L90 HydrophobicContact CB-CD2 4.21Å; C83-L90 HydrophobicContact CB-CG 4.15Å; E88-L90 PolarHBondContact O-N 3.29Å; L90-G92 PolarHBondContact O-N 3.47Å; L90-A93 WeakPolarHBondContact O-CB 3.49Å; L90-A93 PolarHBondContact O-N 3.1Å
91	I	53.4	Low	47.4	Very low	92 Å²	92	60.6 Å²	60.6	47%	0.472	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	122.4	170.3	-52.3	179.6	0	0	0	108.4	N81 L89	N81-I91 HydrophobicContact CB-CD1 4.02Å; N81-I91 HydrophobicContact CB-CG1 3.73Å; L89-I91 HydrophobicContact CD1-CD1 4.02Å; L89-I91 HydrophobicContact CD1-CG1 4.13Å; L89-I91 HydrophobicContact CD2-CB 4.32Å; L89-I91 HydrophobicContact CG-CB 4.21Å; L89-I91 HydrophobicContact CG-CD1 4.41Å; L89-I91 HydrophobicContact CG-CG1 4.16Å
92	G	45.1	Very low	45.6	Very low	34 Å²	34	68.1 Å²	68.1	35%	0.351	42%	0.415	S	S	.	.	T	Hydrogen-bonded Turn	trans	89.2	1.2	-175.8	0	0	0	0	0	115.5	L90 D94 A490	L90-G92 PolarHBondContact O-N 3.47Å; G92-D94 VanDerWaalsContact C-N 3.28Å; G92-D94 PolarHBondContact O-N 3.44Å; G92-A490 WeakPolarHBondContact O-CB 3.36Å
93	A	40.3	Very low	43.7	Very low	28 Å²	28	76.2 Å²	76.2	23%	0.231	45%	0.451	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-24.6	175.2	0	0	0	0	0	113.4	L90 V95	L90-A93 WeakPolarHBondContact O-CB 3.49Å; L90-A93 PolarHBondContact O-N 3.1Å; A93-V95 PolarHBondContact O-N 3.3Å
94	D	35	Very low	41.9	Very low	114 Å²	114	83 Å²	83	61%	0.61	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.9	24.9	-174.7	-60.3	-52.3	0	0	0	114.9	F67 G92	F67-D94 WeakPolarHBondContact CE1-OD1 3.14Å; G92-D94 VanDerWaalsContact C-N 3.28Å; G92-D94 PolarHBondContact O-N 3.44Å
95	V	29.6	Very low	40.2	Very low	84 Å²	84	85.4 Å²	85.4	51%	0.509	51%	0.508	S	S	.	.			trans	-129.4	47.9	178.2	-158.9	0	0	0	0	111.3	A93	A93-V95 PolarHBondContact O-N 3.3Å
96	C	26	Very low	39	Very low	88 Å²	88	90.9 Å²	90.9	60%	0.595	54%	0.535	S	S	*	.			trans	-147.2	49.3	176.9	-91.6	0	0	0	0	113.5
97	S	26.6	Very low	37.2	Very low	113 Å²	113	99.9 Å²	99.9	79%	0.79	58%	0.577	S	S	*	*	S	Bend	trans	-104.8	133.3	154.9	-63.5	0	0	0	0	108.4	G99	S97-G99 PolarHBondContact O-N 3.2Å
98	P	29.8	Very low	36	Very low	122 Å²	122	105.5 Å²	105.5	79%	0.792	61%	0.607	S	S	*	*			trans	-63.4	126.6	170.3	28.2	-32.6	0	0	0	108.3	E100	P98-E100 PolarHBondContact O-N 2.79Å; P98-E100 VanDerWaalsContact O-N 3.12Å
99	G	27.4	Very low	34.7	Very low	75 Å²	75	109.1 Å²	109.1	77%	0.773	63%	0.634	S	S	*	*			trans	-68.5	109.6	176.8	0	0	0	0	0	110	S97	S97-G99 PolarHBondContact O-N 3.2Å
100	E	27.3	Very low	33.3	Very low	179 Å²	179	114.8 Å²	114.8	84%	0.836	66%	0.656	S	S	*	*			trans	-57.8	132.7	164.4	-66.5	-176.9	142.8	0	0	108.6	P98 K102	P98-E100 PolarHBondContact O-N 2.79Å; P98-E100 VanDerWaalsContact O-N 3.12Å; E100-K102 PolarHBondContact O-N 3.4Å; E100-K102 VanDerWaalsContact O-N 3.14Å
101	P	28.9	Very low	31.6	Very low	102 Å²	102	119.9 Å²	119.9	66%	0.662	69%	0.687	S	S	*	*			trans	-64.4	119.6	174.4	27.2	-32.5	0	0	0	108.1	F103	P101-F103 VanDerWaalsContact C-N 3.29Å; P101-F103 HydrophobicContact CG-CD2 4.43Å; P101-F103 HydrophobicContact CG-CE2 4.32Å; P101-F103 PolarHBondContact O-N 2.83Å
102	K	27.8	Very low	30.6	Very low	202 Å²	202	123.1 Å²	123.1	88%	0.878	70%	0.701	S	S	*	*			trans	-65.3	89.8	174.2	-74	-172.8	176.2	-176.2	0	109.7	E100 I104	E100-K102 PolarHBondContact O-N 3.4Å; E100-K102 VanDerWaalsContact O-N 3.14Å; K102-I104 PolarHBondContact O-N 2.9Å
103	F	26.6	Very low	29.8	Very low	186 Å²	186	127 Å²	127	82%	0.816	72%	0.717	S	S	*	*			trans	-61.5	107.1	163.7	-91.5	-89.8	0	0	0	108.4	P101 A105	P101-F103 VanDerWaalsContact C-N 3.29Å; P101-F103 HydrophobicContact CG-CD2 4.43Å; P101-F103 HydrophobicContact CG-CE2 4.32Å; P101-F103 PolarHBondContact O-N 2.83Å; F103-A105 VanDerWaalsContact C-N 3.27Å; F103-A105 PolarHBondContact O-N 3.02Å
104	I	28.1	Very low	29.3	Very low	145 Å²	145	131.8 Å²	131.8	74%	0.744	74%	0.739	S	S	*	*			trans	-74.2	90	167.7	-59.9	176.8	0	0	0	106.4	K102 N106	K102-I104 PolarHBondContact O-N 2.9Å; I104-N106 PolarHBondContact O-N 2.82Å
105	A	27.5	Very low	29.1	Very low	90 Å²	90	133 Å²	133	74%	0.744	74%	0.743	S	S	*	*			trans	-74.6	77.1	174.4	0	0	0	0	0	110.1	F103 E107	F103-A105 VanDerWaalsContact C-N 3.27Å; F103-A105 PolarHBondContact O-N 3.02Å; A105-E107 PolarHBondContact O-N 2.89Å
106	N	31.1	Very low	29	Very low	142 Å²	142	137 Å²	137	76%	0.759	76%	0.758	S	S	*	*			trans	-78.4	107.9	162.7	-86.1	10.8	0	0	0	108.8	I104 V108	I104-N106 PolarHBondContact O-N 2.82Å; N106-V108 PolarHBondContact O-N 2.94Å; N106-V108 VanDerWaalsContact O-N 3.12Å
107	E	27	Very low	29.1	Very low	192 Å²	192	139.3 Å²	139.3	90%	0.897	77%	0.765	S	S	*	*			trans	-69.5	98.6	169	-62.9	-176.3	124.9	0	0	110.8	A105	A105-E107 PolarHBondContact O-N 2.89Å
108	V	32.5	Very low	29.1	Very low	136 Å²	136	138.5 Å²	138.5	82%	0.824	76%	0.759	S	S	*	*			trans	-137.3	134.6	149.3	-177.1	0	0	0	0	109.5	N106	N106-V108 PolarHBondContact O-N 2.94Å; N106-V108 VanDerWaalsContact O-N 3.12Å
109	S	32.1	Very low	29.1	Very low	91 Å²	91	137.2 Å²	137.2	64%	0.636	75%	0.753	S	S	*	*			trans	-63.7	140.3	-168	53.9	0	0	0	0	118.2
110	K	30.1	Very low	29.2	Very low	188 Å²	188	143 Å²	143	82%	0.817	76%	0.757	S	S	*	*			trans	85.6	150	133.3	-74.5	168.8	-176.9	179.8	0	122
111	T	31.7	Very low	29.4	Very low	114 Å²	114	140.3 Å²	140.3	70%	0.699	76%	0.755	S	S	*	*			trans	73.5	89.5	152.4	37.1	0	0	0	0	121
112	Q	31.6	Very low	29.5	Very low	161 Å²	161	143.8 Å²	143.8	75%	0.752	77%	0.767	S	S	*	*				73.7	114.3	113.7	-88.9	175.7	-30.1	0	0	121.5
113	T	28.9	Very low	29.4	Very low	114 Å²	114	138.7 Å²	138.7	70%	0.699	76%	0.757	S	S	*	*				44.7	138.5	122.1	63.4	0	0	0	0	119.4
114	N	30.3	Very low	29.7	Very low	129 Å²	129	136.9 Å²	136.9	69%	0.69	76%	0.756	S	S	*	*			cis	-176.2	178.6	38.4	-140.7	-5.9	0	0	0	113.9
115	M	30.4	Very low	29.7	Very low	141 Å²	141	136.9 Å²	136.9	70%	0.695	76%	0.757	S	S	*	*			trans	64.9	103.5	155.3	-61.3	-58.8	-176.6	0	0	122.1
116	M	28.2	Very low	29.6	Very low	166 Å²	166	137.1 Å²	137.1	82%	0.818	75%	0.753	S	S	*	*				49	109.5	107.7	-83.3	173.9	161.8	0	0	123.1
117	D	27.5	Very low	29.6	Very low	138 Å²	138	136 Å²	136	74%	0.738	76%	0.756	S	S	*	*				105.3	136.1	99.4	-149.8	8.1	0	0	0	122
118	S	26.9	Very low	29.8	Very low	96 Å²	96	132.3 Å²	132.3	67%	0.671	75%	0.751	S	S	*	*			trans	58.9	133.5	154.7	85.7	0	0	0	0	119.2
119	S	29.8	Very low	29.5	Very low	95 Å²	95	132.5 Å²	132.5	66%	0.664	75%	0.752	S	S	*	*			cis	177	165.9	36.7	59.6	0	0	0	0	113.3
120	K	29.6	Very low	29.5	Very low	195 Å²	195	133.2 Å²	133.2	85%	0.848	76%	0.755	S	S	*	*			trans	74.8	140.1	155	-72.6	171.7	-178.6	173.9	0	121.1
121	P	31.1	Very low	29.5	Very low	123 Å²	123	130.3 Å²	130.3	80%	0.799	75%	0.753	S	S	*	*			trans	-101.2	168.2	175.7	40.7	-35.4	0	0	0	113.3
122	L	30.9	Very low	29.1	Very low	176 Å²	176	128 Å²	128	92%	0.921	75%	0.751	S	S	*	*			trans	-138.5	140.1	160	-94.4	171.9	0	0	0	111.2
123	S	26.3	Very low	28.9	Very low	95 Å²	95	129 Å²	129	66%	0.664	75%	0.753	S	S	*	*			trans	-98.2	146.9	175.5	53.7	0	0	0	0	111.5
124	N	31.1	Very low	28.8	Very low	147 Å²	147	130.1 Å²	130.1	79%	0.786	76%	0.755	S	S	*	*			trans	-143.5	120.3	151.7	-86.4	-38.5	0	0	0	107.2
125	L	29.7	Very low	28.5	Very low	146 Å²	146	131.6 Å²	131.6	76%	0.764	76%	0.76	S	S	*	*				54	130.5	94.7	-81.2	99.8	0	0	0	114.2
126	S	24.8	Very low	28.3	Very low	95 Å²	95	129.8 Å²	129.8	66%	0.664	76%	0.761	S	S	*	*			cis	151.6	109.1	-21.6	50.2	0	0	0	0	108.1
127	S	31	Very low	28	Very low	119 Å²	119	127.6 Å²	127.6	83%	0.832	76%	0.761	S	S	*	*			trans	171	154.3	165.8	33.1	0	0	0	0	108.9
128	S	31.1	Very low	27.9	Very low	114 Å²	114	129.1 Å²	129.1	80%	0.797	76%	0.763	S	S	*	*			cis	-157.2	150.9	-23.2	44.2	0	0	0	0	109.8
129	V	25.6	Very low	27.8	Very low	139 Å²	139	131.4 Å²	131.4	84%	0.842	77%	0.768	S	S	*	*			trans	-117.6	-179.7	171.2	-126.7	0	0	0	0	106.4
130	P	33.1	Very low	27.7	Very low	107 Å²	107	131 Å²	131	70%	0.695	77%	0.77	S	S	*	*			cis	-136.5	-153.9	-10.2	30.8	-4.9	0	0	0	113.6
131	V	28.8	Very low	27.5	Very low	127 Å²	127	127.7 Å²	127.7	77%	0.77	77%	0.767	S	S	*	*			trans	78.1	143	165.4	-165.7	0	0	0	0	115.7	F133	V131-F133 HydrophobicContact CG1-CD2 4.08Å; V131-F133 HydrophobicContact CG1-CE2 4.33Å
132	G	25.2	Very low	27.5	Very low	64 Å²	64	133.4 Å²	133.4	66%	0.66	77%	0.772	S	S	*	*			cis	153.3	173.2	-10.9	0	0	0	0	0	114.4
133	F	26.8	Very low	27.2	Very low	182 Å²	182	130.2 Å²	130.2	80%	0.798	77%	0.765	S	S	*	*			trans	77.2	133.8	168.2	-70.4	-81.8	0	0	0	122.6	V131	V131-F133 HydrophobicContact CG1-CD2 4.08Å; V131-F133 HydrophobicContact CG1-CE2 4.33Å
134	N	26	Very low	27.6	Very low	138 Å²	138	130.4 Å²	130.4	74%	0.738	76%	0.764	S	S	*	*			trans	55.2	142.7	148.5	-61.1	-7.1	0	0	0	122.2
135	M	23.8	Very low	27.5	Very low	161 Å²	161	130.2 Å²	130.2	79%	0.793	76%	0.763	S	S	*	*			cis	104.8	148.5	27.3	-132.7	-171.8	85.8	0	0	113
136	S	26.6	Very low	27.7	Very low	103 Å²	103	130.2 Å²	130.2	72%	0.72	76%	0.763	S	S	*	*			trans	80.5	132.2	-169.6	-33.5	0	0	0	0	113
137	C	22.8	Very low	27.8	Very low	119 Å²	119	131.8 Å²	131.8	80%	0.804	77%	0.768	S	S	*	*			cis	116	147.9	13.3	-75.7	0	0	0	0	112.4
138	E	24.8	Very low	27.7	Very low	170 Å²	170	130.5 Å²	130.5	79%	0.794	77%	0.765	S	S	*	*			trans	78	117.9	169.2	-50.5	-154.3	130.2	0	0	120.2
139	N	24.5	Very low	27.5	Very low	144 Å²	144	135.9 Å²	135.9	77%	0.77	77%	0.769	S	S	*	*				38.9	131.6	123.6	-48.1	-35.5	0	0	0	118.5
140	A	28.6	Very low	27.8	Very low	87 Å²	87	134.5 Å²	134.5	72%	0.719	76%	0.763	S	S	*	*				-173.3	151.4	56.7	0	0	0	0	0	114.8
141	T	25.9	Very low	27.7	Very low	125 Å²	125	141.3 Å²	141.3	77%	0.767	78%	0.775	S	S	*	*			trans	14.9	129.2	149.2	60.8	0	0	0	0	121.5
142	R	30.5	Very low	27.5	Very low	243 Å²	243	143.8 Å²	143.8	92%	0.917	78%	0.777	S	S	*	*				-171.1	124.1	111.1	-103.1	165.7	-173.9	-176.2	2.1	114.4
143	S	24.3	Very low	27.9	Very low	109 Å²	109	146 Å²	146	76%	0.762	78%	0.78	S	S	*	*			trans	-81.8	-171.5	157.1	-40.6	0	0	0	0	109.1
144	P	34.9	Very low	28.1	Very low	100 Å²	100	145 Å²	145	65%	0.649	78%	0.782	S	S	*	*			cis	-144.8	-168.3	8.2	42.6	-21.3	0	0	0	116.9
145	N	29.7	Very low	28	Very low	142 Å²	142	145.6 Å²	145.6	76%	0.759	78%	0.784	S	S	*	*			trans	69.8	155.4	157.7	-59.2	-17.2	0	0	0	117.6
146	L	32	Very low	28.4	Very low	147 Å²	147	143.1 Å²	143.1	77%	0.77	78%	0.78	S	S	*	*			cis	-129.8	146.3	2.2	-89.5	100.4	0	0	0	110.1
147	V	27.6	Very low	28.4	Very low	128 Å²	128	144.1 Å²	144.1	78%	0.776	78%	0.781	S	S	*	*				50.4	120.8	93.3	-169.1	0	0	0	0	113.1
148	A	30	Very low	28.6	Very low	92 Å²	92	142.6 Å²	142.6	76%	0.76	78%	0.777	S	S	*	*				-152.5	171.5	61.4	0	0	0	0	0	117.2
149	Y	25.5	Very low	28.9	Very low	227 Å²	227	140.6 Å²	140.6	89%	0.89	78%	0.777	S	S	*	*			trans	-95.8	-143.9	178.5	-73	-107.5	0	0	0	112.7
150	P	33.3	Very low	29	Very low	109 Å²	109	141.1 Å²	141.1	71%	0.708	78%	0.78	S	S	*	*				-126.2	-179.6	-111.5	40.7	-22	0	0	0	114.6
151	R	29.9	Very low	29.1	Very low	251 Å²	251	141.8 Å²	141.8	95%	0.947	79%	0.785	S	S	*	*			trans	-168.6	122.9	151	-106.9	150	-164.6	-155	2.8	115.2
152	H	25.2	Very low	29.4	Very low	178 Å²	178	138.9 Å²	138.9	82%	0.824	77%	0.774	S	S	*	*			trans	-87	-179.4	144.8	-69	-89.7	0	0	0	108.8
153	P	33.4	Very low	29.4	Very low	110 Å²	110	136.1 Å²	136.1	71%	0.714	77%	0.769	S	S	*	*			cis	-118.8	-162.8	-35.6	35.1	-18.3	0	0	0	109.9
154	I	30.4	Very low	29.7	Very low	163 Å²	163	136.1 Å²	136.1	84%	0.836	77%	0.769	S	S	*	*			trans	178.1	147.2	133.5	-93.7	156.1	0	0	0	110.9
155	L	24.9	Very low	29.4	Very low	150 Å²	150	138.2 Å²	138.2	79%	0.785	77%	0.774	S	S	*	*			trans	-99.9	153.2	174.7	-88.9	153	0	0	0	111.3
156	P	31.2	Very low	29.6	Very low	109 Å²	109	136.5 Å²	136.5	71%	0.708	77%	0.77	S	S	*	*				-116	148.3	112.7	-10.1	29.8	0	0	0	111.3
157	V	27.5	Very low	29.6	Very low	123 Å²	123	134.8 Å²	134.8	75%	0.745	77%	0.771	S	S	*	*			cis	62	80.3	48	-172.8	0	0	0	0	110.3
158	A	26.5	Very low	29.4	Very low	87 Å²	87	134 Å²	134	72%	0.719	77%	0.77	S	S	*	*				82.8	126.3	72.7	0	0	0	0	0	114.4
159	T	31.9	Very low	29.4	Very low	129 Å²	129	137.4 Å²	137.4	79%	0.791	77%	0.773	S	S	*	*			trans	178.1	111.4	137.8	36.7	0	0	0	0	111
160	D	26.3	Very low	29.4	Very low	155 Å²	155	130.4 Å²	130.4	83%	0.829	76%	0.763	S	S	*	*			trans	48.2	156.9	131.3	-55.3	-43.4	0	0	0	125.7
161	A	30.4	Very low	29.2	Very low	101 Å²	101	130.3 Å²	130.3	84%	0.835	76%	0.764	S	S	*	*			trans	77.1	141.8	164.8	0	0	0	0	0	117.3
162	A	31.5	Very low	29	Very low	63 Å²	63	126.6 Å²	126.6	52%	0.521	76%	0.755	S	S	.	*			cis	-156.5	158	0.7	0	0	0	0	0	112.7
163	F	30.2	Very low	29.1	Very low	185 Å²	185	127.2 Å²	127.2	81%	0.811	76%	0.756	S	S	*	*			trans	30	140.9	157.1	-51.4	-70.8	0	0	0	121.3	L165	F163-L165 HydrophobicContact CD1-CD1 4.31Å
164	S	31.4	Very low	28.8	Very low	109 Å²	109	125.9 Å²	125.9	76%	0.762	75%	0.749	S	S	*	*			cis	-150.2	146.4	15.1	37.7	0	0	0	0	109.4
165	L	28.5	Very low	28.7	Very low	144 Å²	144	127.1 Å²	127.1	75%	0.754	75%	0.751	S	S	*	*				81.8	141	54.4	-71.7	175.7	0	0	0	115	F163	F163-L165 HydrophobicContact CD1-CD1 4.31Å
166	P	34.4	Very low	28.9	Very low	106 Å²	106	123.5 Å²	123.5	69%	0.688	75%	0.75	S	S	*	*				-144.3	179	-123.4	43.6	-24.9	0	0	0	117.5
167	S	30.7	Very low	28.8	Very low	112 Å²	112	125.1 Å²	125.1	78%	0.783	75%	0.753	S	S	*	*			trans	-159.5	124.9	158.9	53.8	0	0	0	0	107.6
168	C	25.2	Very low	28.9	Very low	111 Å²	111	125.6 Å²	125.6	75%	0.75	75%	0.751	S	S	*	*			cis	57.6	131.7	30.8	-57.1	0	0	0	0	111.6
169	I	28.8	Very low	29.1	Very low	164 Å²	164	128 Å²	128	84%	0.841	75%	0.752	S	S	*	*			cis	-135.6	148.4	42.1	-74.1	164.7	0	0	0	111.2
170	A	26.1	Very low	29.1	Very low	80 Å²	80	125.8 Å²	125.8	66%	0.661	75%	0.746	S	S	*	*			trans	-110.8	177.6	166.4	0	0	0	0	0	110.1
171	S	28.2	Very low	29.4	Very low	107 Å²	107	125.9 Å²	125.9	75%	0.748	74%	0.741	S	S	*	*			trans	76.2	162.5	166.5	95.7	0	0	0	0	115.5
172	K	26.2	Very low	29.6	Very low	173 Å²	173	128.6 Å²	128.6	75%	0.752	74%	0.737	S	S	*	*			cis	-172.9	142.1	-23.1	-111.7	179.2	-175.8	177	0	107.2
173	F	26.5	Very low	29.6	Very low	191 Å²	191	130 Å²	130	84%	0.838	74%	0.742	S	S	*	*			trans	64.3	166.5	152	-79.1	-125.8	0	0	0	114.9
174	S	27.6	Very low	29.6	Very low	82 Å²	82	128.8 Å²	128.8	57%	0.573	74%	0.739	S	S	*	*			cis	-164.8	159.7	-18.6	43.5	0	0	0	0	109.4
175	Q	29.5	Very low	29.6	Very low	189 Å²	189	134.1 Å²	134.1	88%	0.883	74%	0.743	S	S	*	*			trans	47.6	114.4	153.1	-66.6	168.9	-9.9	0	0	117.6
176	G	28.5	Very low	29.7	Very low	74 Å²	74	131.9 Å²	131.9	76%	0.763	74%	0.739	S	S	*	*			cis	92.3	104.6	17.4	0	0	0	0	0	111.8
177	N	28.6	Very low	29.3	Very low	142 Å²	142	134.5 Å²	134.5	76%	0.759	75%	0.747	S	S	*	*			trans	-167.5	142.5	170.6	-139.4	1.2	0	0	0	112
178	L	29.6	Very low	29.2	Very low	134 Å²	134	137 Å²	137	70%	0.702	75%	0.751	S	S	*	*			trans	63.4	149.5	158.7	-50.6	174.5	0	0	0	117.4
179	N	30.5	Very low	29.1	Very low	138 Å²	138	136.8 Å²	136.8	74%	0.738	75%	0.751	S	S	*	*			cis	-159.7	165.6	-6.6	-123	-9.4	0	0	0	111
180	A	33.1	Very low	29.1	Very low	82 Å²	82	138.3 Å²	138.3	68%	0.678	75%	0.752	S	S	*	*			trans	67.8	151.5	156.2	0	0	0	0	0	118
181	Q	32.8	Very low	28.9	Very low	156 Å²	156	139.5 Å²	139.5	73%	0.729	76%	0.755	S	S	*	*			cis	-163.7	147.9	-11.6	-121.7	175.2	-55.5	0	0	111.2
182	H	33.2	Very low	29.1	Very low	159 Å²	159	139.8 Å²	139.8	74%	0.736	76%	0.755	S	S	*	*			trans	60.5	152.6	160.2	-65	-65.1	0	0	0	118.2
183	S	32.7	Very low	29	Very low	91 Å²	91	136.3 Å²	136.3	64%	0.636	75%	0.752	S	S	*	*			cis	-154.5	144.3	-1.2	46.9	0	0	0	0	111.5
184	E	30	Very low	29.2	Very low	160 Å²	160	135.7 Å²	135.7	75%	0.748	75%	0.749	S	S	*	*			trans	54.6	145.9	134.4	-72.2	169.1	-127.3	0	0	122
185	W	30.8	Very low	29.1	Very low	222 Å²	222	139.5 Å²	139.5	84%	0.841	76%	0.757	S	S	*	*			cis	-137	167.4	22	-92.7	-31.2	0	0	0	115.5
186	S	30.8	Very low	29.1	Very low	96 Å²	96	139.8 Å²	139.8	67%	0.671	76%	0.756	S	S	*	*			trans	10.7	124.6	158.1	61.1	0	0	0	0	120.5
187	N	25.7	Very low	29.1	Very low	161 Å²	161	142 Å²	142	86%	0.861	75%	0.751	S	S	*	*				57.3	112	61.7	-70.2	-23.4	0	0	0	116.3
188	L	28.4	Very low	29	Very low	165 Å²	165	143.1 Å²	143.1	86%	0.864	75%	0.751	S	S	*	*				-163	133.9	128.6	-111.3	168.3	0	0	0	110.4
189	S	23.7	Very low	28.7	Very low	106 Å²	106	144.2 Å²	144.2	74%	0.741	76%	0.757	S	S	*	*			trans	-119.5	128.9	-175.7	56.6	0	0	0	0	111.2
190	F	27.8	Very low	28.5	Very low	197 Å²	197	148.9 Å²	148.9	86%	0.864	76%	0.764	S	S	*	*			trans	-138.8	137.4	168.5	-100.8	-87.1	0	0	0	113
191	S	23.1	Very low	28.4	Very low	105 Å²	105	153 Å²	153	73%	0.734	77%	0.769	S	S	*	*			trans	-115.5	169.1	159.6	-66.2	0	0	0	0	106.1
192	P	31.2	Very low	28.1	Very low	113 Å²	113	153.8 Å²	153.8	73%	0.734	78%	0.778	S	S	*	*			cis	-149.6	176.2	26.1	44.2	-23.7	0	0	0	118.3
193	S	25.4	Very low	27.9	Very low	99 Å²	99	155.6 Å²	155.6	69%	0.692	78%	0.784	S	S	*	*			trans	34.1	135.8	140.8	72.2	0	0	0	0	124.6
194	K	31.1	Very low	27.8	Very low	178 Å²	178	155.2 Å²	155.2	77%	0.774	79%	0.787	S	S	*	*			trans	89.8	114.8	145.2	-76.6	-178.7	178.3	-176.8	0	121.2
195	Q	25.4	Very low	27.6	Very low	162 Å²	162	155.1 Å²	155.1	76%	0.757	79%	0.791	S	S	*	*			trans	58.2	102.6	136.7	-63.2	176.1	-91.2	0	0	119.7
196	F	29	Very low	27.4	Very low	195 Å²	195	150.7 Å²	150.7	86%	0.855	78%	0.782	S	S	*	*				-149.8	151.8	124.7	-110.3	-79.9	0	0	0	109.9
197	D	28.8	Very low	27.1	Very low	121 Å²	121	150.6 Å²	150.6	65%	0.647	78%	0.78	S	S	*	*			trans	19.2	109.3	169.7	-56.4	-24.6	0	0	0	120.1
198	Q	26	Very low	27.2	Very low	166 Å²	166	151.4 Å²	151.4	78%	0.776	78%	0.776	S	S	*	*				72.1	129.7	77.3	-71.1	-164	51.5	0	0	116.1
199	L	23.6	Very low	27	Very low	156 Å²	156	149 Å²	149	82%	0.817	77%	0.771	S	S	*	*			trans	62.9	78.4	159.7	-62.9	168.5	0	0	0	119
200	R	26.8	Very low	27.2	Very low	237 Å²	237	148.3 Å²	148.3	89%	0.894	76%	0.763	S	S	*	*			trans	-159.4	162	144.6	-106.8	152.5	-157.9	-152.1	4.5	112.1
201	H	30	Very low	27.3	Very low	168 Å²	168	143.6 Å²	143.6	78%	0.778	75%	0.752	S	S	*	*			trans	75	36.5	173.5	-62.3	-72.3	0	0	0	120.4
202	N	25.9	Very low	27.6	Very low	172 Å²	172	144.7 Å²	144.7	92%	0.92	75%	0.754	S	S	*	*			trans	-87.7	96.8	142.4	-95	-14.7	0	0	0	109.4
203	K	29.8	Very low	27.4	Very low	197 Å²	197	143.6 Å²	143.6	86%	0.857	74%	0.742	S	S	*	*			trans	-100.9	86.3	164.1	-90.3	-168.2	173	-178.1	0	109.2
204	A	29.7	Very low	27.4	Very low	84 Å²	84	145.6 Å²	145.6	69%	0.694	75%	0.753	S	S	*	*			trans	-63.8	151.1	173	0	0	0	0	0	111.4	I206	A204-I206 PolarHBondContact O-N 3.17Å
205	N	26.9	Very low	27.2	Very low	157 Å²	157	141.2 Å²	141.2	84%	0.84	74%	0.744	S	S	*	*			trans	-70.7	96	174.4	-76.6	-40.2	0	0	0	110.5
206	I	27.1	Very low	27.5	Very low	129 Å²	129	140.2 Å²	140.2	66%	0.662	74%	0.738	S	S	*	*			trans	-85.2	123.1	168.8	-58.8	176.7	0	0	0	108.3	A204 F208	A204-I206 PolarHBondContact O-N 3.17Å; I206-F208 WeakPolarHBondContact O-CD2 3.47Å; I206-F208 PolarHBondContact O-N 2.86Å
207	P	24.7	Very low	27.3	Very low	95 Å²	95	136 Å²	136	62%	0.617	73%	0.733	S	S	*	*			trans	-64.2	115.1	176	-21.1	33.4	0	0	0	111.1	C209	P207-C209 PolarHBondContact O-N 3.17Å
208	F	26.8	Very low	27.3	Very low	178 Å²	178	138.8 Å²	138.8	78%	0.781	73%	0.734	S	S	*	*			trans	-77.6	104.8	179.7	-84.2	-86.2	0	0	0	111.7	I206 V210	I206-F208 WeakPolarHBondContact O-CD2 3.47Å; I206-F208 PolarHBondContact O-N 2.86Å; F208-V210 PolarHBondContact O-N 3.43Å
209	C	24.6	Very low	27.4	Very low	113 Å²	113	142 Å²	142	76%	0.764	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-59.1	119.7	164.1	-67	0	0	0	0	110.2	P207	P207-C209 PolarHBondContact O-N 3.17Å
210	V	28.3	Very low	27.7	Very low	92 Å²	92	142.5 Å²	142.5	56%	0.558	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-89.9	134.2	172.1	-178.9	0	0	0	0	108.2	F208 V212	F208-V210 PolarHBondContact O-N 3.43Å; V210-V212 PolarHBondContact O-N 2.57Å
211	P	30.1	Very low	27.8	Very low	98 Å²	98	138.3 Å²	138.3	64%	0.636	73%	0.732	S	S	*	*	P	Polyproline II helix	trans	-58.2	131.6	174	-24.4	34.7	0	0	0	111.7
212	V	28.2	Very low	27.7	Very low	129 Å²	129	140.2 Å²	140.2	78%	0.782	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-73.8	150.5	168.9	179.6	0	0	0	0	108.8	V210	V210-V212 PolarHBondContact O-N 2.57Å
213	D	26.6	Very low	27.8	Very low	89 Å²	89	135.8 Å²	135.8	48%	0.476	73%	0.733	S	S	.	*	P	Polyproline II helix	trans	-46.2	125.1	175.4	-71.1	-58.6	0	0	0	111.1	S215 R469	D213-S215 PolarHBondContact O-N 3.1Å; D213-R469 IonicContact OD2-CZ 2.81Å; D213-R469 IonicContact OD2-NH1 2.71Å; D213-R469 PolarHBondContact OD2-NH1 3.13Å; D213-R469 IonicContact OD2-NH2 3.39Å
214	P	25.8	Very low	27.8	Very low	142 Å²	142	133.9 Å²	133.9	92%	0.922	73%	0.73	S	S	*	*	S	Bend	trans	-78.8	62.7	177.6	32.5	-35.4	0	0	0	111.4
215	S	27.6	Very low	27.6	Very low	85 Å²	85	137.5 Å²	137.5	59%	0.594	74%	0.737	S	S	*	*			trans	-127.2	137.5	168	50.5	0	0	0	0	109.4	D213	D213-S215 PolarHBondContact O-N 3.1Å
216	F	30.2	Very low	27.8	Very low	142 Å²	142	138.6 Å²	138.6	62%	0.623	74%	0.737	S	S	*	*	S	Bend	trans	65.6	69.3	-171.9	-67.6	-82.5	0	0	0	117.3	L1003	F216-L1003 HydrophobicContact CD1-CD1 4.17Å; F216-L1003 HydrophobicContact CG-CD1 4.4Å
217	S	25.8	Very low	27.7	Very low	107 Å²	107	139.9 Å²	139.9	75%	0.748	75%	0.745	S	S	*	*				32.2	95	126.3	60	0	0	0	0	118.8
218	R	28.6	Very low	28	Very low	178 Å²	178	141.7 Å²	141.7	67%	0.672	75%	0.754	S	S	*	*			trans	-135.6	84.9	151	-76.6	-169.6	178.4	174.3	2.2	111.1	T1001	R218-T1001 PolarHBondContact NH2-O 3.3Å; R218-T1001 VanDerWaalsContact NH2-O 3.13Å
219	Y	27.6	Very low	28	Very low	235 Å²	235	138.2 Å²	138.2	92%	0.922	75%	0.752	S	S	*	*			trans	-85.6	119.5	154.9	-81.3	-81.7	0	0	0	108.3
220	K	31.3	Very low	28.2	Very low	166 Å²	166	138.5 Å²	138.5	72%	0.722	75%	0.751	S	S	*	*			trans	-133.1	117	163.4	-100.5	-165.4	173	-170.1	0	109.7
221	N	27.4	Very low	28.3	Very low	149 Å²	149	139.5 Å²	139.5	80%	0.797	75%	0.753	S	S	*	*			trans	46	81.2	145	-54.1	14.8	0	0	0	117.2
222	F	29.4	Very low	28.2	Very low	208 Å²	208	142.4 Å²	142.4	91%	0.912	76%	0.758	S	S	*	*			trans	-105.4	106.8	137	-85.7	-84.3	0	0	0	107.8
223	G	27.2	Very low	28.4	Very low	79 Å²	79	145.2 Å²	145.2	81%	0.814	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-79.8	117.6	173.2	0	0	0	0	0	109.5
224	I	29.6	Very low	28.5	Very low	156 Å²	156	147.8 Å²	147.8	80%	0.8	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-92.6	120.8	171.5	-62.4	177.6	0	0	0	107.4	Q226	I224-Q226 PolarHBondContact O-N 3.04Å
225	L	25.6	Very low	28.7	Very low	161 Å²	161	147.9 Å²	147.9	84%	0.843	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-64.3	122.4	173.9	-71.9	159.6	0	0	0	109.6
226	Q	30.3	Very low	28.8	Very low	180 Å²	180	151.4 Å²	151.4	84%	0.841	76%	0.764	S	S	*	*			trans	-96	112.4	163.5	-77	-171	-39.7	0	0	109	I224	I224-Q226 PolarHBondContact O-N 3.04Å
227	N	26.1	Very low	28.8	Very low	155 Å²	155	150.6 Å²	150.6	83%	0.829	77%	0.77	S	S	*	*			trans	-77.6	124.5	167.4	-71.8	-15	0	0	0	109.1
228	V	30.5	Very low	29.1	Very low	133 Å²	133	151.5 Å²	151.5	81%	0.806	77%	0.771	S	S	*	*			trans	-136	127.9	163.4	-173.4	0	0	0	0	107.5
229	S	27.6	Very low	29.3	Very low	105 Å²	105	150.4 Å²	150.4	73%	0.734	77%	0.771	S	S	*	*			trans	-66.4	163.8	174.9	-48.7	0	0	0	0	110.6
230	T	28.7	Very low	29.6	Very low	119 Å²	119	144.5 Å²	144.5	73%	0.73	76%	0.756	S	S	*	*			cis	-150.8	-177.4	38.4	47.7	0	0	0	0	113.8
231	D	30.8	Very low	29.6	Very low	114 Å²	114	142.4 Å²	142.4	61%	0.61	75%	0.752	S	S	*	*			trans	90.7	83.1	152.2	-61.7	-53.7	0	0	0	121.9
232	Q	27.7	Very low	29.8	Very low	158 Å²	158	143 Å²	143	74%	0.738	75%	0.75	S	S	*	*				60.2	95.1	115.3	-67.4	-177.3	65.8	0	0	119.2
233	K	31.5	Very low	29.7	Very low	189 Å²	189	143.3 Å²	143.3	82%	0.822	75%	0.747	S	S	*	*				163.4	145.4	121.6	-88.9	156.6	-174.6	173.6	0	110.2
234	Q	28.4	Very low	29.9	Very low	142 Å²	142	145.4 Å²	145.4	66%	0.664	74%	0.744	S	S	*	*			cis	-168	152	-17.9	-160.4	172.9	6.2	0	0	107.6
235	H	29.9	Very low	29.9	Very low	144 Å²	144	145.2 Å²	145.2	67%	0.667	75%	0.745	S	S	*	*			trans	74.1	143.8	176.9	-46.1	93.4	0	0	0	116.4
236	Q	30.1	Very low	30.1	Very low	159 Å²	159	142.9 Å²	142.9	74%	0.743	74%	0.739	S	S	*	*			cis	-165.3	154.3	-18.8	-118.2	-176.1	-10.1	0	0	109.9
237	V	30.3	Very low	29.9	Very low	125 Å²	125	140.2 Å²	140.2	76%	0.758	74%	0.739	S	S	*	*			trans	62.6	134.3	143.7	168.1	0	0	0	0	117.8
238	V	33.4	Very low	29.9	Very low	127 Å²	127	140 Å²	140	77%	0.77	74%	0.737	S	S	*	*			cis	-168.6	162	-3.4	127.2	0	0	0	0	105.9
239	K	31.4	Very low	29.9	Very low	155 Å²	155	143.7 Å²	143.7	67%	0.674	74%	0.743	S	S	*	*			cis	179.6	171.7	-32.3	-161.6	-155.3	152.9	-138.3	0	106.6
240	N	34	Very low	30	Very low	111 Å²	111	147.5 Å²	147.5	59%	0.594	75%	0.747	S	S	*	*			trans	79.3	117.5	171.8	-53.3	-16.3	0	0	0	113.4
241	N	32.2	Very low	29.9	Very low	122 Å²	122	148.5 Å²	148.5	65%	0.652	75%	0.747	S	S	*	*				81.2	137.3	61.2	-65.1	31.2	0	0	0	111.1
242	E	31.1	Very low	29.8	Very low	162 Å²	162	151.4 Å²	151.4	76%	0.757	76%	0.761	S	S	*	*			cis	-153.5	-173.2	15.2	-131.3	146.6	-122.3	0	0	113.2
243	Y	27.9	Very low	29.8	Very low	214 Å²	214	152.3 Å²	152.3	84%	0.839	76%	0.759	S	S	*	*			trans	-56.6	167.5	-178.4	-72.9	-105	0	0	0	114.5
244	T	30.3	Very low	29.8	Very low	123 Å²	123	149.1 Å²	149.1	76%	0.755	76%	0.758	S	S	*	*			cis	-165	166.3	35.7	-30.2	0	0	0	0	113.6
245	D	30	Very low	29.9	Very low	152 Å²	152	151 Å²	151	81%	0.813	76%	0.763	S	S	*	*			trans	79.3	128.3	150.5	-134.1	10	0	0	0	120.7
246	P	29.5	Very low	30.1	Very low	111 Å²	111	152.2 Å²	152.2	72%	0.721	77%	0.77	S	S	*	*			trans	-118.6	104.7	-168.8	38.4	-23.5	0	0	0	115.6
247	C	26.1	Very low	30.2	Very low	124 Å²	124	151.5 Å²	151.5	84%	0.838	77%	0.771	S	S	*	*			trans	-154.6	67.3	166.8	-105.9	0	0	0	0	114.6
248	N	27.2	Very low	30.2	Very low	150 Å²	150	148.7 Å²	148.7	80%	0.802	77%	0.767	S	S	*	*			trans	-178.4	126.5	152.9	-107.2	-69.2	0	0	0	111.1
249	F	29.6	Very low	30.1	Very low	211 Å²	211	152.2 Å²	152.2	93%	0.925	77%	0.772	S	S	*	*			trans	-129.3	94.8	164	-102.8	-78.8	0	0	0	111
250	K	29	Very low	29.8	Very low	186 Å²	186	150 Å²	150	81%	0.809	77%	0.773	S	S	*	*			trans	-94.4	155.2	163.1	-104.3	178.5	177.2	173.9	0	109.7
251	L	26.8	Very low	29.7	Very low	140 Å²	140	153.5 Å²	153.5	73%	0.733	79%	0.785	S	S	*	*			trans	-47.2	136.6	-177	-65.2	111	0	0	0	114.5	Y253	L251-Y253 HydrophobicContact CB-CD2 3.91Å; L251-Y253 HydrophobicContact CB-CE2 3.93Å; L251-Y253 HydrophobicContact CD1-CE2 4.38Å; L251-Y253 HydrophobicContact CD2-CE2 4.43Å; L251-Y253 HydrophobicContact CG-CE2 4.48Å; L251-Y253 PolarHBondContact O-N 2.69Å
252	L	28.9	Very low	29.4	Very low	174 Å²	174	152 Å²	152	91%	0.911	78%	0.784	S	S	*	*			trans	-80.7	103.4	158.4	-82.1	168	0	0	0	109.8
253	Y	27.3	Very low	29.2	Very low	178 Å²	178	151.1 Å²	151.1	70%	0.698	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-91.3	157	158.4	-77.6	-102.6	0	0	0	109.7	L251	L251-Y253 HydrophobicContact CB-CD2 3.91Å; L251-Y253 HydrophobicContact CB-CE2 3.93Å; L251-Y253 HydrophobicContact CD1-CE2 4.38Å; L251-Y253 HydrophobicContact CD2-CE2 4.43Å; L251-Y253 HydrophobicContact CG-CE2 4.48Å; L251-Y253 PolarHBondContact O-N 2.69Å
254	P	32.8	Very low	29.2	Very low	122 Å²	122	147.1 Å²	147.1	79%	0.792	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-62	137.9	148.4	-12.3	28.7	0	0	0	109.9
255	K	29.6	Very low	29	Very low	180 Å²	180	151.8 Å²	151.8	78%	0.783	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-73.8	168.2	166.9	-67.3	179.1	-179.8	174.5	0	108.5
256	E	34.4	Very low	28.8	Very low	171 Å²	171	150.8 Å²	150.8	80%	0.799	77%	0.774	S	S	*	*			cis	-147.7	142.5	45.6	-77.9	172.4	160.9	0	0	110.9
257	N	32.4	Very low	28.7	Very low	144 Å²	144	150.3 Å²	150.3	77%	0.77	77%	0.773	S	S	*	*				48.4	124.8	87.4	-54.8	-16.5	0	0	0	113.7
258	G	30.9	Very low	28.9	Very low	66 Å²	66	153.3 Å²	153.3	68%	0.68	77%	0.772	S	S	*	*			cis	174.4	-177.4	-4.6	0	0	0	0	0	113.3
259	F	30	Very low	29	Very low	200 Å²	200	153.3 Å²	153.3	88%	0.877	77%	0.767	S	S	*	*			trans	58.4	93.5	164.5	-77.4	-92.5	0	0	0	121.3
260	T	26.9	Very low	29	Very low	110 Å²	110	151.6 Å²	151.6	68%	0.675	76%	0.76	S	S	*	*				18.1	149.1	122.3	56.6	0	0	0	0	122.7
261	Q	31	Very low	28.9	Very low	183 Å²	183	148.8 Å²	148.8	86%	0.855	75%	0.754	S	S	*	*			trans	72.4	137.9	163.4	-68.9	175.4	9.5	0	0	115.4
262	S	25.3	Very low	29.2	Very low	90 Å²	90	149.6 Å²	149.6	63%	0.629	76%	0.759	S	S	*	*			cis	163.4	175.2	-22.4	47.1	0	0	0	0	105.6
263	I	28.4	Very low	29.1	Very low	145 Å²	145	147 Å²	147	74%	0.744	75%	0.745	S	S	*	*			trans	84.9	96.7	162	-66.1	172.9	0	0	0	117.7
264	L	26.1	Very low	29.3	Very low	129 Å²	129	147.9 Å²	147.9	68%	0.675	75%	0.753	S	S	*	*			trans	68.9	140.7	133.4	-83.4	83.8	0	0	0	125.4
265	W	26.3	Very low	29.2	Very low	221 Å²	221	147 Å²	147	84%	0.837	75%	0.75	S	S	*	*			trans	103.7	142.4	144.1	-108.2	-65.6	0	0	0	121.1
266	N	25.9	Very low	29.2	Very low	131 Å²	131	143.6 Å²	143.6	70%	0.701	75%	0.747	S	S	*	*			trans	-103.9	178.5	-161.1	-50.8	-45.3	0	0	0	114
267	S	27.2	Very low	28.9	Very low	101 Å²	101	140.2 Å²	140.2	71%	0.706	74%	0.742	S	S	*	*			trans	84.8	106	139.2	-61.9	0	0	0	0	120.1
268	K	30.1	Very low	28.9	Very low	188 Å²	188	141.1 Å²	141.1	82%	0.817	74%	0.742	S	S	*	*				-170.2	130.7	111.1	-97.9	151.5	-173.2	178	0	110.3
269	H	30.9	Very low	28.8	Very low	150 Å²	150	146.8 Å²	146.8	69%	0.694	75%	0.748	S	S	*	*				60.9	136.2	93.8	-82.9	-100.9	0	0	0	113.7
270	F	29	Very low	28.7	Very low	175 Å²	175	141 Å²	141	77%	0.768	73%	0.732	S	S	*	*			cis	-129.7	150	-0.3	-83.7	-98.8	0	0	0	107.4
271	N	26.9	Very low	28.9	Very low	127 Å²	127	143.8 Å²	143.8	68%	0.679	74%	0.737	S	S	*	*				69.1	106.5	53.9	-160.5	65.6	0	0	0	114.9
272	D	32.2	Very low	29.2	Very low	157 Å²	157	139.5 Å²	139.5	84%	0.84	73%	0.725	S	S	*	*			trans	-159	165.7	138.6	-133.4	-25.9	0	0	0	114.3
273	N	26.8	Very low	29.4	Very low	118 Å²	118	143 Å²	143	63%	0.631	73%	0.73	S	S	*	*			trans	-119.7	157.6	-159.6	-67	-91.8	0	0	0	115.9
274	K	32.8	Very low	29.6	Very low	198 Å²	198	142.6 Å²	142.6	86%	0.861	73%	0.729	S	S	*	*			trans	-175.1	124.1	131.5	-102.2	150.7	-171.4	169.1	0	116.1
275	S	30	Very low	29.9	Very low	103 Å²	103	142.4 Å²	142.4	72%	0.72	73%	0.729	S	S	*	*			trans	26.9	139.5	130.7	60.9	0	0	0	0	120.6
276	C	28.9	Very low	30.1	Very low	108 Å²	108	138.5 Å²	138.5	73%	0.73	73%	0.729	S	S	*	*			cis	-150.8	140	26.4	-96.5	0	0	0	0	109.2
277	S	29	Very low	30.1	Very low	100 Å²	100	136.5 Å²	136.5	70%	0.699	73%	0.725	S	S	*	*				40.4	139.2	86	73.9	0	0	0	0	115.6
278	Q	31.9	Very low	30.1	Very low	164 Å²	164	138 Å²	138	77%	0.766	73%	0.725	S	S	*	*			cis	-115.4	-154.9	19.7	-67.1	173.5	-25.4	0	0	110.4
279	F	29.7	Very low	30.2	Very low	185 Å²	185	139.5 Å²	139.5	81%	0.811	73%	0.727	S	S	*	*			cis	-149.9	170.9	11.6	-134.9	-78.1	0	0	0	110.1
280	S	27.2	Very low	29.9	Very low	77 Å²	77	142.5 Å²	142.5	54%	0.538	73%	0.733	S	S	.	*			trans	-146.8	154.8	-172.2	46.7	0	0	0	0	114.1
281	H	32.1	Very low	29.9	Very low	169 Å²	169	141.9 Å²	141.9	78%	0.782	73%	0.732	S	S	*	*				178.1	156.4	107.9	-95.1	-71.2	0	0	0	114.4
282	P	36.4	Very low	30	Very low	93 Å²	93	146.4 Å²	146.4	60%	0.604	74%	0.739	S	S	*	*			trans	-131.4	-144	-169.3	44.5	-26.1	0	0	0	114.3
283	F	29.3	Very low	29.8	Very low	163 Å²	163	149.7 Å²	149.7	72%	0.715	74%	0.74	S	S	*	*			trans	79.6	147.9	-179.8	-54.9	-77.1	0	0	0	115
284	N	32.5	Very low	29.9	Very low	137 Å²	137	149.8 Å²	149.8	73%	0.733	75%	0.745	S	S	*	*			cis	-139.4	-176.3	13.8	-68.7	-94.7	0	0	0	109
285	N	31.9	Very low	29.8	Very low	126 Å²	126	146.1 Å²	146.1	67%	0.674	75%	0.745	S	S	*	*			cis	-171.5	168	-40.7	-80.1	-11.4	0	0	0	104.9
286	V	31.1	Very low	29.9	Very low	139 Å²	139	144.6 Å²	144.6	84%	0.842	75%	0.745	S	S	*	*			cis	-147.6	-172.6	1.3	86.6	0	0	0	0	108.6
287	S	25.8	Very low	30.2	Very low	88 Å²	88	145.9 Å²	145.9	62%	0.615	75%	0.752	S	S	*	*			trans	-130.6	171.9	-172.9	60	0	0	0	0	117
288	D	28.6	Very low	30.3	Very low	133 Å²	133	144.8 Å²	144.8	71%	0.711	76%	0.757	S	S	*	*			trans	92.4	159.4	143.1	-72.5	-55	0	0	0	125.4
289	Y	30.3	Very low	30.2	Very low	219 Å²	219	145 Å²	145	86%	0.859	76%	0.759	S	S	*	*			trans	96.5	154.2	159.6	-74.3	-72	0	0	0	122.2
290	R	25.9	Very low	30.3	Very low	213 Å²	213	144.2 Å²	144.2	80%	0.804	76%	0.758	S	S	*	*			trans	-133	156.9	-153.5	-60.8	176.9	175.3	162.6	-2.4	113.4
291	H	29	Very low	30.4	Very low	163 Å²	163	147.6 Å²	147.6	76%	0.755	77%	0.771	S	S	*	*			trans	82.9	142.4	140.1	-78.5	-26.7	0	0	0	123.3
292	R	28.6	Very low	30.3	Very low	222 Å²	222	148.4 Å²	148.4	84%	0.838	77%	0.772	S	S	*	*			trans	84.6	95.1	147.6	-76.2	172.6	-173.6	-151.7	3.8	121.9
293	R	27.6	Very low	29.9	Very low	225 Å²	225	150.9 Å²	150.9	85%	0.849	78%	0.779	S	S	*	*				66.4	129.9	114.6	-77	-166.5	178.2	-162.7	0.4	122.8
294	T	30.2	Very low	30	Very low	121 Å²	121	149 Å²	149	74%	0.742	78%	0.781	S	S	*	*			trans	89.5	127.3	132.7	44.6	0	0	0	0	123.9
295	S	30.5	Very low	29.8	Very low	121 Å²	121	146.5 Å²	146.5	85%	0.846	77%	0.774	S	S	*	*			trans	67.9	133.9	146.3	50.5	0	0	0	0	122
296	G	31.2	Very low	29.8	Very low	70 Å²	70	146.2 Å²	146.2	72%	0.722	77%	0.773	S	S	*	*			trans	-136.2	-177.7	155.1	0	0	0	0	0	109.5
297	P	36.1	Very low	29.8	Very low	135 Å²	135	148 Å²	148	88%	0.877	77%	0.771	S	S	*	*			trans	-150.5	154.2	155	38.4	-21.6	0	0	0	117.6
298	G	29.8	Very low	30	Very low	78 Å²	78	148.7 Å²	148.7	80%	0.804	78%	0.776	S	S	*	*			trans	74.5	166.6	148.5	0	0	0	0	0	119.6
299	M	31.3	Very low	30.1	Very low	167 Å²	167	146.4 Å²	146.4	82%	0.823	77%	0.771	S	S	*	*			cis	-165.9	160.9	-20.5	-144.7	-162.3	-175.4	0	0	111.4
300	Q	31.8	Very low	30	Very low	169 Å²	169	143.5 Å²	143.5	79%	0.79	77%	0.77	S	S	*	*			trans	70.3	163.4	160.4	-61.7	176.4	29.7	0	0	119.5
301	N	29.5	Very low	30.1	Very low	149 Å²	149	140.2 Å²	140.2	80%	0.797	76%	0.763	S	S	*	*			cis	-168.9	175.9	-48.9	-147.7	-13.4	0	0	0	110.2
302	K	29.9	Very low	30.1	Very low	185 Å²	185	138.5 Å²	138.5	80%	0.804	76%	0.76	S	S	*	*			trans	74.1	155.2	169.7	-64.9	-172.8	176.9	-178.2	0	117.5
303	L	26.6	Very low	30.1	Very low	146 Å²	146	132.8 Å²	132.8	76%	0.764	75%	0.749	S	S	*	*			cis	-172.1	173	-38.5	-125	171.5	0	0	0	108.6
304	T	31.3	Very low	30.1	Very low	122 Å²	122	133.4 Å²	133.4	75%	0.748	75%	0.753	S	S	*	*			trans	64.5	150.7	168.5	55.8	0	0	0	0	119.1
305	S	29	Very low	30	Very low	85 Å²	85	135.1 Å²	135.1	59%	0.594	75%	0.752	S	S	*	*			cis	-168.6	171.5	-37.1	50.4	0	0	0	0	110.6
306	D	31.1	Very low	29.8	Very low	120 Å²	120	133 Å²	133	64%	0.642	74%	0.742	S	S	*	*			trans	78.9	128.7	150.3	-52.4	-37	0	0	0	123
307	H	31.2	Very low	29.5	Very low	176 Å²	176	137.1 Å²	137.1	82%	0.815	75%	0.748	S	S	*	*			trans	37.2	140.7	142.3	-52.8	-50.1	0	0	0	122
308	S	30.2	Very low	29	Very low	103 Å²	103	135.9 Å²	135.9	72%	0.72	74%	0.743	S	S	*	*			cis	-171.2	-163.9	-10.8	62	0	0	0	0	107.8
309	S	31.6	Very low	28.8	Very low	86 Å²	86	138.6 Å²	138.6	60%	0.601	74%	0.743	S	S	*	*			cis	-168	124.5	-0.7	21.9	0	0	0	0	109.7
310	L	26.9	Very low	28.6	Very low	158 Å²	158	136.8 Å²	136.8	83%	0.827	74%	0.744	S	S	*	*			trans	61.5	159.8	167.4	-67.3	98.4	0	0	0	116.2
311	E	29	Very low	28.2	Very low	143 Å²	143	133.7 Å²	133.7	67%	0.668	74%	0.741	S	S	*	*			cis	-152.8	162.8	18.4	-146	174.1	-109.5	0	0	112.4
312	N	29.5	Very low	28	Very low	127 Å²	127	130.7 Å²	130.7	68%	0.679	73%	0.732	S	S	*	*			trans	50.6	94.8	162.6	-50.8	-43.2	0	0	0	117.8
313	V	27.9	Very low	27.8	Very low	102 Å²	102	131.4 Å²	131.4	62%	0.618	73%	0.731	S	S	*	*			cis	73.6	107.9	32	-172.6	0	0	0	0	116.2
314	Y	28.2	Very low	27.9	Very low	238 Å²	238	132.3 Å²	132.3	93%	0.933	74%	0.735	S	S	*	*			trans	-141.9	118.3	131.4	-111.6	-81.8	0	0	0	109.3
315	H	27.9	Very low	27.7	Very low	157 Å²	157	131.5 Å²	131.5	73%	0.727	73%	0.73	S	S	*	*			trans	-83.1	152.2	175.9	-75.8	-73.8	0	0	0	110.2
316	A	26.4	Very low	27.8	Very low	76 Å²	76	135.1 Å²	135.1	63%	0.628	74%	0.741	S	S	*	*			cis	93.6	120.4	32.5	0	0	0	0	0	115.2
317	N	24.6	Very low	27.6	Very low	157 Å²	157	135.8 Å²	135.8	84%	0.84	75%	0.745	S	S	*	*			trans	55.5	146.1	151.7	-62.9	-14.9	0	0	0	123.6
318	S	24.9	Very low	27.6	Very low	110 Å²	110	133.2 Å²	133.2	77%	0.769	74%	0.742	S	S	*	*			trans	90.1	123.8	150.8	73.6	0	0	0	0	121.6
319	V	26.4	Very low	27.5	Very low	135 Å²	135	133.8 Å²	133.8	82%	0.818	75%	0.746	S	S	*	*				36.2	122.1	124.4	-171.2	0	0	0	0	116.6
320	P	27	Very low	27.3	Very low	128 Å²	128	135.1 Å²	135.1	83%	0.831	75%	0.752	S	S	*	*				-148.8	-162.7	64.6	43.5	-23.9	0	0	0	117
321	S	23.9	Very low	27.4	Very low	105 Å²	105	135.7 Å²	135.7	73%	0.734	75%	0.754	S	S	*	*			trans	-84.1	162.2	-172.1	-167.8	0	0	0	0	115.2
322	S	24.3	Very low	27.2	Very low	86 Å²	86	136.8 Å²	136.8	60%	0.601	77%	0.765	S	S	*	*			trans	84.2	139.3	143.8	77.1	0	0	0	0	121.6
323	Y	26.4	Very low	27	Very low	199 Å²	199	135.8 Å²	135.8	78%	0.78	77%	0.768	S	S	*	*			trans	64.7	148.3	169.6	-55.6	-74.8	0	0	0	116.8
324	L	29.2	Very low	26.9	Very low	165 Å²	165	139 Å²	139	86%	0.864	78%	0.781	S	S	*	*			cis	-119	154.3	10.2	-78.6	164.6	0	0	0	114.2
325	T	26.6	Very low	27	Very low	105 Å²	105	134.3 Å²	134.3	64%	0.644	77%	0.77	S	S	*	*			trans	-89.4	163	179	48.4	0	0	0	0	113.8
326	I	30.6	Very low	26.8	Very low	161 Å²	161	133 Å²	133	83%	0.826	77%	0.769	S	S	*	*				-148.8	121.6	122.3	-95.6	144.8	0	0	0	109.7
327	N	26.2	Very low	26.9	Very low	134 Å²	134	136.1 Å²	136.1	72%	0.717	78%	0.78	S	S	*	*			trans	6.3	149.6	154.3	-51.4	-22.2	0	0	0	120.5
328	T	31.7	Very low	27	Very low	123 Å²	123	132.2 Å²	132.2	76%	0.755	77%	0.765	S	S	*	*			cis	-143.4	149.8	29.2	48.3	0	0	0	0	116.5
329	S	28.6	Very low	27	Very low	114 Å²	114	135.9 Å²	135.9	80%	0.797	77%	0.77	S	S	*	*			trans	66.3	136.5	152.2	53.7	0	0	0	0	120.5
330	P	26.9	Very low	27.1	Very low	114 Å²	114	132.6 Å²	132.6	74%	0.74	76%	0.763	S	S	*	*			trans	-105.4	149.9	-172.7	39.3	-32.8	0	0	0	114.7
331	I	29.8	Very low	26.9	Very low	170 Å²	170	134.8 Å²	134.8	87%	0.872	76%	0.763	S	S	*	*			trans	-122.3	86.7	159.3	-57.7	178.7	0	0	0	107.2
332	N	24.9	Very low	27	Very low	167 Å²	167	139.8 Å²	139.8	89%	0.893	77%	0.767	S	S	*	*			trans	-153.3	51.5	175.4	-115.6	-3.7	0	0	0	110.2
333	S	25.3	Very low	27	Very low	106 Å²	106	141.4 Å²	141.4	74%	0.741	77%	0.773	S	S	*	*	S	Bend	trans	-150.6	48.3	-178.9	64.6	0	0	0	0	111.5
334	L	24.6	Very low	26.9	Very low	168 Å²	168	139.6 Å²	139.6	88%	0.88	77%	0.77	S	S	*	*			trans	-170.6	156.7	167.4	-106.6	159.7	0	0	0	109.1
335	I	30.3	Very low	26.8	Very low	141 Å²	141	135.9 Å²	135.9	72%	0.723	76%	0.757	S	S	*	*			trans	78.1	63.8	-169.1	-45.2	170.5	0	0	0	112.7	T337	I335-T337 PolarHBondContact O-N 3.18Å
336	D	25	Very low	26.8	Very low	129 Å²	129	137.3 Å²	137.3	69%	0.69	76%	0.761	S	S	*	*			trans	-53.1	132.3	144.4	-172.5	-47.2	0	0	0	107.8	S338	D336-S338 PolarHBondContact O-N 3.36Å; D336-S338 WeakPolarHBondContact OD1-CB 3.19Å; D336-S338 PolarHBondContact OD1-N 3.06Å; D336-S338 PolarHBondContact OD1-OG 3.38Å
337	T	28.7	Very low	26.8	Very low	141 Å²	141	134.9 Å²	134.9	87%	0.865	75%	0.75	S	S	*	*	S	Bend	trans	-93	30.7	-171.6	-15.6	0	0	0	0	113	I335	I335-T337 PolarHBondContact O-N 3.18Å
338	S	26.4	Very low	27.1	Very low	75 Å²	75	135.6 Å²	135.6	52%	0.524	74%	0.743	S	S	.	*	S	Bend	trans	-123.1	147.4	171.7	68	0	0	0	0	111.4	D336	D336-S338 PolarHBondContact O-N 3.36Å; D336-S338 WeakPolarHBondContact OD1-CB 3.19Å; D336-S338 PolarHBondContact OD1-N 3.06Å; D336-S338 PolarHBondContact OD1-OG 3.38Å
339	Q	25.4	Very low	27.1	Very low	187 Å²	187	135.7 Å²	135.7	87%	0.874	73%	0.729	S	S	*	*			trans	62.6	59.6	-179.1	-50.7	-160.8	34.8	0	0	117.4	Q341	Q339-Q341 VanDerWaalsContact C-N 3.27Å; Q339-Q341 PolarHBondContact O-N 2.91Å
340	G	26.6	Very low	27.4	Very low	66 Å²	66	136.4 Å²	136.4	68%	0.68	72%	0.724	S	S	*	*			trans	-76	53	172.6	0	0	0	0	0	116.2	Y342	G340-Y342 VanDerWaalsContact C-N 3.34Å; G340-Y342 PolarHBondContact O-N 2.83Å
341	Q	22.9	Very low	27.7	Very low	175 Å²	175	135 Å²	135	82%	0.818	71%	0.71	S	S	*	*			trans	-72.9	87.1	167.3	-82.2	-165.4	-6.2	0	0	110.4	Q339 T343	Q339-Q341 VanDerWaalsContact C-N 3.27Å; Q339-Q341 PolarHBondContact O-N 2.91Å; Q341-T343 VanDerWaalsContact C-N 3.34Å; Q341-T343 PolarHBondContact O-N 3.49Å
342	Y	26.7	Very low	27.7	Very low	210 Å²	210	131.8 Å²	131.8	82%	0.824	70%	0.701	S	S	*	*			trans	-71.3	89.9	168.3	-71.9	-76.8	0	0	0	110.3	G340 F344	G340-Y342 VanDerWaalsContact C-N 3.34Å; G340-Y342 PolarHBondContact O-N 2.83Å; Y342-F344 PolarHBondContact O-N 3.13Å
343	T	23.8	Very low	28.1	Very low	119 Å²	119	126.7 Å²	126.7	73%	0.73	68%	0.678	S	S	*	*			trans	-58.4	125.3	164.7	47.1	0	0	0	0	109.3	Q341 S345	Q341-T343 VanDerWaalsContact C-N 3.34Å; Q341-T343 PolarHBondContact O-N 3.49Å; T343-S345 PolarHBondContact O-N 3.16Å; T343-S345 VanDerWaalsContact O-N 3.11Å
344	F	25.6	Very low	28.5	Very low	161 Å²	161	123.5 Å²	123.5	71%	0.706	66%	0.658	S	S	*	*			trans	-69.5	105.2	165.4	-88.2	-102.2	0	0	0	107.4	Y342 D346	Y342-F344 PolarHBondContact O-N 3.13Å; F344-D346 PolarHBondContact O-N 3.35Å
345	S	26.3	Very low	29.1	Very low	87 Å²	87	119.7 Å²	119.7	61%	0.608	65%	0.646	S	S	*	*			trans	-73.6	118	166	57.5	0	0	0	0	108.8	T343 N347	T343-S345 PolarHBondContact O-N 3.16Å; T343-S345 VanDerWaalsContact O-N 3.11Å; S345-N347 PolarHBondContact O-N 3.43Å
346	D	27.7	Very low	29.6	Very low	136 Å²	136	117.1 Å²	117.1	73%	0.727	63%	0.631	S	S	*	*	S	Bend	trans	-67	3.6	-168.4	-70.9	-63.8	0	0	0	116.3	F344 W348	F344-D346 PolarHBondContact O-N 3.35Å; D346-W348 PolarHBondContact O-N 2.85Å
347	N	30.4	Very low	30.4	Very low	109 Å²	109	113 Å²	113	58%	0.583	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.1	33.2	-173.1	-56.5	23.4	0	0	0	113.8	S345 W349	S345-N347 PolarHBondContact O-N 3.43Å; N347-W349 PolarHBondContact O-N 3.42Å
348	W	31	Very low	31	Very low	150 Å²	150	107.4 Å²	107.4	57%	0.568	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64	-20.6	170.2	-93.4	48	0	0	0	112.7	D346 M655	D346-W348 PolarHBondContact O-N 2.85Å; W348-M655 HydrophobicContact CZ3-CG 4.29Å
349	W	32.8	Very low	31.4	Very low	124 Å²	124	105.2 Å²	105.2	47%	0.47	56%	0.56	S	S	.	*	S	Bend	trans	-81.7	-28.1	-175	-60.1	97.3	0	0	0	113.9	N347 N351 R648	N347-W349 PolarHBondContact O-N 3.42Å; W349-N351 VanDerWaalsContact C-N 3.27Å; W349-N351 PolarHBondContact O-N 3.1Å; W349-R648 HydrophobicContact CD2-CG 4.28Å; W349-R648 HydrophobicContact CE3-CG 4.45Å; W349-R648 HydrophobicContact CH2-CB 4Å; W349-R648 HydrophobicContact CH2-CG 3.69Å; W349-R648 HydrophobicContact CZ2-CB 3.53Å; W349-R648 HydrophobicContact CZ2-CG 3.43Å; W349-R648 VanDerWaalsContact CZ2-CG 3.43Å; W349-R648 HydrophobicContact CZ3-CG 4.17Å
350	D	34	Very low	32.3	Very low	129 Å²	129	98.2 Å²	98.2	69%	0.69	53%	0.529	S	S	*	.	S	Bend	trans	-84.9	-2.3	-179.8	-52.6	-57.3	0	0	0	112.8	P352	D350-P352 VanDerWaalsContact O-CD 3.3Å; D350-P352 WeakPolarHBondContact O-CD 3.15Å
351	N	32.6	Very low	33.1	Very low	84 Å²	84	98.2 Å²	98.2	45%	0.449	51%	0.513	S	S	.	.			trans	-96.9	105.2	-179	-166.7	-19.6	0	0	0	110.6	W349 S353 A354	W349-N351 VanDerWaalsContact C-N 3.27Å; W349-N351 PolarHBondContact O-N 3.1Å; N351-S353 PolarHBondContact O-N 3.32Å; N351-S353 WeakPolarHBondContact OD1-CB 3.45Å; N351-S353 PolarHBondContact OD1-N 2.73Å; N351-S353 PolarHBondContact OD1-OG 2.94Å; N351-A354 PolarHBondContact O-N 3.14Å
352	P	29.7	Very low	34.1	Very low	104 Å²	104	92 Å²	92	68%	0.675	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-17.6	-178.7	23.9	-34.1	0	0	0	113.2	D350 A354 S355 Q356	D350-P352 VanDerWaalsContact O-CD 3.3Å; D350-P352 WeakPolarHBondContact O-CD 3.15Å; P352-A354 PolarHBondContact O-N 2.97Å; P352-S355 PolarHBondContact O-N 3.42Å; P352-Q356 WeakPolarHBondContact O-CB 3.18Å; P352-Q356 PolarHBondContact O-N 3.2Å
353	S	35.3	Very low	34.8	Very low	59 Å²	59	87.9 Å²	87.9	41%	0.413	47%	0.468	S	S	.	.	H	α-helix	trans	-52.6	-35.2	170.1	-52.5	0	0	0	0	113.3	N351 Q356 I357	N351-S353 PolarHBondContact O-N 3.32Å; N351-S353 WeakPolarHBondContact OD1-CB 3.45Å; N351-S353 PolarHBondContact OD1-N 2.73Å; N351-S353 PolarHBondContact OD1-OG 2.94Å; S353-Q356 PolarHBondContact O-N 2.97Å; S353-I357 WeakPolarHBondContact O-CB 3.16Å; S353-I357 VanDerWaalsContact O-CD1 3.32Å; S353-I357 WeakPolarHBondContact O-CD1 3.45Å; S353-I357 WeakPolarHBondContact O-CG1 3.29Å; S353-I357 PolarHBondContact O-N 3.47Å
354	A	33.8	Very low	35.9	Very low	40 Å²	40	84.9 Å²	84.9	33%	0.331	45%	0.446	S	S	.	.	H	α-helix	trans	-66.9	-47	-177.4	0	0	0	0	0	112.1	N351 P352 Q356 V358	N351-A354 PolarHBondContact O-N 3.14Å; P352-A354 PolarHBondContact O-N 2.97Å; A354-Q356 VanDerWaalsContact C-N 3.34Å; A354-V358 PolarHBondContact O-N 2.88Å
355	S	36	Very low	36.5	Very low	87 Å²	87	78.5 Å²	78.5	61%	0.608	42%	0.42	S	S	*	.	H	α-helix	trans	-67.8	-35.1	174.6	-169	0	0	0	0	111.8	P352 V358 A359	P352-S355 PolarHBondContact O-N 3.42Å; S355-V358 VanDerWaalsContact O-CB 3.28Å; S355-V358 WeakPolarHBondContact O-CB 3.4Å; S355-V358 WeakPolarHBondContact O-CG1 3.21Å; S355-V358 PolarHBondContact O-N 3.33Å; S355-A359 WeakPolarHBondContact O-CB 3.44Å; S355-A359 PolarHBondContact O-N 3.43Å
356	Q	40.5	Very low	36.8	Very low	88 Å²	88	81.4 Å²	81.4	41%	0.411	42%	0.424	S	S	.	.	H	α-helix	trans	-68.8	-41.5	176.5	-175.2	63.3	27.9	0	0	112.8	P352 S353 A354 V358 A359 D360	P352-Q356 WeakPolarHBondContact O-CB 3.18Å; P352-Q356 PolarHBondContact O-N 3.2Å; S353-Q356 PolarHBondContact O-N 2.97Å; A354-Q356 VanDerWaalsContact C-N 3.34Å; Q356-V358 VanDerWaalsContact C-N 3.26Å; Q356-V358 PolarHBondContact O-N 3.01Å; Q356-A359 PolarHBondContact O-N 3.39Å; Q356-A359 VanDerWaalsContact O-N 3.15Å; Q356-D360 WeakPolarHBondContact CG-OD2 3.32Å; Q356-D360 PolarHBondContact NE2-OD1 3.13Å; Q356-D360 PolarHBondContact NE2-OD2 3.26Å; Q356-D360 WeakPolarHBondContact O-CB 3.49Å; Q356-D360 VanDerWaalsContact O-CG 3.22Å; Q356-D360 PolarHBondContact O-N 3.3Å
357	I	42.6	Very low	37	Very low	43 Å²	43	80.8 Å²	80.8	22%	0.221	42%	0.42	C	S	.	.	H	α-helix	trans	-54.3	-46.7	171.8	-76.5	159.8	0	0	0	110.3	S353 L361 R678	S353-I357 WeakPolarHBondContact O-CB 3.16Å; S353-I357 VanDerWaalsContact O-CD1 3.32Å; S353-I357 WeakPolarHBondContact O-CD1 3.45Å; S353-I357 WeakPolarHBondContact O-CG1 3.29Å; S353-I357 PolarHBondContact O-N 3.47Å; I357-L361 HydrophobicContact CG2-CD1 3.84Å; I357-L361 WeakPolarHBondContact O-CB 3.13Å; I357-L361 WeakPolarHBondContact O-CD1 3.17Å; I357-L361 WeakPolarHBondContact O-CG 3.36Å; I357-L361 PolarHBondContact O-N 3.06Å; I357-L361 VanDerWaalsContact O-N 3.15Å; I357-R678 HydrophobicContact CG1-CG 4.48Å
358	V	40.6	Very low	37	Very low	23 Å²	23	79.3 Å²	79.3	14%	0.139	42%	0.418	C	S	.	.	H	α-helix	trans	-57.5	-48.9	174.6	140.4	0	0	0	0	112	A354 S355 Q356 L362 Q645	A354-V358 PolarHBondContact O-N 2.88Å; S355-V358 VanDerWaalsContact O-CB 3.28Å; S355-V358 WeakPolarHBondContact O-CB 3.4Å; S355-V358 WeakPolarHBondContact O-CG1 3.21Å; S355-V358 PolarHBondContact O-N 3.33Å; Q356-V358 VanDerWaalsContact C-N 3.26Å; Q356-V358 PolarHBondContact O-N 3.01Å; V358-L362 WeakPolarHBondContact O-CB 3.37Å; V358-L362 WeakPolarHBondContact O-CG 3.22Å; V358-L362 PolarHBondContact O-N 3.16Å; V358-Q645 HydrophobicContact CB-CG 4.12Å; V358-Q645 HydrophobicContact CG1-CG 3.59Å; V358-Q645 HydrophobicContact CG2-CG 3.44Å; V358-Q645 VanDerWaalsContact CG2-CG 3.44Å
359	A	36.1	Very low	37.1	Very low	29 Å²	29	76.6 Å²	76.6	24%	0.24	42%	0.418	C	S	.	.	H	α-helix	trans	-70.7	-33	-176.9	0	0	0	0	0	113.1	S355 Q356 R363	S355-A359 WeakPolarHBondContact O-CB 3.44Å; S355-A359 PolarHBondContact O-N 3.43Å; Q356-A359 PolarHBondContact O-N 3.39Å; Q356-A359 VanDerWaalsContact O-N 3.15Å; A359-R363 WeakPolarHBondContact O-CB 3.23Å; A359-R363 WeakPolarHBondContact O-CG 3.22Å; A359-R363 PolarHBondContact O-N 3.14Å
360	D	42.5	Very low	37	Very low	39 Å²	39	75.2 Å²	75.2	21%	0.209	43%	0.427	C	S	.	.	H	α-helix	trans	-74.6	-45	-179.8	-66.9	-25.6	0	0	0	111.8	Q356 L362 R363 E364 R678	Q356-D360 WeakPolarHBondContact CG-OD2 3.32Å; Q356-D360 PolarHBondContact NE2-OD1 3.13Å; Q356-D360 PolarHBondContact NE2-OD2 3.26Å; Q356-D360 WeakPolarHBondContact O-CB 3.49Å; Q356-D360 VanDerWaalsContact O-CG 3.22Å; Q356-D360 PolarHBondContact O-N 3.3Å; D360-L362 PolarHBondContact O-N 2.82Å; D360-R363 PolarHBondContact O-N 3.1Å; D360-R363 VanDerWaalsContact O-N 3.11Å; D360-R363 IonicContact OD1-CZ 3.75Å; D360-R363 IonicContact OD1-NE 2.67Å; D360-R363 PolarHBondContact OD1-NE 3.2Å; D360-R363 IonicContact OD1-NH2 2.79Å; D360-R363 PolarHBondContact OD1-NH2 3.44Å; D360-E364 PolarHBondContact O-N 3.33Å; D360-R678 IonicContact OD2-NH1 3.92Å; D360-R678 IonicContact OD2-NH2 2.97Å
361	L	44.6	Very low	36.9	Very low	67 Å²	67	72.1 Å²	72.1	35%	0.351	42%	0.42	S	S	.	.	H	α-helix	trans	-63	-27	174	-69.2	166.6	0	0	0	112.3	I357 T365 V641	I357-L361 HydrophobicContact CG2-CD1 3.84Å; I357-L361 WeakPolarHBondContact O-CB 3.13Å; I357-L361 WeakPolarHBondContact O-CD1 3.17Å; I357-L361 WeakPolarHBondContact O-CG 3.36Å; I357-L361 PolarHBondContact O-N 3.06Å; I357-L361 VanDerWaalsContact O-N 3.15Å; L361-T365 WeakPolarHBondContact O-CG2 3.5Å; L361-T365 PolarHBondContact O-N 3.2Å; L361-T365 PolarHBondContact O-OG1 3Å; L361-V641 HydrophobicContact CB-CG1 3.95Å; L361-V641 HydrophobicContact CD1-CG1 3.82Å; L361-V641 HydrophobicContact CD1-CG2 3.97Å
362	L	42.8	Very low	36.7	Very low	45 Å²	45	73 Å²	73	24%	0.236	43%	0.425	C	S	.	.	H	α-helix	trans	-77.6	-40.7	170.1	-74.6	177.2	0	0	0	113.4	V358 D360 T365 Q366 R642	V358-L362 WeakPolarHBondContact O-CB 3.37Å; V358-L362 WeakPolarHBondContact O-CG 3.22Å; V358-L362 PolarHBondContact O-N 3.16Å; D360-L362 PolarHBondContact O-N 2.82Å; L362-T365 PolarHBondContact O-N 3.14Å; L362-T365 PolarHBondContact O-OG1 3.38Å; L362-T365 VanDerWaalsContact O-OG1 3.13Å; L362-Q366 PolarHBondContact O-N 3.09Å; L362-Q366 VanDerWaalsContact O-N 3.08Å; L362-R642 HydrophobicContact CD2-CG 3.92Å
363	R	42.7	Very low	36.7	Very low	123 Å²	123	72.7 Å²	72.7	46%	0.464	42%	0.421	S	S	.	.	H	α-helix	trans	-60.5	-48.5	176.2	-86.5	-176.4	-83.2	-102.5	0.8	112	A359 D360 T365 Q366 L367	A359-R363 WeakPolarHBondContact O-CB 3.23Å; A359-R363 WeakPolarHBondContact O-CG 3.22Å; A359-R363 PolarHBondContact O-N 3.14Å; D360-R363 PolarHBondContact O-N 3.1Å; D360-R363 VanDerWaalsContact O-N 3.11Å; D360-R363 IonicContact OD1-CZ 3.75Å; D360-R363 IonicContact OD1-NE 2.67Å; D360-R363 PolarHBondContact OD1-NE 3.2Å; D360-R363 IonicContact OD1-NH2 2.79Å; D360-R363 PolarHBondContact OD1-NH2 3.44Å; R363-T365 VanDerWaalsContact C-N 3.3Å; R363-T365 PolarHBondContact O-N 2.99Å; R363-Q366 PolarHBondContact O-N 3.41Å; R363-L367 PolarHBondContact O-N 3.42Å; R363-L367 VanDerWaalsContact O-N 3.13Å
364	E	45.6	Very low	36.3	Very low	56 Å²	56	76 Å²	76	26%	0.262	44%	0.443	S	S	.	.	H	α-helix	trans	-64.5	-35.5	179.5	-68	-157.8	131.5	0	0	112.3	D360 L367 S368	D360-E364 PolarHBondContact O-N 3.33Å; E364-L367 PolarHBondContact O-N 2.87Å; E364-S368 PolarHBondContact O-N 2.86Å
365	T	39.3	Very low	36.2	Very low	26 Å²	26	80.3 Å²	80.3	16%	0.16	46%	0.46	C	S	.	.	H	α-helix	trans	-72	-34.2	178.1	49.4	0	0	0	0	112.8	L361 L362 R363 S368 V369 V638	L361-T365 WeakPolarHBondContact O-CG2 3.5Å; L361-T365 PolarHBondContact O-N 3.2Å; L361-T365 PolarHBondContact O-OG1 3Å; L362-T365 PolarHBondContact O-N 3.14Å; L362-T365 PolarHBondContact O-OG1 3.38Å; L362-T365 VanDerWaalsContact O-OG1 3.13Å; R363-T365 VanDerWaalsContact C-N 3.3Å; R363-T365 PolarHBondContact O-N 2.99Å; T365-S368 PolarHBondContact O-N 2.82Å; T365-S368 PolarHBondContact O-OG 3.48Å; T365-V369 WeakPolarHBondContact O-CG2 3.43Å; T365-V369 PolarHBondContact O-N 3.23Å; T365-V369 VanDerWaalsContact O-N 3.13Å; T365-V638 HydrophobicContact CG2-CB 4.47Å; T365-V638 HydrophobicContact CG2-CG1 3.81Å; T365-V638 HydrophobicContact CG2-CG2 3.75Å
366	Q	33	Very low	35.9	Very low	148 Å²	148	81.4 Å²	81.4	69%	0.692	47%	0.465	S	S	*	.	H	α-helix	trans	-65.3	-38.2	170.8	-72.2	-170.5	-6.1	0	0	112.8	L362 R363 S368 V369 S370	L362-Q366 PolarHBondContact O-N 3.09Å; L362-Q366 VanDerWaalsContact O-N 3.08Å; R363-Q366 PolarHBondContact O-N 3.41Å; Q366-S368 VanDerWaalsContact C-N 3.3Å; Q366-S368 PolarHBondContact O-N 3.46Å; Q366-V369 PolarHBondContact O-N 2.96Å; Q366-S370 PolarHBondContact O-N 3.35Å; Q366-S370 PolarHBondContact O-OG 3.3Å
367	L	31.1	Very low	35.4	Very low	123 Å²	123	82.8 Å²	82.8	64%	0.644	48%	0.481	S	S	*	.	H	α-helix	trans	-66.6	-28.5	173.2	-71.3	167.6	0	0	0	113.1	R363 E364 S370	R363-L367 PolarHBondContact O-N 3.42Å; R363-L367 VanDerWaalsContact O-N 3.13Å; E364-L367 PolarHBondContact O-N 2.87Å; L367-S370 PolarHBondContact O-OG 2.99Å
368	S	30.9	Very low	34.8	Very low	78 Å²	78	91.1 Å²	91.1	55%	0.545	52%	0.516	S	S	.	.	H	α-helix	trans	-75	-33.4	174.7	77.1	0	0	0	0	113.5	E364 T365 Q366	E364-S368 PolarHBondContact O-N 2.86Å; T365-S368 PolarHBondContact O-N 2.82Å; T365-S368 PolarHBondContact O-OG 3.48Å; Q366-S368 VanDerWaalsContact C-N 3.3Å; Q366-S368 PolarHBondContact O-N 3.46Å
369	V	33	Very low	34.3	Very low	93 Å²	93	95.1 Å²	95.1	56%	0.564	55%	0.545	S	S	*	.	H	α-helix	trans	-77.6	-36	-177.3	169.7	0	0	0	0	111.8	T365 Q366 A371	T365-V369 WeakPolarHBondContact O-CG2 3.43Å; T365-V369 PolarHBondContact O-N 3.23Å; T365-V369 VanDerWaalsContact O-N 3.13Å; Q366-V369 PolarHBondContact O-N 2.96Å; V369-A371 PolarHBondContact O-N 2.89Å
370	S	30.3	Very low	33.9	Very low	95 Å²	95	98.2 Å²	98.2	66%	0.664	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.1	-11.1	178.3	56.1	0	0	0	0	114.3	Q366 L367	Q366-S370 PolarHBondContact O-N 3.35Å; Q366-S370 PolarHBondContact O-OG 3.3Å; L367-S370 PolarHBondContact O-OG 2.99Å
371	A	31.3	Very low	33.2	Very low	65 Å²	65	104 Å²	104	54%	0.537	60%	0.6	S	S	.	*	T	Hydrogen-bonded Turn	trans	-88.4	-29.7	-177.6	0	0	0	0	0	114.9	V369	V369-A371 PolarHBondContact O-N 2.89Å
372	N	28.4	Very low	32.3	Very low	103 Å²	103	111.7 Å²	111.7	55%	0.551	63%	0.627	S	S	*	*	S	Bend	trans	-159.9	77.2	-176.2	-76.5	-85.2	0	0	0	114.3	K482	N372-K482 PolarHBondContact OD1-NZ 3.49Å
373	T	30.9	Very low	31.7	Very low	97 Å²	97	116.9 Å²	116.9	60%	0.595	65%	0.65	S	S	*	*			trans	-172.1	118.4	143.9	21.2	0	0	0	0	112	I375	T373-I375 HydrophobicContact CG2-CD1 3.57Å; T373-I375 HydrophobicContact CG2-CG1 3.95Å; T373-I375 PolarHBondContact O-N 3.33Å
374	S	25.4	Very low	31	Very low	127 Å²	127	116.2 Å²	116.2	89%	0.888	66%	0.661	S	S	*	*			trans	-88	85.2	162.5	56.1	0	0	0	0	109.7
375	I	32.8	Very low	30.2	Very low	132 Å²	132	124.8 Å²	124.8	68%	0.677	69%	0.691	S	S	*	*			trans	-125.7	120.1	174.9	-60.5	176.6	0	0	0	107.7	T373	T373-I375 HydrophobicContact CG2-CD1 3.57Å; T373-I375 HydrophobicContact CG2-CG1 3.95Å; T373-I375 PolarHBondContact O-N 3.33Å
376	P	29	Very low	29.6	Very low	110 Å²	110	131.8 Å²	131.8	71%	0.714	72%	0.722	S	S	*	*			trans	-71.8	144.1	-179	29.5	-34.4	0	0	0	111.4
377	P	30.6	Very low	29.4	Very low	117 Å²	117	134.5 Å²	134.5	76%	0.76	73%	0.728	S	S	*	*			trans	-70.4	140.6	178.2	29.6	-34.4	0	0	0	111.6	S379	P377-S379 PolarHBondContact O-N 2.96Å
378	K	30.2	Very low	29.2	Very low	217 Å²	217	134.9 Å²	134.9	94%	0.943	73%	0.726	S	S	*	*			trans	-82.3	106.1	171	-78	-172	173.2	-173.5	0	110.4
379	S	29	Very low	29	Very low	107 Å²	107	138.4 Å²	138.4	75%	0.748	73%	0.734	S	S	*	*			trans	-156.5	74.4	172	58.5	0	0	0	0	113.4	P377	P377-S379 PolarHBondContact O-N 2.96Å
380	A	28.1	Very low	28.8	Very low	94 Å²	94	142.8 Å²	142.8	78%	0.777	75%	0.75	S	S	*	*			trans	-162	155.5	161.8	0	0	0	0	0	112.3
381	L	29	Very low	28.7	Very low	160 Å²	160	145.8 Å²	145.8	84%	0.838	76%	0.758	S	S	*	*			trans	59.3	72.8	162.3	-55.3	-175.4	0	0	0	118.3
382	Y	25.5	Very low	28.9	Very low	230 Å²	230	147.9 Å²	147.9	90%	0.902	77%	0.765	S	S	*	*			trans	-81.8	108.6	139.7	-140.7	-88.1	0	0	0	107.5
383	Q	29.4	Very low	28.8	Very low	154 Å²	154	148.4 Å²	148.4	72%	0.72	78%	0.777	S	S	*	*			trans	-151.5	128.1	161.7	-82.2	-153.4	-9.6	0	0	110.3
384	P	27.9	Very low	28.6	Very low	109 Å²	109	147.8 Å²	147.8	71%	0.708	78%	0.782	S	S	*	*			trans	-103.5	131	177	35.8	-28.3	0	0	0	112.2
385	W	29.5	Very low	28.6	Very low	236 Å²	236	146.5 Å²	146.5	89%	0.894	77%	0.773	S	S	*	*			trans	-142.3	129.2	162.1	-74.1	103.1	0	0	0	110.5
386	Q	26.2	Very low	28.5	Very low	172 Å²	172	149.5 Å²	149.5	80%	0.804	78%	0.781	S	S	*	*			trans	-85	153	169.7	-60.2	159.4	-80.7	0	0	109.2
387	Y	29.3	Very low	28.5	Very low	206 Å²	206	149.5 Å²	149.5	81%	0.808	78%	0.784	S	S	*	*				-164.8	175	109.3	-122.9	-93.9	0	0	0	112.6
388	Q	27.1	Very low	28.7	Very low	130 Å²	130	149 Å²	149	61%	0.607	78%	0.781	S	S	*	*			trans	-83.3	150.3	-159.1	-72.7	167.9	-98	0	0	116.6
389	E	26.8	Very low	28.8	Very low	152 Å²	152	144 Å²	144	71%	0.71	77%	0.773	S	S	*	*				32.9	126.9	128.9	-50.5	170.4	109.1	0	0	120.1
390	M	28	Very low	29	Very low	185 Å²	185	143.3 Å²	143.3	91%	0.911	77%	0.774	S	S	*	*				-167.2	173.9	96.1	-99.9	-166.8	-179.9	0	0	112.2
391	I	29.2	Very low	29.3	Very low	159 Å²	159	143.8 Å²	143.8	82%	0.815	77%	0.771	S	S	*	*			trans	-107.5	-164	-165.7	-27.5	-178.3	0	0	0	110.7
392	P	34.9	Very low	29.6	Very low	108 Å²	108	145.9 Å²	145.9	70%	0.701	77%	0.768	S	S	*	*				-115.1	180	-114.9	39.6	-24.7	0	0	0	116.5
393	S	26.5	Very low	30.1	Very low	115 Å²	115	143.4 Å²	143.4	80%	0.804	76%	0.762	S	S	*	*				125.8	156.8	124.8	76.4	0	0	0	0	119.2
394	A	26.2	Very low	30.3	Very low	83 Å²	83	140.6 Å²	140.6	69%	0.686	76%	0.76	S	S	*	*			trans	68.7	92.3	149.5	0	0	0	0	0	122.2
395	S	26.3	Very low	30.7	Very low	101 Å²	101	141.4 Å²	141.4	71%	0.706	76%	0.762	S	S	*	*				94.6	157.4	117.3	83.9	0	0	0	0	122
396	K	29.8	Very low	30.8	Very low	194 Å²	194	140.9 Å²	140.9	84%	0.843	76%	0.76	S	S	*	*			trans	75.9	102.5	160.9	-64.8	171	-174.5	174.3	0	119.6
397	S	28.4	Very low	31.3	Very low	110 Å²	110	139.7 Å²	139.7	77%	0.769	76%	0.758	S	S	*	*			trans	-71.1	-178.8	145	60.4	0	0	0	0	111.1
398	P	36.6	Very low	31.5	Very low	108 Å²	108	141.5 Å²	141.5	70%	0.701	76%	0.763	S	S	*	*			cis	-143	-176.3	8.5	43.9	-25.1	0	0	0	117.9
399	S	31.6	Very low	31.9	Very low	110 Å²	110	139.2 Å²	139.2	77%	0.769	78%	0.775	S	S	*	*			trans	87.3	127.1	142.7	78.2	0	0	0	0	121.8
400	A	32.9	Very low	32.3	Very low	93 Å²	93	135 Å²	135	77%	0.769	77%	0.772	S	S	*	*				137.4	135.6	108	0	0	0	0	0	116.2
401	S	34	Very low	32.6	Very low	105 Å²	105	137.2 Å²	137.2	73%	0.734	77%	0.772	S	S	*	*			trans	71.8	139.1	150.5	166	0	0	0	0	118.9
402	R	35.7	Very low	32.7	Very low	203 Å²	203	134.3 Å²	134.3	77%	0.766	76%	0.764	S	S	*	*			cis	-167.4	155.4	-3.5	-112.1	172	176.1	173.4	-0.3	112.1
403	K	36	Very low	32.7	Very low	178 Å²	178	140.1 Å²	140.1	77%	0.774	77%	0.772	S	S	*	*			trans	69.6	149.2	148.9	-71.7	176.3	178.2	-174.9	0	118.9
404	S	33.5	Very low	32.8	Very low	96 Å²	96	145.7 Å²	145.7	67%	0.671	78%	0.776	S	S	*	*			cis	-173.6	165.3	-13.1	50.5	0	0	0	0	114.1
405	V	36.4	Very low	33.1	Very low	126 Å²	126	150.1 Å²	150.1	76%	0.764	78%	0.779	S	S	*	*			trans	75.3	130.5	155.2	154.3	0	0	0	0	115.8
406	R	32.5	Very low	33.2	Very low	225 Å²	225	151.7 Å²	151.7	85%	0.849	78%	0.775	S	S	*	*			cis	-166.4	-157.8	-8.9	-135	177.5	-169.8	166.5	2.7	106.8
407	I	36.1	Very low	33.4	Very low	147 Å²	147	148 Å²	148	75%	0.754	77%	0.771	S	S	*	*			cis	-126.2	-88	5.7	-65.4	177.6	0	0	0	112.3
408	R	33.9	Very low	33.5	Very low	244 Å²	244	147.3 Å²	147.3	92%	0.921	77%	0.766	S	S	*	*			trans	-162.6	162.5	-167.4	-66.3	172.2	176.6	162.4	-5.1	109.1
409	G	34.5	Very low	32.9	Very low	82 Å²	82	151 Å²	151	85%	0.845	77%	0.774	S	S	*	*			cis	157	163.9	-2.5	0	0	0	0	0	110.4
410	G	35.5	Very low	32.8	Very low	63 Å²	63	151.7 Å²	151.7	65%	0.649	78%	0.777	S	S	*	*			cis	168	-176.9	-6	0	0	0	0	0	113.3
411	Y	34.1	Very low	32.5	Very low	232 Å²	232	152.1 Å²	152.1	91%	0.91	78%	0.775	S	S	*	*			trans	71.4	140.5	168.9	-63.6	-87.6	0	0	0	118.4
412	C	32.4	Very low	32.1	Very low	98 Å²	98	158.2 Å²	158.2	66%	0.662	78%	0.782	S	S	*	*			cis	-169.1	171	-21.4	-137.6	0	0	0	0	107.7
413	R	33.6	Very low	31.8	Very low	229 Å²	229	154.1 Å²	154.1	86%	0.864	78%	0.78	S	S	*	*			cis	-130	-178.2	8.5	-59.1	-179.6	171.4	174.3	-2.7	107.9
414	R	29.6	Very low	31.5	Very low	233 Å²	233	153.7 Å²	153.7	88%	0.879	78%	0.78	S	S	*	*			cis	70.9	129.5	23.6	-65.4	179.9	173.3	-167.5	-3.6	114.3
415	K	31.1	Very low	31.1	Very low	175 Å²	175	155.4 Å²	155.4	76%	0.761	78%	0.781	S	S	*	*			cis	-138.3	177.6	11.1	-92	173.8	158.7	-132.2	0	108.4
416	H	29.5	Very low	30.9	Very low	134 Å²	134	157.2 Å²	157.2	62%	0.62	79%	0.787	S	S	*	*			cis	-161.1	161.7	-4.3	-123.4	-48.6	0	0	0	110
417	P	33.9	Very low	30.5	Very low	117 Å²	117	152.7 Å²	152.7	76%	0.76	78%	0.779	S	S	*	*			trans	-135.9	137.7	152.6	36.7	-23.1	0	0	0	114.8
418	S	29.6	Very low	30.3	Very low	95 Å²	95	153.3 Å²	153.3	66%	0.664	78%	0.783	S	S	*	*			trans	-176.8	138.7	164.5	51.1	0	0	0	0	113.6
419	E	25.5	Very low	30.1	Very low	185 Å²	185	146.7 Å²	146.7	86%	0.864	77%	0.77	S	S	*	*			trans	54	120.3	146.6	-64.2	166.6	-165.4	0	0	121.9
420	C	28.9	Very low	29.8	Very low	125 Å²	125	147.9 Å²	147.9	85%	0.845	76%	0.761	S	S	*	*				-172.9	124	112.1	-117.8	0	0	0	0	116.8
421	S	25.7	Very low	29.5	Very low	102 Å²	102	152.7 Å²	152.7	71%	0.713	76%	0.764	S	S	*	*			trans	-4.7	144.2	146.9	-52.1	0	0	0	0	123.8
422	R	26.2	Very low	29.3	Very low	233 Å²	233	149 Å²	149	88%	0.879	76%	0.756	S	S	*	*			trans	48.6	131.1	140.5	-67.1	175.8	163.4	170.6	-6	118.9
423	T	29.2	Very low	29.1	Very low	118 Å²	118	151 Å²	151	72%	0.724	76%	0.76	S	S	*	*				-168.2	155.1	71.9	29.7	0	0	0	0	114.9
424	Q	30.1	Very low	29.1	Very low	169 Å²	169	145.1 Å²	145.1	79%	0.79	75%	0.751	S	S	*	*			trans	48.1	124.9	143.2	-65.3	168.6	-20.7	0	0	121.8
425	L	25.3	Very low	29.3	Very low	131 Å²	131	138.5 Å²	138.5	69%	0.686	75%	0.746	S	S	*	*				82	113.8	63.6	-117.9	167.5	0	0	0	114.6
426	N	30.8	Very low	29.1	Very low	165 Å²	165	136.8 Å²	136.8	88%	0.882	74%	0.744	S	S	*	*			trans	-160.2	142.4	137.1	-103.1	-26.1	0	0	0	110.9
427	N	25.9	Very low	29.1	Very low	129 Å²	129	136.1 Å²	136.1	69%	0.69	75%	0.753	S	S	*	*			trans	-106.1	170.8	178.4	-70.2	-37	0	0	0	110.9
428	L	31.2	Very low	28.7	Very low	160 Å²	160	141.6 Å²	141.6	84%	0.838	76%	0.759	S	S	*	*			trans	168.4	105.6	143.5	-85.3	151.8	0	0	0	106.3
429	T	29.8	Very low	28.7	Very low	106 Å²	106	141.1 Å²	141.1	65%	0.65	76%	0.761	S	S	*	*				65	138.9	78.9	67.2	0	0	0	0	113.7
430	T	27	Very low	28.8	Very low	107 Å²	107	143.9 Å²	143.9	66%	0.656	76%	0.763	S	S	*	*			cis	-167.2	-176.1	13.6	-3.2	0	0	0	0	112.6
431	F	30.6	Very low	28.6	Very low	163 Å²	163	143 Å²	143	72%	0.715	76%	0.758	S	S	*	*			trans	79	115.1	164.2	-61.5	-67	0	0	0	117.5
432	Q	30	Very low	28.8	Very low	155 Å²	155	148.2 Å²	148.2	72%	0.724	77%	0.768	S	S	*	*				74.9	142	79.4	-74	-177.3	2	0	0	113.6
433	N	28.8	Very low	28.6	Very low	140 Å²	140	142.2 Å²	142.2	75%	0.749	76%	0.762	S	S	*	*			cis	-154.1	169.7	20.8	-130	-1.1	0	0	0	112.8
434	P	32.8	Very low	28.7	Very low	105 Å²	105	141.3 Å²	141.3	68%	0.682	76%	0.761	S	S	*	*			trans	-116.7	159.3	-175.9	40.8	-31.5	0	0	0	117.3
435	A	33.1	Very low	28.5	Very low	94 Å²	94	139.7 Å²	139.7	78%	0.777	76%	0.757	S	S	*	*			trans	-153.6	136.9	159.5	0	0	0	0	0	108.4
436	I	26.9	Very low	28.7	Very low	140 Å²	140	141.9 Å²	141.9	72%	0.718	76%	0.761	S	S	*	*			cis	89.8	90	30.6	-56.2	174.6	0	0	0	114.8
437	C	28.9	Very low	28.7	Very low	120 Å²	120	141.6 Å²	141.6	81%	0.811	76%	0.755	S	S	*	*			trans	-163.3	124.7	138.1	-99.9	0	0	0	0	106
438	R	25.8	Very low	28.8	Very low	232 Å²	232	142 Å²	142	88%	0.875	76%	0.757	S	S	*	*				58.6	131.5	62.6	-66.3	-176.1	177.2	159.4	0.2	112.5
439	A	30.2	Very low	28.7	Very low	85 Å²	85	141.2 Å²	141.2	70%	0.702	75%	0.754	S	S	*	*			cis	-135.9	139.5	13.9	0	0	0	0	0	112.1
440	R	28.8	Very low	28.7	Very low	243 Å²	243	142.1 Å²	142.1	92%	0.917	75%	0.754	S	S	*	*				71.4	126	101.7	-70.1	-171	167.4	179.8	-4.3	116.9
441	S	23.2	Very low	29	Very low	105 Å²	105	144.3 Å²	144.3	73%	0.734	76%	0.762	S	S	*	*			trans	-74	160.4	169	47.5	0	0	0	0	113.6
442	F	29.7	Very low	28.9	Very low	213 Å²	213	141.7 Å²	141.7	93%	0.934	76%	0.764	S	S	*	*			trans	-148.8	160.8	137.7	-103.9	-73.6	0	0	0	109.9
443	S	23.1	Very low	29	Very low	106 Å²	106	138 Å²	138	74%	0.741	77%	0.768	S	S	*	*			trans	-138.2	129.8	-177.5	179.9	0	0	0	0	109.5
444	S	31	Very low	29.1	Very low	100 Å²	100	138.3 Å²	138.3	70%	0.699	78%	0.775	S	S	*	*			trans	-178.3	108	159.2	45.4	0	0	0	0	109.8
445	D	25.3	Very low	29	Very low	134 Å²	134	140.1 Å²	140.1	72%	0.717	78%	0.779	S	S	*	*				46.5	156	116.1	-43	-36.1	0	0	0	122.5
446	F	30.4	Very low	28.9	Very low	177 Å²	177	139.2 Å²	139.2	78%	0.776	77%	0.767	S	S	*	*			trans	91.2	109.4	165.6	-67	-83	0	0	0	120.8
447	E	30.6	Very low	28.9	Very low	160 Å²	160	138.3 Å²	138.3	75%	0.748	77%	0.773	S	S	*	*			trans	69.3	103.4	134.9	-71.2	172.3	-166.1	0	0	121.6
448	D	27.4	Very low	28.9	Very low	137 Å²	137	141.3 Å²	141.3	73%	0.733	77%	0.772	S	S	*	*				21.4	115.7	115.1	-62.4	-16.8	0	0	0	118.1
449	N	30.3	Very low	28.9	Very low	143 Å²	143	137.6 Å²	137.6	77%	0.765	77%	0.769	S	S	*	*				-164.8	159.5	88.2	-111.2	-72.8	0	0	0	117.2
450	N	29.7	Very low	28.7	Very low	125 Å²	125	142.2 Å²	142.2	67%	0.668	78%	0.776	S	S	*	*			trans	-63.8	151.2	178.2	-55.4	-90.8	0	0	0	113.3
451	N	31.6	Very low	28.5	Very low	153 Å²	153	134.8 Å²	134.8	82%	0.818	76%	0.759	S	S	*	*				-166.1	147.1	103.4	-110.1	-52.9	0	0	0	118.1
452	S	29.9	Very low	28.6	Very low	109 Å²	109	136.3 Å²	136.3	76%	0.762	76%	0.759	S	S	*	*			trans	42.7	95.4	151.5	64.7	0	0	0	0	120.3
453	G	31.1	Very low	28.4	Very low	78 Å²	78	131.5 Å²	131.5	80%	0.804	74%	0.737	S	S	*	*			trans	-133.4	119.9	148.8	0	0	0	0	0	109.1
454	V	30.4	Very low	28.6	Very low	146 Å²	146	132.9 Å²	132.9	89%	0.885	74%	0.737	S	S	*	*			trans	-82.4	122.9	-175.1	176.5	0	0	0	0	110.2
455	D	32.4	Very low	28.4	Very low	143 Å²	143	133.2 Å²	133.2	77%	0.765	72%	0.723	S	S	*	*			trans	-142.5	100.7	160.9	-146.6	-8.7	0	0	0	115.6
456	S	31.1	Very low	28.7	Very low	75 Å²	75	131.7 Å²	131.7	52%	0.524	71%	0.711	S	S	.	*			trans	32.1	94.1	137.6	-37.6	0	0	0	0	119.5	K458	S456-K458 PolarHBondContact O-N 3.07Å
457	S	25.2	Very low	28.6	Very low	121 Å²	121	125 Å²	125	85%	0.846	69%	0.686	S	S	*	*			trans	-64.2	92.9	162.8	59.4	0	0	0	0	112.2
458	K	29.9	Very low	28.6	Very low	183 Å²	183	117.6 Å²	117.6	80%	0.796	65%	0.653	S	S	*	*			trans	-90.9	110.3	170.8	-79.1	176.6	177.9	164.9	0	110.8	S456 Q460	S456-K458 PolarHBondContact O-N 3.07Å; K458-Q460 PolarHBondContact O-N 3.31Å
459	L	25.8	Very low	29	Very low	154 Å²	154	117.8 Å²	117.8	81%	0.806	64%	0.643	S	S	*	*	P	Polyproline II helix	trans	-61.8	117.6	166.3	-71.2	92.4	0	0	0	109
460	Q	26.5	Very low	29.2	Very low	182 Å²	182	112.6 Å²	112.6	85%	0.85	62%	0.616	S	S	*	*	P	Polyproline II helix	trans	-71.1	128.3	167.3	-71.7	-168.1	-8	0	0	109.5	K458 N462	K458-Q460 PolarHBondContact O-N 3.31Å; Q460-N462 PolarHBondContact O-N 3Å
461	P	24.5	Very low	29.1	Very low	87 Å²	87	106.9 Å²	106.9	57%	0.565	59%	0.586	S	S	*	*	P	Polyproline II helix	trans	-67.5	125.3	172.2	-13.5	27.9	0	0	0	109.2	F463	P461-F463 VanDerWaalsContact C-N 3.27Å; P461-F463 HydrophobicContact CB-CD2 4.03Å; P461-F463 HydrophobicContact CB-CE1 4.18Å; P461-F463 HydrophobicContact CB-CE2 3.62Å; P461-F463 HydrophobicContact CB-CG 4.48Å; P461-F463 HydrophobicContact CB-CZ 3.7Å; P461-F463 HydrophobicContact CG-CE2 3.83Å; P461-F463 HydrophobicContact CG-CZ 4Å; P461-F463 WeakPolarHBondContact O-CD2 3.25Å; P461-F463 PolarHBondContact O-N 3.49Å
462	N	24.1	Very low	29.2	Very low	136 Å²	136	101 Å²	101	73%	0.727	55%	0.553	S	S	*	*			trans	-80.4	76.7	-175.8	-153.8	-10.9	0	0	0	109.9	Q460 N464	Q460-N462 PolarHBondContact O-N 3Å; N462-N464 PolarHBondContact O-N 2.98Å
463	F	25.7	Very low	29.2	Very low	112 Å²	112	99.1 Å²	99.1	49%	0.491	54%	0.54	S	S	.	.			trans	-69.7	69.4	-173.7	-72.9	-62.3	0	0	0	113	P461 W465	P461-F463 VanDerWaalsContact C-N 3.27Å; P461-F463 HydrophobicContact CB-CD2 4.03Å; P461-F463 HydrophobicContact CB-CE1 4.18Å; P461-F463 HydrophobicContact CB-CE2 3.62Å; P461-F463 HydrophobicContact CB-CG 4.48Å; P461-F463 HydrophobicContact CB-CZ 3.7Å; P461-F463 HydrophobicContact CG-CE2 3.83Å; P461-F463 HydrophobicContact CG-CZ 4Å; P461-F463 WeakPolarHBondContact O-CD2 3.25Å; P461-F463 PolarHBondContact O-N 3.49Å; F463-W465 AromaticContact CD1-NE1 3.59Å; F463-W465 PolarHBondContact O-N 3.32Å
464	N	26.7	Very low	29.1	Very low	135 Å²	135	98.1 Å²	98.1	72%	0.722	52%	0.524	S	S	*	.			trans	-80.5	59	-179.9	-155.5	-2.4	0	0	0	111.3	N462	N462-N464 PolarHBondContact O-N 2.98Å
465	W	28.8	Very low	29.3	Very low	107 Å²	107	94.8 Å²	94.8	41%	0.405	50%	0.499	S	S	.	.			trans	-72.6	129.7	176	-67.8	116	0	0	0	110.2	F463 S467 E796	F463-W465 AromaticContact CD1-NE1 3.59Å; F463-W465 PolarHBondContact O-N 3.32Å; W465-S467 PolarHBondContact O-N 3.24Å; W465-S467 VanDerWaalsContact O-N 3.13Å; W465-E796 WeakPolarHBondContact CH2-OE2 3.22Å
466	Q	30.2	Very low	29.4	Very low	102 Å²	102	90.4 Å²	90.4	48%	0.477	48%	0.475	S	S	.	.			trans	-63	114.1	151.5	-68.2	179.1	-18.3	0	0	106.8	R797	Q466-R797 PolarHBondContact O-NH1 3.32Å; Q466-R797 PolarHBondContact O-NH2 3.1Å
467	S	28.9	Very low	29.3	Very low	36 Å²	36	87.5 Å²	87.5	25%	0.252	45%	0.454	S	S	.	.			trans	-49.7	175	162	-97	0	0	0	0	111.3	W465 R469 E875	W465-S467 PolarHBondContact O-N 3.24Å; W465-S467 VanDerWaalsContact O-N 3.13Å; S467-R469 PolarHBondContact O-N 2.88Å; S467-E875 WeakPolarHBondContact CB-OE1 3.41Å; S467-E875 PolarHBondContact OG-OE1 3.5Å
468	S	30.7	Very low	29.5	Very low	6 Å²	6	84 Å²	84	4%	0.042	43%	0.433	C	S	.	.			trans	-69.1	66.7	179.8	60.2	0	0	0	0	112.4	T470 A471 W472 E875	S468-T470 CarbonylContact O-C 3.59Å; S468-T470 PolarHBondContact O-N 3.37Å; S468-A471 WeakPolarHBondContact O-CA 3.26Å; S468-A471 WeakPolarHBondContact O-CB 3.46Å; S468-A471 PolarHBondContact O-N 3.35Å; S468-W472 VanDerWaalsContact O-CD1 3.31Å; S468-W472 PolarHBondContact O-N 3.47Å; S468-E875 PolarHBondContact N-OE1 3.09Å
469	R	36.2	Very low	30	Very low	141 Å²	141	78.3 Å²	78.3	53%	0.532	41%	0.414	S	S	.	.	H	α-helix	trans	-52.2	-21.6	178.1	-88.8	-170	174.9	-177.4	-0.6	112.4	D213 S467 W472 S473	D213-R469 IonicContact OD2-CZ 2.81Å; D213-R469 IonicContact OD2-NH1 2.71Å; D213-R469 PolarHBondContact OD2-NH1 3.13Å; D213-R469 IonicContact OD2-NH2 3.39Å; S467-R469 PolarHBondContact O-N 2.88Å; R469-W472 PolarHBondContact O-N 3.45Å; R469-S473 WeakPolarHBondContact O-CB 3.28Å; R469-S473 PolarHBondContact O-N 3.2Å; R469-S473 PolarHBondContact O-OG 3.23Å
470	T	33.3	Very low	30.4	Very low	33 Å²	33	73 Å²	73	20%	0.202	39%	0.386	C	S	.	.	H	α-helix	trans	-56.3	-49.7	166	21	0	0	0	0	113.5	S468 W472 S473	S468-T470 CarbonylContact O-C 3.59Å; S468-T470 PolarHBondContact O-N 3.37Å; T470-W472 VanDerWaalsContact C-N 3.34Å; T470-S473 PolarHBondContact O-OG 2.91Å
471	A	27.8	Very low	30.9	Very low	5 Å²	5	70.4 Å²	70.4	4%	0.041	37%	0.372	C	S	.	.	H	α-helix	trans	-67.3	-34.9	174.8	0	0	0	0	0	111.7	S468 R852	S468-A471 WeakPolarHBondContact O-CA 3.26Å; S468-A471 WeakPolarHBondContact O-CB 3.46Å; S468-A471 PolarHBondContact O-N 3.35Å; A471-R852 VanDerWaalsContact O-CZ 3.29Å; A471-R852 PolarHBondContact O-NH1 3.23Å; A471-R852 PolarHBondContact O-NH2 2.99Å
472	W	33	Very low	31.5	Very low	30 Å²	30	74 Å²	74	11%	0.114	38%	0.378	C	S	.	.	H	α-helix	trans	-80.3	-36.9	-176.4	-66.6	54.7	0	0	0	112.3	S468 R469 T470 A474 H475 D476 V902 E928	S468-W472 VanDerWaalsContact O-CD1 3.31Å; S468-W472 PolarHBondContact O-N 3.47Å; R469-W472 PolarHBondContact O-N 3.45Å; T470-W472 VanDerWaalsContact C-N 3.34Å; W472-A474 PolarHBondContact O-N 2.65Å; W472-H475 PolarHBondContact O-N 3.28Å; W472-D476 PolarHBondContact O-N 2.93Å; W472-V902 HydrophobicContact CH2-CG1 3.97Å; W472-V902 HydrophobicContact CZ2-CG1 3.4Å; W472-E928 HydrophobicContact CH2-CB 3.72Å; W472-E928 HydrophobicContact CZ3-CB 4.14Å; W472-E928 WeakPolarHBondContact CZ3-OE2 3.42Å
473	S	30.2	Very low	32	Very low	69 Å²	69	69.5 Å²	69.5	48%	0.483	35%	0.352	S	S	.	.	H	α-helix	trans	-71.8	-11.8	179.2	65.8	0	0	0	0	114.5	R469 T470 H475	R469-S473 WeakPolarHBondContact O-CB 3.28Å; R469-S473 PolarHBondContact O-N 3.2Å; R469-S473 PolarHBondContact O-OG 3.23Å; T470-S473 PolarHBondContact O-OG 2.91Å; S473-H475 PolarHBondContact O-N 2.94Å
474	A	30.5	Very low	32.3	Very low	58 Å²	58	69 Å²	69	48%	0.479	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-20	168.6	0	0	0	0	0	112.4	W472	W472-A474 PolarHBondContact O-N 2.65Å
475	H	34.1	Very low	32.6	Very low	76 Å²	76	65.8 Å²	65.8	35%	0.352	35%	0.352	S	S	.	.	S	Bend	trans	-124.1	3.6	-175.9	-59.1	-68.3	0	0	0	113.8	W472 S473 P477 R852	W472-H475 PolarHBondContact O-N 3.28Å; S473-H475 PolarHBondContact O-N 2.94Å; H475-P477 WeakPolarHBondContact O-CD 3.49Å; H475-R852 PolarHBondContact NE2-NH1 3.24Å
476	D	34	Very low	32.7	Very low	50 Å²	50	63 Å²	63	27%	0.267	35%	0.352	S	S	.	.			trans	-67.3	110.2	179.5	180	6.1	0	0	0	111.6	W472 A478 V479 L480	W472-D476 PolarHBondContact O-N 2.93Å; D476-A478 PolarHBondContact O-N 2.81Å; D476-A478 VanDerWaalsContact OD1-CB 3.31Å; D476-A478 WeakPolarHBondContact OD1-CB 3.47Å; D476-A478 PolarHBondContact OD1-N 2.82Å; D476-V479 HydrophobicContact CB-CG2 4.18Å; D476-V479 WeakPolarHBondContact O-CB 3.37Å; D476-V479 PolarHBondContact O-N 2.81Å; D476-L480 PolarHBondContact O-N 3.29Å
477	P	28.8	Very low	32.8	Very low	14 Å²	14	61.2 Å²	61.2	9%	0.091	34%	0.342	C	S	.	.	H	α-helix	trans	-67.7	-18.7	-178	-18.7	35.2	0	0	0	113.5	H475 V479 L480 K481 Y982 Y984	H475-P477 WeakPolarHBondContact O-CD 3.49Å; P477-V479 PolarHBondContact O-N 3.4Å; P477-L480 CarbonylContact O-C 3.49Å; P477-L480 WeakPolarHBondContact O-CA 3.37Å; P477-L480 PolarHBondContact O-N 3.27Å; P477-K481 WeakPolarHBondContact O-CG 3.46Å; P477-K481 PolarHBondContact O-N 3.21Å; P477-Y982 HydrophobicContact CG-CD1 4Å; P477-Y982 HydrophobicContact CG-CE1 4.13Å; P477-Y984 HydrophobicContact CB-CE1 3.95Å; P477-Y984 HydrophobicContact CB-CE2 3.96Å; P477-Y984 VanDerWaalsContact CB-CZ 3.46Å; P477-Y984 VanDerWaalsContact CB-OH 3.29Å; P477-Y984 WeakPolarHBondContact CB-OH 3.39Å; P477-Y984 HydrophobicContact CG-CD2 4.25Å; P477-Y984 HydrophobicContact CG-CE1 4.35Å; P477-Y984 HydrophobicContact CG-CE2 3.55Å
478	A	30.7	Very low	33	Very low	48 Å²	48	63.6 Å²	63.6	40%	0.397	35%	0.351	S	S	.	.	H	α-helix	trans	-62	-28.4	171.2	0	0	0	0	0	111.8	D476	D476-A478 PolarHBondContact O-N 2.81Å; D476-A478 VanDerWaalsContact OD1-CB 3.31Å; D476-A478 WeakPolarHBondContact OD1-CB 3.47Å; D476-A478 PolarHBondContact OD1-N 2.82Å
479	V	38.5	Very low	33	Very low	64 Å²	64	72.5 Å²	72.5	39%	0.388	38%	0.384	S	S	.	.	H	α-helix	trans	-82	-24.1	171.4	-172.4	0	0	0	0	111.9	D476 P477	D476-V479 HydrophobicContact CB-CG2 4.18Å; D476-V479 WeakPolarHBondContact O-CB 3.37Å; D476-V479 PolarHBondContact O-N 2.81Å; P477-V479 PolarHBondContact O-N 3.4Å
480	L	35.1	Very low	32.7	Very low	42 Å²	42	66.6 Å²	66.6	22%	0.22	37%	0.365	C	S	.	.	H	α-helix	trans	-90.1	-5.1	-178.7	-56	173.9	0	0	0	114.9	D476 P477 K482 K483	D476-L480 PolarHBondContact O-N 3.29Å; P477-L480 CarbonylContact O-C 3.49Å; P477-L480 WeakPolarHBondContact O-CA 3.37Å; P477-L480 PolarHBondContact O-N 3.27Å; L480-K482 PolarHBondContact O-N 3.39Å; L480-K483 HydrophobicContact CD2-CD 4.21Å; L480-K483 PolarHBondContact O-N 2.87Å
481	K	36.6	Very low	32.6	Very low	128 Å²	128	69.4 Å²	69.4	56%	0.557	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	17.4	178.8	-83.4	168.1	-170.6	172.1	0	116.2	P477 E1005	P477-K481 WeakPolarHBondContact O-CG 3.46Å; P477-K481 PolarHBondContact O-N 3.21Å; K481-E1005 WeakPolarHBondContact CE-OE2 3.26Å; K481-E1005 IonicContact NZ-OE1 2.69Å; K481-E1005 PolarHBondContact NZ-OE1 2.94Å; K481-E1005 IonicContact NZ-OE2 3.02Å; K481-E1005 PolarHBondContact NZ-OE2 3.4Å
482	K	37.5	Very low	33	Very low	163 Å²	163	75.2 Å²	75.2	71%	0.709	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-132.6	14.3	170.5	-69.7	-161.2	174.5	-164.8	0	114.5	N372 L480	N372-K482 PolarHBondContact OD1-NZ 3.49Å; L480-K482 PolarHBondContact O-N 3.39Å
483	K	35.4	Very low	32.7	Very low	40 Å²	40	76.9 Å²	76.9	17%	0.174	42%	0.424	C	S	.	.			trans	-118	136.3	-176.4	-79	-173.9	157.9	-173.5	0	114	E88 L480 Y487	E88-K483 VanDerWaalsContact OE1-CE 3.28Å; E88-K483 WeakPolarHBondContact OE1-CE 3.42Å; E88-K483 IonicContact OE1-NZ 3.25Å; E88-K483 PolarHBondContact OE1-NZ 3.48Å; L480-K483 HydrophobicContact CD2-CD 4.21Å; L480-K483 PolarHBondContact O-N 2.87Å; K483-Y487 HydrophobicContact CD-CD1 3.76Å; K483-Y487 HydrophobicContact CD-CD2 4.41Å; K483-Y487 HydrophobicContact CD-CE1 4.23Å; K483-Y487 HydrophobicContact CD-CG 3.87Å
484	P	31.7	Very low	32.7	Very low	103 Å²	103	83.2 Å²	83.2	67%	0.669	45%	0.446	S	S	*	.			trans	-75.5	160	173	32.7	-35.4	0	0	0	111.9	A486 Y487	P484-A486 PolarHBondContact O-N 2.8Å; P484-Y487 PolarHBondContact O-N 3.41Å
485	A	33.2	Very low	32.7	Very low	66 Å²	66	83.7 Å²	83.7	55%	0.545	46%	0.456	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-12.3	-173.8	0	0	0	0	0	116.1	Y487 L488 R489	A485-Y487 VanDerWaalsContact C-N 3.3Å; A485-Y487 PolarHBondContact O-N 2.84Å; A485-L488 PolarHBondContact O-N 3.31Å; A485-R489 PolarHBondContact O-N 3.38Å
486	A	31.1	Very low	32.3	Very low	49 Å²	49	88.2 Å²	88.2	41%	0.405	48%	0.483	S	S	.	.	H	α-helix	trans	-59.1	-37	173.5	0	0	0	0	0	113	P484 L488 R489 A490	P484-A486 PolarHBondContact O-N 2.8Å; A486-L488 PolarHBondContact O-N 2.93Å; A486-R489 PolarHBondContact O-N 3.37Å; A486-A490 PolarHBondContact O-N 3.25Å
487	Y	31.9	Very low	32	Very low	65 Å²	65	92.3 Å²	92.3	26%	0.255	51%	0.51	S	S	.	.	H	α-helix	trans	-65.6	-28.7	-178.5	-164.8	-108.2	0	0	0	112.5	L89 K483 P484 A485	L89-Y487 PolarHBondContact O-OH 2.69Å; K483-Y487 HydrophobicContact CD-CD1 3.76Å; K483-Y487 HydrophobicContact CD-CD2 4.41Å; K483-Y487 HydrophobicContact CD-CE1 4.23Å; K483-Y487 HydrophobicContact CD-CG 3.87Å; P484-Y487 PolarHBondContact O-N 3.41Å; A485-Y487 VanDerWaalsContact C-N 3.3Å; A485-Y487 PolarHBondContact O-N 2.84Å
488	L	32.1	Very low	32	Very low	86 Å²	86	95.6 Å²	95.6	45%	0.45	54%	0.538	S	S	.	.	H	α-helix	trans	-78.8	-17.4	172.4	-70.1	174.5	0	0	0	113.3	A485 A486 Y492	A485-L488 PolarHBondContact O-N 3.31Å; A486-L488 PolarHBondContact O-N 2.93Å; L488-Y492 WeakPolarHBondContact O-CD2 3.27Å
489	R	30.9	Very low	31.8	Very low	192 Å²	192	101.7 Å²	101.7	73%	0.725	56%	0.556	S	S	*	*	H	α-helix	trans	-84.4	-34.7	176.7	-65.9	-174.2	-173.5	-174.7	2.3	112.9	A485 A486 S491 Y492	A485-R489 PolarHBondContact O-N 3.38Å; A486-R489 PolarHBondContact O-N 3.37Å; R489-S491 PolarHBondContact O-N 3.23Å; R489-S491 VanDerWaalsContact O-N 3.15Å; R489-Y492 PolarHBondContact O-N 3.02Å
490	A	30.3	Very low	31.3	Very low	18 Å²	18	104.9 Å²	104.9	15%	0.149	58%	0.575	C	S	.	*	T	Hydrogen-bonded Turn	trans	-64.5	-17.3	-178.8	0	0	0	0	0	113.9	G92 A486	G92-A490 WeakPolarHBondContact O-CB 3.36Å; A486-A490 PolarHBondContact O-N 3.25Å
491	S	30.8	Very low	31.1	Very low	91 Å²	91	110 Å²	110	64%	0.636	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86	-1.3	172.4	-58	0	0	0	0	114.3	R489	R489-S491 PolarHBondContact O-N 3.23Å; R489-S491 VanDerWaalsContact O-N 3.15Å
492	Y	36.4	Very low	30.5	Very low	128 Å²	128	112 Å²	112	50%	0.502	61%	0.614	S	S	.	*	S	Bend	trans	-123.7	14	-168.4	-77.3	-96	0	0	0	114.3	L488 R489 C933	L488-Y492 WeakPolarHBondContact O-CD2 3.27Å; R489-Y492 PolarHBondContact O-N 3.02Å; Y492-C933 HydrophobicContact CE1-CB 3.98Å; Y492-C933 WeakPolarHBondContact OH-CB 3.44Å; Y492-C933 PolarHBondContact OH-SG 3.47Å
493	S	27.7	Very low	30.2	Very low	65 Å²	65	112.5 Å²	112.5	46%	0.455	62%	0.618	S	S	.	*			trans	-112.7	49.2	-172.3	54.5	0	0	0	0	114.9
494	Q	30.4	Very low	29.9	Very low	202 Å²	202	115.4 Å²	115.4	94%	0.944	64%	0.644	S	S	*	*			trans	-129.8	101.7	153.8	-71.3	-158.8	10.7	0	0	110.2
495	G	28.8	Very low	29.9	Very low	67 Å²	67	118.3 Å²	118.3	69%	0.691	65%	0.654	S	S	*	*			trans	-173.5	39.9	-171.3	0	0	0	0	0	113.5	V497	G495-V497 VanDerWaalsContact C-N 3.31Å; G495-V497 PolarHBondContact O-N 2.89Å
496	N	27.4	Very low	29.7	Very low	172 Å²	172	119.6 Å²	119.6	92%	0.92	66%	0.659	S	S	*	*			trans	-69.8	88.8	172.9	-91.2	8.1	0	0	0	110.1	A498	N496-A498 PolarHBondContact O-N 3.3Å; N496-A498 VanDerWaalsContact O-N 3.14Å
497	V	28.1	Very low	29.7	Very low	136 Å²	136	123.6 Å²	123.6	82%	0.824	67%	0.673	S	S	*	*			trans	-71.1	101.3	163	-179.6	0	0	0	0	107.3	G495 F499	G495-V497 VanDerWaalsContact C-N 3.31Å; G495-V497 PolarHBondContact O-N 2.89Å; V497-F499 PolarHBondContact O-N 3.03Å; V497-F499 VanDerWaalsContact O-N 3.09Å
498	A	28	Very low	29.6	Very low	82 Å²	82	127.6 Å²	127.6	68%	0.678	70%	0.696	S	S	*	*			trans	-67.4	106.6	174.6	0	0	0	0	0	109.5	N496 V500	N496-A498 PolarHBondContact O-N 3.3Å; N496-A498 VanDerWaalsContact O-N 3.14Å; A498-V500 VanDerWaalsContact C-N 3.32Å; A498-V500 PolarHBondContact O-N 3.18Å
499	F	25.7	Very low	29.6	Very low	177 Å²	177	132.1 Å²	132.1	78%	0.776	71%	0.712	S	S	*	*			trans	-74.4	85.1	175.5	-165.5	-89.4	0	0	0	109.1	V497 Q501	V497-F499 PolarHBondContact O-N 3.03Å; V497-F499 VanDerWaalsContact O-N 3.09Å; F499-Q501 PolarHBondContact O-N 2.83Å; F499-Q501 VanDerWaalsContact O-N 3.11Å
500	V	28.8	Very low	29.6	Very low	130 Å²	130	128.3 Å²	128.3	79%	0.788	71%	0.713	S	S	*	*			trans	-73.5	102.7	175.5	179.7	0	0	0	0	108.3	A498 L502	A498-V500 VanDerWaalsContact C-N 3.32Å; A498-V500 PolarHBondContact O-N 3.18Å; V500-L502 PolarHBondContact O-N 3.07Å
501	Q	30.2	Very low	29.7	Very low	149 Å²	149	134.8 Å²	134.8	70%	0.696	75%	0.745	S	S	*	*			trans	-71.3	126.1	176.8	-161.8	160.6	-47.2	0	0	109.3	F499 E503	F499-Q501 PolarHBondContact O-N 2.83Å; F499-Q501 VanDerWaalsContact O-N 3.11Å; Q501-E503 PolarHBondContact O-N 2.86Å
502	L	25.1	Very low	29.7	Very low	172 Å²	172	137.2 Å²	137.2	90%	0.901	75%	0.75	S	S	*	*			trans	-71.8	113.1	176.9	-84.8	156	0	0	0	109.8	V500	V500-L502 PolarHBondContact O-N 3.07Å
503	E	31.3	Very low	29.5	Very low	172 Å²	172	135.8 Å²	135.8	80%	0.804	76%	0.759	S	S	*	*			trans	-114.9	141.3	154.9	-72	-162.9	156.4	0	0	110.3	Q501	Q501-E503 PolarHBondContact O-N 2.86Å
504	S	27.7	Very low	29.7	Very low	102 Å²	102	138.7 Å²	138.7	71%	0.713	77%	0.77	S	S	*	*			trans	-77.4	140.3	-171.2	51.3	0	0	0	0	112.6
505	N	31.5	Very low	29.7	Very low	163 Å²	163	134.9 Å²	134.9	87%	0.872	76%	0.756	S	S	*	*				-159.7	146.9	112.9	-99.3	-41.3	0	0	0	112.7
506	S	29.4	Very low	29.9	Very low	93 Å²	93	139 Å²	139	65%	0.65	76%	0.757	S	S	*	*			trans	-98.6	139.9	-179	50.3	0	0	0	0	111.5
507	N	31.4	Very low	30.2	Very low	133 Å²	133	137.2 Å²	137.2	71%	0.711	75%	0.747	S	S	*	*				175.5	147.7	116.1	-93.7	-54.2	0	0	0	114.1
508	M	30.1	Very low	30.5	Very low	149 Å²	149	135.3 Å²	135.3	73%	0.734	73%	0.732	S	S	*	*			trans	27	137.7	136.3	-53	-92.4	168.7	0	0	118.8
509	K	31.1	Very low	30.8	Very low	181 Å²	181	139.6 Å²	139.6	79%	0.787	74%	0.735	S	S	*	*			cis	-168.8	154	9	-124.9	168.5	179.1	171	0	109.4
510	P	31.2	Very low	31.2	Very low	113 Å²	113	135.2 Å²	135.2	73%	0.734	73%	0.726	S	S	*	*			trans	-97.8	148.5	175.4	36.5	-33.2	0	0	0	114.4
511	N	32.8	Very low	31.4	Very low	154 Å²	154	136.9 Å²	136.9	82%	0.824	73%	0.726	S	S	*	*			trans	-168.1	138.6	152	-92.9	-32.9	0	0	0	107
512	N	30.6	Very low	31.6	Very low	141 Å²	141	137 Å²	137	75%	0.754	73%	0.727	S	S	*	*			cis	105.2	138	24.3	-170.5	24.7	0	0	0	112.3
513	S	32.7	Very low	31.7	Very low	98 Å²	98	133.9 Å²	133.9	69%	0.685	72%	0.719	S	S	*	*			trans	67.8	154.1	-175.6	86.2	0	0	0	0	115
514	N	32.4	Very low	31.9	Very low	127 Å²	127	131.2 Å²	131.2	68%	0.679	72%	0.716	S	S	*	*			cis	-160.2	162.9	-2.1	-132.2	-6.6	0	0	0	111.2
515	N	29.2	Very low	31.9	Very low	121 Å²	121	133.3 Å²	133.3	65%	0.647	72%	0.719	S	S	*	*			trans	32.6	148.8	134.8	-70.6	-8.9	0	0	0	121.7
516	Q	33.9	Very low	31.9	Very low	153 Å²	153	130.7 Å²	130.7	72%	0.715	71%	0.711	S	S	*	*			cis	-175.5	158.3	18.1	-126.3	173.8	-25.3	0	0	111.4
517	L	33.5	Very low	31.7	Very low	136 Å²	136	131.9 Å²	131.9	71%	0.712	72%	0.718	S	S	*	*			trans	60	163.3	150.6	-100.6	65.5	0	0	0	118.2
518	D	33.8	Very low	31.6	Very low	95 Å²	95	130.6 Å²	130.6	51%	0.508	72%	0.719	S	S	.	*			cis	-156.5	158.8	1.8	-143.5	-18.6	0	0	0	111.9
519	K	34.2	Very low	31.4	Very low	172 Å²	172	130.3 Å²	130.3	75%	0.748	72%	0.721	S	S	*	*			trans	52	152.8	152.4	-74.6	148.2	-164.7	156.6	0	121.3
520	S	33.5	Very low	31.3	Very low	85 Å²	85	126.2 Å²	126.2	59%	0.594	72%	0.715	S	S	*	*			cis	-174.5	145.8	-13.5	49.4	0	0	0	0	112.1
521	Q	34.6	Very low	31.5	Very low	165 Å²	165	130 Å²	130	77%	0.771	72%	0.72	S	S	*	*			trans	66	157.5	153.2	-66.8	168.8	4	0	0	116.6
522	Q	33	Very low	31.5	Very low	153 Å²	153	127.2 Å²	127.2	72%	0.715	71%	0.712	S	S	*	*			cis	-156	144.7	-4.8	-122.2	163.1	12.6	0	0	111.1
523	S	28.3	Very low	31.4	Very low	106 Å²	106	125.9 Å²	125.9	74%	0.741	71%	0.713	S	S	*	*			trans	22	162.1	146.3	43.3	0	0	0	0	125.7
524	P	34.6	Very low	31.5	Very low	115 Å²	115	127.1 Å²	127.1	75%	0.747	71%	0.712	S	S	*	*			trans	-117.8	-165.2	-159	41.4	-27	0	0	0	116.9
525	L	27.9	Very low	31.6	Very low	147 Å²	147	128.7 Å²	128.7	77%	0.77	72%	0.715	S	S	*	*			trans	98.7	176.2	173.6	-52.1	170.8	0	0	0	115
526	P	32.5	Very low	31.7	Very low	107 Å²	107	132.9 Å²	132.9	70%	0.695	73%	0.727	S	S	*	*				-137	178.9	-92.1	41.9	-23.3	0	0	0	116.9
527	C	24.3	Very low	31.6	Very low	119 Å²	119	131.1 Å²	131.1	80%	0.804	73%	0.727	S	S	*	*			trans	66.1	129.9	153.2	-72	0	0	0	0	122.8
528	S	28.9	Very low	31.7	Very low	106 Å²	106	134.8 Å²	134.8	74%	0.741	74%	0.737	S	S	*	*			trans	97.9	132.6	135.3	81.2	0	0	0	0	122.6
529	N	27.2	Very low	31.7	Very low	143 Å²	143	134.5 Å²	134.5	77%	0.765	74%	0.742	S	S	*	*			trans	69.2	94.5	136.9	-66.7	-6.5	0	0	0	123.8
530	S	29.2	Very low	31.8	Very low	95 Å²	95	132 Å²	132	66%	0.664	74%	0.737	S	S	*	*				89	164	107.9	79.2	0	0	0	0	121.3
531	K	34.6	Very low	31.7	Very low	192 Å²	192	134.1 Å²	134.1	84%	0.835	74%	0.742	S	S	*	*			trans	81.5	141	171.1	-59.9	168.4	-173.5	175.7	0	116.1
532	S	33.3	Very low	31.6	Very low	96 Å²	96	131.2 Å²	131.2	67%	0.671	74%	0.736	S	S	*	*			cis	-172.6	152.3	-13.3	49.4	0	0	0	0	112.6
533	C	28.9	Very low	31.6	Very low	112 Å²	112	130.9 Å²	130.9	76%	0.757	74%	0.744	S	S	*	*			trans	66.8	160	146.9	-78.4	0	0	0	0	119.1
534	N	34.5	Very low	31.7	Very low	125 Å²	125	128.7 Å²	128.7	67%	0.668	74%	0.738	S	S	*	*			cis	-146	142.1	9.3	-129.9	-10.4	0	0	0	115.4
535	Q	34.6	Very low	31.6	Very low	159 Å²	159	129.3 Å²	129.3	74%	0.743	75%	0.745	S	S	*	*			trans	12	138.3	146.6	-62.7	172.9	-2	0	0	121.7
536	K	31.3	Very low	31.7	Very low	210 Å²	210	127.7 Å²	127.7	91%	0.913	75%	0.747	S	S	*	*				-148.8	142.7	102.4	-120.7	170.2	-174.2	171.8	0	113
537	V	31.2	Very low	32	Very low	116 Å²	116	127.2 Å²	127.2	70%	0.703	74%	0.743	S	S	*	*			trans	-119.7	148.2	-174.4	172.6	0	0	0	0	108.8
538	K	35.6	Very low	32.3	Very low	213 Å²	213	128.1 Å²	128.1	93%	0.926	74%	0.74	S	S	*	*			trans	-146.9	137.6	138.2	-114.2	177.8	-177.2	-171.4	0	110.5
539	S	33.5	Very low	32.4	Very low	88 Å²	88	129.3 Å²	129.3	62%	0.615	74%	0.738	S	S	*	*			trans	-117.6	-162.6	-167.1	48.3	0	0	0	0	110.6
540	N	35.9	Very low	32.4	Very low	121 Å²	121	132.9 Å²	132.9	65%	0.647	74%	0.741	S	S	*	*			trans	107.9	110.5	161.7	-61.3	59	0	0	0	112.6
541	D	33	Very low	32.4	Very low	128 Å²	128	132.3 Å²	132.3	68%	0.684	74%	0.737	S	S	*	*				93.2	146.5	68.9	-68.9	-19.9	0	0	0	109.8
542	T	32.3	Very low	32.1	Very low	105 Å²	105	130.3 Å²	130.3	64%	0.644	73%	0.73	S	S	*	*			cis	-166.8	154.6	-8.2	21.2	0	0	0	0	107.9
543	T	31.3	Very low	31.8	Very low	145 Å²	145	135 Å²	135	89%	0.89	73%	0.734	S	S	*	*			trans	60.1	154.6	157.4	53.8	0	0	0	0	118.4
544	G	30.7	Very low	31.8	Very low	60 Å²	60	135.4 Å²	135.4	62%	0.619	73%	0.728	S	S	*	*			cis	174.7	-169.8	-2.8	0	0	0	0	0	111.4
545	S	33.8	Very low	31.7	Very low	128 Å²	128	135.7 Å²	135.7	90%	0.895	73%	0.73	S	S	*	*			trans	60.6	118.5	170.7	43.9	0	0	0	0	119.8
546	S	29.3	Very low	31.4	Very low	114 Å²	114	133.4 Å²	133.4	80%	0.797	73%	0.727	S	S	*	*			trans	-98	-168.8	154.5	-143	0	0	0	0	107.9
547	P	38.1	Very low	31.6	Very low	97 Å²	97	132.4 Å²	132.4	63%	0.63	73%	0.725	S	S	*	*			cis	-139.7	-172.7	-6.7	41.1	-21.4	0	0	0	116
548	D	30.2	Very low	31.5	Very low	137 Å²	137	131 Å²	131	73%	0.733	73%	0.725	S	S	*	*			trans	74.2	152.2	141.3	-77	-34.7	0	0	0	125.1
549	N	31.8	Very low	31.4	Very low	132 Å²	132	130.1 Å²	130.1	71%	0.706	72%	0.722	S	S	*	*			trans	72.1	144.9	159.2	-69.7	-50.9	0	0	0	119.6
550	R	27.5	Very low	31.2	Very low	218 Å²	218	130.6 Å²	130.6	82%	0.823	73%	0.725	S	S	*	*			cis	-167.4	160.9	-26.9	-145.3	179.9	-170	-171.5	3.4	109.7
551	S	28.5	Very low	31.1	Very low	82 Å²	82	132.2 Å²	132.2	57%	0.573	73%	0.733	S	S	*	*			trans	57.7	135.6	150.8	50.1	0	0	0	0	122.7
552	E	28.3	Very low	30.8	Very low	150 Å²	150	137 Å²	137	70%	0.701	74%	0.742	S	S	*	*			trans	71.1	149.6	140.8	-70.3	164.2	-148.5	0	0	119.4
553	W	26.9	Very low	30.5	Very low	195 Å²	195	136.9 Å²	136.9	74%	0.739	74%	0.744	S	S	*	*			cis	-159.3	147.8	-13.9	-128.8	-28.9	0	0	0	111.9
554	N	29.4	Very low	30.6	Very low	120 Å²	120	138.8 Å²	138.8	64%	0.642	74%	0.743	S	S	*	*			trans	63.7	157.2	140.4	-74.4	-14.1	0	0	0	125.3
555	N	32.1	Very low	30.8	Very low	132 Å²	132	144.6 Å²	144.6	71%	0.706	75%	0.753	S	S	*	*			trans	87.6	88.7	148.2	-68.5	-10.6	0	0	0	122.7
556	T	28.4	Very low	30.8	Very low	110 Å²	110	144.1 Å²	144.1	68%	0.675	75%	0.747	S	S	*	*				43.3	132.5	114.9	60.5	0	0	0	0	121.6
557	H	35.8	Very low	31.1	Very low	189 Å²	189	143.7 Å²	143.7	88%	0.875	74%	0.742	S	S	*	*				-159.5	157.8	116.1	-108.3	-65.3	0	0	0	112.7
558	A	28.7	Very low	30.8	Very low	86 Å²	86	149.8 Å²	149.8	71%	0.711	75%	0.752	S	S	*	*			trans	-133.4	150.9	-179.2	0	0	0	0	0	112.5
559	K	34.1	Very low	31	Very low	196 Å²	196	155.3 Å²	155.3	85%	0.852	76%	0.763	S	S	*	*			trans	-175.6	126.1	160.2	-94.2	141.8	-177	-179.2	0	106.5
560	S	28.7	Very low	30.9	Very low	97 Å²	97	154.7 Å²	154.7	68%	0.678	76%	0.76	S	S	*	*			cis	86.5	100.8	38.4	79.8	0	0	0	0	114.9
561	N	34.8	Very low	31.3	Very low	155 Å²	155	156.6 Å²	156.6	83%	0.829	77%	0.767	S	S	*	*			trans	173.5	121.3	146.9	-85.1	-21.4	0	0	0	107.1
562	R	26	Very low	31.3	Very low	229 Å²	229	161.7 Å²	161.7	86%	0.864	77%	0.773	S	S	*	*			cis	83.8	127.4	47.7	-81.3	-160	178.2	-165.6	3.2	115.5
563	C	25.6	Very low	31.4	Very low	103 Å²	103	166 Å²	166	70%	0.696	79%	0.785	S	S	*	*			trans	68.4	127	165.1	-53.8	0	0	0	0	116.4
564	H	34.4	Very low	31.6	Very low	185 Å²	185	162.1 Å²	162.1	86%	0.856	78%	0.777	S	S	*	*				-158.7	153.6	53.5	-91.3	-88.4	0	0	0	115.1
565	H	34.2	Very low	31.7	Very low	181 Å²	181	161.5 Å²	161.5	84%	0.838	78%	0.783	S	S	*	*			trans	-106.6	156.1	157.5	-91	-51.7	0	0	0	109.2
566	P	34.5	Very low	31.7	Very low	118 Å²	118	164.2 Å²	164.2	77%	0.766	79%	0.788	S	S	*	*				-151.2	-162.5	102	40.7	-19.6	0	0	0	113.5
567	P	35.9	Very low	31.7	Very low	106 Å²	106	163.9 Å²	163.9	69%	0.688	79%	0.79	S	S	*	*				-137.6	156.7	-75.3	42.4	-26.6	0	0	0	117.8
568	R	30.2	Very low	31.4	Very low	224 Å²	224	162.4 Å²	162.4	85%	0.845	79%	0.788	S	S	*	*			trans	37.4	135.7	139.3	-62.5	176.9	172.9	176.5	-1.5	122.3
569	R	35.4	Very low	31.3	Very low	253 Å²	253	162.9 Å²	162.9	96%	0.955	79%	0.786	S	S	*	*				-150.8	160.5	115.7	-112.4	171.8	-173.6	-169.4	1.3	112.3
570	N	30.5	Very low	31.1	Very low	120 Å²	120	160.1 Å²	160.1	64%	0.642	79%	0.786	S	S	*	*			trans	-113.1	160.6	-165.5	-53.7	-69.8	0	0	0	113.5
571	R	34.5	Very low	31	Very low	257 Å²	257	160.9 Å²	160.9	97%	0.97	79%	0.79	S	S	*	*				-149	163.9	117.1	-109	170	-174.6	-172.5	0.5	110.8
572	R	29.7	Very low	30.8	Very low	189 Å²	189	162.1 Å²	162.1	71%	0.713	79%	0.793	S	S	*	*			trans	-124.2	160.5	-163.5	-60.6	167.3	171.5	162.9	-4.3	111.4
573	Y	30.6	Very low	30.8	Very low	242 Å²	242	158.9 Å²	158.9	95%	0.949	79%	0.792	S	S	*	*				-141	164.3	125.9	-112	-82.2	0	0	0	110.4
574	I	29.8	Very low	31	Very low	112 Å²	112	157.7 Å²	157.7	57%	0.574	80%	0.798	S	S	*	*			trans	-142.1	132.2	-160.6	-73.5	174.2	0	0	0	111.7
575	S	32.5	Very low	30.6	Very low	108 Å²	108	155.2 Å²	155.2	76%	0.755	80%	0.796	S	S	*	*				-167.7	129.4	114	34.5	0	0	0	0	108.7
576	K	30.5	Very low	30.3	Very low	189 Å²	189	153.1 Å²	153.1	82%	0.822	80%	0.796	S	S	*	*				53.7	134	81.7	-68	-171.9	177.8	-173.8	0	112.8
577	S	30	Very low	30.2	Very low	103 Å²	103	153.6 Å²	153.6	72%	0.72	80%	0.797	S	S	*	*			cis	-171.4	173	-5.1	43.7	0	0	0	0	107.9
578	L	29.5	Very low	29.9	Very low	157 Å²	157	156 Å²	156	82%	0.822	80%	0.804	S	S	*	*			cis	-145.8	-130.8	13.5	-146.9	150.6	0	0	0	109.7
579	S	26.8	Very low	30	Very low	96 Å²	96	152.9 Å²	152.9	67%	0.671	80%	0.804	S	S	*	*			trans	-159.2	163.6	175.8	57.8	0	0	0	0	110.4
580	V	29.9	Very low	29.9	Very low	139 Å²	139	146.5 Å²	146.5	84%	0.842	80%	0.795	S	S	*	*			trans	-175.7	147.9	138.8	140.9	0	0	0	0	109.2
581	C	25	Very low	30.1	Very low	113 Å²	113	147.7 Å²	147.7	76%	0.764	81%	0.806	S	S	*	*			trans	-98.3	168.2	-178.9	-45.3	0	0	0	0	111.8
582	M	31.6	Very low	29.9	Very low	181 Å²	181	142.1 Å²	142.1	89%	0.892	80%	0.801	S	S	*	*				-165.7	147.9	129.7	-103.2	-56.2	164.7	0	0	111
583	D	25.8	Very low	30	Very low	161 Å²	161	136.4 Å²	136.4	86%	0.861	80%	0.801	S	S	*	*			trans	-81.7	156.3	172.2	-64.3	-73.9	0	0	0	111.4
584	G	29.6	Very low	30.1	Very low	78 Å²	78	132.5 Å²	132.5	80%	0.804	80%	0.795	S	S	*	*			trans	-173.4	87.7	-179.7	0	0	0	0	0	114.6
585	T	26.9	Very low	30.4	Very low	133 Å²	133	133.8 Å²	133.8	82%	0.816	80%	0.802	S	S	*	*			trans	-75.3	133.6	166.8	51.2	0	0	0	0	111
586	T	28.3	Very low	30.5	Very low	136 Å²	136	137.2 Å²	137.2	83%	0.834	80%	0.804	S	S	*	*				-173.8	154.9	124.6	19.1	0	0	0	0	115.1
587	T	31.9	Very low	30.8	Very low	129 Å²	129	137.5 Å²	137.5	79%	0.791	81%	0.808	S	S	*	*			trans	-38.4	147.2	172.9	48.4	0	0	0	0	118.9
588	N	28.5	Very low	31	Very low	156 Å²	156	136 Å²	136	83%	0.834	81%	0.809	S	S	*	*			trans	-63.6	141.7	163.6	-61.9	-36.4	0	0	0	112.8
589	N	33.1	Very low	31.4	Very low	158 Å²	158	136.5 Å²	136.5	85%	0.845	81%	0.811	S	S	*	*			trans	-162.5	133.9	138.5	-107.4	-21.8	0	0	0	110.2
590	P	33.6	Very low	31.7	Very low	120 Å²	120	137.2 Å²	137.2	78%	0.779	82%	0.816	S	S	*	*			trans	-92	133.6	-179.6	34.3	-31.8	0	0	0	112.2
591	V	33.5	Very low	32.1	Very low	144 Å²	144	137.8 Å²	137.8	87%	0.873	81%	0.812	S	S	*	*			trans	-135.8	130.3	166.3	-178	0	0	0	0	109.6
592	T	31.3	Very low	32.5	Very low	140 Å²	140	139.6 Å²	139.6	86%	0.859	81%	0.814	S	S	*	*			trans	-92.6	139.6	177	49.9	0	0	0	0	111.7
593	G	31.3	Very low	32.9	Very low	70 Å²	70	138.5 Å²	138.5	72%	0.722	81%	0.812	S	S	*	*			trans	157.5	139.2	152	0	0	0	0	0	119
594	I	34.1	Very low	33.4	Very low	160 Å²	160	139.2 Å²	139.2	82%	0.821	81%	0.809	S	S	*	*			trans	78.9	89.2	143	-50.9	178.7	0	0	0	118.5
595	L	35	Very low	33.6	Very low	138 Å²	138	142 Å²	142	72%	0.723	81%	0.811	S	S	*	*				51.8	124.5	125.6	-58.7	175.6	0	0	0	122.3
596	K	35	Very low	34.3	Very low	180 Å²	180	142.5 Å²	142.5	78%	0.783	81%	0.809	S	S	*	*				55	138.7	128.7	-59.3	-179.7	174.1	-175.3	0	118.7
597	E	37.3	Very low	34.6	Very low	195 Å²	195	145.6 Å²	145.6	91%	0.911	81%	0.811	S	S	*	*			cis	-141.7	-175.1	43.2	-76.7	-176.6	152.5	0	0	112.6
598	G	32.4	Very low	35.2	Very low	72 Å²	72	146.3 Å²	146.3	74%	0.742	81%	0.808	S	S	*	*			trans	-136.1	161.5	-170	0	0	0	0	0	115.1
599	I	38	Very low	35.7	Very low	168 Å²	168	146.1 Å²	146.1	86%	0.862	81%	0.807	S	S	*	*			trans	-124.9	127.9	172.5	-61.6	176.8	0	0	0	107.8
600	S	34	Very low	36	Very low	111 Å²	111	147 Å²	147	78%	0.776	81%	0.806	S	S	*	*			trans	-98.6	134.8	-176.1	-58.9	0	0	0	0	112
601	I	38.9	Very low	36.4	Very low	150 Å²	150	146.5 Å²	146.5	77%	0.769	80%	0.803	S	S	*	*			trans	-127.5	117.2	168.7	-57.4	179.8	0	0	0	108.2
602	N	33.1	Very low	36.7	Very low	151 Å²	151	149.4 Å²	149.4	81%	0.807	80%	0.803	S	S	*	*			trans	-84	125.5	-177.1	-75.6	-44.3	0	0	0	111.8
603	L	38.9	Very low	37.1	Very low	159 Å²	159	148.6 Å²	148.6	83%	0.832	79%	0.794	S	S	*	*			trans	-130.5	91	168.2	-85.9	168.7	0	0	0	111.6
604	H	36.2	Very low	37.7	Very low	175 Å²	175	153.7 Å²	153.7	81%	0.81	80%	0.799	S	S	*	*			trans	20.5	103.9	156.7	-74.9	79	0	0	0	118.9	N606	H604-N606 PolarHBondContact O-N 3.19Å; H604-N606 VanDerWaalsContact O-N 3.14Å
605	T	34.7	Very low	38.5	Very low	137 Å²	137	154.2 Å²	154.2	84%	0.84	80%	0.796	S	S	*	*			trans	-73.9	94.5	166.7	52.6	0	0	0	0	112	K607	T605-K607 PolarHBondContact O-N 3.2Å
606	N	41.2	Very low	39.3	Very low	143 Å²	143	154.8 Å²	154.8	77%	0.765	80%	0.798	S	S	*	*			trans	-75.1	112.6	163	-87.9	-19.3	0	0	0	109.9	H604 I608	H604-N606 PolarHBondContact O-N 3.19Å; H604-N606 VanDerWaalsContact O-N 3.14Å; N606-I608 PolarHBondContact O-N 3.27Å
607	K	35.4	Very low	40.3	Very low	202 Å²	202	150.9 Å²	150.9	88%	0.878	79%	0.789	S	S	*	*			trans	-72.2	90.4	170.9	-74.7	-176	176.7	179.3	0	110.1	T605	T605-K607 PolarHBondContact O-N 3.2Å
608	I	44.5	Very low	41.4	Very low	143 Å²	143	144 Å²	144	73%	0.733	76%	0.763	S	S	*	*			trans	-89.6	125.7	163.6	-60.2	178.3	0	0	0	107.2	N606 E610	N606-I608 PolarHBondContact O-N 3.27Å; I608-E610 PolarHBondContact O-N 2.94Å; I608-E610 VanDerWaalsContact O-N 3.14Å
609	N	38	Very low	43.2	Very low	153 Å²	153	146.8 Å²	146.8	82%	0.818	76%	0.76	S	S	*	*			trans	-74	102	176.9	-70	-29.8	0	0	0	109.4
610	E	38.8	Very low	45	Very low	177 Å²	177	145.2 Å²	145.2	83%	0.827	74%	0.744	S	S	*	*			trans	-66.4	132.8	167.1	-68.6	-165.3	140.1	0	0	110.1	I608	I608-E610 PolarHBondContact O-N 2.94Å; I608-E610 VanDerWaalsContact O-N 3.14Å
611	P	42.3	Very low	46.9	Very low	108 Å²	108	143.3 Å²	143.3	70%	0.701	72%	0.724	S	S	*	*			trans	-68	138.1	173.2	29.2	-33.4	0	0	0	109.5	N613	P611-N613 PolarHBondContact O-N 3.06Å
612	K	40	Very low	48.9	Very low	205 Å²	205	141.8 Å²	141.8	89%	0.891	72%	0.717	S	S	*	*			trans	-67.8	82.8	169.8	-70.9	-175.2	177.9	-177.8	0	109.8	E614	K612-E614 PolarHBondContact O-N 2.95Å
613	N	40.8	Very low	51.5	Low	123 Å²	123	137.8 Å²	137.8	66%	0.658	70%	0.696	S	S	*	*			trans	-70.4	95.8	170.7	-113.4	-2.7	0	0	0	108.3	P611 F615	P611-N613 PolarHBondContact O-N 3.06Å; N613-F615 HydrophobicContact CB-CD2 4.37Å; N613-F615 HydrophobicContact CB-CE2 4.25Å; N613-F615 PolarHBondContact O-N 3.38Å
614	E	43.3	Very low	54	Low	178 Å²	178	133.5 Å²	133.5	83%	0.832	68%	0.677	S	S	*	*			trans	-63.4	91.5	162.2	-70.5	-171.3	141.3	0	0	108.1	K612 I616	K612-E614 PolarHBondContact O-N 2.95Å; E614-I616 PolarHBondContact O-N 3.28Å
615	F	51.1	Low	56.7	Low	171 Å²	171	127.6 Å²	127.6	75%	0.75	65%	0.652	S	S	*	*			trans	-61	101.7	168.2	-83.7	-88.4	0	0	0	108	N613 T617	N613-F615 HydrophobicContact CB-CD2 4.37Å; N613-F615 HydrophobicContact CB-CE2 4.25Å; N613-F615 PolarHBondContact O-N 3.38Å; F615-T617 PolarHBondContact O-N 3.33Å
616	I	51	Low	59.5	Low	149 Å²	149	127.7 Å²	127.7	76%	0.764	64%	0.643	S	S	*	*			trans	-63.6	85.3	167.9	-56.7	176.1	0	0	0	107	E614 S618	E614-I616 PolarHBondContact O-N 3.28Å; I616-S618 PolarHBondContact O-N 3.35Å
617	T	55.5	Low	62	Low	98 Å²	98	125.2 Å²	125.2	60%	0.601	63%	0.629	S	S	*	*			trans	-58.8	103.5	170.5	45	0	0	0	0	106.3	F615 N619	F615-T617 PolarHBondContact O-N 3.33Å; T617-N619 PolarHBondContact O-N 2.97Å
618	S	61.6	Low	64.6	Low	51 Å²	51	116.6 Å²	116.6	36%	0.357	59%	0.591	S	S	.	*			trans	-60.6	118.8	-162	-53	0	0	0	0	109.1	I616 W620 L621	I616-S618 PolarHBondContact O-N 3.35Å; S618-W620 PolarHBondContact O-N 3.25Å; S618-L621 WeakPolarHBondContact O-CB 3.32Å; S618-L621 PolarHBondContact O-N 3.36Å
619	N	69.6	Low	67	Low	130 Å²	130	111.4 Å²	111.4	70%	0.695	56%	0.564	S	S	*	*	G	3₁₀ helix	trans	-55.6	-22.5	-157.5	-151	-3.1	0	0	0	114.3	T617 L621 L622	T617-N619 PolarHBondContact O-N 2.97Å; N619-L621 VanDerWaalsContact C-N 3.3Å; N619-L621 PolarHBondContact O-N 3.31Å; N619-L622 PolarHBondContact O-N 3.18Å
620	W	76	Confident	69.6	Low	135 Å²	135	107.4 Å²	107.4	51%	0.511	54%	0.541	S	S	.	.	G	3₁₀ helix	trans	-66.3	-20.8	173	61.6	-96.8	0	0	0	114.8	S618 L622 L623 W628 L650	S618-W620 PolarHBondContact O-N 3.25Å; W620-L622 VanDerWaalsContact C-N 3.28Å; W620-L623 WeakPolarHBondContact O-CD1 3.43Å; W620-L623 VanDerWaalsContact O-CG 3.3Å; W620-L623 WeakPolarHBondContact O-CG 3.35Å; W620-W628 AromaticContact CE3-CH2 3.41Å; W620-W628 HydrophobicContact CE3-CH2 3.41Å; W620-W628 VanDerWaalsContact CE3-CH2 3.41Å; W620-W628 AromaticContact CE3-CZ2 3.38Å; W620-W628 HydrophobicContact CE3-CZ2 3.38Å; W620-W628 AromaticContact CZ3-CH2 3.5Å; W620-W628 HydrophobicContact CZ3-CH2 3.5Å; W620-W628 AromaticContact CZ3-CZ2 3.58Å; W620-W628 HydrophobicContact CZ3-CZ2 3.58Å; W620-W628 WeakPolarHBondContact O-CZ2 3.29Å; W620-L650 HydrophobicContact CZ3-CD1 4.45Å
621	L	73.5	Confident	72.1	Confident	71 Å²	71	102.5 Å²	102.5	37%	0.372	52%	0.523	S	S	.	.	G	3₁₀ helix	trans	-76.4	-13.2	172.3	-75	168.4	0	0	0	113.3	S618 N619 L623 W628	S618-L621 WeakPolarHBondContact O-CB 3.32Å; S618-L621 PolarHBondContact O-N 3.36Å; N619-L621 VanDerWaalsContact C-N 3.3Å; N619-L621 PolarHBondContact O-N 3.31Å; L621-L623 VanDerWaalsContact C-N 3.32Å; L621-W628 HydrophobicContact CD2-CZ2 4.48Å
622	L	80.9	Confident	74.5	Confident	118 Å²	118	97.4 Å²	97.4	62%	0.618	49%	0.489	S	S	*	.	G	3₁₀ helix	trans	-89.7	3.2	176.5	-58.7	176.5	0	0	0	112.8	N619 W620	N619-L622 PolarHBondContact O-N 3.18Å; W620-L622 VanDerWaalsContact C-N 3.28Å
623	L	87.7	Confident	77	Confident	67 Å²	67	92.5 Å²	92.5	35%	0.351	47%	0.465	S	S	.	.	S	Bend	trans	-65.4	134.7	172.2	-66.1	173.9	0	0	0	110.4	W620 L621 L627 W628	W620-L623 WeakPolarHBondContact O-CD1 3.43Å; W620-L623 VanDerWaalsContact O-CG 3.3Å; W620-L623 WeakPolarHBondContact O-CG 3.35Å; L621-L623 VanDerWaalsContact C-N 3.32Å; L623-L627 HydrophobicContact CB-CB 4.46Å; L623-L627 HydrophobicContact CD2-CD1 4.05Å; L623-W628 VanDerWaalsContact O-CD1 3.26Å
624	P	91.7	Very high	79.5	Confident	69 Å²	69	95.2 Å²	95.2	45%	0.448	47%	0.468	S	S	.	.			trans	-56.6	152.5	173.6	-27.7	35.5	0	0	0	113.7	E626 L627 W628	P624-E626 WeakPolarHBondContact CB-OE2 3.39Å; P624-E626 PolarHBondContact O-N 2.82Å; P624-E626 VanDerWaalsContact O-N 3.09Å; P624-L627 PolarHBondContact O-N 2.75Å; P624-W628 PolarHBondContact O-N 3.35Å; P624-W628 VanDerWaalsContact O-N 3.1Å
625	D	93.3	Very high	81.7	Confident	51 Å²	51	89.3 Å²	89.3	27%	0.273	44%	0.442	S	S	.	.	H	α-helix	trans	-48.8	-37.7	177.3	-84.2	8.9	0	0	0	112.4	W628 L629 H649 R652 L653	D625-W628 WeakPolarHBondContact O-CB 3.2Å; D625-W628 PolarHBondContact O-N 2.89Å; D625-L629 WeakPolarHBondContact O-CB 3.23Å; D625-L629 VanDerWaalsContact O-CG 3.26Å; D625-L629 WeakPolarHBondContact O-CG 3.46Å; D625-L629 PolarHBondContact O-N 3.03Å; D625-H649 IonicContact OD1-CE1 2.64Å; D625-H649 PolarHBondContact OD1-CE1 3.43Å; D625-H649 VanDerWaalsContact OD1-CE1 3.26Å; D625-H649 IonicContact OD1-NE2 2.96Å; D625-R652 IonicContact OD1-CZ 3.72Å; D625-R652 IonicContact OD1-NH1 3.97Å; D625-R652 IonicContact OD1-NH2 2.76Å; D625-R652 PolarHBondContact OD1-NH2 3.01Å; D625-R652 IonicContact OD2-CZ 3.12Å; D625-R652 VanDerWaalsContact OD2-CZ 3.26Å; D625-R652 IonicContact OD2-NH1 2.69Å; D625-R652 PolarHBondContact OD2-NH1 2.93Å; D625-R652 IonicContact OD2-NH2 2.93Å; D625-R652 PolarHBondContact OD2-NH2 3.25Å; D625-L653 HydrophobicContact CB-CD2 4.17Å
626	E	93.3	Very high	83.3	Confident	139 Å²	139	83.4 Å²	83.4	65%	0.65	42%	0.421	S	S	*	.	H	α-helix	trans	-66	-40	179.7	-60.9	84.1	173.4	0	0	112.9	P624 E630	P624-E626 WeakPolarHBondContact CB-OE2 3.39Å; P624-E626 PolarHBondContact O-N 2.82Å; P624-E626 VanDerWaalsContact O-N 3.09Å; E626-E630 PolarHBondContact O-N 3.41Å
627	L	92.8	Very high	84.9	Confident	91 Å²	91	79.9 Å²	79.9	48%	0.476	41%	0.408	S	S	.	.	H	α-helix	trans	-71.7	-35.5	176.5	-61.4	-170.7	0	0	0	110.6	L623 P624 E630 V631	L623-L627 HydrophobicContact CB-CB 4.46Å; L623-L627 HydrophobicContact CD2-CD1 4.05Å; P624-L627 PolarHBondContact O-N 2.75Å; L627-E630 PolarHBondContact O-N 3.25Å; L627-V631 WeakPolarHBondContact O-CG2 3.21Å; L627-V631 PolarHBondContact O-N 2.97Å
628	W	91.8	Very high	86.2	Confident	22 Å²	22	77.4 Å²	77.4	8%	0.083	39%	0.393	C	S	.	.	H	α-helix	trans	-63.5	-46.7	171.8	-89.4	122.7	0	0	0	113.1	W620 L621 L623 P624 D625 E630 V631 L632 H649 L650 L653	W620-W628 AromaticContact CE3-CH2 3.41Å; W620-W628 HydrophobicContact CE3-CH2 3.41Å; W620-W628 VanDerWaalsContact CE3-CH2 3.41Å; W620-W628 AromaticContact CE3-CZ2 3.38Å; W620-W628 HydrophobicContact CE3-CZ2 3.38Å; W620-W628 AromaticContact CZ3-CH2 3.5Å; W620-W628 HydrophobicContact CZ3-CH2 3.5Å; W620-W628 AromaticContact CZ3-CZ2 3.58Å; W620-W628 HydrophobicContact CZ3-CZ2 3.58Å; W620-W628 WeakPolarHBondContact O-CZ2 3.29Å; L621-W628 HydrophobicContact CD2-CZ2 4.48Å; L623-W628 VanDerWaalsContact O-CD1 3.26Å; P624-W628 PolarHBondContact O-N 3.35Å; P624-W628 VanDerWaalsContact O-N 3.1Å; D625-W628 WeakPolarHBondContact O-CB 3.2Å; D625-W628 PolarHBondContact O-N 2.89Å; W628-E630 PolarHBondContact O-N 2.91Å; W628-V631 HydrophobicContact CE3-CB 4.4Å; W628-V631 HydrophobicContact CE3-CG1 4.42Å; W628-V631 HydrophobicContact CZ3-CG1 4.36Å; W628-V631 PolarHBondContact O-N 3.46Å; W628-V631 VanDerWaalsContact O-N 3.16Å; W628-L632 WeakPolarHBondContact O-CB 3.37Å; W628-L632 WeakPolarHBondContact O-CG 3.36Å; W628-L632 PolarHBondContact O-N 2.76Å; W628-H649 AromaticContact CD1-NE2 3.39Å; W628-H649 AromaticContact NE1-NE2 3.58Å; W628-L650 HydrophobicContact CD2-CD2 3.78Å; W628-L650 HydrophobicContact CE3-CD2 3.62Å; W628-L650 HydrophobicContact CG-CD2 4.48Å; W628-L650 HydrophobicContact CH2-CD1 4.25Å; W628-L650 HydrophobicContact CH2-CD2 3.88Å; W628-L650 HydrophobicContact CZ2-CD2 3.99Å; W628-L650 HydrophobicContact CZ3-CD2 3.7Å; W628-L653 HydrophobicContact CB-CD1 3.45Å; W628-L653 VanDerWaalsContact CB-CD1 3.45Å; W628-L653 HydrophobicContact CG-CD1 3.88Å
629	L	93.4	Very high	87.5	Confident	34 Å²	34	77.5 Å²	77.5	18%	0.178	39%	0.389	C	S	.	.	H	α-helix	trans	-61.2	-36.1	176.5	-71.8	172.1	0	0	0	111.2	D625 L632 R633 L653 D656 L659	D625-L629 WeakPolarHBondContact O-CB 3.23Å; D625-L629 VanDerWaalsContact O-CG 3.26Å; D625-L629 WeakPolarHBondContact O-CG 3.46Å; D625-L629 PolarHBondContact O-N 3.03Å; L629-L632 PolarHBondContact O-N 3.21Å; L629-R633 WeakPolarHBondContact O-CB 3.42Å; L629-R633 PolarHBondContact O-N 2.79Å; L629-L653 HydrophobicContact CD2-CB 4.36Å; L629-L653 HydrophobicContact CD2-CD2 4.31Å; L629-L653 HydrophobicContact CG-CD2 4.37Å; L629-D656 HydrophobicContact CD2-CB 3.64Å; L629-L659 HydrophobicContact CD2-CD1 4.16Å; L629-L659 HydrophobicContact CD2-CD2 4.42Å; L629-L659 HydrophobicContact CD2-CG 4.14Å
630	E	92.7	Very high	88.5	Confident	69 Å²	69	72.6 Å²	72.6	32%	0.322	36%	0.361	S	S	.	.	H	α-helix	trans	-65.9	-42.8	173.2	-172.5	52.6	-136.9	0	0	112.4	E626 L627 W628 R633 Y634	E626-E630 PolarHBondContact O-N 3.41Å; L627-E630 PolarHBondContact O-N 3.25Å; W628-E630 PolarHBondContact O-N 2.91Å; E630-R633 VanDerWaalsContact CD-NE 3.3Å; E630-R633 WeakPolarHBondContact O-CB 3.4Å; E630-R633 PolarHBondContact O-N 3.44Å; E630-R633 IonicContact OE1-CZ 3.26Å; E630-R633 IonicContact OE1-NE 3.16Å; E630-R633 PolarHBondContact OE1-NE 3.44Å; E630-R633 IonicContact OE1-NH2 3.26Å; E630-R633 PolarHBondContact OE1-NH2 3.13Å; E630-R633 IonicContact OE2-CZ 3.91Å; E630-R633 VanDerWaalsContact OE2-CZ 3.24Å; E630-R633 IonicContact OE2-NE 3.24Å; E630-R633 PolarHBondContact OE2-NE 2.74Å; E630-R633 IonicContact OE2-NH2 3.81Å; E630-R633 PolarHBondContact OE2-NH2 3.04Å; E630-Y634 HydrophobicContact CG-CE2 4.49Å; E630-Y634 VanDerWaalsContact O-CD2 3.23Å; E630-Y634 WeakPolarHBondContact O-CD2 3.49Å; E630-Y634 WeakPolarHBondContact OE1-CE2 3.44Å
631	V	92.5	Very high	89	Confident	73 Å²	73	66.5 Å²	66.5	44%	0.442	34%	0.339	S	S	.	.	H	α-helix	trans	-61.6	-48.1	172.7	169.7	0	0	0	0	111.5	L627 W628 R633 Y634	L627-V631 WeakPolarHBondContact O-CG2 3.21Å; L627-V631 PolarHBondContact O-N 2.97Å; W628-V631 HydrophobicContact CE3-CB 4.4Å; W628-V631 HydrophobicContact CE3-CG1 4.42Å; W628-V631 HydrophobicContact CZ3-CG1 4.36Å; W628-V631 PolarHBondContact O-N 3.46Å; W628-V631 VanDerWaalsContact O-N 3.16Å; V631-R633 PolarHBondContact O-N 2.83Å; V631-Y634 PolarHBondContact O-N 2.85Å
632	L	93	Very high	89.9	Confident	1 Å²	1	68.3 Å²	68.3	1%	0.005	34%	0.341	C	S	.	.	H	α-helix	trans	-64.7	-24.5	179.1	-65.9	171.3	0	0	0	112.3	W628 L629 Y634 L635 R640 V643 L653 L659	W628-L632 WeakPolarHBondContact O-CB 3.37Å; W628-L632 WeakPolarHBondContact O-CG 3.36Å; W628-L632 PolarHBondContact O-N 2.76Å; L629-L632 PolarHBondContact O-N 3.21Å; L632-Y634 VanDerWaalsContact C-N 3.29Å; L632-Y634 PolarHBondContact O-N 3.19Å; L632-L635 HydrophobicContact CD2-CD1 3.76Å; L632-L635 WeakPolarHBondContact O-CB 3.45Å; L632-L635 PolarHBondContact O-N 3.04Å; L632-R640 PolarHBondContact O-NE 3.31Å; L632-V643 HydrophobicContact CD2-CB 4.37Å; L632-V643 HydrophobicContact CD2-CG1 3.71Å; L632-L653 HydrophobicContact CD1-CB 3.64Å; L632-L659 HydrophobicContact CB-CD1 3.78Å; L632-L659 HydrophobicContact CB-CD2 4Å; L632-L659 HydrophobicContact CD1-CD1 4.13Å
633	R	92.3	Very high	90.4	Very high	102 Å²	102	64.4 Å²	64.4	39%	0.385	32%	0.321	S	S	.	.	H	α-helix	trans	-60.1	-37.1	175.7	-163.8	169.7	72.9	133.8	-1.9	112.2	L629 E630 V631 R640 L659	L629-R633 WeakPolarHBondContact O-CB 3.42Å; L629-R633 PolarHBondContact O-N 2.79Å; E630-R633 VanDerWaalsContact CD-NE 3.3Å; E630-R633 WeakPolarHBondContact O-CB 3.4Å; E630-R633 PolarHBondContact O-N 3.44Å; E630-R633 IonicContact OE1-CZ 3.26Å; E630-R633 IonicContact OE1-NE 3.16Å; E630-R633 PolarHBondContact OE1-NE 3.44Å; E630-R633 IonicContact OE1-NH2 3.26Å; E630-R633 PolarHBondContact OE1-NH2 3.13Å; E630-R633 IonicContact OE2-CZ 3.91Å; E630-R633 VanDerWaalsContact OE2-CZ 3.24Å; E630-R633 IonicContact OE2-NE 3.24Å; E630-R633 PolarHBondContact OE2-NE 2.74Å; E630-R633 IonicContact OE2-NH2 3.81Å; E630-R633 PolarHBondContact OE2-NH2 3.04Å; V631-R633 PolarHBondContact O-N 2.83Å; R633-R640 PolarHBondContact O-NH2 3Å; R633-L659 HydrophobicContact CB-CD2 4.37Å
634	Y	91.7	Very high	90.6	Very high	181 Å²	181	61.4 Å²	61.4	71%	0.71	31%	0.307	S	S	*	.	H	α-helix	trans	-76.4	-19.4	178.3	-69.7	-80.2	0	0	0	114.3	E630 V631 L632	E630-Y634 HydrophobicContact CG-CE2 4.49Å; E630-Y634 VanDerWaalsContact O-CD2 3.23Å; E630-Y634 WeakPolarHBondContact O-CD2 3.49Å; E630-Y634 WeakPolarHBondContact OE1-CE2 3.44Å; V631-Y634 PolarHBondContact O-N 2.85Å; L632-Y634 VanDerWaalsContact C-N 3.29Å; L632-Y634 PolarHBondContact O-N 3.19Å
635	L	89.8	Confident	90.5	Very high	54 Å²	54	62.1 Å²	62.1	28%	0.283	30%	0.304	S	S	.	.	S	Bend	trans	-71.8	147.5	176.8	-62.9	-175.6	0	0	0	111.7	L632 D639 R640 V643	L632-L635 HydrophobicContact CD2-CD1 3.76Å; L632-L635 WeakPolarHBondContact O-CB 3.45Å; L632-L635 PolarHBondContact O-N 3.04Å; L635-D639 HydrophobicContact CB-CB 4.1Å; L635-D639 HydrophobicContact CD2-CB 4.4Å; L635-R640 HydrophobicContact CB-CG 3.8Å; L635-R640 PolarHBondContact O-NE 3.31Å; L635-R640 VanDerWaalsContact O-NE 3.1Å; L635-R640 PolarHBondContact O-NH2 3.27Å; L635-V643 HydrophobicContact CD1-CB 4.34Å; L635-V643 HydrophobicContact CD1-CG2 3.73Å
636	S	86	Confident	90.5	Very high	46 Å²	46	64.1 Å²	64.1	32%	0.322	32%	0.318	S	S	.	.			trans	-64.6	158.5	170.7	86.2	0	0	0	0	110.8	V638 D639 R640	S636-V638 PolarHBondContact O-N 3.41Å; S636-V638 VanDerWaalsContact O-N 3.14Å; S636-V638 PolarHBondContact OG-N 2.88Å; S636-D639 VanDerWaalsContact CB-OD2 3.32Å; S636-D639 WeakPolarHBondContact CB-OD2 3.47Å; S636-D639 PolarHBondContact O-N 2.98Å; S636-D639 VanDerWaalsContact OG-CG 3.28Å; S636-D639 PolarHBondContact OG-N 3.41Å; S636-D639 VanDerWaalsContact OG-N 3.13Å; S636-D639 PolarHBondContact OG-OD2 2.98Å; S636-R640 WeakPolarHBondContact O-CG 3.27Å; S636-R640 PolarHBondContact O-N 3.02Å
637	P	82.9	Confident	90.3	Very high	75 Å²	75	59.9 Å²	59.9	49%	0.487	30%	0.303	S	S	.	.	H	α-helix	trans	-52.8	-34.6	173.8	-28.4	36.8	0	0	0	113.5	V641 W660	P637-V641 VanDerWaalsContact O-CG2 3.32Å; P637-V641 WeakPolarHBondContact O-CG2 3.46Å; P637-V641 PolarHBondContact O-N 2.56Å; P637-W660 HydrophobicContact CB-CH2 4.02Å; P637-W660 HydrophobicContact CB-CZ3 3.89Å
638	V	82.9	Confident	90.2	Very high	46 Å²	46	63.4 Å²	63.4	28%	0.279	31%	0.31	S	S	.	.	H	α-helix	trans	-70.8	-41.6	177.2	-172.3	0	0	0	0	111	T365 S636 V641 R642	T365-V638 HydrophobicContact CG2-CB 4.47Å; T365-V638 HydrophobicContact CG2-CG1 3.81Å; T365-V638 HydrophobicContact CG2-CG2 3.75Å; S636-V638 PolarHBondContact O-N 3.41Å; S636-V638 VanDerWaalsContact O-N 3.14Å; S636-V638 PolarHBondContact OG-N 2.88Å; V638-V641 PolarHBondContact O-N 2.79Å; V638-R642 VanDerWaalsContact CG1-CZ 3.48Å; V638-R642 WeakPolarHBondContact O-CG 3.46Å; V638-R642 PolarHBondContact O-N 3.48Å
639	D	90.4	Very high	90.2	Very high	53 Å²	53	65.2 Å²	65.2	28%	0.283	32%	0.319	S	S	.	.	H	α-helix	trans	-73.4	-31.2	-178.5	-60	-53.4	0	0	0	112.5	L635 S636 V641 R642 V643	L635-D639 HydrophobicContact CB-CB 4.1Å; L635-D639 HydrophobicContact CD2-CB 4.4Å; S636-D639 VanDerWaalsContact CB-OD2 3.32Å; S636-D639 WeakPolarHBondContact CB-OD2 3.47Å; S636-D639 PolarHBondContact O-N 2.98Å; S636-D639 VanDerWaalsContact OG-CG 3.28Å; S636-D639 PolarHBondContact OG-N 3.41Å; S636-D639 VanDerWaalsContact OG-N 3.13Å; S636-D639 PolarHBondContact OG-OD2 2.98Å; D639-V641 VanDerWaalsContact C-N 3.32Å; D639-V641 PolarHBondContact O-N 2.89Å; D639-R642 WeakPolarHBondContact O-CB 3.39Å; D639-R642 PolarHBondContact O-N 3.42Å; D639-R642 IonicContact OD1-CZ 3.04Å; D639-R642 IonicContact OD1-NH1 2.68Å; D639-R642 PolarHBondContact OD1-NH1 3.37Å; D639-V643 WeakPolarHBondContact O-CB 3.49Å; D639-V643 WeakPolarHBondContact O-CG2 3.4Å; D639-V643 PolarHBondContact O-N 3.3Å
640	R	90.6	Very high	90	Very high	27 Å²	27	64 Å²	64	10%	0.102	31%	0.313	C	S	.	.	H	α-helix	trans	-60.6	-42.6	168.1	-65.8	172.5	-168	164.1	3.7	111.5	L632 R633 L635 S636 R642 V643 A644 S654 L659 W660	L632-R640 PolarHBondContact O-NE 3.31Å; R633-R640 PolarHBondContact O-NH2 3Å; L635-R640 HydrophobicContact CB-CG 3.8Å; L635-R640 PolarHBondContact O-NE 3.31Å; L635-R640 VanDerWaalsContact O-NE 3.1Å; L635-R640 PolarHBondContact O-NH2 3.27Å; S636-R640 WeakPolarHBondContact O-CG 3.27Å; S636-R640 PolarHBondContact O-N 3.02Å; R640-R642 VanDerWaalsContact C-N 3.35Å; R640-V643 PolarHBondContact O-N 3.16Å; R640-A644 WeakPolarHBondContact O-CB 3.3Å; R640-A644 PolarHBondContact O-N 3.19Å; R640-S654 VanDerWaalsContact O-CB 3.25Å; R640-S654 WeakPolarHBondContact O-CB 3.38Å; R640-S654 PolarHBondContact O-OG 3.22Å; R640-L659 PolarHBondContact NH1-O 3.04Å; R640-W660 HydrophobicContact CB-CZ2 4.31Å
641	V	86.6	Confident	90	Very high	8 Å²	8	61.6 Å²	61.6	5%	0.048	30%	0.304	C	S	.	.	H	α-helix	trans	-68.7	-32.2	177	172.8	0	0	0	0	111.8	L361 P637 V638 D639 Q645 W660	L361-V641 HydrophobicContact CB-CG1 3.95Å; L361-V641 HydrophobicContact CD1-CG1 3.82Å; L361-V641 HydrophobicContact CD1-CG2 3.97Å; P637-V641 VanDerWaalsContact O-CG2 3.32Å; P637-V641 WeakPolarHBondContact O-CG2 3.46Å; P637-V641 PolarHBondContact O-N 2.56Å; V638-V641 PolarHBondContact O-N 2.79Å; D639-V641 VanDerWaalsContact C-N 3.32Å; D639-V641 PolarHBondContact O-N 2.89Å; V641-Q645 WeakPolarHBondContact O-CG 3.34Å; V641-Q645 PolarHBondContact O-NE2 3.38Å; V641-W660 HydrophobicContact CG2-CH2 3.99Å; V641-W660 HydrophobicContact CG2-CZ2 4.16Å
642	R	91.2	Very high	90	Very high	109 Å²	109	64.2 Å²	64.2	41%	0.411	31%	0.306	S	S	.	.	H	α-helix	trans	-65.5	-48.4	168.6	-70.4	166.8	-178	152.3	-0.3	111.5	L362 V638 D639 R640 A644 Q645	L362-R642 HydrophobicContact CD2-CG 3.92Å; V638-R642 VanDerWaalsContact CG1-CZ 3.48Å; V638-R642 WeakPolarHBondContact O-CG 3.46Å; V638-R642 PolarHBondContact O-N 3.48Å; D639-R642 WeakPolarHBondContact O-CB 3.39Å; D639-R642 PolarHBondContact O-N 3.42Å; D639-R642 IonicContact OD1-CZ 3.04Å; D639-R642 IonicContact OD1-NH1 2.68Å; D639-R642 PolarHBondContact OD1-NH1 3.37Å; R640-R642 VanDerWaalsContact C-N 3.35Å; R642-A644 PolarHBondContact O-N 3.2Å; R642-Q645 VanDerWaalsContact O-CB 3.27Å; R642-Q645 WeakPolarHBondContact O-CB 3.49Å; R642-Q645 PolarHBondContact O-N 3.12Å; R642-Q645 VanDerWaalsContact O-N 3.07Å
643	V	91.6	Very high	90	Very high	35 Å²	35	64.3 Å²	64.3	21%	0.212	31%	0.307	C	S	.	.	H	α-helix	trans	-63.8	-28.8	177.5	170.1	0	0	0	0	112.1	L632 L635 D639 R640 Q645 T646 L650	L632-V643 HydrophobicContact CD2-CB 4.37Å; L632-V643 HydrophobicContact CD2-CG1 3.71Å; L635-V643 HydrophobicContact CD1-CB 4.34Å; L635-V643 HydrophobicContact CD1-CG2 3.73Å; D639-V643 WeakPolarHBondContact O-CB 3.49Å; D639-V643 WeakPolarHBondContact O-CG2 3.4Å; D639-V643 PolarHBondContact O-N 3.3Å; R640-V643 PolarHBondContact O-N 3.16Å; V643-Q645 PolarHBondContact O-N 3.41Å; V643-T646 PolarHBondContact O-N 3.12Å; V643-T646 PolarHBondContact O-OG1 3.22Å; V643-L650 HydrophobicContact CG1-CB 3.94Å; V643-L650 HydrophobicContact CG1-CD1 4.06Å; V643-L650 HydrophobicContact CG1-CD2 4.38Å; V643-L650 HydrophobicContact CG1-CG 4.35Å
644	A	91.3	Very high	90	Very high	5 Å²	5	59.5 Å²	59.5	4%	0.041	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-10.1	174.2	0	0	0	0	0	114.4	R640 R642 S651 M655	R640-A644 WeakPolarHBondContact O-CB 3.3Å; R640-A644 PolarHBondContact O-N 3.19Å; R642-A644 PolarHBondContact O-N 3.2Å; A644-S651 WeakPolarHBondContact O-CB 3.38Å; A644-S651 PolarHBondContact O-OG 3.24Å; A644-M655 HydrophobicContact CB-CE 4.28Å
645	Q	90.9	Very high	89.9	Confident	84 Å²	84	53.1 Å²	53.1	39%	0.393	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.7	-11.3	-178.6	-58.2	164.7	38.4	0	0	112.8	V358 V641 R642 V643	V358-Q645 HydrophobicContact CB-CG 4.12Å; V358-Q645 HydrophobicContact CG1-CG 3.59Å; V358-Q645 HydrophobicContact CG2-CG 3.44Å; V358-Q645 VanDerWaalsContact CG2-CG 3.44Å; V641-Q645 WeakPolarHBondContact O-CG 3.34Å; V641-Q645 PolarHBondContact O-NE2 3.38Å; R642-Q645 VanDerWaalsContact O-CB 3.27Å; R642-Q645 WeakPolarHBondContact O-CB 3.49Å; R642-Q645 PolarHBondContact O-N 3.12Å; R642-Q645 VanDerWaalsContact O-N 3.07Å; V643-Q645 PolarHBondContact O-N 3.41Å
646	T	92.9	Very high	89.9	Confident	93 Å²	93	53 Å²	53	57%	0.571	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.3	-42.8	-167.8	62	0	0	0	0	113.2	V643 L650	V643-T646 PolarHBondContact O-N 3.12Å; V643-T646 PolarHBondContact O-OG1 3.22Å; T646-L650 WeakPolarHBondContact OG1-CD1 3.38Å
647	C	89.4	Confident	90	Very high	49 Å²	49	58.3 Å²	58.3	33%	0.331	28%	0.278	S	S	.	.			trans	-156.3	163.2	175.4	78.8	0	0	0	0	111.9	H649 L650 S651	C647-H649 VanDerWaalsContact C-N 3.31Å; C647-H649 PolarHBondContact O-N 2.73Å; C647-L650 PolarHBondContact O-N 2.86Å; C647-L650 PolarHBondContact SG-N 3.25Å; C647-L650 VanDerWaalsContact SG-N 3.42Å; C647-S651 WeakPolarHBondContact O-CB 3.23Å; C647-S651 PolarHBondContact O-N 2.94Å
648	R	90.3	Very high	90.3	Very high	166 Å²	166	58 Å²	58	63%	0.626	28%	0.278	S	S	*	.	H	α-helix	trans	-57.9	-40.2	-177.4	-59.4	-163.4	167.2	177.8	-3.7	113.5	W349 S651 R652	W349-R648 HydrophobicContact CD2-CG 4.28Å; W349-R648 HydrophobicContact CE3-CG 4.45Å; W349-R648 HydrophobicContact CH2-CB 4Å; W349-R648 HydrophobicContact CH2-CG 3.69Å; W349-R648 HydrophobicContact CZ2-CB 3.53Å; W349-R648 HydrophobicContact CZ2-CG 3.43Å; W349-R648 VanDerWaalsContact CZ2-CG 3.43Å; W349-R648 HydrophobicContact CZ3-CG 4.17Å; R648-S651 WeakPolarHBondContact O-CB 3.1Å; R648-S651 PolarHBondContact O-N 2.84Å; R648-R652 PolarHBondContact O-N 3.1Å; R648-R652 VanDerWaalsContact O-N 3.14Å
649	H	90.8	Very high	90.7	Very high	59 Å²	59	56.3 Å²	56.3	27%	0.273	27%	0.268	S	S	.	.	H	α-helix	trans	-65.1	-49.3	179.9	176.2	94.2	0	0	0	111.7	D625 W628 C647 S651 R652 L653	D625-H649 IonicContact OD1-CE1 2.64Å; D625-H649 PolarHBondContact OD1-CE1 3.43Å; D625-H649 VanDerWaalsContact OD1-CE1 3.26Å; D625-H649 IonicContact OD1-NE2 2.96Å; W628-H649 AromaticContact CD1-NE2 3.39Å; W628-H649 AromaticContact NE1-NE2 3.58Å; C647-H649 VanDerWaalsContact C-N 3.31Å; C647-H649 PolarHBondContact O-N 2.73Å; H649-S651 VanDerWaalsContact C-N 3.32Å; H649-S651 PolarHBondContact O-N 3.4Å; H649-R652 PolarHBondContact CE1-NH2 3.49Å; H649-R652 PolarHBondContact ND1-NH2 3.34Å; H649-R652 PolarHBondContact O-N 3.14Å; H649-L653 VanDerWaalsContact NE2-CD1 3.33Å; H649-L653 WeakPolarHBondContact NE2-CD1 3.43Å; H649-L653 PolarHBondContact O-N 3.13Å; H649-L653 VanDerWaalsContact O-N 3.1Å
650	L	91.1	Very high	90.8	Very high	8 Å²	8	55 Å²	55	4%	0.042	26%	0.259	C	S	.	.	H	α-helix	trans	-70.3	-27.6	177.2	-68.1	174.4	0	0	0	112.6	W620 W628 V643 T646 C647 L653 S654	W620-L650 HydrophobicContact CZ3-CD1 4.45Å; W628-L650 HydrophobicContact CD2-CD2 3.78Å; W628-L650 HydrophobicContact CE3-CD2 3.62Å; W628-L650 HydrophobicContact CG-CD2 4.48Å; W628-L650 HydrophobicContact CH2-CD1 4.25Å; W628-L650 HydrophobicContact CH2-CD2 3.88Å; W628-L650 HydrophobicContact CZ2-CD2 3.99Å; W628-L650 HydrophobicContact CZ3-CD2 3.7Å; V643-L650 HydrophobicContact CG1-CB 3.94Å; V643-L650 HydrophobicContact CG1-CD1 4.06Å; V643-L650 HydrophobicContact CG1-CD2 4.38Å; V643-L650 HydrophobicContact CG1-CG 4.35Å; T646-L650 WeakPolarHBondContact OG1-CD1 3.38Å; C647-L650 PolarHBondContact O-N 2.86Å; C647-L650 PolarHBondContact SG-N 3.25Å; C647-L650 VanDerWaalsContact SG-N 3.42Å; L650-L653 PolarHBondContact O-N 2.95Å; L650-S654 VanDerWaalsContact O-CB 3.26Å; L650-S654 WeakPolarHBondContact O-CB 3.44Å; L650-S654 PolarHBondContact O-N 3.15Å; L650-S654 PolarHBondContact O-OG 3.38Å
651	S	92	Very high	90.9	Very high	20 Å²	20	59.8 Å²	59.8	14%	0.14	28%	0.277	C	S	.	.	H	α-helix	trans	-60.1	-48.5	170	-151.8	0	0	0	0	112.2	A644 C647 R648 H649 M655	A644-S651 WeakPolarHBondContact O-CB 3.38Å; A644-S651 PolarHBondContact O-OG 3.24Å; C647-S651 WeakPolarHBondContact O-CB 3.23Å; C647-S651 PolarHBondContact O-N 2.94Å; R648-S651 WeakPolarHBondContact O-CB 3.1Å; R648-S651 PolarHBondContact O-N 2.84Å; H649-S651 VanDerWaalsContact C-N 3.32Å; H649-S651 PolarHBondContact O-N 3.4Å; S651-M655 WeakPolarHBondContact O-CG 3.39Å; S651-M655 PolarHBondContact O-N 3.15Å
652	R	92.6	Very high	91.1	Very high	127 Å²	127	62.8 Å²	62.8	48%	0.479	30%	0.295	S	S	.	.	H	α-helix	trans	-59.8	-47.3	174.3	179.3	-173.8	61.8	101.7	5.8	111.7	D625 R648 H649 M655	D625-R652 IonicContact OD1-CZ 3.72Å; D625-R652 IonicContact OD1-NH1 3.97Å; D625-R652 IonicContact OD1-NH2 2.76Å; D625-R652 PolarHBondContact OD1-NH2 3.01Å; D625-R652 IonicContact OD2-CZ 3.12Å; D625-R652 VanDerWaalsContact OD2-CZ 3.26Å; D625-R652 IonicContact OD2-NH1 2.69Å; D625-R652 PolarHBondContact OD2-NH1 2.93Å; D625-R652 IonicContact OD2-NH2 2.93Å; D625-R652 PolarHBondContact OD2-NH2 3.25Å; R648-R652 PolarHBondContact O-N 3.1Å; R648-R652 VanDerWaalsContact O-N 3.14Å; H649-R652 PolarHBondContact CE1-NH2 3.49Å; H649-R652 PolarHBondContact ND1-NH2 3.34Å; H649-R652 PolarHBondContact O-N 3.14Å; R652-M655 PolarHBondContact O-N 2.86Å
653	L	93.1	Very high	91.2	Very high	4 Å²	4	58.3 Å²	58.3	2%	0.021	28%	0.279	C	S	.	.	H	α-helix	trans	-73.3	-39.4	-175.2	-66.3	-175.6	0	0	0	113.5	D625 W628 L629 L632 H649 L650 M655 D656 L659	D625-L653 HydrophobicContact CB-CD2 4.17Å; W628-L653 HydrophobicContact CB-CD1 3.45Å; W628-L653 VanDerWaalsContact CB-CD1 3.45Å; W628-L653 HydrophobicContact CG-CD1 3.88Å; L629-L653 HydrophobicContact CD2-CB 4.36Å; L629-L653 HydrophobicContact CD2-CD2 4.31Å; L629-L653 HydrophobicContact CG-CD2 4.37Å; L632-L653 HydrophobicContact CD1-CB 3.64Å; H649-L653 VanDerWaalsContact NE2-CD1 3.33Å; H649-L653 WeakPolarHBondContact NE2-CD1 3.43Å; H649-L653 PolarHBondContact O-N 3.13Å; H649-L653 VanDerWaalsContact O-N 3.1Å; L650-L653 PolarHBondContact O-N 2.95Å; L653-M655 PolarHBondContact O-N 2.89Å; L653-M655 VanDerWaalsContact O-N 3.13Å; L653-D656 WeakPolarHBondContact O-CB 3.46Å; L653-D656 PolarHBondContact O-N 3.27Å; L653-L659 WeakPolarHBondContact O-CD1 3.33Å
654	S	92.6	Very high	91.2	Very high	1 Å²	1	61.6 Å²	61.6	1%	0.007	29%	0.292	C	S	.	.	H	α-helix	trans	-61.1	-20	172.9	-84.3	0	0	0	0	113.5	R640 L650 W660	R640-S654 VanDerWaalsContact O-CB 3.25Å; R640-S654 WeakPolarHBondContact O-CB 3.38Å; R640-S654 PolarHBondContact O-OG 3.22Å; L650-S654 VanDerWaalsContact O-CB 3.26Å; L650-S654 WeakPolarHBondContact O-CB 3.44Å; L650-S654 PolarHBondContact O-N 3.15Å; L650-S654 PolarHBondContact O-OG 3.38Å; S654-W660 PolarHBondContact O-NE1 3.09Å
655	M	88.3	Confident	91.2	Very high	47 Å²	47	62.5 Å²	62.5	23%	0.232	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.8	4	177	-64.9	-64.3	-179.3	0	0	113.5	W348 A644 S651 R652 L653	W348-M655 HydrophobicContact CZ3-CG 4.29Å; A644-M655 HydrophobicContact CB-CE 4.28Å; S651-M655 WeakPolarHBondContact O-CG 3.39Å; S651-M655 PolarHBondContact O-N 3.15Å; R652-M655 PolarHBondContact O-N 2.86Å; L653-M655 PolarHBondContact O-N 2.89Å; L653-M655 VanDerWaalsContact O-N 3.13Å
656	D	90.4	Very high	91.2	Very high	52 Å²	52	62.6 Å²	62.6	28%	0.278	30%	0.296	S	S	.	.			trans	-68.2	143.4	179.6	179.7	-107.9	0	0	0	113.4	L629 L653 S658 L659 W660	L629-D656 HydrophobicContact CD2-CB 3.64Å; L653-D656 WeakPolarHBondContact O-CB 3.46Å; L653-D656 PolarHBondContact O-N 3.27Å; D656-S658 PolarHBondContact O-N 3.37Å; D656-S658 WeakPolarHBondContact OD1-CB 3.46Å; D656-S658 PolarHBondContact OD1-N 2.79Å; D656-S658 PolarHBondContact OD1-OG 3.06Å; D656-L659 WeakPolarHBondContact O-CB 3.36Å; D656-L659 PolarHBondContact O-N 2.85Å; D656-L659 VanDerWaalsContact O-N 3.1Å; D656-W660 VanDerWaalsContact O-CD1 3.26Å
657	R	87.2	Confident	91	Very high	156 Å²	156	62.9 Å²	62.9	59%	0.589	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-20.3	-175.6	-68.2	-179.9	-71.8	-130.9	1	113.9	L659 R661	R657-L659 VanDerWaalsContact C-N 3.33Å; R657-R661 PolarHBondContact O-N 3.37Å
658	S	90.1	Very high	90.8	Very high	68 Å²	68	63.6 Å²	63.6	48%	0.476	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-36.9	173.6	65.7	0	0	0	0	112.2	D656	D656-S658 PolarHBondContact O-N 3.37Å; D656-S658 WeakPolarHBondContact OD1-CB 3.46Å; D656-S658 PolarHBondContact OD1-N 2.79Å; D656-S658 PolarHBondContact OD1-OG 3.06Å
659	L	92	Very high	90.5	Very high	12 Å²	12	59 Å²	59	6%	0.063	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-36.8	-179.5	-57.8	-179.6	0	0	0	112	L629 L632 R633 R640 L653 D656 R657	L629-L659 HydrophobicContact CD2-CD1 4.16Å; L629-L659 HydrophobicContact CD2-CD2 4.42Å; L629-L659 HydrophobicContact CD2-CG 4.14Å; L632-L659 HydrophobicContact CB-CD1 3.78Å; L632-L659 HydrophobicContact CB-CD2 4Å; L632-L659 HydrophobicContact CD1-CD1 4.13Å; R633-L659 HydrophobicContact CB-CD2 4.37Å; R640-L659 PolarHBondContact NH1-O 3.04Å; L653-L659 WeakPolarHBondContact O-CD1 3.33Å; D656-L659 WeakPolarHBondContact O-CB 3.36Å; D656-L659 PolarHBondContact O-N 2.85Å; D656-L659 VanDerWaalsContact O-N 3.1Å; R657-L659 VanDerWaalsContact C-N 3.33Å
660	W	91.2	Very high	90.3	Very high	25 Å²	25	62.2 Å²	62.2	10%	0.095	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.9	16	-174.6	-58.6	101.2	0	0	0	114.2	P637 R640 V641 S654 D656 V662 I663 L682	P637-W660 HydrophobicContact CB-CH2 4.02Å; P637-W660 HydrophobicContact CB-CZ3 3.89Å; R640-W660 HydrophobicContact CB-CZ2 4.31Å; V641-W660 HydrophobicContact CG2-CH2 3.99Å; V641-W660 HydrophobicContact CG2-CZ2 4.16Å; S654-W660 PolarHBondContact O-NE1 3.09Å; D656-W660 VanDerWaalsContact O-CD1 3.26Å; W660-V662 PolarHBondContact O-N 3.07Å; W660-V662 VanDerWaalsContact O-N 3.13Å; W660-I663 HydrophobicContact CE3-CD1 4.42Å; W660-I663 HydrophobicContact CE3-CG1 4.31Å; W660-L682 HydrophobicContact CB-CB 4.03Å; W660-L682 HydrophobicContact CB-CD1 4.32Å; W660-L682 HydrophobicContact CB-CD2 4.37Å; W660-L682 HydrophobicContact CB-CG 4.47Å; W660-L682 HydrophobicContact CD2-CD1 3.87Å; W660-L682 HydrophobicContact CD2-CD2 4.32Å; W660-L682 HydrophobicContact CE3-CD1 3.88Å; W660-L682 HydrophobicContact CG-CB 4.44Å; W660-L682 HydrophobicContact CG-CD1 4.04Å; W660-L682 HydrophobicContact CG-CD2 3.91Å; W660-L682 HydrophobicContact CG-CG 4.36Å
661	R	92.4	Very high	90.2	Very high	128 Å²	128	62.2 Å²	62.2	48%	0.483	29%	0.285	S	S	.	.	S	Bend	trans	-56.7	-30	-179.9	-161.9	-175.5	84.9	178.2	4.3	113.6	R657 K685 E686	R657-R661 PolarHBondContact O-N 3.37Å; R661-K685 HydrophobicContact CG-CB 4.05Å; R661-K685 HydrophobicContact CG-CD 3.97Å; R661-K685 HydrophobicContact CG-CG 4.11Å; R661-K685 PolarHBondContact O-N 2.8Å; R661-E686 PolarHBondContact O-N 3.17Å
662	V	92.4	Very high	90.3	Very high	71 Å²	71	63.9 Å²	63.9	43%	0.43	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	124.8	176.7	-176.5	0	0	0	0	108.2	W660 E686	W660-V662 PolarHBondContact O-N 3.07Å; W660-V662 VanDerWaalsContact O-N 3.13Å; V662-E686 CarbonylContact C-O 3.36Å; V662-E686 WeakPolarHBondContact CA-O 3.47Å; V662-E686 HydrophobicContact CB-CB 4.49Å; V662-E686 HydrophobicContact CG1-CB 4.29Å; V662-E686 HydrophobicContact CG1-CG 4.1Å; V662-E686 HydrophobicContact CG2-CB 4.19Å
663	I	93.1	Very high	90.4	Very high	14 Å²	14	59.2 Å²	59.2	7%	0.072	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	124.3	174.6	-65.3	178.4	0	0	0	108.6	W660 L665 I679 L682 P684 E686 L687 R688	W660-I663 HydrophobicContact CE3-CD1 4.42Å; W660-I663 HydrophobicContact CE3-CG1 4.31Å; I663-L665 HydrophobicContact CG2-CD2 4.5Å; I663-L665 HydrophobicContact CG2-CG 4.39Å; I663-I679 HydrophobicContact CD1-CG2 4.15Å; I663-I679 HydrophobicContact CG2-CG2 4.46Å; I663-L682 HydrophobicContact CD1-CB 4.09Å; I663-L682 HydrophobicContact CD1-CD1 3.76Å; I663-P684 HydrophobicContact CB-CB 4.42Å; I663-P684 HydrophobicContact CD1-CB 3.95Å; I663-P684 HydrophobicContact CD1-CG 4.01Å; I663-P684 HydrophobicContact CG1-CB 4.06Å; I663-E686 PolarHBondContact N-O 2.89Å; I663-L687 HydrophobicContact CB-CD1 3.96Å; I663-L687 HydrophobicContact CG2-CD1 3.86Å; I663-R688 PolarHBondContact O-N 2.7Å
664	H	91.9	Very high	90.4	Very high	104 Å²	104	61.5 Å²	61.5	48%	0.481	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	121.6	176.4	-172.7	-167.1	0	0	0	110.8	R688 T690	H664-R688 WeakPolarHBondContact CA-O 3.5Å; H664-R688 HydrophobicContact CB-CB 4.25Å; H664-R688 PolarHBondContact CD2-O 2.81Å; H664-T690 PolarHBondContact NE2-OG1 2.6Å
665	L	91.5	Very high	90.4	Very high	25 Å²	25	62.6 Å²	62.6	13%	0.131	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	122.4	173.9	-56.8	174.8	0	0	0	108.3	I663 Q668 L671 I679 R688 F689 T690 C692	I663-L665 HydrophobicContact CG2-CD2 4.5Å; I663-L665 HydrophobicContact CG2-CG 4.39Å; L665-Q668 HydrophobicContact CB-CG 4.12Å; L665-Q668 HydrophobicContact CD2-CG 4.38Å; L665-L671 HydrophobicContact CD1-CD1 4.24Å; L665-L671 HydrophobicContact CD1-CD2 4.32Å; L665-I679 HydrophobicContact CD1-CD1 3.76Å; L665-R688 PolarHBondContact N-O 2.84Å; L665-F689 HydrophobicContact CB-CD1 4.44Å; L665-F689 HydrophobicContact CD1-CD1 3.87Å; L665-F689 HydrophobicContact CD1-CE1 3.59Å; L665-F689 HydrophobicContact CD1-CZ 4.27Å; L665-F689 CarbonylContact O-C 3.55Å; L665-T690 PolarHBondContact O-N 3.04Å; L665-C692 PolarHBondContact O-SG 2.56Å; L665-C692 VanDerWaalsContact O-SG 3.36Å
666	H	89.2	Confident	90.7	Very high	85 Å²	85	60.3 Å²	60.3	39%	0.394	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	127.3	179	-170.1	82.5	0	0	0	109.7	Q668 T690 Y691	H666-Q668 PolarHBondContact O-N 3.32Å; H666-T690 CarbonylContact C-O 3.55Å; H666-T690 WeakPolarHBondContact CA-O 3.46Å; H666-T690 WeakPolarHBondContact ND1-CG2 3.35Å; H666-Y691 AromaticContact CE1-CD2 3.95Å
667	R	88.6	Confident	90.8	Very high	99 Å²	99	60 Å²	60	37%	0.374	29%	0.293	S	S	.	.	S	Bend	trans	48.9	32.1	178.4	-62.6	-178.6	-149.6	-169.4	9.1	115.4	H669 T690 Y691	R667-H669 PolarHBondContact O-CE1 2.82Å; R667-H669 VanDerWaalsContact O-CE1 3.32Å; R667-H669 PolarHBondContact O-N 3Å; R667-H669 PolarHBondContact O-ND1 3.5Å; R667-T690 PolarHBondContact N-O 3.02Å; R667-Y691 WeakPolarHBondContact CA-O 3.48Å
668	Q	85.8	Confident	90.9	Very high	64 Å²	64	55.7 Å²	55.7	30%	0.299	28%	0.277	S	S	.	.			trans	-72.7	130.9	174.2	-62.7	-63.2	-0.1	0	0	110.2	L665 H666 L671 C692 R693	L665-Q668 HydrophobicContact CB-CG 4.12Å; L665-Q668 HydrophobicContact CD2-CG 4.38Å; H666-Q668 PolarHBondContact O-N 3.32Å; Q668-L671 HydrophobicContact CB-CD1 3.93Å; Q668-L671 HydrophobicContact CB-CD2 3.87Å; Q668-L671 HydrophobicContact CB-CG 3.69Å; Q668-L671 HydrophobicContact CG-CD2 4.28Å; Q668-C692 CarbonylContact O-C 3.46Å; Q668-C692 WeakPolarHBondContact O-CA 3.32Å; Q668-R693 PolarHBondContact O-N 3.32Å
669	H	84.9	Confident	91.1	Very high	69 Å²	69	53.3 Å²	53.3	32%	0.319	26%	0.259	S	S	.	.			trans	-120.8	-10.1	-172.4	-62.8	-23.3	0	0	0	113.8	R667	R667-H669 PolarHBondContact O-CE1 2.82Å; R667-H669 VanDerWaalsContact O-CE1 3.32Å; R667-H669 PolarHBondContact O-N 3Å; R667-H669 PolarHBondContact O-ND1 3.5Å
670	H	86.2	Confident	91.1	Very high	127 Å²	127	52.8 Å²	52.8	59%	0.588	26%	0.256	S	S	*	.			trans	-119.5	9.6	-175.6	-57.3	-53.7	0	0	0	113.9	T672	H670-T672 PolarHBondContact O-N 3.11Å
671	L	89.1	Confident	91.2	Very high	8 Å²	8	56.3 Å²	56.3	4%	0.042	28%	0.276	C	S	.	.			trans	-49.3	129.3	177.8	-64.2	176.5	0	0	0	111.1	L665 Q668 F689 C692 L697	L665-L671 HydrophobicContact CD1-CD1 4.24Å; L665-L671 HydrophobicContact CD1-CD2 4.32Å; Q668-L671 HydrophobicContact CB-CD1 3.93Å; Q668-L671 HydrophobicContact CB-CD2 3.87Å; Q668-L671 HydrophobicContact CB-CG 3.69Å; Q668-L671 HydrophobicContact CG-CD2 4.28Å; L671-F689 HydrophobicContact CD1-CD1 4.31Å; L671-F689 HydrophobicContact CD1-CE1 4.11Å; L671-C692 HydrophobicContact CD1-CB 4.39Å; L671-L697 HydrophobicContact CB-CD1 4.3Å; L671-L697 HydrophobicContact CB-CD2 3.99Å; L671-L697 HydrophobicContact CB-CG 4.33Å; L671-L697 WeakPolarHBondContact O-CD2 3.47Å
672	T	93.6	Very high	91.2	Very high	55 Å²	55	51.9 Å²	51.9	34%	0.337	26%	0.262	S	S	.	.			trans	-106.7	165	174.2	77.2	0	0	0	0	111.7	H670 A674 D675 L676	H670-T672 PolarHBondContact O-N 3.11Å; T672-A674 PolarHBondContact O-N 3.24Å; T672-A674 WeakPolarHBondContact OG1-CB 3.43Å; T672-A674 PolarHBondContact OG1-N 3.33Å; T672-D675 WeakPolarHBondContact CB-OD2 3.43Å; T672-D675 PolarHBondContact N-OD2 3.06Å; T672-D675 PolarHBondContact O-N 2.94Å; T672-D675 PolarHBondContact OG1-N 3.47Å; T672-D675 PolarHBondContact OG1-OD2 3Å; T672-L676 PolarHBondContact O-N 2.88Å; T672-L676 VanDerWaalsContact O-N 3.12Å
673	D	95	Very high	91.2	Very high	30 Å²	30	53.8 Å²	53.8	16%	0.16	27%	0.265	C	S	.	.	H	α-helix	trans	-56.1	-29.3	170.5	-83.5	11.6	0	0	0	113	V677 T698 G701	D673-V677 WeakPolarHBondContact O-CG2 3.35Å; D673-V677 PolarHBondContact O-N 2.79Å; D673-V677 VanDerWaalsContact O-N 3.12Å; D673-T698 PolarHBondContact OD1-N 2.91Å; D673-T698 WeakPolarHBondContact OD2-CB 3.27Å; D673-T698 WeakPolarHBondContact OD2-CG2 3.34Å; D673-T698 PolarHBondContact OD2-OG1 3.38Å; D673-G701 WeakPolarHBondContact OD1-CA 3.5Å; D673-G701 WeakPolarHBondContact OD2-CA 3.48Å; D673-G701 PolarHBondContact OD2-N 2.7Å; D673-G701 VanDerWaalsContact OD2-N 3.16Å
674	A	93.5	Very high	91.3	Very high	51 Å²	51	53.1 Å²	53.1	42%	0.421	26%	0.261	S	S	.	.	H	α-helix	trans	-68.4	-37.4	176.1	0	0	0	0	0	111.4	T672 V677 R678	T672-A674 PolarHBondContact O-N 3.24Å; T672-A674 WeakPolarHBondContact OG1-CB 3.43Å; T672-A674 PolarHBondContact OG1-N 3.33Å; A674-V677 PolarHBondContact O-N 2.67Å; A674-R678 WeakPolarHBondContact O-CD 3.39Å; A674-R678 VanDerWaalsContact O-CG 3.22Å; A674-R678 WeakPolarHBondContact O-CG 3.39Å; A674-R678 PolarHBondContact O-N 2.77Å
675	D	92.2	Very high	91.5	Very high	24 Å²	24	52.9 Å²	52.9	13%	0.128	26%	0.259	C	S	.	.	H	α-helix	trans	-71	-39.6	178.3	-52	-55.6	0	0	0	111.4	T672 V677 R678 I679	T672-D675 WeakPolarHBondContact CB-OD2 3.43Å; T672-D675 PolarHBondContact N-OD2 3.06Å; T672-D675 PolarHBondContact O-N 2.94Å; T672-D675 PolarHBondContact OG1-N 3.47Å; T672-D675 PolarHBondContact OG1-OD2 3Å; D675-V677 VanDerWaalsContact C-N 3.31Å; D675-V677 PolarHBondContact O-N 3.16Å; D675-R678 WeakPolarHBondContact O-CB 3.36Å; D675-R678 PolarHBondContact O-N 2.99Å; D675-R678 IonicContact OD1-CZ 3.63Å; D675-R678 IonicContact OD1-NH1 2.83Å; D675-R678 PolarHBondContact OD1-NH1 3.13Å; D675-I679 WeakPolarHBondContact O-CB 3.22Å; D675-I679 VanDerWaalsContact O-CD1 3.3Å; D675-I679 WeakPolarHBondContact O-CD1 3.2Å; D675-I679 WeakPolarHBondContact O-CG1 3.3Å; D675-I679 PolarHBondContact O-N 2.91Å
676	L	94	Very high	91.7	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-57.8	-42.5	170	-63.8	-173.9	0	0	0	112.1	T672 I679 G680 F689 L697 L702 M705	T672-L676 PolarHBondContact O-N 2.88Å; T672-L676 VanDerWaalsContact O-N 3.12Å; L676-I679 PolarHBondContact O-N 3.07Å; L676-G680 PolarHBondContact O-N 2.88Å; L676-F689 HydrophobicContact CD2-CE1 4.14Å; L676-F689 HydrophobicContact CD2-CZ 4.1Å; L676-L697 HydrophobicContact CD1-CD1 4.12Å; L676-L697 HydrophobicContact CD1-CD2 3.59Å; L676-L697 HydrophobicContact CD1-CG 4.33Å; L676-L697 HydrophobicContact CD2-CD1 4.41Å; L676-L697 HydrophobicContact CD2-CD2 4.37Å; L676-L697 HydrophobicContact CG-CD2 3.76Å; L676-L702 HydrophobicContact CD1-CD2 3.74Å; L676-L702 HydrophobicContact CD1-CG 3.94Å; L676-L702 HydrophobicContact CD2-CD2 4.45Å; L676-M705 HydrophobicContact CB-CB 4.08Å; L676-M705 HydrophobicContact CB-SD 4.14Å; L676-M705 HydrophobicContact CD2-CE 4.42Å; L676-M705 HydrophobicContact CD2-SD 3.87Å; L676-M705 WeakPolarHBondContact O-CB 3.23Å; L676-M705 WeakPolarHBondContact O-CG 3.49Å
677	V	93.6	Very high	92.1	Very high	45 Å²	45	49 Å²	49	27%	0.273	24%	0.24	S	C	.	.	H	α-helix	trans	-66.4	-42.4	175.9	171.5	0	0	0	0	111.6	D673 A674 D675 I679 G680 N681 R704	D673-V677 WeakPolarHBondContact O-CG2 3.35Å; D673-V677 PolarHBondContact O-N 2.79Å; D673-V677 VanDerWaalsContact O-N 3.12Å; A674-V677 PolarHBondContact O-N 2.67Å; D675-V677 VanDerWaalsContact C-N 3.31Å; D675-V677 PolarHBondContact O-N 3.16Å; V677-I679 PolarHBondContact O-N 3.29Å; V677-G680 PolarHBondContact O-N 3.45Å; V677-N681 VanDerWaalsContact O-CG 3.29Å; V677-N681 PolarHBondContact O-N 2.86Å; V677-N681 PolarHBondContact O-ND2 3.08Å; V677-R704 HydrophobicContact CG2-CB 3.78Å
678	R	89.4	Confident	92.4	Very high	66 Å²	66	47.8 Å²	47.8	25%	0.249	24%	0.236	C	C	.	.	H	α-helix	trans	-56.8	-47.8	173.4	-68.8	159.1	178.4	-178	-10.9	110.8	I357 D360 A674 D675 G680 N681 L682	I357-R678 HydrophobicContact CG1-CG 4.48Å; D360-R678 IonicContact OD2-NH1 3.92Å; D360-R678 IonicContact OD2-NH2 2.97Å; A674-R678 WeakPolarHBondContact O-CD 3.39Å; A674-R678 VanDerWaalsContact O-CG 3.22Å; A674-R678 WeakPolarHBondContact O-CG 3.39Å; A674-R678 PolarHBondContact O-N 2.77Å; D675-R678 WeakPolarHBondContact O-CB 3.36Å; D675-R678 PolarHBondContact O-N 2.99Å; D675-R678 IonicContact OD1-CZ 3.63Å; D675-R678 IonicContact OD1-NH1 2.83Å; D675-R678 PolarHBondContact OD1-NH1 3.13Å; R678-G680 PolarHBondContact O-N 3.44Å; R678-N681 PolarHBondContact O-N 2.86Å; R678-L682 PolarHBondContact O-N 2.95Å
679	I	92.8	Very high	92.8	Very high	18 Å²	18	44.8 Å²	44.8	9%	0.092	22%	0.222	C	C	.	.	H	α-helix	trans	-61.9	-41.9	176.2	-68.2	156.7	0	0	0	111.8	I663 L665 D675 L676 V677 N681 L682 P684 L687 M705	I663-I679 HydrophobicContact CD1-CG2 4.15Å; I663-I679 HydrophobicContact CG2-CG2 4.46Å; L665-I679 HydrophobicContact CD1-CD1 3.76Å; D675-I679 WeakPolarHBondContact O-CB 3.22Å; D675-I679 VanDerWaalsContact O-CD1 3.3Å; D675-I679 WeakPolarHBondContact O-CD1 3.2Å; D675-I679 WeakPolarHBondContact O-CG1 3.3Å; D675-I679 PolarHBondContact O-N 2.91Å; L676-I679 PolarHBondContact O-N 3.07Å; V677-I679 PolarHBondContact O-N 3.29Å; I679-N681 PolarHBondContact O-N 2.93Å; I679-L682 PolarHBondContact O-N 3.03Å; I679-P684 WeakPolarHBondContact O-CD 3.43Å; I679-L687 HydrophobicContact CG2-CD1 3.81Å; I679-L687 HydrophobicContact CG2-CD2 4.35Å; I679-M705 HydrophobicContact CB-SD 4.41Å; I679-M705 HydrophobicContact CG2-SD 4.04Å
680	G	93.6	Very high	93.2	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-60.2	-43.9	176.2	0	0	0	0	0	112.4	L676 V677 R678 L682 K683 V708	L676-G680 PolarHBondContact O-N 2.88Å; V677-G680 PolarHBondContact O-N 3.45Å; R678-G680 PolarHBondContact O-N 3.44Å; G680-L682 VanDerWaalsContact C-N 3.28Å; G680-L682 PolarHBondContact O-N 3.17Å; G680-K683 PolarHBondContact O-N 3.42Å; G680-V708 WeakPolarHBondContact O-CG1 3.29Å
681	N	92.9	Very high	93.3	Very high	99 Å²	99	38.4 Å²	38.4	53%	0.529	19%	0.192	S	C	.	.	H	α-helix	trans	-64	-27.7	179.9	-71.7	-19	0	0	0	113.8	V677 R678 I679 K683	V677-N681 VanDerWaalsContact O-CG 3.29Å; V677-N681 PolarHBondContact O-N 2.86Å; V677-N681 PolarHBondContact O-ND2 3.08Å; R678-N681 PolarHBondContact O-N 2.86Å; I679-N681 PolarHBondContact O-N 2.93Å; N681-K683 PolarHBondContact O-N 2.89Å
682	L	91.6	Very high	93.4	Very high	36 Å²	36	38 Å²	38	19%	0.188	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-14.9	173.1	-64.5	173.8	0	0	0	113.3	W660 I663 R678 I679 G680	W660-L682 HydrophobicContact CB-CB 4.03Å; W660-L682 HydrophobicContact CB-CD1 4.32Å; W660-L682 HydrophobicContact CB-CD2 4.37Å; W660-L682 HydrophobicContact CB-CG 4.47Å; W660-L682 HydrophobicContact CD2-CD1 3.87Å; W660-L682 HydrophobicContact CD2-CD2 4.32Å; W660-L682 HydrophobicContact CE3-CD1 3.88Å; W660-L682 HydrophobicContact CG-CB 4.44Å; W660-L682 HydrophobicContact CG-CD1 4.04Å; W660-L682 HydrophobicContact CG-CD2 3.91Å; W660-L682 HydrophobicContact CG-CG 4.36Å; I663-L682 HydrophobicContact CD1-CB 4.09Å; I663-L682 HydrophobicContact CD1-CD1 3.76Å; R678-L682 PolarHBondContact O-N 2.95Å; I679-L682 PolarHBondContact O-N 3.03Å; G680-L682 VanDerWaalsContact C-N 3.28Å; G680-L682 PolarHBondContact O-N 3.17Å
683	K	93	Very high	93.3	Very high	111 Å²	111	38.2 Å²	38.2	48%	0.483	18%	0.184	S	C	.	.			trans	49.4	55.9	179.5	-61.7	-173.6	178.6	-172.8	0	113.8	G680 N681 V708	G680-K683 PolarHBondContact O-N 3.42Å; N681-K683 PolarHBondContact O-N 2.89Å; K683-V708 HydrophobicContact CG-CG1 4.41Å
684	P	95.1	Very high	93	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	18%	0.176	C	C	.	.			trans	-60.3	144.3	176.2	28.1	-37.1	0	0	0	111.7	I663 I679 L687 L713	I663-P684 HydrophobicContact CB-CB 4.42Å; I663-P684 HydrophobicContact CD1-CB 3.95Å; I663-P684 HydrophobicContact CD1-CG 4.01Å; I663-P684 HydrophobicContact CG1-CB 4.06Å; I679-P684 WeakPolarHBondContact O-CD 3.43Å; P684-L687 HydrophobicContact CG-CB 4.33Å; P684-L713 WeakPolarHBondContact O-CD1 3.36Å
685	K	95.8	Very high	92.9	Very high	99 Å²	99	38 Å²	38	43%	0.43	18%	0.176	S	C	.	.	S	Bend	trans	-82.6	-25	167.6	-71	-173.2	155.5	-136	0	112.2	R661 Q714 K715	R661-K685 HydrophobicContact CG-CB 4.05Å; R661-K685 HydrophobicContact CG-CD 3.97Å; R661-K685 HydrophobicContact CG-CG 4.11Å; R661-K685 PolarHBondContact O-N 2.8Å; K685-Q714 PolarHBondContact O-N 2.82Å; K685-K715 PolarHBondContact O-N 2.81Å
686	E	97	Very high	92.8	Very high	29 Å²	29	40.3 Å²	40.3	14%	0.136	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	118.1	178.5	177.5	159.7	-165.4	0	0	110	R661 V662 I663 R688 K715	R661-E686 PolarHBondContact O-N 3.17Å; V662-E686 CarbonylContact C-O 3.36Å; V662-E686 WeakPolarHBondContact CA-O 3.47Å; V662-E686 HydrophobicContact CB-CB 4.49Å; V662-E686 HydrophobicContact CG1-CB 4.29Å; V662-E686 HydrophobicContact CG1-CG 4.1Å; V662-E686 HydrophobicContact CG2-CB 4.19Å; I663-E686 PolarHBondContact N-O 2.89Å; E686-R688 HydrophobicContact CG-CG 4.27Å; E686-R688 IonicContact OE1-CZ 3.61Å; E686-R688 IonicContact OE1-NE 3.83Å; E686-R688 PolarHBondContact OE1-NE 2.8Å; E686-R688 IonicContact OE1-NH2 3.91Å; E686-R688 PolarHBondContact OE1-NH2 3.47Å; E686-K715 WeakPolarHBondContact CA-O 3.47Å; E686-K715 HydrophobicContact CB-CB 3.9Å; E686-K715 HydrophobicContact CB-CD 4.45Å; E686-K715 HydrophobicContact CG-CB 3.72Å; E686-K715 HydrophobicContact CG-CD 4.22Å; E686-K715 WeakPolarHBondContact OE2-CD 3.32Å; E686-K715 IonicContact OE2-NZ 2.75Å
687	L	96.5	Very high	92.8	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	121.7	-179.7	-178.8	57.9	0	0	0	109.6	I663 I679 P684 F689 M705 F706 L713 K715 L716 S717	I663-L687 HydrophobicContact CB-CD1 3.96Å; I663-L687 HydrophobicContact CG2-CD1 3.86Å; I679-L687 HydrophobicContact CG2-CD1 3.81Å; I679-L687 HydrophobicContact CG2-CD2 4.35Å; P684-L687 HydrophobicContact CG-CB 4.33Å; L687-F689 HydrophobicContact CD1-CE2 4.11Å; L687-F689 HydrophobicContact CD1-CZ 4.46Å; L687-F689 HydrophobicContact CD2-CE2 3.7Å; L687-F689 HydrophobicContact CD2-CZ 4.26Å; L687-F689 HydrophobicContact CG-CD2 4.27Å; L687-F689 HydrophobicContact CG-CE2 3.7Å; L687-F689 HydrophobicContact CG-CZ 4.44Å; L687-M705 HydrophobicContact CD2-CE 3.93Å; L687-M705 HydrophobicContact CD2-SD 3.94Å; L687-F706 HydrophobicContact CD2-CE1 4.35Å; L687-L713 HydrophobicContact CB-CD1 3.75Å; L687-K715 PolarHBondContact N-O 2.96Å; L687-L716 CarbonylContact O-C 3.38Å; L687-L716 WeakPolarHBondContact O-CA 3.46Å; L687-S717 PolarHBondContact O-N 2.99Å
688	R	95.5	Very high	92.8	Very high	73 Å²	73	41.8 Å²	41.8	28%	0.275	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	119.3	-178.4	-58.3	-173.4	174.6	-155.1	1.4	110.8	I663 H664 L665 E686	I663-R688 PolarHBondContact O-N 2.7Å; H664-R688 WeakPolarHBondContact CA-O 3.5Å; H664-R688 HydrophobicContact CB-CB 4.25Å; H664-R688 PolarHBondContact CD2-O 2.81Å; L665-R688 PolarHBondContact N-O 2.84Å; E686-R688 HydrophobicContact CG-CG 4.27Å; E686-R688 IonicContact OE1-CZ 3.61Å; E686-R688 IonicContact OE1-NE 3.83Å; E686-R688 PolarHBondContact OE1-NE 2.8Å; E686-R688 IonicContact OE1-NH2 3.91Å; E686-R688 PolarHBondContact OE1-NH2 3.47Å
689	F	93.8	Very high	93	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	139.3	160.7	-59	-100.2	0	0	0	108.6	L665 L671 L676 L687 C692 M705 S717 L718 I719 C721 F726	L665-F689 HydrophobicContact CB-CD1 4.44Å; L665-F689 HydrophobicContact CD1-CD1 3.87Å; L665-F689 HydrophobicContact CD1-CE1 3.59Å; L665-F689 HydrophobicContact CD1-CZ 4.27Å; L665-F689 CarbonylContact O-C 3.55Å; L671-F689 HydrophobicContact CD1-CD1 4.31Å; L671-F689 HydrophobicContact CD1-CE1 4.11Å; L676-F689 HydrophobicContact CD2-CE1 4.14Å; L676-F689 HydrophobicContact CD2-CZ 4.1Å; L687-F689 HydrophobicContact CD1-CE2 4.11Å; L687-F689 HydrophobicContact CD1-CZ 4.46Å; L687-F689 HydrophobicContact CD2-CE2 3.7Å; L687-F689 HydrophobicContact CD2-CZ 4.26Å; L687-F689 HydrophobicContact CG-CD2 4.27Å; L687-F689 HydrophobicContact CG-CE2 3.7Å; L687-F689 HydrophobicContact CG-CZ 4.44Å; F689-C692 HydrophobicContact CB-CB 4.25Å; F689-C692 HydrophobicContact CD1-CB 4.16Å; F689-M705 HydrophobicContact CE2-CE 4.17Å; F689-M705 HydrophobicContact CZ-CE 3.97Å; F689-M705 HydrophobicContact CZ-SD 4.17Å; F689-S717 PolarHBondContact N-O 3.08Å; F689-L718 HydrophobicContact CB-CD2 4.11Å; F689-L718 HydrophobicContact CD2-CD2 3.61Å; F689-L718 HydrophobicContact CE2-CD2 4.34Å; F689-L718 HydrophobicContact CG-CD2 4.11Å; F689-I719 PolarHBondContact O-N 3.24Å; F689-C721 VanDerWaalsContact CB-SG 3.55Å; F689-F726 HydrophobicContact CD1-CZ 4.08Å; F689-F726 HydrophobicContact CE1-CZ 4.24Å; F689-F726 HydrophobicContact CG-CZ 4.5Å
690	T	92.4	Very high	93.1	Very high	14 Å²	14	42.9 Å²	42.9	9%	0.086	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	107.7	-177.4	-56	0	0	0	0	110.2	H664 L665 H666 R667 C692 I719	H664-T690 PolarHBondContact NE2-OG1 2.6Å; L665-T690 PolarHBondContact O-N 3.04Å; H666-T690 CarbonylContact C-O 3.55Å; H666-T690 WeakPolarHBondContact CA-O 3.46Å; H666-T690 WeakPolarHBondContact ND1-CG2 3.35Å; R667-T690 PolarHBondContact N-O 3.02Å; T690-C692 PolarHBondContact O-N 3.31Å; T690-I719 WeakPolarHBondContact CA-O 3.45Å; T690-I719 HydrophobicContact CG2-CB 4.29Å; T690-I719 HydrophobicContact CG2-CG2 4.39Å
691	Y	90.1	Very high	93.1	Very high	49 Å²	49	42.9 Å²	42.9	19%	0.192	22%	0.221	C	C	.	.	S	Bend	trans	54.4	26.5	-172	-47.4	-60.1	0	0	0	113.6	H666 R667 I719	H666-Y691 AromaticContact CE1-CD2 3.95Å; R667-Y691 WeakPolarHBondContact CA-O 3.48Å; Y691-I719 HydrophobicContact CE1-CG2 4.16Å; Y691-I719 PolarHBondContact N-O 3.34Å
692	C	90.5	Very high	93.2	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	20%	0.196	C	C	.	.			trans	-69.6	148	170.8	-65.6	0	0	0	0	110.1	L665 Q668 L671 F689 T690 C721 T722	L665-C692 PolarHBondContact O-SG 2.56Å; L665-C692 VanDerWaalsContact O-SG 3.36Å; Q668-C692 CarbonylContact O-C 3.46Å; Q668-C692 WeakPolarHBondContact O-CA 3.32Å; L671-C692 HydrophobicContact CD1-CB 4.39Å; F689-C692 HydrophobicContact CB-CB 4.25Å; F689-C692 HydrophobicContact CD1-CB 4.16Å; T690-C692 PolarHBondContact O-N 3.31Å; C692-C721 VanDerWaalsContact O-CA 3.26Å; C692-C721 WeakPolarHBondContact O-CA 3.49Å; C692-C721 WeakPolarHBondContact O-CB 3.46Å; C692-T722 PolarHBondContact O-N 2.78Å; C692-T722 VanDerWaalsContact O-N 3.16Å
693	R	90.6	Very high	93.4	Very high	58 Å²	58	41 Å²	41	22%	0.219	21%	0.207	C	C	.	.	B	Isolated β-bridge	trans	-110.1	146.3	173.3	-65.7	178.7	55.8	134.7	-6	111	Q668 D695 T722	Q668-R693 PolarHBondContact O-N 3.32Å; R693-D695 VanDerWaalsContact CB-OD2 3.25Å; R693-D695 WeakPolarHBondContact CB-OD2 3.44Å; R693-D695 IonicContact CZ-OD1 2.61Å; R693-D695 IonicContact CZ-OD2 3.75Å; R693-D695 IonicContact NE-OD1 2.63Å; R693-D695 IonicContact NE-OD2 3.84Å; R693-D695 PolarHBondContact NE-OD2 3.49Å; R693-D695 VanDerWaalsContact NH2-CG 3.32Å; R693-D695 IonicContact NH2-OD1 2.76Å; R693-D695 PolarHBondContact NH2-OD1 3.26Å; R693-D695 IonicContact NH2-OD2 3.83Å; R693-D695 PolarHBondContact NH2-OD2 3.11Å; R693-D695 VanDerWaalsContact NH2-OD2 3.13Å; R693-T722 CarbonylContact C-O 3.5Å; R693-T722 VanDerWaalsContact CA-O 3.24Å; R693-T722 WeakPolarHBondContact CA-O 3.37Å
694	G	90.2	Very high	93.6	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	21%	0.209	C	C	.	.			trans	-108.1	22.5	-178	0	0	0	0	0	114.9	S696 L697 T722 K723 G724	G694-S696 PolarHBondContact O-N 2.86Å; G694-S696 VanDerWaalsContact O-N 3.14Å; G694-L697 PolarHBondContact O-N 3.13Å; G694-T722 PolarHBondContact N-O 2.89Å; G694-K723 WeakPolarHBondContact CA-O 3.48Å; G694-G724 WeakPolarHBondContact O-CA 3.41Å
695	D	90.6	Very high	93.6	Very high	78 Å²	78	42.4 Å²	42.4	42%	0.417	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55	-32.8	-174.3	-57.2	-90.3	0	0	0	113.7	R693 K723	R693-D695 VanDerWaalsContact CB-OD2 3.25Å; R693-D695 WeakPolarHBondContact CB-OD2 3.44Å; R693-D695 IonicContact CZ-OD1 2.61Å; R693-D695 IonicContact CZ-OD2 3.75Å; R693-D695 IonicContact NE-OD1 2.63Å; R693-D695 IonicContact NE-OD2 3.84Å; R693-D695 PolarHBondContact NE-OD2 3.49Å; R693-D695 VanDerWaalsContact NH2-CG 3.32Å; R693-D695 IonicContact NH2-OD1 2.76Å; R693-D695 PolarHBondContact NH2-OD1 3.26Å; R693-D695 IonicContact NH2-OD2 3.83Å; R693-D695 PolarHBondContact NH2-OD2 3.11Å; R693-D695 VanDerWaalsContact NH2-OD2 3.13Å; D695-K723 WeakPolarHBondContact OD1-CB 3.4Å; D695-K723 WeakPolarHBondContact OD1-CG 3.34Å
696	S	90.6	Very high	93.7	Very high	72 Å²	72	37.8 Å²	37.8	50%	0.503	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.7	11.1	178.2	-56.3	0	0	0	0	114.4	G694	G694-S696 PolarHBondContact O-N 2.86Å; G694-S696 VanDerWaalsContact O-N 3.14Å
697	L	93.1	Very high	93.6	Very high	12 Å²	12	41.2 Å²	41.2	6%	0.063	21%	0.208	C	C	.	.			trans	-101.1	147.6	-177.4	-64.5	-178.6	0	0	0	112.1	L671 L676 G694 P725 F726	L671-L697 HydrophobicContact CB-CD1 4.3Å; L671-L697 HydrophobicContact CB-CD2 3.99Å; L671-L697 HydrophobicContact CB-CG 4.33Å; L671-L697 WeakPolarHBondContact O-CD2 3.47Å; L676-L697 HydrophobicContact CD1-CD1 4.12Å; L676-L697 HydrophobicContact CD1-CD2 3.59Å; L676-L697 HydrophobicContact CD1-CG 4.33Å; L676-L697 HydrophobicContact CD2-CD1 4.41Å; L676-L697 HydrophobicContact CD2-CD2 4.37Å; L676-L697 HydrophobicContact CG-CD2 3.76Å; G694-L697 PolarHBondContact O-N 3.13Å; L697-P725 HydrophobicContact CB-CG 3.88Å; L697-P725 WeakPolarHBondContact O-CD 3.44Å; L697-F726 HydrophobicContact CD1-CE2 3.66Å; L697-F726 HydrophobicContact CD1-CZ 4.06Å
698	T	93.7	Very high	93.6	Very high	63 Å²	63	43.6 Å²	43.6	39%	0.387	22%	0.222	S	C	.	.			trans	-111.5	163	170.9	87.3	0	0	0	0	112.1	D673 T700 G701 L702	D673-T698 PolarHBondContact OD1-N 2.91Å; D673-T698 WeakPolarHBondContact OD2-CB 3.27Å; D673-T698 WeakPolarHBondContact OD2-CG2 3.34Å; D673-T698 PolarHBondContact OD2-OG1 3.38Å; T698-T700 PolarHBondContact O-N 2.71Å; T698-T700 WeakPolarHBondContact OG1-CB 3.34Å; T698-T700 PolarHBondContact OG1-N 3.21Å; T698-G701 PolarHBondContact O-N 2.58Å; T698-G701 PolarHBondContact OG1-N 2.85Å; T698-L702 PolarHBondContact O-N 3.44Å
699	A	93.1	Very high	93.6	Very high	36 Å²	36	40.2 Å²	40.2	30%	0.298	21%	0.209	S	C	.	.	H	α-helix	trans	-58.2	-29.7	168.7	0	0	0	0	0	112.2	K703 L730	A699-K703 WeakPolarHBondContact O-CB 3.36Å; A699-K703 WeakPolarHBondContact O-CG 3.35Å; A699-K703 PolarHBondContact O-N 2.98Å; A699-L730 HydrophobicContact CB-CD1 3.79Å
700	T	94.6	Very high	93.7	Very high	71 Å²	71	40.2 Å²	40.2	44%	0.436	21%	0.209	S	C	.	.	H	α-helix	trans	-72.7	-38.5	179.8	-54.6	0	0	0	0	111.7	T698 K703 R704	T698-T700 PolarHBondContact O-N 2.71Å; T698-T700 WeakPolarHBondContact OG1-CB 3.34Å; T698-T700 PolarHBondContact OG1-N 3.21Å; T700-K703 PolarHBondContact O-N 3.2Å; T700-R704 HydrophobicContact CG2-CG 4.48Å; T700-R704 WeakPolarHBondContact O-CB 3.35Å; T700-R704 VanDerWaalsContact O-CG 3.29Å; T700-R704 WeakPolarHBondContact O-CG 3.3Å; T700-R704 PolarHBondContact O-N 3.43Å
701	G	94.6	Very high	93.8	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-60.9	-49.2	173.4	0	0	0	0	0	112.6	D673 T698 K703 R704 M705	D673-G701 WeakPolarHBondContact OD1-CA 3.5Å; D673-G701 WeakPolarHBondContact OD2-CA 3.48Å; D673-G701 PolarHBondContact OD2-N 2.7Å; D673-G701 VanDerWaalsContact OD2-N 3.16Å; T698-G701 PolarHBondContact O-N 2.58Å; T698-G701 PolarHBondContact OG1-N 2.85Å; G701-K703 PolarHBondContact O-N 3.3Å; G701-R704 PolarHBondContact O-N 3.29Å; G701-M705 PolarHBondContact O-N 3Å
702	L	94.8	Very high	94	Very high	1 Å²	1	42.8 Å²	42.8	1%	0.005	24%	0.239	C	C	.	.	H	α-helix	trans	-60.6	-44.6	175	-73.5	176.5	0	0	0	112	L676 T698 R704 M705 F706 P725 F726 P731 I734	L676-L702 HydrophobicContact CD1-CD2 3.74Å; L676-L702 HydrophobicContact CD1-CG 3.94Å; L676-L702 HydrophobicContact CD2-CD2 4.45Å; T698-L702 PolarHBondContact O-N 3.44Å; L702-R704 PolarHBondContact O-N 3.27Å; L702-M705 HydrophobicContact CD2-CE 3.91Å; L702-M705 PolarHBondContact O-N 3.39Å; L702-F706 HydrophobicContact CD2-CE2 4.18Å; L702-F706 VanDerWaalsContact O-CD2 3.27Å; L702-F706 WeakPolarHBondContact O-CD2 3.37Å; L702-F706 PolarHBondContact O-N 3.34Å; L702-P725 HydrophobicContact CD1-CB 3.61Å; L702-P725 HydrophobicContact CD1-CG 3.56Å; L702-P725 HydrophobicContact CG-CG 4.32Å; L702-F726 HydrophobicContact CD2-CE1 4.48Å; L702-P731 HydrophobicContact CD1-CB 4.47Å; L702-P731 HydrophobicContact CD1-CG 4.31Å; L702-I734 HydrophobicContact CB-CD1 4.11Å
703	K	96.3	Very high	94.3	Very high	95 Å²	95	42.8 Å²	42.8	41%	0.413	24%	0.239	S	C	.	.	H	α-helix	trans	-58.7	-46.8	175.5	-79.6	-174.6	174.3	-169	0	112	A699 T700 G701 M705 F706 L707 I734 Y738	A699-K703 WeakPolarHBondContact O-CB 3.36Å; A699-K703 WeakPolarHBondContact O-CG 3.35Å; A699-K703 PolarHBondContact O-N 2.98Å; T700-K703 PolarHBondContact O-N 3.2Å; G701-K703 PolarHBondContact O-N 3.3Å; K703-M705 PolarHBondContact O-N 2.83Å; K703-F706 PolarHBondContact O-N 3.46Å; K703-L707 WeakPolarHBondContact O-CB 3.45Å; K703-L707 PolarHBondContact O-N 3.31Å; K703-I734 HydrophobicContact CG-CD1 3.82Å; K703-I734 HydrophobicContact CG-CG1 3.85Å; K703-I734 HydrophobicContact CG-CG2 4Å; K703-Y738 HydrophobicContact CB-CE2 4.43Å; K703-Y738 HydrophobicContact CG-CE2 4.31Å
704	R	96.3	Very high	94.6	Very high	141 Å²	141	42.8 Å²	42.8	53%	0.532	24%	0.242	S	C	.	.	H	α-helix	trans	-62.7	-41.1	178.3	-72.9	171.9	177.2	165.9	-0.5	112.2	V677 T700 G701 L702 V708	V677-R704 HydrophobicContact CG2-CB 3.78Å; T700-R704 HydrophobicContact CG2-CG 4.48Å; T700-R704 WeakPolarHBondContact O-CB 3.35Å; T700-R704 VanDerWaalsContact O-CG 3.29Å; T700-R704 WeakPolarHBondContact O-CG 3.3Å; T700-R704 PolarHBondContact O-N 3.43Å; G701-R704 PolarHBondContact O-N 3.29Å; L702-R704 PolarHBondContact O-N 3.27Å; R704-V708 WeakPolarHBondContact O-CG2 3.32Å; R704-V708 PolarHBondContact O-N 3.14Å
705	M	96.3	Very high	95	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-60.8	-55.6	175.1	180	-178.3	71.5	0	0	111.6	L676 I679 L687 F689 G701 L702 K703 L707 V708 C709	L676-M705 HydrophobicContact CB-CB 4.08Å; L676-M705 HydrophobicContact CB-SD 4.14Å; L676-M705 HydrophobicContact CD2-CE 4.42Å; L676-M705 HydrophobicContact CD2-SD 3.87Å; L676-M705 WeakPolarHBondContact O-CB 3.23Å; L676-M705 WeakPolarHBondContact O-CG 3.49Å; I679-M705 HydrophobicContact CB-SD 4.41Å; I679-M705 HydrophobicContact CG2-SD 4.04Å; L687-M705 HydrophobicContact CD2-CE 3.93Å; L687-M705 HydrophobicContact CD2-SD 3.94Å; F689-M705 HydrophobicContact CE2-CE 4.17Å; F689-M705 HydrophobicContact CZ-CE 3.97Å; F689-M705 HydrophobicContact CZ-SD 4.17Å; G701-M705 PolarHBondContact O-N 3Å; L702-M705 HydrophobicContact CD2-CE 3.91Å; L702-M705 PolarHBondContact O-N 3.39Å; K703-M705 PolarHBondContact O-N 2.83Å; M705-L707 VanDerWaalsContact C-N 3.33Å; M705-L707 PolarHBondContact O-N 3.27Å; M705-V708 PolarHBondContact O-N 3.39Å; M705-V708 VanDerWaalsContact O-N 3.09Å; M705-C709 PolarHBondContact O-N 3.22Å; M705-C709 PolarHBondContact O-SG 3.41Å
706	F	96.7	Very high	95.3	Very high	1 Å²	1	42.8 Å²	42.8	0%	0.004	24%	0.238	C	C	.	.	H	α-helix	trans	-70.1	-26.9	-176.3	-72.9	-61.7	0	0	0	113.3	L687 L702 K703 V708 G710 L713 L716 I734 V735 Y738	L687-F706 HydrophobicContact CD2-CE1 4.35Å; L702-F706 HydrophobicContact CD2-CE2 4.18Å; L702-F706 VanDerWaalsContact O-CD2 3.27Å; L702-F706 WeakPolarHBondContact O-CD2 3.37Å; L702-F706 PolarHBondContact O-N 3.34Å; K703-F706 PolarHBondContact O-N 3.46Å; F706-V708 VanDerWaalsContact C-N 3.26Å; F706-V708 PolarHBondContact O-N 3.06Å; F706-G710 WeakPolarHBondContact O-CA 3.37Å; F706-G710 PolarHBondContact O-N 3.12Å; F706-L713 HydrophobicContact CD1-CD2 4.23Å; F706-L713 HydrophobicContact CE1-CD2 3.85Å; F706-L716 HydrophobicContact CE1-CD1 4.22Å; F706-L716 HydrophobicContact CZ-CD1 4.14Å; F706-I734 HydrophobicContact CB-CG2 4.04Å; F706-I734 HydrophobicContact CD2-CG2 3.72Å; F706-I734 HydrophobicContact CG-CG2 4.28Å; F706-V735 HydrophobicContact CD1-CG2 4.03Å; F706-V735 HydrophobicContact CD2-CG2 4.05Å; F706-V735 HydrophobicContact CE1-CG2 3.65Å; F706-V735 HydrophobicContact CE2-CG2 3.65Å; F706-V735 HydrophobicContact CG-CG2 4.23Å; F706-V735 HydrophobicContact CZ-CG2 3.44Å; F706-V735 VanDerWaalsContact CZ-CG2 3.44Å; F706-Y738 HydrophobicContact CB-CD2 3.93Å; F706-Y738 HydrophobicContact CB-CG 4.47Å; F706-Y738 WeakPolarHBondContact O-CB 3.38Å
707	L	96.4	Very high	95.6	Very high	102 Å²	102	39.7 Å²	39.7	53%	0.534	22%	0.216	S	C	.	.	H	α-helix	trans	-59.4	-35.7	168.8	178.7	65.3	0	0	0	112.3	K703 M705 Y738	K703-L707 WeakPolarHBondContact O-CB 3.45Å; K703-L707 PolarHBondContact O-N 3.31Å; M705-L707 VanDerWaalsContact C-N 3.33Å; M705-L707 PolarHBondContact O-N 3.27Å; L707-Y738 HydrophobicContact CB-CE1 4.37Å; L707-Y738 HydrophobicContact CD1-CD1 4.07Å; L707-Y738 HydrophobicContact CD1-CE1 3.7Å
708	V	95.2	Very high	95.7	Very high	50 Å²	50	39.5 Å²	39.5	30%	0.303	22%	0.216	S	C	.	.	H	α-helix	trans	-89.3	-40.8	-177.5	-179.5	0	0	0	0	113	G680 K683 R704 M705 F706	G680-V708 WeakPolarHBondContact O-CG1 3.29Å; K683-V708 HydrophobicContact CG-CG1 4.41Å; R704-V708 WeakPolarHBondContact O-CG2 3.32Å; R704-V708 PolarHBondContact O-N 3.14Å; M705-V708 PolarHBondContact O-N 3.39Å; M705-V708 VanDerWaalsContact O-N 3.09Å; F706-V708 VanDerWaalsContact C-N 3.26Å; F706-V708 PolarHBondContact O-N 3.06Å
709	C	95.5	Very high	95.7	Very high	1 Å²	1	37.9 Å²	37.9	1%	0.007	20%	0.204	C	C	.	.	H	α-helix	trans	-98	-25.2	-177.1	70.1	0	0	0	0	114.8	M705 G712 L713	M705-C709 PolarHBondContact O-N 3.22Å; M705-C709 PolarHBondContact O-SG 3.41Å; C709-G712 PolarHBondContact O-N 2.62Å; C709-L713 PolarHBondContact O-N 2.92Å; C709-L713 VanDerWaalsContact O-N 3.14Å
710	G	95.4	Very high	95.5	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	19%	0.192	C	C	.	.	G	3₁₀ helix	trans	-52.5	-44.2	-171.8	0	0	0	0	0	115.4	F706 G712 L713 Y738 C739	F706-G710 WeakPolarHBondContact O-CA 3.37Å; F706-G710 PolarHBondContact O-N 3.12Å; G710-G712 PolarHBondContact O-N 2.86Å; G710-G712 VanDerWaalsContact O-N 3.14Å; G710-L713 PolarHBondContact O-N 3.07Å; G710-L713 VanDerWaalsContact O-N 3.1Å; G710-Y738 CarbonylContact C-O 3.55Å; G710-C739 VanDerWaalsContact CA-SG 3.51Å
711	P	95.1	Very high	95.3	Very high	80 Å²	80	33.1 Å²	33.1	52%	0.519	17%	0.172	S	C	.	.	G	3₁₀ helix	trans	-60	-23.8	176.3	-27.4	36.4	0	0	0	114.7	N741	P711-N741 PolarHBondContact O-ND2 2.84Å
712	G	94.6	Very high	95.1	Very high	37 Å²	37	33.3 Å²	33.3	38%	0.381	17%	0.173	S	C	.	.	G	3₁₀ helix	trans	-101.1	-6.8	176.6	0	0	0	0	0	114.9	C709 G710 Q714	C709-G712 PolarHBondContact O-N 2.62Å; G710-G712 PolarHBondContact O-N 2.86Å; G710-G712 VanDerWaalsContact O-N 3.14Å; G712-Q714 PolarHBondContact O-N 2.97Å
713	L	96.8	Very high	94.8	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.189	C	C	.	.			trans	-81.7	115.6	-171.7	-169.2	70.2	0	0	0	111	P684 L687 F706 C709 G710 K715 L716 N741 L742	P684-L713 WeakPolarHBondContact O-CD1 3.36Å; L687-L713 HydrophobicContact CB-CD1 3.75Å; F706-L713 HydrophobicContact CD1-CD2 4.23Å; F706-L713 HydrophobicContact CE1-CD2 3.85Å; C709-L713 PolarHBondContact O-N 2.92Å; C709-L713 VanDerWaalsContact O-N 3.14Å; G710-L713 PolarHBondContact O-N 3.07Å; G710-L713 VanDerWaalsContact O-N 3.1Å; L713-K715 WeakPolarHBondContact CD1-O 3.5Å; L713-L716 HydrophobicContact CD2-CB 4.31Å; L713-L716 HydrophobicContact CD2-CD1 4.39Å; L713-N741 CarbonylContact O-C 3.16Å; L713-L742 HydrophobicContact CD2-CD1 4.29Å; L713-L742 HydrophobicContact CG-CD1 4.12Å
714	Q	97.3	Very high	94.5	Very high	58 Å²	58	33.8 Å²	33.8	27%	0.271	18%	0.184	S	C	.	.			trans	-101.5	-23.5	-179.1	-56.1	-172	-88.2	0	0	112.3	K685 G712 Q743 H744	K685-Q714 PolarHBondContact O-N 2.82Å; G712-Q714 PolarHBondContact O-N 2.97Å; Q714-Q743 PolarHBondContact O-N 3.06Å; Q714-H744 PolarHBondContact O-N 2.86Å; Q714-H744 VanDerWaalsContact O-N 3.13Å
715	K	98.1	Very high	94.2	Very high	73 Å²	73	27.2 Å²	27.2	32%	0.317	16%	0.16	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	129.4	-178.8	-57.2	-172.2	179.8	175.7	0	111.7	K685 E686 L687 L713 H744	K685-K715 PolarHBondContact O-N 2.81Å; E686-K715 WeakPolarHBondContact CA-O 3.47Å; E686-K715 HydrophobicContact CB-CB 3.9Å; E686-K715 HydrophobicContact CB-CD 4.45Å; E686-K715 HydrophobicContact CG-CB 3.72Å; E686-K715 HydrophobicContact CG-CD 4.22Å; E686-K715 WeakPolarHBondContact OE2-CD 3.32Å; E686-K715 IonicContact OE2-NZ 2.75Å; L687-K715 PolarHBondContact N-O 2.96Å; L713-K715 WeakPolarHBondContact CD1-O 3.5Å; K715-H744 WeakPolarHBondContact CA-O 3.35Å; K715-H744 HydrophobicContact CB-CB 4.39Å; K715-H744 HydrophobicContact CD-CB 4.42Å; K715-H744 VanDerWaalsContact CE-CD2 3.44Å; K715-H744 WeakPolarHBondContact CE-CD2 3.13Å; K715-H744 HydrophobicContact CG-CB 3.97Å
716	L	97.5	Very high	93.9	Very high	6 Å²	6	27.5 Å²	27.5	3%	0.031	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	134.4	175.5	178.4	66.9	0	0	0	110.6	L687 F706 L713 L718 L732 V735 L742 H744 V745 N746	L687-L716 CarbonylContact O-C 3.38Å; L687-L716 WeakPolarHBondContact O-CA 3.46Å; F706-L716 HydrophobicContact CE1-CD1 4.22Å; F706-L716 HydrophobicContact CZ-CD1 4.14Å; L713-L716 HydrophobicContact CD2-CB 4.31Å; L713-L716 HydrophobicContact CD2-CD1 4.39Å; L716-L718 HydrophobicContact CD1-CD2 4.34Å; L716-L718 HydrophobicContact CD1-CG 4.28Å; L716-L718 HydrophobicContact CD2-CD1 4.18Å; L716-L718 HydrophobicContact CD2-CG 4.3Å; L716-L718 HydrophobicContact CG-CG 4.23Å; L716-L732 HydrophobicContact CD2-CD2 4.36Å; L716-V735 HydrophobicContact CD2-CB 4.18Å; L716-V735 HydrophobicContact CD2-CG1 3.74Å; L716-V735 HydrophobicContact CD2-CG2 3.48Å; L716-V735 VanDerWaalsContact CD2-CG2 3.48Å; L716-L742 HydrophobicContact CB-CD1 3.89Å; L716-L742 HydrophobicContact CB-CD2 4.29Å; L716-H744 PolarHBondContact N-O 2.73Å; L716-V745 WeakPolarHBondContact O-CA 3.5Å; L716-N746 PolarHBondContact O-N 3.13Å
717	S	96.8	Very high	93.3	Very high	6 Å²	6	30.3 Å²	30.3	4%	0.042	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	129.3	168.6	-160.2	0	0	0	0	110.3	L687 F689 I719 N746	L687-S717 PolarHBondContact O-N 2.99Å; F689-S717 PolarHBondContact N-O 3.08Å; S717-I719 VanDerWaalsContact OG-CD1 3.29Å; S717-I719 WeakPolarHBondContact OG-CD1 3.48Å; S717-I719 WeakPolarHBondContact OG-CG1 3.29Å; S717-N746 CarbonylContact C-O 3.07Å; S717-N746 WeakPolarHBondContact CA-O 3.28Å
718	L	94.4	Very high	92.6	Very high	9 Å²	9	30.1 Å²	30.1	5%	0.047	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	73.1	172.9	-63.3	176.2	0	0	0	106.8	F689 L716 F726 P731 L732 N746 A747 T750	F689-L718 HydrophobicContact CB-CD2 4.11Å; F689-L718 HydrophobicContact CD2-CD2 3.61Å; F689-L718 HydrophobicContact CE2-CD2 4.34Å; F689-L718 HydrophobicContact CG-CD2 4.11Å; L716-L718 HydrophobicContact CD1-CD2 4.34Å; L716-L718 HydrophobicContact CD1-CG 4.28Å; L716-L718 HydrophobicContact CD2-CD1 4.18Å; L716-L718 HydrophobicContact CD2-CG 4.3Å; L716-L718 HydrophobicContact CG-CG 4.23Å; L718-F726 HydrophobicContact CD2-CE1 4.07Å; L718-P731 HydrophobicContact CD1-CB 3.9Å; L718-L732 HydrophobicContact CD1-CD2 4.02Å; L718-L732 HydrophobicContact CD1-CG 4.46Å; L718-N746 PolarHBondContact N-O 3.08Å; L718-A747 CarbonylContact O-C 3.51Å; L718-A747 WeakPolarHBondContact O-CA 3.41Å; L718-T750 WeakPolarHBondContact O-CG2 3.04Å
719	I	93.3	Very high	92.3	Very high	28 Å²	28	29.8 Å²	29.8	14%	0.144	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	122.6	-176.9	-65.2	162.5	0	0	0	109.2	F689 T690 Y691 S717 C721 N746 S748	F689-I719 PolarHBondContact O-N 3.24Å; T690-I719 WeakPolarHBondContact CA-O 3.45Å; T690-I719 HydrophobicContact CG2-CB 4.29Å; T690-I719 HydrophobicContact CG2-CG2 4.39Å; Y691-I719 HydrophobicContact CE1-CG2 4.16Å; Y691-I719 PolarHBondContact N-O 3.34Å; S717-I719 VanDerWaalsContact OG-CD1 3.29Å; S717-I719 WeakPolarHBondContact OG-CD1 3.48Å; S717-I719 WeakPolarHBondContact OG-CG1 3.29Å; I719-C721 PolarHBondContact O-N 3.14Å; I719-C721 PolarHBondContact O-SG 3.35Å; I719-N746 WeakPolarHBondContact CD1-ND2 3.49Å; I719-S748 WeakPolarHBondContact CA-O 3.33Å
720	G	89.1	Confident	92.1	Very high	5 Å²	5	30.9 Å²	30.9	5%	0.052	18%	0.175	C	C	.	.	S	Bend	trans	51.5	26.3	172.4	0	0	0	0	0	115.9	S748	G720-S748 PolarHBondContact N-O 3.38Å
721	C	90.9	Very high	92	Very high	2 Å²	2	31.1 Å²	31.1	1%	0.014	18%	0.176	C	C	.	.			trans	-77.2	144.6	179.3	-60.5	0	0	0	0	110.5	F689 C692 I719 F726 T750	F689-C721 VanDerWaalsContact CB-SG 3.55Å; C692-C721 VanDerWaalsContact O-CA 3.26Å; C692-C721 WeakPolarHBondContact O-CA 3.49Å; C692-C721 WeakPolarHBondContact O-CB 3.46Å; I719-C721 PolarHBondContact O-N 3.14Å; I719-C721 PolarHBondContact O-SG 3.35Å; C721-F726 HydrophobicContact CB-CB 4.24Å; C721-F726 HydrophobicContact CB-CD1 4.11Å; C721-F726 HydrophobicContact CB-CD2 4.24Å; C721-F726 HydrophobicContact CB-CG 3.96Å; C721-T750 HydrophobicContact CB-CG2 4.4Å
722	T	89.6	Confident	92	Very high	4 Å²	4	27.6 Å²	27.6	3%	0.025	15%	0.153	C	C	.	.	B	Isolated β-bridge	trans	-142.1	169.4	-173.6	59.1	0	0	0	0	111.8	S84 C692 R693 G694 D727	S84-T722 PolarHBondContact O-OG1 3.42Å; C692-T722 PolarHBondContact O-N 2.78Å; C692-T722 VanDerWaalsContact O-N 3.16Å; R693-T722 CarbonylContact C-O 3.5Å; R693-T722 VanDerWaalsContact CA-O 3.24Å; R693-T722 WeakPolarHBondContact CA-O 3.37Å; G694-T722 PolarHBondContact N-O 2.89Å; T722-D727 WeakPolarHBondContact CA-OD1 3.35Å; T722-D727 WeakPolarHBondContact CB-OD1 3.45Å
723	K	89.8	Confident	92	Very high	76 Å²	76	30.6 Å²	30.6	33%	0.33	15%	0.153	S	C	.	.	S	Bend	trans	68.9	157.5	174.6	-59	-78.1	151.5	-110	0	116.2	G694 D695 F726 D727	G694-K723 WeakPolarHBondContact CA-O 3.48Å; D695-K723 WeakPolarHBondContact OD1-CB 3.4Å; D695-K723 WeakPolarHBondContact OD1-CG 3.34Å; K723-F726 WeakPolarHBondContact O-CB 3.13Å; K723-F726 PolarHBondContact O-N 2.59Å; K723-D727 WeakPolarHBondContact CA-OD2 3.32Å; K723-D727 PolarHBondContact N-OD1 3.08Å; K723-D727 PolarHBondContact N-OD2 2.69Å; K723-D727 IonicContact NZ-OD2 3.64Å; K723-D727 PolarHBondContact NZ-OD2 3.44Å
724	G	89.8	Confident	91.9	Very high	31 Å²	31	30.8 Å²	30.8	32%	0.32	15%	0.154	S	C	.	.	G	3₁₀ helix	trans	49.5	-121	-172.4	0	0	0	0	0	112	G694 F726 Q728	G694-G724 WeakPolarHBondContact O-CA 3.41Å; G724-F726 VanDerWaalsContact C-N 3.33Å; G724-F726 PolarHBondContact O-N 2.91Å; G724-Q728 PolarHBondContact O-NE2 2.57Å
725	P	89.6	Confident	91.9	Very high	3 Å²	3	28 Å²	28	2%	0.019	14%	0.141	C	C	.	.	G	3₁₀ helix	trans	-74.3	-16.8	179	31.6	-35.5	0	0	0	113.8	L697 L702 Q728 L730 P731	L697-P725 HydrophobicContact CB-CG 3.88Å; L697-P725 WeakPolarHBondContact O-CD 3.44Å; L702-P725 HydrophobicContact CD1-CB 3.61Å; L702-P725 HydrophobicContact CD1-CG 3.56Å; L702-P725 HydrophobicContact CG-CG 4.32Å; P725-Q728 PolarHBondContact O-N 3.29Å; P725-L730 HydrophobicContact CB-CD1 4.47Å; P725-P731 VanDerWaalsContact O-CD 3.29Å; P725-P731 WeakPolarHBondContact O-CD 3.42Å; P725-P731 VanDerWaalsContact O-CG 3.31Å; P725-P731 WeakPolarHBondContact O-CG 3.46Å
726	F	89.9	Confident	91.8	Very high	5 Å²	5	24.9 Å²	24.9	2%	0.022	13%	0.129	C	C	.	.	G	3₁₀ helix	trans	-76.2	-24.2	179.7	-63.4	-59.4	0	0	0	113.7	F689 L697 L702 L718 C721 K723 G724 Q728 P731 S752	F689-F726 HydrophobicContact CD1-CZ 4.08Å; F689-F726 HydrophobicContact CE1-CZ 4.24Å; F689-F726 HydrophobicContact CG-CZ 4.5Å; L697-F726 HydrophobicContact CD1-CE2 3.66Å; L697-F726 HydrophobicContact CD1-CZ 4.06Å; L702-F726 HydrophobicContact CD2-CE1 4.48Å; L718-F726 HydrophobicContact CD2-CE1 4.07Å; C721-F726 HydrophobicContact CB-CB 4.24Å; C721-F726 HydrophobicContact CB-CD1 4.11Å; C721-F726 HydrophobicContact CB-CD2 4.24Å; C721-F726 HydrophobicContact CB-CG 3.96Å; K723-F726 WeakPolarHBondContact O-CB 3.13Å; K723-F726 PolarHBondContact O-N 2.59Å; G724-F726 VanDerWaalsContact C-N 3.33Å; G724-F726 PolarHBondContact O-N 2.91Å; F726-Q728 PolarHBondContact O-N 2.91Å; F726-P731 HydrophobicContact CD1-CB 4.44Å; F726-P731 HydrophobicContact CD1-CG 3.94Å; F726-S752 VanDerWaalsContact O-CB 3.23Å; F726-S752 WeakPolarHBondContact O-CB 3.29Å; F726-S752 PolarHBondContact O-OG 2.9Å
727	D	85	Confident	91.7	Very high	60 Å²	60	28.8 Å²	28.8	32%	0.321	15%	0.15	S	C	.	.	G	3₁₀ helix	trans	-74.3	-12.1	171.4	-75.7	-8.7	0	0	0	112.1	T722 K723	T722-D727 WeakPolarHBondContact CA-OD1 3.35Å; T722-D727 WeakPolarHBondContact CB-OD1 3.45Å; K723-D727 WeakPolarHBondContact CA-OD2 3.32Å; K723-D727 PolarHBondContact N-OD1 3.08Å; K723-D727 PolarHBondContact N-OD2 2.69Å; K723-D727 IonicContact NZ-OD2 3.64Å; K723-D727 PolarHBondContact NZ-OD2 3.44Å
728	Q	80.5	Confident	91.7	Very high	99 Å²	99	31.8 Å²	31.8	46%	0.463	16%	0.161	S	C	.	.	S	Bend	trans	-102	161.9	-179.4	-57.5	178	46.6	0	0	111.2	G724 P725 F726 L730 P731 S752	G724-Q728 PolarHBondContact O-NE2 2.57Å; P725-Q728 PolarHBondContact O-N 3.29Å; F726-Q728 PolarHBondContact O-N 2.91Å; Q728-L730 HydrophobicContact CB-CB 4.35Å; Q728-L730 HydrophobicContact CB-CD1 4.21Å; Q728-L730 HydrophobicContact CB-CG 3.92Å; Q728-L730 PolarHBondContact O-N 3.47Å; Q728-L730 VanDerWaalsContact O-N 3.14Å; Q728-L730 VanDerWaalsContact OE1-CD1 3.24Å; Q728-P731 WeakPolarHBondContact O-CD 3.38Å; Q728-S752 WeakPolarHBondContact O-CB 3.31Å
729	D	89.8	Confident	91.8	Very high	42 Å²	42	31.5 Å²	31.5	23%	0.225	16%	0.159	C	C	.	.	S	Bend	trans	-70.3	-6.9	177.8	84.3	-49.7	0	0	0	113.5	P731 R733 T757	D729-P731 VanDerWaalsContact C-CD 3.45Å; D729-R733 PolarHBondContact O-N 3.26Å; D729-R733 IonicContact OD1-CZ 2.74Å; D729-R733 IonicContact OD1-NH1 3.68Å; D729-R733 PolarHBondContact OD1-NH1 3.03Å; D729-R733 IonicContact OD2-CZ 3.88Å; D729-R733 IonicContact OD2-NH1 2.73Å; D729-R733 PolarHBondContact OD2-NH1 2.68Å; D729-T757 HydrophobicContact CB-CG2 3.62Å; D729-T757 WeakPolarHBondContact O-CG2 3.38Å
730	L	91.3	Very high	91.9	Very high	25 Å²	25	38.2 Å²	38.2	13%	0.131	18%	0.182	C	C	.	.	H	α-helix	trans	-51.4	-44.9	-176.9	-64.2	-179.2	0	0	0	116.1	A699 P725 Q728 L732 R733 I734	A699-L730 HydrophobicContact CB-CD1 3.79Å; P725-L730 HydrophobicContact CB-CD1 4.47Å; Q728-L730 HydrophobicContact CB-CB 4.35Å; Q728-L730 HydrophobicContact CB-CD1 4.21Å; Q728-L730 HydrophobicContact CB-CG 3.92Å; Q728-L730 PolarHBondContact O-N 3.47Å; Q728-L730 VanDerWaalsContact O-N 3.14Å; Q728-L730 VanDerWaalsContact OE1-CD1 3.24Å; L730-L732 PolarHBondContact O-N 3.4Å; L730-R733 PolarHBondContact O-N 3.43Å; L730-I734 HydrophobicContact CB-CD1 4.11Å; L730-I734 WeakPolarHBondContact O-CB 3.4Å; L730-I734 WeakPolarHBondContact O-CD1 3.43Å; L730-I734 VanDerWaalsContact O-CG1 3.23Å; L730-I734 WeakPolarHBondContact O-CG1 3.34Å; L730-I734 PolarHBondContact O-N 2.78Å
731	P	93	Very high	92.2	Very high	5 Å²	5	42.1 Å²	42.1	3%	0.032	20%	0.202	C	C	.	.	H	α-helix	trans	-63.5	-45.8	-168.7	-22.5	33.6	0	0	0	112.3	L702 L718 P725 F726 Q728 D729 V735	L702-P731 HydrophobicContact CD1-CB 4.47Å; L702-P731 HydrophobicContact CD1-CG 4.31Å; L718-P731 HydrophobicContact CD1-CB 3.9Å; P725-P731 VanDerWaalsContact O-CD 3.29Å; P725-P731 WeakPolarHBondContact O-CD 3.42Å; P725-P731 VanDerWaalsContact O-CG 3.31Å; P725-P731 WeakPolarHBondContact O-CG 3.46Å; F726-P731 HydrophobicContact CD1-CB 4.44Å; F726-P731 HydrophobicContact CD1-CG 3.94Å; Q728-P731 WeakPolarHBondContact O-CD 3.38Å; D729-P731 VanDerWaalsContact C-CD 3.45Å; P731-V735 WeakPolarHBondContact O-CB 3.45Å; P731-V735 WeakPolarHBondContact O-CG2 3.39Å; P731-V735 PolarHBondContact O-N 3.27Å
732	L	94.9	Very high	92.5	Very high	6 Å²	6	42 Å²	42	3%	0.031	20%	0.202	C	C	.	.	H	α-helix	trans	-72.6	-28.7	176.8	-72.6	-173.1	0	0	0	112.8	L716 L718 L730 V735 A736 V745 A747 V753 T757	L716-L732 HydrophobicContact CD2-CD2 4.36Å; L718-L732 HydrophobicContact CD1-CD2 4.02Å; L718-L732 HydrophobicContact CD1-CG 4.46Å; L730-L732 PolarHBondContact O-N 3.4Å; L732-V735 PolarHBondContact O-N 2.72Å; L732-A736 WeakPolarHBondContact O-CB 3.17Å; L732-A736 PolarHBondContact O-N 3.05Å; L732-V745 HydrophobicContact CD2-CG1 4.37Å; L732-A747 HydrophobicContact CD1-CB 4.16Å; L732-V753 HydrophobicContact CD1-CG2 3.83Å; L732-T757 HydrophobicContact CB-CG2 4.33Å
733	R	94.8	Very high	92.8	Very high	100 Å²	100	44.3 Å²	44.3	38%	0.377	21%	0.212	S	C	.	.	H	α-helix	trans	-69.5	-44.9	175.1	-155	166.9	76.7	-141	3.5	111.6	D729 L730 V735 A736 D737	D729-R733 PolarHBondContact O-N 3.26Å; D729-R733 IonicContact OD1-CZ 2.74Å; D729-R733 IonicContact OD1-NH1 3.68Å; D729-R733 PolarHBondContact OD1-NH1 3.03Å; D729-R733 IonicContact OD2-CZ 3.88Å; D729-R733 IonicContact OD2-NH1 2.73Å; D729-R733 PolarHBondContact OD2-NH1 2.68Å; L730-R733 PolarHBondContact O-N 3.43Å; R733-V735 VanDerWaalsContact C-N 3.31Å; R733-V735 PolarHBondContact O-N 2.62Å; R733-A736 WeakPolarHBondContact O-CB 3.47Å; R733-A736 PolarHBondContact O-N 2.95Å; R733-D737 VanDerWaalsContact O-CG 3.28Å; R733-D737 PolarHBondContact O-N 2.76Å
734	I	95.6	Very high	93.2	Very high	3 Å²	3	42.7 Å²	42.7	2%	0.015	21%	0.206	C	C	.	.	H	α-helix	trans	-61.3	-39.2	172	-67.8	164.2	0	0	0	111.1	L702 K703 F706 L730 D737 Y738	L702-I734 HydrophobicContact CB-CD1 4.11Å; K703-I734 HydrophobicContact CG-CD1 3.82Å; K703-I734 HydrophobicContact CG-CG1 3.85Å; K703-I734 HydrophobicContact CG-CG2 4Å; F706-I734 HydrophobicContact CB-CG2 4.04Å; F706-I734 HydrophobicContact CD2-CG2 3.72Å; F706-I734 HydrophobicContact CG-CG2 4.28Å; L730-I734 HydrophobicContact CB-CD1 4.11Å; L730-I734 WeakPolarHBondContact O-CB 3.4Å; L730-I734 WeakPolarHBondContact O-CD1 3.43Å; L730-I734 VanDerWaalsContact O-CG1 3.23Å; L730-I734 WeakPolarHBondContact O-CG1 3.34Å; L730-I734 PolarHBondContact O-N 2.78Å; I734-D737 PolarHBondContact O-N 3.12Å; I734-Y738 HydrophobicContact CG2-CD2 3.89Å; I734-Y738 HydrophobicContact CG2-CE2 3.99Å; I734-Y738 WeakPolarHBondContact O-CD2 3.4Å; I734-Y738 PolarHBondContact O-N 2.64Å
735	V	95.9	Very high	93.6	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-64.5	-41.7	175	164.6	0	0	0	0	111.2	F706 L716 P731 L732 R733 D737 Y738 C739 L742 L761	F706-V735 HydrophobicContact CD1-CG2 4.03Å; F706-V735 HydrophobicContact CD2-CG2 4.05Å; F706-V735 HydrophobicContact CE1-CG2 3.65Å; F706-V735 HydrophobicContact CE2-CG2 3.65Å; F706-V735 HydrophobicContact CG-CG2 4.23Å; F706-V735 HydrophobicContact CZ-CG2 3.44Å; F706-V735 VanDerWaalsContact CZ-CG2 3.44Å; L716-V735 HydrophobicContact CD2-CB 4.18Å; L716-V735 HydrophobicContact CD2-CG1 3.74Å; L716-V735 HydrophobicContact CD2-CG2 3.48Å; L716-V735 VanDerWaalsContact CD2-CG2 3.48Å; P731-V735 WeakPolarHBondContact O-CB 3.45Å; P731-V735 WeakPolarHBondContact O-CG2 3.39Å; P731-V735 PolarHBondContact O-N 3.27Å; L732-V735 PolarHBondContact O-N 2.72Å; R733-V735 VanDerWaalsContact C-N 3.31Å; R733-V735 PolarHBondContact O-N 2.62Å; V735-D737 VanDerWaalsContact C-N 3.31Å; V735-D737 PolarHBondContact O-N 2.96Å; V735-Y738 PolarHBondContact O-N 3.13Å; V735-C739 HydrophobicContact CG1-CB 3.92Å; V735-C739 WeakPolarHBondContact O-CA 3.11Å; V735-C739 WeakPolarHBondContact O-CB 3.34Å; V735-C739 PolarHBondContact O-N 2.95Å; V735-C739 PolarHBondContact O-SG 3.36Å; V735-C739 VanDerWaalsContact O-SG 3.41Å; V735-L742 HydrophobicContact CG1-CD2 3.53Å; V735-L761 HydrophobicContact CG1-CD1 4.23Å
736	A	96	Very high	94	Very high	7 Å²	7	42.4 Å²	42.4	6%	0.058	20%	0.197	C	C	.	.	H	α-helix	trans	-60.4	-39.5	173.8	0	0	0	0	0	112.3	L732 R733 Y738 A760 S764	L732-A736 WeakPolarHBondContact O-CB 3.17Å; L732-A736 PolarHBondContact O-N 3.05Å; R733-A736 WeakPolarHBondContact O-CB 3.47Å; R733-A736 PolarHBondContact O-N 2.95Å; A736-Y738 VanDerWaalsContact C-N 3.34Å; A736-Y738 PolarHBondContact O-N 3.01Å; A736-A760 HydrophobicContact CB-CB 3.96Å; A736-S764 VanDerWaalsContact CA-OG 3.27Å; A736-S764 WeakPolarHBondContact CA-OG 3.21Å; A736-S764 VanDerWaalsContact CB-OG 3.3Å; A736-S764 WeakPolarHBondContact CB-OG 3.32Å; A736-S764 WeakPolarHBondContact O-CB 3.46Å; A736-S764 PolarHBondContact O-OG 3.14Å
737	D	95.9	Very high	94.2	Very high	89 Å²	89	42.2 Å²	42.2	48%	0.476	20%	0.196	S	C	.	.	H	α-helix	trans	-61.9	-37.9	178.3	-61.1	-30.9	0	0	0	112.9	R733 I734 V735	R733-D737 VanDerWaalsContact O-CG 3.28Å; R733-D737 PolarHBondContact O-N 2.76Å; I734-D737 PolarHBondContact O-N 3.12Å; V735-D737 VanDerWaalsContact C-N 3.31Å; V735-D737 PolarHBondContact O-N 2.96Å
738	Y	96.2	Very high	94.7	Very high	69 Å²	69	39.4 Å²	39.4	27%	0.271	18%	0.181	S	C	.	.	H	α-helix	trans	-115.6	-19.3	-168.3	-59.1	-61.8	0	0	0	116.7	K703 F706 L707 G710 I734 V735 A736	K703-Y738 HydrophobicContact CB-CE2 4.43Å; K703-Y738 HydrophobicContact CG-CE2 4.31Å; F706-Y738 HydrophobicContact CB-CD2 3.93Å; F706-Y738 HydrophobicContact CB-CG 4.47Å; F706-Y738 WeakPolarHBondContact O-CB 3.38Å; L707-Y738 HydrophobicContact CB-CE1 4.37Å; L707-Y738 HydrophobicContact CD1-CD1 4.07Å; L707-Y738 HydrophobicContact CD1-CE1 3.7Å; G710-Y738 CarbonylContact C-O 3.55Å; I734-Y738 HydrophobicContact CG2-CD2 3.89Å; I734-Y738 HydrophobicContact CG2-CE2 3.99Å; I734-Y738 WeakPolarHBondContact O-CD2 3.4Å; I734-Y738 PolarHBondContact O-N 2.64Å; V735-Y738 PolarHBondContact O-N 3.13Å; A736-Y738 VanDerWaalsContact C-N 3.34Å; A736-Y738 PolarHBondContact O-N 3.01Å
739	C	96.3	Very high	95.1	Very high	2 Å²	2	36.5 Å²	36.5	1%	0.014	17%	0.166	C	C	.	.			trans	-109.5	57.8	-165.5	-51.1	0	0	0	0	113.7	G710 V735 N741 L742	G710-C739 VanDerWaalsContact CA-SG 3.51Å; V735-C739 HydrophobicContact CG1-CB 3.92Å; V735-C739 WeakPolarHBondContact O-CA 3.11Å; V735-C739 WeakPolarHBondContact O-CB 3.34Å; V735-C739 PolarHBondContact O-N 2.95Å; V735-C739 PolarHBondContact O-SG 3.36Å; V735-C739 VanDerWaalsContact O-SG 3.41Å; C739-N741 PolarHBondContact O-N 2.91Å; C739-L742 HydrophobicContact CB-CB 4.27Å; C739-L742 HydrophobicContact CB-CD2 4.24Å; C739-L742 WeakPolarHBondContact O-CB 3.49Å; C739-L742 PolarHBondContact O-N 2.83Å
740	R	95	Very high	95	Very high	169 Å²	169	34.8 Å²	34.8	64%	0.638	16%	0.157	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-22.8	-174.6	-57.8	-176.8	-172.5	173.3	1.6	115.4	L742 S764 T766	R740-L742 VanDerWaalsContact C-N 3.33Å; R740-S764 WeakPolarHBondContact CA-O 3.07Å; R740-T766 PolarHBondContact O-N 3.25Å; R740-T766 PolarHBondContact O-OG1 2.91Å; R740-T766 VanDerWaalsContact O-OG1 3.13Å
741	N	95.6	Very high	94.7	Very high	88 Å²	88	38 Å²	38	47%	0.471	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.7	12.8	-178.4	-69.9	-31.4	0	0	0	113.5	P711 L713 C739	P711-N741 PolarHBondContact O-ND2 2.84Å; L713-N741 CarbonylContact O-C 3.16Å; C739-N741 PolarHBondContact O-N 2.91Å
742	L	97	Very high	94.5	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	17%	0.173	C	C	.	.			trans	-75	128.3	-176	-164.1	64.3	0	0	0	110.9	L713 L716 V735 C739 R740 V745 L761 L768	L713-L742 HydrophobicContact CD2-CD1 4.29Å; L713-L742 HydrophobicContact CG-CD1 4.12Å; L716-L742 HydrophobicContact CB-CD1 3.89Å; L716-L742 HydrophobicContact CB-CD2 4.29Å; V735-L742 HydrophobicContact CG1-CD2 3.53Å; C739-L742 HydrophobicContact CB-CB 4.27Å; C739-L742 HydrophobicContact CB-CD2 4.24Å; C739-L742 WeakPolarHBondContact O-CB 3.49Å; C739-L742 PolarHBondContact O-N 2.83Å; R740-L742 VanDerWaalsContact C-N 3.33Å; L742-V745 HydrophobicContact CD2-CG2 3.47Å; L742-V745 VanDerWaalsContact CD2-CG2 3.47Å; L742-V745 HydrophobicContact CG-CG2 3.71Å; L742-L761 HydrophobicContact CD2-CD1 4.05Å; L742-L768 WeakPolarHBondContact O-CD2 3.4Å
743	Q	97.7	Very high	94.4	Very high	52 Å²	52	38.1 Å²	38.1	24%	0.243	17%	0.173	C	C	.	.			trans	-115.4	-33.1	-174.1	-67	175	-37	0	0	112.6	Q714 H767 I769 S770	Q714-Q743 PolarHBondContact O-N 3.06Å; Q743-H767 WeakPolarHBondContact CA-O 3.38Å; Q743-I769 HydrophobicContact CB-CD1 4.15Å; Q743-I769 HydrophobicContact CB-CG1 4.29Å; Q743-I769 HydrophobicContact CG-CD1 4.31Å; Q743-I769 PolarHBondContact O-N 3.3Å; Q743-S770 PolarHBondContact O-N 3.48Å
744	H	98.2	Very high	94.4	Very high	41 Å²	41	38.6 Å²	38.6	19%	0.19	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	126	179	-49.8	-103.3	0	0	0	110.8	Q714 K715 L716 S770	Q714-H744 PolarHBondContact O-N 2.86Å; Q714-H744 VanDerWaalsContact O-N 3.13Å; K715-H744 WeakPolarHBondContact CA-O 3.35Å; K715-H744 HydrophobicContact CB-CB 4.39Å; K715-H744 HydrophobicContact CD-CB 4.42Å; K715-H744 VanDerWaalsContact CE-CD2 3.44Å; K715-H744 WeakPolarHBondContact CE-CD2 3.13Å; K715-H744 HydrophobicContact CG-CB 3.97Å; L716-H744 PolarHBondContact N-O 2.73Å; H744-S770 CarbonylContact C-O 3.6Å; H744-S770 WeakPolarHBondContact CA-O 3.3Å; H744-S770 WeakPolarHBondContact ND1-CB 3.28Å
745	V	97.5	Very high	94.4	Very high	5 Å²	5	40.2 Å²	40.2	3%	0.03	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	127.5	179.7	-174.7	0	0	0	0	110.1	L716 L732 L742 L761 L768 S770 V771 K772	L716-V745 WeakPolarHBondContact O-CA 3.5Å; L732-V745 HydrophobicContact CD2-CG1 4.37Å; L742-V745 HydrophobicContact CD2-CG2 3.47Å; L742-V745 VanDerWaalsContact CD2-CG2 3.47Å; L742-V745 HydrophobicContact CG-CG2 3.71Å; V745-L761 HydrophobicContact CB-CD2 4.33Å; V745-L761 HydrophobicContact CG1-CD2 4Å; V745-L761 HydrophobicContact CG2-CD1 4.4Å; V745-L761 HydrophobicContact CG2-CD2 4.13Å; V745-L768 HydrophobicContact CG2-CD2 3.93Å; V745-S770 PolarHBondContact N-O 2.99Å; V745-V771 WeakPolarHBondContact O-CA 3.23Å; V745-K772 PolarHBondContact O-N 3.37Å
746	N	97.1	Very high	94.4	Very high	24 Å²	24	45.8 Å²	45.8	13%	0.128	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	106.6	172.5	-176.6	-1.9	0	0	0	110.5	L716 S717 L718 I719 S748 K772	L716-N746 PolarHBondContact O-N 3.13Å; S717-N746 CarbonylContact C-O 3.07Å; S717-N746 WeakPolarHBondContact CA-O 3.28Å; L718-N746 PolarHBondContact N-O 3.08Å; I719-N746 WeakPolarHBondContact CD1-ND2 3.49Å; N746-S748 VanDerWaalsContact OD1-CB 3.26Å; N746-S748 WeakPolarHBondContact OD1-CB 2.99Å; N746-S748 PolarHBondContact OD1-N 3.24Å; N746-S748 VanDerWaalsContact OD1-N 3.08Å; N746-S748 PolarHBondContact OD1-OG 3.4Å; N746-K772 WeakPolarHBondContact CA-O 3.33Å; N746-K772 HydrophobicContact CB-CB 4.07Å; N746-K772 HydrophobicContact CB-CD 4.22Å
747	A	95.6	Very high	94.3	Very high	1 Å²	1	45.5 Å²	45.5	1%	0.008	21%	0.207	C	C	.	.			trans	-110.9	23.7	177.7	0	0	0	0	0	112.3	L718 L732 Y749 T750 V753 K772 L773	L718-A747 CarbonylContact O-C 3.51Å; L718-A747 WeakPolarHBondContact O-CA 3.41Å; L732-A747 HydrophobicContact CD1-CB 4.16Å; A747-Y749 PolarHBondContact O-N 2.99Å; A747-T750 PolarHBondContact O-N 3.33Å; A747-T750 PolarHBondContact O-OG1 3.13Å; A747-V753 HydrophobicContact CB-CG2 3.61Å; A747-K772 PolarHBondContact N-O 2.98Å; A747-L773 HydrophobicContact CB-CD2 4.21Å
748	S	94.2	Very high	94.4	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.8	136.8	-173.5	-57.8	0	0	0	0	112.7	I719 G720 N746 T750 N774	I719-S748 WeakPolarHBondContact CA-O 3.33Å; G720-S748 PolarHBondContact N-O 3.38Å; N746-S748 VanDerWaalsContact OD1-CB 3.26Å; N746-S748 WeakPolarHBondContact OD1-CB 2.99Å; N746-S748 PolarHBondContact OD1-N 3.24Å; N746-S748 VanDerWaalsContact OD1-N 3.08Å; N746-S748 PolarHBondContact OD1-OG 3.4Å; S748-T750 PolarHBondContact O-N 3.34Å; S748-N774 CarbonylContact C-O 3.57Å; S748-N774 WeakPolarHBondContact CA-O 3.48Å; S748-N774 PolarHBondContact OG-ND2 3.38Å
749	Y	89.2	Confident	94.4	Very high	39 Å²	39	39 Å²	39	15%	0.153	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.8	18.7	178.2	-44.3	-74	0	0	0	115.5	W82 A747 N774	W82-Y749 HydrophobicContact CE3-CD1 4.32Å; W82-Y749 WeakPolarHBondContact CZ2-O 3.23Å; W82-Y749 PolarHBondContact NE1-O 3.25Å; W82-Y749 VanDerWaalsContact NE1-O 3.16Å; A747-Y749 PolarHBondContact O-N 2.99Å; Y749-N774 HydrophobicContact CE2-CB 4.5Å; Y749-N774 PolarHBondContact N-O 3.13Å
750	T	89	Confident	94.5	Very high	6 Å²	6	40 Å²	40	4%	0.037	18%	0.184	C	C	.	.			trans	-88.7	130.1	168.7	52.7	0	0	0	0	111.5	L718 C721 A747 S748 S752 V753	L718-T750 WeakPolarHBondContact O-CG2 3.04Å; C721-T750 HydrophobicContact CB-CG2 4.4Å; A747-T750 PolarHBondContact O-N 3.33Å; A747-T750 PolarHBondContact O-OG1 3.13Å; S748-T750 PolarHBondContact O-N 3.34Å; T750-S752 VanDerWaalsContact C-N 3.27Å; T750-S752 PolarHBondContact O-N 3.33Å; T750-V753 WeakPolarHBondContact OG1-CG2 3.29Å
751	Q	83.8	Confident	94.5	Very high	92 Å²	92	32.1 Å²	32.1	43%	0.43	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.1	-13.6	-174.6	-64.3	178.5	-6.2	0	0	113.2	W82	W82-Q751 HydrophobicContact CZ2-CG 3.62Å
752	S	88.1	Confident	94.6	Very high	10 Å²	10	27.9 Å²	27.9	7%	0.07	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-19.3	179.2	34.4	0	0	0	0	114.6	F726 Q728 T750 R754	F726-S752 VanDerWaalsContact O-CB 3.23Å; F726-S752 WeakPolarHBondContact O-CB 3.29Å; F726-S752 PolarHBondContact O-OG 2.9Å; Q728-S752 WeakPolarHBondContact O-CB 3.31Å; T750-S752 VanDerWaalsContact C-N 3.27Å; T750-S752 PolarHBondContact O-N 3.33Å; S752-R754 WeakPolarHBondContact O-CG 3.48Å; S752-R754 PolarHBondContact O-N 3.17Å
753	V	93.6	Very high	94.6	Very high	3 Å²	3	34.9 Å²	34.9	2%	0.018	16%	0.159	C	C	.	.			trans	-69	120.8	179.5	173.4	0	0	0	0	110.4	L732 A747 T750 V758 L773 A776 Q778 I779	L732-V753 HydrophobicContact CD1-CG2 3.83Å; A747-V753 HydrophobicContact CB-CG2 3.61Å; T750-V753 WeakPolarHBondContact OG1-CG2 3.29Å; V753-V758 HydrophobicContact CG1-CG2 4.21Å; V753-L773 HydrophobicContact CG1-CD2 4.26Å; V753-A776 HydrophobicContact CB-CB 4.07Å; V753-A776 HydrophobicContact CG1-CB 3.66Å; V753-Q778 WeakPolarHBondContact O-CB 3.35Å; V753-I779 HydrophobicContact CG1-CD1 3.79Å; V753-I779 HydrophobicContact CG1-CG1 3.84Å
754	R	94.2	Very high	94.5	Very high	110 Å²	110	33.7 Å²	33.7	42%	0.415	16%	0.157	S	C	.	.	B	Isolated β-bridge	trans	-143.1	162.4	177.9	-5.9	-179.4	73.1	85.9	-0.2	109.8	S752 Q756 T757 Q778	S752-R754 WeakPolarHBondContact O-CG 3.48Å; S752-R754 PolarHBondContact O-N 3.17Å; R754-Q756 VanDerWaalsContact C-N 3.3Å; R754-Q756 PolarHBondContact O-N 2.84Å; R754-T757 PolarHBondContact N-OG1 2.75Å; R754-T757 WeakPolarHBondContact O-CB 3.46Å; R754-T757 PolarHBondContact O-N 2.88Å; R754-T757 PolarHBondContact O-OG1 2.66Å; R754-Q778 HydrophobicContact CB-CB 3.97Å
755	D	96.3	Very high	94.3	Very high	37 Å²	37	32 Å²	32	20%	0.198	15%	0.15	C	C	.	.	H	α-helix	trans	-43.1	-50.3	-174.3	-72.3	-17.3	0	0	0	114.6	T757 V758 I759 I779 S780 A783	D755-T757 PolarHBondContact O-N 2.73Å; D755-T757 VanDerWaalsContact O-N 3.12Å; D755-V758 PolarHBondContact O-N 2.93Å; D755-V758 VanDerWaalsContact O-N 3.07Å; D755-I759 HydrophobicContact CB-CD1 4.23Å; D755-I759 VanDerWaalsContact O-CG1 3.23Å; D755-I759 WeakPolarHBondContact O-CG1 3.29Å; D755-I759 PolarHBondContact O-N 3.32Å; D755-I779 VanDerWaalsContact OD1-CA 3.29Å; D755-I779 WeakPolarHBondContact OD1-CA 3.25Å; D755-S780 PolarHBondContact OD1-N 3.49Å; D755-S780 WeakPolarHBondContact OD2-CB 3.27Å; D755-S780 PolarHBondContact OD2-OG 3.35Å; D755-A783 HydrophobicContact CB-CB 3.87Å; D755-A783 WeakPolarHBondContact OD1-CB 3.44Å
756	Q	95.5	Very high	94.1	Very high	117 Å²	117	36.4 Å²	36.4	55%	0.547	18%	0.177	S	C	.	.	H	α-helix	trans	-54.4	-33.9	179.4	-173.4	58.1	33.4	0	0	114.1	R754 A760	R754-Q756 VanDerWaalsContact C-N 3.3Å; R754-Q756 PolarHBondContact O-N 2.84Å; Q756-A760 VanDerWaalsContact O-CB 3.32Å; Q756-A760 WeakPolarHBondContact O-CB 3.37Å; Q756-A760 PolarHBondContact O-N 3.37Å
757	T	95.2	Very high	94	Very high	1 Å²	1	39.2 Å²	39.2	1%	0.006	19%	0.189	C	C	.	.	H	α-helix	trans	-71.7	-41	178.3	59.9	0	0	0	0	112.3	D729 L732 R754 D755 L761	D729-T757 HydrophobicContact CB-CG2 3.62Å; D729-T757 WeakPolarHBondContact O-CG2 3.38Å; L732-T757 HydrophobicContact CB-CG2 4.33Å; R754-T757 PolarHBondContact N-OG1 2.75Å; R754-T757 WeakPolarHBondContact O-CB 3.46Å; R754-T757 PolarHBondContact O-N 2.88Å; R754-T757 PolarHBondContact O-OG1 2.66Å; D755-T757 PolarHBondContact O-N 2.73Å; D755-T757 VanDerWaalsContact O-N 3.12Å; T757-L761 VanDerWaalsContact O-CB 3.29Å; T757-L761 WeakPolarHBondContact O-CB 3.38Å; T757-L761 PolarHBondContact O-N 2.95Å
758	V	96.9	Very high	94.1	Very high	1 Å²	1	39.2 Å²	39.2	1%	0.006	19%	0.189	C	C	.	.	H	α-helix	trans	-74.3	-35	178.3	174.8	0	0	0	0	110.8	V753 D755 L761 A762 L773 I779 A783	V753-V758 HydrophobicContact CG1-CG2 4.21Å; D755-V758 PolarHBondContact O-N 2.93Å; D755-V758 VanDerWaalsContact O-N 3.07Å; V758-L761 PolarHBondContact O-N 3.5Å; V758-A762 VanDerWaalsContact O-CB 3.29Å; V758-A762 WeakPolarHBondContact O-CB 3.48Å; V758-A762 PolarHBondContact O-N 3.46Å; V758-L773 HydrophobicContact CG1-CD1 4.32Å; V758-L773 HydrophobicContact CG2-CD1 3.88Å; V758-L773 HydrophobicContact CG2-CD2 4.2Å; V758-I779 HydrophobicContact CB-CD1 4.21Å; V758-I779 HydrophobicContact CG2-CD1 3.57Å; V758-A783 HydrophobicContact CB-CB 4.12Å; V758-A783 HydrophobicContact CG1-CB 4.14Å
759	I	97.4	Very high	94.2	Very high	22 Å²	22	40.4 Å²	40.4	11%	0.113	20%	0.195	C	C	.	.	H	α-helix	trans	-65.1	-43.1	173.2	-64.5	169.4	0	0	0	111	D755 R763 A783 Q786	D755-I759 HydrophobicContact CB-CD1 4.23Å; D755-I759 VanDerWaalsContact O-CG1 3.23Å; D755-I759 WeakPolarHBondContact O-CG1 3.29Å; D755-I759 PolarHBondContact O-N 3.32Å; I759-R763 WeakPolarHBondContact O-CB 3.47Å; I759-R763 WeakPolarHBondContact O-CD 3.36Å; I759-R763 VanDerWaalsContact O-CG 3.23Å; I759-R763 WeakPolarHBondContact O-CG 3.37Å; I759-R763 PolarHBondContact O-N 3.03Å; I759-A783 HydrophobicContact CG1-CB 4.19Å; I759-Q786 HydrophobicContact CD1-CG 4.35Å; I759-Q786 HydrophobicContact CG1-CB 3.99Å; I759-Q786 HydrophobicContact CG1-CG 3.95Å; I759-Q786 HydrophobicContact CG2-CB 4.42Å; I759-Q786 HydrophobicContact CG2-CG 4.16Å
760	A	96.8	Very high	94.7	Very high	21 Å²	21	39 Å²	39	17%	0.174	19%	0.191	C	C	.	.	H	α-helix	trans	-63.7	-43.6	175.1	0	0	0	0	0	112	A736 Q756 R763 S764	A736-A760 HydrophobicContact CB-CB 3.96Å; Q756-A760 VanDerWaalsContact O-CB 3.32Å; Q756-A760 WeakPolarHBondContact O-CB 3.37Å; Q756-A760 PolarHBondContact O-N 3.37Å; A760-R763 PolarHBondContact O-N 3.1Å; A760-S764 PolarHBondContact O-N 3.22Å; A760-S764 PolarHBondContact O-OG 3.35Å
761	L	96.4	Very high	95.1	Very high	4 Å²	4	38.8 Å²	38.8	2%	0.021	19%	0.189	C	C	.	.	H	α-helix	trans	-61.9	-48.2	177.5	-179.8	67.5	0	0	0	112.3	V735 L742 V745 T757 V758 R763 S764 A765 L768	V735-L761 HydrophobicContact CG1-CD1 4.23Å; L742-L761 HydrophobicContact CD2-CD1 4.05Å; V745-L761 HydrophobicContact CB-CD2 4.33Å; V745-L761 HydrophobicContact CG1-CD2 4Å; V745-L761 HydrophobicContact CG2-CD1 4.4Å; V745-L761 HydrophobicContact CG2-CD2 4.13Å; T757-L761 VanDerWaalsContact O-CB 3.29Å; T757-L761 WeakPolarHBondContact O-CB 3.38Å; T757-L761 PolarHBondContact O-N 2.95Å; V758-L761 PolarHBondContact O-N 3.5Å; L761-R763 PolarHBondContact O-N 2.89Å; L761-S764 PolarHBondContact O-N 3.08Å; L761-S764 PolarHBondContact O-OG 2.77Å; L761-A765 WeakPolarHBondContact O-CB 3.08Å; L761-A765 PolarHBondContact O-N 2.98Å; L761-L768 HydrophobicContact CG-CD1 4.34Å
762	A	96.8	Very high	95.8	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-66	-23.2	178.6	0	0	0	0	0	113.7	V758 L787 Y790 H791	V758-A762 VanDerWaalsContact O-CB 3.29Å; V758-A762 WeakPolarHBondContact O-CB 3.48Å; V758-A762 PolarHBondContact O-N 3.46Å; A762-L787 HydrophobicContact CB-CB 4.47Å; A762-L787 HydrophobicContact CB-CD1 4.03Å; A762-Y790 HydrophobicContact CB-CD2 4.23Å; A762-Y790 WeakPolarHBondContact O-CB 3.29Å; A762-Y790 WeakPolarHBondContact O-CD2 3.43Å; A762-Y790 VanDerWaalsContact O-CG 3.24Å; A762-H791 PolarHBondContact O-NE2 3.31Å
763	R	96.6	Very high	96.1	Very high	146 Å²	146	35.3 Å²	35.3	55%	0.551	17%	0.172	S	C	*	.	H	α-helix	trans	-83.6	-17.2	176.8	-76.2	172.5	-178	-167.2	0.4	114.2	I759 A760 L761 Y790	I759-R763 WeakPolarHBondContact O-CB 3.47Å; I759-R763 WeakPolarHBondContact O-CD 3.36Å; I759-R763 VanDerWaalsContact O-CG 3.23Å; I759-R763 WeakPolarHBondContact O-CG 3.37Å; I759-R763 PolarHBondContact O-N 3.03Å; A760-R763 PolarHBondContact O-N 3.1Å; L761-R763 PolarHBondContact O-N 2.89Å; R763-Y790 HydrophobicContact CB-CE2 4.45Å; R763-Y790 HydrophobicContact CG-CD2 4.15Å; R763-Y790 HydrophobicContact CG-CE2 3.4Å
764	S	95.5	Very high	96.2	Very high	28 Å²	28	35.4 Å²	35.4	20%	0.196	17%	0.172	C	C	.	.	H	α-helix	trans	-119.5	-32	-168	55.6	0	0	0	0	114.1	A736 R740 A760 L761	A736-S764 VanDerWaalsContact CA-OG 3.27Å; A736-S764 WeakPolarHBondContact CA-OG 3.21Å; A736-S764 VanDerWaalsContact CB-OG 3.3Å; A736-S764 WeakPolarHBondContact CB-OG 3.32Å; A736-S764 WeakPolarHBondContact O-CB 3.46Å; A736-S764 PolarHBondContact O-OG 3.14Å; R740-S764 WeakPolarHBondContact CA-O 3.07Å; A760-S764 PolarHBondContact O-N 3.22Å; A760-S764 PolarHBondContact O-OG 3.35Å; L761-S764 PolarHBondContact O-N 3.08Å; L761-S764 PolarHBondContact O-OG 2.77Å
765	A	95.5	Very high	95.9	Very high	5 Å²	5	30.4 Å²	30.4	4%	0.041	16%	0.155	C	C	.	.			trans	-72.3	135.7	166	0	0	0	0	0	109.3	L761 L768 H791	L761-A765 WeakPolarHBondContact O-CB 3.08Å; L761-A765 PolarHBondContact O-N 2.98Å; A765-L768 HydrophobicContact CB-CD1 4.11Å; A765-L768 HydrophobicContact CB-CD2 3.87Å; A765-L768 HydrophobicContact CB-CG 3.72Å; A765-H791 PolarHBondContact O-CE1 2.6Å; A765-H791 PolarHBondContact O-NE2 2.92Å
766	T	92.2	Very high	95.7	Very high	98 Å²	98	28.7 Å²	28.7	60%	0.601	15%	0.146	S	C	*	.	S	Bend	trans	-91.9	-15.6	-175.1	53.2	0	0	0	0	114	R740	R740-T766 PolarHBondContact O-N 3.25Å; R740-T766 PolarHBondContact O-OG1 2.91Å; R740-T766 VanDerWaalsContact O-OG1 3.13Å
767	H	94.7	Very high	95.4	Very high	83 Å²	83	26.4 Å²	26.4	38%	0.384	14%	0.135	S	C	.	.			trans	-158.2	65.4	-169.8	-164.4	84.3	0	0	0	111.8	Q743 I769 T794	Q743-H767 WeakPolarHBondContact CA-O 3.38Å; H767-I769 PolarHBondContact O-N 3.5Å; H767-T794 WeakPolarHBondContact ND1-CG2 3.2Å
768	L	97.5	Very high	95.2	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	15%	0.146	C	C	.	.			trans	-73	121.5	174.9	-69.9	174.4	0	0	0	110.7	L742 V745 L761 A765 V771 L787 H791 T794 L795	L742-L768 WeakPolarHBondContact O-CD2 3.4Å; V745-L768 HydrophobicContact CG2-CD2 3.93Å; L761-L768 HydrophobicContact CG-CD1 4.34Å; A765-L768 HydrophobicContact CB-CD1 4.11Å; A765-L768 HydrophobicContact CB-CD2 3.87Å; A765-L768 HydrophobicContact CB-CG 3.72Å; L768-V771 HydrophobicContact CB-CG2 4.31Å; L768-V771 HydrophobicContact CD1-CG2 4.11Å; L768-L787 HydrophobicContact CD1-CD1 3.76Å; L768-H791 HydrophobicContact CB-CB 4.48Å; L768-H791 PolarHBondContact N-ND1 2.8Å; L768-T794 CarbonylContact O-C 3.59Å; L768-T794 VanDerWaalsContact O-C 3.32Å; L768-T794 WeakPolarHBondContact O-CB 3.31Å; L768-T794 PolarHBondContact O-OG1 2.93Å; L768-L795 PolarHBondContact O-N 2.97Å
769	I	98	Very high	95.1	Very high	25 Å²	25	28.7 Å²	28.7	13%	0.128	15%	0.146	C	C	.	.			trans	-100.9	-38.5	178.6	-57.3	177.6	0	0	0	110.7	Q743 H767 T794 E796 R797	Q743-I769 HydrophobicContact CB-CD1 4.15Å; Q743-I769 HydrophobicContact CB-CG1 4.29Å; Q743-I769 HydrophobicContact CG-CD1 4.31Å; Q743-I769 PolarHBondContact O-N 3.3Å; H767-I769 PolarHBondContact O-N 3.5Å; I769-T794 WeakPolarHBondContact CA-O 3.47Å; I769-E796 HydrophobicContact CG2-CB 3.98Å; I769-E796 HydrophobicContact CG2-CG 3.94Å; I769-E796 WeakPolarHBondContact CG2-OE2 3.22Å; I769-E796 PolarHBondContact O-N 2.83Å; I769-R797 PolarHBondContact O-N 2.88Å
770	S	98.2	Very high	95	Very high	10 Å²	10	29 Å²	29	7%	0.07	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	128.2	-179.9	-172.6	0	0	0	0	113	Q743 H744 V745 R797	Q743-S770 PolarHBondContact O-N 3.48Å; H744-S770 CarbonylContact C-O 3.6Å; H744-S770 WeakPolarHBondContact CA-O 3.3Å; H744-S770 WeakPolarHBondContact ND1-CB 3.28Å; V745-S770 PolarHBondContact N-O 2.99Å; S770-R797 CarbonylContact C-O 3.32Å; S770-R797 VanDerWaalsContact CA-O 3.28Å; S770-R797 WeakPolarHBondContact CA-O 3.35Å; S770-R797 WeakPolarHBondContact OG-CB 3.07Å; S770-R797 WeakPolarHBondContact OG-CG 3.48Å
771	V	97.9	Very high	95	Very high	1 Å²	1	28.8 Å²	28.8	1%	0.006	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	118.6	178.2	174.5	0	0	0	0	109.3	V745 L768 L773 L787 L795 R797 L798 E799	V745-V771 WeakPolarHBondContact O-CA 3.23Å; L768-V771 HydrophobicContact CB-CG2 4.31Å; L768-V771 HydrophobicContact CD1-CG2 4.11Å; V771-L773 HydrophobicContact CG1-CD1 3.87Å; V771-L773 HydrophobicContact CG1-CD2 4.16Å; V771-L773 HydrophobicContact CG1-CG 3.75Å; V771-L787 HydrophobicContact CB-CD2 4.18Å; V771-L787 HydrophobicContact CG1-CD2 4.02Å; V771-L787 HydrophobicContact CG2-CD1 4.08Å; V771-L787 HydrophobicContact CG2-CD2 4.23Å; V771-L795 HydrophobicContact CB-CD1 4.26Å; V771-L795 HydrophobicContact CG2-CD1 4Å; V771-R797 PolarHBondContact N-O 3.16Å; V771-L798 HydrophobicContact CB-CD1 4.19Å; V771-L798 HydrophobicContact CG1-CD1 4.25Å; V771-L798 WeakPolarHBondContact O-CA 3.34Å; V771-E799 PolarHBondContact O-N 3.26Å
772	K	97.6	Very high	95	Very high	29 Å²	29	30.8 Å²	30.8	13%	0.126	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	115	177.8	-55.2	-178.2	173	-125.9	0	110	V745 N746 A747 E799	V745-K772 PolarHBondContact O-N 3.37Å; N746-K772 WeakPolarHBondContact CA-O 3.33Å; N746-K772 HydrophobicContact CB-CB 4.07Å; N746-K772 HydrophobicContact CB-CD 4.22Å; A747-K772 PolarHBondContact N-O 2.98Å; K772-E799 HydrophobicContact CB-CB 4.22Å; K772-E799 VanDerWaalsContact CD-OE2 3.28Å; K772-E799 WeakPolarHBondContact CD-OE2 3.36Å; K772-E799 WeakPolarHBondContact CE-OE1 3.25Å; K772-E799 HydrophobicContact CG-CB 4.13Å; K772-E799 HydrophobicContact CG-CG 4.05Å; K772-E799 WeakPolarHBondContact CG-OE2 3.46Å; K772-E799 IonicContact NZ-OE1 2.75Å; K772-E799 PolarHBondContact NZ-OE1 2.76Å; K772-E799 IonicContact NZ-OE2 2.72Å; K772-E799 PolarHBondContact NZ-OE2 3.13Å
773	L	96.3	Very high	95	Very high	1 Å²	1	30.8 Å²	30.8	1%	0.005	16%	0.163	C	C	.	.			trans	-124.4	25.5	-176.3	-54.8	173.3	0	0	0	111.4	A747 V753 V758 V771 G775 A776 I784 E799 L800 C803	A747-L773 HydrophobicContact CB-CD2 4.21Å; V753-L773 HydrophobicContact CG1-CD2 4.26Å; V758-L773 HydrophobicContact CG1-CD1 4.32Å; V758-L773 HydrophobicContact CG2-CD1 3.88Å; V758-L773 HydrophobicContact CG2-CD2 4.2Å; V771-L773 HydrophobicContact CG1-CD1 3.87Å; V771-L773 HydrophobicContact CG1-CD2 4.16Å; V771-L773 HydrophobicContact CG1-CG 3.75Å; L773-G775 PolarHBondContact O-N 2.8Å; L773-A776 HydrophobicContact CB-CB 4.09Å; L773-A776 WeakPolarHBondContact O-CB 3.16Å; L773-A776 PolarHBondContact O-N 2.96Å; L773-I784 HydrophobicContact CD1-CD1 4.3Å; L773-E799 PolarHBondContact N-O 2.9Å; L773-L800 HydrophobicContact CB-CD2 4.19Å; L773-L800 HydrophobicContact CD1-CD2 4.19Å; L773-C803 PolarHBondContact O-SG 2.77Å; L773-C803 VanDerWaalsContact O-SG 3.35Å
774	N	94.2	Very high	95.1	Very high	4 Å²	4	23.9 Å²	23.9	2%	0.021	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.6	127	-175.9	-57.8	-45.8	0	0	0	111.2	S748 Y749 A776 E799 L800 F801	S748-N774 CarbonylContact C-O 3.57Å; S748-N774 WeakPolarHBondContact CA-O 3.48Å; S748-N774 PolarHBondContact OG-ND2 3.38Å; Y749-N774 HydrophobicContact CE2-CB 4.5Å; Y749-N774 PolarHBondContact N-O 3.13Å; N774-A776 VanDerWaalsContact C-N 3.31Å; N774-A776 PolarHBondContact O-N 2.9Å; N774-E799 PolarHBondContact ND2-OE2 2.76Å; N774-E799 WeakPolarHBondContact OD1-CB 3.36Å; N774-E799 PolarHBondContact OD1-O 3.21Å; N774-L800 PolarHBondContact OD1-N 3.37Å; N774-F801 CarbonylContact C-O 3.6Å; N774-F801 WeakPolarHBondContact CA-O 3.44Å; N774-F801 HydrophobicContact CB-CB 3.94Å; N774-F801 WeakPolarHBondContact OD1-CB 3.36Å; N774-F801 PolarHBondContact OD1-N 2.92Å; N774-F801 VanDerWaalsContact OD1-N 3.1Å
775	G	89.3	Confident	95.1	Very high	6 Å²	6	27.6 Å²	27.6	6%	0.062	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	77.2	5.2	-176.3	0	0	0	0	0	115.3	W82 L773 Q777 F801	W82-G775 VanDerWaalsContact CH2-O 3.26Å; W82-G775 WeakPolarHBondContact CH2-O 3.33Å; L773-G775 PolarHBondContact O-N 2.8Å; G775-Q777 VanDerWaalsContact C-N 3.29Å; G775-Q777 PolarHBondContact O-N 3.1Å; G775-F801 PolarHBondContact N-O 3.18Å
776	A	91.6	Very high	95.2	Very high	1 Å²	1	29.2 Å²	29.2	1%	0.008	16%	0.158	C	C	.	.			trans	-74.4	79.7	175.5	0	0	0	0	0	111.2	V753 L773 N774 Q778 I779 C803	V753-A776 HydrophobicContact CB-CB 4.07Å; V753-A776 HydrophobicContact CG1-CB 3.66Å; L773-A776 HydrophobicContact CB-CB 4.09Å; L773-A776 WeakPolarHBondContact O-CB 3.16Å; L773-A776 PolarHBondContact O-N 2.96Å; N774-A776 VanDerWaalsContact C-N 3.31Å; N774-A776 PolarHBondContact O-N 2.9Å; A776-Q778 PolarHBondContact O-N 3.41Å; A776-I779 HydrophobicContact CB-CB 4.49Å; A776-I779 HydrophobicContact CB-CG1 3.72Å; A776-I779 PolarHBondContact O-N 2.87Å; A776-I779 VanDerWaalsContact O-N 3.13Å; A776-C803 PolarHBondContact O-SG 2.84Å
777	Q	87.7	Confident	95.5	Very high	69 Å²	69	24.7 Å²	24.7	32%	0.322	13%	0.13	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-12.4	-174.6	-67.7	177.7	-20.4	0	0	115.2	N81 G775 F804 R805	N81-Q777 PolarHBondContact ND2-NE2 3.41Å; G775-Q777 VanDerWaalsContact C-N 3.29Å; G775-Q777 PolarHBondContact O-N 3.1Å; Q777-F804 HydrophobicContact CG-CD2 4.46Å; Q777-R805 WeakPolarHBondContact O-CD 3.26Å
778	Q	92.2	Very high	95.6	Very high	50 Å²	50	20.8 Å²	20.8	23%	0.234	11%	0.112	C	C	.	.	B	Isolated β-bridge	trans	-100.5	10.5	179	-52.4	-69.9	-59.4	0	0	113.5	V753 R754 A776 R805	V753-Q778 WeakPolarHBondContact O-CB 3.35Å; R754-Q778 HydrophobicContact CB-CB 3.97Å; A776-Q778 PolarHBondContact O-N 3.41Å; Q778-R805 VanDerWaalsContact OE1-NH2 3.12Å
779	I	95	Very high	95.6	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	14%	0.137	C	C	.	.			trans	-93	127.2	177.1	-65.6	-63.1	0	0	0	111.5	V753 D755 V758 A776 A783 I784 R805	V753-I779 HydrophobicContact CG1-CD1 3.79Å; V753-I779 HydrophobicContact CG1-CG1 3.84Å; D755-I779 VanDerWaalsContact OD1-CA 3.29Å; D755-I779 WeakPolarHBondContact OD1-CA 3.25Å; V758-I779 HydrophobicContact CB-CD1 4.21Å; V758-I779 HydrophobicContact CG2-CD1 3.57Å; A776-I779 HydrophobicContact CB-CB 4.49Å; A776-I779 HydrophobicContact CB-CG1 3.72Å; A776-I779 PolarHBondContact O-N 2.87Å; A776-I779 VanDerWaalsContact O-N 3.13Å; I779-A783 HydrophobicContact CD1-CB 4.36Å; I779-A783 HydrophobicContact CG2-CB 4.49Å; I779-I784 HydrophobicContact CG2-CD1 3.98Å; I779-I784 HydrophobicContact CG2-CG1 4.18Å; I779-R805 VanDerWaalsContact O-CB 3.32Å; I779-R805 WeakPolarHBondContact O-CB 3.23Å
780	S	95.5	Very high	95.5	Very high	29 Å²	29	30 Å²	30	20%	0.203	15%	0.15	C	C	.	.	B	Isolated β-bridge	trans	-112.6	175.2	174.9	81.8	0	0	0	0	112.1	D755 A782 A783	D755-S780 PolarHBondContact OD1-N 3.49Å; D755-S780 WeakPolarHBondContact OD2-CB 3.27Å; D755-S780 PolarHBondContact OD2-OG 3.35Å; S780-A782 PolarHBondContact O-N 3.18Å; S780-A782 VanDerWaalsContact O-N 3.14Å; S780-A782 PolarHBondContact OG-N 2.98Å; S780-A783 PolarHBondContact O-N 2.94Å
781	N	96	Very high	95.5	Very high	16 Å²	16	29.6 Å²	29.6	9%	0.086	15%	0.148	C	C	.	.	H	α-helix	trans	-57.4	-26.9	176.2	-69.5	17.6	0	0	0	112.8	A783 I784 Q785 L806 N807 S809 I810	N781-A783 PolarHBondContact O-N 2.89Å; N781-I784 PolarHBondContact O-N 3.47Å; N781-Q785 WeakPolarHBondContact O-CB 3.44Å; N781-Q785 PolarHBondContact O-N 2.92Å; N781-L806 VanDerWaalsContact OD1-CA 3.23Å; N781-L806 WeakPolarHBondContact OD1-CA 3.36Å; N781-L806 VanDerWaalsContact OD1-CD2 3.27Å; N781-L806 WeakPolarHBondContact OD1-CD2 3.25Å; N781-N807 PolarHBondContact ND2-O 3.27Å; N781-N807 PolarHBondContact ND2-OD1 2.72Å; N781-N807 PolarHBondContact OD1-N 3.19Å; N781-N807 VanDerWaalsContact OD1-N 3.08Å; N781-S809 PolarHBondContact ND2-OG 2.89Å; N781-I810 HydrophobicContact CB-CD1 4.26Å; N781-I810 PolarHBondContact ND2-N 3.08Å
782	A	96.6	Very high	95.4	Very high	46 Å²	46	32.7 Å²	32.7	38%	0.38	16%	0.162	S	C	.	.	H	α-helix	trans	-64.9	-38	-178.1	0	0	0	0	0	113.1	S780 Q786	S780-A782 PolarHBondContact O-N 3.18Å; S780-A782 VanDerWaalsContact O-N 3.14Å; S780-A782 PolarHBondContact OG-N 2.98Å; A782-Q786 PolarHBondContact O-N 2.97Å
783	A	97.1	Very high	95.3	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-71.4	-38.7	176.5	0	0	0	0	0	112.5	D755 V758 I759 I779 S780 N781 Q786 L787	D755-A783 HydrophobicContact CB-CB 3.87Å; D755-A783 WeakPolarHBondContact OD1-CB 3.44Å; V758-A783 HydrophobicContact CB-CB 4.12Å; V758-A783 HydrophobicContact CG1-CB 4.14Å; I759-A783 HydrophobicContact CG1-CB 4.19Å; I779-A783 HydrophobicContact CD1-CB 4.36Å; I779-A783 HydrophobicContact CG2-CB 4.49Å; S780-A783 PolarHBondContact O-N 2.94Å; N781-A783 PolarHBondContact O-N 2.89Å; A783-Q786 PolarHBondContact O-N 3.04Å; A783-L787 PolarHBondContact O-N 3.39Å
784	I	97.3	Very high	95.3	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-71.7	-34.6	177.2	-50.9	-56.3	0	0	0	110.8	L773 I779 N781 Q786 L787 V788 L798 L800 L806 I810 L814	L773-I784 HydrophobicContact CD1-CD1 4.3Å; I779-I784 HydrophobicContact CG2-CD1 3.98Å; I779-I784 HydrophobicContact CG2-CG1 4.18Å; N781-I784 PolarHBondContact O-N 3.47Å; I784-Q786 VanDerWaalsContact C-N 3.29Å; I784-Q786 PolarHBondContact O-N 2.96Å; I784-L787 WeakPolarHBondContact O-CB 3.48Å; I784-L787 PolarHBondContact O-N 2.66Å; I784-L787 VanDerWaalsContact O-N 3.11Å; I784-V788 HydrophobicContact CG2-CG2 4.3Å; I784-V788 VanDerWaalsContact O-CG2 3.3Å; I784-V788 WeakPolarHBondContact O-CG2 3.36Å; I784-V788 PolarHBondContact O-N 2.76Å; I784-L798 HydrophobicContact CG2-CD2 4.42Å; I784-L800 HydrophobicContact CD1-CD1 4.25Å; I784-L800 HydrophobicContact CD1-CD2 3.8Å; I784-L800 HydrophobicContact CG1-CD1 4.33Å; I784-L806 HydrophobicContact CG1-CD2 4.14Å; I784-I810 HydrophobicContact CB-CD1 3.54Å; I784-I810 HydrophobicContact CG1-CD1 3.99Å; I784-I810 HydrophobicContact CG2-CD1 3.56Å; I784-L814 HydrophobicContact CG2-CD2 4Å
785	Q	97.4	Very high	95.5	Very high	106 Å²	106	38.2 Å²	38.2	50%	0.495	19%	0.194	S	C	.	.	H	α-helix	trans	-57.8	-41.4	171.1	-174.2	-177.9	-1.8	0	0	111.7	N781 H789 L813	N781-Q785 WeakPolarHBondContact O-CB 3.44Å; N781-Q785 PolarHBondContact O-N 2.92Å; Q785-H789 WeakPolarHBondContact O-CB 3.32Å; Q785-H789 PolarHBondContact O-N 3.24Å; Q785-L813 HydrophobicContact CB-CD1 3.88Å; Q785-L813 HydrophobicContact CG-CD1 4.24Å; Q785-L813 HydrophobicContact CG-CD2 4.15Å
786	Q	97.5	Very high	95.9	Very high	40 Å²	40	39.9 Å²	39.9	19%	0.187	20%	0.2	C	C	.	.	H	α-helix	trans	-69.1	-39.4	173.1	-69.3	-72.5	-84.2	0	0	112	I759 A782 A783 I784 V788 H789 Y790	I759-Q786 HydrophobicContact CD1-CG 4.35Å; I759-Q786 HydrophobicContact CG1-CB 3.99Å; I759-Q786 HydrophobicContact CG1-CG 3.95Å; I759-Q786 HydrophobicContact CG2-CB 4.42Å; I759-Q786 HydrophobicContact CG2-CG 4.16Å; A782-Q786 PolarHBondContact O-N 2.97Å; A783-Q786 PolarHBondContact O-N 3.04Å; I784-Q786 VanDerWaalsContact C-N 3.29Å; I784-Q786 PolarHBondContact O-N 2.96Å; Q786-V788 PolarHBondContact O-N 3.46Å; Q786-H789 PolarHBondContact O-N 3.16Å; Q786-Y790 WeakPolarHBondContact O-CD2 3.15Å; Q786-Y790 PolarHBondContact O-N 2.68Å
787	L	97.3	Very high	96.2	Very high	2 Å²	2	41 Å²	41	1%	0.01	20%	0.204	C	C	.	.	H	α-helix	trans	-59.6	-46.2	174.6	-175.2	69.4	0	0	0	112.1	A762 L768 V771 A783 I784 H791 L795 L798	A762-L787 HydrophobicContact CB-CB 4.47Å; A762-L787 HydrophobicContact CB-CD1 4.03Å; L768-L787 HydrophobicContact CD1-CD1 3.76Å; V771-L787 HydrophobicContact CB-CD2 4.18Å; V771-L787 HydrophobicContact CG1-CD2 4.02Å; V771-L787 HydrophobicContact CG2-CD1 4.08Å; V771-L787 HydrophobicContact CG2-CD2 4.23Å; A783-L787 PolarHBondContact O-N 3.39Å; I784-L787 WeakPolarHBondContact O-CB 3.48Å; I784-L787 PolarHBondContact O-N 2.66Å; I784-L787 VanDerWaalsContact O-N 3.11Å; L787-H791 WeakPolarHBondContact O-CB 3.19Å; L787-H791 PolarHBondContact O-N 3.29Å; L787-L795 HydrophobicContact CD2-CD2 4.15Å; L787-L795 HydrophobicContact CG-CD2 4.44Å; L787-L798 HydrophobicContact CD2-CD1 3.98Å
788	V	97.1	Very high	96.7	Very high	1 Å²	1	37.8 Å²	37.8	1%	0.006	19%	0.189	C	C	.	.	H	α-helix	trans	-61	-47.2	175.1	172.8	0	0	0	0	110.6	I784 Q786 Y790 H791 Q792 L814 Q816	I784-V788 HydrophobicContact CG2-CG2 4.3Å; I784-V788 VanDerWaalsContact O-CG2 3.3Å; I784-V788 WeakPolarHBondContact O-CG2 3.36Å; I784-V788 PolarHBondContact O-N 2.76Å; Q786-V788 PolarHBondContact O-N 3.46Å; V788-Y790 VanDerWaalsContact C-N 3.27Å; V788-Y790 PolarHBondContact O-N 2.7Å; V788-H791 PolarHBondContact O-N 3.31Å; V788-Q792 HydrophobicContact CG1-CB 4.25Å; V788-Q792 VanDerWaalsContact O-CB 3.29Å; V788-Q792 WeakPolarHBondContact O-CB 3.46Å; V788-Q792 PolarHBondContact O-N 3.43Å; V788-L814 HydrophobicContact CG2-CD2 3.79Å; V788-Q816 HydrophobicContact CG1-CB 3.96Å
789	H	96.7	Very high	96.9	Very high	115 Å²	115	35.7 Å²	35.7	53%	0.532	18%	0.179	S	C	.	.	H	α-helix	trans	-55.1	-38.4	-178.3	178.3	64.5	0	0	0	113.7	Q785 Q786	Q785-H789 WeakPolarHBondContact O-CB 3.32Å; Q785-H789 PolarHBondContact O-N 3.24Å; Q786-H789 PolarHBondContact O-N 3.16Å
790	Y	97	Very high	96.9	Very high	103 Å²	103	35.7 Å²	35.7	40%	0.404	18%	0.179	S	C	.	.	H	α-helix	trans	-91.6	-24.9	177.6	-65.1	-72.4	0	0	0	114.2	A762 R763 Q786 V788	A762-Y790 HydrophobicContact CB-CD2 4.23Å; A762-Y790 WeakPolarHBondContact O-CB 3.29Å; A762-Y790 WeakPolarHBondContact O-CD2 3.43Å; A762-Y790 VanDerWaalsContact O-CG 3.24Å; R763-Y790 HydrophobicContact CB-CE2 4.45Å; R763-Y790 HydrophobicContact CG-CD2 4.15Å; R763-Y790 HydrophobicContact CG-CE2 3.4Å; Q786-Y790 WeakPolarHBondContact O-CD2 3.15Å; Q786-Y790 PolarHBondContact O-N 2.68Å; V788-Y790 VanDerWaalsContact C-N 3.27Å; V788-Y790 PolarHBondContact O-N 2.7Å
791	H	97.1	Very high	96.7	Very high	3 Å²	3	35.8 Å²	35.8	1%	0.014	18%	0.176	C	C	.	.	H	α-helix	trans	-128.6	13.2	-168	-61.1	-62.4	0	0	0	116.6	A762 A765 L768 L787 V788 N793 T794 L795	A762-H791 PolarHBondContact O-NE2 3.31Å; A765-H791 PolarHBondContact O-CE1 2.6Å; A765-H791 PolarHBondContact O-NE2 2.92Å; L768-H791 HydrophobicContact CB-CB 4.48Å; L768-H791 PolarHBondContact N-ND1 2.8Å; L787-H791 WeakPolarHBondContact O-CB 3.19Å; L787-H791 PolarHBondContact O-N 3.29Å; V788-H791 PolarHBondContact O-N 3.31Å; H791-N793 PolarHBondContact O-N 2.87Å; H791-T794 WeakPolarHBondContact CB-OG1 3.43Å; H791-T794 PolarHBondContact ND1-OG1 3.17Å; H791-T794 PolarHBondContact O-N 2.76Å; H791-T794 PolarHBondContact O-OG1 2.76Å; H791-L795 HydrophobicContact CB-CB 4.37Å; H791-L795 WeakPolarHBondContact O-CB 3.41Å; H791-L795 PolarHBondContact O-N 2.85Å
792	Q	96	Very high	96.3	Very high	66 Å²	66	35.2 Å²	35.2	31%	0.308	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-49.9	-32.7	174.9	54.4	177.8	2.7	0	0	114.3	V788 C817	V788-Q792 HydrophobicContact CG1-CB 4.25Å; V788-Q792 VanDerWaalsContact O-CB 3.29Å; V788-Q792 WeakPolarHBondContact O-CB 3.46Å; V788-Q792 PolarHBondContact O-N 3.43Å; Q792-C817 WeakPolarHBondContact O-CA 3.07Å
793	N	95.7	Very high	96.1	Very high	126 Å²	126	33 Å²	33	67%	0.674	16%	0.156	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.3	4	-179	-60.6	-17.8	0	0	0	113.9	H791	H791-N793 PolarHBondContact O-N 2.87Å
794	T	96.9	Very high	95.8	Very high	23 Å²	23	36.9 Å²	36.9	14%	0.141	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-134.5	-22.4	-173.2	69.3	0	0	0	0	114.2	H767 L768 I769 H791 E796	H767-T794 WeakPolarHBondContact ND1-CG2 3.2Å; L768-T794 CarbonylContact O-C 3.59Å; L768-T794 VanDerWaalsContact O-C 3.32Å; L768-T794 WeakPolarHBondContact O-CB 3.31Å; L768-T794 PolarHBondContact O-OG1 2.93Å; I769-T794 WeakPolarHBondContact CA-O 3.47Å; H791-T794 WeakPolarHBondContact CB-OG1 3.43Å; H791-T794 PolarHBondContact ND1-OG1 3.17Å; H791-T794 PolarHBondContact O-N 2.76Å; H791-T794 PolarHBondContact O-OG1 2.76Å; T794-E796 PolarHBondContact O-N 3.29Å
795	L	97.5	Very high	95.6	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	20%	0.197	C	C	.	.			trans	-79.4	100.5	-172	-172.1	69.6	0	0	0	112	L768 V771 L787 H791 L798 L820	L768-L795 PolarHBondContact O-N 2.97Å; V771-L795 HydrophobicContact CB-CD1 4.26Å; V771-L795 HydrophobicContact CG2-CD1 4Å; L787-L795 HydrophobicContact CD2-CD2 4.15Å; L787-L795 HydrophobicContact CG-CD2 4.44Å; H791-L795 HydrophobicContact CB-CB 4.37Å; H791-L795 WeakPolarHBondContact O-CB 3.41Å; H791-L795 PolarHBondContact O-N 2.85Å; L795-L798 HydrophobicContact CD2-CB 4.21Å; L795-L798 HydrophobicContact CD2-CD1 4.49Å; L795-L798 HydrophobicContact CD2-CD2 4.25Å; L795-L820 HydrophobicContact CD2-CD2 4.41Å; L795-L820 HydrophobicContact CG-CD2 4.2Å; L795-L820 VanDerWaalsContact O-CD2 3.32Å; L795-L820 WeakPolarHBondContact O-CD2 3.25Å; L795-L820 WeakPolarHBondContact O-CG 3.45Å
796	E	98	Very high	95.4	Very high	42 Å²	42	38.5 Å²	38.5	20%	0.196	18%	0.175	C	C	.	.			trans	-85.3	-26.8	176.3	-64.1	-168.6	134	0	0	113.9	W465 I769 T794 E819 R821 A822	W465-E796 WeakPolarHBondContact CH2-OE2 3.22Å; I769-E796 HydrophobicContact CG2-CB 3.98Å; I769-E796 HydrophobicContact CG2-CG 3.94Å; I769-E796 WeakPolarHBondContact CG2-OE2 3.22Å; I769-E796 PolarHBondContact O-N 2.83Å; T794-E796 PolarHBondContact O-N 3.29Å; E796-E819 WeakPolarHBondContact CA-O 3.42Å; E796-R821 HydrophobicContact CB-CG 4.3Å; E796-R821 WeakPolarHBondContact O-CA 3.05Å; E796-R821 PolarHBondContact O-N 3.21Å; E796-R821 IonicContact OE1-CZ 2.93Å; E796-R821 VanDerWaalsContact OE1-CZ 3.3Å; E796-R821 IonicContact OE1-NE 3.3Å; E796-R821 PolarHBondContact OE1-NE 3.21Å; E796-R821 IonicContact OE1-NH2 3.61Å; E796-R821 PolarHBondContact OE1-NH2 3.2Å; E796-A822 PolarHBondContact O-N 3.23Å
797	R	98.3	Very high	95.1	Very high	25 Å²	25	40.5 Å²	40.5	9%	0.094	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	122.2	-175.9	174	174.2	-81.8	172.7	-16.1	113.4	Q466 I769 S770 V771 E799 A822	Q466-R797 PolarHBondContact O-NH1 3.32Å; Q466-R797 PolarHBondContact O-NH2 3.1Å; I769-R797 PolarHBondContact O-N 2.88Å; S770-R797 CarbonylContact C-O 3.32Å; S770-R797 VanDerWaalsContact CA-O 3.28Å; S770-R797 WeakPolarHBondContact CA-O 3.35Å; S770-R797 WeakPolarHBondContact OG-CB 3.07Å; S770-R797 WeakPolarHBondContact OG-CG 3.48Å; V771-R797 PolarHBondContact N-O 3.16Å; R797-E799 HydrophobicContact CG-CG 4.36Å; R797-A822 WeakPolarHBondContact CA-O 3.26Å; R797-A822 HydrophobicContact CB-CB 3.97Å; R797-A822 HydrophobicContact CG-CB 3.79Å; R797-A822 VanDerWaalsContact NE-CB 3.33Å
798	L	97.9	Very high	94.9	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	122.5	177.6	-177.6	60.3	0	0	0	111.4	V771 I784 L787 L795 L800 L814 L820 A822 L823 A824	V771-L798 HydrophobicContact CB-CD1 4.19Å; V771-L798 HydrophobicContact CG1-CD1 4.25Å; V771-L798 WeakPolarHBondContact O-CA 3.34Å; I784-L798 HydrophobicContact CG2-CD2 4.42Å; L787-L798 HydrophobicContact CD2-CD1 3.98Å; L795-L798 HydrophobicContact CD2-CB 4.21Å; L795-L798 HydrophobicContact CD2-CD1 4.49Å; L795-L798 HydrophobicContact CD2-CD2 4.25Å; L798-L800 HydrophobicContact CD1-CD1 4.2Å; L798-L800 HydrophobicContact CD1-CD2 4.22Å; L798-L800 HydrophobicContact CD1-CG 4.05Å; L798-L800 HydrophobicContact CD2-CD1 3.79Å; L798-L800 HydrophobicContact CD2-CG 4.44Å; L798-L800 HydrophobicContact CG-CD1 3.88Å; L798-L800 HydrophobicContact CG-CG 3.98Å; L798-L814 HydrophobicContact CD2-CD1 3.94Å; L798-L814 HydrophobicContact CD2-CD2 3.34Å; L798-L814 HydrophobicContact CD2-CG 4.31Å; L798-L820 HydrophobicContact CB-CD2 4.03Å; L798-A822 PolarHBondContact N-O 2.98Å; L798-L823 HydrophobicContact CB-CD1 4.17Å; L798-L823 HydrophobicContact CD2-CD1 4.44Å; L798-L823 HydrophobicContact CG-CD1 4.47Å; L798-L823 WeakPolarHBondContact O-CA 3.49Å; L798-A824 PolarHBondContact O-N 3.06Å; L798-A824 VanDerWaalsContact O-N 3.08Å
799	E	97.4	Very high	94.7	Very high	6 Å²	6	45 Å²	45	3%	0.028	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	119.1	178.2	-56.5	179	-168.8	0	0	111.1	V771 K772 L773 N774 R797 A824	V771-E799 PolarHBondContact O-N 3.26Å; K772-E799 HydrophobicContact CB-CB 4.22Å; K772-E799 VanDerWaalsContact CD-OE2 3.28Å; K772-E799 WeakPolarHBondContact CD-OE2 3.36Å; K772-E799 WeakPolarHBondContact CE-OE1 3.25Å; K772-E799 HydrophobicContact CG-CB 4.13Å; K772-E799 HydrophobicContact CG-CG 4.05Å; K772-E799 WeakPolarHBondContact CG-OE2 3.46Å; K772-E799 IonicContact NZ-OE1 2.75Å; K772-E799 PolarHBondContact NZ-OE1 2.76Å; K772-E799 IonicContact NZ-OE2 2.72Å; K772-E799 PolarHBondContact NZ-OE2 3.13Å; L773-E799 PolarHBondContact N-O 2.9Å; N774-E799 PolarHBondContact ND2-OE2 2.76Å; N774-E799 WeakPolarHBondContact OD1-CB 3.36Å; N774-E799 PolarHBondContact OD1-O 3.21Å; R797-E799 HydrophobicContact CG-CG 4.36Å; E799-A824 HydrophobicContact CB-CB 4.01Å; E799-A824 HydrophobicContact CG-CB 3.95Å
800	L	95.3	Very high	94.6	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	19%	0.193	C	C	.	.			trans	-130.2	25	-171.5	-65.4	172.7	0	0	0	112.4	L773 N774 I784 L798 G802 C803 L806 A824 F825	L773-L800 HydrophobicContact CB-CD2 4.19Å; L773-L800 HydrophobicContact CD1-CD2 4.19Å; N774-L800 PolarHBondContact OD1-N 3.37Å; I784-L800 HydrophobicContact CD1-CD1 4.25Å; I784-L800 HydrophobicContact CD1-CD2 3.8Å; I784-L800 HydrophobicContact CG1-CD1 4.33Å; L798-L800 HydrophobicContact CD1-CD1 4.2Å; L798-L800 HydrophobicContact CD1-CD2 4.22Å; L798-L800 HydrophobicContact CD1-CG 4.05Å; L798-L800 HydrophobicContact CD2-CD1 3.79Å; L798-L800 HydrophobicContact CD2-CG 4.44Å; L798-L800 HydrophobicContact CG-CD1 3.88Å; L798-L800 HydrophobicContact CG-CG 3.98Å; L800-G802 PolarHBondContact O-N 2.87Å; L800-C803 WeakPolarHBondContact O-CB 3.48Å; L800-C803 PolarHBondContact O-N 2.82Å; L800-L806 HydrophobicContact CB-CD1 3.96Å; L800-L806 HydrophobicContact CD1-CD1 3.93Å; L800-L806 HydrophobicContact CG-CD1 4.37Å; L800-A824 PolarHBondContact N-O 3.34Å; L800-F825 HydrophobicContact CB-CD1 4.33Å; L800-F825 HydrophobicContact CD1-CE1 4.14Å
801	F	90.6	Very high	94.5	Very high	31 Å²	31	34.8 Å²	34.8	14%	0.136	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-48.8	127.6	175.9	174.5	-76.2	0	0	0	110.7	N774 G775 C803 G826 H827	N774-F801 CarbonylContact C-O 3.6Å; N774-F801 WeakPolarHBondContact CA-O 3.44Å; N774-F801 HydrophobicContact CB-CB 3.94Å; N774-F801 WeakPolarHBondContact OD1-CB 3.36Å; N774-F801 PolarHBondContact OD1-N 2.92Å; N774-F801 VanDerWaalsContact OD1-N 3.1Å; G775-F801 PolarHBondContact N-O 3.18Å; F801-C803 PolarHBondContact O-N 2.75Å; F801-G826 WeakPolarHBondContact CA-O 3.02Å; F801-H827 AromaticContact CE2-CD2 3.38Å; F801-H827 WeakPolarHBondContact CE2-CD2 3.34Å; F801-H827 AromaticContact CE2-NE2 3.74Å; F801-H827 AromaticContact CZ-CD2 3.32Å; F801-H827 WeakPolarHBondContact CZ-CD2 3.36Å; F801-H827 AromaticContact CZ-NE2 3.59Å
802	G	88.2	Confident	94.4	Very high	4 Å²	4	37.2 Å²	37.2	4%	0.041	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	65.3	14.9	175.6	0	0	0	0	0	116.4	L800 F804 G826	L800-G802 PolarHBondContact O-N 2.87Å; G802-F804 WeakPolarHBondContact O-CD2 3.04Å; G802-F804 WeakPolarHBondContact O-CE2 3.42Å; G802-F804 WeakPolarHBondContact O-CG 3.4Å; G802-F804 PolarHBondContact O-N 3.03Å; G802-G826 PolarHBondContact N-O 3.04Å
803	C	92.6	Very high	94.3	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	19%	0.189	C	C	.	.			trans	-75.5	68.8	169.4	-72.8	0	0	0	0	111.2	L773 A776 L800 F801 R805 L806 L828	L773-C803 PolarHBondContact O-SG 2.77Å; L773-C803 VanDerWaalsContact O-SG 3.35Å; A776-C803 PolarHBondContact O-SG 2.84Å; L800-C803 WeakPolarHBondContact O-CB 3.48Å; L800-C803 PolarHBondContact O-N 2.82Å; F801-C803 PolarHBondContact O-N 2.75Å; C803-R805 PolarHBondContact O-N 3.13Å; C803-L806 HydrophobicContact CB-CD1 3.63Å; C803-L806 HydrophobicContact CB-CG 3.96Å; C803-L806 WeakPolarHBondContact O-CG 3.45Å; C803-L806 PolarHBondContact O-N 2.99Å; C803-L828 WeakPolarHBondContact O-CD2 3.43Å
804	F	89.7	Confident	94.4	Very high	81 Å²	81	29.7 Å²	29.7	36%	0.355	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-2.8	-168.6	-53.3	-61.8	0	0	0	116.9	Q777 G802 H827 L828	Q777-F804 HydrophobicContact CG-CD2 4.46Å; G802-F804 WeakPolarHBondContact O-CD2 3.04Å; G802-F804 WeakPolarHBondContact O-CE2 3.42Å; G802-F804 WeakPolarHBondContact O-CG 3.4Å; G802-F804 PolarHBondContact O-N 3.03Å; F804-H827 HydrophobicContact CE1-CB 4.08Å; F804-L828 HydrophobicContact CD1-CD2 4.39Å
805	R	92.5	Very high	94.3	Very high	134 Å²	134	29 Å²	29	51%	0.506	15%	0.154	S	C	.	.	B	Isolated β-bridge	trans	-94.4	-0.6	173.8	-77.2	-174.6	179.8	169.4	4	114	Q777 Q778 I779 C803	Q777-R805 WeakPolarHBondContact O-CD 3.26Å; Q778-R805 VanDerWaalsContact OE1-NH2 3.12Å; I779-R805 VanDerWaalsContact O-CB 3.32Å; I779-R805 WeakPolarHBondContact O-CB 3.23Å; C803-R805 PolarHBondContact O-N 3.13Å
806	L	93.5	Very high	94.1	Very high	7 Å²	7	33.1 Å²	33.1	4%	0.037	17%	0.174	C	C	.	.			trans	-70.8	163.9	169.4	-61.7	174.4	0	0	0	110.7	N781 I784 L800 C803 I810 L828 H830	N781-L806 VanDerWaalsContact OD1-CA 3.23Å; N781-L806 WeakPolarHBondContact OD1-CA 3.36Å; N781-L806 VanDerWaalsContact OD1-CD2 3.27Å; N781-L806 WeakPolarHBondContact OD1-CD2 3.25Å; I784-L806 HydrophobicContact CG1-CD2 4.14Å; L800-L806 HydrophobicContact CB-CD1 3.96Å; L800-L806 HydrophobicContact CD1-CD1 3.93Å; L800-L806 HydrophobicContact CG-CD1 4.37Å; C803-L806 HydrophobicContact CB-CD1 3.63Å; C803-L806 HydrophobicContact CB-CG 3.96Å; C803-L806 WeakPolarHBondContact O-CG 3.45Å; C803-L806 PolarHBondContact O-N 2.99Å; L806-I810 HydrophobicContact CD2-CD1 4.11Å; L806-I810 HydrophobicContact CD2-CG1 4.3Å; L806-L828 HydrophobicContact CD1-CD1 3.94Å; L806-H830 PolarHBondContact O-NE2 3.31Å
807	N	91.7	Very high	94.1	Very high	81 Å²	81	31.1 Å²	31.1	43%	0.433	16%	0.164	S	C	.	.			trans	-148	164.4	169.5	71.5	65.9	0	0	0	110.7	N781 S809 I810	N781-N807 PolarHBondContact ND2-O 3.27Å; N781-N807 PolarHBondContact ND2-OD1 2.72Å; N781-N807 PolarHBondContact OD1-N 3.19Å; N781-N807 VanDerWaalsContact OD1-N 3.08Å; N807-S809 PolarHBondContact O-N 3.12Å; N807-S809 WeakPolarHBondContact OD1-CB 3.24Å; N807-S809 PolarHBondContact OD1-N 3.32Å; N807-S809 VanDerWaalsContact OD1-N 3.17Å; N807-S809 PolarHBondContact OD1-OG 2.95Å; N807-I810 VanDerWaalsContact O-CB 3.25Å; N807-I810 WeakPolarHBondContact O-CB 3.42Å; N807-I810 WeakPolarHBondContact O-CG2 3.31Å; N807-I810 PolarHBondContact O-N 3.12Å
808	S	93	Very high	93.9	Very high	37 Å²	37	34 Å²	34	26%	0.259	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.4	-23.1	-170	-53.3	0	0	0	0	116.6	I810 L811 S832	S808-I810 PolarHBondContact O-N 2.86Å; S808-I810 VanDerWaalsContact O-N 3.1Å; S808-L811 WeakPolarHBondContact O-CB 3.41Å; S808-L811 WeakPolarHBondContact O-CG 3.36Å; S808-L811 PolarHBondContact O-N 3.13Å; S808-S832 PolarHBondContact OG-N 2.95Å
809	S	92.9	Very high	93.8	Very high	62 Å²	62	37.3 Å²	37.3	43%	0.434	19%	0.194	S	C	.	.	H	α-helix	trans	-61.1	-17.9	172.4	63.2	0	0	0	0	113.6	N781 N807 L811 A812 L813	N781-S809 PolarHBondContact ND2-OG 2.89Å; N807-S809 PolarHBondContact O-N 3.12Å; N807-S809 WeakPolarHBondContact OD1-CB 3.24Å; N807-S809 PolarHBondContact OD1-N 3.32Å; N807-S809 VanDerWaalsContact OD1-N 3.17Å; N807-S809 PolarHBondContact OD1-OG 2.95Å; S809-L811 PolarHBondContact O-N 3.29Å; S809-A812 PolarHBondContact O-N 3.19Å; S809-L813 PolarHBondContact O-N 3.13Å
810	I	94.6	Very high	93.7	Very high	0 Å²	0	37 Å²	37	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-57.7	-31.2	171.7	-161.7	61.8	0	0	0	112.5	N781 I784 L806 N807 S808 L813 L814 L831	N781-I810 HydrophobicContact CB-CD1 4.26Å; N781-I810 PolarHBondContact ND2-N 3.08Å; I784-I810 HydrophobicContact CB-CD1 3.54Å; I784-I810 HydrophobicContact CG1-CD1 3.99Å; I784-I810 HydrophobicContact CG2-CD1 3.56Å; L806-I810 HydrophobicContact CD2-CD1 4.11Å; L806-I810 HydrophobicContact CD2-CG1 4.3Å; N807-I810 VanDerWaalsContact O-CB 3.25Å; N807-I810 WeakPolarHBondContact O-CB 3.42Å; N807-I810 WeakPolarHBondContact O-CG2 3.31Å; N807-I810 PolarHBondContact O-N 3.12Å; S808-I810 PolarHBondContact O-N 2.86Å; S808-I810 VanDerWaalsContact O-N 3.1Å; I810-L813 HydrophobicContact CD1-CD1 4.47Å; I810-L813 PolarHBondContact O-N 3.13Å; I810-L814 HydrophobicContact CG1-CD1 3.95Å; I810-L814 HydrophobicContact CG1-CG 4.5Å; I810-L814 WeakPolarHBondContact O-CG 3.43Å; I810-L814 PolarHBondContact O-N 3.35Å; I810-L831 HydrophobicContact CG2-CD2 3.94Å
811	L	95.1	Very high	93.8	Very high	2 Å²	2	39.7 Å²	39.7	1%	0.01	20%	0.203	C	C	.	.	H	α-helix	trans	-74	-37.4	-175.2	-54.4	168.7	0	0	0	110.6	S808 S809 G815 F825 L831 G835 L836 L839	S808-L811 WeakPolarHBondContact O-CB 3.41Å; S808-L811 WeakPolarHBondContact O-CG 3.36Å; S808-L811 PolarHBondContact O-N 3.13Å; S809-L811 PolarHBondContact O-N 3.29Å; L811-G815 PolarHBondContact O-N 3.44Å; L811-F825 HydrophobicContact CD2-CD2 4.37Å; L811-F825 HydrophobicContact CD2-CE2 3.49Å; L811-F825 VanDerWaalsContact CD2-CE2 3.49Å; L811-F825 HydrophobicContact CD2-CZ 3.69Å; L811-L831 HydrophobicContact CD1-CB 4.41Å; L811-L831 HydrophobicContact CD1-CD2 4.35Å; L811-L831 HydrophobicContact CD2-CD1 4.47Å; L811-G835 WeakPolarHBondContact CB-O 3.47Å; L811-L836 HydrophobicContact CD1-CB 4.37Å; L811-L836 HydrophobicContact CD2-CD1 4.41Å; L811-L839 HydrophobicContact CB-CB 4.24Å; L811-L839 HydrophobicContact CB-CD2 4.33Å; L811-L839 HydrophobicContact CD2-CD2 3.66Å
812	A	94.3	Very high	94.2	Very high	54 Å²	54	38.5 Å²	38.5	45%	0.446	20%	0.199	S	C	.	.	H	α-helix	trans	-68.1	-34.6	173	0	0	0	0	0	112.7	S809	S809-A812 PolarHBondContact O-N 3.19Å
813	L	94.9	Very high	94.6	Very high	34 Å²	34	38.4 Å²	38.4	18%	0.178	20%	0.197	C	C	.	.	H	α-helix	trans	-67.4	-47.9	174.4	-67.7	173.8	0	0	0	111.7	Q785 S809 I810 G815 Q816	Q785-L813 HydrophobicContact CB-CD1 3.88Å; Q785-L813 HydrophobicContact CG-CD1 4.24Å; Q785-L813 HydrophobicContact CG-CD2 4.15Å; S809-L813 PolarHBondContact O-N 3.13Å; I810-L813 HydrophobicContact CD1-CD1 4.47Å; I810-L813 PolarHBondContact O-N 3.13Å; L813-G815 PolarHBondContact O-N 3.26Å; L813-Q816 WeakPolarHBondContact O-CB 3.29Å; L813-Q816 WeakPolarHBondContact O-CG 3.02Å; L813-Q816 PolarHBondContact O-N 2.97Å; L813-Q816 VanDerWaalsContact O-N 3.17Å
814	L	96.5	Very high	94.7	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-70.2	-18	-175.5	-70.9	170.2	0	0	0	114	I784 V788 L798 I810 Q816 C817 L823 F825 L839	I784-L814 HydrophobicContact CG2-CD2 4Å; V788-L814 HydrophobicContact CG2-CD2 3.79Å; L798-L814 HydrophobicContact CD2-CD1 3.94Å; L798-L814 HydrophobicContact CD2-CD2 3.34Å; L798-L814 HydrophobicContact CD2-CG 4.31Å; I810-L814 HydrophobicContact CG1-CD1 3.95Å; I810-L814 HydrophobicContact CG1-CG 4.5Å; I810-L814 WeakPolarHBondContact O-CG 3.43Å; I810-L814 PolarHBondContact O-N 3.35Å; L814-Q816 PolarHBondContact O-N 3.27Å; L814-Q816 VanDerWaalsContact O-N 3.09Å; L814-C817 PolarHBondContact O-N 3.42Å; L814-L823 HydrophobicContact CD1-CD1 4.5Å; L814-F825 HydrophobicContact CD1-CE1 4.09Å; L814-F825 HydrophobicContact CD1-CZ 3.69Å; L814-L839 HydrophobicContact CB-CD1 3.88Å; L814-L839 HydrophobicContact CB-CD2 4.3Å
815	G	94.8	Very high	94.8	Very high	8 Å²	8	34.9 Å²	34.9	8%	0.082	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-7.3	170.7	0	0	0	0	0	114.5	L811 L813 Q818 L839	L811-G815 PolarHBondContact O-N 3.44Å; L813-G815 PolarHBondContact O-N 3.26Å; G815-Q818 PolarHBondContact O-NE2 2.82Å; G815-L839 VanDerWaalsContact N-CD1 3.31Å
816	Q	95	Very high	94.7	Very high	88 Å²	88	28.5 Å²	28.5	41%	0.411	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.8	-23.8	172	-62.5	166.5	34.8	0	0	112.1	V788 L813 L814 Q818	V788-Q816 HydrophobicContact CG1-CB 3.96Å; L813-Q816 WeakPolarHBondContact O-CB 3.29Å; L813-Q816 WeakPolarHBondContact O-CG 3.02Å; L813-Q816 PolarHBondContact O-N 2.97Å; L813-Q816 VanDerWaalsContact O-N 3.17Å; L814-Q816 PolarHBondContact O-N 3.27Å; L814-Q816 VanDerWaalsContact O-N 3.09Å; Q816-Q818 PolarHBondContact O-N 3.22Å; Q816-Q818 VanDerWaalsContact O-N 3.07Å
817	C	96.4	Very high	94.4	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	17%	0.172	C	C	.	.			trans	-86.2	75	-173.8	-58.2	0	0	0	0	112.4	Q792 L814 E819 L820 L843	Q792-C817 WeakPolarHBondContact O-CA 3.07Å; L814-C817 PolarHBondContact O-N 3.42Å; C817-E819 PolarHBondContact O-N 3.39Å; C817-E819 VanDerWaalsContact O-N 3.13Å; C817-L820 HydrophobicContact CB-CD1 3.61Å; C817-L820 HydrophobicContact CB-CG 3.7Å; C817-L820 WeakPolarHBondContact O-CB 3.41Å; C817-L820 PolarHBondContact O-N 3.22Å; C817-L843 WeakPolarHBondContact O-CD2 3.16Å
818	Q	94.6	Very high	94.3	Very high	85 Å²	85	27.6 Å²	27.6	40%	0.397	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-27	-173	-66	-61.1	-64.1	0	0	114.8	G815 Q816 L820 K842	G815-Q818 PolarHBondContact O-NE2 2.82Å; Q816-Q818 PolarHBondContact O-N 3.22Å; Q816-Q818 VanDerWaalsContact O-N 3.07Å; Q818-L820 VanDerWaalsContact C-N 3.33Å; Q818-L820 PolarHBondContact O-N 3.26Å; Q818-K842 PolarHBondContact NE2-O 3.5Å; Q818-K842 PolarHBondContact OE1-O 3.02Å
819	E	95.7	Very high	93.9	Very high	69 Å²	69	31.2 Å²	31.2	32%	0.322	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.2	0.6	178.2	-67.1	-57.4	144.8	0	0	114.8	E796 C817 R821 H845	E796-E819 WeakPolarHBondContact CA-O 3.42Å; C817-E819 PolarHBondContact O-N 3.39Å; C817-E819 VanDerWaalsContact O-N 3.13Å; E819-R821 WeakPolarHBondContact O-CG 3.24Å; E819-R821 PolarHBondContact O-N 3.18Å; E819-R821 VanDerWaalsContact O-N 3.08Å; E819-R821 IonicContact OE2-CZ 3.28Å; E819-R821 IonicContact OE2-NH1 3.65Å; E819-R821 IonicContact OE2-NH2 2.94Å; E819-R821 PolarHBondContact OE2-NH2 3.18Å; E819-H845 IonicContact OE2-CD2 2.65Å
820	L	96.9	Very high	93.6	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	16%	0.159	C	C	.	.			trans	-61.2	115.6	179.3	-84.4	173.3	0	0	0	111.8	L795 L798 C817 Q818 L843 H845 L846	L795-L820 HydrophobicContact CD2-CD2 4.41Å; L795-L820 HydrophobicContact CG-CD2 4.2Å; L795-L820 VanDerWaalsContact O-CD2 3.32Å; L795-L820 WeakPolarHBondContact O-CD2 3.25Å; L795-L820 WeakPolarHBondContact O-CG 3.45Å; L798-L820 HydrophobicContact CB-CD2 4.03Å; C817-L820 HydrophobicContact CB-CD1 3.61Å; C817-L820 HydrophobicContact CB-CG 3.7Å; C817-L820 WeakPolarHBondContact O-CB 3.41Å; C817-L820 PolarHBondContact O-N 3.22Å; Q818-L820 VanDerWaalsContact C-N 3.33Å; Q818-L820 PolarHBondContact O-N 3.26Å; L820-L843 HydrophobicContact CB-CD1 4.04Å; L820-L843 HydrophobicContact CB-CD2 4.1Å; L820-L843 HydrophobicContact CD1-CD1 4.08Å; L820-L843 HydrophobicContact CD1-CD2 4.18Å; L820-H845 CarbonylContact O-C 3.55Å; L820-L846 WeakPolarHBondContact O-CA 3.39Å; L820-L846 PolarHBondContact O-N 3.3Å
821	R	97.4	Very high	93.3	Very high	57 Å²	57	32 Å²	32	22%	0.215	16%	0.161	C	C	.	.			trans	-100.1	-30.9	174.4	-48.6	-166.6	-166.4	-63.4	-20.7	112.8	E796 E819 H845 S847 S848	E796-R821 HydrophobicContact CB-CG 4.3Å; E796-R821 WeakPolarHBondContact O-CA 3.05Å; E796-R821 PolarHBondContact O-N 3.21Å; E796-R821 IonicContact OE1-CZ 2.93Å; E796-R821 VanDerWaalsContact OE1-CZ 3.3Å; E796-R821 IonicContact OE1-NE 3.3Å; E796-R821 PolarHBondContact OE1-NE 3.21Å; E796-R821 IonicContact OE1-NH2 3.61Å; E796-R821 PolarHBondContact OE1-NH2 3.2Å; E819-R821 WeakPolarHBondContact O-CG 3.24Å; E819-R821 PolarHBondContact O-N 3.18Å; E819-R821 VanDerWaalsContact O-N 3.08Å; E819-R821 IonicContact OE2-CZ 3.28Å; E819-R821 IonicContact OE2-NH1 3.65Å; E819-R821 IonicContact OE2-NH2 2.94Å; E819-R821 PolarHBondContact OE2-NH2 3.18Å; R821-H845 WeakPolarHBondContact CA-O 3.43Å; R821-H845 HydrophobicContact CG-CB 4.45Å; R821-S847 PolarHBondContact O-N 3.4Å; R821-S847 PolarHBondContact O-OG 2.85Å; R821-S848 PolarHBondContact O-N 3.05Å
822	A	97.5	Very high	93	Very high	5 Å²	5	34 Å²	34	4%	0.041	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	127.1	-175.7	0	0	0	0	0	112.9	E796 R797 L798 S848	E796-A822 PolarHBondContact O-N 3.23Å; R797-A822 WeakPolarHBondContact CA-O 3.26Å; R797-A822 HydrophobicContact CB-CB 3.97Å; R797-A822 HydrophobicContact CG-CB 3.79Å; R797-A822 VanDerWaalsContact NE-CB 3.33Å; L798-A822 PolarHBondContact N-O 2.98Å; A822-S848 WeakPolarHBondContact CA-O 3.41Å
823	L	96.6	Very high	92.9	Very high	3 Å²	3	32.6 Å²	32.6	2%	0.016	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	131.1	-175.5	-172.7	62	0	0	0	111.8	L798 L814 F825 L839 L843 L846 S848 L849 D850	L798-L823 HydrophobicContact CB-CD1 4.17Å; L798-L823 HydrophobicContact CD2-CD1 4.44Å; L798-L823 HydrophobicContact CG-CD1 4.47Å; L798-L823 WeakPolarHBondContact O-CA 3.49Å; L814-L823 HydrophobicContact CD1-CD1 4.5Å; L823-F825 HydrophobicContact CD1-CE1 4.18Å; L823-F825 HydrophobicContact CD1-CE2 4.23Å; L823-F825 HydrophobicContact CD1-CZ 3.9Å; L823-F825 HydrophobicContact CD2-CD2 4.24Å; L823-F825 HydrophobicContact CD2-CE2 3.56Å; L823-F825 HydrophobicContact CD2-CZ 3.94Å; L823-F825 HydrophobicContact CG-CD2 4.26Å; L823-F825 HydrophobicContact CG-CE2 3.9Å; L823-F825 HydrophobicContact CG-CZ 4.1Å; L823-L839 HydrophobicContact CD2-CD2 3.77Å; L823-L843 HydrophobicContact CD2-CD1 4.28Å; L823-L846 HydrophobicContact CB-CD1 3.98Å; L823-S848 PolarHBondContact N-O 2.83Å; L823-L849 HydrophobicContact CB-CD1 4.29Å; L823-L849 WeakPolarHBondContact O-CA 3.5Å; L823-D850 PolarHBondContact O-N 3.47Å
824	A	95.2	Very high	92.7	Very high	6 Å²	6	36 Å²	36	5%	0.05	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	123.9	178	0	0	0	0	0	113	L798 E799 L800 D850	L798-A824 PolarHBondContact O-N 3.06Å; L798-A824 VanDerWaalsContact O-N 3.08Å; E799-A824 HydrophobicContact CB-CB 4.01Å; E799-A824 HydrophobicContact CG-CB 3.95Å; L800-A824 PolarHBondContact N-O 3.34Å; A824-D850 WeakPolarHBondContact CA-O 3.46Å; A824-D850 HydrophobicContact CB-CB 3.81Å
825	F	92.8	Very high	92.5	Very high	1 Å²	1	36.6 Å²	36.6	0%	0.004	19%	0.187	C	C	.	.			trans	-125.8	22.6	-179	-70.3	-44.1	0	0	0	113.4	L800 L811 L814 L823 H827 L828 L831 L836 L839 D850 L851 T854	L800-F825 HydrophobicContact CB-CD1 4.33Å; L800-F825 HydrophobicContact CD1-CE1 4.14Å; L811-F825 HydrophobicContact CD2-CD2 4.37Å; L811-F825 HydrophobicContact CD2-CE2 3.49Å; L811-F825 VanDerWaalsContact CD2-CE2 3.49Å; L811-F825 HydrophobicContact CD2-CZ 3.69Å; L814-F825 HydrophobicContact CD1-CE1 4.09Å; L814-F825 HydrophobicContact CD1-CZ 3.69Å; L823-F825 HydrophobicContact CD1-CE1 4.18Å; L823-F825 HydrophobicContact CD1-CE2 4.23Å; L823-F825 HydrophobicContact CD1-CZ 3.9Å; L823-F825 HydrophobicContact CD2-CD2 4.24Å; L823-F825 HydrophobicContact CD2-CE2 3.56Å; L823-F825 HydrophobicContact CD2-CZ 3.94Å; L823-F825 HydrophobicContact CG-CD2 4.26Å; L823-F825 HydrophobicContact CG-CE2 3.9Å; L823-F825 HydrophobicContact CG-CZ 4.1Å; F825-H827 PolarHBondContact O-N 2.95Å; F825-L828 HydrophobicContact CB-CD1 4.05Å; F825-L828 HydrophobicContact CD1-CD1 3.74Å; F825-L828 HydrophobicContact CG-CD1 4.28Å; F825-L828 VanDerWaalsContact O-CB 3.3Å; F825-L828 WeakPolarHBondContact O-CB 3.47Å; F825-L828 WeakPolarHBondContact O-CG 3.42Å; F825-L828 PolarHBondContact O-N 3.36Å; F825-L828 VanDerWaalsContact O-N 3.11Å; F825-L831 HydrophobicContact CB-CD1 4.16Å; F825-L831 HydrophobicContact CD1-CD1 4.29Å; F825-L831 HydrophobicContact CD2-CD1 4.26Å; F825-L831 HydrophobicContact CG-CD1 4.04Å; F825-L836 HydrophobicContact CD2-CD1 4.13Å; F825-L836 HydrophobicContact CE2-CD1 4.09Å; F825-L839 HydrophobicContact CE2-CD2 3.89Å; F825-L839 HydrophobicContact CZ-CD2 4.17Å; F825-D850 PolarHBondContact N-O 3.3Å; F825-L851 HydrophobicContact CB-CD2 4.3Å; F825-T854 VanDerWaalsContact O-CG2 3.26Å; F825-T854 WeakPolarHBondContact O-CG2 3.48Å
826	G	88.8	Confident	92.5	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-49.5	137.7	-176.6	0	0	0	0	0	114.5	F801 G802 L828 R852	F801-G826 WeakPolarHBondContact CA-O 3.02Å; G802-G826 PolarHBondContact N-O 3.04Å; G826-L828 PolarHBondContact O-N 2.89Å; G826-R852 CarbonylContact C-O 3.59Å; G826-R852 WeakPolarHBondContact CA-O 3.19Å
827	H	86.9	Confident	92.5	Very high	68 Å²	68	32.5 Å²	32.5	32%	0.315	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.8	7.7	-175.3	-55.2	-93.3	0	0	0	117.2	F801 F804 F825 H829 R852	F801-H827 AromaticContact CE2-CD2 3.38Å; F801-H827 WeakPolarHBondContact CE2-CD2 3.34Å; F801-H827 AromaticContact CE2-NE2 3.74Å; F801-H827 AromaticContact CZ-CD2 3.32Å; F801-H827 WeakPolarHBondContact CZ-CD2 3.36Å; F801-H827 AromaticContact CZ-NE2 3.59Å; F804-H827 HydrophobicContact CE1-CB 4.08Å; F825-H827 PolarHBondContact O-N 2.95Å; H827-H829 PolarHBondContact O-N 3.03Å; H827-H829 PolarHBondContact O-ND1 2.98Å; H827-R852 PolarHBondContact N-O 2.95Å
828	L	89.7	Confident	92.4	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	19%	0.185	C	C	.	.			trans	-78.7	63.9	171.4	-57.5	-177.7	0	0	0	111.6	C803 F804 L806 F825 G826 H830 L831	C803-L828 WeakPolarHBondContact O-CD2 3.43Å; F804-L828 HydrophobicContact CD1-CD2 4.39Å; L806-L828 HydrophobicContact CD1-CD1 3.94Å; F825-L828 HydrophobicContact CB-CD1 4.05Å; F825-L828 HydrophobicContact CD1-CD1 3.74Å; F825-L828 HydrophobicContact CG-CD1 4.28Å; F825-L828 VanDerWaalsContact O-CB 3.3Å; F825-L828 WeakPolarHBondContact O-CB 3.47Å; F825-L828 WeakPolarHBondContact O-CG 3.42Å; F825-L828 PolarHBondContact O-N 3.36Å; F825-L828 VanDerWaalsContact O-N 3.11Å; G826-L828 PolarHBondContact O-N 2.89Å; L828-H830 PolarHBondContact O-N 2.99Å; L828-H830 VanDerWaalsContact O-N 3.09Å; L828-L831 HydrophobicContact CB-CD1 3.6Å; L828-L831 HydrophobicContact CB-CG 3.92Å; L828-L831 HydrophobicContact CD1-CD1 3.87Å; L828-L831 HydrophobicContact CG-CD1 4.41Å; L828-L831 PolarHBondContact O-N 3.36Å
829	H	85.1	Confident	92.4	Very high	113 Å²	113	32.7 Å²	32.7	52%	0.523	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-14	-175.4	55.2	-89.5	0	0	0	115.6	H827	H827-H829 PolarHBondContact O-N 3.03Å; H827-H829 PolarHBondContact O-ND1 2.98Å
830	H	86.2	Confident	92.3	Very high	69 Å²	69	29.5 Å²	29.5	32%	0.319	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.4	-4.3	179.8	54.8	-112.1	0	0	0	114.1	L806 L828	L806-H830 PolarHBondContact O-NE2 3.31Å; L828-H830 PolarHBondContact O-N 2.99Å; L828-H830 VanDerWaalsContact O-N 3.09Å
831	L	89.3	Confident	92.2	Very high	9 Å²	9	32.5 Å²	32.5	5%	0.047	17%	0.173	C	C	.	.	S	Bend	trans	-75.9	139.8	-180	-64.6	176.8	0	0	0	110.7	I810 L811 F825 L828 T856	I810-L831 HydrophobicContact CG2-CD2 3.94Å; L811-L831 HydrophobicContact CD1-CB 4.41Å; L811-L831 HydrophobicContact CD1-CD2 4.35Å; L811-L831 HydrophobicContact CD2-CD1 4.47Å; F825-L831 HydrophobicContact CB-CD1 4.16Å; F825-L831 HydrophobicContact CD1-CD1 4.29Å; F825-L831 HydrophobicContact CD2-CD1 4.26Å; F825-L831 HydrophobicContact CG-CD1 4.04Å; L828-L831 HydrophobicContact CB-CD1 3.6Å; L828-L831 HydrophobicContact CB-CG 3.92Å; L828-L831 HydrophobicContact CD1-CD1 3.87Å; L828-L831 HydrophobicContact CG-CD1 4.41Å; L828-L831 PolarHBondContact O-N 3.36Å; L831-T856 HydrophobicContact CB-CG2 4.22Å; L831-T856 WeakPolarHBondContact O-CB 3.34Å; L831-T856 WeakPolarHBondContact O-CG2 3.46Å
832	S	89.5	Confident	92.1	Very high	44 Å²	44	33.5 Å²	33.5	31%	0.308	18%	0.179	S	C	.	.			trans	-69.7	137.7	176.6	54.5	0	0	0	0	111.9	S808 D834 G835 L836	S808-S832 PolarHBondContact OG-N 2.95Å; S832-D834 PolarHBondContact O-N 2.91Å; S832-G835 PolarHBondContact OG-N 3.18Å; S832-L836 WeakPolarHBondContact O-CB 3.34Å; S832-L836 PolarHBondContact O-N 2.88Å
833	S	90.8	Very high	92	Very high	25 Å²	25	33.5 Å²	33.5	18%	0.175	18%	0.178	C	C	.	.	H	α-helix	trans	-48.5	-45.8	163.7	42.7	0	0	0	0	111.6	L836 L837 T856	S833-L836 WeakPolarHBondContact O-CB 3.5Å; S833-L836 PolarHBondContact O-N 3.13Å; S833-L837 WeakPolarHBondContact O-CB 3.49Å; S833-L837 WeakPolarHBondContact O-CG 3.3Å; S833-L837 PolarHBondContact O-N 3.11Å; S833-T856 WeakPolarHBondContact CB-O 3.46Å
834	D	91.4	Very high	91.8	Very high	107 Å²	107	36.8 Å²	36.8	57%	0.572	20%	0.2	S	C	*	.	H	α-helix	trans	-76.2	-43.3	-164.3	-52.7	-5.7	0	0	0	110.7	S832 L836 L837 E838	S832-D834 PolarHBondContact O-N 2.91Å; D834-L836 VanDerWaalsContact C-N 3.27Å; D834-L836 PolarHBondContact O-N 2.85Å; D834-L837 CarbonylContact O-C 3.39Å; D834-L837 PolarHBondContact O-N 3.44Å; D834-E838 WeakPolarHBondContact O-CB 3.44Å; D834-E838 PolarHBondContact O-N 3.19Å
835	G	93	Very high	91.7	Very high	12 Å²	12	40.5 Å²	40.5	12%	0.124	22%	0.216	C	C	.	.	H	α-helix	trans	-64.4	-28.7	170.6	0	0	0	0	0	113.3	L811 S832 L839	L811-G835 WeakPolarHBondContact CB-O 3.47Å; S832-G835 PolarHBondContact OG-N 3.18Å; G835-L839 WeakPolarHBondContact O-CB 3.35Å; G835-L839 PolarHBondContact O-N 2.76Å
836	L	93.8	Very high	91.9	Very high	3 Å²	3	40.6 Å²	40.6	2%	0.016	22%	0.216	C	C	.	.	H	α-helix	trans	-74.3	-42.1	174.2	179	58.1	0	0	0	110.2	L811 F825 S832 S833 D834 E838 L839 V840 L851 F857	L811-L836 HydrophobicContact CD1-CB 4.37Å; L811-L836 HydrophobicContact CD2-CD1 4.41Å; F825-L836 HydrophobicContact CD2-CD1 4.13Å; F825-L836 HydrophobicContact CE2-CD1 4.09Å; S832-L836 WeakPolarHBondContact O-CB 3.34Å; S832-L836 PolarHBondContact O-N 2.88Å; S833-L836 WeakPolarHBondContact O-CB 3.5Å; S833-L836 PolarHBondContact O-N 3.13Å; D834-L836 VanDerWaalsContact C-N 3.27Å; D834-L836 PolarHBondContact O-N 2.85Å; L836-E838 VanDerWaalsContact C-N 3.3Å; L836-E838 PolarHBondContact O-N 3.19Å; L836-L839 HydrophobicContact CD1-CD2 4.45Å; L836-L839 PolarHBondContact O-N 2.87Å; L836-V840 HydrophobicContact CD1-CG1 4.29Å; L836-V840 WeakPolarHBondContact O-CG1 3.35Å; L836-V840 WeakPolarHBondContact O-CG2 3.46Å; L836-V840 PolarHBondContact O-N 3.25Å; L836-L851 HydrophobicContact CD2-CD1 4.09Å; L836-L851 HydrophobicContact CD2-CD2 3.78Å; L836-F857 HydrophobicContact CB-CZ 4.44Å; L836-F857 HydrophobicContact CD2-CE2 3.7Å; L836-F857 HydrophobicContact CD2-CZ 3.63Å; L836-F857 HydrophobicContact CG-CZ 4.06Å
837	L	94.1	Very high	92.3	Very high	7 Å²	7	42 Å²	42	4%	0.037	23%	0.226	C	C	.	.	H	α-helix	trans	-61.5	-36.7	171	-73.5	170.8	0	0	0	111.8	S833 D834 V840 S841 F857 N862 Q865 L866 K869	S833-L837 WeakPolarHBondContact O-CB 3.49Å; S833-L837 WeakPolarHBondContact O-CG 3.3Å; S833-L837 PolarHBondContact O-N 3.11Å; D834-L837 CarbonylContact O-C 3.39Å; D834-L837 PolarHBondContact O-N 3.44Å; L837-V840 WeakPolarHBondContact O-CG2 3.4Å; L837-S841 PolarHBondContact O-N 2.91Å; L837-S841 PolarHBondContact O-OG 2.8Å; L837-F857 HydrophobicContact CD1-CE1 4.36Å; L837-F857 HydrophobicContact CD2-CE1 4.49Å; L837-F857 HydrophobicContact CD2-CZ 4.48Å; L837-F857 HydrophobicContact CG-CE1 4.1Å; L837-F857 HydrophobicContact CG-CZ 4.37Å; L837-N862 HydrophobicContact CD1-CB 4.11Å; L837-Q865 HydrophobicContact CD2-CB 3.96Å; L837-L866 HydrophobicContact CD2-CB 3.86Å; L837-K869 VanDerWaalsContact O-CD 3.23Å; L837-K869 WeakPolarHBondContact O-CD 3.31Å; L837-K869 PolarHBondContact O-NZ 3.22Å
838	E	94.4	Very high	92.8	Very high	87 Å²	87	39.3 Å²	39.3	41%	0.407	22%	0.215	S	C	.	.	H	α-helix	trans	-66.3	-48.7	174.6	-166.3	-162.9	150	0	0	111.1	D834 L836 V840 S841 K842	D834-E838 WeakPolarHBondContact O-CB 3.44Å; D834-E838 PolarHBondContact O-N 3.19Å; L836-E838 VanDerWaalsContact C-N 3.3Å; L836-E838 PolarHBondContact O-N 3.19Å; E838-V840 PolarHBondContact O-N 3.3Å; E838-S841 PolarHBondContact O-N 3.06Å; E838-S841 PolarHBondContact O-OG 3.33Å; E838-K842 PolarHBondContact O-N 3.09Å; E838-K842 WeakPolarHBondContact OE1-CE 3.26Å; E838-K842 IonicContact OE1-NZ 3.17Å; E838-K842 PolarHBondContact OE1-NZ 2.88Å
839	L	95.4	Very high	93.1	Very high	1 Å²	1	39.5 Å²	39.5	1%	0.005	22%	0.216	C	C	.	.	H	α-helix	trans	-55.7	-51.6	176.4	170.4	59.5	0	0	0	111.6	L811 L814 G815 L823 F825 G835 L836 S841 K842 L843	L811-L839 HydrophobicContact CB-CB 4.24Å; L811-L839 HydrophobicContact CB-CD2 4.33Å; L811-L839 HydrophobicContact CD2-CD2 3.66Å; L814-L839 HydrophobicContact CB-CD1 3.88Å; L814-L839 HydrophobicContact CB-CD2 4.3Å; G815-L839 VanDerWaalsContact N-CD1 3.31Å; L823-L839 HydrophobicContact CD2-CD2 3.77Å; F825-L839 HydrophobicContact CE2-CD2 3.89Å; F825-L839 HydrophobicContact CZ-CD2 4.17Å; G835-L839 WeakPolarHBondContact O-CB 3.35Å; G835-L839 PolarHBondContact O-N 2.76Å; L836-L839 HydrophobicContact CD1-CD2 4.45Å; L836-L839 PolarHBondContact O-N 2.87Å; L839-S841 VanDerWaalsContact C-N 3.28Å; L839-S841 PolarHBondContact O-N 3.05Å; L839-K842 WeakPolarHBondContact O-CA 3.47Å; L839-K842 WeakPolarHBondContact O-CB 3.47Å; L839-K842 PolarHBondContact O-N 3.38Å; L839-L843 HydrophobicContact CD1-CD1 3.89Å; L839-L843 HydrophobicContact CD1-CD2 4.2Å; L839-L843 HydrophobicContact CD1-CG 3.96Å; L839-L843 HydrophobicContact CG-CD1 4.16Å; L839-L843 PolarHBondContact O-N 3.1Å
840	V	94.6	Very high	93.6	Very high	2 Å²	2	34.6 Å²	34.6	1%	0.012	19%	0.193	C	C	.	.	H	α-helix	trans	-65.4	-30.8	-176.1	-59.6	0	0	0	0	112.4	L836 L837 E838 K842 L843 L846 K869 C870	L836-V840 HydrophobicContact CD1-CG1 4.29Å; L836-V840 WeakPolarHBondContact O-CG1 3.35Å; L836-V840 WeakPolarHBondContact O-CG2 3.46Å; L836-V840 PolarHBondContact O-N 3.25Å; L837-V840 WeakPolarHBondContact O-CG2 3.4Å; E838-V840 PolarHBondContact O-N 3.3Å; V840-K842 PolarHBondContact O-N 3.23Å; V840-L843 PolarHBondContact O-N 2.95Å; V840-L846 HydrophobicContact CB-CD2 4.32Å; V840-L846 HydrophobicContact CG1-CD2 3.88Å; V840-K869 HydrophobicContact CG2-CB 4.14Å; V840-K869 HydrophobicContact CG2-CD 4.15Å; V840-C870 PolarHBondContact O-SG 3.01Å; V840-C870 VanDerWaalsContact O-SG 3.41Å
841	S	93.9	Very high	94	Very high	63 Å²	63	31.4 Å²	31.4	44%	0.441	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67	-10.6	168.9	34.8	0	0	0	0	115.1	L837 E838 L839 K869	L837-S841 PolarHBondContact O-N 2.91Å; L837-S841 PolarHBondContact O-OG 2.8Å; E838-S841 PolarHBondContact O-N 3.06Å; E838-S841 PolarHBondContact O-OG 3.33Å; L839-S841 VanDerWaalsContact C-N 3.28Å; L839-S841 PolarHBondContact O-N 3.05Å; S841-K869 PolarHBondContact OG-NZ 3.19Å
842	K	94.9	Very high	94.2	Very high	78 Å²	78	31.4 Å²	31.4	34%	0.339	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102	-0.1	175.7	-65.7	172.3	175.3	176.1	0	113.1	Q818 E838 L839 V840 P844	Q818-K842 PolarHBondContact NE2-O 3.5Å; Q818-K842 PolarHBondContact OE1-O 3.02Å; E838-K842 PolarHBondContact O-N 3.09Å; E838-K842 WeakPolarHBondContact OE1-CE 3.26Å; E838-K842 IonicContact OE1-NZ 3.17Å; E838-K842 PolarHBondContact OE1-NZ 2.88Å; L839-K842 WeakPolarHBondContact O-CA 3.47Å; L839-K842 WeakPolarHBondContact O-CB 3.47Å; L839-K842 PolarHBondContact O-N 3.38Å; V840-K842 PolarHBondContact O-N 3.23Å; K842-P844 WeakPolarHBondContact O-CD 3.11Å
843	L	95.4	Very high	94.1	Very high	5 Å²	5	29.7 Å²	29.7	3%	0.026	17%	0.167	C	C	.	.			trans	-113.9	86.2	-177.4	-60.6	-172.8	0	0	0	111	C817 L820 L823 L839 V840 H845 L846	C817-L843 WeakPolarHBondContact O-CD2 3.16Å; L820-L843 HydrophobicContact CB-CD1 4.04Å; L820-L843 HydrophobicContact CB-CD2 4.1Å; L820-L843 HydrophobicContact CD1-CD1 4.08Å; L820-L843 HydrophobicContact CD1-CD2 4.18Å; L823-L843 HydrophobicContact CD2-CD1 4.28Å; L839-L843 HydrophobicContact CD1-CD1 3.89Å; L839-L843 HydrophobicContact CD1-CD2 4.2Å; L839-L843 HydrophobicContact CD1-CG 3.96Å; L839-L843 HydrophobicContact CG-CD1 4.16Å; L839-L843 PolarHBondContact O-N 3.1Å; V840-L843 PolarHBondContact O-N 2.95Å; L843-H845 PolarHBondContact O-N 2.68Å; L843-L846 HydrophobicContact CB-CB 3.98Å; L843-L846 HydrophobicContact CD1-CD1 4.22Å; L843-L846 HydrophobicContact CD1-CD2 4.46Å; L843-L846 PolarHBondContact O-N 2.99Å
844	P	92.4	Very high	94	Very high	73 Å²	73	28.6 Å²	28.6	47%	0.474	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-9	-173.1	30.1	-37.6	0	0	0	114.2	K842	K842-P844 WeakPolarHBondContact O-CD 3.11Å
845	H	94.2	Very high	93.6	Very high	84 Å²	84	27.1 Å²	27.1	39%	0.389	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	-119.8	7.3	-173.6	-67.7	-17.4	0	0	0	113.9	E819 L820 R821 L843 S847	E819-H845 IonicContact OE2-CD2 2.65Å; L820-H845 CarbonylContact O-C 3.55Å; R821-H845 WeakPolarHBondContact CA-O 3.43Å; R821-H845 HydrophobicContact CG-CB 4.45Å; L843-H845 PolarHBondContact O-N 2.68Å; H845-S847 PolarHBondContact O-N 2.73Å; H845-S847 VanDerWaalsContact O-N 3.16Å
846	L	96.6	Very high	93	Very high	3 Å²	3	27.2 Å²	27.2	2%	0.016	15%	0.148	C	C	.	.			trans	-65.3	112.1	-179.7	-170.3	70.5	0	0	0	111.3	L820 L823 V840 L843 L873	L820-L846 WeakPolarHBondContact O-CA 3.39Å; L820-L846 PolarHBondContact O-N 3.3Å; L823-L846 HydrophobicContact CB-CD1 3.98Å; V840-L846 HydrophobicContact CB-CD2 4.32Å; V840-L846 HydrophobicContact CG1-CD2 3.88Å; L843-L846 HydrophobicContact CB-CB 3.98Å; L843-L846 HydrophobicContact CD1-CD1 4.22Å; L843-L846 HydrophobicContact CD1-CD2 4.46Å; L843-L846 PolarHBondContact O-N 2.99Å; L846-L873 HydrophobicContact CD2-CD2 4.28Å; L846-L873 HydrophobicContact CG-CD2 4.04Å
847	S	97	Very high	92.4	Very high	29 Å²	29	27.1 Å²	27.1	20%	0.203	15%	0.147	C	C	.	.			trans	-115.4	-10.7	178.8	73.6	0	0	0	0	113.6	R821 H845 E874 E875	R821-S847 PolarHBondContact O-N 3.4Å; R821-S847 PolarHBondContact O-OG 2.85Å; H845-S847 PolarHBondContact O-N 2.73Å; H845-S847 VanDerWaalsContact O-N 3.16Å; S847-E874 WeakPolarHBondContact O-CA 3.4Å; S847-E874 PolarHBondContact O-N 3.42Å; S847-E875 PolarHBondContact O-N 2.93Å
848	S	97.7	Very high	91.4	Very high	12 Å²	12	31 Å²	31	8%	0.084	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	124.2	-176.2	165.7	0	0	0	0	110.9	R821 A822 L823 E875	R821-S848 PolarHBondContact O-N 3.05Å; A822-S848 WeakPolarHBondContact CA-O 3.41Å; L823-S848 PolarHBondContact N-O 2.83Å; S848-E875 CarbonylContact C-O 3.58Å; S848-E875 WeakPolarHBondContact CA-O 3.39Å; S848-E875 VanDerWaalsContact CB-OE2 3.3Å; S848-E875 WeakPolarHBondContact CB-OE2 3.19Å; S848-E875 PolarHBondContact OG-OE2 2.87Å
849	L	96.4	Very high	90.6	Very high	4 Å²	4	29.6 Å²	29.6	2%	0.021	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	120.4	-176.7	-175.6	60.7	0	0	0	112.3	L823 L851 L866 L873 E875 V876 V877	L823-L849 HydrophobicContact CB-CD1 4.29Å; L823-L849 WeakPolarHBondContact O-CA 3.5Å; L849-L851 HydrophobicContact CD1-CD2 4.13Å; L849-L851 HydrophobicContact CD1-CG 4.35Å; L849-L851 HydrophobicContact CD2-CD1 4.16Å; L849-L851 HydrophobicContact CD2-CG 4.47Å; L849-L851 HydrophobicContact CG-CD1 4.33Å; L849-L851 HydrophobicContact CG-CD2 4.42Å; L849-L851 HydrophobicContact CG-CG 4.09Å; L849-L866 HydrophobicContact CD2-CD1 3.94Å; L849-L866 HydrophobicContact CD2-CD2 4.15Å; L849-L866 HydrophobicContact CD2-CG 4.39Å; L849-L873 HydrophobicContact CB-CD2 3.94Å; L849-E875 PolarHBondContact N-O 3.3Å; L849-V876 WeakPolarHBondContact O-CA 3.49Å; L849-V877 PolarHBondContact O-N 3.07Å
850	D	95.4	Very high	89.7	Confident	9 Å²	9	30.5 Å²	30.5	5%	0.048	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	117.1	177.3	179.1	-8.1	0	0	0	111.8	L823 A824 F825 R852 V877	L823-D850 PolarHBondContact O-N 3.47Å; A824-D850 WeakPolarHBondContact CA-O 3.46Å; A824-D850 HydrophobicContact CB-CB 3.81Å; F825-D850 PolarHBondContact N-O 3.3Å; D850-R852 WeakPolarHBondContact OD1-CB 3.26Å; D850-R852 PolarHBondContact OD1-N 3.36Å; D850-V877 HydrophobicContact CB-CB 4Å; D850-V877 HydrophobicContact CB-CG2 4.45Å
851	L	94.4	Very high	89.4	Confident	2 Å²	2	34.5 Å²	34.5	1%	0.01	20%	0.196	C	C	.	.			trans	-121.8	19.2	-179.7	-57.9	177.2	0	0	0	111.9	F825 L836 L849 G853 T854 F857 L866 V877 L878 M881	F825-L851 HydrophobicContact CB-CD2 4.3Å; L836-L851 HydrophobicContact CD2-CD1 4.09Å; L836-L851 HydrophobicContact CD2-CD2 3.78Å; L849-L851 HydrophobicContact CD1-CD2 4.13Å; L849-L851 HydrophobicContact CD1-CG 4.35Å; L849-L851 HydrophobicContact CD2-CD1 4.16Å; L849-L851 HydrophobicContact CD2-CG 4.47Å; L849-L851 HydrophobicContact CG-CD1 4.33Å; L849-L851 HydrophobicContact CG-CD2 4.42Å; L849-L851 HydrophobicContact CG-CG 4.09Å; L851-G853 PolarHBondContact O-N 3.41Å; L851-T854 HydrophobicContact CB-CG2 4.48Å; L851-T854 VanDerWaalsContact O-CB 3.3Å; L851-T854 WeakPolarHBondContact O-CB 3.21Å; L851-T854 VanDerWaalsContact O-CG2 3.25Å; L851-T854 WeakPolarHBondContact O-CG2 3.47Å; L851-T854 PolarHBondContact O-N 2.86Å; L851-T854 PolarHBondContact O-OG1 2.95Å; L851-F857 HydrophobicContact CD1-CD2 4.15Å; L851-F857 HydrophobicContact CD1-CE2 3.7Å; L851-L866 HydrophobicContact CD1-CD1 4.22Å; L851-V877 PolarHBondContact N-O 3.25Å; L851-L878 HydrophobicContact CB-CD2 4.2Å; L851-L878 HydrophobicContact CD1-CD2 4.18Å; L851-M881 HydrophobicContact CB-SD 3.78Å; L851-M881 WeakPolarHBondContact O-CG 3.3Å; L851-M881 VanDerWaalsContact O-SD 3.37Å
852	R	92.6	Very high	89.2	Confident	9 Å²	9	32.6 Å²	32.6	3%	0.034	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-45.7	128.9	-176.5	177.5	175.3	-71.6	-173.7	0.1	113	A471 H475 G826 H827 D850 T854 V877 A879 D904	A471-R852 VanDerWaalsContact O-CZ 3.29Å; A471-R852 PolarHBondContact O-NH1 3.23Å; A471-R852 PolarHBondContact O-NH2 2.99Å; H475-R852 PolarHBondContact NE2-NH1 3.24Å; G826-R852 CarbonylContact C-O 3.59Å; G826-R852 WeakPolarHBondContact CA-O 3.19Å; H827-R852 PolarHBondContact N-O 2.95Å; D850-R852 WeakPolarHBondContact OD1-CB 3.26Å; D850-R852 PolarHBondContact OD1-N 3.36Å; R852-T854 PolarHBondContact O-N 3Å; R852-V877 HydrophobicContact CB-CG1 4.07Å; R852-A879 CarbonylContact C-O 3.58Å; R852-A879 WeakPolarHBondContact CA-O 3.37Å; R852-A879 HydrophobicContact CG-CB 4.17Å; R852-A879 WeakPolarHBondContact CG-O 3.39Å; R852-D904 IonicContact CZ-OD2 3.25Å; R852-D904 IonicContact NE-OD2 3.78Å; R852-D904 IonicContact NH2-OD2 3.21Å; R852-D904 PolarHBondContact NH2-OD2 3.34Å
853	G	88.3	Confident	89	Confident	8 Å²	8	28.9 Å²	28.9	8%	0.082	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	63.2	7.7	175.2	0	0	0	0	0	115.3	L851 Q855 A879	L851-G853 PolarHBondContact O-N 3.41Å; G853-Q855 PolarHBondContact O-NE2 2.79Å; G853-A879 PolarHBondContact N-O 3.41Å
854	T	88.2	Confident	88.8	Confident	2 Å²	2	29.4 Å²	29.4	1%	0.012	17%	0.169	C	C	.	.			trans	-71.3	156.4	166.6	67.1	0	0	0	0	109.8	F825 L851 R852 M881	F825-T854 VanDerWaalsContact O-CG2 3.26Å; F825-T854 WeakPolarHBondContact O-CG2 3.48Å; L851-T854 HydrophobicContact CB-CG2 4.48Å; L851-T854 VanDerWaalsContact O-CB 3.3Å; L851-T854 WeakPolarHBondContact O-CB 3.21Å; L851-T854 VanDerWaalsContact O-CG2 3.25Å; L851-T854 WeakPolarHBondContact O-CG2 3.47Å; L851-T854 PolarHBondContact O-N 2.86Å; L851-T854 PolarHBondContact O-OG1 2.95Å; R852-T854 PolarHBondContact O-N 3Å; T854-M881 WeakPolarHBondContact O-CG 3.39Å; T854-M881 VanDerWaalsContact OG1-CE 3.31Å; T854-M881 WeakPolarHBondContact OG1-CE 3.09Å
855	Q	83.7	Confident	88.8	Confident	77 Å²	77	29.3 Å²	29.3	36%	0.36	16%	0.162	S	C	.	.			trans	-123.1	25.1	179	-51.7	-57	-33.7	0	0	111.1	G853 N880 S883	G853-Q855 PolarHBondContact O-NE2 2.79Å; Q855-N880 PolarHBondContact NE2-O 2.9Å; Q855-S883 PolarHBondContact OE1-OG 3.01Å
856	T	78.8	Confident	88.8	Confident	14 Å²	14	25.5 Å²	25.5	9%	0.086	15%	0.145	C	C	.	.			trans	-81.7	-25.5	-168.9	58.7	0	0	0	0	112.9	L831 S833	L831-T856 HydrophobicContact CB-CG2 4.22Å; L831-T856 WeakPolarHBondContact O-CB 3.34Å; L831-T856 WeakPolarHBondContact O-CG2 3.46Å; S833-T856 WeakPolarHBondContact CB-O 3.46Å
857	F	81.5	Confident	88.6	Confident	0 Å²	0	25.3 Å²	25.3	0%	0	14%	0.144	C	C	.	.			trans	-107.4	108.5	175.5	-64.6	-48	0	0	0	110.5	L836 L837 L851 N862 L863 L866 M881 S883 L884	L836-F857 HydrophobicContact CB-CZ 4.44Å; L836-F857 HydrophobicContact CD2-CE2 3.7Å; L836-F857 HydrophobicContact CD2-CZ 3.63Å; L836-F857 HydrophobicContact CG-CZ 4.06Å; L837-F857 HydrophobicContact CD1-CE1 4.36Å; L837-F857 HydrophobicContact CD2-CE1 4.49Å; L837-F857 HydrophobicContact CD2-CZ 4.48Å; L837-F857 HydrophobicContact CG-CE1 4.1Å; L837-F857 HydrophobicContact CG-CZ 4.37Å; L851-F857 HydrophobicContact CD1-CD2 4.15Å; L851-F857 HydrophobicContact CD1-CE2 3.7Å; F857-N862 HydrophobicContact CD1-CB 3.51Å; F857-N862 HydrophobicContact CE1-CB 3.87Å; F857-N862 HydrophobicContact CG-CB 4.39Å; F857-L863 HydrophobicContact CB-CD2 4.3Å; F857-L863 HydrophobicContact CD2-CD2 3.97Å; F857-L863 HydrophobicContact CG-CD2 4.31Å; F857-L866 HydrophobicContact CE2-CD1 3.46Å; F857-L866 VanDerWaalsContact CE2-CD1 3.46Å; F857-L866 HydrophobicContact CZ-CD1 3.74Å; F857-M881 HydrophobicContact CB-CE 4.21Å; F857-M881 HydrophobicContact CD2-CE 4.19Å; F857-S883 VanDerWaalsContact O-CB 3.29Å; F857-S883 WeakPolarHBondContact O-CB 3.38Å; F857-S883 PolarHBondContact O-OG 3.33Å; F857-L884 HydrophobicContact CB-CD2 4.26Å; F857-L884 WeakPolarHBondContact O-CD2 3.32Å
858	S	73.3	Confident	88.4	Confident	89 Å²	89	26.6 Å²	26.6	62%	0.622	16%	0.156	S	C	*	.			trans	-108.5	-9.2	175.6	52.9	0	0	0	0	113.5
859	D	77.2	Confident	88.2	Confident	57 Å²	57	30 Å²	30	31%	0.305	17%	0.169	S	C	.	.	S	Bend	trans	-123.8	138.7	-179.6	-175.1	28.4	0	0	0	112.7	N861 N862 R886	D859-N861 PolarHBondContact O-N 3.42Å; D859-N861 WeakPolarHBondContact OD2-CB 3.47Å; D859-N862 PolarHBondContact O-N 2.74Å; D859-N862 VanDerWaalsContact O-N 3.12Å; D859-R886 IonicContact OD1-CZ 3.35Å; D859-R886 IonicContact OD1-NH2 2.7Å; D859-R886 PolarHBondContact OD1-NH2 3.13Å
860	D	77.6	Confident	88	Confident	20 Å²	20	30.1 Å²	30.1	11%	0.107	17%	0.171	C	C	.	.	H	α-helix	trans	-58.1	-33.3	178.4	-67.2	18.3	0	0	0	112.2	N862 L863 S864 R886 T888 G889	D860-N862 VanDerWaalsContact C-N 3.3Å; D860-N862 PolarHBondContact O-N 3.04Å; D860-L863 PolarHBondContact O-N 3.44Å; D860-S864 PolarHBondContact O-N 2.95Å; D860-R886 WeakPolarHBondContact OD1-CB 3.11Å; D860-R886 IonicContact OD1-CZ 3.67Å; D860-R886 IonicContact OD1-NE 3.39Å; D860-R886 PolarHBondContact OD1-NE 3.47Å; D860-R886 IonicContact OD1-NH1 2.72Å; D860-R886 IonicContact OD1-NH2 2.58Å; D860-R886 PolarHBondContact OD1-NH2 2.83Å; D860-R886 IonicContact OD2-CZ 3.88Å; D860-R886 VanDerWaalsContact OD2-CZ 3.25Å; D860-R886 IonicContact OD2-NE 2.76Å; D860-R886 PolarHBondContact OD2-NE 2.9Å; D860-R886 IonicContact OD2-NH1 2.59Å; D860-R886 PolarHBondContact OD2-NH1 2.87Å; D860-T888 WeakPolarHBondContact OD2-CB 3.31Å; D860-T888 PolarHBondContact OD2-OG1 3.48Å; D860-G889 VanDerWaalsContact CB-CA 3.45Å; D860-G889 VanDerWaalsContact CG-N 3.27Å; D860-G889 WeakPolarHBondContact OD2-CA 3.45Å; D860-G889 PolarHBondContact OD2-N 2.7Å
861	N	87.1	Confident	87.8	Confident	86 Å²	86	32.4 Å²	32.4	46%	0.46	19%	0.186	S	C	.	.	H	α-helix	trans	-57.7	-44.6	176.2	-170.9	12.9	0	0	0	110.9	D859 L863 S864 Q865	D859-N861 PolarHBondContact O-N 3.42Å; D859-N861 WeakPolarHBondContact OD2-CB 3.47Å; N861-L863 PolarHBondContact O-N 3.45Å; N861-S864 PolarHBondContact O-N 3.29Å; N861-Q865 VanDerWaalsContact CG-NE2 3.31Å; N861-Q865 PolarHBondContact ND2-NE2 3.04Å; N861-Q865 WeakPolarHBondContact O-CB 3.42Å; N861-Q865 WeakPolarHBondContact O-CG 3.24Å; N861-Q865 PolarHBondContact O-N 2.92Å; N861-Q865 PolarHBondContact OD1-NE2 2.72Å
862	N	90.7	Very high	87.7	Confident	23 Å²	23	36.4 Å²	36.4	12%	0.123	20%	0.204	C	C	.	.	H	α-helix	trans	-66.8	-37.9	-177.5	-68.2	-5.2	0	0	0	111.7	L837 F857 D859 D860 Q865 L866	L837-N862 HydrophobicContact CD1-CB 4.11Å; F857-N862 HydrophobicContact CD1-CB 3.51Å; F857-N862 HydrophobicContact CE1-CB 3.87Å; F857-N862 HydrophobicContact CG-CB 4.39Å; D859-N862 PolarHBondContact O-N 2.74Å; D859-N862 VanDerWaalsContact O-N 3.12Å; D860-N862 VanDerWaalsContact C-N 3.3Å; D860-N862 PolarHBondContact O-N 3.04Å; N862-Q865 PolarHBondContact O-N 3.37Å; N862-L866 WeakPolarHBondContact O-CB 3.46Å; N862-L866 PolarHBondContact O-N 2.69Å
863	L	91.5	Very high	87.9	Confident	1 Å²	1	36 Å²	36	1%	0.005	20%	0.203	C	C	.	.	H	α-helix	trans	-65.1	-42	172	-72.3	-171.6	0	0	0	112.4	F857 D860 N861 L866 A867 L884 I890 M893	F857-L863 HydrophobicContact CB-CD2 4.3Å; F857-L863 HydrophobicContact CD2-CD2 3.97Å; F857-L863 HydrophobicContact CG-CD2 4.31Å; D860-L863 PolarHBondContact O-N 3.44Å; N861-L863 PolarHBondContact O-N 3.45Å; L863-L866 PolarHBondContact O-N 3.18Å; L863-A867 PolarHBondContact O-N 2.87Å; L863-A867 VanDerWaalsContact O-N 3.13Å; L863-L884 HydrophobicContact CD1-CD1 4.05Å; L863-L884 HydrophobicContact CD1-CD2 3.62Å; L863-L884 HydrophobicContact CD1-CG 4.46Å; L863-L884 HydrophobicContact CD2-CD2 4.38Å; L863-L884 HydrophobicContact CG-CD2 4.05Å; L863-I890 HydrophobicContact CD1-CG1 4.11Å; L863-M893 HydrophobicContact CB-CB 4.16Å; L863-M893 HydrophobicContact CB-CG 4.44Å; L863-M893 HydrophobicContact CB-SD 4.49Å; L863-M893 HydrophobicContact CD2-SD 4.23Å
864	S	90.3	Very high	88.3	Confident	15 Å²	15	38.4 Å²	38.4	11%	0.105	21%	0.212	C	C	.	.	H	α-helix	trans	-68.8	-34.3	177.9	-157.5	0	0	0	0	112.4	D860 N861 A868 Q892 R896	D860-S864 PolarHBondContact O-N 2.95Å; N861-S864 PolarHBondContact O-N 3.29Å; S864-A868 VanDerWaalsContact O-CB 3.25Å; S864-A868 WeakPolarHBondContact O-CB 3.48Å; S864-A868 PolarHBondContact O-N 3.42Å; S864-Q892 PolarHBondContact OG-O 2.68Å; S864-R896 WeakPolarHBondContact O-CD 3.47Å; S864-R896 PolarHBondContact OG-NE 2.98Å
865	Q	92.5	Very high	88.7	Confident	71 Å²	71	38.8 Å²	38.8	33%	0.332	21%	0.214	S	C	.	.	H	α-helix	trans	-66.7	-40.4	172.6	-73.9	-177.6	34.2	0	0	112.3	L837 N861 N862 A868 K869	L837-Q865 HydrophobicContact CD2-CB 3.96Å; N861-Q865 VanDerWaalsContact CG-NE2 3.31Å; N861-Q865 PolarHBondContact ND2-NE2 3.04Å; N861-Q865 WeakPolarHBondContact O-CB 3.42Å; N861-Q865 WeakPolarHBondContact O-CG 3.24Å; N861-Q865 PolarHBondContact O-N 2.92Å; N861-Q865 PolarHBondContact OD1-NE2 2.72Å; N862-Q865 PolarHBondContact O-N 3.37Å; Q865-A868 PolarHBondContact O-N 3.33Å; Q865-K869 WeakPolarHBondContact O-CB 3.45Å; Q865-K869 WeakPolarHBondContact O-CG 3.32Å; Q865-K869 PolarHBondContact O-N 2.92Å
866	L	93.4	Very high	89.4	Confident	4 Å²	4	35.3 Å²	35.3	2%	0.021	20%	0.197	C	C	.	.	H	α-helix	trans	-58.7	-49.5	175.2	-178.6	153	0	0	0	110.9	L837 L849 L851 F857 N862 L863 A868 K869 C870 L873	L837-L866 HydrophobicContact CD2-CB 3.86Å; L849-L866 HydrophobicContact CD2-CD1 3.94Å; L849-L866 HydrophobicContact CD2-CD2 4.15Å; L849-L866 HydrophobicContact CD2-CG 4.39Å; L851-L866 HydrophobicContact CD1-CD1 4.22Å; F857-L866 HydrophobicContact CE2-CD1 3.46Å; F857-L866 VanDerWaalsContact CE2-CD1 3.46Å; F857-L866 HydrophobicContact CZ-CD1 3.74Å; N862-L866 WeakPolarHBondContact O-CB 3.46Å; N862-L866 PolarHBondContact O-N 2.69Å; L863-L866 PolarHBondContact O-N 3.18Å; L866-A868 PolarHBondContact O-N 3.37Å; L866-K869 PolarHBondContact O-N 3.31Å; L866-C870 PolarHBondContact O-N 3.04Å; L866-L873 HydrophobicContact CD2-CD1 3.92Å
867	A	93.4	Very high	90.2	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-70.7	-29.4	178.3	0	0	0	0	0	113.4	L863 K869 C870 M893 R896 L897	L863-A867 PolarHBondContact O-N 2.87Å; L863-A867 VanDerWaalsContact O-N 3.13Å; A867-K869 VanDerWaalsContact C-N 3.34Å; A867-C870 CarbonylContact O-C 3.41Å; A867-M893 HydrophobicContact CB-CB 4.42Å; A867-M893 HydrophobicContact CB-CG 3.68Å; A867-M893 WeakPolarHBondContact CB-O 3.42Å; A867-R896 HydrophobicContact CB-CB 3.78Å; A867-L897 HydrophobicContact CB-CD1 4.27Å; A867-L897 HydrophobicContact CB-CD2 3.75Å; A867-L897 HydrophobicContact CB-CG 3.87Å
868	A	93	Very high	90.8	Very high	56 Å²	56	34.8 Å²	34.8	46%	0.463	19%	0.194	S	C	.	.	H	α-helix	trans	-68.3	-32.1	171.6	0	0	0	0	0	112.8	S864 Q865 L866	S864-A868 VanDerWaalsContact O-CB 3.25Å; S864-A868 WeakPolarHBondContact O-CB 3.48Å; S864-A868 PolarHBondContact O-N 3.42Å; Q865-A868 PolarHBondContact O-N 3.33Å; L866-A868 PolarHBondContact O-N 3.37Å
869	K	93.3	Very high	91.7	Very high	83 Å²	83	30.6 Å²	30.6	36%	0.361	17%	0.165	S	C	.	.	H	α-helix	trans	-79.1	-32.9	176.1	-74	178	171	-152.1	0	113	L837 V840 S841 Q865 L866 A867 P871	L837-K869 VanDerWaalsContact O-CD 3.23Å; L837-K869 WeakPolarHBondContact O-CD 3.31Å; L837-K869 PolarHBondContact O-NZ 3.22Å; V840-K869 HydrophobicContact CG2-CB 4.14Å; V840-K869 HydrophobicContact CG2-CD 4.15Å; S841-K869 PolarHBondContact OG-NZ 3.19Å; Q865-K869 WeakPolarHBondContact O-CB 3.45Å; Q865-K869 WeakPolarHBondContact O-CG 3.32Å; Q865-K869 PolarHBondContact O-N 2.92Å; L866-K869 PolarHBondContact O-N 3.31Å; A867-K869 VanDerWaalsContact C-N 3.34Å; K869-P871 VanDerWaalsContact C-CD 3.44Å; K869-P871 WeakPolarHBondContact O-CD 3.43Å
870	C	92.8	Very high	92.4	Very high	7 Å²	7	29.8 Å²	29.8	5%	0.047	16%	0.16	C	C	.	.			trans	-123	69.9	179.3	-65.2	0	0	0	0	113.1	V840 L866 A867 H872 L873 L897	V840-C870 PolarHBondContact O-SG 3.01Å; V840-C870 VanDerWaalsContact O-SG 3.41Å; L866-C870 PolarHBondContact O-N 3.04Å; A867-C870 CarbonylContact O-C 3.41Å; C870-H872 PolarHBondContact O-N 3.35Å; C870-L873 HydrophobicContact CB-CD1 3.89Å; C870-L873 HydrophobicContact CB-CD2 4.49Å; C870-L873 HydrophobicContact CB-CG 3.87Å; C870-L873 PolarHBondContact O-N 3.45Å; C870-L897 WeakPolarHBondContact O-CD2 3.2Å
871	P	90.4	Very high	93	Very high	57 Å²	57	28.8 Å²	28.8	37%	0.37	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.4	14.7	177.4	33.4	-38.8	0	0	0	113.9	K869	K869-P871 VanDerWaalsContact C-CD 3.44Å; K869-P871 WeakPolarHBondContact O-CD 3.43Å
872	H	92	Very high	93	Very high	86 Å²	86	30.3 Å²	30.3	40%	0.398	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-121.8	9.9	-177.7	-65.2	-9.5	0	0	0	112.9	C870 E874	C870-H872 PolarHBondContact O-N 3.35Å; H872-E874 PolarHBondContact O-N 3.12Å
873	L	96.5	Very high	92.9	Very high	0 Å²	0	30 Å²	30	0%	0	16%	0.159	C	C	.	.			trans	-63.6	124	172	-68	166.5	0	0	0	111	L846 L849 L866 C870 V876 L897	L846-L873 HydrophobicContact CD2-CD2 4.28Å; L846-L873 HydrophobicContact CG-CD2 4.04Å; L849-L873 HydrophobicContact CB-CD2 3.94Å; L866-L873 HydrophobicContact CD2-CD1 3.92Å; C870-L873 HydrophobicContact CB-CD1 3.89Å; C870-L873 HydrophobicContact CB-CD2 4.49Å; C870-L873 HydrophobicContact CB-CG 3.87Å; C870-L873 PolarHBondContact O-N 3.45Å; L873-V876 HydrophobicContact CB-CG2 3.95Å; L873-V876 HydrophobicContact CD1-CG2 4.03Å; L873-V876 HydrophobicContact CG-CG2 4.43Å; L873-L897 HydrophobicContact CB-CD2 4.14Å; L873-L897 HydrophobicContact CD1-CD1 4.47Å; L873-L897 HydrophobicContact CD1-CD2 4.25Å
874	E	96.9	Very high	92.9	Very high	58 Å²	58	30.4 Å²	30.4	27%	0.271	16%	0.161	S	C	.	.	S	Bend	trans	-101.7	-29.2	172.2	-66.1	-175.9	-150	0	0	111.5	S847 H872 R901 V902	S847-E874 WeakPolarHBondContact O-CA 3.4Å; S847-E874 PolarHBondContact O-N 3.42Å; H872-E874 PolarHBondContact O-N 3.12Å; E874-R901 HydrophobicContact CB-CB 4.5Å; E874-R901 CarbonylContact O-C 3.53Å; E874-R901 WeakPolarHBondContact O-CA 3.42Å; E874-R901 PolarHBondContact O-N 3.45Å; E874-R901 VanDerWaalsContact OE2-CD 3.29Å; E874-R901 WeakPolarHBondContact OE2-CD 3.32Å; E874-R901 IonicContact OE2-CZ 3.37Å; E874-R901 IonicContact OE2-NE 3.13Å; E874-R901 IonicContact OE2-NH1 2.7Å; E874-R901 PolarHBondContact OE2-NH1 2.03Å; E874-V902 PolarHBondContact O-N 3.36Å
875	E	97.6	Very high	92.7	Very high	11 Å²	11	38.3 Å²	38.3	5%	0.051	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	122.5	-178.9	176.2	175.9	-129.5	0	0	110.7	S467 S468 S847 S848 L849 V902	S467-E875 WeakPolarHBondContact CB-OE1 3.41Å; S467-E875 PolarHBondContact OG-OE1 3.5Å; S468-E875 PolarHBondContact N-OE1 3.09Å; S847-E875 PolarHBondContact O-N 2.93Å; S848-E875 CarbonylContact C-O 3.58Å; S848-E875 WeakPolarHBondContact CA-O 3.39Å; S848-E875 VanDerWaalsContact CB-OE2 3.3Å; S848-E875 WeakPolarHBondContact CB-OE2 3.19Å; S848-E875 PolarHBondContact OG-OE2 2.87Å; L849-E875 PolarHBondContact N-O 3.3Å; E875-V902 WeakPolarHBondContact CA-O 3.47Å; E875-V902 HydrophobicContact CB-CB 4.09Å; E875-V902 HydrophobicContact CG-CB 4.04Å; E875-V902 HydrophobicContact CG-CG1 4.04Å
876	V	96.7	Very high	92.7	Very high	3 Å²	3	40.3 Å²	40.3	2%	0.018	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	125.8	179.5	174.3	0	0	0	0	110.5	L849 L873 L878 M893 L897 L900 V902 L903 D904	L849-V876 WeakPolarHBondContact O-CA 3.49Å; L873-V876 HydrophobicContact CB-CG2 3.95Å; L873-V876 HydrophobicContact CD1-CG2 4.03Å; L873-V876 HydrophobicContact CG-CG2 4.43Å; V876-L878 HydrophobicContact CG1-CD1 4.23Å; V876-L878 HydrophobicContact CG1-CD2 4.12Å; V876-L878 HydrophobicContact CG1-CG 3.85Å; V876-M893 HydrophobicContact CG1-CE 4.4Å; V876-L897 HydrophobicContact CG2-CD1 4.16Å; V876-L900 HydrophobicContact CB-CD1 3.99Å; V876-L900 HydrophobicContact CG2-CD1 3.73Å; V876-V902 PolarHBondContact N-O 2.91Å; V876-L903 HydrophobicContact CB-CD1 4.17Å; V876-L903 HydrophobicContact CG1-CD1 4.21Å; V876-L903 WeakPolarHBondContact O-CA 3.38Å; V876-D904 PolarHBondContact O-N 3.37Å
877	V	95.9	Very high	92.7	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	111.7	179.2	177.7	0	0	0	0	110	L849 D850 L851 R852 D904	L849-V877 PolarHBondContact O-N 3.07Å; D850-V877 HydrophobicContact CB-CB 4Å; D850-V877 HydrophobicContact CB-CG2 4.45Å; L851-V877 PolarHBondContact N-O 3.25Å; R852-V877 HydrophobicContact CB-CG1 4.07Å; V877-D904 HydrophobicContact CB-CB 4.33Å; V877-D904 HydrophobicContact CG1-CB 4.06Å; V877-D904 WeakPolarHBondContact CG1-OD2 3.23Å; V877-D904 HydrophobicContact CG2-CB 4.09Å
878	L	94.7	Very high	92.6	Very high	4 Å²	4	46 Å²	46	2%	0.021	23%	0.229	C	C	.	.			trans	-120.9	12.4	179.7	-52.6	179	0	0	0	112.9	L851 V876 N880 M881 L884 M893 D904 L905 L908	L851-L878 HydrophobicContact CB-CD2 4.2Å; L851-L878 HydrophobicContact CD1-CD2 4.18Å; V876-L878 HydrophobicContact CG1-CD1 4.23Å; V876-L878 HydrophobicContact CG1-CD2 4.12Å; V876-L878 HydrophobicContact CG1-CG 3.85Å; L878-N880 PolarHBondContact O-N 2.92Å; L878-M881 HydrophobicContact CB-SD 3.9Å; L878-M881 HydrophobicContact CD2-SD 3.69Å; L878-M881 HydrophobicContact CG-SD 4.36Å; L878-M881 WeakPolarHBondContact O-CB 3.29Å; L878-M881 VanDerWaalsContact O-CG 3.23Å; L878-M881 WeakPolarHBondContact O-CG 3.31Å; L878-M881 PolarHBondContact O-N 3.4Å; L878-L884 HydrophobicContact CB-CD1 4.45Å; L878-L884 HydrophobicContact CD1-CD1 4.26Å; L878-M893 HydrophobicContact CD1-CE 3.82Å; L878-M893 HydrophobicContact CD1-SD 3.88Å; L878-D904 PolarHBondContact N-O 2.94Å; L878-L905 HydrophobicContact CB-CD2 4.18Å; L878-L905 HydrophobicContact CD1-CD2 4.17Å; L878-L908 HydrophobicContact CB-CD1 4.23Å
879	A	93.4	Very high	92.6	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50.7	139.6	-176.7	0	0	0	0	0	113.3	R852 G853 M881 D904 C906	R852-A879 CarbonylContact C-O 3.58Å; R852-A879 WeakPolarHBondContact CA-O 3.37Å; R852-A879 HydrophobicContact CG-CB 4.17Å; R852-A879 WeakPolarHBondContact CG-O 3.39Å; G853-A879 PolarHBondContact N-O 3.41Å; A879-M881 PolarHBondContact O-N 2.88Å; A879-M881 VanDerWaalsContact O-N 3.13Å; A879-D904 WeakPolarHBondContact CB-OD2 3.14Å; A879-D904 PolarHBondContact N-O 3.26Å; A879-C906 CarbonylContact C-O 3.58Å; A879-C906 WeakPolarHBondContact CA-O 3.34Å; A879-C906 HydrophobicContact CB-CB 4.05Å; A879-C906 WeakPolarHBondContact CB-O 3.24Å
880	N	90.8	Very high	92.6	Very high	40 Å²	40	39.3 Å²	39.3	21%	0.214	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.3	21.5	179.8	-55.8	-63.7	0	0	0	115.9	Q855 L878 H882 C906	Q855-N880 PolarHBondContact NE2-O 2.9Å; L878-N880 PolarHBondContact O-N 2.92Å; N880-H882 PolarHBondContact O-CD2 3.15Å; N880-H882 VanDerWaalsContact O-CD2 3.3Å; N880-H882 PolarHBondContact O-N 3.06Å; N880-H882 PolarHBondContact O-NE2 2.69Å; N880-C906 PolarHBondContact N-O 3.41Å
881	M	90.8	Very high	92.8	Very high	0 Å²	0	39 Å²	39	0%	0	19%	0.188	C	C	.	.			trans	-76	71.3	167.8	-67.3	-172.9	62.8	0	0	111.3	L851 T854 F857 L878 A879 S883 L884 L908	L851-M881 HydrophobicContact CB-SD 3.78Å; L851-M881 WeakPolarHBondContact O-CG 3.3Å; L851-M881 VanDerWaalsContact O-SD 3.37Å; T854-M881 WeakPolarHBondContact O-CG 3.39Å; T854-M881 VanDerWaalsContact OG1-CE 3.31Å; T854-M881 WeakPolarHBondContact OG1-CE 3.09Å; F857-M881 HydrophobicContact CB-CE 4.21Å; F857-M881 HydrophobicContact CD2-CE 4.19Å; L878-M881 HydrophobicContact CB-SD 3.9Å; L878-M881 HydrophobicContact CD2-SD 3.69Å; L878-M881 HydrophobicContact CG-SD 4.36Å; L878-M881 WeakPolarHBondContact O-CB 3.29Å; L878-M881 VanDerWaalsContact O-CG 3.23Å; L878-M881 WeakPolarHBondContact O-CG 3.31Å; L878-M881 PolarHBondContact O-N 3.4Å; A879-M881 PolarHBondContact O-N 2.88Å; A879-M881 VanDerWaalsContact O-N 3.13Å; M881-S883 PolarHBondContact O-N 3.33Å; M881-L884 HydrophobicContact CB-CD1 3.92Å; M881-L884 HydrophobicContact CB-CG 4.05Å; M881-L884 HydrophobicContact CE-CD1 4.42Å; M881-L884 WeakPolarHBondContact O-CB 3.47Å; M881-L884 PolarHBondContact O-N 3.32Å; M881-L884 HydrophobicContact SD-CD1 4.4Å; M881-L908 HydrophobicContact CB-CD2 4.14Å; M881-L908 WeakPolarHBondContact O-CD2 3.34Å
882	H	87.3	Confident	92.9	Very high	118 Å²	118	39.7 Å²	39.7	55%	0.546	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-9.8	-175.8	-48.5	-56.3	0	0	0	115.2	N880 L884	N880-H882 PolarHBondContact O-CD2 3.15Å; N880-H882 VanDerWaalsContact O-CD2 3.3Å; N880-H882 PolarHBondContact O-N 3.06Å; N880-H882 PolarHBondContact O-NE2 2.69Å; H882-L884 VanDerWaalsContact C-N 3.26Å
883	S	88.3	Confident	93	Very high	17 Å²	17	35.6 Å²	35.6	12%	0.119	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-24.3	166.4	57.4	0	0	0	0	113.5	Q855 F857 M881 K885	Q855-S883 PolarHBondContact OE1-OG 3.01Å; F857-S883 VanDerWaalsContact O-CB 3.29Å; F857-S883 WeakPolarHBondContact O-CB 3.38Å; F857-S883 PolarHBondContact O-OG 3.33Å; M881-S883 PolarHBondContact O-N 3.33Å; S883-K885 PolarHBondContact O-N 2.79Å; S883-K885 VanDerWaalsContact O-N 3.1Å
884	L	90.1	Very high	93	Very high	8 Å²	8	35.6 Å²	35.6	4%	0.042	17%	0.167	C	C	.	.			trans	-78.3	89.4	175.7	-59.5	-178.7	0	0	0	110.5	F857 L863 L878 M881 H882 I890 L908 A910	F857-L884 HydrophobicContact CB-CD2 4.26Å; F857-L884 WeakPolarHBondContact O-CD2 3.32Å; L863-L884 HydrophobicContact CD1-CD1 4.05Å; L863-L884 HydrophobicContact CD1-CD2 3.62Å; L863-L884 HydrophobicContact CD1-CG 4.46Å; L863-L884 HydrophobicContact CD2-CD2 4.38Å; L863-L884 HydrophobicContact CG-CD2 4.05Å; L878-L884 HydrophobicContact CB-CD1 4.45Å; L878-L884 HydrophobicContact CD1-CD1 4.26Å; M881-L884 HydrophobicContact CB-CD1 3.92Å; M881-L884 HydrophobicContact CB-CG 4.05Å; M881-L884 HydrophobicContact CE-CD1 4.42Å; M881-L884 WeakPolarHBondContact O-CB 3.47Å; M881-L884 PolarHBondContact O-N 3.32Å; M881-L884 HydrophobicContact SD-CD1 4.4Å; H882-L884 VanDerWaalsContact C-N 3.26Å; L884-I890 HydrophobicContact CB-CD1 4.45Å; L884-I890 HydrophobicContact CD1-CD1 4.43Å; L884-I890 HydrophobicContact CD1-CG1 4.49Å; L884-L908 HydrophobicContact CD1-CD1 4.31Å; L884-A910 VanDerWaalsContact O-CB 3.25Å; L884-A910 WeakPolarHBondContact O-CB 2.98Å
885	K	87.5	Confident	92.9	Very high	181 Å²	181	38.4 Å²	38.4	79%	0.787	18%	0.176	S	C	*	.			trans	-93.2	-11.1	-175.7	-65.4	-179.7	-178.7	-179.9	0	115.2	S883	S883-K885 PolarHBondContact O-N 2.79Å; S883-K885 VanDerWaalsContact O-N 3.1Å
886	R	91	Very high	92.7	Very high	114 Å²	114	43.1 Å²	43.1	43%	0.43	19%	0.193	S	C	.	.			trans	-120.7	132.2	-175.1	-78.1	-177.6	-73.3	163.2	-9.7	111.1	D859 D860 T888	D859-R886 IonicContact OD1-CZ 3.35Å; D859-R886 IonicContact OD1-NH2 2.7Å; D859-R886 PolarHBondContact OD1-NH2 3.13Å; D860-R886 WeakPolarHBondContact OD1-CB 3.11Å; D860-R886 IonicContact OD1-CZ 3.67Å; D860-R886 IonicContact OD1-NE 3.39Å; D860-R886 PolarHBondContact OD1-NE 3.47Å; D860-R886 IonicContact OD1-NH1 2.72Å; D860-R886 IonicContact OD1-NH2 2.58Å; D860-R886 PolarHBondContact OD1-NH2 2.83Å; D860-R886 IonicContact OD2-CZ 3.88Å; D860-R886 VanDerWaalsContact OD2-CZ 3.25Å; D860-R886 IonicContact OD2-NE 2.76Å; D860-R886 PolarHBondContact OD2-NE 2.9Å; D860-R886 IonicContact OD2-NH1 2.59Å; D860-R886 PolarHBondContact OD2-NH1 2.87Å; R886-T888 VanDerWaalsContact C-N 3.26Å; R886-T888 PolarHBondContact O-N 3.23Å
887	E	93.7	Very high	92.6	Very high	47 Å²	47	43 Å²	43	22%	0.22	19%	0.192	C	C	.	.	H	α-helix	trans	-64.9	-33.1	173.5	-164.3	164.5	-161.2	0	0	112.3	G889 I890 A891 A910 G912 L914 T915	E887-G889 VanDerWaalsContact C-N 3.3Å; E887-G889 PolarHBondContact O-N 2.79Å; E887-I890 PolarHBondContact O-N 3.04Å; E887-I890 VanDerWaalsContact O-N 3.15Å; E887-A891 WeakPolarHBondContact O-CB 3.23Å; E887-A891 PolarHBondContact O-N 3.44Å; E887-A910 WeakPolarHBondContact CA-O 3.5Å; E887-A910 VanDerWaalsContact CB-O 3.22Å; E887-A910 WeakPolarHBondContact CB-O 3.16Å; E887-G912 VanDerWaalsContact OE1-CA 3.23Å; E887-G912 WeakPolarHBondContact OE1-CA 3.4Å; E887-G912 PolarHBondContact OE1-N 3.35Å; E887-G912 VanDerWaalsContact OE1-O 3.05Å; E887-L914 HydrophobicContact CG-CB 4.39Å; E887-L914 HydrophobicContact CG-CD2 4.47Å; E887-L914 PolarHBondContact OE1-N 3.21Å; E887-T915 WeakPolarHBondContact CG-OG1 3.36Å; E887-T915 WeakPolarHBondContact OE1-CB 3.03Å; E887-T915 PolarHBondContact OE1-N 2.89Å; E887-T915 PolarHBondContact OE1-OG1 2.9Å
888	T	92.4	Very high	92.5	Very high	75 Å²	75	46.3 Å²	46.3	46%	0.46	21%	0.213	S	C	.	.	H	α-helix	trans	-57.2	-37.2	-176.6	42	0	0	0	0	113.6	D860 R886 Q892	D860-T888 WeakPolarHBondContact OD2-CB 3.31Å; D860-T888 PolarHBondContact OD2-OG1 3.48Å; R886-T888 VanDerWaalsContact C-N 3.26Å; R886-T888 PolarHBondContact O-N 3.23Å; T888-Q892 WeakPolarHBondContact O-CB 3.3Å; T888-Q892 PolarHBondContact O-N 3.3Å
889	G	92.4	Very high	92.5	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-70.7	-40.3	178.2	0	0	0	0	0	113	D860 E887 Q892 M893	D860-G889 VanDerWaalsContact CB-CA 3.45Å; D860-G889 VanDerWaalsContact CG-N 3.27Å; D860-G889 WeakPolarHBondContact OD2-CA 3.45Å; D860-G889 PolarHBondContact OD2-N 2.7Å; E887-G889 VanDerWaalsContact C-N 3.3Å; E887-G889 PolarHBondContact O-N 2.79Å; G889-Q892 PolarHBondContact O-N 3.47Å; G889-M893 WeakPolarHBondContact O-CB 3.38Å; G889-M893 PolarHBondContact O-N 2.88Å
890	I	94.6	Very high	92.6	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-67.9	-47.5	177.4	-56.9	175.8	0	0	0	109.2	L863 L884 E887 Q892 M893 L894 L905 L908 V911 T915	L863-I890 HydrophobicContact CD1-CG1 4.11Å; L884-I890 HydrophobicContact CB-CD1 4.45Å; L884-I890 HydrophobicContact CD1-CD1 4.43Å; L884-I890 HydrophobicContact CD1-CG1 4.49Å; E887-I890 PolarHBondContact O-N 3.04Å; E887-I890 VanDerWaalsContact O-N 3.15Å; I890-Q892 PolarHBondContact O-N 2.95Å; I890-M893 WeakPolarHBondContact O-CB 3.25Å; I890-M893 PolarHBondContact O-N 3.34Å; I890-L894 HydrophobicContact CG2-CD1 3.97Å; I890-L894 VanDerWaalsContact O-CG 3.25Å; I890-L894 WeakPolarHBondContact O-CG 3.45Å; I890-L894 PolarHBondContact O-N 3.47Å; I890-L905 HydrophobicContact CG2-CD1 4.1Å; I890-L905 HydrophobicContact CG2-CD2 4.17Å; I890-L908 HydrophobicContact CD1-CD1 4.1Å; I890-V911 HydrophobicContact CD1-CG2 3.48Å; I890-V911 VanDerWaalsContact CD1-CG2 3.48Å; I890-V911 HydrophobicContact CG2-CG2 4.44Å; I890-T915 HydrophobicContact CG2-CG2 4.06Å
891	A	95.2	Very high	92.8	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-54.9	-47.7	171.8	0	0	0	0	0	112.3	E887 M893 L894 R895 V918	E887-A891 WeakPolarHBondContact O-CB 3.23Å; E887-A891 PolarHBondContact O-N 3.44Å; A891-M893 VanDerWaalsContact C-N 3.31Å; A891-M893 PolarHBondContact O-N 2.98Å; A891-L894 PolarHBondContact O-N 2.87Å; A891-R895 WeakPolarHBondContact O-CG 3.47Å; A891-R895 PolarHBondContact O-N 3.42Å; A891-R895 VanDerWaalsContact O-N 3.1Å; A891-V918 HydrophobicContact CB-CG2 4.05Å; A891-V918 WeakPolarHBondContact O-CG1 2.96Å
892	Q	93.6	Very high	93.1	Very high	71 Å²	71	54.1 Å²	54.1	33%	0.332	24%	0.241	S	C	.	.	H	α-helix	trans	-75.6	-16.9	-177.4	-166.6	58.3	17.3	0	0	114.1	S864 T888 G889 I890	S864-Q892 PolarHBondContact OG-O 2.68Å; T888-Q892 WeakPolarHBondContact O-CB 3.3Å; T888-Q892 PolarHBondContact O-N 3.3Å; G889-Q892 PolarHBondContact O-N 3.47Å; I890-Q892 PolarHBondContact O-N 2.95Å
893	M	94.8	Very high	93.6	Very high	1 Å²	1	48.5 Å²	48.5	1%	0.005	22%	0.215	C	C	.	.	H	α-helix	trans	-72.4	-51.7	164.8	-176.1	-165.1	70.3	0	0	110.5	L863 A867 V876 L878 G889 I890 A891 R895 R896 L897	L863-M893 HydrophobicContact CB-CB 4.16Å; L863-M893 HydrophobicContact CB-CG 4.44Å; L863-M893 HydrophobicContact CB-SD 4.49Å; L863-M893 HydrophobicContact CD2-SD 4.23Å; A867-M893 HydrophobicContact CB-CB 4.42Å; A867-M893 HydrophobicContact CB-CG 3.68Å; A867-M893 WeakPolarHBondContact CB-O 3.42Å; V876-M893 HydrophobicContact CG1-CE 4.4Å; L878-M893 HydrophobicContact CD1-CE 3.82Å; L878-M893 HydrophobicContact CD1-SD 3.88Å; G889-M893 WeakPolarHBondContact O-CB 3.38Å; G889-M893 PolarHBondContact O-N 2.88Å; I890-M893 WeakPolarHBondContact O-CB 3.25Å; I890-M893 PolarHBondContact O-N 3.34Å; A891-M893 VanDerWaalsContact C-N 3.31Å; A891-M893 PolarHBondContact O-N 2.98Å; M893-R895 VanDerWaalsContact C-N 3.35Å; M893-R895 PolarHBondContact O-N 2.89Å; M893-R896 WeakPolarHBondContact O-CB 3.25Å; M893-R896 PolarHBondContact O-N 2.79Å; M893-L897 HydrophobicContact CG-CD1 4.22Å
894	L	95.2	Very high	94	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-63.2	-36.3	-174.7	-67.8	167.6	0	0	0	113.1	I890 A891 R896 L897 L900 L903 T915 V918 L919	I890-L894 HydrophobicContact CG2-CD1 3.97Å; I890-L894 VanDerWaalsContact O-CG 3.25Å; I890-L894 WeakPolarHBondContact O-CG 3.45Å; I890-L894 PolarHBondContact O-N 3.47Å; A891-L894 PolarHBondContact O-N 2.87Å; L894-R896 PolarHBondContact O-N 3.36Å; L894-L897 PolarHBondContact O-N 3.04Å; L894-L900 HydrophobicContact CD2-CD2 3.43Å; L894-L900 VanDerWaalsContact CD2-CD2 3.43Å; L894-L903 HydrophobicContact CD1-CD2 4.45Å; L894-L903 HydrophobicContact CD2-CD1 4.47Å; L894-L903 HydrophobicContact CD2-CD2 3.75Å; L894-T915 HydrophobicContact CD1-CG2 3.69Å; L894-V918 HydrophobicContact CB-CG1 3.74Å; L894-L919 HydrophobicContact CD1-CD2 3.73Å; L894-L919 HydrophobicContact CD1-CG 3.97Å; L894-L919 HydrophobicContact CD2-CD2 3.8Å; L894-L919 HydrophobicContact CG-CD2 4.26Å
895	R	95	Very high	94.3	Very high	117 Å²	117	47.4 Å²	47.4	44%	0.442	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-15.7	171.5	-70.8	-177.9	-169.1	116.4	4.5	114.5	A891 M893 V918	A891-R895 WeakPolarHBondContact O-CG 3.47Å; A891-R895 PolarHBondContact O-N 3.42Å; A891-R895 VanDerWaalsContact O-N 3.1Å; M893-R895 VanDerWaalsContact C-N 3.35Å; M893-R895 PolarHBondContact O-N 2.89Å; R895-V918 HydrophobicContact CG-CG1 3.67Å; R895-V918 HydrophobicContact CG-CG2 4.42Å; R895-V918 VanDerWaalsContact NH2-CG2 3.32Å
896	R	94.2	Very high	94.6	Very high	109 Å²	109	39.2 Å²	39.2	41%	0.411	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.4	-0.4	177.8	-60.7	-171.6	-177.4	-73.8	5.3	113.9	S864 A867 M893 L894 P898	S864-R896 WeakPolarHBondContact O-CD 3.47Å; S864-R896 PolarHBondContact OG-NE 2.98Å; A867-R896 HydrophobicContact CB-CB 3.78Å; M893-R896 WeakPolarHBondContact O-CB 3.25Å; M893-R896 PolarHBondContact O-N 2.79Å; L894-R896 PolarHBondContact O-N 3.36Å; R896-P898 WeakPolarHBondContact O-CD 3.36Å
897	L	94.9	Very high	94.7	Very high	1 Å²	1	34.2 Å²	34.2	1%	0.005	16%	0.157	C	C	.	.			trans	-117.7	66.9	-174.6	-59.5	-177.4	0	0	0	112.6	A867 C870 L873 V876 M893 L894 R899 L900	A867-L897 HydrophobicContact CB-CD1 4.27Å; A867-L897 HydrophobicContact CB-CD2 3.75Å; A867-L897 HydrophobicContact CB-CG 3.87Å; C870-L897 WeakPolarHBondContact O-CD2 3.2Å; L873-L897 HydrophobicContact CB-CD2 4.14Å; L873-L897 HydrophobicContact CD1-CD1 4.47Å; L873-L897 HydrophobicContact CD1-CD2 4.25Å; V876-L897 HydrophobicContact CG2-CD1 4.16Å; M893-L897 HydrophobicContact CG-CD1 4.22Å; L894-L897 PolarHBondContact O-N 3.04Å; L897-R899 PolarHBondContact O-N 2.63Å; L897-L900 HydrophobicContact CB-CB 4.18Å; L897-L900 VanDerWaalsContact O-CB 3.31Å; L897-L900 WeakPolarHBondContact O-CB 3.43Å; L897-L900 PolarHBondContact O-N 2.66Å
898	P	92.8	Very high	94.6	Very high	69 Å²	69	32.1 Å²	32.1	45%	0.448	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-13.5	-175.9	30.2	-37.1	0	0	0	114.4	R896	R896-P898 WeakPolarHBondContact O-CD 3.36Å
899	R	94.3	Very high	94.5	Very high	116 Å²	116	32 Å²	32	44%	0.438	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.1	6	176.3	-64.8	-171.6	-178.2	170.9	3.8	113.8	L897 R901	L897-R899 PolarHBondContact O-N 2.63Å; R899-R901 PolarHBondContact O-N 2.61Å
900	L	95.6	Very high	94.4	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	16%	0.164	C	C	.	.			trans	-64.7	123.5	-176.3	-168.7	66.1	0	0	0	110.8	V876 L894 L897 L903 C923 Q925 L926	V876-L900 HydrophobicContact CB-CD1 3.99Å; V876-L900 HydrophobicContact CG2-CD1 3.73Å; L894-L900 HydrophobicContact CD2-CD2 3.43Å; L894-L900 VanDerWaalsContact CD2-CD2 3.43Å; L897-L900 HydrophobicContact CB-CB 4.18Å; L897-L900 VanDerWaalsContact O-CB 3.31Å; L897-L900 WeakPolarHBondContact O-CB 3.43Å; L897-L900 PolarHBondContact O-N 2.66Å; L900-L903 HydrophobicContact CD2-CB 4.1Å; L900-L903 HydrophobicContact CD2-CD1 4.25Å; L900-L903 HydrophobicContact CD2-CD2 3.96Å; L900-L903 HydrophobicContact CD2-CG 4.33Å; L900-L903 HydrophobicContact CG-CB 4.48Å; L900-C923 HydrophobicContact CB-CB 4.43Å; L900-Q925 CarbonylContact O-C 3.53Å; L900-Q925 VanDerWaalsContact O-C 3.32Å; L900-L926 WeakPolarHBondContact O-CA 3.27Å; L900-L926 PolarHBondContact O-N 3.48Å
901	R	95.7	Very high	94.4	Very high	80 Å²	80	33.2 Å²	33.2	30%	0.302	16%	0.164	S	C	.	.			trans	-114.4	-33.5	-177.9	-71	171	63.2	-157.5	-1.8	112.4	E874 R899 Q925 E927 E928	E874-R901 HydrophobicContact CB-CB 4.5Å; E874-R901 CarbonylContact O-C 3.53Å; E874-R901 WeakPolarHBondContact O-CA 3.42Å; E874-R901 PolarHBondContact O-N 3.45Å; E874-R901 VanDerWaalsContact OE2-CD 3.29Å; E874-R901 WeakPolarHBondContact OE2-CD 3.32Å; E874-R901 IonicContact OE2-CZ 3.37Å; E874-R901 IonicContact OE2-NE 3.13Å; E874-R901 IonicContact OE2-NH1 2.7Å; E874-R901 PolarHBondContact OE2-NH1 2.03Å; R899-R901 PolarHBondContact O-N 2.61Å; R901-Q925 HydrophobicContact CG-CB 4.19Å; R901-Q925 WeakPolarHBondContact CG-O 3.46Å; R901-E927 HydrophobicContact CB-CG 4.15Å; R901-E927 HydrophobicContact CG-CG 4.26Å; R901-E927 IonicContact CZ-OE2 3.85Å; R901-E927 IonicContact NE-OE2 2.77Å; R901-E927 PolarHBondContact NE-OE2 3.43Å; R901-E927 VanDerWaalsContact NE-OE2 3.12Å; R901-E927 IonicContact NH2-OE2 3.72Å; R901-E927 PolarHBondContact NH2-OE2 2.96Å; R901-E927 CarbonylContact O-C 3.49Å; R901-E927 WeakPolarHBondContact O-CA 3.4Å; R901-E927 PolarHBondContact O-N 2.62Å; R901-E928 PolarHBondContact O-N 3.3Å
902	V	97	Very high	94.4	Very high	12 Å²	12	33.5 Å²	33.5	7%	0.073	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	123.1	-177.2	-179.8	0	0	0	0	109	W472 E874 E875 V876 E928	W472-V902 HydrophobicContact CH2-CG1 3.97Å; W472-V902 HydrophobicContact CZ2-CG1 3.4Å; E874-V902 PolarHBondContact O-N 3.36Å; E875-V902 WeakPolarHBondContact CA-O 3.47Å; E875-V902 HydrophobicContact CB-CB 4.09Å; E875-V902 HydrophobicContact CG-CB 4.04Å; E875-V902 HydrophobicContact CG-CG1 4.04Å; V876-V902 PolarHBondContact N-O 2.91Å; V902-E928 WeakPolarHBondContact CA-O 3.11Å; V902-E928 HydrophobicContact CG2-CB 4.4Å
903	L	97.2	Very high	94.5	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	125.5	-178.9	179.6	60.7	0	0	0	111.7	V876 L894 L900 L905 L919 L926 E928 L929 D930	V876-L903 HydrophobicContact CB-CD1 4.17Å; V876-L903 HydrophobicContact CG1-CD1 4.21Å; V876-L903 WeakPolarHBondContact O-CA 3.38Å; L894-L903 HydrophobicContact CD1-CD2 4.45Å; L894-L903 HydrophobicContact CD2-CD1 4.47Å; L894-L903 HydrophobicContact CD2-CD2 3.75Å; L900-L903 HydrophobicContact CD2-CB 4.1Å; L900-L903 HydrophobicContact CD2-CD1 4.25Å; L900-L903 HydrophobicContact CD2-CD2 3.96Å; L900-L903 HydrophobicContact CD2-CG 4.33Å; L900-L903 HydrophobicContact CG-CB 4.48Å; L903-L905 HydrophobicContact CD1-CD1 4.47Å; L903-L905 HydrophobicContact CD1-CD2 3.95Å; L903-L905 HydrophobicContact CD1-CG 3.94Å; L903-L905 HydrophobicContact CD2-CD1 3.89Å; L903-L905 HydrophobicContact CD2-CG 4.16Å; L903-L905 HydrophobicContact CG-CD1 4.22Å; L903-L905 HydrophobicContact CG-CD2 4.49Å; L903-L905 HydrophobicContact CG-CG 3.93Å; L903-L919 HydrophobicContact CD2-CD1 4.06Å; L903-L919 HydrophobicContact CD2-CD2 3.45Å; L903-L919 VanDerWaalsContact CD2-CD2 3.45Å; L903-L919 HydrophobicContact CD2-CG 4.37Å; L903-L926 HydrophobicContact CB-CD1 4.08Å; L903-E928 PolarHBondContact N-O 3.07Å; L903-L929 HydrophobicContact CB-CD1 3.98Å; L903-L929 HydrophobicContact CD2-CD1 3.83Å; L903-L929 HydrophobicContact CG-CD1 4.02Å; L903-L929 WeakPolarHBondContact O-CA 3.4Å; L903-D930 PolarHBondContact O-N 3.39Å
904	D	96.5	Very high	94.6	Very high	3 Å²	3	34.6 Å²	34.6	2%	0.016	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	110.4	173.7	176.2	16	0	0	0	111	R852 V876 V877 L878 A879 C906 D930	R852-D904 IonicContact CZ-OD2 3.25Å; R852-D904 IonicContact NE-OD2 3.78Å; R852-D904 IonicContact NH2-OD2 3.21Å; R852-D904 PolarHBondContact NH2-OD2 3.34Å; V876-D904 PolarHBondContact O-N 3.37Å; V877-D904 HydrophobicContact CB-CB 4.33Å; V877-D904 HydrophobicContact CG1-CB 4.06Å; V877-D904 WeakPolarHBondContact CG1-OD2 3.23Å; V877-D904 HydrophobicContact CG2-CB 4.09Å; L878-D904 PolarHBondContact N-O 2.94Å; A879-D904 WeakPolarHBondContact CB-OD2 3.14Å; A879-D904 PolarHBondContact N-O 3.26Å; D904-C906 WeakPolarHBondContact OD1-CB 3.19Å; D904-C906 PolarHBondContact OD1-N 3.14Å; D904-D930 HydrophobicContact CB-CB 4.36Å
905	L	96	Very high	94.6	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	18%	0.175	C	C	.	.			trans	-114.4	18.5	176.7	-62.5	177	0	0	0	111.7	L878 I890 L903 G907 L908 V911 T915 D930 V931	L878-L905 HydrophobicContact CB-CD2 4.18Å; L878-L905 HydrophobicContact CD1-CD2 4.17Å; I890-L905 HydrophobicContact CG2-CD1 4.1Å; I890-L905 HydrophobicContact CG2-CD2 4.17Å; L903-L905 HydrophobicContact CD1-CD1 4.47Å; L903-L905 HydrophobicContact CD1-CD2 3.95Å; L903-L905 HydrophobicContact CD1-CG 3.94Å; L903-L905 HydrophobicContact CD2-CD1 3.89Å; L903-L905 HydrophobicContact CD2-CG 4.16Å; L903-L905 HydrophobicContact CG-CD1 4.22Å; L903-L905 HydrophobicContact CG-CD2 4.49Å; L903-L905 HydrophobicContact CG-CG 3.93Å; L905-G907 PolarHBondContact O-N 3.41Å; L905-L908 HydrophobicContact CB-CD1 4.11Å; L905-L908 HydrophobicContact CD2-CD1 3.79Å; L905-L908 WeakPolarHBondContact O-CB 3.41Å; L905-L908 WeakPolarHBondContact O-CG 3.18Å; L905-L908 PolarHBondContact O-N 3.13Å; L905-V911 HydrophobicContact CB-CG2 4.27Å; L905-V911 HydrophobicContact CD1-CG1 4.13Å; L905-V911 HydrophobicContact CD1-CG2 4Å; L905-T915 HydrophobicContact CD1-CG2 3.92Å; L905-D930 PolarHBondContact N-O 3.16Å; L905-V931 HydrophobicContact CD1-CG1 4.48Å
906	C	94.7	Very high	94.6	Very high	9 Å²	9	29 Å²	29	6%	0.061	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.2	133.2	-173.5	-179	0	0	0	0	112.7	A879 N880 D904 L908 S932	A879-C906 CarbonylContact C-O 3.58Å; A879-C906 WeakPolarHBondContact CA-O 3.34Å; A879-C906 HydrophobicContact CB-CB 4.05Å; A879-C906 WeakPolarHBondContact CB-O 3.24Å; N880-C906 PolarHBondContact N-O 3.41Å; D904-C906 WeakPolarHBondContact OD1-CB 3.19Å; D904-C906 PolarHBondContact OD1-N 3.14Å; C906-L908 VanDerWaalsContact C-N 3.3Å; C906-L908 PolarHBondContact O-N 3.12Å; C906-S932 WeakPolarHBondContact CA-O 3.34Å
907	G	92.4	Very high	94.6	Very high	9 Å²	9	27.9 Å²	27.9	9%	0.093	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	74.8	9.3	179.7	0	0	0	0	0	115.6	L905 A909 S932	L905-G907 PolarHBondContact O-N 3.41Å; G907-A909 PolarHBondContact O-N 3.41Å; G907-S932 PolarHBondContact N-O 2.93Å
908	L	92.4	Very high	94.7	Very high	3 Å²	3	27.9 Å²	27.9	2%	0.016	15%	0.153	C	C	.	.			trans	-87.3	92.4	172.7	-63.5	-178.6	0	0	0	110.8	L878 M881 L884 I890 L905 C906 A910 V911 T934	L878-L908 HydrophobicContact CB-CD1 4.23Å; M881-L908 HydrophobicContact CB-CD2 4.14Å; M881-L908 WeakPolarHBondContact O-CD2 3.34Å; L884-L908 HydrophobicContact CD1-CD1 4.31Å; I890-L908 HydrophobicContact CD1-CD1 4.1Å; L905-L908 HydrophobicContact CB-CD1 4.11Å; L905-L908 HydrophobicContact CD2-CD1 3.79Å; L905-L908 WeakPolarHBondContact O-CB 3.41Å; L905-L908 WeakPolarHBondContact O-CG 3.18Å; L905-L908 PolarHBondContact O-N 3.13Å; C906-L908 VanDerWaalsContact C-N 3.3Å; C906-L908 PolarHBondContact O-N 3.12Å; L908-A910 PolarHBondContact O-N 2.91Å; L908-V911 HydrophobicContact CB-CB 4.39Å; L908-V911 HydrophobicContact CB-CG2 3.76Å; L908-V911 HydrophobicContact CD1-CG2 4.24Å; L908-V911 WeakPolarHBondContact O-CB 3.14Å; L908-V911 PolarHBondContact O-N 3.43Å; L908-T934 WeakPolarHBondContact O-CG2 3.36Å
909	A	90.1	Very high	94.7	Very high	73 Å²	73	24.7 Å²	24.7	60%	0.603	13%	0.132	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-18.7	177.8	0	0	0	0	0	114.2	G907 V911 S935	G907-A909 PolarHBondContact O-N 3.41Å; A909-V911 VanDerWaalsContact C-N 3.29Å; A909-V911 PolarHBondContact O-N 2.96Å; A909-S935 PolarHBondContact O-OG 3.44Å
910	A	91.3	Very high	94.7	Very high	23 Å²	23	19.7 Å²	19.7	19%	0.19	12%	0.116	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.6	-2.7	174.6	0	0	0	0	0	114.6	L884 E887 L908	L884-A910 VanDerWaalsContact O-CB 3.25Å; L884-A910 WeakPolarHBondContact O-CB 2.98Å; E887-A910 WeakPolarHBondContact CA-O 3.5Å; E887-A910 VanDerWaalsContact CB-O 3.22Å; E887-A910 WeakPolarHBondContact CB-O 3.16Å; L908-A910 PolarHBondContact O-N 2.91Å
911	V	94.5	Very high	94.6	Very high	1 Å²	1	24.7 Å²	24.7	1%	0.006	15%	0.147	C	C	.	.			trans	-92.4	130.1	174.6	169.8	0	0	0	0	109.1	I890 L905 L908 A909 T915 V931 T934 S935 V936	I890-V911 HydrophobicContact CD1-CG2 3.48Å; I890-V911 VanDerWaalsContact CD1-CG2 3.48Å; I890-V911 HydrophobicContact CG2-CG2 4.44Å; L905-V911 HydrophobicContact CB-CG2 4.27Å; L905-V911 HydrophobicContact CD1-CG1 4.13Å; L905-V911 HydrophobicContact CD1-CG2 4Å; L908-V911 HydrophobicContact CB-CB 4.39Å; L908-V911 HydrophobicContact CB-CG2 3.76Å; L908-V911 HydrophobicContact CD1-CG2 4.24Å; L908-V911 WeakPolarHBondContact O-CB 3.14Å; L908-V911 PolarHBondContact O-N 3.43Å; A909-V911 VanDerWaalsContact C-N 3.29Å; A909-V911 PolarHBondContact O-N 2.96Å; V911-T915 HydrophobicContact CG1-CG2 3.95Å; V911-V931 HydrophobicContact CG1-CG1 4.39Å; V911-T934 HydrophobicContact CB-CG2 3.88Å; V911-T934 HydrophobicContact CG1-CG2 4Å; V911-T934 WeakPolarHBondContact O-CB 3.35Å; V911-S935 CarbonylContact O-C 3.6Å; V911-S935 VanDerWaalsContact O-CA 3.31Å; V911-S935 WeakPolarHBondContact O-CA 3.42Å; V911-S935 WeakPolarHBondContact O-CB 3.17Å; V911-S935 PolarHBondContact O-N 2.77Å; V911-V936 HydrophobicContact CG1-CG2 4.08Å
912	G	95	Very high	94.4	Very high	6 Å²	6	22.2 Å²	22.2	6%	0.062	14%	0.141	C	C	.	.			trans	-149.1	-149.2	-179.3	0	0	0	0	0	111.7	E887 L914 T915 M916	E887-G912 VanDerWaalsContact OE1-CA 3.23Å; E887-G912 WeakPolarHBondContact OE1-CA 3.4Å; E887-G912 PolarHBondContact OE1-N 3.35Å; E887-G912 VanDerWaalsContact OE1-O 3.05Å; G912-L914 PolarHBondContact O-N 3.3Å; G912-T915 WeakPolarHBondContact O-CB 3.28Å; G912-T915 PolarHBondContact O-N 3.16Å; G912-M916 PolarHBondContact O-N 2.94Å
913	D	95.4	Very high	94.3	Very high	36 Å²	36	21.8 Å²	21.8	19%	0.193	14%	0.139	C	C	.	.	H	α-helix	trans	-70.8	-30	-168.3	-61.1	-33.5	0	0	0	113.6	M916 E917 T937 K939 G940	D913-M916 WeakPolarHBondContact O-CB 3.38Å; D913-M916 PolarHBondContact O-N 3.26Å; D913-E917 PolarHBondContact O-N 2.89Å; D913-T937 VanDerWaalsContact CG-OG1 3.28Å; D913-T937 PolarHBondContact OD1-N 3Å; D913-T937 PolarHBondContact OD1-OG1 3.36Å; D913-T937 VanDerWaalsContact OD1-OG1 3.09Å; D913-T937 PolarHBondContact OD2-OG1 2.8Å; D913-K939 HydrophobicContact CB-CB 4.37Å; D913-G940 VanDerWaalsContact CG-N 3.31Å; D913-G940 WeakPolarHBondContact OD1-CA 3.35Å; D913-G940 PolarHBondContact OD1-N 3.42Å
914	L	95.6	Very high	94	Very high	59 Å²	59	24.7 Å²	24.7	31%	0.309	16%	0.158	S	C	.	.	H	α-helix	trans	-68.5	-34	176.9	170	66.6	0	0	0	111.8	E887 G912 M916 E917 V918	E887-L914 HydrophobicContact CG-CB 4.39Å; E887-L914 HydrophobicContact CG-CD2 4.47Å; E887-L914 PolarHBondContact OE1-N 3.21Å; G912-L914 PolarHBondContact O-N 3.3Å; L914-M916 VanDerWaalsContact C-N 3.27Å; L914-M916 PolarHBondContact O-N 3.36Å; L914-E917 PolarHBondContact O-N 2.95Å; L914-V918 HydrophobicContact CD1-CG2 4.48Å; L914-V918 WeakPolarHBondContact O-CG2 2.96Å; L914-V918 PolarHBondContact O-N 3.03Å
915	T	95.8	Very high	93.8	Very high	0 Å²	0	29 Å²	29	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-61.6	-41.9	172.1	-54.7	0	0	0	0	110	E887 I890 L894 L905 V911 G912 V918 L919	E887-T915 WeakPolarHBondContact CG-OG1 3.36Å; E887-T915 WeakPolarHBondContact OE1-CB 3.03Å; E887-T915 PolarHBondContact OE1-N 2.89Å; E887-T915 PolarHBondContact OE1-OG1 2.9Å; I890-T915 HydrophobicContact CG2-CG2 4.06Å; L894-T915 HydrophobicContact CD1-CG2 3.69Å; L905-T915 HydrophobicContact CD1-CG2 3.92Å; V911-T915 HydrophobicContact CG1-CG2 3.95Å; G912-T915 WeakPolarHBondContact O-CB 3.28Å; G912-T915 PolarHBondContact O-N 3.16Å; T915-V918 PolarHBondContact O-N 2.76Å; T915-L919 HydrophobicContact CG2-CD1 4.27Å; T915-L919 WeakPolarHBondContact O-CG 3.19Å; T915-L919 PolarHBondContact O-N 2.71Å
916	M	95.4	Very high	93.7	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-70.1	-39.2	179.9	-56.3	-60.6	-62.4	0	0	112.4	G912 D913 L914 V918 L919 A920 L929 V931 V936 G940 L941 L944	G912-M916 PolarHBondContact O-N 2.94Å; D913-M916 WeakPolarHBondContact O-CB 3.38Å; D913-M916 PolarHBondContact O-N 3.26Å; L914-M916 VanDerWaalsContact C-N 3.27Å; L914-M916 PolarHBondContact O-N 3.36Å; M916-V918 VanDerWaalsContact C-N 3.29Å; M916-V918 PolarHBondContact O-N 3.3Å; M916-L919 PolarHBondContact O-N 3.41Å; M916-L919 HydrophobicContact SD-CD1 4.05Å; M916-A920 WeakPolarHBondContact O-CB 3.36Å; M916-A920 PolarHBondContact O-N 3.18Å; M916-L929 HydrophobicContact CE-CD2 3.82Å; M916-L929 HydrophobicContact SD-CD2 4.35Å; M916-V931 HydrophobicContact SD-CG1 3.99Å; M916-V931 HydrophobicContact SD-CG2 4.31Å; M916-V936 HydrophobicContact CG-CG1 3.85Å; M916-V936 HydrophobicContact CG-CG2 3.78Å; M916-V936 HydrophobicContact SD-CG1 4.3Å; M916-V936 HydrophobicContact SD-CG2 3.96Å; M916-G940 WeakPolarHBondContact CB-O 3.43Å; M916-L941 HydrophobicContact CE-CD2 4.09Å; M916-L944 HydrophobicContact CE-CD1 3.47Å; M916-L944 VanDerWaalsContact CE-CD1 3.47Å; M916-L944 HydrophobicContact CE-CD2 4.21Å; M916-L944 HydrophobicContact CE-CG 3.77Å
917	E	95.2	Very high	93.7	Very high	85 Å²	85	30.7 Å²	30.7	40%	0.397	19%	0.185	S	C	.	.	H	α-helix	trans	-56.2	-43.5	169.7	-177.5	-175.4	-170.8	0	0	111.7	D913 L914 T921 H943	D913-E917 PolarHBondContact O-N 2.89Å; L914-E917 PolarHBondContact O-N 2.95Å; E917-T921 WeakPolarHBondContact O-CG2 3.42Å; E917-T921 PolarHBondContact O-N 2.98Å; E917-T921 VanDerWaalsContact O-N 3.09Å; E917-T921 PolarHBondContact O-OG1 3.48Å; E917-H943 HydrophobicContact CB-CB 4.5Å
918	V	95	Very high	93.9	Very high	2 Å²	2	33 Å²	33	1%	0.012	19%	0.194	C	C	.	.	H	α-helix	trans	-70.8	-40.4	178.2	169.2	0	0	0	0	112.3	A891 L894 R895 L914 T915 M916 A920 T921 S922	A891-V918 HydrophobicContact CB-CG2 4.05Å; A891-V918 WeakPolarHBondContact O-CG1 2.96Å; L894-V918 HydrophobicContact CB-CG1 3.74Å; R895-V918 HydrophobicContact CG-CG1 3.67Å; R895-V918 HydrophobicContact CG-CG2 4.42Å; R895-V918 VanDerWaalsContact NH2-CG2 3.32Å; L914-V918 HydrophobicContact CD1-CG2 4.48Å; L914-V918 WeakPolarHBondContact O-CG2 2.96Å; L914-V918 PolarHBondContact O-N 3.03Å; T915-V918 PolarHBondContact O-N 2.76Å; M916-V918 VanDerWaalsContact C-N 3.29Å; M916-V918 PolarHBondContact O-N 3.3Å; V918-A920 VanDerWaalsContact C-N 3.34Å; V918-A920 PolarHBondContact O-N 3.34Å; V918-T921 WeakPolarHBondContact CA-OG1 3.1Å; V918-T921 PolarHBondContact O-N 3.34Å; V918-T921 PolarHBondContact O-OG1 3.02Å; V918-S922 WeakPolarHBondContact O-CA 3.47Å; V918-S922 WeakPolarHBondContact O-CB 3.49Å; V918-S922 PolarHBondContact O-N 3.23Å; V918-S922 PolarHBondContact O-OG 3.18Å; V918-S922 VanDerWaalsContact O-OG 3.05Å
919	L	94.6	Very high	94.1	Very high	2 Å²	2	32.9 Å²	32.9	1%	0.01	19%	0.193	C	C	.	.	H	α-helix	trans	-60.2	-46.7	174.4	-73.1	170.4	0	0	0	111.4	L894 L903 T915 M916 T921 C923 L926 L929	L894-L919 HydrophobicContact CD1-CD2 3.73Å; L894-L919 HydrophobicContact CD1-CG 3.97Å; L894-L919 HydrophobicContact CD2-CD2 3.8Å; L894-L919 HydrophobicContact CG-CD2 4.26Å; L903-L919 HydrophobicContact CD2-CD1 4.06Å; L903-L919 HydrophobicContact CD2-CD2 3.45Å; L903-L919 VanDerWaalsContact CD2-CD2 3.45Å; L903-L919 HydrophobicContact CD2-CG 4.37Å; T915-L919 HydrophobicContact CG2-CD1 4.27Å; T915-L919 WeakPolarHBondContact O-CG 3.19Å; T915-L919 PolarHBondContact O-N 2.71Å; M916-L919 PolarHBondContact O-N 3.41Å; M916-L919 HydrophobicContact SD-CD1 4.05Å; L919-T921 VanDerWaalsContact C-N 3.3Å; L919-T921 PolarHBondContact O-N 3.13Å; L919-C923 HydrophobicContact CD2-CB 4.36Å; L919-C923 PolarHBondContact O-N 2.69Å; L919-L926 HydrophobicContact CD2-CD2 4.26Å; L919-L929 HydrophobicContact CD1-CD1 3.88Å; L919-L929 HydrophobicContact CD1-CD2 3.99Å
920	A	93	Very high	94.4	Very high	11 Å²	11	29.7 Å²	29.7	9%	0.091	17%	0.165	C	C	.	.	H	α-helix	trans	-57	-41.1	177.3	0	0	0	0	0	112.6	M916 V918 H943 L944 A947	M916-A920 WeakPolarHBondContact O-CB 3.36Å; M916-A920 PolarHBondContact O-N 3.18Å; V918-A920 VanDerWaalsContact C-N 3.34Å; V918-A920 PolarHBondContact O-N 3.34Å; A920-H943 HydrophobicContact CB-CB 4.05Å; A920-H943 WeakPolarHBondContact CB-O 3.44Å; A920-L944 HydrophobicContact CB-CD2 4.32Å; A920-A947 HydrophobicContact CB-CB 3.58Å; A920-A947 VanDerWaalsContact O-CB 3.24Å; A920-A947 WeakPolarHBondContact O-CB 3.41Å
921	T	93	Very high	94.6	Very high	105 Å²	105	28.6 Å²	28.6	64%	0.644	16%	0.156	S	C	*	.	H	α-helix	trans	-89.3	-28.3	-177.1	50.7	0	0	0	0	114.7	E917 V918 L919	E917-T921 WeakPolarHBondContact O-CG2 3.42Å; E917-T921 PolarHBondContact O-N 2.98Å; E917-T921 VanDerWaalsContact O-N 3.09Å; E917-T921 PolarHBondContact O-OG1 3.48Å; V918-T921 WeakPolarHBondContact CA-OG1 3.1Å; V918-T921 PolarHBondContact O-N 3.34Å; V918-T921 PolarHBondContact O-OG1 3.02Å; L919-T921 VanDerWaalsContact C-N 3.3Å; L919-T921 PolarHBondContact O-N 3.13Å
922	S	93.2	Very high	94.6	Very high	27 Å²	27	28.9 Å²	28.9	19%	0.189	16%	0.158	C	C	.	.	H	α-helix	trans	-111.9	-20.4	-167.1	-50.9	0	0	0	0	115	V918 P924	V918-S922 WeakPolarHBondContact O-CA 3.47Å; V918-S922 WeakPolarHBondContact O-CB 3.49Å; V918-S922 PolarHBondContact O-N 3.23Å; V918-S922 PolarHBondContact O-OG 3.18Å; V918-S922 VanDerWaalsContact O-OG 3.05Å; S922-P924 VanDerWaalsContact C-CD 3.41Å; S922-P924 VanDerWaalsContact O-CD 3.25Å; S922-P924 WeakPolarHBondContact O-CD 3.3Å
923	C	93.7	Very high	94.5	Very high	4 Å²	4	29.8 Å²	29.8	3%	0.027	16%	0.164	C	C	.	.			trans	-120.7	63.9	-172.4	-60.5	0	0	0	0	112.4	L900 L919 Q925 L926	L900-C923 HydrophobicContact CB-CB 4.43Å; L919-C923 HydrophobicContact CD2-CB 4.36Å; L919-C923 PolarHBondContact O-N 2.69Å; C923-Q925 PolarHBondContact O-N 2.73Å; C923-L926 HydrophobicContact CB-CB 4.4Å; C923-L926 VanDerWaalsContact O-CB 3.31Å; C923-L926 WeakPolarHBondContact O-CB 3.2Å; C923-L926 PolarHBondContact O-N 2.93Å; C923-L926 VanDerWaalsContact O-N 3.1Å
924	P	90.7	Very high	94.5	Very high	60 Å²	60	28.5 Å²	28.5	39%	0.39	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-9.6	-174.3	30.1	-37.6	0	0	0	114.4	S922 P948 C951	S922-P924 VanDerWaalsContact C-CD 3.41Å; S922-P924 VanDerWaalsContact O-CD 3.25Å; S922-P924 WeakPolarHBondContact O-CD 3.3Å; P924-P948 HydrophobicContact CB-CG 4.45Å; P924-C951 PolarHBondContact O-SG 3.25Å
925	Q	92.4	Very high	94.4	Very high	94 Å²	94	29 Å²	29	44%	0.439	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.5	3.6	177	-61.4	-166.7	-34.2	0	0	113.4	L900 R901 C923 E927	L900-Q925 CarbonylContact O-C 3.53Å; L900-Q925 VanDerWaalsContact O-C 3.32Å; R901-Q925 HydrophobicContact CG-CB 4.19Å; R901-Q925 WeakPolarHBondContact CG-O 3.46Å; C923-Q925 PolarHBondContact O-N 2.73Å; Q925-E927 WeakPolarHBondContact O-CG 3.43Å; Q925-E927 PolarHBondContact O-N 3.43Å
926	L	94.5	Very high	94.4	Very high	12 Å²	12	29 Å²	29	6%	0.063	17%	0.166	C	C	.	.			trans	-60.6	119.3	-176.2	-169	66.2	0	0	0	111.6	L900 L903 L919 C923 L929 C951 L952	L900-L926 WeakPolarHBondContact O-CA 3.27Å; L900-L926 PolarHBondContact O-N 3.48Å; L903-L926 HydrophobicContact CB-CD1 4.08Å; L919-L926 HydrophobicContact CD2-CD2 4.26Å; C923-L926 HydrophobicContact CB-CB 4.4Å; C923-L926 VanDerWaalsContact O-CB 3.31Å; C923-L926 WeakPolarHBondContact O-CB 3.2Å; C923-L926 PolarHBondContact O-N 2.93Å; C923-L926 VanDerWaalsContact O-N 3.1Å; L926-L929 HydrophobicContact CD2-CB 4.16Å; L926-L929 HydrophobicContact CD2-CD1 4.33Å; L926-L929 HydrophobicContact CD2-CD2 4.14Å; L926-L929 HydrophobicContact CD2-CG 4.45Å; L926-C951 CarbonylContact O-C 3.57Å; L926-C951 VanDerWaalsContact O-CB 3.29Å; L926-C951 WeakPolarHBondContact O-CB 3.43Å; L926-L952 HydrophobicContact CG-CD1 4.33Å; L926-L952 WeakPolarHBondContact O-CA 3.16Å; L926-L952 PolarHBondContact O-N 3.25Å; L926-L952 VanDerWaalsContact O-N 3.13Å
927	E	94.9	Very high	94.3	Very high	32 Å²	32	30 Å²	30	15%	0.15	17%	0.172	C	C	.	.			trans	-108.2	-36.4	-177.7	-50.1	-159.6	114.3	0	0	112	R901 Q925 K953 C954	R901-E927 HydrophobicContact CB-CG 4.15Å; R901-E927 HydrophobicContact CG-CG 4.26Å; R901-E927 IonicContact CZ-OE2 3.85Å; R901-E927 IonicContact NE-OE2 2.77Å; R901-E927 PolarHBondContact NE-OE2 3.43Å; R901-E927 VanDerWaalsContact NE-OE2 3.12Å; R901-E927 IonicContact NH2-OE2 3.72Å; R901-E927 PolarHBondContact NH2-OE2 2.96Å; R901-E927 CarbonylContact O-C 3.49Å; R901-E927 WeakPolarHBondContact O-CA 3.4Å; R901-E927 PolarHBondContact O-N 2.62Å; Q925-E927 WeakPolarHBondContact O-CG 3.43Å; Q925-E927 PolarHBondContact O-N 3.43Å; E927-K953 HydrophobicContact CB-CD 4.27Å; E927-K953 HydrophobicContact CB-CG 4.5Å; E927-K953 WeakPolarHBondContact O-CA 3.26Å; E927-K953 WeakPolarHBondContact O-CB 3.2Å; E927-K953 PolarHBondContact O-N 2.95Å; E927-K953 WeakPolarHBondContact OE1-CE 3.39Å; E927-K953 IonicContact OE1-NZ 2.87Å; E927-K953 PolarHBondContact OE1-NZ 3Å; E927-K953 IonicContact OE2-NZ 2.68Å; E927-K953 PolarHBondContact OE2-NZ 3.42Å; E927-C954 PolarHBondContact O-N 2.9Å; E927-C954 VanDerWaalsContact O-N 3.12Å
928	E	96	Very high	94.3	Very high	59 Å²	59	29.7 Å²	29.7	28%	0.276	17%	0.17	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	124.9	-179.6	-51.5	-166.3	-170.7	0	0	111.2	W472 R901 V902 L903 C954	W472-E928 HydrophobicContact CH2-CB 3.72Å; W472-E928 HydrophobicContact CZ3-CB 4.14Å; W472-E928 WeakPolarHBondContact CZ3-OE2 3.42Å; R901-E928 PolarHBondContact O-N 3.3Å; V902-E928 WeakPolarHBondContact CA-O 3.11Å; V902-E928 HydrophobicContact CG2-CB 4.4Å; L903-E928 PolarHBondContact N-O 3.07Å; E928-C954 WeakPolarHBondContact CA-O 3.29Å; E928-C954 HydrophobicContact CB-CB 4.11Å; E928-C954 HydrophobicContact CG-CB 3.88Å
929	L	96.3	Very high	94.2	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	130.7	-177.4	-179.8	62.3	0	0	0	111.7	L903 M916 L919 L926 V931 L944 L952 C954 L955 R956	L903-L929 HydrophobicContact CB-CD1 3.98Å; L903-L929 HydrophobicContact CD2-CD1 3.83Å; L903-L929 HydrophobicContact CG-CD1 4.02Å; L903-L929 WeakPolarHBondContact O-CA 3.4Å; M916-L929 HydrophobicContact CE-CD2 3.82Å; M916-L929 HydrophobicContact SD-CD2 4.35Å; L919-L929 HydrophobicContact CD1-CD1 3.88Å; L919-L929 HydrophobicContact CD1-CD2 3.99Å; L926-L929 HydrophobicContact CD2-CB 4.16Å; L926-L929 HydrophobicContact CD2-CD1 4.33Å; L926-L929 HydrophobicContact CD2-CD2 4.14Å; L926-L929 HydrophobicContact CD2-CG 4.45Å; L929-V931 HydrophobicContact CD1-CG1 3.91Å; L929-V931 HydrophobicContact CD2-CG1 4.3Å; L929-V931 HydrophobicContact CG-CG1 4.08Å; L929-L944 HydrophobicContact CD2-CD1 4.39Å; L929-L952 HydrophobicContact CB-CD1 4.09Å; L929-C954 PolarHBondContact N-O 3.42Å; L929-L955 HydrophobicContact CB-CD1 4.11Å; L929-L955 HydrophobicContact CD2-CD1 3.98Å; L929-L955 HydrophobicContact CG-CD1 4.19Å; L929-L955 CarbonylContact O-C 3.44Å; L929-L955 WeakPolarHBondContact O-CA 3.41Å; L929-R956 PolarHBondContact O-N 2.9Å
930	D	96	Very high	94.2	Very high	5 Å²	5	36.3 Å²	36.3	3%	0.027	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	112.4	168.3	-152.1	-37.8	0	0	0	110.7	L903 D904 L905 S932 R956	L903-D930 PolarHBondContact O-N 3.39Å; D904-D930 HydrophobicContact CB-CB 4.36Å; L905-D930 PolarHBondContact N-O 3.16Å; D930-S932 WeakPolarHBondContact OD1-CB 3.35Å; D930-S932 PolarHBondContact OD1-N 3.15Å; D930-S932 PolarHBondContact OD1-OG 3.16Å; D930-R956 HydrophobicContact CB-CB 4.3Å; D930-R956 HydrophobicContact CB-CG 4.42Å; D930-R956 WeakPolarHBondContact OD1-CB 3.43Å; D930-R956 WeakPolarHBondContact OD2-CD 3.38Å; D930-R956 WeakPolarHBondContact OD2-CG 3.43Å; D930-R956 IonicContact OD2-CZ 3.07Å; D930-R956 IonicContact OD2-NE 3.67Å; D930-R956 IonicContact OD2-NH1 3.72Å; D930-R956 PolarHBondContact OD2-NH1 3.2Å
931	V	96	Very high	94.2	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	19%	0.194	C	C	.	.			trans	-121.8	27.7	170.8	-65.5	0	0	0	0	110.5	L905 V911 M916 L929 T934 V936 R956 I957 C960	L905-V931 HydrophobicContact CD1-CG1 4.48Å; V911-V931 HydrophobicContact CG1-CG1 4.39Å; M916-V931 HydrophobicContact SD-CG1 3.99Å; M916-V931 HydrophobicContact SD-CG2 4.31Å; L929-V931 HydrophobicContact CD1-CG1 3.91Å; L929-V931 HydrophobicContact CD2-CG1 4.3Å; L929-V931 HydrophobicContact CG-CG1 4.08Å; V931-T934 HydrophobicContact CB-CG2 4.17Å; V931-T934 WeakPolarHBondContact O-CB 3.37Å; V931-T934 WeakPolarHBondContact O-CG2 3.42Å; V931-T934 PolarHBondContact O-OG1 2.65Å; V931-V936 HydrophobicContact CB-CG2 4.27Å; V931-V936 HydrophobicContact CG2-CG2 4.33Å; V931-R956 PolarHBondContact N-O 3.43Å; V931-I957 HydrophobicContact CG2-CG2 3.98Å; V931-C960 PolarHBondContact O-SG 2.98Å
932	S	94.8	Very high	94.2	Very high	7 Å²	7	35.1 Å²	35.1	5%	0.049	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.1	141.3	178.2	-52.8	0	0	0	0	111.2	C906 G907 D930 T934 R956 S958	C906-S932 WeakPolarHBondContact CA-O 3.34Å; G907-S932 PolarHBondContact N-O 2.93Å; D930-S932 WeakPolarHBondContact OD1-CB 3.35Å; D930-S932 PolarHBondContact OD1-N 3.15Å; D930-S932 PolarHBondContact OD1-OG 3.16Å; S932-T934 VanDerWaalsContact C-N 3.25Å; S932-T934 PolarHBondContact O-N 3.29Å; S932-R956 VanDerWaalsContact OG-CB 3.28Å; S932-R956 WeakPolarHBondContact OG-CB 3.48Å; S932-S958 CarbonylContact C-O 3.54Å; S932-S958 VanDerWaalsContact CA-O 3.27Å; S932-S958 WeakPolarHBondContact CA-O 3.29Å; S932-S958 WeakPolarHBondContact CB-O 3.46Å; S932-S958 PolarHBondContact OG-N 3.48Å
933	C	93.2	Very high	94.2	Very high	25 Å²	25	36.8 Å²	36.8	17%	0.169	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.6	34.7	177.6	-48.2	0	0	0	0	113.9	Y492 S958	Y492-C933 HydrophobicContact CE1-CB 3.98Å; Y492-C933 WeakPolarHBondContact OH-CB 3.44Å; Y492-C933 PolarHBondContact OH-SG 3.47Å; C933-S958 PolarHBondContact N-O 3.18Å
934	T	94.4	Very high	94	Very high	10 Å²	10	36.8 Å²	36.8	6%	0.061	19%	0.187	C	C	.	.	S	Bend	trans	-103.7	-173.7	172.3	65.7	0	0	0	0	110.7	L908 V911 V931 S932 V936	L908-T934 WeakPolarHBondContact O-CG2 3.36Å; V911-T934 HydrophobicContact CB-CG2 3.88Å; V911-T934 HydrophobicContact CG1-CG2 4Å; V911-T934 WeakPolarHBondContact O-CB 3.35Å; V931-T934 HydrophobicContact CB-CG2 4.17Å; V931-T934 WeakPolarHBondContact O-CB 3.37Å; V931-T934 WeakPolarHBondContact O-CG2 3.42Å; V931-T934 PolarHBondContact O-OG1 2.65Å; S932-T934 VanDerWaalsContact C-N 3.25Å; S932-T934 PolarHBondContact O-N 3.29Å; T934-V936 WeakPolarHBondContact OG1-CG2 3.4Å; T934-V936 PolarHBondContact OG1-N 3.36Å
935	S	94.5	Very high	93.9	Very high	70 Å²	70	35 Å²	35	49%	0.49	18%	0.175	S	C	.	.	S	Bend	trans	-94.8	15.5	174.8	-54.7	0	0	0	0	113.7	A909 V911	A909-S935 PolarHBondContact O-OG 3.44Å; V911-S935 CarbonylContact O-C 3.6Å; V911-S935 VanDerWaalsContact O-CA 3.31Å; V911-S935 WeakPolarHBondContact O-CA 3.42Å; V911-S935 WeakPolarHBondContact O-CB 3.17Å; V911-S935 PolarHBondContact O-N 2.77Å
936	V	95.1	Very high	93.2	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	18%	0.182	C	C	.	.			trans	-63.9	134.8	176.2	172.9	0	0	0	0	110.8	V911 M916 V931 T934 L941	V911-V936 HydrophobicContact CG1-CG2 4.08Å; M916-V936 HydrophobicContact CG-CG1 3.85Å; M916-V936 HydrophobicContact CG-CG2 3.78Å; M916-V936 HydrophobicContact SD-CG1 4.3Å; M916-V936 HydrophobicContact SD-CG2 3.96Å; V931-V936 HydrophobicContact CB-CG2 4.27Å; V931-V936 HydrophobicContact CG2-CG2 4.33Å; T934-V936 WeakPolarHBondContact OG1-CG2 3.4Å; T934-V936 PolarHBondContact OG1-N 3.36Å; V936-L941 HydrophobicContact CG1-CD2 4.1Å; V936-L941 HydrophobicContact CG1-CG 4.42Å
937	T	94.6	Very high	92.2	Very high	21 Å²	21	36.2 Å²	36.2	13%	0.129	19%	0.188	C	C	.	.			trans	-112.7	-178.1	177.5	81.6	0	0	0	0	111.6	D913 K939 G940 L941	D913-T937 VanDerWaalsContact CG-OG1 3.28Å; D913-T937 PolarHBondContact OD1-N 3Å; D913-T937 PolarHBondContact OD1-OG1 3.36Å; D913-T937 VanDerWaalsContact OD1-OG1 3.09Å; D913-T937 PolarHBondContact OD2-OG1 2.8Å; T937-K939 PolarHBondContact O-N 2.97Å; T937-K939 PolarHBondContact OG1-N 3.49Å; T937-G940 PolarHBondContact O-N 3.36Å; T937-G940 VanDerWaalsContact O-N 3.17Å; T937-L941 PolarHBondContact O-N 2.94Å
938	Q	93.7	Very high	90.6	Very high	77 Å²	77	38.4 Å²	38.4	36%	0.36	21%	0.205	S	C	.	.	H	α-helix	trans	-57.4	-23.6	169.5	57.9	-178.8	-15	0	0	113.6	F942 E962 T964 V967	Q938-F942 WeakPolarHBondContact O-CB 3.5Å; Q938-F942 PolarHBondContact O-N 2.91Å; Q938-E962 VanDerWaalsContact CB-O 3.29Å; Q938-E962 WeakPolarHBondContact CB-O 3.47Å; Q938-E962 VanDerWaalsContact CG-O 3.24Å; Q938-E962 WeakPolarHBondContact CG-O 3.16Å; Q938-E962 PolarHBondContact N-O 2.87Å; Q938-T964 PolarHBondContact OE1-OG1 3.5Å; Q938-V967 HydrophobicContact CB-CB 4.14Å; Q938-V967 HydrophobicContact CB-CG1 3.78Å; Q938-V967 HydrophobicContact CB-CG2 4.35Å; Q938-V967 WeakPolarHBondContact O-CG2 3.41Å
939	K	93.8	Very high	89.2	Confident	143 Å²	143	36.3 Å²	36.3	62%	0.622	20%	0.198	S	C	*	.	H	α-helix	trans	-67.2	-48.1	174.3	-60	172.1	-176.5	169.4	0	110.4	D913 T937 L941 F942 H943	D913-K939 HydrophobicContact CB-CB 4.37Å; T937-K939 PolarHBondContact O-N 2.97Å; T937-K939 PolarHBondContact OG1-N 3.49Å; K939-L941 VanDerWaalsContact C-N 3.34Å; K939-L941 PolarHBondContact O-N 3.2Å; K939-F942 WeakPolarHBondContact O-CA 3.44Å; K939-F942 WeakPolarHBondContact O-CB 3.37Å; K939-F942 PolarHBondContact O-N 3.41Å; K939-H943 PolarHBondContact O-CD2 3.41Å; K939-H943 PolarHBondContact O-N 3.13Å; K939-H943 VanDerWaalsContact O-N 3.14Å
940	G	94	Very high	88.2	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-56.8	-45.3	175.8	0	0	0	0	0	112.3	D913 M916 T937 F942 H943	D913-G940 VanDerWaalsContact CG-N 3.31Å; D913-G940 WeakPolarHBondContact OD1-CA 3.35Å; D913-G940 PolarHBondContact OD1-N 3.42Å; M916-G940 WeakPolarHBondContact CB-O 3.43Å; T937-G940 PolarHBondContact O-N 3.36Å; T937-G940 VanDerWaalsContact O-N 3.17Å; G940-F942 VanDerWaalsContact C-N 3.31Å; G940-F942 PolarHBondContact O-N 2.94Å; G940-H943 PolarHBondContact O-N 3.19Å
941	L	93.7	Very high	87.9	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-64.7	-33.4	174.4	-61.1	-166.1	0	0	0	112.9	M916 V936 T937 K939 H943 L944 I957 I963 V967 L968 L971	M916-L941 HydrophobicContact CE-CD2 4.09Å; V936-L941 HydrophobicContact CG1-CD2 4.1Å; V936-L941 HydrophobicContact CG1-CG 4.42Å; T937-L941 PolarHBondContact O-N 2.94Å; K939-L941 VanDerWaalsContact C-N 3.34Å; K939-L941 PolarHBondContact O-N 3.2Å; L941-H943 VanDerWaalsContact C-N 3.3Å; L941-H943 PolarHBondContact O-N 2.86Å; L941-L944 WeakPolarHBondContact O-CB 3.47Å; L941-L944 PolarHBondContact O-N 3.22Å; L941-L944 VanDerWaalsContact O-N 3.14Å; L941-I957 HydrophobicContact CD1-CD1 4.02Å; L941-I957 HydrophobicContact CD1-CG2 4.33Å; L941-I957 HydrophobicContact CD2-CG2 3.86Å; L941-I963 HydrophobicContact CD1-CD1 3.7Å; L941-I963 HydrophobicContact CD1-CG1 4.25Å; L941-I963 HydrophobicContact CD1-CG2 3.88Å; L941-I963 HydrophobicContact CG-CD1 4.04Å; L941-V967 HydrophobicContact CB-CG2 3.76Å; L941-L968 HydrophobicContact CD1-CD2 4.05Å; L941-L971 HydrophobicContact CB-CD1 3.98Å; L941-L971 HydrophobicContact CD2-CD1 4.36Å
942	F	92.9	Very high	87.7	Confident	92 Å²	92	40.8 Å²	40.8	40%	0.404	23%	0.226	S	C	.	.	H	α-helix	trans	-66.7	-26.6	175.4	-167.2	-110.3	0	0	0	113.3	Q938 K939 G940 L944 T945 N946 V967 K970	Q938-F942 WeakPolarHBondContact O-CB 3.5Å; Q938-F942 PolarHBondContact O-N 2.91Å; K939-F942 WeakPolarHBondContact O-CA 3.44Å; K939-F942 WeakPolarHBondContact O-CB 3.37Å; K939-F942 PolarHBondContact O-N 3.41Å; G940-F942 VanDerWaalsContact C-N 3.31Å; G940-F942 PolarHBondContact O-N 2.94Å; F942-L944 VanDerWaalsContact C-N 3.29Å; F942-L944 PolarHBondContact O-N 2.85Å; F942-T945 VanDerWaalsContact CD2-OG1 3.3Å; F942-T945 WeakPolarHBondContact CD2-OG1 3.23Å; F942-T945 WeakPolarHBondContact CE2-OG1 3.41Å; F942-T945 PolarHBondContact O-N 3.17Å; F942-T945 VanDerWaalsContact O-N 3.16Å; F942-T945 PolarHBondContact O-OG1 2.83Å; F942-N946 WeakPolarHBondContact CD1-ND2 3.47Å; F942-N946 WeakPolarHBondContact CE1-ND2 3.21Å; F942-N946 PolarHBondContact O-ND2 2.68Å; F942-V967 HydrophobicContact CB-CG2 4.35Å; F942-K970 HydrophobicContact CE2-CD 4.31Å
943	H	93	Very high	87.7	Confident	62 Å²	62	43.8 Å²	43.8	29%	0.287	24%	0.238	S	C	.	.	H	α-helix	trans	-63.2	-35	170.6	-71.5	-83.6	0	0	0	112.3	E917 A920 K939 G940 L941 T945 N946	E917-H943 HydrophobicContact CB-CB 4.5Å; A920-H943 HydrophobicContact CB-CB 4.05Å; A920-H943 WeakPolarHBondContact CB-O 3.44Å; K939-H943 PolarHBondContact O-CD2 3.41Å; K939-H943 PolarHBondContact O-N 3.13Å; K939-H943 VanDerWaalsContact O-N 3.14Å; G940-H943 PolarHBondContact O-N 3.19Å; L941-H943 VanDerWaalsContact C-N 3.3Å; L941-H943 PolarHBondContact O-N 2.86Å; H943-T945 VanDerWaalsContact C-N 3.26Å; H943-T945 PolarHBondContact O-N 3.28Å; H943-N946 PolarHBondContact O-N 3.19Å
944	L	90.3	Very high	87.8	Confident	3 Å²	3	42.8 Å²	42.8	2%	0.016	23%	0.231	C	C	.	.	H	α-helix	trans	-67.4	-23.8	174.8	-63.5	-177.9	0	0	0	113.2	M916 A920 L929 L941 F942 L952 L971	M916-L944 HydrophobicContact CE-CD1 3.47Å; M916-L944 VanDerWaalsContact CE-CD1 3.47Å; M916-L944 HydrophobicContact CE-CD2 4.21Å; M916-L944 HydrophobicContact CE-CG 3.77Å; A920-L944 HydrophobicContact CB-CD2 4.32Å; L929-L944 HydrophobicContact CD2-CD1 4.39Å; L941-L944 WeakPolarHBondContact O-CB 3.47Å; L941-L944 PolarHBondContact O-N 3.22Å; L941-L944 VanDerWaalsContact O-N 3.14Å; F942-L944 VanDerWaalsContact C-N 3.29Å; F942-L944 PolarHBondContact O-N 2.85Å; L944-L952 HydrophobicContact CD1-CD2 4.4Å; L944-L971 HydrophobicContact CB-CD1 4.2Å; L944-L971 HydrophobicContact CD1-CD1 4.14Å
945	T	87.9	Confident	87.8	Confident	23 Å²	23	42.3 Å²	42.3	14%	0.141	23%	0.228	C	C	.	.	H	α-helix	trans	-80.1	-21	179.6	73.1	0	0	0	0	113.3	F942 H943 K970 L971	F942-T945 VanDerWaalsContact CD2-OG1 3.3Å; F942-T945 WeakPolarHBondContact CD2-OG1 3.23Å; F942-T945 WeakPolarHBondContact CE2-OG1 3.41Å; F942-T945 PolarHBondContact O-N 3.17Å; F942-T945 VanDerWaalsContact O-N 3.16Å; F942-T945 PolarHBondContact O-OG1 2.83Å; H943-T945 VanDerWaalsContact C-N 3.26Å; H943-T945 PolarHBondContact O-N 3.28Å; T945-K970 HydrophobicContact CG2-CB 4.21Å; T945-L971 HydrophobicContact CG2-CB 3.81Å; T945-L971 HydrophobicContact CG2-CG 4.42Å
946	N	78.3	Confident	87.8	Confident	109 Å²	109	40.2 Å²	40.2	58%	0.583	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-97	0.4	-176.9	-58.2	-34.2	0	0	0	113	F942 H943	F942-N946 WeakPolarHBondContact CD1-ND2 3.47Å; F942-N946 WeakPolarHBondContact CE1-ND2 3.21Å; F942-N946 PolarHBondContact O-ND2 2.68Å; H943-N946 PolarHBondContact O-N 3.19Å
947	A	72.9	Confident	87.8	Confident	22 Å²	22	40.2 Å²	40.2	18%	0.182	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-118.9	165	-170.7	0	0	0	0	0	112.3	A920 A949	A920-A947 HydrophobicContact CB-CB 3.58Å; A920-A947 VanDerWaalsContact O-CB 3.24Å; A920-A947 WeakPolarHBondContact O-CB 3.41Å; A947-A949 PolarHBondContact O-N 2.78Å
948	P	61.6	Low	87.7	Confident	78 Å²	78	39.8 Å²	39.8	51%	0.506	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.3	50.2	173.5	33.2	-37.3	0	0	0	112.8	P924 V950	P924-P948 HydrophobicContact CB-CG 4.45Å; P948-V950 HydrophobicContact CB-CG2 4.32Å; P948-V950 PolarHBondContact O-N 3.44Å
949	A	66.4	Low	87.5	Confident	15 Å²	15	40 Å²	40	12%	0.124	21%	0.208	C	C	.	.			trans	-68.3	22.4	170.4	0	0	0	0	0	113.3	A947 C951 L952	A947-A949 PolarHBondContact O-N 2.78Å; A949-C951 PolarHBondContact O-N 3.31Å; A949-L952 WeakPolarHBondContact O-CB 3.49Å; A949-L952 PolarHBondContact O-N 3.1Å
950	V	75.8	Confident	87.3	Confident	68 Å²	68	33.6 Å²	33.6	41%	0.412	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-11.4	-179.4	-157.7	0	0	0	0	112.2	P948 P976 K977	P948-V950 HydrophobicContact CB-CG2 4.32Å; P948-V950 PolarHBondContact O-N 3.44Å; V950-P976 HydrophobicContact CG1-CG 3.79Å; V950-K977 WeakPolarHBondContact O-CD 3.19Å; V950-K977 WeakPolarHBondContact O-CE 3.41Å; V950-K977 VanDerWaalsContact O-CG 3.24Å; V950-K977 WeakPolarHBondContact O-CG 3.37Å; V950-K977 PolarHBondContact O-NZ 3.04Å
951	C	88.7	Confident	86.9	Confident	29 Å²	29	42.9 Å²	42.9	20%	0.196	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.2	-18.5	176.7	-65.4	0	0	0	0	114	P924 L926 A949 K953	P924-C951 PolarHBondContact O-SG 3.25Å; L926-C951 CarbonylContact O-C 3.57Å; L926-C951 VanDerWaalsContact O-CB 3.29Å; L926-C951 WeakPolarHBondContact O-CB 3.43Å; A949-C951 PolarHBondContact O-N 3.31Å; C951-K953 PolarHBondContact O-N 3.14Å
952	L	93	Very high	86.5	Confident	2 Å²	2	49.4 Å²	49.4	1%	0.01	25%	0.247	C	C	.	.			trans	-67.3	121.1	-170.5	-166.5	68.8	0	0	0	111.6	L926 L929 L944 A949 L955 K977 L978	L926-L952 HydrophobicContact CG-CD1 4.33Å; L926-L952 WeakPolarHBondContact O-CA 3.16Å; L926-L952 PolarHBondContact O-N 3.25Å; L926-L952 VanDerWaalsContact O-N 3.13Å; L929-L952 HydrophobicContact CB-CD1 4.09Å; L944-L952 HydrophobicContact CD1-CD2 4.4Å; A949-L952 WeakPolarHBondContact O-CB 3.49Å; A949-L952 PolarHBondContact O-N 3.1Å; L952-L955 HydrophobicContact CD2-CB 4.31Å; L952-K977 CarbonylContact O-C 3.46Å; L952-L978 WeakPolarHBondContact O-CA 3.5Å; L952-L978 PolarHBondContact O-N 3.25Å
953	K	93.7	Very high	86.4	Confident	71 Å²	71	45.2 Å²	45.2	31%	0.309	23%	0.229	S	C	.	.			trans	-108.4	-36	-178.9	-60.1	172.8	-164.8	161	0	113	E927 C951 K977 L978 T979 L980	E927-K953 HydrophobicContact CB-CD 4.27Å; E927-K953 HydrophobicContact CB-CG 4.5Å; E927-K953 WeakPolarHBondContact O-CA 3.26Å; E927-K953 WeakPolarHBondContact O-CB 3.2Å; E927-K953 PolarHBondContact O-N 2.95Å; E927-K953 WeakPolarHBondContact OE1-CE 3.39Å; E927-K953 IonicContact OE1-NZ 2.87Å; E927-K953 PolarHBondContact OE1-NZ 3Å; E927-K953 IonicContact OE2-NZ 2.68Å; E927-K953 PolarHBondContact OE2-NZ 3.42Å; C951-K953 PolarHBondContact O-N 3.14Å; K953-K977 WeakPolarHBondContact CA-O 3.35Å; K953-L978 WeakPolarHBondContact O-CD1 3.2Å; K953-T979 PolarHBondContact O-N 2.97Å; K953-T979 PolarHBondContact O-OG1 3.33Å; K953-T979 VanDerWaalsContact O-OG1 3.12Å; K953-L980 PolarHBondContact O-N 3.01Å; K953-L980 VanDerWaalsContact O-N 3.13Å
954	C	94.7	Very high	86.3	Confident	3 Å²	3	44.4 Å²	44.4	2%	0.02	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	133.1	-179.9	-177.5	0	0	0	0	110.9	E927 E928 L929 L980	E927-C954 PolarHBondContact O-N 2.9Å; E927-C954 VanDerWaalsContact O-N 3.12Å; E928-C954 WeakPolarHBondContact CA-O 3.29Å; E928-C954 HydrophobicContact CB-CB 4.11Å; E928-C954 HydrophobicContact CG-CB 3.88Å; L929-C954 PolarHBondContact N-O 3.42Å; C954-L980 WeakPolarHBondContact CA-O 3.35Å; C954-L980 HydrophobicContact CB-CB 4.34Å
955	L	95.2	Very high	86.3	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	133.7	174.5	178.9	60.3	0	0	0	110.2	L929 L952 I957 L971 L978 L980 L981 Y982	L929-L955 HydrophobicContact CB-CD1 4.11Å; L929-L955 HydrophobicContact CD2-CD1 3.98Å; L929-L955 HydrophobicContact CG-CD1 4.19Å; L929-L955 CarbonylContact O-C 3.44Å; L929-L955 WeakPolarHBondContact O-CA 3.41Å; L952-L955 HydrophobicContact CD2-CB 4.31Å; L955-I957 HydrophobicContact CD1-CG2 3.95Å; L955-I957 HydrophobicContact CD2-CG2 4.15Å; L955-I957 HydrophobicContact CG-CG2 3.91Å; L955-L971 HydrophobicContact CD2-CD1 4Å; L955-L971 HydrophobicContact CD2-CD2 3.75Å; L955-L978 HydrophobicContact CB-CD1 4.05Å; L955-L978 HydrophobicContact CB-CD2 4.46Å; L955-L980 PolarHBondContact N-O 3.4Å; L955-L981 HydrophobicContact CB-CD1 4.12Å; L955-L981 HydrophobicContact CD2-CD1 4.16Å; L955-L981 HydrophobicContact CG-CD1 4.16Å; L955-L981 WeakPolarHBondContact O-CA 3.27Å; L955-Y982 PolarHBondContact O-N 2.99Å
956	R	95	Very high	86.5	Confident	26 Å²	26	49.8 Å²	49.8	10%	0.098	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	128.5	167.4	-41.5	-147.8	-178.9	67.2	16.7	110.8	L929 D930 V931 S932 Y982	L929-R956 PolarHBondContact O-N 2.9Å; D930-R956 HydrophobicContact CB-CB 4.3Å; D930-R956 HydrophobicContact CB-CG 4.42Å; D930-R956 WeakPolarHBondContact OD1-CB 3.43Å; D930-R956 WeakPolarHBondContact OD2-CD 3.38Å; D930-R956 WeakPolarHBondContact OD2-CG 3.43Å; D930-R956 IonicContact OD2-CZ 3.07Å; D930-R956 IonicContact OD2-NE 3.67Å; D930-R956 IonicContact OD2-NH1 3.72Å; D930-R956 PolarHBondContact OD2-NH1 3.2Å; V931-R956 PolarHBondContact N-O 3.43Å; S932-R956 VanDerWaalsContact OG-CB 3.28Å; S932-R956 WeakPolarHBondContact OG-CB 3.48Å; R956-Y982 VanDerWaalsContact CD-CD2 3.44Å; R956-Y982 VanDerWaalsContact CD-CG 3.48Å; R956-Y982 HydrophobicContact CG-CD2 3.6Å; R956-Y982 HydrophobicContact CG-CE2 4.43Å; R956-Y982 HydrophobicContact CG-CG 3.9Å
957	I	94.6	Very high	87.2	Confident	0 Å²	0	45 Å²	45	0%	0	23%	0.234	C	C	.	.			trans	-135.1	23.3	-175.9	51.8	165.9	0	0	0	110.1	V931 L941 L955 H959 C960 I963 L968 L981 Y982 F986	V931-I957 HydrophobicContact CG2-CG2 3.98Å; L941-I957 HydrophobicContact CD1-CD1 4.02Å; L941-I957 HydrophobicContact CD1-CG2 4.33Å; L941-I957 HydrophobicContact CD2-CG2 3.86Å; L955-I957 HydrophobicContact CD1-CG2 3.95Å; L955-I957 HydrophobicContact CD2-CG2 4.15Å; L955-I957 HydrophobicContact CG-CG2 3.91Å; I957-H959 PolarHBondContact O-N 3.12Å; I957-C960 VanDerWaalsContact C-SG 3.57Å; I957-C960 VanDerWaalsContact O-CB 3.31Å; I957-C960 WeakPolarHBondContact O-CB 3.28Å; I957-C960 PolarHBondContact O-N 3.15Å; I957-C960 VanDerWaalsContact O-N 3.15Å; I957-C960 PolarHBondContact O-SG 2.81Å; I957-I963 HydrophobicContact CD1-CG2 4.43Å; I957-L968 HydrophobicContact CD1-CD2 3.67Å; I957-L981 HydrophobicContact CD1-CD1 4.17Å; I957-L981 HydrophobicContact CG1-CD1 4.17Å; I957-Y982 PolarHBondContact N-O 3.05Å; I957-Y982 VanDerWaalsContact N-O 3.13Å; I957-F986 HydrophobicContact CB-CZ 4.42Å; I957-F986 HydrophobicContact CD1-CE2 3.98Å; I957-F986 HydrophobicContact CD1-CZ 3.95Å; I957-F986 HydrophobicContact CG1-CE2 4.01Å; I957-F986 HydrophobicContact CG1-CZ 4.1Å; I957-F986 WeakPolarHBondContact O-CZ 3.3Å
958	S	92.7	Very high	88.2	Confident	12 Å²	12	44 Å²	44	8%	0.084	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.7	137.5	-170.2	-66.5	0	0	0	0	111	S932 C933 C960 Y982 Y984	S932-S958 CarbonylContact C-O 3.54Å; S932-S958 VanDerWaalsContact CA-O 3.27Å; S932-S958 WeakPolarHBondContact CA-O 3.29Å; S932-S958 WeakPolarHBondContact CB-O 3.46Å; S932-S958 PolarHBondContact OG-N 3.48Å; C933-S958 PolarHBondContact N-O 3.18Å; S958-C960 PolarHBondContact O-N 3.45Å; S958-C960 VanDerWaalsContact O-N 3.12Å; S958-Y982 PolarHBondContact OG-O 3.41Å; S958-Y982 VanDerWaalsContact OG-O 3.12Å; S958-Y984 CarbonylContact C-O 3.5Å; S958-Y984 WeakPolarHBondContact CA-O 3.25Å; S958-Y984 PolarHBondContact OG-N 2.81Å
959	H	89.7	Confident	89.6	Confident	83 Å²	83	43.6 Å²	43.6	38%	0.384	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	56	17.2	-174.1	-49	-86	0	0	0	116	I957 Y984	I957-H959 PolarHBondContact O-N 3.12Å; H959-Y984 PolarHBondContact N-O 3.2Å
960	C	90.2	Very high	90.8	Very high	7 Å²	7	47.8 Å²	47.8	5%	0.047	23%	0.233	C	C	.	.			trans	-63.5	154.3	162.3	-64.1	0	0	0	0	109.9	V931 I957 S958 I963 F986	V931-C960 PolarHBondContact O-SG 2.98Å; I957-C960 VanDerWaalsContact C-SG 3.57Å; I957-C960 VanDerWaalsContact O-CB 3.31Å; I957-C960 WeakPolarHBondContact O-CB 3.28Å; I957-C960 PolarHBondContact O-N 3.15Å; I957-C960 VanDerWaalsContact O-N 3.15Å; I957-C960 PolarHBondContact O-SG 2.81Å; S958-C960 PolarHBondContact O-N 3.45Å; S958-C960 VanDerWaalsContact O-N 3.12Å; C960-I963 HydrophobicContact CB-CD1 4.37Å; C960-I963 HydrophobicContact CB-CG1 4Å; C960-F986 HydrophobicContact CB-CE1 4.43Å; C960-F986 HydrophobicContact CB-CZ 4.28Å; C960-F986 VanDerWaalsContact O-CE1 3.23Å; C960-F986 WeakPolarHBondContact O-CE1 3.43Å
961	R	85	Confident	91.6	Very high	195 Å²	195	44.6 Å²	44.6	74%	0.736	21%	0.213	S	C	*	.	S	Bend	trans	-99.2	159.8	180	-62	-175.2	-175.7	-176.4	2.7	110.5	I963	R961-I963 PolarHBondContact O-N 2.95Å
962	E	85.2	Confident	91.8	Very high	138 Å²	138	43.2 Å²	43.2	65%	0.645	20%	0.204	S	C	*	.	S	Bend	trans	58	26.1	168.8	-61.7	168.7	-141.7	0	0	115.1	Q938	Q938-E962 VanDerWaalsContact CB-O 3.29Å; Q938-E962 WeakPolarHBondContact CB-O 3.47Å; Q938-E962 VanDerWaalsContact CG-O 3.24Å; Q938-E962 WeakPolarHBondContact CG-O 3.16Å; Q938-E962 PolarHBondContact N-O 2.87Å
963	I	90.7	Very high	91.7	Very high	4 Å²	4	49 Å²	49	2%	0.021	23%	0.231	C	C	.	.			trans	-85.6	131.5	170.3	-48.9	-50.6	0	0	0	109.7	L941 I957 C960 R961 V967 L968 F986	L941-I963 HydrophobicContact CD1-CD1 3.7Å; L941-I963 HydrophobicContact CD1-CG1 4.25Å; L941-I963 HydrophobicContact CD1-CG2 3.88Å; L941-I963 HydrophobicContact CG-CD1 4.04Å; I957-I963 HydrophobicContact CD1-CG2 4.43Å; C960-I963 HydrophobicContact CB-CD1 4.37Å; C960-I963 HydrophobicContact CB-CG1 4Å; R961-I963 PolarHBondContact O-N 2.95Å; I963-V967 HydrophobicContact CG2-CG1 3.9Å; I963-L968 HydrophobicContact CG2-CD1 4.01Å; I963-L968 HydrophobicContact CG2-CD2 3.95Å; I963-L968 HydrophobicContact CG2-CG 3.85Å; I963-F986 HydrophobicContact CB-CD1 4.18Å; I963-F986 HydrophobicContact CB-CE1 3.51Å; I963-F986 HydrophobicContact CB-CZ 4Å; I963-F986 HydrophobicContact CG1-CE1 3.48Å; I963-F986 VanDerWaalsContact CG1-CE1 3.48Å; I963-F986 HydrophobicContact CG1-CZ 3.76Å; I963-F986 HydrophobicContact CG2-CE1 4.34Å; I963-F986 HydrophobicContact CG2-CZ 4.44Å
964	T	90.2	Very high	91.5	Very high	45 Å²	45	47.4 Å²	47.4	28%	0.276	23%	0.231	S	C	.	.			trans	-107.7	165.8	-178.9	48.9	0	0	0	0	111.4	Q938 D966 V967 L968	Q938-T964 PolarHBondContact OE1-OG1 3.5Å; T964-D966 VanDerWaalsContact C-N 3.28Å; T964-D966 PolarHBondContact O-N 3.31Å; T964-V967 WeakPolarHBondContact O-CG1 3.25Å; T964-V967 WeakPolarHBondContact OG1-CG1 3.36Å; T964-L968 WeakPolarHBondContact O-CG 3.12Å
965	S	91.1	Very high	91.3	Very high	47 Å²	47	47.3 Å²	47.3	33%	0.329	23%	0.23	S	C	.	.	H	α-helix	trans	-54.7	-47.7	166.8	31.3	0	0	0	0	111.2	V967 L968 E969	S965-V967 VanDerWaalsContact C-N 3.34Å; S965-V967 PolarHBondContact O-N 2.97Å; S965-L968 CarbonylContact O-C 3.47Å; S965-L968 WeakPolarHBondContact O-CA 3.36Å; S965-L968 WeakPolarHBondContact O-CB 3.45Å; S965-L968 PolarHBondContact O-N 2.9Å; S965-E969 PolarHBondContact O-N 2.76Å
966	D	91.6	Very high	91	Very high	92 Å²	92	50.9 Å²	50.9	49%	0.492	25%	0.253	S	S	.	.	H	α-helix	trans	-69	-31.5	-163.3	-49.2	17.5	0	0	0	112.6	T964 K970	T964-D966 VanDerWaalsContact C-N 3.28Å; T964-D966 PolarHBondContact O-N 3.31Å; D966-K970 WeakPolarHBondContact O-CD 3.38Å; D966-K970 WeakPolarHBondContact O-CG 3.39Å; D966-K970 PolarHBondContact O-N 2.85Å
967	V	92.6	Very high	90.8	Very high	8 Å²	8	54.4 Å²	54.4	5%	0.048	27%	0.269	C	S	.	.	H	α-helix	trans	-75.4	-33.3	171.9	70.3	0	0	0	0	111.8	Q938 L941 F942 I963 T964 S965 L971	Q938-V967 HydrophobicContact CB-CB 4.14Å; Q938-V967 HydrophobicContact CB-CG1 3.78Å; Q938-V967 HydrophobicContact CB-CG2 4.35Å; Q938-V967 WeakPolarHBondContact O-CG2 3.41Å; L941-V967 HydrophobicContact CB-CG2 3.76Å; F942-V967 HydrophobicContact CB-CG2 4.35Å; I963-V967 HydrophobicContact CG2-CG1 3.9Å; T964-V967 WeakPolarHBondContact O-CG1 3.25Å; T964-V967 WeakPolarHBondContact OG1-CG1 3.36Å; S965-V967 VanDerWaalsContact C-N 3.34Å; S965-V967 PolarHBondContact O-N 2.97Å; V967-L971 WeakPolarHBondContact O-CB 3.46Å; V967-L971 PolarHBondContact O-N 3.07Å
968	L	93.6	Very high	90.7	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-71.7	-37.3	176.8	-64.6	176.3	0	0	0	111.5	L941 I957 I963 T964 S965 L971 I972 I989 W992 F994 L995	L941-L968 HydrophobicContact CD1-CD2 4.05Å; I957-L968 HydrophobicContact CD1-CD2 3.67Å; I963-L968 HydrophobicContact CG2-CD1 4.01Å; I963-L968 HydrophobicContact CG2-CD2 3.95Å; I963-L968 HydrophobicContact CG2-CG 3.85Å; T964-L968 WeakPolarHBondContact O-CG 3.12Å; S965-L968 CarbonylContact O-C 3.47Å; S965-L968 WeakPolarHBondContact O-CA 3.36Å; S965-L968 WeakPolarHBondContact O-CB 3.45Å; S965-L968 PolarHBondContact O-N 2.9Å; L968-L971 PolarHBondContact O-N 3.02Å; L968-I972 WeakPolarHBondContact O-CG1 3.47Å; L968-I972 PolarHBondContact O-N 3.1Å; L968-I989 HydrophobicContact CD1-CD1 3.72Å; L968-W992 HydrophobicContact CD1-CH2 4.15Å; L968-W992 HydrophobicContact CD1-CZ3 3.88Å; L968-F994 HydrophobicContact CB-CE2 4.37Å; L968-L995 HydrophobicContact CB-CD2 4.04Å
969	E	92.6	Very high	90.7	Very high	70 Å²	70	56.7 Å²	56.7	33%	0.327	28%	0.283	S	S	.	.	H	α-helix	trans	-56.3	-57.2	171.8	-69.8	-170.5	154.5	0	0	110.8	S965 L971 I972 E973 F994 L995 I998	S965-E969 PolarHBondContact O-N 2.76Å; E969-L971 VanDerWaalsContact C-N 3.26Å; E969-L971 PolarHBondContact O-N 3.35Å; E969-I972 PolarHBondContact O-N 3.06Å; E969-I972 VanDerWaalsContact O-N 3.16Å; E969-E973 WeakPolarHBondContact O-CG 3.38Å; E969-E973 PolarHBondContact O-N 2.67Å; E969-F994 HydrophobicContact CG-CD2 3.46Å; E969-F994 VanDerWaalsContact CG-CD2 3.46Å; E969-F994 HydrophobicContact CG-CE2 3.73Å; E969-F994 VanDerWaalsContact OE1-CD2 3.3Å; E969-F994 WeakPolarHBondContact OE1-CD2 3.31Å; E969-L995 HydrophobicContact CG-CD2 4.49Å; E969-I998 HydrophobicContact CB-CD1 3.71Å; E969-I998 HydrophobicContact CG-CD1 3.68Å
970	K	91.9	Very high	90.9	Very high	104 Å²	104	54.7 Å²	54.7	45%	0.452	28%	0.275	S	S	.	.	H	α-helix	trans	-58.7	-35.7	178.4	-66.9	168.1	-171.4	169.9	0	112.9	F942 T945 D966 A974	F942-K970 HydrophobicContact CE2-CD 4.31Å; T945-K970 HydrophobicContact CG2-CB 4.21Å; D966-K970 WeakPolarHBondContact O-CD 3.38Å; D966-K970 WeakPolarHBondContact O-CG 3.39Å; D966-K970 PolarHBondContact O-N 2.85Å; K970-A974 VanDerWaalsContact O-CB 3.23Å; K970-A974 WeakPolarHBondContact O-CB 3.43Å; K970-A974 PolarHBondContact O-N 2.72Å
971	L	92.5	Very high	91.1	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-72.8	-39.2	178.1	-173.7	151.4	0	0	0	112.5	L941 L944 T945 L955 V967 L968 E969 C975 L978	L941-L971 HydrophobicContact CB-CD1 3.98Å; L941-L971 HydrophobicContact CD2-CD1 4.36Å; L944-L971 HydrophobicContact CB-CD1 4.2Å; L944-L971 HydrophobicContact CD1-CD1 4.14Å; T945-L971 HydrophobicContact CG2-CB 3.81Å; T945-L971 HydrophobicContact CG2-CG 4.42Å; L955-L971 HydrophobicContact CD2-CD1 4Å; L955-L971 HydrophobicContact CD2-CD2 3.75Å; V967-L971 WeakPolarHBondContact O-CB 3.46Å; V967-L971 PolarHBondContact O-N 3.07Å; L968-L971 PolarHBondContact O-N 3.02Å; E969-L971 VanDerWaalsContact C-N 3.26Å; E969-L971 PolarHBondContact O-N 3.35Å; L971-C975 VanDerWaalsContact O-CB 3.24Å; L971-C975 WeakPolarHBondContact O-CB 3.48Å; L971-C975 PolarHBondContact O-N 2.79Å; L971-C975 PolarHBondContact O-SG 2.73Å; L971-C975 VanDerWaalsContact O-SG 3.33Å; L971-L978 HydrophobicContact CD2-CD2 3.47Å; L971-L978 VanDerWaalsContact CD2-CD2 3.47Å
972	I	92.1	Very high	91.4	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-64.7	-45.3	171.7	-64.6	-44.8	0	0	0	109.9	L968 E969 C975 L978 L995 I998 R999 L1002	L968-I972 WeakPolarHBondContact O-CG1 3.47Å; L968-I972 PolarHBondContact O-N 3.1Å; E969-I972 PolarHBondContact O-N 3.06Å; E969-I972 VanDerWaalsContact O-N 3.16Å; I972-C975 PolarHBondContact O-N 2.96Å; I972-L978 HydrophobicContact CD1-CD2 3.56Å; I972-L978 HydrophobicContact CD1-CG 4.09Å; I972-L995 HydrophobicContact CG1-CD1 4.43Å; I972-L995 HydrophobicContact CG1-CD2 3.8Å; I972-I998 HydrophobicContact CB-CG2 4.41Å; I972-I998 HydrophobicContact CG2-CB 4.34Å; I972-I998 HydrophobicContact CG2-CG2 3.75Å; I972-R999 HydrophobicContact CG2-CB 3.89Å; I972-R999 PolarHBondContact O-NH1 3.04Å; I972-R999 PolarHBondContact O-NH2 3.11Å; I972-L1002 HydrophobicContact CD1-CD1 4.11Å; I972-L1002 HydrophobicContact CD1-CD2 3.59Å; I972-L1002 HydrophobicContact CG1-CD2 3.82Å; I972-L1002 HydrophobicContact CG2-CD2 4.37Å
973	E	90.6	Very high	91.6	Very high	125 Å²	125	39.8 Å²	39.8	58%	0.584	21%	0.212	S	C	*	.	H	α-helix	trans	-56.8	-50.8	176.3	-71.1	179.2	160.1	0	0	112.2	E969 C975 I998	E969-E973 WeakPolarHBondContact O-CG 3.38Å; E969-E973 PolarHBondContact O-N 2.67Å; E973-C975 PolarHBondContact O-N 3.15Å; E973-I998 HydrophobicContact CG-CD1 4.45Å; E973-I998 HydrophobicContact CG-CG2 3.8Å
974	A	90	Very high	91.5	Very high	37 Å²	37	41.3 Å²	41.3	31%	0.306	22%	0.218	S	C	.	.	H	α-helix	trans	-70	-26.8	-177.8	0	0	0	0	0	114.7	K970 P976	K970-A974 VanDerWaalsContact O-CB 3.23Å; K970-A974 WeakPolarHBondContact O-CB 3.43Å; K970-A974 PolarHBondContact O-N 2.72Å; A974-P976 WeakPolarHBondContact O-CD 3.44Å
975	C	90.6	Very high	91.2	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	23%	0.226	C	C	.	.			trans	-104.6	81.5	-176.9	-60.5	0	0	0	0	111.6	L971 I972 E973 K977 L978 R999	L971-C975 VanDerWaalsContact O-CB 3.24Å; L971-C975 WeakPolarHBondContact O-CB 3.48Å; L971-C975 PolarHBondContact O-N 2.79Å; L971-C975 PolarHBondContact O-SG 2.73Å; L971-C975 VanDerWaalsContact O-SG 3.33Å; I972-C975 PolarHBondContact O-N 2.96Å; E973-C975 PolarHBondContact O-N 3.15Å; C975-K977 VanDerWaalsContact C-N 3.29Å; C975-K977 PolarHBondContact O-N 3.09Å; C975-L978 HydrophobicContact CB-CB 3.86Å; C975-L978 HydrophobicContact CB-CD2 4.19Å; C975-L978 WeakPolarHBondContact O-CB 3.47Å; C975-L978 PolarHBondContact O-N 2.83Å; C975-L978 VanDerWaalsContact O-N 3.08Å; C975-R999 PolarHBondContact O-NH1 3.45Å; C975-R999 PolarHBondContact O-NH2 2.95Å
976	P	88.5	Confident	90.9	Very high	75 Å²	75	40 Å²	40	49%	0.487	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-26.7	-170.9	24.6	-36.1	0	0	0	114.9	V950 A974	V950-P976 HydrophobicContact CG1-CG 3.79Å; A974-P976 WeakPolarHBondContact O-CD 3.44Å
977	K	91.2	Very high	90.2	Very high	101 Å²	101	41.9 Å²	41.9	44%	0.439	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85	-5.4	178.1	-63.8	-171.6	-160.1	133.4	0	113.9	V950 L952 K953 C975 T979	V950-K977 WeakPolarHBondContact O-CD 3.19Å; V950-K977 WeakPolarHBondContact O-CE 3.41Å; V950-K977 VanDerWaalsContact O-CG 3.24Å; V950-K977 WeakPolarHBondContact O-CG 3.37Å; V950-K977 PolarHBondContact O-NZ 3.04Å; L952-K977 CarbonylContact O-C 3.46Å; K953-K977 WeakPolarHBondContact CA-O 3.35Å; C975-K977 VanDerWaalsContact C-N 3.29Å; C975-K977 PolarHBondContact O-N 3.09Å; K977-T979 PolarHBondContact O-N 3.49Å; K977-T979 VanDerWaalsContact O-N 3.13Å
978	L	92.5	Very high	89.6	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	26%	0.256	C	S	.	.			trans	-70.3	113	-175.6	-178.4	52	0	0	0	109.8	L952 K953 L955 L971 I972 C975 L980 R999 L1002	L952-L978 WeakPolarHBondContact O-CA 3.5Å; L952-L978 PolarHBondContact O-N 3.25Å; K953-L978 WeakPolarHBondContact O-CD1 3.2Å; L955-L978 HydrophobicContact CB-CD1 4.05Å; L955-L978 HydrophobicContact CB-CD2 4.46Å; L971-L978 HydrophobicContact CD2-CD2 3.47Å; L971-L978 VanDerWaalsContact CD2-CD2 3.47Å; I972-L978 HydrophobicContact CD1-CD2 3.56Å; I972-L978 HydrophobicContact CD1-CG 4.09Å; C975-L978 HydrophobicContact CB-CB 3.86Å; C975-L978 HydrophobicContact CB-CD2 4.19Å; C975-L978 WeakPolarHBondContact O-CB 3.47Å; C975-L978 PolarHBondContact O-N 2.83Å; C975-L978 VanDerWaalsContact O-N 3.08Å; L978-L980 WeakPolarHBondContact CD1-O 3.25Å; L978-R999 WeakPolarHBondContact O-CD 3.2Å; L978-R999 PolarHBondContact O-NH1 3.23Å; L978-L1002 HydrophobicContact CG-CD1 4.19Å; L978-L1002 WeakPolarHBondContact O-CD1 3.32Å
979	T	92.8	Very high	89.2	Confident	59 Å²	59	46.2 Å²	46.2	36%	0.362	26%	0.259	S	S	.	.			trans	-114	-18.1	-174.5	52.8	0	0	0	0	113.7	K953 K977 L1003	K953-T979 PolarHBondContact O-N 2.97Å; K953-T979 PolarHBondContact O-OG1 3.33Å; K953-T979 VanDerWaalsContact O-OG1 3.12Å; K977-T979 PolarHBondContact O-N 3.49Å; K977-T979 VanDerWaalsContact O-N 3.13Å; T979-L1003 PolarHBondContact O-N 3.29Å
980	L	93.1	Very high	88.5	Confident	41 Å²	41	49.6 Å²	49.6	22%	0.215	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	121.3	-173.4	-177	55.5	0	0	0	110.7	K953 C954 L955 L978 Y982 L1003	K953-L980 PolarHBondContact O-N 3.01Å; K953-L980 VanDerWaalsContact O-N 3.13Å; C954-L980 WeakPolarHBondContact CA-O 3.35Å; C954-L980 HydrophobicContact CB-CB 4.34Å; L955-L980 PolarHBondContact N-O 3.4Å; L978-L980 WeakPolarHBondContact CD1-O 3.25Å; L980-Y982 HydrophobicContact CD1-CD2 4.37Å; L980-Y982 HydrophobicContact CD1-CE2 3.83Å; L980-Y982 HydrophobicContact CD2-CE2 3.52Å; L980-Y982 HydrophobicContact CG-CD2 4.03Å; L980-Y982 HydrophobicContact CG-CE2 3.44Å; L980-Y982 VanDerWaalsContact CG-CE2 3.44Å; L980-L1003 WeakPolarHBondContact CA-O 3.3Å; L980-L1003 HydrophobicContact CD1-CB 4.22Å; L980-L1003 HydrophobicContact CD1-CD2 3.74Å
981	L	93.9	Very high	88.2	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	125.5	178.7	178.1	64.4	0	0	0	109.6	L955 I957 A983 W992 L995 L1002 L1003 V1004 E1005	L955-L981 HydrophobicContact CB-CD1 4.12Å; L955-L981 HydrophobicContact CD2-CD1 4.16Å; L955-L981 HydrophobicContact CG-CD1 4.16Å; L955-L981 WeakPolarHBondContact O-CA 3.27Å; I957-L981 HydrophobicContact CD1-CD1 4.17Å; I957-L981 HydrophobicContact CG1-CD1 4.17Å; L981-A983 HydrophobicContact CG-CB 4.31Å; L981-W992 HydrophobicContact CD2-CZ3 4.44Å; L981-L995 HydrophobicContact CD2-CD1 3.67Å; L981-L1002 HydrophobicContact CB-CD1 4.39Å; L981-L1003 PolarHBondContact N-O 3.46Å; L981-V1004 HydrophobicContact CB-CG2 4.48Å; L981-V1004 HydrophobicContact CD2-CG1 4.48Å; L981-V1004 CarbonylContact O-C 3.56Å; L981-V1004 WeakPolarHBondContact O-CA 3.44Å; L981-E1005 PolarHBondContact O-N 3.18Å
982	Y	92.4	Very high	88	Confident	26 Å²	26	50.4 Å²	50.4	10%	0.102	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	111.4	174	-68	-96.6	0	0	0	110.6	P477 L955 R956 I957 S958 L980 Y984 E1005	P477-Y982 HydrophobicContact CG-CD1 4Å; P477-Y982 HydrophobicContact CG-CE1 4.13Å; L955-Y982 PolarHBondContact O-N 2.99Å; R956-Y982 VanDerWaalsContact CD-CD2 3.44Å; R956-Y982 VanDerWaalsContact CD-CG 3.48Å; R956-Y982 HydrophobicContact CG-CD2 3.6Å; R956-Y982 HydrophobicContact CG-CE2 4.43Å; R956-Y982 HydrophobicContact CG-CG 3.9Å; I957-Y982 PolarHBondContact N-O 3.05Å; I957-Y982 VanDerWaalsContact N-O 3.13Å; S958-Y982 PolarHBondContact OG-O 3.41Å; S958-Y982 VanDerWaalsContact OG-O 3.12Å; L980-Y982 HydrophobicContact CD1-CD2 4.37Å; L980-Y982 HydrophobicContact CD1-CE2 3.83Å; L980-Y982 HydrophobicContact CD2-CE2 3.52Å; L980-Y982 HydrophobicContact CG-CD2 4.03Å; L980-Y982 HydrophobicContact CG-CE2 3.44Å; L980-Y982 VanDerWaalsContact CG-CE2 3.44Å; Y982-Y984 HydrophobicContact CD1-CE2 4.13Å; Y982-E1005 WeakPolarHBondContact CA-O 3.29Å; Y982-E1005 HydrophobicContact CD1-CB 3.62Å; Y982-E1005 HydrophobicContact CD1-CG 4.36Å; Y982-E1005 HydrophobicContact CE1-CB 3.8Å; Y982-E1005 HydrophobicContact CE1-CG 4.01Å; Y982-E1005 HydrophobicContact CG-CB 4.34Å
983	A	90.1	Very high	87.7	Confident	2 Å²	2	51.2 Å²	51.2	2%	0.017	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	66	-168.4	0	0	0	0	0	111.9	L981 F986 W992 E1005	L981-A983 HydrophobicContact CG-CB 4.31Å; A983-F986 HydrophobicContact CB-CD2 3.85Å; A983-F986 HydrophobicContact CB-CE2 3.76Å; A983-W992 HydrophobicContact CB-CH2 3.38Å; A983-W992 HydrophobicContact CB-CZ2 4.22Å; A983-W992 HydrophobicContact CB-CZ3 3.6Å; A983-E1005 PolarHBondContact N-O 3Å
984	Y	88.2	Confident	87.7	Confident	35 Å²	35	46.3 Å²	46.3	14%	0.137	27%	0.272	C	S	.	.			trans	-87.2	149.6	176.6	-66.6	-101.4	0	0	0	111.1	P477 S958 H959 Y982 E1005 K1006 G1007	P477-Y984 HydrophobicContact CB-CE1 3.95Å; P477-Y984 HydrophobicContact CB-CE2 3.96Å; P477-Y984 VanDerWaalsContact CB-CZ 3.46Å; P477-Y984 VanDerWaalsContact CB-OH 3.29Å; P477-Y984 WeakPolarHBondContact CB-OH 3.39Å; P477-Y984 HydrophobicContact CG-CD2 4.25Å; P477-Y984 HydrophobicContact CG-CE1 4.35Å; P477-Y984 HydrophobicContact CG-CE2 3.55Å; S958-Y984 CarbonylContact C-O 3.5Å; S958-Y984 WeakPolarHBondContact CA-O 3.25Å; S958-Y984 PolarHBondContact OG-N 2.81Å; H959-Y984 PolarHBondContact N-O 3.2Å; Y982-Y984 HydrophobicContact CD1-CE2 4.13Å; Y984-E1005 VanDerWaalsContact CE2-C 3.43Å; Y984-E1005 HydrophobicContact CE2-CB 3.99Å; Y984-E1005 WeakPolarHBondContact CE2-O 3.23Å; Y984-E1005 WeakPolarHBondContact OH-CB 3.24Å; Y984-E1005 PolarHBondContact OH-OE2 3.12Å; Y984-K1006 WeakPolarHBondContact CE1-O 3.22Å; Y984-K1006 VanDerWaalsContact CZ-C 3.43Å; Y984-K1006 PolarHBondContact OH-N 2.89Å; Y984-K1006 PolarHBondContact OH-O 2.71Å; Y984-G1007 VanDerWaalsContact CD1-CA 3.5Å; Y984-G1007 VanDerWaalsContact CD1-N 3.28Å; Y984-G1007 VanDerWaalsContact CE1-N 3.32Å
985	G	83.8	Confident	87.7	Confident	43 Å²	43	44.6 Å²	44.6	44%	0.443	26%	0.258	S	S	.	.	S	Bend	trans	84.7	2.2	172.2	0	0	0	0	0	116.9	V987	G985-V987 PolarHBondContact O-N 3.28Å
986	F	84.1	Confident	87.5	Confident	22 Å²	22	49.9 Å²	49.9	10%	0.096	28%	0.283	C	S	.	.			trans	-80	102	176.5	-67.5	-66.2	0	0	0	112.2	I957 C960 I963 A983 S988 I989 W992	I957-F986 HydrophobicContact CB-CZ 4.42Å; I957-F986 HydrophobicContact CD1-CE2 3.98Å; I957-F986 HydrophobicContact CD1-CZ 3.95Å; I957-F986 HydrophobicContact CG1-CE2 4.01Å; I957-F986 HydrophobicContact CG1-CZ 4.1Å; I957-F986 WeakPolarHBondContact O-CZ 3.3Å; C960-F986 HydrophobicContact CB-CE1 4.43Å; C960-F986 HydrophobicContact CB-CZ 4.28Å; C960-F986 VanDerWaalsContact O-CE1 3.23Å; C960-F986 WeakPolarHBondContact O-CE1 3.43Å; I963-F986 HydrophobicContact CB-CD1 4.18Å; I963-F986 HydrophobicContact CB-CE1 3.51Å; I963-F986 HydrophobicContact CB-CZ 4Å; I963-F986 HydrophobicContact CG1-CE1 3.48Å; I963-F986 VanDerWaalsContact CG1-CE1 3.48Å; I963-F986 HydrophobicContact CG1-CZ 3.76Å; I963-F986 HydrophobicContact CG2-CE1 4.34Å; I963-F986 HydrophobicContact CG2-CZ 4.44Å; A983-F986 HydrophobicContact CB-CD2 3.85Å; A983-F986 HydrophobicContact CB-CE2 3.76Å; F986-S988 VanDerWaalsContact C-N 3.3Å; F986-I989 HydrophobicContact CB-CB 4.48Å; F986-W992 HydrophobicContact CB-CH2 4.49Å; F986-W992 HydrophobicContact CB-CZ2 4.08Å; F986-W992 AromaticContact CD2-CH2 3.83Å; F986-W992 HydrophobicContact CD2-CH2 3.83Å; F986-W992 HydrophobicContact CD2-CZ2 4.13Å; F986-W992 HydrophobicContact CG-CH2 4.43Å; F986-W992 HydrophobicContact CG-CZ2 4.48Å
987	V	77.2	Confident	87.5	Confident	132 Å²	132	54.4 Å²	54.4	80%	0.8	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.8	-19.6	177.5	-172.4	0	0	0	0	112.4	G985	G985-V987 PolarHBondContact O-N 3.28Å
988	S	80.7	Confident	87.4	Confident	87 Å²	87	52.3 Å²	52.3	61%	0.608	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.5	-23.2	178.7	43.5	0	0	0	0	114.2	F986	F986-S988 VanDerWaalsContact C-N 3.3Å
989	I	84.1	Confident	87.2	Confident	12 Å²	12	53.8 Å²	53.8	6%	0.062	29%	0.293	C	S	.	.			trans	-118.5	94	-168.4	-52.2	-177.5	0	0	0	109.4	L968 F986 D991 W992 F994	L968-I989 HydrophobicContact CD1-CD1 3.72Å; F986-I989 HydrophobicContact CB-CB 4.48Å; I989-D991 VanDerWaalsContact CG2-O 3.26Å; I989-D991 WeakPolarHBondContact CG2-O 3.32Å; I989-W992 HydrophobicContact CB-CH2 4.29Å; I989-W992 HydrophobicContact CB-CZ2 3.66Å; I989-W992 HydrophobicContact CD1-CH2 4.11Å; I989-W992 HydrophobicContact CD1-CZ2 4.34Å; I989-W992 HydrophobicContact CG2-CD2 3.85Å; I989-W992 VanDerWaalsContact CG2-CE2 3.44Å; I989-W992 HydrophobicContact CG2-CE3 4.36Å; I989-W992 HydrophobicContact CG2-CG 4.23Å; I989-W992 HydrophobicContact CG2-CH2 4.13Å; I989-W992 HydrophobicContact CG2-CZ2 3.62Å; I989-W992 HydrophobicContact CG2-CZ3 4.49Å; I989-W992 PolarHBondContact O-NE1 2.9Å; I989-F994 HydrophobicContact CG2-CE1 3.69Å; I989-F994 HydrophobicContact CG2-CZ 4.11Å
990	N	79.4	Confident	87	Confident	140 Å²	140	56.1 Å²	56.1	75%	0.749	31%	0.309	S	S	*	.			trans	-85.5	-50.5	-179	-66.3	-47.1	0	0	0	112.2
991	D	84.8	Confident	86.8	Confident	106 Å²	106	57.1 Å²	57.1	57%	0.567	32%	0.318	S	S	*	.			trans	-86.9	142.3	169.4	-176.5	28.3	0	0	0	110.7	I989 G993 F994	I989-D991 VanDerWaalsContact CG2-O 3.26Å; I989-D991 WeakPolarHBondContact CG2-O 3.32Å; D991-G993 PolarHBondContact OD1-N 3.3Å; D991-F994 WeakPolarHBondContact O-CD1 3.44Å; D991-F994 VanDerWaalsContact O-CE1 3.25Å; D991-F994 WeakPolarHBondContact O-CE1 3.36Å
992	W	88.1	Confident	86.6	Confident	15 Å²	15	57.5 Å²	57.5	6%	0.057	32%	0.319	C	S	.	.			trans	-126.4	2.1	177.3	-65.8	67.5	0	0	0	112.2	L968 L981 A983 F986 I989 F994 L995 V1004 K1006	L968-W992 HydrophobicContact CD1-CH2 4.15Å; L968-W992 HydrophobicContact CD1-CZ3 3.88Å; L981-W992 HydrophobicContact CD2-CZ3 4.44Å; A983-W992 HydrophobicContact CB-CH2 3.38Å; A983-W992 HydrophobicContact CB-CZ2 4.22Å; A983-W992 HydrophobicContact CB-CZ3 3.6Å; F986-W992 HydrophobicContact CB-CH2 4.49Å; F986-W992 HydrophobicContact CB-CZ2 4.08Å; F986-W992 AromaticContact CD2-CH2 3.83Å; F986-W992 HydrophobicContact CD2-CH2 3.83Å; F986-W992 HydrophobicContact CD2-CZ2 4.13Å; F986-W992 HydrophobicContact CG-CH2 4.43Å; F986-W992 HydrophobicContact CG-CZ2 4.48Å; I989-W992 HydrophobicContact CB-CH2 4.29Å; I989-W992 HydrophobicContact CB-CZ2 3.66Å; I989-W992 HydrophobicContact CD1-CH2 4.11Å; I989-W992 HydrophobicContact CD1-CZ2 4.34Å; I989-W992 HydrophobicContact CG2-CD2 3.85Å; I989-W992 VanDerWaalsContact CG2-CE2 3.44Å; I989-W992 HydrophobicContact CG2-CE3 4.36Å; I989-W992 HydrophobicContact CG2-CG 4.23Å; I989-W992 HydrophobicContact CG2-CH2 4.13Å; I989-W992 HydrophobicContact CG2-CZ2 3.62Å; I989-W992 HydrophobicContact CG2-CZ3 4.49Å; I989-W992 PolarHBondContact O-NE1 2.9Å; W992-F994 PolarHBondContact O-N 3.14Å; W992-L995 HydrophobicContact CE3-CD1 3.94Å; W992-L995 HydrophobicContact CZ3-CD1 4.22Å; W992-L995 PolarHBondContact O-N 3.01Å; W992-V1004 HydrophobicContact CD2-CG1 4.35Å; W992-V1004 HydrophobicContact CE3-CG1 3.76Å; W992-V1004 HydrophobicContact CZ3-CG1 4.3Å; W992-K1006 HydrophobicContact CB-CD 4.09Å; W992-K1006 VanDerWaalsContact CG-CD 3.49Å; W992-K1006 HydrophobicContact CG-CD 3.49Å; W992-K1006 HydrophobicContact CD2-CD 3.92Å; W992-K1006 VanDerWaalsContact CD1-CD 3.41Å
993	G	85.8	Confident	86.5	Confident	17 Å²	17	59.2 Å²	59.2	18%	0.175	33%	0.33	C	S	.	.	H	α-helix	trans	-61.8	-20.7	176.9	0	0	0	0	0	113.1	D991 L995 Q996 K997	D991-G993 PolarHBondContact OD1-N 3.3Å; G993-L995 PolarHBondContact O-N 3.31Å; G993-Q996 PolarHBondContact O-N 3.46Å; G993-Q996 VanDerWaalsContact O-N 3.13Å; G993-K997 WeakPolarHBondContact O-CG 3.4Å; G993-K997 PolarHBondContact O-N 2.96Å
994	F	89.9	Confident	86.4	Confident	23 Å²	23	60.2 Å²	60.2	10%	0.101	34%	0.336	C	S	.	.	H	α-helix	trans	-56.5	-46.5	172.6	72.7	-86.6	0	0	0	112.4	L968 E969 I989 D991 W992 Q996 K997 I998	L968-F994 HydrophobicContact CB-CE2 4.37Å; E969-F994 HydrophobicContact CG-CD2 3.46Å; E969-F994 VanDerWaalsContact CG-CD2 3.46Å; E969-F994 HydrophobicContact CG-CE2 3.73Å; E969-F994 VanDerWaalsContact OE1-CD2 3.3Å; E969-F994 WeakPolarHBondContact OE1-CD2 3.31Å; I989-F994 HydrophobicContact CG2-CE1 3.69Å; I989-F994 HydrophobicContact CG2-CZ 4.11Å; D991-F994 WeakPolarHBondContact O-CD1 3.44Å; D991-F994 VanDerWaalsContact O-CE1 3.25Å; D991-F994 WeakPolarHBondContact O-CE1 3.36Å; W992-F994 PolarHBondContact O-N 3.14Å; F994-Q996 VanDerWaalsContact C-N 3.29Å; F994-Q996 PolarHBondContact O-N 3.49Å; F994-K997 WeakPolarHBondContact O-CB 3.34Å; F994-K997 PolarHBondContact O-N 3.09Å; F994-I998 PolarHBondContact O-N 3.14Å
995	L	90.7	Very high	86.4	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-65.3	-31.9	175.1	-58.9	-173.6	0	0	0	112.9	L968 E969 I972 L981 W992 G993 I998 R999 L1002 V1004	L968-L995 HydrophobicContact CB-CD2 4.04Å; E969-L995 HydrophobicContact CG-CD2 4.49Å; I972-L995 HydrophobicContact CG1-CD1 4.43Å; I972-L995 HydrophobicContact CG1-CD2 3.8Å; L981-L995 HydrophobicContact CD2-CD1 3.67Å; W992-L995 HydrophobicContact CE3-CD1 3.94Å; W992-L995 HydrophobicContact CZ3-CD1 4.22Å; W992-L995 PolarHBondContact O-N 3.01Å; G993-L995 PolarHBondContact O-N 3.31Å; L995-I998 PolarHBondContact O-N 3.12Å; L995-R999 PolarHBondContact O-N 3.49Å; L995-L1002 HydrophobicContact CD1-CD2 4.31Å; L995-L1002 HydrophobicContact CB-CD2 3.99Å; L995-V1004 HydrophobicContact CD1-CG2 4.3Å
996	Q	86.1	Confident	86	Confident	112 Å²	112	61.4 Å²	61.4	52%	0.523	33%	0.33	S	S	.	.	H	α-helix	trans	-73.9	-25.5	176.9	-66.4	-176.2	-14.3	0	0	112.8	G993 F994 R999 P1000	G993-Q996 PolarHBondContact O-N 3.46Å; G993-Q996 VanDerWaalsContact O-N 3.13Å; F994-Q996 VanDerWaalsContact C-N 3.29Å; F994-Q996 PolarHBondContact O-N 3.49Å; Q996-R999 CarbonylContact O-C 3.49Å; Q996-P1000 WeakPolarHBondContact O-CA 3.36Å; Q996-P1000 VanDerWaalsContact O-CD 3.3Å; Q996-P1000 WeakPolarHBondContact O-CD 3.07Å; Q996-P1000 VanDerWaalsContact O-CG 3.31Å; Q996-P1000 WeakPolarHBondContact O-CG 3.31Å; Q996-P1000 VanDerWaalsContact O-N 3.12Å
997	K	88.7	Confident	85	Confident	170 Å²	170	62 Å²	62	74%	0.739	34%	0.342	S	S	*	.	H	α-helix	trans	-66.7	-43.9	169.8	-66.2	167.3	-169.3	169.4	0	111	G993 F994	G993-K997 WeakPolarHBondContact O-CG 3.4Å; G993-K997 PolarHBondContact O-N 2.96Å; F994-K997 WeakPolarHBondContact O-CB 3.34Å; F994-K997 PolarHBondContact O-N 3.09Å
998	I	88.7	Confident	83.3	Confident	56 Å²	56	67.6 Å²	67.6	29%	0.287	37%	0.365	S	S	.	.	H	α-helix	trans	-68.9	-44.8	177.4	-59.8	171.6	0	0	0	110.7	E969 I972 E973 F994 L995	E969-I998 HydrophobicContact CB-CD1 3.71Å; E969-I998 HydrophobicContact CG-CD1 3.68Å; I972-I998 HydrophobicContact CB-CG2 4.41Å; I972-I998 HydrophobicContact CG2-CB 4.34Å; I972-I998 HydrophobicContact CG2-CG2 3.75Å; E973-I998 HydrophobicContact CG-CD1 4.45Å; E973-I998 HydrophobicContact CG-CG2 3.8Å; F994-I998 PolarHBondContact O-N 3.14Å; L995-I998 PolarHBondContact O-N 3.12Å
999	R	88.7	Confident	83.4	Confident	31 Å²	31	66.7 Å²	66.7	12%	0.117	35%	0.353	C	S	.	.			trans	-140.7	93.4	179.9	-170.5	169.9	-64.5	141.3	13.6	112.5	I972 C975 L978 L995 Q996 T1001 L1002	I972-R999 HydrophobicContact CG2-CB 3.89Å; I972-R999 PolarHBondContact O-NH1 3.04Å; I972-R999 PolarHBondContact O-NH2 3.11Å; C975-R999 PolarHBondContact O-NH1 3.45Å; C975-R999 PolarHBondContact O-NH2 2.95Å; L978-R999 WeakPolarHBondContact O-CD 3.2Å; L978-R999 PolarHBondContact O-NH1 3.23Å; L995-R999 PolarHBondContact O-N 3.49Å; Q996-R999 CarbonylContact O-C 3.49Å; R999-T1001 WeakPolarHBondContact CG-OG1 3.47Å; R999-T1001 PolarHBondContact O-N 2.8Å; R999-T1001 VanDerWaalsContact CG-OG1 3.29Å; R999-L1002 HydrophobicContact CB-CB 4Å; R999-L1002 HydrophobicContact CG-CB 3.95Å; R999-L1002 WeakPolarHBondContact O-CB 3.12Å; R999-L1002 PolarHBondContact O-N 3.05Å
1000	P	88.5	Confident	83.4	Confident	108 Å²	108	69.5 Å²	69.5	70%	0.701	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-9.7	175.7	-24.3	32.8	0	0	0	115.3	Q996	Q996-P1000 WeakPolarHBondContact O-CA 3.36Å; Q996-P1000 VanDerWaalsContact O-CD 3.3Å; Q996-P1000 WeakPolarHBondContact O-CD 3.07Å; Q996-P1000 VanDerWaalsContact O-CG 3.31Å; Q996-P1000 WeakPolarHBondContact O-CG 3.31Å; Q996-P1000 VanDerWaalsContact O-N 3.12Å
1001	T	88.4	Confident	83.6	Confident	63 Å²	63	65.6 Å²	65.6	39%	0.387	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.5	-2.5	178	50.4	0	0	0	0	114.1	R218 R999	R218-T1001 PolarHBondContact NH2-O 3.3Å; R218-T1001 VanDerWaalsContact NH2-O 3.13Å; R999-T1001 WeakPolarHBondContact CG-OG1 3.47Å; R999-T1001 PolarHBondContact O-N 2.8Å; R999-T1001 VanDerWaalsContact CG-OG1 3.29Å
1002	L	90.2	Very high	83.5	Confident	7 Å²	7	63.2 Å²	63.2	4%	0.037	33%	0.334	C	S	.	.			trans	-78.9	121.5	176.2	179.6	73.1	0	0	0	109.6	I972 L978 L981 L995 R999 V1004	I972-L1002 HydrophobicContact CD1-CD1 4.11Å; I972-L1002 HydrophobicContact CD1-CD2 3.59Å; I972-L1002 HydrophobicContact CG1-CD2 3.82Å; I972-L1002 HydrophobicContact CG2-CD2 4.37Å; L978-L1002 HydrophobicContact CG-CD1 4.19Å; L978-L1002 WeakPolarHBondContact O-CD1 3.32Å; L981-L1002 HydrophobicContact CB-CD1 4.39Å; L995-L1002 HydrophobicContact CD1-CD2 4.31Å; L995-L1002 HydrophobicContact CB-CD2 3.99Å; R999-L1002 HydrophobicContact CB-CB 4Å; R999-L1002 HydrophobicContact CG-CB 3.95Å; R999-L1002 WeakPolarHBondContact O-CB 3.12Å; R999-L1002 PolarHBondContact O-N 3.05Å; L1002-V1004 HydrophobicContact CD2-CG2 3.73Å; L1002-V1004 HydrophobicContact CG-CG2 3.9Å
1003	L	90.1	Very high	83.2	Confident	62 Å²	62	66.3 Å²	66.3	33%	0.325	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	114.5	172.4	-161.4	152.5	0	0	0	108.5	F216 T979 L980 L981 E1005	F216-L1003 HydrophobicContact CD1-CD1 4.17Å; F216-L1003 HydrophobicContact CG-CD1 4.4Å; T979-L1003 PolarHBondContact O-N 3.29Å; L980-L1003 WeakPolarHBondContact CA-O 3.3Å; L980-L1003 HydrophobicContact CD1-CB 4.22Å; L980-L1003 HydrophobicContact CD1-CD2 3.74Å; L981-L1003 PolarHBondContact N-O 3.46Å; L1003-E1005 HydrophobicContact CD2-CG 3.71Å
1004	V	89.2	Confident	83.1	Confident	23 Å²	23	69.5 Å²	69.5	14%	0.139	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	103.1	178.2	-176.1	0	0	0	0	108.3	L981 W992 L995 L1002 K1006	L981-V1004 HydrophobicContact CB-CG2 4.48Å; L981-V1004 HydrophobicContact CD2-CG1 4.48Å; L981-V1004 CarbonylContact O-C 3.56Å; L981-V1004 WeakPolarHBondContact O-CA 3.44Å; W992-V1004 HydrophobicContact CD2-CG1 4.35Å; W992-V1004 HydrophobicContact CE3-CG1 3.76Å; W992-V1004 HydrophobicContact CZ3-CG1 4.3Å; L995-V1004 HydrophobicContact CD1-CG2 4.3Å; L1002-V1004 HydrophobicContact CD2-CG2 3.73Å; L1002-V1004 HydrophobicContact CG-CG2 3.9Å; V1004-K1006 HydrophobicContact CG1-CB 4.38Å
1005	E	86.7	Confident	82.6	Confident	22 Å²	22	72.9 Å²	72.9	10%	0.103	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	116	168.2	-82.5	-66.4	-179.7	0	0	108.1	K481 L981 Y982 A983 Y984 L1003	K481-E1005 WeakPolarHBondContact CE-OE2 3.26Å; K481-E1005 IonicContact NZ-OE1 2.69Å; K481-E1005 PolarHBondContact NZ-OE1 2.94Å; K481-E1005 IonicContact NZ-OE2 3.02Å; K481-E1005 PolarHBondContact NZ-OE2 3.4Å; L981-E1005 PolarHBondContact O-N 3.18Å; Y982-E1005 WeakPolarHBondContact CA-O 3.29Å; Y982-E1005 HydrophobicContact CD1-CB 3.62Å; Y982-E1005 HydrophobicContact CD1-CG 4.36Å; Y982-E1005 HydrophobicContact CE1-CB 3.8Å; Y982-E1005 HydrophobicContact CE1-CG 4.01Å; Y982-E1005 HydrophobicContact CG-CB 4.34Å; A983-E1005 PolarHBondContact N-O 3Å; Y984-E1005 VanDerWaalsContact CE2-C 3.43Å; Y984-E1005 HydrophobicContact CE2-CB 3.99Å; Y984-E1005 WeakPolarHBondContact CE2-O 3.23Å; Y984-E1005 WeakPolarHBondContact OH-CB 3.24Å; Y984-E1005 PolarHBondContact OH-OE2 3.12Å; L1003-E1005 HydrophobicContact CD2-CG 3.71Å
1006	K	75	Confident	81.9	Confident	81 Å²	81	78.5 Å²	78.5	35%	0.352	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	163.3	-176.4	62	171.3	-175.2	165.3	0	110.9	Y984 W992 V1004	Y984-K1006 WeakPolarHBondContact CE1-O 3.22Å; Y984-K1006 VanDerWaalsContact CZ-C 3.43Å; Y984-K1006 PolarHBondContact OH-N 2.89Å; Y984-K1006 PolarHBondContact OH-O 2.71Å; W992-K1006 HydrophobicContact CB-CD 4.09Å; W992-K1006 VanDerWaalsContact CG-CD 3.49Å; W992-K1006 HydrophobicContact CG-CD 3.49Å; W992-K1006 HydrophobicContact CD2-CD 3.92Å; W992-K1006 VanDerWaalsContact CD1-CD 3.41Å; V1004-K1006 HydrophobicContact CG1-CB 4.38Å
1007	G	63.6	Low	81.6	Confident	35 Å²	35	75.7 Å²	75.7	36%	0.361	40%	0.402	S	S	.	.			trans	-68.8	161.7	175.2	0	0	0	0	0	112.9	Y984	Y984-G1007 VanDerWaalsContact CD1-CA 3.5Å; Y984-G1007 VanDerWaalsContact CD1-N 3.28Å; Y984-G1007 VanDerWaalsContact CE1-N 3.32Å
1008	I	41.4	Very low	80.9	Confident	250 Å²	250	67.1 Å²	67.1	100%	1.282	37%	0.372	S	S	*	.			trans	-100.5	0	153.4	-54.5	176.5	0	0	0	105.9

Retrieved 1,008 of 1,008 residues in 595.8 ms (Link to these results)

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