A0A5K4EZS5_SCHMA Loading...

Metalloendopeptidase

AlphaFold DB , UniProt , Accession A0A5K4EZS5, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,646 aa.

						>A0A5K4EZS5_SCHMA|A0A5K4EZS5
MNFPVDHFFILINAFVHLVVNIQLIWLNPHVTEETIVNIPKVYFIHPGPSVSGSQLIKNQFQSYNGSYFEKPYNYKVKKHKMNNNTTNNNNSRLYNGTQTNSRPTHKKIFKDHNISKTTLFVERLHEKVNYFIPKSLKFEPEKDLAILYPGSTWLDPCKATAYYGDIALDEHESQIMLSKGMVLSDDPLQIWNLEDNKETNNGRNKHSNIPNSNPLDDIKREISTHLAGNSRHLKQKHIRSYKDMADRNLPRKLKNLTSRRRDQSNKFGQRWQRRRNELLKRRRYNQLKAETQAFIQLNKSYQQKADILMFTPEQRKRKEFSQSKRRSKRAATAYVSRTWTNGVIPYIIQANFSSETKATIMKAMRHWENYTCLSFVERQPHHRSYIIFTEKACGCCSYVGRRSEDEPQAISIGKNCDKKGIVIHELGHVIGFWHEHTRPDRDEHVDILLDNVVEGQDFNFKKMDPGEVNSLGEPYDYSSIMHYAKGTFAKANKDETIRPKACCPRPPIGQRIQLSPGDIRQTNKLYLCPACGRTLLEPVGSLSSPQMAWKLEDRFGGNANSSLFPDPIGLEQSIQLGNAISVDHLLPDDNENMYHPYRSLTNGNSIDGGEDHSLIGMVNDNNYQLKTLPYNPFKGSFNNEEVPLIAMSRLSKLSKTSSSSTLGFTSASPILCQWRINAASGERIRLNFTHMDISGPITQDSIHTPNNLNDLHKAYELNQKSINRISCINDYVEIRDGYYSGSPLIGRYCGQNLPPQLISTGSRLWLEYRRSAGSMTTGFIADYEAICGGELQMEEGTLTSPNYPEFYRPSKECVWQIIVPVGYSVALIFHSFQLEKHDTCVYDYLEVRDGLKDTSPLLKKLCGSHLPTPIKSTNNVMYVKFVSDSSVEKQGFTATFQKEFDECKTMKHGCSHTCVNTLGGYRCQCEIGYELHADGKRCEDACGGVINESNGTIQTPLFPDLYPPKKNCIWKILAPPKTTIFLNFTHFNLEGHNRACRYDFINVYNGSTDNQQKIGTFCGDQIPEPITSHTNELSIEFYSDTSVQRTGFRAVFFTDRDECADNNGGCQHLCRNTIGSYHCACRPGFNLYGRYECKENIKTGCQQDISSPDGEIITPNWPNEYPVKQNCHWKITVTPGHRVKVIFADFELESHQQCTYDQVIAYDGPTNSSAFLGQYCGSRKPGPIISSQNQLLLTFNSDSSVQRKGFRAQHTTICGGHLTADSVAQTLYSHAKFGDLDYESNQQCYWTITPKLDNHTVLLKFLYFEVEEETLCTYDYLRVFDGGDPKGKLLGGFCGRTLPNTFLSNSGQLYLQFVSDDTIGGKGFQAQYQMIPYDFKLPKHEIDSQVLVNQIPSHSSPSSSSSSSSSSPSSVYYGKNEMLQQYQPFHGNRYLFPPAWGTGRIRYFGDMRSSEMTENYQSTRPFNYHPSYQHVKQSSPIQQTNPMIYSQNNIYQRRDGRLPVNRDNSQLPWRFAYTYPQAKSPSTIRQTATNNLFRSNPSYSTYSSRLSKQTAIQSKSPIEFLHTTTQPDSPLLSQNTINSRKPRISSTWHVRPGRVVHQPQLNIVNRIIQPNSKNYQSPPRSIRRQAKSHLYQQKQTEQNPKSPMRFHVVTQRDRSPPLFSGGSQWKQRSMPLSRSRWDDRAIKTF
					

Structure Viewer

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	30.7	Very low	28.9	Very low	226 Å²	226	146.8 Å²	146.8	100%	1.113	74%	0.736	S	S	*	*				0	68.1	0	-63.3	-179.6	-176.5	0	0	107
2	N	35.8	Very low	28.8	Very low	145 Å²	145	145.8 Å²	145.8	78%	0.775	73%	0.732	S	S	*	*				85.8	64.6	78.3	-65.4	28.6	0	0	0	108.2
3	F	25.9	Very low	28.6	Very low	203 Å²	203	146.2 Å²	146.2	89%	0.89	74%	0.738	S	S	*	*				73.9	139	77.5	-88.8	-107.2	0	0	0	114.4
4	P	38.3	Very low	28.4	Very low	91 Å²	91	140.7 Å²	140.7	59%	0.591	73%	0.726	S	S	*	*				-144.4	-166	-125.5	33.1	-7.2	0	0	0	115.2
5	V	29.9	Very low	28.3	Very low	121 Å²	121	144.7 Å²	144.7	73%	0.733	74%	0.736	S	S	*	*			trans	57.6	164.8	156	-72.6	0	0	0	0	118.3
6	D	27.8	Very low	28.3	Very low	123 Å²	123	143 Å²	143	66%	0.658	74%	0.735	S	S	*	*			cis	-155.2	159.5	1.5	-133.8	-27.4	0	0	0	111.7
7	H	28.4	Very low	28.2	Very low	145 Å²	145	143.9 Å²	143.9	67%	0.671	74%	0.735	S	S	*	*			trans	50.4	174.6	146.8	-95.8	-128.6	0	0	0	119.8
8	F	25.7	Very low	28.3	Very low	147 Å²	147	144.3 Å²	144.3	65%	0.645	74%	0.738	S	S	*	*			cis	-157.9	166.7	-34.5	-139	-144.3	0	0	0	109.1
9	F	25.2	Very low	28.4	Very low	158 Å²	158	143.1 Å²	143.1	69%	0.693	74%	0.738	S	S	*	*			trans	64.9	127.9	145.4	-94.5	-147.3	0	0	0	124.8
10	I	26.1	Very low	28.5	Very low	120 Å²	120	142.3 Å²	142.3	62%	0.615	74%	0.739	S	S	*	*				74.2	116.9	126.8	-70.9	-170.8	0	0	0	122.4
11	L	24.6	Very low	28.4	Very low	136 Å²	136	142.3 Å²	142.3	71%	0.712	74%	0.741	S	S	*	*			trans	40.1	146.2	131.2	-49.1	176.3	0	0	0	123.2
12	I	27.5	Very low	28.3	Very low	135 Å²	135	138.6 Å²	138.6	69%	0.692	72%	0.724	S	S	*	*				43.6	121.3	127.7	-60.5	171.7	0	0	0	116.2
13	N	26	Very low	27.9	Very low	151 Å²	151	136.9 Å²	136.9	81%	0.807	71%	0.711	S	S	*	*			cis	-162	175.8	13.6	-121.6	-3.1	0	0	0	107.4
14	A	25.6	Very low	28	Very low	69 Å²	69	134.4 Å²	134.4	57%	0.57	71%	0.706	S	S	*	*			cis	-155.1	172.9	7.4	0	0	0	0	0	109
15	F	27.4	Very low	27.5	Very low	200 Å²	200	136 Å²	136	88%	0.877	71%	0.708	S	S	*	*			trans	-150.4	81.6	146.3	-128.2	-77.3	0	0	0	114.3
16	V	28.3	Very low	27.2	Very low	118 Å²	118	139.5 Å²	139.5	72%	0.715	71%	0.709	S	S	*	*			trans	-70.3	131.9	140.8	159.9	0	0	0	0	105.7
17	H	26.9	Very low	27.4	Very low	159 Å²	159	140.9 Å²	140.9	74%	0.736	72%	0.715	S	S	*	*			cis	-153.3	160.5	10.5	-135.7	-150.7	0	0	0	109.8
18	L	29.1	Very low	27.3	Very low	151 Å²	151	139 Å²	139	79%	0.791	71%	0.71	S	S	*	*			trans	-144.8	119	167	-152.3	103.8	0	0	0	111.1
19	V	31	Very low	28	Very low	121 Å²	121	136.1 Å²	136.1	73%	0.733	71%	0.706	S	S	*	*			trans	52.3	133.4	134	167.1	0	0	0	0	119.2
20	V	29.8	Very low	28.1	Very low	127 Å²	127	136.4 Å²	136.4	77%	0.77	71%	0.71	S	S	*	*			cis	-164.9	170.5	-13.6	107.5	0	0	0	0	108.6
21	N	26	Very low	28.3	Very low	143 Å²	143	137 Å²	137	77%	0.765	72%	0.719	S	S	*	*			trans	-61.1	156	173.6	-65.8	-56.5	0	0	0	114
22	I	30	Very low	28.4	Very low	147 Å²	147	136.1 Å²	136.1	75%	0.754	72%	0.719	S	S	*	*				-174.9	132.2	115.3	-98.9	161.9	0	0	0	112.9
23	Q	27.7	Very low	28.3	Very low	110 Å²	110	138.2 Å²	138.2	51%	0.514	73%	0.726	S	S	.	*			trans	52.9	122.9	155.6	-67.3	170	-17.6	0	0	119.9
24	L	27.4	Very low	28.2	Very low	150 Å²	150	139.3 Å²	139.3	79%	0.785	73%	0.726	S	S	*	*				67.4	138.1	67	-61.2	178.7	0	0	0	112.2
25	I	26.6	Very low	28.3	Very low	124 Å²	124	142 Å²	142	64%	0.636	74%	0.735	S	S	*	*			cis	-161.2	148.5	18.3	-129.4	159.9	0	0	0	113.8
26	W	25.4	Very low	28.2	Very low	195 Å²	195	139.8 Å²	139.8	74%	0.739	73%	0.731	S	S	*	*			trans	65.9	148.8	160.7	-69.2	24.7	0	0	0	118.9	N28	W26-N28 HydrophobicContact CD2-CB 4.5Å; W26-N28 HydrophobicContact CG-CB 4.46Å
27	L	30.5	Very low	27.9	Very low	153 Å²	153	139.8 Å²	139.8	80%	0.801	73%	0.731	S	S	*	*			cis	-126.7	137.9	21	-67.1	153.5	0	0	0	110.4
28	N	27.8	Very low	27.9	Very low	104 Å²	104	139.5 Å²	139.5	56%	0.556	74%	0.735	S	S	*	*			cis	75	145.2	26	-137.8	20.8	0	0	0	113.2	W26	W26-N28 HydrophobicContact CD2-CB 4.5Å; W26-N28 HydrophobicContact CG-CB 4.46Å
29	P	39.6	Very low	27.7	Very low	88 Å²	88	139.6 Å²	139.6	57%	0.571	74%	0.735	S	S	*	*			cis	-141.1	-173	7.6	37.7	-15	0	0	0	119
30	H	27.8	Very low	27.7	Very low	164 Å²	164	138.6 Å²	138.6	76%	0.759	73%	0.731	S	S	*	*			trans	86.1	151.7	163.1	-60	-52.1	0	0	0	117.7
31	V	29.3	Very low	27.6	Very low	133 Å²	133	139.9 Å²	139.9	81%	0.806	73%	0.726	S	S	*	*			cis	-111.4	-148.5	5.3	-148.4	0	0	0	0	112.2
32	T	27.3	Very low	27.5	Very low	117 Å²	117	138.7 Å²	138.7	72%	0.718	72%	0.724	S	S	*	*			trans	-150.5	151.7	-169.3	49.1	0	0	0	0	113.2
33	E	25	Very low	27.5	Very low	178 Å²	178	137.8 Å²	137.8	83%	0.832	71%	0.712	S	S	*	*			trans	3.1	158.7	154.8	-67.5	173.3	130.3	0	0	124.9
34	E	24.3	Very low	27.4	Very low	175 Å²	175	139 Å²	139	82%	0.818	72%	0.716	S	S	*	*			trans	87.9	155.1	149	-87.6	-171.8	-179	0	0	123.6
35	T	27.7	Very low	27.6	Very low	125 Å²	125	137.5 Å²	137.5	77%	0.767	71%	0.707	S	S	*	*			trans	66.2	127.6	-175.9	59.2	0	0	0	0	116.7
36	I	24	Very low	27.7	Very low	153 Å²	153	137.7 Å²	137.7	79%	0.785	71%	0.705	S	S	*	*			cis	82.4	102.5	44.6	-62.6	173.4	0	0	0	113.3
37	V	23.7	Very low	28.2	Very low	118 Å²	118	134 Å²	134	72%	0.715	71%	0.707	S	S	*	*			trans	47.4	99.5	147.3	-173.9	0	0	0	0	117.7
38	N	26.3	Very low	28.1	Very low	154 Å²	154	130.2 Å²	130.2	82%	0.824	70%	0.704	S	S	*	*				-173	146.5	109.2	-104.2	-53.3	0	0	0	116.7
39	I	23.6	Very low	28.5	Very low	152 Å²	152	131 Å²	131	78%	0.779	72%	0.715	S	S	*	*			trans	-75.7	154.4	157.6	-76.4	164.1	0	0	0	107.6
40	P	31.3	Very low	27.8	Very low	101 Å²	101	132.1 Å²	132.1	66%	0.656	73%	0.725	S	S	*	*			cis	-141.5	-172.4	27.1	22.9	4.8	0	0	0	117.5
41	K	28.4	Very low	27.9	Very low	154 Å²	154	130.2 Å²	130.2	67%	0.67	72%	0.724	S	S	*	*			trans	73.2	74.3	148.7	-79.6	159.8	-176	179.3	0	117.9	Y43	K41-Y43 HydrophobicContact CG-CD1 4.44Å; K41-Y43 HydrophobicContact CG-CE1 4.42Å
42	V	24.2	Very low	27.8	Very low	118 Å²	118	129.2 Å²	129.2	72%	0.715	72%	0.723	S	S	*	*			trans	-57.4	141.1	133.9	178.7	0	0	0	0	109.1	F44	V42-F44 HydrophobicContact CG1-CD2 4.32Å; V42-F44 HydrophobicContact CG1-CE2 3.84Å
43	Y	29.3	Very low	27.7	Very low	127 Å²	127	127.6 Å²	127.6	50%	0.498	73%	0.73	S	S	.	*			trans	-172.3	156.4	165.5	-93.7	169.4	0	0	0	107.4	K41 Q1527 P1528	K41-Y43 HydrophobicContact CG-CD1 4.44Å; K41-Y43 HydrophobicContact CG-CE1 4.42Å; Y43-Q1527 HydrophobicContact CD1-CB 3.56Å; Y43-Q1527 HydrophobicContact CD1-CG 3.9Å; Y43-Q1527 HydrophobicContact CD2-CB 3.91Å; Y43-Q1527 HydrophobicContact CD2-CG 3.47Å; Y43-Q1527 VanDerWaalsContact CD2-CG 3.47Å; Y43-Q1527 HydrophobicContact CE1-CB 4.13Å; Y43-Q1527 HydrophobicContact CE1-CG 4.09Å; Y43-Q1527 HydrophobicContact CE2-CB 4.45Å; Y43-Q1527 HydrophobicContact CE2-CG 3.72Å; Y43-Q1527 HydrophobicContact CG-CB 3.44Å; Y43-Q1527 VanDerWaalsContact CG-CB 3.44Å; Y43-Q1527 HydrophobicContact CG-CG 3.59Å; Y43-P1528 VanDerWaalsContact CB-CG 3.42Å; Y43-P1528 HydrophobicContact CD1-CB 4.03Å; Y43-P1528 HydrophobicContact CG-CB 4.32Å
44	F	26.2	Very low	27.9	Very low	136 Å²	136	124.1 Å²	124.1	60%	0.596	73%	0.725	S	S	*	*			trans	-123.8	156	-173.8	-54.5	166.3	0	0	0	112.7	V42 T1526 Q1527 P1528	V42-F44 HydrophobicContact CG1-CD2 4.32Å; V42-F44 HydrophobicContact CG1-CE2 3.84Å; F44-T1526 HydrophobicContact CB-CG2 3.98Å; F44-T1526 CarbonylContact O-C 3.56Å; F44-T1526 WeakPolarHBondContact O-CA 3.45Å; F44-T1526 WeakPolarHBondContact O-CB 3.05Å; F44-T1526 VanDerWaalsContact O-CG2 3.31Å; F44-T1526 WeakPolarHBondContact O-CG2 3.14Å; F44-Q1527 VanDerWaalsContact N-OE1 3.16Å; F44-Q1527 PolarHBondContact O-N 3.24Å; F44-P1528 WeakPolarHBondContact O-CD 3.42Å
45	I	31.6	Very low	28.1	Very low	119 Å²	119	124.3 Å²	124.3	61%	0.61	73%	0.726	S	S	*	*			trans	-129.4	104.7	152.4	-75.1	179.4	0	0	0	112	P1528	I45-P1528 WeakPolarHBondContact CD1-O 3.25Å
46	H	29.5	Very low	28	Very low	127 Å²	127	125.3 Å²	125.3	59%	0.588	73%	0.726	S	S	*	*			trans	53.7	158.1	147.4	-82.3	-36.5	0	0	0	123.1	T1525 T1526	H46-T1525 PolarHBondContact CE1-O 2.8Å; H46-T1526 HydrophobicContact CB-CG2 4.48Å; H46-T1526 PolarHBondContact CD2-OG1 3.3Å; H46-T1526 PolarHBondContact CE1-OG1 3.3Å; H46-T1526 PolarHBondContact NE2-OG1 2.54Å
47	P	35.2	Very low	28.3	Very low	119 Å²	119	125.1 Å²	125.1	77%	0.773	73%	0.725	S	S	*	*			trans	-135.7	-176.4	-137.9	44.1	-25.8	0	0	0	115.6
48	G	27.5	Very low	28.5	Very low	73 Å²	73	127.8 Å²	127.8	75%	0.753	73%	0.727	S	S	*	*			trans	171.7	112.5	164.6	0	0	0	0	0	112.8
49	P	35.8	Very low	28.7	Very low	121 Å²	121	125.9 Å²	125.9	79%	0.786	72%	0.717	S	S	*	*			trans	-106.4	167.7	-173.2	39	-34.6	0	0	0	115.4
50	S	26.4	Very low	28.9	Very low	110 Å²	110	125.4 Å²	125.4	77%	0.769	71%	0.711	S	S	*	*			trans	107	147.9	138.3	79.9	0	0	0	0	121.6
51	V	29.9	Very low	28.8	Very low	125 Å²	125	127.9 Å²	127.9	76%	0.758	71%	0.712	S	S	*	*			trans	83	117.8	159.5	-167.5	0	0	0	0	120.6
52	S	27.1	Very low	28.6	Very low	111 Å²	111	127.9 Å²	127.9	78%	0.776	72%	0.715	S	S	*	*			trans	37.1	124.2	157.3	71.2	0	0	0	0	121.8
53	G	25.3	Very low	28.7	Very low	83 Å²	83	125.8 Å²	125.8	86%	0.856	71%	0.705	S	S	*	*			trans	-102.3	-176.3	165.9	0	0	0	0	0	114.7
54	S	29.1	Very low	28.6	Very low	106 Å²	106	129.4 Å²	129.4	74%	0.741	72%	0.719	S	S	*	*			trans	-139.9	127.6	170.1	57	0	0	0	0	110.1
55	Q	28.6	Very low	28.7	Very low	179 Å²	179	130.3 Å²	130.3	84%	0.836	73%	0.73	S	S	*	*				33.4	144.5	120.3	-63.7	-164.7	-2.6	0	0	119.2
56	L	26	Very low	28.5	Very low	146 Å²	146	127.1 Å²	127.1	76%	0.764	73%	0.727	S	S	*	*			cis	161.7	129.1	-11	-120.5	172.3	0	0	0	104.3
57	I	29.8	Very low	28.3	Very low	149 Å²	149	126.3 Å²	126.3	76%	0.764	74%	0.735	S	S	*	*			trans	-169.3	116.3	158.6	-105.4	147.6	0	0	0	105.6
58	K	27	Very low	28.1	Very low	173 Å²	173	130 Å²	130	75%	0.752	74%	0.735	S	S	*	*				61	134.9	86.7	-70.8	179.7	178.8	176.9	0	111
59	N	30.2	Very low	28.2	Very low	114 Å²	114	134.6 Å²	134.6	61%	0.61	74%	0.735	S	S	*	*			cis	-163.6	-169.3	21.8	-112.9	6.8	0	0	0	107.7
60	Q	28.9	Very low	27.8	Very low	143 Å²	143	135 Å²	135	67%	0.668	73%	0.726	S	S	*	*			cis	-160.2	135.6	4	-133.8	153.5	-66	0	0	111
61	F	28	Very low	27.8	Very low	153 Å²	153	137.2 Å²	137.2	67%	0.671	72%	0.722	S	S	*	*				68.6	136.5	126.5	-77.3	-137.6	0	0	0	120.3
62	Q	25.1	Very low	28	Very low	154 Å²	154	136.4 Å²	136.4	72%	0.72	72%	0.719	S	S	*	*				78.3	144.5	59.5	-75.6	-175.3	-7.3	0	0	113.9
63	S	26.1	Very low	28	Very low	74 Å²	74	142.1 Å²	142.1	52%	0.517	73%	0.726	S	S	.	*			cis	-174.8	-171.9	-1.5	45.6	0	0	0	0	112.5
64	Y	28.1	Very low	28	Very low	203 Å²	203	144.7 Å²	144.7	80%	0.796	72%	0.719	S	S	*	*			trans	79.7	146.2	169.9	-52.7	-69.6	0	0	0	116.4
65	N	28.5	Very low	27.7	Very low	155 Å²	155	149.5 Å²	149.5	83%	0.829	72%	0.723	S	S	*	*			cis	-159.1	176.5	-5.8	-120.7	-10.1	0	0	0	109
66	G	26.5	Very low	27.6	Very low	52 Å²	52	150 Å²	150	54%	0.536	72%	0.723	S	S	.	*			cis	158.2	146.7	-5.9	0	0	0	0	0	113.2
67	S	26.1	Very low	27.5	Very low	110 Å²	110	148.7 Å²	148.7	77%	0.769	72%	0.72	S	S	*	*			trans	71.2	154.2	178.6	82.6	0	0	0	0	117
68	Y	29.7	Very low	27.3	Very low	196 Å²	196	150.4 Å²	150.4	77%	0.769	72%	0.722	S	S	*	*			cis	-152.2	150.3	13.9	-121.8	-55	0	0	0	112.9
69	F	29.1	Very low	27.2	Very low	170 Å²	170	149.7 Å²	149.7	75%	0.746	72%	0.719	S	S	*	*			trans	57.6	149.4	168.8	-70.7	-90.6	0	0	0	120.5
70	E	28.3	Very low	27.1	Very low	130 Å²	130	151.2 Å²	151.2	61%	0.607	72%	0.722	S	S	*	*			cis	-179.9	164.4	-37.5	-93.3	-137.9	137.8	0	0	106.1
71	K	26	Very low	26.9	Very low	155 Å²	155	152 Å²	152	67%	0.674	72%	0.723	S	S	*	*			cis	-155.6	158.3	-6.4	-129.2	-178.1	-170.4	116.3	0	108.5
72	P	35.1	Very low	26.8	Very low	108 Å²	108	151.5 Å²	151.5	70%	0.701	73%	0.725	S	S	*	*			trans	-105.7	171	178.9	39.8	-33.1	0	0	0	114.2
73	Y	27	Very low	27	Very low	232 Å²	232	149.9 Å²	149.9	91%	0.91	72%	0.721	S	S	*	*			trans	-145.9	167.9	155.1	-102.8	-69.1	0	0	0	113.1
74	N	23.7	Very low	27.1	Very low	136 Å²	136	152 Å²	152	73%	0.727	73%	0.727	S	S	*	*			trans	-151.2	145.5	-148.6	-134	-9	0	0	0	113.5
75	Y	23.9	Very low	27	Very low	207 Å²	207	148.4 Å²	148.4	81%	0.812	72%	0.721	S	S	*	*			trans	67.6	160.6	157	-93.3	-100.7	0	0	0	122.7
76	K	25.6	Very low	27	Very low	191 Å²	191	146.5 Å²	146.5	83%	0.83	72%	0.715	S	S	*	*			trans	76.6	124.5	174.9	-58.4	177.7	-177	174.9	0	115.4
77	V	25.6	Very low	27.2	Very low	118 Å²	118	149.1 Å²	149.1	72%	0.715	72%	0.721	S	S	*	*			cis	96.1	112.2	19.7	-175.6	0	0	0	0	115.5
78	K	24.8	Very low	27.4	Very low	184 Å²	184	150.2 Å²	150.2	80%	0.8	72%	0.718	S	S	*	*			trans	79.2	112.7	157.2	-77.5	171.3	-177.2	173.6	0	121.7
79	K	25.5	Very low	27.6	Very low	158 Å²	158	146.7 Å²	146.7	69%	0.687	71%	0.713	S	S	*	*				88.3	122.7	120.3	-82.1	-173.1	160.2	-156.4	0	122.1
80	H	26.4	Very low	27.8	Very low	147 Å²	147	144.4 Å²	144.4	68%	0.681	71%	0.708	S	S	*	*			trans	68.8	153.8	140.2	-62.1	-40.2	0	0	0	117.5
81	K	26.7	Very low	28	Very low	159 Å²	159	144.2 Å²	144.2	69%	0.691	71%	0.711	S	S	*	*			cis	-152.2	170.6	-1.7	-132	-178.5	-177.1	-170.8	0	110.6
82	M	26	Very low	28.2	Very low	142 Å²	142	140.5 Å²	140.5	70%	0.7	71%	0.705	S	S	*	*			trans	6.7	146.3	137.3	-70.5	157.8	171	0	0	118.3
83	N	27.7	Very low	28	Very low	121 Å²	121	146.1 Å²	146.1	65%	0.647	71%	0.712	S	S	*	*			cis	-164.8	157.7	31.9	-137.1	17	0	0	0	115
84	N	28.2	Very low	28.1	Very low	119 Å²	119	141.2 Å²	141.2	64%	0.636	70%	0.701	S	S	*	*			trans	41.5	139.6	137	-72.5	8.1	0	0	0	124.3
85	N	27	Very low	28.4	Very low	126 Å²	126	144.4 Å²	144.4	67%	0.674	71%	0.705	S	S	*	*				95.6	125.2	129.3	-82.6	13.6	0	0	0	122.4
86	T	28.9	Very low	28.5	Very low	115 Å²	115	142.2 Å²	142.2	71%	0.706	71%	0.707	S	S	*	*			trans	74.1	144	133.6	58.9	0	0	0	0	119
87	T	29.3	Very low	28.7	Very low	108 Å²	108	136.1 Å²	136.1	66%	0.663	70%	0.699	S	S	*	*			cis	-165	168.5	-0.7	9.1	0	0	0	0	112
88	N	31.4	Very low	28.8	Very low	132 Å²	132	136.7 Å²	136.7	71%	0.706	70%	0.702	S	S	*	*			trans	70	148.2	151.3	-64.1	-6.1	0	0	0	116.9
89	N	33.2	Very low	28.9	Very low	123 Å²	123	136.6 Å²	136.6	66%	0.658	71%	0.705	S	S	*	*			cis	-153.8	164.1	0	-119.8	-1.9	0	0	0	108.1
90	N	33.7	Very low	29.1	Very low	122 Å²	122	134.3 Å²	134.3	65%	0.652	70%	0.704	S	S	*	*			cis	-150.8	-163.5	4.1	-140.6	-10.2	0	0	0	106.5
91	N	32.7	Very low	29.2	Very low	125 Å²	125	134.3 Å²	134.3	67%	0.668	71%	0.709	S	S	*	*			cis	-151.6	167.1	10.4	-152	-13.4	0	0	0	113
92	S	29.3	Very low	29.4	Very low	78 Å²	78	132.6 Å²	132.6	55%	0.545	72%	0.717	S	S	.	*			trans	-56.4	166.1	163.3	67	0	0	0	0	115.8
93	R	31.3	Very low	29.3	Very low	225 Å²	225	137.4 Å²	137.4	85%	0.849	73%	0.728	S	S	*	*			cis	-141.5	155.5	27.8	-73	179.4	171	167.9	-5.1	112.4
94	L	29.2	Very low	29.7	Very low	130 Å²	130	136.8 Å²	136.8	68%	0.681	73%	0.73	S	S	*	*			cis	93.3	112.7	40.2	-128.6	179.7	0	0	0	114.1
95	Y	29.6	Very low	29.7	Very low	203 Å²	203	136.9 Å²	136.9	80%	0.796	74%	0.735	S	S	*	*			trans	154.9	163.5	137.8	-97.2	-77.6	0	0	0	116.5
96	N	26.3	Very low	29.8	Very low	160 Å²	160	138.3 Å²	138.3	86%	0.856	74%	0.737	S	S	*	*			trans	-106	164.7	-169.9	-62.2	-33.7	0	0	0	114
97	G	29.8	Very low	29.7	Very low	64 Å²	64	140.8 Å²	140.8	66%	0.66	74%	0.738	S	S	*	*			trans	151.7	103.6	159.5	0	0	0	0	0	112.3
98	T	27.8	Very low	29.5	Very low	130 Å²	130	145 Å²	145	80%	0.798	75%	0.747	S	S	*	*				73.8	123.1	69.8	62.6	0	0	0	0	116
99	Q	27.5	Very low	29.3	Very low	182 Å²	182	146 Å²	146	85%	0.85	75%	0.751	S	S	*	*			trans	70.5	149.2	164.4	-61.3	178.1	2.7	0	0	115.7
100	T	30.1	Very low	29.1	Very low	109 Å²	109	150.2 Å²	150.2	67%	0.669	76%	0.764	S	S	*	*			cis	-154.3	158.5	-1.6	-0.1	0	0	0	0	112.1
101	N	27.8	Very low	28.9	Very low	147 Å²	147	149.4 Å²	149.4	79%	0.786	76%	0.755	S	S	*	*			trans	17.8	119.5	150.5	-57.8	-15.1	0	0	0	120.8
102	S	30	Very low	28.7	Very low	124 Å²	124	147.6 Å²	147.6	87%	0.867	75%	0.745	S	S	*	*				-178.8	142.3	104.1	43.3	0	0	0	0	115
103	R	25	Very low	28.9	Very low	243 Å²	243	151.7 Å²	151.7	92%	0.917	76%	0.756	S	S	*	*			trans	-100.5	171.8	156	-94.9	-179	174.3	179.7	-0.9	107.1
104	P	34.6	Very low	28.7	Very low	107 Å²	107	147.5 Å²	147.5	70%	0.695	75%	0.75	S	S	*	*			cis	-139.1	-155.8	11	32.4	-7.1	0	0	0	114.6
105	T	29.6	Very low	28.9	Very low	121 Å²	121	149.5 Å²	149.5	74%	0.742	76%	0.76	S	S	*	*			trans	82.9	93	152.4	46.4	0	0	0	0	122.3
106	H	28.5	Very low	28.8	Very low	156 Å²	156	144.5 Å²	144.5	72%	0.722	75%	0.754	S	S	*	*				76.8	116.4	118.4	-97.9	-162.6	0	0	0	124.2
107	K	27.5	Very low	28.9	Very low	167 Å²	167	146.8 Å²	146.8	73%	0.726	76%	0.756	S	S	*	*			trans	76.7	115.2	133.8	-72.2	-178.7	178	178.1	0	120.8
108	K	25	Very low	28.7	Very low	196 Å²	196	149.5 Å²	149.5	85%	0.852	76%	0.76	S	S	*	*			trans	59.4	100.9	142.9	-67.1	-170.5	173.6	-171.3	0	118.2
109	I	27	Very low	28.6	Very low	154 Å²	154	149.8 Å²	149.8	79%	0.79	76%	0.762	S	S	*	*				-165.9	136	114.1	-92.4	146.1	0	0	0	106.4
110	F	28.3	Very low	28.6	Very low	212 Å²	212	148.3 Å²	148.3	93%	0.93	76%	0.759	S	S	*	*			trans	-152.9	115.5	159.4	-102.2	-66.8	0	0	0	112.3
111	K	30.1	Very low	28.4	Very low	104 Å²	104	152.7 Å²	152.7	45%	0.452	77%	0.77	S	S	.	*			trans	-151.2	152.5	164.8	-90.2	-157.4	140.1	-133.8	0	104.3	F1386	K111-F1386 HydrophobicContact CD-CE1 3.56Å; K111-F1386 HydrophobicContact CD-CZ 3.82Å; K111-F1386 HydrophobicContact CG-CE1 4.27Å
112	D	28.6	Very low	28.3	Very low	87 Å²	87	152.1 Å²	152.1	47%	0.465	77%	0.771	S	S	.	*			cis	-149.5	153.2	-13.1	-91.6	-35	0	0	0	105.9
113	H	32.8	Very low	28.1	Very low	165 Å²	165	154.9 Å²	154.9	76%	0.764	77%	0.77	S	S	*	*				171.8	133.2	122.2	-97.3	-65.6	0	0	0	114.4
114	N	28.2	Very low	28.1	Very low	136 Å²	136	154.9 Å²	154.9	73%	0.727	77%	0.77	S	S	*	*			trans	37.1	116.6	141.4	-56.1	1.9	0	0	0	120.6
115	I	32.9	Very low	27.7	Very low	173 Å²	173	157.4 Å²	157.4	89%	0.887	78%	0.777	S	S	*	*				-148.7	164.6	109.1	-99.5	154.2	0	0	0	108
116	S	28.3	Very low	27.4	Very low	98 Å²	98	159.9 Å²	159.9	69%	0.685	78%	0.78	S	S	*	*			trans	-71.6	150.8	-157	47.4	0	0	0	0	117.2
117	K	27.8	Very low	27.3	Very low	207 Å²	207	159.8 Å²	159.8	90%	0.9	78%	0.78	S	S	*	*			trans	-110.9	122.4	152.4	-81.3	-171.4	171.3	-172.4	0	109
118	T	26.1	Very low	27.2	Very low	121 Å²	121	160.9 Å²	160.9	74%	0.742	78%	0.784	S	S	*	*			trans	-146.7	35.5	-178.2	-37.7	0	0	0	0	113.2
119	T	25.8	Very low	27.1	Very low	137 Å²	137	158.1 Å²	158.1	84%	0.84	78%	0.784	S	S	*	*			trans	-153.7	155.2	168.8	12.6	0	0	0	0	110.2
120	L	27	Very low	27	Very low	150 Å²	150	157.5 Å²	157.5	79%	0.785	78%	0.782	S	S	*	*			trans	91	61	-170.8	-61.7	166.7	0	0	0	116.7
121	F	26.2	Very low	26.9	Very low	202 Å²	202	156.8 Å²	156.8	89%	0.886	78%	0.775	S	S	*	*			trans	-137.4	44.3	150.1	-161.3	-98.8	0	0	0	110.4
122	V	24.7	Very low	26.6	Very low	135 Å²	135	162.1 Å²	162.1	82%	0.818	80%	0.798	S	S	*	*			trans	-141.3	66.7	-178.1	-172	0	0	0	0	109.1
123	E	25.3	Very low	26.3	Very low	182 Å²	182	164.2 Å²	164.2	85%	0.85	81%	0.808	S	S	*	*	S	Bend	trans	-160.7	32.5	173.2	-130.2	162.3	-136.7	0	0	113.4
124	R	26.2	Very low	25.9	Very low	242 Å²	242	160.4 Å²	160.4	91%	0.913	80%	0.798	S	S	*	*	S	Bend	trans	-146.6	22.3	179.3	-132.7	-178.6	-130.3	-157.7	2.5	114.9
125	L	25.1	Very low	25.8	Very low	161 Å²	161	164.5 Å²	164.5	84%	0.843	81%	0.809	S	S	*	*			trans	-139.7	30.3	-173.5	-99.7	170.5	0	0	0	113.4
126	H	24.2	Very low	25.3	Very low	172 Å²	172	158.2 Å²	158.2	80%	0.796	78%	0.781	S	S	*	*			trans	-120.1	36.6	178.8	-118.9	-125.8	0	0	0	112.5
127	E	26	Very low	25.1	Very low	154 Å²	154	159.9 Å²	159.9	72%	0.72	78%	0.781	S	S	*	*	S	Bend	trans	-133.4	16.6	178.8	-153.8	166.1	-131.7	0	0	113.4	K837	E127-K837 IonicContact OE1-NZ 2.68Å; E127-K837 PolarHBondContact OE1-NZ 3.16Å
128	K	24.7	Very low	25	Very low	190 Å²	190	159.8 Å²	159.8	83%	0.826	78%	0.781	S	S	*	*	S	Bend	trans	-136.7	146.3	167.5	-67.2	-172.9	179	-180	0	109
129	V	23.4	Very low	24.8	Very low	138 Å²	138	159.7 Å²	159.7	84%	0.836	77%	0.77	S	S	*	*			trans	74.7	80.1	-170.4	-165.7	0	0	0	0	114.5
130	N	25.4	Very low	24.7	Very low	142 Å²	142	160.1 Å²	160.1	76%	0.759	76%	0.763	S	S	*	*	S	Bend		-157.2	149.9	115.1	-110.3	-36.7	0	0	0	112.7
131	Y	27.2	Very low	24.8	Very low	197 Å²	197	156.2 Å²	156.2	77%	0.773	75%	0.747	S	S	*	*			trans	52.1	95.7	177.3	-76.3	-80.1	0	0	0	119.3	I133	Y131-I133 PolarHBondContact O-N 3.4Å
132	F	22.9	Very low	25.2	Very low	216 Å²	216	153.1 Å²	153.1	95%	0.947	74%	0.735	S	S	*	*			trans	-54.9	121.8	141.6	-100.4	-113.7	0	0	0	109.5
133	I	23.1	Very low	25.6	Very low	130 Å²	130	151.3 Å²	151.3	67%	0.667	72%	0.716	S	S	*	*			trans	-131.5	135.7	160.3	-62	179.5	0	0	0	106.3	Y131 K135	Y131-I133 PolarHBondContact O-N 3.4Å; I133-K135 PolarHBondContact O-N 3.12Å
134	P	23.9	Very low	26.1	Very low	85 Å²	85	147.8 Å²	147.8	55%	0.552	70%	0.703	S	S	*	*			trans	-62.1	130.2	-171.4	-24.9	35.1	0	0	0	113.4	S136	P134-S136 VanDerWaalsContact CB-OG 3.24Å; P134-S136 WeakPolarHBondContact CB-OG 3.39Å; P134-S136 PolarHBondContact O-N 3.23Å
135	K	25.4	Very low	26.8	Very low	222 Å²	222	138.2 Å²	138.2	97%	0.965	67%	0.669	S	S	*	*	S	Bend	trans	-74.8	39	168.7	-71.6	-173.2	175.8	178.9	0	112.3	I133	I133-K135 PolarHBondContact O-N 3.12Å
136	S	23.6	Very low	27.4	Very low	41 Å²	41	133 Å²	133	29%	0.287	65%	0.65	S	S	.	*			trans	-120.5	29.4	-175.6	55.5	0	0	0	0	113.5	P134	P134-S136 VanDerWaalsContact CB-OG 3.24Å; P134-S136 WeakPolarHBondContact CB-OG 3.39Å; P134-S136 PolarHBondContact O-N 3.23Å
137	L	24.3	Very low	28.1	Very low	134 Å²	134	130 Å²	130	70%	0.702	64%	0.638	S	S	*	*			trans	-142	84.1	158.5	-104	154.6	0	0	0	109.1	F139	L137-F139 HydrophobicContact CD2-CD2 3.84Å; L137-F139 HydrophobicContact CD2-CE2 4.17Å; L137-F139 PolarHBondContact O-N 3.48Å
138	K	23.9	Very low	28.8	Very low	204 Å²	204	126.9 Å²	126.9	89%	0.887	63%	0.626	S	S	*	*			trans	-65.7	89.4	150.8	-103.2	-164.2	170.9	-163.9	0	106	E140	K138-E140 PolarHBondContact O-N 2.78Å
139	F	22.8	Very low	29.8	Very low	119 Å²	119	122.3 Å²	122.3	52%	0.522	61%	0.605	S	S	.	*			trans	-64.6	123.1	163.6	-127	-84	0	0	0	106.8	L137 P141	L137-F139 HydrophobicContact CD2-CD2 3.84Å; L137-F139 HydrophobicContact CD2-CE2 4.17Å; L137-F139 PolarHBondContact O-N 3.48Å; F139-P141 WeakPolarHBondContact O-CD 3.32Å
140	E	23.7	Very low	30.3	Very low	147 Å²	147	121.1 Å²	121.1	69%	0.687	60%	0.6	S	S	*	*			trans	-85.9	106.5	163.8	-66.8	-179.5	161.7	0	0	108.4	K138	K138-E140 PolarHBondContact O-N 2.78Å
141	P	29.7	Very low	30.7	Very low	68 Å²	68	116.7 Å²	116.7	44%	0.442	59%	0.588	S	S	.	*			trans	-119.4	10	148.2	39.5	-33.1	0	0	0	111.9	F139 K143	F139-P141 WeakPolarHBondContact O-CD 3.32Å; P141-K143 PolarHBondContact O-N 2.97Å
142	E	34.4	Very low	31.5	Very low	136 Å²	136	112.6 Å²	112.6	64%	0.636	59%	0.588	S	S	*	*			trans	-81.3	96.2	155.4	-69.6	-169.4	163.5	0	0	107.7	D144	E142-D144 PolarHBondContact O-N 2.83Å; E142-D144 VanDerWaalsContact O-N 3.07Å
143	K	32.7	Very low	33.5	Very low	98 Å²	98	107.1 Å²	107.1	43%	0.426	57%	0.573	S	S	.	*			trans	-62.5	110	158.6	-76.5	175	-177.4	160.9	0	106	P141 L145 I147 L148 G920	P141-K143 PolarHBondContact O-N 2.97Å; K143-L145 PolarHBondContact O-N 3.18Å; K143-I147 HydrophobicContact CB-CB 4.34Å; K143-I147 HydrophobicContact CB-CG2 4.4Å; K143-I147 HydrophobicContact CG-CG2 4.2Å; K143-L148 HydrophobicContact CB-CD1 4.06Å; K143-L148 HydrophobicContact CB-CG 3.87Å; K143-L148 HydrophobicContact CD-CD2 3.81Å; K143-L148 HydrophobicContact CD-CG 4Å; K143-G920 PolarHBondContact NZ-O 2.86Å
144	D	36.4	Very low	35.7	Very low	108 Å²	108	104.6 Å²	104.6	58%	0.578	56%	0.555	S	S	*	*			trans	-47.1	142.6	167.5	-171	-2.6	0	0	0	108.5	E142 A146 I147 L148	E142-D144 PolarHBondContact O-N 2.83Å; E142-D144 VanDerWaalsContact O-N 3.07Å; D144-A146 PolarHBondContact O-N 3.42Å; D144-I147 HydrophobicContact CB-CD1 4.13Å; D144-I147 HydrophobicContact CB-CG1 4.29Å; D144-I147 WeakPolarHBondContact O-CA 3.29Å; D144-I147 WeakPolarHBondContact O-CB 3.39Å; D144-I147 PolarHBondContact O-N 2.8Å; D144-L148 PolarHBondContact O-N 2.68Å
145	L	40.2	Very low	38.6	Very low	40 Å²	40	103.1 Å²	103.1	21%	0.209	54%	0.542	C	S	.	.	H	α-helix	trans	-62.8	-21.4	-171.7	-88	160.2	0	0	0	112.2	K143 I147 L148 Y149 Q350	K143-L145 PolarHBondContact O-N 3.18Å; L145-I147 VanDerWaalsContact C-N 3.29Å; L145-I147 PolarHBondContact O-N 3.38Å; L145-L148 PolarHBondContact O-N 3.42Å; L145-Y149 HydrophobicContact CD2-CD2 3.88Å; L145-Y149 HydrophobicContact CD2-CE2 3.74Å; L145-Y149 WeakPolarHBondContact O-CD2 3.47Å; L145-Y149 PolarHBondContact O-N 3.38Å; L145-Q350 HydrophobicContact CD1-CG 3.72Å
146	A	37.8	Very low	41.4	Very low	53 Å²	53	93.1 Å²	93.1	44%	0.438	50%	0.499	S	S	.	.	H	α-helix	trans	-66.8	-21.7	168.8	0	0	0	0	0	114.7	D144 Y149 P150	D144-A146 PolarHBondContact O-N 3.42Å; A146-Y149 CarbonylContact O-C 3.54Å; A146-P150 VanDerWaalsContact O-CA 3.23Å; A146-P150 WeakPolarHBondContact O-CA 3.21Å; A146-P150 WeakPolarHBondContact O-CB 3.11Å
147	I	39.7	Very low	44.5	Very low	107 Å²	107	91.1 Å²	91.1	55%	0.549	49%	0.485	S	S	.	.	H	α-helix	trans	-88.2	-32.4	177.2	-57.6	173.8	0	0	0	110.9	K143 D144 L145	K143-I147 HydrophobicContact CB-CB 4.34Å; K143-I147 HydrophobicContact CB-CG2 4.4Å; K143-I147 HydrophobicContact CG-CG2 4.2Å; D144-I147 HydrophobicContact CB-CD1 4.13Å; D144-I147 HydrophobicContact CB-CG1 4.29Å; D144-I147 WeakPolarHBondContact O-CA 3.29Å; D144-I147 WeakPolarHBondContact O-CB 3.39Å; D144-I147 PolarHBondContact O-N 2.8Å; L145-I147 VanDerWaalsContact C-N 3.29Å; L145-I147 PolarHBondContact O-N 3.38Å
148	L	40.8	Very low	47.4	Very low	89 Å²	89	86.2 Å²	86.2	47%	0.466	46%	0.461	S	S	.	.	H	α-helix	trans	-76.2	-29.3	169.9	-77.6	165.1	0	0	0	112.5	K143 D144 L145 P150	K143-L148 HydrophobicContact CB-CD1 4.06Å; K143-L148 HydrophobicContact CB-CG 3.87Å; K143-L148 HydrophobicContact CD-CD2 3.81Å; K143-L148 HydrophobicContact CD-CG 4Å; D144-L148 PolarHBondContact O-N 2.68Å; L145-L148 PolarHBondContact O-N 3.42Å; L148-P150 VanDerWaalsContact C-CD 3.5Å
149	Y	44.5	Very low	50.3	Low	94 Å²	94	84 Å²	84	37%	0.369	45%	0.452	S	S	.	.	S	Bend	trans	-130.1	68.8	179.1	-55.7	-74.4	0	0	0	112.1	L145 A146 G151 R379	L145-Y149 HydrophobicContact CD2-CD2 3.88Å; L145-Y149 HydrophobicContact CD2-CE2 3.74Å; L145-Y149 WeakPolarHBondContact O-CD2 3.47Å; L145-Y149 PolarHBondContact O-N 3.38Å; A146-Y149 CarbonylContact O-C 3.54Å; Y149-G151 PolarHBondContact O-N 2.81Å; Y149-R379 PolarHBondContact OH-NH1 2.04Å
150	P	34	Very low	53.2	Low	113 Å²	113	79.1 Å²	79.1	73%	0.734	43%	0.433	S	S	*	.			trans	-78.6	61.2	-178.7	33.5	-36.6	0	0	0	112.4	A146 L148	A146-P150 VanDerWaalsContact O-CA 3.23Å; A146-P150 WeakPolarHBondContact O-CA 3.21Å; A146-P150 WeakPolarHBondContact O-CB 3.11Å; L148-P150 VanDerWaalsContact C-CD 3.5Å
151	G	34.1	Very low	56	Low	50 Å²	50	75.4 Å²	75.4	52%	0.515	42%	0.421	S	S	.	.	S	Bend	trans	161.5	151.6	175.2	0	0	0	0	0	114.5	Y149	Y149-G151 PolarHBondContact O-N 2.81Å
152	S	44.3	Very low	58.5	Low	110 Å²	110	72.4 Å²	72.4	77%	0.769	40%	0.402	S	S	*	.	S	Bend	trans	52.4	85.9	172.2	44.7	0	0	0	0	117.1
153	T	63.9	Low	60.8	Low	102 Å²	102	66.2 Å²	66.2	63%	0.626	37%	0.373	S	S	*	.				37.5	92.6	129.2	48.4	0	0	0	0	118.5
154	W	69.7	Low	63	Low	76 Å²	76	61.6 Å²	61.6	29%	0.288	35%	0.352	S	S	.	.			trans	-81.8	154.3	141.5	62.1	88.4	0	0	0	110.1	D156 I388 P408	W154-D156 PolarHBondContact O-N 2.9Å; W154-I388 HydrophobicContact CB-CD1 4.1Å; W154-I388 HydrophobicContact CD2-CD1 4.14Å; W154-I388 HydrophobicContact CG-CD1 3.93Å; W154-P408 CarbonylContact C-O 3.59Å; W154-P408 WeakPolarHBondContact CA-O 3.32Å; W154-P408 HydrophobicContact CB-CB 3.82Å; W154-P408 HydrophobicContact CB-CG 3.96Å; W154-P408 WeakPolarHBondContact CB-O 3.38Å
155	L	84.1	Confident	65.1	Low	54 Å²	54	56.4 Å²	56.4	28%	0.283	33%	0.325	S	S	.	.	B	Isolated β-bridge	trans	-72.8	106.8	177	-67.6	166.5	0	0	0	110	Y399 R403 P408 Q409 A410	L155-Y399 HydrophobicContact CB-CD2 4.39Å; L155-Y399 HydrophobicContact CB-CE2 3.69Å; L155-R403 HydrophobicContact CD1-CB 3.45Å; L155-R403 VanDerWaalsContact CD1-CB 3.45Å; L155-R403 HydrophobicContact CD1-CG 4.06Å; L155-P408 PolarHBondContact N-O 3.36Å; L155-Q409 HydrophobicContact CB-CB 4.25Å; L155-A410 PolarHBondContact O-N 2.82Å
156	D	85.4	Confident	66.7	Low	12 Å²	12	55.1 Å²	55.1	6%	0.064	32%	0.318	C	S	.	.			trans	-89.8	108.8	179.8	-169.3	-11.3	0	0	0	109.3	W154 C158 K159 K392	W154-D156 PolarHBondContact O-N 2.9Å; D156-C158 PolarHBondContact O-N 2.89Å; D156-K159 HydrophobicContact CB-CB 4.28Å; D156-K159 HydrophobicContact CB-CD 4.01Å; D156-K159 HydrophobicContact CB-CG 4.14Å; D156-K159 WeakPolarHBondContact O-CA 3.44Å; D156-K159 PolarHBondContact O-N 2.86Å; D156-K159 WeakPolarHBondContact OD2-CE 3Å; D156-K159 IonicContact OD2-NZ 2.71Å; D156-K159 PolarHBondContact OD2-NZ 2.88Å; D156-K392 IonicContact OD1-NZ 2.7Å; D156-K392 PolarHBondContact OD1-NZ 2.86Å; D156-K392 IonicContact OD2-NZ 3.47Å; D156-K392 PolarHBondContact OD2-NZ 3.49Å
157	P	87.3	Confident	69	Low	0 Å²	0	52.6 Å²	52.6	0%	0	30%	0.297	C	S	.	.	G	3₁₀ helix	trans	-64.6	-29.3	-171.4	27.7	-35.9	0	0	0	112	K159 A160 Y163 A168 Y399 A410	P157-K159 PolarHBondContact O-N 3.23Å; P157-K159 VanDerWaalsContact O-N 3.07Å; P157-A160 VanDerWaalsContact O-CB 3.25Å; P157-A160 WeakPolarHBondContact O-CB 3.47Å; P157-A160 PolarHBondContact O-N 3.37Å; P157-A160 VanDerWaalsContact O-N 3.08Å; P157-Y163 WeakPolarHBondContact O-CE1 3.03Å; P157-Y163 PolarHBondContact O-OH 3.1Å; P157-A168 HydrophobicContact CB-CB 3.73Å; P157-Y399 HydrophobicContact CB-CD2 4.13Å; P157-Y399 HydrophobicContact CB-CE2 3.82Å; P157-A410 WeakPolarHBondContact CD-O 3.39Å; P157-A410 WeakPolarHBondContact CG-O 3.14Å
158	C	86.3	Confident	71.3	Confident	30 Å²	30	47.5 Å²	47.5	20%	0.203	27%	0.271	C	S	.	.	G	3₁₀ helix	trans	-67.8	0.2	171.1	-62.5	0	0	0	0	114.5	D156 Y163 K392 C394	D156-C158 PolarHBondContact O-N 2.89Å; C158-Y163 WeakPolarHBondContact CA-OH 3.42Å; C158-Y163 PolarHBondContact O-OH 3.3Å; C158-K392 WeakPolarHBondContact SG-CB 3.37Å; C158-C394 VanDerWaalsContact CA-SG 3.55Å; C158-C394 HydrophobicContact CB-CB 3.68Å; C158-C394 WeakPolarHBondContact CB-SG 3.31Å; C158-C394 WeakPolarHBondContact SG-CB 3.33Å; C158-C394 CovalentContact SG-SG 2.04Å; C158-C394 PolarHBondContact SG-SG 3.43Å
159	K	84.9	Confident	73.4	Confident	159 Å²	159	43.3 Å²	43.3	69%	0.691	25%	0.249	S	C	*	.	G	3₁₀ helix	trans	-123.6	19.2	174.1	-57.6	179.6	-175.1	134.1	0	111.5	D156 P157	D156-K159 HydrophobicContact CB-CB 4.28Å; D156-K159 HydrophobicContact CB-CD 4.01Å; D156-K159 HydrophobicContact CB-CG 4.14Å; D156-K159 WeakPolarHBondContact O-CA 3.44Å; D156-K159 PolarHBondContact O-N 2.86Å; D156-K159 WeakPolarHBondContact OD2-CE 3Å; D156-K159 IonicContact OD2-NZ 2.71Å; D156-K159 PolarHBondContact OD2-NZ 2.88Å; P157-K159 PolarHBondContact O-N 3.23Å; P157-K159 VanDerWaalsContact O-N 3.07Å
160	A	83.2	Confident	75.2	Confident	15 Å²	15	41 Å²	41	12%	0.124	24%	0.244	C	C	.	.			trans	-59	156.1	174.5	0	0	0	0	0	111.5	P157 A162 Y163 A168	P157-A160 VanDerWaalsContact O-CB 3.25Å; P157-A160 WeakPolarHBondContact O-CB 3.47Å; P157-A160 PolarHBondContact O-N 3.37Å; P157-A160 VanDerWaalsContact O-N 3.08Å; A160-A162 VanDerWaalsContact C-N 3.28Å; A160-A162 PolarHBondContact O-N 2.93Å; A160-Y163 HydrophobicContact CB-CD1 4.45Å; A160-Y163 HydrophobicContact CB-CE1 3.9Å; A160-Y163 HydrophobicContact CB-CE2 4.45Å; A160-A168 HydrophobicContact CB-CB 3.81Å
161	T	82.2	Confident	77.3	Confident	69 Å²	69	41.6 Å²	41.6	42%	0.423	24%	0.236	S	C	.	.	S	Bend	trans	-73.5	-25.4	-178	62.1	0	0	0	0	112.9	L169 D170 E171 S174	T161-L169 PolarHBondContact N-O 2.81Å; T161-L169 PolarHBondContact OG1-O 2.6Å; T161-D170 PolarHBondContact OG1-O 2.99Å; T161-E171 HydrophobicContact CG2-CB 3.81Å; T161-E171 HydrophobicContact CG2-CG 4.07Å; T161-E171 WeakPolarHBondContact OG1-CA 3.2Å; T161-E171 PolarHBondContact OG1-N 3.1Å; T161-S174 WeakPolarHBondContact OG1-CB 3.43Å; T161-S174 PolarHBondContact OG1-OG 3.24Å
162	A	83.4	Confident	79.4	Confident	6 Å²	6	45.3 Å²	45.3	5%	0.05	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-165.2	168.9	172.7	0	0	0	0	0	109.6	A160 L169 L184 S185	A160-A162 VanDerWaalsContact C-N 3.28Å; A160-A162 PolarHBondContact O-N 2.93Å; A162-L169 WeakPolarHBondContact O-CB 3.2Å; A162-L169 PolarHBondContact O-N 2.89Å; A162-L184 HydrophobicContact CB-CB 3.69Å; A162-L184 HydrophobicContact CB-CD1 3.65Å; A162-L184 HydrophobicContact CB-CG 4.29Å; A162-S185 CarbonylContact C-O 3.54Å; A162-S185 VanDerWaalsContact CA-O 3.32Å; A162-S185 WeakPolarHBondContact CA-O 3.36Å
163	Y	82.5	Confident	81	Confident	5 Å²	5	40.4 Å²	40.4	2%	0.02	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	151.9	-179.9	-54.6	-96.2	0	0	0	112.3	P157 C158 A160 I167 A168 S185 D186 D187 P188	P157-Y163 WeakPolarHBondContact O-CE1 3.03Å; P157-Y163 PolarHBondContact O-OH 3.1Å; C158-Y163 WeakPolarHBondContact CA-OH 3.42Å; C158-Y163 PolarHBondContact O-OH 3.3Å; A160-Y163 HydrophobicContact CB-CD1 4.45Å; A160-Y163 HydrophobicContact CB-CE1 3.9Å; A160-Y163 HydrophobicContact CB-CE2 4.45Å; Y163-I167 VanDerWaalsContact CA-O 3.32Å; Y163-I167 WeakPolarHBondContact CA-O 3.02Å; Y163-A168 HydrophobicContact CD1-CB 4.39Å; Y163-A168 HydrophobicContact CE1-CB 4.34Å; Y163-S185 PolarHBondContact N-O 2.04Å; Y163-S185 PolarHBondContact O-N 2.8Å; Y163-D186 WeakPolarHBondContact CE2-O 3.26Å; Y163-D187 VanDerWaalsContact CD2-C 3.49Å; Y163-P188 HydrophobicContact CD1-CB 3.79Å; Y163-P188 HydrophobicContact CD1-CG 4.47Å; Y163-P188 HydrophobicContact CE1-CB 3.7Å; Y163-P188 HydrophobicContact CE1-CG 3.95Å; Y163-P188 HydrophobicContact CE2-CG 4.35Å; Y163-P188 HydrophobicContact CG-CB 4.23Å
164	Y	79.2	Confident	81.7	Confident	1 Å²	1	36 Å²	36	0%	0.004	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	70.3	174.4	-167.3	-105.2	0	0	0	110.4	I167 M182 L184 T438 F459 K462 M464	Y164-I167 PolarHBondContact N-O 2.5Å; Y164-M182 HydrophobicContact CD2-CE 4.29Å; Y164-M182 HydrophobicContact CE1-CE 4.46Å; Y164-M182 HydrophobicContact CE2-CE 3.67Å; Y164-L184 HydrophobicContact CD2-CD2 3.97Å; Y164-T438 HydrophobicContact CE1-CG2 3.9Å; Y164-F459 HydrophobicContact CD2-CD2 4.46Å; Y164-F459 WeakPolarHBondContact CE2-O 3.28Å; Y164-F459 PolarHBondContact OH-O 3.16Å; Y164-K462 WeakPolarHBondContact OH-CA 3.44Å; Y164-K462 WeakPolarHBondContact OH-CB 3.37Å; Y164-K462 PolarHBondContact OH-N 2.68Å; Y164-K462 PolarHBondContact OH-O 2.83Å; Y164-K462 VanDerWaalsContact OH-O 3.12Å; Y164-M464 HydrophobicContact CD1-SD 4.38Å; Y164-M464 HydrophobicContact CE1-SD 4.14Å
165	G	78.7	Confident	82.1	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	93.2	-131.6	-163.5	0	0	0	0	0	110.5	N460 Y484	G165-N460 PolarHBondContact N-OD1 3.29Å; G165-Y484 WeakPolarHBondContact CA-OH 3.04Å
166	D	75.1	Confident	81.7	Confident	13 Å²	13	36.9 Å²	36.9	7%	0.07	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.5	-14.2	163.2	36.9	33.6	0	0	0	112.4	A168 C397 S398 H425 H429 H435	D166-A168 PolarHBondContact O-N 3.38Å; D166-C397 VanDerWaalsContact O-CA 3.28Å; D166-C397 WeakPolarHBondContact O-CA 3.47Å; D166-C397 WeakPolarHBondContact O-CB 3.36Å; D166-S398 PolarHBondContact O-N 3.44Å; D166-H425 IonicContact OD2-NE2 3.07Å; D166-H429 IonicContact OD1-NE2 3.27Å; D166-H435 IonicContact OD1-CE1 3.92Å; D166-H435 PolarHBondContact OD1-CE1 2.5Å; D166-H435 IonicContact OD1-NE2 2.71Å; D166-H435 PolarHBondContact OD1-NE2 2.6Å; D166-H435 IonicContact OD2-NE2 3.15Å
167	I	85.5	Confident	81.1	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	119.4	176.8	-62.9	172.1	0	0	0	111.6	Y163 Y164 L169 V400 H429 W434	Y163-I167 VanDerWaalsContact CA-O 3.32Å; Y163-I167 WeakPolarHBondContact CA-O 3.02Å; Y164-I167 PolarHBondContact N-O 2.5Å; I167-L169 HydrophobicContact CG2-CD2 4.01Å; I167-V400 HydrophobicContact CB-CG2 4.49Å; I167-V400 HydrophobicContact CD1-CG2 3.92Å; I167-V400 HydrophobicContact CG1-CG2 4.07Å; I167-V400 HydrophobicContact CG2-CG2 3.65Å; I167-H429 VanDerWaalsContact CG1-CE1 3.42Å; I167-H429 WeakPolarHBondContact CG1-CE1 2.98Å; I167-W434 HydrophobicContact CD1-CD2 4.43Å; I167-W434 HydrophobicContact CD1-CE3 3.54Å; I167-W434 HydrophobicContact CD1-CZ3 4.01Å; I167-W434 HydrophobicContact CG2-CE3 4.4Å; I167-W434 HydrophobicContact CG2-CH2 4.4Å; I167-W434 HydrophobicContact CG2-CZ3 3.8Å
168	A	88.8	Confident	80.4	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	133.2	172.3	0	0	0	0	0	112.3	P157 A160 Y163 D166 S398 Y399 R403	P157-A168 HydrophobicContact CB-CB 3.73Å; A160-A168 HydrophobicContact CB-CB 3.81Å; Y163-A168 HydrophobicContact CD1-CB 4.39Å; Y163-A168 HydrophobicContact CE1-CB 4.34Å; D166-A168 PolarHBondContact O-N 3.38Å; A168-S398 PolarHBondContact N-O 3.31Å; A168-Y399 HydrophobicContact CB-CD1 3.69Å; A168-Y399 HydrophobicContact CB-CD2 4.49Å; A168-Y399 HydrophobicContact CB-CE1 3.64Å; A168-Y399 HydrophobicContact CB-CE2 4.43Å; A168-Y399 HydrophobicContact CB-CG 4.15Å; A168-Y399 WeakPolarHBondContact O-CD1 3.46Å; A168-R403 PolarHBondContact O-NH2 3.4Å; A168-R403 VanDerWaalsContact O-NH2 3.15Å
169	L	84.3	Confident	79.9	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	138.3	179.5	-56.8	178.9	0	0	0	113.3	T161 A162 I167 E173 M177 L184 W434	T161-L169 PolarHBondContact N-O 2.81Å; T161-L169 PolarHBondContact OG1-O 2.6Å; A162-L169 WeakPolarHBondContact O-CB 3.2Å; A162-L169 PolarHBondContact O-N 2.89Å; I167-L169 HydrophobicContact CG2-CD2 4.01Å; L169-E173 WeakPolarHBondContact CA-OE2 3.26Å; L169-E173 HydrophobicContact CB-CB 4.15Å; L169-E173 HydrophobicContact CD2-CB 4.3Å; L169-E173 VanDerWaalsContact CD2-OE2 3.31Å; L169-E173 WeakPolarHBondContact CD2-OE2 3.33Å; L169-M177 HydrophobicContact CD1-CE 4Å; L169-M177 HydrophobicContact CD1-SD 3.81Å; L169-M177 HydrophobicContact CD2-CE 3.79Å; L169-L184 HydrophobicContact CD1-CD1 3.99Å; L169-L184 HydrophobicContact CD1-CD2 3.76Å; L169-L184 HydrophobicContact CD1-CG 4.47Å; L169-W434 HydrophobicContact CD2-CH2 3.98Å; L169-W434 HydrophobicContact CD2-CZ3 4.21Å
170	D	82.8	Confident	79.1	Confident	47 Å²	47	41.4 Å²	41.4	25%	0.251	22%	0.218	S	C	.	.			trans	-75.9	168.4	169.8	65.4	62.5	0	0	0	112.1	T161 H172 E173 S174 R403	T161-D170 PolarHBondContact OG1-O 2.99Å; D170-H172 VanDerWaalsContact C-N 3.25Å; D170-H172 PolarHBondContact O-N 3.41Å; D170-H172 WeakPolarHBondContact OD1-CB 3.38Å; D170-H172 PolarHBondContact OD1-N 3.4Å; D170-E173 PolarHBondContact N-OE2 2.85Å; D170-E173 PolarHBondContact O-N 3.21Å; D170-E173 PolarHBondContact OD1-N 2.82Å; D170-S174 PolarHBondContact O-N 2.96Å; D170-S174 PolarHBondContact O-OG 3.31Å; D170-R403 IonicContact OD2-CZ 2.62Å; D170-R403 IonicContact OD2-NH1 3.97Å; D170-R403 PolarHBondContact OD2-NH1 2.91Å
171	E	77.4	Confident	78.1	Confident	124 Å²	124	43.1 Å²	43.1	58%	0.579	24%	0.237	S	C	*	.	H	α-helix	trans	-63.7	-31.2	-175.5	-157.4	-172.4	151.8	0	0	112.6	T161 S174 Q175	T161-E171 HydrophobicContact CG2-CB 3.81Å; T161-E171 HydrophobicContact CG2-CG 4.07Å; T161-E171 WeakPolarHBondContact OG1-CA 3.2Å; T161-E171 PolarHBondContact OG1-N 3.1Å; E171-S174 WeakPolarHBondContact CA-OG 3.07Å; E171-S174 PolarHBondContact O-OG 3.08Å; E171-Q175 WeakPolarHBondContact O-CB 3.16Å; E171-Q175 WeakPolarHBondContact O-CG 3.15Å; E171-Q175 PolarHBondContact O-N 3.25Å; E171-Q175 VanDerWaalsContact O-N 3.1Å; E171-Q175 PolarHBondContact OE1-NE2 3.2Å
172	H	78.2	Confident	77.3	Confident	128 Å²	128	40.7 Å²	40.7	59%	0.593	22%	0.221	S	C	*	.	H	α-helix	trans	-74.4	-42.9	179.9	-170.4	51.5	0	0	0	110.7	D170 I176	D170-H172 VanDerWaalsContact C-N 3.25Å; D170-H172 PolarHBondContact O-N 3.41Å; D170-H172 WeakPolarHBondContact OD1-CB 3.38Å; D170-H172 PolarHBondContact OD1-N 3.4Å; H172-I176 WeakPolarHBondContact O-CB 3.32Å; H172-I176 VanDerWaalsContact O-CG1 3.25Å; H172-I176 WeakPolarHBondContact O-CG1 3.02Å; H172-I176 PolarHBondContact O-N 3.23Å
173	E	78.9	Confident	76.3	Confident	7 Å²	7	44 Å²	44	3%	0.033	24%	0.241	C	C	.	.	H	α-helix	trans	-60.7	-47.8	171.8	-76.6	-175.6	144.9	0	0	113.3	L169 D170 Q175 I176 M177 R338 R403	L169-E173 WeakPolarHBondContact CA-OE2 3.26Å; L169-E173 HydrophobicContact CB-CB 4.15Å; L169-E173 HydrophobicContact CD2-CB 4.3Å; L169-E173 VanDerWaalsContact CD2-OE2 3.31Å; L169-E173 WeakPolarHBondContact CD2-OE2 3.33Å; D170-E173 PolarHBondContact N-OE2 2.85Å; D170-E173 PolarHBondContact O-N 3.21Å; D170-E173 PolarHBondContact OD1-N 2.82Å; E173-Q175 VanDerWaalsContact C-N 3.33Å; E173-Q175 PolarHBondContact O-N 2.66Å; E173-I176 PolarHBondContact O-N 3.39Å; E173-I176 VanDerWaalsContact O-N 3.16Å; E173-M177 WeakPolarHBondContact O-CB 3.23Å; E173-M177 WeakPolarHBondContact O-CG 3.24Å; E173-M177 PolarHBondContact O-N 2.72Å; E173-R338 IonicContact OE1-CZ 3.67Å; E173-R338 IonicContact OE1-NH1 3.48Å; E173-R338 PolarHBondContact OE1-NH1 2.74Å; E173-R338 IonicContact OE1-NH2 2.78Å; E173-R338 PolarHBondContact OE1-NH2 3.1Å; E173-R403 IonicContact OE1-CZ 2.77Å; E173-R403 IonicContact OE1-NH1 2.64Å; E173-R403 PolarHBondContact OE1-NH1 3.37Å; E173-R403 IonicContact OE1-NH2 2.77Å; E173-R403 PolarHBondContact OE1-NH2 3.09Å; E173-R403 IonicContact OE2-CZ 2.73Å; E173-R403 IonicContact OE2-NH1 2.81Å; E173-R403 PolarHBondContact OE2-NH1 3.27Å; E173-R403 IonicContact OE2-NH2 2.65Å; E173-R403 PolarHBondContact OE2-NH2 3.12Å
174	S	77.5	Confident	75.6	Confident	9 Å²	9	44.9 Å²	44.9	6%	0.063	25%	0.246	C	C	.	.	H	α-helix	trans	-64	-41.6	-178.1	63.2	0	0	0	0	110.4	T161 D170 E171 M177 L178	T161-S174 WeakPolarHBondContact OG1-CB 3.43Å; T161-S174 PolarHBondContact OG1-OG 3.24Å; D170-S174 PolarHBondContact O-N 2.96Å; D170-S174 PolarHBondContact O-OG 3.31Å; E171-S174 WeakPolarHBondContact CA-OG 3.07Å; E171-S174 PolarHBondContact O-OG 3.08Å; S174-M177 PolarHBondContact O-N 3.42Å; S174-L178 VanDerWaalsContact O-CB 3.27Å; S174-L178 WeakPolarHBondContact O-CB 3.26Å; S174-L178 WeakPolarHBondContact O-CD1 3.06Å; S174-L178 WeakPolarHBondContact O-CG 3.39Å; S174-L178 PolarHBondContact O-N 3.39Å
175	Q	78.9	Confident	75.1	Confident	106 Å²	106	45.8 Å²	45.8	50%	0.495	25%	0.252	S	S	.	.	H	α-helix	trans	-59.6	-45.1	170	-72.3	178.2	27.5	0	0	112.8	E171 E173 S179	E171-Q175 WeakPolarHBondContact O-CB 3.16Å; E171-Q175 WeakPolarHBondContact O-CG 3.15Å; E171-Q175 PolarHBondContact O-N 3.25Å; E171-Q175 VanDerWaalsContact O-N 3.1Å; E171-Q175 PolarHBondContact OE1-NE2 3.2Å; E173-Q175 VanDerWaalsContact C-N 3.33Å; E173-Q175 PolarHBondContact O-N 2.66Å; Q175-S179 WeakPolarHBondContact O-CB 3.43Å; Q175-S179 PolarHBondContact O-N 3.17Å
176	I	75.5	Confident	74.5	Confident	44 Å²	44	52.6 Å²	52.6	23%	0.226	29%	0.289	C	S	.	.	H	α-helix	trans	-60.6	-50.5	176.4	-75	168	0	0	0	110.9	H172 E173 L178 S179 K180	H172-I176 WeakPolarHBondContact O-CB 3.32Å; H172-I176 VanDerWaalsContact O-CG1 3.25Å; H172-I176 WeakPolarHBondContact O-CG1 3.02Å; H172-I176 PolarHBondContact O-N 3.23Å; E173-I176 PolarHBondContact O-N 3.39Å; E173-I176 VanDerWaalsContact O-N 3.16Å; I176-L178 PolarHBondContact O-N 2.82Å; I176-S179 PolarHBondContact O-N 3.21Å; I176-S179 PolarHBondContact O-OG 3.19Å; I176-K180 HydrophobicContact CG2-CD 4.09Å; I176-K180 WeakPolarHBondContact O-CG 3.17Å; I176-K180 PolarHBondContact O-N 2.82Å
177	M	72.6	Confident	73.9	Confident	6 Å²	6	57.6 Å²	57.6	3%	0.03	32%	0.316	C	S	.	.	H	α-helix	trans	-63.6	-42.2	-178.8	-70.3	-149.6	-165.3	0	0	111.9	L169 E173 S174 S179 K180 G181 M182 L184 W434 M464	L169-M177 HydrophobicContact CD1-CE 4Å; L169-M177 HydrophobicContact CD1-SD 3.81Å; L169-M177 HydrophobicContact CD2-CE 3.79Å; E173-M177 WeakPolarHBondContact O-CB 3.23Å; E173-M177 WeakPolarHBondContact O-CG 3.24Å; E173-M177 PolarHBondContact O-N 2.72Å; S174-M177 PolarHBondContact O-N 3.42Å; M177-S179 PolarHBondContact O-N 2.89Å; M177-K180 CarbonylContact O-C 3.51Å; M177-K180 PolarHBondContact O-N 2.9Å; M177-G181 PolarHBondContact O-N 3.14Å; M177-M182 HydrophobicContact CB-CB 4.07Å; M177-M182 HydrophobicContact CB-CG 4.43Å; M177-M182 HydrophobicContact CB-SD 4.06Å; M177-M182 HydrophobicContact CG-SD 3.96Å; M177-M182 VanDerWaalsContact O-CB 3.27Å; M177-M182 WeakPolarHBondContact O-CB 3.23Å; M177-M182 PolarHBondContact O-N 3.08Å; M177-M182 HydrophobicContact SD-CE 3.93Å; M177-M182 HydrophobicContact SD-SD 3.8Å; M177-L184 HydrophobicContact CB-CD1 4.24Å; M177-L184 HydrophobicContact CB-CD2 4.15Å; M177-L184 HydrophobicContact SD-CD2 4Å; M177-W434 HydrophobicContact CE-CH2 3.62Å; M177-W434 HydrophobicContact CE-CZ3 3.83Å; M177-M464 HydrophobicContact CE-CE 3.72Å; M177-M464 HydrophobicContact CE-SD 3.98Å
178	L	73.2	Confident	72.5	Confident	100 Å²	100	58.2 Å²	58.2	52%	0.524	32%	0.32	S	S	.	.	H	α-helix	trans	-61.7	-42	173.4	-71.3	167.8	0	0	0	111.3	S174 I176 K180 G181 L184	S174-L178 VanDerWaalsContact O-CB 3.27Å; S174-L178 WeakPolarHBondContact O-CB 3.26Å; S174-L178 WeakPolarHBondContact O-CD1 3.06Å; S174-L178 WeakPolarHBondContact O-CG 3.39Å; S174-L178 PolarHBondContact O-N 3.39Å; I176-L178 PolarHBondContact O-N 2.82Å; L178-K180 VanDerWaalsContact C-N 3.28Å; L178-K180 PolarHBondContact O-N 3.24Å; L178-G181 PolarHBondContact O-N 3.03Å; L178-L184 HydrophobicContact CD2-CD1 4.4Å; L178-L184 HydrophobicContact CG-CD1 4.03Å
179	S	74.6	Confident	70.9	Confident	101 Å²	101	60 Å²	60	71%	0.706	33%	0.329	S	S	*	.	H	α-helix	trans	-63.4	-32.7	175.2	83.7	0	0	0	0	113	Q175 I176 M177 G181	Q175-S179 WeakPolarHBondContact O-CB 3.43Å; Q175-S179 PolarHBondContact O-N 3.17Å; I176-S179 PolarHBondContact O-N 3.21Å; I176-S179 PolarHBondContact O-OG 3.19Å; M177-S179 PolarHBondContact O-N 2.89Å; S179-G181 PolarHBondContact O-N 2.03Å
180	K	68.3	Low	69	Low	88 Å²	88	67.6 Å²	67.6	38%	0.383	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.8	1	173.4	-67.6	-179.9	-177	-178.2	0	113.1	I176 M177 L178 D465 E468	I176-K180 HydrophobicContact CG2-CD 4.09Å; I176-K180 WeakPolarHBondContact O-CG 3.17Å; I176-K180 PolarHBondContact O-N 2.82Å; M177-K180 CarbonylContact O-C 3.51Å; M177-K180 PolarHBondContact O-N 2.9Å; L178-K180 VanDerWaalsContact C-N 3.28Å; L178-K180 PolarHBondContact O-N 3.24Å; K180-D465 HydrophobicContact CD-CB 3.9Å; K180-D465 VanDerWaalsContact NZ-CG 3.34Å; K180-D465 IonicContact NZ-OD1 2.65Å; K180-D465 PolarHBondContact NZ-OD1 2.87Å; K180-E468 IonicContact NZ-OE1 2.67Å; K180-E468 PolarHBondContact NZ-OE1 3.39Å
181	G	62.6	Low	67	Low	52 Å²	52	68.2 Å²	68.2	54%	0.536	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	78	17.7	179.1	0	0	0	0	0	114.3	M177 L178 S179 K462	M177-G181 PolarHBondContact O-N 3.14Å; L178-G181 PolarHBondContact O-N 3.03Å; S179-G181 PolarHBondContact O-N 2.03Å; G181-K462 PolarHBondContact O-NZ 2.88Å
182	M	64.4	Low	65	Low	17 Å²	17	66 Å²	66	8%	0.084	35%	0.354	C	S	.	.			trans	-72.8	160.6	168.4	-54.3	-177.2	70.6	0	0	109.3	Y164 M177 K462 M464	Y164-M182 HydrophobicContact CD2-CE 4.29Å; Y164-M182 HydrophobicContact CE1-CE 4.46Å; Y164-M182 HydrophobicContact CE2-CE 3.67Å; M177-M182 HydrophobicContact CB-CB 4.07Å; M177-M182 HydrophobicContact CB-CG 4.43Å; M177-M182 HydrophobicContact CB-SD 4.06Å; M177-M182 HydrophobicContact CG-SD 3.96Å; M177-M182 VanDerWaalsContact O-CB 3.27Å; M177-M182 WeakPolarHBondContact O-CB 3.23Å; M177-M182 PolarHBondContact O-N 3.08Å; M177-M182 HydrophobicContact SD-CE 3.93Å; M177-M182 HydrophobicContact SD-SD 3.8Å; M182-K462 HydrophobicContact CB-CD 4.38Å; M182-K462 HydrophobicContact CE-CB 4.33Å; M182-M464 HydrophobicContact CE-SD 4.14Å
183	V	62.7	Low	62.6	Low	77 Å²	77	66 Å²	66	47%	0.467	36%	0.357	S	S	.	.			trans	-122.2	141.2	173.6	168.9	0	0	0	0	104.2	F459 K462	V183-F459 HydrophobicContact CB-CB 3.92Å; V183-F459 HydrophobicContact CG1-CB 4.19Å; V183-F459 HydrophobicContact CG1-CD1 4.49Å; V183-F459 HydrophobicContact CG1-CG 4.37Å; V183-F459 WeakPolarHBondContact O-CB 3.19Å; V183-F459 VanDerWaalsContact O-CD2 3.32Å; V183-F459 WeakPolarHBondContact O-CD2 3.02Å; V183-K462 VanDerWaalsContact N-NZ 3.17Å
184	L	69.4	Low	60.2	Low	22 Å²	22	72.8 Å²	72.8	12%	0.115	39%	0.393	C	S	.	.			trans	-126.1	162.3	-172.9	-51.4	173.3	0	0	0	108.3	A162 Y164 L169 M177 L178	A162-L184 HydrophobicContact CB-CB 3.69Å; A162-L184 HydrophobicContact CB-CD1 3.65Å; A162-L184 HydrophobicContact CB-CG 4.29Å; Y164-L184 HydrophobicContact CD2-CD2 3.97Å; L169-L184 HydrophobicContact CD1-CD1 3.99Å; L169-L184 HydrophobicContact CD1-CD2 3.76Å; L169-L184 HydrophobicContact CD1-CG 4.47Å; M177-L184 HydrophobicContact CB-CD1 4.24Å; M177-L184 HydrophobicContact CB-CD2 4.15Å; M177-L184 HydrophobicContact SD-CD2 4Å; L178-L184 HydrophobicContact CD2-CD1 4.4Å; L178-L184 HydrophobicContact CG-CD1 4.03Å
185	S	67.7	Low	57.9	Low	21 Å²	21	78.4 Å²	78.4	15%	0.147	42%	0.419	C	S	.	.	B	Isolated β-bridge	trans	-93.5	146.9	172.5	-167.3	0	0	0	0	110.5	A162 Y163 D187	A162-S185 CarbonylContact C-O 3.54Å; A162-S185 VanDerWaalsContact CA-O 3.32Å; A162-S185 WeakPolarHBondContact CA-O 3.36Å; Y163-S185 PolarHBondContact N-O 2.04Å; Y163-S185 PolarHBondContact O-N 2.8Å; S185-D187 VanDerWaalsContact CB-O 3.23Å; S185-D187 WeakPolarHBondContact CB-O 3.47Å; S185-D187 PolarHBondContact OG-N 3.25Å; S185-D187 PolarHBondContact OG-O 3.43Å
186	D	66	Low	55.3	Low	142 Å²	142	79.6 Å²	79.6	76%	0.759	43%	0.428	S	S	*	.	S	Bend	trans	-83.1	-19.2	168.8	-60.1	-30.5	0	0	0	111.5	Y163	Y163-D186 WeakPolarHBondContact CE2-O 3.26Å
187	D	62.2	Low	53	Low	119 Å²	119	84.7 Å²	84.7	64%	0.636	46%	0.456	S	S	*	.	S	Bend	trans	-117	144	177.7	-79.3	-52.1	0	0	0	112	Y163 S185	Y163-D187 VanDerWaalsContact CD2-C 3.49Å; S185-D187 VanDerWaalsContact CB-O 3.23Å; S185-D187 WeakPolarHBondContact CB-O 3.47Å; S185-D187 PolarHBondContact OG-N 3.25Å; S185-D187 PolarHBondContact OG-O 3.43Å
188	P	56.8	Low	50.7	Low	13 Å²	13	93.6 Å²	93.6	8%	0.084	50%	0.495	C	S	.	.			trans	-72.8	146	166.5	29.3	-27.8	0	0	0	110.7	Y163 Q190 C394 C397	Y163-P188 HydrophobicContact CD1-CB 3.79Å; Y163-P188 HydrophobicContact CD1-CG 4.47Å; Y163-P188 HydrophobicContact CE1-CB 3.7Å; Y163-P188 HydrophobicContact CE1-CG 3.95Å; Y163-P188 HydrophobicContact CE2-CG 4.35Å; Y163-P188 HydrophobicContact CG-CB 4.23Å; P188-Q190 PolarHBondContact O-N 3.33Å; P188-C394 HydrophobicContact CG-CB 3.56Å; P188-C394 WeakPolarHBondContact CG-O 3.36Å; P188-C397 HydrophobicContact CB-CB 4.48Å
189	L	54.9	Low	48.5	Very low	37 Å²	37	96.2 Å²	96.2	19%	0.194	50%	0.504	C	S	.	.			trans	-90.4	112.9	-164.2	-72.8	155.2	0	0	0	112.9	I191 F459 F489	L189-I191 PolarHBondContact O-N 2.88Å; L189-F459 HydrophobicContact CD1-CZ 4.37Å; L189-F489 HydrophobicContact CB-CE1 4.47Å; L189-F489 HydrophobicContact CD1-CE1 3.77Å; L189-F489 HydrophobicContact CD1-CZ 3.72Å; L189-F489 HydrophobicContact CD2-CE1 4.2Å; L189-F489 HydrophobicContact CG-CE1 4.36Å
190	Q	45.5	Very low	46.3	Very low	159 Å²	159	97.8 Å²	97.8	74%	0.743	51%	0.51	S	S	*	.			trans	-69.3	66.4	173.4	-66.7	-172.6	-10.4	0	0	113	P188	P188-Q190 PolarHBondContact O-N 3.33Å
191	I	39.6	Very low	44.3	Very low	61 Å²	61	99.9 Å²	99.9	31%	0.313	53%	0.525	S	S	.	.			trans	-131.8	80.9	179.1	-48	-171.4	0	0	0	112.7	L189 F489	L189-I191 PolarHBondContact O-N 2.88Å; I191-F489 HydrophobicContact CD1-CD1 3.65Å; I191-F489 HydrophobicContact CD1-CE1 3.44Å; I191-F489 VanDerWaalsContact CD1-CE1 3.44Å; I191-F489 HydrophobicContact CD1-CZ 4.33Å; I191-F489 HydrophobicContact CG1-CE1 4.48Å
192	W	34.9	Very low	42.6	Very low	78 Å²	78	105.7 Å²	105.7	30%	0.295	54%	0.544	S	S	.	.			trans	-126	0.8	154.3	-75.2	110.1	0	0	0	114.1	L194 I422 R512	W192-L194 VanDerWaalsContact C-N 3.3Å; W192-L194 PolarHBondContact O-N 3.18Å; W192-L194 VanDerWaalsContact O-N 3.08Å; W192-I422 HydrophobicContact CD2-CD1 4.47Å; W192-I422 HydrophobicContact CG-CD1 4.2Å; W192-R512 HydrophobicContact CH2-CG 4.2Å; W192-R512 VanDerWaalsContact CH2-NE 3.31Å; W192-R512 HydrophobicContact CZ3-CG 4.13Å
193	N	29.2	Very low	40.9	Very low	126 Å²	126	107.3 Å²	107.3	67%	0.674	57%	0.565	S	S	*	*			trans	-84.2	53.9	177.3	-68.1	-7.5	0	0	0	112.7	N416	N193-N416 PolarHBondContact OD1-ND2 3.43Å
194	L	28	Very low	39.1	Very low	150 Å²	150	114.5 Å²	114.5	79%	0.785	58%	0.583	S	S	*	*	S	Bend	trans	-160.2	37.6	179.3	-121.6	171.2	0	0	0	118.2	W192	W192-L194 VanDerWaalsContact C-N 3.3Å; W192-L194 PolarHBondContact O-N 3.18Å; W192-L194 VanDerWaalsContact O-N 3.08Å
195	E	28.1	Very low	37.1	Very low	128 Å²	128	117.7 Å²	117.7	60%	0.598	60%	0.601	S	S	*	*	S	Bend	trans	-152.1	48.6	157.7	-136.6	160.2	-141.2	0	0	115.8	K486	E195-K486 IonicContact OE1-NZ 2.78Å; E195-K486 PolarHBondContact OE1-NZ 3.18Å; E195-K486 IonicContact OE2-NZ 2.68Å; E195-K486 PolarHBondContact OE2-NZ 3.39Å
196	D	25.7	Very low	35.3	Very low	130 Å²	130	124.9 Å²	124.9	70%	0.695	63%	0.629	S	S	*	*	S	Bend	trans	-122.2	62	164.4	-89.9	-51.2	0	0	0	109.7	K419	D196-K419 IonicContact OD2-NZ 2.9Å; D196-K419 PolarHBondContact OD2-NZ 2.82Å
197	N	26.2	Very low	33.5	Very low	151 Å²	151	125.1 Å²	125.1	81%	0.807	63%	0.625	S	S	*	*			trans	-169.7	127.3	167.7	-113.7	-50.8	0	0	0	112.8
198	K	25.8	Very low	31.7	Very low	194 Å²	194	124.1 Å²	124.1	84%	0.843	63%	0.628	S	S	*	*			trans	-151.5	37.9	171.4	-136.5	-172.3	-175.2	-169.2	0	117.4
199	E	26.5	Very low	30.3	Very low	155 Å²	155	131.7 Å²	131.7	72%	0.724	67%	0.667	S	S	*	*	S	Bend	trans	-134.3	129.6	158.3	-75.6	-165.8	175.7	0	0	108.7
200	T	27.8	Very low	28.9	Very low	134 Å²	134	137.3 Å²	137.3	82%	0.822	70%	0.696	S	S	*	*			cis	-137.8	162.7	-21.3	49.7	0	0	0	0	108.4
201	N	25.4	Very low	28	Very low	131 Å²	131	134.7 Å²	134.7	70%	0.701	69%	0.693	S	S	*	*			trans	-118.8	108.8	-172.9	-164.2	-9.4	0	0	0	112.7
202	N	28.6	Very low	27.4	Very low	175 Å²	175	138 Å²	138	94%	0.936	71%	0.711	S	S	*	*			trans	-163.7	104.2	168.6	-106	-21	0	0	0	109.9
203	G	27.8	Very low	26.9	Very low	50 Å²	50	139.9 Å²	139.9	52%	0.515	74%	0.736	S	S	.	*			cis	157.9	129.2	-15.1	0	0	0	0	0	113.2
204	R	26	Very low	26.8	Very low	229 Å²	229	139.9 Å²	139.9	86%	0.864	74%	0.737	S	S	*	*			trans	66.9	151.6	168.1	-57.1	174.4	173.9	164.4	0.2	115.1
205	N	27.5	Very low	26.8	Very low	89 Å²	89	138.1 Å²	138.1	48%	0.476	73%	0.734	S	S	.	*			cis	-164.8	154.5	-14.3	-114.4	-44.4	0	0	0	104.8	N493	N205-N493 PolarHBondContact OD1-ND2 2.92Å; N205-N493 VanDerWaalsContact OD1-ND2 3.13Å
206	K	28.5	Very low	26.7	Very low	171 Å²	171	139.7 Å²	139.7	74%	0.743	75%	0.745	S	S	*	*			cis	-173.4	158.3	46.6	-127.2	155.2	-174.5	176.8	0	110.3
207	H	27.8	Very low	26.7	Very low	147 Å²	147	140.8 Å²	140.8	68%	0.681	75%	0.751	S	S	*	*			trans	2.9	149.2	146.5	-54.8	-25.6	0	0	0	120.7
208	S	24.6	Very low	26.8	Very low	99 Å²	99	139.8 Å²	139.8	69%	0.692	75%	0.746	S	S	*	*			cis	178.1	149.9	-4.4	48.2	0	0	0	0	110.4
209	N	28	Very low	26.9	Very low	171 Å²	171	137.2 Å²	137.2	91%	0.914	74%	0.74	S	S	*	*			trans	-160.4	74.5	153.3	-99.5	-23.1	0	0	0	113
210	I	25.9	Very low	26.8	Very low	155 Å²	155	140.5 Å²	140.5	80%	0.795	75%	0.752	S	S	*	*			trans	-74.4	151.8	150.2	-81.6	167.1	0	0	0	106.9
211	P	26.9	Very low	26.7	Very low	104 Å²	104	144.1 Å²	144.1	68%	0.675	75%	0.751	S	S	*	*			cis	-140.7	-165.2	28.8	37.9	-15.8	0	0	0	116.7
212	N	26.1	Very low	26.8	Very low	131 Å²	131	145.9 Å²	145.9	70%	0.701	76%	0.755	S	S	*	*			trans	83.6	73.1	158.6	-65.2	6.3	0	0	0	118.7	N214	N212-N214 PolarHBondContact O-N 3.1Å
213	S	25.3	Very low	26.8	Very low	117 Å²	117	143.8 Å²	143.8	82%	0.818	74%	0.742	S	S	*	*			trans	-77.5	87.5	140.9	53.8	0	0	0	0	110.2
214	N	25.7	Very low	26.7	Very low	127 Å²	127	146.9 Å²	146.9	68%	0.679	76%	0.756	S	S	*	*			trans	-90.3	118	159.9	-90	36.8	0	0	0	108.4	N212	N212-N214 PolarHBondContact O-N 3.1Å
215	P	28.7	Very low	26.8	Very low	113 Å²	113	141.2 Å²	141.2	73%	0.734	75%	0.747	S	S	*	*			trans	-141.3	91.1	141.6	34.3	-17.5	0	0	0	111.7
216	L	26.6	Very low	26.8	Very low	160 Å²	160	145 Å²	145	84%	0.838	76%	0.761	S	S	*	*			trans	-166.6	44.4	156.1	-111.6	163.4	0	0	0	113.2	D218	L216-D218 VanDerWaalsContact C-N 3.32Å; L216-D218 PolarHBondContact O-N 3.21Å
217	D	24.6	Very low	26.7	Very low	153 Å²	153	145.8 Å²	145.8	82%	0.818	77%	0.773	S	S	*	*			trans	-88	76.1	152.8	-90.3	-48.3	0	0	0	107.8
218	D	27.8	Very low	26.7	Very low	131 Å²	131	142.4 Å²	142.4	70%	0.701	77%	0.77	S	S	*	*	S	Bend	trans	-165	143	130.1	-119.1	-31.9	0	0	0	114.2	L216	L216-D218 VanDerWaalsContact C-N 3.32Å; L216-D218 PolarHBondContact O-N 3.21Å
219	I	29.5	Very low	26.8	Very low	140 Å²	140	140.8 Å²	140.8	72%	0.718	77%	0.769	S	S	*	*			trans	48.1	73.1	162.6	-39.7	178.2	0	0	0	117.3
220	K	24.8	Very low	26.9	Very low	223 Å²	223	140.9 Å²	140.9	97%	0.97	77%	0.769	S	S	*	*			trans	-119.2	73.3	130.1	-121.8	-176.2	-173.2	178.4	0	110.5
221	R	24.9	Very low	27.1	Very low	211 Å²	211	138.6 Å²	138.6	80%	0.796	77%	0.767	S	S	*	*			trans	-143.9	130.1	172.2	-162.6	170.8	-172.9	-119.8	-3.9	107.8
222	E	27.2	Very low	27.2	Very low	167 Å²	167	141.1 Å²	141.1	78%	0.78	76%	0.764	S	S	*	*	S	Bend	trans	71	129.9	-167.1	-62.9	178.7	-158.9	0	0	113.2
223	I	28.8	Very low	27.4	Very low	132 Å²	132	143.6 Å²	143.6	68%	0.677	77%	0.771	S	S	*	*			cis	-127.3	124.5	-8.7	-70.3	100.5	0	0	0	111.2
224	S	25.1	Very low	27.6	Very low	115 Å²	115	144.1 Å²	144.1	80%	0.804	76%	0.763	S	S	*	*	S	Bend		-131.3	118.7	127.4	-174.5	0	0	0	0	104
225	T	28	Very low	27.7	Very low	109 Å²	109	148.2 Å²	148.2	67%	0.669	78%	0.775	S	S	*	*			cis	-143	148.8	45.9	43.7	0	0	0	0	112.8
226	H	28.8	Very low	27.8	Very low	169 Å²	169	151 Å²	151	78%	0.782	78%	0.778	S	S	*	*			trans	-157	52.8	155.6	-106.8	-51.8	0	0	0	114.4	A228	H226-A228 PolarHBondContact ND1-O 3.01Å
227	L	25.4	Very low	27.8	Very low	188 Å²	188	152.3 Å²	152.3	98%	0.984	78%	0.777	S	S	*	*			trans	-102	59	152.7	-88.4	175	0	0	0	110.3
228	A	28.6	Very low	27.9	Very low	76 Å²	76	152.1 Å²	152.1	63%	0.628	77%	0.771	S	S	*	*			trans	-154.4	118.2	165.5	0	0	0	0	0	107.9	H226	H226-A228 PolarHBondContact ND1-O 3.01Å
229	G	25.7	Very low	28	Very low	65 Å²	65	153.7 Å²	153.7	67%	0.67	78%	0.778	S	S	*	*			trans	-98.4	155.7	176.1	0	0	0	0	0	112.1
230	N	30	Very low	27.8	Very low	172 Å²	172	157 Å²	157	92%	0.92	78%	0.781	S	S	*	*			trans	67.7	128.9	179.8	-46.6	-49.3	0	0	0	113.9
231	S	30.6	Very low	27.8	Very low	108 Å²	108	150.6 Å²	150.6	76%	0.755	76%	0.764	S	S	*	*			cis	-155.2	136.5	23	-169.3	0	0	0	0	114.3
232	R	29.3	Very low	27.9	Very low	157 Å²	157	149.5 Å²	149.5	59%	0.592	76%	0.762	S	S	*	*			trans	22.6	123.1	152	-64.6	176.2	174.5	149.8	0.1	120.9	T1502	R232-T1502 PolarHBondContact NH1-O 2.7Å; R232-T1502 PolarHBondContact NH2-O 2.88Å; R232-T1502 VanDerWaalsContact NH2-O 3.1Å; R232-T1502 PolarHBondContact NH2-OG1 3.35Å
233	H	30	Very low	28	Very low	183 Å²	183	150.1 Å²	150.1	85%	0.847	76%	0.762	S	S	*	*			trans	-50.9	144.4	150.5	-81.6	0.4	0	0	0	113.2
234	L	28.7	Very low	28.2	Very low	128 Å²	128	149.8 Å²	149.8	67%	0.67	76%	0.761	S	S	*	*				168.6	125	101	-112.7	155.1	0	0	0	113.9	Q236	L234-Q236 HydrophobicContact CD2-CG 4.19Å
235	K	29	Very low	28.2	Very low	213 Å²	213	152.4 Å²	152.4	93%	0.926	76%	0.763	S	S	*	*			trans	-161.9	154.8	136.7	-115.6	170.4	-175.6	175.2	0	111
236	Q	29.8	Very low	28.6	Very low	171 Å²	171	152.1 Å²	152.1	80%	0.799	77%	0.772	S	S	*	*			trans	-111.7	143.8	-162.3	-69.2	178	-19.3	0	0	114.8	L234	L234-Q236 HydrophobicContact CD2-CG 4.19Å
237	K	26.5	Very low	28.7	Very low	187 Å²	187	151.5 Å²	151.5	81%	0.813	77%	0.774	S	S	*	*			trans	20.2	124.8	144.1	-71.7	179.5	176.2	175.1	0	121
238	H	27.7	Very low	28.9	Very low	149 Å²	149	153.1 Å²	153.1	69%	0.69	77%	0.767	S	S	*	*			trans	67.4	128.7	135.9	-74.9	-63.7	0	0	0	122.4
239	I	28.8	Very low	29.2	Very low	165 Å²	165	156.7 Å²	156.7	85%	0.846	78%	0.776	S	S	*	*			trans	-112.9	159.9	142	-79.5	179.2	0	0	0	109.8
240	R	25.2	Very low	29.4	Very low	209 Å²	209	160.9 Å²	160.9	79%	0.789	78%	0.782	S	S	*	*			trans	-145.3	155.6	-177.9	-78.7	-179.1	175.4	-176.8	-2.3	108.4
241	S	26.4	Very low	29.4	Very low	88 Å²	88	158.3 Å²	158.3	62%	0.615	78%	0.775	S	S	*	*			cis	-172.8	178.1	-14.1	179.6	0	0	0	0	107.8
242	Y	27	Very low	29.4	Very low	189 Å²	189	165.1 Å²	165.1	74%	0.741	78%	0.784	S	S	*	*			trans	77.6	135.8	163.5	-67.1	-78	0	0	0	119.8
243	K	29.4	Very low	29.5	Very low	180 Å²	180	167.1 Å²	167.1	78%	0.783	80%	0.797	S	S	*	*				-117.3	127.6	118	-83.1	-163.4	166.7	-170.1	0	109.4
244	D	32.2	Very low	29.8	Very low	124 Å²	124	165.8 Å²	165.8	66%	0.663	80%	0.795	S	S	*	*				49	129.7	125.1	-36.4	-33.9	0	0	0	119
245	M	26.1	Very low	29.8	Very low	171 Å²	171	169.7 Å²	169.7	84%	0.842	81%	0.807	S	S	*	*			cis	82	71.2	20.3	-56.5	-150.6	-173.4	0	0	119
246	A	35.2	Very low	29.8	Very low	103 Å²	103	165.8 Å²	165.8	85%	0.851	80%	0.796	S	S	*	*			trans	-150	150.6	135.8	0	0	0	0	0	107.2
247	D	31.2	Very low	29.8	Very low	156 Å²	156	165.6 Å²	165.6	83%	0.834	80%	0.8	S	S	*	*			cis	-138.8	175.6	12.7	-168.3	10.9	0	0	0	111.2
248	R	28.6	Very low	30	Very low	221 Å²	221	162.7 Å²	162.7	83%	0.834	80%	0.798	S	S	*	*			trans	-128.2	135	-178.7	-62.2	176.4	177.4	177.8	0.7	111.8
249	N	35.3	Very low	30.1	Very low	151 Å²	151	159.8 Å²	159.8	81%	0.807	79%	0.794	S	S	*	*			trans	-171.1	145.4	141.6	-104.8	-41.7	0	0	0	116.3
250	L	29.9	Very low	30.2	Very low	154 Å²	154	163.9 Å²	163.9	81%	0.806	80%	0.799	S	S	*	*			trans	59.9	163.3	155.9	-97.8	65	0	0	0	119.9
251	P	31.5	Very low	30.6	Very low	117 Å²	117	165.4 Å²	165.4	76%	0.76	81%	0.805	S	S	*	*				-135.6	-163.6	-122.7	40	-17.5	0	0	0	116.6	K253	P251-K253 PolarHBondContact O-N 2.79Å
252	R	30.1	Very low	30.9	Very low	252 Å²	252	171 Å²	171	95%	0.951	81%	0.812	S	S	*	*	S	Bend	trans	-64.8	80.1	-171.7	-60.5	173.7	176.8	169.4	-2.3	115.1
253	K	30.8	Very low	31.4	Very low	198 Å²	198	167.7 Å²	167.7	86%	0.861	81%	0.807	S	S	*	*	S	Bend	trans	-155.1	37.8	158.7	-127	175.9	-173.9	-177.5	0	118.5	P251	P251-K253 PolarHBondContact O-N 2.79Å
254	L	35.5	Very low	31.8	Very low	156 Å²	156	166.4 Å²	166.4	82%	0.817	80%	0.804	S	S	*	*			trans	-148.3	43.3	160.8	-139.4	85.1	0	0	0	114.6	N256	L254-N256 VanDerWaalsContact C-N 3.29Å; L254-N256 PolarHBondContact O-N 2.94Å; L254-N256 VanDerWaalsContact O-N 3.1Å
255	K	29.1	Very low	32.1	Very low	210 Å²	210	164.4 Å²	164.4	91%	0.913	80%	0.8	S	S	*	*			trans	-83.5	69.1	171.4	-89	-165.5	172	-171.9	0	111.9
256	N	29.3	Very low	32.7	Very low	130 Å²	130	161.3 Å²	161.3	70%	0.695	79%	0.786	S	S	*	*	S	Bend	trans	-175.9	163.4	151.5	-94.2	-24.5	0	0	0	108.5	L254	L254-N256 VanDerWaalsContact C-N 3.29Å; L254-N256 PolarHBondContact O-N 2.94Å; L254-N256 VanDerWaalsContact O-N 3.1Å
257	L	30.1	Very low	33.1	Very low	168 Å²	168	164.5 Å²	164.5	88%	0.88	78%	0.781	S	S	*	*	S	Bend	trans	67.8	50.4	-176.3	-56.9	170.6	0	0	0	116.3
258	T	29.9	Very low	33.6	Very low	126 Å²	126	163.5 Å²	163.5	77%	0.773	77%	0.77	S	S	*	*	S	Bend	trans	-163.2	1.7	150.2	8.1	0	0	0	0	115.5	R260	T258-R260 PolarHBondContact O-N 3.34Å
259	S	29.7	Very low	34.1	Very low	87 Å²	87	154.5 Å²	154.5	61%	0.608	75%	0.745	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.8	-0.9	-172	49.6	0	0	0	0	116.5
260	R	31.3	Very low	34.5	Very low	251 Å²	251	153.2 Å²	153.2	95%	0.947	74%	0.735	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.6	13.6	178.4	-92.9	-173	174.4	-175.3	-1.1	115.4	T258	T258-R260 PolarHBondContact O-N 3.34Å
261	R	33.9	Very low	35.2	Very low	242 Å²	242	155 Å²	155	91%	0.913	73%	0.731	S	S	*	*	S	Bend	trans	-132.1	14.5	179	-103.9	-175.9	177.5	-177.9	-1.4	116.6
262	R	32.9	Very low	35.9	Very low	206 Å²	206	156.8 Å²	156.8	78%	0.777	72%	0.722	S	S	*	*	S	Bend	trans	-120.3	-30.1	174.3	-91.1	-179.2	169.7	161.2	-2.1	116.4	Q264 S265	R262-Q264 PolarHBondContact O-N 3.02Å; R262-S265 WeakPolarHBondContact O-CB 3.03Å; R262-S265 PolarHBondContact O-N 3.03Å
263	D	37.2	Very low	37	Very low	118 Å²	118	150.4 Å²	150.4	63%	0.631	70%	0.703	S	S	*	*	H	α-helix	trans	-78.4	-14	-175	-72.9	-50.1	0	0	0	116.5	S265	D263-S265 VanDerWaalsContact C-N 3.33Å
264	Q	38.2	Very low	38.2	Very low	154 Å²	154	150.2 Å²	150.2	72%	0.72	70%	0.697	S	S	*	*	H	α-helix	trans	-74.5	-22.9	167.1	-81.2	-175.1	-21.5	0	0	112.8	R262 F268	R262-Q264 PolarHBondContact O-N 3.02Å; Q264-F268 PolarHBondContact O-N 2.96Å
265	S	38.8	Very low	39.1	Very low	82 Å²	82	151.1 Å²	151.1	57%	0.573	69%	0.69	S	S	*	*	H	α-helix	trans	-68.6	-51.1	178.2	-171.8	0	0	0	0	111.4	R262 D263 K267 F268 G269	R262-S265 WeakPolarHBondContact O-CB 3.03Å; R262-S265 PolarHBondContact O-N 3.03Å; D263-S265 VanDerWaalsContact C-N 3.33Å; S265-K267 PolarHBondContact O-N 3.14Å; S265-F268 PolarHBondContact O-N 2.03Å; S265-G269 PolarHBondContact O-N 2.97Å
266	N	38.9	Very low	40.8	Very low	105 Å²	105	148.1 Å²	148.1	56%	0.561	67%	0.672	S	S	*	*	H	α-helix	trans	-67.1	-35	-173.9	-72.9	-19.9	0	0	0	113.7	G269 Q270	N266-G269 PolarHBondContact O-N 3.39Å; N266-Q270 WeakPolarHBondContact O-CG 3.49Å; N266-Q270 PolarHBondContact O-N 2.82Å
267	K	42.7	Very low	42.6	Very low	171 Å²	171	146.8 Å²	146.8	74%	0.743	67%	0.665	S	S	*	*	H	α-helix	trans	-71.7	-31.7	175.1	-91.9	-175	174.2	179.5	0	113.1	S265 R271	S265-K267 PolarHBondContact O-N 3.14Å; K267-R271 PolarHBondContact O-N 2.9Å
268	F	41.2	Very low	44.3	Very low	135 Å²	135	144.8 Å²	144.8	59%	0.592	65%	0.652	S	S	*	*	H	α-helix	trans	-71.7	-44.9	171.8	-150.9	-99.6	0	0	0	110.5	Q264 S265 Q270 R271 W272	Q264-F268 PolarHBondContact O-N 2.96Å; S265-F268 PolarHBondContact O-N 2.03Å; F268-Q270 PolarHBondContact O-N 3.12Å; F268-R271 PolarHBondContact O-N 2.96Å; F268-W272 AromaticContact CE1-CD1 3.58Å; F268-W272 WeakPolarHBondContact O-CB 3.38Å; F268-W272 PolarHBondContact O-N 3.21Å
269	G	39.2	Very low	46.1	Very low	31 Å²	31	144.1 Å²	144.1	32%	0.32	64%	0.643	S	S	.	*	H	α-helix	trans	-51.4	-52.3	174.9	0	0	0	0	0	113.1	S265 N266 R271 W272 Q273	S265-G269 PolarHBondContact O-N 2.97Å; N266-G269 PolarHBondContact O-N 3.39Å; G269-R271 PolarHBondContact O-N 3.39Å; G269-W272 PolarHBondContact O-N 2.86Å; G269-Q273 WeakPolarHBondContact O-CB 3.48Å; G269-Q273 VanDerWaalsContact O-CG 3.3Å; G269-Q273 WeakPolarHBondContact O-CG 3.22Å; G269-Q273 PolarHBondContact O-N 3.45Å; G269-Q273 PolarHBondContact O-OE1 2.88Å
270	Q	45.2	Very low	48	Very low	125 Å²	125	144.5 Å²	144.5	58%	0.584	64%	0.637	S	S	*	*	H	α-helix	trans	-65.6	-36.1	178.8	-71.5	-177.2	1.2	0	0	113.6	N266 F268 Q273 R274	N266-Q270 WeakPolarHBondContact O-CG 3.49Å; N266-Q270 PolarHBondContact O-N 2.82Å; F268-Q270 PolarHBondContact O-N 3.12Å; Q270-Q273 PolarHBondContact O-N 3.37Å; Q270-R274 PolarHBondContact O-N 3.46Å
271	R	43.9	Very low	49.8	Very low	192 Å²	192	140.6 Å²	140.6	73%	0.725	63%	0.627	S	S	*	*	H	α-helix	trans	-71.6	-36.5	177.2	-159.2	176.2	-168.8	-175.3	4.4	111.6	K267 F268 G269 R275	K267-R271 PolarHBondContact O-N 2.9Å; F268-R271 PolarHBondContact O-N 2.96Å; G269-R271 PolarHBondContact O-N 3.39Å; R271-R275 PolarHBondContact O-N 2.71Å; R271-R275 VanDerWaalsContact O-N 3.07Å
272	W	46.4	Very low	51.4	Low	154 Å²	154	137.9 Å²	137.9	58%	0.583	62%	0.617	S	S	*	*	H	α-helix	trans	-70.2	-38.4	172.8	-130.6	93.6	0	0	0	111.7	F268 G269 R276	F268-W272 AromaticContact CE1-CD1 3.58Å; F268-W272 WeakPolarHBondContact O-CB 3.38Å; F268-W272 PolarHBondContact O-N 3.21Å; G269-W272 PolarHBondContact O-N 2.86Å; W272-R276 HydrophobicContact CE3-CB 4.22Å; W272-R276 HydrophobicContact CZ3-CB 4.48Å; W272-R276 WeakPolarHBondContact O-CB 3.09Å; W272-R276 PolarHBondContact O-N 3.18Å
273	Q	52.2	Low	53.1	Low	118 Å²	118	137.3 Å²	137.3	55%	0.551	62%	0.615	S	S	*	*	H	α-helix	trans	-67	-39.4	174.1	-76.9	171.5	-42.9	0	0	112.2	G269 Q270 R276 N277	G269-Q273 WeakPolarHBondContact O-CB 3.48Å; G269-Q273 VanDerWaalsContact O-CG 3.3Å; G269-Q273 WeakPolarHBondContact O-CG 3.22Å; G269-Q273 PolarHBondContact O-N 3.45Å; G269-Q273 PolarHBondContact O-OE1 2.88Å; Q270-Q273 PolarHBondContact O-N 3.37Å; Q273-R276 PolarHBondContact O-N 2.04Å; Q273-N277 VanDerWaalsContact O-CB 3.24Å; Q273-N277 WeakPolarHBondContact O-CB 3.42Å; Q273-N277 PolarHBondContact O-N 3.41Å; Q273-N277 PolarHBondContact O-OD1 3.31Å
274	R	56.4	Low	54.6	Low	194 Å²	194	140.5 Å²	140.5	73%	0.732	62%	0.618	S	S	*	*	H	α-helix	trans	-61.3	-52.8	171.3	-78.1	-173.9	178.3	-178	-0.4	111.4	Q270 R276 N277 E278	Q270-R274 PolarHBondContact O-N 3.46Å; R274-R276 VanDerWaalsContact C-N 3.32Å; R274-R276 PolarHBondContact O-N 3.22Å; R274-N277 PolarHBondContact O-N 3.42Å; R274-E278 WeakPolarHBondContact O-CG 3.37Å; R274-E278 PolarHBondContact O-N 2.93Å
275	R	54	Low	56.1	Low	175 Å²	175	140.6 Å²	140.6	66%	0.66	61%	0.613	S	S	*	*	H	α-helix	trans	-60.6	-36.5	175.6	-88.5	-172.9	167.3	-176.1	-4.2	113.3	R271 L279	R271-R275 PolarHBondContact O-N 2.71Å; R271-R275 VanDerWaalsContact O-N 3.07Å; R275-L279 VanDerWaalsContact O-CB 3.28Å; R275-L279 WeakPolarHBondContact O-CB 3.43Å; R275-L279 VanDerWaalsContact O-CG 3.24Å; R275-L279 WeakPolarHBondContact O-CG 3.43Å; R275-L279 PolarHBondContact O-N 2.88Å
276	R	65.1	Low	57.5	Low	146 Å²	146	141.2 Å²	141.2	55%	0.551	61%	0.61	S	S	*	*	H	α-helix	trans	-69.6	-37.7	176.3	-172.7	175.2	-177	152.3	-1.9	111.4	W272 Q273 R274 L279 L280	W272-R276 HydrophobicContact CE3-CB 4.22Å; W272-R276 HydrophobicContact CZ3-CB 4.48Å; W272-R276 WeakPolarHBondContact O-CB 3.09Å; W272-R276 PolarHBondContact O-N 3.18Å; Q273-R276 PolarHBondContact O-N 2.04Å; R274-R276 VanDerWaalsContact C-N 3.32Å; R274-R276 PolarHBondContact O-N 3.22Å; R276-L279 PolarHBondContact O-N 3.27Å; R276-L280 HydrophobicContact CG-CD1 4.12Å; R276-L280 VanDerWaalsContact O-CB 3.25Å; R276-L280 WeakPolarHBondContact O-CB 3.21Å; R276-L280 WeakPolarHBondContact O-CD1 3.42Å; R276-L280 WeakPolarHBondContact O-CG 3.34Å; R276-L280 PolarHBondContact O-N 3.42Å
277	N	68.5	Low	58.9	Low	102 Å²	102	141.4 Å²	141.4	55%	0.545	61%	0.607	S	S	.	*	H	α-helix	trans	-72.8	-33.5	175.4	-71.3	-2.8	0	0	0	112.1	Q273 R274 K281	Q273-N277 VanDerWaalsContact O-CB 3.24Å; Q273-N277 WeakPolarHBondContact O-CB 3.42Å; Q273-N277 PolarHBondContact O-N 3.41Å; Q273-N277 PolarHBondContact O-OD1 3.31Å; R274-N277 PolarHBondContact O-N 3.42Å; N277-K281 WeakPolarHBondContact O-CB 3.35Å; N277-K281 PolarHBondContact O-N 2.02Å
278	E	65.7	Low	60.2	Low	127 Å²	127	137.8 Å²	137.8	59%	0.593	60%	0.595	S	S	*	*	H	α-helix	trans	-66.6	-45.8	168.3	-74.6	-179.4	144.2	0	0	111.8	R274 L280 K281 R282	R274-E278 WeakPolarHBondContact O-CG 3.37Å; R274-E278 PolarHBondContact O-N 2.93Å; E278-L280 VanDerWaalsContact C-N 3.29Å; E278-L280 PolarHBondContact O-N 3.19Å; E278-K281 CarbonylContact O-C 3.56Å; E278-K281 WeakPolarHBondContact O-CB 3Å; E278-K281 PolarHBondContact O-N 2.91Å; E278-R282 WeakPolarHBondContact O-CB 3.27Å; E278-R282 PolarHBondContact O-N 3.35Å
279	L	66.2	Low	61.6	Low	112 Å²	112	136.6 Å²	136.6	59%	0.586	59%	0.59	S	S	*	*	H	α-helix	trans	-65.1	-32.3	175.3	-76.1	166.5	0	0	0	112.2	R275 R276 R283	R275-L279 VanDerWaalsContact O-CB 3.28Å; R275-L279 WeakPolarHBondContact O-CB 3.43Å; R275-L279 VanDerWaalsContact O-CG 3.24Å; R275-L279 WeakPolarHBondContact O-CG 3.43Å; R275-L279 PolarHBondContact O-N 2.88Å; R276-L279 PolarHBondContact O-N 3.27Å; L279-R283 VanDerWaalsContact O-CB 3.27Å; L279-R283 WeakPolarHBondContact O-CB 3.36Å; L279-R283 WeakPolarHBondContact O-CG 3.32Å; L279-R283 PolarHBondContact O-N 2.72Å
280	L	70.7	Confident	62.9	Low	94 Å²	94	137.7 Å²	137.7	49%	0.492	60%	0.596	S	S	.	*	H	α-helix	trans	-72.2	-38.4	170.7	-76.3	166.3	0	0	0	111.8	R276 E278 R284	R276-L280 HydrophobicContact CG-CD1 4.12Å; R276-L280 VanDerWaalsContact O-CB 3.25Å; R276-L280 WeakPolarHBondContact O-CB 3.21Å; R276-L280 WeakPolarHBondContact O-CD1 3.42Å; R276-L280 WeakPolarHBondContact O-CG 3.34Å; R276-L280 PolarHBondContact O-N 3.42Å; E278-L280 VanDerWaalsContact C-N 3.29Å; E278-L280 PolarHBondContact O-N 3.19Å; L280-R284 WeakPolarHBondContact O-CB 3.38Å; L280-R284 PolarHBondContact O-N 3.08Å
281	K	69.6	Low	64.1	Low	169 Å²	169	136.4 Å²	136.4	74%	0.735	59%	0.59	S	S	*	*	H	α-helix	trans	-61.1	-47.9	169	-95	-168.1	171.1	-170.7	0	111.2	N277 E278 R284 Y285	N277-K281 WeakPolarHBondContact O-CB 3.35Å; N277-K281 PolarHBondContact O-N 2.02Å; E278-K281 CarbonylContact O-C 3.56Å; E278-K281 WeakPolarHBondContact O-CB 3Å; E278-K281 PolarHBondContact O-N 2.91Å; K281-R284 PolarHBondContact O-N 2.83Å; K281-Y285 WeakPolarHBondContact O-CB 3.22Å; K281-Y285 PolarHBondContact O-N 2.81Å
282	R	67.2	Low	65.3	Low	186 Å²	186	130.8 Å²	130.8	70%	0.702	58%	0.577	S	S	*	*	H	α-helix	trans	-64.4	-41.5	177.8	-114.7	-179	179.5	-172.4	0.7	111.8	E278 N286	E278-R282 WeakPolarHBondContact O-CB 3.27Å; E278-R282 PolarHBondContact O-N 3.35Å; R282-N286 VanDerWaalsContact O-CB 3.25Å; R282-N286 WeakPolarHBondContact O-CB 3.01Å; R282-N286 PolarHBondContact O-N 2.74Å; R282-N286 PolarHBondContact O-OD1 2.84Å
283	R	68	Low	66.1	Low	193 Å²	193	128.7 Å²	128.7	73%	0.728	57%	0.574	S	S	*	*	H	α-helix	trans	-63.4	-47.7	172.1	-84.5	-171.8	170.7	-165.7	-3.1	111.7	L279 Y285 N286 Q287	L279-R283 VanDerWaalsContact O-CB 3.27Å; L279-R283 WeakPolarHBondContact O-CB 3.36Å; L279-R283 WeakPolarHBondContact O-CG 3.32Å; L279-R283 PolarHBondContact O-N 2.72Å; R283-Y285 VanDerWaalsContact C-N 3.34Å; R283-Y285 PolarHBondContact O-N 2.79Å; R283-N286 PolarHBondContact O-N 3.01Å; R283-Q287 WeakPolarHBondContact O-CB 3.33Å; R283-Q287 PolarHBondContact O-N 2.85Å
284	R	68.7	Low	66.8	Low	185 Å²	185	125.5 Å²	125.5	70%	0.698	57%	0.568	S	S	*	*	H	α-helix	trans	-67.2	-33.6	-179.6	-161.9	173.9	-168.2	176.2	3.5	112.3	L280 K281 L288	L280-R284 WeakPolarHBondContact O-CB 3.38Å; L280-R284 PolarHBondContact O-N 3.08Å; K281-R284 PolarHBondContact O-N 2.83Å; R284-L288 HydrophobicContact CG-CD1 4.47Å; R284-L288 VanDerWaalsContact O-CB 3.29Å; R284-L288 WeakPolarHBondContact O-CB 3.05Å; R284-L288 WeakPolarHBondContact O-CG 3.43Å; R284-L288 PolarHBondContact O-N 2.93Å
285	Y	69.6	Low	67.3	Low	156 Å²	156	122.4 Å²	122.4	61%	0.612	56%	0.56	S	S	*	*	H	α-helix	trans	-68.9	-46.8	171.4	177.8	-104.1	0	0	0	111.9	K281 R283 Q287 L288 K289	K281-Y285 WeakPolarHBondContact O-CB 3.22Å; K281-Y285 PolarHBondContact O-N 2.81Å; R283-Y285 VanDerWaalsContact C-N 3.34Å; R283-Y285 PolarHBondContact O-N 2.79Å; Y285-Q287 VanDerWaalsContact C-N 3.29Å; Y285-Q287 PolarHBondContact O-N 2.8Å; Y285-L288 PolarHBondContact O-N 2.83Å; Y285-K289 VanDerWaalsContact O-CB 3.25Å; Y285-K289 WeakPolarHBondContact O-CB 3.41Å; Y285-K289 PolarHBondContact O-N 2.95Å
286	N	67.4	Low	67.7	Low	95 Å²	95	118.5 Å²	118.5	51%	0.508	55%	0.551	S	S	.	*	H	α-helix	trans	-65.7	-33.6	175.8	-71.3	3	0	0	0	112	R282 R283 A290	R282-N286 VanDerWaalsContact O-CB 3.25Å; R282-N286 WeakPolarHBondContact O-CB 3.01Å; R282-N286 PolarHBondContact O-N 2.74Å; R282-N286 PolarHBondContact O-OD1 2.84Å; R283-N286 PolarHBondContact O-N 3.01Å; N286-A290 VanDerWaalsContact O-CB 3.3Å; N286-A290 WeakPolarHBondContact O-CB 3.47Å; N286-A290 PolarHBondContact O-N 2.75Å
287	Q	70	Confident	67.5	Low	110 Å²	110	118.2 Å²	118.2	51%	0.514	56%	0.556	S	S	.	*	H	α-helix	trans	-70.4	-49.4	175	178.6	171.3	-4.8	0	0	110.8	R283 Y285 K289 A290 E291	R283-Q287 WeakPolarHBondContact O-CB 3.33Å; R283-Q287 PolarHBondContact O-N 2.85Å; Y285-Q287 VanDerWaalsContact C-N 3.29Å; Y285-Q287 PolarHBondContact O-N 2.8Å; Q287-K289 VanDerWaalsContact C-N 3.26Å; Q287-K289 PolarHBondContact O-N 3.07Å; Q287-A290 CarbonylContact O-C 3.58Å; Q287-A290 PolarHBondContact O-N 3.49Å; Q287-A290 VanDerWaalsContact O-N 3.1Å; Q287-E291 HydrophobicContact CG-CG 4.3Å; Q287-E291 WeakPolarHBondContact CG-OE1 3.3Å; Q287-E291 PolarHBondContact NE2-OE1 3.19Å; Q287-E291 WeakPolarHBondContact O-CB 3.29Å; Q287-E291 VanDerWaalsContact O-CG 3.31Å; Q287-E291 WeakPolarHBondContact O-CG 3.29Å; Q287-E291 PolarHBondContact O-N 2.84Å
288	L	70.1	Confident	67.1	Low	94 Å²	94	118 Å²	118	49%	0.492	55%	0.554	S	S	.	*	H	α-helix	trans	-57	-39.7	171.2	-86.5	161.1	0	0	0	111.9	R284 Y285 T292	R284-L288 HydrophobicContact CG-CD1 4.47Å; R284-L288 VanDerWaalsContact O-CB 3.29Å; R284-L288 WeakPolarHBondContact O-CB 3.05Å; R284-L288 WeakPolarHBondContact O-CG 3.43Å; R284-L288 PolarHBondContact O-N 2.93Å; Y285-L288 PolarHBondContact O-N 2.83Å; L288-T292 VanDerWaalsContact O-CB 3.22Å; L288-T292 WeakPolarHBondContact O-CB 3.32Å; L288-T292 PolarHBondContact O-N 3.01Å; L288-T292 PolarHBondContact O-OG1 2.86Å
289	K	68.8	Low	66.7	Low	111 Å²	111	115.6 Å²	115.6	48%	0.483	55%	0.546	S	S	.	.	H	α-helix	trans	-64.1	-44.2	174.9	-175.7	175.4	178	177.6	0	111.4	Y285 Q287 Q293	Y285-K289 VanDerWaalsContact O-CB 3.25Å; Y285-K289 WeakPolarHBondContact O-CB 3.41Å; Y285-K289 PolarHBondContact O-N 2.95Å; Q287-K289 VanDerWaalsContact C-N 3.26Å; Q287-K289 PolarHBondContact O-N 3.07Å; K289-Q293 VanDerWaalsContact O-CB 3.31Å; K289-Q293 WeakPolarHBondContact O-CB 3.37Å; K289-Q293 VanDerWaalsContact O-CG 3.23Å; K289-Q293 WeakPolarHBondContact O-CG 3.35Å; K289-Q293 PolarHBondContact O-N 3.43Å
290	A	66.7	Low	66.1	Low	53 Å²	53	116.5 Å²	116.5	44%	0.438	55%	0.545	S	S	.	.	H	α-helix	trans	-67	-42.4	176.7	0	0	0	0	0	112.5	N286 Q287 Q293 A294	N286-A290 VanDerWaalsContact O-CB 3.3Å; N286-A290 WeakPolarHBondContact O-CB 3.47Å; N286-A290 PolarHBondContact O-N 2.75Å; Q287-A290 CarbonylContact O-C 3.58Å; Q287-A290 PolarHBondContact O-N 3.49Å; Q287-A290 VanDerWaalsContact O-N 3.1Å; A290-Q293 PolarHBondContact O-N 3.06Å; A290-A294 VanDerWaalsContact O-CB 3.26Å; A290-A294 WeakPolarHBondContact O-CB 3.03Å; A290-A294 PolarHBondContact O-N 3.1Å
291	E	71.6	Confident	65	Low	98 Å²	98	114.3 Å²	114.3	46%	0.458	54%	0.537	S	S	.	.	H	α-helix	trans	-64.5	-41.4	175.5	-72.8	164.7	178.4	0	0	110.9	Q287 A294 F295	Q287-E291 HydrophobicContact CG-CG 4.3Å; Q287-E291 WeakPolarHBondContact CG-OE1 3.3Å; Q287-E291 PolarHBondContact NE2-OE1 3.19Å; Q287-E291 WeakPolarHBondContact O-CB 3.29Å; Q287-E291 VanDerWaalsContact O-CG 3.31Å; Q287-E291 WeakPolarHBondContact O-CG 3.29Å; Q287-E291 PolarHBondContact O-N 2.84Å; E291-A294 PolarHBondContact O-N 2.64Å; E291-F295 VanDerWaalsContact O-CB 3.31Å; E291-F295 WeakPolarHBondContact O-CB 2.97Å; E291-F295 PolarHBondContact O-N 2.78Å
292	T	67.7	Low	64.3	Low	75 Å²	75	113.7 Å²	113.7	46%	0.46	53%	0.531	S	S	.	.	H	α-helix	trans	-67.3	-40.9	174.2	-53.4	0	0	0	0	111.4	L288 F295 I296	L288-T292 VanDerWaalsContact O-CB 3.22Å; L288-T292 WeakPolarHBondContact O-CB 3.32Å; L288-T292 PolarHBondContact O-N 3.01Å; L288-T292 PolarHBondContact O-OG1 2.86Å; T292-F295 PolarHBondContact O-N 3.35Å; T292-I296 HydrophobicContact CG2-CD1 3.98Å; T292-I296 WeakPolarHBondContact O-CB 3Å; T292-I296 WeakPolarHBondContact O-CD1 3.46Å; T292-I296 VanDerWaalsContact O-CG1 3.23Å; T292-I296 WeakPolarHBondContact O-CG1 3.34Å; T292-I296 PolarHBondContact O-N 3.26Å
293	Q	64.3	Low	63.5	Low	109 Å²	109	111.5 Å²	111.5	51%	0.509	53%	0.529	S	S	.	.	H	α-helix	trans	-66.3	-38.5	175.2	-75.8	179.6	-61.5	0	0	112.1	K289 A290 I296 Q297	K289-Q293 VanDerWaalsContact O-CB 3.31Å; K289-Q293 WeakPolarHBondContact O-CB 3.37Å; K289-Q293 VanDerWaalsContact O-CG 3.23Å; K289-Q293 WeakPolarHBondContact O-CG 3.35Å; K289-Q293 PolarHBondContact O-N 3.43Å; A290-Q293 PolarHBondContact O-N 3.06Å; Q293-I296 PolarHBondContact O-N 3.2Å; Q293-Q297 WeakPolarHBondContact O-CG 3.44Å; Q293-Q297 PolarHBondContact O-N 2.87Å
294	A	67	Low	62.6	Low	51 Å²	51	108.4 Å²	108.4	42%	0.421	52%	0.523	S	S	.	.	H	α-helix	trans	-66.2	-41.3	173.5	0	0	0	0	0	111.6	A290 E291 Q297 L298	A290-A294 VanDerWaalsContact O-CB 3.26Å; A290-A294 WeakPolarHBondContact O-CB 3.03Å; A290-A294 PolarHBondContact O-N 3.1Å; E291-A294 PolarHBondContact O-N 2.64Å; A294-Q297 PolarHBondContact O-N 3.11Å; A294-L298 WeakPolarHBondContact O-CB 3.42Å; A294-L298 PolarHBondContact O-N 3.28Å
295	F	66.1	Low	61.8	Low	130 Å²	130	106.5 Å²	106.5	57%	0.57	52%	0.52	S	S	*	.	H	α-helix	trans	-64.4	-39.9	174.7	-167.3	-98.4	0	0	0	111.9	E291 T292 L298 N299	E291-F295 VanDerWaalsContact O-CB 3.31Å; E291-F295 WeakPolarHBondContact O-CB 2.97Å; E291-F295 PolarHBondContact O-N 2.78Å; T292-F295 PolarHBondContact O-N 3.35Å; F295-L298 PolarHBondContact O-N 2.68Å; F295-N299 WeakPolarHBondContact CE1-ND2 3.44Å; F295-N299 WeakPolarHBondContact O-CB 3.42Å; F295-N299 PolarHBondContact O-N 2.84Å
296	I	62.7	Low	60.8	Low	92 Å²	92	102 Å²	102	47%	0.472	52%	0.515	S	S	.	.	H	α-helix	trans	-65	-38.2	172.6	-71.2	165.9	0	0	0	111.5	T292 Q293 K300	T292-I296 HydrophobicContact CG2-CD1 3.98Å; T292-I296 WeakPolarHBondContact O-CB 3Å; T292-I296 WeakPolarHBondContact O-CD1 3.46Å; T292-I296 VanDerWaalsContact O-CG1 3.23Å; T292-I296 WeakPolarHBondContact O-CG1 3.34Å; T292-I296 PolarHBondContact O-N 3.26Å; Q293-I296 PolarHBondContact O-N 3.2Å; I296-K300 WeakPolarHBondContact O-CB 3.31Å; I296-K300 WeakPolarHBondContact O-CG 3.34Å; I296-K300 PolarHBondContact O-N 2.55Å
297	Q	61	Low	59.8	Low	141 Å²	141	101.3 Å²	101.3	66%	0.659	51%	0.511	S	S	*	.	H	α-helix	trans	-67.4	-41.9	173	-78.7	-179.1	-32.9	0	0	112.2	Q293 A294 K300 S301	Q293-Q297 WeakPolarHBondContact O-CG 3.44Å; Q293-Q297 PolarHBondContact O-N 2.87Å; A294-Q297 PolarHBondContact O-N 3.11Å; Q297-K300 WeakPolarHBondContact O-CB 3.42Å; Q297-K300 PolarHBondContact O-N 3.45Å; Q297-S301 PolarHBondContact O-N 2.86Å
298	L	60.8	Low	58.9	Low	97 Å²	97	101 Å²	101	51%	0.508	51%	0.512	S	S	.	.	H	α-helix	trans	-62.7	-48.2	176.9	-150.9	89.5	0	0	0	110.8	A294 F295 K300 S301 Y302	A294-L298 WeakPolarHBondContact O-CB 3.42Å; A294-L298 PolarHBondContact O-N 3.28Å; F295-L298 PolarHBondContact O-N 2.68Å; L298-K300 VanDerWaalsContact C-N 3.32Å; L298-K300 PolarHBondContact O-N 2.8Å; L298-S301 WeakPolarHBondContact O-CB 3.29Å; L298-S301 PolarHBondContact O-N 2.96Å; L298-S301 PolarHBondContact O-OG 2.88Å; L298-Y302 HydrophobicContact CD2-CE2 4.22Å; L298-Y302 HydrophobicContact CG-CD2 4.35Å; L298-Y302 HydrophobicContact CG-CE2 4.32Å; L298-Y302 WeakPolarHBondContact O-CD2 3.45Å; L298-Y302 PolarHBondContact O-N 2.74Å
299	N	56.6	Low	58.1	Low	77 Å²	77	103.8 Å²	103.8	41%	0.412	53%	0.526	S	S	.	.	H	α-helix	trans	-61.8	-37.1	174.9	-88.3	-5.1	0	0	0	112.4	F295 S301 Y302 Q303	F295-N299 WeakPolarHBondContact CE1-ND2 3.44Å; F295-N299 WeakPolarHBondContact O-CB 3.42Å; F295-N299 PolarHBondContact O-N 2.84Å; N299-S301 VanDerWaalsContact C-N 3.33Å; N299-S301 PolarHBondContact O-N 2.89Å; N299-Y302 PolarHBondContact O-N 3.2Å; N299-Q303 WeakPolarHBondContact O-CB 3.44Å; N299-Q303 WeakPolarHBondContact O-CG 3.38Å; N299-Q303 PolarHBondContact O-N 2.96Å
300	K	53.9	Low	57.1	Low	131 Å²	131	105.7 Å²	105.7	57%	0.57	54%	0.539	S	S	*	.	H	α-helix	trans	-60.6	-41.5	170.9	-85.1	-174.7	173.4	-175	0	112.2	I296 Q297 L298 Q303 Q304	I296-K300 WeakPolarHBondContact O-CB 3.31Å; I296-K300 WeakPolarHBondContact O-CG 3.34Å; I296-K300 PolarHBondContact O-N 2.55Å; Q297-K300 WeakPolarHBondContact O-CB 3.42Å; Q297-K300 PolarHBondContact O-N 3.45Å; L298-K300 VanDerWaalsContact C-N 3.32Å; L298-K300 PolarHBondContact O-N 2.8Å; K300-Q303 PolarHBondContact O-N 3.06Å; K300-Q304 WeakPolarHBondContact O-CB 3.24Å; K300-Q304 WeakPolarHBondContact O-CG 3.31Å; K300-Q304 PolarHBondContact O-N 2.78Å
301	S	47.5	Very low	56	Low	47 Å²	47	106.7 Å²	106.7	33%	0.329	53%	0.533	S	S	.	.	H	α-helix	trans	-65.6	-36.7	176.3	80.7	0	0	0	0	113.1	Q297 L298 N299 K305	Q297-S301 PolarHBondContact O-N 2.86Å; L298-S301 WeakPolarHBondContact O-CB 3.29Å; L298-S301 PolarHBondContact O-N 2.96Å; L298-S301 PolarHBondContact O-OG 2.88Å; N299-S301 VanDerWaalsContact C-N 3.33Å; N299-S301 PolarHBondContact O-N 2.89Å; S301-K305 WeakPolarHBondContact O-CG 3.26Å; S301-K305 PolarHBondContact O-N 3Å
302	Y	55.3	Low	55.5	Low	156 Å²	156	105.2 Å²	105.2	61%	0.612	53%	0.531	S	S	*	.	H	α-helix	trans	-72.4	-41.6	176.6	-90.3	-79.5	0	0	0	111.8	L298 N299 K305 A306	L298-Y302 HydrophobicContact CD2-CE2 4.22Å; L298-Y302 HydrophobicContact CG-CD2 4.35Å; L298-Y302 HydrophobicContact CG-CE2 4.32Å; L298-Y302 WeakPolarHBondContact O-CD2 3.45Å; L298-Y302 PolarHBondContact O-N 2.74Å; N299-Y302 PolarHBondContact O-N 3.2Å; Y302-K305 PolarHBondContact O-N 2.86Å; Y302-A306 WeakPolarHBondContact O-CB 3.09Å; Y302-A306 PolarHBondContact O-N 3.19Å
303	Q	49.4	Very low	54.8	Low	140 Å²	140	106.9 Å²	106.9	65%	0.654	54%	0.543	S	S	*	.	H	α-helix	trans	-61.9	-43.5	171.9	-76.7	-173.8	-44.2	0	0	111.7	N299 K300 K305 A306 D307	N299-Q303 WeakPolarHBondContact O-CB 3.44Å; N299-Q303 WeakPolarHBondContact O-CG 3.38Å; N299-Q303 PolarHBondContact O-N 2.96Å; K300-Q303 PolarHBondContact O-N 3.06Å; Q303-K305 VanDerWaalsContact C-N 3.35Å; Q303-K305 PolarHBondContact O-N 2.88Å; Q303-A306 PolarHBondContact O-N 2.84Å; Q303-D307 WeakPolarHBondContact O-CB 3.42Å; Q303-D307 PolarHBondContact O-N 2.99Å
304	Q	48.9	Very low	54.1	Low	128 Å²	128	109.2 Å²	109.2	60%	0.598	55%	0.554	S	S	*	*	H	α-helix	trans	-61.6	-39.7	174.9	-77.9	179.3	-44	0	0	112.5	K300 D307 I308	K300-Q304 WeakPolarHBondContact O-CB 3.24Å; K300-Q304 WeakPolarHBondContact O-CG 3.31Å; K300-Q304 PolarHBondContact O-N 2.78Å; Q304-D307 PolarHBondContact O-N 3.35Å; Q304-I308 WeakPolarHBondContact O-CB 3.35Å; Q304-I308 WeakPolarHBondContact O-CD1 3.34Å; Q304-I308 WeakPolarHBondContact O-CG1 3.12Å; Q304-I308 PolarHBondContact O-N 3.43Å; Q304-I308 VanDerWaalsContact O-N 3.07Å
305	K	51.4	Low	53.5	Low	146 Å²	146	111.1 Å²	111.1	64%	0.635	55%	0.554	S	S	*	*	H	α-helix	trans	-68.6	-35.3	175.2	-76.9	-177.4	175.5	-176.3	0	113.2	S301 Y302 Q303	S301-K305 WeakPolarHBondContact O-CG 3.26Å; S301-K305 PolarHBondContact O-N 3Å; Y302-K305 PolarHBondContact O-N 2.86Å; Q303-K305 VanDerWaalsContact C-N 3.35Å; Q303-K305 PolarHBondContact O-N 2.88Å
306	A	50.5	Low	52.7	Low	61 Å²	61	110.3 Å²	110.3	50%	0.504	55%	0.547	S	S	.	.	H	α-helix	trans	-66.8	-44.8	173.2	0	0	0	0	0	111.9	Y302 Q303 I308 L309	Y302-A306 WeakPolarHBondContact O-CB 3.09Å; Y302-A306 PolarHBondContact O-N 3.19Å; Q303-A306 PolarHBondContact O-N 2.84Å; A306-I308 VanDerWaalsContact C-N 3.27Å; A306-I308 PolarHBondContact O-N 2.92Å; A306-L309 PolarHBondContact O-N 2.89Å
307	D	45.4	Very low	52.1	Low	81 Å²	81	113.4 Å²	113.4	43%	0.433	56%	0.558	S	S	.	*	H	α-helix	trans	-62.3	-33.1	177.2	-121.9	39.4	0	0	0	111.9	Q303 Q304 L309 F311 K319	Q303-D307 WeakPolarHBondContact O-CB 3.42Å; Q303-D307 PolarHBondContact O-N 2.99Å; Q304-D307 PolarHBondContact O-N 3.35Å; D307-L309 VanDerWaalsContact C-N 3.31Å; D307-L309 PolarHBondContact O-N 3.42Å; D307-F311 WeakPolarHBondContact O-CD2 3.5Å; D307-K319 IonicContact OD1-NZ 2.65Å; D307-K319 IonicContact OD2-NZ 3.57Å; D307-K319 PolarHBondContact OD2-NZ 2.85Å
308	I	52.1	Low	51.5	Low	104 Å²	104	116.9 Å²	116.9	53%	0.533	56%	0.564	S	S	.	*	H	α-helix	trans	-67.5	-28.2	-178.9	-77.9	166	0	0	0	113.1	Q304 A306 R316	Q304-I308 WeakPolarHBondContact O-CB 3.35Å; Q304-I308 WeakPolarHBondContact O-CD1 3.34Å; Q304-I308 WeakPolarHBondContact O-CG1 3.12Å; Q304-I308 PolarHBondContact O-N 3.43Å; Q304-I308 VanDerWaalsContact O-N 3.07Å; A306-I308 VanDerWaalsContact C-N 3.27Å; A306-I308 PolarHBondContact O-N 2.92Å; I308-R316 PolarHBondContact O-NH2 2.87Å
309	L	51.7	Low	50.5	Low	151 Å²	151	115.8 Å²	115.8	79%	0.791	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.7	-5.2	-173.8	-78.2	164.1	0	0	0	115.1	A306 D307	A306-L309 PolarHBondContact O-N 2.89Å; D307-L309 VanDerWaalsContact C-N 3.31Å; D307-L309 PolarHBondContact O-N 3.42Å
310	M	48.6	Very low	49.7	Very low	151 Å²	151	117.8 Å²	117.8	74%	0.744	56%	0.562	S	S	*	*	S	Bend	trans	-118.1	8.8	-169.3	-73	-71.7	-73.2	0	0	115.4
311	F	44.5	Very low	49.1	Very low	74 Å²	74	120.3 Å²	120.3	33%	0.325	57%	0.574	S	S	.	*			trans	-128.5	132.7	178.8	-63.4	-69.6	0	0	0	113.7	D307 Q315 R316	D307-F311 WeakPolarHBondContact O-CD2 3.5Å; F311-Q315 HydrophobicContact CB-CB 4Å; F311-Q315 HydrophobicContact CD1-CB 4.03Å; F311-Q315 HydrophobicContact CG-CB 4.45Å; F311-R316 HydrophobicContact CB-CG 4.43Å
312	T	59.2	Low	48.8	Very low	68 Å²	68	121 Å²	121	42%	0.417	58%	0.578	S	S	.	*			trans	-70.7	164.3	174.9	68.4	0	0	0	0	112.2	E314 Q315 R316	T312-E314 VanDerWaalsContact C-N 3.28Å; T312-E314 PolarHBondContact O-N 3.46Å; T312-Q315 WeakPolarHBondContact O-CB 3.17Å; T312-Q315 PolarHBondContact O-N 2.6Å; T312-Q315 WeakPolarHBondContact OG1-CG 3.19Å; T312-Q315 PolarHBondContact OG1-N 3.38Å; T312-Q315 PolarHBondContact OG1-OE1 2.79Å; T312-R316 PolarHBondContact O-N 3.4Å
313	P	54.9	Low	47.9	Very low	110 Å²	110	120.5 Å²	120.5	71%	0.714	58%	0.582	S	S	*	*	H	α-helix	trans	-56.2	-36.2	178.9	-28.1	36.8	0	0	0	114.4	R316 K317	P313-R316 PolarHBondContact O-N 2.68Å; P313-K317 PolarHBondContact O-N 2.76Å; P313-K317 VanDerWaalsContact O-N 3.1Å
314	E	49.4	Very low	47.2	Very low	157 Å²	157	118.2 Å²	118.2	73%	0.734	58%	0.582	S	S	*	*	H	α-helix	trans	-69.7	-37.4	175.1	-63.6	-166.5	117.3	0	0	112.8	T312 R316 K317 R318	T312-E314 VanDerWaalsContact C-N 3.28Å; T312-E314 PolarHBondContact O-N 3.46Å; E314-R316 VanDerWaalsContact C-N 3.3Å; E314-R316 PolarHBondContact O-N 3.28Å; E314-K317 PolarHBondContact O-N 2.88Å; E314-R318 PolarHBondContact O-N 3.12Å
315	Q	53.7	Low	46.6	Very low	91 Å²	91	120.2 Å²	120.2	43%	0.425	59%	0.588	S	S	.	*	H	α-helix	trans	-67.3	-32.8	175.2	-70.4	169.8	-18.1	0	0	111.3	F311 T312 R318 K319	F311-Q315 HydrophobicContact CB-CB 4Å; F311-Q315 HydrophobicContact CD1-CB 4.03Å; F311-Q315 HydrophobicContact CG-CB 4.45Å; T312-Q315 WeakPolarHBondContact O-CB 3.17Å; T312-Q315 PolarHBondContact O-N 2.6Å; T312-Q315 WeakPolarHBondContact OG1-CG 3.19Å; T312-Q315 PolarHBondContact OG1-N 3.38Å; T312-Q315 PolarHBondContact OG1-OE1 2.79Å; Q315-R318 PolarHBondContact O-N 3.42Å; Q315-K319 PolarHBondContact O-N 3.36Å
316	R	50.3	Low	45.9	Very low	113 Å²	113	124.4 Å²	124.4	43%	0.426	60%	0.6	S	S	.	*	H	α-helix	trans	-63.6	-49.4	169.3	-68.7	-171.7	-175.9	-178.1	1.7	111.6	I308 F311 T312 P313 E314 R318 K319 E320	I308-R316 PolarHBondContact O-NH2 2.87Å; F311-R316 HydrophobicContact CB-CG 4.43Å; T312-R316 PolarHBondContact O-N 3.4Å; P313-R316 PolarHBondContact O-N 2.68Å; E314-R316 VanDerWaalsContact C-N 3.3Å; E314-R316 PolarHBondContact O-N 3.28Å; R316-R318 VanDerWaalsContact C-N 3.29Å; R316-R318 PolarHBondContact O-N 2.85Å; R316-K319 CarbonylContact O-C 3.56Å; R316-K319 WeakPolarHBondContact O-CA 3.13Å; R316-K319 PolarHBondContact O-N 3.33Å; R316-E320 WeakPolarHBondContact O-CG 3.48Å; R316-E320 PolarHBondContact O-N 3.48Å
317	K	48.2	Very low	45.2	Very low	158 Å²	158	132.2 Å²	132.2	69%	0.687	62%	0.616	S	S	*	*	H	α-helix	trans	-55.9	-39.6	174.2	-80.2	-171.5	173.6	-177.6	0	113	P313 E314 E320 F321	P313-K317 PolarHBondContact O-N 2.76Å; P313-K317 VanDerWaalsContact O-N 3.1Å; E314-K317 PolarHBondContact O-N 2.88Å; K317-E320 PolarHBondContact O-N 3.12Å; K317-F321 WeakPolarHBondContact O-CB 3.27Å; K317-F321 PolarHBondContact O-N 2.86Å
318	R	48.4	Very low	45	Very low	213 Å²	213	131.1 Å²	131.1	80%	0.804	62%	0.615	S	S	*	*	H	α-helix	trans	-69.4	-31.5	173.7	-77.1	-171.6	173.7	-171.4	-0.3	113.8	E314 Q315 R316 S322	E314-R318 PolarHBondContact O-N 3.12Å; Q315-R318 PolarHBondContact O-N 3.42Å; R316-R318 VanDerWaalsContact C-N 3.29Å; R316-R318 PolarHBondContact O-N 2.85Å; R318-S322 WeakPolarHBondContact O-CB 3.24Å; R318-S322 PolarHBondContact O-N 3.07Å
319	K	41.1	Very low	44.5	Very low	75 Å²	75	129.4 Å²	129.4	33%	0.326	60%	0.604	S	S	.	*	H	α-helix	trans	-72.7	-39.1	172.5	-119.2	176.7	-179.5	174.9	0	111.6	D307 Q315 R316 S322 Q323	D307-K319 IonicContact OD1-NZ 2.65Å; D307-K319 IonicContact OD2-NZ 3.57Å; D307-K319 PolarHBondContact OD2-NZ 2.85Å; Q315-K319 PolarHBondContact O-N 3.36Å; R316-K319 CarbonylContact O-C 3.56Å; R316-K319 WeakPolarHBondContact O-CA 3.13Å; R316-K319 PolarHBondContact O-N 3.33Å; K319-S322 CarbonylContact O-C 3.53Å; K319-S322 WeakPolarHBondContact O-CA 3.36Å; K319-S322 WeakPolarHBondContact O-CB 3.39Å; K319-S322 PolarHBondContact O-N 3.1Å; K319-S322 VanDerWaalsContact O-N 3.11Å; K319-Q323 WeakPolarHBondContact O-CG 3.4Å; K319-Q323 PolarHBondContact O-N 3.21Å
320	E	38.7	Very low	44.6	Very low	118 Å²	118	125.7 Å²	125.7	55%	0.551	58%	0.579	S	S	*	*	H	α-helix	trans	-68.5	-44.6	178.6	-72.2	166.6	161.8	0	0	111.8	R316 K317 S322 Q323 S324	R316-E320 WeakPolarHBondContact O-CG 3.48Å; R316-E320 PolarHBondContact O-N 3.48Å; K317-E320 PolarHBondContact O-N 3.12Å; E320-S322 PolarHBondContact O-N 2.93Å; E320-S322 VanDerWaalsContact O-N 3.15Å; E320-Q323 PolarHBondContact O-N 3.38Å; E320-S324 PolarHBondContact O-N 2.59Å
321	F	42.9	Very low	45.1	Very low	184 Å²	184	118.6 Å²	118.6	81%	0.807	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-12.5	170.9	-139.1	-92.4	0	0	0	113.1	K317	K317-F321 WeakPolarHBondContact O-CB 3.27Å; K317-F321 PolarHBondContact O-N 2.86Å
322	S	41.4	Very low	46.5	Very low	61 Å²	61	115 Å²	115	43%	0.427	53%	0.529	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.4	-5.5	169	-177	0	0	0	0	113.7	R318 K319 E320	R318-S322 WeakPolarHBondContact O-CB 3.24Å; R318-S322 PolarHBondContact O-N 3.07Å; K319-S322 CarbonylContact O-C 3.53Å; K319-S322 WeakPolarHBondContact O-CA 3.36Å; K319-S322 WeakPolarHBondContact O-CB 3.39Å; K319-S322 PolarHBondContact O-N 3.1Å; K319-S322 VanDerWaalsContact O-N 3.11Å; E320-S322 PolarHBondContact O-N 2.93Å; E320-S322 VanDerWaalsContact O-N 3.15Å
323	Q	35.3	Very low	47.4	Very low	146 Å²	146	112 Å²	112	68%	0.682	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.8	-5.1	-178.7	-81.1	-178.2	-11.5	0	0	114	K319 E320 K325	K319-Q323 WeakPolarHBondContact O-CG 3.4Å; K319-Q323 PolarHBondContact O-N 3.21Å; E320-Q323 PolarHBondContact O-N 3.38Å; Q323-K325 PolarHBondContact O-N 2.81Å
324	S	35.1	Very low	48.3	Very low	93 Å²	93	108.6 Å²	108.6	65%	0.65	49%	0.492	S	S	*	.			trans	-71.4	6.3	161.3	64.7	0	0	0	0	113.7	E320 R326	E320-S324 PolarHBondContact O-N 2.59Å; S324-R326 VanDerWaalsContact C-N 3.27Å; S324-R326 PolarHBondContact O-N 2.88Å
325	K	36.6	Very low	49.7	Very low	169 Å²	169	105.4 Å²	105.4	74%	0.735	47%	0.473	S	S	*	.			trans	-62.9	86.7	168	-76.9	-173.5	175.5	179.4	0	110.4	Q323 R327	Q323-K325 PolarHBondContact O-N 2.81Å; K325-R327 PolarHBondContact O-N 2.82Å
326	R	36.2	Very low	50.9	Low	234 Å²	234	106.7 Å²	106.7	88%	0.883	49%	0.487	S	S	*	.			trans	-37.5	133	157.1	-79.9	178.5	163.6	171.9	-5.5	108.1	S324 S328	S324-R326 VanDerWaalsContact C-N 3.27Å; S324-R326 PolarHBondContact O-N 2.88Å; R326-S328 PolarHBondContact O-N 2.75Å
327	R	35.3	Very low	52.4	Low	225 Å²	225	105.1 Å²	105.1	85%	0.849	49%	0.494	S	S	*	.			trans	-51.9	111.1	173.3	-72.8	178.2	176.5	162.2	-0.8	107.4	K325	K325-R327 PolarHBondContact O-N 2.82Å
328	S	41.4	Very low	54.3	Low	58 Å²	58	98.9 Å²	98.9	41%	0.406	47%	0.466	S	S	.	.			trans	-67	143.2	-175.5	74.8	0	0	0	0	109.3	R326 R330	R326-S328 PolarHBondContact O-N 2.75Å; S328-R330 VanDerWaalsContact O-CG 3.3Å; S328-R330 WeakPolarHBondContact O-CG 3.4Å; S328-R330 PolarHBondContact O-NE 2.96Å; S328-R330 PolarHBondContact OG-NE 2.85Å; S328-R330 PolarHBondContact OG-NH2 3.3Å
329	K	41.6	Very low	56.3	Low	69 Å²	69	89.9 Å²	89.9	30%	0.3	44%	0.435	S	S	.	.			trans	-73.5	139.5	-178.3	-59.7	-163	170.7	-141.7	0	110	D441 H445 S471	K329-D441 VanDerWaalsContact CB-OD2 3.3Å; K329-D441 WeakPolarHBondContact CB-OD2 3.49Å; K329-D441 WeakPolarHBondContact CD-OD2 3.44Å; K329-D441 HydrophobicContact CG-CB 4.43Å; K329-D441 VanDerWaalsContact CG-OD2 3.24Å; K329-D441 WeakPolarHBondContact CG-OD2 3.39Å; K329-H445 PolarHBondContact NZ-NE2 3.3Å; K329-S471 VanDerWaalsContact CB-OG 3.26Å; K329-S471 WeakPolarHBondContact CB-OG 3.07Å; K329-S471 WeakPolarHBondContact O-CB 3.23Å; K329-S471 PolarHBondContact O-N 2.85Å; K329-S471 PolarHBondContact O-OG 2.82Å
330	R	53.7	Low	58.7	Low	72 Å²	72	86.5 Å²	86.5	27%	0.272	42%	0.42	S	S	.	.			trans	-145.1	100	-158.4	-75.4	177.5	-164.6	-119.5	-4.4	115.5	S328 R439 P440 D441 P466 V469 S471	S328-R330 VanDerWaalsContact O-CG 3.3Å; S328-R330 WeakPolarHBondContact O-CG 3.4Å; S328-R330 PolarHBondContact O-NE 2.96Å; S328-R330 PolarHBondContact OG-NE 2.85Å; S328-R330 PolarHBondContact OG-NH2 3.3Å; R330-R439 VanDerWaalsContact O-CG 3.32Å; R330-R439 WeakPolarHBondContact O-CG 3.07Å; R330-P440 HydrophobicContact CB-CG 3.77Å; R330-P440 WeakPolarHBondContact O-CD 2.93Å; R330-D441 PolarHBondContact N-OD1 3.43Å; R330-P466 PolarHBondContact NH1-O 2.84Å; R330-V469 VanDerWaalsContact C-CG1 3.43Å; R330-V469 HydrophobicContact CB-CB 4.19Å; R330-V469 HydrophobicContact CB-CG1 4.43Å; R330-V469 WeakPolarHBondContact CB-O 3.01Å; R330-V469 VanDerWaalsContact CD-O 3.22Å; R330-V469 WeakPolarHBondContact CD-O 3.4Å; R330-V469 WeakPolarHBondContact CG-O 3.48Å; R330-V469 VanDerWaalsContact O-CG1 3.27Å; R330-V469 WeakPolarHBondContact O-CG1 3.36Å; R330-S471 VanDerWaalsContact CA-N 3.29Å
331	A	58.5	Low	61	Low	2 Å²	2	85 Å²	85	2%	0.017	42%	0.418	C	S	.	.			trans	-126.1	-46.6	-175.3	0	0	0	0	0	118.1	E436 R439 V469 N470 S471 Q522	A331-E436 WeakPolarHBondContact CB-OE2 3.5Å; A331-R439 HydrophobicContact CB-CG 3.84Å; A331-V469 VanDerWaalsContact CA-CG1 3.4Å; A331-V469 WeakPolarHBondContact O-CG1 3.38Å; A331-N470 VanDerWaalsContact N-C 3.28Å; A331-S471 VanDerWaalsContact N-N 3.18Å; A331-Q522 VanDerWaalsContact CB-OE1 3.3Å
332	A	74.7	Confident	63.1	Low	0 Å²	0	81.6 Å²	81.6	0%	0	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	174.5	173.9	0	0	0	0	0	112.8	F433 V469 N470 Q522 L526	A332-F433 HydrophobicContact CB-CD1 3.66Å; A332-F433 HydrophobicContact CB-CE1 3.63Å; A332-V469 CarbonylContact O-C 3.52Å; A332-V469 WeakPolarHBondContact O-CA 3.31Å; A332-V469 WeakPolarHBondContact O-CG1 3.14Å; A332-N470 WeakPolarHBondContact CA-O 3.45Å; A332-N470 VanDerWaalsContact CB-O 3.28Å; A332-N470 WeakPolarHBondContact CB-O 3.4Å; A332-N470 PolarHBondContact N-O 2.76Å; A332-N470 PolarHBondContact O-N 2.97Å; A332-Q522 HydrophobicContact CB-CG 4.47Å; A332-L526 HydrophobicContact CB-CD2 4.22Å
333	T	77.3	Confident	65.3	Low	4 Å²	4	78.8 Å²	78.8	3%	0.025	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.5	140.5	173.8	-170.4	0	0	0	0	112.9	Y335 R338 G432	T333-Y335 PolarHBondContact OG1-N 2.95Å; T333-R338 HydrophobicContact CG2-CB 4.24Å; T333-G432 WeakPolarHBondContact CB-O 3.44Å; T333-G432 PolarHBondContact N-O 3.09Å
334	A	74.7	Confident	68	Low	39 Å²	39	72.3 Å²	72.3	32%	0.322	36%	0.36	S	S	.	.	S	Bend	trans	-85.3	-12.2	172.9	0	0	0	0	0	113.9	G467 E468 N470	A334-G467 WeakPolarHBondContact CB-O 3.16Å; A334-E468 VanDerWaalsContact CB-C 3.49Å; A334-E468 PolarHBondContact N-O 2.77Å; A334-N470 HydrophobicContact CB-CB 4.32Å
335	Y	79.7	Confident	70.9	Confident	89 Å²	89	67.9 Å²	67.9	35%	0.349	33%	0.329	S	S	.	.			trans	-97.6	113.9	-174.6	-59.9	-79.8	0	0	0	112.1	T333 S337 R338 E468	T333-Y335 PolarHBondContact OG1-N 2.95Å; Y335-S337 PolarHBondContact O-N 2.72Å; Y335-R338 WeakPolarHBondContact O-CB 3.25Å; Y335-R338 PolarHBondContact O-N 3.44Å; Y335-E468 WeakPolarHBondContact CE2-OE2 3.5Å; Y335-E468 PolarHBondContact OH-OE2 2.68Å
336	V	78.2	Confident	73.6	Confident	118 Å²	118	60.1 Å²	60.1	72%	0.715	30%	0.295	S	S	*	.	G	3₁₀ helix	trans	-58.6	-32.3	176.9	-176.9	0	0	0	0	112.1	R338 T339	V336-R338 PolarHBondContact O-N 2.74Å; V336-R338 VanDerWaalsContact O-N 3.15Å; V336-T339 PolarHBondContact O-N 3.08Å; V336-T339 PolarHBondContact O-OG1 3.41Å
337	S	82	Confident	76.3	Confident	80 Å²	80	49.9 Å²	49.9	56%	0.559	26%	0.257	S	S	*	.	G	3₁₀ helix	trans	-57.8	-27.8	175.6	49.9	0	0	0	0	113.9	Y335 R402	Y335-S337 PolarHBondContact O-N 2.72Å; S337-R402 PolarHBondContact O-NH2 3.17Å
338	R	87.3	Confident	78.9	Confident	28 Å²	28	41 Å²	41	11%	0.106	23%	0.226	C	C	.	.	G	3₁₀ helix	trans	-86.1	-3.7	177.7	-60.4	-173.4	-172.3	-155.7	3.1	114.2	E173 T333 Y335 V336 G401 R402	E173-R338 IonicContact OE1-CZ 3.67Å; E173-R338 IonicContact OE1-NH1 3.48Å; E173-R338 PolarHBondContact OE1-NH1 2.74Å; E173-R338 IonicContact OE1-NH2 2.78Å; E173-R338 PolarHBondContact OE1-NH2 3.1Å; T333-R338 HydrophobicContact CG2-CB 4.24Å; Y335-R338 WeakPolarHBondContact O-CB 3.25Å; Y335-R338 PolarHBondContact O-N 3.44Å; V336-R338 PolarHBondContact O-N 2.74Å; V336-R338 VanDerWaalsContact O-N 3.15Å; R338-G401 CarbonylContact O-C 3.48Å; R338-G401 VanDerWaalsContact O-CA 3.3Å; R338-G401 WeakPolarHBondContact O-CA 3.42Å; R338-R402 WeakPolarHBondContact CA-O 3.36Å; R338-R402 PolarHBondContact O-N 2.71Å
339	T	90.7	Very high	81.1	Confident	24 Å²	24	39.6 Å²	39.6	15%	0.147	21%	0.214	C	C	.	.	S	Bend	trans	-78.2	151.4	168.1	65	0	0	0	0	110.1	V336 R402 L526	V336-T339 PolarHBondContact O-N 3.08Å; V336-T339 PolarHBondContact O-OG1 3.41Å; T339-R402 PolarHBondContact O-NE 3.33Å; T339-R402 VanDerWaalsContact O-NE 3.14Å; T339-L526 HydrophobicContact CG2-CD1 3.79Å; T339-L526 HydrophobicContact CG2-CG 4.08Å
340	W	91.9	Very high	82.9	Confident	4 Å²	4	37.7 Å²	37.7	2%	0.015	21%	0.206	C	C	.	.	P	Polyproline II helix	trans	-80.3	135.2	172.8	-67.9	88.1	0	0	0	111	N342 G343 I345 I387 R402 V430 Y527	W340-N342 PolarHBondContact O-N 3.04Å; W340-G343 PolarHBondContact O-N 3.3Å; W340-I345 HydrophobicContact CB-CG1 3.91Å; W340-I345 HydrophobicContact CD2-CB 4.39Å; W340-I345 HydrophobicContact CD2-CG1 3.98Å; W340-I345 HydrophobicContact CD2-CG2 4.11Å; W340-I345 HydrophobicContact CE3-CG2 4.33Å; W340-I345 HydrophobicContact CG-CD1 4.03Å; W340-I345 HydrophobicContact CG-CG1 3.65Å; W340-I345 HydrophobicContact CZ2-CG2 4.29Å; W340-I387 HydrophobicContact CH2-CG2 3.79Å; W340-I387 HydrophobicContact CZ2-CG2 3.63Å; W340-R402 HydrophobicContact CD2-CB 3.92Å; W340-R402 HydrophobicContact CD2-CG 4.1Å; W340-R402 HydrophobicContact CE3-CB 4.4Å; W340-R402 HydrophobicContact CE3-CG 4.06Å; W340-R402 HydrophobicContact CG-CB 4.27Å; W340-R402 HydrophobicContact CH2-CB 4.43Å; W340-R402 HydrophobicContact CH2-CG 3.98Å; W340-R402 HydrophobicContact CZ2-CB 3.97Å; W340-R402 HydrophobicContact CZ2-CG 4.04Å; W340-R402 HydrophobicContact CZ3-CG 4Å; W340-V430 HydrophobicContact CZ2-CG1 4.18Å; W340-V430 PolarHBondContact NE1-O 2.92Å; W340-Y527 HydrophobicContact CB-CE1 4.12Å; W340-Y527 PolarHBondContact N-OH 3Å; W340-Y527 WeakPolarHBondContact O-CE1 3.18Å
341	T	87.4	Confident	83.6	Confident	85 Å²	85	36.5 Å²	36.5	52%	0.521	21%	0.212	S	C	.	.	G	3₁₀ helix	trans	-62.1	127	-174.8	42.8	0	0	0	0	111.1	G343 V344	T341-G343 PolarHBondContact O-N 2.68Å; T341-V344 PolarHBondContact O-N 3.48Å
342	N	85.7	Confident	84.5	Confident	114 Å²	114	40.3 Å²	40.3	61%	0.61	23%	0.232	S	C	*	.	G	3₁₀ helix	trans	54.9	18.4	-174.4	-50.3	-42.2	0	0	0	115	W340 V344 Y740	W340-N342 PolarHBondContact O-N 3.04Å; N342-V344 HydrophobicContact CB-CG2 4.33Å; N342-V344 PolarHBondContact O-N 3.37Å; N342-Y740 HydrophobicContact CB-CD2 4.3Å
343	G	89	Confident	84.7	Confident	1 Å²	1	40.7 Å²	40.7	1%	0.01	23%	0.233	C	C	.	.	G	3₁₀ helix	trans	70.1	13.7	-173.7	0	0	0	0	0	114.8	W340 T341 L374 S375	W340-G343 PolarHBondContact O-N 3.3Å; T341-G343 PolarHBondContact O-N 2.68Å; G343-L374 WeakPolarHBondContact O-CA 3.33Å; G343-S375 PolarHBondContact O-N 3.4Å
344	V	91.8	Very high	84.8	Confident	11 Å²	11	43.4 Å²	43.4	7%	0.067	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	123.3	178.3	-179.8	0	0	0	0	109.7	T341 N342 P346 S375 V377 Y739 Y740	T341-V344 PolarHBondContact O-N 3.48Å; N342-V344 HydrophobicContact CB-CG2 4.33Å; N342-V344 PolarHBondContact O-N 3.37Å; V344-P346 HydrophobicContact CG1-CG 4.44Å; V344-S375 WeakPolarHBondContact CA-O 3.18Å; V344-V377 HydrophobicContact CG1-CG1 4.44Å; V344-V377 HydrophobicContact CG1-CG2 3.71Å; V344-Y739 HydrophobicContact CB-CE2 4.46Å; V344-Y739 HydrophobicContact CG1-CD2 4.18Å; V344-Y739 HydrophobicContact CG1-CE2 3.66Å; V344-Y739 HydrophobicContact CG2-CD2 3.94Å; V344-Y739 HydrophobicContact CG2-CE2 3.89Å; V344-Y740 HydrophobicContact CG2-CG 4.26Å
345	I	95	Very high	84.7	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	96.5	179.8	-50	-173.2	0	0	0	108.6	W340 L374 S375 F376 V377 I387 V430 I431	W340-I345 HydrophobicContact CB-CG1 3.91Å; W340-I345 HydrophobicContact CD2-CB 4.39Å; W340-I345 HydrophobicContact CD2-CG1 3.98Å; W340-I345 HydrophobicContact CD2-CG2 4.11Å; W340-I345 HydrophobicContact CE3-CG2 4.33Å; W340-I345 HydrophobicContact CG-CD1 4.03Å; W340-I345 HydrophobicContact CG-CG1 3.65Å; W340-I345 HydrophobicContact CZ2-CG2 4.29Å; I345-L374 HydrophobicContact CD1-CD2 4.46Å; I345-S375 PolarHBondContact N-O 2.84Å; I345-F376 HydrophobicContact CB-CD1 3.84Å; I345-F376 HydrophobicContact CB-CE1 3.89Å; I345-F376 HydrophobicContact CB-CG 4.5Å; I345-F376 HydrophobicContact CD1-CE1 3.86Å; I345-F376 HydrophobicContact CD1-CE2 4.5Å; I345-F376 HydrophobicContact CD1-CZ 3.81Å; I345-F376 HydrophobicContact CG1-CE1 4.38Å; I345-F376 HydrophobicContact CG2-CD1 3.99Å; I345-F376 HydrophobicContact CG2-CE1 3.83Å; I345-F376 WeakPolarHBondContact O-CA 3.5Å; I345-V377 PolarHBondContact O-N 2.79Å; I345-V377 VanDerWaalsContact O-N 3.1Å; I345-I387 HydrophobicContact CG2-CD1 4.01Å; I345-I387 HydrophobicContact CG2-CG1 4.27Å; I345-I387 HydrophobicContact CG2-CG2 4.17Å; I345-V430 HydrophobicContact CG2-CG1 4.22Å; I345-I431 HydrophobicContact CD1-CG1 3.92Å
346	P	93.8	Very high	84.6	Confident	5 Å²	5	44 Å²	44	3%	0.032	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	144	176.6	-13.3	29.1	0	0	0	111.1	V344 V377 H383 Y386 I387	V344-P346 HydrophobicContact CG1-CG 4.44Å; P346-V377 CarbonylContact C-O 3.52Å; P346-V377 VanDerWaalsContact CA-O 3.24Å; P346-V377 WeakPolarHBondContact CA-O 3.39Å; P346-V377 HydrophobicContact CB-CG2 3.98Å; P346-V377 HydrophobicContact CG-CG2 4.14Å; P346-H383 HydrophobicContact CB-CB 3.92Å; P346-H383 WeakPolarHBondContact CB-ND1 3.31Å; P346-H383 HydrophobicContact CG-CB 3.96Å; P346-Y386 CarbonylContact O-C 3.54Å; P346-Y386 WeakPolarHBondContact O-CA 3.15Å; P346-Y386 VanDerWaalsContact O-CB 3.31Å; P346-Y386 WeakPolarHBondContact O-CB 3.47Å; P346-I387 PolarHBondContact O-N 2.89Å
347	Y	93.4	Very high	85	Confident	20 Å²	20	39.2 Å²	39.2	8%	0.078	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	157.8	-175.4	73.6	-94.5	0	0	0	115	I349 M365 F376 V377 E378 R379 I387	Y347-I349 HydrophobicContact CD2-CD1 4.45Å; Y347-I349 HydrophobicContact CD2-CG1 4Å; Y347-I349 HydrophobicContact CE2-CD1 4.11Å; Y347-I349 HydrophobicContact CE2-CG1 4.11Å; Y347-M365 HydrophobicContact CD1-CE 4.06Å; Y347-M365 HydrophobicContact CD1-SD 3.77Å; Y347-M365 HydrophobicContact CD2-CE 4.02Å; Y347-M365 HydrophobicContact CD2-SD 4.37Å; Y347-M365 HydrophobicContact CE1-CE 3.77Å; Y347-M365 HydrophobicContact CE1-SD 4Å; Y347-M365 HydrophobicContact CE2-CE 3.73Å; Y347-M365 HydrophobicContact CG-CE 4.19Å; Y347-M365 HydrophobicContact CG-SD 3.97Å; Y347-F376 HydrophobicContact CD1-CB 4.11Å; Y347-F376 HydrophobicContact CE1-CB 4.18Å; Y347-V377 VanDerWaalsContact CD1-C 3.48Å; Y347-V377 WeakPolarHBondContact CD1-O 3.44Å; Y347-V377 VanDerWaalsContact CE1-C 3.44Å; Y347-V377 PolarHBondContact N-O 2.83Å; Y347-E378 HydrophobicContact CE2-CG 4.36Å; Y347-R379 WeakPolarHBondContact O-CB 3.41Å; Y347-R379 PolarHBondContact O-N 3.37Å; Y347-I387 CarbonylContact C-O 3.34Å; Y347-I387 VanDerWaalsContact CA-O 3.31Å; Y347-I387 WeakPolarHBondContact CA-O 3.13Å
348	I	89.4	Confident	85.1	Confident	37 Å²	37	36.4 Å²	36.4	19%	0.19	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	140.3	161	-64	-175.5	0	0	0	108.1	R379 Y386 I387 I388 F389	I348-R379 HydrophobicContact CD1-CB 4.48Å; I348-R379 HydrophobicContact CG1-CB 3.92Å; I348-Y386 HydrophobicContact CD1-CD2 4.3Å; I348-Y386 HydrophobicContact CD1-CE2 3.72Å; I348-Y386 HydrophobicContact CG1-CD2 4.25Å; I348-Y386 HydrophobicContact CG1-CE2 4.16Å; I348-I387 PolarHBondContact N-O 2.9Å; I348-I388 WeakPolarHBondContact O-CA 3.34Å; I348-F389 PolarHBondContact O-N 2.88Å
349	I	87	Confident	84.9	Confident	30 Å²	30	35.1 Å²	35.1	15%	0.154	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	130	166.1	-53.6	171.7	0	0	0	108	Y347 F353 K358 I361 M362 M365 F389	Y347-I349 HydrophobicContact CD2-CD1 4.45Å; Y347-I349 HydrophobicContact CD2-CG1 4Å; Y347-I349 HydrophobicContact CE2-CD1 4.11Å; Y347-I349 HydrophobicContact CE2-CG1 4.11Å; I349-F353 HydrophobicContact CG2-CB 4.44Å; I349-F353 HydrophobicContact CG2-CD2 3.68Å; I349-F353 HydrophobicContact CG2-CE2 4.32Å; I349-F353 HydrophobicContact CG2-CG 4.33Å; I349-K358 HydrophobicContact CG2-CG 4.01Å; I349-I361 HydrophobicContact CD1-CB 4.28Å; I349-I361 HydrophobicContact CD1-CG2 3.71Å; I349-I361 HydrophobicContact CG1-CG2 4.16Å; I349-I361 HydrophobicContact CG2-CD1 4.21Å; I349-M362 HydrophobicContact CD1-CE 3.93Å; I349-M362 HydrophobicContact CD1-CG 4Å; I349-M365 HydrophobicContact CD1-CE 4.41Å; I349-F389 HydrophobicContact CG1-CB 4.43Å; I349-F389 HydrophobicContact CG1-CD2 3.75Å; I349-F389 HydrophobicContact CG1-CE2 4.38Å; I349-F389 HydrophobicContact CG1-CG 4.34Å; I349-F389 HydrophobicContact CG2-CB 4.26Å
350	Q	80.5	Confident	84.9	Confident	29 Å²	29	35.3 Å²	35.3	14%	0.136	20%	0.2	C	C	.	.			trans	-64.6	150.5	178.6	-75.4	-169.5	-46.1	0	0	112.8	L145 N352 F353 I388 F389 T390	L145-Q350 HydrophobicContact CD1-CG 3.72Å; Q350-N352 VanDerWaalsContact C-N 3.29Å; Q350-N352 WeakPolarHBondContact CB-OD1 3.19Å; Q350-N352 PolarHBondContact O-N 2.86Å; Q350-F353 HydrophobicContact CB-CD2 4.28Å; Q350-F353 HydrophobicContact CB-CE2 4.38Å; Q350-I388 HydrophobicContact CG-CG2 4.24Å; Q350-F389 VanDerWaalsContact CG-O 3.27Å; Q350-F389 WeakPolarHBondContact CG-O 3.29Å; Q350-F389 PolarHBondContact N-O 2.82Å; Q350-T390 HydrophobicContact CG-CG2 4.24Å; Q350-T390 VanDerWaalsContact OE1-CA 3.24Å; Q350-T390 VanDerWaalsContact OE1-CB 3.26Å
351	A	68.6	Low	84.9	Confident	47 Å²	47	35.1 Å²	35.1	39%	0.388	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-31.3	-175	0	0	0	0	0	113.6	F353 K358	A351-F353 VanDerWaalsContact C-N 3.29Å; A351-F353 PolarHBondContact O-N 2.96Å; A351-K358 PolarHBondContact O-NZ 2.97Å
352	N	76.6	Confident	85	Confident	82 Å²	82	32.6 Å²	32.6	44%	0.439	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-23.5	-176.2	65.2	-39.4	0	0	0	115.1	Q350 E391	Q350-N352 VanDerWaalsContact C-N 3.29Å; Q350-N352 WeakPolarHBondContact CB-OD1 3.19Å; Q350-N352 PolarHBondContact O-N 2.86Å; N352-E391 VanDerWaalsContact ND2-CB 3.3Å; N352-E391 WeakPolarHBondContact ND2-CB 3.14Å; N352-E391 PolarHBondContact ND2-OE2 2.87Å
353	F	79	Confident	85.2	Confident	8 Å²	8	28.8 Å²	28.8	4%	0.035	16%	0.16	C	C	.	.	S	Bend	trans	-62.1	141.2	176.3	-75.8	-73.3	0	0	0	112	I349 Q350 A351 T357 K358 I361 F389 T390 E391 I413	I349-F353 HydrophobicContact CG2-CB 4.44Å; I349-F353 HydrophobicContact CG2-CD2 3.68Å; I349-F353 HydrophobicContact CG2-CE2 4.32Å; I349-F353 HydrophobicContact CG2-CG 4.33Å; Q350-F353 HydrophobicContact CB-CD2 4.28Å; Q350-F353 HydrophobicContact CB-CE2 4.38Å; A351-F353 VanDerWaalsContact C-N 3.29Å; A351-F353 PolarHBondContact O-N 2.96Å; F353-T357 HydrophobicContact CD1-CG2 3.55Å; F353-T357 HydrophobicContact CE1-CG2 4.1Å; F353-T357 HydrophobicContact CG-CG2 4.46Å; F353-K358 HydrophobicContact CB-CG 3.74Å; F353-K358 WeakPolarHBondContact O-CE 3.5Å; F353-K358 PolarHBondContact O-NZ 3.16Å; F353-I361 HydrophobicContact CD1-CD1 4.3Å; F353-I361 HydrophobicContact CD2-CD1 4.5Å; F353-I361 HydrophobicContact CE1-CD1 4.28Å; F353-I361 HydrophobicContact CE2-CD1 4.48Å; F353-I361 HydrophobicContact CG-CD1 4.4Å; F353-I361 HydrophobicContact CZ-CD1 4.35Å; F353-F389 HydrophobicContact CE2-CB 4.07Å; F353-T390 VanDerWaalsContact CZ-C 3.4Å; F353-E391 HydrophobicContact CE1-CB 3.94Å; F353-E391 HydrophobicContact CE1-CG 4.36Å; F353-E391 HydrophobicContact CZ-CB 3.92Å; F353-I413 HydrophobicContact CE1-CB 3.98Å; F353-I413 HydrophobicContact CE1-CG2 4.16Å; F353-I413 HydrophobicContact CZ-CB 3.94Å
354	S	79.1	Confident	85.5	Confident	60 Å²	60	28.8 Å²	28.8	42%	0.42	16%	0.159	S	C	.	.			trans	-62	158	175	86	0	0	0	0	112	E356 T357 K358	S354-E356 PolarHBondContact O-N 2.96Å; S354-E356 PolarHBondContact OG-N 2.8Å; S354-T357 PolarHBondContact O-N 2.56Å; S354-T357 PolarHBondContact OG-N 3.2Å; S354-T357 PolarHBondContact OG-OG1 3.15Å; S354-K358 WeakPolarHBondContact O-CB 3.02Å; S354-K358 WeakPolarHBondContact O-CG 3.11Å; S354-K358 PolarHBondContact O-N 3.44Å
355	S	73.3	Confident	85.6	Confident	25 Å²	25	28.4 Å²	28.4	18%	0.175	16%	0.157	C	C	.	.	H	α-helix	trans	-48.6	-42	172.6	-58.1	0	0	0	0	112.8	A359 S832	S355-A359 WeakPolarHBondContact O-CB 3.5Å; S355-A359 PolarHBondContact O-N 2.63Å; S355-A359 VanDerWaalsContact O-N 3.09Å; S355-S832 VanDerWaalsContact CB-OG 3.27Å; S355-S832 WeakPolarHBondContact CB-OG 3.44Å
356	E	78	Confident	85.3	Confident	115 Å²	115	30 Å²	30	54%	0.537	16%	0.163	S	C	.	.	H	α-helix	trans	-76.9	-38	-177.5	-174.6	171	-176	0	0	112.3	S354 A359 T360	S354-E356 PolarHBondContact O-N 2.96Å; S354-E356 PolarHBondContact OG-N 2.8Å; E356-A359 PolarHBondContact O-N 2.82Å; E356-T360 WeakPolarHBondContact O-CB 3.15Å; E356-T360 PolarHBondContact O-N 3.35Å; E356-T360 PolarHBondContact O-OG1 3.43Å
357	T	85.3	Confident	85.3	Confident	18 Å²	18	30.6 Å²	30.6	11%	0.11	17%	0.165	C	C	.	.	H	α-helix	trans	-68.4	-43	174.9	-43.1	0	0	0	0	111.1	F353 S354 A359 T360 I361 D418	F353-T357 HydrophobicContact CD1-CG2 3.55Å; F353-T357 HydrophobicContact CE1-CG2 4.1Å; F353-T357 HydrophobicContact CG-CG2 4.46Å; S354-T357 PolarHBondContact O-N 2.56Å; S354-T357 PolarHBondContact OG-N 3.2Å; S354-T357 PolarHBondContact OG-OG1 3.15Å; T357-A359 VanDerWaalsContact C-N 3.35Å; T357-A359 PolarHBondContact O-N 3.02Å; T357-T360 PolarHBondContact O-N 3.5Å; T357-I361 HydrophobicContact CG2-CD1 4.29Å; T357-I361 WeakPolarHBondContact O-CG1 3.45Å; T357-I361 PolarHBondContact O-N 2.84Å; T357-D418 HydrophobicContact CG2-CB 3.78Å
358	K	83.9	Confident	85.3	Confident	22 Å²	22	29.7 Å²	29.7	10%	0.096	16%	0.161	C	C	.	.	H	α-helix	trans	-56.4	-48.4	172.1	-75.5	170.4	175.8	138.5	0	111.1	I349 A351 F353 S354 T360 I361 M362 H831	I349-K358 HydrophobicContact CG2-CG 4.01Å; A351-K358 PolarHBondContact O-NZ 2.97Å; F353-K358 HydrophobicContact CB-CG 3.74Å; F353-K358 WeakPolarHBondContact O-CE 3.5Å; F353-K358 PolarHBondContact O-NZ 3.16Å; S354-K358 WeakPolarHBondContact O-CB 3.02Å; S354-K358 WeakPolarHBondContact O-CG 3.11Å; S354-K358 PolarHBondContact O-N 3.44Å; K358-T360 PolarHBondContact O-N 2.77Å; K358-I361 PolarHBondContact O-N 2.86Å; K358-M362 WeakPolarHBondContact O-CG 3.17Å; K358-M362 PolarHBondContact O-N 2.95Å; K358-M362 VanDerWaalsContact O-N 3.09Å; K358-H831 WeakPolarHBondContact CD-O 3.31Å; K358-H831 PolarHBondContact NZ-O 3.42Å
359	A	84.4	Confident	85.5	Confident	0 Å²	0	28.1 Å²	28.1	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-60.6	-45	176.3	0	0	0	0	0	111.5	S355 E356 T357 I361 M362 K363 P805 Q891	S355-A359 WeakPolarHBondContact O-CB 3.5Å; S355-A359 PolarHBondContact O-N 2.63Å; S355-A359 VanDerWaalsContact O-N 3.09Å; E356-A359 PolarHBondContact O-N 2.82Å; T357-A359 VanDerWaalsContact C-N 3.35Å; T357-A359 PolarHBondContact O-N 3.02Å; A359-I361 PolarHBondContact O-N 3.42Å; A359-M362 CarbonylContact O-C 3.54Å; A359-M362 PolarHBondContact O-N 2.99Å; A359-M362 VanDerWaalsContact O-N 3.13Å; A359-K363 WeakPolarHBondContact O-CG 3.41Å; A359-K363 PolarHBondContact O-N 2.8Å; A359-P805 HydrophobicContact CB-CB 3.91Å; A359-Q891 HydrophobicContact CB-CG 3.68Å
360	T	89.2	Confident	85.6	Confident	29 Å²	29	29.3 Å²	29.3	18%	0.178	16%	0.16	C	C	.	.	H	α-helix	trans	-64.9	-37.2	-180	-59.9	0	0	0	0	113	E356 T357 K358 K363 A364 D418 K420	E356-T360 WeakPolarHBondContact O-CB 3.15Å; E356-T360 PolarHBondContact O-N 3.35Å; E356-T360 PolarHBondContact O-OG1 3.43Å; T357-T360 PolarHBondContact O-N 3.5Å; K358-T360 PolarHBondContact O-N 2.77Å; T360-K363 PolarHBondContact O-N 2.98Å; T360-A364 PolarHBondContact O-N 2.93Å; T360-D418 WeakPolarHBondContact CG2-O 3.34Å; T360-K420 HydrophobicContact CG2-CB 3.84Å
361	I	91.7	Very high	86.1	Confident	0 Å²	0	33 Å²	33	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-59.2	-47.3	170.3	-71.5	164.1	0	0	0	110.7	I349 F353 T357 K358 A359 K363 A364 M365 F389 V423	I349-I361 HydrophobicContact CD1-CB 4.28Å; I349-I361 HydrophobicContact CD1-CG2 3.71Å; I349-I361 HydrophobicContact CG1-CG2 4.16Å; I349-I361 HydrophobicContact CG2-CD1 4.21Å; F353-I361 HydrophobicContact CD1-CD1 4.3Å; F353-I361 HydrophobicContact CD2-CD1 4.5Å; F353-I361 HydrophobicContact CE1-CD1 4.28Å; F353-I361 HydrophobicContact CE2-CD1 4.48Å; F353-I361 HydrophobicContact CG-CD1 4.4Å; F353-I361 HydrophobicContact CZ-CD1 4.35Å; T357-I361 HydrophobicContact CG2-CD1 4.29Å; T357-I361 WeakPolarHBondContact O-CG1 3.45Å; T357-I361 PolarHBondContact O-N 2.84Å; K358-I361 PolarHBondContact O-N 2.86Å; A359-I361 PolarHBondContact O-N 3.42Å; I361-K363 VanDerWaalsContact C-N 3.35Å; I361-K363 PolarHBondContact O-N 2.66Å; I361-A364 WeakPolarHBondContact O-CB 3.47Å; I361-A364 PolarHBondContact O-N 3.36Å; I361-M365 HydrophobicContact CG2-CE 4.12Å; I361-M365 PolarHBondContact O-N 2.88Å; I361-F389 HydrophobicContact CD1-CB 4.36Å; I361-F389 HydrophobicContact CD1-CD1 4.15Å; I361-F389 HydrophobicContact CD1-CG 4.37Å; I361-F389 HydrophobicContact CG1-CD1 4.3Å; I361-F389 HydrophobicContact CG1-CE1 4.5Å; I361-F389 HydrophobicContact CG2-CD1 3.74Å; I361-F389 HydrophobicContact CG2-CD2 3.94Å; I361-F389 HydrophobicContact CG2-CE1 3.5Å; I361-F389 VanDerWaalsContact CG2-CE1 3.5Å; I361-F389 HydrophobicContact CG2-CE2 3.7Å; I361-F389 HydrophobicContact CG2-CG 3.95Å; I361-F389 HydrophobicContact CG2-CZ 3.47Å; I361-F389 VanDerWaalsContact CG2-CZ 3.47Å; I361-V423 HydrophobicContact CG1-CG1 4.15Å; I361-V423 HydrophobicContact CG1-CG2 4.44Å
362	M	90.1	Very high	87.3	Confident	31 Å²	31	31 Å²	31	15%	0.153	16%	0.156	C	C	.	.	H	α-helix	trans	-66.2	-32.9	176.2	-66.5	-176.3	179.8	0	0	113	I349 K358 A359 A364 M365 R366 Y804 P805	I349-M362 HydrophobicContact CD1-CE 3.93Å; I349-M362 HydrophobicContact CD1-CG 4Å; K358-M362 WeakPolarHBondContact O-CG 3.17Å; K358-M362 PolarHBondContact O-N 2.95Å; K358-M362 VanDerWaalsContact O-N 3.09Å; A359-M362 CarbonylContact O-C 3.54Å; A359-M362 PolarHBondContact O-N 2.99Å; A359-M362 VanDerWaalsContact O-N 3.13Å; M362-A364 VanDerWaalsContact C-N 3.34Å; M362-M365 HydrophobicContact CB-CE 4.34Å; M362-M365 HydrophobicContact CG-CE 3.9Å; M362-M365 PolarHBondContact O-N 3.32Å; M362-R366 WeakPolarHBondContact O-CB 3.28Å; M362-R366 PolarHBondContact O-N 3.04Å; M362-Y804 HydrophobicContact CE-CE1 4.35Å; M362-Y804 HydrophobicContact SD-CD1 4.25Å; M362-Y804 HydrophobicContact SD-CE1 3.62Å; M362-P805 HydrophobicContact CB-CB 3.91Å; M362-P805 HydrophobicContact CB-CG 3.53Å; M362-P805 HydrophobicContact SD-CB 4.49Å
363	K	89.9	Confident	87.9	Confident	35 Å²	35	28 Å²	28	15%	0.152	14%	0.142	C	C	.	.	H	α-helix	trans	-68	-30.2	172.2	-67.5	-168.5	-173.7	-157.2	0	112.9	A359 T360 I361 H367 P805 E806 Q891	A359-K363 WeakPolarHBondContact O-CG 3.41Å; A359-K363 PolarHBondContact O-N 2.8Å; T360-K363 PolarHBondContact O-N 2.98Å; I361-K363 VanDerWaalsContact C-N 3.35Å; I361-K363 PolarHBondContact O-N 2.66Å; K363-H367 WeakPolarHBondContact O-CB 3.21Å; K363-H367 PolarHBondContact O-N 2.93Å; K363-H367 VanDerWaalsContact O-N 3.11Å; K363-P805 WeakPolarHBondContact CE-O 3.16Å; K363-P805 HydrophobicContact CG-CB 4.27Å; K363-P805 HydrophobicContact CG-CG 3.9Å; K363-E806 WeakPolarHBondContact CD-OE1 3.32Å; K363-E806 VanDerWaalsContact CE-CD 3.44Å; K363-E806 WeakPolarHBondContact CE-OE1 3.2Å; K363-E806 VanDerWaalsContact CE-OE2 3.26Å; K363-E806 WeakPolarHBondContact CE-OE2 3.02Å; K363-E806 VanDerWaalsContact CG-OE1 3.26Å; K363-E806 WeakPolarHBondContact CG-OE1 3.26Å; K363-E806 IonicContact NZ-OE1 2.93Å; K363-E806 PolarHBondContact NZ-OE1 2.96Å; K363-E806 IonicContact NZ-OE2 3.01Å; K363-E806 PolarHBondContact NZ-OE2 2.81Å; K363-Q891 VanDerWaalsContact CE-NE2 3.27Å
364	A	94.7	Very high	88.6	Confident	0 Å²	0	27.6 Å²	27.6	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-71.8	-42.1	172	0	0	0	0	0	111.6	T360 I361 M362 H367 W368 V423 I424 L427	T360-A364 PolarHBondContact O-N 2.93Å; I361-A364 WeakPolarHBondContact O-CB 3.47Å; I361-A364 PolarHBondContact O-N 3.36Å; M362-A364 VanDerWaalsContact C-N 3.34Å; A364-H367 WeakPolarHBondContact O-CB 3.26Å; A364-H367 PolarHBondContact O-N 3.38Å; A364-W368 PolarHBondContact O-N 3.02Å; A364-V423 HydrophobicContact CB-CB 3.73Å; A364-V423 HydrophobicContact CB-CG1 3.72Å; A364-I424 HydrophobicContact CB-CG1 3.72Å; A364-L427 HydrophobicContact CB-CD1 4.04Å
365	M	93.8	Very high	89.2	Confident	4 Å²	4	24.9 Å²	24.9	2%	0.02	12%	0.121	C	C	.	.	H	α-helix	trans	-63	-48	173.3	-68.6	-172.6	-63.1	0	0	111.9	Y347 I349 I361 M362 H367 W368 E369 F376 F389 L427	Y347-M365 HydrophobicContact CD1-CE 4.06Å; Y347-M365 HydrophobicContact CD1-SD 3.77Å; Y347-M365 HydrophobicContact CD2-CE 4.02Å; Y347-M365 HydrophobicContact CD2-SD 4.37Å; Y347-M365 HydrophobicContact CE1-CE 3.77Å; Y347-M365 HydrophobicContact CE1-SD 4Å; Y347-M365 HydrophobicContact CE2-CE 3.73Å; Y347-M365 HydrophobicContact CG-CE 4.19Å; Y347-M365 HydrophobicContact CG-SD 3.97Å; I349-M365 HydrophobicContact CD1-CE 4.41Å; I361-M365 HydrophobicContact CG2-CE 4.12Å; I361-M365 PolarHBondContact O-N 2.88Å; M362-M365 HydrophobicContact CB-CE 4.34Å; M362-M365 HydrophobicContact CG-CE 3.9Å; M362-M365 PolarHBondContact O-N 3.32Å; M365-H367 PolarHBondContact O-N 3.02Å; M365-W368 PolarHBondContact O-N 2.84Å; M365-E369 PolarHBondContact O-N 2.82Å; M365-F376 HydrophobicContact CB-CB 3.98Å; M365-F376 HydrophobicContact CB-CD1 4.22Å; M365-F376 HydrophobicContact CB-CD2 3.92Å; M365-F376 HydrophobicContact CB-CE2 4.48Å; M365-F376 HydrophobicContact CB-CG 3.77Å; M365-F376 HydrophobicContact CG-CB 4.22Å; M365-F376 HydrophobicContact CG-CD1 3.7Å; M365-F376 HydrophobicContact CG-CD2 4.25Å; M365-F376 HydrophobicContact CG-CE1 4.06Å; M365-F376 HydrophobicContact CG-CG 3.79Å; M365-F376 HydrophobicContact CG-CZ 4.49Å; M365-F376 HydrophobicContact SD-CB 3.85Å; M365-F376 HydrophobicContact SD-CD1 3.51Å; M365-F376 VanDerWaalsContact SD-CD1 3.51Å; M365-F376 HydrophobicContact SD-CE1 4.27Å; M365-F376 HydrophobicContact SD-CG 3.83Å; M365-F389 HydrophobicContact CE-CE2 4.36Å; M365-F389 HydrophobicContact CG-CZ 4.34Å; M365-F389 HydrophobicContact SD-CE2 3.81Å; M365-F389 HydrophobicContact SD-CZ 3.91Å; M365-L427 HydrophobicContact CG-CD1 3.7Å
366	R	90.2	Very high	90.1	Very high	34 Å²	34	23.9 Å²	23.9	13%	0.128	11%	0.113	C	C	.	.	H	α-helix	trans	-57.1	-35.2	173.4	-88.8	-170.5	171.6	162.3	6.6	112.9	M362 W368 E369 N370 L537 N803 Y804	M362-R366 WeakPolarHBondContact O-CB 3.28Å; M362-R366 PolarHBondContact O-N 3.04Å; R366-W368 VanDerWaalsContact C-N 3.34Å; R366-W368 PolarHBondContact O-N 2.96Å; R366-E369 PolarHBondContact O-N 2.82Å; R366-N370 WeakPolarHBondContact O-CB 3.27Å; R366-N370 PolarHBondContact O-N 2.87Å; R366-L537 HydrophobicContact CB-CD1 4.14Å; R366-L537 HydrophobicContact CG-CD1 4.28Å; R366-N803 PolarHBondContact NH1-O 3.1Å; R366-Y804 PolarHBondContact NH1-O 2.63Å; R366-Y804 PolarHBondContact NH2-O 2.9Å
367	H	93	Very high	90.7	Very high	17 Å²	17	18.7 Å²	18.7	8%	0.079	9%	0.089	C	C	.	.	H	α-helix	trans	-62.9	-40.6	175.1	-168.1	-49.2	0	0	0	111.8	K363 A364 M365 Y371 I424 Q514 L515	K363-H367 WeakPolarHBondContact O-CB 3.21Å; K363-H367 PolarHBondContact O-N 2.93Å; K363-H367 VanDerWaalsContact O-N 3.11Å; A364-H367 WeakPolarHBondContact O-CB 3.26Å; A364-H367 PolarHBondContact O-N 3.38Å; M365-H367 PolarHBondContact O-N 3.02Å; H367-Y371 AromaticContact CE1-CD2 3.53Å; H367-Y371 AromaticContact CE1-CE2 3.32Å; H367-Y371 WeakPolarHBondContact CE1-CE2 3.43Å; H367-Y371 AromaticContact ND1-CD2 3.59Å; H367-Y371 AromaticContact ND1-CE2 3.68Å; H367-Y371 AromaticContact NE2-CE2 3.89Å; H367-Y371 WeakPolarHBondContact O-CD2 3.39Å; H367-I424 HydrophobicContact CB-CD1 3.95Å; H367-I424 HydrophobicContact CB-CG1 4.48Å; H367-Q514 VanDerWaalsContact NE2-CB 3.32Å; H367-Q514 WeakPolarHBondContact NE2-CB 3.23Å; H367-L515 PolarHBondContact CE1-N 2.92Å
368	W	94.6	Very high	90.7	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-68.5	-41.8	173.7	-80	108.6	0	0	0	112.1	A364 M365 R366 N370 T372 L374 F376 I424 I431 F433 L515 T523	A364-W368 PolarHBondContact O-N 3.02Å; M365-W368 PolarHBondContact O-N 2.84Å; R366-W368 VanDerWaalsContact C-N 3.34Å; R366-W368 PolarHBondContact O-N 2.96Å; W368-N370 PolarHBondContact O-N 2.86Å; W368-T372 HydrophobicContact CE3-CG2 4.28Å; W368-T372 PolarHBondContact O-N 3.02Å; W368-T372 PolarHBondContact O-OG1 2.81Å; W368-L374 HydrophobicContact CE3-CD1 4.33Å; W368-F376 HydrophobicContact CB-CE2 3.67Å; W368-F376 HydrophobicContact CB-CZ 4.39Å; W368-F376 HydrophobicContact CG-CE2 4.37Å; W368-I424 HydrophobicContact CZ2-CG2 4.34Å; W368-I424 PolarHBondContact NE1-O 2.81Å; W368-I424 VanDerWaalsContact NE1-O 3.13Å; W368-I431 HydrophobicContact CB-CD1 4.44Å; W368-I431 HydrophobicContact CD2-CD1 3.26Å; W368-I431 HydrophobicContact CE3-CD1 3.53Å; W368-I431 HydrophobicContact CG-CD1 3.73Å; W368-I431 HydrophobicContact CH2-CD1 3.97Å; W368-I431 HydrophobicContact CZ2-CD1 3.74Å; W368-I431 HydrophobicContact CZ3-CD1 3.88Å; W368-F433 HydrophobicContact CH2-CD2 4.17Å; W368-F433 AromaticContact CH2-CE2 3.84Å; W368-F433 HydrophobicContact CH2-CE2 3.84Å; W368-F433 HydrophobicContact CZ3-CE2 4.22Å; W368-L515 HydrophobicContact CD2-CD1 3.78Å; W368-L515 HydrophobicContact CD2-CD2 3.97Å; W368-L515 HydrophobicContact CD2-CG 4.45Å; W368-L515 HydrophobicContact CE3-CD1 3.46Å; W368-L515 VanDerWaalsContact CE3-CD1 3.46Å; W368-L515 HydrophobicContact CE3-CD2 3.97Å; W368-L515 HydrophobicContact CE3-CG 4.37Å; W368-L515 HydrophobicContact CG-CD1 4.37Å; W368-L515 HydrophobicContact CH2-CD1 4.39Å; W368-L515 HydrophobicContact CH2-CD2 3.42Å; W368-L515 VanDerWaalsContact CH2-CD2 3.42Å; W368-L515 HydrophobicContact CZ2-CD2 3.4Å; W368-L515 HydrophobicContact CZ3-CD1 3.78Å; W368-L515 HydrophobicContact CZ3-CD2 3.69Å; W368-L515 HydrophobicContact CZ3-CG 4.39Å; W368-T523 HydrophobicContact CZ3-CG2 4.32Å; W368-T523 WeakPolarHBondContact CZ3-OG1 3.48Å
369	E	92.1	Very high	90.8	Very high	5 Å²	5	22.9 Å²	22.9	2%	0.023	11%	0.106	C	C	.	.	H	α-helix	trans	-60.6	-41.5	175.8	-63.5	-165.6	137.9	0	0	112.2	M365 R366 Y371 T372 S375 F376 T535 N678 R764	M365-E369 PolarHBondContact O-N 2.82Å; R366-E369 PolarHBondContact O-N 2.82Å; E369-Y371 PolarHBondContact O-N 3.19Å; E369-T372 VanDerWaalsContact O-O 3.07Å; E369-S375 WeakPolarHBondContact OE1-CA 3.25Å; E369-F376 HydrophobicContact CG-CD2 3.95Å; E369-F376 PolarHBondContact OE1-N 2.87Å; E369-T535 HydrophobicContact CB-CG2 4.31Å; E369-T535 VanDerWaalsContact O-CB 3.24Å; E369-T535 WeakPolarHBondContact O-CB 3.39Å; E369-T535 PolarHBondContact O-OG1 3.25Å; E369-N678 VanDerWaalsContact CD-ND2 3.27Å; E369-N678 PolarHBondContact OE1-ND2 2.93Å; E369-N678 PolarHBondContact OE2-ND2 3.27Å; E369-R764 IonicContact OE1-CZ 3.52Å; E369-R764 IonicContact OE1-NH1 2.95Å; E369-R764 PolarHBondContact OE1-NH1 2.76Å; E369-R764 IonicContact OE1-NH2 2.71Å; E369-R764 IonicContact OE2-NH1 3.23Å
370	N	90.2	Very high	90.5	Very high	54 Å²	54	27.2 Å²	27.2	29%	0.289	13%	0.126	S	C	.	.	H	α-helix	trans	-59.2	-41.5	-173.5	-164.6	47.9	0	0	0	113.6	R366 W368 L537	R366-N370 WeakPolarHBondContact O-CB 3.27Å; R366-N370 PolarHBondContact O-N 2.87Å; W368-N370 PolarHBondContact O-N 2.86Å; N370-L537 HydrophobicContact CB-CD1 3.77Å
371	Y	90.7	Very high	89.7	Confident	106 Å²	106	30.8 Å²	30.8	42%	0.416	15%	0.149	S	C	.	.	H	α-helix	trans	-101.6	-3.5	-172.6	-61.4	-74.6	0	0	0	114.3	H367 E369 I520 N524	H367-Y371 AromaticContact CE1-CD2 3.53Å; H367-Y371 AromaticContact CE1-CE2 3.32Å; H367-Y371 WeakPolarHBondContact CE1-CE2 3.43Å; H367-Y371 AromaticContact ND1-CD2 3.59Å; H367-Y371 AromaticContact ND1-CE2 3.68Å; H367-Y371 AromaticContact NE2-CE2 3.89Å; H367-Y371 WeakPolarHBondContact O-CD2 3.39Å; E369-Y371 PolarHBondContact O-N 3.19Å; Y371-I520 HydrophobicContact CD1-CD1 4.01Å; Y371-I520 HydrophobicContact CD2-CD1 4.44Å; Y371-I520 HydrophobicContact CG-CD1 3.81Å; Y371-I520 HydrophobicContact CG-CG1 4.4Å; Y371-I520 WeakPolarHBondContact O-CG2 3.37Å; Y371-N524 PolarHBondContact O-ND2 3Å
372	T	92.7	Very high	89.1	Confident	6 Å²	6	36.9 Å²	36.9	4%	0.037	18%	0.177	C	C	.	.	S	Bend	trans	-137.4	175	-173.3	76.6	0	0	0	0	113.3	W368 E369 L374 T523 N524 R676	W368-T372 HydrophobicContact CE3-CG2 4.28Å; W368-T372 PolarHBondContact O-N 3.02Å; W368-T372 PolarHBondContact O-OG1 2.81Å; E369-T372 VanDerWaalsContact O-O 3.07Å; T372-L374 VanDerWaalsContact C-N 3.29Å; T372-L374 WeakPolarHBondContact OG1-CB 3.43Å; T372-L374 WeakPolarHBondContact OG1-CG 3.27Å; T372-L374 PolarHBondContact OG1-N 2.99Å; T372-T523 HydrophobicContact CG2-CG2 3.84Å; T372-N524 WeakPolarHBondContact CA-OD1 3.36Å; T372-N524 VanDerWaalsContact CB-OD1 3.25Å; T372-N524 WeakPolarHBondContact CB-OD1 3.39Å; T372-R676 PolarHBondContact O-NH1 3.24Å; T372-R676 PolarHBondContact O-NH2 2.76Å
373	C	89.9	Confident	88.9	Confident	19 Å²	19	36.6 Å²	36.6	13%	0.128	18%	0.176	C	C	.	.	S	Bend	trans	-82	0.5	170.4	69.3	0	0	0	0	115.2	C529 R676	C373-C529 HydrophobicContact CB-CB 3.51Å; C373-C529 WeakPolarHBondContact CB-SG 3.46Å; C373-C529 PolarHBondContact N-SG 3.28Å; C373-C529 WeakPolarHBondContact SG-CA 3.26Å; C373-C529 WeakPolarHBondContact SG-CB 3.39Å; C373-C529 CovalentContact SG-SG 2.02Å; C373-C529 PolarHBondContact SG-SG 3.2Å; C373-R676 VanDerWaalsContact C-NH1 3.29Å; C373-R676 PolarHBondContact O-NH1 2.86Å
374	L	93.1	Very high	88.5	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	20%	0.198	C	C	.	.			trans	-64.3	148.5	176.2	-62.2	175.5	0	0	0	111.8	G343 I345 W368 T372 I431 T523 Y527 R676	G343-L374 WeakPolarHBondContact O-CA 3.33Å; I345-L374 HydrophobicContact CD1-CD2 4.46Å; W368-L374 HydrophobicContact CE3-CD1 4.33Å; T372-L374 VanDerWaalsContact C-N 3.29Å; T372-L374 WeakPolarHBondContact OG1-CB 3.43Å; T372-L374 WeakPolarHBondContact OG1-CG 3.27Å; T372-L374 PolarHBondContact OG1-N 2.99Å; L374-I431 HydrophobicContact CD1-CB 4.44Å; L374-I431 HydrophobicContact CD1-CD1 3.42Å; L374-I431 VanDerWaalsContact CD1-CD1 3.42Å; L374-I431 HydrophobicContact CD1-CG1 3.63Å; L374-I431 HydrophobicContact CD1-CG2 3.92Å; L374-T523 HydrophobicContact CD1-CG2 3.72Å; L374-T523 HydrophobicContact CG-CG2 4.12Å; L374-Y527 HydrophobicContact CD2-CD1 3.76Å; L374-Y527 HydrophobicContact CD2-CD2 3.78Å; L374-Y527 HydrophobicContact CD2-CE1 3.87Å; L374-Y527 HydrophobicContact CD2-CE2 3.92Å; L374-Y527 HydrophobicContact CD2-CG 3.71Å; L374-R676 PolarHBondContact O-NH1 3.45Å
375	S	91.9	Very high	88.2	Confident	3 Å²	3	43.3 Å²	43.3	2%	0.021	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	117.6	177.2	-56.3	0	0	0	0	110.3	G343 V344 I345 E369 R676	G343-S375 PolarHBondContact O-N 3.4Å; V344-S375 WeakPolarHBondContact CA-O 3.18Å; I345-S375 PolarHBondContact N-O 2.84Å; E369-S375 WeakPolarHBondContact OE1-CA 3.25Å; S375-R676 WeakPolarHBondContact OG-CD 3.47Å
376	F	93.7	Very high	88.1	Confident	3 Å²	3	43.8 Å²	43.8	1%	0.013	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	117.9	178.3	-73	-91.6	0	0	0	109.5	I345 Y347 M365 W368 E369 I387 L427 I431 R764	I345-F376 HydrophobicContact CB-CD1 3.84Å; I345-F376 HydrophobicContact CB-CE1 3.89Å; I345-F376 HydrophobicContact CB-CG 4.5Å; I345-F376 HydrophobicContact CD1-CE1 3.86Å; I345-F376 HydrophobicContact CD1-CE2 4.5Å; I345-F376 HydrophobicContact CD1-CZ 3.81Å; I345-F376 HydrophobicContact CG1-CE1 4.38Å; I345-F376 HydrophobicContact CG2-CD1 3.99Å; I345-F376 HydrophobicContact CG2-CE1 3.83Å; I345-F376 WeakPolarHBondContact O-CA 3.5Å; Y347-F376 HydrophobicContact CD1-CB 4.11Å; Y347-F376 HydrophobicContact CE1-CB 4.18Å; M365-F376 HydrophobicContact CB-CB 3.98Å; M365-F376 HydrophobicContact CB-CD1 4.22Å; M365-F376 HydrophobicContact CB-CD2 3.92Å; M365-F376 HydrophobicContact CB-CE2 4.48Å; M365-F376 HydrophobicContact CB-CG 3.77Å; M365-F376 HydrophobicContact CG-CB 4.22Å; M365-F376 HydrophobicContact CG-CD1 3.7Å; M365-F376 HydrophobicContact CG-CD2 4.25Å; M365-F376 HydrophobicContact CG-CE1 4.06Å; M365-F376 HydrophobicContact CG-CG 3.79Å; M365-F376 HydrophobicContact CG-CZ 4.49Å; M365-F376 HydrophobicContact SD-CB 3.85Å; M365-F376 HydrophobicContact SD-CD1 3.51Å; M365-F376 VanDerWaalsContact SD-CD1 3.51Å; M365-F376 HydrophobicContact SD-CE1 4.27Å; M365-F376 HydrophobicContact SD-CG 3.83Å; W368-F376 HydrophobicContact CB-CE2 3.67Å; W368-F376 HydrophobicContact CB-CZ 4.39Å; W368-F376 HydrophobicContact CG-CE2 4.37Å; E369-F376 HydrophobicContact CG-CD2 3.95Å; E369-F376 PolarHBondContact OE1-N 2.87Å; F376-I387 HydrophobicContact CE1-CD1 4.34Å; F376-L427 HydrophobicContact CE1-CD2 3.64Å; F376-L427 HydrophobicContact CZ-CD1 4.44Å; F376-L427 HydrophobicContact CZ-CD2 3.96Å; F376-I431 HydrophobicContact CZ-CD1 4.27Å; F376-R764 PolarHBondContact O-NH1 2.77Å; F376-R764 PolarHBondContact O-NH2 3.39Å
377	V	90	Very high	88.3	Confident	6 Å²	6	42.2 Å²	42.2	4%	0.036	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	143	-171.8	-61.2	0	0	0	0	112.3	V344 I345 P346 Y347 R379 Y739	V344-V377 HydrophobicContact CG1-CG1 4.44Å; V344-V377 HydrophobicContact CG1-CG2 3.71Å; I345-V377 PolarHBondContact O-N 2.79Å; I345-V377 VanDerWaalsContact O-N 3.1Å; P346-V377 CarbonylContact C-O 3.52Å; P346-V377 VanDerWaalsContact CA-O 3.24Å; P346-V377 WeakPolarHBondContact CA-O 3.39Å; P346-V377 HydrophobicContact CB-CG2 3.98Å; P346-V377 HydrophobicContact CG-CG2 4.14Å; Y347-V377 VanDerWaalsContact CD1-C 3.48Å; Y347-V377 WeakPolarHBondContact CD1-O 3.44Å; Y347-V377 VanDerWaalsContact CE1-C 3.44Å; Y347-V377 PolarHBondContact N-O 2.83Å; V377-R379 PolarHBondContact O-N 2.95Å; V377-Y739 HydrophobicContact CG1-CD1 3.84Å; V377-Y739 HydrophobicContact CG1-CD2 3.81Å; V377-Y739 HydrophobicContact CG1-CE1 4.04Å; V377-Y739 HydrophobicContact CG1-CE2 4.01Å; V377-Y739 HydrophobicContact CG1-CG 3.72Å
378	E	84.8	Confident	88.3	Confident	62 Å²	62	41.9 Å²	41.9	29%	0.29	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.2	132.7	170.5	-70.8	172.2	-143.6	0	0	108.9	Y347 Q380 S681 T798	Y347-E378 HydrophobicContact CE2-CG 4.36Å; E378-Q380 PolarHBondContact O-N 3.17Å; E378-S681 PolarHBondContact OE1-OG 2.98Å; E378-T798 PolarHBondContact OE2-OG1 2.78Å
379	R	86	Confident	88.2	Confident	67 Å²	67	41.9 Å²	41.9	25%	0.253	20%	0.197	S	C	.	.			trans	-61.6	131.2	-176	-176.9	-147	167.2	-154.1	3.9	110.9	Y149 Y347 I348 V377 H383 Y386	Y149-R379 PolarHBondContact OH-NH1 2.04Å; Y347-R379 WeakPolarHBondContact O-CB 3.41Å; Y347-R379 PolarHBondContact O-N 3.37Å; I348-R379 HydrophobicContact CD1-CB 4.48Å; I348-R379 HydrophobicContact CG1-CB 3.92Å; V377-R379 PolarHBondContact O-N 2.95Å; R379-H383 HydrophobicContact CG-CB 3.93Å; R379-H383 PolarHBondContact NE-O 2.95Å; R379-Y386 HydrophobicContact CG-CD1 3.93Å; R379-Y386 HydrophobicContact CG-CD2 4.24Å; R379-Y386 HydrophobicContact CG-CE1 4.31Å; R379-Y386 HydrophobicContact CG-CG 3.9Å
380	Q	78.9	Confident	88.1	Confident	90 Å²	90	41.6 Å²	41.6	42%	0.421	20%	0.195	S	C	.	.			trans	-104.3	159.8	174.4	-70.3	-66.4	-37.5	0	0	110.2	E378 H382 H383	E378-Q380 PolarHBondContact O-N 3.17Å; Q380-H382 WeakPolarHBondContact CB-CE1 3.28Å; Q380-H382 PolarHBondContact O-N 3.49Å; Q380-H383 PolarHBondContact N-ND1 2.66Å; Q380-H383 WeakPolarHBondContact O-CB 3.48Å; Q380-H383 PolarHBondContact O-N 3.37Å
381	P	72.3	Confident	87.9	Confident	104 Å²	104	42.7 Å²	42.7	68%	0.675	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-23.7	-177.3	-28.3	36.1	0	0	0	115.4
382	H	79.4	Confident	87.5	Confident	128 Å²	128	40.3 Å²	40.3	59%	0.593	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85	-13	176.4	61.6	-97.8	0	0	0	114.3	Q380 R384	Q380-H382 WeakPolarHBondContact CB-CE1 3.28Å; Q380-H382 PolarHBondContact O-N 3.49Å; H382-R384 PolarHBondContact O-N 2.94Å
383	H	84.3	Confident	86.7	Confident	26 Å²	26	44.6 Å²	44.6	12%	0.12	23%	0.226	C	C	.	.			trans	-79.3	104.7	175.2	-67.2	149.2	0	0	0	110	P346 R379 Q380 Y386	P346-H383 HydrophobicContact CB-CB 3.92Å; P346-H383 WeakPolarHBondContact CB-ND1 3.31Å; P346-H383 HydrophobicContact CG-CB 3.96Å; R379-H383 HydrophobicContact CG-CB 3.93Å; R379-H383 PolarHBondContact NE-O 2.95Å; Q380-H383 PolarHBondContact N-ND1 2.66Å; Q380-H383 WeakPolarHBondContact O-CB 3.48Å; Q380-H383 PolarHBondContact O-N 3.37Å; H383-Y386 WeakPolarHBondContact O-CD1 3.43Å
384	R	82.4	Confident	86.1	Confident	162 Å²	162	44.9 Å²	44.9	61%	0.611	23%	0.228	S	C	*	.			trans	-84.6	-53.7	178.1	-60.4	-173.8	177.2	-176.7	-2.7	112.7	H382 Y386 D406	H382-R384 PolarHBondContact O-N 2.94Å; R384-Y386 WeakPolarHBondContact O-CD1 3.5Å; R384-Y386 VanDerWaalsContact O-CE1 3.31Å; R384-Y386 WeakPolarHBondContact O-CE1 3.44Å; R384-D406 WeakPolarHBondContact CD-OD1 3.49Å; R384-D406 IonicContact CZ-OD1 3.65Å; R384-D406 IonicContact NE-OD1 3.53Å; R384-D406 IonicContact NH1-OD1 2.65Å; R384-D406 PolarHBondContact NH1-OD1 2.83Å
385	S	88.8	Confident	85.6	Confident	13 Å²	13	45.4 Å²	45.4	9%	0.091	23%	0.234	C	C	.	.	S	Bend	trans	-81	124.6	166.7	-172.2	0	0	0	0	110.3	R402 S404 E405	S385-R402 WeakPolarHBondContact OG-CG 3.43Å; S385-S404 VanDerWaalsContact CB-O 3.22Å; S385-S404 WeakPolarHBondContact CB-O 3.33Å; S385-S404 PolarHBondContact OG-O 2.66Å; S385-E405 WeakPolarHBondContact CB-O 3.48Å; S385-E405 PolarHBondContact N-O 3.31Å
386	Y	92.2	Very high	85.5	Confident	15 Å²	15	45.9 Å²	45.9	6%	0.059	24%	0.237	C	C	.	.			trans	-159.9	162.5	178.7	58.6	-89.4	0	0	0	111	P346 I348 R379 H383 R384 I388 P408 Q409	P346-Y386 CarbonylContact O-C 3.54Å; P346-Y386 WeakPolarHBondContact O-CA 3.15Å; P346-Y386 VanDerWaalsContact O-CB 3.31Å; P346-Y386 WeakPolarHBondContact O-CB 3.47Å; I348-Y386 HydrophobicContact CD1-CD2 4.3Å; I348-Y386 HydrophobicContact CD1-CE2 3.72Å; I348-Y386 HydrophobicContact CG1-CD2 4.25Å; I348-Y386 HydrophobicContact CG1-CE2 4.16Å; R379-Y386 HydrophobicContact CG-CD1 3.93Å; R379-Y386 HydrophobicContact CG-CD2 4.24Å; R379-Y386 HydrophobicContact CG-CE1 4.31Å; R379-Y386 HydrophobicContact CG-CG 3.9Å; H383-Y386 WeakPolarHBondContact O-CD1 3.43Å; R384-Y386 WeakPolarHBondContact O-CD1 3.5Å; R384-Y386 VanDerWaalsContact O-CE1 3.31Å; R384-Y386 WeakPolarHBondContact O-CE1 3.44Å; Y386-I388 HydrophobicContact CD2-CD1 4.49Å; Y386-I388 HydrophobicContact CD2-CG1 3.89Å; Y386-I388 HydrophobicContact CE2-CD1 3.79Å; Y386-I388 HydrophobicContact CE2-CG1 3.64Å; Y386-P408 HydrophobicContact CD1-CB 4.2Å; Y386-P408 HydrophobicContact CD1-CG 4.32Å; Y386-P408 HydrophobicContact CD2-CB 3.99Å; Y386-P408 HydrophobicContact CE1-CB 3.93Å; Y386-P408 HydrophobicContact CE1-CG 3.63Å; Y386-P408 HydrophobicContact CE2-CB 3.71Å; Y386-P408 HydrophobicContact CE2-CG 4.02Å; Y386-P408 HydrophobicContact CG-CB 4.22Å; Y386-P408 VanDerWaalsContact CZ-CG 3.46Å; Y386-P408 WeakPolarHBondContact O-CA 3.35Å; Y386-Q409 PolarHBondContact O-N 3.48Å
387	I	94.4	Very high	85.3	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	146.8	174.6	67.8	175.8	0	0	0	112.6	W340 I345 P346 Y347 I348 F376 F389 Q409 L427 V430	W340-I387 HydrophobicContact CH2-CG2 3.79Å; W340-I387 HydrophobicContact CZ2-CG2 3.63Å; I345-I387 HydrophobicContact CG2-CD1 4.01Å; I345-I387 HydrophobicContact CG2-CG1 4.27Å; I345-I387 HydrophobicContact CG2-CG2 4.17Å; P346-I387 PolarHBondContact O-N 2.89Å; Y347-I387 CarbonylContact C-O 3.34Å; Y347-I387 VanDerWaalsContact CA-O 3.31Å; Y347-I387 WeakPolarHBondContact CA-O 3.13Å; I348-I387 PolarHBondContact N-O 2.9Å; F376-I387 HydrophobicContact CE1-CD1 4.34Å; I387-F389 HydrophobicContact CD1-CE2 3.74Å; I387-F389 HydrophobicContact CD1-CZ 3.93Å; I387-F389 HydrophobicContact CG1-CE2 4.27Å; I387-Q409 CarbonylContact C-O 3.37Å; I387-Q409 VanDerWaalsContact CA-O 3.24Å; I387-Q409 WeakPolarHBondContact CA-O 3.25Å; I387-Q409 HydrophobicContact CG2-CG 4.03Å; I387-L427 HydrophobicContact CD1-CD2 4.13Å; I387-V430 HydrophobicContact CD1-CG1 4.32Å; I387-V430 HydrophobicContact CG2-CG1 3.7Å
388	I	92.1	Very high	85.4	Confident	10 Å²	10	45.4 Å²	45.4	5%	0.051	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	112	174.5	-50.5	178.1	0	0	0	108.8	W154 I348 Q350 Y386 T390 P408 Q409 A410 I411	W154-I388 HydrophobicContact CB-CD1 4.1Å; W154-I388 HydrophobicContact CD2-CD1 4.14Å; W154-I388 HydrophobicContact CG-CD1 3.93Å; I348-I388 WeakPolarHBondContact O-CA 3.34Å; Q350-I388 HydrophobicContact CG-CG2 4.24Å; Y386-I388 HydrophobicContact CD2-CD1 4.49Å; Y386-I388 HydrophobicContact CD2-CG1 3.89Å; Y386-I388 HydrophobicContact CE2-CD1 3.79Å; Y386-I388 HydrophobicContact CE2-CG1 3.64Å; I388-T390 HydrophobicContact CB-CG2 4.39Å; I388-T390 HydrophobicContact CG2-CG2 3.77Å; I388-T390 PolarHBondContact O-N 2.64Å; I388-P408 HydrophobicContact CD1-CB 3.92Å; I388-P408 HydrophobicContact CG1-CB 4.28Å; I388-Q409 PolarHBondContact N-O 2.97Å; I388-A410 HydrophobicContact CB-CB 4.4Å; I388-A410 CarbonylContact O-C 3.55Å; I388-A410 WeakPolarHBondContact O-CA 3.37Å; I388-I411 WeakPolarHBondContact O-CG2 3.4Å; I388-I411 PolarHBondContact O-N 2.83Å
389	F	92.7	Very high	85.8	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	125.7	169.4	-65.4	-93.3	0	0	0	109.4	I348 I349 Q350 F353 I361 M365 I387 I411 I413 V423 L427	I348-F389 PolarHBondContact O-N 2.88Å; I349-F389 HydrophobicContact CG1-CB 4.43Å; I349-F389 HydrophobicContact CG1-CD2 3.75Å; I349-F389 HydrophobicContact CG1-CE2 4.38Å; I349-F389 HydrophobicContact CG1-CG 4.34Å; I349-F389 HydrophobicContact CG2-CB 4.26Å; Q350-F389 VanDerWaalsContact CG-O 3.27Å; Q350-F389 WeakPolarHBondContact CG-O 3.29Å; Q350-F389 PolarHBondContact N-O 2.82Å; F353-F389 HydrophobicContact CE2-CB 4.07Å; I361-F389 HydrophobicContact CD1-CB 4.36Å; I361-F389 HydrophobicContact CD1-CD1 4.15Å; I361-F389 HydrophobicContact CD1-CG 4.37Å; I361-F389 HydrophobicContact CG1-CD1 4.3Å; I361-F389 HydrophobicContact CG1-CE1 4.5Å; I361-F389 HydrophobicContact CG2-CD1 3.74Å; I361-F389 HydrophobicContact CG2-CD2 3.94Å; I361-F389 HydrophobicContact CG2-CE1 3.5Å; I361-F389 VanDerWaalsContact CG2-CE1 3.5Å; I361-F389 HydrophobicContact CG2-CE2 3.7Å; I361-F389 HydrophobicContact CG2-CG 3.95Å; I361-F389 HydrophobicContact CG2-CZ 3.47Å; I361-F389 VanDerWaalsContact CG2-CZ 3.47Å; M365-F389 HydrophobicContact CE-CE2 4.36Å; M365-F389 HydrophobicContact CG-CZ 4.34Å; M365-F389 HydrophobicContact SD-CE2 3.81Å; M365-F389 HydrophobicContact SD-CZ 3.91Å; I387-F389 HydrophobicContact CD1-CE2 3.74Å; I387-F389 HydrophobicContact CD1-CZ 3.93Å; I387-F389 HydrophobicContact CG1-CE2 4.27Å; F389-I411 HydrophobicContact CB-CG2 4.38Å; F389-I411 HydrophobicContact CD1-CD1 4.25Å; F389-I411 HydrophobicContact CD1-CG1 4.44Å; F389-I411 HydrophobicContact CD1-CG2 3.64Å; F389-I411 HydrophobicContact CD2-CG2 4.37Å; F389-I411 HydrophobicContact CE1-CD1 3.88Å; F389-I411 HydrophobicContact CE1-CG2 3.96Å; F389-I411 HydrophobicContact CG-CG2 3.87Å; F389-I411 HydrophobicContact CZ-CG2 4.47Å; F389-I413 HydrophobicContact CD1-CG1 3.97Å; F389-V423 HydrophobicContact CE1-CG1 4.13Å; F389-L427 HydrophobicContact CE1-CD2 4.39Å; F389-L427 HydrophobicContact CZ-CD2 3.96Å
390	T	89.7	Confident	86	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	141.8	-178.1	67.1	0	0	0	0	111.5	Q350 F353 I388 A410 I411 S412 I413	Q350-T390 HydrophobicContact CG-CG2 4.24Å; Q350-T390 VanDerWaalsContact OE1-CA 3.24Å; Q350-T390 VanDerWaalsContact OE1-CB 3.26Å; F353-T390 VanDerWaalsContact CZ-C 3.4Å; I388-T390 HydrophobicContact CB-CG2 4.39Å; I388-T390 HydrophobicContact CG2-CG2 3.77Å; I388-T390 PolarHBondContact O-N 2.64Å; T390-A410 HydrophobicContact CG2-CB 3.9Å; T390-I411 PolarHBondContact N-O 3.26Å; T390-I411 PolarHBondContact OG1-O 2.86Å; T390-S412 WeakPolarHBondContact O-CA 3.43Å; T390-I413 PolarHBondContact O-N 3.27Å
391	E	85.2	Confident	86.7	Confident	76 Å²	76	35.4 Å²	35.4	36%	0.355	19%	0.191	S	C	.	.			trans	-92.6	120.4	171.2	-164.4	-163.8	164.6	0	0	108.7	N352 F353	N352-E391 VanDerWaalsContact ND2-CB 3.3Å; N352-E391 WeakPolarHBondContact ND2-CB 3.14Å; N352-E391 PolarHBondContact ND2-OE2 2.87Å; F353-E391 HydrophobicContact CE1-CB 3.94Å; F353-E391 HydrophobicContact CE1-CG 4.36Å; F353-E391 HydrophobicContact CZ-CB 3.92Å
392	K	82.2	Confident	87.6	Confident	56 Å²	56	31.4 Å²	31.4	24%	0.243	16%	0.162	C	C	.	.			trans	-135.8	152.1	-178.7	-58.7	-67.3	-178.2	88.4	0	111.5	D156 C158 C394 G414	D156-K392 IonicContact OD1-NZ 2.7Å; D156-K392 PolarHBondContact OD1-NZ 2.86Å; D156-K392 IonicContact OD2-NZ 3.47Å; D156-K392 PolarHBondContact OD2-NZ 3.49Å; C158-K392 WeakPolarHBondContact SG-CB 3.37Å; K392-C394 PolarHBondContact O-N 2.88Å; K392-G414 WeakPolarHBondContact O-CA 3.32Å
393	A	76.3	Confident	88	Confident	96 Å²	96	27.4 Å²	27.4	79%	0.793	14%	0.141	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.1	-10.1	177.2	0	0	0	0	0	114.4	G395	A393-G395 VanDerWaalsContact C-N 3.3Å; A393-G395 PolarHBondContact O-N 2.89Å
394	C	78.8	Confident	87.9	Confident	25 Å²	25	27.5 Å²	27.5	17%	0.169	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-12.7	-178.7	92.7	0	0	0	0	113.6	C158 P188 K392 C397	C158-C394 VanDerWaalsContact CA-SG 3.55Å; C158-C394 HydrophobicContact CB-CB 3.68Å; C158-C394 WeakPolarHBondContact CB-SG 3.31Å; C158-C394 WeakPolarHBondContact SG-CB 3.33Å; C158-C394 CovalentContact SG-SG 2.04Å; C158-C394 PolarHBondContact SG-SG 3.43Å; P188-C394 HydrophobicContact CG-CB 3.56Å; P188-C394 WeakPolarHBondContact CG-O 3.36Å; K392-C394 PolarHBondContact O-N 2.88Å; C394-C397 PolarHBondContact SG-SG 2.99Å
395	G	82.5	Confident	87.8	Confident	12 Å²	12	25.6 Å²	25.6	12%	0.124	14%	0.143	C	C	.	.			trans	103.9	-147.7	177.9	0	0	0	0	0	112.9	A393 S412 G414 C417	A393-G395 VanDerWaalsContact C-N 3.3Å; A393-G395 PolarHBondContact O-N 2.89Å; G395-S412 WeakPolarHBondContact O-CB 3.4Å; G395-S412 PolarHBondContact O-OG 3.47Å; G395-G414 PolarHBondContact O-N 2.69Å; G395-G414 VanDerWaalsContact O-N 3.14Å; G395-C417 VanDerWaalsContact C-SG 3.59Å
396	C	89	Confident	87.4	Confident	12 Å²	12	29.5 Å²	29.5	8%	0.081	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	124.6	177.3	-27.1	0	0	0	0	108	S412 C417 I422 E426	C396-S412 WeakPolarHBondContact CA-O 3.14Å; C396-C417 WeakPolarHBondContact CA-SG 3.35Å; C396-C417 HydrophobicContact CB-CB 3.92Å; C396-C417 WeakPolarHBondContact CB-SG 3.36Å; C396-C417 PolarHBondContact N-SG 3.41Å; C396-C417 WeakPolarHBondContact SG-CB 3.33Å; C396-C417 CovalentContact SG-SG 2.03Å; C396-C417 PolarHBondContact SG-SG 2.97Å; C396-I422 HydrophobicContact CB-CG2 4.27Å; C396-E426 HydrophobicContact CB-CG 4.38Å; C396-E426 WeakPolarHBondContact CB-OE1 3.48Å
397	C	90	Very high	86.9	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.8	151.6	173.5	60.2	0	0	0	0	112.7	D166 P188 C394 S412 E426	D166-C397 VanDerWaalsContact O-CA 3.28Å; D166-C397 WeakPolarHBondContact O-CA 3.47Å; D166-C397 WeakPolarHBondContact O-CB 3.36Å; P188-C397 HydrophobicContact CB-CB 4.48Å; C394-C397 PolarHBondContact SG-SG 2.99Å; C397-S412 PolarHBondContact N-O 2.79Å; C397-S412 PolarHBondContact O-N 2.8Å; C397-S412 WeakPolarHBondContact SG-CB 3.42Å; C397-E426 WeakPolarHBondContact CA-OE2 3.02Å
398	S	92	Very high	86.6	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	161.2	-178.8	-173.7	0	0	0	0	112.2	D166 A168 E426 V430	D166-S398 PolarHBondContact O-N 3.44Å; A168-S398 PolarHBondContact N-O 3.31Å; S398-E426 VanDerWaalsContact CB-OE2 3.27Å; S398-E426 WeakPolarHBondContact CB-OE2 3.33Å; S398-E426 PolarHBondContact N-OE2 2.8Å; S398-E426 PolarHBondContact OG-O 3.35Å; S398-V430 VanDerWaalsContact OG-CG2 3.3Å; S398-V430 WeakPolarHBondContact OG-CG2 3.32Å
399	Y	92.2	Very high	86.6	Confident	9 Å²	9	32.9 Å²	32.9	4%	0.035	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	146.5	170.4	-73.8	-70.7	0	0	0	111	L155 P157 A168 G401 R403 Q409 H429	L155-Y399 HydrophobicContact CB-CD2 4.39Å; L155-Y399 HydrophobicContact CB-CE2 3.69Å; P157-Y399 HydrophobicContact CB-CD2 4.13Å; P157-Y399 HydrophobicContact CB-CE2 3.82Å; A168-Y399 HydrophobicContact CB-CD1 3.69Å; A168-Y399 HydrophobicContact CB-CD2 4.49Å; A168-Y399 HydrophobicContact CB-CE1 3.64Å; A168-Y399 HydrophobicContact CB-CE2 4.43Å; A168-Y399 HydrophobicContact CB-CG 4.15Å; A168-Y399 WeakPolarHBondContact O-CD1 3.46Å; Y399-G401 PolarHBondContact O-N 2.62Å; Y399-R403 HydrophobicContact CD1-CG 4.21Å; Y399-R403 HydrophobicContact CD2-CG 4.5Å; Y399-R403 HydrophobicContact CG-CG 3.92Å; Y399-Q409 HydrophobicContact CD2-CB 4.41Å; Y399-H429 CarbonylContact O-C 3.6Å
400	V	91.6	Very high	86.5	Confident	0 Å²	0	33 Å²	33	0%	0	18%	0.181	C	C	.	.	S	Bend	trans	-83.2	109.6	175.9	178.7	0	0	0	0	111.5	I167 H429 W434	I167-V400 HydrophobicContact CB-CG2 4.49Å; I167-V400 HydrophobicContact CD1-CG2 3.92Å; I167-V400 HydrophobicContact CG1-CG2 4.07Å; I167-V400 HydrophobicContact CG2-CG2 3.65Å; V400-H429 CarbonylContact C-O 3.25Å; V400-H429 WeakPolarHBondContact CA-O 3.26Å; V400-H429 HydrophobicContact CG2-CB 4.34Å; V400-W434 HydrophobicContact CB-CZ2 4.25Å; V400-W434 HydrophobicContact CG1-CD2 4.31Å; V400-W434 HydrophobicContact CG1-CG 4.45Å; V400-W434 HydrophobicContact CG1-CZ2 4.28Å; V400-W434 HydrophobicContact CG2-CD2 4.12Å; V400-W434 HydrophobicContact CG2-CE3 4.14Å; V400-W434 HydrophobicContact CG2-CH2 4.38Å; V400-W434 HydrophobicContact CG2-CZ2 4.4Å; V400-W434 HydrophobicContact CG2-CZ3 4.27Å
401	G	92.1	Very high	86.7	Confident	0 Å²	0	33 Å²	33	0%	0	18%	0.181	C	C	.	.	S	Bend	trans	79.4	-175.1	-179.7	0	0	0	0	0	113.8	R338 Y399 Q409 H429 V430	R338-G401 CarbonylContact O-C 3.48Å; R338-G401 VanDerWaalsContact O-CA 3.3Å; R338-G401 WeakPolarHBondContact O-CA 3.42Å; Y399-G401 PolarHBondContact O-N 2.62Å; G401-Q409 PolarHBondContact O-NE2 2.77Å; G401-Q409 PolarHBondContact O-OE1 2.72Å; G401-H429 PolarHBondContact N-O 3.18Å; G401-V430 CarbonylContact C-O 3.58Å; G401-V430 VanDerWaalsContact CA-O 3.27Å; G401-V430 WeakPolarHBondContact CA-O 3.48Å
402	R	92.7	Very high	87	Confident	20 Å²	20	29.3 Å²	29.3	8%	0.075	16%	0.164	C	C	.	.			trans	-68.4	127.2	169.4	-170.3	178.1	62.4	120.6	13	110.1	S337 R338 T339 W340 S385 S404 E405	S337-R402 PolarHBondContact O-NH2 3.17Å; R338-R402 WeakPolarHBondContact CA-O 3.36Å; R338-R402 PolarHBondContact O-N 2.71Å; T339-R402 PolarHBondContact O-NE 3.33Å; T339-R402 VanDerWaalsContact O-NE 3.14Å; W340-R402 HydrophobicContact CD2-CB 3.92Å; W340-R402 HydrophobicContact CD2-CG 4.1Å; W340-R402 HydrophobicContact CE3-CB 4.4Å; W340-R402 HydrophobicContact CE3-CG 4.06Å; W340-R402 HydrophobicContact CG-CB 4.27Å; W340-R402 HydrophobicContact CH2-CB 4.43Å; W340-R402 HydrophobicContact CH2-CG 3.98Å; W340-R402 HydrophobicContact CZ2-CB 3.97Å; W340-R402 HydrophobicContact CZ2-CG 4.04Å; W340-R402 HydrophobicContact CZ3-CG 4Å; S385-R402 WeakPolarHBondContact OG-CG 3.43Å; R402-S404 WeakPolarHBondContact CG-O 3.3Å; R402-E405 IonicContact CZ-OE1 3.71Å; R402-E405 IonicContact NH1-OE1 3.3Å; R402-E405 PolarHBondContact NH1-OE1 3.22Å; R402-E405 IonicContact NH2-OE1 3.41Å; R402-E405 PolarHBondContact NH2-OE1 3.12Å
403	R	87.2	Confident	87.4	Confident	43 Å²	43	26.7 Å²	26.7	16%	0.162	15%	0.153	C	C	.	.			trans	-93.8	-33.9	-176.6	-71.6	-64.5	-168.8	-174.7	-6.4	114.6	L155 A168 D170 E173 Y399	L155-R403 HydrophobicContact CD1-CB 3.45Å; L155-R403 VanDerWaalsContact CD1-CB 3.45Å; L155-R403 HydrophobicContact CD1-CG 4.06Å; A168-R403 PolarHBondContact O-NH2 3.4Å; A168-R403 VanDerWaalsContact O-NH2 3.15Å; D170-R403 IonicContact OD2-CZ 2.62Å; D170-R403 IonicContact OD2-NH1 3.97Å; D170-R403 PolarHBondContact OD2-NH1 2.91Å; E173-R403 IonicContact OE1-CZ 2.77Å; E173-R403 IonicContact OE1-NH1 2.64Å; E173-R403 PolarHBondContact OE1-NH1 3.37Å; E173-R403 IonicContact OE1-NH2 2.77Å; E173-R403 PolarHBondContact OE1-NH2 3.09Å; E173-R403 IonicContact OE2-CZ 2.73Å; E173-R403 IonicContact OE2-NH1 2.81Å; E173-R403 PolarHBondContact OE2-NH1 3.27Å; E173-R403 IonicContact OE2-NH2 2.65Å; E173-R403 PolarHBondContact OE2-NH2 3.12Å; Y399-R403 HydrophobicContact CD1-CG 4.21Å; Y399-R403 HydrophobicContact CD2-CG 4.5Å; Y399-R403 HydrophobicContact CG-CG 3.92Å
404	S	82.4	Confident	87.7	Confident	28 Å²	28	22.4 Å²	22.4	20%	0.196	12%	0.118	C	C	.	.			trans	-140.3	156	-177.4	-174.4	0	0	0	0	111	S385 R402 D406 E407	S385-S404 VanDerWaalsContact CB-O 3.22Å; S385-S404 WeakPolarHBondContact CB-O 3.33Å; S385-S404 PolarHBondContact OG-O 2.66Å; R402-S404 WeakPolarHBondContact CG-O 3.3Å; S404-D406 PolarHBondContact OG-N 3.44Å; S404-E407 PolarHBondContact OG-N 2.04Å; S404-E407 VanDerWaalsContact OG-N 3.12Å
405	E	79	Confident	87.7	Confident	123 Å²	123	29.2 Å²	29.2	58%	0.575	14%	0.144	S	C	*	.	S	Bend	trans	-87	-28.1	173.4	-50.1	-134.2	101.9	0	0	111.9	S385 R402	S385-E405 WeakPolarHBondContact CB-O 3.48Å; S385-E405 PolarHBondContact N-O 3.31Å; R402-E405 IonicContact CZ-OE1 3.71Å; R402-E405 IonicContact NH1-OE1 3.3Å; R402-E405 PolarHBondContact NH1-OE1 3.22Å; R402-E405 IonicContact NH2-OE1 3.41Å; R402-E405 PolarHBondContact NH2-OE1 3.12Å
406	D	81.3	Confident	87.6	Confident	95 Å²	95	33 Å²	33	51%	0.508	16%	0.162	S	C	.	.	S	Bend	trans	-114.7	-17.4	-172.9	-75	-54.8	0	0	0	114.1	R384 S404	R384-D406 WeakPolarHBondContact CD-OD1 3.49Å; R384-D406 IonicContact CZ-OD1 3.65Å; R384-D406 IonicContact NE-OD1 3.53Å; R384-D406 IonicContact NH1-OD1 2.65Å; R384-D406 PolarHBondContact NH1-OD1 2.83Å; S404-D406 PolarHBondContact OG-N 3.44Å
407	E	82.6	Confident	87.5	Confident	79 Å²	79	32.5 Å²	32.5	37%	0.369	16%	0.158	S	C	.	.	S	Bend	trans	-108.5	149.4	-178.4	-58.6	-178.8	134.6	0	0	112.8	S404	S404-E407 PolarHBondContact OG-N 2.04Å; S404-E407 VanDerWaalsContact OG-N 3.12Å
408	P	87.9	Confident	87	Confident	16 Å²	16	36.1 Å²	36.1	10%	0.104	18%	0.178	C	C	.	.			trans	-79.7	156.4	173.2	-2.5	20.7	0	0	0	112.2	W154 L155 Y386 I388	W154-P408 CarbonylContact C-O 3.59Å; W154-P408 WeakPolarHBondContact CA-O 3.32Å; W154-P408 HydrophobicContact CB-CB 3.82Å; W154-P408 HydrophobicContact CB-CG 3.96Å; W154-P408 WeakPolarHBondContact CB-O 3.38Å; L155-P408 PolarHBondContact N-O 3.36Å; Y386-P408 HydrophobicContact CD1-CB 4.2Å; Y386-P408 HydrophobicContact CD1-CG 4.32Å; Y386-P408 HydrophobicContact CD2-CB 3.99Å; Y386-P408 HydrophobicContact CE1-CB 3.93Å; Y386-P408 HydrophobicContact CE1-CG 3.63Å; Y386-P408 HydrophobicContact CE2-CB 3.71Å; Y386-P408 HydrophobicContact CE2-CG 4.02Å; Y386-P408 HydrophobicContact CG-CB 4.22Å; Y386-P408 VanDerWaalsContact CZ-CG 3.46Å; Y386-P408 WeakPolarHBondContact O-CA 3.35Å; I388-P408 HydrophobicContact CD1-CB 3.92Å; I388-P408 HydrophobicContact CG1-CB 4.28Å
409	Q	90.8	Very high	86.8	Confident	1 Å²	1	42 Å²	42	1%	0.005	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	138.7	170.4	65.5	-169.6	70.1	0	0	110.9	L155 Y386 I387 I388 Y399 G401	L155-Q409 HydrophobicContact CB-CB 4.25Å; Y386-Q409 PolarHBondContact O-N 3.48Å; I387-Q409 CarbonylContact C-O 3.37Å; I387-Q409 VanDerWaalsContact CA-O 3.24Å; I387-Q409 WeakPolarHBondContact CA-O 3.25Å; I387-Q409 HydrophobicContact CG2-CG 4.03Å; I388-Q409 PolarHBondContact N-O 2.97Å; Y399-Q409 HydrophobicContact CD2-CB 4.41Å; G401-Q409 PolarHBondContact O-NE2 2.77Å; G401-Q409 PolarHBondContact O-OE1 2.72Å
410	A	90.7	Very high	86.6	Confident	1 Å²	1	45.5 Å²	45.5	1%	0.008	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	154.8	174.2	0	0	0	0	0	111.7	L155 P157 I388 T390	L155-A410 PolarHBondContact O-N 2.82Å; P157-A410 WeakPolarHBondContact CD-O 3.39Å; P157-A410 WeakPolarHBondContact CG-O 3.14Å; I388-A410 HydrophobicContact CB-CB 4.4Å; I388-A410 CarbonylContact O-C 3.55Å; I388-A410 WeakPolarHBondContact O-CA 3.37Å; T390-A410 HydrophobicContact CG2-CB 3.9Å
411	I	93.7	Very high	86.6	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	127.5	170	166.7	172.6	0	0	0	106.1	I388 F389 T390 I413 E426 L427 V430	I388-I411 WeakPolarHBondContact O-CG2 3.4Å; I388-I411 PolarHBondContact O-N 2.83Å; F389-I411 HydrophobicContact CB-CG2 4.38Å; F389-I411 HydrophobicContact CD1-CD1 4.25Å; F389-I411 HydrophobicContact CD1-CG1 4.44Å; F389-I411 HydrophobicContact CD1-CG2 3.64Å; F389-I411 HydrophobicContact CD2-CG2 4.37Å; F389-I411 HydrophobicContact CE1-CD1 3.88Å; F389-I411 HydrophobicContact CE1-CG2 3.96Å; F389-I411 HydrophobicContact CG-CG2 3.87Å; F389-I411 HydrophobicContact CZ-CG2 4.47Å; T390-I411 PolarHBondContact N-O 3.26Å; T390-I411 PolarHBondContact OG1-O 2.86Å; I411-I413 HydrophobicContact CD1-CD1 4.22Å; I411-I413 HydrophobicContact CG1-CD1 4.11Å; I411-I413 HydrophobicContact CG1-CG1 4.5Å; I411-E426 HydrophobicContact CD1-CB 3.55Å; I411-E426 HydrophobicContact CG1-CB 4.16Å; I411-L427 HydrophobicContact CD1-CD2 4.49Å; I411-V430 HydrophobicContact CB-CG2 4.5Å; I411-V430 HydrophobicContact CD1-CG2 4.06Å
412	S	91.9	Very high	86.5	Confident	0 Å²	0	46 Å²	46	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	116.2	-177.8	-174.5	0	0	0	0	110	T390 G395 C396 C397	T390-S412 WeakPolarHBondContact O-CA 3.43Å; G395-S412 WeakPolarHBondContact O-CB 3.4Å; G395-S412 PolarHBondContact O-OG 3.47Å; C396-S412 WeakPolarHBondContact CA-O 3.14Å; C397-S412 PolarHBondContact N-O 2.79Å; C397-S412 PolarHBondContact O-N 2.8Å; C397-S412 WeakPolarHBondContact SG-CB 3.42Å
413	I	90.4	Very high	86.6	Confident	1 Å²	1	45 Å²	45	1%	0.005	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	79.7	168.1	-53.3	-58.8	0	0	0	106	F353 F389 T390 I411 C417 V423 E426	F353-I413 HydrophobicContact CE1-CB 3.98Å; F353-I413 HydrophobicContact CE1-CG2 4.16Å; F353-I413 HydrophobicContact CZ-CB 3.94Å; F389-I413 HydrophobicContact CD1-CG1 3.97Å; T390-I413 PolarHBondContact O-N 3.27Å; I411-I413 HydrophobicContact CD1-CD1 4.22Å; I411-I413 HydrophobicContact CG1-CD1 4.11Å; I411-I413 HydrophobicContact CG1-CG1 4.5Å; I413-C417 HydrophobicContact CB-CB 4.43Å; I413-C417 HydrophobicContact CG2-CB 3.74Å; I413-V423 HydrophobicContact CD1-CG1 4.26Å; I413-V423 HydrophobicContact CD1-CG2 4.28Å; I413-V423 HydrophobicContact CG2-CG2 4.49Å; I413-E426 HydrophobicContact CD1-CB 4.32Å; I413-E426 HydrophobicContact CD1-CG 4.15Å
414	G	83.1	Confident	87	Confident	5 Å²	5	43 Å²	43	5%	0.052	21%	0.211	C	C	.	.			trans	-71.9	-172	177.1	0	0	0	0	0	113.5	K392 G395 N416 C417	K392-G414 WeakPolarHBondContact O-CA 3.32Å; G395-G414 PolarHBondContact O-N 2.69Å; G395-G414 VanDerWaalsContact O-N 3.14Å; G414-N416 PolarHBondContact O-N 2.85Å; G414-C417 PolarHBondContact N-SG 3.09Å; G414-C417 VanDerWaalsContact N-SG 3.45Å; G414-C417 WeakPolarHBondContact O-CB 3.22Å; G414-C417 PolarHBondContact O-N 2.85Å; G414-C417 VanDerWaalsContact O-N 3.1Å; G414-C417 PolarHBondContact O-SG 2.97Å; G414-C417 VanDerWaalsContact O-SG 3.35Å
415	K	78.7	Confident	87.5	Confident	169 Å²	169	41.7 Å²	41.7	74%	0.735	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.9	137	176.7	-64.6	-169.5	174.9	-169.2	0	111.2	C417	K415-C417 PolarHBondContact O-N 2.93Å
416	N	80.6	Confident	88.3	Confident	91 Å²	91	35.8 Å²	35.8	49%	0.487	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	68.2	4.1	-175.9	-49.2	1.6	0	0	0	115.2	N193 G414 D418 I422	N193-N416 PolarHBondContact OD1-ND2 3.43Å; G414-N416 PolarHBondContact O-N 2.85Å; N416-D418 VanDerWaalsContact C-N 3.34Å; N416-I422 WeakPolarHBondContact O-CD1 3.42Å
417	C	85.8	Confident	89	Confident	1 Å²	1	31.3 Å²	31.3	1%	0.007	15%	0.15	C	C	.	.			trans	-88.3	0.4	176.1	-53.3	0	0	0	0	113.6	G395 C396 I413 G414 K415 I422	G395-C417 VanDerWaalsContact C-SG 3.59Å; C396-C417 WeakPolarHBondContact CA-SG 3.35Å; C396-C417 HydrophobicContact CB-CB 3.92Å; C396-C417 WeakPolarHBondContact CB-SG 3.36Å; C396-C417 PolarHBondContact N-SG 3.41Å; C396-C417 WeakPolarHBondContact SG-CB 3.33Å; C396-C417 CovalentContact SG-SG 2.03Å; C396-C417 PolarHBondContact SG-SG 2.97Å; I413-C417 HydrophobicContact CB-CB 4.43Å; I413-C417 HydrophobicContact CG2-CB 3.74Å; G414-C417 PolarHBondContact N-SG 3.09Å; G414-C417 VanDerWaalsContact N-SG 3.45Å; G414-C417 WeakPolarHBondContact O-CB 3.22Å; G414-C417 PolarHBondContact O-N 2.85Å; G414-C417 VanDerWaalsContact O-N 3.1Å; G414-C417 PolarHBondContact O-SG 2.97Å; G414-C417 VanDerWaalsContact O-SG 3.35Å; K415-C417 PolarHBondContact O-N 2.93Å; C417-I422 HydrophobicContact CB-CG2 4.24Å
418	D	81	Confident	89.6	Confident	76 Å²	76	27.5 Å²	27.5	41%	0.406	13%	0.132	S	C	.	.			trans	-80.6	-10.2	-171.1	57.3	-32.2	0	0	0	114.4	T357 T360 N416 K420	T357-D418 HydrophobicContact CG2-CB 3.78Å; T360-D418 WeakPolarHBondContact CG2-O 3.34Å; N416-D418 VanDerWaalsContact C-N 3.34Å; D418-K420 PolarHBondContact O-N 2.85Å
419	K	87	Confident	89.9	Confident	123 Å²	123	26.8 Å²	26.8	54%	0.535	13%	0.127	S	C	.	.	S	Bend	trans	-61.4	125.3	170.2	-66.3	-173.5	177.8	-175.7	0	110.1	D196 G421 I422 V423	D196-K419 IonicContact OD2-NZ 2.9Å; D196-K419 PolarHBondContact OD2-NZ 2.82Å; K419-G421 VanDerWaalsContact C-N 3.28Å; K419-G421 PolarHBondContact O-N 2.92Å; K419-I422 HydrophobicContact CB-CD1 4.11Å; K419-I422 HydrophobicContact CB-CG1 4.3Å; K419-I422 WeakPolarHBondContact O-CB 3.48Å; K419-I422 PolarHBondContact O-N 3.1Å; K419-V423 PolarHBondContact O-N 2.78Å
420	K	89.1	Confident	90.1	Very high	83 Å²	83	26.8 Å²	26.8	36%	0.361	13%	0.127	S	C	.	.	H	α-helix	trans	-39.3	-48.4	-176.6	-175.9	-176.3	176.7	-177.7	0	114.8	T360 D418 I422 V423 I424	T360-K420 HydrophobicContact CG2-CB 3.84Å; D418-K420 PolarHBondContact O-N 2.85Å; K420-I422 VanDerWaalsContact C-N 3.32Å; K420-I422 PolarHBondContact O-N 2.98Å; K420-V423 PolarHBondContact O-N 2.84Å; K420-I424 HydrophobicContact CG-CD1 4.06Å; K420-I424 WeakPolarHBondContact O-CG1 3.36Å; K420-I424 PolarHBondContact O-N 2.8Å
421	G	90.5	Very high	90.3	Very high	3 Å²	3	26.7 Å²	26.7	3%	0.031	13%	0.127	C	C	.	.	H	α-helix	trans	-68.6	-23.3	-177.8	0	0	0	0	0	115.2	K419 H425 R512	K419-G421 VanDerWaalsContact C-N 3.28Å; K419-G421 PolarHBondContact O-N 2.92Å; G421-H425 PolarHBondContact O-N 2.87Å; G421-R512 WeakPolarHBondContact CA-O 3.31Å
422	I	90.6	Very high	90.3	Very high	8 Å²	8	26.7 Å²	26.7	4%	0.041	13%	0.127	C	C	.	.	H	α-helix	trans	-72.7	-45.3	170.6	-57.4	176.3	0	0	0	109	W192 C396 N416 C417 K419 K420 I424 H425 E426	W192-I422 HydrophobicContact CD2-CD1 4.47Å; W192-I422 HydrophobicContact CG-CD1 4.2Å; C396-I422 HydrophobicContact CB-CG2 4.27Å; N416-I422 WeakPolarHBondContact O-CD1 3.42Å; C417-I422 HydrophobicContact CB-CG2 4.24Å; K419-I422 HydrophobicContact CB-CD1 4.11Å; K419-I422 HydrophobicContact CB-CG1 4.3Å; K419-I422 WeakPolarHBondContact O-CB 3.48Å; K419-I422 PolarHBondContact O-N 3.1Å; K420-I422 VanDerWaalsContact C-N 3.32Å; K420-I422 PolarHBondContact O-N 2.98Å; I422-I424 VanDerWaalsContact C-N 3.29Å; I422-I424 PolarHBondContact O-N 2.92Å; I422-H425 WeakPolarHBondContact O-CA 3.29Å; I422-H425 VanDerWaalsContact O-CB 3.27Å; I422-H425 WeakPolarHBondContact O-CB 3.26Å; I422-H425 PolarHBondContact O-N 2.88Å; I422-E426 PolarHBondContact O-N 2.9Å
423	V	94	Very high	90.3	Very high	0 Å²	0	27 Å²	27	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-63.1	-34.9	176.1	-167.4	0	0	0	0	111.9	I361 A364 F389 I413 K419 K420 H425 L427	I361-V423 HydrophobicContact CG1-CG1 4.15Å; I361-V423 HydrophobicContact CG1-CG2 4.44Å; A364-V423 HydrophobicContact CB-CB 3.73Å; A364-V423 HydrophobicContact CB-CG1 3.72Å; F389-V423 HydrophobicContact CE1-CG1 4.13Å; I413-V423 HydrophobicContact CD1-CG1 4.26Å; I413-V423 HydrophobicContact CD1-CG2 4.28Å; I413-V423 HydrophobicContact CG2-CG2 4.49Å; K419-V423 PolarHBondContact O-N 2.78Å; K420-V423 PolarHBondContact O-N 2.84Å; V423-H425 VanDerWaalsContact C-N 3.34Å; V423-L427 HydrophobicContact CG1-CD1 4.33Å; V423-L427 VanDerWaalsContact O-CB 3.29Å; V423-L427 WeakPolarHBondContact O-CB 3.04Å; V423-L427 VanDerWaalsContact O-CG 3.28Å; V423-L427 WeakPolarHBondContact O-CG 3.06Å; V423-L427 PolarHBondContact O-N 2.88Å
424	I	95.3	Very high	90.3	Very high	0 Å²	0	27 Å²	27	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-62.6	-39.9	171.8	-66.8	172.4	0	0	0	111.3	A364 H367 W368 K420 I422 G428 I481 L515	A364-I424 HydrophobicContact CB-CG1 3.72Å; H367-I424 HydrophobicContact CB-CD1 3.95Å; H367-I424 HydrophobicContact CB-CG1 4.48Å; W368-I424 HydrophobicContact CZ2-CG2 4.34Å; W368-I424 PolarHBondContact NE1-O 2.81Å; W368-I424 VanDerWaalsContact NE1-O 3.13Å; K420-I424 HydrophobicContact CG-CD1 4.06Å; K420-I424 WeakPolarHBondContact O-CG1 3.36Å; K420-I424 PolarHBondContact O-N 2.8Å; I422-I424 VanDerWaalsContact C-N 3.29Å; I422-I424 PolarHBondContact O-N 2.92Å; I424-G428 PolarHBondContact O-N 2.91Å; I424-I481 HydrophobicContact CG2-CG1 4.02Å; I424-I481 HydrophobicContact CG2-CG2 4.4Å; I424-L515 HydrophobicContact CG2-CD2 3.47Å; I424-L515 VanDerWaalsContact CG2-CD2 3.47Å; I424-L515 HydrophobicContact CG2-CG 4.14Å
425	H	93.8	Very high	90.7	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-64.1	-51.2	177.2	-173.8	78.7	0	0	0	112.2	D166 G421 I422 V423 L427 G428 H429 H435 I481 M482 R512	D166-H425 IonicContact OD2-NE2 3.07Å; G421-H425 PolarHBondContact O-N 2.87Å; I422-H425 WeakPolarHBondContact O-CA 3.29Å; I422-H425 VanDerWaalsContact O-CB 3.27Å; I422-H425 WeakPolarHBondContact O-CB 3.26Å; I422-H425 PolarHBondContact O-N 2.88Å; V423-H425 VanDerWaalsContact C-N 3.34Å; H425-L427 VanDerWaalsContact C-N 3.29Å; H425-L427 PolarHBondContact O-N 3.38Å; H425-G428 VanDerWaalsContact O-CA 3.31Å; H425-G428 WeakPolarHBondContact O-CA 3.48Å; H425-G428 PolarHBondContact O-N 2.83Å; H425-H429 AromaticContact NE2-NE2 3.81Å; H425-H429 PolarHBondContact O-N 2.85Å; H425-H435 AromaticContact CE1-CD2 3.82Å; H425-H435 AromaticContact CE1-NE2 4Å; H425-H435 AromaticContact NE2-CD2 3.9Å; H425-H435 AromaticContact NE2-NE2 3.61Å; H425-I481 HydrophobicContact CB-CG1 4.19Å; H425-I481 PolarHBondContact CE1-O 2.87Å; H425-I481 PolarHBondContact ND1-O 3.15Å; H425-M482 WeakPolarHBondContact O-CE 3.37Å; H425-R512 PolarHBondContact CE1-NH2 3.12Å; H425-R512 PolarHBondContact ND1-NH2 2.88Å; H425-R512 PolarHBondContact NE2-NH2 2.76Å
426	E	94.7	Very high	91.3	Very high	0 Å²	0	19.1 Å²	19.1	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-62.2	-36.2	177.7	-62.5	-65.4	164.4	0	0	112.2	C396 C397 S398 I411 I413 I422 G428 H429 V430	C396-E426 HydrophobicContact CB-CG 4.38Å; C396-E426 WeakPolarHBondContact CB-OE1 3.48Å; C397-E426 WeakPolarHBondContact CA-OE2 3.02Å; S398-E426 VanDerWaalsContact CB-OE2 3.27Å; S398-E426 WeakPolarHBondContact CB-OE2 3.33Å; S398-E426 PolarHBondContact N-OE2 2.8Å; S398-E426 PolarHBondContact OG-O 3.35Å; I411-E426 HydrophobicContact CD1-CB 3.55Å; I411-E426 HydrophobicContact CG1-CB 4.16Å; I413-E426 HydrophobicContact CD1-CB 4.32Å; I413-E426 HydrophobicContact CD1-CG 4.15Å; I422-E426 PolarHBondContact O-N 2.9Å; E426-G428 VanDerWaalsContact C-N 3.31Å; E426-H429 WeakPolarHBondContact O-CB 3.31Å; E426-H429 PolarHBondContact O-N 2.79Å; E426-H429 IonicContact OE2-CD2 3.68Å; E426-V430 PolarHBondContact O-N 3.49Å; E426-V430 VanDerWaalsContact O-N 3.14Å
427	L	95.9	Very high	91.7	Very high	0 Å²	0	14.8 Å²	14.8	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-65.3	-32.1	169.8	-78.9	175.1	0	0	0	112.6	A364 M365 F376 I387 F389 I411 V423 H425 H429 V430 I431	A364-L427 HydrophobicContact CB-CD1 4.04Å; M365-L427 HydrophobicContact CG-CD1 3.7Å; F376-L427 HydrophobicContact CE1-CD2 3.64Å; F376-L427 HydrophobicContact CZ-CD1 4.44Å; F376-L427 HydrophobicContact CZ-CD2 3.96Å; I387-L427 HydrophobicContact CD1-CD2 4.13Å; F389-L427 HydrophobicContact CE1-CD2 4.39Å; F389-L427 HydrophobicContact CZ-CD2 3.96Å; I411-L427 HydrophobicContact CD1-CD2 4.49Å; V423-L427 HydrophobicContact CG1-CD1 4.33Å; V423-L427 VanDerWaalsContact O-CB 3.29Å; V423-L427 WeakPolarHBondContact O-CB 3.04Å; V423-L427 VanDerWaalsContact O-CG 3.28Å; V423-L427 WeakPolarHBondContact O-CG 3.06Å; V423-L427 PolarHBondContact O-N 2.88Å; H425-L427 VanDerWaalsContact C-N 3.29Å; H425-L427 PolarHBondContact O-N 3.38Å; L427-H429 VanDerWaalsContact C-N 3.31Å; L427-H429 PolarHBondContact O-N 2.66Å; L427-V430 HydrophobicContact CD2-CB 4.45Å; L427-V430 HydrophobicContact CD2-CG2 4.48Å; L427-V430 WeakPolarHBondContact O-CB 3.27Å; L427-V430 PolarHBondContact O-N 3.44Å; L427-V430 VanDerWaalsContact O-N 3.15Å; L427-I431 WeakPolarHBondContact O-CB 3.44Å; L427-I431 WeakPolarHBondContact O-CD1 3.29Å; L427-I431 WeakPolarHBondContact O-CG1 3.19Å; L427-I431 PolarHBondContact O-N 2.03Å
428	G	95.7	Very high	91.8	Very high	0 Å²	0	14.8 Å²	14.8	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-59.6	-40	171.3	0	0	0	0	0	112.5	I424 H425 E426 I431 G432 F433	I424-G428 PolarHBondContact O-N 2.91Å; H425-G428 VanDerWaalsContact O-CA 3.31Å; H425-G428 WeakPolarHBondContact O-CA 3.48Å; H425-G428 PolarHBondContact O-N 2.83Å; E426-G428 VanDerWaalsContact C-N 3.31Å; G428-I431 PolarHBondContact O-N 2.87Å; G428-G432 PolarHBondContact O-N 3.35Å; G428-F433 WeakPolarHBondContact O-CB 3.37Å; G428-F433 WeakPolarHBondContact O-CD2 3.41Å; G428-F433 PolarHBondContact O-N 3.37Å
429	H	94.6	Very high	92.1	Very high	0 Å²	0	11.2 Å²	11.2	0%	0	5%	0.05	C	C	.	.	H	α-helix	trans	-62.2	-50.1	169.2	-64.4	-46.6	0	0	0	111.4	D166 I167 Y399 V400 G401 H425 E426 L427 I431 G432 F433 H435 M482	D166-H429 IonicContact OD1-NE2 3.27Å; I167-H429 VanDerWaalsContact CG1-CE1 3.42Å; I167-H429 WeakPolarHBondContact CG1-CE1 2.98Å; Y399-H429 CarbonylContact O-C 3.6Å; V400-H429 CarbonylContact C-O 3.25Å; V400-H429 WeakPolarHBondContact CA-O 3.26Å; V400-H429 HydrophobicContact CG2-CB 4.34Å; G401-H429 PolarHBondContact N-O 3.18Å; H425-H429 AromaticContact NE2-NE2 3.81Å; H425-H429 PolarHBondContact O-N 2.85Å; E426-H429 WeakPolarHBondContact O-CB 3.31Å; E426-H429 PolarHBondContact O-N 2.79Å; E426-H429 IonicContact OE2-CD2 3.68Å; L427-H429 VanDerWaalsContact C-N 3.31Å; L427-H429 PolarHBondContact O-N 2.66Å; H429-I431 PolarHBondContact O-N 2.81Å; H429-I431 VanDerWaalsContact O-N 3.15Å; H429-G432 WeakPolarHBondContact O-CA 3.23Å; H429-G432 PolarHBondContact O-N 2.77Å; H429-F433 PolarHBondContact ND1-O 3.1Å; H429-H435 AromaticContact CE1-CD2 3.8Å; H429-H435 AromaticContact CE1-CE1 3.99Å; H429-H435 AromaticContact CE1-NE2 3.48Å; H429-H435 PolarHBondContact CE1-NE2 3.37Å; H429-H435 AromaticContact NE2-NE2 3.48Å; H429-H435 PolarHBondContact NE2-NE2 3.47Å; H429-M482 WeakPolarHBondContact CE1-CE 3.35Å; H429-M482 VanDerWaalsContact ND1-CE 3.35Å; H429-M482 WeakPolarHBondContact ND1-CE 3.14Å
430	V	95.4	Very high	92.1	Very high	1 Å²	1	6.5 Å²	6.5	1%	0.006	3%	0.032	C	C	.	.	H	α-helix	trans	-52.8	-38.8	177.2	171.2	0	0	0	0	112.4	W340 I345 I387 S398 G401 I411 E426 L427 G432	W340-V430 HydrophobicContact CZ2-CG1 4.18Å; W340-V430 PolarHBondContact NE1-O 2.92Å; I345-V430 HydrophobicContact CG2-CG1 4.22Å; I387-V430 HydrophobicContact CD1-CG1 4.32Å; I387-V430 HydrophobicContact CG2-CG1 3.7Å; S398-V430 VanDerWaalsContact OG-CG2 3.3Å; S398-V430 WeakPolarHBondContact OG-CG2 3.32Å; G401-V430 CarbonylContact C-O 3.58Å; G401-V430 VanDerWaalsContact CA-O 3.27Å; G401-V430 WeakPolarHBondContact CA-O 3.48Å; I411-V430 HydrophobicContact CB-CG2 4.5Å; I411-V430 HydrophobicContact CD1-CG2 4.06Å; E426-V430 PolarHBondContact O-N 3.49Å; E426-V430 VanDerWaalsContact O-N 3.14Å; L427-V430 HydrophobicContact CD2-CB 4.45Å; L427-V430 HydrophobicContact CD2-CG2 4.48Å; L427-V430 WeakPolarHBondContact O-CB 3.27Å; L427-V430 PolarHBondContact O-N 3.44Å; L427-V430 VanDerWaalsContact O-N 3.15Å; V430-G432 VanDerWaalsContact C-N 3.33Å
431	I	95.1	Very high	92	Very high	0 Å²	0	3 Å²	3	0%	0	2%	0.017	C	C	.	.	H	α-helix	trans	-72	-26.3	-179.7	-72.6	163.2	0	0	0	112.3	I345 W368 L374 F376 L427 G428 H429 F433 T523 Y527	I345-I431 HydrophobicContact CD1-CG1 3.92Å; W368-I431 HydrophobicContact CB-CD1 4.44Å; W368-I431 HydrophobicContact CD2-CD1 3.26Å; W368-I431 HydrophobicContact CE3-CD1 3.53Å; W368-I431 HydrophobicContact CG-CD1 3.73Å; W368-I431 HydrophobicContact CH2-CD1 3.97Å; W368-I431 HydrophobicContact CZ2-CD1 3.74Å; W368-I431 HydrophobicContact CZ3-CD1 3.88Å; L374-I431 HydrophobicContact CD1-CB 4.44Å; L374-I431 HydrophobicContact CD1-CD1 3.42Å; L374-I431 VanDerWaalsContact CD1-CD1 3.42Å; L374-I431 HydrophobicContact CD1-CG1 3.63Å; L374-I431 HydrophobicContact CD1-CG2 3.92Å; F376-I431 HydrophobicContact CZ-CD1 4.27Å; L427-I431 WeakPolarHBondContact O-CB 3.44Å; L427-I431 WeakPolarHBondContact O-CD1 3.29Å; L427-I431 WeakPolarHBondContact O-CG1 3.19Å; L427-I431 PolarHBondContact O-N 2.03Å; G428-I431 PolarHBondContact O-N 2.87Å; H429-I431 PolarHBondContact O-N 2.81Å; H429-I431 VanDerWaalsContact O-N 3.15Å; I431-F433 HydrophobicContact CB-CD2 4.49Å; I431-F433 HydrophobicContact CB-CE2 4.49Å; I431-F433 HydrophobicContact CG2-CD2 4.14Å; I431-F433 HydrophobicContact CG2-CE2 3.7Å; I431-T523 HydrophobicContact CG2-CG2 4.11Å; I431-Y527 HydrophobicContact CG2-CE2 3.77Å; I431-Y527 PolarHBondContact O-OH 2.83Å
432	G	92.7	Very high	92	Very high	0 Å²	0	3.3 Å²	3.3	0%	0	2%	0.017	C	C	.	.	T	Hydrogen-bonded Turn	trans	126.7	14.4	174.4	0	0	0	0	0	115.7	T333 G428 H429 V430	T333-G432 WeakPolarHBondContact CB-O 3.44Å; T333-G432 PolarHBondContact N-O 3.09Å; G428-G432 PolarHBondContact O-N 3.35Å; H429-G432 WeakPolarHBondContact O-CA 3.23Å; H429-G432 PolarHBondContact O-N 2.77Å; V430-G432 VanDerWaalsContact C-N 3.33Å
433	F	92.5	Very high	92	Very high	5 Å²	5	6.5 Å²	6.5	2%	0.022	4%	0.035	C	C	.	.	B	Isolated β-bridge	trans	-89.3	139.2	179.4	-63.3	-67.7	0	0	0	113.7	A332 W368 G428 H429 I431 M482 Q522 T523	A332-F433 HydrophobicContact CB-CD1 3.66Å; A332-F433 HydrophobicContact CB-CE1 3.63Å; W368-F433 HydrophobicContact CH2-CD2 4.17Å; W368-F433 AromaticContact CH2-CE2 3.84Å; W368-F433 HydrophobicContact CH2-CE2 3.84Å; W368-F433 HydrophobicContact CZ3-CE2 4.22Å; G428-F433 WeakPolarHBondContact O-CB 3.37Å; G428-F433 WeakPolarHBondContact O-CD2 3.41Å; G428-F433 PolarHBondContact O-N 3.37Å; H429-F433 PolarHBondContact ND1-O 3.1Å; I431-F433 HydrophobicContact CB-CD2 4.49Å; I431-F433 HydrophobicContact CB-CE2 4.49Å; I431-F433 HydrophobicContact CG2-CD2 4.14Å; I431-F433 HydrophobicContact CG2-CE2 3.7Å; F433-M482 HydrophobicContact CB-CE 4.25Å; F433-M482 HydrophobicContact CB-CG 3.86Å; F433-M482 HydrophobicContact CB-SD 4.39Å; F433-M482 HydrophobicContact CG-CG 4.34Å; F433-Q522 HydrophobicContact CE1-CB 4.06Å; F433-Q522 HydrophobicContact CE1-CG 3.96Å; F433-Q522 HydrophobicContact CZ-CB 4.37Å; F433-T523 VanDerWaalsContact CE2-OG1 3.28Å; F433-T523 WeakPolarHBondContact CE2-OG1 3.46Å; F433-T523 WeakPolarHBondContact CZ-OG1 3.12Å
434	W	90.1	Very high	91.9	Very high	3 Å²	3	12.3 Å²	12.3	1%	0.011	6%	0.062	C	C	.	.	P	Polyproline II helix	trans	-89.8	170.9	159.5	-62.1	89.7	0	0	0	109.2	I167 L169 M177 V400 E436 M464 V469	I167-W434 HydrophobicContact CD1-CD2 4.43Å; I167-W434 HydrophobicContact CD1-CE3 3.54Å; I167-W434 HydrophobicContact CD1-CZ3 4.01Å; I167-W434 HydrophobicContact CG2-CE3 4.4Å; I167-W434 HydrophobicContact CG2-CH2 4.4Å; I167-W434 HydrophobicContact CG2-CZ3 3.8Å; L169-W434 HydrophobicContact CD2-CH2 3.98Å; L169-W434 HydrophobicContact CD2-CZ3 4.21Å; M177-W434 HydrophobicContact CE-CH2 3.62Å; M177-W434 HydrophobicContact CE-CZ3 3.83Å; V400-W434 HydrophobicContact CB-CZ2 4.25Å; V400-W434 HydrophobicContact CG1-CD2 4.31Å; V400-W434 HydrophobicContact CG1-CG 4.45Å; V400-W434 HydrophobicContact CG1-CZ2 4.28Å; V400-W434 HydrophobicContact CG2-CD2 4.12Å; V400-W434 HydrophobicContact CG2-CE3 4.14Å; V400-W434 HydrophobicContact CG2-CH2 4.38Å; V400-W434 HydrophobicContact CG2-CZ2 4.4Å; V400-W434 HydrophobicContact CG2-CZ3 4.27Å; W434-E436 PolarHBondContact O-N 2.87Å; W434-M464 HydrophobicContact CD2-CE 3.62Å; W434-M464 HydrophobicContact CD2-CG 4.45Å; W434-M464 HydrophobicContact CD2-SD 4.31Å; W434-M464 HydrophobicContact CE3-CE 3.58Å; W434-M464 HydrophobicContact CE3-CG 4.34Å; W434-M464 HydrophobicContact CE3-SD 3.83Å; W434-M464 HydrophobicContact CG-CE 4.42Å; W434-M464 HydrophobicContact CH2-CE 3.63Å; W434-M464 HydrophobicContact CZ2-CE 3.61Å; W434-M464 HydrophobicContact CZ3-CE 3.6Å; W434-M464 HydrophobicContact CZ3-SD 3.98Å; W434-V469 HydrophobicContact CG-CG2 4.36Å
435	H	90.9	Very high	91.7	Very high	0 Å²	0	13.9 Å²	13.9	0%	0	7%	0.069	C	C	.	.	P	Polyproline II helix	trans	-64.9	134.8	175	-59.7	120.2	0	0	0	112.9	D166 H425 H429 H437 T438 M482 Y484	D166-H435 IonicContact OD1-CE1 3.92Å; D166-H435 PolarHBondContact OD1-CE1 2.5Å; D166-H435 IonicContact OD1-NE2 2.71Å; D166-H435 PolarHBondContact OD1-NE2 2.6Å; D166-H435 IonicContact OD2-NE2 3.15Å; H425-H435 AromaticContact CE1-CD2 3.82Å; H425-H435 AromaticContact CE1-NE2 4Å; H425-H435 AromaticContact NE2-CD2 3.9Å; H425-H435 AromaticContact NE2-NE2 3.61Å; H429-H435 AromaticContact CE1-CD2 3.8Å; H429-H435 AromaticContact CE1-CE1 3.99Å; H429-H435 AromaticContact CE1-NE2 3.48Å; H429-H435 PolarHBondContact CE1-NE2 3.37Å; H429-H435 AromaticContact NE2-NE2 3.48Å; H429-H435 PolarHBondContact NE2-NE2 3.47Å; H435-H437 WeakPolarHBondContact CB-CE1 3.09Å; H435-H437 WeakPolarHBondContact CB-ND1 3.17Å; H435-H437 AromaticContact CG-CE1 3.7Å; H435-H437 AromaticContact ND1-CE1 3.98Å; H435-H437 PolarHBondContact O-N 2.96Å; H435-T438 HydrophobicContact CB-CG2 3.84Å; H435-T438 WeakPolarHBondContact O-CB 3.13Å; H435-T438 PolarHBondContact O-N 3.45Å; H435-T438 PolarHBondContact O-OG1 3.36Å; H435-M482 VanDerWaalsContact CA-O 3.23Å; H435-M482 WeakPolarHBondContact CA-O 3.23Å; H435-M482 WeakPolarHBondContact CB-O 3.39Å; H435-M482 PolarHBondContact CD2-O 2.72Å; H435-Y484 AromaticContact CD2-CE1 3.69Å; H435-Y484 AromaticContact CE1-CE1 3.57Å; H435-Y484 AromaticContact CE1-CZ 3.8Å; H435-Y484 PolarHBondContact CE1-OH 3.35Å; H435-Y484 AromaticContact CG-CE1 3.95Å; H435-Y484 AromaticContact ND1-CE1 3.89Å; H435-Y484 AromaticContact ND1-CZ 3.97Å; H435-Y484 AromaticContact NE2-CE1 3.43Å; H435-Y484 WeakPolarHBondContact NE2-CE1 3.2Å
436	E	92.3	Very high	91.6	Very high	7 Å²	7	14 Å²	14	3%	0.033	7%	0.07	C	C	.	.	G	3₁₀ helix	trans	-60.3	-32.6	-178.7	-177.2	66	-173.6	0	0	112	A331 W434 T438 R439 Y476 D477 M482 H483	A331-E436 WeakPolarHBondContact CB-OE2 3.5Å; W434-E436 PolarHBondContact O-N 2.87Å; E436-T438 PolarHBondContact O-N 2.83Å; E436-T438 VanDerWaalsContact O-N 3.17Å; E436-R439 WeakPolarHBondContact O-CD 3.34Å; E436-R439 WeakPolarHBondContact O-CG 3.07Å; E436-R439 PolarHBondContact O-N 3.1Å; E436-R439 WeakPolarHBondContact OE1-CD 3.49Å; E436-R439 IonicContact OE1-CZ 3.64Å; E436-R439 IonicContact OE1-NE 2.67Å; E436-R439 IonicContact OE1-NH1 3.12Å; E436-R439 PolarHBondContact OE1-NH1 2.9Å; E436-R439 VanDerWaalsContact OE2-CD 3.31Å; E436-R439 WeakPolarHBondContact OE2-CD 3.5Å; E436-R439 IonicContact OE2-NH1 3.77Å; E436-R439 PolarHBondContact OE2-NH1 2.69Å; E436-Y476 HydrophobicContact CG-CE1 4.28Å; E436-Y476 HydrophobicContact CG-CE2 4.35Å; E436-Y476 WeakPolarHBondContact O-CE2 3.29Å; E436-Y476 WeakPolarHBondContact OE1-CA 3.29Å; E436-D477 WeakPolarHBondContact CG-O 3.4Å; E436-D477 PolarHBondContact OE1-N 2.88Å; E436-M482 PolarHBondContact N-O 3.03Å; E436-H483 HydrophobicContact CB-CB 4.17Å
437	H	89.5	Confident	91.5	Very high	0 Å²	0	17.3 Å²	17.3	0%	0	9%	0.088	C	C	.	.	G	3₁₀ helix	trans	-74.4	2.7	175.1	79.8	-76.4	0	0	0	114.2	H435 R442 N460 Y476 Y484 I498	H435-H437 WeakPolarHBondContact CB-CE1 3.09Å; H435-H437 WeakPolarHBondContact CB-ND1 3.17Å; H435-H437 AromaticContact CG-CE1 3.7Å; H435-H437 AromaticContact ND1-CE1 3.98Å; H435-H437 PolarHBondContact O-N 2.96Å; H437-R442 PolarHBondContact O-NE 2.77Å; H437-R442 PolarHBondContact O-NH2 3.19Å; H437-N460 PolarHBondContact NE2-O 3.15Å; H437-Y476 WeakPolarHBondContact CA-OH 3.37Å; H437-Y484 AromaticContact CE1-CD1 3.66Å; H437-Y484 AromaticContact CE1-CD2 3.11Å; H437-Y484 WeakPolarHBondContact CE1-CD2 3.32Å; H437-Y484 AromaticContact CE1-CE1 3.83Å; H437-Y484 AromaticContact CE1-CE2 3.26Å; H437-Y484 WeakPolarHBondContact CE1-CE2 3.44Å; H437-Y484 AromaticContact CE1-CG 3.31Å; H437-Y484 AromaticContact CE1-CZ 3.64Å; H437-Y484 AromaticContact ND1-CD1 3.98Å; H437-Y484 AromaticContact ND1-CD2 3.75Å; H437-Y484 AromaticContact ND1-CG 3.56Å; H437-Y484 AromaticContact NE2-CD2 3.34Å; H437-Y484 VanDerWaalsContact NE2-CD2 3.34Å; H437-Y484 WeakPolarHBondContact NE2-CD2 3.21Å; H437-Y484 AromaticContact NE2-CE2 3.42Å; H437-Y484 WeakPolarHBondContact NE2-CE2 3.2Å; H437-Y484 AromaticContact NE2-CG 3.98Å; H437-I498 HydrophobicContact CB-CD1 3.93Å
438	T	88.3	Confident	91.2	Very high	2 Å²	2	18.9 Å²	18.9	1%	0.012	10%	0.096	C	C	.	.	G	3₁₀ helix	trans	-102.5	-3.8	177.5	68.7	0	0	0	0	113.6	Y164 H435 E436 K463 M464	Y164-T438 HydrophobicContact CE1-CG2 3.9Å; H435-T438 HydrophobicContact CB-CG2 3.84Å; H435-T438 WeakPolarHBondContact O-CB 3.13Å; H435-T438 PolarHBondContact O-N 3.45Å; H435-T438 PolarHBondContact O-OG1 3.36Å; E436-T438 PolarHBondContact O-N 2.83Å; E436-T438 VanDerWaalsContact O-N 3.17Å; T438-K463 WeakPolarHBondContact O-CA 3.48Å; T438-M464 PolarHBondContact O-N 3.24Å
439	R	87	Confident	91	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	10%	0.104	C	C	.	.			trans	-48.3	137.7	-180	-74.7	173.6	67.7	138.4	-5.6	113.7	R330 A331 E436 D441 R442 E474 P475	R330-R439 VanDerWaalsContact O-CG 3.32Å; R330-R439 WeakPolarHBondContact O-CG 3.07Å; A331-R439 HydrophobicContact CB-CG 3.84Å; E436-R439 WeakPolarHBondContact O-CD 3.34Å; E436-R439 WeakPolarHBondContact O-CG 3.07Å; E436-R439 PolarHBondContact O-N 3.1Å; E436-R439 WeakPolarHBondContact OE1-CD 3.49Å; E436-R439 IonicContact OE1-CZ 3.64Å; E436-R439 IonicContact OE1-NE 2.67Å; E436-R439 IonicContact OE1-NH1 3.12Å; E436-R439 PolarHBondContact OE1-NH1 2.9Å; E436-R439 VanDerWaalsContact OE2-CD 3.31Å; E436-R439 WeakPolarHBondContact OE2-CD 3.5Å; E436-R439 IonicContact OE2-NH1 3.77Å; E436-R439 PolarHBondContact OE2-NH1 2.69Å; R439-D441 IonicContact CZ-OD1 3.85Å; R439-D441 IonicContact CZ-OD2 3.83Å; R439-D441 IonicContact NE-OD1 2.79Å; R439-D441 PolarHBondContact NE-OD1 3.4Å; R439-D441 VanDerWaalsContact NE-OD1 3.15Å; R439-D441 IonicContact NE-OD2 3.49Å; R439-D441 PolarHBondContact NE-OD2 2.82Å; R439-D441 IonicContact NH2-OD1 3.65Å; R439-D441 IonicContact NH2-OD2 3.7Å; R439-D441 PolarHBondContact NH2-OD2 3.34Å; R439-D441 PolarHBondContact O-N 3.36Å; R439-D441 VanDerWaalsContact O-N 3.16Å; R439-R442 HydrophobicContact CB-CB 4.18Å; R439-R442 VanDerWaalsContact O-CB 3.25Å; R439-R442 WeakPolarHBondContact O-CB 3.49Å; R439-R442 VanDerWaalsContact O-CD 3.25Å; R439-R442 WeakPolarHBondContact O-CD 3.24Å; R439-R442 VanDerWaalsContact O-CG 3.27Å; R439-R442 WeakPolarHBondContact O-CG 3.37Å; R439-R442 PolarHBondContact O-N 2.78Å; R439-E474 PolarHBondContact NH2-O 3.45Å; R439-P475 PolarHBondContact NH1-O 2.88Å; R439-P475 PolarHBondContact NH2-O 2.95Å
440	P	85.6	Confident	90.5	Very high	24 Å²	24	25.1 Å²	25.1	16%	0.156	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.7	-31.9	169.4	-29	36.2	0	0	0	114.8	R330 K463 P466	R330-P440 HydrophobicContact CB-CG 3.77Å; R330-P440 WeakPolarHBondContact O-CD 2.93Å; P440-K463 PolarHBondContact O-NZ 2.62Å; P440-P466 HydrophobicContact CB-CG 4.22Å; P440-P466 HydrophobicContact CG-CG 4.1Å
441	D	87.9	Confident	90	Very high	9 Å²	9	31.3 Å²	31.3	5%	0.048	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92	-1.2	179.1	58	-51.2	0	0	0	114.7	K329 R330 R439 D443 E444	K329-D441 VanDerWaalsContact CB-OD2 3.3Å; K329-D441 WeakPolarHBondContact CB-OD2 3.49Å; K329-D441 WeakPolarHBondContact CD-OD2 3.44Å; K329-D441 HydrophobicContact CG-CB 4.43Å; K329-D441 VanDerWaalsContact CG-OD2 3.24Å; K329-D441 WeakPolarHBondContact CG-OD2 3.39Å; R330-D441 PolarHBondContact N-OD1 3.43Å; R439-D441 IonicContact CZ-OD1 3.85Å; R439-D441 IonicContact CZ-OD2 3.83Å; R439-D441 IonicContact NE-OD1 2.79Å; R439-D441 PolarHBondContact NE-OD1 3.4Å; R439-D441 VanDerWaalsContact NE-OD1 3.15Å; R439-D441 IonicContact NE-OD2 3.49Å; R439-D441 PolarHBondContact NE-OD2 2.82Å; R439-D441 IonicContact NH2-OD1 3.65Å; R439-D441 IonicContact NH2-OD2 3.7Å; R439-D441 PolarHBondContact NH2-OD2 3.34Å; R439-D441 PolarHBondContact O-N 3.36Å; R439-D441 VanDerWaalsContact O-N 3.16Å; D441-D443 PolarHBondContact O-N 3.17Å; D441-E444 WeakPolarHBondContact O-CB 3.47Å; D441-E444 PolarHBondContact O-N 3.04Å; D441-E444 VanDerWaalsContact O-N 3.11Å
442	R	89.9	Confident	89.7	Confident	10 Å²	10	32.4 Å²	32.4	4%	0.038	17%	0.167	C	C	.	.	G	3₁₀ helix	trans	-49.7	-33.4	-177.5	76.4	-158.8	-78	-137.8	39.1	114.8	H437 R439 E444 H445 V446 F461 K463 Y476	H437-R442 PolarHBondContact O-NE 2.77Å; H437-R442 PolarHBondContact O-NH2 3.19Å; R439-R442 HydrophobicContact CB-CB 4.18Å; R439-R442 VanDerWaalsContact O-CB 3.25Å; R439-R442 WeakPolarHBondContact O-CB 3.49Å; R439-R442 VanDerWaalsContact O-CD 3.25Å; R439-R442 WeakPolarHBondContact O-CD 3.24Å; R439-R442 VanDerWaalsContact O-CG 3.27Å; R439-R442 WeakPolarHBondContact O-CG 3.37Å; R439-R442 PolarHBondContact O-N 2.78Å; R442-E444 PolarHBondContact O-N 2.94Å; R442-E444 VanDerWaalsContact O-N 3.16Å; R442-H445 CarbonylContact O-C 3.54Å; R442-H445 WeakPolarHBondContact O-CA 3.36Å; R442-H445 PolarHBondContact O-N 2.95Å; R442-V446 HydrophobicContact CB-CG2 4.04Å; R442-V446 HydrophobicContact CG-CG2 4.47Å; R442-V446 WeakPolarHBondContact O-CG2 3.3Å; R442-V446 PolarHBondContact O-N 2.83Å; R442-F461 VanDerWaalsContact CZ-O 3.24Å; R442-F461 PolarHBondContact NH1-O 2.76Å; R442-F461 PolarHBondContact NH2-O 2.96Å; R442-K463 VanDerWaalsContact CD-CD 3.41Å; R442-K463 HydrophobicContact CG-CD 3.9Å; R442-Y476 HydrophobicContact CB-CE2 3.96Å
443	D	91.2	Very high	89.2	Confident	75 Å²	75	32.5 Å²	32.5	40%	0.401	17%	0.168	S	C	.	.	G	3₁₀ helix	trans	-72.2	-12.3	-170.6	-49.9	-33.1	0	0	0	111.3	D441 H445 K463 K501	D441-D443 PolarHBondContact O-N 3.17Å; D443-H445 VanDerWaalsContact C-N 3.32Å; D443-K463 WeakPolarHBondContact OD2-CE 3.4Å; D443-K463 IonicContact OD2-NZ 2.71Å; D443-K463 PolarHBondContact OD2-NZ 2.86Å; D443-K501 PolarHBondContact O-NZ 3.27Å
444	E	91.2	Very high	88.7	Confident	122 Å²	122	35.2 Å²	35.2	57%	0.57	19%	0.185	S	C	*	.	G	3₁₀ helix	trans	-79.2	-15.9	169.1	-62.3	172.4	-158.3	0	0	112	D441 R442	D441-E444 WeakPolarHBondContact O-CB 3.47Å; D441-E444 PolarHBondContact O-N 3.04Å; D441-E444 VanDerWaalsContact O-N 3.11Å; R442-E444 PolarHBondContact O-N 2.94Å; R442-E444 VanDerWaalsContact O-N 3.16Å
445	H	91.5	Very high	88	Confident	34 Å²	34	43.9 Å²	43.9	16%	0.157	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-123.5	-33.5	-167.9	-63.6	-70.9	0	0	0	114.2	K329 R442 D443 Y476 Y478 K501	K329-H445 PolarHBondContact NZ-NE2 3.3Å; R442-H445 CarbonylContact O-C 3.54Å; R442-H445 WeakPolarHBondContact O-CA 3.36Å; R442-H445 PolarHBondContact O-N 2.95Å; D443-H445 VanDerWaalsContact C-N 3.32Å; H445-Y476 HydrophobicContact CB-CD1 3.84Å; H445-Y476 HydrophobicContact CB-CD2 3.72Å; H445-Y476 HydrophobicContact CB-CE1 4.28Å; H445-Y476 HydrophobicContact CB-CE2 4.17Å; H445-Y476 HydrophobicContact CB-CG 3.55Å; H445-Y476 VanDerWaalsContact CD2-CB 3.44Å; H445-Y476 WeakPolarHBondContact CD2-CB 3.48Å; H445-Y476 AromaticContact CD2-CD2 3.78Å; H445-Y476 AromaticContact CD2-CG 3.82Å; H445-Y476 AromaticContact CG-CD2 3.87Å; H445-Y476 AromaticContact CG-CG 3.59Å; H445-Y478 HydrophobicContact CB-CE1 4.43Å; H445-Y478 WeakPolarHBondContact O-CE1 3.32Å; H445-Y478 PolarHBondContact O-OH 2.92Å; H445-K501 WeakPolarHBondContact O-CB 3.23Å; H445-K501 PolarHBondContact O-N 3.01Å
446	V	92.3	Very high	87.2	Confident	1 Å²	1	46 Å²	46	1%	0.006	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	149.3	177.8	-66.6	0	0	0	0	111.7	R442 I448 Y476 Y478 I498 R499	R442-V446 HydrophobicContact CB-CG2 4.04Å; R442-V446 HydrophobicContact CG-CG2 4.47Å; R442-V446 WeakPolarHBondContact O-CG2 3.3Å; R442-V446 PolarHBondContact O-N 2.83Å; V446-I448 HydrophobicContact CG2-CD1 4.22Å; V446-Y476 HydrophobicContact CG1-CE1 4.1Å; V446-Y478 HydrophobicContact CG1-CD1 4.42Å; V446-Y478 HydrophobicContact CG1-CE1 4Å; V446-I498 HydrophobicContact CB-CG2 3.87Å; V446-I498 HydrophobicContact CG1-CG2 3.89Å; V446-I498 HydrophobicContact CG2-CG2 4.26Å; V446-R499 CarbonylContact C-O 3.37Å; V446-R499 VanDerWaalsContact CA-O 3.26Å; V446-R499 WeakPolarHBondContact CA-O 3.37Å
447	D	91.8	Very high	86.5	Confident	71 Å²	71	47.7 Å²	47.7	38%	0.38	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	134.8	161.8	-75	-50	0	0	0	110	L449 R499 K501	D447-L449 HydrophobicContact CB-CD2 4.48Å; D447-R499 PolarHBondContact N-O 2.7Å; D447-R499 PolarHBondContact O-N 3.45Å; D447-K501 WeakPolarHBondContact OD1-CE 3.47Å; D447-K501 IonicContact OD1-NZ 3.92Å; D447-K501 PolarHBondContact OD1-NZ 2.91Å; D447-K501 WeakPolarHBondContact OD2-CE 3.22Å; D447-K501 IonicContact OD2-NZ 2.83Å
448	I	90.8	Very high	86	Confident	33 Å²	33	51.4 Å²	51.4	17%	0.169	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	115.4	171.2	-53.9	-51	0	0	0	109	V446 L450 F461 I498	V446-I448 HydrophobicContact CG2-CD1 4.22Å; I448-L450 VanDerWaalsContact C-N 3.34Å; I448-L450 HydrophobicContact CG2-CD2 3.65Å; I448-L450 HydrophobicContact CG2-CG 3.99Å; I448-L450 PolarHBondContact O-N 2.03Å; I448-L450 VanDerWaalsContact O-N 3.1Å; I448-F461 HydrophobicContact CD1-CD1 4.24Å; I448-F461 HydrophobicContact CG2-CB 3.72Å; I448-F461 HydrophobicContact CG2-CD1 3.88Å; I448-F461 HydrophobicContact CG2-CG 3.95Å; I448-I498 HydrophobicContact CD1-CB 4.49Å; I448-I498 HydrophobicContact CD1-CG1 4.1Å; I448-I498 HydrophobicContact CD1-CG2 4.08Å
449	L	90.1	Very high	85.5	Confident	34 Å²	34	51.8 Å²	51.8	18%	0.178	28%	0.276	C	S	.	.			trans	-88.5	72.6	-177.9	-54.6	176.4	0	0	0	109.4	D447 D451 N452 V453 E496 T497 R499	D447-L449 HydrophobicContact CB-CD2 4.48Å; L449-D451 PolarHBondContact O-N 2.71Å; L449-D451 VanDerWaalsContact O-N 3.14Å; L449-N452 HydrophobicContact CB-CB 4.12Å; L449-N452 WeakPolarHBondContact CB-ND2 3.46Å; L449-N452 WeakPolarHBondContact O-CA 3.23Å; L449-N452 VanDerWaalsContact O-CB 3.23Å; L449-N452 WeakPolarHBondContact O-CB 3.4Å; L449-N452 PolarHBondContact O-N 3.38Å; L449-V453 PolarHBondContact O-N 3.44Å; L449-E496 HydrophobicContact CD1-CB 4.04Å; L449-T497 PolarHBondContact N-O 3.34Å; L449-R499 HydrophobicContact CD1-CB 4.28Å
450	L	84.9	Confident	85.1	Confident	97 Å²	97	51.8 Å²	51.8	51%	0.508	28%	0.276	S	S	.	.	G	3₁₀ helix	trans	-55.4	-32.1	-175.8	-66.9	174.2	0	0	0	113.5	I448 N452 V453 D458 F461	I448-L450 VanDerWaalsContact C-N 3.34Å; I448-L450 HydrophobicContact CG2-CD2 3.65Å; I448-L450 HydrophobicContact CG2-CG 3.99Å; I448-L450 PolarHBondContact O-N 2.03Å; I448-L450 VanDerWaalsContact O-N 3.1Å; L450-N452 PolarHBondContact O-N 2.88Å; L450-N452 VanDerWaalsContact O-N 3.07Å; L450-V453 PolarHBondContact O-N 3.08Å; L450-D458 HydrophobicContact CD2-CB 4.13Å; L450-F461 HydrophobicContact CD2-CB 4.47Å
451	D	84.7	Confident	85.1	Confident	130 Å²	130	51 Å²	51	70%	0.695	27%	0.27	S	S	*	.	G	3₁₀ helix	trans	-60.5	-17.2	172.6	-70.2	-31.1	0	0	0	113.8	L449 K491 K494	L449-D451 PolarHBondContact O-N 2.71Å; L449-D451 VanDerWaalsContact O-N 3.14Å; D451-K491 PolarHBondContact O-NZ 3.37Å; D451-K494 PolarHBondContact O-NZ 3.44Å
452	N	88.3	Confident	84.8	Confident	24 Å²	24	53.2 Å²	53.2	13%	0.128	28%	0.28	C	S	.	.	G	3₁₀ helix	trans	-101	-21.1	-177.5	-52.9	0.7	0	0	0	112.4	L449 L450 K491 K494 E496 T497	L449-N452 HydrophobicContact CB-CB 4.12Å; L449-N452 WeakPolarHBondContact CB-ND2 3.46Å; L449-N452 WeakPolarHBondContact O-CA 3.23Å; L449-N452 VanDerWaalsContact O-CB 3.23Å; L449-N452 WeakPolarHBondContact O-CB 3.4Å; L449-N452 PolarHBondContact O-N 3.38Å; L450-N452 PolarHBondContact O-N 2.88Å; L450-N452 VanDerWaalsContact O-N 3.07Å; N452-K491 WeakPolarHBondContact O-CB 3.36Å; N452-K491 WeakPolarHBondContact O-CG 3.37Å; N452-K491 PolarHBondContact O-N 3.43Å; N452-K494 HydrophobicContact CB-CB 4.18Å; N452-K494 HydrophobicContact CB-CD 3.78Å; N452-K494 WeakPolarHBondContact OD1-CD 3.32Å; N452-K494 WeakPolarHBondContact OD1-CE 3.49Å; N452-K494 PolarHBondContact OD1-NZ 2.04Å; N452-E496 VanDerWaalsContact CB-O 3.25Å; N452-E496 WeakPolarHBondContact CB-O 3.05Å; N452-E496 PolarHBondContact ND2-O 3.42Å; N452-T497 HydrophobicContact CB-CG2 4.33Å
453	V	83.1	Confident	84.6	Confident	2 Å²	2	56.4 Å²	56.4	1%	0.012	29%	0.294	C	S	.	.	B	Isolated β-bridge	trans	-70.1	143.5	175.8	-179	0	0	0	0	110.7	L449 L450 Q457 F461 F489 K491 T497	L449-V453 PolarHBondContact O-N 3.44Å; L450-V453 PolarHBondContact O-N 3.08Å; V453-Q457 HydrophobicContact CG1-CB 3.96Å; V453-F461 HydrophobicContact CB-CE2 4.26Å; V453-F461 HydrophobicContact CG1-CD2 3.99Å; V453-F461 HydrophobicContact CG1-CE2 3.52Å; V453-F461 HydrophobicContact CG1-CZ 4.41Å; V453-F461 HydrophobicContact CG2-CD2 3.95Å; V453-F461 HydrophobicContact CG2-CE2 3.62Å; V453-F461 HydrophobicContact CG2-CZ 3.91Å; V453-F489 CarbonylContact C-O 3.57Å; V453-F489 WeakPolarHBondContact CA-O 3.43Å; V453-F489 HydrophobicContact CG1-CB 4.08Å; V453-K491 WeakPolarHBondContact O-CE 3.44Å; V453-K491 PolarHBondContact O-NZ 3.25Å; V453-T497 HydrophobicContact CB-CG2 4.49Å; V453-T497 HydrophobicContact CG2-CG2 3.82Å
454	V	81.3	Confident	84	Confident	62 Å²	62	53 Å²	53	38%	0.376	28%	0.276	S	S	.	.	P	Polyproline II helix	trans	-56.9	141.2	173.2	171.7	0	0	0	0	111	G456 Q457 F489 K491	V454-G456 PolarHBondContact O-N 2.87Å; V454-Q457 HydrophobicContact CB-CB 4.26Å; V454-Q457 HydrophobicContact CB-CG 4.07Å; V454-Q457 HydrophobicContact CG1-CG 4.11Å; V454-Q457 WeakPolarHBondContact O-CB 3.46Å; V454-Q457 PolarHBondContact O-N 2.81Å; V454-F489 PolarHBondContact N-O 3.46Å; V454-K491 HydrophobicContact CG2-CG 4.31Å
455	E	75.9	Confident	83.2	Confident	184 Å²	184	50.2 Å²	50.2	86%	0.86	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	126.9	-177.7	-171.2	168.4	-177.7	0	0	110.6
456	G	73.3	Confident	82.1	Confident	44 Å²	44	51.2 Å²	51.2	45%	0.454	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.3	-4.5	-173.3	0	0	0	0	0	115.5	V454 F459	V454-G456 PolarHBondContact O-N 2.87Å; G456-F459 WeakPolarHBondContact O-CD1 3.1Å; G456-F459 VanDerWaalsContact O-CE1 3.27Å; G456-F459 WeakPolarHBondContact O-CE1 3.24Å
457	Q	78.9	Confident	81	Confident	43 Å²	43	53 Å²	53	20%	0.201	29%	0.293	C	S	.	.			trans	-101.1	7.4	176.7	-64.7	-65.2	-18.1	0	0	113.6	V453 V454 F459 N460 F489	V453-Q457 HydrophobicContact CG1-CB 3.96Å; V454-Q457 HydrophobicContact CB-CB 4.26Å; V454-Q457 HydrophobicContact CB-CG 4.07Å; V454-Q457 HydrophobicContact CG1-CG 4.11Å; V454-Q457 WeakPolarHBondContact O-CB 3.46Å; V454-Q457 PolarHBondContact O-N 2.81Å; Q457-F459 PolarHBondContact O-N 2.64Å; Q457-N460 PolarHBondContact O-ND2 2.93Å; Q457-N460 PolarHBondContact OE1-ND2 2.88Å; Q457-F489 HydrophobicContact CB-CB 4.2Å; Q457-F489 HydrophobicContact CB-CD1 3.96Å; Q457-F489 HydrophobicContact CB-CG 4.22Å; Q457-F489 HydrophobicContact CG-CD1 4.02Å
458	D	78.7	Confident	80.1	Confident	79 Å²	79	50.3 Å²	50.3	42%	0.422	28%	0.278	S	S	.	.	G	3₁₀ helix	trans	-65.4	-21.7	179.8	60.5	-74	0	0	0	113.8	L450 N460 F461	L450-D458 HydrophobicContact CD2-CB 4.13Å; D458-N460 VanDerWaalsContact C-N 3.33Å; D458-N460 PolarHBondContact O-N 3.49Å; D458-F461 PolarHBondContact O-N 2.98Å
459	F	76.8	Confident	79.3	Confident	9 Å²	9	48.8 Å²	48.8	4%	0.039	27%	0.27	C	S	.	.	G	3₁₀ helix	trans	-64.8	-34.5	-178.5	70.4	-88.7	0	0	0	113.3	Y164 V183 L189 G456 Q457 F461 K462	Y164-F459 HydrophobicContact CD2-CD2 4.46Å; Y164-F459 WeakPolarHBondContact CE2-O 3.28Å; Y164-F459 PolarHBondContact OH-O 3.16Å; V183-F459 HydrophobicContact CB-CB 3.92Å; V183-F459 HydrophobicContact CG1-CB 4.19Å; V183-F459 HydrophobicContact CG1-CD1 4.49Å; V183-F459 HydrophobicContact CG1-CG 4.37Å; V183-F459 WeakPolarHBondContact O-CB 3.19Å; V183-F459 VanDerWaalsContact O-CD2 3.32Å; V183-F459 WeakPolarHBondContact O-CD2 3.02Å; L189-F459 HydrophobicContact CD1-CZ 4.37Å; G456-F459 WeakPolarHBondContact O-CD1 3.1Å; G456-F459 VanDerWaalsContact O-CE1 3.27Å; G456-F459 WeakPolarHBondContact O-CE1 3.24Å; Q457-F459 PolarHBondContact O-N 2.64Å; F459-F461 PolarHBondContact O-N 2.8Å; F459-K462 WeakPolarHBondContact O-CB 3.01Å; F459-K462 PolarHBondContact O-N 2.83Å
460	N	79.1	Confident	78.8	Confident	1 Å²	1	49.9 Å²	49.9	1%	0.005	28%	0.276	C	S	.	.	G	3₁₀ helix	trans	-59.8	-12.6	173.2	-56.2	-71.7	0	0	0	113.4	G165 H437 Q457 D458 Y484 F489	G165-N460 PolarHBondContact N-OD1 3.29Å; H437-N460 PolarHBondContact NE2-O 3.15Å; Q457-N460 PolarHBondContact O-ND2 2.93Å; Q457-N460 PolarHBondContact OE1-ND2 2.88Å; D458-N460 VanDerWaalsContact C-N 3.33Å; D458-N460 PolarHBondContact O-N 3.49Å; N460-Y484 HydrophobicContact CB-CE2 4.33Å; N460-F489 HydrophobicContact CB-CD2 4.28Å; N460-F489 HydrophobicContact CB-CE2 3.94Å; N460-F489 HydrophobicContact CB-CZ 4.44Å
461	F	85.9	Confident	78.3	Confident	7 Å²	7	45.2 Å²	45.2	3%	0.031	25%	0.252	C	S	.	.	G	3₁₀ helix	trans	-113.8	15.9	177.8	-52.4	-95.1	0	0	0	113.1	R442 I448 L450 V453 D458 F459 T488 F489 I498	R442-F461 VanDerWaalsContact CZ-O 3.24Å; R442-F461 PolarHBondContact NH1-O 2.76Å; R442-F461 PolarHBondContact NH2-O 2.96Å; I448-F461 HydrophobicContact CD1-CD1 4.24Å; I448-F461 HydrophobicContact CG2-CB 3.72Å; I448-F461 HydrophobicContact CG2-CD1 3.88Å; I448-F461 HydrophobicContact CG2-CG 3.95Å; L450-F461 HydrophobicContact CD2-CB 4.47Å; V453-F461 HydrophobicContact CB-CE2 4.26Å; V453-F461 HydrophobicContact CG1-CD2 3.99Å; V453-F461 HydrophobicContact CG1-CE2 3.52Å; V453-F461 HydrophobicContact CG1-CZ 4.41Å; V453-F461 HydrophobicContact CG2-CD2 3.95Å; V453-F461 HydrophobicContact CG2-CE2 3.62Å; V453-F461 HydrophobicContact CG2-CZ 3.91Å; D458-F461 PolarHBondContact O-N 2.98Å; F459-F461 PolarHBondContact O-N 2.8Å; F461-T488 WeakPolarHBondContact CZ-O 3.33Å; F461-F489 HydrophobicContact CE2-CB 3.91Å; F461-F489 AromaticContact CE2-CD2 3.71Å; F461-F489 HydrophobicContact CE2-CD2 3.71Å; F461-F489 HydrophobicContact CE2-CG 4.12Å; F461-F489 HydrophobicContact CZ-CB 4.02Å; F461-F489 AromaticContact CZ-CD2 3.7Å; F461-F489 HydrophobicContact CZ-CD2 3.7Å; F461-F489 HydrophobicContact CZ-CG 4.31Å; F461-I498 HydrophobicContact CD1-CD1 4.37Å; F461-I498 HydrophobicContact CD1-CG1 4.18Å; F461-I498 HydrophobicContact CE1-CD1 3.96Å; F461-I498 HydrophobicContact CE1-CG1 3.73Å
462	K	82.2	Confident	78.2	Confident	56 Å²	56	41 Å²	41	24%	0.243	23%	0.229	C	C	.	.	S	Bend	trans	-65.9	167.7	163.1	-70.1	177.8	178.5	-177.7	0	110.4	Y164 G181 M182 V183 F459	Y164-K462 WeakPolarHBondContact OH-CA 3.44Å; Y164-K462 WeakPolarHBondContact OH-CB 3.37Å; Y164-K462 PolarHBondContact OH-N 2.68Å; Y164-K462 PolarHBondContact OH-O 2.83Å; Y164-K462 VanDerWaalsContact OH-O 3.12Å; G181-K462 PolarHBondContact O-NZ 2.88Å; M182-K462 HydrophobicContact CB-CD 4.38Å; M182-K462 HydrophobicContact CE-CB 4.33Å; V183-K462 VanDerWaalsContact N-NZ 3.17Å; F459-K462 WeakPolarHBondContact O-CB 3.01Å; F459-K462 PolarHBondContact O-N 2.83Å
463	K	85.4	Confident	77.8	Confident	77 Å²	77	43 Å²	43	34%	0.335	25%	0.254	S	S	.	.	P	Polyproline II helix	trans	-96.8	139.3	172.9	-48.5	-153.3	-65.1	-174.2	0	108.3	T438 P440 R442 D443	T438-K463 WeakPolarHBondContact O-CA 3.48Å; P440-K463 PolarHBondContact O-NZ 2.62Å; R442-K463 VanDerWaalsContact CD-CD 3.41Å; R442-K463 HydrophobicContact CG-CD 3.9Å; D443-K463 WeakPolarHBondContact OD2-CE 3.4Å; D443-K463 IonicContact OD2-NZ 2.71Å; D443-K463 PolarHBondContact OD2-NZ 2.86Å
464	M	78.3	Confident	77.9	Confident	4 Å²	4	43.5 Å²	43.5	2%	0.02	26%	0.257	C	S	.	.	P	Polyproline II helix	trans	-65	150.7	168.6	-73.3	-65	-67.3	0	0	110.3	Y164 M177 M182 W434 T438 E468 V469	Y164-M464 HydrophobicContact CD1-SD 4.38Å; Y164-M464 HydrophobicContact CE1-SD 4.14Å; M177-M464 HydrophobicContact CE-CE 3.72Å; M177-M464 HydrophobicContact CE-SD 3.98Å; M182-M464 HydrophobicContact CE-SD 4.14Å; W434-M464 HydrophobicContact CD2-CE 3.62Å; W434-M464 HydrophobicContact CD2-CG 4.45Å; W434-M464 HydrophobicContact CD2-SD 4.31Å; W434-M464 HydrophobicContact CE3-CE 3.58Å; W434-M464 HydrophobicContact CE3-CG 4.34Å; W434-M464 HydrophobicContact CE3-SD 3.83Å; W434-M464 HydrophobicContact CG-CE 4.42Å; W434-M464 HydrophobicContact CH2-CE 3.63Å; W434-M464 HydrophobicContact CZ2-CE 3.61Å; W434-M464 HydrophobicContact CZ3-CE 3.6Å; W434-M464 HydrophobicContact CZ3-SD 3.98Å; T438-M464 PolarHBondContact O-N 3.24Å; M464-E468 HydrophobicContact CE-CB 3.83Å; M464-E468 HydrophobicContact CE-CG 4.04Å; M464-V469 HydrophobicContact CB-CG2 3.44Å; M464-V469 VanDerWaalsContact CB-CG2 3.44Å; M464-V469 HydrophobicContact CE-CG2 4.04Å; M464-V469 HydrophobicContact CG-CG2 4.06Å
465	D	74.8	Confident	78.2	Confident	62 Å²	62	44.1 Å²	44.1	33%	0.332	26%	0.262	S	S	.	.	P	Polyproline II helix	trans	-71.7	138.5	176.1	177.1	-111.9	0	0	0	110.4	K180 G467 E468	K180-D465 HydrophobicContact CD-CB 3.9Å; K180-D465 VanDerWaalsContact NZ-CG 3.34Å; K180-D465 IonicContact NZ-OD1 2.65Å; K180-D465 PolarHBondContact NZ-OD1 2.87Å; D465-G467 PolarHBondContact O-N 2.83Å; D465-G467 PolarHBondContact OD1-N 3.31Å; D465-E468 HydrophobicContact CB-CG 4.27Å; D465-E468 PolarHBondContact O-N 2.94Å
466	P	67.5	Low	78.9	Confident	55 Å²	55	36 Å²	36	36%	0.357	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.5	-28.1	177.7	-31.6	37.7	0	0	0	114.8	R330 P440 E468	R330-P466 PolarHBondContact NH1-O 2.84Å; P440-P466 HydrophobicContact CB-CG 4.22Å; P440-P466 HydrophobicContact CG-CG 4.1Å; P466-E468 VanDerWaalsContact C-N 3.27Å; P466-E468 PolarHBondContact O-N 2.75Å
467	G	69.4	Low	79.8	Confident	39 Å²	39	35.2 Å²	35.2	40%	0.402	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-29.4	177.7	0	0	0	0	0	114.3	A334 D465	A334-G467 WeakPolarHBondContact CB-O 3.16Å; D465-G467 PolarHBondContact O-N 2.83Å; D465-G467 PolarHBondContact OD1-N 3.31Å
468	E	72.6	Confident	80.5	Confident	15 Å²	15	34.8 Å²	34.8	7%	0.07	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.4	-17.7	-173.4	-42.7	-61.5	148.5	0	0	113.4	K180 A334 Y335 M464 D465 P466	K180-E468 IonicContact NZ-OE1 2.67Å; K180-E468 PolarHBondContact NZ-OE1 3.39Å; A334-E468 VanDerWaalsContact CB-C 3.49Å; A334-E468 PolarHBondContact N-O 2.77Å; Y335-E468 WeakPolarHBondContact CE2-OE2 3.5Å; Y335-E468 PolarHBondContact OH-OE2 2.68Å; M464-E468 HydrophobicContact CE-CB 3.83Å; M464-E468 HydrophobicContact CE-CG 4.04Å; D465-E468 HydrophobicContact CB-CG 4.27Å; D465-E468 PolarHBondContact O-N 2.94Å; P466-E468 VanDerWaalsContact C-N 3.27Å; P466-E468 PolarHBondContact O-N 2.75Å
469	V	74.6	Confident	81.1	Confident	1 Å²	1	33.3 Å²	33.3	1%	0.006	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	146.8	-159.9	-156.4	0	0	0	0	113.7	R330 A331 A332 W434 M464	R330-V469 VanDerWaalsContact C-CG1 3.43Å; R330-V469 HydrophobicContact CB-CB 4.19Å; R330-V469 HydrophobicContact CB-CG1 4.43Å; R330-V469 WeakPolarHBondContact CB-O 3.01Å; R330-V469 VanDerWaalsContact CD-O 3.22Å; R330-V469 WeakPolarHBondContact CD-O 3.4Å; R330-V469 WeakPolarHBondContact CG-O 3.48Å; R330-V469 VanDerWaalsContact O-CG1 3.27Å; R330-V469 WeakPolarHBondContact O-CG1 3.36Å; A331-V469 VanDerWaalsContact CA-CG1 3.4Å; A331-V469 WeakPolarHBondContact O-CG1 3.38Å; A332-V469 CarbonylContact O-C 3.52Å; A332-V469 WeakPolarHBondContact O-CA 3.31Å; A332-V469 WeakPolarHBondContact O-CG1 3.14Å; W434-V469 HydrophobicContact CG-CG2 4.36Å; M464-V469 HydrophobicContact CB-CG2 3.44Å; M464-V469 VanDerWaalsContact CB-CG2 3.44Å; M464-V469 HydrophobicContact CE-CG2 4.04Å; M464-V469 HydrophobicContact CG-CG2 4.06Å
470	N	78.8	Confident	81.9	Confident	56 Å²	56	33 Å²	33	30%	0.299	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.1	121.4	-173.3	-173.9	3	0	0	0	112.4	A331 A332 A334 L472	A331-N470 VanDerWaalsContact N-C 3.28Å; A332-N470 WeakPolarHBondContact CA-O 3.45Å; A332-N470 VanDerWaalsContact CB-O 3.28Å; A332-N470 WeakPolarHBondContact CB-O 3.4Å; A332-N470 PolarHBondContact N-O 2.76Å; A332-N470 PolarHBondContact O-N 2.97Å; A334-N470 HydrophobicContact CB-CB 4.32Å; N470-L472 VanDerWaalsContact C-N 3.34Å; N470-L472 WeakPolarHBondContact ND2-CD2 3.18Å; N470-L472 PolarHBondContact OD1-N 3.33Å
471	S	74.9	Confident	82.5	Confident	0 Å²	0	33 Å²	33	0%	0	20%	0.201	C	C	.	.			trans	-90.6	0.7	-179.2	71.4	0	0	0	0	112.9	K329 R330 A331 G473 E474	K329-S471 VanDerWaalsContact CB-OG 3.26Å; K329-S471 WeakPolarHBondContact CB-OG 3.07Å; K329-S471 WeakPolarHBondContact O-CB 3.23Å; K329-S471 PolarHBondContact O-N 2.85Å; K329-S471 PolarHBondContact O-OG 2.82Å; R330-S471 VanDerWaalsContact CA-N 3.29Å; A331-S471 VanDerWaalsContact N-N 3.18Å; S471-G473 PolarHBondContact O-N 3.06Å; S471-G473 VanDerWaalsContact O-N 3.12Å; S471-E474 WeakPolarHBondContact O-CB 3.24Å; S471-E474 WeakPolarHBondContact O-CG 3.38Å; S471-E474 PolarHBondContact O-N 2.79Å; S471-E474 PolarHBondContact OG-O 2.81Å
472	L	82.4	Confident	82.9	Confident	42 Å²	42	32.7 Å²	32.7	22%	0.22	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.7	29.8	179	-51	167.3	0	0	0	112.4	N470 Q522 K525 L526	N470-L472 VanDerWaalsContact C-N 3.34Å; N470-L472 WeakPolarHBondContact ND2-CD2 3.18Å; N470-L472 PolarHBondContact OD1-N 3.33Å; L472-Q522 HydrophobicContact CD1-CG 4.23Å; L472-Q522 WeakPolarHBondContact CD1-O 3.44Å; L472-K525 HydrophobicContact CB-CB 3.87Å; L472-K525 HydrophobicContact CB-CD 3.91Å; L472-K525 HydrophobicContact CD1-CB 3.74Å; L472-K525 HydrophobicContact CG-CB 4.38Å; L472-K525 VanDerWaalsContact O-CD 3.31Å; L472-K525 WeakPolarHBondContact O-CD 3.35Å; L472-K525 PolarHBondContact O-NZ 3.01Å; L472-L526 HydrophobicContact CD1-CB 3.67Å; L472-L526 HydrophobicContact CD1-CD1 4.28Å
473	G	79.5	Confident	83.4	Confident	64 Å²	64	30 Å²	30	66%	0.66	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	84.1	1.1	-179.2	0	0	0	0	0	115.2	S471	S471-G473 PolarHBondContact O-N 3.06Å; S471-G473 VanDerWaalsContact O-N 3.12Å
474	E	86	Confident	83.5	Confident	13 Å²	13	26.7 Å²	26.7	6%	0.061	17%	0.173	C	C	.	.			trans	-68.4	149.3	-179.7	-68.4	-59.9	121.2	0	0	113.3	R439 S471 R521 Q522 K525	R439-E474 PolarHBondContact NH2-O 3.45Å; S471-E474 WeakPolarHBondContact O-CB 3.24Å; S471-E474 WeakPolarHBondContact O-CG 3.38Å; S471-E474 PolarHBondContact O-N 2.79Å; S471-E474 PolarHBondContact OG-O 2.81Å; E474-R521 IonicContact OE1-NE 3.87Å; E474-R521 IonicContact OE2-CZ 3.17Å; E474-R521 IonicContact OE2-NE 3.94Å; E474-R521 PolarHBondContact OE2-NE 2.63Å; E474-R521 IonicContact OE2-NH2 2.78Å; E474-R521 PolarHBondContact OE2-NH2 3.41Å; E474-Q522 HydrophobicContact CG-CB 4.08Å; E474-Q522 HydrophobicContact CG-CG 4.18Å; E474-K525 WeakPolarHBondContact OE1-CE 3.36Å; E474-K525 IonicContact OE1-NZ 3.16Å; E474-K525 PolarHBondContact OE1-NZ 3.41Å
475	P	88.2	Confident	84	Confident	75 Å²	75	27 Å²	27	49%	0.487	18%	0.177	S	C	.	.			trans	-63.1	177.9	168.6	30.4	-36.5	0	0	0	111.5	R439	R439-P475 PolarHBondContact NH1-O 2.88Å; R439-P475 PolarHBondContact NH2-O 2.95Å
476	Y	90.4	Very high	84.7	Confident	13 Å²	13	27.3 Å²	27.3	5%	0.051	18%	0.175	C	C	.	.			trans	-78.2	129	170.6	-169.1	-79.8	0	0	0	109.6	E436 H437 R442 H445 V446 Y478 H483	E436-Y476 HydrophobicContact CG-CE1 4.28Å; E436-Y476 HydrophobicContact CG-CE2 4.35Å; E436-Y476 WeakPolarHBondContact O-CE2 3.29Å; E436-Y476 WeakPolarHBondContact OE1-CA 3.29Å; H437-Y476 WeakPolarHBondContact CA-OH 3.37Å; R442-Y476 HydrophobicContact CB-CE2 3.96Å; H445-Y476 HydrophobicContact CB-CD1 3.84Å; H445-Y476 HydrophobicContact CB-CD2 3.72Å; H445-Y476 HydrophobicContact CB-CE1 4.28Å; H445-Y476 HydrophobicContact CB-CE2 4.17Å; H445-Y476 HydrophobicContact CB-CG 3.55Å; H445-Y476 VanDerWaalsContact CD2-CB 3.44Å; H445-Y476 WeakPolarHBondContact CD2-CB 3.48Å; H445-Y476 AromaticContact CD2-CD2 3.78Å; H445-Y476 AromaticContact CD2-CG 3.82Å; H445-Y476 AromaticContact CG-CD2 3.87Å; H445-Y476 AromaticContact CG-CG 3.59Å; V446-Y476 HydrophobicContact CG1-CE1 4.1Å; Y476-Y478 AromaticContact CD1-CD1 3.93Å; Y476-Y478 HydrophobicContact CD1-CD1 3.93Å; Y476-Y478 HydrophobicContact CD1-CD2 4.47Å; Y476-Y478 AromaticContact CD1-CE1 3.9Å; Y476-Y478 HydrophobicContact CD1-CE1 3.9Å; Y476-Y478 HydrophobicContact CD1-CE2 4.45Å; Y476-Y478 HydrophobicContact CD1-CG 4.23Å; Y476-Y478 AromaticContact CE1-CD1 3.76Å; Y476-Y478 HydrophobicContact CE1-CD1 3.76Å; Y476-Y478 AromaticContact CE1-CE1 3.9Å; Y476-Y478 HydrophobicContact CE1-CE1 3.9Å; Y476-Y478 HydrophobicContact CE1-CG 4.37Å; Y476-H483 AromaticContact CE1-CD2 3.76Å; Y476-H483 AromaticContact CE1-NE2 3.56Å; Y476-H483 AromaticContact CZ-CD2 3.88Å; Y476-H483 AromaticContact CZ-NE2 3.59Å; Y476-H483 PolarHBondContact OH-CD2 2.88Å; Y476-H483 PolarHBondContact OH-NE2 2.88Å
477	D	92	Very high	85.5	Confident	28 Å²	28	25.8 Å²	25.8	15%	0.15	17%	0.17	C	C	.	.			trans	-109.8	96.8	-177.1	-166.1	-20.4	0	0	0	111.9	E436 S479 S480 S516 G518	E436-D477 WeakPolarHBondContact CG-O 3.4Å; E436-D477 PolarHBondContact OE1-N 2.88Å; D477-S479 PolarHBondContact O-N 3.41Å; D477-S479 WeakPolarHBondContact OD1-CA 3.46Å; D477-S479 WeakPolarHBondContact OD1-CB 3.38Å; D477-S479 PolarHBondContact OD1-N 2.71Å; D477-S480 VanDerWaalsContact O-CB 3.29Å; D477-S480 WeakPolarHBondContact O-CB 3.48Å; D477-S480 PolarHBondContact O-N 3.2Å; D477-S480 VanDerWaalsContact O-N 3.11Å; D477-S480 PolarHBondContact OD1-N 3.49Å; D477-S516 VanDerWaalsContact OD2-CB 3.24Å; D477-S516 WeakPolarHBondContact OD2-CB 3.45Å; D477-S516 PolarHBondContact OD2-OG 3.41Å; D477-G518 WeakPolarHBondContact OD2-CA 3.46Å; D477-G518 PolarHBondContact OD2-N 3.09Å
478	Y	92.2	Very high	86.1	Confident	34 Å²	34	24.8 Å²	24.8	13%	0.133	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-30.1	174.2	-60.3	-74.9	0	0	0	113.2	H445 V446 Y476 P500 A502 P507 I509	H445-Y478 HydrophobicContact CB-CE1 4.43Å; H445-Y478 WeakPolarHBondContact O-CE1 3.32Å; H445-Y478 PolarHBondContact O-OH 2.92Å; V446-Y478 HydrophobicContact CG1-CD1 4.42Å; V446-Y478 HydrophobicContact CG1-CE1 4Å; Y476-Y478 AromaticContact CD1-CD1 3.93Å; Y476-Y478 HydrophobicContact CD1-CD1 3.93Å; Y476-Y478 HydrophobicContact CD1-CD2 4.47Å; Y476-Y478 AromaticContact CD1-CE1 3.9Å; Y476-Y478 HydrophobicContact CD1-CE1 3.9Å; Y476-Y478 HydrophobicContact CD1-CE2 4.45Å; Y476-Y478 HydrophobicContact CD1-CG 4.23Å; Y476-Y478 AromaticContact CE1-CD1 3.76Å; Y476-Y478 HydrophobicContact CE1-CD1 3.76Å; Y476-Y478 AromaticContact CE1-CE1 3.9Å; Y476-Y478 HydrophobicContact CE1-CE1 3.9Å; Y476-Y478 HydrophobicContact CE1-CG 4.37Å; Y478-P500 HydrophobicContact CD1-CB 4.1Å; Y478-P500 HydrophobicContact CD1-CG 4.25Å; Y478-P500 HydrophobicContact CE1-CB 3.81Å; Y478-P500 HydrophobicContact CE1-CG 4.41Å; Y478-A502 HydrophobicContact CE2-CB 3.89Å; Y478-A502 WeakPolarHBondContact OH-CB 3.49Å; Y478-P507 HydrophobicContact CD1-CG 3.9Å; Y478-P507 HydrophobicContact CD2-CB 4.1Å; Y478-P507 HydrophobicContact CD2-CG 3.59Å; Y478-P507 HydrophobicContact CE1-CG 4.24Å; Y478-P507 HydrophobicContact CE2-CG 3.95Å; Y478-P507 HydrophobicContact CG-CB 4.03Å; Y478-P507 HydrophobicContact CG-CG 3.55Å; Y478-I509 HydrophobicContact CD1-CG2 3.84Å; Y478-I509 HydrophobicContact CG-CG2 4.28Å; Y478-I509 WeakPolarHBondContact O-CA 3.39Å
479	S	91.6	Very high	86.6	Confident	49 Å²	49	24.8 Å²	24.8	34%	0.343	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.9	-0.1	-178.9	-62.3	0	0	0	0	113.8	D477 I481 Q511	D477-S479 PolarHBondContact O-N 3.41Å; D477-S479 WeakPolarHBondContact OD1-CA 3.46Å; D477-S479 WeakPolarHBondContact OD1-CB 3.38Å; D477-S479 PolarHBondContact OD1-N 2.71Å; S479-I481 PolarHBondContact O-N 3.05Å; S479-Q511 WeakPolarHBondContact O-CG 3.47Å; S479-Q511 PolarHBondContact O-NE2 2.8Å
480	S	93.7	Very high	87.1	Confident	2 Å²	2	26.3 Å²	26.3	1%	0.014	17%	0.168	C	C	.	.			trans	-51.2	135.4	176.6	173.4	0	0	0	0	111.4	D477 M482 H483 D519	D477-S480 VanDerWaalsContact O-CB 3.29Å; D477-S480 WeakPolarHBondContact O-CB 3.48Å; D477-S480 PolarHBondContact O-N 3.2Å; D477-S480 VanDerWaalsContact O-N 3.11Å; D477-S480 PolarHBondContact OD1-N 3.49Å; S480-M482 PolarHBondContact O-N 3.4Å; S480-M482 VanDerWaalsContact O-N 3.16Å; S480-M482 WeakPolarHBondContact OG-CB 3.34Å; S480-M482 PolarHBondContact OG-N 3.35Å; S480-H483 WeakPolarHBondContact O-CB 3.29Å; S480-H483 PolarHBondContact O-N 3.13Å; S480-D519 WeakPolarHBondContact CA-OD1 3.26Å; S480-D519 VanDerWaalsContact CB-OD1 3.24Å; S480-D519 WeakPolarHBondContact CB-OD1 3.08Å; S480-D519 PolarHBondContact OG-OD1 2.8Å
481	I	93.2	Very high	87.3	Confident	0 Å²	0	27.3 Å²	27.3	0%	0	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-27.7	171.3	-163.5	74.3	0	0	0	110.5	I424 H425 S479 H483 R512 L515 D519	I424-I481 HydrophobicContact CG2-CG1 4.02Å; I424-I481 HydrophobicContact CG2-CG2 4.4Å; H425-I481 HydrophobicContact CB-CG1 4.19Å; H425-I481 PolarHBondContact CE1-O 2.87Å; H425-I481 PolarHBondContact ND1-O 3.15Å; S479-I481 PolarHBondContact O-N 3.05Å; I481-H483 VanDerWaalsContact C-N 3.29Å; I481-H483 PolarHBondContact O-N 2.81Å; I481-R512 VanDerWaalsContact O-CZ 3.25Å; I481-R512 PolarHBondContact O-NH1 2.91Å; I481-L515 HydrophobicContact CG2-CD2 4Å; I481-D519 WeakPolarHBondContact CG2-OD2 3.47Å; I481-D519 PolarHBondContact N-OD2 3.36Å
482	M	92.4	Very high	87.2	Confident	2 Å²	2	32.5 Å²	32.5	1%	0.01	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81	0.6	179.9	-51.4	-49.7	-59.2	0	0	114	H425 H429 F433 H435 E436 S480	H425-M482 WeakPolarHBondContact O-CE 3.37Å; H429-M482 WeakPolarHBondContact CE1-CE 3.35Å; H429-M482 VanDerWaalsContact ND1-CE 3.35Å; H429-M482 WeakPolarHBondContact ND1-CE 3.14Å; F433-M482 HydrophobicContact CB-CE 4.25Å; F433-M482 HydrophobicContact CB-CG 3.86Å; F433-M482 HydrophobicContact CB-SD 4.39Å; F433-M482 HydrophobicContact CG-CG 4.34Å; H435-M482 VanDerWaalsContact CA-O 3.23Å; H435-M482 WeakPolarHBondContact CA-O 3.23Å; H435-M482 WeakPolarHBondContact CB-O 3.39Å; H435-M482 PolarHBondContact CD2-O 2.72Å; E436-M482 PolarHBondContact N-O 3.03Å; S480-M482 PolarHBondContact O-N 3.4Å; S480-M482 VanDerWaalsContact O-N 3.16Å; S480-M482 WeakPolarHBondContact OG-CB 3.34Å; S480-M482 PolarHBondContact OG-N 3.35Å
483	H	93.1	Very high	86.6	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	22%	0.224	C	C	.	.	S	Bend	trans	-83.8	142.5	176	-157.8	-68.8	0	0	0	111.1	E436 Y476 S480 I481 G510 R512	E436-H483 HydrophobicContact CB-CB 4.17Å; Y476-H483 AromaticContact CE1-CD2 3.76Å; Y476-H483 AromaticContact CE1-NE2 3.56Å; Y476-H483 AromaticContact CZ-CD2 3.88Å; Y476-H483 AromaticContact CZ-NE2 3.59Å; Y476-H483 PolarHBondContact OH-CD2 2.88Å; Y476-H483 PolarHBondContact OH-NE2 2.88Å; S480-H483 WeakPolarHBondContact O-CB 3.29Å; S480-H483 PolarHBondContact O-N 3.13Å; I481-H483 VanDerWaalsContact C-N 3.29Å; I481-H483 PolarHBondContact O-N 2.81Å; H483-G510 WeakPolarHBondContact O-CA 3.39Å; H483-R512 PolarHBondContact O-NH1 2.82Å; H483-R512 PolarHBondContact O-NH2 2.79Å
484	Y	88.9	Confident	86.3	Confident	6 Å²	6	35.5 Å²	35.5	2%	0.024	21%	0.21	C	C	.	.	P	Polyproline II helix	trans	-71.3	154.2	168.7	-81.7	-0.6	0	0	0	112.2	G165 H435 H437 N460 T488 F489 G510	G165-Y484 WeakPolarHBondContact CA-OH 3.04Å; H435-Y484 AromaticContact CD2-CE1 3.69Å; H435-Y484 AromaticContact CE1-CE1 3.57Å; H435-Y484 AromaticContact CE1-CZ 3.8Å; H435-Y484 PolarHBondContact CE1-OH 3.35Å; H435-Y484 AromaticContact CG-CE1 3.95Å; H435-Y484 AromaticContact ND1-CE1 3.89Å; H435-Y484 AromaticContact ND1-CZ 3.97Å; H435-Y484 AromaticContact NE2-CE1 3.43Å; H435-Y484 WeakPolarHBondContact NE2-CE1 3.2Å; H437-Y484 AromaticContact CE1-CD1 3.66Å; H437-Y484 AromaticContact CE1-CD2 3.11Å; H437-Y484 WeakPolarHBondContact CE1-CD2 3.32Å; H437-Y484 AromaticContact CE1-CE1 3.83Å; H437-Y484 AromaticContact CE1-CE2 3.26Å; H437-Y484 WeakPolarHBondContact CE1-CE2 3.44Å; H437-Y484 AromaticContact CE1-CG 3.31Å; H437-Y484 AromaticContact CE1-CZ 3.64Å; H437-Y484 AromaticContact ND1-CD1 3.98Å; H437-Y484 AromaticContact ND1-CD2 3.75Å; H437-Y484 AromaticContact ND1-CG 3.56Å; H437-Y484 AromaticContact NE2-CD2 3.34Å; H437-Y484 VanDerWaalsContact NE2-CD2 3.34Å; H437-Y484 WeakPolarHBondContact NE2-CD2 3.21Å; H437-Y484 AromaticContact NE2-CE2 3.42Å; H437-Y484 WeakPolarHBondContact NE2-CE2 3.2Å; H437-Y484 AromaticContact NE2-CG 3.98Å; N460-Y484 HydrophobicContact CB-CE2 4.33Å; Y484-T488 HydrophobicContact CD2-CG2 4.18Å; Y484-T488 HydrophobicContact CG-CG2 4.37Å; Y484-F489 HydrophobicContact CD2-CE2 4.26Å; Y484-F489 HydrophobicContact CE2-CD2 4.28Å; Y484-F489 AromaticContact CE2-CE2 3.61Å; Y484-F489 HydrophobicContact CE2-CE2 3.61Å; Y484-G510 WeakPolarHBondContact O-CA 3.38Å
485	A	87.9	Confident	85.6	Confident	12 Å²	12	40.4 Å²	40.4	10%	0.099	24%	0.237	C	C	.	.	P	Polyproline II helix	trans	-68.7	154.8	173.6	0	0	0	0	0	111.3	G487 T488	A485-G487 PolarHBondContact O-N 3.21Å; A485-T488 PolarHBondContact N-OG1 3.02Å; A485-T488 VanDerWaalsContact N-OG1 3.16Å; A485-T488 PolarHBondContact O-N 2.76Å; A485-T488 VanDerWaalsContact O-N 3.14Å; A485-T488 PolarHBondContact O-OG1 2.77Å
486	K	89.2	Confident	85.5	Confident	68 Å²	68	39.1 Å²	39.1	30%	0.296	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50	-31.9	-178	66.9	-173.9	175.7	-61.9	0	114.5	E195 E496 T497 I498 I509	E195-K486 IonicContact OE1-NZ 2.78Å; E195-K486 PolarHBondContact OE1-NZ 3.18Å; E195-K486 IonicContact OE2-NZ 2.68Å; E195-K486 PolarHBondContact OE2-NZ 3.39Å; K486-E496 CarbonylContact O-C 3.59Å; K486-E496 WeakPolarHBondContact O-CA 3.42Å; K486-T497 PolarHBondContact O-N 3.38Å; K486-T497 PolarHBondContact O-OG1 2.78Å; K486-I498 PolarHBondContact O-N 2.92Å; K486-I498 VanDerWaalsContact O-N 3.12Å; K486-I509 HydrophobicContact CB-CD1 3.89Å; K486-I509 HydrophobicContact CB-CG1 3.99Å
487	G	84.4	Confident	85.5	Confident	23 Å²	23	38.5 Å²	38.5	24%	0.237	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112.8	11.5	-174.7	0	0	0	0	0	114.9	A485 F489 A490 D495	A485-G487 PolarHBondContact O-N 3.21Å; G487-F489 PolarHBondContact O-N 3.31Å; G487-A490 WeakPolarHBondContact O-CB 2.99Å; G487-A490 PolarHBondContact O-N 3.45Å; G487-D495 WeakPolarHBondContact CA-O 3.45Å
488	T	83.1	Confident	85.4	Confident	18 Å²	18	37.1 Å²	37.1	11%	0.11	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.7	134.7	177.8	-47.6	0	0	0	0	109.6	F461 Y484 A485 A490 T497	F461-T488 WeakPolarHBondContact CZ-O 3.33Å; Y484-T488 HydrophobicContact CD2-CG2 4.18Å; Y484-T488 HydrophobicContact CG-CG2 4.37Å; A485-T488 PolarHBondContact N-OG1 3.02Å; A485-T488 VanDerWaalsContact N-OG1 3.16Å; A485-T488 PolarHBondContact O-N 2.76Å; A485-T488 VanDerWaalsContact O-N 3.14Å; A485-T488 PolarHBondContact O-OG1 2.77Å; T488-A490 VanDerWaalsContact C-N 3.25Å; T488-A490 PolarHBondContact O-N 3.38Å; T488-T497 WeakPolarHBondContact O-CB 3.38Å; T488-T497 WeakPolarHBondContact O-CG2 3.42Å; T488-T497 PolarHBondContact O-OG1 3.31Å
489	F	81.7	Confident	85.4	Confident	15 Å²	15	39.4 Å²	39.4	7%	0.066	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.6	22.7	-171.4	-51	-75.7	0	0	0	116.2	L189 I191 V453 V454 Q457 N460 F461 Y484 G487	L189-F489 HydrophobicContact CB-CE1 4.47Å; L189-F489 HydrophobicContact CD1-CE1 3.77Å; L189-F489 HydrophobicContact CD1-CZ 3.72Å; L189-F489 HydrophobicContact CD2-CE1 4.2Å; L189-F489 HydrophobicContact CG-CE1 4.36Å; I191-F489 HydrophobicContact CD1-CD1 3.65Å; I191-F489 HydrophobicContact CD1-CE1 3.44Å; I191-F489 VanDerWaalsContact CD1-CE1 3.44Å; I191-F489 HydrophobicContact CD1-CZ 4.33Å; I191-F489 HydrophobicContact CG1-CE1 4.48Å; V453-F489 CarbonylContact C-O 3.57Å; V453-F489 WeakPolarHBondContact CA-O 3.43Å; V453-F489 HydrophobicContact CG1-CB 4.08Å; V454-F489 PolarHBondContact N-O 3.46Å; Q457-F489 HydrophobicContact CB-CB 4.2Å; Q457-F489 HydrophobicContact CB-CD1 3.96Å; Q457-F489 HydrophobicContact CB-CG 4.22Å; Q457-F489 HydrophobicContact CG-CD1 4.02Å; N460-F489 HydrophobicContact CB-CD2 4.28Å; N460-F489 HydrophobicContact CB-CE2 3.94Å; N460-F489 HydrophobicContact CB-CZ 4.44Å; F461-F489 HydrophobicContact CE2-CB 3.91Å; F461-F489 AromaticContact CE2-CD2 3.71Å; F461-F489 HydrophobicContact CE2-CD2 3.71Å; F461-F489 HydrophobicContact CE2-CG 4.12Å; F461-F489 HydrophobicContact CZ-CB 4.02Å; F461-F489 AromaticContact CZ-CD2 3.7Å; F461-F489 HydrophobicContact CZ-CD2 3.7Å; F461-F489 HydrophobicContact CZ-CG 4.31Å; Y484-F489 HydrophobicContact CD2-CE2 4.26Å; Y484-F489 HydrophobicContact CE2-CD2 4.28Å; Y484-F489 AromaticContact CE2-CE2 3.61Å; Y484-F489 HydrophobicContact CE2-CE2 3.61Å; G487-F489 PolarHBondContact O-N 3.31Å
490	A	84.6	Confident	85.4	Confident	32 Å²	32	37.5 Å²	37.5	26%	0.264	21%	0.209	S	C	.	.	B	Isolated β-bridge	trans	-62.6	138.8	174.5	0	0	0	0	0	113.6	G487 T488 K494 T497	G487-A490 WeakPolarHBondContact O-CB 2.99Å; G487-A490 PolarHBondContact O-N 3.45Å; T488-A490 VanDerWaalsContact C-N 3.25Å; T488-A490 PolarHBondContact O-N 3.38Å; A490-K494 VanDerWaalsContact CB-O 3.31Å; A490-K494 WeakPolarHBondContact CB-O 3.04Å; A490-T497 HydrophobicContact CB-CG2 4.08Å
491	K	84.1	Confident	85.3	Confident	77 Å²	77	41.6 Å²	41.6	34%	0.335	23%	0.227	S	C	.	.			trans	-64.7	136.6	158.8	-69.2	171.7	173.6	113.1	0	108.5	D451 N452 V453 V454 N493 K494	D451-K491 PolarHBondContact O-NZ 3.37Å; N452-K491 WeakPolarHBondContact O-CB 3.36Å; N452-K491 WeakPolarHBondContact O-CG 3.37Å; N452-K491 PolarHBondContact O-N 3.43Å; V453-K491 WeakPolarHBondContact O-CE 3.44Å; V453-K491 PolarHBondContact O-NZ 3.25Å; V454-K491 HydrophobicContact CG2-CG 4.31Å; K491-N493 PolarHBondContact O-N 2.72Å; K491-K494 PolarHBondContact O-N 3.36Å
492	A	72.6	Confident	84.9	Confident	109 Å²	109	43.5 Å²	43.5	90%	0.901	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.3	10.9	-171.9	0	0	0	0	0	118.5
493	N	70	Confident	84.1	Confident	87 Å²	87	47.7 Å²	47.7	47%	0.465	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-129	9.7	177.7	-88	-25.6	0	0	0	112.4	N205 K491	N205-N493 PolarHBondContact OD1-ND2 2.92Å; N205-N493 VanDerWaalsContact OD1-ND2 3.13Å; K491-N493 PolarHBondContact O-N 2.72Å
494	K	72.8	Confident	83.1	Confident	82 Å²	82	53.5 Å²	53.5	36%	0.357	31%	0.31	S	S	.	.			trans	-149	112.1	-174.8	-61.4	-169.3	-173.7	174.9	0	113.2	D451 N452 A490 K491 E496	D451-K494 PolarHBondContact O-NZ 3.44Å; N452-K494 HydrophobicContact CB-CB 4.18Å; N452-K494 HydrophobicContact CB-CD 3.78Å; N452-K494 WeakPolarHBondContact OD1-CD 3.32Å; N452-K494 WeakPolarHBondContact OD1-CE 3.49Å; N452-K494 PolarHBondContact OD1-NZ 2.04Å; A490-K494 VanDerWaalsContact CB-O 3.31Å; A490-K494 WeakPolarHBondContact CB-O 3.04Å; K491-K494 PolarHBondContact O-N 3.36Å; K494-E496 PolarHBondContact O-N 2.78Å
495	D	72.4	Confident	82.6	Confident	117 Å²	117	58.9 Å²	58.9	63%	0.626	35%	0.346	S	S	*	.	S	Bend	trans	-79.3	-10.3	-165.3	-47.9	7.7	0	0	0	116	G487	G487-D495 WeakPolarHBondContact CA-O 3.45Å
496	E	85.1	Confident	82.4	Confident	47 Å²	47	64.6 Å²	64.6	22%	0.22	37%	0.365	C	S	.	.			trans	-123.2	122.2	-179.1	-68.9	-178.5	159.1	0	0	111.3	L449 N452 K486 K494 R499 R506	L449-E496 HydrophobicContact CD1-CB 4.04Å; N452-E496 VanDerWaalsContact CB-O 3.25Å; N452-E496 WeakPolarHBondContact CB-O 3.05Å; N452-E496 PolarHBondContact ND2-O 3.42Å; K486-E496 CarbonylContact O-C 3.59Å; K486-E496 WeakPolarHBondContact O-CA 3.42Å; K494-E496 PolarHBondContact O-N 2.78Å; E496-R499 IonicContact OE2-CZ 3.15Å; E496-R499 IonicContact OE2-NE 2.8Å; E496-R499 PolarHBondContact OE2-NE 2.85Å; E496-R499 IonicContact OE2-NH2 3.71Å; E496-R499 PolarHBondContact OE2-NH2 2.02Å; E496-R506 IonicContact OE1-NH1 2.66Å; E496-R506 PolarHBondContact OE1-NH1 2.79Å
497	T	89.6	Confident	82.2	Confident	0 Å²	0	62.9 Å²	62.9	0%	0	36%	0.361	C	S	.	.	S	Bend	trans	-104	-30.9	162.9	52.2	0	0	0	0	112	L449 N452 V453 K486 T488 A490	L449-T497 PolarHBondContact N-O 3.34Å; N452-T497 HydrophobicContact CB-CG2 4.33Å; V453-T497 HydrophobicContact CB-CG2 4.49Å; V453-T497 HydrophobicContact CG2-CG2 3.82Å; K486-T497 PolarHBondContact O-N 3.38Å; K486-T497 PolarHBondContact O-OG1 2.78Å; T488-T497 WeakPolarHBondContact O-CB 3.38Å; T488-T497 WeakPolarHBondContact O-CG2 3.42Å; T488-T497 PolarHBondContact O-OG1 3.31Å; A490-T497 HydrophobicContact CB-CG2 4.08Å
498	I	91.6	Very high	82.3	Confident	0 Å²	0	66.7 Å²	66.7	0%	0	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	132	172.9	-48.7	179.6	0	0	0	109	H437 V446 I448 F461 K486 I509	H437-I498 HydrophobicContact CB-CD1 3.93Å; V446-I498 HydrophobicContact CB-CG2 3.87Å; V446-I498 HydrophobicContact CG1-CG2 3.89Å; V446-I498 HydrophobicContact CG2-CG2 4.26Å; I448-I498 HydrophobicContact CD1-CB 4.49Å; I448-I498 HydrophobicContact CD1-CG1 4.1Å; I448-I498 HydrophobicContact CD1-CG2 4.08Å; F461-I498 HydrophobicContact CD1-CD1 4.37Å; F461-I498 HydrophobicContact CD1-CG1 4.18Å; F461-I498 HydrophobicContact CE1-CD1 3.96Å; F461-I498 HydrophobicContact CE1-CG1 3.73Å; K486-I498 PolarHBondContact O-N 2.92Å; K486-I498 VanDerWaalsContact O-N 3.12Å; I498-I509 HydrophobicContact CB-CD1 3.97Å; I498-I509 HydrophobicContact CG2-CD1 3.96Å
499	R	90.9	Very high	82.6	Confident	81 Å²	81	66.9 Å²	66.9	31%	0.306	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	121.8	178.3	179.6	179.6	-67.8	156.1	1.4	111.5	V446 D447 L449 E496	V446-R499 CarbonylContact C-O 3.37Å; V446-R499 VanDerWaalsContact CA-O 3.26Å; V446-R499 WeakPolarHBondContact CA-O 3.37Å; D447-R499 PolarHBondContact N-O 2.7Å; D447-R499 PolarHBondContact O-N 3.45Å; L449-R499 HydrophobicContact CD1-CB 4.28Å; E496-R499 IonicContact OE2-CZ 3.15Å; E496-R499 IonicContact OE2-NE 2.8Å; E496-R499 PolarHBondContact OE2-NE 2.85Å; E496-R499 IonicContact OE2-NH2 3.71Å; E496-R499 PolarHBondContact OE2-NH2 2.02Å
500	P	92.4	Very high	82.8	Confident	10 Å²	10	66.6 Å²	66.6	7%	0.065	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.3	139.1	170	-25.7	36.3	0	0	0	113.2	Y478 P507 I509	Y478-P500 HydrophobicContact CD1-CB 4.1Å; Y478-P500 HydrophobicContact CD1-CG 4.25Å; Y478-P500 HydrophobicContact CE1-CB 3.81Å; Y478-P500 HydrophobicContact CE1-CG 4.41Å; P500-P507 HydrophobicContact CB-CG 3.86Å; P500-P507 HydrophobicContact CG-CG 4.25Å; P500-I509 HydrophobicContact CG-CD1 4.18Å; P500-I509 HydrophobicContact CG-CG1 4.33Å; P500-I509 HydrophobicContact CG-CG2 3.8Å
501	K	91.3	Very high	83	Confident	87 Å²	87	67.4 Å²	67.4	38%	0.378	38%	0.381	S	S	.	.	S	Bend	trans	-84.2	-32.5	172.5	-67.5	-174.9	172.7	-177.9	0	112.5	D443 H445 D447 C503	D443-K501 PolarHBondContact O-NZ 3.27Å; H445-K501 WeakPolarHBondContact O-CB 3.23Å; H445-K501 PolarHBondContact O-N 3.01Å; D447-K501 WeakPolarHBondContact OD1-CE 3.47Å; D447-K501 IonicContact OD1-NZ 3.92Å; D447-K501 PolarHBondContact OD1-NZ 2.91Å; D447-K501 WeakPolarHBondContact OD2-CE 3.22Å; D447-K501 IonicContact OD2-NZ 2.83Å; K501-C503 PolarHBondContact O-N 2.83Å
502	A	84.5	Confident	83.2	Confident	40 Å²	40	65.8 Å²	65.8	33%	0.331	37%	0.373	S	S	.	.			trans	-57.2	136.1	167.6	0	0	0	0	0	110.1	Y478 P507	Y478-A502 HydrophobicContact CE2-CB 3.89Å; Y478-A502 WeakPolarHBondContact OH-CB 3.49Å; A502-P507 HydrophobicContact CB-CG 4.14Å; A502-P507 WeakPolarHBondContact O-CD 3.43Å
503	C	76.9	Confident	83.8	Confident	91 Å²	91	66.2 Å²	66.2	62%	0.615	36%	0.359	S	S	*	.			trans	-134.3	163.5	-165.4	62.9	0	0	0	0	113.1	K501 P505	K501-C503 PolarHBondContact O-N 2.83Å; C503-P505 CarbonylContact C-O 3.57Å; C503-P505 VanDerWaalsContact C-O 3.25Å
504	C	72.2	Confident	84.8	Confident	121 Å²	121	66.6 Å²	66.6	82%	0.818	36%	0.358	S	S	*	.	S	Bend	trans	58.3	67.7	167.7	-57.7	0	0	0	0	116.8
505	P	77.3	Confident	85.8	Confident	120 Å²	120	62.9 Å²	62.9	78%	0.779	34%	0.342	S	S	*	.	S	Bend	cis	-79.9	161.2	-4.8	32.7	-35	0	0	0	112.2	C503	C503-P505 CarbonylContact C-O 3.57Å; C503-P505 VanDerWaalsContact C-O 3.25Å
506	R	83.5	Confident	86.8	Confident	132 Å²	132	57.5 Å²	57.5	50%	0.498	31%	0.313	S	S	.	.	P	Polyproline II helix	trans	-67.7	135.5	169.1	-68.6	-170.4	-170.4	140.8	9.3	108.9	E496	E496-R506 IonicContact OE1-NH1 2.66Å; E496-R506 PolarHBondContact OE1-NH1 2.79Å
507	P	85.4	Confident	87	Confident	32 Å²	32	59.2 Å²	59.2	21%	0.208	33%	0.329	C	S	.	.	P	Polyproline II helix	trans	-65	145.1	176.6	27.3	-34.3	0	0	0	110.9	Y478 P500 A502	Y478-P507 HydrophobicContact CD1-CG 3.9Å; Y478-P507 HydrophobicContact CD2-CB 4.1Å; Y478-P507 HydrophobicContact CD2-CG 3.59Å; Y478-P507 HydrophobicContact CE1-CG 4.24Å; Y478-P507 HydrophobicContact CE2-CG 3.95Å; Y478-P507 HydrophobicContact CG-CB 4.03Å; Y478-P507 HydrophobicContact CG-CG 3.55Å; P500-P507 HydrophobicContact CB-CG 3.86Å; P500-P507 HydrophobicContact CG-CG 4.25Å; A502-P507 HydrophobicContact CB-CG 4.14Å; A502-P507 WeakPolarHBondContact O-CD 3.43Å
508	P	86.1	Confident	87	Confident	103 Å²	103	59.4 Å²	59.4	67%	0.669	33%	0.331	S	S	*	.	P	Polyproline II helix	trans	-64.4	150	168.7	29.7	-34.5	0	0	0	110.3
509	I	90.4	Very high	87.1	Confident	21 Å²	21	59.7 Å²	59.7	11%	0.108	33%	0.332	C	S	.	.			trans	-134.7	142.2	179	50.4	165.2	0	0	0	112.5	Y478 K486 I498 P500	Y478-I509 HydrophobicContact CD1-CG2 3.84Å; Y478-I509 HydrophobicContact CG-CG2 4.28Å; Y478-I509 WeakPolarHBondContact O-CA 3.39Å; K486-I509 HydrophobicContact CB-CD1 3.89Å; K486-I509 HydrophobicContact CB-CG1 3.99Å; I498-I509 HydrophobicContact CB-CD1 3.97Å; I498-I509 HydrophobicContact CG2-CD1 3.96Å; P500-I509 HydrophobicContact CG-CD1 4.18Å; P500-I509 HydrophobicContact CG-CG1 4.33Å; P500-I509 HydrophobicContact CG-CG2 3.8Å
510	G	85.3	Confident	87.2	Confident	10 Å²	10	57.4 Å²	57.4	10%	0.103	33%	0.326	C	S	.	.			trans	74.4	38.6	175	0	0	0	0	0	115.1	H483 Y484 R512	H483-G510 WeakPolarHBondContact O-CA 3.39Å; Y484-G510 WeakPolarHBondContact O-CA 3.38Å; G510-R512 PolarHBondContact O-NH1 3.28Å
511	Q	89.3	Confident	87.1	Confident	48 Å²	48	61.2 Å²	61.2	22%	0.224	34%	0.339	C	S	.	.			trans	-59.1	153.4	168.8	63.8	81	16.5	0	0	111.6	S479 Q514	S479-Q511 WeakPolarHBondContact O-CG 3.47Å; S479-Q511 PolarHBondContact O-NE2 2.8Å; Q511-Q514 PolarHBondContact NE2-O 3.23Å; Q511-Q514 PolarHBondContact OE1-O 2.98Å
512	R	86.8	Confident	87.1	Confident	43 Å²	43	57.5 Å²	57.5	16%	0.162	32%	0.323	C	S	.	.			trans	-134.9	52.8	177.6	-69.8	-64.7	-178.6	-81.6	7.7	111.2	W192 G421 H425 I481 H483 G510	W192-R512 HydrophobicContact CH2-CG 4.2Å; W192-R512 VanDerWaalsContact CH2-NE 3.31Å; W192-R512 HydrophobicContact CZ3-CG 4.13Å; G421-R512 WeakPolarHBondContact CA-O 3.31Å; H425-R512 PolarHBondContact CE1-NH2 3.12Å; H425-R512 PolarHBondContact ND1-NH2 2.88Å; H425-R512 PolarHBondContact NE2-NH2 2.76Å; I481-R512 VanDerWaalsContact O-CZ 3.25Å; I481-R512 PolarHBondContact O-NH1 2.91Å; H483-R512 PolarHBondContact O-NH1 2.82Å; H483-R512 PolarHBondContact O-NH2 2.79Å; G510-R512 PolarHBondContact O-NH1 3.28Å
513	I	87	Confident	87.5	Confident	119 Å²	119	55.6 Å²	55.6	61%	0.61	31%	0.307	S	S	*	.	S	Bend	trans	-119	-54.9	-174.6	-56.6	176.9	0	0	0	111
514	Q	90.8	Very high	88.2	Confident	94 Å²	94	53.5 Å²	53.5	44%	0.439	29%	0.29	S	S	.	.	S	Bend	trans	-154.9	174.7	-170	59.8	176.5	63.6	0	0	112.2	H367 Q511	H367-Q514 VanDerWaalsContact NE2-CB 3.32Å; H367-Q514 WeakPolarHBondContact NE2-CB 3.23Å; Q511-Q514 PolarHBondContact NE2-O 3.23Å; Q511-Q514 PolarHBondContact OE1-O 2.98Å
515	L	92	Very high	89	Confident	4 Å²	4	52.1 Å²	52.1	2%	0.021	27%	0.27	C	S	.	.			trans	-70.2	143.4	170.4	-59.1	176.1	0	0	0	111.4	H367 W368 I424 I481 D519 I520	H367-L515 PolarHBondContact CE1-N 2.92Å; W368-L515 HydrophobicContact CD2-CD1 3.78Å; W368-L515 HydrophobicContact CD2-CD2 3.97Å; W368-L515 HydrophobicContact CD2-CG 4.45Å; W368-L515 HydrophobicContact CE3-CD1 3.46Å; W368-L515 VanDerWaalsContact CE3-CD1 3.46Å; W368-L515 HydrophobicContact CE3-CD2 3.97Å; W368-L515 HydrophobicContact CE3-CG 4.37Å; W368-L515 HydrophobicContact CG-CD1 4.37Å; W368-L515 HydrophobicContact CH2-CD1 4.39Å; W368-L515 HydrophobicContact CH2-CD2 3.42Å; W368-L515 VanDerWaalsContact CH2-CD2 3.42Å; W368-L515 HydrophobicContact CZ2-CD2 3.4Å; W368-L515 HydrophobicContact CZ3-CD1 3.78Å; W368-L515 HydrophobicContact CZ3-CD2 3.69Å; W368-L515 HydrophobicContact CZ3-CG 4.39Å; I424-L515 HydrophobicContact CG2-CD2 3.47Å; I424-L515 VanDerWaalsContact CG2-CD2 3.47Å; I424-L515 HydrophobicContact CG2-CG 4.14Å; I481-L515 HydrophobicContact CG2-CD2 4Å; L515-D519 HydrophobicContact CB-CB 4.29Å; L515-D519 HydrophobicContact CD2-CB 4.26Å; L515-I520 HydrophobicContact CB-CD1 4.16Å; L515-I520 HydrophobicContact CB-CG1 3.95Å; L515-I520 HydrophobicContact CD1-CG1 4.24Å
516	S	93.4	Very high	89.7	Confident	4 Å²	4	47.7 Å²	47.7	3%	0.028	24%	0.24	C	C	.	.			trans	-82.5	163.2	169	81	0	0	0	0	111.9	D477 G518 D519 I520	D477-S516 VanDerWaalsContact OD2-CB 3.24Å; D477-S516 WeakPolarHBondContact OD2-CB 3.45Å; D477-S516 PolarHBondContact OD2-OG 3.41Å; S516-G518 PolarHBondContact O-N 2.82Å; S516-G518 PolarHBondContact OG-N 2.87Å; S516-D519 PolarHBondContact N-OD2 2.87Å; S516-D519 PolarHBondContact O-N 2.88Å; S516-D519 PolarHBondContact OG-N 3.37Å; S516-D519 PolarHBondContact OG-OD2 3.24Å; S516-I520 WeakPolarHBondContact O-CD1 3.46Å; S516-I520 VanDerWaalsContact O-CG1 3.3Å; S516-I520 WeakPolarHBondContact O-CG1 3.25Å; S516-I520 PolarHBondContact O-N 3.24Å; S516-I520 VanDerWaalsContact O-N 3.09Å
517	P	89.8	Confident	90	Very high	84 Å²	84	42.6 Å²	42.6	55%	0.545	22%	0.221	S	C	.	.	H	α-helix	trans	-58.6	-30.3	169.9	-25.7	36.1	0	0	0	113.6	R521	P517-R521 WeakPolarHBondContact O-CG 3.29Å; P517-R521 PolarHBondContact O-N 3.29Å; P517-R521 PolarHBondContact O-NH1 3.32Å
518	G	90.2	Very high	90.2	Very high	4 Å²	4	47.7 Å²	47.7	4%	0.041	25%	0.245	C	C	.	.	H	α-helix	trans	-72	-44.2	173.8	0	0	0	0	0	113.1	D477 S516 I520 R521 Q522	D477-G518 WeakPolarHBondContact OD2-CA 3.46Å; D477-G518 PolarHBondContact OD2-N 3.09Å; S516-G518 PolarHBondContact O-N 2.82Å; S516-G518 PolarHBondContact OG-N 2.87Å; G518-I520 VanDerWaalsContact C-N 3.25Å; G518-I520 PolarHBondContact O-N 2.02Å; G518-R521 PolarHBondContact O-N 2.87Å; G518-Q522 VanDerWaalsContact O-CB 3.22Å; G518-Q522 WeakPolarHBondContact O-CB 3.43Å; G518-Q522 PolarHBondContact O-N 2.93Å
519	D	94.2	Very high	90.3	Very high	6 Å²	6	44 Å²	44	3%	0.032	22%	0.221	C	C	.	.	H	α-helix	trans	-53.9	-47	173.6	-61.9	-33.6	0	0	0	110	S480 I481 L515 S516 T523	S480-D519 WeakPolarHBondContact CA-OD1 3.26Å; S480-D519 VanDerWaalsContact CB-OD1 3.24Å; S480-D519 WeakPolarHBondContact CB-OD1 3.08Å; S480-D519 PolarHBondContact OG-OD1 2.8Å; I481-D519 WeakPolarHBondContact CG2-OD2 3.47Å; I481-D519 PolarHBondContact N-OD2 3.36Å; L515-D519 HydrophobicContact CB-CB 4.29Å; L515-D519 HydrophobicContact CD2-CB 4.26Å; S516-D519 PolarHBondContact N-OD2 2.87Å; S516-D519 PolarHBondContact O-N 2.88Å; S516-D519 PolarHBondContact OG-N 3.37Å; S516-D519 PolarHBondContact OG-OD2 3.24Å; D519-T523 WeakPolarHBondContact O-CB 3.49Å; D519-T523 PolarHBondContact O-N 2.81Å; D519-T523 PolarHBondContact O-OG1 2.94Å
520	I	92.3	Very high	90	Very high	33 Å²	33	45 Å²	45	17%	0.169	23%	0.229	C	C	.	.	H	α-helix	trans	-63	-53.9	179.7	-66.9	164.1	0	0	0	111.3	Y371 L515 S516 G518 Q522 T523 N524	Y371-I520 HydrophobicContact CD1-CD1 4.01Å; Y371-I520 HydrophobicContact CD2-CD1 4.44Å; Y371-I520 HydrophobicContact CG-CD1 3.81Å; Y371-I520 HydrophobicContact CG-CG1 4.4Å; Y371-I520 WeakPolarHBondContact O-CG2 3.37Å; L515-I520 HydrophobicContact CB-CD1 4.16Å; L515-I520 HydrophobicContact CB-CG1 3.95Å; L515-I520 HydrophobicContact CD1-CG1 4.24Å; S516-I520 WeakPolarHBondContact O-CD1 3.46Å; S516-I520 VanDerWaalsContact O-CG1 3.3Å; S516-I520 WeakPolarHBondContact O-CG1 3.25Å; S516-I520 PolarHBondContact O-N 3.24Å; S516-I520 VanDerWaalsContact O-N 3.09Å; G518-I520 VanDerWaalsContact C-N 3.25Å; G518-I520 PolarHBondContact O-N 2.02Å; I520-Q522 VanDerWaalsContact C-N 3.33Å; I520-Q522 PolarHBondContact O-N 3.45Å; I520-T523 PolarHBondContact O-N 3.06Å; I520-N524 WeakPolarHBondContact O-CB 3.32Å; I520-N524 VanDerWaalsContact O-CG 3.23Å; I520-N524 PolarHBondContact O-N 3.18Å; I520-N524 PolarHBondContact O-ND2 2.86Å
521	R	90.5	Very high	89.6	Confident	90 Å²	90	49.6 Å²	49.6	34%	0.34	27%	0.267	S	S	.	.	H	α-helix	trans	-63.3	-38.2	-179.8	-72	-171.8	-45.9	-90.2	-11.3	112.4	E474 P517 G518 N524 K525	E474-R521 IonicContact OE1-NE 3.87Å; E474-R521 IonicContact OE2-CZ 3.17Å; E474-R521 IonicContact OE2-NE 3.94Å; E474-R521 PolarHBondContact OE2-NE 2.63Å; E474-R521 IonicContact OE2-NH2 2.78Å; E474-R521 PolarHBondContact OE2-NH2 3.41Å; P517-R521 WeakPolarHBondContact O-CG 3.29Å; P517-R521 PolarHBondContact O-N 3.29Å; P517-R521 PolarHBondContact O-NH1 3.32Å; G518-R521 PolarHBondContact O-N 2.87Å; R521-N524 PolarHBondContact O-N 3.21Å; R521-K525 WeakPolarHBondContact O-CG 3.39Å; R521-K525 PolarHBondContact O-N 3.37Å
522	Q	91.4	Very high	89.4	Confident	9 Å²	9	48.9 Å²	48.9	4%	0.042	27%	0.266	C	S	.	.	H	α-helix	trans	-68.7	-40.7	179	-153.8	174.9	120.8	0	0	111.2	A331 A332 F433 L472 E474 G518 I520 K525 L526	A331-Q522 VanDerWaalsContact CB-OE1 3.3Å; A332-Q522 HydrophobicContact CB-CG 4.47Å; F433-Q522 HydrophobicContact CE1-CB 4.06Å; F433-Q522 HydrophobicContact CE1-CG 3.96Å; F433-Q522 HydrophobicContact CZ-CB 4.37Å; L472-Q522 HydrophobicContact CD1-CG 4.23Å; L472-Q522 WeakPolarHBondContact CD1-O 3.44Å; E474-Q522 HydrophobicContact CG-CB 4.08Å; E474-Q522 HydrophobicContact CG-CG 4.18Å; G518-Q522 VanDerWaalsContact O-CB 3.22Å; G518-Q522 WeakPolarHBondContact O-CB 3.43Å; G518-Q522 PolarHBondContact O-N 2.93Å; I520-Q522 VanDerWaalsContact C-N 3.33Å; I520-Q522 PolarHBondContact O-N 3.45Å; Q522-K525 PolarHBondContact O-N 3.35Å; Q522-L526 WeakPolarHBondContact O-CB 3.42Å; Q522-L526 PolarHBondContact O-N 3Å
523	T	92.9	Very high	89.3	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-61.8	-45.1	172.4	-51.7	0	0	0	0	111.2	W368 T372 L374 I431 F433 D519 I520 K525 L526 Y527	W368-T523 HydrophobicContact CZ3-CG2 4.32Å; W368-T523 WeakPolarHBondContact CZ3-OG1 3.48Å; T372-T523 HydrophobicContact CG2-CG2 3.84Å; L374-T523 HydrophobicContact CD1-CG2 3.72Å; L374-T523 HydrophobicContact CG-CG2 4.12Å; I431-T523 HydrophobicContact CG2-CG2 4.11Å; F433-T523 VanDerWaalsContact CE2-OG1 3.28Å; F433-T523 WeakPolarHBondContact CE2-OG1 3.46Å; F433-T523 WeakPolarHBondContact CZ-OG1 3.12Å; D519-T523 WeakPolarHBondContact O-CB 3.49Å; D519-T523 PolarHBondContact O-N 2.81Å; D519-T523 PolarHBondContact O-OG1 2.94Å; I520-T523 PolarHBondContact O-N 3.06Å; T523-K525 VanDerWaalsContact C-N 3.27Å; T523-K525 PolarHBondContact O-N 2.9Å; T523-L526 PolarHBondContact O-N 3.44Å; T523-Y527 HydrophobicContact CG2-CD2 4.07Å; T523-Y527 PolarHBondContact O-N 2.87Å
524	N	90.9	Very high	89.3	Confident	47 Å²	47	47.9 Å²	47.9	25%	0.251	27%	0.267	S	S	.	.	H	α-helix	trans	-65.9	-31.1	-177.9	-71.3	-15.3	0	0	0	112.5	Y371 T372 I520 R521 L528 C529	Y371-N524 PolarHBondContact O-ND2 3Å; T372-N524 WeakPolarHBondContact CA-OD1 3.36Å; T372-N524 VanDerWaalsContact CB-OD1 3.25Å; T372-N524 WeakPolarHBondContact CB-OD1 3.39Å; I520-N524 WeakPolarHBondContact O-CB 3.32Å; I520-N524 VanDerWaalsContact O-CG 3.23Å; I520-N524 PolarHBondContact O-N 3.18Å; I520-N524 PolarHBondContact O-ND2 2.86Å; R521-N524 PolarHBondContact O-N 3.21Å; N524-L528 PolarHBondContact O-N 2.61Å; N524-C529 VanDerWaalsContact CA-SG 3.56Å; N524-C529 HydrophobicContact CB-CB 3.92Å; N524-C529 PolarHBondContact O-N 2.83Å; N524-C529 PolarHBondContact OD1-SG 3.21Å
525	K	90.3	Very high	89.2	Confident	92 Å²	92	43.5 Å²	43.5	40%	0.4	25%	0.246	S	C	.	.	H	α-helix	trans	-73.9	-37	168.6	-72.9	173.8	167.8	-179.2	0	113.4	L472 E474 R521 Q522 T523 Y527	L472-K525 HydrophobicContact CB-CB 3.87Å; L472-K525 HydrophobicContact CB-CD 3.91Å; L472-K525 HydrophobicContact CD1-CB 3.74Å; L472-K525 HydrophobicContact CG-CB 4.38Å; L472-K525 VanDerWaalsContact O-CD 3.31Å; L472-K525 WeakPolarHBondContact O-CD 3.35Å; L472-K525 PolarHBondContact O-NZ 3.01Å; E474-K525 WeakPolarHBondContact OE1-CE 3.36Å; E474-K525 IonicContact OE1-NZ 3.16Å; E474-K525 PolarHBondContact OE1-NZ 3.41Å; R521-K525 WeakPolarHBondContact O-CG 3.39Å; R521-K525 PolarHBondContact O-N 3.37Å; Q522-K525 PolarHBondContact O-N 3.35Å; T523-K525 VanDerWaalsContact C-N 3.27Å; T523-K525 PolarHBondContact O-N 2.9Å; K525-Y527 VanDerWaalsContact C-N 3.34Å
526	L	91.1	Very high	89.2	Confident	27 Å²	27	43.4 Å²	43.4	14%	0.141	25%	0.246	C	C	.	.	H	α-helix	trans	-67.2	-37	-177.5	-177.6	59.5	0	0	0	111.8	A332 T339 L472 Q522 T523	A332-L526 HydrophobicContact CB-CD2 4.22Å; T339-L526 HydrophobicContact CG2-CD1 3.79Å; T339-L526 HydrophobicContact CG2-CG 4.08Å; L472-L526 HydrophobicContact CD1-CB 3.67Å; L472-L526 HydrophobicContact CD1-CD1 4.28Å; Q522-L526 WeakPolarHBondContact O-CB 3.42Å; Q522-L526 PolarHBondContact O-N 3Å; T523-L526 PolarHBondContact O-N 3.44Å
527	Y	90.8	Very high	88.8	Confident	25 Å²	25	45.2 Å²	45.2	10%	0.098	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.5	11	-178.2	-72.9	-87.1	0	0	0	114.1	W340 L374 I431 T523 K525 C529	W340-Y527 HydrophobicContact CB-CE1 4.12Å; W340-Y527 PolarHBondContact N-OH 3Å; W340-Y527 WeakPolarHBondContact O-CE1 3.18Å; L374-Y527 HydrophobicContact CD2-CD1 3.76Å; L374-Y527 HydrophobicContact CD2-CD2 3.78Å; L374-Y527 HydrophobicContact CD2-CE1 3.87Å; L374-Y527 HydrophobicContact CD2-CE2 3.92Å; L374-Y527 HydrophobicContact CD2-CG 3.71Å; I431-Y527 HydrophobicContact CG2-CE2 3.77Å; I431-Y527 PolarHBondContact O-OH 2.83Å; T523-Y527 HydrophobicContact CG2-CD2 4.07Å; T523-Y527 PolarHBondContact O-N 2.87Å; K525-Y527 VanDerWaalsContact C-N 3.34Å; Y527-C529 VanDerWaalsContact C-N 3.29Å; Y527-C529 PolarHBondContact O-N 2.78Å
528	L	88.5	Confident	88.6	Confident	138 Å²	138	45.2 Å²	45.2	72%	0.723	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.3	43	178.4	-57.7	176.6	0	0	0	113.5	N524	N524-L528 PolarHBondContact O-N 2.61Å
529	C	89	Confident	88.3	Confident	25 Å²	25	45.9 Å²	45.9	17%	0.169	25%	0.251	C	S	.	.			trans	-65.4	146	-174.8	-58.5	0	0	0	0	112.5	C373 N524 Y527	C373-C529 HydrophobicContact CB-CB 3.51Å; C373-C529 WeakPolarHBondContact CB-SG 3.46Å; C373-C529 PolarHBondContact N-SG 3.28Å; C373-C529 WeakPolarHBondContact SG-CA 3.26Å; C373-C529 WeakPolarHBondContact SG-CB 3.39Å; C373-C529 CovalentContact SG-SG 2.02Å; C373-C529 PolarHBondContact SG-SG 3.2Å; N524-C529 VanDerWaalsContact CA-SG 3.56Å; N524-C529 HydrophobicContact CB-CB 3.92Å; N524-C529 PolarHBondContact O-N 2.83Å; N524-C529 PolarHBondContact OD1-SG 3.21Å; Y527-C529 VanDerWaalsContact C-N 3.29Å; Y527-C529 PolarHBondContact O-N 2.78Å
530	P	84.3	Confident	88.1	Confident	42 Å²	42	49.5 Å²	49.5	27%	0.273	27%	0.273	S	S	.	.			trans	-59.3	151.8	-179.7	-25.9	35.8	0	0	0	113.9	C532 Q674	P530-C532 PolarHBondContact O-N 2.97Å; P530-Q674 HydrophobicContact CG-CB 3.96Å; P530-Q674 HydrophobicContact CG-CG 3.84Å
531	A	75.5	Confident	88.1	Confident	108 Å²	108	48.9 Å²	48.9	89%	0.893	28%	0.275	S	S	*	.	S	Bend	trans	-73.9	-10.7	179.7	0	0	0	0	0	114.1
532	C	85.6	Confident	88.2	Confident	32 Å²	32	46.6 Å²	46.6	22%	0.216	27%	0.273	C	S	.	.	B	Isolated β-bridge	trans	-152.8	163.1	178.8	51.4	0	0	0	0	112.2	P530 P546 L672 C673 Q674	P530-C532 PolarHBondContact O-N 2.97Å; C532-P546 HydrophobicContact CB-CG 4.45Å; C532-L672 PolarHBondContact SG-O 3.25Å; C532-C673 HydrophobicContact CB-CB 3.9Å; C532-C673 WeakPolarHBondContact CB-SG 3.05Å; C532-C673 WeakPolarHBondContact O-CA 3.29Å; C532-C673 WeakPolarHBondContact O-CB 3.43Å; C532-C673 WeakPolarHBondContact SG-CA 3.41Å; C532-C673 WeakPolarHBondContact SG-CB 3.31Å; C532-C673 CovalentContact SG-SG 2.04Å; C532-C673 PolarHBondContact SG-SG 3.36Å; C532-Q674 PolarHBondContact O-N 2.75Å; C532-Q674 VanDerWaalsContact O-N 3.08Å
533	G	85.3	Confident	88.2	Confident	37 Å²	37	46.3 Å²	46.3	38%	0.381	27%	0.272	S	S	.	.			trans	86.4	165.6	-165.9	0	0	0	0	0	112.1	Q674	G533-Q674 CarbonylContact C-O 3.4Å; G533-Q674 WeakPolarHBondContact CA-O 3.43Å
534	R	87.6	Confident	88.1	Confident	105 Å²	105	46.5 Å²	46.5	40%	0.396	27%	0.273	S	S	.	.			trans	-148.9	167.8	-177.2	66.7	173.8	-169.3	162.2	14.5	111.5	L536 E538 Q674 W675 R676	R534-L536 HydrophobicContact CG-CD2 4.05Å; R534-L536 HydrophobicContact CG-CG 4.33Å; R534-L536 VanDerWaalsContact NE-CD2 3.28Å; R534-E538 IonicContact CZ-OE1 2.78Å; R534-E538 IonicContact NH1-OE1 2.68Å; R534-E538 VanDerWaalsContact NH2-CD 3.34Å; R534-E538 IonicContact NH2-OE1 3.86Å; R534-E538 PolarHBondContact NH2-OE1 3.3Å; R534-E538 IonicContact NH2-OE2 3.27Å; R534-E538 PolarHBondContact NH2-OE2 2.77Å; R534-Q674 PolarHBondContact N-O 3.47Å; R534-W675 WeakPolarHBondContact O-CA 3.33Å; R534-R676 PolarHBondContact O-N 3.01Å
535	T	88.4	Confident	88.1	Confident	1 Å²	1	44.3 Å²	44.3	1%	0.006	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	140.8	160.3	-47.8	0	0	0	0	108.8	E369 L537 R676	E369-T535 HydrophobicContact CB-CG2 4.31Å; E369-T535 VanDerWaalsContact O-CB 3.24Å; E369-T535 WeakPolarHBondContact O-CB 3.39Å; E369-T535 PolarHBondContact O-OG1 3.25Å; T535-L537 HydrophobicContact CG2-CD2 3.66Å; T535-L537 HydrophobicContact CG2-CG 4.14Å; T535-R676 CarbonylContact C-O 3.57Å; T535-R676 VanDerWaalsContact CA-O 3.3Å; T535-R676 WeakPolarHBondContact CA-O 3.48Å; T535-R676 HydrophobicContact CG2-CB 4.3Å; T535-R676 PolarHBondContact OG1-NH1 3.3Å; T535-R676 PolarHBondContact OG1-NH2 2.81Å
536	L	90.9	Very high	87.8	Confident	2 Å²	2	42.4 Å²	42.4	1%	0.01	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	106.3	-179.6	-71.1	168.4	0	0	0	106.9	R534 L543 W675 R676 I677 N678 Y784	R534-L536 HydrophobicContact CG-CD2 4.05Å; R534-L536 HydrophobicContact CG-CG 4.33Å; R534-L536 VanDerWaalsContact NE-CD2 3.28Å; L536-L543 HydrophobicContact CD1-CB 4.04Å; L536-L543 HydrophobicContact CD1-CD2 3.69Å; L536-L543 HydrophobicContact CD1-CG 4.46Å; L536-W675 HydrophobicContact CD1-CB 4.37Å; L536-W675 HydrophobicContact CD1-CG 4.48Å; L536-R676 PolarHBondContact N-O 3.3Å; L536-I677 HydrophobicContact CB-CB 4.47Å; L536-I677 HydrophobicContact CB-CG1 4.12Å; L536-I677 HydrophobicContact CD1-CG1 3.86Å; L536-N678 PolarHBondContact O-N 2.67Å; L536-Y784 HydrophobicContact CB-CE1 4.42Å; L536-Y784 HydrophobicContact CB-CE2 4.37Å; L536-Y784 HydrophobicContact CD1-CD1 4.44Å; L536-Y784 HydrophobicContact CD1-CE1 3.91Å; L536-Y784 HydrophobicContact CD2-CE1 4.26Å; L536-Y784 HydrophobicContact CG-CE1 4.42Å
537	L	85.7	Confident	87.3	Confident	42 Å²	42	42.1 Å²	42.1	22%	0.22	26%	0.256	C	S	.	.			trans	-105.5	-3.5	-177.5	-59	-176.3	0	0	0	112.7	R366 N370 T535 N678	R366-L537 HydrophobicContact CB-CD1 4.14Å; R366-L537 HydrophobicContact CG-CD1 4.28Å; N370-L537 HydrophobicContact CB-CD1 3.77Å; T535-L537 HydrophobicContact CG2-CD2 3.66Å; T535-L537 HydrophobicContact CG2-CG 4.14Å; L537-N678 HydrophobicContact CD2-CB 3.88Å
538	E	85.4	Confident	86.9	Confident	85 Å²	85	41.2 Å²	41.2	40%	0.397	25%	0.253	S	S	.	.	S	Bend	trans	-75.2	144	175.3	-54.9	127.5	-179	0	0	108.9	R534 V540 Y784	R534-E538 IonicContact CZ-OE1 2.78Å; R534-E538 IonicContact NH1-OE1 2.68Å; R534-E538 VanDerWaalsContact NH2-CD 3.34Å; R534-E538 IonicContact NH2-OE1 3.86Å; R534-E538 PolarHBondContact NH2-OE1 3.3Å; R534-E538 IonicContact NH2-OE2 3.27Å; R534-E538 PolarHBondContact NH2-OE2 2.77Å; E538-V540 PolarHBondContact O-N 3.37Å; E538-Y784 VanDerWaalsContact O-CE2 3.29Å; E538-Y784 WeakPolarHBondContact O-CE2 3.38Å; E538-Y784 PolarHBondContact O-OH 2.93Å; E538-Y784 PolarHBondContact OE2-OH 2.8Å
539	P	84.2	Confident	86.1	Confident	18 Å²	18	34.9 Å²	34.9	12%	0.117	22%	0.221	C	C	.	.	S	Bend	trans	-77.7	-6.8	177.7	33.2	-39	0	0	0	113.3	A786 N803	P539-A786 HydrophobicContact CB-CB 3.96Å; P539-A786 WeakPolarHBondContact O-CB 3.5Å; P539-A786 PolarHBondContact O-N 2.85Å; P539-N803 WeakPolarHBondContact CB-OD1 3.38Å; P539-N803 WeakPolarHBondContact CG-OD1 3.28Å
540	V	90.7	Very high	84.7	Confident	82 Å²	82	39 Å²	39	50%	0.497	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	138.8	173.2	-172.4	0	0	0	0	107.6	E538 Y784 E785	E538-V540 PolarHBondContact O-N 3.37Å; V540-Y784 WeakPolarHBondContact CA-O 3.5Å; V540-E785 HydrophobicContact CG2-CG 4.35Å
541	G	91.4	Very high	83.4	Confident	20 Å²	20	40.9 Å²	40.9	21%	0.206	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-179	-168.1	171.2	0	0	0	0	0	113.8	Y784	G541-Y784 VanDerWaalsContact CA-CE1 3.41Å; G541-Y784 PolarHBondContact N-O 3.23Å; G541-Y784 WeakPolarHBondContact O-CD1 3.26Å; G541-Y784 PolarHBondContact O-N 2.51Å
542	S	91.4	Very high	82.5	Confident	42 Å²	42	36.6 Å²	36.6	29%	0.294	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	150.1	179.2	-53.9	0	0	0	0	110.7	A782 D783	S542-A782 CarbonylContact C-O 3.58Å; S542-A782 WeakPolarHBondContact CA-O 3.36Å; S542-D783 VanDerWaalsContact CB-OD1 3.26Å; S542-D783 WeakPolarHBondContact CB-OD1 3.4Å; S542-D783 PolarHBondContact OG-OD1 2.73Å
543	L	91.7	Very high	80.6	Confident	3 Å²	3	39.6 Å²	39.6	2%	0.016	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	147.4	174.5	73.1	107.8	0	0	0	110.9	L536 W675 I677 L687 L767 F780 A782 Y784	L536-L543 HydrophobicContact CD1-CB 4.04Å; L536-L543 HydrophobicContact CD1-CD2 3.69Å; L536-L543 HydrophobicContact CD1-CG 4.46Å; L543-W675 HydrophobicContact CD1-CD2 3.88Å; L543-W675 HydrophobicContact CD1-CE3 4.22Å; L543-W675 HydrophobicContact CD1-CG 4.09Å; L543-I677 HydrophobicContact CD2-CD1 4.02Å; L543-L687 HydrophobicContact CD2-CD1 4.44Å; L543-L767 HydrophobicContact CD1-CD2 4.3Å; L543-F780 HydrophobicContact CD1-CE2 3.61Å; L543-F780 HydrophobicContact CD1-CZ 3.85Å; L543-A782 HydrophobicContact CG-CB 4.48Å; L543-A782 PolarHBondContact N-O 2.64Å; L543-A782 PolarHBondContact O-N 3.28Å; L543-Y784 HydrophobicContact CD2-CD1 4.09Å
544	S	91.9	Very high	78.5	Confident	4 Å²	4	43.2 Å²	43.2	3%	0.028	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	151.2	-173.1	59.3	0	0	0	0	112.2	A549 L552 W675 F780	S544-A549 WeakPolarHBondContact OG-CA 3.39Å; S544-L552 WeakPolarHBondContact OG-CD1 2.95Å; S544-W675 VanDerWaalsContact O-CZ2 3.31Å; S544-W675 WeakPolarHBondContact O-CZ2 3.2Å; S544-F780 VanDerWaalsContact CA-O 3.24Å; S544-F780 WeakPolarHBondContact CA-O 3.28Å; S544-F780 VanDerWaalsContact CB-O 3.32Å; S544-F780 WeakPolarHBondContact CB-O 3.23Å
545	S	89.6	Confident	76.4	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	23%	0.225	C	C	.	.			trans	-55.1	146.7	164.3	54.5	0	0	0	0	111.7	Q547 M548 A549 G779 F780	S545-Q547 PolarHBondContact O-N 2.87Å; S545-Q547 VanDerWaalsContact O-N 3.1Å; S545-M548 PolarHBondContact O-N 2.91Å; S545-A549 PolarHBondContact O-N 2.89Å; S545-G779 VanDerWaalsContact OG-CA 3.29Å; S545-G779 WeakPolarHBondContact OG-CA 3.19Å; S545-F780 PolarHBondContact N-O 3.48Å; S545-F780 VanDerWaalsContact N-O 3.09Å; S545-F780 PolarHBondContact OG-N 2.64Å; S545-F780 PolarHBondContact OG-O 3.24Å
546	P	84	Confident	74.1	Confident	53 Å²	53	53.1 Å²	53.1	34%	0.344	26%	0.262	S	S	.	.	G	3₁₀ helix	trans	-53.7	-34.4	-179	-28.3	35.6	0	0	0	115	C532 M548 A549 I671 C673	C532-P546 HydrophobicContact CB-CG 4.45Å; P546-M548 PolarHBondContact O-N 3.43Å; P546-M548 VanDerWaalsContact O-N 3.16Å; P546-A549 PolarHBondContact O-N 2.79Å; P546-I671 HydrophobicContact CG-CG2 4.3Å; P546-C673 VanDerWaalsContact CG-SG 3.5Å
547	Q	80.8	Confident	71.1	Confident	21 Å²	21	56.2 Å²	56.2	10%	0.098	29%	0.294	C	S	.	.	G	3₁₀ helix	trans	-60.2	-22.7	177.4	-65	119.5	-88	0	0	114.3	S545 W550 Y769 T777 T778	S545-Q547 PolarHBondContact O-N 2.87Å; S545-Q547 VanDerWaalsContact O-N 3.1Å; Q547-W550 PolarHBondContact O-NE1 2.89Å; Q547-Y769 PolarHBondContact NE2-OH 3.43Å; Q547-Y769 PolarHBondContact OE1-OH 3.09Å; Q547-T777 PolarHBondContact NE2-O 3.19Å; Q547-T778 WeakPolarHBondContact CB-O 3.04Å
548	M	82.1	Confident	68.3	Low	6 Å²	6	57 Å²	57	3%	0.03	31%	0.312	C	S	.	.	G	3₁₀ helix	trans	-118.3	4.7	-172.5	-150.5	85.1	-62.5	0	0	113.7	S545 P546 W550 K551 I781	S545-M548 PolarHBondContact O-N 2.91Å; P546-M548 PolarHBondContact O-N 3.43Å; P546-M548 VanDerWaalsContact O-N 3.16Å; M548-W550 VanDerWaalsContact C-N 3.33Å; M548-W550 HydrophobicContact CE-CH2 4.46Å; M548-W550 HydrophobicContact CE-CZ2 3.56Å; M548-W550 PolarHBondContact O-N 3.17Å; M548-K551 HydrophobicContact CE-CD 3.81Å; M548-K551 HydrophobicContact CE-CG 4.12Å; M548-K551 HydrophobicContact CG-CB 4.32Å; M548-K551 HydrophobicContact CG-CD 4.05Å; M548-K551 HydrophobicContact CG-CG 4.42Å; M548-K551 PolarHBondContact O-N 2.91Å; M548-K551 VanDerWaalsContact O-N 3.14Å; M548-K551 HydrophobicContact SD-CD 3.69Å; M548-K551 HydrophobicContact SD-CG 4.45Å; M548-K551 PolarHBondContact SD-NZ 2.86Å; M548-I781 HydrophobicContact CB-CG1 4.36Å; M548-I781 HydrophobicContact CG-CD1 3.81Å; M548-I781 HydrophobicContact CG-CG1 3.84Å
549	A	71.8	Confident	65.6	Low	5 Å²	5	61.1 Å²	61.1	4%	0.041	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-42.1	-176	0	0	0	0	0	114.2	S544 S545 P546 K551 L552 N579	S544-A549 WeakPolarHBondContact OG-CA 3.39Å; S545-A549 PolarHBondContact O-N 2.89Å; P546-A549 PolarHBondContact O-N 2.79Å; A549-K551 PolarHBondContact O-N 2.94Å; A549-L552 WeakPolarHBondContact O-CB 3.09Å; A549-L552 PolarHBondContact O-N 2.77Å; A549-L552 VanDerWaalsContact O-N 3.11Å; A549-N579 HydrophobicContact CB-CB 3.74Å
550	W	60.1	Low	62.9	Low	111 Å²	111	64 Å²	64	42%	0.42	36%	0.362	S	S	.	.	H	α-helix	trans	-60	-28.7	179.3	55.8	-85.9	0	0	0	113.6	Q547 M548 L552 E553	Q547-W550 PolarHBondContact O-NE1 2.89Å; M548-W550 VanDerWaalsContact C-N 3.33Å; M548-W550 HydrophobicContact CE-CH2 4.46Å; M548-W550 HydrophobicContact CE-CZ2 3.56Å; M548-W550 PolarHBondContact O-N 3.17Å; W550-L552 PolarHBondContact O-N 2.84Å; W550-E553 PolarHBondContact O-N 3.04Å; W550-E553 VanDerWaalsContact O-N 3.14Å
551	K	56.6	Low	59.8	Low	81 Å²	81	67.9 Å²	67.9	35%	0.352	38%	0.381	S	S	.	.	H	α-helix	trans	-71.3	-6.2	176.8	-75.6	-166	-175	167.1	0	114.5	M548 A549 I781	M548-K551 HydrophobicContact CE-CD 3.81Å; M548-K551 HydrophobicContact CE-CG 4.12Å; M548-K551 HydrophobicContact CG-CB 4.32Å; M548-K551 HydrophobicContact CG-CD 4.05Å; M548-K551 HydrophobicContact CG-CG 4.42Å; M548-K551 PolarHBondContact O-N 2.91Å; M548-K551 VanDerWaalsContact O-N 3.14Å; M548-K551 HydrophobicContact SD-CD 3.69Å; M548-K551 HydrophobicContact SD-CG 4.45Å; M548-K551 PolarHBondContact SD-NZ 2.86Å; A549-K551 PolarHBondContact O-N 2.94Å; K551-I781 HydrophobicContact CB-CD1 4.27Å
552	L	57.3	Low	56.7	Low	18 Å²	18	72.9 Å²	72.9	9%	0.094	41%	0.412	C	S	.	.	H	α-helix	trans	-82.8	-33.6	169.4	-77.2	163.9	0	0	0	111.4	S544 A549 W550 R555 F556 I781	S544-L552 WeakPolarHBondContact OG-CD1 2.95Å; A549-L552 WeakPolarHBondContact O-CB 3.09Å; A549-L552 PolarHBondContact O-N 2.77Å; A549-L552 VanDerWaalsContact O-N 3.11Å; W550-L552 PolarHBondContact O-N 2.84Å; L552-R555 PolarHBondContact O-N 3.15Å; L552-F556 WeakPolarHBondContact O-CD2 3.45Å; L552-I781 HydrophobicContact CD2-CG2 4.21Å
553	E	46.6	Very low	53.5	Low	95 Å²	95	75.9 Å²	75.9	44%	0.444	43%	0.434	S	S	.	.	H	α-helix	trans	-71.4	-46.8	-177.8	-61.9	176.5	138.7	0	0	111.1	W550 R555 F556 G557 L577	W550-E553 PolarHBondContact O-N 3.04Å; W550-E553 VanDerWaalsContact O-N 3.14Å; E553-R555 PolarHBondContact O-N 2.93Å; E553-F556 PolarHBondContact O-N 2.88Å; E553-G557 PolarHBondContact O-N 2.59Å; E553-L577 HydrophobicContact CG-CD2 4.47Å
554	D	41.2	Very low	50.4	Low	113 Å²	113	83.3 Å²	83.3	60%	0.604	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.7	-27	172	-78.5	-24.6	0	0	0	113.1	F556	D554-F556 VanDerWaalsContact C-N 3.35Å
555	R	42	Very low	47.3	Very low	136 Å²	136	92.8 Å²	92.8	51%	0.513	51%	0.513	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.5	-12.6	-177.7	-146.6	-170.5	-67	-173.2	1.1	113.5	L552 E553	L552-R555 PolarHBondContact O-N 3.15Å; E553-R555 PolarHBondContact O-N 2.93Å
556	F	41	Very low	44.4	Very low	179 Å²	179	98 Å²	98	79%	0.785	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.2	-14.9	176.5	-76	-80.1	0	0	0	114.1	L552 E553 D554	L552-F556 WeakPolarHBondContact O-CD2 3.45Å; E553-F556 PolarHBondContact O-N 2.88Å; D554-F556 VanDerWaalsContact C-N 3.35Å
557	G	28.4	Very low	41.6	Very low	66 Å²	66	102.6 Å²	102.6	68%	0.68	57%	0.569	S	S	*	*	S	Bend	trans	-117	75.4	178.7	0	0	0	0	0	113.9	E553	E553-G557 PolarHBondContact O-N 2.59Å
558	G	26	Very low	39.1	Very low	58 Å²	58	107.8 Å²	107.8	60%	0.598	60%	0.604	S	S	*	*			trans	-157.3	14.4	-164.2	0	0	0	0	0	122.5
559	N	28.7	Very low	36.4	Very low	172 Å²	172	115.7 Å²	115.7	92%	0.92	65%	0.645	S	S	*	*			trans	172.3	147.9	146.9	-98.4	-45.7	0	0	0	113.8
560	A	27.7	Very low	34.2	Very low	78 Å²	78	119 Å²	119	65%	0.645	68%	0.68	S	S	*	*			trans	-99.5	163.2	162.8	0	0	0	0	0	110.9
561	N	24.9	Very low	32.6	Very low	165 Å²	165	121.7 Å²	121.7	88%	0.882	70%	0.701	S	S	*	*			trans	71.4	90.5	172.5	-50.5	-29.4	0	0	0	117.4
562	S	27	Very low	31.1	Very low	124 Å²	124	126.8 Å²	126.8	87%	0.867	73%	0.726	S	S	*	*				-165.7	143.3	109.1	-163	0	0	0	0	112
563	S	24.5	Very low	29.5	Very low	106 Å²	106	134.4 Å²	134.4	74%	0.741	76%	0.761	S	S	*	*			trans	-69.7	127.4	-170	52.4	0	0	0	0	115.7
564	L	25.4	Very low	28.5	Very low	158 Å²	158	135.2 Å²	135.2	83%	0.827	78%	0.778	S	S	*	*			trans	-177.8	98.6	138.8	-106.3	156.8	0	0	0	111.9
565	F	28	Very low	27.7	Very low	204 Å²	204	137.1 Å²	137.1	90%	0.895	79%	0.786	S	S	*	*	S	Bend	trans	164.1	145.9	148.3	-86.1	-57.3	0	0	0	108.7
566	P	28.4	Very low	26.9	Very low	108 Å²	108	139.4 Å²	139.4	70%	0.701	80%	0.803	S	S	*	*			trans	-91.8	141.4	-168.9	34.5	-34.6	0	0	0	115.6
567	D	24.2	Very low	26.3	Very low	151 Å²	151	137.1 Å²	137.1	81%	0.807	80%	0.798	S	S	*	*			trans	40.8	97.3	148.9	-54.4	-12.5	0	0	0	120.6
568	P	29.2	Very low	26.1	Very low	129 Å²	129	136.2 Å²	136.2	84%	0.838	79%	0.789	S	S	*	*			trans	-93.4	137.8	158.7	34.9	-29.4	0	0	0	112.2
569	I	25.3	Very low	26.2	Very low	172 Å²	172	137.2 Å²	137.2	88%	0.882	78%	0.78	S	S	*	*			trans	-123.7	126.4	168.6	-64.2	177.8	0	0	0	108.9
570	G	25	Very low	26	Very low	75 Å²	75	132.3 Å²	132.3	77%	0.773	76%	0.764	S	S	*	*			trans	82.7	68.5	163.9	0	0	0	0	0	116.4
571	L	27.7	Very low	26	Very low	167 Å²	167	136.1 Å²	136.1	87%	0.874	77%	0.772	S	S	*	*			trans	-137.9	106.6	162.5	-155.4	86.9	0	0	0	110.9
572	E	23.6	Very low	26	Very low	189 Å²	189	133 Å²	133	88%	0.883	76%	0.763	S	S	*	*			trans	-128.6	77.3	173.8	-169.5	172.2	-121.8	0	0	109.8
573	Q	24.7	Very low	26	Very low	177 Å²	177	133 Å²	133	83%	0.827	76%	0.758	S	S	*	*			trans	-168.3	157.6	168.7	-114.6	155	82.9	0	0	111.6
574	S	25	Very low	25.9	Very low	113 Å²	113	134.2 Å²	134.2	79%	0.79	76%	0.756	S	S	*	*			trans	65.4	66.1	170.8	63.4	0	0	0	0	118.7
575	I	24.6	Very low	25.9	Very low	153 Å²	153	135 Å²	135	79%	0.785	76%	0.755	S	S	*	*			trans	-127	106.5	138.3	-58	178.8	0	0	0	108.1	L577	I575-L577 HydrophobicContact CG2-CD1 3.77Å
576	Q	26.5	Very low	25.9	Very low	184 Å²	184	133 Å²	133	86%	0.86	75%	0.752	S	S	*	*			trans	-123.6	116.2	158.4	-82.4	-167.7	-27.7	0	0	107.4
577	L	27.2	Very low	25.8	Very low	131 Å²	131	134.9 Å²	134.9	69%	0.686	76%	0.756	S	S	*	*			trans	-63	152.1	175.7	-94	64.7	0	0	0	110.4	E553 I575	E553-L577 HydrophobicContact CG-CD2 4.47Å; I575-L577 HydrophobicContact CG2-CD1 3.77Å
578	G	24.6	Very low	26.1	Very low	47 Å²	47	133.1 Å²	133.1	49%	0.485	75%	0.753	S	S	.	*			trans	-151.7	110.1	167.5	0	0	0	0	0	111.2
579	N	27.7	Very low	25.9	Very low	78 Å²	78	134.8 Å²	134.8	42%	0.417	75%	0.754	S	S	.	*			trans	-166.1	160.4	134.6	-90.7	-41.8	0	0	0	111.2	A549	A549-N579 HydrophobicContact CB-CB 3.74Å
580	A	25.6	Very low	26	Very low	70 Å²	70	133.6 Å²	133.6	58%	0.579	75%	0.75	S	S	*	*	S	Bend	trans	60.3	104.9	161.1	0	0	0	0	0	120.5
581	I	26	Very low	26.2	Very low	158 Å²	158	133.8 Å²	133.8	81%	0.81	73%	0.733	S	S	*	*			trans	62.3	78.3	137.3	-41.3	169	0	0	0	117.6
582	S	26.7	Very low	26.1	Very low	99 Å²	99	132.8 Å²	132.8	69%	0.692	72%	0.724	S	S	*	*				-164.2	156.4	119.7	-165.5	0	0	0	0	110.4
583	V	25.2	Very low	26.2	Very low	125 Å²	125	127 Å²	127	76%	0.758	70%	0.699	S	S	*	*	S	Bend	trans	-114.9	61.6	167.4	-171.7	0	0	0	0	108.5
584	D	23.4	Very low	26.4	Very low	131 Å²	131	122.8 Å²	122.8	70%	0.701	68%	0.68	S	S	*	*	S	Bend	trans	-153.9	145.8	163.5	-94.5	-44.7	0	0	0	109.6
585	H	26	Very low	26.6	Very low	175 Å²	175	122.4 Å²	122.4	81%	0.81	66%	0.662	S	S	*	*	S	Bend	trans	44.6	91.8	174.9	-63.1	-49.8	0	0	0	118.3
586	L	26.4	Very low	26.6	Very low	160 Å²	160	122.9 Å²	122.9	84%	0.838	66%	0.661	S	S	*	*				177.6	116.1	99	-91.5	163.2	0	0	0	111.6
587	L	27.5	Very low	26.8	Very low	149 Å²	149	118.6 Å²	118.6	78%	0.78	65%	0.649	S	S	*	*	S	Bend	trans	-89.1	146.1	142.6	-71.6	170.2	0	0	0	106.3	D589	L587-D589 PolarHBondContact O-N 3.05Å; L587-D589 VanDerWaalsContact O-N 3.16Å
588	P	30	Very low	27	Very low	114 Å²	114	123.5 Å²	123.5	74%	0.74	66%	0.66	S	S	*	*			trans	-70.5	112.2	178.8	28	-33	0	0	0	110.6
589	D	24.8	Very low	27	Very low	163 Å²	163	131.8 Å²	131.8	87%	0.872	68%	0.677	S	S	*	*			trans	-73.6	115.2	156.7	-89.8	-48.1	0	0	0	108	L587	L587-D589 PolarHBondContact O-N 3.05Å; L587-D589 VanDerWaalsContact O-N 3.16Å
590	D	27.1	Very low	27.1	Very low	148 Å²	148	133 Å²	133	79%	0.791	69%	0.691	S	S	*	*			trans	-151.1	99.5	157.8	-132.6	-25.7	0	0	0	111
591	N	29.1	Very low	27	Very low	79 Å²	79	136.6 Å²	136.6	42%	0.422	70%	0.7	S	S	.	*			trans	-173.1	94.9	170.5	-121.2	-31.3	0	0	0	110.5	G1400 I1402 R1403	N591-G1400 PolarHBondContact ND2-O 3.18Å; N591-I1402 HydrophobicContact CB-CB 4.04Å; N591-I1402 HydrophobicContact CB-CD1 3.93Å; N591-I1402 HydrophobicContact CB-CG1 4.38Å; N591-I1402 HydrophobicContact CB-CG2 3.51Å; N591-I1402 WeakPolarHBondContact ND2-CD1 3.47Å; N591-I1402 WeakPolarHBondContact O-CG2 3.37Å; N591-I1402 VanDerWaalsContact OD1-CB 3.3Å; N591-I1402 WeakPolarHBondContact OD1-CB 3.28Å; N591-I1402 VanDerWaalsContact OD1-CG2 3.24Å; N591-I1402 WeakPolarHBondContact OD1-CG2 3.29Å; N591-R1403 PolarHBondContact O-NE 3.37Å; N591-R1403 PolarHBondContact O-NH2 3.08Å
592	E	26.2	Very low	27.2	Very low	146 Å²	146	134.5 Å²	134.5	68%	0.682	70%	0.695	S	S	*	*			trans	-103.2	165.7	168.1	-56.1	-155.6	133.5	0	0	112.2	I1402 R1403	E592-I1402 VanDerWaalsContact C-CG2 3.47Å; E592-I1402 CarbonylContact O-C 3.5Å; E592-I1402 WeakPolarHBondContact O-CG2 3.49Å; E592-R1403 PolarHBondContact O-N 3.06Å
593	N	26.7	Very low	27.2	Very low	66 Å²	66	137.7 Å²	137.7	35%	0.353	70%	0.704	S	S	.	*			cis	-148.2	97.4	2.1	-148.6	-51.1	0	0	0	113.2	Y595 R1403 Y1404	N593-Y595 HydrophobicContact CB-CD2 4.26Å; N593-Y595 WeakPolarHBondContact O-CB 3.41Å; N593-R1403 VanDerWaalsContact C-CA 3.5Å; N593-R1403 CarbonylContact O-C 3.49Å; N593-Y1404 PolarHBondContact O-N 3.41Å
594	M	27.6	Very low	27.2	Very low	89 Å²	89	135.1 Å²	135.1	44%	0.438	70%	0.703	S	S	.	*			trans	-109.3	114.9	156	-102.3	173.7	-160.4	0	0	101.8	R1403 Y1404	M594-R1403 HydrophobicContact CB-CB 3.61Å; M594-R1403 HydrophobicContact CB-CG 3.64Å; M594-R1403 HydrophobicContact CE-CB 4.26Å; M594-R1403 HydrophobicContact CG-CB 3.58Å; M594-R1403 HydrophobicContact CG-CG 4.15Å; M594-R1403 PolarHBondContact O-NH1 2.97Å; M594-R1403 HydrophobicContact SD-CB 3.87Å; M594-R1403 HydrophobicContact SD-CG 4.35Å; M594-Y1404 HydrophobicContact CE-CD2 3.7Å; M594-Y1404 HydrophobicContact CE-CG 3.94Å
595	Y	28.8	Very low	27.6	Very low	105 Å²	105	136.6 Å²	136.6	41%	0.412	71%	0.711	S	S	.	*			cis	72	108.9	16.7	-121.7	-39.7	0	0	0	111.4	N593 F1405	N593-Y595 HydrophobicContact CB-CD2 4.26Å; N593-Y595 WeakPolarHBondContact O-CB 3.41Å; Y595-F1405 HydrophobicContact CD1-CB 3.64Å; Y595-F1405 AromaticContact CD1-CD2 3.88Å; Y595-F1405 HydrophobicContact CD1-CD2 3.88Å; Y595-F1405 HydrophobicContact CD1-CG 4.25Å; Y595-F1405 HydrophobicContact CD2-CB 3.99Å; Y595-F1405 VanDerWaalsContact CD2-O 3.28Å; Y595-F1405 WeakPolarHBondContact CD2-O 3.44Å; Y595-F1405 HydrophobicContact CE1-CB 3.84Å; Y595-F1405 HydrophobicContact CE2-CB 4.2Å; Y595-F1405 WeakPolarHBondContact CE2-O 3.44Å; Y595-F1405 HydrophobicContact CG-CB 3.71Å; Y595-F1405 HydrophobicContact CG-CD2 4Å; Y595-F1405 HydrophobicContact CG-CG 4.37Å; Y595-F1405 WeakPolarHBondContact O-CE2 3.38Å
596	H	26.4	Very low	27.6	Very low	164 Å²	164	133.3 Å²	133.3	76%	0.759	71%	0.708	S	S	*	*			trans	-112.6	158.6	-172.9	-64.3	-121.1	0	0	0	110.6
597	P	29.9	Very low	27.6	Very low	94 Å²	94	133 Å²	133	61%	0.61	71%	0.705	S	S	*	*	S	Bend	trans	-100.8	102.6	153.7	33.4	-22	0	0	0	110.6	F1405	P597-F1405 HydrophobicContact CB-CZ 4.29Å; P597-F1405 HydrophobicContact CG-CE2 4.35Å; P597-F1405 HydrophobicContact CG-CZ 4.09Å
598	Y	31	Very low	27.7	Very low	234 Å²	234	133.4 Å²	133.4	92%	0.918	71%	0.708	S	S	*	*				171.9	153.1	118.9	-96.2	-70.9	0	0	0	111.2
599	R	25.2	Very low	27.7	Very low	221 Å²	221	131.4 Å²	131.4	83%	0.834	71%	0.709	S	S	*	*			trans	-148.5	127.3	-155.6	-175.7	-170.9	-167.3	-179.2	6.5	112.7
600	S	28.7	Very low	27.7	Very low	102 Å²	102	127.3 Å²	127.3	71%	0.713	70%	0.704	S	S	*	*			trans	-170	131.3	154.5	-96.3	0	0	0	0	107.6
601	L	24.2	Very low	27.8	Very low	146 Å²	146	128.9 Å²	128.9	76%	0.764	71%	0.707	S	S	*	*				68.6	122.4	63.4	-63.3	169.8	0	0	0	111
602	T	29.6	Very low	27.5	Very low	115 Å²	115	133.1 Å²	133.1	71%	0.706	73%	0.73	S	S	*	*			cis	-151.8	158.7	11.7	52.1	0	0	0	0	114
603	N	26.8	Very low	27.7	Very low	166 Å²	166	134.4 Å²	134.4	89%	0.888	74%	0.735	S	S	*	*			trans	27.1	135.3	145.2	-54.7	1.8	0	0	0	122.3
604	G	26.4	Very low	27.7	Very low	71 Å²	71	136 Å²	136	73%	0.732	75%	0.752	S	S	*	*			trans	149	103.5	140.9	0	0	0	0	0	119.5
605	N	30.5	Very low	27.5	Very low	162 Å²	162	140.4 Å²	140.4	87%	0.866	78%	0.776	S	S	*	*			trans	45	109.1	146.1	-60	0.2	0	0	0	123.2
606	S	26.2	Very low	27.2	Very low	106 Å²	106	142.9 Å²	142.9	74%	0.741	80%	0.795	S	S	*	*				65.8	136.3	110.7	-142.5	0	0	0	0	123.3
607	I	27.3	Very low	27.1	Very low	152 Å²	152	138.2 Å²	138.2	78%	0.779	79%	0.791	S	S	*	*			trans	63.9	138.8	166.8	-5.7	-175.8	0	0	0	114.6
608	D	29.3	Very low	27	Very low	158 Å²	158	142.8 Å²	142.8	85%	0.845	81%	0.807	S	S	*	*			cis	-154.7	161.2	17.4	-159	-0.9	0	0	0	113.8
609	G	29.2	Very low	26.7	Very low	73 Å²	73	137.8 Å²	137.8	75%	0.753	80%	0.8	S	S	*	*			trans	78.8	118.4	149.4	0	0	0	0	0	122.4
610	G	26.2	Very low	26.7	Very low	76 Å²	76	133.8 Å²	133.8	78%	0.784	80%	0.795	S	S	*	*			trans	131.5	98.7	135.6	0	0	0	0	0	120.2
611	E	28.8	Very low	26.6	Very low	181 Å²	181	135.7 Å²	135.7	85%	0.846	80%	0.797	S	S	*	*			trans	55.5	90.2	150.4	-60.7	-173.2	170.3	0	0	120.6
612	D	22.8	Very low	26.8	Very low	168 Å²	168	136.4 Å²	136.4	90%	0.898	80%	0.802	S	S	*	*			trans	-65.4	142.4	144.6	-82.2	-57.7	0	0	0	110.9
613	H	30.4	Very low	26.6	Very low	173 Å²	173	136.6 Å²	136.6	80%	0.801	80%	0.799	S	S	*	*			trans	-135	118.3	161.2	-111.3	-63.8	0	0	0	111.3
614	S	26.7	Very low	26.6	Very low	100 Å²	100	138.4 Å²	138.4	70%	0.699	79%	0.794	S	S	*	*			trans	-82.9	150.4	-171.5	51.7	0	0	0	0	114.1	I616	S614-I616 PolarHBondContact O-N 2.78Å; S614-I616 VanDerWaalsContact O-N 3.15Å
615	L	23.8	Very low	26.6	Very low	181 Å²	181	143.5 Å²	143.5	95%	0.948	80%	0.799	S	S	*	*			trans	-76.7	91.9	175.4	-86.3	159.5	0	0	0	111.5
616	I	22	Very low	26.5	Very low	157 Å²	157	143.1 Å²	143.1	81%	0.805	80%	0.796	S	S	*	*			trans	-136.1	119.6	164.5	-61.1	-179.8	0	0	0	109.8	S614	S614-I616 PolarHBondContact O-N 2.78Å; S614-I616 VanDerWaalsContact O-N 3.15Å
617	G	24.9	Very low	26.3	Very low	66 Å²	66	147.9 Å²	147.9	68%	0.68	80%	0.804	S	S	*	*			trans	117.8	144.8	173.2	0	0	0	0	0	113.8
618	M	27.2	Very low	26.4	Very low	191 Å²	191	146.8 Å²	146.8	94%	0.941	80%	0.804	S	S	*	*			cis	-141.7	150.5	2.3	-62.7	-174.8	-172.2	0	0	112.2
619	V	24.2	Very low	26.1	Very low	128 Å²	128	147.3 Å²	147.3	78%	0.776	81%	0.806	S	S	*	*			trans	-84.7	147.5	164.5	171.7	0	0	0	0	109
620	N	25.5	Very low	26.1	Very low	137 Å²	137	149.5 Å²	149.5	73%	0.733	81%	0.807	S	S	*	*			trans	66.6	120.8	177	-63.4	-30.8	0	0	0	117.4
621	D	27.5	Very low	26	Very low	142 Å²	142	156.4 Å²	156.4	76%	0.759	81%	0.811	S	S	*	*			trans	-148.1	72.6	137.9	-151.8	-10.1	0	0	0	110.6	N623	D621-N623 PolarHBondContact O-N 2.95Å
622	N	27.3	Very low	26.1	Very low	161 Å²	161	154.5 Å²	154.5	86%	0.861	81%	0.807	S	S	*	*			trans	-79.1	97.1	177.2	-95.5	-29	0	0	0	110.1
623	N	25.6	Very low	26.7	Very low	119 Å²	119	150.4 Å²	150.4	64%	0.636	79%	0.79	S	S	*	*			trans	-122.5	48.8	-176	-134.5	-38.8	0	0	0	114.3	D621	D621-N623 PolarHBondContact O-N 2.95Å
624	Y	27.4	Very low	26.8	Very low	204 Å²	204	151.5 Å²	151.5	80%	0.8	79%	0.792	S	S	*	*			trans	-94	88.2	163.6	-94.8	-85.2	0	0	0	110.4	L626	Y624-L626 PolarHBondContact O-N 3.23Å
625	Q	25.3	Very low	26.9	Very low	178 Å²	178	156.6 Å²	156.6	83%	0.832	80%	0.802	S	S	*	*			trans	-72	89.5	168.2	-74.4	-167	-11.3	0	0	110.9
626	L	28.9	Very low	27.2	Very low	154 Å²	154	151.5 Å²	151.5	81%	0.806	79%	0.793	S	S	*	*			trans	-76.7	131.9	162.2	-146.8	78.5	0	0	0	109.2	Y624 T628	Y624-L626 PolarHBondContact O-N 3.23Å; L626-T628 PolarHBondContact O-N 2.95Å
627	K	22.3	Very low	27.4	Very low	206 Å²	206	148.9 Å²	148.9	90%	0.896	79%	0.789	S	S	*	*			trans	-76.1	107.8	-178	-71.6	179.7	178.3	176.8	0	111.7
628	T	28.6	Very low	27.6	Very low	129 Å²	129	154.5 Å²	154.5	79%	0.791	80%	0.795	S	S	*	*			trans	-137.6	141	155.9	43.9	0	0	0	0	110.4	L626	L626-T628 PolarHBondContact O-N 2.95Å
629	L	23	Very low	27.7	Very low	170 Å²	170	151.2 Å²	151.2	89%	0.89	78%	0.781	S	S	*	*			trans	-71.6	151.4	171.8	-67.1	155.9	0	0	0	109.2
630	P	29.4	Very low	27.8	Very low	119 Å²	119	151.9 Å²	151.9	77%	0.773	78%	0.78	S	S	*	*				-143.7	161.8	99.1	38.5	-25	0	0	0	116.7
631	Y	25.5	Very low	27.9	Very low	220 Å²	220	153.9 Å²	153.9	86%	0.863	79%	0.785	S	S	*	*			trans	-11.8	141.7	150.1	-145.5	-106.2	0	0	0	118.7
632	N	30.7	Very low	28	Very low	142 Å²	142	156 Å²	156	76%	0.759	79%	0.79	S	S	*	*			trans	-144.7	126.3	167.5	-174.3	4.5	0	0	0	108.2
633	P	35.4	Very low	28.1	Very low	82 Å²	82	154.7 Å²	154.7	53%	0.532	79%	0.788	S	S	.	*				-147.1	145	111.3	36.7	-21.8	0	0	0	115.2
634	F	31.7	Very low	28.6	Very low	195 Å²	195	154.3 Å²	154.3	86%	0.855	79%	0.792	S	S	*	*				-170.9	-178	109.4	-106.6	-75.6	0	0	0	111.4
635	K	28.7	Very low	28.4	Very low	207 Å²	207	152.2 Å²	152.2	90%	0.9	79%	0.794	S	S	*	*			trans	-121.9	158.5	-157.6	-66.5	179	175.1	178.9	0	115.5
636	G	29.5	Very low	28.7	Very low	75 Å²	75	151.9 Å²	151.9	77%	0.773	80%	0.796	S	S	*	*			trans	119.2	114.9	165.3	0	0	0	0	0	112.3
637	S	26.4	Very low	28.5	Very low	101 Å²	101	148.8 Å²	148.8	71%	0.706	79%	0.793	S	S	*	*			cis	82.1	99.6	19.9	-159.9	0	0	0	0	115.5
638	F	29.5	Very low	29	Very low	185 Å²	185	148.3 Å²	148.3	81%	0.811	80%	0.796	S	S	*	*				-176.7	153.1	108.8	-106.2	-81	0	0	0	114.2
639	N	29.1	Very low	28.8	Very low	121 Å²	121	146.9 Å²	146.9	65%	0.647	79%	0.791	S	S	*	*			trans	-37	151.2	-172.7	-53.5	-6.9	0	0	0	123.7
640	N	26.2	Very low	29.2	Very low	142 Å²	142	150.5 Å²	150.5	76%	0.759	79%	0.793	S	S	*	*			trans	19.5	138.4	131.4	-42.5	-5.8	0	0	0	121.5
641	E	28.8	Very low	29	Very low	179 Å²	179	152.3 Å²	152.3	84%	0.836	80%	0.795	S	S	*	*				-175.8	144.1	94.1	-99	173.6	-170.2	0	0	115.1
642	E	27.9	Very low	29	Very low	186 Å²	186	146.8 Å²	146.8	87%	0.869	79%	0.789	S	S	*	*			trans	33.4	164.9	154.2	-53.6	-158.1	144.4	0	0	126.3
643	V	29.9	Very low	29	Very low	134 Å²	134	149.8 Å²	149.8	81%	0.812	80%	0.796	S	S	*	*			trans	-154.2	133.8	-166.1	165.4	0	0	0	0	108
644	P	36.2	Very low	28.5	Very low	112 Å²	112	153.8 Å²	153.8	73%	0.727	81%	0.812	S	S	*	*				-159.5	151.5	104.9	40	-19.5	0	0	0	120.3
645	L	24.6	Very low	28.1	Very low	159 Å²	159	148.4 Å²	148.4	83%	0.832	80%	0.798	S	S	*	*			trans	38.3	130.5	135.7	-60.9	167.7	0	0	0	122.8
646	I	30.5	Very low	27.9	Very low	172 Å²	172	147.9 Å²	147.9	88%	0.882	80%	0.796	S	S	*	*				-160.1	153.2	119.3	-101.6	156.2	0	0	0	109.1
647	A	25.6	Very low	27.6	Very low	89 Å²	89	150.3 Å²	150.3	74%	0.736	80%	0.796	S	S	*	*			trans	-127.1	153.9	179	0	0	0	0	0	112
648	M	31.2	Very low	27.5	Very low	195 Å²	195	151.1 Å²	151.1	96%	0.961	80%	0.801	S	S	*	*			trans	-160.1	163	160.4	-98.8	-66	167.9	0	0	109.8
649	S	25.9	Very low	27.3	Very low	99 Å²	99	148 Å²	148	69%	0.692	80%	0.803	S	S	*	*			trans	-125.4	165.5	-167	63.1	0	0	0	0	114
650	R	29.6	Very low	27	Very low	246 Å²	246	147.4 Å²	147.4	93%	0.928	81%	0.808	S	S	*	*			trans	-176.5	175.3	130.9	-99.9	162.8	-170.2	-153	1.2	114.1
651	L	25.7	Very low	27	Very low	157 Å²	157	145.3 Å²	145.3	82%	0.822	81%	0.805	S	S	*	*			trans	-117	155.2	-156	-82.5	128.2	0	0	0	116
652	S	26.3	Very low	26.9	Very low	104 Å²	104	143.6 Å²	143.6	73%	0.727	81%	0.806	S	S	*	*			trans	77.2	125.3	141.1	70.9	0	0	0	0	122
653	K	30.7	Very low	27	Very low	206 Å²	206	142.7 Å²	142.7	90%	0.896	81%	0.806	S	S	*	*				-160.4	163.3	113.9	-109.5	171.8	-177.6	176.6	0	113.3
654	L	24.8	Very low	26.9	Very low	166 Å²	166	139.5 Å²	139.5	87%	0.869	80%	0.801	S	S	*	*			trans	-73	167.5	-176.9	-97.9	67.2	0	0	0	113.2
655	S	23	Very low	26.9	Very low	82 Å²	82	141.2 Å²	141.2	57%	0.573	80%	0.797	S	S	*	*			cis	-171.6	166.3	-0.1	49	0	0	0	0	112
656	K	23.7	Very low	27.6	Very low	196 Å²	196	138.8 Å²	138.8	85%	0.852	79%	0.789	S	S	*	*			trans	72.3	146.4	170.4	-49.6	174.4	-176	177.2	0	113.3
657	T	24.9	Very low	28.5	Very low	125 Å²	125	133 Å²	133	77%	0.767	76%	0.764	S	S	*	*			cis	-132.8	165.5	12.2	46.4	0	0	0	0	113.5
658	S	22.4	Very low	30	Very low	118 Å²	118	132.5 Å²	132.5	83%	0.825	76%	0.76	S	S	*	*			trans	-21	126.5	166.9	53.4	0	0	0	0	120.2
659	S	26.4	Very low	31.5	Very low	121 Å²	121	127 Å²	127	85%	0.846	74%	0.741	S	S	*	*			trans	-156.5	153.1	147.8	59.9	0	0	0	0	110.8
660	S	22.9	Very low	34.1	Very low	107 Å²	107	126.9 Å²	126.9	75%	0.748	74%	0.737	S	S	*	*			trans	-93.8	167	-179.4	-164.8	0	0	0	0	113.1
661	S	25.3	Very low	36.7	Very low	99 Å²	99	116.2 Å²	116.2	69%	0.692	70%	0.699	S	S	*	*			trans	51.9	99.6	152.5	62.8	0	0	0	0	119.9
662	T	27.5	Very low	39.6	Very low	143 Å²	143	112.5 Å²	112.5	88%	0.877	68%	0.679	S	S	*	*			trans	-142.2	71.9	150.6	55.3	0	0	0	0	112
663	L	29.5	Very low	42.7	Very low	166 Å²	166	107.5 Å²	107.5	87%	0.869	64%	0.644	S	S	*	*			trans	-91.4	107.3	158.1	-81.7	172.7	0	0	0	108.2	F665	L663-F665 PolarHBondContact O-N 2.71Å; L663-F665 VanDerWaalsContact O-N 3.15Å
664	G	28.1	Very low	45.6	Very low	68 Å²	68	99.6 Å²	99.6	70%	0.701	61%	0.611	S	S	*	*			trans	-81.7	89.1	-167.1	0	0	0	0	0	114.6	T666	G664-T666 VanDerWaalsContact C-N 3.27Å; G664-T666 PolarHBondContact O-N 3.31Å; G664-T666 VanDerWaalsContact O-N 3.14Å
665	F	36.2	Very low	48.9	Very low	148 Å²	148	92.3 Å²	92.3	65%	0.649	57%	0.572	S	S	*	*			trans	-84.8	60.4	167.7	-87.9	-77.9	0	0	0	112.8	L663 S667	L663-F665 PolarHBondContact O-N 2.71Å; L663-F665 VanDerWaalsContact O-N 3.15Å; F665-S667 VanDerWaalsContact C-N 3.27Å; F665-S667 PolarHBondContact O-N 2.76Å
666	T	39.7	Very low	52.2	Low	108 Å²	108	89.1 Å²	89.1	66%	0.663	55%	0.547	S	S	*	.			trans	-79.8	71	172.7	55.4	0	0	0	0	111.3	G664 A668 M776	G664-T666 VanDerWaalsContact C-N 3.27Å; G664-T666 PolarHBondContact O-N 3.31Å; G664-T666 VanDerWaalsContact O-N 3.14Å; T666-A668 PolarHBondContact O-N 3.03Å; T666-A668 VanDerWaalsContact O-N 3.11Å; T666-M776 HydrophobicContact CG2-CE 3.95Å
667	S	49.9	Very low	55.5	Low	50 Å²	50	79.9 Å²	79.9	35%	0.35	51%	0.507	S	S	.	.			trans	-66.2	109.2	167.5	52.2	0	0	0	0	109.2	F665 S669 R771	F665-S667 VanDerWaalsContact C-N 3.27Å; F665-S667 PolarHBondContact O-N 2.76Å; S667-S669 VanDerWaalsContact C-N 3.31Å; S667-S669 PolarHBondContact O-N 2.87Å; S667-R771 PolarHBondContact O-NH1 2.87Å; S667-R771 PolarHBondContact O-NH2 2.9Å; S667-R771 PolarHBondContact OG-NH2 3Å
668	A	55.5	Low	58.6	Low	78 Å²	78	74.1 Å²	74.1	65%	0.645	47%	0.471	S	S	*	.			trans	-70.7	-27.7	-176.3	0	0	0	0	0	113	T666 A773	T666-A668 PolarHBondContact O-N 3.03Å; T666-A668 VanDerWaalsContact O-N 3.11Å; A668-A773 WeakPolarHBondContact O-CA 3.46Å; A668-A773 VanDerWaalsContact O-CB 3.24Å; A668-A773 WeakPolarHBondContact O-CB 3.23Å
669	S	63.3	Low	61.8	Low	81 Å²	81	69.2 Å²	69.2	57%	0.566	44%	0.438	S	S	*	.	S	Bend	trans	-71.6	148.7	-178.8	-53.9	0	0	0	0	113.1	S667 R771	S667-S669 VanDerWaalsContact C-N 3.31Å; S667-S669 PolarHBondContact O-N 2.87Å; S669-R771 PolarHBondContact O-NH2 3.21Å
670	P	80.6	Confident	64.5	Low	95 Å²	95	63.5 Å²	63.5	62%	0.617	40%	0.398	S	S	*	.			trans	-62.3	148.9	169.4	29.8	-34.9	0	0	0	110.6	R771	P670-R771 CarbonylContact C-O 3.49Å; P670-R771 VanDerWaalsContact CA-O 3.28Å; P670-R771 WeakPolarHBondContact CA-O 3.35Å
671	I	83.7	Confident	67.2	Low	23 Å²	23	59.7 Å²	59.7	12%	0.118	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	135	179.7	-59.7	176.6	0	0	0	108.9	P546 C673 Y769 R770 R771	P546-I671 HydrophobicContact CG-CG2 4.3Å; I671-C673 WeakPolarHBondContact CG2-SG 3.2Å; I671-Y769 HydrophobicContact CG2-CD1 4.38Å; I671-Y769 HydrophobicContact CG2-CE1 4.49Å; I671-R770 WeakPolarHBondContact O-CA 3.37Å; I671-R771 HydrophobicContact CB-CB 4.23Å; I671-R771 PolarHBondContact N-O 2.87Å; I671-R771 PolarHBondContact O-N 3.48Å
672	L	87.7	Confident	69.6	Low	78 Å²	78	56 Å²	56	41%	0.408	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	108.4	167.6	-178.1	67.9	0	0	0	108.1	C532 E768 Y769 R770	C532-L672 PolarHBondContact SG-O 3.25Å; L672-E768 HydrophobicContact CD1-CG 3.63Å; L672-Y769 WeakPolarHBondContact CA-O 3.49Å; L672-R770 HydrophobicContact CD1-CB 4.37Å
673	C	91	Very high	72.5	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	144.5	173.6	-50.5	0	0	0	0	110.1	C532 P546 I671 W675 E768 Y769	C532-C673 HydrophobicContact CB-CB 3.9Å; C532-C673 WeakPolarHBondContact CB-SG 3.05Å; C532-C673 WeakPolarHBondContact O-CA 3.29Å; C532-C673 WeakPolarHBondContact O-CB 3.43Å; C532-C673 WeakPolarHBondContact SG-CA 3.41Å; C532-C673 WeakPolarHBondContact SG-CB 3.31Å; C532-C673 CovalentContact SG-SG 2.04Å; C532-C673 PolarHBondContact SG-SG 3.36Å; P546-C673 VanDerWaalsContact CG-SG 3.5Å; I671-C673 WeakPolarHBondContact CG2-SG 3.2Å; C673-W675 HydrophobicContact CB-CE3 4.35Å; C673-W675 HydrophobicContact CB-CH2 3.45Å; C673-W675 VanDerWaalsContact CB-CH2 3.45Å; C673-W675 HydrophobicContact CB-CZ2 4.09Å; C673-W675 HydrophobicContact CB-CZ3 3.6Å; C673-E768 WeakPolarHBondContact O-CA 3.36Å; C673-Y769 PolarHBondContact N-O 2.76Å; C673-Y769 PolarHBondContact O-N 3.07Å
674	Q	91.9	Very high	75.4	Confident	40 Å²	40	44.6 Å²	44.6	19%	0.187	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	135.9	171.8	-57.4	171.7	-10.3	0	0	111.5	P530 C532 G533 R534 W766 L767 E768	P530-Q674 HydrophobicContact CG-CB 3.96Å; P530-Q674 HydrophobicContact CG-CG 3.84Å; C532-Q674 PolarHBondContact O-N 2.75Å; C532-Q674 VanDerWaalsContact O-N 3.08Å; G533-Q674 CarbonylContact C-O 3.4Å; G533-Q674 WeakPolarHBondContact CA-O 3.43Å; R534-Q674 PolarHBondContact N-O 3.47Å; Q674-W766 VanDerWaalsContact CD-CZ2 3.49Å; Q674-W766 HydrophobicContact CG-CZ2 4.07Å; Q674-L767 CarbonylContact C-O 3.59Å; Q674-L767 WeakPolarHBondContact CA-O 3.38Å; Q674-E768 HydrophobicContact CG-CB 4.11Å; Q674-E768 HydrophobicContact CG-CG 4.11Å; Q674-E768 PolarHBondContact NE2-OE2 3.34Å
675	W	93.1	Very high	78.5	Confident	13 Å²	13	41.4 Å²	41.4	5%	0.049	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	146.9	174	-61.9	-101.5	0	0	0	110.2	R534 L536 L543 S544 C673 L767 F780	R534-W675 WeakPolarHBondContact O-CA 3.33Å; L536-W675 HydrophobicContact CD1-CB 4.37Å; L536-W675 HydrophobicContact CD1-CG 4.48Å; L543-W675 HydrophobicContact CD1-CD2 3.88Å; L543-W675 HydrophobicContact CD1-CE3 4.22Å; L543-W675 HydrophobicContact CD1-CG 4.09Å; S544-W675 VanDerWaalsContact O-CZ2 3.31Å; S544-W675 WeakPolarHBondContact O-CZ2 3.2Å; C673-W675 HydrophobicContact CB-CE3 4.35Å; C673-W675 HydrophobicContact CB-CH2 3.45Å; C673-W675 VanDerWaalsContact CB-CH2 3.45Å; C673-W675 HydrophobicContact CB-CZ2 4.09Å; C673-W675 HydrophobicContact CB-CZ3 3.6Å; W675-L767 HydrophobicContact CB-CB 4.41Å; W675-L767 HydrophobicContact CB-CD1 4.45Å; W675-L767 HydrophobicContact CE3-CB 4.47Å; W675-L767 PolarHBondContact N-O 3.48Å; W675-L767 PolarHBondContact O-N 3.27Å; W675-F780 HydrophobicContact CH2-CE1 4.23Å; W675-F780 AromaticContact CH2-CZ 3.93Å; W675-F780 HydrophobicContact CH2-CZ 3.93Å; W675-F780 HydrophobicContact CZ3-CE1 4.33Å; W675-F780 AromaticContact CZ3-CZ 3.93Å; W675-F780 HydrophobicContact CZ3-CZ 3.93Å
676	R	92.2	Very high	81.2	Confident	14 Å²	14	37.8 Å²	37.8	5%	0.053	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	115.1	170.2	-79.2	155.8	-69.4	127.7	16.3	107.7	T372 C373 L374 S375 R534 T535 L536 L765	T372-R676 PolarHBondContact O-NH1 3.24Å; T372-R676 PolarHBondContact O-NH2 2.76Å; C373-R676 VanDerWaalsContact C-NH1 3.29Å; C373-R676 PolarHBondContact O-NH1 2.86Å; L374-R676 PolarHBondContact O-NH1 3.45Å; S375-R676 WeakPolarHBondContact OG-CD 3.47Å; R534-R676 PolarHBondContact O-N 3.01Å; T535-R676 CarbonylContact C-O 3.57Å; T535-R676 VanDerWaalsContact CA-O 3.3Å; T535-R676 WeakPolarHBondContact CA-O 3.48Å; T535-R676 HydrophobicContact CG2-CB 4.3Å; T535-R676 PolarHBondContact OG1-NH1 3.3Å; T535-R676 PolarHBondContact OG1-NH2 2.81Å; L536-R676 PolarHBondContact N-O 3.3Å; R676-L765 CarbonylContact C-O 3.58Å; R676-L765 WeakPolarHBondContact CA-O 3.4Å
677	I	93.5	Very high	83.9	Confident	3 Å²	3	32.7 Å²	32.7	2%	0.015	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	119.3	172.8	-54.8	166.6	0	0	0	106.6	L536 L543 I685 L687 R764 L765 L767 Y784	L536-I677 HydrophobicContact CB-CB 4.47Å; L536-I677 HydrophobicContact CB-CG1 4.12Å; L536-I677 HydrophobicContact CD1-CG1 3.86Å; L543-I677 HydrophobicContact CD2-CD1 4.02Å; I677-I685 HydrophobicContact CB-CD1 3.91Å; I677-I685 HydrophobicContact CD1-CG2 4.21Å; I677-I685 HydrophobicContact CG2-CD1 3.64Å; I677-I685 HydrophobicContact CG2-CG1 4.03Å; I677-I685 HydrophobicContact CG2-CG2 3.99Å; I677-I685 WeakPolarHBondContact O-CD1 3.29Å; I677-L687 HydrophobicContact CD1-CD1 4.47Å; I677-R764 VanDerWaalsContact O-CA 3.26Å; I677-R764 WeakPolarHBondContact O-CA 3.34Å; I677-L765 HydrophobicContact CB-CB 4.37Å; I677-L765 HydrophobicContact CD1-CB 4.41Å; I677-L765 HydrophobicContact CD1-CD1 4.47Å; I677-L765 PolarHBondContact N-O 2.87Å; I677-L765 PolarHBondContact O-N 2.85Å; I677-L767 HydrophobicContact CD1-CD1 3.89Å; I677-L767 HydrophobicContact CG1-CD1 4.16Å; I677-Y784 HydrophobicContact CD1-CD1 4.45Å; I677-Y784 HydrophobicContact CD1-CD2 4.05Å; I677-Y784 HydrophobicContact CD1-CG 3.89Å; I677-Y784 HydrophobicContact CG1-CD2 4.34Å; I677-Y784 HydrophobicContact CG2-CD2 3.55Å; I677-Y784 HydrophobicContact CG2-CE2 3.63Å; I677-Y784 HydrophobicContact CG2-CG 4.46Å
678	N	90.1	Very high	86	Confident	4 Å²	4	33 Å²	33	2%	0.021	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	98.8	-179.7	-63.9	-8.5	0	0	0	110	E369 L536 L537 R764	E369-N678 VanDerWaalsContact CD-ND2 3.27Å; E369-N678 PolarHBondContact OE1-ND2 2.93Å; E369-N678 PolarHBondContact OE2-ND2 3.27Å; L536-N678 PolarHBondContact O-N 2.67Å; L537-N678 HydrophobicContact CD2-CB 3.88Å; N678-R764 PolarHBondContact ND2-NH1 3.28Å
679	A	88.9	Confident	87.8	Confident	14 Å²	14	30 Å²	30	12%	0.116	17%	0.166	C	C	.	.			trans	-78.8	-180	170	0	0	0	0	0	111.6	E683 I685 S763 A786	A679-E683 HydrophobicContact CB-CB 3.94Å; A679-I685 HydrophobicContact CB-CD1 4.47Å; A679-I685 HydrophobicContact CB-CG1 4.03Å; A679-S763 PolarHBondContact N-O 2.83Å; A679-A786 HydrophobicContact CB-CB 3.82Å
680	A	84.6	Confident	89.1	Confident	1 Å²	1	29.3 Å²	29.3	1%	0.008	16%	0.158	C	C	.	.			trans	-75.2	151.4	173.6	0	0	0	0	0	111.6	G682 E683 S763 T800	A680-G682 PolarHBondContact O-N 2.97Å; A680-E683 HydrophobicContact CB-CG 4.15Å; A680-E683 VanDerWaalsContact CB-OE2 3.28Å; A680-E683 WeakPolarHBondContact CB-OE2 3.16Å; A680-E683 PolarHBondContact N-OE2 2.89Å; A680-E683 WeakPolarHBondContact O-CB 3.41Å; A680-E683 PolarHBondContact O-N 2.78Å; A680-S763 WeakPolarHBondContact O-CB 3.06Å; A680-T800 WeakPolarHBondContact CB-OG1 3.25Å
681	S	79.4	Confident	89.7	Confident	28 Å²	28	27.3 Å²	27.3	20%	0.196	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.1	123.8	-177.6	-61.8	0	0	0	0	110.7	E378 T798 L799 T800	E378-S681 PolarHBondContact OE1-OG 2.98Å; S681-T798 CarbonylContact C-O 3.49Å; S681-L799 CarbonylContact O-C 3.43Å; S681-T800 PolarHBondContact N-OG1 2.94Å; S681-T800 WeakPolarHBondContact O-CB 3.26Å; S681-T800 WeakPolarHBondContact O-CG2 3.28Å; S681-T800 PolarHBondContact O-N 3.04Å; S681-T800 PolarHBondContact O-OG1 2.95Å
682	G	75.3	Confident	90	Very high	20 Å²	20	26.5 Å²	26.5	21%	0.206	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	91.8	0.4	-172.9	0	0	0	0	0	115.2	A680 T798 W816	A680-G682 PolarHBondContact O-N 2.97Å; G682-T798 WeakPolarHBondContact CA-O 3.36Å; G682-T798 PolarHBondContact N-O 2.87Å; G682-W816 PolarHBondContact O-NE1 2.99Å
683	E	87.7	Confident	90.1	Very high	8 Å²	8	23.9 Å²	23.9	4%	0.037	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	161.2	157.7	-57.9	-174.9	129.3	0	0	110.5	A679 A680 G762 S763 C788 P802	A679-E683 HydrophobicContact CB-CB 3.94Å; A680-E683 HydrophobicContact CB-CG 4.15Å; A680-E683 VanDerWaalsContact CB-OE2 3.28Å; A680-E683 WeakPolarHBondContact CB-OE2 3.16Å; A680-E683 PolarHBondContact N-OE2 2.89Å; A680-E683 WeakPolarHBondContact O-CB 3.41Å; A680-E683 PolarHBondContact O-N 2.78Å; E683-G762 CarbonylContact O-C 3.49Å; E683-S763 WeakPolarHBondContact O-CA 3.34Å; E683-S763 WeakPolarHBondContact O-CB 3.21Å; E683-S763 PolarHBondContact O-N 2.95Å; E683-C788 HydrophobicContact CG-CB 4.11Å; E683-P802 WeakPolarHBondContact OE1-CA 3.29Å; E683-P802 WeakPolarHBondContact OE1-CB 3.24Å
684	R	90.6	Very high	89.9	Confident	62 Å²	62	24 Å²	24	23%	0.234	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	162.2	169.8	-68.5	174.7	-67.4	163.8	2.8	109.3	I759 S760 A786 I787 G789	R684-I759 HydrophobicContact CB-CG2 4.29Å; R684-S760 WeakPolarHBondContact CD-O 3.31Å; R684-S760 WeakPolarHBondContact CG-O 3.44Å; R684-A786 CarbonylContact O-C 3.57Å; R684-A786 WeakPolarHBondContact O-CA 3.22Å; R684-I787 HydrophobicContact CB-CG1 4.22Å; R684-I787 PolarHBondContact N-O 3.17Å; R684-I787 VanDerWaalsContact O-CG1 3.29Å; R684-I787 WeakPolarHBondContact O-CG1 3.5Å; R684-I787 PolarHBondContact O-N 2.88Å; R684-G789 PolarHBondContact NH2-O 2.84Å
685	I	92.7	Very high	89.3	Confident	1 Å²	1	24 Å²	24	1%	0.005	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	118.1	-176.5	-58.3	154	0	0	0	108.9	I677 A679 I759 S760 S763 L765 E785	I677-I685 HydrophobicContact CB-CD1 3.91Å; I677-I685 HydrophobicContact CD1-CG2 4.21Å; I677-I685 HydrophobicContact CG2-CD1 3.64Å; I677-I685 HydrophobicContact CG2-CG1 4.03Å; I677-I685 HydrophobicContact CG2-CG2 3.99Å; I677-I685 WeakPolarHBondContact O-CD1 3.29Å; A679-I685 HydrophobicContact CB-CD1 4.47Å; A679-I685 HydrophobicContact CB-CG1 4.03Å; I685-I759 WeakPolarHBondContact O-CA 3.31Å; I685-S760 PolarHBondContact N-OG 2.99Å; I685-S760 PolarHBondContact O-N 2.84Å; I685-S763 WeakPolarHBondContact CD1-O 3.48Å; I685-L765 HydrophobicContact CB-CD1 3.92Å; I685-L765 HydrophobicContact CB-CG 4.25Å; I685-L765 HydrophobicContact CD1-CB 4.15Å; I685-L765 HydrophobicContact CD1-CG 4.05Å; I685-L765 HydrophobicContact CG2-CD1 3.69Å; I685-L765 HydrophobicContact CG2-CG 4.42Å; I685-E785 WeakPolarHBondContact CA-O 3.42Å
686	R	94.5	Very high	87.9	Confident	73 Å²	73	25.1 Å²	25.1	28%	0.275	14%	0.143	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82	134.3	165	174.6	-174.2	-71.5	145.5	0.5	108.4	Q757 L758 Y784 E785 I787	R686-Q757 HydrophobicContact CG-CG 4.27Å; R686-L758 CarbonylContact C-O 3.58Å; R686-L758 WeakPolarHBondContact CA-O 3.42Å; R686-Y784 CarbonylContact O-C 3.56Å; R686-Y784 VanDerWaalsContact O-CA 3.28Å; R686-Y784 WeakPolarHBondContact O-CA 3.23Å; R686-E785 HydrophobicContact CB-CB 4.35Å; R686-E785 WeakPolarHBondContact CD-OE2 3.35Å; R686-E785 IonicContact CZ-OE2 2.76Å; R686-E785 PolarHBondContact N-O 2.83Å; R686-E785 IonicContact NE-OE2 2.74Å; R686-E785 VanDerWaalsContact NH1-CD 3.31Å; R686-E785 IonicContact NH1-OE1 2.75Å; R686-E785 PolarHBondContact NH1-OE1 2.93Å; R686-E785 IonicContact NH1-OE2 3.17Å; R686-E785 PolarHBondContact NH1-OE2 2.99Å; R686-E785 PolarHBondContact O-N 3.16Å; R686-I787 HydrophobicContact CB-CD1 4.29Å
687	L	94.9	Very high	86	Confident	0 Å²	0	27 Å²	27	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	124	178	-178.5	71	0	0	0	110.2	L543 I677 F689 I735 L758 L765 L767 A782	L543-L687 HydrophobicContact CD2-CD1 4.44Å; I677-L687 HydrophobicContact CD1-CD1 4.47Å; L687-F689 HydrophobicContact CD2-CE2 3.99Å; L687-F689 HydrophobicContact CD2-CZ 4.41Å; L687-F689 HydrophobicContact CG-CE2 4.27Å; L687-I735 HydrophobicContact CD2-CD1 4.01Å; L687-I735 HydrophobicContact CD2-CG2 4.34Å; L687-L758 HydrophobicContact CB-CB 4.43Å; L687-L758 PolarHBondContact N-O 3.41Å; L687-L758 PolarHBondContact O-N 3.26Å; L687-L765 HydrophobicContact CB-CD1 4.27Å; L687-L765 HydrophobicContact CD2-CD1 4.34Å; L687-L767 HydrophobicContact CD2-CD2 3.88Å; L687-A782 HydrophobicContact CD1-CB 3.92Å
688	N	94.9	Very high	83.4	Confident	58 Å²	58	34.3 Å²	34.3	31%	0.31	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	132.8	178.7	-72.5	-20.3	0	0	0	110	Q757 A782 D783	N688-Q757 PolarHBondContact ND2-NE2 2.83Å; N688-Q757 WeakPolarHBondContact OD1-CB 3.4Å; N688-Q757 VanDerWaalsContact OD1-CG 3.29Å; N688-Q757 WeakPolarHBondContact OD1-CG 3.48Å; N688-Q757 PolarHBondContact OD1-NE2 3.33Å; N688-A782 CarbonylContact O-C 3.57Å; N688-A782 WeakPolarHBondContact O-CA 3.2Å; N688-A782 WeakPolarHBondContact O-CB 3.29Å; N688-D783 PolarHBondContact N-O 3.35Å; N688-D783 PolarHBondContact O-N 3.16Å
689	F	93.2	Very high	80.8	Confident	13 Å²	13	39 Å²	39	6%	0.057	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	128.2	169.3	-73.9	-99	0	0	0	110	L687 M692 V733 I735 L754 P755 F780 A782	L687-F689 HydrophobicContact CD2-CE2 3.99Å; L687-F689 HydrophobicContact CD2-CZ 4.41Å; L687-F689 HydrophobicContact CG-CE2 4.27Å; F689-M692 HydrophobicContact CD1-CE 3.42Å; F689-M692 VanDerWaalsContact CD1-CE 3.42Å; F689-M692 HydrophobicContact CE1-CE 3.48Å; F689-M692 VanDerWaalsContact CE1-CE 3.48Å; F689-M692 HydrophobicContact CG-CE 4.05Å; F689-M692 HydrophobicContact CZ-CE 4.16Å; F689-V733 HydrophobicContact CE1-CG1 4.12Å; F689-V733 HydrophobicContact CZ-CG1 4.19Å; F689-V733 HydrophobicContact CZ-CG2 4.47Å; F689-I735 HydrophobicContact CE2-CD1 3.61Å; F689-I735 HydrophobicContact CZ-CD1 3.65Å; F689-L754 HydrophobicContact CB-CD2 4.01Å; F689-P755 HydrophobicContact CD2-CB 3.88Å; F689-P755 HydrophobicContact CD2-CG 3.68Å; F689-P755 HydrophobicContact CE2-CB 4.26Å; F689-P755 HydrophobicContact CE2-CG 3.97Å; F689-P755 HydrophobicContact CG-CG 4.02Å; F689-F780 HydrophobicContact CD1-CB 4.34Å; F689-F780 AromaticContact CD1-CD2 3.98Å; F689-F780 HydrophobicContact CD1-CD2 3.98Å; F689-F780 HydrophobicContact CD1-CG 4.49Å; F689-F780 HydrophobicContact CE1-CB 4.39Å; F689-F780 AromaticContact CE1-CD2 3.54Å; F689-F780 HydrophobicContact CE1-CD2 3.54Å; F689-F780 HydrophobicContact CE1-CE2 4.08Å; F689-F780 HydrophobicContact CE1-CG 4.12Å; F689-A782 HydrophobicContact CD1-CB 3.79Å; F689-A782 HydrophobicContact CD2-CB 4.37Å; F689-A782 HydrophobicContact CE1-CB 3.83Å; F689-A782 HydrophobicContact CE2-CB 4.39Å; F689-A782 HydrophobicContact CG-CB 4.07Å; F689-A782 HydrophobicContact CZ-CB 4.13Å
690	T	91.7	Very high	78	Confident	67 Å²	67	45.1 Å²	45.1	41%	0.411	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	-14.1	174.5	49.6	0	0	0	0	113.3	I781 D783	T690-I781 PolarHBondContact N-O 2.84Å; T690-D783 WeakPolarHBondContact CG2-OD2 3.46Å; T690-D783 PolarHBondContact OG1-OD2 2.86Å
691	H	92.7	Very high	75.3	Confident	53 Å²	53	52 Å²	52	25%	0.245	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	139.9	167.2	-177.2	73.7	0	0	0	110.1	T778 F780 I781	H691-T778 PolarHBondContact NE2-OG1 2.82Å; H691-F780 CarbonylContact O-C 3.46Å; H691-F780 WeakPolarHBondContact O-CA 3.28Å; H691-F780 WeakPolarHBondContact O-CB 3.48Å; H691-I781 HydrophobicContact CB-CB 4.09Å; H691-I781 HydrophobicContact CB-CD1 4.33Å; H691-I781 HydrophobicContact CB-CG1 4.11Å; H691-I781 PolarHBondContact N-O 3Å; H691-I781 PolarHBondContact O-N 3.05Å
692	M	90.3	Very high	72.7	Confident	7 Å²	7	55.4 Å²	55.4	3%	0.034	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	134.7	167.5	-173.7	170.4	-68.9	0	0	110.7	F689 I694 V733 Q752 L754 P755 G779	F689-M692 HydrophobicContact CD1-CE 3.42Å; F689-M692 VanDerWaalsContact CD1-CE 3.42Å; F689-M692 HydrophobicContact CE1-CE 3.48Å; F689-M692 VanDerWaalsContact CE1-CE 3.48Å; F689-M692 HydrophobicContact CG-CE 4.05Å; F689-M692 HydrophobicContact CZ-CE 4.16Å; M692-I694 HydrophobicContact CE-CD1 4.34Å; M692-I694 HydrophobicContact CG-CD1 4.08Å; M692-I694 HydrophobicContact CG-CG1 4.13Å; M692-I694 HydrophobicContact SD-CD1 4.24Å; M692-V733 HydrophobicContact CE-CG1 3.5Å; M692-Q752 WeakPolarHBondContact O-CA 3.48Å; M692-L754 HydrophobicContact CB-CD2 3.95Å; M692-P755 VanDerWaalsContact CE-CD 3.47Å; M692-P755 HydrophobicContact CE-CG 3.54Å; M692-P755 HydrophobicContact SD-CG 4.21Å; M692-G779 CarbonylContact C-O 3.45Å; M692-G779 WeakPolarHBondContact CA-O 3.37Å
693	D	89.6	Confident	70.5	Confident	23 Å²	23	61.1 Å²	61.1	12%	0.123	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.9	91	175.7	172.1	45.2	0	0	0	107.1	G751 Q752 T777 T778 G779	D693-G751 WeakPolarHBondContact CA-O 3.37Å; D693-Q752 HydrophobicContact CB-CG 4.04Å; D693-Q752 WeakPolarHBondContact OD1-CG 3.2Å; D693-Q752 PolarHBondContact OD1-NE2 2.75Å; D693-T777 WeakPolarHBondContact O-CB 3.3Å; D693-T777 PolarHBondContact O-OG1 3.11Å; D693-T778 VanDerWaalsContact CB-OG1 3.29Å; D693-T778 WeakPolarHBondContact CB-OG1 3.47Å; D693-T778 WeakPolarHBondContact OD2-CB 3.48Å; D693-T778 PolarHBondContact OD2-N 3.11Å; D693-T778 PolarHBondContact OD2-OG1 2.81Å; D693-G779 CarbonylContact C-O 2.91Å; D693-G779 PolarHBondContact N-O 2.86Å; D693-G779 VanDerWaalsContact O-CA 3.25Å; D693-G779 WeakPolarHBondContact O-CA 3.36Å; D693-G779 PolarHBondContact O-N 3.43Å; D693-G779 VanDerWaalsContact O-O 3.13Å
694	I	87.1	Confident	67.6	Low	2 Å²	2	68.8 Å²	68.8	1%	0.01	37%	0.37	C	S	.	.	B	Isolated β-bridge	trans	-127.9	140.8	-176.4	-60.4	175.1	0	0	0	106.9	M692 G696 D731 V733 C750 G751 Y769 F780	M692-I694 HydrophobicContact CE-CD1 4.34Å; M692-I694 HydrophobicContact CG-CD1 4.08Å; M692-I694 HydrophobicContact CG-CG1 4.13Å; M692-I694 HydrophobicContact SD-CD1 4.24Å; I694-G696 PolarHBondContact O-N 2.95Å; I694-D731 HydrophobicContact CG2-CB 3.75Å; I694-V733 HydrophobicContact CD1-CB 4.07Å; I694-V733 HydrophobicContact CD1-CG1 3.93Å; I694-C750 HydrophobicContact CB-CB 4.45Å; I694-C750 HydrophobicContact CG2-CB 4.12Å; I694-G751 PolarHBondContact N-O 2.96Å; I694-G751 WeakPolarHBondContact O-CA 3.3Å; I694-G751 PolarHBondContact O-N 2.81Å; I694-Y769 HydrophobicContact CD1-CD2 4.19Å; I694-Y769 HydrophobicContact CD1-CE2 3.85Å; I694-Y769 HydrophobicContact CG1-CE2 3.99Å; I694-Y769 HydrophobicContact CG2-CE2 4.29Å; I694-F780 HydrophobicContact CD1-CB 4.45Å; I694-F780 HydrophobicContact CD1-CD1 4.31Å
695	S	78.4	Confident	64.7	Low	40 Å²	40	72.1 Å²	72.1	28%	0.28	40%	0.398	S	S	.	.	P	Polyproline II helix	trans	-62.7	127.4	-172.5	78.6	0	0	0	0	111.8	D731	S695-D731 WeakPolarHBondContact CB-OD2 3.41Å; S695-D731 WeakPolarHBondContact OG-CB 2.97Å; S695-D731 PolarHBondContact OG-OD2 3.03Å
696	G	63.2	Low	61.6	Low	36 Å²	36	77.6 Å²	77.6	37%	0.371	43%	0.434	S	S	.	.	P	Polyproline II helix	trans	-83.6	168.3	177.2	0	0	0	0	0	111.9	I694 I698	I694-G696 PolarHBondContact O-N 2.95Å; G696-I698 PolarHBondContact O-N 2.97Å
697	P	53.1	Low	58.5	Low	54 Å²	54	81.4 Å²	81.4	35%	0.351	46%	0.46	S	S	.	.	P	Polyproline II helix	trans	-60	135	166.9	28.2	-34.3	0	0	0	109.7	T699 I726	P697-T699 PolarHBondContact O-N 3.44Å; P697-T699 VanDerWaalsContact O-N 3.16Å; P697-I726 VanDerWaalsContact CD-CG2 3.49Å; P697-I726 HydrophobicContact CG-CG2 3.45Å; P697-I726 VanDerWaalsContact CG-CG2 3.45Å
698	I	39.5	Very low	55.6	Low	157 Å²	157	89.5 Å²	89.5	81%	0.805	50%	0.503	S	S	*	.			trans	-68.5	110.7	179.1	-58.5	168.3	0	0	0	108.3	G696	G696-I698 PolarHBondContact O-N 2.97Å
699	T	34.6	Very low	52.7	Low	101 Å²	101	94.1 Å²	94.1	62%	0.62	53%	0.527	S	S	*	.			trans	-74.1	130.9	158.6	56.4	0	0	0	0	108	P697 D701	P697-T699 PolarHBondContact O-N 3.44Å; P697-T699 VanDerWaalsContact O-N 3.16Å; T699-D701 WeakPolarHBondContact CB-OD2 3.4Å; T699-D701 PolarHBondContact O-N 2.93Å; T699-D701 PolarHBondContact OG1-OD2 2.83Å
700	Q	29.6	Very low	49.7	Very low	144 Å²	144	101.6 Å²	101.6	67%	0.673	57%	0.567	S	S	*	*			trans	-82	57.9	177.1	-69.9	-170.8	-89.9	0	0	111.1	S702 I703	Q700-S702 PolarHBondContact O-N 3.35Å; Q700-I703 PolarHBondContact O-N 3.45Å
701	D	28.1	Very low	47.1	Very low	144 Å²	144	103.2 Å²	103.2	77%	0.77	57%	0.573	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.5	50.7	171.5	-63	-57.6	0	0	0	111	T699	T699-D701 WeakPolarHBondContact CB-OD2 3.4Å; T699-D701 PolarHBondContact O-N 2.93Å; T699-D701 PolarHBondContact OG1-OD2 2.83Å
702	S	26	Very low	44.5	Very low	101 Å²	101	108.1 Å²	108.1	71%	0.706	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-144.1	19.1	173.6	58.8	0	0	0	0	112	Q700	Q700-S702 PolarHBondContact O-N 3.35Å
703	I	28.1	Very low	42	Very low	139 Å²	139	116.2 Å²	116.2	71%	0.713	64%	0.638	S	S	*	*	P	Polyproline II helix	trans	-77.5	123.9	167.3	-64.2	176.7	0	0	0	108.4	Q700	Q700-I703 PolarHBondContact O-N 3.45Å
704	H	27.5	Very low	39.5	Very low	169 Å²	169	122.7 Å²	122.7	78%	0.782	67%	0.665	S	S	*	*	P	Polyproline II helix	trans	-55.9	151.8	175.8	-83.1	-77.5	0	0	0	112.5	P706	H704-P706 WeakPolarHBondContact O-CD 3.37Å
705	T	28.9	Very low	37.1	Very low	132 Å²	132	126.4 Å²	126.4	81%	0.81	70%	0.696	S	S	*	*	P	Polyproline II helix	trans	-55.8	130.1	159.9	48.9	0	0	0	0	111.3
706	P	28.7	Very low	34.9	Very low	117 Å²	117	133.3 Å²	133.3	76%	0.76	72%	0.717	S	S	*	*				-131.9	153.7	129.5	38.2	-31.5	0	0	0	112.8	H704	H704-P706 WeakPolarHBondContact O-CD 3.37Å
707	N	28.8	Very low	33.6	Very low	153 Å²	153	140.9 Å²	140.9	82%	0.818	74%	0.743	S	S	*	*			trans	-82.1	128.3	-179	-48.6	-54.6	0	0	0	111.3
708	N	33.9	Very low	32.4	Very low	169 Å²	169	144.2 Å²	144.2	90%	0.904	76%	0.757	S	S	*	*				-167	160.5	126.4	-116.9	-54.6	0	0	0	114.8
709	L	32.9	Very low	31.9	Very low	156 Å²	156	142.9 Å²	142.9	82%	0.817	75%	0.752	S	S	*	*			trans	-112.7	82.9	-174.7	-179.5	77.6	0	0	0	110.3
710	N	31.2	Very low	31.6	Very low	169 Å²	169	145.3 Å²	145.3	90%	0.904	76%	0.756	S	S	*	*			trans	-172.9	64.2	168.6	-102.6	-26	0	0	0	114.8
711	D	36.7	Very low	31.4	Very low	101 Å²	101	147.1 Å²	147.1	54%	0.54	76%	0.762	S	S	.	*			trans	-147	34.8	165.3	-146.8	-4.1	0	0	0	113.3	H713 K714	D711-H713 PolarHBondContact O-N 2.69Å; D711-K714 IonicContact OD1-NZ 2.7Å; D711-K714 PolarHBondContact OD1-NZ 3.16Å; D711-K714 IonicContact OD2-NZ 2.71Å; D711-K714 PolarHBondContact OD2-NZ 2.93Å
712	L	38.7	Very low	31.4	Very low	156 Å²	156	145.9 Å²	145.9	82%	0.817	76%	0.764	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.7	-8.2	-176.2	-162.5	65.9	0	0	0	113.8
713	H	38.2	Very low	31.7	Very low	177 Å²	177	149 Å²	149	82%	0.819	77%	0.772	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91	-11.3	-174.1	-119.5	91.1	0	0	0	115	D711	D711-H713 PolarHBondContact O-N 2.69Å
714	K	37.5	Very low	31.8	Very low	159 Å²	159	150.4 Å²	150.4	69%	0.691	78%	0.78	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.8	-5.8	172.7	-65	-170.3	-173.4	77.7	0	113.9	D711	D711-K714 IonicContact OD1-NZ 2.7Å; D711-K714 PolarHBondContact OD1-NZ 3.16Å; D711-K714 IonicContact OD2-NZ 2.71Å; D711-K714 PolarHBondContact OD2-NZ 2.93Å
715	A	35.9	Very low	32.4	Very low	81 Å²	81	153.3 Å²	153.3	67%	0.669	78%	0.784	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.4	5	-176.5	0	0	0	0	0	114.1
716	Y	32.8	Very low	33.6	Very low	184 Å²	184	153 Å²	153	72%	0.722	78%	0.776	S	S	*	*			trans	-125.4	3.7	-166.8	-125.5	-90.5	0	0	0	116.5	L718	Y716-L718 HydrophobicContact CD1-CD1 4.15Å; Y716-L718 HydrophobicContact CE1-CD1 4.32Å; Y716-L718 WeakPolarHBondContact O-CD1 3.29Å; Y716-L718 PolarHBondContact O-N 3.05Å; Y716-L718 VanDerWaalsContact O-N 3.09Å
717	E	34.4	Very low	35	Very low	196 Å²	196	150.5 Å²	150.5	92%	0.916	76%	0.762	S	S	*	*			trans	-78.4	91.6	162.8	-72.2	-161.4	131.9	0	0	109.7
718	L	29.2	Very low	37.2	Very low	123 Å²	123	143.8 Å²	143.8	64%	0.644	73%	0.727	S	S	*	*			trans	-62.2	159.2	169.1	-79.2	73	0	0	0	111.1	Y716	Y716-L718 HydrophobicContact CD1-CD1 4.15Å; Y716-L718 HydrophobicContact CE1-CD1 4.32Å; Y716-L718 WeakPolarHBondContact O-CD1 3.29Å; Y716-L718 PolarHBondContact O-N 3.05Å; Y716-L718 VanDerWaalsContact O-N 3.09Å
719	N	28	Very low	39.3	Very low	129 Å²	129	140.9 Å²	140.9	69%	0.69	71%	0.71	S	S	*	*			trans	93.1	133.1	163.7	-56.2	-73.3	0	0	0	116.1
720	Q	27.5	Very low	41.4	Very low	153 Å²	153	138.6 Å²	138.6	72%	0.715	70%	0.699	S	S	*	*			cis	-149	127.5	4.6	-125.6	156.5	60.2	0	0	113.3
721	K	26	Very low	44.1	Very low	182 Å²	182	130.7 Å²	130.7	79%	0.791	66%	0.656	S	S	*	*	S	Bend	trans	59.4	99.4	161.1	-63.9	178.7	179.7	176.6	0	118.4
722	S	29.3	Very low	46.7	Very low	118 Å²	118	126.2 Å²	126.2	83%	0.825	63%	0.632	S	S	*	*			trans	62.5	49.2	145.1	61.2	0	0	0	0	119.2
723	I	32.1	Very low	49.3	Very low	167 Å²	167	118.8 Å²	118.8	86%	0.856	59%	0.593	S	S	*	*			trans	-104	78.9	159.9	-55.7	-179.8	0	0	0	109.2
724	N	29.5	Very low	51.9	Low	167 Å²	167	110.8 Å²	110.8	89%	0.893	56%	0.556	S	S	*	*			trans	-157.7	68.3	160.9	-124.5	-6.2	0	0	0	109.2
725	R	39.7	Very low	54.6	Low	230 Å²	230	103.2 Å²	103.2	87%	0.868	52%	0.523	S	S	*	.			trans	-111.6	124.1	168.9	-81.7	-168.8	174.6	-164.1	-0.5	109	S727	R725-S727 PolarHBondContact O-N 2.78Å; R725-S727 VanDerWaalsContact O-N 3.15Å
726	I	53.9	Low	57.3	Low	125 Å²	125	101.4 Å²	101.4	64%	0.641	50%	0.499	S	S	*	.			trans	-41.1	112.9	175	-62.6	170	0	0	0	109.7	P697 C728	P697-I726 VanDerWaalsContact CD-CG2 3.49Å; P697-I726 HydrophobicContact CG-CG2 3.45Å; P697-I726 VanDerWaalsContact CG-CG2 3.45Å; I726-C728 PolarHBondContact O-N 3.08Å; I726-C728 VanDerWaalsContact O-N 3.1Å
727	S	59.5	Low	60.1	Low	66 Å²	66	93.9 Å²	93.9	46%	0.462	47%	0.471	S	S	.	.			trans	-85.9	85.6	-170.3	53.7	0	0	0	0	111.7	R725 I729	R725-S727 PolarHBondContact O-N 2.78Å; R725-S727 VanDerWaalsContact O-N 3.15Å; S727-I729 PolarHBondContact O-N 2.86Å
728	C	75.1	Confident	62.7	Low	12 Å²	12	85.1 Å²	85.1	8%	0.081	43%	0.433	C	S	.	.			trans	-67	76	170.8	-50.6	0	0	0	0	110.9	I726 Y732 R748 C750	I726-C728 PolarHBondContact O-N 3.08Å; I726-C728 VanDerWaalsContact O-N 3.1Å; C728-Y732 WeakPolarHBondContact O-CD1 3Å; C728-R748 HydrophobicContact CB-CG 4.13Å; C728-R748 WeakPolarHBondContact O-CD 3.25Å; C728-R748 PolarHBondContact O-NH1 3.32Å; C728-C750 VanDerWaalsContact CA-SG 3.54Å; C728-C750 HydrophobicContact CB-CB 3.67Å; C728-C750 WeakPolarHBondContact CB-SG 2.97Å; C728-C750 WeakPolarHBondContact SG-CB 3.42Å; C728-C750 PolarHBondContact SG-N 3.15Å; C728-C750 CovalentContact SG-SG 2.04Å; C728-C750 PolarHBondContact SG-SG 2.72Å
729	I	76.4	Confident	65.4	Low	108 Å²	108	81.2 Å²	81.2	55%	0.554	41%	0.41	S	S	*	.			trans	-89	-49.1	-173.8	-66.1	167.2	0	0	0	111.3	S727	S727-I729 PolarHBondContact O-N 2.86Å
730	N	78.3	Confident	68.1	Low	107 Å²	107	78.2 Å²	78.2	57%	0.572	39%	0.39	S	S	*	.	S	Bend	trans	-88.5	-53.7	-169.4	-67.6	-13.3	0	0	0	112
731	D	88.1	Confident	70.7	Confident	3 Å²	3	73.8 Å²	73.8	2%	0.016	38%	0.376	C	S	.	.	S	Bend	trans	-114	135.9	176.3	-66.1	10.4	0	0	0	109.1	I694 S695 R770 S772 S775	I694-D731 HydrophobicContact CG2-CB 3.75Å; S695-D731 WeakPolarHBondContact CB-OD2 3.41Å; S695-D731 WeakPolarHBondContact OG-CB 2.97Å; S695-D731 PolarHBondContact OG-OD2 3.03Å; D731-R770 VanDerWaalsContact CA-O 3.3Å; D731-R770 WeakPolarHBondContact CA-O 3.37Å; D731-S772 WeakPolarHBondContact OD1-CB 3.33Å; D731-S772 PolarHBondContact OD1-N 3.45Å; D731-S772 PolarHBondContact OD1-OG 3.27Å; D731-S775 WeakPolarHBondContact OD2-CB 3.35Å; D731-S775 PolarHBondContact OD2-OG 3.14Å
732	Y	91.1	Very high	73.4	Confident	7 Å²	7	67.2 Å²	67.2	3%	0.027	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-165.1	159.1	178.5	53.8	-101.9	0	0	0	112.8	C728 E734 R748 Y749 E768 Y769 R770	C728-Y732 WeakPolarHBondContact O-CD1 3Å; Y732-E734 HydrophobicContact CD2-CB 3.73Å; Y732-E734 HydrophobicContact CE2-CB 3.85Å; Y732-R748 VanDerWaalsContact CB-CG 3.49Å; Y732-R748 HydrophobicContact CD1-CG 4.49Å; Y732-R748 HydrophobicContact CD2-CG 4.08Å; Y732-R748 VanDerWaalsContact CE1-NH1 3.29Å; Y732-R748 HydrophobicContact CG-CG 3.81Å; Y732-Y749 WeakPolarHBondContact CA-O 3.44Å; Y732-E768 HydrophobicContact CE2-CG 4.09Å; Y732-E768 VanDerWaalsContact CE2-OE1 3.27Å; Y732-E768 WeakPolarHBondContact CE2-OE1 3.42Å; Y732-E768 PolarHBondContact OH-OE1 3.02Å; Y732-Y769 WeakPolarHBondContact O-CA 3.45Å; Y732-Y769 VanDerWaalsContact O-CD2 3.29Å; Y732-Y769 WeakPolarHBondContact O-CD2 3.5Å; Y732-R770 HydrophobicContact CD1-CB 4.23Å; Y732-R770 HydrophobicContact CD2-CB 4.11Å; Y732-R770 HydrophobicContact CE1-CB 3.91Å; Y732-R770 VanDerWaalsContact CE1-CD 3.46Å; Y732-R770 HydrophobicContact CE1-CG 4.29Å; Y732-R770 HydrophobicContact CE2-CB 3.76Å; Y732-R770 HydrophobicContact CG-CB 4.33Å; Y732-R770 PolarHBondContact N-O 2.88Å; Y732-R770 PolarHBondContact O-N 3.29Å; Y732-R770 VanDerWaalsContact OH-CD 3.31Å; Y732-R770 WeakPolarHBondContact OH-CD 3.32Å
733	V	92.2	Very high	76.1	Confident	0 Å²	0	61.9 Å²	61.9	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	125.4	146.7	65.1	0	0	0	0	109.2	F689 M692 I694 I735 R748 Y749 E768 F780	F689-V733 HydrophobicContact CE1-CG1 4.12Å; F689-V733 HydrophobicContact CZ-CG1 4.19Å; F689-V733 HydrophobicContact CZ-CG2 4.47Å; M692-V733 HydrophobicContact CE-CG1 3.5Å; I694-V733 HydrophobicContact CD1-CB 4.07Å; I694-V733 HydrophobicContact CD1-CG1 3.93Å; V733-I735 HydrophobicContact CG2-CG1 4.37Å; V733-R748 CarbonylContact O-C 3.54Å; V733-R748 WeakPolarHBondContact O-CA 3.32Å; V733-Y749 HydrophobicContact CG1-CD2 4.46Å; V733-Y749 PolarHBondContact N-O 3.06Å; V733-Y749 PolarHBondContact O-N 2.95Å; V733-E768 CarbonylContact C-O 3.49Å; V733-E768 WeakPolarHBondContact CA-O 3.47Å; V733-F780 HydrophobicContact CG2-CE1 4.43Å; V733-F780 HydrophobicContact CG2-CZ 4.41Å
734	E	92.8	Very high	78.9	Confident	9 Å²	9	58.6 Å²	58.6	4%	0.042	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	136.3	177.2	-179.7	164.7	112.9	0	0	109.4	Y732 R736 L745 R748 L767 E768	Y732-E734 HydrophobicContact CD2-CB 3.73Å; Y732-E734 HydrophobicContact CE2-CB 3.85Å; E734-R736 HydrophobicContact CG-CG 4.42Å; E734-R736 IonicContact OE1-CZ 3.59Å; E734-R736 IonicContact OE1-NE 3.2Å; E734-R736 PolarHBondContact OE1-NE 2.7Å; E734-R736 IonicContact OE1-NH2 3.53Å; E734-R736 PolarHBondContact OE1-NH2 2.94Å; E734-R736 IonicContact OE2-NH2 2.72Å; E734-L745 HydrophobicContact CG-CD1 3.52Å; E734-R748 HydrophobicContact CB-CG 4.19Å; E734-R748 IonicContact OE2-CZ 2.75Å; E734-R748 IonicContact OE2-NE 3.97Å; E734-R748 PolarHBondContact OE2-NE 2.79Å; E734-R748 IonicContact OE2-NH2 2.78Å; E734-R748 PolarHBondContact OE2-NH2 2.79Å; E734-L767 CarbonylContact O-C 3.45Å; E734-L767 VanDerWaalsContact O-CA 3.29Å; E734-L767 WeakPolarHBondContact O-CA 3.38Å; E734-E768 HydrophobicContact CB-CB 4.46Å; E734-E768 PolarHBondContact N-O 2.9Å; E734-E768 PolarHBondContact O-N 2.86Å
735	I	94.4	Very high	81.8	Confident	0 Å²	0	55 Å²	55	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	124.5	-172.8	-49.8	177.5	0	0	0	108.9	L687 F689 V733 I746 G747 Y749 L758 L765 L767	L687-I735 HydrophobicContact CD2-CD1 4.01Å; L687-I735 HydrophobicContact CD2-CG2 4.34Å; F689-I735 HydrophobicContact CE2-CD1 3.61Å; F689-I735 HydrophobicContact CZ-CD1 3.65Å; V733-I735 HydrophobicContact CG2-CG1 4.37Å; I735-I746 HydrophobicContact CG2-CD1 4.24Å; I735-I746 WeakPolarHBondContact O-CB 3.42Å; I735-I746 PolarHBondContact O-N 2.97Å; I735-G747 PolarHBondContact N-O 3Å; I735-G747 PolarHBondContact O-N 3.48Å; I735-Y749 HydrophobicContact CD1-CD2 3.96Å; I735-Y749 HydrophobicContact CD1-CE2 3.74Å; I735-Y749 HydrophobicContact CG1-CD2 4.33Å; I735-Y749 HydrophobicContact CG1-CE2 4.2Å; I735-L758 HydrophobicContact CD1-CD1 3.6Å; I735-L758 HydrophobicContact CG2-CD1 4.19Å; I735-L765 HydrophobicContact CG2-CD2 4.32Å; I735-L767 HydrophobicContact CG1-CD2 4.41Å; I735-L767 HydrophobicContact CG2-CG 4.39Å
736	R	93.5	Very high	84.2	Confident	44 Å²	44	46.7 Å²	46.7	17%	0.166	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	141.2	-176	-59.9	-175.8	171.4	-100.3	0.1	111.5	E734 G738 S741 S743 P744 L745 L765 W766	E734-R736 HydrophobicContact CG-CG 4.42Å; E734-R736 IonicContact OE1-CZ 3.59Å; E734-R736 IonicContact OE1-NE 3.2Å; E734-R736 PolarHBondContact OE1-NE 2.7Å; E734-R736 IonicContact OE1-NH2 3.53Å; E734-R736 PolarHBondContact OE1-NH2 2.94Å; E734-R736 IonicContact OE2-NH2 2.72Å; R736-G738 PolarHBondContact O-N 2.87Å; R736-S741 WeakPolarHBondContact CD-O 3.13Å; R736-S741 PolarHBondContact NE-O 3.13Å; R736-S741 PolarHBondContact NH1-O 2.88Å; R736-S743 WeakPolarHBondContact CD-O 3.32Å; R736-S743 PolarHBondContact NH1-O 3.32Å; R736-P744 CarbonylContact C-O 3.58Å; R736-P744 WeakPolarHBondContact CA-O 3.37Å; R736-P744 WeakPolarHBondContact CB-O 3.3Å; R736-L745 HydrophobicContact CG-CD1 4.21Å; R736-L765 WeakPolarHBondContact O-CD2 3.49Å; R736-W766 HydrophobicContact CB-CB 4.42Å; R736-W766 HydrophobicContact CB-CE3 4.14Å; R736-W766 HydrophobicContact CG-CE3 3.89Å; R736-W766 HydrophobicContact CG-CZ3 4.24Å; R736-W766 PolarHBondContact N-O 2.04Å; R736-W766 PolarHBondContact O-N 2.65Å
737	D	91.6	Very high	85.9	Confident	25 Å²	25	41.2 Å²	41.2	13%	0.134	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	99.1	179.8	-154.3	-8.6	0	0	0	109.1	S743 P744 I746 S760 T761	D737-S743 VanDerWaalsContact O-CB 3.25Å; D737-S743 WeakPolarHBondContact O-CB 3.37Å; D737-P744 PolarHBondContact N-O 2.94Å; D737-P744 WeakPolarHBondContact O-CD 3.32Å; D737-I746 HydrophobicContact CB-CD1 3.89Å; D737-I746 HydrophobicContact CB-CG1 3.88Å; D737-S760 VanDerWaalsContact OD1-CB 3.3Å; D737-S760 WeakPolarHBondContact OD1-CB 3.34Å; D737-T761 PolarHBondContact OD1-N 2.93Å; D737-T761 PolarHBondContact OD1-OG1 2.81Å; D737-T761 VanDerWaalsContact OD2-CB 3.29Å; D737-T761 WeakPolarHBondContact OD2-CB 3.49Å; D737-T761 VanDerWaalsContact OD2-CG2 3.3Å; D737-T761 WeakPolarHBondContact OD2-CG2 3.44Å; D737-T761 PolarHBondContact OD2-N 3.46Å; D737-T761 PolarHBondContact OD2-OG1 3.39Å
738	G	89.2	Confident	87.3	Confident	12 Å²	12	42.6 Å²	42.6	12%	0.124	23%	0.234	C	C	.	.	S	Bend	trans	138.7	-154	-170.4	0	0	0	0	0	114.1	R736 R764 L765 W766	R736-G738 PolarHBondContact O-N 2.87Å; G738-R764 PolarHBondContact N-O 3.38Å; G738-R764 CarbonylContact O-C 3.48Å; G738-R764 VanDerWaalsContact O-C 3.25Å; G738-R764 WeakPolarHBondContact O-CB 3.05Å; G738-L765 CarbonylContact O-C 3.56Å; G738-L765 WeakPolarHBondContact O-CA 3.41Å; G738-L765 PolarHBondContact O-N 3.39Å; G738-W766 PolarHBondContact O-N 2.87Å; G738-W766 VanDerWaalsContact O-N 3.12Å
739	Y	85.8	Confident	88.1	Confident	41 Å²	41	44.2 Å²	44.2	16%	0.161	24%	0.238	C	C	.	.	S	Bend	trans	-119	-12	-162.7	48.7	-91.2	0	0	0	115.4	V344 V377 S743	V344-Y739 HydrophobicContact CB-CE2 4.46Å; V344-Y739 HydrophobicContact CG1-CD2 4.18Å; V344-Y739 HydrophobicContact CG1-CE2 3.66Å; V344-Y739 HydrophobicContact CG2-CD2 3.94Å; V344-Y739 HydrophobicContact CG2-CE2 3.89Å; V377-Y739 HydrophobicContact CG1-CD1 3.84Å; V377-Y739 HydrophobicContact CG1-CD2 3.81Å; V377-Y739 HydrophobicContact CG1-CE1 4.04Å; V377-Y739 HydrophobicContact CG1-CE2 4.01Å; V377-Y739 HydrophobicContact CG1-CG 3.72Å; Y739-S743 PolarHBondContact N-OG 3.23Å
740	Y	84.9	Confident	88.7	Confident	67 Å²	67	39.9 Å²	39.9	26%	0.263	22%	0.217	S	C	.	.	S	Bend	trans	-148.8	172.5	-176.1	80.3	-60.2	0	0	0	112.9	N342 V344 G742 S743	N342-Y740 HydrophobicContact CB-CD2 4.3Å; V344-Y740 HydrophobicContact CG2-CG 4.26Å; Y740-G742 VanDerWaalsContact CD2-N 3.33Å; Y740-G742 VanDerWaalsContact CE2-CA 3.5Å; Y740-G742 PolarHBondContact O-N 3Å; Y740-G742 VanDerWaalsContact O-N 3.09Å; Y740-S743 VanDerWaalsContact CD1-OG 3.26Å; Y740-S743 WeakPolarHBondContact CD1-OG 3.04Å; Y740-S743 PolarHBondContact N-OG 3.23Å; Y740-S743 VanDerWaalsContact N-OG 3.1Å; Y740-S743 WeakPolarHBondContact O-CB 3.17Å; Y740-S743 PolarHBondContact O-N 2.83Å; Y740-S743 PolarHBondContact O-OG 2.91Å
741	S	81.5	Confident	89.1	Confident	59 Å²	59	35.9 Å²	35.9	41%	0.413	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-20.5	-178.7	53.8	0	0	0	0	115.5	R736	R736-S741 WeakPolarHBondContact CD-O 3.13Å; R736-S741 PolarHBondContact NE-O 3.13Å; R736-S741 PolarHBondContact NH1-O 2.88Å
742	G	82.2	Confident	89	Confident	44 Å²	44	42.2 Å²	42.2	45%	0.454	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-6.2	174.9	0	0	0	0	0	115	Y740	Y740-G742 VanDerWaalsContact CD2-N 3.33Å; Y740-G742 VanDerWaalsContact CE2-CA 3.5Å; Y740-G742 PolarHBondContact O-N 3Å; Y740-G742 VanDerWaalsContact O-N 3.09Å
743	S	87.2	Confident	88.8	Confident	7 Å²	7	48.4 Å²	48.4	5%	0.049	27%	0.265	C	S	.	.	S	Bend	trans	-69.2	155.9	-177.9	-33	0	0	0	0	111.7	R736 D737 Y739 Y740 L745	R736-S743 WeakPolarHBondContact CD-O 3.32Å; R736-S743 PolarHBondContact NH1-O 3.32Å; D737-S743 VanDerWaalsContact O-CB 3.25Å; D737-S743 WeakPolarHBondContact O-CB 3.37Å; Y739-S743 PolarHBondContact N-OG 3.23Å; Y740-S743 VanDerWaalsContact CD1-OG 3.26Å; Y740-S743 WeakPolarHBondContact CD1-OG 3.04Å; Y740-S743 PolarHBondContact N-OG 3.23Å; Y740-S743 VanDerWaalsContact N-OG 3.1Å; Y740-S743 WeakPolarHBondContact O-CB 3.17Å; Y740-S743 PolarHBondContact O-N 2.83Å; Y740-S743 PolarHBondContact O-OG 2.91Å; S743-L745 PolarHBondContact O-N 3.36Å
744	P	90.2	Very high	88.6	Confident	97 Å²	97	52.8 Å²	52.8	63%	0.63	29%	0.288	S	S	*	.			trans	-46.7	131	177.4	-31.8	35.7	0	0	0	114.2	R736 D737 I746	R736-P744 CarbonylContact C-O 3.58Å; R736-P744 WeakPolarHBondContact CA-O 3.37Å; R736-P744 WeakPolarHBondContact CB-O 3.3Å; D737-P744 PolarHBondContact N-O 2.94Å; D737-P744 WeakPolarHBondContact O-CD 3.32Å; P744-I746 PolarHBondContact O-N 3.07Å
745	L	89.6	Confident	88.3	Confident	91 Å²	91	52.9 Å²	52.9	48%	0.476	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	115.2	-179.8	178.7	65.1	0	0	0	110.6	E734 R736 S743 G747	E734-L745 HydrophobicContact CG-CD1 3.52Å; R736-L745 HydrophobicContact CG-CD1 4.21Å; S743-L745 PolarHBondContact O-N 3.36Å; L745-G747 WeakPolarHBondContact CD1-O 3.29Å
746	I	90.6	Very high	88	Confident	57 Å²	57	57.1 Å²	57.1	29%	0.292	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	-47.3	171	-55.1	-178.8	0	0	0	109.1	I735 D737 P744 L758 L765	I735-I746 HydrophobicContact CG2-CD1 4.24Å; I735-I746 WeakPolarHBondContact O-CB 3.42Å; I735-I746 PolarHBondContact O-N 2.97Å; D737-I746 HydrophobicContact CB-CD1 3.89Å; D737-I746 HydrophobicContact CB-CG1 3.88Å; P744-I746 PolarHBondContact O-N 3.07Å; I746-L758 HydrophobicContact CG2-CD1 4.15Å; I746-L758 HydrophobicContact CG2-CD2 4.07Å; I746-L765 HydrophobicContact CD1-CD2 3.66Å
747	G	89	Confident	87.8	Confident	9 Å²	9	60 Å²	60	9%	0.093	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-179.7	166.7	177.4	0	0	0	0	0	113.4	I735 L745	I735-G747 PolarHBondContact N-O 3Å; I735-G747 PolarHBondContact O-N 3.48Å; L745-G747 WeakPolarHBondContact CD1-O 3.29Å
748	R	90.4	Very high	87.8	Confident	95 Å²	95	59.6 Å²	59.6	36%	0.358	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	131.7	171.5	-173	-169.4	-72.6	-160.5	-7.4	108.1	C728 Y732 V733 E734	C728-R748 HydrophobicContact CB-CG 4.13Å; C728-R748 WeakPolarHBondContact O-CD 3.25Å; C728-R748 PolarHBondContact O-NH1 3.32Å; Y732-R748 VanDerWaalsContact CB-CG 3.49Å; Y732-R748 HydrophobicContact CD1-CG 4.49Å; Y732-R748 HydrophobicContact CD2-CG 4.08Å; Y732-R748 VanDerWaalsContact CE1-NH1 3.29Å; Y732-R748 HydrophobicContact CG-CG 3.81Å; V733-R748 CarbonylContact O-C 3.54Å; V733-R748 WeakPolarHBondContact O-CA 3.32Å; E734-R748 HydrophobicContact CB-CG 4.19Å; E734-R748 IonicContact OE2-CZ 2.75Å; E734-R748 IonicContact OE2-NE 3.97Å; E734-R748 PolarHBondContact OE2-NE 2.79Å; E734-R748 IonicContact OE2-NH2 2.78Å; E734-R748 PolarHBondContact OE2-NH2 2.79Å
749	Y	91.5	Very high	87.8	Confident	47 Å²	47	62.8 Å²	62.8	18%	0.184	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	142.8	-166.4	-52.3	-88.6	0	0	0	111.3	Y732 V733 I735 P755 L758	Y732-Y749 WeakPolarHBondContact CA-O 3.44Å; V733-Y749 HydrophobicContact CG1-CD2 4.46Å; V733-Y749 PolarHBondContact N-O 3.06Å; V733-Y749 PolarHBondContact O-N 2.95Å; I735-Y749 HydrophobicContact CD1-CD2 3.96Å; I735-Y749 HydrophobicContact CD1-CE2 3.74Å; I735-Y749 HydrophobicContact CG1-CD2 4.33Å; I735-Y749 HydrophobicContact CG1-CE2 4.2Å; Y749-P755 HydrophobicContact CD1-CB 3.9Å; Y749-P755 HydrophobicContact CD1-CG 3.66Å; Y749-P755 HydrophobicContact CD2-CG 4.19Å; Y749-P755 HydrophobicContact CE1-CB 3.83Å; Y749-P755 HydrophobicContact CE1-CG 4.12Å; Y749-P755 HydrophobicContact CG-CB 4.3Å; Y749-P755 HydrophobicContact CG-CG 3.7Å; Y749-L758 HydrophobicContact CE2-CD1 4.37Å
750	C	89.4	Confident	88.1	Confident	16 Å²	16	60.9 Å²	60.9	11%	0.108	34%	0.336	C	S	.	.			trans	-157.2	173.6	175.4	63.1	0	0	0	0	109.5	I694 C728	I694-C750 HydrophobicContact CB-CB 4.45Å; I694-C750 HydrophobicContact CG2-CB 4.12Å; C728-C750 VanDerWaalsContact CA-SG 3.54Å; C728-C750 HydrophobicContact CB-CB 3.67Å; C728-C750 WeakPolarHBondContact CB-SG 2.97Å; C728-C750 WeakPolarHBondContact SG-CB 3.42Å; C728-C750 PolarHBondContact SG-N 3.15Å; C728-C750 CovalentContact SG-SG 2.04Å; C728-C750 PolarHBondContact SG-SG 2.72Å
751	G	86.6	Confident	88.2	Confident	23 Å²	23	63 Å²	63	24%	0.237	36%	0.356	C	S	.	.	B	Isolated β-bridge	trans	85.4	-157.2	-168.6	0	0	0	0	0	112.2	D693 I694	D693-G751 WeakPolarHBondContact CA-O 3.37Å; I694-G751 PolarHBondContact N-O 2.96Å; I694-G751 WeakPolarHBondContact O-CA 3.3Å; I694-G751 PolarHBondContact O-N 2.81Å
752	Q	86	Confident	88.4	Confident	136 Å²	136	61.6 Å²	61.6	64%	0.636	35%	0.351	S	S	*	.	S	Bend	trans	-110.6	-1.3	-179	-70.8	174.2	-6.7	0	0	113.7	M692 D693 L754	M692-Q752 WeakPolarHBondContact O-CA 3.48Å; D693-Q752 HydrophobicContact CB-CG 4.04Å; D693-Q752 WeakPolarHBondContact OD1-CG 3.2Å; D693-Q752 PolarHBondContact OD1-NE2 2.75Å; Q752-L754 PolarHBondContact O-N 3.02Å
753	N	85.9	Confident	88.7	Confident	138 Å²	138	60.5 Å²	60.5	74%	0.738	34%	0.336	S	S	*	.	P	Polyproline II helix	trans	-78	118.5	178.7	-68.2	-24.5	0	0	0	109.9
754	L	87.9	Confident	88.9	Confident	92 Å²	92	62.1 Å²	62.1	48%	0.482	34%	0.341	S	S	.	.	P	Polyproline II helix	trans	-60	130.2	174.7	-62.2	176.2	0	0	0	110.4	F689 M692 Q752	F689-L754 HydrophobicContact CB-CD2 4.01Å; M692-L754 HydrophobicContact CB-CD2 3.95Å; Q752-L754 PolarHBondContact O-N 3.02Å
755	P	87.6	Confident	89.1	Confident	11 Å²	11	57.5 Å²	57.5	7%	0.071	31%	0.311	C	S	.	.	P	Polyproline II helix	trans	-56.4	149.8	168.4	-26.2	34.8	0	0	0	111.9	F689 M692 Y749	F689-P755 HydrophobicContact CD2-CB 3.88Å; F689-P755 HydrophobicContact CD2-CG 3.68Å; F689-P755 HydrophobicContact CE2-CB 4.26Å; F689-P755 HydrophobicContact CE2-CG 3.97Å; F689-P755 HydrophobicContact CG-CG 4.02Å; M692-P755 VanDerWaalsContact CE-CD 3.47Å; M692-P755 HydrophobicContact CE-CG 3.54Å; M692-P755 HydrophobicContact SD-CG 4.21Å; Y749-P755 HydrophobicContact CD1-CB 3.9Å; Y749-P755 HydrophobicContact CD1-CG 3.66Å; Y749-P755 HydrophobicContact CD2-CG 4.19Å; Y749-P755 HydrophobicContact CE1-CB 3.83Å; Y749-P755 HydrophobicContact CE1-CG 4.12Å; Y749-P755 HydrophobicContact CG-CB 4.3Å; Y749-P755 HydrophobicContact CG-CG 3.7Å
756	P	88.1	Confident	89.3	Confident	89 Å²	89	53.6 Å²	53.6	58%	0.578	29%	0.29	S	S	*	.	P	Polyproline II helix	trans	-61	159	169.4	29.6	-35.8	0	0	0	110.6	L758	P756-L758 HydrophobicContact CG-CD2 4.39Å; P756-L758 WeakPolarHBondContact O-CG 3.37Å; P756-L758 PolarHBondContact O-N 2.84Å
757	Q	88.8	Confident	89.5	Confident	103 Å²	103	50.9 Å²	50.9	48%	0.481	28%	0.276	S	S	.	.	P	Polyproline II helix	trans	-52.7	123.9	171.3	170.9	165	104.8	0	0	110	R686 N688	R686-Q757 HydrophobicContact CG-CG 4.27Å; N688-Q757 PolarHBondContact ND2-NE2 2.83Å; N688-Q757 WeakPolarHBondContact OD1-CB 3.4Å; N688-Q757 VanDerWaalsContact OD1-CG 3.29Å; N688-Q757 WeakPolarHBondContact OD1-CG 3.48Å; N688-Q757 PolarHBondContact OD1-NE2 3.33Å
758	L	91.5	Very high	89.7	Confident	18 Å²	18	51.5 Å²	51.5	9%	0.094	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	144.9	176.8	-56	-178.8	0	0	0	109.7	R686 L687 I735 I746 Y749 P756	R686-L758 CarbonylContact C-O 3.58Å; R686-L758 WeakPolarHBondContact CA-O 3.42Å; L687-L758 HydrophobicContact CB-CB 4.43Å; L687-L758 PolarHBondContact N-O 3.41Å; L687-L758 PolarHBondContact O-N 3.26Å; I735-L758 HydrophobicContact CD1-CD1 3.6Å; I735-L758 HydrophobicContact CG2-CD1 4.19Å; I746-L758 HydrophobicContact CG2-CD1 4.15Å; I746-L758 HydrophobicContact CG2-CD2 4.07Å; Y749-L758 HydrophobicContact CE2-CD1 4.37Å; P756-L758 HydrophobicContact CG-CD2 4.39Å; P756-L758 WeakPolarHBondContact O-CG 3.37Å; P756-L758 PolarHBondContact O-N 2.84Å
759	I	90.1	Very high	89.8	Confident	78 Å²	78	47 Å²	47	40%	0.4	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	125.4	170.2	-59.2	177	0	0	0	106.6	R684 I685 I787	R684-I759 HydrophobicContact CB-CG2 4.29Å; I685-I759 WeakPolarHBondContact O-CA 3.31Å; I759-I787 HydrophobicContact CD1-CD1 4.49Å; I759-I787 HydrophobicContact CG2-CD1 4.18Å
760	S	92	Very high	89.7	Confident	2 Å²	2	50.6 Å²	50.6	1%	0.014	27%	0.273	C	S	.	.			trans	-70.6	154.6	176.2	60.1	0	0	0	0	112.5	R684 I685 D737 G762	R684-S760 WeakPolarHBondContact CD-O 3.31Å; R684-S760 WeakPolarHBondContact CG-O 3.44Å; I685-S760 PolarHBondContact N-OG 2.99Å; I685-S760 PolarHBondContact O-N 2.84Å; D737-S760 VanDerWaalsContact OD1-CB 3.3Å; D737-S760 WeakPolarHBondContact OD1-CB 3.34Å; S760-G762 WeakPolarHBondContact CB-O 3.21Å; S760-G762 PolarHBondContact OG-O 2.95Å
761	T	86.3	Confident	89.6	Confident	111 Å²	111	50.3 Å²	50.3	68%	0.681	27%	0.269	S	S	*	.	S	Bend	trans	-74.3	-31.2	173.1	55.5	0	0	0	0	112	D737	D737-T761 PolarHBondContact OD1-N 2.93Å; D737-T761 PolarHBondContact OD1-OG1 2.81Å; D737-T761 VanDerWaalsContact OD2-CB 3.29Å; D737-T761 WeakPolarHBondContact OD2-CB 3.49Å; D737-T761 VanDerWaalsContact OD2-CG2 3.3Å; D737-T761 WeakPolarHBondContact OD2-CG2 3.44Å; D737-T761 PolarHBondContact OD2-N 3.46Å; D737-T761 PolarHBondContact OD2-OG1 3.39Å
762	G	86	Confident	89.6	Confident	30 Å²	30	51 Å²	51	31%	0.309	27%	0.271	S	S	.	.	S	Bend	trans	-128.6	-168.6	177.7	0	0	0	0	0	114.2	E683 S760 R764	E683-G762 CarbonylContact O-C 3.49Å; S760-G762 WeakPolarHBondContact CB-O 3.21Å; S760-G762 PolarHBondContact OG-O 2.95Å; G762-R764 VanDerWaalsContact C-N 3.26Å; G762-R764 PolarHBondContact O-N 2.85Å
763	S	88.8	Confident	89.1	Confident	20 Å²	20	47.6 Å²	47.6	14%	0.14	27%	0.266	C	S	.	.	S	Bend	trans	-81.2	11.1	-172	60.7	0	0	0	0	115.5	A679 A680 E683 I685	A679-S763 PolarHBondContact N-O 2.83Å; A680-S763 WeakPolarHBondContact O-CB 3.06Å; E683-S763 WeakPolarHBondContact O-CA 3.34Å; E683-S763 WeakPolarHBondContact O-CB 3.21Å; E683-S763 PolarHBondContact O-N 2.95Å; I685-S763 WeakPolarHBondContact CD1-O 3.48Å
764	R	91.1	Very high	88.3	Confident	42 Å²	42	44 Å²	44	16%	0.158	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	136.9	-178.9	-59.3	-169.3	-175.1	-143.7	4.5	113.3	E369 F376 I677 N678 G738 G762	E369-R764 IonicContact OE1-CZ 3.52Å; E369-R764 IonicContact OE1-NH1 2.95Å; E369-R764 PolarHBondContact OE1-NH1 2.76Å; E369-R764 IonicContact OE1-NH2 2.71Å; E369-R764 IonicContact OE2-NH1 3.23Å; F376-R764 PolarHBondContact O-NH1 2.77Å; F376-R764 PolarHBondContact O-NH2 3.39Å; I677-R764 VanDerWaalsContact O-CA 3.26Å; I677-R764 WeakPolarHBondContact O-CA 3.34Å; N678-R764 PolarHBondContact ND2-NH1 3.28Å; G738-R764 PolarHBondContact N-O 3.38Å; G738-R764 CarbonylContact O-C 3.48Å; G738-R764 VanDerWaalsContact O-C 3.25Å; G738-R764 WeakPolarHBondContact O-CB 3.05Å; G762-R764 VanDerWaalsContact C-N 3.26Å; G762-R764 PolarHBondContact O-N 2.85Å
765	L	93.9	Very high	87.7	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	137.3	167.4	-78.1	177.8	0	0	0	110.2	R676 I677 I685 L687 I735 R736 G738 I746 L767	R676-L765 CarbonylContact C-O 3.58Å; R676-L765 WeakPolarHBondContact CA-O 3.4Å; I677-L765 HydrophobicContact CB-CB 4.37Å; I677-L765 HydrophobicContact CD1-CB 4.41Å; I677-L765 HydrophobicContact CD1-CD1 4.47Å; I677-L765 PolarHBondContact N-O 2.87Å; I677-L765 PolarHBondContact O-N 2.85Å; I685-L765 HydrophobicContact CB-CD1 3.92Å; I685-L765 HydrophobicContact CB-CG 4.25Å; I685-L765 HydrophobicContact CD1-CB 4.15Å; I685-L765 HydrophobicContact CD1-CG 4.05Å; I685-L765 HydrophobicContact CG2-CD1 3.69Å; I685-L765 HydrophobicContact CG2-CG 4.42Å; L687-L765 HydrophobicContact CB-CD1 4.27Å; L687-L765 HydrophobicContact CD2-CD1 4.34Å; I735-L765 HydrophobicContact CG2-CD2 4.32Å; R736-L765 WeakPolarHBondContact O-CD2 3.49Å; G738-L765 CarbonylContact O-C 3.56Å; G738-L765 WeakPolarHBondContact O-CA 3.41Å; G738-L765 PolarHBondContact O-N 3.39Å; I746-L765 HydrophobicContact CD1-CD2 3.66Å; L765-L767 HydrophobicContact CB-CD1 4.04Å
766	W	94.1	Very high	87	Confident	9 Å²	9	47 Å²	47	3%	0.034	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	128.9	170.9	-177.9	96.9	0	0	0	109.2	Q674 R736 G738 E768	Q674-W766 VanDerWaalsContact CD-CZ2 3.49Å; Q674-W766 HydrophobicContact CG-CZ2 4.07Å; R736-W766 HydrophobicContact CB-CB 4.42Å; R736-W766 HydrophobicContact CB-CE3 4.14Å; R736-W766 HydrophobicContact CG-CE3 3.89Å; R736-W766 HydrophobicContact CG-CZ3 4.24Å; R736-W766 PolarHBondContact N-O 2.04Å; R736-W766 PolarHBondContact O-N 2.65Å; G738-W766 PolarHBondContact O-N 2.87Å; G738-W766 VanDerWaalsContact O-N 3.12Å; W766-E768 HydrophobicContact CE3-CB 4.45Å; W766-E768 HydrophobicContact CH2-CB 3.53Å; W766-E768 HydrophobicContact CH2-CG 4.32Å; W766-E768 HydrophobicContact CZ2-CB 4.27Å; W766-E768 HydrophobicContact CZ3-CB 3.62Å
767	L	94.7	Very high	86.7	Confident	0 Å²	0	44 Å²	44	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	135.5	-178	-59.8	87.8	0	0	0	109.9	L543 Q674 W675 I677 L687 E734 I735 L765	L543-L767 HydrophobicContact CD1-CD2 4.3Å; Q674-L767 CarbonylContact C-O 3.59Å; Q674-L767 WeakPolarHBondContact CA-O 3.38Å; W675-L767 HydrophobicContact CB-CB 4.41Å; W675-L767 HydrophobicContact CB-CD1 4.45Å; W675-L767 HydrophobicContact CE3-CB 4.47Å; W675-L767 PolarHBondContact N-O 3.48Å; W675-L767 PolarHBondContact O-N 3.27Å; I677-L767 HydrophobicContact CD1-CD1 3.89Å; I677-L767 HydrophobicContact CG1-CD1 4.16Å; L687-L767 HydrophobicContact CD2-CD2 3.88Å; E734-L767 CarbonylContact O-C 3.45Å; E734-L767 VanDerWaalsContact O-CA 3.29Å; E734-L767 WeakPolarHBondContact O-CA 3.38Å; I735-L767 HydrophobicContact CG1-CD2 4.41Å; I735-L767 HydrophobicContact CG2-CG 4.39Å; L765-L767 HydrophobicContact CB-CD1 4.04Å
768	E	93	Very high	86.5	Confident	22 Å²	22	41.6 Å²	41.6	10%	0.103	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	125.9	170.6	175.8	173.2	105.6	0	0	110.2	L672 C673 Q674 Y732 V733 E734 W766	L672-E768 HydrophobicContact CD1-CG 3.63Å; C673-E768 WeakPolarHBondContact O-CA 3.36Å; Q674-E768 HydrophobicContact CG-CB 4.11Å; Q674-E768 HydrophobicContact CG-CG 4.11Å; Q674-E768 PolarHBondContact NE2-OE2 3.34Å; Y732-E768 HydrophobicContact CE2-CG 4.09Å; Y732-E768 VanDerWaalsContact CE2-OE1 3.27Å; Y732-E768 WeakPolarHBondContact CE2-OE1 3.42Å; Y732-E768 PolarHBondContact OH-OE1 3.02Å; V733-E768 CarbonylContact C-O 3.49Å; V733-E768 WeakPolarHBondContact CA-O 3.47Å; E734-E768 HydrophobicContact CB-CB 4.46Å; E734-E768 PolarHBondContact N-O 2.9Å; E734-E768 PolarHBondContact O-N 2.86Å; W766-E768 HydrophobicContact CE3-CB 4.45Å; W766-E768 HydrophobicContact CH2-CB 3.53Å; W766-E768 HydrophobicContact CH2-CG 4.32Å; W766-E768 HydrophobicContact CZ2-CB 4.27Å; W766-E768 HydrophobicContact CZ3-CB 3.62Å
769	Y	92.9	Very high	86.4	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	123.2	165.9	177.2	-119.7	0	0	0	109.6	Q547 I671 L672 C673 I694 Y732 R771 F780	Q547-Y769 PolarHBondContact NE2-OH 3.43Å; Q547-Y769 PolarHBondContact OE1-OH 3.09Å; I671-Y769 HydrophobicContact CG2-CD1 4.38Å; I671-Y769 HydrophobicContact CG2-CE1 4.49Å; L672-Y769 WeakPolarHBondContact CA-O 3.49Å; C673-Y769 PolarHBondContact N-O 2.76Å; C673-Y769 PolarHBondContact O-N 3.07Å; I694-Y769 HydrophobicContact CD1-CD2 4.19Å; I694-Y769 HydrophobicContact CD1-CE2 3.85Å; I694-Y769 HydrophobicContact CG1-CE2 3.99Å; I694-Y769 HydrophobicContact CG2-CE2 4.29Å; Y732-Y769 WeakPolarHBondContact O-CA 3.45Å; Y732-Y769 VanDerWaalsContact O-CD2 3.29Å; Y732-Y769 WeakPolarHBondContact O-CD2 3.5Å; Y769-R771 HydrophobicContact CE1-CB 4.06Å; Y769-F780 HydrophobicContact CD1-CE1 4.39Å; Y769-F780 HydrophobicContact CD2-CD1 4.01Å; Y769-F780 AromaticContact CD2-CE1 3.85Å; Y769-F780 HydrophobicContact CD2-CE1 3.85Å; Y769-F780 HydrophobicContact CE2-CD1 4.3Å; Y769-F780 HydrophobicContact CG-CD1 4.35Å; Y769-F780 AromaticContact CG-CE1 3.78Å; Y769-F780 HydrophobicContact CG-CE1 3.78Å
770	R	89.6	Confident	86.5	Confident	123 Å²	123	37 Å²	37	46%	0.464	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	135.4	174.8	-172.4	178.1	-178.9	153.6	-2.7	109.7	I671 L672 D731 Y732	I671-R770 WeakPolarHBondContact O-CA 3.37Å; L672-R770 HydrophobicContact CD1-CB 4.37Å; D731-R770 VanDerWaalsContact CA-O 3.3Å; D731-R770 WeakPolarHBondContact CA-O 3.37Å; Y732-R770 HydrophobicContact CD1-CB 4.23Å; Y732-R770 HydrophobicContact CD2-CB 4.11Å; Y732-R770 HydrophobicContact CE1-CB 3.91Å; Y732-R770 VanDerWaalsContact CE1-CD 3.46Å; Y732-R770 HydrophobicContact CE1-CG 4.29Å; Y732-R770 HydrophobicContact CE2-CB 3.76Å; Y732-R770 HydrophobicContact CG-CB 4.33Å; Y732-R770 PolarHBondContact N-O 2.88Å; Y732-R770 PolarHBondContact O-N 3.29Å; Y732-R770 VanDerWaalsContact OH-CD 3.31Å; Y732-R770 WeakPolarHBondContact OH-CD 3.32Å
771	R	87.5	Confident	86.6	Confident	9 Å²	9	37.1 Å²	37.1	3%	0.034	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	133.3	174.4	-169.3	-153.4	67	137.8	-6.1	110.9	S667 S669 P670 I671 Y769 S775	S667-R771 PolarHBondContact O-NH1 2.87Å; S667-R771 PolarHBondContact O-NH2 2.9Å; S667-R771 PolarHBondContact OG-NH2 3Å; S669-R771 PolarHBondContact O-NH2 3.21Å; P670-R771 CarbonylContact C-O 3.49Å; P670-R771 VanDerWaalsContact CA-O 3.28Å; P670-R771 WeakPolarHBondContact CA-O 3.35Å; I671-R771 HydrophobicContact CB-CB 4.23Å; I671-R771 PolarHBondContact N-O 2.87Å; I671-R771 PolarHBondContact O-N 3.48Å; Y769-R771 HydrophobicContact CE1-CB 4.06Å; R771-S775 PolarHBondContact NH1-O 2.76Å
772	S	85.6	Confident	87	Confident	38 Å²	38	31.8 Å²	31.8	27%	0.266	19%	0.192	S	C	.	.			trans	-71.1	157.7	177.9	-53.5	0	0	0	0	112.5	D731 S775	D731-S772 WeakPolarHBondContact OD1-CB 3.33Å; D731-S772 PolarHBondContact OD1-N 3.45Å; D731-S772 PolarHBondContact OD1-OG 3.27Å; S772-S775 PolarHBondContact O-N 3.38Å
773	A	75.9	Confident	87.4	Confident	65 Å²	65	32.2 Å²	32.2	54%	0.537	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.6	138.1	168.1	0	0	0	0	0	110.4	A668 S775	A668-A773 WeakPolarHBondContact O-CA 3.46Å; A668-A773 VanDerWaalsContact O-CB 3.24Å; A668-A773 WeakPolarHBondContact O-CB 3.23Å; A773-S775 VanDerWaalsContact C-N 3.27Å; A773-S775 PolarHBondContact O-N 3.22Å
774	G	70.2	Confident	87.7	Confident	61 Å²	61	31.5 Å²	31.5	63%	0.629	18%	0.181	S	C	*	.	T	Hydrogen-bonded Turn	trans	75.6	-3.5	179.2	0	0	0	0	0	116.8	M776	G774-M776 PolarHBondContact O-N 3.3Å
775	S	73.7	Confident	87.8	Confident	15 Å²	15	32.9 Å²	32.9	11%	0.105	19%	0.189	C	C	.	.			trans	-67.8	119.5	176.9	179.2	0	0	0	0	111.6	D731 R771 S772 A773	D731-S775 WeakPolarHBondContact OD2-CB 3.35Å; D731-S775 PolarHBondContact OD2-OG 3.14Å; R771-S775 PolarHBondContact NH1-O 2.76Å; S772-S775 PolarHBondContact O-N 3.38Å; A773-S775 VanDerWaalsContact C-N 3.27Å; A773-S775 PolarHBondContact O-N 3.22Å
776	M	72.9	Confident	87.6	Confident	152 Å²	152	33.6 Å²	33.6	75%	0.749	20%	0.196	S	C	*	.			trans	-88.6	2.7	-169.9	-69.4	-103.4	59	0	0	114.9	T666 G774	T666-M776 HydrophobicContact CG2-CE 3.95Å; G774-M776 PolarHBondContact O-N 3.3Å
777	T	82.1	Confident	87.5	Confident	26 Å²	26	34.4 Å²	34.4	16%	0.16	20%	0.2	C	C	.	.			trans	-73.5	154.4	-172.5	64.8	0	0	0	0	113.3	Q547 D693	Q547-T777 PolarHBondContact NE2-O 3.19Å; D693-T777 WeakPolarHBondContact O-CB 3.3Å; D693-T777 PolarHBondContact O-OG1 3.11Å
778	T	85.6	Confident	87.2	Confident	53 Å²	53	36 Å²	36	33%	0.325	21%	0.211	S	C	.	.			trans	-79	-16.7	-174.7	60	0	0	0	0	113.9	Q547 H691 D693	Q547-T778 WeakPolarHBondContact CB-O 3.04Å; H691-T778 PolarHBondContact NE2-OG1 2.82Å; D693-T778 VanDerWaalsContact CB-OG1 3.29Å; D693-T778 WeakPolarHBondContact CB-OG1 3.47Å; D693-T778 WeakPolarHBondContact OD2-CB 3.48Å; D693-T778 PolarHBondContact OD2-N 3.11Å; D693-T778 PolarHBondContact OD2-OG1 2.81Å
779	G	88.7	Confident	86.9	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	94.2	-135.6	173.7	0	0	0	0	0	113.4	S545 M692 D693	S545-G779 VanDerWaalsContact OG-CA 3.29Å; S545-G779 WeakPolarHBondContact OG-CA 3.19Å; M692-G779 CarbonylContact C-O 3.45Å; M692-G779 WeakPolarHBondContact CA-O 3.37Å; D693-G779 CarbonylContact C-O 2.91Å; D693-G779 PolarHBondContact N-O 2.86Å; D693-G779 VanDerWaalsContact O-CA 3.25Å; D693-G779 WeakPolarHBondContact O-CA 3.36Å; D693-G779 PolarHBondContact O-N 3.43Å; D693-G779 VanDerWaalsContact O-O 3.13Å
780	F	92.5	Very high	86.6	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	160	-176.4	77.5	-85.8	0	0	0	113.3	L543 S544 S545 W675 F689 H691 I694 V733 Y769 A782	L543-F780 HydrophobicContact CD1-CE2 3.61Å; L543-F780 HydrophobicContact CD1-CZ 3.85Å; S544-F780 VanDerWaalsContact CA-O 3.24Å; S544-F780 WeakPolarHBondContact CA-O 3.28Å; S544-F780 VanDerWaalsContact CB-O 3.32Å; S544-F780 WeakPolarHBondContact CB-O 3.23Å; S545-F780 PolarHBondContact N-O 3.48Å; S545-F780 VanDerWaalsContact N-O 3.09Å; S545-F780 PolarHBondContact OG-N 2.64Å; S545-F780 PolarHBondContact OG-O 3.24Å; W675-F780 HydrophobicContact CH2-CE1 4.23Å; W675-F780 AromaticContact CH2-CZ 3.93Å; W675-F780 HydrophobicContact CH2-CZ 3.93Å; W675-F780 HydrophobicContact CZ3-CE1 4.33Å; W675-F780 AromaticContact CZ3-CZ 3.93Å; W675-F780 HydrophobicContact CZ3-CZ 3.93Å; F689-F780 HydrophobicContact CD1-CB 4.34Å; F689-F780 AromaticContact CD1-CD2 3.98Å; F689-F780 HydrophobicContact CD1-CD2 3.98Å; F689-F780 HydrophobicContact CD1-CG 4.49Å; F689-F780 HydrophobicContact CE1-CB 4.39Å; F689-F780 AromaticContact CE1-CD2 3.54Å; F689-F780 HydrophobicContact CE1-CD2 3.54Å; F689-F780 HydrophobicContact CE1-CE2 4.08Å; F689-F780 HydrophobicContact CE1-CG 4.12Å; H691-F780 CarbonylContact O-C 3.46Å; H691-F780 WeakPolarHBondContact O-CA 3.28Å; H691-F780 WeakPolarHBondContact O-CB 3.48Å; I694-F780 HydrophobicContact CD1-CB 4.45Å; I694-F780 HydrophobicContact CD1-CD1 4.31Å; V733-F780 HydrophobicContact CG2-CE1 4.43Å; V733-F780 HydrophobicContact CG2-CZ 4.41Å; Y769-F780 HydrophobicContact CD1-CE1 4.39Å; Y769-F780 HydrophobicContact CD2-CD1 4.01Å; Y769-F780 AromaticContact CD2-CE1 3.85Å; Y769-F780 HydrophobicContact CD2-CE1 3.85Å; Y769-F780 HydrophobicContact CE2-CD1 4.3Å; Y769-F780 HydrophobicContact CG-CD1 4.35Å; Y769-F780 AromaticContact CG-CE1 3.78Å; Y769-F780 HydrophobicContact CG-CE1 3.78Å; F780-A782 HydrophobicContact CD2-CB 4.28Å; F780-A782 HydrophobicContact CE2-CB 4.33Å
781	I	94	Very high	86.6	Confident	3 Å²	3	35 Å²	35	2%	0.015	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	131.5	165.8	-53.9	175.7	0	0	0	107.6	M548 K551 L552 T690 H691	M548-I781 HydrophobicContact CB-CG1 4.36Å; M548-I781 HydrophobicContact CG-CD1 3.81Å; M548-I781 HydrophobicContact CG-CG1 3.84Å; K551-I781 HydrophobicContact CB-CD1 4.27Å; L552-I781 HydrophobicContact CD2-CG2 4.21Å; T690-I781 PolarHBondContact N-O 2.84Å; H691-I781 HydrophobicContact CB-CB 4.09Å; H691-I781 HydrophobicContact CB-CD1 4.33Å; H691-I781 HydrophobicContact CB-CG1 4.11Å; H691-I781 PolarHBondContact N-O 3Å; H691-I781 PolarHBondContact O-N 3.05Å
782	A	94	Very high	86.6	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	139.8	174.8	0	0	0	0	0	111.5	S542 L543 L687 N688 F689 F780	S542-A782 CarbonylContact C-O 3.58Å; S542-A782 WeakPolarHBondContact CA-O 3.36Å; L543-A782 HydrophobicContact CG-CB 4.48Å; L543-A782 PolarHBondContact N-O 2.64Å; L543-A782 PolarHBondContact O-N 3.28Å; L687-A782 HydrophobicContact CD1-CB 3.92Å; N688-A782 CarbonylContact O-C 3.57Å; N688-A782 WeakPolarHBondContact O-CA 3.2Å; N688-A782 WeakPolarHBondContact O-CB 3.29Å; F689-A782 HydrophobicContact CD1-CB 3.79Å; F689-A782 HydrophobicContact CD2-CB 4.37Å; F689-A782 HydrophobicContact CE1-CB 3.83Å; F689-A782 HydrophobicContact CE2-CB 4.39Å; F689-A782 HydrophobicContact CG-CB 4.07Å; F689-A782 HydrophobicContact CZ-CB 4.13Å; F780-A782 HydrophobicContact CD2-CB 4.28Å; F780-A782 HydrophobicContact CE2-CB 4.33Å
783	D	95.2	Very high	86.8	Confident	39 Å²	39	40.5 Å²	40.5	21%	0.209	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	137	-179.7	-56.5	-60.3	0	0	0	108.7	S542 N688 T690	S542-D783 VanDerWaalsContact CB-OD1 3.26Å; S542-D783 WeakPolarHBondContact CB-OD1 3.4Å; S542-D783 PolarHBondContact OG-OD1 2.73Å; N688-D783 PolarHBondContact N-O 3.35Å; N688-D783 PolarHBondContact O-N 3.16Å; T690-D783 WeakPolarHBondContact CG2-OD2 3.46Å; T690-D783 PolarHBondContact OG1-OD2 2.86Å
784	Y	94.8	Very high	87.2	Confident	5 Å²	5	41 Å²	41	2%	0.02	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	149.5	-172.6	78.1	-83.6	0	0	0	112.7	L536 E538 V540 G541 L543 I677 R686	L536-Y784 HydrophobicContact CB-CE1 4.42Å; L536-Y784 HydrophobicContact CB-CE2 4.37Å; L536-Y784 HydrophobicContact CD1-CD1 4.44Å; L536-Y784 HydrophobicContact CD1-CE1 3.91Å; L536-Y784 HydrophobicContact CD2-CE1 4.26Å; L536-Y784 HydrophobicContact CG-CE1 4.42Å; E538-Y784 VanDerWaalsContact O-CE2 3.29Å; E538-Y784 WeakPolarHBondContact O-CE2 3.38Å; E538-Y784 PolarHBondContact O-OH 2.93Å; E538-Y784 PolarHBondContact OE2-OH 2.8Å; V540-Y784 WeakPolarHBondContact CA-O 3.5Å; G541-Y784 VanDerWaalsContact CA-CE1 3.41Å; G541-Y784 PolarHBondContact N-O 3.23Å; G541-Y784 WeakPolarHBondContact O-CD1 3.26Å; G541-Y784 PolarHBondContact O-N 2.51Å; L543-Y784 HydrophobicContact CD2-CD1 4.09Å; I677-Y784 HydrophobicContact CD1-CD1 4.45Å; I677-Y784 HydrophobicContact CD1-CD2 4.05Å; I677-Y784 HydrophobicContact CD1-CG 3.89Å; I677-Y784 HydrophobicContact CG1-CD2 4.34Å; I677-Y784 HydrophobicContact CG2-CD2 3.55Å; I677-Y784 HydrophobicContact CG2-CE2 3.63Å; I677-Y784 HydrophobicContact CG2-CG 4.46Å; R686-Y784 CarbonylContact O-C 3.56Å; R686-Y784 VanDerWaalsContact O-CA 3.28Å; R686-Y784 WeakPolarHBondContact O-CA 3.23Å
785	E	93.3	Very high	88	Confident	70 Å²	70	42.4 Å²	42.4	33%	0.327	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	125	-176.2	-179.1	-171.6	179	0	0	110.3	V540 I685 R686 I787	V540-E785 HydrophobicContact CG2-CG 4.35Å; I685-E785 WeakPolarHBondContact CA-O 3.42Å; R686-E785 HydrophobicContact CB-CB 4.35Å; R686-E785 WeakPolarHBondContact CD-OE2 3.35Å; R686-E785 IonicContact CZ-OE2 2.76Å; R686-E785 PolarHBondContact N-O 2.83Å; R686-E785 IonicContact NE-OE2 2.74Å; R686-E785 VanDerWaalsContact NH1-CD 3.31Å; R686-E785 IonicContact NH1-OE1 2.75Å; R686-E785 PolarHBondContact NH1-OE1 2.93Å; R686-E785 IonicContact NH1-OE2 3.17Å; R686-E785 PolarHBondContact NH1-OE2 2.99Å; R686-E785 PolarHBondContact O-N 3.16Å; E785-I787 HydrophobicContact CG-CG2 3.92Å; E785-I787 PolarHBondContact O-N 2.86Å
786	A	89.9	Confident	88.7	Confident	16 Å²	16	47.8 Å²	47.8	13%	0.132	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	117.5	166.8	0	0	0	0	0	109.3	P539 A679 R684	P539-A786 HydrophobicContact CB-CB 3.96Å; P539-A786 WeakPolarHBondContact O-CB 3.5Å; P539-A786 PolarHBondContact O-N 2.85Å; A679-A786 HydrophobicContact CB-CB 3.82Å; R684-A786 CarbonylContact O-C 3.57Å; R684-A786 WeakPolarHBondContact O-CA 3.22Å
787	I	90.8	Very high	89.3	Confident	26 Å²	26	41.4 Å²	41.4	13%	0.133	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	117.6	179	52.4	170	0	0	0	109.7	R684 R686 I759 E785	R684-I787 HydrophobicContact CB-CG1 4.22Å; R684-I787 PolarHBondContact N-O 3.17Å; R684-I787 VanDerWaalsContact O-CG1 3.29Å; R684-I787 WeakPolarHBondContact O-CG1 3.5Å; R684-I787 PolarHBondContact O-N 2.88Å; R686-I787 HydrophobicContact CB-CD1 4.29Å; I759-I787 HydrophobicContact CD1-CD1 4.49Å; I759-I787 HydrophobicContact CG2-CD1 4.18Å; E785-I787 HydrophobicContact CG-CG2 3.92Å; E785-I787 PolarHBondContact O-N 2.86Å
788	C	89.6	Confident	89.5	Confident	33 Å²	33	41.7 Å²	41.7	22%	0.223	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	152.6	172.8	62.7	0	0	0	0	111.3	E683 P802 C814 W816	E683-C788 HydrophobicContact CG-CB 4.11Å; C788-P802 HydrophobicContact CB-CG 4.3Å; C788-C814 HydrophobicContact CB-CB 3.65Å; C788-C814 WeakPolarHBondContact CB-SG 3.5Å; C788-C814 VanDerWaalsContact SG-CA 3.55Å; C788-C814 WeakPolarHBondContact SG-CB 3.5Å; C788-C814 CovalentContact SG-SG 2.03Å; C788-C814 PolarHBondContact SG-SG 2.79Å; C788-W816 HydrophobicContact CB-CZ2 4.25Å
789	G	86.4	Confident	89.7	Confident	5 Å²	5	39.2 Å²	39.2	5%	0.052	21%	0.207	C	C	.	.			trans	82.7	-171.3	173.1	0	0	0	0	0	116.4	R684 V815 W816	R684-G789 PolarHBondContact NH2-O 2.84Å; G789-V815 CarbonylContact C-O 3.57Å; G789-V815 WeakPolarHBondContact CA-O 3.16Å; G789-W816 VanDerWaalsContact CA-CD1 3.5Å
790	G	86.6	Confident	89.8	Confident	23 Å²	23	39.3 Å²	39.3	24%	0.237	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	100.4	-173.3	-172.6	0	0	0	0	0	113.9	V815 W816 Q817	G790-V815 PolarHBondContact N-O 2.98Å; G790-W816 WeakPolarHBondContact O-CA 3.27Å; G790-Q817 PolarHBondContact O-N 2.82Å
791	E	89.6	Confident	89.8	Confident	97 Å²	97	39.3 Å²	39.3	45%	0.453	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	132.7	-179.4	-162.8	180	129.2	0	0	111.9	Q793 Q817 I819	E791-Q793 HydrophobicContact CG-CG 4.49Å; E791-Q793 PolarHBondContact OE1-NE2 2.8Å; E791-Q817 WeakPolarHBondContact CA-O 3.45Å; E791-I819 HydrophobicContact CG-CD1 3.68Å; E791-I819 HydrophobicContact CG-CG1 4.43Å; E791-I819 WeakPolarHBondContact OE1-CD1 3.36Å
792	L	87.1	Confident	89.5	Confident	17 Å²	17	39.4 Å²	39.4	9%	0.089	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	95.6	-179.5	-63.7	-179.5	0	0	0	109.8	M794 L799 W816 Q817 I819 F897	L792-M794 HydrophobicContact CD2-CE 4.2Å; L792-M794 PolarHBondContact O-N 2.85Å; L792-L799 HydrophobicContact CD1-CD2 3.67Å; L792-W816 HydrophobicContact CD1-CB 4.47Å; L792-Q817 PolarHBondContact N-O 3.22Å; L792-I819 PolarHBondContact O-N 3.33Å; L792-F897 HydrophobicContact CB-CZ 4.36Å; L792-F897 HydrophobicContact CD1-CE1 3.99Å; L792-F897 HydrophobicContact CD1-CZ 4.07Å
793	Q	89.6	Confident	89.2	Confident	144 Å²	144	40.6 Å²	40.6	67%	0.673	22%	0.215	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-90	85.4	171.1	-62.2	-167.2	13.9	0	0	109.9	E791 I819	E791-Q793 HydrophobicContact CG-CG 4.49Å; E791-Q793 PolarHBondContact OE1-NE2 2.8Å; Q793-I819 HydrophobicContact CG-CB 4.21Å; Q793-I819 HydrophobicContact CG-CD1 4.24Å
794	M	84.6	Confident	88.8	Confident	76 Å²	76	39 Å²	39	37%	0.374	21%	0.206	S	C	.	.			trans	-152.9	150.9	178.1	57.4	-174.8	62.6	0	0	111.4	L792 E796 I819 F897	L792-M794 HydrophobicContact CD2-CE 4.2Å; L792-M794 PolarHBondContact O-N 2.85Å; M794-E796 WeakPolarHBondContact CG-O 3.28Å; M794-I819 PolarHBondContact N-O 2.77Å; M794-F897 HydrophobicContact CG-CE2 3.69Å; M794-F897 HydrophobicContact CG-CZ 3.51Å; M794-F897 HydrophobicContact SD-CE2 4.46Å; M794-F897 HydrophobicContact SD-CZ 3.74Å
795	E	88	Confident	88.5	Confident	90 Å²	90	39 Å²	39	42%	0.421	21%	0.207	S	C	.	.	S	Bend	trans	-75.8	-24.9	-175.5	-61.5	-156.6	126.6	0	0	113.8	P821 Q898 K899	E795-P821 HydrophobicContact CG-CG 4.19Å; E795-Q898 CarbonylContact O-C 3.05Å; E795-Q898 WeakPolarHBondContact O-CA 3.48Å; E795-K899 HydrophobicContact CB-CD 4.03Å; E795-K899 HydrophobicContact CB-CG 4.49Å; E795-K899 HydrophobicContact CG-CD 4.17Å; E795-K899 PolarHBondContact O-N 3.41Å; E795-K899 WeakPolarHBondContact OE1-CD 3.48Å; E795-K899 IonicContact OE1-NZ 2.72Å; E795-K899 PolarHBondContact OE1-NZ 2.94Å; E795-K899 IonicContact OE2-NZ 3.44Å; E795-K899 PolarHBondContact OE2-NZ 3.11Å
796	E	88	Confident	88	Confident	128 Å²	128	39.3 Å²	39.3	60%	0.598	21%	0.208	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-152.6	156.9	175.8	60.8	-177	-174.5	0	0	109.5	M794 F897 Q898	M794-E796 WeakPolarHBondContact CG-O 3.28Å; E796-F897 CarbonylContact C-O 3.5Å; E796-F897 VanDerWaalsContact CA-O 3.25Å; E796-F897 WeakPolarHBondContact CA-O 3.41Å; E796-Q898 HydrophobicContact CB-CB 4.44Å
797	G	85.4	Confident	87.9	Confident	19 Å²	19	43.7 Å²	43.7	20%	0.196	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	179.8	165.3	177.3	0	0	0	0	0	114.4	T896 F897	G797-T896 CarbonylContact O-C 3.58Å; G797-T896 WeakPolarHBondContact O-CA 3.4Å; G797-T896 WeakPolarHBondContact O-CB 3.29Å; G797-F897 PolarHBondContact N-O 3.1Å; G797-F897 WeakPolarHBondContact O-CD1 3.46Å; G797-F897 PolarHBondContact O-N 3.16Å
798	T	86.1	Confident	87.9	Confident	32 Å²	32	42.6 Å²	42.6	20%	0.196	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	128	179.2	-51.8	0	0	0	0	110.7	E378 S681 G682 T800	E378-T798 PolarHBondContact OE2-OG1 2.78Å; S681-T798 CarbonylContact C-O 3.49Å; G682-T798 WeakPolarHBondContact CA-O 3.36Å; G682-T798 PolarHBondContact N-O 2.87Å; T798-T800 HydrophobicContact CG2-CG2 4.3Å
799	L	89.5	Confident	87.6	Confident	1 Å²	1	46 Å²	46	1%	0.005	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	136.8	172.5	-63.8	179	0	0	0	110.4	S681 L792 W816 I818 L828 T894 A895 F897	S681-L799 CarbonylContact O-C 3.43Å; L792-L799 HydrophobicContact CD1-CD2 3.67Å; L799-W816 HydrophobicContact CD2-CB 4.5Å; L799-W816 HydrophobicContact CD2-CD2 4.24Å; L799-W816 HydrophobicContact CD2-CG 3.87Å; L799-I818 HydrophobicContact CD1-CD1 3.93Å; L799-L828 HydrophobicContact CD1-CD1 4.21Å; L799-T894 WeakPolarHBondContact O-CA 3.24Å; L799-A895 PolarHBondContact N-O 3.14Å; L799-A895 PolarHBondContact O-N 2.88Å; L799-A895 VanDerWaalsContact O-O 3.08Å; L799-F897 HydrophobicContact CD1-CD1 3.96Å; L799-F897 HydrophobicContact CD1-CE1 4.33Å; L799-F897 HydrophobicContact CD2-CD1 4.48Å; L799-F897 HydrophobicContact CD2-CE1 4.1Å; L799-F897 HydrophobicContact CG-CD1 3.83Å; L799-F897 HydrophobicContact CG-CE1 3.94Å
800	T	90.8	Very high	87.7	Confident	2 Å²	2	47.9 Å²	47.9	1%	0.012	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	158.2	173.7	65.5	0	0	0	0	111.2	A680 S681 T798 Y804 W816 F893	A680-T800 WeakPolarHBondContact CB-OG1 3.25Å; S681-T800 PolarHBondContact N-OG1 2.94Å; S681-T800 WeakPolarHBondContact O-CB 3.26Å; S681-T800 WeakPolarHBondContact O-CG2 3.28Å; S681-T800 PolarHBondContact O-N 3.04Å; S681-T800 PolarHBondContact O-OG1 2.95Å; T798-T800 HydrophobicContact CG2-CG2 4.3Å; T800-Y804 HydrophobicContact CG2-CD1 3.91Å; T800-Y804 HydrophobicContact CG2-CG 4.28Å; T800-W816 WeakPolarHBondContact O-CZ2 3.26Å; T800-F893 VanDerWaalsContact CA-O 3.23Å; T800-F893 WeakPolarHBondContact CA-O 3.34Å; T800-F893 WeakPolarHBondContact CB-O 3.26Å
801	S	92.4	Very high	87.8	Confident	0 Å²	0	51 Å²	51	0%	0	26%	0.256	C	S	.	.			trans	-62.8	151.2	165	50.7	0	0	0	0	110.8	Y804 G892 F893	S801-Y804 VanDerWaalsContact O-CB 3.23Å; S801-Y804 WeakPolarHBondContact O-CB 3.19Å; S801-Y804 PolarHBondContact O-N 3.22Å; S801-Y804 VanDerWaalsContact O-N 3.15Å; S801-G892 VanDerWaalsContact OG-CA 3.29Å; S801-G892 WeakPolarHBondContact OG-CA 3.48Å; S801-F893 PolarHBondContact N-O 2.92Å; S801-F893 VanDerWaalsContact N-O 3.13Å; S801-F893 PolarHBondContact OG-N 3.49Å
802	P	88.9	Confident	87.8	Confident	4 Å²	4	50.5 Å²	50.5	3%	0.026	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-48.6	144.3	176.5	-30.1	36.8	0	0	0	113.6	E683 C788 Y804 Y808 C814 F882	E683-P802 WeakPolarHBondContact OE1-CA 3.29Å; E683-P802 WeakPolarHBondContact OE1-CB 3.24Å; C788-P802 HydrophobicContact CB-CG 4.3Å; P802-Y804 PolarHBondContact O-N 3.01Å; P802-Y804 VanDerWaalsContact O-N 3.08Å; P802-Y808 WeakPolarHBondContact O-CA 3.09Å; P802-C814 WeakPolarHBondContact CG-SG 3.22Å; P802-F882 HydrophobicContact CG-CE1 4.49Å
803	N	86.3	Confident	88.1	Confident	25 Å²	25	54.9 Å²	54.9	13%	0.134	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	61.5	-6.1	-175.7	-50.2	-30.4	0	0	0	117.6	R366 P539 E806 F807	R366-N803 PolarHBondContact NH1-O 3.1Å; P539-N803 WeakPolarHBondContact CB-OD1 3.38Å; P539-N803 WeakPolarHBondContact CG-OD1 3.28Å; N803-E806 HydrophobicContact CB-CB 4.19Å; N803-E806 WeakPolarHBondContact O-CB 2.96Å; N803-E806 PolarHBondContact O-N 3.05Å; N803-F807 PolarHBondContact ND2-O 2.69Å
804	Y	87.9	Confident	88.2	Confident	7 Å²	7	48 Å²	48	3%	0.027	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-47.1	135.6	-176.6	-172.8	-90.9	0	0	0	112.1	M362 R366 T800 S801 P802 Q891 T894	M362-Y804 HydrophobicContact CE-CE1 4.35Å; M362-Y804 HydrophobicContact SD-CD1 4.25Å; M362-Y804 HydrophobicContact SD-CE1 3.62Å; R366-Y804 PolarHBondContact NH1-O 2.63Å; R366-Y804 PolarHBondContact NH2-O 2.9Å; T800-Y804 HydrophobicContact CG2-CD1 3.91Å; T800-Y804 HydrophobicContact CG2-CG 4.28Å; S801-Y804 VanDerWaalsContact O-CB 3.23Å; S801-Y804 WeakPolarHBondContact O-CB 3.19Å; S801-Y804 PolarHBondContact O-N 3.22Å; S801-Y804 VanDerWaalsContact O-N 3.15Å; P802-Y804 PolarHBondContact O-N 3.01Å; P802-Y804 VanDerWaalsContact O-N 3.08Å; Y804-Q891 WeakPolarHBondContact CD2-O 3.14Å; Y804-Q891 WeakPolarHBondContact CE2-O 3.23Å; Y804-T894 HydrophobicContact CE1-CG2 3.86Å
805	P	86.9	Confident	88.7	Confident	5 Å²	5	46.1 Å²	46.1	3%	0.032	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	cis	-80.4	5.8	5	37.9	-47.3	0	0	0	116.8	A359 M362 K363 Q891	A359-P805 HydrophobicContact CB-CB 3.91Å; M362-P805 HydrophobicContact CB-CB 3.91Å; M362-P805 HydrophobicContact CB-CG 3.53Å; M362-P805 HydrophobicContact SD-CB 4.49Å; K363-P805 WeakPolarHBondContact CE-O 3.16Å; K363-P805 HydrophobicContact CG-CB 4.27Å; K363-P805 HydrophobicContact CG-CG 3.9Å; P805-Q891 PolarHBondContact O-NE2 3.12Å
806	E	84.4	Confident	89	Confident	76 Å²	76	41.8 Å²	41.8	36%	0.355	21%	0.213	S	C	.	.	S	Bend	trans	-76.1	167.7	169.2	-63	-54.3	145.4	0	0	110.6	K363 N803	K363-E806 WeakPolarHBondContact CD-OE1 3.32Å; K363-E806 VanDerWaalsContact CE-CD 3.44Å; K363-E806 WeakPolarHBondContact CE-OE1 3.2Å; K363-E806 VanDerWaalsContact CE-OE2 3.26Å; K363-E806 WeakPolarHBondContact CE-OE2 3.02Å; K363-E806 VanDerWaalsContact CG-OE1 3.26Å; K363-E806 WeakPolarHBondContact CG-OE1 3.26Å; K363-E806 IonicContact NZ-OE1 2.93Å; K363-E806 PolarHBondContact NZ-OE1 2.96Å; K363-E806 IonicContact NZ-OE2 3.01Å; K363-E806 PolarHBondContact NZ-OE2 2.81Å; N803-E806 HydrophobicContact CB-CB 4.19Å; N803-E806 WeakPolarHBondContact O-CB 2.96Å; N803-E806 PolarHBondContact O-N 3.05Å
807	F	87.4	Confident	89.3	Confident	108 Å²	108	38.8 Å²	38.8	47%	0.474	20%	0.198	S	C	.	.	P	Polyproline II helix	trans	-61.8	139.8	178	-64.4	-17.2	0	0	0	111.1	N803 E889 K890	N803-F807 PolarHBondContact ND2-O 2.69Å; F807-E889 HydrophobicContact CB-CB 4.06Å; F807-E889 HydrophobicContact CD2-CB 4.4Å; F807-K890 VanDerWaalsContact CA-O 3.28Å; F807-K890 WeakPolarHBondContact CA-O 3.42Å; F807-K890 VanDerWaalsContact CD1-C 3.43Å; F807-K890 WeakPolarHBondContact CD1-O 3.32Å
808	Y	89.9	Confident	89.7	Confident	2 Å²	2	37.9 Å²	37.9	1%	0.008	19%	0.189	C	C	.	.	P	Polyproline II helix	trans	-63.9	150	171.2	52.2	-96.9	0	0	0	110.1	P802 L835 E836 D844 F882 E889 K890	P802-Y808 WeakPolarHBondContact O-CA 3.09Å; Y808-L835 HydrophobicContact CD1-CD2 4.23Å; Y808-L835 HydrophobicContact CE1-CD2 3.54Å; Y808-E836 PolarHBondContact OH-N 2.64Å; Y808-D844 VanDerWaalsContact CE2-OD2 3.24Å; Y808-D844 WeakPolarHBondContact CE2-OD2 3.41Å; Y808-D844 VanDerWaalsContact CZ-OD2 3.23Å; Y808-D844 PolarHBondContact OH-OD2 2.83Å; Y808-F882 HydrophobicContact CD1-CZ 4.2Å; Y808-F882 HydrophobicContact CD2-CE1 4.47Å; Y808-F882 AromaticContact CD2-CZ 3.83Å; Y808-F882 HydrophobicContact CD2-CZ 3.83Å; Y808-F882 HydrophobicContact CE2-CZ 4.21Å; Y808-F882 HydrophobicContact CG-CE1 4.33Å; Y808-F882 AromaticContact CG-CZ 3.82Å; Y808-F882 HydrophobicContact CG-CZ 3.82Å; Y808-E889 HydrophobicContact CE2-CB 4.47Å; Y808-E889 WeakPolarHBondContact O-CB 3.26Å; Y808-E889 VanDerWaalsContact O-CG 3.29Å; Y808-E889 WeakPolarHBondContact O-CG 3.35Å; Y808-K890 WeakPolarHBondContact CD1-O 3.32Å; Y808-K890 HydrophobicContact CE1-CB 3.77Å; Y808-K890 WeakPolarHBondContact CE1-O 3.37Å; Y808-K890 VanDerWaalsContact CZ-N 3.31Å; Y808-K890 PolarHBondContact N-O 2.97Å; Y808-K890 WeakPolarHBondContact OH-CB 3.32Å; Y808-K890 PolarHBondContact OH-N 3.03Å
809	R	85	Confident	90.1	Very high	106 Å²	106	37.9 Å²	37.9	40%	0.4	19%	0.188	S	C	.	.	P	Polyproline II helix	trans	-74.4	149	175.9	-83.3	169.3	179.8	-166	-1.6	111.1	K812 S884	R809-K812 HydrophobicContact CB-CG 3.86Å; R809-S884 PolarHBondContact O-OG 2.76Å
810	P	86.8	Confident	90.3	Very high	44 Å²	44	38 Å²	38	29%	0.286	19%	0.188	S	C	.	.	S	Bend	trans	-66.3	159.9	168.6	29.6	-33.8	0	0	0	110.7	K812 D885 S886 E889	P810-K812 VanDerWaalsContact C-N 3.33Å; P810-K812 PolarHBondContact O-N 2.92Å; P810-D885 CarbonylContact C-O 3.57Å; P810-D885 WeakPolarHBondContact CA-O 3.44Å; P810-D885 WeakPolarHBondContact CB-O 3.49Å; P810-S886 VanDerWaalsContact CB-C 3.48Å; P810-E889 WeakPolarHBondContact CD-OE1 3.44Å
811	S	90.1	Very high	90.4	Very high	88 Å²	88	40.4 Å²	40.4	62%	0.615	20%	0.204	S	C	*	.	S	Bend	trans	53.2	44.3	178.4	-59.6	0	0	0	0	113.5	S884 D885	S811-S884 WeakPolarHBondContact CA-O 3.41Å; S811-S884 PolarHBondContact N-O 2.68Å; S811-S884 PolarHBondContact N-OG 3.3Å; S811-D885 PolarHBondContact N-O 2.75Å
812	K	88.5	Confident	90.4	Very high	87 Å²	87	46.4 Å²	46.4	38%	0.378	24%	0.24	S	C	.	.			trans	-111.9	131.3	176.2	-73.6	-59	-167.4	175.7	0	111.7	R809 P810 V883 S884	R809-K812 HydrophobicContact CB-CG 3.86Å; P810-K812 VanDerWaalsContact C-N 3.33Å; P810-K812 PolarHBondContact O-N 2.92Å; K812-V883 CarbonylContact O-C 3.54Å; K812-V883 VanDerWaalsContact O-CA 3.31Å; K812-V883 WeakPolarHBondContact O-CA 3.46Å; K812-S884 PolarHBondContact N-OG 3.09Å; K812-S884 PolarHBondContact O-N 3.01Å; K812-S884 PolarHBondContact O-OG 3.28Å
813	E	93	Very high	90.3	Very high	108 Å²	108	49.1 Å²	49.1	51%	0.505	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	130.5	166	176.9	166.8	154.5	0	0	109.1	V815 K881 F882 V883	E813-V815 HydrophobicContact CG-CG2 4.08Å; E813-K881 WeakPolarHBondContact OE1-CE 3.12Å; E813-K881 IonicContact OE1-NZ 3.62Å; E813-K881 PolarHBondContact OE1-NZ 2.74Å; E813-K881 WeakPolarHBondContact OE2-CE 3.37Å; E813-K881 IonicContact OE2-NZ 3.41Å; E813-K881 PolarHBondContact OE2-NZ 3.1Å; E813-F882 WeakPolarHBondContact CA-O 3.39Å; E813-V883 HydrophobicContact CG-CG2 4.3Å
814	C	93.3	Very high	90.5	Very high	1 Å²	1	51.8 Å²	51.8	1%	0.007	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	124.2	177.6	-60.8	0	0	0	0	109.4	C788 P802 W816 K881 F882	C788-C814 HydrophobicContact CB-CB 3.65Å; C788-C814 WeakPolarHBondContact CB-SG 3.5Å; C788-C814 VanDerWaalsContact SG-CA 3.55Å; C788-C814 WeakPolarHBondContact SG-CB 3.5Å; C788-C814 CovalentContact SG-SG 2.03Å; C788-C814 PolarHBondContact SG-SG 2.79Å; P802-C814 WeakPolarHBondContact CG-SG 3.22Å; C814-W816 HydrophobicContact CB-CE3 4.39Å; C814-W816 HydrophobicContact CB-CH2 3.47Å; C814-W816 VanDerWaalsContact CB-CH2 3.47Å; C814-W816 HydrophobicContact CB-CZ2 3.94Å; C814-W816 HydrophobicContact CB-CZ3 3.72Å; C814-K881 CarbonylContact O-C 3.5Å; C814-K881 WeakPolarHBondContact O-CA 3.44Å; C814-F882 HydrophobicContact CB-CB 4.27Å; C814-F882 HydrophobicContact CB-CD1 4.46Å; C814-F882 PolarHBondContact N-O 2.91Å; C814-F882 PolarHBondContact O-N 3.17Å
815	V	94.2	Very high	90.8	Very high	35 Å²	35	52 Å²	52	21%	0.212	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	112.8	-174.4	174.9	0	0	0	0	109.6	G789 G790 E813 Y879 V880 K881	G789-V815 CarbonylContact C-O 3.57Å; G789-V815 WeakPolarHBondContact CA-O 3.16Å; G790-V815 PolarHBondContact N-O 2.98Å; E813-V815 HydrophobicContact CG-CG2 4.08Å; V815-Y879 HydrophobicContact CG1-CD2 4.06Å; V815-Y879 HydrophobicContact CG1-CE2 3.29Å; V815-V880 CarbonylContact C-O 3.53Å; V815-V880 WeakPolarHBondContact CA-O 3.29Å; V815-K881 HydrophobicContact CG2-CB 4.16Å; V815-K881 HydrophobicContact CG2-CD 4.1Å; V815-K881 HydrophobicContact CG2-CG 4.03Å
816	W	93.4	Very high	91.2	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	134.4	175.4	-58	-93.7	0	0	0	110.7	G682 C788 G789 G790 L792 L799 T800 C814 V880 F882 F893	G682-W816 PolarHBondContact O-NE1 2.99Å; C788-W816 HydrophobicContact CB-CZ2 4.25Å; G789-W816 VanDerWaalsContact CA-CD1 3.5Å; G790-W816 WeakPolarHBondContact O-CA 3.27Å; L792-W816 HydrophobicContact CD1-CB 4.47Å; L799-W816 HydrophobicContact CD2-CB 4.5Å; L799-W816 HydrophobicContact CD2-CD2 4.24Å; L799-W816 HydrophobicContact CD2-CG 3.87Å; T800-W816 WeakPolarHBondContact O-CZ2 3.26Å; C814-W816 HydrophobicContact CB-CE3 4.39Å; C814-W816 HydrophobicContact CB-CH2 3.47Å; C814-W816 VanDerWaalsContact CB-CH2 3.47Å; C814-W816 HydrophobicContact CB-CZ2 3.94Å; C814-W816 HydrophobicContact CB-CZ3 3.72Å; W816-V880 HydrophobicContact CB-CB 4.45Å; W816-V880 HydrophobicContact CE3-CB 4.3Å; W816-V880 HydrophobicContact CE3-CG1 4.01Å; W816-V880 HydrophobicContact CZ3-CG1 4.43Å; W816-V880 PolarHBondContact N-O 3.23Å; W816-V880 PolarHBondContact O-N 2.7Å; W816-F882 HydrophobicContact CH2-CB 4.15Å; W816-F882 HydrophobicContact CZ3-CB 3.78Å; W816-F893 AromaticContact CH2-CZ 3.96Å; W816-F893 HydrophobicContact CH2-CZ 3.96Å; W816-F893 HydrophobicContact CZ3-CZ 4.11Å
817	Q	94.3	Very high	91.6	Very high	64 Å²	64	48.2 Å²	48.2	30%	0.299	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	95.3	176.1	-77.7	170.3	-47.5	0	0	108.3	G790 E791 L792 L852 Y879	G790-Q817 PolarHBondContact O-N 2.82Å; E791-Q817 WeakPolarHBondContact CA-O 3.45Å; L792-Q817 PolarHBondContact N-O 3.22Å; Q817-L852 HydrophobicContact CB-CD2 4.12Å; Q817-L852 PolarHBondContact NE2-O 2.91Å; Q817-Y879 HydrophobicContact CG-CD2 4.12Å
818	I	94.5	Very high	91.8	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84	129	-175.9	-50.8	170.5	0	0	0	108.9	L799 V826 V877 M878 V880 F897	L799-I818 HydrophobicContact CD1-CD1 3.93Å; I818-V826 HydrophobicContact CB-CG1 4.39Å; I818-V826 HydrophobicContact CD1-CG1 4.21Å; I818-V826 HydrophobicContact CG2-CG1 3.82Å; I818-V826 HydrophobicContact CG2-CG2 4.09Å; I818-V877 WeakPolarHBondContact O-CA 2.96Å; I818-M878 HydrophobicContact CB-CB 4.37Å; I818-M878 HydrophobicContact CD1-CB 4.41Å; I818-M878 HydrophobicContact CD1-SD 4.4Å; I818-M878 PolarHBondContact N-O 2.82Å; I818-M878 PolarHBondContact O-N 2.93Å; I818-V880 HydrophobicContact CD1-CG2 3.98Å; I818-F897 HydrophobicContact CD1-CB 4.17Å; I818-F897 HydrophobicContact CD1-CD1 4.09Å; I818-F897 HydrophobicContact CD1-CG 4.02Å; I818-F897 HydrophobicContact CG2-CD2 3.47Å; I818-F897 VanDerWaalsContact CG2-CD2 3.47Å; I818-F897 HydrophobicContact CG2-CE2 3.55Å; I818-F897 HydrophobicContact CG2-CG 4.04Å; I818-F897 HydrophobicContact CG2-CZ 4.17Å
819	I	94.8	Very high	91.9	Very high	33 Å²	33	44.9 Å²	44.9	17%	0.169	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	117	176.6	-55.5	176.4	0	0	0	108.6	E791 L792 Q793 M794 L852 V877	E791-I819 HydrophobicContact CG-CD1 3.68Å; E791-I819 HydrophobicContact CG-CG1 4.43Å; E791-I819 WeakPolarHBondContact OE1-CD1 3.36Å; L792-I819 PolarHBondContact O-N 3.33Å; Q793-I819 HydrophobicContact CG-CB 4.21Å; Q793-I819 HydrophobicContact CG-CD1 4.24Å; M794-I819 PolarHBondContact N-O 2.77Å; I819-L852 HydrophobicContact CD1-CD1 4.13Å; I819-L852 HydrophobicContact CD1-CD2 4.39Å; I819-L852 HydrophobicContact CG1-CD1 4.33Å; I819-L852 HydrophobicContact CG1-CD2 3.86Å; I819-V877 HydrophobicContact CG1-CG1 4.28Å
820	V	93.6	Very high	92.1	Very high	3 Å²	3	40.3 Å²	40.3	2%	0.018	23%	0.232	C	C	.	.	P	Polyproline II helix	trans	-103.2	166.4	169.8	-62.3	0	0	0	0	110	V826 N876 K899	V820-V826 HydrophobicContact CG1-CG2 4.03Å; V820-V826 HydrophobicContact CG2-CG2 3.82Å; V820-N876 HydrophobicContact CG2-CB 3.96Å; V820-N876 WeakPolarHBondContact CG2-O 3.43Å; V820-N876 PolarHBondContact N-O 2.82Å; V820-N876 PolarHBondContact O-ND2 2.5Å; V820-K899 HydrophobicContact CB-CB 4.08Å; V820-K899 HydrophobicContact CG1-CB 4.06Å
821	P	93.8	Very high	92	Very high	53 Å²	53	41.2 Å²	41.2	34%	0.344	23%	0.233	S	C	.	.	P	Polyproline II helix	trans	-56.2	149.8	178.7	-27.7	36.9	0	0	0	113.7	E795 Y824	E795-P821 HydrophobicContact CG-CG 4.19Å; P821-Y824 HydrophobicContact CB-CD2 4.05Å; P821-Y824 HydrophobicContact CB-CE2 4.4Å; P821-Y824 WeakPolarHBondContact O-CB 3.34Å; P821-Y824 WeakPolarHBondContact O-CD2 3.4Å; P821-Y824 PolarHBondContact O-N 2.65Å
822	V	91.1	Very high	91.7	Very high	125 Å²	125	37 Å²	37	76%	0.758	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.7	139.9	-178.6	-129.1	0	0	0	0	111.2
823	G	86.5	Confident	91.9	Very high	61 Å²	61	33 Å²	33	63%	0.629	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	91.1	-7.7	-174.8	0	0	0	0	0	114.7
824	Y	91.7	Very high	91.7	Very high	82 Å²	82	30 Å²	30	32%	0.322	17%	0.172	S	C	.	.			trans	-102	170.9	168.8	-62.8	-92.3	0	0	0	111.1	P821 N875 N876 K899 F901	P821-Y824 HydrophobicContact CB-CD2 4.05Å; P821-Y824 HydrophobicContact CB-CE2 4.4Å; P821-Y824 WeakPolarHBondContact O-CB 3.34Å; P821-Y824 WeakPolarHBondContact O-CD2 3.4Å; P821-Y824 PolarHBondContact O-N 2.65Å; Y824-N875 CarbonylContact O-C 3.58Å; Y824-N876 WeakPolarHBondContact O-CA 3.06Å; Y824-N876 VanDerWaalsContact O-CB 3.25Å; Y824-N876 WeakPolarHBondContact O-CB 3.27Å; Y824-N876 PolarHBondContact O-N 2.71Å; Y824-N876 VanDerWaalsContact O-N 3.16Å; Y824-K899 HydrophobicContact CD1-CB 4.21Å; Y824-K899 HydrophobicContact CD1-CD 4.14Å; Y824-K899 HydrophobicContact CD1-CG 4.2Å; Y824-K899 HydrophobicContact CE1-CD 4.18Å; Y824-K899 HydrophobicContact CG-CB 4.29Å; Y824-K899 HydrophobicContact CG-CD 4.45Å; Y824-F901 HydrophobicContact CD1-CB 3.93Å; Y824-F901 HydrophobicContact CD1-CD2 4.16Å; Y824-F901 HydrophobicContact CD1-CG 4.45Å; Y824-F901 HydrophobicContact CE1-CB 3.94Å; Y824-F901 HydrophobicContact CE1-CD2 4.05Å; Y824-F901 HydrophobicContact CE1-CG 4.22Å
825	S	93.5	Very high	91.7	Very high	12 Å²	12	30.3 Å²	30.3	8%	0.084	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	167.9	167.2	52.4	0	0	0	0	110	K872 S873 E900	S825-K872 VanDerWaalsContact OG-CE 3.23Å; S825-K872 WeakPolarHBondContact OG-CE 3.5Å; S825-S873 WeakPolarHBondContact CB-O 3.47Å; S825-E900 PolarHBondContact N-O 3.38Å; S825-E900 PolarHBondContact O-N 3.25Å; S825-E900 WeakPolarHBondContact OG-CG 3.49Å; S825-E900 PolarHBondContact OG-O 3.44Å
826	V	94.4	Very high	91.7	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	124.3	175.1	-175	0	0	0	0	108.5	I818 V820 K872 S873 M878 F897	I818-V826 HydrophobicContact CB-CG1 4.39Å; I818-V826 HydrophobicContact CD1-CG1 4.21Å; I818-V826 HydrophobicContact CG2-CG1 3.82Å; I818-V826 HydrophobicContact CG2-CG2 4.09Å; V820-V826 HydrophobicContact CG1-CG2 4.03Å; V820-V826 HydrophobicContact CG2-CG2 3.82Å; V826-K872 WeakPolarHBondContact O-CA 3.37Å; V826-S873 WeakPolarHBondContact CB-OG 3.29Å; V826-S873 PolarHBondContact N-OG 3.37Å; V826-S873 PolarHBondContact O-N 3.32Å; V826-S873 PolarHBondContact O-OG 3.01Å; V826-M878 HydrophobicContact CB-CB 3.89Å; V826-M878 HydrophobicContact CB-CE 4.08Å; V826-M878 HydrophobicContact CG1-CB 3.97Å; V826-M878 HydrophobicContact CG1-CE 4.11Å; V826-M878 HydrophobicContact CG1-SD 4.08Å; V826-M878 HydrophobicContact CG2-CB 4.04Å; V826-M878 WeakPolarHBondContact O-CE 3.22Å; V826-F897 HydrophobicContact CG1-CB 4.14Å
827	A	93.1	Very high	91.5	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	136.8	165	0	0	0	0	0	110	I871 F897 Q898 E900 L919	A827-I871 CarbonylContact C-O 3.52Å; A827-I871 WeakPolarHBondContact CA-O 3.33Å; A827-F897 CarbonylContact O-C 3.53Å; A827-F897 WeakPolarHBondContact O-CA 3.39Å; A827-F897 WeakPolarHBondContact O-CB 3.34Å; A827-Q898 HydrophobicContact CB-CG 4.04Å; A827-Q898 PolarHBondContact N-O 2.86Å; A827-Q898 PolarHBondContact O-N 2.87Å; A827-E900 HydrophobicContact CB-CB 3.72Å; A827-E900 HydrophobicContact CB-CG 4.17Å; A827-L919 HydrophobicContact CB-CD2 3.92Å
828	L	93	Very high	91.4	Very high	2 Å²	2	35.3 Å²	35.3	1%	0.01	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	123.6	177.7	-176	72.6	0	0	0	109.2	L799 F830 V848 P870 I871 M878 V880 A895 T896 F897	L799-L828 HydrophobicContact CD1-CD1 4.21Å; L828-F830 HydrophobicContact CD2-CE2 3.9Å; L828-F830 HydrophobicContact CD2-CZ 3.74Å; L828-F830 HydrophobicContact CG-CE2 4.08Å; L828-F830 HydrophobicContact CG-CZ 4.21Å; L828-V848 HydrophobicContact CD2-CG1 4.34Å; L828-V848 HydrophobicContact CD2-CG2 4.03Å; L828-P870 CarbonylContact O-C 3.57Å; L828-P870 VanDerWaalsContact O-CA 3.28Å; L828-P870 WeakPolarHBondContact O-CA 3.25Å; L828-I871 PolarHBondContact N-O 3.48Å; L828-I871 PolarHBondContact O-N 3.12Å; L828-M878 HydrophobicContact CB-CE 4.35Å; L828-M878 HydrophobicContact CB-SD 3.97Å; L828-M878 HydrophobicContact CD2-SD 4.18Å; L828-V880 HydrophobicContact CD2-CG2 4.3Å; L828-A895 HydrophobicContact CD1-CB 3.93Å; L828-A895 HydrophobicContact CG-CB 4.36Å; L828-T896 WeakPolarHBondContact CA-O 3.36Å; L828-F897 HydrophobicContact CD1-CB 4.15Å
829	I	90.8	Very high	90.9	Very high	38 Å²	38	41.3 Å²	41.3	20%	0.195	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	122.6	-169.5	-57.7	172.8	0	0	0	109.1	H831 P870 A895 T896	I829-H831 PolarHBondContact O-CE1 3.15Å; I829-P870 HydrophobicContact CG1-CB 4.26Å; I829-P870 HydrophobicContact CG1-CG 4.46Å; I829-P870 HydrophobicContact CG2-CG 4.44Å; I829-A895 CarbonylContact O-C 3.55Å; I829-A895 WeakPolarHBondContact O-CA 3.44Å; I829-A895 VanDerWaalsContact O-CB 3.31Å; I829-A895 WeakPolarHBondContact O-CB 3.42Å; I829-T896 PolarHBondContact N-O 3.3Å; I829-T896 PolarHBondContact O-N 3.01Å
830	F	90.3	Very high	90.6	Very high	11 Å²	11	44.2 Å²	44.2	5%	0.048	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	135.6	-176	-68.4	-91.9	0	0	0	112.5	L828 F833 L846 L862 L867 P868 I871 F893 A895	L828-F830 HydrophobicContact CD2-CE2 3.9Å; L828-F830 HydrophobicContact CD2-CZ 3.74Å; L828-F830 HydrophobicContact CG-CE2 4.08Å; L828-F830 HydrophobicContact CG-CZ 4.21Å; F830-F833 AromaticContact CD1-CD2 3.81Å; F830-F833 HydrophobicContact CD1-CD2 3.81Å; F830-F833 HydrophobicContact CD1-CE2 4.5Å; F830-F833 AromaticContact CE1-CD2 3.9Å; F830-F833 HydrophobicContact CE1-CD2 3.9Å; F830-F833 HydrophobicContact CE1-CE2 4.14Å; F830-L846 HydrophobicContact CE1-CD2 3.45Å; F830-L846 VanDerWaalsContact CE1-CD2 3.45Å; F830-L846 HydrophobicContact CZ-CD2 3.58Å; F830-L862 HydrophobicContact CE2-CD1 4.21Å; F830-L862 HydrophobicContact CZ-CD1 3.93Å; F830-L867 HydrophobicContact CB-CD1 3.85Å; F830-L867 HydrophobicContact CB-CG 4.37Å; F830-P868 HydrophobicContact CB-CG 4.45Å; F830-P868 HydrophobicContact CD1-CG 4.14Å; F830-P868 HydrophobicContact CD2-CB 3.67Å; F830-P868 HydrophobicContact CD2-CG 3.89Å; F830-P868 HydrophobicContact CE1-CG 4.4Å; F830-P868 HydrophobicContact CE2-CB 3.96Å; F830-P868 HydrophobicContact CE2-CG 4.16Å; F830-P868 HydrophobicContact CG-CB 4.14Å; F830-P868 HydrophobicContact CG-CG 3.89Å; F830-P868 HydrophobicContact CZ-CG 4.41Å; F830-I871 HydrophobicContact CE2-CD1 4.17Å; F830-F893 HydrophobicContact CE1-CD2 4.45Å; F830-A895 HydrophobicContact CD1-CB 3.71Å; F830-A895 HydrophobicContact CE1-CB 3.88Å; F830-A895 HydrophobicContact CG-CB 4.12Å; F830-A895 HydrophobicContact CZ-CB 4.42Å
831	H	83.2	Confident	90.6	Very high	63 Å²	63	45 Å²	45	29%	0.292	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	-19.9	178.9	-54	94.3	0	0	0	113.5	K358 I829 T894 T896	K358-H831 WeakPolarHBondContact CD-O 3.31Å; K358-H831 PolarHBondContact NZ-O 3.42Å; I829-H831 PolarHBondContact O-CE1 3.15Å; H831-T894 HydrophobicContact CB-CG2 4.05Å; H831-T894 PolarHBondContact N-O 3.41Å; H831-T896 PolarHBondContact CE1-OG1 2.96Å
832	S	85.4	Confident	90.5	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.1	139.9	174.4	177.3	0	0	0	0	108.1	S355 F893 T894	S355-S832 VanDerWaalsContact CB-OG 3.27Å; S355-S832 WeakPolarHBondContact CB-OG 3.44Å; S832-F893 VanDerWaalsContact O-CA 3.26Å; S832-F893 WeakPolarHBondContact O-CA 3.4Å; S832-F893 WeakPolarHBondContact O-CB 3.38Å; S832-T894 PolarHBondContact N-O 3.45Å; S832-T894 PolarHBondContact O-N 3.31Å
833	F	90.8	Very high	90.5	Very high	2 Å²	2	45.2 Å²	45.2	1%	0.009	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	115.3	175.5	-165.4	-91.3	0	0	0	111	F830 L835 L846 L862 G864 S865 L867 P868 F893	F830-F833 AromaticContact CD1-CD2 3.81Å; F830-F833 HydrophobicContact CD1-CD2 3.81Å; F830-F833 HydrophobicContact CD1-CE2 4.5Å; F830-F833 AromaticContact CE1-CD2 3.9Å; F830-F833 HydrophobicContact CE1-CD2 3.9Å; F830-F833 HydrophobicContact CE1-CE2 4.14Å; F833-L835 HydrophobicContact CE1-CD1 4.41Å; F833-L835 HydrophobicContact CE1-CG 4.22Å; F833-L835 HydrophobicContact CE2-CD1 4.24Å; F833-L835 HydrophobicContact CE2-CG 4.4Å; F833-L835 HydrophobicContact CZ-CD1 3.7Å; F833-L835 HydrophobicContact CZ-CG 3.9Å; F833-L846 HydrophobicContact CE2-CB 4.16Å; F833-L846 HydrophobicContact CE2-CD2 4.04Å; F833-L846 HydrophobicContact CZ-CB 4.4Å; F833-L862 HydrophobicContact CE1-CB 4.25Å; F833-L862 HydrophobicContact CE2-CB 4.17Å; F833-L862 HydrophobicContact CE2-CD1 4.49Å; F833-L862 HydrophobicContact CZ-CB 3.56Å; F833-G864 VanDerWaalsContact CD1-O 3.31Å; F833-G864 WeakPolarHBondContact CD1-O 3.48Å; F833-G864 WeakPolarHBondContact CE1-O 3.42Å; F833-S865 CarbonylContact O-C 3.59Å; F833-L867 HydrophobicContact CB-CD1 4.15Å; F833-P868 HydrophobicContact CB-CG 4.35Å; F833-P868 HydrophobicContact CD1-CG 4.18Å; F833-P868 HydrophobicContact CD2-CG 3.84Å; F833-P868 HydrophobicContact CE1-CG 4.49Å; F833-P868 HydrophobicContact CE2-CG 4.17Å; F833-P868 HydrophobicContact CG-CG 3.85Å; F833-P868 HydrophobicContact CZ-CG 4.5Å; F833-F893 HydrophobicContact CD2-CB 3.7Å; F833-F893 HydrophobicContact CD2-CG 4.44Å; F833-F893 HydrophobicContact CE2-CB 4.27Å; F833-F893 HydrophobicContact CG-CB 4.5Å
834	Q	90.8	Very high	91	Very high	46 Å²	46	42.3 Å²	42.3	22%	0.215	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	98.2	172.7	-73.9	-174.4	-11	0	0	109.3	G864 K890 Q891 G892	Q834-G864 WeakPolarHBondContact CA-O 3.46Å; Q834-K890 HydrophobicContact CB-CB 4.43Å; Q834-K890 VanDerWaalsContact O-CB 3.22Å; Q834-K890 WeakPolarHBondContact O-CB 3.47Å; Q834-Q891 HydrophobicContact CB-CB 4.24Å; Q834-Q891 VanDerWaalsContact OE1-CB 3.31Å; Q834-G892 PolarHBondContact N-O 3.4Å; Q834-G892 VanDerWaalsContact O-CA 3.24Å; Q834-G892 WeakPolarHBondContact O-CA 3.34Å; Q834-G892 PolarHBondContact O-N 3.19Å
835	L	93.2	Very high	91.2	Very high	6 Å²	6	40.2 Å²	40.2	3%	0.031	20%	0.201	C	C	.	.			trans	-108.2	174.2	165	-59.5	-173.8	0	0	0	109.6	Y808 F833 D844 L846 G864 F882 F893	Y808-L835 HydrophobicContact CD1-CD2 4.23Å; Y808-L835 HydrophobicContact CE1-CD2 3.54Å; F833-L835 HydrophobicContact CE1-CD1 4.41Å; F833-L835 HydrophobicContact CE1-CG 4.22Å; F833-L835 HydrophobicContact CE2-CD1 4.24Å; F833-L835 HydrophobicContact CE2-CG 4.4Å; F833-L835 HydrophobicContact CZ-CD1 3.7Å; F833-L835 HydrophobicContact CZ-CG 3.9Å; L835-D844 HydrophobicContact CB-CB 4.1Å; L835-L846 HydrophobicContact CD1-CB 4.23Å; L835-G864 PolarHBondContact N-O 2.98Å; L835-G864 CarbonylContact O-C 3.53Å; L835-G864 VanDerWaalsContact O-CA 3.29Å; L835-G864 WeakPolarHBondContact O-CA 3.4Å; L835-F882 HydrophobicContact CD1-CD2 4.27Å; L835-F882 HydrophobicContact CD1-CE2 4Å; L835-F882 HydrophobicContact CD2-CD2 4.4Å; L835-F882 HydrophobicContact CD2-CE2 3.57Å; L835-F882 HydrophobicContact CD2-CZ 4.25Å; L835-F882 HydrophobicContact CG-CE2 4.46Å; L835-F893 HydrophobicContact CD2-CD1 4.42Å
836	E	93.3	Very high	91.3	Very high	31 Å²	31	39.7 Å²	39.7	15%	0.145	20%	0.198	C	C	.	.			trans	-55.7	145.6	166.9	-173.3	173.6	-152.7	0	0	111.3	Y808 Y843 D844 C863 G864 V888	Y808-E836 PolarHBondContact OH-N 2.64Å; E836-Y843 HydrophobicContact CG-CD2 4.31Å; E836-Y843 WeakPolarHBondContact OE2-CB 3.25Å; E836-Y843 VanDerWaalsContact OE2-CD2 3.23Å; E836-Y843 WeakPolarHBondContact OE2-CD2 3.36Å; E836-D844 HydrophobicContact CB-CB 4Å; E836-D844 WeakPolarHBondContact CB-OD2 3.18Å; E836-C863 WeakPolarHBondContact O-CB 3.49Å; E836-G864 PolarHBondContact O-N 3.2Å; E836-V888 HydrophobicContact CB-CG1 4.37Å; E836-V888 HydrophobicContact CG-CB 4.37Å; E836-V888 HydrophobicContact CG-CG1 3.89Å; E836-V888 WeakPolarHBondContact OE1-CB 3.14Å; E836-V888 VanDerWaalsContact OE1-CG1 3.29Å; E836-V888 WeakPolarHBondContact OE1-CG1 3.19Å
837	K	90	Very high	91.4	Very high	116 Å²	116	40.7 Å²	40.7	50%	0.504	20%	0.202	S	C	.	.			trans	-95.4	122	179.8	178.3	179.4	172.9	172.5	0	110.4	E127	E127-K837 IonicContact OE1-NZ 2.68Å; E127-K837 PolarHBondContact OE1-NZ 3.16Å
838	H	91.4	Very high	91.6	Very high	58 Å²	58	40.7 Å²	40.7	27%	0.269	20%	0.202	S	C	.	.			trans	-142.8	138.6	169.7	-171.6	-103.5	0	0	0	110.5	T840 C841 Y843 C863	H838-T840 PolarHBondContact CE1-OG1 3.1Å; H838-T840 PolarHBondContact ND1-N 2.04Å; H838-T840 PolarHBondContact ND1-OG1 3.3Å; H838-T840 VanDerWaalsContact ND1-OG1 3.08Å; H838-T840 PolarHBondContact O-N 2.77Å; H838-C841 PolarHBondContact O-N 2.71Å; H838-Y843 HydrophobicContact CB-CD2 3.94Å; H838-Y843 HydrophobicContact CB-CE2 4.19Å; H838-Y843 AromaticContact CD2-CD2 3.98Å; H838-Y843 AromaticContact CD2-CE2 3.37Å; H838-Y843 WeakPolarHBondContact CD2-CE2 3.49Å; H838-Y843 AromaticContact CD2-CZ 3.8Å; H838-Y843 AromaticContact CG-CE2 3.94Å; H838-C863 PolarHBondContact O-SG 2.62Å
839	D	85	Confident	91.8	Very high	126 Å²	126	42.9 Å²	42.9	67%	0.674	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-25.4	-173.5	-69.1	-10.1	0	0	0	113.9
840	T	88.3	Confident	92.1	Very high	94 Å²	94	42.4 Å²	42.4	58%	0.577	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	-117.5	10.1	176.2	58.3	0	0	0	0	114.2	H838 V842	H838-T840 PolarHBondContact CE1-OG1 3.1Å; H838-T840 PolarHBondContact ND1-N 2.04Å; H838-T840 PolarHBondContact ND1-OG1 3.3Å; H838-T840 VanDerWaalsContact ND1-OG1 3.08Å; H838-T840 PolarHBondContact O-N 2.77Å; T840-V842 VanDerWaalsContact OG1-CG2 3.26Å; T840-V842 WeakPolarHBondContact OG1-CG2 3.31Å
841	C	92.5	Very high	92.3	Very high	19 Å²	19	42.2 Å²	42.2	13%	0.128	21%	0.21	C	C	.	.			trans	48.3	63.2	-178.9	-58	0	0	0	0	113.6	H838 K861 C863	H838-C841 PolarHBondContact O-N 2.71Å; C841-K861 HydrophobicContact CB-CD 4.35Å; C841-K861 HydrophobicContact CB-CG 4.44Å; C841-K861 WeakPolarHBondContact O-CE 3.42Å; C841-K861 PolarHBondContact O-NZ 2.91Å; C841-C863 WeakPolarHBondContact CA-SG 3.49Å; C841-C863 HydrophobicContact CB-CB 3.57Å; C841-C863 WeakPolarHBondContact CB-SG 3.13Å; C841-C863 WeakPolarHBondContact SG-CB 3.23Å; C841-C863 PolarHBondContact SG-N 3.18Å; C841-C863 VanDerWaalsContact SG-N 3.37Å; C841-C863 CovalentContact SG-SG 2.04Å; C841-C863 PolarHBondContact SG-SG 3.1Å
842	V	92.4	Very high	92.8	Very high	85 Å²	85	42 Å²	42	52%	0.515	21%	0.211	S	C	.	.			trans	-102.3	-33.3	-174.4	169.9	0	0	0	0	113.4	T840	T840-V842 VanDerWaalsContact OG1-CG2 3.26Å; T840-V842 WeakPolarHBondContact OG1-CG2 3.31Å
843	Y	91.7	Very high	93.2	Very high	97 Å²	97	48.3 Å²	48.3	38%	0.38	24%	0.238	S	C	.	.	S	Bend	trans	-75	-111.7	173.4	-45.4	-47	0	0	0	109.8	E836 H838 Y845	E836-Y843 HydrophobicContact CG-CD2 4.31Å; E836-Y843 WeakPolarHBondContact OE2-CB 3.25Å; E836-Y843 VanDerWaalsContact OE2-CD2 3.23Å; E836-Y843 WeakPolarHBondContact OE2-CD2 3.36Å; H838-Y843 HydrophobicContact CB-CD2 3.94Å; H838-Y843 HydrophobicContact CB-CE2 4.19Å; H838-Y843 AromaticContact CD2-CD2 3.98Å; H838-Y843 AromaticContact CD2-CE2 3.37Å; H838-Y843 WeakPolarHBondContact CD2-CE2 3.49Å; H838-Y843 AromaticContact CD2-CZ 3.8Å; H838-Y843 AromaticContact CG-CE2 3.94Å; Y843-Y845 VanDerWaalsContact O-CD1 3.26Å; Y843-Y845 WeakPolarHBondContact O-CD1 3.34Å
844	D	96.1	Very high	93.2	Very high	1 Å²	1	52.8 Å²	52.8	1%	0.005	26%	0.262	C	S	.	.	S	Bend	trans	-70.4	133.8	171.1	-59.3	-28.7	0	0	0	112.4	Y808 L835 E836 C863 V883 S884 D885	Y808-D844 VanDerWaalsContact CE2-OD2 3.24Å; Y808-D844 WeakPolarHBondContact CE2-OD2 3.41Å; Y808-D844 VanDerWaalsContact CZ-OD2 3.23Å; Y808-D844 PolarHBondContact OH-OD2 2.83Å; L835-D844 HydrophobicContact CB-CB 4.1Å; E836-D844 HydrophobicContact CB-CB 4Å; E836-D844 WeakPolarHBondContact CB-OD2 3.18Å; D844-C863 VanDerWaalsContact O-CB 3.31Å; D844-C863 WeakPolarHBondContact O-CB 3.46Å; D844-V883 WeakPolarHBondContact CA-O 3.5Å; D844-S884 WeakPolarHBondContact OD1-CA 3.06Å; D844-S884 VanDerWaalsContact OD1-CB 3.23Å; D844-S884 WeakPolarHBondContact OD1-CB 3.4Å; D844-D885 PolarHBondContact OD1-N 2.88Å
845	Y	96.2	Very high	93.3	Very high	38 Å²	38	55.9 Å²	55.9	15%	0.149	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.5	155.1	173.9	61.9	-95.7	0	0	0	114.5	Y843 E847 K861 L862 F882 V883	Y843-Y845 VanDerWaalsContact O-CD1 3.26Å; Y843-Y845 WeakPolarHBondContact O-CD1 3.34Å; Y845-E847 HydrophobicContact CD2-CB 4.04Å; Y845-E847 HydrophobicContact CE2-CB 4.11Å; Y845-K861 HydrophobicContact CD2-CD 4.36Å; Y845-K861 HydrophobicContact CD2-CG 4.24Å; Y845-K861 VanDerWaalsContact CE2-CE 3.42Å; Y845-K861 HydrophobicContact CG-CD 4.43Å; Y845-K861 HydrophobicContact CG-CG 4.46Å; Y845-L862 CarbonylContact C-O 3.57Å; Y845-L862 VanDerWaalsContact CA-O 3.29Å; Y845-L862 WeakPolarHBondContact CA-O 3.42Å; Y845-F882 WeakPolarHBondContact O-CA 3.02Å; Y845-F882 WeakPolarHBondContact O-CD2 3.25Å; Y845-V883 HydrophobicContact CD1-CB 4.36Å; Y845-V883 HydrophobicContact CD2-CB 4.46Å; Y845-V883 HydrophobicContact CE1-CB 3.88Å; Y845-V883 HydrophobicContact CE1-CG1 4.16Å; Y845-V883 HydrophobicContact CE1-CG2 4.35Å; Y845-V883 HydrophobicContact CE2-CB 4.03Å; Y845-V883 HydrophobicContact CE2-CG2 3.86Å; Y845-V883 PolarHBondContact N-O 2.78Å; Y845-V883 PolarHBondContact O-N 3.22Å
846	L	96.3	Very high	93.5	Very high	1 Å²	1	56.5 Å²	56.5	1%	0.005	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	124.5	163.6	-171.5	69	0	0	0	109.6	F830 F833 L835 K861 L862 V880 F882 F893	F830-L846 HydrophobicContact CE1-CD2 3.45Å; F830-L846 VanDerWaalsContact CE1-CD2 3.45Å; F830-L846 HydrophobicContact CZ-CD2 3.58Å; F833-L846 HydrophobicContact CE2-CB 4.16Å; F833-L846 HydrophobicContact CE2-CD2 4.04Å; F833-L846 HydrophobicContact CZ-CB 4.4Å; L835-L846 HydrophobicContact CD1-CB 4.23Å; L846-K861 CarbonylContact O-C 3.46Å; L846-K861 WeakPolarHBondContact O-CA 3.34Å; L846-L862 HydrophobicContact CB-CB 4.36Å; L846-L862 PolarHBondContact N-O 2.83Å; L846-L862 PolarHBondContact O-N 2.8Å; L846-V880 HydrophobicContact CD1-CG1 3.61Å; L846-V880 HydrophobicContact CG-CG1 4.25Å; L846-F882 HydrophobicContact CD1-CB 3.81Å; L846-F893 HydrophobicContact CD1-CE1 3.83Å; L846-F893 HydrophobicContact CD1-CE2 4.4Å; L846-F893 HydrophobicContact CD1-CZ 3.68Å; L846-F893 HydrophobicContact CD2-CD1 4.42Å; L846-F893 HydrophobicContact CD2-CD2 4.37Å; L846-F893 HydrophobicContact CD2-CE1 4.29Å; L846-F893 HydrophobicContact CD2-CE2 4.24Å; L846-F893 HydrophobicContact CD2-CG 4.47Å; L846-F893 HydrophobicContact CD2-CZ 4.2Å
847	E	95.8	Very high	93.6	Very high	21 Å²	21	59.1 Å²	59.1	10%	0.098	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	128.3	-178.4	-168.9	174.2	95.6	0	0	109.9	Y845 R849 L858 K861 V880 K881	Y845-E847 HydrophobicContact CD2-CB 4.04Å; Y845-E847 HydrophobicContact CE2-CB 4.11Å; E847-R849 HydrophobicContact CG-CG 4.49Å; E847-R849 IonicContact OE1-CZ 2.72Å; E847-R849 IonicContact OE1-NE 3.59Å; E847-R849 PolarHBondContact OE1-NE 3.3Å; E847-R849 IonicContact OE1-NH2 3.9Å; E847-R849 PolarHBondContact OE1-NH2 2.89Å; E847-R849 IonicContact OE2-NH2 2.68Å; E847-R849 PolarHBondContact OE2-NH2 3.37Å; E847-L858 HydrophobicContact CG-CD1 3.48Å; E847-L858 VanDerWaalsContact CG-CD1 3.48Å; E847-K861 HydrophobicContact CB-CG 4.48Å; E847-V880 CarbonylContact O-C 3.6Å; E847-V880 WeakPolarHBondContact O-CA 3.12Å; E847-K881 HydrophobicContact CB-CB 4.39Å; E847-K881 PolarHBondContact N-O 3.4Å; E847-K881 PolarHBondContact O-N 2.78Å
848	V	97.3	Very high	93.9	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	125.9	-176.2	-175.2	0	0	0	0	109.5	L828 L859 K860 I871 M878 V880	L828-V848 HydrophobicContact CD2-CG1 4.34Å; L828-V848 HydrophobicContact CD2-CG2 4.03Å; V848-L859 HydrophobicContact CG1-CD1 4.33Å; V848-L859 WeakPolarHBondContact O-CB 3.21Å; V848-L859 PolarHBondContact O-N 2.93Å; V848-K860 PolarHBondContact N-O 3.19Å; V848-K860 PolarHBondContact O-N 2.99Å; V848-I871 HydrophobicContact CB-CD1 4.26Å; V848-I871 HydrophobicContact CG1-CD1 4.41Å; V848-I871 HydrophobicContact CG1-CG2 4.01Å; V848-I871 HydrophobicContact CG2-CD1 4.09Å; V848-M878 HydrophobicContact CG1-CE 4.28Å; V848-M878 HydrophobicContact CG1-CG 3.93Å; V848-M878 HydrophobicContact CG1-SD 3.62Å; V848-V880 HydrophobicContact CG1-CG2 4.4Å; V848-V880 HydrophobicContact CG2-CG1 4.48Å
849	R	97.3	Very high	94	Very high	47 Å²	47	58 Å²	58	18%	0.177	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	150.1	-172.7	-62.1	-179.4	176.7	-94.6	0.9	113.1	E847 G851 D854 S856 P857 L858 Y879	E847-R849 HydrophobicContact CG-CG 4.49Å; E847-R849 IonicContact OE1-CZ 2.72Å; E847-R849 IonicContact OE1-NE 3.59Å; E847-R849 PolarHBondContact OE1-NE 3.3Å; E847-R849 IonicContact OE1-NH2 3.9Å; E847-R849 PolarHBondContact OE1-NH2 2.89Å; E847-R849 IonicContact OE2-NH2 2.68Å; E847-R849 PolarHBondContact OE2-NH2 3.37Å; R849-G851 PolarHBondContact O-N 3.37Å; R849-D854 VanDerWaalsContact CD-O 3.27Å; R849-D854 WeakPolarHBondContact CD-O 3.19Å; R849-D854 PolarHBondContact NE-O 3.45Å; R849-D854 VanDerWaalsContact NE-O 3.1Å; R849-D854 PolarHBondContact NH1-O 2.75Å; R849-S856 WeakPolarHBondContact CD-O 3.13Å; R849-S856 PolarHBondContact NH1-O 3.21Å; R849-P857 CarbonylContact C-O 3.19Å; R849-P857 WeakPolarHBondContact CA-O 3.47Å; R849-P857 WeakPolarHBondContact CB-O 3.11Å; R849-L858 HydrophobicContact CG-CD1 4.17Å; R849-Y879 HydrophobicContact CB-CD1 4.1Å; R849-Y879 HydrophobicContact CG-CD1 4.18Å; R849-Y879 PolarHBondContact N-O 2.87Å; R849-Y879 PolarHBondContact O-N 2.88Å
850	D	96.1	Very high	94.5	Very high	28 Å²	28	55.7 Å²	55.7	15%	0.15	29%	0.293	C	S	.	.	S	Bend	trans	-88.1	77.5	-175.2	-158.1	22.7	0	0	0	111.4	P857 L859 S873 T874	D850-P857 HydrophobicContact CB-CB 4.28Å; D850-P857 PolarHBondContact N-O 3.2Å; D850-L859 HydrophobicContact CB-CD1 3.99Å; D850-L859 HydrophobicContact CB-CD2 3.93Å; D850-L859 HydrophobicContact CB-CG 3.87Å; D850-S873 VanDerWaalsContact OD1-CA 3.29Å; D850-S873 WeakPolarHBondContact OD1-CA 3.4Å; D850-S873 WeakPolarHBondContact OD1-CB 2.95Å; D850-T874 PolarHBondContact OD1-N 2.9Å; D850-T874 PolarHBondContact OD1-OG1 2.84Å; D850-T874 WeakPolarHBondContact OD2-CB 3.3Å; D850-T874 WeakPolarHBondContact OD2-CG2 3.4Å; D850-T874 PolarHBondContact OD2-OG1 2.88Å
851	G	95.3	Very high	94.8	Very high	8 Å²	8	54.5 Å²	54.5	8%	0.082	28%	0.28	C	S	.	.	S	Bend	trans	154.7	-156.6	-176.5	0	0	0	0	0	113	R849 S856 M878 Y879	R849-G851 PolarHBondContact O-N 3.37Å; G851-S856 WeakPolarHBondContact CA-OG 3.31Å; G851-M878 CarbonylContact O-C 3.59Å; G851-M878 VanDerWaalsContact O-CA 3.3Å; G851-M878 WeakPolarHBondContact O-CA 3.22Å; G851-M878 PolarHBondContact O-N 3.28Å; G851-Y879 WeakPolarHBondContact O-CB 3.42Å; G851-Y879 PolarHBondContact O-N 2.88Å
852	L	93.3	Very high	94.9	Very high	59 Å²	59	54.5 Å²	54.5	31%	0.309	28%	0.279	S	S	.	.	S	Bend	trans	-114.2	6.3	178.8	-65.8	179.2	0	0	0	114	Q817 I819 V877	Q817-L852 HydrophobicContact CB-CD2 4.12Å; Q817-L852 PolarHBondContact NE2-O 2.91Å; I819-L852 HydrophobicContact CD1-CD1 4.13Å; I819-L852 HydrophobicContact CD1-CD2 4.39Å; I819-L852 HydrophobicContact CG1-CD1 4.33Å; I819-L852 HydrophobicContact CG1-CD2 3.86Å; L852-V877 HydrophobicContact CD1-CB 4.49Å; L852-V877 HydrophobicContact CD1-CG1 3.88Å; L852-V877 HydrophobicContact CD2-CB 3.73Å; L852-V877 HydrophobicContact CD2-CG1 3.78Å; L852-V877 HydrophobicContact CG-CB 3.79Å; L852-V877 HydrophobicContact CG-CG1 3.73Å; L852-V877 HydrophobicContact CG-CG2 4.42Å
853	K	93.3	Very high	95.1	Very high	131 Å²	131	51.6 Å²	51.6	57%	0.57	26%	0.262	S	S	*	.	S	Bend	trans	-124.6	153.6	-174.5	-61.6	-172	179.8	-174.8	0	112	T855 S856	K853-T855 PolarHBondContact O-N 3.38Å; K853-S856 PolarHBondContact N-OG 3.49Å; K853-S856 WeakPolarHBondContact O-CB 3.42Å; K853-S856 PolarHBondContact O-N 3.03Å; K853-S856 PolarHBondContact O-OG 3.22Å
854	D	91.5	Very high	95.1	Very high	96 Å²	96	47.2 Å²	47.2	51%	0.513	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.8	-34.1	162	62.1	-32.4	0	0	0	112.3	R849 S856	R849-D854 VanDerWaalsContact CD-O 3.27Å; R849-D854 WeakPolarHBondContact CD-O 3.19Å; R849-D854 PolarHBondContact NE-O 3.45Å; R849-D854 VanDerWaalsContact NE-O 3.1Å; R849-D854 PolarHBondContact NH1-O 2.75Å; D854-S856 VanDerWaalsContact C-N 3.26Å; D854-S856 PolarHBondContact O-N 2.77Å
855	T	94	Very high	94.7	Very high	111 Å²	111	50.8 Å²	50.8	68%	0.681	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.5	-0.9	175.1	72.1	0	0	0	0	114.7	K853	K853-T855 PolarHBondContact O-N 3.38Å
856	S	95.8	Very high	94.2	Very high	19 Å²	19	56.7 Å²	56.7	13%	0.133	30%	0.3	C	S	.	.	S	Bend	trans	-72.5	156.2	179.9	-72.9	0	0	0	0	112.2	R849 G851 K853 D854 L858	R849-S856 WeakPolarHBondContact CD-O 3.13Å; R849-S856 PolarHBondContact NH1-O 3.21Å; G851-S856 WeakPolarHBondContact CA-OG 3.31Å; K853-S856 PolarHBondContact N-OG 3.49Å; K853-S856 WeakPolarHBondContact O-CB 3.42Å; K853-S856 PolarHBondContact O-N 3.03Å; K853-S856 PolarHBondContact O-OG 3.22Å; D854-S856 VanDerWaalsContact C-N 3.26Å; D854-S856 PolarHBondContact O-N 2.77Å; S856-L858 PolarHBondContact O-N 3.17Å
857	P	96.6	Very high	93.7	Very high	87 Å²	87	61 Å²	61	57%	0.565	32%	0.323	S	S	*	.	P	Polyproline II helix	trans	-52.8	134.9	178.4	-26.6	34.9	0	0	0	112.6	R849 D850 L859	R849-P857 CarbonylContact C-O 3.19Å; R849-P857 WeakPolarHBondContact CA-O 3.47Å; R849-P857 WeakPolarHBondContact CB-O 3.11Å; D850-P857 HydrophobicContact CB-CB 4.28Å; D850-P857 PolarHBondContact N-O 3.2Å; P857-L859 PolarHBondContact O-N 2.79Å
858	L	95.3	Very high	93.4	Very high	90 Å²	90	60.7 Å²	60.7	47%	0.471	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	119.2	180	-178.3	66.4	0	0	0	110.3	E847 R849 S856 K860	E847-L858 HydrophobicContact CG-CD1 3.48Å; E847-L858 VanDerWaalsContact CG-CD1 3.48Å; R849-L858 HydrophobicContact CG-CD1 4.17Å; S856-L858 PolarHBondContact O-N 3.17Å; L858-K860 WeakPolarHBondContact CD1-O 3.38Å
859	L	94.8	Very high	93	Very high	59 Å²	59	64.8 Å²	64.8	31%	0.309	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	-43.6	172.9	-65	172.1	0	0	0	110.9	V848 D850 P857 I871 M878	V848-L859 HydrophobicContact CG1-CD1 4.33Å; V848-L859 WeakPolarHBondContact O-CB 3.21Å; V848-L859 PolarHBondContact O-N 2.93Å; D850-L859 HydrophobicContact CB-CD1 3.99Å; D850-L859 HydrophobicContact CB-CD2 3.93Å; D850-L859 HydrophobicContact CB-CG 3.87Å; P857-L859 PolarHBondContact O-N 2.79Å; L859-I871 HydrophobicContact CB-CG2 4.03Å; L859-I871 HydrophobicContact CD1-CG2 3.96Å; L859-M878 HydrophobicContact CD1-CE 4.33Å
860	K	94.1	Very high	92.6	Very high	79 Å²	79	64.9 Å²	64.9	34%	0.343	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.4	147.3	178.6	-130.7	156.4	179.9	168.2	0	112.2	V848 L858 L862 T869 I871	V848-K860 PolarHBondContact N-O 3.19Å; V848-K860 PolarHBondContact O-N 2.99Å; L858-K860 WeakPolarHBondContact CD1-O 3.38Å; K860-L862 HydrophobicContact CB-CD2 4.41Å; K860-L862 HydrophobicContact CB-CG 4.34Å; K860-L862 HydrophobicContact CD-CD2 3.99Å; K860-L862 HydrophobicContact CG-CD2 3.91Å; K860-L862 HydrophobicContact CG-CG 4.36Å; K860-T869 PolarHBondContact NZ-OG1 2.83Å; K860-I871 HydrophobicContact CB-CD1 3.83Å; K860-I871 HydrophobicContact CD-CD1 3.95Å; K860-I871 HydrophobicContact CD-CG1 4.28Å
861	K	95.1	Very high	92.5	Very high	68 Å²	68	64.1 Å²	64.1	30%	0.296	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	135.7	162.4	-154.6	-177	-165.6	-154.4	0	107.7	C841 Y845 L846 E847	C841-K861 HydrophobicContact CB-CD 4.35Å; C841-K861 HydrophobicContact CB-CG 4.44Å; C841-K861 WeakPolarHBondContact O-CE 3.42Å; C841-K861 PolarHBondContact O-NZ 2.91Å; Y845-K861 HydrophobicContact CD2-CD 4.36Å; Y845-K861 HydrophobicContact CD2-CG 4.24Å; Y845-K861 VanDerWaalsContact CE2-CE 3.42Å; Y845-K861 HydrophobicContact CG-CD 4.43Å; Y845-K861 HydrophobicContact CG-CG 4.46Å; L846-K861 CarbonylContact O-C 3.46Å; L846-K861 WeakPolarHBondContact O-CA 3.34Å; E847-K861 HydrophobicContact CB-CG 4.48Å
862	L	95.6	Very high	92.4	Very high	19 Å²	19	67.2 Å²	67.2	10%	0.099	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	138.8	-165.6	-61.1	168.8	0	0	0	111	F830 F833 Y845 L846 K860 P868 I871	F830-L862 HydrophobicContact CE2-CD1 4.21Å; F830-L862 HydrophobicContact CZ-CD1 3.93Å; F833-L862 HydrophobicContact CE1-CB 4.25Å; F833-L862 HydrophobicContact CE2-CB 4.17Å; F833-L862 HydrophobicContact CE2-CD1 4.49Å; F833-L862 HydrophobicContact CZ-CB 3.56Å; Y845-L862 CarbonylContact C-O 3.57Å; Y845-L862 VanDerWaalsContact CA-O 3.29Å; Y845-L862 WeakPolarHBondContact CA-O 3.42Å; L846-L862 HydrophobicContact CB-CB 4.36Å; L846-L862 PolarHBondContact N-O 2.83Å; L846-L862 PolarHBondContact O-N 2.8Å; K860-L862 HydrophobicContact CB-CD2 4.41Å; K860-L862 HydrophobicContact CB-CG 4.34Å; K860-L862 HydrophobicContact CD-CD2 3.99Å; K860-L862 HydrophobicContact CG-CD2 3.91Å; K860-L862 HydrophobicContact CG-CG 4.36Å; L862-P868 HydrophobicContact CD1-CB 3.91Å; L862-P868 HydrophobicContact CD1-CG 3.76Å; L862-P868 HydrophobicContact CD2-CB 4Å; L862-P868 HydrophobicContact CD2-CG 4.11Å; L862-P868 HydrophobicContact CG-CG 4.44Å; L862-I871 HydrophobicContact CD1-CD1 4.09Å
863	C	94.9	Very high	92.5	Very high	24 Å²	24	64.6 Å²	64.6	16%	0.162	35%	0.348	C	S	.	.			trans	-158.5	176.1	174.4	66.9	0	0	0	0	110.2	E836 H838 C841 D844	E836-C863 WeakPolarHBondContact O-CB 3.49Å; H838-C863 PolarHBondContact O-SG 2.62Å; C841-C863 WeakPolarHBondContact CA-SG 3.49Å; C841-C863 HydrophobicContact CB-CB 3.57Å; C841-C863 WeakPolarHBondContact CB-SG 3.13Å; C841-C863 WeakPolarHBondContact SG-CB 3.23Å; C841-C863 PolarHBondContact SG-N 3.18Å; C841-C863 VanDerWaalsContact SG-N 3.37Å; C841-C863 CovalentContact SG-SG 2.04Å; C841-C863 PolarHBondContact SG-SG 3.1Å; D844-C863 VanDerWaalsContact O-CB 3.31Å; D844-C863 WeakPolarHBondContact O-CB 3.46Å
864	G	91.9	Very high	92.4	Very high	5 Å²	5	64 Å²	64	5%	0.052	36%	0.355	C	S	.	.	S	Bend	trans	73.6	-157	-175.3	0	0	0	0	0	114.2	F833 Q834 L835 E836	F833-G864 VanDerWaalsContact CD1-O 3.31Å; F833-G864 WeakPolarHBondContact CD1-O 3.48Å; F833-G864 WeakPolarHBondContact CE1-O 3.42Å; Q834-G864 WeakPolarHBondContact CA-O 3.46Å; L835-G864 PolarHBondContact N-O 2.98Å; L835-G864 CarbonylContact O-C 3.53Å; L835-G864 VanDerWaalsContact O-CA 3.29Å; L835-G864 WeakPolarHBondContact O-CA 3.4Å; E836-G864 PolarHBondContact O-N 3.2Å
865	S	87.9	Confident	92.4	Very high	76 Å²	76	63.4 Å²	63.4	53%	0.531	35%	0.352	S	S	.	.	S	Bend	trans	-113.8	4.2	-166.9	54.9	0	0	0	0	115.7	F833	F833-S865 CarbonylContact O-C 3.59Å
866	H	85.1	Confident	92.5	Very high	163 Å²	163	59.2 Å²	59.2	76%	0.755	33%	0.326	S	S	*	.	S	Bend	trans	-80.6	127.2	174.9	-71.1	-63	0	0	0	110.5	P868	H866-P868 VanDerWaalsContact O-CD 3.28Å; H866-P868 WeakPolarHBondContact O-CD 3.26Å
867	L	85.8	Confident	92.5	Very high	91 Å²	91	59.3 Å²	59.3	48%	0.476	33%	0.325	S	S	.	.	P	Polyproline II helix	trans	-63	119.2	177.1	-166.9	70	0	0	0	110	F830 F833	F830-L867 HydrophobicContact CB-CD1 3.85Å; F830-L867 HydrophobicContact CB-CG 4.37Å; F833-L867 HydrophobicContact CB-CD1 4.15Å
868	P	90.2	Very high	92.5	Very high	14 Å²	14	55.2 Å²	55.2	9%	0.091	30%	0.298	C	S	.	.	P	Polyproline II helix	trans	-67	140.1	-177.4	-19.5	30.6	0	0	0	112	F830 F833 L862 H866	F830-P868 HydrophobicContact CB-CG 4.45Å; F830-P868 HydrophobicContact CD1-CG 4.14Å; F830-P868 HydrophobicContact CD2-CB 3.67Å; F830-P868 HydrophobicContact CD2-CG 3.89Å; F830-P868 HydrophobicContact CE1-CG 4.4Å; F830-P868 HydrophobicContact CE2-CB 3.96Å; F830-P868 HydrophobicContact CE2-CG 4.16Å; F830-P868 HydrophobicContact CG-CB 4.14Å; F830-P868 HydrophobicContact CG-CG 3.89Å; F830-P868 HydrophobicContact CZ-CG 4.41Å; F833-P868 HydrophobicContact CB-CG 4.35Å; F833-P868 HydrophobicContact CD1-CG 4.18Å; F833-P868 HydrophobicContact CD2-CG 3.84Å; F833-P868 HydrophobicContact CE1-CG 4.49Å; F833-P868 HydrophobicContact CE2-CG 4.17Å; F833-P868 HydrophobicContact CG-CG 3.85Å; F833-P868 HydrophobicContact CZ-CG 4.5Å; L862-P868 HydrophobicContact CD1-CB 3.91Å; L862-P868 HydrophobicContact CD1-CG 3.76Å; L862-P868 HydrophobicContact CD2-CB 4Å; L862-P868 HydrophobicContact CD2-CG 4.11Å; L862-P868 HydrophobicContact CG-CG 4.44Å; H866-P868 VanDerWaalsContact O-CD 3.28Å; H866-P868 WeakPolarHBondContact O-CD 3.26Å
869	T	89.1	Confident	92.6	Very high	87 Å²	87	51.6 Å²	51.6	53%	0.534	28%	0.279	S	S	.	.	P	Polyproline II helix	trans	-54.1	141.3	162.6	60.1	0	0	0	0	109.6	K860	K860-T869 PolarHBondContact NZ-OG1 2.83Å
870	P	89.7	Confident	92.7	Very high	48 Å²	48	48.8 Å²	48.8	31%	0.312	26%	0.264	S	S	.	.	P	Polyproline II helix	trans	-50.1	148.9	173.8	-30.7	37.5	0	0	0	113.9	L828 I829 L919	L828-P870 CarbonylContact O-C 3.57Å; L828-P870 VanDerWaalsContact O-CA 3.28Å; L828-P870 WeakPolarHBondContact O-CA 3.25Å; I829-P870 HydrophobicContact CG1-CB 4.26Å; I829-P870 HydrophobicContact CG1-CG 4.46Å; I829-P870 HydrophobicContact CG2-CG 4.44Å; P870-L919 HydrophobicContact CB-CD1 3.21Å; P870-L919 HydrophobicContact CG-CD1 3.98Å
871	I	93.8	Very high	92.7	Very high	12 Å²	12	46.7 Å²	46.7	6%	0.062	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	136.1	-174.5	-56.1	175.4	0	0	0	108.9	A827 L828 F830 V848 L859 K860 L862 M878	A827-I871 CarbonylContact C-O 3.52Å; A827-I871 WeakPolarHBondContact CA-O 3.33Å; L828-I871 PolarHBondContact N-O 3.48Å; L828-I871 PolarHBondContact O-N 3.12Å; F830-I871 HydrophobicContact CE2-CD1 4.17Å; V848-I871 HydrophobicContact CB-CD1 4.26Å; V848-I871 HydrophobicContact CG1-CD1 4.41Å; V848-I871 HydrophobicContact CG1-CG2 4.01Å; V848-I871 HydrophobicContact CG2-CD1 4.09Å; L859-I871 HydrophobicContact CB-CG2 4.03Å; L859-I871 HydrophobicContact CD1-CG2 3.96Å; K860-I871 HydrophobicContact CB-CD1 3.83Å; K860-I871 HydrophobicContact CD-CD1 3.95Å; K860-I871 HydrophobicContact CD-CG1 4.28Å; L862-I871 HydrophobicContact CD1-CD1 4.09Å; I871-M878 HydrophobicContact CG2-CE 4.31Å
872	K	92.9	Very high	92.8	Very high	73 Å²	73	43.4 Å²	43.4	32%	0.317	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	131.9	-179.7	-179.5	171.6	179.3	163.2	0	109.5	S825 V826 E900 L919	S825-K872 VanDerWaalsContact OG-CE 3.23Å; S825-K872 WeakPolarHBondContact OG-CE 3.5Å; V826-K872 WeakPolarHBondContact O-CA 3.37Å; K872-E900 HydrophobicContact CD-CG 3.71Å; K872-E900 HydrophobicContact CG-CG 4.17Å; K872-E900 VanDerWaalsContact NZ-CG 3.31Å; K872-E900 IonicContact NZ-OE1 3.51Å; K872-E900 PolarHBondContact NZ-OE1 2.9Å; K872-L919 HydrophobicContact CB-CD2 4.42Å; K872-L919 HydrophobicContact CD-CD2 4.09Å
873	S	94.9	Very high	92.8	Very high	4 Å²	4	43.7 Å²	43.7	3%	0.028	24%	0.243	C	C	.	.			trans	-78.3	160.6	170.5	60	0	0	0	0	111.2	S825 V826 D850 N875 V877	S825-S873 WeakPolarHBondContact CB-O 3.47Å; V826-S873 WeakPolarHBondContact CB-OG 3.29Å; V826-S873 PolarHBondContact N-OG 3.37Å; V826-S873 PolarHBondContact O-N 3.32Å; V826-S873 PolarHBondContact O-OG 3.01Å; D850-S873 VanDerWaalsContact OD1-CA 3.29Å; D850-S873 WeakPolarHBondContact OD1-CA 3.4Å; D850-S873 WeakPolarHBondContact OD1-CB 2.95Å; S873-N875 PolarHBondContact OG-O 2.66Å; S873-V877 WeakPolarHBondContact CB-O 3.35Å; S873-V877 PolarHBondContact OG-O 3.27Å
874	T	92.1	Very high	92.8	Very high	119 Å²	119	42.8 Å²	42.8	73%	0.73	24%	0.237	S	C	*	.	S	Bend	trans	-81	-19.1	174.4	62.5	0	0	0	0	113.1	D850	D850-T874 PolarHBondContact OD1-N 2.9Å; D850-T874 PolarHBondContact OD1-OG1 2.84Å; D850-T874 WeakPolarHBondContact OD2-CB 3.3Å; D850-T874 WeakPolarHBondContact OD2-CG2 3.4Å; D850-T874 PolarHBondContact OD2-OG1 2.88Å
875	N	92	Very high	92.9	Very high	84 Å²	84	44.6 Å²	44.6	45%	0.449	25%	0.246	S	C	.	.	S	Bend	trans	-136.7	178.6	-176.5	-163.6	13.4	0	0	0	111.8	Y824 S873 V877	Y824-N875 CarbonylContact O-C 3.58Å; S873-N875 PolarHBondContact OG-O 2.66Å; N875-V877 HydrophobicContact CB-CG2 4.44Å; N875-V877 PolarHBondContact O-N 3.28Å
876	N	95	Very high	93.1	Very high	23 Å²	23	45.3 Å²	45.3	12%	0.123	25%	0.25	C	S	.	.	S	Bend	trans	-69	17.4	-173.3	79.9	-64	0	0	0	116	V820 Y824	V820-N876 HydrophobicContact CG2-CB 3.96Å; V820-N876 WeakPolarHBondContact CG2-O 3.43Å; V820-N876 PolarHBondContact N-O 2.82Å; V820-N876 PolarHBondContact O-ND2 2.5Å; Y824-N876 WeakPolarHBondContact O-CA 3.06Å; Y824-N876 VanDerWaalsContact O-CB 3.25Å; Y824-N876 WeakPolarHBondContact O-CB 3.27Å; Y824-N876 PolarHBondContact O-N 2.71Å; Y824-N876 VanDerWaalsContact O-N 3.16Å
877	V	96.3	Very high	93.3	Very high	21 Å²	21	39.8 Å²	39.8	13%	0.127	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	143.6	-171.6	-70.9	0	0	0	0	111.6	I818 I819 L852 S873 N875	I818-V877 WeakPolarHBondContact O-CA 2.96Å; I819-V877 HydrophobicContact CG1-CG1 4.28Å; L852-V877 HydrophobicContact CD1-CB 4.49Å; L852-V877 HydrophobicContact CD1-CG1 3.88Å; L852-V877 HydrophobicContact CD2-CB 3.73Å; L852-V877 HydrophobicContact CD2-CG1 3.78Å; L852-V877 HydrophobicContact CG-CB 3.79Å; L852-V877 HydrophobicContact CG-CG1 3.73Å; L852-V877 HydrophobicContact CG-CG2 4.42Å; S873-V877 WeakPolarHBondContact CB-O 3.35Å; S873-V877 PolarHBondContact OG-O 3.27Å; N875-V877 HydrophobicContact CB-CG2 4.44Å; N875-V877 PolarHBondContact O-N 3.28Å
878	M	96.4	Very high	93.3	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	138.4	174.5	-176.7	-177.8	-74.7	0	0	110.8	I818 V826 L828 V848 G851 L859 I871 V880	I818-M878 HydrophobicContact CB-CB 4.37Å; I818-M878 HydrophobicContact CD1-CB 4.41Å; I818-M878 HydrophobicContact CD1-SD 4.4Å; I818-M878 PolarHBondContact N-O 2.82Å; I818-M878 PolarHBondContact O-N 2.93Å; V826-M878 HydrophobicContact CB-CB 3.89Å; V826-M878 HydrophobicContact CB-CE 4.08Å; V826-M878 HydrophobicContact CG1-CB 3.97Å; V826-M878 HydrophobicContact CG1-CE 4.11Å; V826-M878 HydrophobicContact CG1-SD 4.08Å; V826-M878 HydrophobicContact CG2-CB 4.04Å; V826-M878 WeakPolarHBondContact O-CE 3.22Å; L828-M878 HydrophobicContact CB-CE 4.35Å; L828-M878 HydrophobicContact CB-SD 3.97Å; L828-M878 HydrophobicContact CD2-SD 4.18Å; V848-M878 HydrophobicContact CG1-CE 4.28Å; V848-M878 HydrophobicContact CG1-CG 3.93Å; V848-M878 HydrophobicContact CG1-SD 3.62Å; G851-M878 CarbonylContact O-C 3.59Å; G851-M878 VanDerWaalsContact O-CA 3.3Å; G851-M878 WeakPolarHBondContact O-CA 3.22Å; G851-M878 PolarHBondContact O-N 3.28Å; L859-M878 HydrophobicContact CD1-CE 4.33Å; I871-M878 HydrophobicContact CG2-CE 4.31Å; M878-V880 HydrophobicContact CG-CG2 4.11Å; M878-V880 HydrophobicContact SD-CG2 4.14Å
879	Y	96.7	Very high	93.2	Very high	14 Å²	14	41.2 Å²	41.2	6%	0.055	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	124.8	178	172.5	-79.8	0	0	0	108.4	V815 Q817 R849 G851 K881	V815-Y879 HydrophobicContact CG1-CD2 4.06Å; V815-Y879 HydrophobicContact CG1-CE2 3.29Å; Q817-Y879 HydrophobicContact CG-CD2 4.12Å; R849-Y879 HydrophobicContact CB-CD1 4.1Å; R849-Y879 HydrophobicContact CG-CD1 4.18Å; R849-Y879 PolarHBondContact N-O 2.87Å; R849-Y879 PolarHBondContact O-N 2.88Å; G851-Y879 WeakPolarHBondContact O-CB 3.42Å; G851-Y879 PolarHBondContact O-N 2.88Å; Y879-K881 HydrophobicContact CE1-CB 3.67Å
880	V	96.2	Very high	93.3	Very high	1 Å²	1	40.3 Å²	40.3	1%	0.006	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	121.7	-178.3	-178.7	0	0	0	0	108.4	V815 W816 I818 L828 L846 E847 V848 M878	V815-V880 CarbonylContact C-O 3.53Å; V815-V880 WeakPolarHBondContact CA-O 3.29Å; W816-V880 HydrophobicContact CB-CB 4.45Å; W816-V880 HydrophobicContact CE3-CB 4.3Å; W816-V880 HydrophobicContact CE3-CG1 4.01Å; W816-V880 HydrophobicContact CZ3-CG1 4.43Å; W816-V880 PolarHBondContact N-O 3.23Å; W816-V880 PolarHBondContact O-N 2.7Å; I818-V880 HydrophobicContact CD1-CG2 3.98Å; L828-V880 HydrophobicContact CD2-CG2 4.3Å; L846-V880 HydrophobicContact CD1-CG1 3.61Å; L846-V880 HydrophobicContact CG-CG1 4.25Å; E847-V880 CarbonylContact O-C 3.6Å; E847-V880 WeakPolarHBondContact O-CA 3.12Å; V848-V880 HydrophobicContact CG1-CG2 4.4Å; V848-V880 HydrophobicContact CG2-CG1 4.48Å; M878-V880 HydrophobicContact CG-CG2 4.11Å; M878-V880 HydrophobicContact SD-CG2 4.14Å
881	K	96.1	Very high	93.2	Very high	34 Å²	34	38.8 Å²	38.8	15%	0.148	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	115.3	178.5	169.2	165.6	173.4	154	0	110.4	E813 C814 V815 E847 Y879 V883	E813-K881 WeakPolarHBondContact OE1-CE 3.12Å; E813-K881 IonicContact OE1-NZ 3.62Å; E813-K881 PolarHBondContact OE1-NZ 2.74Å; E813-K881 WeakPolarHBondContact OE2-CE 3.37Å; E813-K881 IonicContact OE2-NZ 3.41Å; E813-K881 PolarHBondContact OE2-NZ 3.1Å; C814-K881 CarbonylContact O-C 3.5Å; C814-K881 WeakPolarHBondContact O-CA 3.44Å; V815-K881 HydrophobicContact CG2-CB 4.16Å; V815-K881 HydrophobicContact CG2-CD 4.1Å; V815-K881 HydrophobicContact CG2-CG 4.03Å; E847-K881 HydrophobicContact CB-CB 4.39Å; E847-K881 PolarHBondContact N-O 3.4Å; E847-K881 PolarHBondContact O-N 2.78Å; Y879-K881 HydrophobicContact CE1-CB 3.67Å; K881-V883 HydrophobicContact CD-CG2 4.26Å; K881-V883 HydrophobicContact CG-CG2 3.96Å
882	F	96.1	Very high	93.1	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	137.7	165.9	173.2	-117.4	0	0	0	109.5	P802 Y808 E813 C814 W816 L835 Y845 L846 F893	P802-F882 HydrophobicContact CG-CE1 4.49Å; Y808-F882 HydrophobicContact CD1-CZ 4.2Å; Y808-F882 HydrophobicContact CD2-CE1 4.47Å; Y808-F882 AromaticContact CD2-CZ 3.83Å; Y808-F882 HydrophobicContact CD2-CZ 3.83Å; Y808-F882 HydrophobicContact CE2-CZ 4.21Å; Y808-F882 HydrophobicContact CG-CE1 4.33Å; Y808-F882 AromaticContact CG-CZ 3.82Å; Y808-F882 HydrophobicContact CG-CZ 3.82Å; E813-F882 WeakPolarHBondContact CA-O 3.39Å; C814-F882 HydrophobicContact CB-CB 4.27Å; C814-F882 HydrophobicContact CB-CD1 4.46Å; C814-F882 PolarHBondContact N-O 2.91Å; C814-F882 PolarHBondContact O-N 3.17Å; W816-F882 HydrophobicContact CH2-CB 4.15Å; W816-F882 HydrophobicContact CZ3-CB 3.78Å; L835-F882 HydrophobicContact CD1-CD2 4.27Å; L835-F882 HydrophobicContact CD1-CE2 4Å; L835-F882 HydrophobicContact CD2-CD2 4.4Å; L835-F882 HydrophobicContact CD2-CE2 3.57Å; L835-F882 HydrophobicContact CD2-CZ 4.25Å; L835-F882 HydrophobicContact CG-CE2 4.46Å; Y845-F882 WeakPolarHBondContact O-CA 3.02Å; Y845-F882 WeakPolarHBondContact O-CD2 3.25Å; L846-F882 HydrophobicContact CD1-CB 3.81Å; F882-F893 HydrophobicContact CB-CE1 4.12Å; F882-F893 HydrophobicContact CB-CZ 4.34Å; F882-F893 AromaticContact CD2-CE1 3.86Å; F882-F893 HydrophobicContact CD2-CE1 3.86Å; F882-F893 HydrophobicContact CE2-CE1 4.5Å; F882-F893 AromaticContact CG-CE1 3.94Å; F882-F893 HydrophobicContact CG-CE1 3.94Å
883	V	95.8	Very high	93	Very high	24 Å²	24	34.9 Å²	34.9	15%	0.145	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	135.4	170.2	179.2	0	0	0	0	108.8	K812 E813 D844 Y845 K881	K812-V883 CarbonylContact O-C 3.54Å; K812-V883 VanDerWaalsContact O-CA 3.31Å; K812-V883 WeakPolarHBondContact O-CA 3.46Å; E813-V883 HydrophobicContact CG-CG2 4.3Å; D844-V883 WeakPolarHBondContact CA-O 3.5Å; Y845-V883 HydrophobicContact CD1-CB 4.36Å; Y845-V883 HydrophobicContact CD2-CB 4.46Å; Y845-V883 HydrophobicContact CE1-CB 3.88Å; Y845-V883 HydrophobicContact CE1-CG1 4.16Å; Y845-V883 HydrophobicContact CE1-CG2 4.35Å; Y845-V883 HydrophobicContact CE2-CB 4.03Å; Y845-V883 HydrophobicContact CE2-CG2 3.86Å; Y845-V883 PolarHBondContact N-O 2.78Å; Y845-V883 PolarHBondContact O-N 3.22Å; K881-V883 HydrophobicContact CD-CG2 4.26Å; K881-V883 HydrophobicContact CG-CG2 3.96Å
884	S	94.7	Very high	92.8	Very high	6 Å²	6	35.3 Å²	35.3	4%	0.042	20%	0.2	C	C	.	.			trans	-113.3	147.3	163.8	56.9	0	0	0	0	113.1	R809 S811 K812 D844	R809-S884 PolarHBondContact O-OG 2.76Å; S811-S884 WeakPolarHBondContact CA-O 3.41Å; S811-S884 PolarHBondContact N-O 2.68Å; S811-S884 PolarHBondContact N-OG 3.3Å; K812-S884 PolarHBondContact N-OG 3.09Å; K812-S884 PolarHBondContact O-N 3.01Å; K812-S884 PolarHBondContact O-OG 3.28Å; D844-S884 WeakPolarHBondContact OD1-CA 3.06Å; D844-S884 VanDerWaalsContact OD1-CB 3.23Å; D844-S884 WeakPolarHBondContact OD1-CB 3.4Å
885	D	93.8	Very high	92.7	Very high	43 Å²	43	29.7 Å²	29.7	23%	0.23	17%	0.165	C	C	.	.			trans	-73.9	172.4	174.4	172.4	-70.5	0	0	0	111.2	P810 S811 D844 S887	P810-D885 CarbonylContact C-O 3.57Å; P810-D885 WeakPolarHBondContact CA-O 3.44Å; P810-D885 WeakPolarHBondContact CB-O 3.49Å; S811-D885 PolarHBondContact N-O 2.75Å; D844-D885 PolarHBondContact OD1-N 2.88Å; D885-S887 PolarHBondContact O-N 3.26Å; D885-S887 VanDerWaalsContact O-N 3.1Å; D885-S887 WeakPolarHBondContact OD1-CB 3.26Å; D885-S887 PolarHBondContact OD1-N 2.82Å; D885-S887 PolarHBondContact OD1-OG 3.37Å
886	S	92.3	Very high	92.6	Very high	90 Å²	90	27.4 Å²	27.4	63%	0.629	16%	0.155	S	C	*	.	S	Bend	trans	-63.3	-1.3	172.3	52.2	0	0	0	0	116.1	P810	P810-S886 VanDerWaalsContact CB-C 3.48Å
887	S	90.4	Very high	92.5	Very high	47 Å²	47	26.4 Å²	26.4	33%	0.329	15%	0.149	S	C	.	.	S	Bend	trans	-154.2	-179	-167.3	65.7	0	0	0	0	114.2	D885 E889	D885-S887 PolarHBondContact O-N 3.26Å; D885-S887 VanDerWaalsContact O-N 3.1Å; D885-S887 WeakPolarHBondContact OD1-CB 3.26Å; D885-S887 PolarHBondContact OD1-N 2.82Å; D885-S887 PolarHBondContact OD1-OG 3.37Å; S887-E889 PolarHBondContact O-N 3.13Å
888	V	84.6	Confident	92.2	Very high	60 Å²	60	27.7 Å²	27.7	36%	0.364	15%	0.154	S	C	.	.			trans	56.1	46.2	165.6	-164	0	0	0	0	115.5	E836 K890	E836-V888 HydrophobicContact CB-CG1 4.37Å; E836-V888 HydrophobicContact CG-CB 4.37Å; E836-V888 HydrophobicContact CG-CG1 3.89Å; E836-V888 WeakPolarHBondContact OE1-CB 3.14Å; E836-V888 VanDerWaalsContact OE1-CG1 3.29Å; E836-V888 WeakPolarHBondContact OE1-CG1 3.19Å; V888-K890 PolarHBondContact O-NZ 3.09Å
889	E	88.9	Confident	91.9	Very high	75 Å²	75	31 Å²	31	35%	0.35	17%	0.168	S	C	.	.			trans	-58.4	147.8	179.7	-50.6	92	145.5	0	0	113.8	F807 Y808 P810 S887	F807-E889 HydrophobicContact CB-CB 4.06Å; F807-E889 HydrophobicContact CD2-CB 4.4Å; Y808-E889 HydrophobicContact CE2-CB 4.47Å; Y808-E889 WeakPolarHBondContact O-CB 3.26Å; Y808-E889 VanDerWaalsContact O-CG 3.29Å; Y808-E889 WeakPolarHBondContact O-CG 3.35Å; P810-E889 WeakPolarHBondContact CD-OE1 3.44Å; S887-E889 PolarHBondContact O-N 3.13Å
890	K	90.6	Very high	91.6	Very high	68 Å²	68	30.3 Å²	30.3	30%	0.296	17%	0.165	S	C	.	.			trans	-136.6	178.7	178.6	-60.2	-68.8	159.7	-65.8	0	111	F807 Y808 Q834 V888 G892	F807-K890 VanDerWaalsContact CA-O 3.28Å; F807-K890 WeakPolarHBondContact CA-O 3.42Å; F807-K890 VanDerWaalsContact CD1-C 3.43Å; F807-K890 WeakPolarHBondContact CD1-O 3.32Å; Y808-K890 WeakPolarHBondContact CD1-O 3.32Å; Y808-K890 HydrophobicContact CE1-CB 3.77Å; Y808-K890 WeakPolarHBondContact CE1-O 3.37Å; Y808-K890 VanDerWaalsContact CZ-N 3.31Å; Y808-K890 PolarHBondContact N-O 2.97Å; Y808-K890 WeakPolarHBondContact OH-CB 3.32Å; Y808-K890 PolarHBondContact OH-N 3.03Å; Q834-K890 HydrophobicContact CB-CB 4.43Å; Q834-K890 VanDerWaalsContact O-CB 3.22Å; Q834-K890 WeakPolarHBondContact O-CB 3.47Å; V888-K890 PolarHBondContact O-NZ 3.09Å; K890-G892 PolarHBondContact O-N 3.45Å; K890-G892 VanDerWaalsContact O-N 3.15Å
891	Q	86.9	Confident	91.3	Very high	17 Å²	17	34 Å²	34	8%	0.079	18%	0.181	C	C	.	.			trans	-60	-22.4	179.3	-143.8	81.8	39	0	0	114	A359 K363 Y804 P805 Q834	A359-Q891 HydrophobicContact CB-CG 3.68Å; K363-Q891 VanDerWaalsContact CE-NE2 3.27Å; Y804-Q891 WeakPolarHBondContact CD2-O 3.14Å; Y804-Q891 WeakPolarHBondContact CE2-O 3.23Å; P805-Q891 PolarHBondContact O-NE2 3.12Å; Q834-Q891 HydrophobicContact CB-CB 4.24Å; Q834-Q891 VanDerWaalsContact OE1-CB 3.31Å
892	G	91.5	Very high	90.7	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	80.9	-148.1	179.9	0	0	0	0	0	113.4	S801 Q834 K890	S801-G892 VanDerWaalsContact OG-CA 3.29Å; S801-G892 WeakPolarHBondContact OG-CA 3.48Å; Q834-G892 PolarHBondContact N-O 3.4Å; Q834-G892 VanDerWaalsContact O-CA 3.24Å; Q834-G892 WeakPolarHBondContact O-CA 3.34Å; Q834-G892 PolarHBondContact O-N 3.19Å; K890-G892 PolarHBondContact O-N 3.45Å; K890-G892 VanDerWaalsContact O-N 3.15Å
893	F	92.1	Very high	90.3	Very high	2 Å²	2	36 Å²	36	1%	0.009	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	156.3	-174.5	67.1	-91.9	0	0	0	113.2	T800 S801 W816 F830 S832 F833 L835 L846 F882	T800-F893 VanDerWaalsContact CA-O 3.23Å; T800-F893 WeakPolarHBondContact CA-O 3.34Å; T800-F893 WeakPolarHBondContact CB-O 3.26Å; S801-F893 PolarHBondContact N-O 2.92Å; S801-F893 VanDerWaalsContact N-O 3.13Å; S801-F893 PolarHBondContact OG-N 3.49Å; W816-F893 AromaticContact CH2-CZ 3.96Å; W816-F893 HydrophobicContact CH2-CZ 3.96Å; W816-F893 HydrophobicContact CZ3-CZ 4.11Å; F830-F893 HydrophobicContact CE1-CD2 4.45Å; S832-F893 VanDerWaalsContact O-CA 3.26Å; S832-F893 WeakPolarHBondContact O-CA 3.4Å; S832-F893 WeakPolarHBondContact O-CB 3.38Å; F833-F893 HydrophobicContact CD2-CB 3.7Å; F833-F893 HydrophobicContact CD2-CG 4.44Å; F833-F893 HydrophobicContact CE2-CB 4.27Å; F833-F893 HydrophobicContact CG-CB 4.5Å; L835-F893 HydrophobicContact CD2-CD1 4.42Å; L846-F893 HydrophobicContact CD1-CE1 3.83Å; L846-F893 HydrophobicContact CD1-CE2 4.4Å; L846-F893 HydrophobicContact CD1-CZ 3.68Å; L846-F893 HydrophobicContact CD2-CD1 4.42Å; L846-F893 HydrophobicContact CD2-CD2 4.37Å; L846-F893 HydrophobicContact CD2-CE1 4.29Å; L846-F893 HydrophobicContact CD2-CE2 4.24Å; L846-F893 HydrophobicContact CD2-CG 4.47Å; L846-F893 HydrophobicContact CD2-CZ 4.2Å; F882-F893 HydrophobicContact CB-CE1 4.12Å; F882-F893 HydrophobicContact CB-CZ 4.34Å; F882-F893 AromaticContact CD2-CE1 3.86Å; F882-F893 HydrophobicContact CD2-CE1 3.86Å; F882-F893 HydrophobicContact CE2-CE1 4.5Å; F882-F893 AromaticContact CG-CE1 3.94Å; F882-F893 HydrophobicContact CG-CE1 3.94Å
894	T	89.9	Confident	90	Very high	13 Å²	13	36.5 Å²	36.5	8%	0.08	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	133.5	158.4	170.2	0	0	0	0	109.5	L799 Y804 H831 S832	L799-T894 WeakPolarHBondContact O-CA 3.24Å; Y804-T894 HydrophobicContact CE1-CG2 3.86Å; H831-T894 HydrophobicContact CB-CG2 4.05Å; H831-T894 PolarHBondContact N-O 3.41Å; S832-T894 PolarHBondContact N-O 3.45Å; S832-T894 PolarHBondContact O-N 3.31Å
895	A	91.3	Very high	89.5	Confident	1 Å²	1	44.2 Å²	44.2	1%	0.008	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	142.3	176.3	0	0	0	0	0	109.8	L799 L828 I829 F830	L799-A895 PolarHBondContact N-O 3.14Å; L799-A895 PolarHBondContact O-N 2.88Å; L799-A895 VanDerWaalsContact O-O 3.08Å; L828-A895 HydrophobicContact CD1-CB 3.93Å; L828-A895 HydrophobicContact CG-CB 4.36Å; I829-A895 CarbonylContact O-C 3.55Å; I829-A895 WeakPolarHBondContact O-CA 3.44Å; I829-A895 VanDerWaalsContact O-CB 3.31Å; I829-A895 WeakPolarHBondContact O-CB 3.42Å; F830-A895 HydrophobicContact CD1-CB 3.71Å; F830-A895 HydrophobicContact CE1-CB 3.88Å; F830-A895 HydrophobicContact CG-CB 4.12Å; F830-A895 HydrophobicContact CZ-CB 4.42Å
896	T	89.5	Confident	88.9	Confident	37 Å²	37	44.6 Å²	44.6	23%	0.227	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	154.6	162.4	60.1	0	0	0	0	109.7	G797 L828 I829 H831	G797-T896 CarbonylContact O-C 3.58Å; G797-T896 WeakPolarHBondContact O-CA 3.4Å; G797-T896 WeakPolarHBondContact O-CB 3.29Å; L828-T896 WeakPolarHBondContact CA-O 3.36Å; I829-T896 PolarHBondContact N-O 3.3Å; I829-T896 PolarHBondContact O-N 3.01Å; H831-T896 PolarHBondContact CE1-OG1 2.96Å
897	F	91.7	Very high	87.8	Confident	2 Å²	2	49.5 Å²	49.5	1%	0.009	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	154.3	158.3	65.3	-86.8	0	0	0	110.4	L792 M794 E796 G797 L799 I818 V826 A827 L828	L792-F897 HydrophobicContact CB-CZ 4.36Å; L792-F897 HydrophobicContact CD1-CE1 3.99Å; L792-F897 HydrophobicContact CD1-CZ 4.07Å; M794-F897 HydrophobicContact CG-CE2 3.69Å; M794-F897 HydrophobicContact CG-CZ 3.51Å; M794-F897 HydrophobicContact SD-CE2 4.46Å; M794-F897 HydrophobicContact SD-CZ 3.74Å; E796-F897 CarbonylContact C-O 3.5Å; E796-F897 VanDerWaalsContact CA-O 3.25Å; E796-F897 WeakPolarHBondContact CA-O 3.41Å; G797-F897 PolarHBondContact N-O 3.1Å; G797-F897 WeakPolarHBondContact O-CD1 3.46Å; G797-F897 PolarHBondContact O-N 3.16Å; L799-F897 HydrophobicContact CD1-CD1 3.96Å; L799-F897 HydrophobicContact CD1-CE1 4.33Å; L799-F897 HydrophobicContact CD2-CD1 4.48Å; L799-F897 HydrophobicContact CD2-CE1 4.1Å; L799-F897 HydrophobicContact CG-CD1 3.83Å; L799-F897 HydrophobicContact CG-CE1 3.94Å; I818-F897 HydrophobicContact CD1-CB 4.17Å; I818-F897 HydrophobicContact CD1-CD1 4.09Å; I818-F897 HydrophobicContact CD1-CG 4.02Å; I818-F897 HydrophobicContact CG2-CD2 3.47Å; I818-F897 VanDerWaalsContact CG2-CD2 3.47Å; I818-F897 HydrophobicContact CG2-CE2 3.55Å; I818-F897 HydrophobicContact CG2-CG 4.04Å; I818-F897 HydrophobicContact CG2-CZ 4.17Å; V826-F897 HydrophobicContact CG1-CB 4.14Å; A827-F897 CarbonylContact O-C 3.53Å; A827-F897 WeakPolarHBondContact O-CA 3.39Å; A827-F897 WeakPolarHBondContact O-CB 3.34Å; L828-F897 HydrophobicContact CD1-CB 4.15Å
898	Q	90.7	Very high	87.2	Confident	47 Å²	47	56.3 Å²	56.3	22%	0.22	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	151.9	177.3	65.2	-173.6	35.7	0	0	110.2	E795 E796 A827 E900	E795-Q898 CarbonylContact O-C 3.05Å; E795-Q898 WeakPolarHBondContact O-CA 3.48Å; E796-Q898 HydrophobicContact CB-CB 4.44Å; A827-Q898 HydrophobicContact CB-CG 4.04Å; A827-Q898 PolarHBondContact N-O 2.86Å; A827-Q898 PolarHBondContact O-N 2.87Å; Q898-E900 PolarHBondContact O-N 2.82Å
899	K	91	Very high	87.2	Confident	69 Å²	69	55.3 Å²	55.3	30%	0.3	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.1	133.3	166.9	73.5	-178.8	-179.8	-166.5	0	109.1	E795 V820 Y824	E795-K899 HydrophobicContact CB-CD 4.03Å; E795-K899 HydrophobicContact CB-CG 4.49Å; E795-K899 HydrophobicContact CG-CD 4.17Å; E795-K899 PolarHBondContact O-N 3.41Å; E795-K899 WeakPolarHBondContact OE1-CD 3.48Å; E795-K899 IonicContact OE1-NZ 2.72Å; E795-K899 PolarHBondContact OE1-NZ 2.94Å; E795-K899 IonicContact OE2-NZ 3.44Å; E795-K899 PolarHBondContact OE2-NZ 3.11Å; V820-K899 HydrophobicContact CB-CB 4.08Å; V820-K899 HydrophobicContact CG1-CB 4.06Å; Y824-K899 HydrophobicContact CD1-CB 4.21Å; Y824-K899 HydrophobicContact CD1-CD 4.14Å; Y824-K899 HydrophobicContact CD1-CG 4.2Å; Y824-K899 HydrophobicContact CE1-CD 4.18Å; Y824-K899 HydrophobicContact CG-CB 4.29Å; Y824-K899 HydrophobicContact CG-CD 4.45Å
900	E	90.2	Very high	86.9	Confident	1 Å²	1	53.9 Å²	53.9	1%	0.005	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	121	-172.4	164.9	65.6	-179.1	0	0	108.3	S825 A827 K872 Q898 N917 T918 L919 G920	S825-E900 PolarHBondContact N-O 3.38Å; S825-E900 PolarHBondContact O-N 3.25Å; S825-E900 WeakPolarHBondContact OG-CG 3.49Å; S825-E900 PolarHBondContact OG-O 3.44Å; A827-E900 HydrophobicContact CB-CB 3.72Å; A827-E900 HydrophobicContact CB-CG 4.17Å; K872-E900 HydrophobicContact CD-CG 3.71Å; K872-E900 HydrophobicContact CG-CG 4.17Å; K872-E900 VanDerWaalsContact NZ-CG 3.31Å; K872-E900 IonicContact NZ-OE1 3.51Å; K872-E900 PolarHBondContact NZ-OE1 2.9Å; Q898-E900 PolarHBondContact O-N 2.82Å; E900-N917 PolarHBondContact OE1-ND2 3.22Å; E900-N917 VanDerWaalsContact OE1-ND2 3.09Å; E900-T918 VanDerWaalsContact OE1-O 3.13Å; E900-L919 HydrophobicContact CG-CD2 4.13Å; E900-L919 WeakPolarHBondContact OE1-CD2 3.43Å; E900-L919 WeakPolarHBondContact OE2-CA 3.48Å; E900-G920 PolarHBondContact OE2-N 3.25Å
901	F	88.4	Confident	86.9	Confident	77 Å²	77	51.4 Å²	51.4	34%	0.338	26%	0.26	S	S	.	.			trans	-103.8	172	176.9	-169.7	-115.9	0	0	0	109.8	Y824 E903 T906 N917	Y824-F901 HydrophobicContact CD1-CB 3.93Å; Y824-F901 HydrophobicContact CD1-CD2 4.16Å; Y824-F901 HydrophobicContact CD1-CG 4.45Å; Y824-F901 HydrophobicContact CE1-CB 3.94Å; Y824-F901 HydrophobicContact CE1-CD2 4.05Å; Y824-F901 HydrophobicContact CE1-CG 4.22Å; F901-E903 HydrophobicContact CD1-CG 3.94Å; F901-E903 HydrophobicContact CE1-CG 4.41Å; F901-T906 HydrophobicContact CE1-CG2 3.57Å; F901-T906 HydrophobicContact CZ-CG2 3.63Å; F901-N917 PolarHBondContact O-ND2 2.67Å
902	D	85.3	Confident	86.9	Confident	33 Å²	33	53.4 Å²	53.4	18%	0.176	28%	0.276	C	S	.	.			trans	-122.1	86.9	172.5	-169	-37.1	0	0	0	108.3	C904 K905 N917	D902-C904 PolarHBondContact O-N 3.09Å; D902-C904 PolarHBondContact OD1-N 2.98Å; D902-K905 HydrophobicContact CB-CB 4.35Å; D902-K905 HydrophobicContact CB-CD 4.09Å; D902-K905 HydrophobicContact CB-CG 4.08Å; D902-K905 WeakPolarHBondContact O-CB 3.45Å; D902-K905 PolarHBondContact O-N 2.8Å; D902-K905 VanDerWaalsContact O-N 3.12Å; D902-K905 PolarHBondContact OD1-N 3.33Å; D902-K905 VanDerWaalsContact OD1-N 3.09Å; D902-K905 IonicContact OD2-NZ 2.74Å; D902-K905 PolarHBondContact OD2-NZ 3.49Å; D902-N917 VanDerWaalsContact CA-OD1 3.24Å; D902-N917 WeakPolarHBondContact CA-OD1 3.15Å; D902-N917 PolarHBondContact OD1-OD1 3.21Å
903	E	87.6	Confident	86.8	Confident	44 Å²	44	56 Å²	56	21%	0.206	29%	0.288	C	S	.	.	G	3₁₀ helix	trans	-62.4	-27.7	-177.1	-67.9	83.1	-161.6	0	0	111.7	F901 K905 T906 N917 G921 Y922	F901-E903 HydrophobicContact CD1-CG 3.94Å; F901-E903 HydrophobicContact CE1-CG 4.41Å; E903-K905 VanDerWaalsContact C-N 3.28Å; E903-K905 PolarHBondContact O-N 2.8Å; E903-T906 WeakPolarHBondContact O-CA 3.36Å; E903-T906 WeakPolarHBondContact O-CB 3.08Å; E903-T906 PolarHBondContact O-N 2.66Å; E903-T906 PolarHBondContact O-OG1 3.13Å; E903-N917 PolarHBondContact N-OD1 2.64Å; E903-N917 VanDerWaalsContact N-OD1 3.12Å; E903-G921 WeakPolarHBondContact OE2-CA 3.37Å; E903-Y922 HydrophobicContact CB-CD1 3.37Å; E903-Y922 HydrophobicContact CB-CE1 3.93Å; E903-Y922 HydrophobicContact CB-CG 3.95Å; E903-Y922 HydrophobicContact CG-CD1 3.53Å; E903-Y922 HydrophobicContact CG-CE1 3.93Å; E903-Y922 PolarHBondContact OE2-N 2.82Å
904	C	87.7	Confident	86.7	Confident	35 Å²	35	59 Å²	59	24%	0.236	31%	0.307	C	S	.	.	G	3₁₀ helix	trans	-70.2	-21	178.8	-59.4	0	0	0	0	113.3	D902 T906 C915 V916 N917	D902-C904 PolarHBondContact O-N 3.09Å; D902-C904 PolarHBondContact OD1-N 2.98Å; C904-T906 PolarHBondContact O-N 3.5Å; C904-C915 WeakPolarHBondContact CA-SG 3.25Å; C904-C915 HydrophobicContact CB-CB 3.68Å; C904-C915 WeakPolarHBondContact CB-SG 3.41Å; C904-C915 WeakPolarHBondContact SG-CB 3.03Å; C904-C915 CovalentContact SG-SG 2.04Å; C904-C915 PolarHBondContact SG-SG 2.99Å; C904-V916 VanDerWaalsContact SG-C 3.53Å; C904-V916 PolarHBondContact SG-N 3.19Å; C904-N917 PolarHBondContact SG-N 2.04Å; C904-N917 VanDerWaalsContact SG-N 3.36Å
905	K	85	Confident	86.7	Confident	168 Å²	168	59.6 Å²	59.6	73%	0.73	31%	0.311	S	S	*	.	G	3₁₀ helix	trans	-69.9	-11.3	165	-73.3	-174.9	179.4	87	0	113.4	D902 E903	D902-K905 HydrophobicContact CB-CB 4.35Å; D902-K905 HydrophobicContact CB-CD 4.09Å; D902-K905 HydrophobicContact CB-CG 4.08Å; D902-K905 WeakPolarHBondContact O-CB 3.45Å; D902-K905 PolarHBondContact O-N 2.8Å; D902-K905 VanDerWaalsContact O-N 3.12Å; D902-K905 PolarHBondContact OD1-N 3.33Å; D902-K905 VanDerWaalsContact OD1-N 3.09Å; D902-K905 IonicContact OD2-NZ 2.74Å; D902-K905 PolarHBondContact OD2-NZ 3.49Å; E903-K905 VanDerWaalsContact C-N 3.28Å; E903-K905 PolarHBondContact O-N 2.8Å
906	T	80.6	Confident	86.6	Confident	50 Å²	50	60.9 Å²	60.9	31%	0.307	32%	0.319	S	S	.	.	S	Bend	trans	-98.9	131.4	178.5	77.9	0	0	0	0	111.8	F901 E903 C904 K908 H909	F901-T906 HydrophobicContact CE1-CG2 3.57Å; F901-T906 HydrophobicContact CZ-CG2 3.63Å; E903-T906 WeakPolarHBondContact O-CA 3.36Å; E903-T906 WeakPolarHBondContact O-CB 3.08Å; E903-T906 PolarHBondContact O-N 2.66Å; E903-T906 PolarHBondContact O-OG1 3.13Å; C904-T906 PolarHBondContact O-N 3.5Å; T906-K908 PolarHBondContact O-N 2.85Å; T906-H909 PolarHBondContact O-CD2 2.74Å; T906-H909 PolarHBondContact O-N 3.14Å
907	M	70.3	Confident	86.3	Confident	193 Å²	193	60.9 Å²	60.9	95%	0.951	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	14.8	176.6	-63.4	-76.6	-75.7	0	0	114.4
908	K	78.5	Confident	85.9	Confident	191 Å²	191	61.9 Å²	61.9	83%	0.83	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-127.2	9.2	-177.2	-72.2	-171.8	177.3	-179.7	0	114.2	T906 G910	T906-K908 PolarHBondContact O-N 2.85Å; K908-G910 PolarHBondContact O-N 3.29Å; K908-G910 VanDerWaalsContact O-N 3.17Å
909	H	83	Confident	85.2	Confident	39 Å²	39	61.7 Å²	61.7	18%	0.181	32%	0.323	C	S	.	.	S	Bend	trans	-54.8	-32.3	171.9	63.3	79.6	0	0	0	112.2	T906 C911 C915 Y922 K937	T906-H909 PolarHBondContact O-CD2 2.74Å; T906-H909 PolarHBondContact O-N 3.14Å; H909-C911 VanDerWaalsContact C-N 3.33Å; H909-C911 WeakPolarHBondContact ND1-CB 3.47Å; H909-C911 PolarHBondContact ND1-N 2.71Å; H909-C911 PolarHBondContact ND1-SG 2.79Å; H909-C911 VanDerWaalsContact ND1-SG 3.4Å; H909-C911 PolarHBondContact O-N 2.93Å; H909-C915 VanDerWaalsContact CG-SG 3.57Å; H909-Y922 HydrophobicContact CB-CD2 4.2Å; H909-Y922 HydrophobicContact CB-CE2 3.95Å; H909-Y922 WeakPolarHBondContact O-CE2 3.46Å; H909-Y922 PolarHBondContact O-OH 2.88Å; H909-K937 PolarHBondContact O-NZ 3.43Å
910	G	84.2	Confident	84.3	Confident	45 Å²	45	60 Å²	60	46%	0.464	33%	0.326	S	S	.	.			trans	69.6	29.4	171.6	0	0	0	0	0	113.8	K908	K908-G910 PolarHBondContact O-N 3.29Å; K908-G910 VanDerWaalsContact O-N 3.17Å
911	C	89	Confident	84	Confident	16 Å²	16	60.6 Å²	60.6	11%	0.108	33%	0.332	C	S	.	.			trans	-77.5	144.3	161.6	-55.7	0	0	0	0	108.1	H909 C924	H909-C911 VanDerWaalsContact C-N 3.33Å; H909-C911 WeakPolarHBondContact ND1-CB 3.47Å; H909-C911 PolarHBondContact ND1-N 2.71Å; H909-C911 PolarHBondContact ND1-SG 2.79Å; H909-C911 VanDerWaalsContact ND1-SG 3.4Å; H909-C911 PolarHBondContact O-N 2.93Å; C911-C924 WeakPolarHBondContact CA-SG 3.09Å; C911-C924 HydrophobicContact CB-CB 3.59Å; C911-C924 WeakPolarHBondContact CB-SG 3.4Å; C911-C924 WeakPolarHBondContact SG-CA 3.13Å; C911-C924 WeakPolarHBondContact SG-CB 3.42Å; C911-C924 CovalentContact SG-SG 2.03Å; C911-C924 PolarHBondContact SG-SG 3.09Å
912	S	88.4	Confident	83.9	Confident	58 Å²	58	60.4 Å²	60.4	41%	0.406	33%	0.33	S	S	.	.	S	Bend	trans	-72	-45.7	175.1	48.5	0	0	0	0	112.5	K937 R938 C939	S912-K937 PolarHBondContact N-O 2.72Å; S912-K937 PolarHBondContact OG-O 2.67Å; S912-R938 VanDerWaalsContact OG-CA 3.32Å; S912-R938 WeakPolarHBondContact OG-CA 3.12Å; S912-C939 PolarHBondContact OG-N 2.74Å; S912-C939 PolarHBondContact OG-SG 2.65Å
913	H	88.9	Confident	84	Confident	55 Å²	55	63 Å²	63	26%	0.255	34%	0.337	S	S	.	.	S	Bend	trans	-107.4	-124.4	173.4	-59.3	161.8	0	0	0	109.5	E927 Y930 C939	H913-E927 HydrophobicContact CB-CG 4.24Å; H913-Y930 AromaticContact CE1-CD1 3.93Å; H913-Y930 AromaticContact CE1-CD2 3.72Å; H913-Y930 AromaticContact CE1-CE2 3.98Å; H913-Y930 AromaticContact CE1-CG 3.7Å; H913-C939 WeakPolarHBondContact ND1-CB 3.37Å; H913-C939 PolarHBondContact ND1-SG 2.69Å; H913-C939 VanDerWaalsContact ND1-SG 3.44Å
914	T	89.3	Confident	84.1	Confident	66 Å²	66	61.4 Å²	61.4	41%	0.405	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	138.9	-171.8	-50.4	0	0	0	0	113.1	V916 C924 Q925	T914-V916 HydrophobicContact CG2-CG2 4.16Å; T914-C924 WeakPolarHBondContact O-CA 3.36Å; T914-Q925 WeakPolarHBondContact CA-O 3.05Å; T914-Q925 WeakPolarHBondContact CB-O 3.01Å; T914-Q925 PolarHBondContact N-O 2.91Å; T914-Q925 PolarHBondContact O-N 3.31Å
915	C	91.1	Very high	84	Confident	24 Å²	24	64.6 Å²	64.6	16%	0.162	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	130	164.3	-171.8	0	0	0	0	109.6	C904 H909	C904-C915 WeakPolarHBondContact CA-SG 3.25Å; C904-C915 HydrophobicContact CB-CB 3.68Å; C904-C915 WeakPolarHBondContact CB-SG 3.41Å; C904-C915 WeakPolarHBondContact SG-CB 3.03Å; C904-C915 CovalentContact SG-SG 2.04Å; C904-C915 PolarHBondContact SG-SG 2.99Å; H909-C915 VanDerWaalsContact CG-SG 3.57Å
916	V	88.3	Confident	84	Confident	29 Å²	29	57.7 Å²	57.7	18%	0.176	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	114.8	175.7	-179	0	0	0	0	108.7	C904 T914 Y922 R923 Q925	C904-V916 VanDerWaalsContact SG-C 3.53Å; C904-V916 PolarHBondContact SG-N 3.19Å; T914-V916 HydrophobicContact CG2-CG2 4.16Å; V916-Y922 WeakPolarHBondContact O-CA 3.42Å; V916-R923 HydrophobicContact CB-CG 4.01Å; V916-R923 HydrophobicContact CG1-CG 4.48Å; V916-R923 PolarHBondContact N-O 2.62Å; V916-R923 PolarHBondContact O-N 2.58Å; V916-Q925 HydrophobicContact CG2-CB 3.93Å
917	N	84.3	Confident	84.1	Confident	37 Å²	37	60.7 Å²	60.7	20%	0.198	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	140	177.7	-152.4	76.6	0	0	0	110.3	E900 F901 D902 E903 C904	E900-N917 PolarHBondContact OE1-ND2 3.22Å; E900-N917 VanDerWaalsContact OE1-ND2 3.09Å; F901-N917 PolarHBondContact O-ND2 2.67Å; D902-N917 VanDerWaalsContact CA-OD1 3.24Å; D902-N917 WeakPolarHBondContact CA-OD1 3.15Å; D902-N917 PolarHBondContact OD1-OD1 3.21Å; E903-N917 PolarHBondContact N-OD1 2.64Å; E903-N917 VanDerWaalsContact N-OD1 3.12Å; C904-N917 PolarHBondContact SG-N 2.04Å; C904-N917 VanDerWaalsContact SG-N 3.36Å
918	T	81.8	Confident	84.3	Confident	22 Å²	22	54.4 Å²	54.4	14%	0.135	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	176.3	174.3	59.5	0	0	0	0	108.5	E900 G920 G921 R923	E900-T918 VanDerWaalsContact OE1-O 3.13Å; T918-G920 PolarHBondContact O-N 2.79Å; T918-G921 CarbonylContact C-O 3.58Å; T918-G921 VanDerWaalsContact CA-O 3.26Å; T918-G921 WeakPolarHBondContact CA-O 3.5Å; T918-G921 WeakPolarHBondContact CB-O 3.42Å; T918-G921 PolarHBondContact N-O 3.23Å; T918-G921 VanDerWaalsContact OG1-C 3.26Å; T918-G921 PolarHBondContact OG1-O 3.11Å; T918-R923 HydrophobicContact CG2-CG 4.21Å
919	L	77.3	Confident	84	Confident	43 Å²	43	45.9 Å²	45.9	23%	0.225	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.9	119.7	179.2	-61.6	172.9	0	0	0	109.3	A827 P870 K872 E900	A827-L919 HydrophobicContact CB-CD2 3.92Å; P870-L919 HydrophobicContact CB-CD1 3.21Å; P870-L919 HydrophobicContact CG-CD1 3.98Å; K872-L919 HydrophobicContact CB-CD2 4.42Å; K872-L919 HydrophobicContact CD-CD2 4.09Å; E900-L919 HydrophobicContact CG-CD2 4.13Å; E900-L919 WeakPolarHBondContact OE1-CD2 3.43Å; E900-L919 WeakPolarHBondContact OE2-CA 3.48Å
920	G	72.2	Confident	84.1	Confident	35 Å²	35	48.7 Å²	48.7	36%	0.361	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.9	40.4	-172.3	0	0	0	0	0	113.7	K143 E900 T918	K143-G920 PolarHBondContact NZ-O 2.86Å; E900-G920 PolarHBondContact OE2-N 3.25Å; T918-G920 PolarHBondContact O-N 2.79Å
921	G	82.4	Confident	83.6	Confident	12 Å²	12	49.3 Å²	49.3	12%	0.124	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	137.3	-167.8	170.7	0	0	0	0	0	113.7	E903 T918	E903-G921 WeakPolarHBondContact OE2-CA 3.37Å; T918-G921 CarbonylContact C-O 3.58Å; T918-G921 VanDerWaalsContact CA-O 3.26Å; T918-G921 WeakPolarHBondContact CA-O 3.5Å; T918-G921 WeakPolarHBondContact CB-O 3.42Å; T918-G921 PolarHBondContact N-O 3.23Å; T918-G921 VanDerWaalsContact OG1-C 3.26Å; T918-G921 PolarHBondContact OG1-O 3.11Å
922	Y	87.2	Confident	83.1	Confident	73 Å²	73	52.2 Å²	52.2	29%	0.286	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	161.9	179.4	65.6	-73.6	0	0	0	111.7	E903 H909 V916 K937	E903-Y922 HydrophobicContact CB-CD1 3.37Å; E903-Y922 HydrophobicContact CB-CE1 3.93Å; E903-Y922 HydrophobicContact CB-CG 3.95Å; E903-Y922 HydrophobicContact CG-CD1 3.53Å; E903-Y922 HydrophobicContact CG-CE1 3.93Å; E903-Y922 PolarHBondContact OE2-N 2.82Å; H909-Y922 HydrophobicContact CB-CD2 4.2Å; H909-Y922 HydrophobicContact CB-CE2 3.95Å; H909-Y922 WeakPolarHBondContact O-CE2 3.46Å; H909-Y922 PolarHBondContact O-OH 2.88Å; V916-Y922 WeakPolarHBondContact O-CA 3.42Å; Y922-K937 PolarHBondContact OH-NZ 3.29Å
923	R	87.9	Confident	82.7	Confident	89 Å²	89	51.8 Å²	51.8	34%	0.336	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	149.6	164	67.3	-179.9	-177.9	-115.3	-2.8	110	V916 T918	V916-R923 HydrophobicContact CB-CG 4.01Å; V916-R923 HydrophobicContact CG1-CG 4.48Å; V916-R923 PolarHBondContact N-O 2.62Å; V916-R923 PolarHBondContact O-N 2.58Å; T918-R923 HydrophobicContact CG2-CG 4.21Å
924	C	89.5	Confident	82.1	Confident	10 Å²	10	54.3 Å²	54.3	7%	0.068	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	144.6	169.7	-56.9	0	0	0	0	110	C911 T914 L932 G936	C911-C924 WeakPolarHBondContact CA-SG 3.09Å; C911-C924 HydrophobicContact CB-CB 3.59Å; C911-C924 WeakPolarHBondContact CB-SG 3.4Å; C911-C924 WeakPolarHBondContact SG-CA 3.13Å; C911-C924 WeakPolarHBondContact SG-CB 3.42Å; C911-C924 CovalentContact SG-SG 2.03Å; C911-C924 PolarHBondContact SG-SG 3.09Å; T914-C924 WeakPolarHBondContact O-CA 3.36Å; C924-L932 HydrophobicContact CB-CD1 3.98Å; C924-G936 WeakPolarHBondContact CB-O 3.5Å; C924-G936 PolarHBondContact SG-O 3.45Å
925	Q	86	Confident	81.9	Confident	102 Å²	102	54.3 Å²	54.3	48%	0.477	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	139	176.2	-176.7	168.7	-10.6	0	0	109.4	T914 V916	T914-Q925 WeakPolarHBondContact CA-O 3.05Å; T914-Q925 WeakPolarHBondContact CB-O 3.01Å; T914-Q925 PolarHBondContact N-O 2.91Å; T914-Q925 PolarHBondContact O-N 3.31Å; V916-Q925 HydrophobicContact CG2-CB 3.93Å
926	C	84.4	Confident	81.5	Confident	22 Å²	22	54.7 Å²	54.7	15%	0.149	30%	0.304	C	S	.	.	P	Polyproline II helix	trans	-90.6	149.4	-178.6	-59.9	0	0	0	0	111.9	Y930 L932 C939	C926-Y930 WeakPolarHBondContact CB-O 3.44Å; C926-L932 VanDerWaalsContact SG-CA 3.56Å; C926-C939 WeakPolarHBondContact CA-SG 3.29Å; C926-C939 HydrophobicContact CB-CB 3.88Å; C926-C939 WeakPolarHBondContact CB-SG 3.26Å; C926-C939 WeakPolarHBondContact SG-CB 3.34Å; C926-C939 CovalentContact SG-SG 2.04Å; C926-C939 PolarHBondContact SG-SG 3.36Å
927	E	82.8	Confident	81.5	Confident	114 Å²	114	56.9 Å²	56.9	53%	0.533	31%	0.311	S	S	.	.	P	Polyproline II helix	trans	-63.6	158.2	167.8	-69	177.4	-162.1	0	0	111.9	H913 G929 Y930	H913-E927 HydrophobicContact CB-CG 4.24Å; E927-G929 PolarHBondContact O-N 2.93Å; E927-Y930 HydrophobicContact CB-CD2 4.3Å; E927-Y930 PolarHBondContact O-N 3.08Å; E927-Y930 VanDerWaalsContact O-N 3.08Å
928	I	74.7	Confident	81.5	Confident	60 Å²	60	61 Å²	61	31%	0.308	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	120.1	-172.9	-58.6	180	0	0	0	110.3	V946 I970 K972	I928-V946 HydrophobicContact CB-CG2 4.19Å; I928-V946 HydrophobicContact CG2-CG2 4.36Å; I928-I970 HydrophobicContact CG2-CB 4.31Å; I928-I970 HydrophobicContact CG2-CG2 4.01Å; I928-I970 VanDerWaalsContact CG2-O 3.23Å; I928-I970 WeakPolarHBondContact CG2-O 3.48Å; I928-K972 HydrophobicContact CD1-CB 3.92Å; I928-K972 HydrophobicContact CD1-CD 4.11Å; I928-K972 HydrophobicContact CG2-CB 4.43Å
929	G	72.5	Confident	81.6	Confident	13 Å²	13	61 Å²	61	13%	0.134	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	108.9	-1.5	-172.2	0	0	0	0	0	114.3	E927 A942	E927-G929 PolarHBondContact O-N 2.93Å; G929-A942 CarbonylContact O-C 3.52Å; G929-A942 WeakPolarHBondContact O-CA 3.44Å; G929-A942 WeakPolarHBondContact O-CB 3.36Å; G929-A942 PolarHBondContact O-N 2.85Å
930	Y	83.6	Confident	81.8	Confident	97 Å²	97	63.3 Å²	63.3	38%	0.38	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	147.7	176.2	-61.7	-92.1	0	0	0	112.3	H913 C926 E927 E940 D941	H913-Y930 AromaticContact CE1-CD1 3.93Å; H913-Y930 AromaticContact CE1-CD2 3.72Å; H913-Y930 AromaticContact CE1-CE2 3.98Å; H913-Y930 AromaticContact CE1-CG 3.7Å; C926-Y930 WeakPolarHBondContact CB-O 3.44Å; E927-Y930 HydrophobicContact CB-CD2 4.3Å; E927-Y930 PolarHBondContact O-N 3.08Å; E927-Y930 VanDerWaalsContact O-N 3.08Å; Y930-E940 CarbonylContact C-O 3.55Å; Y930-E940 VanDerWaalsContact CA-O 3.22Å; Y930-E940 WeakPolarHBondContact CA-O 3.38Å; Y930-E940 WeakPolarHBondContact CB-O 3.26Å; Y930-D941 WeakPolarHBondContact CE1-OD1 3.29Å
931	E	73.8	Confident	81.8	Confident	58 Å²	58	68 Å²	68	27%	0.271	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	148.7	174.5	66.2	-173.5	-161.3	0	0	111.6	H933 C939 E940 A942 K967	E931-H933 PolarHBondContact O-N 2.83Å; E931-C939 CarbonylContact O-C 3.51Å; E931-C939 VanDerWaalsContact O-CA 3.32Å; E931-C939 WeakPolarHBondContact O-CA 3.1Å; E931-E940 PolarHBondContact N-O 2.95Å; E931-E940 PolarHBondContact O-N 3.45Å; E931-A942 HydrophobicContact CB-CB 3.82Å; E931-A942 HydrophobicContact CG-CB 3.97Å; E931-K967 IonicContact OE1-NZ 3.19Å; E931-K967 PolarHBondContact OE1-NZ 2.94Å; E931-K967 IonicContact OE2-NZ 2.62Å; E931-K967 PolarHBondContact OE2-NZ 2.85Å
932	L	78.9	Confident	81.2	Confident	77 Å²	77	68.7 Å²	68.7	40%	0.403	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	118.1	-178.8	-166.6	72	0	0	0	109.7	C924 C926	C924-L932 HydrophobicContact CB-CD1 3.98Å; C926-L932 VanDerWaalsContact SG-CA 3.56Å
933	H	79.7	Confident	80.9	Confident	49 Å²	49	66.5 Å²	66.5	23%	0.227	35%	0.35	C	S	.	.			trans	-53.4	147.5	173.5	-173.6	-38.4	0	0	0	109.6	E931 D935 G936 R938 E940	E931-H933 PolarHBondContact O-N 2.83Å; H933-D935 IonicContact CG-OD1 2.67Å; H933-D935 PolarHBondContact ND1-N 3.44Å; H933-D935 PolarHBondContact O-N 2.9Å; H933-G936 PolarHBondContact O-N 3.32Å; H933-R938 HydrophobicContact CB-CB 3.93Å; H933-R938 VanDerWaalsContact CB-O 3.25Å; H933-R938 WeakPolarHBondContact CB-O 3.29Å; H933-R938 PolarHBondContact CD2-NH1 2.87Å; H933-R938 PolarHBondContact CD2-NH2 2.59Å; H933-R938 VanDerWaalsContact CD2-NH2 3.27Å; H933-R938 PolarHBondContact CE1-NH2 2.93Å; H933-R938 PolarHBondContact N-O 3.48Å; H933-R938 VanDerWaalsContact NE2-CZ 3.28Å; H933-R938 PolarHBondContact NE2-NH1 3.02Å; H933-R938 PolarHBondContact NE2-NH2 3.04Å; H933-E940 HydrophobicContact CB-CG 4.24Å; H933-E940 IonicContact CD2-OE1 3.44Å; H933-E940 PolarHBondContact CD2-OE1 2.89Å; H933-E940 IonicContact CG-OE1 2.6Å; H933-E940 IonicContact NE2-OE1 2.66Å
934	A	76.1	Confident	80.7	Confident	109 Å²	109	63.6 Å²	63.6	90%	0.901	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.5	-1	172.9	0	0	0	0	0	116.9
935	D	86.3	Confident	80.6	Confident	65 Å²	65	63.8 Å²	63.8	35%	0.348	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.2	-3.5	168.7	75.9	-3.4	0	0	0	113.7	H933 K937 R938	H933-D935 IonicContact CG-OD1 2.67Å; H933-D935 PolarHBondContact ND1-N 3.44Å; H933-D935 PolarHBondContact O-N 2.9Å; D935-K937 VanDerWaalsContact C-N 3.26Å; D935-K937 PolarHBondContact O-N 2.83Å; D935-K937 PolarHBondContact OD1-N 2.88Å; D935-R938 PolarHBondContact OD1-N 2.04Å; D935-R938 IonicContact OD2-CZ 2.69Å; D935-R938 IonicContact OD2-NE 2.66Å; D935-R938 PolarHBondContact OD2-NE 2.98Å; D935-R938 IonicContact OD2-NH2 3.66Å; D935-R938 PolarHBondContact OD2-NH2 3.33Å
936	G	82.6	Confident	80.6	Confident	33 Å²	33	62.9 Å²	62.9	34%	0.34	35%	0.353	S	S	.	.	S	Bend	trans	72.4	11.6	179.5	0	0	0	0	0	114.8	C924 H933	C924-G936 WeakPolarHBondContact CB-O 3.5Å; C924-G936 PolarHBondContact SG-O 3.45Å; H933-G936 PolarHBondContact O-N 3.32Å
937	K	87.2	Confident	80.9	Confident	75 Å²	75	63.4 Å²	63.4	33%	0.326	35%	0.354	S	S	.	.	S	Bend	trans	-137	-42	-170.2	-70.2	-170	171.7	-132.4	0	114.9	H909 S912 Y922 D935	H909-K937 PolarHBondContact O-NZ 3.43Å; S912-K937 PolarHBondContact N-O 2.72Å; S912-K937 PolarHBondContact OG-O 2.67Å; Y922-K937 PolarHBondContact OH-NZ 3.29Å; D935-K937 VanDerWaalsContact C-N 3.26Å; D935-K937 PolarHBondContact O-N 2.83Å; D935-K937 PolarHBondContact OD1-N 2.88Å
938	R	85.2	Confident	81.2	Confident	124 Å²	124	63.9 Å²	63.9	47%	0.468	36%	0.36	S	S	.	.			trans	-85.2	153	176.5	-77	178.3	-69.3	124.8	9	110.9	S912 H933 D935	S912-R938 VanDerWaalsContact OG-CA 3.32Å; S912-R938 WeakPolarHBondContact OG-CA 3.12Å; H933-R938 HydrophobicContact CB-CB 3.93Å; H933-R938 VanDerWaalsContact CB-O 3.25Å; H933-R938 WeakPolarHBondContact CB-O 3.29Å; H933-R938 PolarHBondContact CD2-NH1 2.87Å; H933-R938 PolarHBondContact CD2-NH2 2.59Å; H933-R938 VanDerWaalsContact CD2-NH2 3.27Å; H933-R938 PolarHBondContact CE1-NH2 2.93Å; H933-R938 PolarHBondContact N-O 3.48Å; H933-R938 VanDerWaalsContact NE2-CZ 3.28Å; H933-R938 PolarHBondContact NE2-NH1 3.02Å; H933-R938 PolarHBondContact NE2-NH2 3.04Å; D935-R938 PolarHBondContact OD1-N 2.04Å; D935-R938 IonicContact OD2-CZ 2.69Å; D935-R938 IonicContact OD2-NE 2.66Å; D935-R938 PolarHBondContact OD2-NE 2.98Å; D935-R938 IonicContact OD2-NH2 3.66Å; D935-R938 PolarHBondContact OD2-NH2 3.33Å
939	C	83.8	Confident	81.6	Confident	22 Å²	22	66.6 Å²	66.6	15%	0.149	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	136	176.8	-66.9	0	0	0	0	108.3	S912 H913 C926 E931	S912-C939 PolarHBondContact OG-N 2.74Å; S912-C939 PolarHBondContact OG-SG 2.65Å; H913-C939 WeakPolarHBondContact ND1-CB 3.37Å; H913-C939 PolarHBondContact ND1-SG 2.69Å; H913-C939 VanDerWaalsContact ND1-SG 3.44Å; C926-C939 WeakPolarHBondContact CA-SG 3.29Å; C926-C939 HydrophobicContact CB-CB 3.88Å; C926-C939 WeakPolarHBondContact CB-SG 3.26Å; C926-C939 WeakPolarHBondContact SG-CB 3.34Å; C926-C939 CovalentContact SG-SG 2.04Å; C926-C939 PolarHBondContact SG-SG 3.36Å; E931-C939 CarbonylContact O-C 3.51Å; E931-C939 VanDerWaalsContact O-CA 3.32Å; E931-C939 WeakPolarHBondContact O-CA 3.1Å
940	E	80.8	Confident	82	Confident	90 Å²	90	69 Å²	69	42%	0.421	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	151.6	-178.8	-60.6	-171	159.8	0	0	109.9	Y930 E931 H933 A942	Y930-E940 CarbonylContact C-O 3.55Å; Y930-E940 VanDerWaalsContact CA-O 3.22Å; Y930-E940 WeakPolarHBondContact CA-O 3.38Å; Y930-E940 WeakPolarHBondContact CB-O 3.26Å; E931-E940 PolarHBondContact N-O 2.95Å; E931-E940 PolarHBondContact O-N 3.45Å; H933-E940 HydrophobicContact CB-CG 4.24Å; H933-E940 IonicContact CD2-OE1 3.44Å; H933-E940 PolarHBondContact CD2-OE1 2.89Å; H933-E940 IonicContact CG-OE1 2.6Å; H933-E940 IonicContact NE2-OE1 2.66Å; E940-A942 PolarHBondContact O-N 3.33Å
941	D	72	Confident	82.3	Confident	134 Å²	134	69.3 Å²	69.3	72%	0.717	40%	0.395	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-57.5	123.5	-178.6	-71.8	-53.4	0	0	0	111.1	Y930	Y930-D941 WeakPolarHBondContact CE1-OD1 3.29Å
942	A	69.9	Low	83	Confident	27 Å²	27	67.4 Å²	67.4	22%	0.223	39%	0.391	C	S	.	.			trans	-115.9	175.7	-179.4	0	0	0	0	0	112.1	G929 E931 E940	G929-A942 CarbonylContact O-C 3.52Å; G929-A942 WeakPolarHBondContact O-CA 3.44Å; G929-A942 WeakPolarHBondContact O-CB 3.36Å; G929-A942 PolarHBondContact O-N 2.85Å; E931-A942 HydrophobicContact CB-CB 3.82Å; E931-A942 HydrophobicContact CG-CB 3.97Å; E940-A942 PolarHBondContact O-N 3.33Å
943	C	82.2	Confident	83.6	Confident	26 Å²	26	67.6 Å²	67.6	18%	0.176	40%	0.395	C	S	.	.	S	Bend	trans	-73.6	135.5	165.4	46.5	0	0	0	0	110.1	P957 C969 I970	C943-P957 HydrophobicContact CB-CG 3.65Å; C943-C969 HydrophobicContact CB-CB 3.67Å; C943-C969 WeakPolarHBondContact CB-SG 3.36Å; C943-C969 WeakPolarHBondContact O-CA 3.4Å; C943-C969 WeakPolarHBondContact O-CB 3.43Å; C943-C969 VanDerWaalsContact SG-CA 3.57Å; C943-C969 WeakPolarHBondContact SG-CB 3.24Å; C943-C969 CovalentContact SG-SG 2.02Å; C943-C969 PolarHBondContact SG-SG 3.26Å; C943-I970 PolarHBondContact O-N 3.03Å
944	G	83.8	Confident	84.2	Confident	28 Å²	28	65.4 Å²	65.4	29%	0.289	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	136.6	-145.1	-177.1	0	0	0	0	0	112.4	I970	G944-I970 CarbonylContact C-O 3.59Å; G944-I970 WeakPolarHBondContact CA-O 3.29Å
945	G	85.7	Confident	85	Confident	15 Å²	15	64.5 Å²	64.5	16%	0.155	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	118.7	168.4	172.3	0	0	0	0	0	113.8	I970 W971 K972	G945-I970 PolarHBondContact N-O 2.83Å; G945-W971 VanDerWaalsContact O-CA 3.3Å; G945-W971 WeakPolarHBondContact O-CA 3.1Å; G945-K972 PolarHBondContact O-N 2.89Å
946	V	87.5	Confident	85.3	Confident	82 Å²	82	61.4 Å²	61.4	50%	0.497	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	123	171.4	-175.3	0	0	0	0	108.9	I928 K972 L974	I928-V946 HydrophobicContact CB-CG2 4.19Å; I928-V946 HydrophobicContact CG2-CG2 4.36Å; V946-K972 CarbonylContact C-O 3.53Å; V946-K972 WeakPolarHBondContact CA-O 3.31Å; V946-K972 HydrophobicContact CG2-CB 4.47Å; V946-L974 HydrophobicContact CG1-CD1 3.49Å; V946-L974 VanDerWaalsContact CG1-CD1 3.49Å; V946-L974 HydrophobicContact CG1-CG 3.84Å
947	I	89.2	Confident	85.4	Confident	33 Å²	33	61.2 Å²	61.2	17%	0.169	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	118.4	178.7	-52.5	171	0	0	0	107.9	E949 I954 K972 I973 L974 F1053	I947-E949 HydrophobicContact CG2-CB 4.18Å; I947-E949 HydrophobicContact CG2-CG 4.18Å; I947-I954 HydrophobicContact CD1-CG2 3.57Å; I947-K972 PolarHBondContact N-O 3.17Å; I947-I973 HydrophobicContact CD1-CG1 4.5Å; I947-I973 CarbonylContact O-C 3.59Å; I947-I973 WeakPolarHBondContact O-CA 2.95Å; I947-L974 PolarHBondContact O-N 2.93Å; I947-F1053 HydrophobicContact CD1-CE1 4.32Å; I947-F1053 HydrophobicContact CG2-CE1 4.33Å; I947-F1053 HydrophobicContact CG2-CZ 3.71Å
948	N	89.9	Confident	85.3	Confident	125 Å²	125	63.1 Å²	63.1	67%	0.668	35%	0.352	S	S	*	.			trans	-117.2	60.6	-176.7	-168.2	21.2	0	0	0	109.9	L974	N948-L974 HydrophobicContact CB-CB 4.44Å; N948-L974 PolarHBondContact OD1-O 2.88Å
949	E	83.8	Confident	85.4	Confident	117 Å²	117	59 Å²	59	55%	0.547	34%	0.337	S	S	.	.			trans	-131.7	146.5	-174.9	-62.1	-172.5	141.7	0	0	109.8	I947 N951	I947-E949 HydrophobicContact CG2-CB 4.18Å; I947-E949 HydrophobicContact CG2-CG 4.18Å; E949-N951 PolarHBondContact O-N 3.25Å
950	S	80.8	Confident	85.6	Confident	64 Å²	64	62.2 Å²	62.2	45%	0.448	36%	0.357	S	S	.	.	S	Bend	trans	-72	-13.5	178.9	49.4	0	0	0	0	114	F1054 T1055	S950-F1054 CarbonylContact O-C 3.57Å; S950-F1054 WeakPolarHBondContact O-CA 3.3Å; S950-T1055 WeakPolarHBondContact CB-OG1 3.46Å; S950-T1055 PolarHBondContact O-N 3.49Å; S950-T1055 PolarHBondContact O-OG1 3.38Å; S950-T1055 VanDerWaalsContact O-OG1 3.12Å
951	N	88.4	Confident	86	Confident	103 Å²	103	63.5 Å²	63.5	55%	0.551	37%	0.367	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-163.1	152.2	174.8	52.9	-11.4	0	0	0	110.2	E949 F1053 F1054	E949-N951 PolarHBondContact O-N 3.25Å; N951-F1053 VanDerWaalsContact CA-O 3.26Å; N951-F1053 WeakPolarHBondContact CA-O 3.28Å; N951-F1053 WeakPolarHBondContact CB-O 2.93Å; N951-F1054 HydrophobicContact CB-CB 3.93Å
952	G	90.1	Very high	86.8	Confident	18 Å²	18	61.3 Å²	61.3	19%	0.186	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-178.4	-168.5	-176.8	0	0	0	0	0	113.4	V1052 F1053	G952-V1052 WeakPolarHBondContact O-CA 3.46Å; G952-V1052 VanDerWaalsContact O-CG1 3.32Å; G952-V1052 WeakPolarHBondContact O-CG1 3.04Å; G952-F1053 VanDerWaalsContact C-CE1 3.43Å; G952-F1053 VanDerWaalsContact CA-CE1 3.44Å; G952-F1053 PolarHBondContact N-O 2.71Å; G952-F1053 PolarHBondContact O-N 3.28Å
953	T	91.3	Very high	87.8	Confident	81 Å²	81	60.1 Å²	60.1	50%	0.497	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	131.3	179.4	-54.8	0	0	0	0	109.9	R1050 A1051 V1052	T953-R1050 HydrophobicContact CG2-CG 3.6Å; T953-A1051 CarbonylContact C-O 3.58Å; T953-A1051 WeakPolarHBondContact CA-O 3.41Å; T953-A1051 WeakPolarHBondContact CG2-O 3.2Å; T953-V1052 HydrophobicContact CG2-CG2 4.49Å
954	I	92.6	Very high	88.1	Confident	3 Å²	3	60.6 Å²	60.6	2%	0.015	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	149	171.7	61.1	172.6	0	0	0	109.8	I947 W971 L983 I1036 F1049 R1050 A1051 F1053	I947-I954 HydrophobicContact CD1-CG2 3.57Å; I954-W971 HydrophobicContact CG2-CG 4.17Å; I954-L983 HydrophobicContact CD1-CD1 4.12Å; I954-I1036 HydrophobicContact CD1-CD1 3.45Å; I954-I1036 VanDerWaalsContact CD1-CD1 3.45Å; I954-I1036 HydrophobicContact CD1-CG2 4.22Å; I954-F1049 HydrophobicContact CD1-CE2 4.31Å; I954-F1049 HydrophobicContact CG1-CE2 4.28Å; I954-R1050 CarbonylContact O-C 3.56Å; I954-R1050 WeakPolarHBondContact O-CA 3.16Å; I954-A1051 HydrophobicContact CD1-CB 4.35Å; I954-A1051 HydrophobicContact CG1-CB 3.91Å; I954-A1051 PolarHBondContact N-O 2.87Å; I954-A1051 PolarHBondContact O-N 3.45Å; I954-F1053 HydrophobicContact CG2-CD1 4.49Å; I954-F1053 HydrophobicContact CG2-CE1 4.36Å
955	Q	92.3	Very high	88.2	Confident	89 Å²	89	61.9 Å²	61.9	42%	0.416	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	156.6	-179.6	62.7	-173	20.6	0	0	111.2	F959 W971 F1049 R1050	Q955-F959 HydrophobicContact CB-CB 4.01Å; Q955-F959 HydrophobicContact CB-CD1 4.43Å; Q955-F959 HydrophobicContact CB-CG 4.22Å; Q955-F959 HydrophobicContact CG-CB 4.2Å; Q955-W971 VanDerWaalsContact O-CZ2 3.32Å; Q955-W971 WeakPolarHBondContact O-CZ2 3.24Å; Q955-F1049 VanDerWaalsContact CA-O 3.25Å; Q955-F1049 WeakPolarHBondContact CA-O 3.24Å; Q955-R1050 HydrophobicContact CB-CB 4.19Å; Q955-R1050 HydrophobicContact CB-CG 4.07Å
956	T	91.3	Very high	88.2	Confident	1 Å²	1	68.2 Å²	68.2	1%	0.006	37%	0.374	C	S	.	.			trans	-59.2	155	169.7	41.7	0	0	0	0	111.7	F959 Y963 F1038 G1048 F1049	T956-F959 WeakPolarHBondContact O-CB 3.22Å; T956-F959 PolarHBondContact O-N 3.35Å; T956-Y963 HydrophobicContact CG2-CD1 4.35Å; T956-F1038 HydrophobicContact CG2-CD1 4.07Å; T956-F1038 HydrophobicContact CG2-CE1 3.85Å; T956-F1038 HydrophobicContact CG2-CE2 4.47Å; T956-F1038 HydrophobicContact CG2-CG 4.46Å; T956-F1038 HydrophobicContact CG2-CZ 4.07Å; T956-G1048 WeakPolarHBondContact OG1-CA 3.25Å; T956-F1049 HydrophobicContact CG2-CD1 3.45Å; T956-F1049 VanDerWaalsContact CG2-CD1 3.45Å; T956-F1049 HydrophobicContact CG2-CE1 3.44Å; T956-F1049 VanDerWaalsContact CG2-CE1 3.44Å; T956-F1049 HydrophobicContact CG2-CG 4.15Å; T956-F1049 HydrophobicContact CG2-CZ 4.16Å; T956-F1049 PolarHBondContact N-O 2.94Å; T956-F1049 PolarHBondContact OG1-N 3.1Å; T956-F1049 PolarHBondContact OG1-O 3.14Å
957	P	86.5	Confident	88	Confident	29 Å²	29	66.5 Å²	66.5	19%	0.188	36%	0.36	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.7	145.2	172.4	-13.8	27	0	0	0	109.9	C943 F959 P964	C943-P957 HydrophobicContact CB-CG 3.65Å; P957-F959 PolarHBondContact O-N 3.14Å; P957-F959 VanDerWaalsContact O-N 3.13Å; P957-P964 HydrophobicContact CB-CG 4.2Å
958	L	84.4	Confident	87.9	Confident	115 Å²	115	67.5 Å²	67.5	60%	0.602	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.9	0	-179.1	-50.4	175.1	0	0	0	116.5	D961 P964	L958-D961 HydrophobicContact CB-CB 4.29Å; L958-D961 WeakPolarHBondContact O-CA 3.16Å; L958-D961 WeakPolarHBondContact O-CB 3.37Å; L958-D961 PolarHBondContact O-N 3.45Å; L958-P964 HydrophobicContact CD1-CG 4.12Å
959	F	87.3	Confident	87.9	Confident	38 Å²	38	61.6 Å²	61.6	17%	0.167	33%	0.334	C	S	.	.	T	Hydrogen-bonded Turn	trans	-48.8	128.4	179.3	-177.3	-89.5	0	0	0	112.3	Q955 T956 P957 H987 T1047 R1050	Q955-F959 HydrophobicContact CB-CB 4.01Å; Q955-F959 HydrophobicContact CB-CD1 4.43Å; Q955-F959 HydrophobicContact CB-CG 4.22Å; Q955-F959 HydrophobicContact CG-CB 4.2Å; T956-F959 WeakPolarHBondContact O-CB 3.22Å; T956-F959 PolarHBondContact O-N 3.35Å; P957-F959 PolarHBondContact O-N 3.14Å; P957-F959 VanDerWaalsContact O-N 3.13Å; F959-H987 HydrophobicContact CE2-CB 4.13Å; F959-H987 AromaticContact CE2-CD2 3.56Å; F959-H987 AromaticContact CE2-CG 3.86Å; F959-H987 HydrophobicContact CZ-CB 4.1Å; F959-T1047 VanDerWaalsContact CD2-O 3.3Å; F959-T1047 WeakPolarHBondContact CD2-O 3.32Å; F959-R1050 HydrophobicContact CD1-CB 4.24Å; F959-R1050 HydrophobicContact CE1-CB 3.91Å; F959-R1050 HydrophobicContact CE1-CG 4.39Å; F959-R1050 HydrophobicContact CE2-CB 4.21Å; F959-R1050 HydrophobicContact CZ-CB 3.9Å
960	P	88.4	Confident	88.1	Confident	88 Å²	88	59 Å²	59	57%	0.571	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	cis	-91.7	5	14.1	38.1	-38.3	0	0	0	116.3
961	D	88.4	Confident	88.5	Confident	117 Å²	117	56.8 Å²	56.8	63%	0.626	31%	0.305	S	S	*	.	S	Bend	trans	-70.9	177.2	172.3	-65.7	-45.4	0	0	0	111.1	L958	L958-D961 HydrophobicContact CB-CB 4.29Å; L958-D961 WeakPolarHBondContact O-CA 3.16Å; L958-D961 WeakPolarHBondContact O-CB 3.37Å; L958-D961 PolarHBondContact O-N 3.45Å
962	L	89.3	Confident	88.6	Confident	88 Å²	88	53 Å²	53	46%	0.461	28%	0.284	S	S	.	.	P	Polyproline II helix	trans	-66.9	135.3	-178.9	-56	177.7	0	0	0	111.4	Q1045 R1046 T1047	L962-Q1045 HydrophobicContact CB-CB 4.15Å; L962-R1046 VanDerWaalsContact CA-O 3.29Å; L962-R1046 WeakPolarHBondContact CA-O 3.43Å; L962-R1046 VanDerWaalsContact CD2-C 3.44Å; L962-T1047 HydrophobicContact CD2-CG2 4.12Å
963	Y	91.3	Very high	88.6	Confident	2 Å²	2	52.2 Å²	52.2	1%	0.008	28%	0.275	C	S	.	.	P	Polyproline II helix	trans	-66.7	154.3	173.6	51.2	-99.4	0	0	0	111.7	T956 L990 E991 D1000 F1038 Q1045 R1046 G1048	T956-Y963 HydrophobicContact CG2-CD1 4.35Å; Y963-L990 HydrophobicContact CD1-CD2 4.27Å; Y963-L990 HydrophobicContact CE1-CD2 3.55Å; Y963-E991 PolarHBondContact OH-N 3.41Å; Y963-D1000 WeakPolarHBondContact CE2-OD2 3.03Å; Y963-D1000 PolarHBondContact OH-OD2 3.06Å; Y963-F1038 HydrophobicContact CD1-CZ 4.17Å; Y963-F1038 HydrophobicContact CD2-CE1 4.4Å; Y963-F1038 AromaticContact CD2-CZ 3.84Å; Y963-F1038 HydrophobicContact CD2-CZ 3.84Å; Y963-F1038 HydrophobicContact CE1-CZ 4.4Å; Y963-F1038 HydrophobicContact CE2-CZ 4.08Å; Y963-F1038 HydrophobicContact CG-CE1 4.3Å; Y963-F1038 AromaticContact CG-CZ 3.89Å; Y963-F1038 HydrophobicContact CG-CZ 3.89Å; Y963-Q1045 HydrophobicContact CD2-CB 4.18Å; Y963-Q1045 HydrophobicContact CD2-CG 4.47Å; Y963-Q1045 HydrophobicContact CE2-CB 4.08Å; Y963-Q1045 HydrophobicContact CE2-CG 4.48Å; Y963-Q1045 VanDerWaalsContact O-CB 3.29Å; Y963-Q1045 WeakPolarHBondContact O-CB 3.37Å; Y963-Q1045 VanDerWaalsContact O-CG 3.26Å; Y963-Q1045 WeakPolarHBondContact O-CG 3.33Å; Y963-R1046 WeakPolarHBondContact CD1-O 3.45Å; Y963-R1046 VanDerWaalsContact CE1-C 3.47Å; Y963-R1046 HydrophobicContact CE1-CB 3.83Å; Y963-R1046 WeakPolarHBondContact CE1-O 3.39Å; Y963-R1046 PolarHBondContact N-O 3.15Å; Y963-R1046 VanDerWaalsContact N-O 3.17Å; Y963-R1046 PolarHBondContact OH-N 3.49Å; Y963-G1048 VanDerWaalsContact CD1-CA 3.45Å
964	P	87	Confident	88.6	Confident	36 Å²	36	50.1 Å²	50.1	23%	0.234	26%	0.261	C	S	.	.	P	Polyproline II helix	trans	-69.8	146.8	174.4	-15	28.8	0	0	0	112	P957 L958 K967 S1040	P957-P964 HydrophobicContact CB-CG 4.2Å; L958-P964 HydrophobicContact CD1-CG 4.12Å; P964-K967 HydrophobicContact CB-CG 3.94Å; P964-K967 HydrophobicContact CG-CG 4.34Å; P964-S1040 PolarHBondContact O-OG 3.42Å
965	P	87.2	Confident	88.3	Confident	55 Å²	55	50.2 Å²	50.2	36%	0.357	26%	0.262	S	S	.	.	S	Bend	trans	-69.9	158.4	169.6	31	-34.1	0	0	0	111.4	K967 D1041 Q1045	P965-K967 PolarHBondContact O-N 3.4Å; P965-D1041 CarbonylContact C-O 3.19Å; P965-D1041 WeakPolarHBondContact CA-O 3.46Å; P965-D1041 WeakPolarHBondContact CB-O 3.09Å; P965-Q1045 HydrophobicContact CB-CG 4.24Å; P965-Q1045 HydrophobicContact CG-CG 4.47Å
966	K	84.8	Confident	87.8	Confident	149 Å²	149	49.1 Å²	49.1	65%	0.648	26%	0.263	S	S	*	.	S	Bend	trans	55.2	43.2	175.8	-151.8	-172.6	-179.4	-177.1	0	114	S1040 D1041 T1042	K966-S1040 WeakPolarHBondContact CA-O 3.08Å; K966-S1040 PolarHBondContact N-O 2.98Å; K966-S1040 PolarHBondContact N-OG 3.22Å; K966-D1041 PolarHBondContact N-O 3.21Å; K966-T1042 HydrophobicContact CB-CG2 4.29Å; K966-T1042 HydrophobicContact CD-CG2 4.06Å; K966-T1042 HydrophobicContact CG-CG2 4.27Å
967	K	84.6	Confident	87.2	Confident	45 Å²	45	54.2 Å²	54.2	20%	0.196	30%	0.296	C	S	.	.			trans	-107.1	138.5	174.9	-76.6	-75.3	159.8	-176.5	0	110.8	E931 P964 P965 Y1039 S1040	E931-K967 IonicContact OE1-NZ 3.19Å; E931-K967 PolarHBondContact OE1-NZ 2.94Å; E931-K967 IonicContact OE2-NZ 2.62Å; E931-K967 PolarHBondContact OE2-NZ 2.85Å; P964-K967 HydrophobicContact CB-CG 3.94Å; P964-K967 HydrophobicContact CG-CG 4.34Å; P965-K967 PolarHBondContact O-N 3.4Å; K967-Y1039 CarbonylContact O-C 3.43Å; K967-Y1039 WeakPolarHBondContact O-CA 3.27Å; K967-S1040 PolarHBondContact N-OG 3.01Å; K967-S1040 PolarHBondContact O-N 3.34Å
968	N	86.8	Confident	86.8	Confident	55 Å²	55	58.9 Å²	58.9	29%	0.294	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	112.1	160.1	-172.2	-21.4	0	0	0	107.6	I970 E1037 F1038 Y1039	N968-I970 VanDerWaalsContact OD1-CG1 3.29Å; N968-I970 WeakPolarHBondContact OD1-CG1 3.46Å; N968-E1037 PolarHBondContact ND2-OE1 3.32Å; N968-E1037 WeakPolarHBondContact OD1-CG 3.07Å; N968-F1038 CarbonylContact C-O 3.47Å; N968-F1038 VanDerWaalsContact CA-O 3.32Å; N968-F1038 WeakPolarHBondContact CA-O 3.06Å; N968-Y1039 HydrophobicContact CB-CD2 4.28Å
969	C	88.6	Confident	86.8	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	120.6	177.3	-49.3	0	0	0	0	110	C943 W971 E1037 F1038	C943-C969 HydrophobicContact CB-CB 3.67Å; C943-C969 WeakPolarHBondContact CB-SG 3.36Å; C943-C969 WeakPolarHBondContact O-CA 3.4Å; C943-C969 WeakPolarHBondContact O-CB 3.43Å; C943-C969 VanDerWaalsContact SG-CA 3.57Å; C943-C969 WeakPolarHBondContact SG-CB 3.24Å; C943-C969 CovalentContact SG-SG 2.02Å; C943-C969 PolarHBondContact SG-SG 3.26Å; C969-W971 HydrophobicContact CB-CE3 4.4Å; C969-W971 HydrophobicContact CB-CH2 3.41Å; C969-W971 VanDerWaalsContact CB-CH2 3.41Å; C969-W971 HydrophobicContact CB-CZ2 4.02Å; C969-W971 HydrophobicContact CB-CZ3 3.62Å; C969-W971 WeakPolarHBondContact O-CZ3 3.29Å; C969-E1037 CarbonylContact O-C 3.31Å; C969-E1037 WeakPolarHBondContact O-CA 3.4Å; C969-F1038 HydrophobicContact CB-CB 4.28Å; C969-F1038 HydrophobicContact CB-CD1 4.26Å; C969-F1038 PolarHBondContact N-O 3.13Å; C969-F1038 PolarHBondContact O-N 2.96Å
970	I	88.7	Confident	86.8	Confident	64 Å²	64	53.8 Å²	53.8	33%	0.328	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	118.9	-177.7	-52.5	179.4	0	0	0	110.4	I928 C943 G944 G945 N968 I1036 E1037	I928-I970 HydrophobicContact CG2-CB 4.31Å; I928-I970 HydrophobicContact CG2-CG2 4.01Å; I928-I970 VanDerWaalsContact CG2-O 3.23Å; I928-I970 WeakPolarHBondContact CG2-O 3.48Å; C943-I970 PolarHBondContact O-N 3.03Å; G944-I970 CarbonylContact C-O 3.59Å; G944-I970 WeakPolarHBondContact CA-O 3.29Å; G945-I970 PolarHBondContact N-O 2.83Å; N968-I970 VanDerWaalsContact OD1-CG1 3.29Å; N968-I970 WeakPolarHBondContact OD1-CG1 3.46Å; I970-I1036 WeakPolarHBondContact CA-O 3.43Å; I970-E1037 HydrophobicContact CG1-CB 4.43Å; I970-E1037 HydrophobicContact CG1-CG 4.29Å
971	W	90	Very high	86.8	Confident	17 Å²	17	49.6 Å²	49.6	6%	0.064	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	137.9	170.7	-60	-89.7	0	0	0	110.5	G945 I954 Q955 C969 S1035 I1036 F1038 F1049	G945-W971 VanDerWaalsContact O-CA 3.3Å; G945-W971 WeakPolarHBondContact O-CA 3.1Å; I954-W971 HydrophobicContact CG2-CG 4.17Å; Q955-W971 VanDerWaalsContact O-CZ2 3.32Å; Q955-W971 WeakPolarHBondContact O-CZ2 3.24Å; C969-W971 HydrophobicContact CB-CE3 4.4Å; C969-W971 HydrophobicContact CB-CH2 3.41Å; C969-W971 VanDerWaalsContact CB-CH2 3.41Å; C969-W971 HydrophobicContact CB-CZ2 4.02Å; C969-W971 HydrophobicContact CB-CZ3 3.62Å; C969-W971 WeakPolarHBondContact O-CZ3 3.29Å; W971-S1035 WeakPolarHBondContact O-CA 3.32Å; W971-I1036 HydrophobicContact CB-CB 4.48Å; W971-I1036 HydrophobicContact CE3-CB 4.49Å; W971-I1036 HydrophobicContact CE3-CG2 4.2Å; W971-I1036 PolarHBondContact N-O 3.43Å; W971-I1036 PolarHBondContact O-N 2.85Å; W971-F1038 HydrophobicContact CH2-CB 4.32Å; W971-F1038 HydrophobicContact CZ3-CB 3.82Å; W971-F1049 AromaticContact CH2-CZ 3.79Å; W971-F1049 HydrophobicContact CH2-CZ 3.79Å; W971-F1049 AromaticContact CZ3-CZ 3.76Å; W971-F1049 HydrophobicContact CZ3-CZ 3.76Å
972	K	89.8	Confident	86.8	Confident	24 Å²	24	45.3 Å²	45.3	10%	0.104	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	109.4	166	-166.4	-177.5	-169.5	-160.1	0	109.3	I928 G945 V946 I947 L974 E1033	I928-K972 HydrophobicContact CD1-CB 3.92Å; I928-K972 HydrophobicContact CD1-CD 4.11Å; I928-K972 HydrophobicContact CG2-CB 4.43Å; G945-K972 PolarHBondContact O-N 2.89Å; V946-K972 CarbonylContact C-O 3.53Å; V946-K972 WeakPolarHBondContact CA-O 3.31Å; V946-K972 HydrophobicContact CG2-CB 4.47Å; I947-K972 PolarHBondContact N-O 3.17Å; K972-L974 HydrophobicContact CD-CD2 3.87Å; K972-L974 HydrophobicContact CG-CD2 3.99Å; K972-E1033 VanDerWaalsContact CE-CD 3.46Å; K972-E1033 WeakPolarHBondContact CE-OE2 3.37Å; K972-E1033 IonicContact NZ-OE1 4Å; K972-E1033 PolarHBondContact NZ-OE1 2.89Å; K972-E1033 IonicContact NZ-OE2 2.73Å; K972-E1033 PolarHBondContact NZ-OE2 2.68Å
973	I	90.9	Very high	86.9	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	121.8	174.7	-57.7	167.8	0	0	0	107.5	I947 I981 E1033 L1034 I1036 F1053	I947-I973 HydrophobicContact CD1-CG1 4.5Å; I947-I973 CarbonylContact O-C 3.59Å; I947-I973 WeakPolarHBondContact O-CA 2.95Å; I973-I981 HydrophobicContact CB-CD1 4.21Å; I973-I981 HydrophobicContact CG2-CD1 3.83Å; I973-I981 HydrophobicContact CG2-CG1 4.32Å; I973-I981 HydrophobicContact CG2-CG2 4.12Å; I973-E1033 WeakPolarHBondContact O-CA 3.33Å; I973-L1034 HydrophobicContact CB-CB 4.45Å; I973-L1034 HydrophobicContact CD1-CD2 4.48Å; I973-L1034 PolarHBondContact N-O 2.04Å; I973-L1034 PolarHBondContact O-N 3.24Å; I973-I1036 HydrophobicContact CD1-CD1 3.85Å; I973-F1053 HydrophobicContact CD1-CB 4.22Å; I973-F1053 HydrophobicContact CD1-CD1 3.69Å; I973-F1053 HydrophobicContact CD1-CD2 4.16Å; I973-F1053 HydrophobicContact CD1-CE1 4.08Å; I973-F1053 HydrophobicContact CD1-CG 3.75Å; I973-F1053 HydrophobicContact CD1-CZ 4.49Å; I973-F1053 HydrophobicContact CG1-CE1 4.42Å; I973-F1053 HydrophobicContact CG2-CD2 3.91Å; I973-F1053 HydrophobicContact CG2-CE2 3.73Å; I973-F1053 HydrophobicContact CG2-CZ 4.26Å
974	L	89.8	Confident	87	Confident	38 Å²	38	44.1 Å²	44.1	20%	0.199	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	127.3	175	-58.4	-176.4	0	0	0	108.7	V946 I947 N948 K972 E1033	V946-L974 HydrophobicContact CG1-CD1 3.49Å; V946-L974 VanDerWaalsContact CG1-CD1 3.49Å; V946-L974 HydrophobicContact CG1-CG 3.84Å; I947-L974 PolarHBondContact O-N 2.93Å; N948-L974 HydrophobicContact CB-CB 4.44Å; N948-L974 PolarHBondContact OD1-O 2.88Å; K972-L974 HydrophobicContact CD-CD2 3.87Å; K972-L974 HydrophobicContact CG-CD2 3.99Å; L974-E1033 HydrophobicContact CD2-CB 4.38Å; L974-E1033 HydrophobicContact CD2-CG 3.71Å; L974-E1033 WeakPolarHBondContact CD2-OE1 3.24Å
975	A	86.2	Confident	87.3	Confident	5 Å²	5	42.6 Å²	42.6	4%	0.041	22%	0.223	C	C	.	.			trans	-116.8	160.7	177.9	0	0	0	0	0	110.9	T979 I981 N1032 T1055	A975-T979 WeakPolarHBondContact CB-OG1 3.3Å; A975-I981 HydrophobicContact CB-CD1 3.86Å; A975-I981 HydrophobicContact CB-CG1 3.65Å; A975-N1032 HydrophobicContact CB-CB 4.15Å; A975-N1032 WeakPolarHBondContact CB-O 3.31Å; A975-N1032 PolarHBondContact N-O 3.47Å; A975-N1032 WeakPolarHBondContact O-CB 3.24Å; A975-N1032 PolarHBondContact O-ND2 3.14Å; A975-T1055 HydrophobicContact CB-CG2 3.42Å; A975-T1055 VanDerWaalsContact CB-CG2 3.42Å
976	P	83	Confident	87.6	Confident	66 Å²	66	42.9 Å²	42.9	43%	0.429	22%	0.223	S	C	.	.			trans	-56.6	147.2	174.3	-24.9	35.1	0	0	0	112.4	T979 N1032	P976-T979 HydrophobicContact CB-CG2 4.31Å; P976-T979 WeakPolarHBondContact O-CB 3.49Å; P976-T979 PolarHBondContact O-N 3.49Å; P976-T979 PolarHBondContact O-OG1 3.46Å; P976-N1032 WeakPolarHBondContact O-CB 3.47Å
977	P	79.2	Confident	88	Confident	107 Å²	107	38.8 Å²	38.8	70%	0.695	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.7	148.6	175.3	25	-34	0	0	0	111.4	T979	P977-T979 VanDerWaalsContact C-N 3.28Å; P977-T979 PolarHBondContact O-N 2.76Å
978	K	76.1	Confident	88.5	Confident	128 Å²	128	36.9 Å²	36.9	56%	0.557	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	64.6	18.3	-168.9	-52.5	-177	177.1	-179.4	0	115.9	D1062	K978-D1062 IonicContact NZ-OD1 3.68Å; K978-D1062 PolarHBondContact NZ-OD1 2.94Å; K978-D1062 IonicContact NZ-OD2 2.6Å
979	T	84.6	Confident	88.8	Confident	18 Å²	18	35.7 Å²	35.7	11%	0.11	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	153	168.8	67.9	0	0	0	0	111.8	A975 P976 P977 N1032 D1056 R1057	A975-T979 WeakPolarHBondContact CB-OG1 3.3Å; P976-T979 HydrophobicContact CB-CG2 4.31Å; P976-T979 WeakPolarHBondContact O-CB 3.49Å; P976-T979 PolarHBondContact O-N 3.49Å; P976-T979 PolarHBondContact O-OG1 3.46Å; P977-T979 VanDerWaalsContact C-N 3.28Å; P977-T979 PolarHBondContact O-N 2.76Å; T979-N1032 VanDerWaalsContact O-CA 3.26Å; T979-N1032 WeakPolarHBondContact O-CA 3.31Å; T979-N1032 VanDerWaalsContact O-CB 3.28Å; T979-N1032 WeakPolarHBondContact O-CB 3.35Å; T979-N1032 PolarHBondContact O-N 3.01Å; T979-D1056 CarbonylContact C-O 3.58Å; T979-D1056 WeakPolarHBondContact CA-O 3.34Å; T979-D1056 WeakPolarHBondContact CB-O 3.3Å; T979-R1057 HydrophobicContact CG2-CB 4.21Å; T979-R1057 HydrophobicContact CG2-CG 4.5Å
980	T	87.1	Confident	89	Confident	27 Å²	27	35.8 Å²	35.8	17%	0.166	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	163.8	167.5	57.4	0	0	0	0	109.5	S1029 T1055 D1056	T980-S1029 WeakPolarHBondContact CB-O 3.29Å; T980-S1029 WeakPolarHBondContact CG2-O 3.44Å; T980-T1055 CarbonylContact O-C 3.47Å; T980-T1055 VanDerWaalsContact O-CA 3.23Å; T980-T1055 WeakPolarHBondContact O-CA 3.39Å; T980-D1056 PolarHBondContact N-O 3.42Å; T980-D1056 PolarHBondContact O-N 2.96Å
981	I	88.9	Confident	89.2	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	119.8	-178	-61.5	158.9	0	0	0	107.6	I973 A975 S1029 L1034 F1053 T1055	I973-I981 HydrophobicContact CB-CD1 4.21Å; I973-I981 HydrophobicContact CG2-CD1 3.83Å; I973-I981 HydrophobicContact CG2-CG1 4.32Å; I973-I981 HydrophobicContact CG2-CG2 4.12Å; A975-I981 HydrophobicContact CB-CD1 3.86Å; A975-I981 HydrophobicContact CB-CG1 3.65Å; I981-S1029 PolarHBondContact N-OG 3.17Å; I981-S1029 PolarHBondContact O-N 3.29Å; I981-L1034 HydrophobicContact CB-CB 4.25Å; I981-L1034 HydrophobicContact CB-CD2 4.43Å; I981-L1034 HydrophobicContact CD1-CB 3.68Å; I981-L1034 HydrophobicContact CG2-CB 4.2Å; I981-L1034 HydrophobicContact CG2-CD2 3.82Å; I981-F1053 HydrophobicContact CG2-CB 4.41Å; I981-F1053 HydrophobicContact CG2-CD2 4.5Å; I981-T1055 HydrophobicContact CG1-CG2 4.44Å
982	F	89.5	Confident	88.6	Confident	28 Å²	28	34.4 Å²	34.4	12%	0.123	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	130.2	173.6	-155	-89.9	0	0	0	109.2	P1026 I1027 T1028 F1053 F1054 I1075	F982-P1026 HydrophobicContact CE1-CB 3.5Å; F982-P1026 VanDerWaalsContact CE1-CB 3.5Å; F982-P1026 HydrophobicContact CZ-CB 3.58Å; F982-I1027 CarbonylContact C-O 3.15Å; F982-I1027 WeakPolarHBondContact CA-O 3.49Å; F982-T1028 HydrophobicContact CD2-CG2 4.01Å; F982-T1028 VanDerWaalsContact CD2-OG1 3.22Å; F982-T1028 WeakPolarHBondContact CD2-OG1 3.26Å; F982-T1028 WeakPolarHBondContact CE2-OG1 3.46Å; F982-F1053 CarbonylContact O-C 3.55Å; F982-F1053 WeakPolarHBondContact O-CA 3.47Å; F982-F1053 WeakPolarHBondContact O-CB 3.35Å; F982-F1054 HydrophobicContact CB-CD2 3.86Å; F982-F1054 HydrophobicContact CB-CE1 4.28Å; F982-F1054 HydrophobicContact CB-CE2 3.37Å; F982-F1054 HydrophobicContact CB-CG 4.48Å; F982-F1054 HydrophobicContact CB-CZ 3.62Å; F982-F1054 AromaticContact CD1-CE1 3.83Å; F982-F1054 HydrophobicContact CD1-CE1 3.83Å; F982-F1054 AromaticContact CD1-CE2 3.97Å; F982-F1054 HydrophobicContact CD1-CE2 3.97Å; F982-F1054 AromaticContact CD1-CZ 3.3Å; F982-F1054 HydrophobicContact CD1-CZ 3.3Å; F982-F1054 HydrophobicContact CE1-CZ 4.09Å; F982-F1054 HydrophobicContact CG-CE1 4.4Å; F982-F1054 AromaticContact CG-CE2 3.76Å; F982-F1054 HydrophobicContact CG-CE2 3.76Å; F982-F1054 AromaticContact CG-CZ 3.61Å; F982-F1054 HydrophobicContact CG-CZ 3.61Å; F982-F1054 PolarHBondContact N-O 2.8Å; F982-F1054 PolarHBondContact O-N 2.86Å; F982-I1075 HydrophobicContact CD2-CD1 3.99Å; F982-I1075 HydrophobicContact CD2-CG1 4.21Å; F982-I1075 HydrophobicContact CE1-CD1 4.1Å; F982-I1075 HydrophobicContact CE2-CD1 3.47Å; F982-I1075 VanDerWaalsContact CE2-CD1 3.47Å; F982-I1075 HydrophobicContact CE2-CG1 4.08Å; F982-I1075 HydrophobicContact CZ-CD1 3.52Å
983	L	91.5	Very high	87.7	Confident	0 Å²	0	40 Å²	40	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	123.3	-176.3	178.8	74	0	0	0	109.7	I954 F985 I1027 L1034 I1036 A1051 F1053	I954-L983 HydrophobicContact CD1-CD1 4.12Å; L983-F985 HydrophobicContact CD2-CE2 4.05Å; L983-F985 HydrophobicContact CD2-CZ 4.14Å; L983-F985 HydrophobicContact CG-CE2 4.41Å; L983-I1027 HydrophobicContact CB-CB 4.35Å; L983-I1027 PolarHBondContact N-O 3.3Å; L983-I1027 PolarHBondContact O-N 3.47Å; L983-L1034 HydrophobicContact CB-CD2 4.1Å; L983-L1034 HydrophobicContact CD2-CD2 4.18Å; L983-I1036 HydrophobicContact CD1-CD1 4.09Å; L983-I1036 HydrophobicContact CD2-CD1 3.65Å; L983-I1036 HydrophobicContact CD2-CG1 4.43Å; L983-A1051 HydrophobicContact CD1-CB 3.69Å; L983-A1051 HydrophobicContact CG-CB 4.3Å; L983-F1053 HydrophobicContact CD1-CB 3.99Å
984	N	92.3	Very high	86.5	Confident	64 Å²	64	42.4 Å²	42.4	34%	0.342	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	123.4	-176.1	-173.6	-0.6	0	0	0	111.3	A1051 V1052	N984-A1051 CarbonylContact O-C 3.44Å; N984-A1051 VanDerWaalsContact O-CA 3.28Å; N984-A1051 WeakPolarHBondContact O-CA 3.3Å; N984-V1052 PolarHBondContact N-O 3Å; N984-V1052 PolarHBondContact O-N 3.28Å
985	F	93.7	Very high	85.3	Confident	5 Å²	5	48.3 Å²	48.3	2%	0.022	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	122.7	-179.7	-70.4	-90.1	0	0	0	111.1	L983 F988 I1002 I1023 P1024 I1027 F1049 A1051	L983-F985 HydrophobicContact CD2-CE2 4.05Å; L983-F985 HydrophobicContact CD2-CZ 4.14Å; L983-F985 HydrophobicContact CG-CE2 4.41Å; F985-F988 AromaticContact CD1-CD2 3.62Å; F985-F988 HydrophobicContact CD1-CD2 3.62Å; F985-F988 HydrophobicContact CD1-CE2 4.12Å; F985-F988 AromaticContact CE1-CD2 3.89Å; F985-F988 HydrophobicContact CE1-CD2 3.89Å; F985-F988 AromaticContact CE1-CE2 3.91Å; F985-F988 HydrophobicContact CE1-CE2 3.91Å; F985-F988 HydrophobicContact CG-CD2 4.26Å; F985-F988 HydrophobicContact CZ-CE2 4.48Å; F985-I1002 HydrophobicContact CE1-CD1 4.06Å; F985-I1002 HydrophobicContact CZ-CD1 4.08Å; F985-I1002 HydrophobicContact CZ-CG2 4.29Å; F985-I1023 HydrophobicContact CB-CG2 3.73Å; F985-I1023 WeakPolarHBondContact O-CG2 3.21Å; F985-P1024 HydrophobicContact CD2-CB 3.88Å; F985-P1024 HydrophobicContact CD2-CG 3.88Å; F985-P1024 HydrophobicContact CE2-CB 4.18Å; F985-P1024 HydrophobicContact CE2-CG 4.1Å; F985-P1024 HydrophobicContact CG-CG 4.27Å; F985-I1027 HydrophobicContact CE2-CD1 4.22Å; F985-F1049 HydrophobicContact CD1-CB 4.22Å; F985-F1049 HydrophobicContact CD1-CD2 4.3Å; F985-F1049 HydrophobicContact CD1-CG 4.46Å; F985-F1049 HydrophobicContact CE1-CB 4.38Å; F985-F1049 AromaticContact CE1-CD2 3.94Å; F985-F1049 HydrophobicContact CE1-CD2 3.94Å; F985-F1049 HydrophobicContact CE1-CG 4.16Å; F985-A1051 HydrophobicContact CD1-CB 3.67Å; F985-A1051 HydrophobicContact CE1-CB 3.85Å; F985-A1051 HydrophobicContact CG-CB 4.08Å; F985-A1051 HydrophobicContact CZ-CB 4.39Å
986	T	92.7	Very high	84.7	Confident	60 Å²	60	51 Å²	51	37%	0.368	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	-13.7	176.7	60.6	0	0	0	0	113.7	R1050 V1052	T986-R1050 PolarHBondContact N-O 2.7Å; T986-R1050 PolarHBondContact OG1-NE 3.31Å; T986-R1050 PolarHBondContact OG1-NH2 3.44Å; T986-R1050 PolarHBondContact OG1-O 2.82Å; T986-V1052 HydrophobicContact CG2-CG2 3.71Å
987	H	94.9	Very high	84.7	Confident	63 Å²	63	48.4 Å²	48.4	29%	0.292	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.2	141.6	171.3	-178.7	88.1	0	0	0	108.1	F959 T1047 G1048 F1049 R1050	F959-H987 HydrophobicContact CE2-CB 4.13Å; F959-H987 AromaticContact CE2-CD2 3.56Å; F959-H987 AromaticContact CE2-CG 3.86Å; F959-H987 HydrophobicContact CZ-CB 4.1Å; H987-T1047 PolarHBondContact NE2-OG1 2.65Å; H987-G1048 PolarHBondContact CD2-O 2.74Å; H987-G1048 VanDerWaalsContact CD2-O 3.32Å; H987-F1049 WeakPolarHBondContact O-CA 3.42Å; H987-F1049 WeakPolarHBondContact O-CB 3.47Å; H987-R1050 PolarHBondContact N-O 3.44Å; H987-R1050 PolarHBondContact O-N 3.18Å
988	F	94.5	Very high	84.8	Confident	6 Å²	6	52.4 Å²	52.4	3%	0.026	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	126.1	178.1	-159	-96.2	0	0	0	110.3	F985 L990 I1002 F1018 G1020 Q1022 I1023 P1024 G1048 F1049	F985-F988 AromaticContact CD1-CD2 3.62Å; F985-F988 HydrophobicContact CD1-CD2 3.62Å; F985-F988 HydrophobicContact CD1-CE2 4.12Å; F985-F988 AromaticContact CE1-CD2 3.89Å; F985-F988 HydrophobicContact CE1-CD2 3.89Å; F985-F988 AromaticContact CE1-CE2 3.91Å; F985-F988 HydrophobicContact CE1-CE2 3.91Å; F985-F988 HydrophobicContact CG-CD2 4.26Å; F985-F988 HydrophobicContact CZ-CE2 4.48Å; F988-L990 HydrophobicContact CE1-CD1 4.27Å; F988-L990 HydrophobicContact CE1-CG 4.27Å; F988-L990 HydrophobicContact CE2-CD1 4.26Å; F988-L990 HydrophobicContact CZ-CD1 3.71Å; F988-L990 HydrophobicContact CZ-CG 4.12Å; F988-I1002 HydrophobicContact CE2-CG2 3.95Å; F988-I1002 HydrophobicContact CZ-CG2 4.11Å; F988-F1018 HydrophobicContact CE1-CB 4.29Å; F988-F1018 HydrophobicContact CE2-CB 4.5Å; F988-F1018 HydrophobicContact CZ-CB 3.76Å; F988-G1020 VanDerWaalsContact CD1-O 3.3Å; F988-G1020 WeakPolarHBondContact CD1-O 3.1Å; F988-Q1022 VanDerWaalsContact CD1-O 3.23Å; F988-Q1022 WeakPolarHBondContact CD1-O 3.42Å; F988-I1023 HydrophobicContact CB-CG1 4.07Å; F988-P1024 HydrophobicContact CD2-CG 4.18Å; F988-P1024 HydrophobicContact CE1-CG 4.48Å; F988-P1024 HydrophobicContact CE2-CG 4.15Å; F988-P1024 HydrophobicContact CG-CG 4.38Å; F988-P1024 HydrophobicContact CZ-CG 4.31Å; F988-G1048 CarbonylContact C-O 3.51Å; F988-F1049 HydrophobicContact CD2-CB 3.64Å; F988-F1049 HydrophobicContact CD2-CG 4.43Å; F988-F1049 HydrophobicContact CE2-CB 4.16Å; F988-F1049 HydrophobicContact CG-CB 4.48Å
989	N	93.4	Very high	85.4	Confident	30 Å²	30	51.3 Å²	51.3	16%	0.16	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-165.7	91.5	-179.3	-177.3	27.5	0	0	0	110.3	G1020 R1046 T1047 G1048	N989-G1020 CarbonylContact C-O 3.42Å; N989-G1020 VanDerWaalsContact CA-O 3.27Å; N989-G1020 WeakPolarHBondContact CA-O 3.36Å; N989-R1046 WeakPolarHBondContact O-CB 3.46Å; N989-R1046 WeakPolarHBondContact OD1-CD 3.2Å; N989-R1046 PolarHBondContact OD1-NH1 2.76Å; N989-T1047 PolarHBondContact ND2-OG1 3.35Å; N989-G1048 PolarHBondContact N-O 2.73Å; N989-G1048 WeakPolarHBondContact O-CA 3.32Å; N989-G1048 PolarHBondContact O-N 3.36Å
990	L	92.8	Very high	85.8	Confident	1 Å²	1	50.5 Å²	50.5	1%	0.005	24%	0.242	C	C	.	.			trans	-115.4	165.7	178	-59.2	-174.5	0	0	0	111.5	Y963 F988 D1000 G1020 F1038	Y963-L990 HydrophobicContact CD1-CD2 4.27Å; Y963-L990 HydrophobicContact CE1-CD2 3.55Å; F988-L990 HydrophobicContact CE1-CD1 4.27Å; F988-L990 HydrophobicContact CE1-CG 4.27Å; F988-L990 HydrophobicContact CE2-CD1 4.26Å; F988-L990 HydrophobicContact CZ-CD1 3.71Å; F988-L990 HydrophobicContact CZ-CG 4.12Å; L990-D1000 HydrophobicContact CB-CB 4.2Å; L990-G1020 PolarHBondContact N-O 2.79Å; L990-G1020 WeakPolarHBondContact O-CA 3.48Å; L990-F1038 HydrophobicContact CD1-CD2 4.2Å; L990-F1038 HydrophobicContact CD1-CE2 3.98Å; L990-F1038 HydrophobicContact CD2-CD2 4.38Å; L990-F1038 HydrophobicContact CD2-CE2 3.58Å; L990-F1038 HydrophobicContact CD2-CZ 4.16Å; L990-F1038 HydrophobicContact CG-CE2 4.43Å
991	E	91.6	Very high	86.1	Confident	40 Å²	40	51.1 Å²	51.1	19%	0.187	24%	0.242	C	C	.	.	S	Bend	trans	-64.2	154.8	165	-177	157.7	-136.9	0	0	111.3	Y963 Y999 D1000 V1044	Y963-E991 PolarHBondContact OH-N 3.41Å; E991-Y999 HydrophobicContact CG-CD2 4.1Å; E991-Y999 HydrophobicContact CG-CG 4.15Å; E991-D1000 HydrophobicContact CB-CB 4.14Å; E991-D1000 WeakPolarHBondContact CB-OD2 3.34Å; E991-V1044 HydrophobicContact CG-CB 4.49Å; E991-V1044 WeakPolarHBondContact OE1-CB 3.18Å; E991-V1044 WeakPolarHBondContact OE1-CG2 3.44Å; E991-V1044 WeakPolarHBondContact OE2-CB 3.35Å; E991-V1044 PolarHBondContact OE2-N 3.16Å
992	G	77.3	Confident	86.3	Confident	13 Å²	13	51.1 Å²	51.1	13%	0.134	24%	0.242	C	C	.	.			trans	94.8	138	177.2	0	0	0	0	0	113.3	G1020	G992-G1020 WeakPolarHBondContact O-CA 3.2Å; G992-G1020 PolarHBondContact O-N 2.77Å
993	H	71	Confident	86.4	Confident	140 Å²	140	50.3 Å²	50.3	65%	0.648	24%	0.239	S	C	*	.			trans	-135.2	13.6	170.3	-110.9	73.5	0	0	0	110.6	D1021	H993-D1021 IonicContact CE1-OD1 2.7Å; H993-D1021 PolarHBondContact CE1-OD1 3.49Å; H993-D1021 VanDerWaalsContact CE1-OD1 3.27Å; H993-D1021 IonicContact CE1-OD2 2.69Å; H993-D1021 IonicContact NE2-OD1 3.54Å
994	N	66	Low	86.5	Confident	52 Å²	52	50.3 Å²	50.3	28%	0.278	24%	0.239	S	C	.	.	S	Bend	trans	-91.4	139.9	-179	49.1	8.1	0	0	0	109.6	A996 C997 R998	N994-A996 PolarHBondContact O-N 3.42Å; N994-C997 PolarHBondContact O-N 2.71Å; N994-C997 WeakPolarHBondContact OD1-CA 3.4Å; N994-C997 PolarHBondContact OD1-N 3.12Å; N994-R998 PolarHBondContact OD1-N 3.36Å
995	R	65.2	Low	86.4	Confident	162 Å²	162	48.6 Å²	48.6	61%	0.611	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.2	-17.1	179.2	-65.7	-176.8	178.3	-171.1	-3.8	114.7	D1238 G1321	R995-D1238 IonicContact CZ-OD1 2.94Å; R995-D1238 IonicContact CZ-OD2 3.44Å; R995-D1238 IonicContact NH1-OD1 3.53Å; R995-D1238 IonicContact NH1-OD2 2.76Å; R995-D1238 PolarHBondContact NH1-OD2 2.73Å; R995-D1238 IonicContact NH2-OD1 2.86Å; R995-D1238 PolarHBondContact NH2-OD1 3.07Å; R995-D1238 IonicContact NH2-OD2 2.56Å; R995-D1238 PolarHBondContact NH2-OD2 3.14Å; R995-G1321 PolarHBondContact NH1-O 2.69Å
996	A	73.4	Confident	86.1	Confident	60 Å²	60	48.7 Å²	48.7	50%	0.496	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97	0.3	178.3	0	0	0	0	0	114.5	N994 R998	N994-A996 PolarHBondContact O-N 3.42Å; A996-R998 HydrophobicContact CB-CG 3.93Å; A996-R998 PolarHBondContact O-N 3.05Å
997	C	83.3	Confident	85.4	Confident	12 Å²	12	46.2 Å²	46.2	8%	0.081	22%	0.215	C	C	.	.			trans	35.5	64.9	177.4	-67.3	0	0	0	0	114.4	N994 F1001 T1017 C1019	N994-C997 PolarHBondContact O-N 2.71Å; N994-C997 WeakPolarHBondContact OD1-CA 3.4Å; N994-C997 PolarHBondContact OD1-N 3.12Å; C997-F1001 HydrophobicContact CB-CB 3.98Å; C997-F1001 VanDerWaalsContact O-CD1 3.25Å; C997-F1001 WeakPolarHBondContact O-CD1 3.29Å; C997-T1017 HydrophobicContact CB-CG2 3.87Å; C997-C1019 WeakPolarHBondContact CA-SG 3.31Å; C997-C1019 HydrophobicContact CB-CB 3.61Å; C997-C1019 WeakPolarHBondContact CB-SG 3.11Å; C997-C1019 WeakPolarHBondContact SG-CB 3.47Å; C997-C1019 PolarHBondContact SG-N 2.8Å; C997-C1019 VanDerWaalsContact SG-N 3.43Å; C997-C1019 CovalentContact SG-SG 2.04Å; C997-C1019 PolarHBondContact SG-SG 3.26Å
998	R	81.8	Confident	84.1	Confident	191 Å²	191	45.5 Å²	45.5	72%	0.721	22%	0.218	S	C	*	.			trans	-87.5	-10.1	-164.8	-66	-170.1	-179.1	176.1	1.7	116.6	N994 A996	N994-R998 PolarHBondContact OD1-N 3.36Å; A996-R998 HydrophobicContact CB-CG 3.93Å; A996-R998 PolarHBondContact O-N 3.05Å
999	Y	87.6	Confident	82.7	Confident	106 Å²	106	49.1 Å²	49.1	42%	0.416	24%	0.24	S	C	.	.	S	Bend	trans	-106.8	-93.3	-174.9	-52.8	-70.4	0	0	0	108.4	E991	E991-Y999 HydrophobicContact CG-CD2 4.1Å; E991-Y999 HydrophobicContact CG-CG 4.15Å
1000	D	92.5	Very high	80.9	Confident	1 Å²	1	54.3 Å²	54.3	1%	0.005	27%	0.268	C	S	.	.	S	Bend	trans	-96.5	140.3	171.4	-58	-18.9	0	0	0	110.2	Y963 L990 E991 C1019 Y1039 S1040 D1041	Y963-D1000 WeakPolarHBondContact CE2-OD2 3.03Å; Y963-D1000 PolarHBondContact OH-OD2 3.06Å; L990-D1000 HydrophobicContact CB-CB 4.2Å; E991-D1000 HydrophobicContact CB-CB 4.14Å; E991-D1000 WeakPolarHBondContact CB-OD2 3.34Å; D1000-C1019 VanDerWaalsContact O-CB 3.29Å; D1000-C1019 WeakPolarHBondContact O-CB 3.36Å; D1000-Y1039 VanDerWaalsContact CA-O 3.31Å; D1000-Y1039 WeakPolarHBondContact CA-O 3.22Å; D1000-S1040 WeakPolarHBondContact OD1-CA 3.48Å; D1000-D1041 PolarHBondContact OD1-N 2.03Å
1001	F	93.8	Very high	79.4	Confident	40 Å²	40	61.4 Å²	61.4	18%	0.175	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.7	156.7	-178.8	55.7	-95.6	0	0	0	112.7	C997 N1003 T1017 F1018 F1038 Y1039	C997-F1001 HydrophobicContact CB-CB 3.98Å; C997-F1001 VanDerWaalsContact O-CD1 3.25Å; C997-F1001 WeakPolarHBondContact O-CD1 3.29Å; F1001-N1003 WeakPolarHBondContact CD2-OD1 3.25Å; F1001-N1003 WeakPolarHBondContact CE2-ND2 3.45Å; F1001-T1017 HydrophobicContact CB-CG2 4.04Å; F1001-T1017 HydrophobicContact CD2-CG2 4.44Å; F1001-T1017 HydrophobicContact CG-CG2 4.38Å; F1001-F1018 CarbonylContact C-O 3.56Å; F1001-F1018 WeakPolarHBondContact CA-O 3.23Å; F1001-F1038 WeakPolarHBondContact O-CA 3.41Å; F1001-F1038 WeakPolarHBondContact O-CD2 3.37Å; F1001-Y1039 HydrophobicContact CD1-CD1 4.34Å; F1001-Y1039 AromaticContact CE1-CD1 3.6Å; F1001-Y1039 HydrophobicContact CE1-CD1 3.6Å; F1001-Y1039 HydrophobicContact CE1-CE1 4.45Å; F1001-Y1039 AromaticContact CE1-CG 3.95Å; F1001-Y1039 HydrophobicContact CE1-CG 3.95Å; F1001-Y1039 HydrophobicContact CE2-CG 4.27Å; F1001-Y1039 VanDerWaalsContact CZ-CB 3.42Å; F1001-Y1039 AromaticContact CZ-CD1 3.83Å; F1001-Y1039 HydrophobicContact CZ-CD1 3.83Å; F1001-Y1039 HydrophobicContact CZ-CD2 4.5Å; F1001-Y1039 AromaticContact CZ-CG 3.68Å; F1001-Y1039 HydrophobicContact CZ-CG 3.68Å; F1001-Y1039 PolarHBondContact N-O 3.33Å; F1001-Y1039 PolarHBondContact O-N 2.96Å
1002	I	93.4	Very high	78.4	Confident	0 Å²	0	61.7 Å²	61.7	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	128.6	161.4	-150.7	178.9	0	0	0	110	F985 F988 T1017 F1018 I1036 E1037 F1038 F1049	F985-I1002 HydrophobicContact CE1-CD1 4.06Å; F985-I1002 HydrophobicContact CZ-CD1 4.08Å; F985-I1002 HydrophobicContact CZ-CG2 4.29Å; F988-I1002 HydrophobicContact CE2-CG2 3.95Å; F988-I1002 HydrophobicContact CZ-CG2 4.11Å; I1002-T1017 CarbonylContact O-C 3.58Å; I1002-T1017 WeakPolarHBondContact O-CA 3.22Å; I1002-F1018 HydrophobicContact CG2-CB 3.97Å; I1002-F1018 HydrophobicContact CG2-CD2 3.85Å; I1002-F1018 HydrophobicContact CG2-CG 4.39Å; I1002-F1018 PolarHBondContact N-O 2.78Å; I1002-F1018 PolarHBondContact O-N 2.85Å; I1002-I1036 HydrophobicContact CD1-CG2 3.43Å; I1002-I1036 VanDerWaalsContact CD1-CG2 3.43Å; I1002-I1036 HydrophobicContact CG1-CG2 3.76Å; I1002-E1037 CarbonylContact C-O 3.58Å; I1002-E1037 VanDerWaalsContact CA-O 3.31Å; I1002-E1037 WeakPolarHBondContact CA-O 3.46Å; I1002-E1037 WeakPolarHBondContact CG1-O 3.48Å; I1002-F1038 HydrophobicContact CG1-CB 4.2Å; I1002-F1049 HydrophobicContact CD1-CD1 4.07Å; I1002-F1049 HydrophobicContact CD1-CD2 4.37Å; I1002-F1049 HydrophobicContact CD1-CE1 3.51Å; I1002-F1049 HydrophobicContact CD1-CE2 3.85Å; I1002-F1049 HydrophobicContact CD1-CG 4.49Å; I1002-F1049 HydrophobicContact CD1-CZ 3.39Å; I1002-F1049 HydrophobicContact CG1-CE1 4.2Å; I1002-F1049 HydrophobicContact CG1-CZ 4.38Å
1003	N	92.4	Very high	78.6	Confident	10 Å²	10	66.6 Å²	66.6	5%	0.053	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	139.3	168.2	-65.8	-30.5	0	0	0	108.9	F1001 Y1005 K1014 T1017 I1036 E1037	F1001-N1003 WeakPolarHBondContact CD2-OD1 3.25Å; F1001-N1003 WeakPolarHBondContact CE2-ND2 3.45Å; N1003-Y1005 HydrophobicContact CB-CD2 4.22Å; N1003-Y1005 HydrophobicContact CB-CE2 3.38Å; N1003-Y1005 PolarHBondContact ND2-OH 2.9Å; N1003-K1014 VanDerWaalsContact CG-CE 3.46Å; N1003-K1014 VanDerWaalsContact CG-NZ 3.32Å; N1003-K1014 WeakPolarHBondContact OD1-CE 3.44Å; N1003-K1014 PolarHBondContact OD1-NZ 2.92Å; N1003-T1017 WeakPolarHBondContact OD1-CG2 3.26Å; N1003-I1036 WeakPolarHBondContact O-CA 3.45Å; N1003-E1037 HydrophobicContact CB-CB 4.22Å; N1003-E1037 PolarHBondContact N-O 3.05Å; N1003-E1037 PolarHBondContact ND2-OE2 3.02Å; N1003-E1037 PolarHBondContact O-N 3.19Å
1004	V	93.3	Very high	79.3	Confident	0 Å²	0	63.4 Å²	63.4	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	130	173.5	-175.2	0	0	0	0	109.4	I1015 G1016 F1018 I1027 L1034 I1036	V1004-I1015 HydrophobicContact CB-CB 4.49Å; V1004-I1015 HydrophobicContact CG1-CB 4.47Å; V1004-I1015 HydrophobicContact CG1-CD1 4.07Å; V1004-I1015 PolarHBondContact O-N 2.02Å; V1004-G1016 PolarHBondContact N-O 3.3Å; V1004-G1016 PolarHBondContact O-N 3.3Å; V1004-F1018 HydrophobicContact CB-CE2 4.46Å; V1004-F1018 HydrophobicContact CG2-CD2 4.42Å; V1004-F1018 HydrophobicContact CG2-CE2 4.04Å; V1004-I1027 HydrophobicContact CB-CD1 4.28Å; V1004-I1027 HydrophobicContact CG1-CD1 4.27Å; V1004-I1027 HydrophobicContact CG1-CG2 4.27Å; V1004-I1027 HydrophobicContact CG2-CD1 3.98Å; V1004-L1034 HydrophobicContact CG1-CD1 3.81Å; V1004-L1034 HydrophobicContact CG1-CG 4.29Å; V1004-I1036 HydrophobicContact CG1-CG1 4.37Å
1005	Y	90.7	Very high	80.3	Confident	29 Å²	29	64.1 Å²	64.1	11%	0.114	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	142.9	-176.4	-56.8	-96.1	0	0	0	111.5	N1003 Q1012 Q1013 K1014 L1034 S1035	N1003-Y1005 HydrophobicContact CB-CD2 4.22Å; N1003-Y1005 HydrophobicContact CB-CE2 3.38Å; N1003-Y1005 PolarHBondContact ND2-OH 2.9Å; Y1005-Q1012 HydrophobicContact CD1-CB 4.28Å; Y1005-Q1013 WeakPolarHBondContact CA-O 3.39Å; Y1005-K1014 HydrophobicContact CD1-CB 3.73Å; Y1005-K1014 HydrophobicContact CD1-CG 3.84Å; Y1005-K1014 HydrophobicContact CE1-CB 3.74Å; Y1005-K1014 HydrophobicContact CE1-CD 3.93Å; Y1005-K1014 HydrophobicContact CE1-CG 3.62Å; Y1005-L1034 WeakPolarHBondContact O-CD1 3.18Å; Y1005-S1035 PolarHBondContact N-O 2.99Å; Y1005-S1035 PolarHBondContact O-N 3.14Å
1006	N	86.9	Confident	81.4	Confident	6 Å²	6	57.1 Å²	57.1	3%	0.032	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	132	-179.5	-170.4	8.3	0	0	0	109.4	Q1012 Q1013 I1015 H1030 T1031	N1006-Q1012 WeakPolarHBondContact O-CA 3.04Å; N1006-Q1013 HydrophobicContact CB-CB 4.44Å; N1006-Q1013 PolarHBondContact N-O 3.01Å; N1006-Q1013 PolarHBondContact O-N 3.28Å; N1006-I1015 HydrophobicContact CB-CD1 4.03Å; N1006-I1015 HydrophobicContact CB-CG1 3.98Å; N1006-H1030 VanDerWaalsContact ND2-CB 3.27Å; N1006-H1030 WeakPolarHBondContact ND2-CB 3.27Å; N1006-H1030 PolarHBondContact ND2-CD2 2.8Å; N1006-H1030 VanDerWaalsContact ND2-CG 3.26Å; N1006-H1030 PolarHBondContact ND2-N 3.2Å; N1006-H1030 PolarHBondContact OD1-N 2.9Å; N1006-T1031 PolarHBondContact OD1-N 2.97Å; N1006-T1031 PolarHBondContact OD1-OG1 3.15Å
1007	G	76.9	Confident	82.2	Confident	8 Å²	8	57 Å²	57	8%	0.082	29%	0.286	C	S	.	.	S	Bend	trans	88.2	177.1	176.6	0	0	0	0	0	115.8	Q1012 T1031 E1033	G1007-Q1012 WeakPolarHBondContact O-CG 3.32Å; G1007-T1031 VanDerWaalsContact CA-OG1 3.26Å; G1007-T1031 WeakPolarHBondContact CA-OG1 3.46Å; G1007-T1031 PolarHBondContact N-OG1 3.45Å; G1007-T1031 VanDerWaalsContact N-OG1 3.1Å; G1007-E1033 PolarHBondContact N-O 3.24Å
1008	S	67.8	Low	82.7	Confident	49 Å²	49	58.9 Å²	58.9	34%	0.343	29%	0.292	S	S	.	.			trans	-69.6	155.2	178.5	-172	0	0	0	0	112.1	D1010 N1011 Q1012 E1033	S1008-D1010 PolarHBondContact O-N 2.92Å; S1008-N1011 CarbonylContact O-C 3.51Å; S1008-N1011 VanDerWaalsContact O-C 3.31Å; S1008-N1011 PolarHBondContact O-N 3.18Å; S1008-Q1012 PolarHBondContact O-N 2.71Å; S1008-E1033 WeakPolarHBondContact CA-OE2 3.48Å; S1008-E1033 WeakPolarHBondContact CB-OE2 3.42Å; S1008-E1033 PolarHBondContact N-OE2 3.18Å
1009	T	65.4	Low	83.2	Confident	82 Å²	82	50.8 Å²	50.8	50%	0.503	27%	0.265	S	S	.	.	G	3₁₀ helix	trans	-49.7	-34.2	-174.4	42.1	0	0	0	0	114.1	N1011	T1009-N1011 VanDerWaalsContact C-N 3.27Å; T1009-N1011 PolarHBondContact O-N 2.75Å
1010	D	54.9	Low	83.4	Confident	139 Å²	139	45.8 Å²	45.8	74%	0.743	25%	0.246	S	C	*	.	G	3₁₀ helix	trans	-76.1	-14.3	-176.8	-51.5	-23.5	0	0	0	113.2	S1008	S1008-D1010 PolarHBondContact O-N 2.92Å
1011	N	62.6	Low	83.3	Confident	149 Å²	149	49.6 Å²	49.6	80%	0.797	27%	0.266	S	S	*	.	G	3₁₀ helix	trans	-143	35.6	-179.8	-91.4	-47.6	0	0	0	112	S1008 T1009 Q1013	S1008-N1011 CarbonylContact O-C 3.51Å; S1008-N1011 VanDerWaalsContact O-C 3.31Å; S1008-N1011 PolarHBondContact O-N 3.18Å; T1009-N1011 VanDerWaalsContact C-N 3.27Å; T1009-N1011 PolarHBondContact O-N 2.75Å; N1011-Q1013 PolarHBondContact O-N 3.4Å
1012	Q	71.1	Confident	83.1	Confident	47 Å²	47	55.2 Å²	55.2	22%	0.22	29%	0.293	C	S	.	.	P	Polyproline II helix	trans	-65.2	116.6	-178.3	-96.1	177.2	-2.5	0	0	112.4	Y1005 N1006 G1007 S1008 S1035	Y1005-Q1012 HydrophobicContact CD1-CB 4.28Å; N1006-Q1012 WeakPolarHBondContact O-CA 3.04Å; G1007-Q1012 WeakPolarHBondContact O-CG 3.32Å; S1008-Q1012 PolarHBondContact O-N 2.71Å; Q1012-S1035 PolarHBondContact NE2-OG 3.33Å; Q1012-S1035 VanDerWaalsContact NE2-OG 3.1Å
1013	Q	80.8	Confident	83	Confident	115 Å²	115	59.7 Å²	59.7	54%	0.537	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	116.5	169.2	-175.8	178.3	2.8	0	0	109.6	Y1005 N1006 N1011 I1015	Y1005-Q1013 WeakPolarHBondContact CA-O 3.39Å; N1006-Q1013 HydrophobicContact CB-CB 4.44Å; N1006-Q1013 PolarHBondContact N-O 3.01Å; N1006-Q1013 PolarHBondContact O-N 3.28Å; N1011-Q1013 PolarHBondContact O-N 3.4Å; Q1013-I1015 PolarHBondContact O-N 2.85Å
1014	K	85.3	Confident	82.9	Confident	73 Å²	73	60 Å²	60	32%	0.317	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	123.8	175	-160.8	179.2	-162.5	-170	0	110.2	N1003 Y1005 G1016 T1017	N1003-K1014 VanDerWaalsContact CG-CE 3.46Å; N1003-K1014 VanDerWaalsContact CG-NZ 3.32Å; N1003-K1014 WeakPolarHBondContact OD1-CE 3.44Å; N1003-K1014 PolarHBondContact OD1-NZ 2.92Å; Y1005-K1014 HydrophobicContact CD1-CB 3.73Å; Y1005-K1014 HydrophobicContact CD1-CG 3.84Å; Y1005-K1014 HydrophobicContact CE1-CB 3.74Å; Y1005-K1014 HydrophobicContact CE1-CD 3.93Å; Y1005-K1014 HydrophobicContact CE1-CG 3.62Å; K1014-G1016 WeakPolarHBondContact CE-O 3.41Å; K1014-T1017 WeakPolarHBondContact CE-OG1 3Å; K1014-T1017 PolarHBondContact NZ-OG1 3.29Å
1015	I	87.1	Confident	82.6	Confident	68 Å²	68	67.7 Å²	67.7	35%	0.349	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	-46.4	175	-54.5	-175.2	0	0	0	110	V1004 N1006 Q1013 I1027 L1034	V1004-I1015 HydrophobicContact CB-CB 4.49Å; V1004-I1015 HydrophobicContact CG1-CB 4.47Å; V1004-I1015 HydrophobicContact CG1-CD1 4.07Å; V1004-I1015 PolarHBondContact O-N 2.02Å; N1006-I1015 HydrophobicContact CB-CD1 4.03Å; N1006-I1015 HydrophobicContact CB-CG1 3.98Å; Q1013-I1015 PolarHBondContact O-N 2.85Å; I1015-I1027 HydrophobicContact CD1-CG2 3.56Å; I1015-I1027 HydrophobicContact CG2-CG2 4.01Å; I1015-L1034 HydrophobicContact CD1-CD1 3.94Å
1016	G	87.9	Confident	82.5	Confident	15 Å²	15	69.1 Å²	69.1	16%	0.155	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-169.3	174.8	-174.7	0	0	0	0	0	114.7	V1004 K1014	V1004-G1016 PolarHBondContact N-O 3.3Å; V1004-G1016 PolarHBondContact O-N 3.3Å; K1014-G1016 WeakPolarHBondContact CE-O 3.41Å
1017	T	91.3	Very high	82.7	Confident	58 Å²	58	69.4 Å²	69.4	36%	0.356	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	126.2	172.2	-41.6	0	0	0	0	106.5	C997 F1001 I1002 N1003 K1014	C997-T1017 HydrophobicContact CB-CG2 3.87Å; F1001-T1017 HydrophobicContact CB-CG2 4.04Å; F1001-T1017 HydrophobicContact CD2-CG2 4.44Å; F1001-T1017 HydrophobicContact CG-CG2 4.38Å; I1002-T1017 CarbonylContact O-C 3.58Å; I1002-T1017 WeakPolarHBondContact O-CA 3.22Å; N1003-T1017 WeakPolarHBondContact OD1-CG2 3.26Å; K1014-T1017 WeakPolarHBondContact CE-OG1 3Å; K1014-T1017 PolarHBondContact NZ-OG1 3.29Å
1018	F	93	Very high	83.1	Confident	50 Å²	50	72 Å²	72	22%	0.219	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	141.2	-174.3	-43.6	-94.3	0	0	0	111.4	F988 F1001 I1002 V1004 P1024 I1027	F988-F1018 HydrophobicContact CE1-CB 4.29Å; F988-F1018 HydrophobicContact CE2-CB 4.5Å; F988-F1018 HydrophobicContact CZ-CB 3.76Å; F1001-F1018 CarbonylContact C-O 3.56Å; F1001-F1018 WeakPolarHBondContact CA-O 3.23Å; I1002-F1018 HydrophobicContact CG2-CB 3.97Å; I1002-F1018 HydrophobicContact CG2-CD2 3.85Å; I1002-F1018 HydrophobicContact CG2-CG 4.39Å; I1002-F1018 PolarHBondContact N-O 2.78Å; I1002-F1018 PolarHBondContact O-N 2.85Å; V1004-F1018 HydrophobicContact CB-CE2 4.46Å; V1004-F1018 HydrophobicContact CG2-CD2 4.42Å; V1004-F1018 HydrophobicContact CG2-CE2 4.04Å; F1018-P1024 HydrophobicContact CB-CG 3.91Å; F1018-P1024 HydrophobicContact CD1-CB 3.77Å; F1018-P1024 HydrophobicContact CD1-CG 3.82Å; F1018-P1024 HydrophobicContact CE1-CB 3.98Å; F1018-P1024 HydrophobicContact CG-CB 4.23Å; F1018-P1024 HydrophobicContact CG-CG 3.88Å; F1018-I1027 HydrophobicContact CE2-CD1 3.65Å; F1018-I1027 HydrophobicContact CZ-CD1 3.66Å; F1018-I1027 HydrophobicContact CZ-CG1 4.5Å
1019	C	93.4	Very high	84.1	Confident	22 Å²	22	69.7 Å²	69.7	15%	0.149	37%	0.367	C	S	.	.			trans	-153	169.8	-179	59.6	0	0	0	0	110	C997 D1000	C997-C1019 WeakPolarHBondContact CA-SG 3.31Å; C997-C1019 HydrophobicContact CB-CB 3.61Å; C997-C1019 WeakPolarHBondContact CB-SG 3.11Å; C997-C1019 WeakPolarHBondContact SG-CB 3.47Å; C997-C1019 PolarHBondContact SG-N 2.8Å; C997-C1019 VanDerWaalsContact SG-N 3.43Å; C997-C1019 CovalentContact SG-SG 2.04Å; C997-C1019 PolarHBondContact SG-SG 3.26Å; D1000-C1019 VanDerWaalsContact O-CB 3.29Å; D1000-C1019 WeakPolarHBondContact O-CB 3.36Å
1020	G	91.5	Very high	84.8	Confident	1 Å²	1	72.8 Å²	72.8	1%	0.01	38%	0.375	C	S	.	.	S	Bend	trans	84.8	-157.8	-178.4	0	0	0	0	0	114.4	F988 N989 L990 G992	F988-G1020 VanDerWaalsContact CD1-O 3.3Å; F988-G1020 WeakPolarHBondContact CD1-O 3.1Å; N989-G1020 CarbonylContact C-O 3.42Å; N989-G1020 VanDerWaalsContact CA-O 3.27Å; N989-G1020 WeakPolarHBondContact CA-O 3.36Å; L990-G1020 PolarHBondContact N-O 2.79Å; L990-G1020 WeakPolarHBondContact O-CA 3.48Å; G992-G1020 WeakPolarHBondContact O-CA 3.2Å; G992-G1020 PolarHBondContact O-N 2.77Å
1021	D	90.7	Very high	86.2	Confident	80 Å²	80	68.6 Å²	68.6	43%	0.428	36%	0.355	S	S	.	.	S	Bend	trans	-116.7	3.1	-174	55.5	32.3	0	0	0	114.7	H993 R1046	H993-D1021 IonicContact CE1-OD1 2.7Å; H993-D1021 PolarHBondContact CE1-OD1 3.49Å; H993-D1021 VanDerWaalsContact CE1-OD1 3.27Å; H993-D1021 IonicContact CE1-OD2 2.69Å; H993-D1021 IonicContact NE2-OD1 3.54Å; D1021-R1046 IonicContact OD2-NH1 3.69Å
1022	Q	89.5	Confident	87.4	Confident	159 Å²	159	64.2 Å²	64.2	74%	0.743	33%	0.331	S	S	*	.	S	Bend	trans	-73.9	129.1	162	-73.7	-163.6	-18.2	0	0	110.2	F988 P1024	F988-Q1022 VanDerWaalsContact CD1-O 3.23Å; F988-Q1022 WeakPolarHBondContact CD1-O 3.42Å; Q1022-P1024 WeakPolarHBondContact O-CD 3.3Å
1023	I	91.2	Very high	88.3	Confident	94 Å²	94	63.8 Å²	63.8	48%	0.482	33%	0.329	S	S	.	.	P	Polyproline II helix	trans	-70.8	125	173.5	-62.5	179.5	0	0	0	108.4	F985 F988	F985-I1023 HydrophobicContact CB-CG2 3.73Å; F985-I1023 WeakPolarHBondContact O-CG2 3.21Å; F988-I1023 HydrophobicContact CB-CG1 4.07Å
1024	P	89.8	Confident	88.8	Confident	15 Å²	15	58.3 Å²	58.3	10%	0.097	30%	0.303	C	S	.	.	P	Polyproline II helix	trans	-61.4	148.2	177.6	-25.5	34.9	0	0	0	113.6	F985 F988 F1018 Q1022	F985-P1024 HydrophobicContact CD2-CB 3.88Å; F985-P1024 HydrophobicContact CD2-CG 3.88Å; F985-P1024 HydrophobicContact CE2-CB 4.18Å; F985-P1024 HydrophobicContact CE2-CG 4.1Å; F985-P1024 HydrophobicContact CG-CG 4.27Å; F988-P1024 HydrophobicContact CD2-CG 4.18Å; F988-P1024 HydrophobicContact CE1-CG 4.48Å; F988-P1024 HydrophobicContact CE2-CG 4.15Å; F988-P1024 HydrophobicContact CG-CG 4.38Å; F988-P1024 HydrophobicContact CZ-CG 4.31Å; F1018-P1024 HydrophobicContact CB-CG 3.91Å; F1018-P1024 HydrophobicContact CD1-CB 3.77Å; F1018-P1024 HydrophobicContact CD1-CG 3.82Å; F1018-P1024 HydrophobicContact CE1-CB 3.98Å; F1018-P1024 HydrophobicContact CG-CB 4.23Å; F1018-P1024 HydrophobicContact CG-CG 3.88Å; Q1022-P1024 WeakPolarHBondContact O-CD 3.3Å
1025	E	87.8	Confident	89.1	Confident	163 Å²	163	55.1 Å²	55.1	76%	0.762	29%	0.291	S	S	*	.	P	Polyproline II helix	trans	-50.1	145.5	164.8	-79.6	-70.8	136.5	0	0	111.2	I1027	E1025-I1027 PolarHBondContact O-N 3.32Å
1026	P	88.4	Confident	89.3	Confident	59 Å²	59	52 Å²	52	38%	0.383	27%	0.274	S	S	.	.	P	Polyproline II helix	trans	-62.1	130.3	179.8	-21.3	33.1	0	0	0	112.7	F982	F982-P1026 HydrophobicContact CE1-CB 3.5Å; F982-P1026 VanDerWaalsContact CE1-CB 3.5Å; F982-P1026 HydrophobicContact CZ-CB 3.58Å
1027	I	90	Very high	89.5	Confident	11 Å²	11	53.3 Å²	53.3	6%	0.056	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	136.5	-172.9	-61.9	175.3	0	0	0	110.1	F982 L983 F985 V1004 I1015 F1018 E1025	F982-I1027 CarbonylContact C-O 3.15Å; F982-I1027 WeakPolarHBondContact CA-O 3.49Å; L983-I1027 HydrophobicContact CB-CB 4.35Å; L983-I1027 PolarHBondContact N-O 3.3Å; L983-I1027 PolarHBondContact O-N 3.47Å; F985-I1027 HydrophobicContact CE2-CD1 4.22Å; V1004-I1027 HydrophobicContact CB-CD1 4.28Å; V1004-I1027 HydrophobicContact CG1-CD1 4.27Å; V1004-I1027 HydrophobicContact CG1-CG2 4.27Å; V1004-I1027 HydrophobicContact CG2-CD1 3.98Å; I1015-I1027 HydrophobicContact CD1-CG2 3.56Å; I1015-I1027 HydrophobicContact CG2-CG2 4.01Å; F1018-I1027 HydrophobicContact CE2-CD1 3.65Å; F1018-I1027 HydrophobicContact CZ-CD1 3.66Å; F1018-I1027 HydrophobicContact CZ-CG1 4.5Å; E1025-I1027 PolarHBondContact O-N 3.32Å
1028	T	86.1	Confident	89.5	Confident	62 Å²	62	50.5 Å²	50.5	38%	0.38	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	132.2	171.4	-43.3	0	0	0	0	109.8	F982	F982-T1028 HydrophobicContact CD2-CG2 4.01Å; F982-T1028 VanDerWaalsContact CD2-OG1 3.22Å; F982-T1028 WeakPolarHBondContact CD2-OG1 3.26Å; F982-T1028 WeakPolarHBondContact CE2-OG1 3.46Å
1029	S	87.7	Confident	89.5	Confident	2 Å²	2	52.1 Å²	52.1	1%	0.014	27%	0.265	C	S	.	.			trans	-74.8	159.6	169	76.2	0	0	0	0	111.2	T980 I981 T1031	T980-S1029 WeakPolarHBondContact CB-O 3.29Å; T980-S1029 WeakPolarHBondContact CG2-O 3.44Å; I981-S1029 PolarHBondContact N-OG 3.17Å; I981-S1029 PolarHBondContact O-N 3.29Å; S1029-T1031 WeakPolarHBondContact CB-O 3.31Å; S1029-T1031 PolarHBondContact OG-O 2.88Å
1030	H	81.4	Confident	89.4	Confident	146 Å²	146	51 Å²	51	68%	0.676	26%	0.258	S	S	*	.	S	Bend	trans	-101.5	0.2	171.3	-53.7	-166.2	0	0	0	111.4	N1006	N1006-H1030 VanDerWaalsContact ND2-CB 3.27Å; N1006-H1030 WeakPolarHBondContact ND2-CB 3.27Å; N1006-H1030 PolarHBondContact ND2-CD2 2.8Å; N1006-H1030 VanDerWaalsContact ND2-CG 3.26Å; N1006-H1030 PolarHBondContact ND2-N 3.2Å; N1006-H1030 PolarHBondContact OD1-N 2.9Å
1031	T	84.8	Confident	89.3	Confident	52 Å²	52	52.4 Å²	52.4	32%	0.319	26%	0.264	S	S	.	.	S	Bend	trans	-140.4	164.5	-174.8	65.4	0	0	0	0	109.8	N1006 G1007 S1029 E1033	N1006-T1031 PolarHBondContact OD1-N 2.97Å; N1006-T1031 PolarHBondContact OD1-OG1 3.15Å; G1007-T1031 VanDerWaalsContact CA-OG1 3.26Å; G1007-T1031 WeakPolarHBondContact CA-OG1 3.46Å; G1007-T1031 PolarHBondContact N-OG1 3.45Å; G1007-T1031 VanDerWaalsContact N-OG1 3.1Å; S1029-T1031 WeakPolarHBondContact CB-O 3.31Å; S1029-T1031 PolarHBondContact OG-O 2.88Å; T1031-E1033 PolarHBondContact O-N 3.27Å; T1031-E1033 VanDerWaalsContact O-N 3.12Å; T1031-E1033 PolarHBondContact OG1-O 3.35Å; T1031-E1033 VanDerWaalsContact OG1-O 3.07Å
1032	N	86.9	Confident	89.2	Confident	57 Å²	57	53.4 Å²	53.4	31%	0.305	27%	0.274	S	S	.	.	S	Bend	trans	-77.8	15	177.2	70.4	-66.8	0	0	0	113.9	A975 P976 T979	A975-N1032 HydrophobicContact CB-CB 4.15Å; A975-N1032 WeakPolarHBondContact CB-O 3.31Å; A975-N1032 PolarHBondContact N-O 3.47Å; A975-N1032 WeakPolarHBondContact O-CB 3.24Å; A975-N1032 PolarHBondContact O-ND2 3.14Å; P976-N1032 WeakPolarHBondContact O-CB 3.47Å; T979-N1032 VanDerWaalsContact O-CA 3.26Å; T979-N1032 WeakPolarHBondContact O-CA 3.31Å; T979-N1032 VanDerWaalsContact O-CB 3.28Å; T979-N1032 WeakPolarHBondContact O-CB 3.35Å; T979-N1032 PolarHBondContact O-N 3.01Å
1033	E	90	Very high	89	Confident	37 Å²	37	48.2 Å²	48.2	17%	0.173	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	131.6	172.3	-60.1	-161.3	141.7	0	0	111.1	K972 I973 L974 G1007 S1008 T1031	K972-E1033 VanDerWaalsContact CE-CD 3.46Å; K972-E1033 WeakPolarHBondContact CE-OE2 3.37Å; K972-E1033 IonicContact NZ-OE1 4Å; K972-E1033 PolarHBondContact NZ-OE1 2.89Å; K972-E1033 IonicContact NZ-OE2 2.73Å; K972-E1033 PolarHBondContact NZ-OE2 2.68Å; I973-E1033 WeakPolarHBondContact O-CA 3.33Å; L974-E1033 HydrophobicContact CD2-CB 4.38Å; L974-E1033 HydrophobicContact CD2-CG 3.71Å; L974-E1033 WeakPolarHBondContact CD2-OE1 3.24Å; G1007-E1033 PolarHBondContact N-O 3.24Å; S1008-E1033 WeakPolarHBondContact CA-OE2 3.48Å; S1008-E1033 WeakPolarHBondContact CB-OE2 3.42Å; S1008-E1033 PolarHBondContact N-OE2 3.18Å; T1031-E1033 PolarHBondContact O-N 3.27Å; T1031-E1033 VanDerWaalsContact O-N 3.12Å; T1031-E1033 PolarHBondContact OG1-O 3.35Å; T1031-E1033 VanDerWaalsContact OG1-O 3.07Å
1034	L	91	Very high	88.7	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	123	175	-170.9	76.1	0	0	0	109	I973 I981 L983 V1004 Y1005 I1015 I1036	I973-L1034 HydrophobicContact CB-CB 4.45Å; I973-L1034 HydrophobicContact CD1-CD2 4.48Å; I973-L1034 PolarHBondContact N-O 2.04Å; I973-L1034 PolarHBondContact O-N 3.24Å; I981-L1034 HydrophobicContact CB-CB 4.25Å; I981-L1034 HydrophobicContact CB-CD2 4.43Å; I981-L1034 HydrophobicContact CD1-CB 3.68Å; I981-L1034 HydrophobicContact CG2-CB 4.2Å; I981-L1034 HydrophobicContact CG2-CD2 3.82Å; L983-L1034 HydrophobicContact CB-CD2 4.1Å; L983-L1034 HydrophobicContact CD2-CD2 4.18Å; V1004-L1034 HydrophobicContact CG1-CD1 3.81Å; V1004-L1034 HydrophobicContact CG1-CG 4.29Å; Y1005-L1034 WeakPolarHBondContact O-CD1 3.18Å; I1015-L1034 HydrophobicContact CD1-CD1 3.94Å; L1034-I1036 HydrophobicContact CD2-CD1 4.03Å; L1034-I1036 HydrophobicContact CD2-CG1 4.35Å; L1034-I1036 HydrophobicContact CG-CD1 4.48Å; L1034-I1036 HydrophobicContact CG-CG1 4.31Å
1035	S	91.4	Very high	88.7	Confident	7 Å²	7	50.2 Å²	50.2	5%	0.049	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	133.5	178	-51.4	0	0	0	0	110	W971 Y1005 Q1012	W971-S1035 WeakPolarHBondContact O-CA 3.32Å; Y1005-S1035 PolarHBondContact N-O 2.99Å; Y1005-S1035 PolarHBondContact O-N 3.14Å; Q1012-S1035 PolarHBondContact NE2-OG 3.33Å; Q1012-S1035 VanDerWaalsContact NE2-OG 3.1Å
1036	I	92	Very high	88.9	Confident	1 Å²	1	46.8 Å²	46.8	1%	0.005	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	123.4	-172.6	-57.7	169.2	0	0	0	107.8	I954 I970 W971 I973 L983 I1002 N1003 V1004 L1034	I954-I1036 HydrophobicContact CD1-CD1 3.45Å; I954-I1036 VanDerWaalsContact CD1-CD1 3.45Å; I954-I1036 HydrophobicContact CD1-CG2 4.22Å; I970-I1036 WeakPolarHBondContact CA-O 3.43Å; W971-I1036 HydrophobicContact CB-CB 4.48Å; W971-I1036 HydrophobicContact CE3-CB 4.49Å; W971-I1036 HydrophobicContact CE3-CG2 4.2Å; W971-I1036 PolarHBondContact N-O 3.43Å; W971-I1036 PolarHBondContact O-N 2.85Å; I973-I1036 HydrophobicContact CD1-CD1 3.85Å; L983-I1036 HydrophobicContact CD1-CD1 4.09Å; L983-I1036 HydrophobicContact CD2-CD1 3.65Å; L983-I1036 HydrophobicContact CD2-CG1 4.43Å; I1002-I1036 HydrophobicContact CD1-CG2 3.43Å; I1002-I1036 VanDerWaalsContact CD1-CG2 3.43Å; I1002-I1036 HydrophobicContact CG1-CG2 3.76Å; N1003-I1036 WeakPolarHBondContact O-CA 3.45Å; V1004-I1036 HydrophobicContact CG1-CG1 4.37Å; L1034-I1036 HydrophobicContact CD2-CD1 4.03Å; L1034-I1036 HydrophobicContact CD2-CG1 4.35Å; L1034-I1036 HydrophobicContact CG-CD1 4.48Å; L1034-I1036 HydrophobicContact CG-CG1 4.31Å
1037	E	91	Very high	89.1	Confident	43 Å²	43	45.8 Å²	45.8	20%	0.201	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	121.7	-178.6	169.3	-173.5	-134	0	0	108.7	N968 C969 I970 I1002 N1003	N968-E1037 PolarHBondContact ND2-OE1 3.32Å; N968-E1037 WeakPolarHBondContact OD1-CG 3.07Å; C969-E1037 CarbonylContact O-C 3.31Å; C969-E1037 WeakPolarHBondContact O-CA 3.4Å; I970-E1037 HydrophobicContact CG1-CB 4.43Å; I970-E1037 HydrophobicContact CG1-CG 4.29Å; I1002-E1037 CarbonylContact C-O 3.58Å; I1002-E1037 VanDerWaalsContact CA-O 3.31Å; I1002-E1037 WeakPolarHBondContact CA-O 3.46Å; I1002-E1037 WeakPolarHBondContact CG1-O 3.48Å; N1003-E1037 HydrophobicContact CB-CB 4.22Å; N1003-E1037 PolarHBondContact N-O 3.05Å; N1003-E1037 PolarHBondContact ND2-OE2 3.02Å; N1003-E1037 PolarHBondContact O-N 3.19Å
1038	F	92.9	Very high	89.2	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	125.4	171.1	166.7	-117	0	0	0	109.7	T956 Y963 N968 C969 W971 L990 F1001 I1002 F1049	T956-F1038 HydrophobicContact CG2-CD1 4.07Å; T956-F1038 HydrophobicContact CG2-CE1 3.85Å; T956-F1038 HydrophobicContact CG2-CE2 4.47Å; T956-F1038 HydrophobicContact CG2-CG 4.46Å; T956-F1038 HydrophobicContact CG2-CZ 4.07Å; Y963-F1038 HydrophobicContact CD1-CZ 4.17Å; Y963-F1038 HydrophobicContact CD2-CE1 4.4Å; Y963-F1038 AromaticContact CD2-CZ 3.84Å; Y963-F1038 HydrophobicContact CD2-CZ 3.84Å; Y963-F1038 HydrophobicContact CE1-CZ 4.4Å; Y963-F1038 HydrophobicContact CE2-CZ 4.08Å; Y963-F1038 HydrophobicContact CG-CE1 4.3Å; Y963-F1038 AromaticContact CG-CZ 3.89Å; Y963-F1038 HydrophobicContact CG-CZ 3.89Å; N968-F1038 CarbonylContact C-O 3.47Å; N968-F1038 VanDerWaalsContact CA-O 3.32Å; N968-F1038 WeakPolarHBondContact CA-O 3.06Å; C969-F1038 HydrophobicContact CB-CB 4.28Å; C969-F1038 HydrophobicContact CB-CD1 4.26Å; C969-F1038 PolarHBondContact N-O 3.13Å; C969-F1038 PolarHBondContact O-N 2.96Å; W971-F1038 HydrophobicContact CH2-CB 4.32Å; W971-F1038 HydrophobicContact CZ3-CB 3.82Å; L990-F1038 HydrophobicContact CD1-CD2 4.2Å; L990-F1038 HydrophobicContact CD1-CE2 3.98Å; L990-F1038 HydrophobicContact CD2-CD2 4.38Å; L990-F1038 HydrophobicContact CD2-CE2 3.58Å; L990-F1038 HydrophobicContact CD2-CZ 4.16Å; L990-F1038 HydrophobicContact CG-CE2 4.43Å; F1001-F1038 WeakPolarHBondContact O-CA 3.41Å; F1001-F1038 WeakPolarHBondContact O-CD2 3.37Å; I1002-F1038 HydrophobicContact CG1-CB 4.2Å; F1038-F1049 HydrophobicContact CB-CE1 3.84Å; F1038-F1049 HydrophobicContact CB-CZ 4.22Å; F1038-F1049 HydrophobicContact CD1-CE1 4.45Å; F1038-F1049 AromaticContact CD2-CE1 3.92Å; F1038-F1049 HydrophobicContact CD2-CE1 3.92Å; F1038-F1049 AromaticContact CG-CE1 3.79Å; F1038-F1049 HydrophobicContact CG-CE1 3.79Å
1039	Y	91.9	Very high	89.6	Confident	83 Å²	83	42.3 Å²	42.3	33%	0.325	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	133.7	174.7	-173.6	-90.7	0	0	0	110	K967 N968 D1000 F1001 D1041	K967-Y1039 CarbonylContact O-C 3.43Å; K967-Y1039 WeakPolarHBondContact O-CA 3.27Å; N968-Y1039 HydrophobicContact CB-CD2 4.28Å; D1000-Y1039 VanDerWaalsContact CA-O 3.31Å; D1000-Y1039 WeakPolarHBondContact CA-O 3.22Å; F1001-Y1039 HydrophobicContact CD1-CD1 4.34Å; F1001-Y1039 AromaticContact CE1-CD1 3.6Å; F1001-Y1039 HydrophobicContact CE1-CD1 3.6Å; F1001-Y1039 HydrophobicContact CE1-CE1 4.45Å; F1001-Y1039 AromaticContact CE1-CG 3.95Å; F1001-Y1039 HydrophobicContact CE1-CG 3.95Å; F1001-Y1039 HydrophobicContact CE2-CG 4.27Å; F1001-Y1039 VanDerWaalsContact CZ-CB 3.42Å; F1001-Y1039 AromaticContact CZ-CD1 3.83Å; F1001-Y1039 HydrophobicContact CZ-CD1 3.83Å; F1001-Y1039 HydrophobicContact CZ-CD2 4.5Å; F1001-Y1039 AromaticContact CZ-CG 3.68Å; F1001-Y1039 HydrophobicContact CZ-CG 3.68Å; F1001-Y1039 PolarHBondContact N-O 3.33Å; F1001-Y1039 PolarHBondContact O-N 2.96Å; Y1039-D1041 HydrophobicContact CE1-CB 4.11Å
1040	S	91.2	Very high	89.9	Confident	0 Å²	0	47 Å²	47	0%	0	24%	0.236	C	C	.	.			trans	-116.4	143.1	163	64.1	0	0	0	0	111.5	P964 K966 K967 D1000	P964-S1040 PolarHBondContact O-OG 3.42Å; K966-S1040 WeakPolarHBondContact CA-O 3.08Å; K966-S1040 PolarHBondContact N-O 2.98Å; K966-S1040 PolarHBondContact N-OG 3.22Å; K967-S1040 PolarHBondContact N-OG 3.01Å; K967-S1040 PolarHBondContact O-N 3.34Å; D1000-S1040 WeakPolarHBondContact OD1-CA 3.48Å
1041	D	90.5	Very high	90.6	Very high	29 Å²	29	40 Å²	40	16%	0.155	20%	0.203	C	C	.	.			trans	-87.3	-172.3	174.7	99.1	1.6	0	0	0	111.8	P965 K966 D1000 Y1039 S1043	P965-D1041 CarbonylContact C-O 3.19Å; P965-D1041 WeakPolarHBondContact CA-O 3.46Å; P965-D1041 WeakPolarHBondContact CB-O 3.09Å; K966-D1041 PolarHBondContact N-O 3.21Å; D1000-D1041 PolarHBondContact OD1-N 2.03Å; Y1039-D1041 HydrophobicContact CE1-CB 4.11Å; D1041-S1043 PolarHBondContact O-N 3.48Å; D1041-S1043 VanDerWaalsContact OD1-CA 3.3Å; D1041-S1043 WeakPolarHBondContact OD1-CA 3.45Å; D1041-S1043 WeakPolarHBondContact OD1-CB 3.39Å; D1041-S1043 PolarHBondContact OD1-N 2.76Å; D1041-S1043 PolarHBondContact OD1-OG 3.33Å
1042	T	87.6	Confident	91	Very high	102 Å²	102	40 Å²	40	63%	0.626	20%	0.203	S	C	*	.	S	Bend	trans	-71.7	-0.2	-179.7	46.9	0	0	0	0	115.3	K966	K966-T1042 HydrophobicContact CB-CG2 4.29Å; K966-T1042 HydrophobicContact CD-CG2 4.06Å; K966-T1042 HydrophobicContact CG-CG2 4.27Å
1043	S	86	Confident	91.3	Very high	49 Å²	49	37.4 Å²	37.4	34%	0.343	19%	0.189	S	C	.	.	S	Bend	trans	-115.9	-136.4	-158.7	-34.7	0	0	0	0	112.2	D1041 Q1045	D1041-S1043 PolarHBondContact O-N 3.48Å; D1041-S1043 VanDerWaalsContact OD1-CA 3.3Å; D1041-S1043 WeakPolarHBondContact OD1-CA 3.45Å; D1041-S1043 WeakPolarHBondContact OD1-CB 3.39Å; D1041-S1043 PolarHBondContact OD1-N 2.76Å; D1041-S1043 PolarHBondContact OD1-OG 3.33Å; S1043-Q1045 PolarHBondContact O-N 3.08Å; S1043-Q1045 VanDerWaalsContact O-N 3.11Å; S1043-Q1045 PolarHBondContact O-NE2 2.7Å
1044	V	83.9	Confident	91.3	Very high	78 Å²	78	38.8 Å²	38.8	47%	0.473	20%	0.195	S	C	.	.			trans	-71.2	104.7	-155.4	-177.3	0	0	0	0	112.3	E991	E991-V1044 HydrophobicContact CG-CB 4.49Å; E991-V1044 WeakPolarHBondContact OE1-CB 3.18Å; E991-V1044 WeakPolarHBondContact OE1-CG2 3.44Å; E991-V1044 WeakPolarHBondContact OE2-CB 3.35Å; E991-V1044 PolarHBondContact OE2-N 3.16Å
1045	Q	89.3	Confident	91.1	Very high	74 Å²	74	40.4 Å²	40.4	35%	0.346	21%	0.205	S	C	.	.			trans	-76.7	146.7	177.8	-44.5	95.5	33.2	0	0	112.3	L962 Y963 P965 S1043	L962-Q1045 HydrophobicContact CB-CB 4.15Å; Y963-Q1045 HydrophobicContact CD2-CB 4.18Å; Y963-Q1045 HydrophobicContact CD2-CG 4.47Å; Y963-Q1045 HydrophobicContact CE2-CB 4.08Å; Y963-Q1045 HydrophobicContact CE2-CG 4.48Å; Y963-Q1045 VanDerWaalsContact O-CB 3.29Å; Y963-Q1045 WeakPolarHBondContact O-CB 3.37Å; Y963-Q1045 VanDerWaalsContact O-CG 3.26Å; Y963-Q1045 WeakPolarHBondContact O-CG 3.33Å; P965-Q1045 HydrophobicContact CB-CG 4.24Å; P965-Q1045 HydrophobicContact CG-CG 4.47Å; S1043-Q1045 PolarHBondContact O-N 3.08Å; S1043-Q1045 VanDerWaalsContact O-N 3.11Å; S1043-Q1045 PolarHBondContact O-NE2 2.7Å
1046	R	92.5	Very high	90.6	Very high	91 Å²	91	40.7 Å²	40.7	34%	0.343	21%	0.205	S	C	.	.			trans	-130.4	-177.9	177.1	-66.2	-148.1	172.3	-162.1	-0.9	111.2	L962 Y963 N989 D1021 G1048	L962-R1046 VanDerWaalsContact CA-O 3.29Å; L962-R1046 WeakPolarHBondContact CA-O 3.43Å; L962-R1046 VanDerWaalsContact CD2-C 3.44Å; Y963-R1046 WeakPolarHBondContact CD1-O 3.45Å; Y963-R1046 VanDerWaalsContact CE1-C 3.47Å; Y963-R1046 HydrophobicContact CE1-CB 3.83Å; Y963-R1046 WeakPolarHBondContact CE1-O 3.39Å; Y963-R1046 PolarHBondContact N-O 3.15Å; Y963-R1046 VanDerWaalsContact N-O 3.17Å; Y963-R1046 PolarHBondContact OH-N 3.49Å; N989-R1046 WeakPolarHBondContact O-CB 3.46Å; N989-R1046 WeakPolarHBondContact OD1-CD 3.2Å; N989-R1046 PolarHBondContact OD1-NH1 2.76Å; D1021-R1046 IonicContact OD2-NH1 3.69Å; R1046-G1048 PolarHBondContact O-N 2.93Å
1047	T	93	Very high	90.1	Very high	38 Å²	38	46.3 Å²	46.3	23%	0.233	23%	0.227	C	C	.	.			trans	-75.9	1.5	-176.6	55.2	0	0	0	0	114.4	F959 L962 H987 N989	F959-T1047 VanDerWaalsContact CD2-O 3.3Å; F959-T1047 WeakPolarHBondContact CD2-O 3.32Å; L962-T1047 HydrophobicContact CD2-CG2 4.12Å; H987-T1047 PolarHBondContact NE2-OG1 2.65Å; N989-T1047 PolarHBondContact ND2-OG1 3.35Å
1048	G	92.6	Very high	89.3	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	76.9	-145.1	167.3	0	0	0	0	0	113.8	T956 Y963 H987 F988 N989 R1046	T956-G1048 WeakPolarHBondContact OG1-CA 3.25Å; Y963-G1048 VanDerWaalsContact CD1-CA 3.45Å; H987-G1048 PolarHBondContact CD2-O 2.74Å; H987-G1048 VanDerWaalsContact CD2-O 3.32Å; F988-G1048 CarbonylContact C-O 3.51Å; N989-G1048 PolarHBondContact N-O 2.73Å; N989-G1048 WeakPolarHBondContact O-CA 3.32Å; N989-G1048 PolarHBondContact O-N 3.36Å; R1046-G1048 PolarHBondContact O-N 2.93Å
1049	F	94.5	Very high	88.8	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	160	-179.9	68.9	-97.8	0	0	0	112.3	I954 Q955 T956 W971 F985 H987 F988 I1002 F1038	I954-F1049 HydrophobicContact CD1-CE2 4.31Å; I954-F1049 HydrophobicContact CG1-CE2 4.28Å; Q955-F1049 VanDerWaalsContact CA-O 3.25Å; Q955-F1049 WeakPolarHBondContact CA-O 3.24Å; T956-F1049 HydrophobicContact CG2-CD1 3.45Å; T956-F1049 VanDerWaalsContact CG2-CD1 3.45Å; T956-F1049 HydrophobicContact CG2-CE1 3.44Å; T956-F1049 VanDerWaalsContact CG2-CE1 3.44Å; T956-F1049 HydrophobicContact CG2-CG 4.15Å; T956-F1049 HydrophobicContact CG2-CZ 4.16Å; T956-F1049 PolarHBondContact N-O 2.94Å; T956-F1049 PolarHBondContact OG1-N 3.1Å; T956-F1049 PolarHBondContact OG1-O 3.14Å; W971-F1049 AromaticContact CH2-CZ 3.79Å; W971-F1049 HydrophobicContact CH2-CZ 3.79Å; W971-F1049 AromaticContact CZ3-CZ 3.76Å; W971-F1049 HydrophobicContact CZ3-CZ 3.76Å; F985-F1049 HydrophobicContact CD1-CB 4.22Å; F985-F1049 HydrophobicContact CD1-CD2 4.3Å; F985-F1049 HydrophobicContact CD1-CG 4.46Å; F985-F1049 HydrophobicContact CE1-CB 4.38Å; F985-F1049 AromaticContact CE1-CD2 3.94Å; F985-F1049 HydrophobicContact CE1-CD2 3.94Å; F985-F1049 HydrophobicContact CE1-CG 4.16Å; H987-F1049 WeakPolarHBondContact O-CA 3.42Å; H987-F1049 WeakPolarHBondContact O-CB 3.47Å; F988-F1049 HydrophobicContact CD2-CB 3.64Å; F988-F1049 HydrophobicContact CD2-CG 4.43Å; F988-F1049 HydrophobicContact CE2-CB 4.16Å; F988-F1049 HydrophobicContact CG-CB 4.48Å; I1002-F1049 HydrophobicContact CD1-CD1 4.07Å; I1002-F1049 HydrophobicContact CD1-CD2 4.37Å; I1002-F1049 HydrophobicContact CD1-CE1 3.51Å; I1002-F1049 HydrophobicContact CD1-CE2 3.85Å; I1002-F1049 HydrophobicContact CD1-CG 4.49Å; I1002-F1049 HydrophobicContact CD1-CZ 3.39Å; I1002-F1049 HydrophobicContact CG1-CE1 4.2Å; I1002-F1049 HydrophobicContact CG1-CZ 4.38Å; F1038-F1049 HydrophobicContact CB-CE1 3.84Å; F1038-F1049 HydrophobicContact CB-CZ 4.22Å; F1038-F1049 HydrophobicContact CD1-CE1 4.45Å; F1038-F1049 AromaticContact CD2-CE1 3.92Å; F1038-F1049 HydrophobicContact CD2-CE1 3.92Å; F1038-F1049 AromaticContact CG-CE1 3.79Å; F1038-F1049 HydrophobicContact CG-CE1 3.79Å
1050	R	94.4	Very high	88.4	Confident	100 Å²	100	46.7 Å²	46.7	38%	0.377	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	115.5	164.9	-174.1	-171.9	74.5	169.5	4.8	110.1	T953 I954 Q955 F959 T986 H987	T953-R1050 HydrophobicContact CG2-CG 3.6Å; I954-R1050 CarbonylContact O-C 3.56Å; I954-R1050 WeakPolarHBondContact O-CA 3.16Å; Q955-R1050 HydrophobicContact CB-CB 4.19Å; Q955-R1050 HydrophobicContact CB-CG 4.07Å; F959-R1050 HydrophobicContact CD1-CB 4.24Å; F959-R1050 HydrophobicContact CE1-CB 3.91Å; F959-R1050 HydrophobicContact CE1-CG 4.39Å; F959-R1050 HydrophobicContact CE2-CB 4.21Å; F959-R1050 HydrophobicContact CZ-CB 3.9Å; T986-R1050 PolarHBondContact N-O 2.7Å; T986-R1050 PolarHBondContact OG1-NE 3.31Å; T986-R1050 PolarHBondContact OG1-NH2 3.44Å; T986-R1050 PolarHBondContact OG1-O 2.82Å; H987-R1050 PolarHBondContact N-O 3.44Å; H987-R1050 PolarHBondContact O-N 3.18Å
1051	A	94.3	Very high	87.6	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	141.3	178.2	0	0	0	0	0	111.4	T953 I954 L983 N984 F985	T953-A1051 CarbonylContact C-O 3.58Å; T953-A1051 WeakPolarHBondContact CA-O 3.41Å; T953-A1051 WeakPolarHBondContact CG2-O 3.2Å; I954-A1051 HydrophobicContact CD1-CB 4.35Å; I954-A1051 HydrophobicContact CG1-CB 3.91Å; I954-A1051 PolarHBondContact N-O 2.87Å; I954-A1051 PolarHBondContact O-N 3.45Å; L983-A1051 HydrophobicContact CD1-CB 3.69Å; L983-A1051 HydrophobicContact CG-CB 4.3Å; N984-A1051 CarbonylContact O-C 3.44Å; N984-A1051 VanDerWaalsContact O-CA 3.28Å; N984-A1051 WeakPolarHBondContact O-CA 3.3Å; F985-A1051 HydrophobicContact CD1-CB 3.67Å; F985-A1051 HydrophobicContact CE1-CB 3.85Å; F985-A1051 HydrophobicContact CG-CB 4.08Å; F985-A1051 HydrophobicContact CZ-CB 4.39Å
1052	V	94.3	Very high	86.7	Confident	52 Å²	52	50.8 Å²	50.8	32%	0.315	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	139	174.4	-164.8	0	0	0	0	107.3	G952 T953 N984 T986	G952-V1052 WeakPolarHBondContact O-CA 3.46Å; G952-V1052 VanDerWaalsContact O-CG1 3.32Å; G952-V1052 WeakPolarHBondContact O-CG1 3.04Å; T953-V1052 HydrophobicContact CG2-CG2 4.49Å; N984-V1052 PolarHBondContact N-O 3Å; N984-V1052 PolarHBondContact O-N 3.28Å; T986-V1052 HydrophobicContact CG2-CG2 3.71Å
1053	F	92.3	Very high	86.4	Confident	1 Å²	1	52.8 Å²	52.8	0%	0.004	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	155.5	175.7	73.1	-92.5	0	0	0	111.7	I947 N951 G952 I954 I973 I981 F982 L983	I947-F1053 HydrophobicContact CD1-CE1 4.32Å; I947-F1053 HydrophobicContact CG2-CE1 4.33Å; I947-F1053 HydrophobicContact CG2-CZ 3.71Å; N951-F1053 VanDerWaalsContact CA-O 3.26Å; N951-F1053 WeakPolarHBondContact CA-O 3.28Å; N951-F1053 WeakPolarHBondContact CB-O 2.93Å; G952-F1053 VanDerWaalsContact C-CE1 3.43Å; G952-F1053 VanDerWaalsContact CA-CE1 3.44Å; G952-F1053 PolarHBondContact N-O 2.71Å; G952-F1053 PolarHBondContact O-N 3.28Å; I954-F1053 HydrophobicContact CG2-CD1 4.49Å; I954-F1053 HydrophobicContact CG2-CE1 4.36Å; I973-F1053 HydrophobicContact CD1-CB 4.22Å; I973-F1053 HydrophobicContact CD1-CD1 3.69Å; I973-F1053 HydrophobicContact CD1-CD2 4.16Å; I973-F1053 HydrophobicContact CD1-CE1 4.08Å; I973-F1053 HydrophobicContact CD1-CG 3.75Å; I973-F1053 HydrophobicContact CD1-CZ 4.49Å; I973-F1053 HydrophobicContact CG1-CE1 4.42Å; I973-F1053 HydrophobicContact CG2-CD2 3.91Å; I973-F1053 HydrophobicContact CG2-CE2 3.73Å; I973-F1053 HydrophobicContact CG2-CZ 4.26Å; I981-F1053 HydrophobicContact CG2-CB 4.41Å; I981-F1053 HydrophobicContact CG2-CD2 4.5Å; F982-F1053 CarbonylContact O-C 3.55Å; F982-F1053 WeakPolarHBondContact O-CA 3.47Å; F982-F1053 WeakPolarHBondContact O-CB 3.35Å; L983-F1053 HydrophobicContact CD1-CB 3.99Å
1054	F	90.1	Very high	86.2	Confident	66 Å²	66	53.1 Å²	53.1	29%	0.289	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	155	172	55.1	-96.6	0	0	0	110.6	S950 N951 F982 I1075	S950-F1054 CarbonylContact O-C 3.57Å; S950-F1054 WeakPolarHBondContact O-CA 3.3Å; N951-F1054 HydrophobicContact CB-CB 3.93Å; F982-F1054 HydrophobicContact CB-CD2 3.86Å; F982-F1054 HydrophobicContact CB-CE1 4.28Å; F982-F1054 HydrophobicContact CB-CE2 3.37Å; F982-F1054 HydrophobicContact CB-CG 4.48Å; F982-F1054 HydrophobicContact CB-CZ 3.62Å; F982-F1054 AromaticContact CD1-CE1 3.83Å; F982-F1054 HydrophobicContact CD1-CE1 3.83Å; F982-F1054 AromaticContact CD1-CE2 3.97Å; F982-F1054 HydrophobicContact CD1-CE2 3.97Å; F982-F1054 AromaticContact CD1-CZ 3.3Å; F982-F1054 HydrophobicContact CD1-CZ 3.3Å; F982-F1054 HydrophobicContact CE1-CZ 4.09Å; F982-F1054 HydrophobicContact CG-CE1 4.4Å; F982-F1054 AromaticContact CG-CE2 3.76Å; F982-F1054 HydrophobicContact CG-CE2 3.76Å; F982-F1054 AromaticContact CG-CZ 3.61Å; F982-F1054 HydrophobicContact CG-CZ 3.61Å; F982-F1054 PolarHBondContact N-O 2.8Å; F982-F1054 PolarHBondContact O-N 2.86Å; F1054-I1075 HydrophobicContact CE2-CG2 3.47Å; F1054-I1075 VanDerWaalsContact CE2-CG2 3.47Å; F1054-I1075 HydrophobicContact CZ-CG2 3.79Å
1055	T	86.5	Confident	85.9	Confident	35 Å²	35	49.8 Å²	49.8	22%	0.215	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	135	177.4	57.6	0	0	0	0	111.4	S950 A975 T980 I981	S950-T1055 WeakPolarHBondContact CB-OG1 3.46Å; S950-T1055 PolarHBondContact O-N 3.49Å; S950-T1055 PolarHBondContact O-OG1 3.38Å; S950-T1055 VanDerWaalsContact O-OG1 3.12Å; A975-T1055 HydrophobicContact CB-CG2 3.42Å; A975-T1055 VanDerWaalsContact CB-CG2 3.42Å; T980-T1055 CarbonylContact O-C 3.47Å; T980-T1055 VanDerWaalsContact O-CA 3.23Å; T980-T1055 WeakPolarHBondContact O-CA 3.39Å; I981-T1055 HydrophobicContact CG1-CG2 4.44Å
1056	D	82.4	Confident	85.5	Confident	12 Å²	12	48.2 Å²	48.2	6%	0.064	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	141	172.2	-172.5	46.9	0	0	0	109.6	T979 T980 N1073 G1076	T979-D1056 CarbonylContact C-O 3.58Å; T979-D1056 WeakPolarHBondContact CA-O 3.34Å; T979-D1056 WeakPolarHBondContact CB-O 3.3Å; T980-D1056 PolarHBondContact N-O 3.42Å; T980-D1056 PolarHBondContact O-N 2.96Å; D1056-N1073 PolarHBondContact OD2-ND2 3.41Å; D1056-G1076 PolarHBondContact OD1-N 3.34Å
1057	R	79.9	Confident	85.2	Confident	120 Å²	120	44.2 Å²	44.2	45%	0.453	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	125.9	177.6	-177.9	-174.3	174.9	-179	-0.4	108.8	T979 E1059 D1062 N1073	T979-R1057 HydrophobicContact CG2-CB 4.21Å; T979-R1057 HydrophobicContact CG2-CG 4.5Å; R1057-E1059 VanDerWaalsContact C-N 3.3Å; R1057-E1059 HydrophobicContact CB-CG 4.36Å; R1057-E1059 HydrophobicContact CG-CG 4.16Å; R1057-E1059 PolarHBondContact O-N 3.08Å; R1057-D1062 IonicContact CZ-OD2 2.75Å; R1057-D1062 IonicContact NE-OD2 2.78Å; R1057-D1062 IonicContact NH2-OD2 2.71Å; R1057-D1062 PolarHBondContact NH2-OD2 2.93Å; R1057-N1073 PolarHBondContact O-OD1 3.29Å
1058	D	74.4	Confident	84.7	Confident	59 Å²	59	47.2 Å²	47.2	32%	0.316	25%	0.253	S	S	.	.			trans	-73.3	90	168.7	-173.2	3.9	0	0	0	110.3	C1060 A1061	D1058-C1060 PolarHBondContact O-N 2.85Å; D1058-C1060 WeakPolarHBondContact OD1-CA 3.22Å; D1058-C1060 WeakPolarHBondContact OD1-CB 3.36Å; D1058-C1060 PolarHBondContact OD1-N 3.23Å; D1058-A1061 HydrophobicContact CB-CB 4.27Å; D1058-A1061 WeakPolarHBondContact O-CB 3.28Å; D1058-A1061 PolarHBondContact O-N 3.33Å; D1058-A1061 PolarHBondContact OD1-N 2.9Å
1059	E	83.7	Confident	84.3	Confident	54 Å²	54	49 Å²	49	25%	0.252	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-12.6	177	-70.7	145.6	172.8	0	0	112.2	R1057 G1065 S1077 Y1078	R1057-E1059 VanDerWaalsContact C-N 3.3Å; R1057-E1059 HydrophobicContact CB-CG 4.36Å; R1057-E1059 HydrophobicContact CG-CG 4.16Å; R1057-E1059 PolarHBondContact O-N 3.08Å; E1059-G1065 VanDerWaalsContact O-CA 3.23Å; E1059-G1065 WeakPolarHBondContact O-CA 3.42Å; E1059-G1065 PolarHBondContact O-N 3.07Å; E1059-S1077 WeakPolarHBondContact OE2-CA 3.32Å; E1059-Y1078 HydrophobicContact CB-CD1 3.4Å; E1059-Y1078 VanDerWaalsContact CB-CD1 3.4Å; E1059-Y1078 HydrophobicContact CB-CE1 4.03Å; E1059-Y1078 HydrophobicContact CB-CG 4.03Å; E1059-Y1078 HydrophobicContact CG-CD1 4.2Å; E1059-Y1078 WeakPolarHBondContact OE2-CD1 3.29Å; E1059-Y1078 PolarHBondContact OE2-N 2.82Å
1060	C	82.3	Confident	83.8	Confident	20 Å²	20	52 Å²	52	14%	0.135	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-24.8	170.9	-55.3	0	0	0	0	112.9	D1058 D1062 N1064 C1071 R1072 N1073	D1058-C1060 PolarHBondContact O-N 2.85Å; D1058-C1060 WeakPolarHBondContact OD1-CA 3.22Å; D1058-C1060 WeakPolarHBondContact OD1-CB 3.36Å; D1058-C1060 PolarHBondContact OD1-N 3.23Å; C1060-D1062 VanDerWaalsContact C-N 3.28Å; C1060-D1062 PolarHBondContact O-N 3.38Å; C1060-N1064 WeakPolarHBondContact O-CA 3.05Å; C1060-N1064 PolarHBondContact O-N 3.15Å; C1060-C1071 WeakPolarHBondContact CA-SG 3.41Å; C1060-C1071 HydrophobicContact CB-CB 3.44Å; C1060-C1071 VanDerWaalsContact CB-CB 3.44Å; C1060-C1071 WeakPolarHBondContact CB-SG 3.19Å; C1060-C1071 WeakPolarHBondContact SG-CB 3.36Å; C1060-C1071 CovalentContact SG-SG 2.02Å; C1060-C1071 PolarHBondContact SG-SG 3.11Å; C1060-R1072 VanDerWaalsContact SG-C 3.54Å; C1060-R1072 PolarHBondContact SG-N 2.99Å; C1060-R1072 VanDerWaalsContact SG-N 3.42Å; C1060-N1073 PolarHBondContact SG-N 3.39Å
1061	A	75.2	Confident	83.3	Confident	63 Å²	63	48 Å²	48	52%	0.521	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-31.7	178.9	0	0	0	0	0	112.7	D1058	D1058-A1061 HydrophobicContact CB-CB 4.27Å; D1058-A1061 WeakPolarHBondContact O-CB 3.28Å; D1058-A1061 PolarHBondContact O-N 3.33Å; D1058-A1061 PolarHBondContact OD1-N 2.9Å
1062	D	72.4	Confident	82.8	Confident	52 Å²	52	55 Å²	55	28%	0.278	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95	105.5	176.6	-71.8	-40.9	0	0	0	110.5	K978 R1057 C1060 N1064 G1065	K978-D1062 IonicContact NZ-OD1 3.68Å; K978-D1062 PolarHBondContact NZ-OD1 2.94Å; K978-D1062 IonicContact NZ-OD2 2.6Å; R1057-D1062 IonicContact CZ-OD2 2.75Å; R1057-D1062 IonicContact NE-OD2 2.78Å; R1057-D1062 IonicContact NH2-OD2 2.71Å; R1057-D1062 PolarHBondContact NH2-OD2 2.93Å; C1060-D1062 VanDerWaalsContact C-N 3.28Å; C1060-D1062 PolarHBondContact O-N 3.38Å; D1062-N1064 VanDerWaalsContact C-N 3.29Å; D1062-N1064 PolarHBondContact O-N 3.04Å; D1062-G1065 PolarHBondContact O-N 3.33Å; D1062-G1065 VanDerWaalsContact O-N 3.17Å
1063	N	81.2	Confident	81.8	Confident	145 Å²	145	54.9 Å²	54.9	78%	0.775	29%	0.288	S	S	*	.	G	3₁₀ helix	trans	53.7	37.2	177.1	-169.1	50	0	0	0	114.4	G1065 G1066	N1063-G1065 PolarHBondContact O-N 2.91Å; N1063-G1065 VanDerWaalsContact O-N 3.14Å; N1063-G1066 PolarHBondContact O-N 3.19Å
1064	N	82	Confident	80.9	Confident	55 Å²	55	57.8 Å²	57.8	29%	0.294	31%	0.306	S	S	.	.	G	3₁₀ helix	trans	54.5	31.6	-179.1	-160.8	37	0	0	0	112.6	C1060 D1062 G1066 C1067 H1069 C1071	C1060-N1064 WeakPolarHBondContact O-CA 3.05Å; C1060-N1064 PolarHBondContact O-N 3.15Å; D1062-N1064 VanDerWaalsContact C-N 3.29Å; D1062-N1064 PolarHBondContact O-N 3.04Å; N1064-G1066 PolarHBondContact O-N 3.42Å; N1064-C1067 PolarHBondContact ND2-O 3.31Å; N1064-C1067 WeakPolarHBondContact O-CB 3.36Å; N1064-C1067 PolarHBondContact O-N 3.23Å; N1064-C1067 PolarHBondContact O-SG 2.92Å; N1064-C1067 VanDerWaalsContact O-SG 3.39Å; N1064-H1069 PolarHBondContact ND2-O 2.67Å; N1064-C1071 VanDerWaalsContact O-CB 3.24Å; N1064-C1071 WeakPolarHBondContact O-CB 2.97Å; N1064-C1071 VanDerWaalsContact OD1-CB 3.23Å; N1064-C1071 WeakPolarHBondContact OD1-CB 3.37Å; N1064-C1071 PolarHBondContact OD1-N 3.25Å; N1064-C1071 VanDerWaalsContact OD1-N 3.08Å
1065	G	76.4	Confident	80	Confident	9 Å²	9	59.5 Å²	59.5	9%	0.093	32%	0.317	C	S	.	.	G	3₁₀ helix	trans	60.4	13.7	-173.5	0	0	0	0	0	114.8	E1059 D1062 N1063 C1067 Y1078	E1059-G1065 VanDerWaalsContact O-CA 3.23Å; E1059-G1065 WeakPolarHBondContact O-CA 3.42Å; E1059-G1065 PolarHBondContact O-N 3.07Å; D1062-G1065 PolarHBondContact O-N 3.33Å; D1062-G1065 VanDerWaalsContact O-N 3.17Å; N1063-G1065 PolarHBondContact O-N 2.91Å; N1063-G1065 VanDerWaalsContact O-N 3.14Å; G1065-C1067 PolarHBondContact O-N 3.38Å; G1065-Y1078 WeakPolarHBondContact O-CE2 3.3Å; G1065-Y1078 PolarHBondContact O-OH 3.26Å
1066	G	80.9	Confident	79.2	Confident	40 Å²	40	60.8 Å²	60.8	41%	0.412	34%	0.338	S	S	.	.	G	3₁₀ helix	trans	73.3	6.4	-167.1	0	0	0	0	0	114.6	N1063 N1064	N1063-G1066 PolarHBondContact O-N 3.19Å; N1064-G1066 PolarHBondContact O-N 3.42Å
1067	C	85.6	Confident	79	Confident	8 Å²	8	63 Å²	63	5%	0.054	36%	0.355	C	S	.	.			trans	-70.7	138.6	172.8	-55.5	0	0	0	0	110.9	N1064 G1065 L1070 C1071 C1080	N1064-C1067 PolarHBondContact ND2-O 3.31Å; N1064-C1067 WeakPolarHBondContact O-CB 3.36Å; N1064-C1067 PolarHBondContact O-N 3.23Å; N1064-C1067 PolarHBondContact O-SG 2.92Å; N1064-C1067 VanDerWaalsContact O-SG 3.39Å; G1065-C1067 PolarHBondContact O-N 3.38Å; C1067-L1070 WeakPolarHBondContact CB-O 3.39Å; C1067-C1071 HydrophobicContact CB-CB 4.04Å; C1067-C1071 VanDerWaalsContact SG-CB 3.6Å; C1067-C1080 WeakPolarHBondContact CA-SG 3.33Å; C1067-C1080 HydrophobicContact CB-CB 3.62Å; C1067-C1080 WeakPolarHBondContact CB-SG 3.31Å; C1067-C1080 WeakPolarHBondContact SG-CA 3.41Å; C1067-C1080 WeakPolarHBondContact SG-CB 3.25Å; C1067-C1080 CovalentContact SG-SG 2.03Å; C1067-C1080 PolarHBondContact SG-SG 3.04Å
1068	Q	83.2	Confident	79.2	Confident	100 Å²	100	60.2 Å²	60.2	47%	0.467	34%	0.344	S	S	.	.	S	Bend	trans	-68.9	-41.4	-178.3	-167.1	-168.8	-49.6	0	0	112.7	Y1092 C1094	Q1068-Y1092 WeakPolarHBondContact CB-O 3.22Å; Q1068-Y1092 PolarHBondContact N-O 3.4Å; Q1068-C1094 HydrophobicContact CB-CB 4.36Å; Q1068-C1094 PolarHBondContact NE2-O 3.43Å; Q1068-C1094 PolarHBondContact OE1-O 3.41Å
1069	H	84.7	Confident	79.8	Confident	37 Å²	37	61.5 Å²	61.5	17%	0.171	35%	0.348	C	S	.	.	S	Bend	trans	-113.2	-73.2	-173.2	-78.1	-163.5	0	0	0	113.3	N1064 R1083 F1086 C1094	N1064-H1069 PolarHBondContact ND2-O 2.67Å; H1069-R1083 HydrophobicContact CB-CG 4.19Å; H1069-F1086 AromaticContact CE1-CD1 3.31Å; H1069-F1086 WeakPolarHBondContact CE1-CD1 3.39Å; H1069-F1086 AromaticContact CE1-CD2 3.62Å; H1069-F1086 AromaticContact CE1-CE1 3.65Å; H1069-F1086 AromaticContact CE1-CE2 3.95Å; H1069-F1086 AromaticContact CE1-CG 3.33Å; H1069-F1086 WeakPolarHBondContact CE1-CG 3.47Å; H1069-F1086 AromaticContact CE1-CZ 3.97Å; H1069-F1086 AromaticContact ND1-CD2 3.98Å; H1069-F1086 AromaticContact ND1-CG 3.72Å; H1069-C1094 HydrophobicContact CB-CB 4.13Å
1070	L	83.2	Confident	79.8	Confident	63 Å²	63	59.5 Å²	59.5	33%	0.33	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	139.1	173.4	-90	74.3	0	0	0	109.3	C1067 C1080 A1081 R1083	C1067-L1070 WeakPolarHBondContact CB-O 3.39Å; L1070-C1080 WeakPolarHBondContact O-CA 3.47Å; L1070-A1081 WeakPolarHBondContact CA-O 3.1Å; L1070-A1081 HydrophobicContact CB-CB 4.16Å; L1070-A1081 WeakPolarHBondContact CB-O 3.38Å; L1070-A1081 PolarHBondContact N-O 3.35Å; L1070-A1081 PolarHBondContact O-N 3.47Å; L1070-R1083 HydrophobicContact CD1-CG 3.45Å; L1070-R1083 VanDerWaalsContact CD1-CG 3.45Å
1071	C	85	Confident	79.8	Confident	17 Å²	17	59.6 Å²	59.6	12%	0.115	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	146	155.6	-176.9	0	0	0	0	109	C1060 N1064 C1067 Y1078	C1060-C1071 WeakPolarHBondContact CA-SG 3.41Å; C1060-C1071 HydrophobicContact CB-CB 3.44Å; C1060-C1071 VanDerWaalsContact CB-CB 3.44Å; C1060-C1071 WeakPolarHBondContact CB-SG 3.19Å; C1060-C1071 WeakPolarHBondContact SG-CB 3.36Å; C1060-C1071 CovalentContact SG-SG 2.02Å; C1060-C1071 PolarHBondContact SG-SG 3.11Å; N1064-C1071 VanDerWaalsContact O-CB 3.24Å; N1064-C1071 WeakPolarHBondContact O-CB 2.97Å; N1064-C1071 VanDerWaalsContact OD1-CB 3.23Å; N1064-C1071 WeakPolarHBondContact OD1-CB 3.37Å; N1064-C1071 PolarHBondContact OD1-N 3.25Å; N1064-C1071 VanDerWaalsContact OD1-N 3.08Å; C1067-C1071 HydrophobicContact CB-CB 4.04Å; C1067-C1071 VanDerWaalsContact SG-CB 3.6Å; C1071-Y1078 WeakPolarHBondContact SG-CD2 3.47Å
1072	R	82.1	Confident	80	Confident	147 Å²	147	57.9 Å²	57.9	56%	0.555	33%	0.326	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-127.6	111.4	172.5	-77.8	-175.8	166.5	-162.5	-5.6	108.3	C1060 Y1078 H1079	C1060-R1072 VanDerWaalsContact SG-C 3.54Å; C1060-R1072 PolarHBondContact SG-N 2.99Å; C1060-R1072 VanDerWaalsContact SG-N 3.42Å; R1072-Y1078 WeakPolarHBondContact O-CA 3.41Å; R1072-H1079 WeakPolarHBondContact CB-CE1 3.38Å; R1072-H1079 PolarHBondContact N-O 3.28Å; R1072-H1079 PolarHBondContact O-N 2.96Å; R1072-H1079 PolarHBondContact O-ND1 3.04Å
1073	N	73.1	Confident	79.8	Confident	49 Å²	49	62.8 Å²	62.8	26%	0.262	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68	145.9	175.7	-167.1	45.4	0	0	0	110.4	D1056 R1057 C1060	D1056-N1073 PolarHBondContact OD2-ND2 3.41Å; R1057-N1073 PolarHBondContact O-OD1 3.29Å; C1060-N1073 PolarHBondContact SG-N 3.39Å
1074	T	74.1	Confident	78.8	Confident	62 Å²	62	59.3 Å²	59.3	38%	0.38	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	165	173.6	51.1	0	0	0	0	109.1	G1076 S1077	T1074-G1076 PolarHBondContact O-N 3.09Å; T1074-S1077 CarbonylContact C-O 3.5Å; T1074-S1077 VanDerWaalsContact CA-O 3.24Å; T1074-S1077 WeakPolarHBondContact CA-O 3.19Å; T1074-S1077 WeakPolarHBondContact CB-O 3.28Å; T1074-S1077 PolarHBondContact N-O 3.47Å; T1074-S1077 CarbonylContact O-C 3.58Å; T1074-S1077 PolarHBondContact O-N 3.48Å; T1074-S1077 VanDerWaalsContact O-N 3.11Å; T1074-S1077 PolarHBondContact OG1-O 3.47Å
1075	I	72.6	Confident	77.6	Confident	102 Å²	102	57 Å²	57	52%	0.523	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	109.4	-173.6	-65.4	164.1	0	0	0	111	F982 F1054	F982-I1075 HydrophobicContact CD2-CD1 3.99Å; F982-I1075 HydrophobicContact CD2-CG1 4.21Å; F982-I1075 HydrophobicContact CE1-CD1 4.1Å; F982-I1075 HydrophobicContact CE2-CD1 3.47Å; F982-I1075 VanDerWaalsContact CE2-CD1 3.47Å; F982-I1075 HydrophobicContact CE2-CG1 4.08Å; F982-I1075 HydrophobicContact CZ-CD1 3.52Å; F1054-I1075 HydrophobicContact CE2-CG2 3.47Å; F1054-I1075 VanDerWaalsContact CE2-CG2 3.47Å; F1054-I1075 HydrophobicContact CZ-CG2 3.79Å
1076	G	69.6	Low	77.3	Confident	62 Å²	62	59.2 Å²	59.2	64%	0.639	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.5	15	178.7	0	0	0	0	0	115.8	D1056 T1074	D1056-G1076 PolarHBondContact OD1-N 3.34Å; T1074-G1076 PolarHBondContact O-N 3.09Å
1077	S	77.7	Confident	76.7	Confident	60 Å²	60	61.6 Å²	61.6	42%	0.42	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-175.1	153.4	177.1	-178.6	0	0	0	0	110.5	E1059 T1074	E1059-S1077 WeakPolarHBondContact OE2-CA 3.32Å; T1074-S1077 CarbonylContact C-O 3.5Å; T1074-S1077 VanDerWaalsContact CA-O 3.24Å; T1074-S1077 WeakPolarHBondContact CA-O 3.19Å; T1074-S1077 WeakPolarHBondContact CB-O 3.28Å; T1074-S1077 PolarHBondContact N-O 3.47Å; T1074-S1077 CarbonylContact O-C 3.58Å; T1074-S1077 PolarHBondContact O-N 3.48Å; T1074-S1077 VanDerWaalsContact O-N 3.11Å; T1074-S1077 PolarHBondContact OG1-O 3.47Å
1078	Y	84.2	Confident	76	Confident	61 Å²	61	64.7 Å²	64.7	24%	0.239	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	168.3	163.5	69.1	-75.7	0	0	0	113.5	E1059 G1065 C1071 R1072 Y1092	E1059-Y1078 HydrophobicContact CB-CD1 3.4Å; E1059-Y1078 VanDerWaalsContact CB-CD1 3.4Å; E1059-Y1078 HydrophobicContact CB-CE1 4.03Å; E1059-Y1078 HydrophobicContact CB-CG 4.03Å; E1059-Y1078 HydrophobicContact CG-CD1 4.2Å; E1059-Y1078 WeakPolarHBondContact OE2-CD1 3.29Å; E1059-Y1078 PolarHBondContact OE2-N 2.82Å; G1065-Y1078 WeakPolarHBondContact O-CE2 3.3Å; G1065-Y1078 PolarHBondContact O-OH 3.26Å; C1071-Y1078 WeakPolarHBondContact SG-CD2 3.47Å; R1072-Y1078 WeakPolarHBondContact O-CA 3.41Å; Y1078-Y1092 HydrophobicContact CE2-CE1 4.13Å
1079	H	86.2	Confident	75.3	Confident	85 Å²	85	67 Å²	67	39%	0.394	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	151.4	163	67.3	-79.6	0	0	0	111.5	R1072	R1072-H1079 WeakPolarHBondContact CB-CE1 3.38Å; R1072-H1079 PolarHBondContact N-O 3.28Å; R1072-H1079 PolarHBondContact O-N 2.96Å; R1072-H1079 PolarHBondContact O-ND1 3.04Å
1080	C	85	Confident	75	Confident	13 Å²	13	68.5 Å²	68.5	9%	0.088	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	147	176.5	-55.6	0	0	0	0	111.9	C1067 L1070 L1088 R1091 Y1092	C1067-C1080 WeakPolarHBondContact CA-SG 3.33Å; C1067-C1080 HydrophobicContact CB-CB 3.62Å; C1067-C1080 WeakPolarHBondContact CB-SG 3.31Å; C1067-C1080 WeakPolarHBondContact SG-CA 3.41Å; C1067-C1080 WeakPolarHBondContact SG-CB 3.25Å; C1067-C1080 CovalentContact SG-SG 2.03Å; C1067-C1080 PolarHBondContact SG-SG 3.04Å; L1070-C1080 WeakPolarHBondContact O-CA 3.47Å; C1080-L1088 HydrophobicContact CB-CD1 3.78Å; C1080-R1091 VanDerWaalsContact CB-O 3.22Å; C1080-R1091 WeakPolarHBondContact CB-O 3.46Å; C1080-R1091 PolarHBondContact SG-O 3.22Å; C1080-Y1092 VanDerWaalsContact SG-CD1 3.56Å
1081	A	82.4	Confident	74.7	Confident	21 Å²	21	74.7 Å²	74.7	17%	0.174	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	160.8	173.1	0	0	0	0	0	109.6	L1070	L1070-A1081 WeakPolarHBondContact CA-O 3.1Å; L1070-A1081 HydrophobicContact CB-CB 4.16Å; L1070-A1081 WeakPolarHBondContact CB-O 3.38Å; L1070-A1081 PolarHBondContact N-O 3.35Å; L1070-A1081 PolarHBondContact O-N 3.47Å
1082	C	78	Confident	74.5	Confident	28 Å²	28	78.7 Å²	78.7	19%	0.189	40%	0.404	C	S	.	.			trans	-106	147.2	177.5	-60.3	0	0	0	0	111.7	F1086 L1088 C1094	C1082-F1086 HydrophobicContact CB-CB 3.9Å; C1082-F1086 WeakPolarHBondContact CB-O 3.36Å; C1082-L1088 WeakPolarHBondContact SG-CA 3.47Å; C1082-L1088 PolarHBondContact SG-N 3.21Å; C1082-C1094 WeakPolarHBondContact CA-SG 3.21Å; C1082-C1094 HydrophobicContact CB-CB 3.92Å; C1082-C1094 WeakPolarHBondContact CB-SG 3.37Å; C1082-C1094 VanDerWaalsContact SG-CA 3.55Å; C1082-C1094 WeakPolarHBondContact SG-CB 3.48Å; C1082-C1094 CovalentContact SG-SG 2.04Å; C1082-C1094 PolarHBondContact SG-SG 3.06Å
1083	R	69.2	Low	74.1	Confident	155 Å²	155	76 Å²	76	59%	0.585	40%	0.398	S	S	*	.			trans	-56.8	148.2	163.2	-68.6	176.5	-174.4	-162	0.6	109.4	H1069 L1070 F1086	H1069-R1083 HydrophobicContact CB-CG 4.19Å; L1070-R1083 HydrophobicContact CD1-CG 3.45Å; L1070-R1083 VanDerWaalsContact CD1-CG 3.45Å; R1083-F1086 PolarHBondContact O-N 2.56Å
1084	P	60.7	Low	74.2	Confident	72 Å²	72	73.9 Å²	73.9	47%	0.468	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-47.4	142.2	171.8	-28.6	36.4	0	0	0	111.7	Q1104	P1084-Q1104 HydrophobicContact CB-CG 4.42Å
1085	G	56.7	Low	73.8	Confident	5 Å²	5	75.3 Å²	75.3	5%	0.052	39%	0.387	C	S	.	.	T	Hydrogen-bonded Turn	trans	86.1	0.8	-171.8	0	0	0	0	0	115.9	N1097 T1100	G1085-N1097 WeakPolarHBondContact O-CA 3.27Å; G1085-N1097 VanDerWaalsContact O-CB 3.26Å; G1085-N1097 WeakPolarHBondContact O-CB 3.08Å; G1085-N1097 PolarHBondContact O-N 2.87Å; G1085-T1100 VanDerWaalsContact CA-O 3.27Å; G1085-T1100 WeakPolarHBondContact CA-O 3.25Å; G1085-T1100 PolarHBondContact N-O 2.88Å
1086	F	69.7	Low	72.7	Confident	56 Å²	56	77.1 Å²	77.1	25%	0.246	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	143.7	179.7	-65.2	-103.9	0	0	0	111.5	H1069 C1082 R1083 C1094 K1095 E1096	H1069-F1086 AromaticContact CE1-CD1 3.31Å; H1069-F1086 WeakPolarHBondContact CE1-CD1 3.39Å; H1069-F1086 AromaticContact CE1-CD2 3.62Å; H1069-F1086 AromaticContact CE1-CE1 3.65Å; H1069-F1086 AromaticContact CE1-CE2 3.95Å; H1069-F1086 AromaticContact CE1-CG 3.33Å; H1069-F1086 WeakPolarHBondContact CE1-CG 3.47Å; H1069-F1086 AromaticContact CE1-CZ 3.97Å; H1069-F1086 AromaticContact ND1-CD2 3.98Å; H1069-F1086 AromaticContact ND1-CG 3.72Å; C1082-F1086 HydrophobicContact CB-CB 3.9Å; C1082-F1086 WeakPolarHBondContact CB-O 3.36Å; R1083-F1086 PolarHBondContact O-N 2.56Å; F1086-C1094 HydrophobicContact CB-CB 4.19Å; F1086-K1095 WeakPolarHBondContact CA-O 3.48Å; F1086-E1096 HydrophobicContact CD1-CB 4.01Å; F1086-E1096 HydrophobicContact CD1-CG 4.38Å; F1086-E1096 HydrophobicContact CE1-CB 3.64Å; F1086-E1096 HydrophobicContact CE1-CG 3.72Å; F1086-E1096 HydrophobicContact CZ-CB 4.4Å; F1086-E1096 HydrophobicContact CZ-CG 3.97Å
1087	N	68.4	Low	71.7	Confident	90 Å²	90	76.4 Å²	76.4	48%	0.481	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	140	176.7	-77.2	-7.9	0	0	0	111.1	Y1089 C1094 K1095 N1097	N1087-Y1089 PolarHBondContact O-N 3.01Å; N1087-C1094 WeakPolarHBondContact O-CA 3.3Å; N1087-K1095 PolarHBondContact N-O 3.41Å; N1087-K1095 PolarHBondContact O-N 3.06Å; N1087-N1097 PolarHBondContact ND2-ND2 2.53Å; N1087-N1097 PolarHBondContact OD1-ND2 3.16Å; N1087-N1097 VanDerWaalsContact OD1-ND2 3.1Å
1088	L	70.6	Confident	70.2	Confident	74 Å²	74	80.9 Å²	80.9	39%	0.387	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	126.2	177	-165.7	78.7	0	0	0	109.6	C1080 C1082 E1093	C1080-L1088 HydrophobicContact CB-CD1 3.78Å; C1082-L1088 WeakPolarHBondContact SG-CA 3.47Å; C1082-L1088 PolarHBondContact SG-N 3.21Å; L1088-E1093 CarbonylContact C-O 3.44Å; L1088-E1093 WeakPolarHBondContact CA-O 3.04Å; L1088-E1093 WeakPolarHBondContact CD1-O 3.04Å
1089	Y	68.1	Low	68.2	Low	149 Å²	149	86.8 Å²	86.8	58%	0.584	42%	0.42	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.9	117.6	-179.1	-149.1	-90.1	0	0	0	109.3	N1087 E1093 K1095	N1087-Y1089 PolarHBondContact O-N 3.01Å; Y1089-E1093 PolarHBondContact N-O 3.36Å; Y1089-E1093 WeakPolarHBondContact O-CB 3.41Å; Y1089-E1093 PolarHBondContact O-N 3.04Å; Y1089-K1095 HydrophobicContact CD1-CD 4.14Å; Y1089-K1095 HydrophobicContact CD2-CD 4.2Å; Y1089-K1095 HydrophobicContact CG-CD 3.82Å
1090	G	78.9	Confident	66.3	Low	67 Å²	67	85.2 Å²	85.2	69%	0.691	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.9	-139.2	-166.6	0	0	0	0	0	111.6
1091	R	76.4	Confident	64.7	Low	194 Å²	194	87 Å²	87	73%	0.732	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.4	-24.7	178.9	-87.5	-170.3	173.5	-159.7	-3.3	115.1	C1080	C1080-R1091 VanDerWaalsContact CB-O 3.22Å; C1080-R1091 WeakPolarHBondContact CB-O 3.46Å; C1080-R1091 PolarHBondContact SG-O 3.22Å
1092	Y	80.5	Confident	64.1	Low	100 Å²	100	86.5 Å²	86.5	39%	0.392	43%	0.432	S	S	.	.	T	Hydrogen-bonded Turn	trans	-130.3	-32.1	-162.8	-56.6	-72.4	0	0	0	114.3	Q1068 Y1078 C1080	Q1068-Y1092 WeakPolarHBondContact CB-O 3.22Å; Q1068-Y1092 PolarHBondContact N-O 3.4Å; Y1078-Y1092 HydrophobicContact CE2-CE1 4.13Å; C1080-Y1092 VanDerWaalsContact SG-CD1 3.56Å
1093	E	74.7	Confident	63.9	Low	92 Å²	92	89.7 Å²	89.7	43%	0.43	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	149.2	-175.5	-58.9	177.9	178.4	0	0	111.6	L1088 Y1089 K1095	L1088-E1093 CarbonylContact C-O 3.44Å; L1088-E1093 WeakPolarHBondContact CA-O 3.04Å; L1088-E1093 WeakPolarHBondContact CD1-O 3.04Å; Y1089-E1093 PolarHBondContact N-O 3.36Å; Y1089-E1093 WeakPolarHBondContact O-CB 3.41Å; Y1089-E1093 PolarHBondContact O-N 3.04Å; E1093-K1095 WeakPolarHBondContact OE2-CE 3.47Å; E1093-K1095 IonicContact OE2-NZ 2.69Å; E1093-K1095 PolarHBondContact OE2-NZ 2.73Å
1094	C	73.9	Confident	64.3	Low	3 Å²	3	85.6 Å²	85.6	2%	0.02	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	110.5	172.4	-74.7	0	0	0	0	108.9	Q1068 H1069 C1082 F1086 N1087	Q1068-C1094 HydrophobicContact CB-CB 4.36Å; Q1068-C1094 PolarHBondContact NE2-O 3.43Å; Q1068-C1094 PolarHBondContact OE1-O 3.41Å; H1069-C1094 HydrophobicContact CB-CB 4.13Å; C1082-C1094 WeakPolarHBondContact CA-SG 3.21Å; C1082-C1094 HydrophobicContact CB-CB 3.92Å; C1082-C1094 WeakPolarHBondContact CB-SG 3.37Å; C1082-C1094 VanDerWaalsContact SG-CA 3.55Å; C1082-C1094 WeakPolarHBondContact SG-CB 3.48Å; C1082-C1094 CovalentContact SG-SG 2.04Å; C1082-C1094 PolarHBondContact SG-SG 3.06Å; F1086-C1094 HydrophobicContact CB-CB 4.19Å; N1087-C1094 WeakPolarHBondContact O-CA 3.3Å
1095	K	65.8	Low	65.4	Low	93 Å²	93	87.9 Å²	87.9	40%	0.404	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	139.9	-178.8	-72.5	178.5	-178.4	155	0	110.8	F1086 N1087 Y1089 E1093 N1097	F1086-K1095 WeakPolarHBondContact CA-O 3.48Å; N1087-K1095 PolarHBondContact N-O 3.41Å; N1087-K1095 PolarHBondContact O-N 3.06Å; Y1089-K1095 HydrophobicContact CD1-CD 4.14Å; Y1089-K1095 HydrophobicContact CD2-CD 4.2Å; Y1089-K1095 HydrophobicContact CG-CD 3.82Å; E1093-K1095 WeakPolarHBondContact OE2-CE 3.47Å; E1093-K1095 IonicContact OE2-NZ 2.69Å; E1093-K1095 PolarHBondContact OE2-NZ 2.73Å; K1095-N1097 PolarHBondContact O-N 2.82Å
1096	E	50.8	Low	66.7	Low	139 Å²	139	88.5 Å²	88.5	65%	0.65	44%	0.442	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-61.4	117.9	-174	-164.1	161.9	-100.6	0	0	110.2	F1086 I1098	F1086-E1096 HydrophobicContact CD1-CB 4.01Å; F1086-E1096 HydrophobicContact CD1-CG 4.38Å; F1086-E1096 HydrophobicContact CE1-CB 3.64Å; F1086-E1096 HydrophobicContact CE1-CG 3.72Å; F1086-E1096 HydrophobicContact CZ-CB 4.4Å; F1086-E1096 HydrophobicContact CZ-CG 3.97Å; E1096-I1098 PolarHBondContact O-N 2.97Å
1097	N	48.5	Very low	67.4	Low	47 Å²	47	90.8 Å²	90.8	25%	0.251	47%	0.465	S	S	.	.			trans	-93.5	94.6	-179.2	-165.7	5	0	0	0	106.8	G1085 N1087 K1095 K1099 T1100	G1085-N1097 WeakPolarHBondContact O-CA 3.27Å; G1085-N1097 VanDerWaalsContact O-CB 3.26Å; G1085-N1097 WeakPolarHBondContact O-CB 3.08Å; G1085-N1097 PolarHBondContact O-N 2.87Å; N1087-N1097 PolarHBondContact ND2-ND2 2.53Å; N1087-N1097 PolarHBondContact OD1-ND2 3.16Å; N1087-N1097 VanDerWaalsContact OD1-ND2 3.1Å; K1095-N1097 PolarHBondContact O-N 2.82Å; N1097-K1099 PolarHBondContact O-N 3.49Å; N1097-T1100 PolarHBondContact ND2-OG1 3.44Å; N1097-T1100 PolarHBondContact O-N 2.82Å; N1097-T1100 VanDerWaalsContact O-N 3.16Å
1098	I	45.3	Very low	67.9	Low	154 Å²	154	88.9 Å²	88.9	79%	0.79	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	21.1	-170.5	-56.6	168.4	0	0	0	113	E1096	E1096-I1098 PolarHBondContact O-N 2.97Å
1099	K	42.3	Very low	68.3	Low	185 Å²	185	87.5 Å²	87.5	80%	0.804	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-137.4	-3	179.5	-70.6	-168.3	172.4	-174.8	0	116	N1097	N1097-K1099 PolarHBondContact O-N 3.49Å
1100	T	47.5	Very low	69.2	Low	52 Å²	52	83.5 Å²	83.5	32%	0.319	44%	0.443	S	S	.	.			trans	-139.2	26	-172.6	54.8	0	0	0	0	116.5	G1085 N1097 C1102	G1085-T1100 VanDerWaalsContact CA-O 3.27Å; G1085-T1100 WeakPolarHBondContact CA-O 3.25Å; G1085-T1100 PolarHBondContact N-O 2.88Å; N1097-T1100 PolarHBondContact ND2-OG1 3.44Å; N1097-T1100 PolarHBondContact O-N 2.82Å; N1097-T1100 VanDerWaalsContact O-N 3.16Å; T1100-C1102 VanDerWaalsContact C-N 3.34Å; T1100-C1102 PolarHBondContact O-N 2.56Å
1101	G	49.5	Very low	69.4	Low	52 Å²	52	81.5 Å²	81.5	54%	0.536	42%	0.422	S	S	.	.	T	Hydrogen-bonded Turn	trans	-47.9	-36.5	-166.9	0	0	0	0	0	118.5
1102	C	70.1	Confident	69.9	Low	10 Å²	10	76.7 Å²	76.7	7%	0.068	41%	0.408	C	S	.	.	T	Hydrogen-bonded Turn	trans	-152.4	41.9	177.4	53.1	0	0	0	0	113.2	T1100 P1116 C1128 H1129	T1100-C1102 VanDerWaalsContact C-N 3.34Å; T1100-C1102 PolarHBondContact O-N 2.56Å; C1102-P1116 HydrophobicContact CB-CG 4Å; C1102-C1128 HydrophobicContact CB-CB 3.64Å; C1102-C1128 WeakPolarHBondContact CB-SG 3.46Å; C1102-C1128 VanDerWaalsContact O-CA 3.29Å; C1102-C1128 WeakPolarHBondContact O-CA 3.41Å; C1102-C1128 WeakPolarHBondContact O-CB 3.28Å; C1102-C1128 WeakPolarHBondContact SG-CA 3.04Å; C1102-C1128 WeakPolarHBondContact SG-CB 3.49Å; C1102-C1128 CovalentContact SG-SG 2.03Å; C1102-C1128 PolarHBondContact SG-SG 3.43Å; C1102-H1129 PolarHBondContact O-N 2.99Å; C1102-H1129 VanDerWaalsContact O-N 3.12Å
1103	Q	74.5	Confident	70.2	Confident	95 Å²	95	72 Å²	72	44%	0.444	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	130.9	175.9	-60.2	-174.5	-14.6	0	0	110.1	H1129	Q1103-H1129 CarbonylContact C-O 3.51Å; Q1103-H1129 WeakPolarHBondContact CA-O 3.47Å; Q1103-H1129 HydrophobicContact CB-CB 4.5Å; Q1103-H1129 HydrophobicContact CG-CB 4.11Å
1104	Q	76.7	Confident	70.8	Confident	69 Å²	69	71.1 Å²	71.1	32%	0.322	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	127	-173.9	-58.7	-179.4	14.3	0	0	111.4	P1084 I1106 H1129 W1130 K1131	P1084-Q1104 HydrophobicContact CB-CG 4.42Å; Q1104-I1106 HydrophobicContact CB-CG1 4.24Å; Q1104-H1129 PolarHBondContact N-O 2.93Å; Q1104-W1130 WeakPolarHBondContact O-CA 3.18Å; Q1104-K1131 PolarHBondContact O-N 2.75Å
1105	D	83.9	Confident	71.5	Confident	119 Å²	119	71 Å²	71	64%	0.636	39%	0.387	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.9	120.7	160.2	-77.8	-50	0	0	0	108.1	K1131	D1105-K1131 WeakPolarHBondContact CA-O 3.46Å; D1105-K1131 WeakPolarHBondContact OD1-CB 3.45Å; D1105-K1131 WeakPolarHBondContact OD1-CD 3.39Å; D1105-K1131 IonicContact OD1-NZ 3.35Å; D1105-K1131 PolarHBondContact OD1-NZ 2.78Å; D1105-K1131 IonicContact OD2-NZ 3.97Å
1106	I	84.4	Confident	72.3	Confident	18 Å²	18	68 Å²	68	9%	0.092	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	122.4	-176.9	-62.8	178.7	0	0	0	109.1	Q1104 I1113 W1130 K1131 I1132 T1133 H1211	Q1104-I1106 HydrophobicContact CB-CG1 4.24Å; I1106-I1113 HydrophobicContact CD1-CD1 4.09Å; I1106-I1113 HydrophobicContact CD1-CG1 3.96Å; I1106-W1130 HydrophobicContact CD1-CB 4.2Å; I1106-K1131 PolarHBondContact N-O 3.15Å; I1106-I1132 HydrophobicContact CB-CG1 4.37Å; I1106-I1132 HydrophobicContact CB-CG2 4.44Å; I1106-I1132 HydrophobicContact CD1-CG1 4.46Å; I1106-I1132 HydrophobicContact CG2-CG2 4.24Å; I1106-I1132 CarbonylContact O-C 3.51Å; I1106-I1132 WeakPolarHBondContact O-CA 3.41Å; I1106-T1133 PolarHBondContact O-N 3.02Å; I1106-H1211 WeakPolarHBondContact CG2-CE1 3.18Å
1107	S	84.1	Confident	73.7	Confident	105 Å²	105	65.8 Å²	65.8	73%	0.734	37%	0.369	S	S	*	.			trans	-119.8	2.9	-179	57.5	0	0	0	0	115.1	T1133	S1107-T1133 WeakPolarHBondContact CA-O 3.24Å
1108	S	79.6	Confident	75.3	Confident	50 Å²	50	67 Å²	67	35%	0.35	37%	0.37	S	S	.	.			trans	-75.5	145.3	178	63.2	0	0	0	0	111.6	D1110 H1211	S1108-D1110 VanDerWaalsContact CB-O 3.27Å; S1108-D1110 WeakPolarHBondContact CB-O 3.3Å; S1108-D1110 PolarHBondContact O-N 2.94Å; S1108-D1110 PolarHBondContact OG-O 2.86Å; S1108-H1211 PolarHBondContact O-NE2 2.8Å; S1108-H1211 PolarHBondContact OG-CE1 3.21Å; S1108-H1211 PolarHBondContact OG-NE2 2.76Å
1109	P	78	Confident	77	Confident	45 Å²	45	63.1 Å²	63.1	29%	0.292	36%	0.355	S	S	.	.	S	Bend	trans	-67.5	-22	-178.5	27.9	-35.7	0	0	0	113	T1212 T1213 A1232 K1233	P1109-T1212 CarbonylContact O-C 3.49Å; P1109-T1213 VanDerWaalsContact CA-OG1 3.32Å; P1109-T1213 WeakPolarHBondContact CA-OG1 3.44Å; P1109-T1213 VanDerWaalsContact O-CB 3.29Å; P1109-T1213 WeakPolarHBondContact O-CB 3.46Å; P1109-T1213 PolarHBondContact O-N 3.32Å; P1109-T1213 PolarHBondContact O-OG1 3.24Å; P1109-A1232 HydrophobicContact CB-CB 4.22Å; P1109-K1233 HydrophobicContact CG-CG 4.41Å
1110	D	87	Confident	78.8	Confident	65 Å²	65	59.8 Å²	59.8	35%	0.348	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	165.8	169.5	53.2	-90	0	0	0	109.7	S1108 H1211 T1212 K1233	S1108-D1110 VanDerWaalsContact CB-O 3.27Å; S1108-D1110 WeakPolarHBondContact CB-O 3.3Å; S1108-D1110 PolarHBondContact O-N 2.94Å; S1108-D1110 PolarHBondContact OG-O 2.86Å; D1110-H1211 VanDerWaalsContact C-CE1 3.43Å; D1110-H1211 VanDerWaalsContact CA-O 3.27Å; D1110-H1211 WeakPolarHBondContact CA-O 3.36Å; D1110-T1212 HydrophobicContact CB-CG2 4.32Å; D1110-K1233 WeakPolarHBondContact OD1-CE 3.27Å; D1110-K1233 IonicContact OD1-NZ 2.68Å; D1110-K1233 PolarHBondContact OD1-NZ 2.84Å
1111	G	84	Confident	80.5	Confident	24 Å²	24	62.6 Å²	62.6	25%	0.247	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	165.9	-169.1	-178.9	0	0	0	0	0	113.7	Q1210 H1211	G1111-Q1210 WeakPolarHBondContact O-CA 3.34Å; G1111-Q1210 WeakPolarHBondContact O-CG 3.44Å; G1111-H1211 VanDerWaalsContact CA-CE1 3.43Å; G1111-H1211 WeakPolarHBondContact CA-CE1 3.2Å; G1111-H1211 PolarHBondContact N-CE1 2.67Å; G1111-H1211 VanDerWaalsContact N-CE1 3.3Å; G1111-H1211 PolarHBondContact N-O 3.22Å; G1111-H1211 PolarHBondContact O-N 3.35Å
1112	E	85.7	Confident	82.2	Confident	94 Å²	94	60.2 Å²	60.2	44%	0.439	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	139	-173.6	-172	176.6	145.3	0	0	111.4	I1114 R1208 A1209	E1112-I1114 HydrophobicContact CG-CG2 4.27Å; E1112-I1114 WeakPolarHBondContact OE1-CG2 3.25Å; E1112-R1208 HydrophobicContact CG-CG 4.31Å; E1112-R1208 WeakPolarHBondContact OE1-CD 3.34Å; E1112-R1208 IonicContact OE1-CZ 3.19Å; E1112-R1208 IonicContact OE1-NE 3.59Å; E1112-R1208 PolarHBondContact OE1-NE 3.38Å; E1112-R1208 IonicContact OE1-NH2 2.74Å; E1112-R1208 IonicContact OE2-CZ 3.73Å; E1112-R1208 IonicContact OE2-NE 2.66Å; E1112-R1208 PolarHBondContact OE2-NE 3.06Å; E1112-R1208 IonicContact OE2-NH2 2.71Å; E1112-R1208 PolarHBondContact OE2-NH2 3.03Å; E1112-A1209 WeakPolarHBondContact CA-O 3.08Å
1113	I	88	Confident	82.9	Confident	1 Å²	1	61.8 Å²	61.8	1%	0.005	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	118.2	179.9	-56.4	176.4	0	0	0	107.4	I1106 W1130 I1132 L1194 F1207 A1209 H1211	I1106-I1113 HydrophobicContact CD1-CD1 4.09Å; I1106-I1113 HydrophobicContact CD1-CG1 3.96Å; I1113-W1130 HydrophobicContact CD1-CB 4.44Å; I1113-W1130 HydrophobicContact CG2-CD2 3.67Å; I1113-W1130 HydrophobicContact CG2-CE3 4.26Å; I1113-W1130 HydrophobicContact CG2-CG 3.78Å; I1113-W1130 HydrophobicContact CG2-CZ2 4.21Å; I1113-I1132 HydrophobicContact CD1-CD1 3.51Å; I1113-I1132 HydrophobicContact CD1-CG1 4.22Å; I1113-L1194 HydrophobicContact CG2-CD2 4.38Å; I1113-F1207 HydrophobicContact CG2-CE2 4.15Å; I1113-A1209 PolarHBondContact N-O 3.49Å; I1113-A1209 PolarHBondContact O-N 2.9Å; I1113-H1211 HydrophobicContact CD1-CB 4.36Å
1114	I	87.6	Confident	83.3	Confident	74 Å²	74	59.9 Å²	59.9	38%	0.379	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	146.7	177.5	52.8	173.1	0	0	0	110.5	E1112 W1118 F1207 R1208	E1112-I1114 HydrophobicContact CG-CG2 4.27Å; E1112-I1114 WeakPolarHBondContact OE1-CG2 3.25Å; I1114-W1118 HydrophobicContact CB-CB 4.29Å; I1114-W1118 HydrophobicContact CG2-CD2 4.49Å; I1114-W1118 HydrophobicContact CG2-CE3 4.26Å; I1114-F1207 WeakPolarHBondContact CA-O 3.16Å; I1114-R1208 HydrophobicContact CG2-CB 4.04Å; I1114-R1208 HydrophobicContact CG2-CG 3.89Å
1115	T	88.2	Confident	83.7	Confident	1 Å²	1	64 Å²	64	1%	0.006	35%	0.352	C	S	.	.			trans	-62.1	153.4	163.6	42.3	0	0	0	0	110.8	N1117 W1118 F1196 G1206 F1207	T1115-N1117 PolarHBondContact O-N 3.15Å; T1115-W1118 PolarHBondContact O-N 3.02Å; T1115-F1196 HydrophobicContact CG2-CD1 4.07Å; T1115-F1196 HydrophobicContact CG2-CE1 4.04Å; T1115-F1196 HydrophobicContact CG2-CG 4.46Å; T1115-F1196 HydrophobicContact CG2-CZ 4.41Å; T1115-G1206 WeakPolarHBondContact OG1-CA 3.12Å; T1115-F1207 HydrophobicContact CG2-CD1 3.29Å; T1115-F1207 HydrophobicContact CG2-CD2 4.37Å; T1115-F1207 HydrophobicContact CG2-CE1 3.25Å; T1115-F1207 HydrophobicContact CG2-CE2 4.38Å; T1115-F1207 HydrophobicContact CG2-CG 3.87Å; T1115-F1207 HydrophobicContact CG2-CZ 3.85Å; T1115-F1207 PolarHBondContact N-O 2.7Å; T1115-F1207 PolarHBondContact OG1-N 3.46Å; T1115-F1207 PolarHBondContact OG1-O 3.27Å
1116	P	82.5	Confident	83.7	Confident	29 Å²	29	60.7 Å²	60.7	19%	0.188	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	-47.8	140.4	165	-26.1	35.4	0	0	0	111	C1102 W1118 P1123	C1102-P1116 HydrophobicContact CB-CG 4Å; P1116-W1118 VanDerWaalsContact C-N 3.27Å; P1116-W1118 PolarHBondContact O-N 3.46Å; P1116-P1123 HydrophobicContact CB-CG 4.45Å
1117	N	80.5	Confident	83.8	Confident	93 Å²	93	63.7 Å²	63.7	50%	0.497	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	67	-9.4	-179.7	-56.9	-14.3	0	0	0	119	T1115 N1120 E1121	T1115-N1117 PolarHBondContact O-N 3.15Å; N1117-N1120 CarbonylContact C-O 3.59Å; N1117-N1120 HydrophobicContact CB-CB 4.41Å; N1117-N1120 WeakPolarHBondContact O-CA 3.37Å; N1117-N1120 WeakPolarHBondContact O-CB 3.39Å; N1117-N1120 PolarHBondContact O-N 2.93Å; N1117-N1120 PolarHBondContact O-ND2 2.88Å; N1117-E1121 WeakPolarHBondContact CB-O 3.2Å; N1117-E1121 PolarHBondContact ND2-O 3.23Å
1118	W	81.1	Confident	84	Confident	72 Å²	72	58.7 Å²	58.7	27%	0.273	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.7	134	-177.7	-175.1	93.2	0	0	0	111.6	I1114 T1115 P1116 D1146 K1205 R1208	I1114-W1118 HydrophobicContact CB-CB 4.29Å; I1114-W1118 HydrophobicContact CG2-CD2 4.49Å; I1114-W1118 HydrophobicContact CG2-CE3 4.26Å; T1115-W1118 PolarHBondContact O-N 3.02Å; P1116-W1118 VanDerWaalsContact C-N 3.27Å; P1116-W1118 PolarHBondContact O-N 3.46Å; W1118-D1146 HydrophobicContact CZ2-CB 4.49Å; W1118-D1146 PolarHBondContact NE1-OD2 3.42Å; W1118-K1205 VanDerWaalsContact CD1-O 3.31Å; W1118-R1208 HydrophobicContact CD2-CB 4.07Å; W1118-R1208 HydrophobicContact CH2-CB 4.48Å; W1118-R1208 VanDerWaalsContact CH2-CD 3.48Å; W1118-R1208 HydrophobicContact CZ2-CB 3.98Å
1119	P	81.8	Confident	84.5	Confident	72 Å²	72	58.5 Å²	58.5	47%	0.468	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	cis	-86.2	6.4	9.2	36	-38.2	0	0	0	115.6
1120	N	79.5	Confident	85	Confident	115 Å²	115	56.4 Å²	56.4	62%	0.615	29%	0.294	S	S	*	.	S	Bend	trans	-84	171	173.7	-48.7	-72.7	0	0	0	110.9	N1117 Y1122	N1117-N1120 CarbonylContact C-O 3.59Å; N1117-N1120 HydrophobicContact CB-CB 4.41Å; N1117-N1120 WeakPolarHBondContact O-CA 3.37Å; N1117-N1120 WeakPolarHBondContact O-CB 3.39Å; N1117-N1120 PolarHBondContact O-N 2.93Å; N1117-N1120 PolarHBondContact O-ND2 2.88Å; N1120-Y1122 PolarHBondContact O-N 2.79Å
1121	E	83.7	Confident	85.3	Confident	112 Å²	112	56.2 Å²	56.2	52%	0.523	29%	0.29	S	S	.	.	P	Polyproline II helix	trans	-63.6	134.1	-175.7	-65.8	177	177.2	0	0	113.4	N1117 Q1203 R1204	N1117-E1121 WeakPolarHBondContact CB-O 3.2Å; N1117-E1121 PolarHBondContact ND2-O 3.23Å; E1121-Q1203 HydrophobicContact CB-CB 4.22Å; E1121-R1204 VanDerWaalsContact CA-O 3.26Å; E1121-R1204 WeakPolarHBondContact CA-O 3.35Å
1122	Y	86.2	Confident	85.6	Confident	1 Å²	1	55 Å²	55	0%	0.004	28%	0.278	C	S	.	.	P	Polyproline II helix	trans	-65.7	156.1	173.8	48.3	-97.4	0	0	0	111.3	N1120 L1149 E1150 D1158 F1196 Q1203 R1204 G1206	N1120-Y1122 PolarHBondContact O-N 2.79Å; Y1122-L1149 HydrophobicContact CD1-CD2 4.35Å; Y1122-L1149 HydrophobicContact CE1-CD2 3.54Å; Y1122-E1150 PolarHBondContact OH-N 2.99Å; Y1122-D1158 WeakPolarHBondContact CE2-OD2 3.36Å; Y1122-D1158 PolarHBondContact OH-OD2 2.91Å; Y1122-F1196 HydrophobicContact CD1-CZ 4.06Å; Y1122-F1196 HydrophobicContact CD2-CE1 4.33Å; Y1122-F1196 AromaticContact CD2-CZ 3.77Å; Y1122-F1196 HydrophobicContact CD2-CZ 3.77Å; Y1122-F1196 HydrophobicContact CE1-CZ 4.24Å; Y1122-F1196 AromaticContact CE2-CZ 3.95Å; Y1122-F1196 HydrophobicContact CE2-CZ 3.95Å; Y1122-F1196 HydrophobicContact CG-CE1 4.2Å; Y1122-F1196 AromaticContact CG-CZ 3.83Å; Y1122-F1196 HydrophobicContact CG-CZ 3.83Å; Y1122-Q1203 HydrophobicContact CD2-CB 3.82Å; Y1122-Q1203 HydrophobicContact CD2-CG 3.97Å; Y1122-Q1203 HydrophobicContact CE2-CB 3.62Å; Y1122-Q1203 HydrophobicContact CE2-CG 3.9Å; Y1122-Q1203 HydrophobicContact CG-CB 4.47Å; Y1122-Q1203 WeakPolarHBondContact O-CB 3.19Å; Y1122-Q1203 VanDerWaalsContact O-CG 3.25Å; Y1122-Q1203 WeakPolarHBondContact O-CG 3.28Å; Y1122-Q1203 PolarHBondContact O-NE2 2.68Å; Y1122-R1204 WeakPolarHBondContact CD1-O 3.31Å; Y1122-R1204 HydrophobicContact CE1-CB 3.99Å; Y1122-R1204 WeakPolarHBondContact CE1-O 3.32Å; Y1122-R1204 VanDerWaalsContact CZ-N 3.32Å; Y1122-R1204 PolarHBondContact N-O 3.13Å; Y1122-R1204 PolarHBondContact OH-N 2.78Å; Y1122-G1206 VanDerWaalsContact CD1-CA 3.4Å
1123	P	82.9	Confident	85.8	Confident	43 Å²	43	52.5 Å²	52.5	28%	0.279	27%	0.269	S	S	.	.	P	Polyproline II helix	trans	-68.8	159.5	172.6	-14.2	28.3	0	0	0	112.2	P1116 Q1126 S1198	P1116-P1123 HydrophobicContact CB-CG 4.45Å; P1123-Q1126 HydrophobicContact CB-CG 3.9Å; P1123-Q1126 HydrophobicContact CG-CG 4.16Å; P1123-Q1126 WeakPolarHBondContact O-CG 3.27Å; P1123-S1198 PolarHBondContact O-OG 2.74Å
1124	V	84.4	Confident	85.8	Confident	55 Å²	55	52.8 Å²	52.8	33%	0.333	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.7	159.8	166.9	-64.1	0	0	0	0	111.8	Q1126 D1199 Q1203	V1124-Q1126 PolarHBondContact O-N 2.64Å; V1124-Q1126 PolarHBondContact O-NE2 3.26Å; V1124-D1199 CarbonylContact C-O 3.49Å; V1124-D1199 WeakPolarHBondContact CA-O 3.37Å; V1124-D1199 WeakPolarHBondContact CB-O 3.47Å; V1124-Q1203 VanDerWaalsContact CG1-CD 3.46Å; V1124-Q1203 HydrophobicContact CG1-CG 3.89Å
1125	K	84.8	Confident	85.6	Confident	155 Å²	155	51.3 Å²	51.3	67%	0.674	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.9	34.3	171.8	-58.2	-174.7	179.4	-179.8	0	114.6	S1198 D1199	K1125-S1198 VanDerWaalsContact CA-O 3.29Å; K1125-S1198 WeakPolarHBondContact CA-O 3.43Å; K1125-S1198 PolarHBondContact N-O 2.68Å; K1125-S1198 PolarHBondContact N-OG 2.91Å; K1125-D1199 PolarHBondContact N-O 2.86Å
1126	Q	83.3	Confident	85.3	Confident	50 Å²	50	54.2 Å²	54.2	23%	0.234	28%	0.284	C	S	.	.			trans	-81	151	175.7	-60.3	-55.8	-75.2	0	0	111	P1123 V1124 F1196 N1197 S1198	P1123-Q1126 HydrophobicContact CB-CG 3.9Å; P1123-Q1126 HydrophobicContact CG-CG 4.16Å; P1123-Q1126 WeakPolarHBondContact O-CG 3.27Å; V1124-Q1126 PolarHBondContact O-N 2.64Å; V1124-Q1126 PolarHBondContact O-NE2 3.26Å; Q1126-F1196 HydrophobicContact CB-CE1 4.42Å; Q1126-N1197 WeakPolarHBondContact O-CA 3.31Å; Q1126-S1198 WeakPolarHBondContact CB-OG 3.17Å; Q1126-S1198 PolarHBondContact N-OG 2.75Å; Q1126-S1198 PolarHBondContact O-N 3.12Å
1127	N	87.5	Confident	85.2	Confident	82 Å²	82	53 Å²	53	44%	0.439	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	93	174.2	-176.5	-11.8	0	0	0	107.9	H1129 F1196 N1197	N1127-H1129 PolarHBondContact OD1-CE1 3.48Å; N1127-H1129 PolarHBondContact OD1-ND1 3.47Å; N1127-F1196 WeakPolarHBondContact CA-O 3.42Å; N1127-N1197 PolarHBondContact OD1-OD1 2.94Å
1128	C	88.1	Confident	85.7	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	143.7	-172	-52.5	0	0	0	0	110.7	C1102 W1130 T1195 F1196	C1102-C1128 HydrophobicContact CB-CB 3.64Å; C1102-C1128 WeakPolarHBondContact CB-SG 3.46Å; C1102-C1128 VanDerWaalsContact O-CA 3.29Å; C1102-C1128 WeakPolarHBondContact O-CA 3.41Å; C1102-C1128 WeakPolarHBondContact O-CB 3.28Å; C1102-C1128 WeakPolarHBondContact SG-CA 3.04Å; C1102-C1128 WeakPolarHBondContact SG-CB 3.49Å; C1102-C1128 CovalentContact SG-SG 2.03Å; C1102-C1128 PolarHBondContact SG-SG 3.43Å; C1128-W1130 HydrophobicContact CB-CE3 4.42Å; C1128-W1130 HydrophobicContact CB-CH2 3.47Å; C1128-W1130 VanDerWaalsContact CB-CH2 3.47Å; C1128-W1130 HydrophobicContact CB-CZ2 3.89Å; C1128-W1130 HydrophobicContact CB-CZ3 3.76Å; C1128-T1195 CarbonylContact O-C 3.55Å; C1128-T1195 VanDerWaalsContact O-CA 3.22Å; C1128-T1195 WeakPolarHBondContact O-CA 3.34Å; C1128-F1196 HydrophobicContact CB-CB 4.22Å; C1128-F1196 HydrophobicContact CB-CD1 4.4Å; C1128-F1196 PolarHBondContact N-O 3.48Å; C1128-F1196 PolarHBondContact O-N 3.01Å
1129	H	89.2	Confident	86.1	Confident	45 Å²	45	48 Å²	48	21%	0.208	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	112.6	-175.5	-65.7	-12.8	0	0	0	109.5	C1102 Q1103 Q1104 N1127 L1193 T1195	C1102-H1129 PolarHBondContact O-N 2.99Å; C1102-H1129 VanDerWaalsContact O-N 3.12Å; Q1103-H1129 CarbonylContact C-O 3.51Å; Q1103-H1129 WeakPolarHBondContact CA-O 3.47Å; Q1103-H1129 HydrophobicContact CB-CB 4.5Å; Q1103-H1129 HydrophobicContact CG-CB 4.11Å; Q1104-H1129 PolarHBondContact N-O 2.93Å; N1127-H1129 PolarHBondContact OD1-CE1 3.48Å; N1127-H1129 PolarHBondContact OD1-ND1 3.47Å; H1129-L1193 HydrophobicContact CB-CD1 4.14Å; H1129-T1195 WeakPolarHBondContact ND1-CG2 3.41Å
1130	W	90.1	Very high	86.6	Confident	2 Å²	2	44.6 Å²	44.6	1%	0.008	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	104.3	172.7	-56.4	-91.3	0	0	0	109	Q1104 I1106 I1113 C1128 L1194 F1196 F1207	Q1104-W1130 WeakPolarHBondContact O-CA 3.18Å; I1106-W1130 HydrophobicContact CD1-CB 4.2Å; I1113-W1130 HydrophobicContact CD1-CB 4.44Å; I1113-W1130 HydrophobicContact CG2-CD2 3.67Å; I1113-W1130 HydrophobicContact CG2-CE3 4.26Å; I1113-W1130 HydrophobicContact CG2-CG 3.78Å; I1113-W1130 HydrophobicContact CG2-CZ2 4.21Å; C1128-W1130 HydrophobicContact CB-CE3 4.42Å; C1128-W1130 HydrophobicContact CB-CH2 3.47Å; C1128-W1130 VanDerWaalsContact CB-CH2 3.47Å; C1128-W1130 HydrophobicContact CB-CZ2 3.89Å; C1128-W1130 HydrophobicContact CB-CZ3 3.76Å; W1130-L1194 HydrophobicContact CB-CB 4.45Å; W1130-L1194 HydrophobicContact CE3-CB 4.32Å; W1130-L1194 HydrophobicContact CE3-CD2 4.18Å; W1130-L1194 HydrophobicContact CE3-CG 4.31Å; W1130-L1194 PolarHBondContact N-O 3.38Å; W1130-L1194 PolarHBondContact O-N 3.36Å; W1130-F1196 HydrophobicContact CH2-CB 3.81Å; W1130-F1196 HydrophobicContact CH2-CD1 4.47Å; W1130-F1196 HydrophobicContact CZ3-CB 3.57Å; W1130-F1207 HydrophobicContact CH2-CE1 4.46Å; W1130-F1207 AromaticContact CH2-CZ 3.71Å; W1130-F1207 HydrophobicContact CH2-CZ 3.71Å; W1130-F1207 AromaticContact CZ3-CZ 3.75Å; W1130-F1207 HydrophobicContact CZ3-CZ 3.75Å
1131	K	91.7	Very high	87.3	Confident	60 Å²	60	42 Å²	42	26%	0.261	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	98.2	178.4	178.3	165.8	141.9	-105.9	0	109.2	Q1104 D1105 I1106 P1166 L1193	Q1104-K1131 PolarHBondContact O-N 2.75Å; D1105-K1131 WeakPolarHBondContact CA-O 3.46Å; D1105-K1131 WeakPolarHBondContact OD1-CB 3.45Å; D1105-K1131 WeakPolarHBondContact OD1-CD 3.39Å; D1105-K1131 IonicContact OD1-NZ 3.35Å; D1105-K1131 PolarHBondContact OD1-NZ 2.78Å; D1105-K1131 IonicContact OD2-NZ 3.97Å; I1106-K1131 PolarHBondContact N-O 3.15Å; K1131-P1166 HydrophobicContact CD-CB 4.14Å; K1131-L1193 HydrophobicContact CB-CD1 4.12Å
1132	I	91.5	Very high	87.7	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	121.8	-177.8	-45.1	172.5	0	0	0	108.1	I1106 I1113 V1134 V1140 V1142 Q1191 L1192 H1211	I1106-I1132 HydrophobicContact CB-CG1 4.37Å; I1106-I1132 HydrophobicContact CB-CG2 4.44Å; I1106-I1132 HydrophobicContact CD1-CG1 4.46Å; I1106-I1132 HydrophobicContact CG2-CG2 4.24Å; I1106-I1132 CarbonylContact O-C 3.51Å; I1106-I1132 WeakPolarHBondContact O-CA 3.41Å; I1113-I1132 HydrophobicContact CD1-CD1 3.51Å; I1113-I1132 HydrophobicContact CD1-CG1 4.22Å; I1132-V1134 HydrophobicContact CG2-CG1 4.29Å; I1132-V1140 HydrophobicContact CB-CG1 4.05Å; I1132-V1140 HydrophobicContact CB-CG2 4.24Å; I1132-V1140 HydrophobicContact CD1-CG1 3.82Å; I1132-V1140 HydrophobicContact CG2-CG1 3.72Å; I1132-V1140 HydrophobicContact CG2-CG2 3.97Å; I1132-V1142 HydrophobicContact CD1-CG2 3.93Å; I1132-Q1191 VanDerWaalsContact O-CA 3.31Å; I1132-Q1191 WeakPolarHBondContact O-CA 3.24Å; I1132-L1192 HydrophobicContact CD1-CD2 4.16Å; I1132-L1192 PolarHBondContact N-O 3.07Å; I1132-L1192 PolarHBondContact O-N 3.18Å; I1132-H1211 HydrophobicContact CD1-CB 4.1Å
1133	T	90.4	Very high	88.1	Confident	41 Å²	41	39.6 Å²	39.6	25%	0.252	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	109.8	177	-61.7	0	0	0	0	109.2	I1106 S1107 N1190 Q1191	I1106-T1133 PolarHBondContact O-N 3.02Å; S1107-T1133 WeakPolarHBondContact CA-O 3.24Å; T1133-N1190 WeakPolarHBondContact CA-O 3.24Å; T1133-Q1191 HydrophobicContact CG2-CG 3.97Å; T1133-Q1191 PolarHBondContact OG1-NE2 3.11Å; T1133-Q1191 VanDerWaalsContact OG1-NE2 3.15Å
1134	V	86.8	Confident	88.6	Confident	7 Å²	7	37.6 Å²	37.6	4%	0.042	19%	0.189	C	C	.	.	P	Polyproline II helix	trans	-99.9	172.7	179.3	-61.8	0	0	0	0	111.1	I1132 H1138 V1140 N1190 T1213	I1132-V1134 HydrophobicContact CG2-CG1 4.29Å; V1134-H1138 HydrophobicContact CG2-CB 4.16Å; V1134-V1140 HydrophobicContact CG1-CG2 3.94Å; V1134-V1140 HydrophobicContact CG2-CG2 3.89Å; V1134-N1190 HydrophobicContact CG2-CB 3.91Å; V1134-N1190 PolarHBondContact N-O 2.81Å; V1134-N1190 PolarHBondContact O-ND2 3.19Å; V1134-T1213 HydrophobicContact CB-CG2 3.99Å; V1134-T1213 HydrophobicContact CG1-CG2 4.32Å; V1134-T1213 WeakPolarHBondContact CG1-OG1 3.4Å; V1134-T1213 HydrophobicContact CG2-CG2 4.08Å
1135	T	83.5	Confident	88.8	Confident	42 Å²	42	37.1 Å²	37.1	26%	0.258	19%	0.191	S	C	.	.	P	Polyproline II helix	trans	-50.1	133.9	176.7	-50	0	0	0	0	111.3	H1138 Y1229	T1135-H1138 VanDerWaalsContact O-CB 3.32Å; T1135-H1138 WeakPolarHBondContact O-CB 3.39Å; T1135-H1138 PolarHBondContact O-N 3.14Å; T1135-H1138 VanDerWaalsContact O-N 3.1Å; T1135-Y1229 HydrophobicContact CG2-CD2 3.89Å; T1135-Y1229 HydrophobicContact CG2-CE2 4.4Å
1136	P	81.1	Confident	89.1	Confident	63 Å²	63	32.4 Å²	32.4	41%	0.409	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.3	145.5	175.5	-30.1	36.9	0	0	0	113	H1138	P1136-H1138 PolarHBondContact O-N 3.16Å; P1136-H1138 PolarHBondContact O-ND1 3.36Å
1137	G	81.4	Confident	89.6	Confident	3 Å²	3	30.3 Å²	30.3	3%	0.031	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	75.1	4.3	-174.1	0	0	0	0	0	114.4	G1216 L1219 W1247	G1137-G1216 CarbonylContact O-C 3.54Å; G1137-G1216 PolarHBondContact O-N 2.99Å; G1137-L1219 VanDerWaalsContact CA-CD2 3.48Å; G1137-W1247 PolarHBondContact O-NE1 3.15Å
1138	H	90	Very high	89.9	Confident	2 Å²	2	28.9 Å²	28.9	1%	0.009	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	167.3	170.9	-61.6	67.2	0	0	0	110.4	V1134 T1135 P1136 Q1189 N1190 T1213 I1214 Y1229 H1231 A1232	V1134-H1138 HydrophobicContact CG2-CB 4.16Å; T1135-H1138 VanDerWaalsContact O-CB 3.32Å; T1135-H1138 WeakPolarHBondContact O-CB 3.39Å; T1135-H1138 PolarHBondContact O-N 3.14Å; T1135-H1138 VanDerWaalsContact O-N 3.1Å; P1136-H1138 PolarHBondContact O-N 3.16Å; P1136-H1138 PolarHBondContact O-ND1 3.36Å; H1138-Q1189 CarbonylContact O-C 3.52Å; H1138-N1190 WeakPolarHBondContact O-CA 3.34Å; H1138-N1190 WeakPolarHBondContact O-CB 3.11Å; H1138-N1190 PolarHBondContact O-N 2.71Å; H1138-T1213 HydrophobicContact CB-CG2 3.31Å; H1138-I1214 CarbonylContact C-O 3.53Å; H1138-I1214 WeakPolarHBondContact CA-O 3.31Å; H1138-I1214 WeakPolarHBondContact CB-O 3.2Å; H1138-Y1229 PolarHBondContact CE1-O 2.81Å; H1138-H1231 VanDerWaalsContact NE2-CA 3.29Å; H1138-H1231 WeakPolarHBondContact NE2-CA 3.47Å; H1138-A1232 PolarHBondContact NE2-N 3.31Å; H1138-A1232 VanDerWaalsContact NE2-N 3.15Å
1139	R	91.5	Very high	90.1	Very high	58 Å²	58	29.1 Å²	29.1	22%	0.219	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	150.5	179.1	-71.7	166.8	-64.3	150.8	4.8	111	I1186 S1187 S1188 T1213 I1214 C1215 G1216	R1139-I1186 HydrophobicContact CB-CG2 4.43Å; R1139-S1187 WeakPolarHBondContact CB-O 3.48Å; R1139-S1187 WeakPolarHBondContact CD-O 3.15Å; R1139-S1187 VanDerWaalsContact CG-O 3.23Å; R1139-S1187 WeakPolarHBondContact CG-O 3.47Å; R1139-S1188 WeakPolarHBondContact CD-O 3.33Å; R1139-T1213 WeakPolarHBondContact O-CA 3.27Å; R1139-I1214 PolarHBondContact N-O 3.16Å; R1139-I1214 PolarHBondContact O-N 3.15Å; R1139-C1215 PolarHBondContact NH2-O 3.06Å; R1139-G1216 WeakPolarHBondContact CD-O 3.5Å; R1139-G1216 WeakPolarHBondContact CG-O 3.34Å; R1139-G1216 PolarHBondContact NE-O 3.46Å
1140	V	91.5	Very high	90.3	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	129.3	175.6	-170.8	0	0	0	0	108.9	I1132 V1134 V1142 I1186 S1187 L1192	I1132-V1140 HydrophobicContact CB-CG1 4.05Å; I1132-V1140 HydrophobicContact CB-CG2 4.24Å; I1132-V1140 HydrophobicContact CD1-CG1 3.82Å; I1132-V1140 HydrophobicContact CG2-CG1 3.72Å; I1132-V1140 HydrophobicContact CG2-CG2 3.97Å; V1134-V1140 HydrophobicContact CG1-CG2 3.94Å; V1134-V1140 HydrophobicContact CG2-CG2 3.89Å; V1140-V1142 HydrophobicContact CG1-CG2 4.19Å; V1140-I1186 WeakPolarHBondContact O-CA 3.43Å; V1140-S1187 PolarHBondContact N-OG 2.96Å; V1140-S1187 PolarHBondContact O-N 2.89Å; V1140-S1187 PolarHBondContact O-OG 2.95Å; V1140-L1192 HydrophobicContact CB-CB 3.88Å; V1140-L1192 HydrophobicContact CB-CD2 4.41Å; V1140-L1192 HydrophobicContact CG1-CB 4.11Å; V1140-L1192 HydrophobicContact CG1-CD2 3.99Å; V1140-L1192 HydrophobicContact CG2-CB 3.96Å
1141	K	93	Very high	90.2	Very high	60 Å²	60	32.5 Å²	32.5	26%	0.261	18%	0.181	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	131.9	165.4	-177.5	-165.6	-146.4	175.6	0	109.1	I1143 I1185 I1186 H1211 T1212 I1214	K1141-I1143 HydrophobicContact CD-CD1 3.96Å; K1141-I1143 HydrophobicContact CD-CG1 4.12Å; K1141-I1143 HydrophobicContact CG-CG1 4.17Å; K1141-I1185 CarbonylContact C-O 3.46Å; K1141-I1185 VanDerWaalsContact CA-O 3.28Å; K1141-I1185 WeakPolarHBondContact CA-O 3.44Å; K1141-I1186 HydrophobicContact CB-CG1 4.4Å; K1141-I1186 HydrophobicContact CG-CG1 4.11Å; K1141-H1211 CarbonylContact O-C 3.57Å; K1141-H1211 VanDerWaalsContact O-CA 3.25Å; K1141-H1211 WeakPolarHBondContact O-CA 3.34Å; K1141-T1212 WeakPolarHBondContact CB-O 3.45Å; K1141-T1212 PolarHBondContact N-O 2.67Å; K1141-T1212 PolarHBondContact O-N 2.97Å; K1141-I1214 HydrophobicContact CB-CD1 3.75Å; K1141-I1214 HydrophobicContact CB-CG1 3.81Å; K1141-I1214 HydrophobicContact CD-CD1 3.85Å; K1141-I1214 HydrophobicContact CD-CG1 4.22Å; K1141-I1214 HydrophobicContact CG-CD1 4.08Å
1142	V	94	Very high	90.1	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	128.2	170.9	-179.6	0	0	0	0	109	I1132 V1140 F1144 P1184 I1185 L1192 A1209 Q1210 H1211	I1132-V1142 HydrophobicContact CD1-CG2 3.93Å; V1140-V1142 HydrophobicContact CG1-CG2 4.19Å; V1142-F1144 HydrophobicContact CG1-CE2 4.28Å; V1142-F1144 HydrophobicContact CG1-CZ 4.45Å; V1142-P1184 WeakPolarHBondContact O-CA 3.35Å; V1142-I1185 HydrophobicContact CB-CB 4.48Å; V1142-I1185 PolarHBondContact N-O 3.1Å; V1142-I1185 PolarHBondContact O-N 2.8Å; V1142-L1192 HydrophobicContact CG2-CD2 3.54Å; V1142-A1209 HydrophobicContact CG1-CB 3.87Å; V1142-Q1210 WeakPolarHBondContact CA-O 3.18Å; V1142-H1211 HydrophobicContact CG2-CB 4.22Å
1143	I	94.1	Very high	89.7	Confident	64 Å²	64	41.6 Å²	41.6	33%	0.328	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	118.7	173.7	-55.9	179.5	0	0	0	107.7	K1141 A1145 P1184 A1209 Q1210	K1141-I1143 HydrophobicContact CD-CD1 3.96Å; K1141-I1143 HydrophobicContact CD-CG1 4.12Å; K1141-I1143 HydrophobicContact CG-CG1 4.17Å; I1143-A1145 PolarHBondContact O-N 3.38Å; I1143-P1184 HydrophobicContact CG1-CB 4.22Å; I1143-P1184 HydrophobicContact CG1-CG 4.49Å; I1143-A1209 CarbonylContact O-C 3.56Å; I1143-A1209 WeakPolarHBondContact O-CA 3.32Å; I1143-Q1210 PolarHBondContact N-O 2.79Å; I1143-Q1210 PolarHBondContact O-N 3.43Å
1144	F	93.6	Very high	89.5	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	130.2	170.9	-65.2	-89.8	0	0	0	109.6	V1142 F1147 V1160 K1181 P1182 I1185 F1207 A1209	V1142-F1144 HydrophobicContact CG1-CE2 4.28Å; V1142-F1144 HydrophobicContact CG1-CZ 4.45Å; F1144-F1147 AromaticContact CD1-CD2 3.56Å; F1144-F1147 HydrophobicContact CD1-CD2 3.56Å; F1144-F1147 HydrophobicContact CD1-CE2 4.22Å; F1144-F1147 AromaticContact CE1-CD2 3.79Å; F1144-F1147 HydrophobicContact CE1-CD2 3.79Å; F1144-F1147 AromaticContact CE1-CE2 3.98Å; F1144-F1147 HydrophobicContact CE1-CE2 3.98Å; F1144-F1147 HydrophobicContact CG-CD2 4.13Å; F1144-F1147 HydrophobicContact CZ-CE2 4.43Å; F1144-V1160 HydrophobicContact CZ-CG1 4.21Å; F1144-K1181 HydrophobicContact CB-CG 4.38Å; F1144-K1181 WeakPolarHBondContact O-CE 3.43Å; F1144-K1181 PolarHBondContact O-NZ 2.84Å; F1144-P1182 HydrophobicContact CD2-CB 3.72Å; F1144-P1182 HydrophobicContact CD2-CG 3.75Å; F1144-P1182 HydrophobicContact CE2-CB 3.91Å; F1144-P1182 HydrophobicContact CE2-CG 3.86Å; F1144-P1182 HydrophobicContact CG-CG 4.3Å; F1144-P1182 HydrophobicContact CZ-CG 4.47Å; F1144-I1185 HydrophobicContact CE2-CD1 3.91Å; F1144-F1207 HydrophobicContact CD1-CB 4.07Å; F1144-F1207 AromaticContact CD1-CD2 3.94Å; F1144-F1207 HydrophobicContact CD1-CD2 3.94Å; F1144-F1207 HydrophobicContact CD1-CG 4.13Å; F1144-F1207 HydrophobicContact CE1-CB 4.32Å; F1144-F1207 HydrophobicContact CE1-CD1 4.48Å; F1144-F1207 AromaticContact CE1-CD2 3.62Å; F1144-F1207 HydrophobicContact CE1-CD2 3.62Å; F1144-F1207 HydrophobicContact CE1-CE2 4.01Å; F1144-F1207 AromaticContact CE1-CG 3.89Å; F1144-F1207 HydrophobicContact CE1-CG 3.89Å; F1144-A1209 HydrophobicContact CD1-CB 3.7Å; F1144-A1209 HydrophobicContact CE1-CB 3.97Å; F1144-A1209 HydrophobicContact CG-CB 4.18Å
1145	A	88.9	Confident	89.6	Confident	46 Å²	46	47.1 Å²	47.1	38%	0.38	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	-52.1	167.6	0	0	0	0	0	109.3	I1143 K1181 R1208	I1143-A1145 PolarHBondContact O-N 3.38Å; A1145-K1181 PolarHBondContact O-NZ 3.25Å; A1145-R1208 WeakPolarHBondContact CA-O 3.34Å; A1145-R1208 HydrophobicContact CB-CG 4.31Å; A1145-R1208 WeakPolarHBondContact CB-O 3.26Å; A1145-R1208 PolarHBondContact N-O 3.03Å
1146	D	90	Very high	89.8	Confident	55 Å²	55	48.4 Å²	48.4	29%	0.294	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	147	-178.9	-179.2	30.5	0	0	0	109.8	W1118 F1207 R1208	W1118-D1146 HydrophobicContact CZ2-CB 4.49Å; W1118-D1146 PolarHBondContact NE1-OD2 3.42Å; D1146-F1207 WeakPolarHBondContact O-CA 3.27Å; D1146-F1207 VanDerWaalsContact O-CB 3.31Å; D1146-F1207 WeakPolarHBondContact O-CB 3.28Å; D1146-R1208 HydrophobicContact CB-CB 4.3Å; D1146-R1208 PolarHBondContact N-O 2.98Å; D1146-R1208 VanDerWaalsContact N-O 3.08Å; D1146-R1208 PolarHBondContact O-N 2.62Å
1147	F	94.1	Very high	90.3	Very high	7 Å²	7	50.1 Å²	50.1	3%	0.031	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.5	109.9	-174.5	-169.8	-87.3	0	0	0	112	F1144 L1149 V1160 G1178 K1181 P1182 F1207	F1144-F1147 AromaticContact CD1-CD2 3.56Å; F1144-F1147 HydrophobicContact CD1-CD2 3.56Å; F1144-F1147 HydrophobicContact CD1-CE2 4.22Å; F1144-F1147 AromaticContact CE1-CD2 3.79Å; F1144-F1147 HydrophobicContact CE1-CD2 3.79Å; F1144-F1147 AromaticContact CE1-CE2 3.98Å; F1144-F1147 HydrophobicContact CE1-CE2 3.98Å; F1144-F1147 HydrophobicContact CG-CD2 4.13Å; F1144-F1147 HydrophobicContact CZ-CE2 4.43Å; F1147-L1149 HydrophobicContact CE1-CD1 4.19Å; F1147-L1149 HydrophobicContact CE1-CG 4.24Å; F1147-L1149 HydrophobicContact CE2-CD1 4.02Å; F1147-L1149 HydrophobicContact CE2-CG 4.46Å; F1147-L1149 HydrophobicContact CZ-CD1 3.56Å; F1147-L1149 HydrophobicContact CZ-CG 4.04Å; F1147-V1160 HydrophobicContact CE2-CB 4.37Å; F1147-V1160 HydrophobicContact CE2-CG2 4.16Å; F1147-G1178 WeakPolarHBondContact CD1-O 3.46Å; F1147-G1178 VanDerWaalsContact CE1-O 3.32Å; F1147-G1178 WeakPolarHBondContact CE1-O 3.23Å; F1147-K1181 HydrophobicContact CB-CB 4.44Å; F1147-P1182 HydrophobicContact CD2-CG 4.12Å; F1147-P1182 HydrophobicContact CE1-CG 4.43Å; F1147-P1182 HydrophobicContact CE2-CG 3.97Å; F1147-P1182 HydrophobicContact CG-CG 4.42Å; F1147-P1182 HydrophobicContact CZ-CG 4.14Å; F1147-F1207 HydrophobicContact CB-CB 4.37Å; F1147-F1207 HydrophobicContact CD2-CB 3.68Å; F1147-F1207 HydrophobicContact CD2-CD1 4.43Å; F1147-F1207 HydrophobicContact CD2-CG 4.22Å; F1147-F1207 HydrophobicContact CE2-CB 4.41Å; F1147-F1207 HydrophobicContact CE2-CD1 4.35Å; F1147-F1207 HydrophobicContact CG-CB 4.35Å
1148	E	92.8	Very high	90.9	Very high	52 Å²	52	50 Å²	50	24%	0.243	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	103.8	175.7	-166.1	-175.3	173.6	0	0	110.1	R1204 K1205 G1206	E1148-R1204 HydrophobicContact CG-CB 4.1Å; E1148-R1204 HydrophobicContact CG-CG 4.32Å; E1148-R1204 WeakPolarHBondContact O-CB 3.4Å; E1148-K1205 IonicContact OE2-NZ 2.68Å; E1148-K1205 PolarHBondContact OE2-NZ 2.91Å; E1148-G1206 CarbonylContact C-O 3.58Å; E1148-G1206 PolarHBondContact N-O 2.91Å; E1148-G1206 WeakPolarHBondContact O-CA 3.13Å; E1148-G1206 PolarHBondContact O-N 3.16Å
1149	L	92.8	Very high	91	Very high	4 Å²	4	51.2 Å²	51.2	2%	0.021	26%	0.261	C	S	.	.			trans	-116.7	172.9	173.8	-58.9	-178.1	0	0	0	110.4	Y1122 F1147 D1158 V1160 G1178 F1196 F1207	Y1122-L1149 HydrophobicContact CD1-CD2 4.35Å; Y1122-L1149 HydrophobicContact CE1-CD2 3.54Å; F1147-L1149 HydrophobicContact CE1-CD1 4.19Å; F1147-L1149 HydrophobicContact CE1-CG 4.24Å; F1147-L1149 HydrophobicContact CE2-CD1 4.02Å; F1147-L1149 HydrophobicContact CE2-CG 4.46Å; F1147-L1149 HydrophobicContact CZ-CD1 3.56Å; F1147-L1149 HydrophobicContact CZ-CG 4.04Å; L1149-D1158 HydrophobicContact CB-CB 4.32Å; L1149-V1160 HydrophobicContact CD1-CG2 3.78Å; L1149-G1178 PolarHBondContact N-O 3.17Å; L1149-G1178 CarbonylContact O-C 3.45Å; L1149-G1178 WeakPolarHBondContact O-CA 2.96Å; L1149-F1196 HydrophobicContact CD1-CD2 4.38Å; L1149-F1196 HydrophobicContact CD1-CE2 4.17Å; L1149-F1196 HydrophobicContact CD2-CD2 4.43Å; L1149-F1196 HydrophobicContact CD2-CE2 3.66Å; L1149-F1196 HydrophobicContact CD2-CZ 4.19Å; L1149-F1207 HydrophobicContact CD2-CD1 4.49Å
1150	E	93.1	Very high	91.1	Very high	26 Å²	26	48.5 Å²	48.5	12%	0.121	25%	0.25	C	S	.	.			trans	-57.5	142.8	168	-165.2	-179.1	-160.6	0	0	111.2	Y1122 Y1157 D1158 C1177 G1178 V1202	Y1122-E1150 PolarHBondContact OH-N 2.99Å; E1150-Y1157 HydrophobicContact CG-CD2 4.29Å; E1150-Y1157 WeakPolarHBondContact OE2-CB 3.47Å; E1150-Y1157 WeakPolarHBondContact OE2-CD2 3.34Å; E1150-D1158 HydrophobicContact CB-CB 3.91Å; E1150-C1177 WeakPolarHBondContact O-CB 3.4Å; E1150-G1178 PolarHBondContact O-N 2.72Å; E1150-V1202 HydrophobicContact CG-CB 4.21Å; E1150-V1202 HydrophobicContact CG-CG1 4.01Å; E1150-V1202 WeakPolarHBondContact OE1-CB 3.45Å
1151	S	88.3	Confident	91.3	Very high	93 Å²	93	49.2 Å²	49.2	65%	0.65	25%	0.254	S	S	*	.			trans	-99.5	111.1	-178	57.2	0	0	0	0	112
1152	H	90.6	Very high	91.3	Very high	52 Å²	52	46.3 Å²	46.3	24%	0.241	24%	0.242	C	C	.	.			trans	-122.9	146	169.3	-173.5	-114.1	0	0	0	111.6	Q1154 C1155 T1156 Y1157 C1177	H1152-Q1154 PolarHBondContact ND1-N 3.32Å; H1152-Q1154 PolarHBondContact O-N 2.88Å; H1152-Q1154 VanDerWaalsContact O-N 3.1Å; H1152-C1155 PolarHBondContact O-N 3.36Å; H1152-C1155 VanDerWaalsContact O-N 3.08Å; H1152-T1156 PolarHBondContact CE1-OG1 3.49Å; H1152-T1156 PolarHBondContact ND1-OG1 3.22Å; H1152-Y1157 HydrophobicContact CB-CD2 3.69Å; H1152-Y1157 HydrophobicContact CB-CE2 3.92Å; H1152-Y1157 HydrophobicContact CB-CG 4.19Å; H1152-Y1157 AromaticContact CD2-CE2 3.53Å; H1152-Y1157 AromaticContact CD2-CZ 3.62Å; H1152-Y1157 AromaticContact CG-CE2 3.85Å; H1152-C1177 PolarHBondContact O-SG 3.05Å
1153	Q	82.9	Confident	91.4	Very high	198 Å²	198	47.9 Å²	47.9	93%	0.925	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-23.5	-178.2	-67.1	-170.6	-0.9	0	0	113.9
1154	Q	86.8	Confident	91.3	Very high	142 Å²	142	45.9 Å²	45.9	66%	0.664	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-118.7	10.3	177.1	-62.8	-179.7	-29	0	0	113	H1152 T1156 Q1175	H1152-Q1154 PolarHBondContact ND1-N 3.32Å; H1152-Q1154 PolarHBondContact O-N 2.88Å; H1152-Q1154 VanDerWaalsContact O-N 3.1Å; Q1154-T1156 VanDerWaalsContact C-N 3.31Å; Q1154-T1156 HydrophobicContact CB-CG2 3.91Å; Q1154-T1156 PolarHBondContact O-N 3.1Å; Q1154-Q1175 PolarHBondContact O-NE2 3.47Å
1155	C	88.8	Confident	91.1	Very high	22 Å²	22	46.1 Å²	46.1	15%	0.149	24%	0.24	C	C	.	.			trans	48.1	45.8	-177.6	-62.6	0	0	0	0	115	H1152 Q1159 Q1175 C1177	H1152-C1155 PolarHBondContact O-N 3.36Å; H1152-C1155 VanDerWaalsContact O-N 3.08Å; C1155-Q1159 VanDerWaalsContact O-CB 3.32Å; C1155-Q1159 WeakPolarHBondContact O-CB 3.39Å; C1155-Q1159 PolarHBondContact O-NE2 3.23Å; C1155-Q1159 PolarHBondContact O-OE1 3.24Å; C1155-Q1175 HydrophobicContact CB-CG 3.95Å; C1155-Q1175 PolarHBondContact O-NE2 2.71Å; C1155-C1177 WeakPolarHBondContact CA-SG 3.22Å; C1155-C1177 HydrophobicContact CB-CB 3.55Å; C1155-C1177 WeakPolarHBondContact CB-SG 3.46Å; C1155-C1177 WeakPolarHBondContact SG-CB 3.35Å; C1155-C1177 PolarHBondContact SG-N 2.79Å; C1155-C1177 VanDerWaalsContact SG-N 3.37Å; C1155-C1177 CovalentContact SG-SG 2.04Å; C1155-C1177 PolarHBondContact SG-SG 3.34Å
1156	T	87.4	Confident	91	Very high	69 Å²	69	46.4 Å²	46.4	42%	0.423	24%	0.238	S	C	.	.			trans	-97.8	-13.9	-175.7	52	0	0	0	0	114.3	H1152 Q1154 Q1159	H1152-T1156 PolarHBondContact CE1-OG1 3.49Å; H1152-T1156 PolarHBondContact ND1-OG1 3.22Å; Q1154-T1156 VanDerWaalsContact C-N 3.31Å; Q1154-T1156 HydrophobicContact CB-CG2 3.91Å; Q1154-T1156 PolarHBondContact O-N 3.1Å; T1156-Q1159 PolarHBondContact O-NE2 2.82Å
1157	Y	90.3	Very high	90.9	Very high	99 Å²	99	46.7 Å²	46.7	39%	0.388	24%	0.242	S	C	.	.	S	Bend	trans	-84.5	-125.6	170.2	-47.5	-33.5	0	0	0	108.1	E1150 H1152 Q1159	E1150-Y1157 HydrophobicContact CG-CD2 4.29Å; E1150-Y1157 WeakPolarHBondContact OE2-CB 3.47Å; E1150-Y1157 WeakPolarHBondContact OE2-CD2 3.34Å; H1152-Y1157 HydrophobicContact CB-CD2 3.69Å; H1152-Y1157 HydrophobicContact CB-CE2 3.92Å; H1152-Y1157 HydrophobicContact CB-CG 4.19Å; H1152-Y1157 AromaticContact CD2-CE2 3.53Å; H1152-Y1157 AromaticContact CD2-CZ 3.62Å; H1152-Y1157 AromaticContact CG-CE2 3.85Å; Y1157-Q1159 PolarHBondContact O-N 2.93Å; Y1157-Q1159 PolarHBondContact O-NE2 3.28Å
1158	D	93.5	Very high	90.5	Very high	1 Å²	1	50.3 Å²	50.3	1%	0.005	26%	0.261	C	S	.	.	S	Bend	trans	-60	127.5	171	-62.5	-22.9	0	0	0	112.2	Y1122 L1149 E1150 C1177 N1197 S1198 D1199	Y1122-D1158 WeakPolarHBondContact CE2-OD2 3.36Å; Y1122-D1158 PolarHBondContact OH-OD2 2.91Å; L1149-D1158 HydrophobicContact CB-CB 4.32Å; E1150-D1158 HydrophobicContact CB-CB 3.91Å; D1158-C1177 VanDerWaalsContact O-CB 3.26Å; D1158-C1177 WeakPolarHBondContact O-CB 3.33Å; D1158-N1197 WeakPolarHBondContact CA-O 3.43Å; D1158-S1198 WeakPolarHBondContact OD1-CA 3.18Å; D1158-S1198 WeakPolarHBondContact OD1-CB 3.34Å; D1158-D1199 PolarHBondContact OD1-N 3.35Å
1159	Q	93.8	Very high	90.2	Very high	28 Å²	28	53 Å²	53	13%	0.131	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.9	146.7	-171	64.4	-172	-71	0	0	113.8	C1155 T1156 Y1157 Y1176 F1196 N1197	C1155-Q1159 VanDerWaalsContact O-CB 3.32Å; C1155-Q1159 WeakPolarHBondContact O-CB 3.39Å; C1155-Q1159 PolarHBondContact O-NE2 3.23Å; C1155-Q1159 PolarHBondContact O-OE1 3.24Å; T1156-Q1159 PolarHBondContact O-NE2 2.82Å; Y1157-Q1159 PolarHBondContact O-N 2.93Å; Y1157-Q1159 PolarHBondContact O-NE2 3.28Å; Q1159-Y1176 WeakPolarHBondContact CA-O 3.37Å; Q1159-F1196 WeakPolarHBondContact O-CA 3.31Å; Q1159-F1196 WeakPolarHBondContact O-CD2 3.07Å; Q1159-N1197 HydrophobicContact CG-CB 4.21Å; Q1159-N1197 PolarHBondContact N-O 3.15Å; Q1159-N1197 PolarHBondContact O-N 3.2Å
1160	V	94	Very high	90	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	131	168.5	170	0	0	0	0	109.5	F1144 F1147 L1149 Q1175 Y1176 L1194 T1195 F1196 F1207	F1144-V1160 HydrophobicContact CZ-CG1 4.21Å; F1147-V1160 HydrophobicContact CE2-CB 4.37Å; F1147-V1160 HydrophobicContact CE2-CG2 4.16Å; L1149-V1160 HydrophobicContact CD1-CG2 3.78Å; V1160-Q1175 CarbonylContact O-C 3.57Å; V1160-Q1175 VanDerWaalsContact O-CA 3.29Å; V1160-Q1175 WeakPolarHBondContact O-CA 3.36Å; V1160-Y1176 HydrophobicContact CG1-CD2 4.49Å; V1160-Y1176 PolarHBondContact N-O 3.41Å; V1160-Y1176 PolarHBondContact O-N 2.94Å; V1160-L1194 HydrophobicContact CG1-CD1 3.57Å; V1160-L1194 HydrophobicContact CG1-CG 4.09Å; V1160-T1195 CarbonylContact C-O 3.6Å; V1160-T1195 VanDerWaalsContact CA-O 3.26Å; V1160-T1195 WeakPolarHBondContact CA-O 3.4Å; V1160-F1196 HydrophobicContact CG2-CB 4.13Å; V1160-F1196 HydrophobicContact CG2-CD2 3.83Å; V1160-F1196 HydrophobicContact CG2-CG 4.37Å; V1160-F1207 HydrophobicContact CG2-CD1 3.69Å; V1160-F1207 HydrophobicContact CG2-CE1 3.2Å; V1160-F1207 HydrophobicContact CG2-CZ 3.98Å
1161	I	93.9	Very high	89.8	Confident	15 Å²	15	56 Å²	56	8%	0.077	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	138.7	175.1	-51.4	173.3	0	0	0	109.3	Y1163 F1172 G1174 Q1175 T1195	I1161-Y1163 HydrophobicContact CB-CE2 3.98Å; I1161-Y1163 HydrophobicContact CG2-CD2 4.08Å; I1161-Y1163 HydrophobicContact CG2-CE1 4.1Å; I1161-Y1163 HydrophobicContact CG2-CE2 3.52Å; I1161-F1172 HydrophobicContact CG2-CD2 3.76Å; I1161-F1172 HydrophobicContact CG2-CE2 3.67Å; I1161-G1174 WeakPolarHBondContact CA-O 3.23Å; I1161-Q1175 HydrophobicContact CG1-CB 4.38Å; I1161-Q1175 HydrophobicContact CG1-CG 4.19Å; I1161-T1195 PolarHBondContact N-O 3.07Å; I1161-T1195 PolarHBondContact O-N 3.02Å
1162	A	94.7	Very high	89.8	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	129	172.5	0	0	0	0	0	111.1	L1173 G1174 I1185 L1194	A1162-L1173 HydrophobicContact CB-CB 4.14Å; A1162-L1173 WeakPolarHBondContact O-CB 3.32Å; A1162-L1173 PolarHBondContact O-N 2.8Å; A1162-G1174 PolarHBondContact N-O 2.87Å; A1162-I1185 HydrophobicContact CB-CD1 3.87Å; A1162-I1185 HydrophobicContact CB-CG2 4.03Å; A1162-L1194 HydrophobicContact CB-CD1 4.05Å
1163	Y	95.2	Very high	89.8	Confident	33 Å²	33	57.7 Å²	57.7	13%	0.129	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	134.9	176	-58.3	-88.2	0	0	0	110.9	I1161 G1165 N1168 A1171 L1192 L1193 T1195	I1161-Y1163 HydrophobicContact CB-CE2 3.98Å; I1161-Y1163 HydrophobicContact CG2-CD2 4.08Å; I1161-Y1163 HydrophobicContact CG2-CE1 4.1Å; I1161-Y1163 HydrophobicContact CG2-CE2 3.52Å; Y1163-G1165 VanDerWaalsContact C-N 3.26Å; Y1163-G1165 PolarHBondContact O-N 2.83Å; Y1163-N1168 HydrophobicContact CE1-CB 4.31Å; Y1163-N1168 VanDerWaalsContact CE1-O 3.24Å; Y1163-N1168 WeakPolarHBondContact CE1-O 3.37Å; Y1163-N1168 HydrophobicContact CE2-CB 4.15Å; Y1163-A1171 CarbonylContact C-O 3.5Å; Y1163-A1171 WeakPolarHBondContact CA-O 3.42Å; Y1163-L1192 WeakPolarHBondContact O-CD1 3.4Å; Y1163-L1193 HydrophobicContact CD2-CG 4.48Å; Y1163-L1193 PolarHBondContact N-O 2.86Å; Y1163-L1193 PolarHBondContact O-N 3.3Å; Y1163-T1195 HydrophobicContact CD2-CG2 4.29Å; Y1163-T1195 HydrophobicContact CE2-CG2 4.03Å
1164	D	91.5	Very high	90.2	Very high	22 Å²	22	48.7 Å²	48.7	12%	0.118	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	65.2	-179.9	-164	17.2	0	0	0	111.6	A1171 L1173 S1187 S1188	D1164-A1171 HydrophobicContact CB-CB 4.24Å; D1164-A1171 PolarHBondContact N-O 2.8Å; D1164-L1173 HydrophobicContact CB-CD1 3.87Å; D1164-L1173 HydrophobicContact CB-CD2 3.94Å; D1164-L1173 HydrophobicContact CB-CG 3.83Å; D1164-S1187 WeakPolarHBondContact OD1-CA 3.34Å; D1164-S1187 WeakPolarHBondContact OD1-CB 3.36Å; D1164-S1188 VanDerWaalsContact CG-OG 3.32Å; D1164-S1188 PolarHBondContact OD1-N 2.72Å; D1164-S1188 PolarHBondContact OD1-OG 2.83Å; D1164-S1188 WeakPolarHBondContact OD2-CB 3.28Å; D1164-S1188 PolarHBondContact OD2-N 2.98Å; D1164-S1188 PolarHBondContact OD2-OG 3.12Å
1165	G	89.7	Confident	90.5	Very high	5 Å²	5	45.3 Å²	45.3	5%	0.052	26%	0.256	C	S	.	.	S	Bend	trans	158.1	-172	-179.5	0	0	0	0	0	113.1	Y1163 T1167 S1170 Q1191 L1192 L1193	Y1163-G1165 VanDerWaalsContact C-N 3.26Å; Y1163-G1165 PolarHBondContact O-N 2.83Å; G1165-T1167 PolarHBondContact O-N 3Å; G1165-S1170 WeakPolarHBondContact CA-OG 3.35Å; G1165-Q1191 PolarHBondContact N-O 3.21Å; G1165-L1192 CarbonylContact O-C 3.6Å; G1165-L1193 VanDerWaalsContact O-CB 3.25Å; G1165-L1193 WeakPolarHBondContact O-CB 3.42Å; G1165-L1193 PolarHBondContact O-N 2.98Å
1166	P	86.5	Confident	90.8	Very high	51 Å²	51	46.9 Å²	46.9	33%	0.331	26%	0.259	S	S	.	.	S	Bend	trans	-82.4	-1.3	-171.6	31.8	-35.5	0	0	0	115.5	K1131	K1131-P1166 HydrophobicContact CD-CB 4.14Å
1167	T	88.6	Confident	91.1	Very high	61 Å²	61	44.5 Å²	44.5	37%	0.374	25%	0.245	S	C	.	.	S	Bend	trans	-145.6	158	-172.2	62.1	0	0	0	0	112.9	G1165 S1169 S1170	G1165-T1167 PolarHBondContact O-N 3Å; T1167-S1169 PolarHBondContact O-N 3.41Å; T1167-S1169 PolarHBondContact OG1-OG 3.2Å; T1167-S1170 PolarHBondContact N-OG 2.67Å; T1167-S1170 WeakPolarHBondContact O-CB 3.38Å; T1167-S1170 PolarHBondContact O-N 2.68Å; T1167-S1170 PolarHBondContact O-OG 2.9Å; T1167-S1170 PolarHBondContact OG1-OG 3.4Å
1168	N	84.6	Confident	91.2	Very high	83 Å²	83	40 Å²	40	44%	0.444	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-6.1	173.9	-56.8	7.3	0	0	0	113.9	Y1163 L1193	Y1163-N1168 HydrophobicContact CE1-CB 4.31Å; Y1163-N1168 VanDerWaalsContact CE1-O 3.24Å; Y1163-N1168 WeakPolarHBondContact CE1-O 3.37Å; Y1163-N1168 HydrophobicContact CE2-CB 4.15Å; N1168-L1193 WeakPolarHBondContact OD1-CD2 3.26Å
1169	S	87.1	Confident	91	Very high	110 Å²	110	44.5 Å²	44.5	77%	0.769	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.7	1.7	172.5	69.6	0	0	0	0	113.2	T1167	T1167-S1169 PolarHBondContact O-N 3.41Å; T1167-S1169 PolarHBondContact OG1-OG 3.2Å
1170	S	88.8	Confident	90.9	Very high	28 Å²	28	53.7 Å²	53.7	20%	0.196	29%	0.294	C	S	.	.	S	Bend	trans	-78.9	168.8	174	-51.3	0	0	0	0	110.2	G1165 T1167 F1172	G1165-S1170 WeakPolarHBondContact CA-OG 3.35Å; T1167-S1170 PolarHBondContact N-OG 2.67Å; T1167-S1170 WeakPolarHBondContact O-CB 3.38Å; T1167-S1170 PolarHBondContact O-N 2.68Å; T1167-S1170 PolarHBondContact O-OG 2.9Å; T1167-S1170 PolarHBondContact OG1-OG 3.4Å; S1170-F1172 PolarHBondContact O-N 3.27Å
1171	A	88	Confident	90.7	Very high	64 Å²	64	59 Å²	59	53%	0.529	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62	135.4	-175.2	0	0	0	0	0	112	Y1163 D1164	Y1163-A1171 CarbonylContact C-O 3.5Å; Y1163-A1171 WeakPolarHBondContact CA-O 3.42Å; D1164-A1171 HydrophobicContact CB-CB 4.24Å; D1164-A1171 PolarHBondContact N-O 2.8Å
1172	F	89.8	Confident	90.6	Very high	119 Å²	119	58.9 Å²	58.9	52%	0.522	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	123.9	-177.5	172.6	-89.2	0	0	0	110.9	I1161 S1170 Q1175	I1161-F1172 HydrophobicContact CG2-CD2 3.76Å; I1161-F1172 HydrophobicContact CG2-CE2 3.67Å; S1170-F1172 PolarHBondContact O-N 3.27Å; F1172-Q1175 HydrophobicContact CE2-CB 3.9Å; F1172-Q1175 HydrophobicContact CZ-CB 3.6Å
1173	L	90.8	Very high	90.4	Very high	62 Å²	62	61.2 Å²	61.2	33%	0.325	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	-28.5	178.4	-64.8	173.5	0	0	0	112.9	A1162 D1164 I1185 L1192	A1162-L1173 HydrophobicContact CB-CB 4.14Å; A1162-L1173 WeakPolarHBondContact O-CB 3.32Å; A1162-L1173 PolarHBondContact O-N 2.8Å; D1164-L1173 HydrophobicContact CB-CD1 3.87Å; D1164-L1173 HydrophobicContact CB-CD2 3.94Å; D1164-L1173 HydrophobicContact CB-CG 3.83Å; L1173-I1185 HydrophobicContact CB-CG2 4.38Å; L1173-I1185 HydrophobicContact CD1-CG2 3.84Å; L1173-L1192 HydrophobicContact CD1-CD1 3.49Å; L1173-L1192 VanDerWaalsContact CD1-CD1 3.49Å
1174	G	90.4	Very high	90.2	Very high	8 Å²	8	63.7 Å²	63.7	8%	0.082	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	164.9	164.1	177.7	0	0	0	0	0	114.2	I1161 A1162	I1161-G1174 WeakPolarHBondContact CA-O 3.23Å; A1162-G1174 PolarHBondContact N-O 2.87Å
1175	Q	93.3	Very high	90.2	Very high	72 Å²	72	63 Å²	63	34%	0.336	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	134.2	179	176.6	-173	14.8	0	0	107.9	Q1154 C1155 V1160 I1161 F1172	Q1154-Q1175 PolarHBondContact O-NE2 3.47Å; C1155-Q1175 HydrophobicContact CB-CG 3.95Å; C1155-Q1175 PolarHBondContact O-NE2 2.71Å; V1160-Q1175 CarbonylContact O-C 3.57Å; V1160-Q1175 VanDerWaalsContact O-CA 3.29Å; V1160-Q1175 WeakPolarHBondContact O-CA 3.36Å; I1161-Q1175 HydrophobicContact CG1-CB 4.38Å; I1161-Q1175 HydrophobicContact CG1-CG 4.19Å; F1172-Q1175 HydrophobicContact CE2-CB 3.9Å; F1172-Q1175 HydrophobicContact CZ-CB 3.6Å
1176	Y	94.6	Very high	90.3	Very high	55 Å²	55	66.1 Å²	66.1	22%	0.216	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	139.7	-167.2	-48.7	-81.6	0	0	0	111.8	Q1159 V1160 P1182 I1185	Q1159-Y1176 WeakPolarHBondContact CA-O 3.37Å; V1160-Y1176 HydrophobicContact CG1-CD2 4.49Å; V1160-Y1176 PolarHBondContact N-O 3.41Å; V1160-Y1176 PolarHBondContact O-N 2.94Å; Y1176-P1182 HydrophobicContact CD1-CB 3.77Å; Y1176-P1182 HydrophobicContact CD1-CG 3.69Å; Y1176-P1182 HydrophobicContact CD2-CG 4.3Å; Y1176-P1182 HydrophobicContact CE1-CB 3.9Å; Y1176-P1182 HydrophobicContact CE1-CG 4.33Å; Y1176-P1182 HydrophobicContact CG-CB 4.13Å; Y1176-P1182 HydrophobicContact CG-CG 3.67Å; Y1176-I1185 HydrophobicContact CD2-CD1 4.38Å; Y1176-I1185 HydrophobicContact CE2-CD1 3.52Å; Y1176-I1185 HydrophobicContact CE2-CG1 4.47Å
1177	C	93.6	Very high	90.6	Very high	18 Å²	18	63.9 Å²	63.9	12%	0.122	36%	0.358	C	S	.	.			trans	-154.9	178	178.3	70.5	0	0	0	0	111	E1150 H1152 C1155 D1158	E1150-C1177 WeakPolarHBondContact O-CB 3.4Å; H1152-C1177 PolarHBondContact O-SG 3.05Å; C1155-C1177 WeakPolarHBondContact CA-SG 3.22Å; C1155-C1177 HydrophobicContact CB-CB 3.55Å; C1155-C1177 WeakPolarHBondContact CB-SG 3.46Å; C1155-C1177 WeakPolarHBondContact SG-CB 3.35Å; C1155-C1177 PolarHBondContact SG-N 2.79Å; C1155-C1177 VanDerWaalsContact SG-N 3.37Å; C1155-C1177 CovalentContact SG-SG 2.04Å; C1155-C1177 PolarHBondContact SG-SG 3.34Å; D1158-C1177 VanDerWaalsContact O-CB 3.26Å; D1158-C1177 WeakPolarHBondContact O-CB 3.33Å
1178	G	92.2	Very high	90.5	Very high	6 Å²	6	63.6 Å²	63.6	6%	0.062	36%	0.359	C	S	.	.	T	Hydrogen-bonded Turn	trans	70	-160.4	-176	0	0	0	0	0	113.8	F1147 L1149 E1150	F1147-G1178 WeakPolarHBondContact CD1-O 3.46Å; F1147-G1178 VanDerWaalsContact CE1-O 3.32Å; F1147-G1178 WeakPolarHBondContact CE1-O 3.23Å; L1149-G1178 PolarHBondContact N-O 3.17Å; L1149-G1178 CarbonylContact O-C 3.45Å; L1149-G1178 WeakPolarHBondContact O-CA 2.96Å; E1150-G1178 PolarHBondContact O-N 2.72Å
1179	S	90.2	Very high	90.6	Very high	95 Å²	95	64.3 Å²	64.3	66%	0.664	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.4	2.8	-179.4	55.3	0	0	0	0	114.6	K1181	S1179-K1181 PolarHBondContact O-N 2.67Å; S1179-K1181 VanDerWaalsContact O-N 3.14Å
1180	R	90.5	Very high	90.7	Very high	221 Å²	221	61 Å²	61	83%	0.834	33%	0.333	S	S	*	.			trans	-85.5	89.4	179	-169.2	-176.7	179.6	-143.9	-1	110.8
1181	K	90.1	Very high	90.8	Very high	110 Å²	110	62.1 Å²	62.1	48%	0.478	34%	0.335	S	S	.	.			trans	-31.4	118.1	167.6	176.4	167.4	170.9	152.1	0	113.6	F1144 A1145 F1147 S1179	F1144-K1181 HydrophobicContact CB-CG 4.38Å; F1144-K1181 WeakPolarHBondContact O-CE 3.43Å; F1144-K1181 PolarHBondContact O-NZ 2.84Å; A1145-K1181 PolarHBondContact O-NZ 3.25Å; F1147-K1181 HydrophobicContact CB-CB 4.44Å; S1179-K1181 PolarHBondContact O-N 2.67Å; S1179-K1181 VanDerWaalsContact O-N 3.14Å
1182	P	91.9	Very high	91.1	Very high	14 Å²	14	59 Å²	59	9%	0.091	31%	0.31	C	S	.	.	P	Polyproline II helix	trans	-63.1	156.1	176.6	-24.5	34.6	0	0	0	113.6	F1144 F1147 Y1176	F1144-P1182 HydrophobicContact CD2-CB 3.72Å; F1144-P1182 HydrophobicContact CD2-CG 3.75Å; F1144-P1182 HydrophobicContact CE2-CB 3.91Å; F1144-P1182 HydrophobicContact CE2-CG 3.86Å; F1144-P1182 HydrophobicContact CG-CG 4.3Å; F1144-P1182 HydrophobicContact CZ-CG 4.47Å; F1147-P1182 HydrophobicContact CD2-CG 4.12Å; F1147-P1182 HydrophobicContact CE1-CG 4.43Å; F1147-P1182 HydrophobicContact CE2-CG 3.97Å; F1147-P1182 HydrophobicContact CG-CG 4.42Å; F1147-P1182 HydrophobicContact CZ-CG 4.14Å; Y1176-P1182 HydrophobicContact CD1-CB 3.77Å; Y1176-P1182 HydrophobicContact CD1-CG 3.69Å; Y1176-P1182 HydrophobicContact CD2-CG 4.3Å; Y1176-P1182 HydrophobicContact CE1-CB 3.9Å; Y1176-P1182 HydrophobicContact CE1-CG 4.33Å; Y1176-P1182 HydrophobicContact CG-CB 4.13Å; Y1176-P1182 HydrophobicContact CG-CG 3.67Å
1183	G	90	Very high	91.3	Very high	49 Å²	49	53.8 Å²	53.8	51%	0.505	29%	0.287	S	S	.	.	P	Polyproline II helix	trans	-71.4	171.4	167.4	0	0	0	0	0	112.4	I1185	G1183-I1185 PolarHBondContact O-N 3.01Å
1184	P	91.4	Very high	91.4	Very high	85 Å²	85	50.9 Å²	50.9	55%	0.552	27%	0.272	S	S	*	.	P	Polyproline II helix	trans	-60.1	119.4	177.3	-23.1	34.7	0	0	0	111.8	V1142 I1143	V1142-P1184 WeakPolarHBondContact O-CA 3.35Å; I1143-P1184 HydrophobicContact CG1-CB 4.22Å; I1143-P1184 HydrophobicContact CG1-CG 4.49Å
1185	I	93.1	Very high	91.5	Very high	8 Å²	8	50.6 Å²	50.6	4%	0.041	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	134.8	174.7	-54.8	179.6	0	0	0	107.7	K1141 V1142 F1144 A1162 L1173 Y1176 G1183 L1192	K1141-I1185 CarbonylContact C-O 3.46Å; K1141-I1185 VanDerWaalsContact CA-O 3.28Å; K1141-I1185 WeakPolarHBondContact CA-O 3.44Å; V1142-I1185 HydrophobicContact CB-CB 4.48Å; V1142-I1185 PolarHBondContact N-O 3.1Å; V1142-I1185 PolarHBondContact O-N 2.8Å; F1144-I1185 HydrophobicContact CE2-CD1 3.91Å; A1162-I1185 HydrophobicContact CB-CD1 3.87Å; A1162-I1185 HydrophobicContact CB-CG2 4.03Å; L1173-I1185 HydrophobicContact CB-CG2 4.38Å; L1173-I1185 HydrophobicContact CD1-CG2 3.84Å; Y1176-I1185 HydrophobicContact CD2-CD1 4.38Å; Y1176-I1185 HydrophobicContact CE2-CD1 3.52Å; Y1176-I1185 HydrophobicContact CE2-CG1 4.47Å; G1183-I1185 PolarHBondContact O-N 3.01Å; I1185-L1192 HydrophobicContact CG2-CD1 4.38Å
1186	I	90.9	Very high	91.5	Very high	70 Å²	70	47.1 Å²	47.1	36%	0.359	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	126.6	179.5	-56.4	175.3	0	0	0	108.5	R1139 V1140 K1141 I1214	R1139-I1186 HydrophobicContact CB-CG2 4.43Å; V1140-I1186 WeakPolarHBondContact O-CA 3.43Å; K1141-I1186 HydrophobicContact CB-CG1 4.4Å; K1141-I1186 HydrophobicContact CG-CG1 4.11Å; I1186-I1214 HydrophobicContact CD1-CD1 4Å; I1186-I1214 HydrophobicContact CG1-CD1 4.34Å; I1186-I1214 HydrophobicContact CG2-CD1 4.36Å
1187	S	92.5	Very high	91.3	Very high	3 Å²	3	46.7 Å²	46.7	2%	0.021	25%	0.254	C	S	.	.			trans	-73.8	156.5	173	60	0	0	0	0	111.9	R1139 V1140 D1164 Q1189	R1139-S1187 WeakPolarHBondContact CB-O 3.48Å; R1139-S1187 WeakPolarHBondContact CD-O 3.15Å; R1139-S1187 VanDerWaalsContact CG-O 3.23Å; R1139-S1187 WeakPolarHBondContact CG-O 3.47Å; V1140-S1187 PolarHBondContact N-OG 2.96Å; V1140-S1187 PolarHBondContact O-N 2.89Å; V1140-S1187 PolarHBondContact O-OG 2.95Å; D1164-S1187 WeakPolarHBondContact OD1-CA 3.34Å; D1164-S1187 WeakPolarHBondContact OD1-CB 3.36Å; S1187-Q1189 WeakPolarHBondContact CB-O 3.29Å; S1187-Q1189 PolarHBondContact OG-O 3Å
1188	S	86.6	Confident	91.2	Very high	55 Å²	55	46.5 Å²	46.5	39%	0.385	25%	0.252	S	S	.	.	S	Bend	trans	-79.5	-26.7	170	65.8	0	0	0	0	112.8	R1139 D1164	R1139-S1188 WeakPolarHBondContact CD-O 3.33Å; D1164-S1188 VanDerWaalsContact CG-OG 3.32Å; D1164-S1188 PolarHBondContact OD1-N 2.72Å; D1164-S1188 PolarHBondContact OD1-OG 2.83Å; D1164-S1188 WeakPolarHBondContact OD2-CB 3.28Å; D1164-S1188 PolarHBondContact OD2-N 2.98Å; D1164-S1188 PolarHBondContact OD2-OG 3.12Å
1189	Q	86.8	Confident	91.1	Very high	99 Å²	99	48.3 Å²	48.3	46%	0.463	26%	0.261	S	S	.	.	S	Bend	trans	-122.2	-176.6	-176.7	-67.9	176.7	65.7	0	0	111.8	H1138 S1187 Q1191	H1138-Q1189 CarbonylContact O-C 3.52Å; S1187-Q1189 WeakPolarHBondContact CB-O 3.29Å; S1187-Q1189 PolarHBondContact OG-O 3Å; Q1189-Q1191 PolarHBondContact O-N 3.28Å
1190	N	88.9	Confident	91.1	Very high	39 Å²	39	47.2 Å²	47.2	21%	0.209	25%	0.253	C	S	.	.	S	Bend	trans	-79.5	12.4	-177.7	76.1	-60.3	0	0	0	114.7	T1133 V1134 H1138	T1133-N1190 WeakPolarHBondContact CA-O 3.24Å; V1134-N1190 HydrophobicContact CG2-CB 3.91Å; V1134-N1190 PolarHBondContact N-O 2.81Å; V1134-N1190 PolarHBondContact O-ND2 3.19Å; H1138-N1190 WeakPolarHBondContact O-CA 3.34Å; H1138-N1190 WeakPolarHBondContact O-CB 3.11Å; H1138-N1190 PolarHBondContact O-N 2.71Å
1191	Q	91.7	Very high	90.8	Very high	52 Å²	52	38.8 Å²	38.8	24%	0.243	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	138.5	179	-66.8	-171	-39.3	0	0	111.5	I1132 T1133 G1165 Q1189	I1132-Q1191 VanDerWaalsContact O-CA 3.31Å; I1132-Q1191 WeakPolarHBondContact O-CA 3.24Å; T1133-Q1191 HydrophobicContact CG2-CG 3.97Å; T1133-Q1191 PolarHBondContact OG1-NE2 3.11Å; T1133-Q1191 VanDerWaalsContact OG1-NE2 3.15Å; G1165-Q1191 PolarHBondContact N-O 3.21Å; Q1189-Q1191 PolarHBondContact O-N 3.28Å
1192	L	93.8	Very high	90.5	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	134.2	174.2	-174.5	84.8	0	0	0	108.4	I1132 V1140 V1142 Y1163 G1165 L1173 I1185	I1132-L1192 HydrophobicContact CD1-CD2 4.16Å; I1132-L1192 PolarHBondContact N-O 3.07Å; I1132-L1192 PolarHBondContact O-N 3.18Å; V1140-L1192 HydrophobicContact CB-CB 3.88Å; V1140-L1192 HydrophobicContact CB-CD2 4.41Å; V1140-L1192 HydrophobicContact CG1-CB 4.11Å; V1140-L1192 HydrophobicContact CG1-CD2 3.99Å; V1140-L1192 HydrophobicContact CG2-CB 3.96Å; V1142-L1192 HydrophobicContact CG2-CD2 3.54Å; Y1163-L1192 WeakPolarHBondContact O-CD1 3.4Å; G1165-L1192 CarbonylContact O-C 3.6Å; L1173-L1192 HydrophobicContact CD1-CD1 3.49Å; L1173-L1192 VanDerWaalsContact CD1-CD1 3.49Å; I1185-L1192 HydrophobicContact CG2-CD1 4.38Å
1193	L	93.5	Very high	90.3	Very high	9 Å²	9	38.3 Å²	38.3	5%	0.047	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	112.4	170	174.8	58.7	0	0	0	109.2	H1129 K1131 Y1163 G1165 N1168 T1195	H1129-L1193 HydrophobicContact CB-CD1 4.14Å; K1131-L1193 HydrophobicContact CB-CD1 4.12Å; Y1163-L1193 HydrophobicContact CD2-CG 4.48Å; Y1163-L1193 PolarHBondContact N-O 2.86Å; Y1163-L1193 PolarHBondContact O-N 3.3Å; G1165-L1193 VanDerWaalsContact O-CB 3.25Å; G1165-L1193 WeakPolarHBondContact O-CB 3.42Å; G1165-L1193 PolarHBondContact O-N 2.98Å; N1168-L1193 WeakPolarHBondContact OD1-CD2 3.26Å; L1193-T1195 HydrophobicContact CD1-CG2 4.18Å; L1193-T1195 HydrophobicContact CD2-CG2 4.31Å; L1193-T1195 HydrophobicContact CG-CG2 3.93Å
1194	L	93.3	Very high	90.3	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	128.4	169.8	-167.1	72.8	0	0	0	108.4	I1113 W1130 V1160 A1162 F1207	I1113-L1194 HydrophobicContact CG2-CD2 4.38Å; W1130-L1194 HydrophobicContact CB-CB 4.45Å; W1130-L1194 HydrophobicContact CE3-CB 4.32Å; W1130-L1194 HydrophobicContact CE3-CD2 4.18Å; W1130-L1194 HydrophobicContact CE3-CG 4.31Å; W1130-L1194 PolarHBondContact N-O 3.38Å; W1130-L1194 PolarHBondContact O-N 3.36Å; V1160-L1194 HydrophobicContact CG1-CD1 3.57Å; V1160-L1194 HydrophobicContact CG1-CG 4.09Å; A1162-L1194 HydrophobicContact CB-CD1 4.05Å; L1194-F1207 HydrophobicContact CD2-CE2 4.28Å; L1194-F1207 HydrophobicContact CD2-CZ 4.32Å
1195	T	92.5	Very high	90.1	Very high	2 Å²	2	40.8 Å²	40.8	1%	0.012	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	148	173.5	70.9	0	0	0	0	110.8	C1128 H1129 V1160 I1161 Y1163 L1193	C1128-T1195 CarbonylContact O-C 3.55Å; C1128-T1195 VanDerWaalsContact O-CA 3.22Å; C1128-T1195 WeakPolarHBondContact O-CA 3.34Å; H1129-T1195 WeakPolarHBondContact ND1-CG2 3.41Å; V1160-T1195 CarbonylContact C-O 3.6Å; V1160-T1195 VanDerWaalsContact CA-O 3.26Å; V1160-T1195 WeakPolarHBondContact CA-O 3.4Å; I1161-T1195 PolarHBondContact N-O 3.07Å; I1161-T1195 PolarHBondContact O-N 3.02Å; Y1163-T1195 HydrophobicContact CD2-CG2 4.29Å; Y1163-T1195 HydrophobicContact CE2-CG2 4.03Å; L1193-T1195 HydrophobicContact CD1-CG2 4.18Å; L1193-T1195 HydrophobicContact CD2-CG2 4.31Å; L1193-T1195 HydrophobicContact CG-CG2 3.93Å
1196	F	92.4	Very high	90	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	124	172.1	166.7	-118.3	0	0	0	108.9	T1115 Y1122 Q1126 N1127 C1128 W1130 L1149 Q1159 V1160 F1207	T1115-F1196 HydrophobicContact CG2-CD1 4.07Å; T1115-F1196 HydrophobicContact CG2-CE1 4.04Å; T1115-F1196 HydrophobicContact CG2-CG 4.46Å; T1115-F1196 HydrophobicContact CG2-CZ 4.41Å; Y1122-F1196 HydrophobicContact CD1-CZ 4.06Å; Y1122-F1196 HydrophobicContact CD2-CE1 4.33Å; Y1122-F1196 AromaticContact CD2-CZ 3.77Å; Y1122-F1196 HydrophobicContact CD2-CZ 3.77Å; Y1122-F1196 HydrophobicContact CE1-CZ 4.24Å; Y1122-F1196 AromaticContact CE2-CZ 3.95Å; Y1122-F1196 HydrophobicContact CE2-CZ 3.95Å; Y1122-F1196 HydrophobicContact CG-CE1 4.2Å; Y1122-F1196 AromaticContact CG-CZ 3.83Å; Y1122-F1196 HydrophobicContact CG-CZ 3.83Å; Q1126-F1196 HydrophobicContact CB-CE1 4.42Å; N1127-F1196 WeakPolarHBondContact CA-O 3.42Å; C1128-F1196 HydrophobicContact CB-CB 4.22Å; C1128-F1196 HydrophobicContact CB-CD1 4.4Å; C1128-F1196 PolarHBondContact N-O 3.48Å; C1128-F1196 PolarHBondContact O-N 3.01Å; W1130-F1196 HydrophobicContact CH2-CB 3.81Å; W1130-F1196 HydrophobicContact CH2-CD1 4.47Å; W1130-F1196 HydrophobicContact CZ3-CB 3.57Å; L1149-F1196 HydrophobicContact CD1-CD2 4.38Å; L1149-F1196 HydrophobicContact CD1-CE2 4.17Å; L1149-F1196 HydrophobicContact CD2-CD2 4.43Å; L1149-F1196 HydrophobicContact CD2-CE2 3.66Å; L1149-F1196 HydrophobicContact CD2-CZ 4.19Å; Q1159-F1196 WeakPolarHBondContact O-CA 3.31Å; Q1159-F1196 WeakPolarHBondContact O-CD2 3.07Å; V1160-F1196 HydrophobicContact CG2-CB 4.13Å; V1160-F1196 HydrophobicContact CG2-CD2 3.83Å; V1160-F1196 HydrophobicContact CG2-CG 4.37Å; F1196-F1207 HydrophobicContact CB-CE1 4.09Å; F1196-F1207 HydrophobicContact CB-CZ 4.4Å; F1196-F1207 HydrophobicContact CD2-CE1 4.2Å; F1196-F1207 HydrophobicContact CG-CE1 4.09Å
1197	N	91.5	Very high	90.1	Very high	46 Å²	46	37 Å²	37	25%	0.246	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	135.7	173.9	-61.5	-46.1	0	0	0	108.7	Q1126 N1127 D1158 Q1159	Q1126-N1197 WeakPolarHBondContact O-CA 3.31Å; N1127-N1197 PolarHBondContact OD1-OD1 2.94Å; D1158-N1197 WeakPolarHBondContact CA-O 3.43Å; Q1159-N1197 HydrophobicContact CG-CB 4.21Å; Q1159-N1197 PolarHBondContact N-O 3.15Å; Q1159-N1197 PolarHBondContact O-N 3.2Å
1198	S	90.6	Very high	90	Very high	13 Å²	13	41 Å²	41	9%	0.091	21%	0.212	C	C	.	.			trans	-114.2	150.3	166.3	66	0	0	0	0	113	P1123 K1125 Q1126 D1158	P1123-S1198 PolarHBondContact O-OG 2.74Å; K1125-S1198 VanDerWaalsContact CA-O 3.29Å; K1125-S1198 WeakPolarHBondContact CA-O 3.43Å; K1125-S1198 PolarHBondContact N-O 2.68Å; K1125-S1198 PolarHBondContact N-OG 2.91Å; Q1126-S1198 WeakPolarHBondContact CB-OG 3.17Å; Q1126-S1198 PolarHBondContact N-OG 2.75Å; Q1126-S1198 PolarHBondContact O-N 3.12Å; D1158-S1198 WeakPolarHBondContact OD1-CA 3.18Å; D1158-S1198 WeakPolarHBondContact OD1-CB 3.34Å
1199	D	91.3	Very high	90.3	Very high	45 Å²	45	38.5 Å²	38.5	24%	0.241	19%	0.194	C	C	.	.			trans	-80.7	-174.3	-177	166.4	-82.3	0	0	0	111.4	V1124 K1125 D1158 S1201	V1124-D1199 CarbonylContact C-O 3.49Å; V1124-D1199 WeakPolarHBondContact CA-O 3.37Å; V1124-D1199 WeakPolarHBondContact CB-O 3.47Å; K1125-D1199 PolarHBondContact N-O 2.86Å; D1158-D1199 PolarHBondContact OD1-N 3.35Å; D1199-S1201 PolarHBondContact O-N 2.98Å; D1199-S1201 WeakPolarHBondContact OD1-CA 3.49Å; D1199-S1201 WeakPolarHBondContact OD1-CB 3.49Å; D1199-S1201 PolarHBondContact OD1-N 2.69Å; D1199-S1201 PolarHBondContact OD1-OG 2.84Å
1200	S	89	Confident	90.5	Very high	71 Å²	71	38.9 Å²	38.9	50%	0.497	20%	0.196	S	C	.	.	S	Bend	trans	-74	-0.8	171.4	50.3	0	0	0	0	115.8
1201	S	85.3	Confident	90.7	Very high	44 Å²	44	37.1 Å²	37.1	31%	0.308	19%	0.186	S	C	.	.	S	Bend	trans	-145.5	177.8	-155.6	-22.9	0	0	0	0	113.2	D1199 Q1203	D1199-S1201 PolarHBondContact O-N 2.98Å; D1199-S1201 WeakPolarHBondContact OD1-CA 3.49Å; D1199-S1201 WeakPolarHBondContact OD1-CB 3.49Å; D1199-S1201 PolarHBondContact OD1-N 2.69Å; D1199-S1201 PolarHBondContact OD1-OG 2.84Å; S1201-Q1203 PolarHBondContact O-N 3.3Å; S1201-Q1203 VanDerWaalsContact O-N 3.12Å
1202	V	82.6	Confident	90.6	Very high	63 Å²	63	36.6 Å²	36.6	38%	0.382	19%	0.186	S	C	.	.			trans	34.3	59.7	157.9	-163.4	0	0	0	0	116.7	E1150	E1150-V1202 HydrophobicContact CG-CB 4.21Å; E1150-V1202 HydrophobicContact CG-CG1 4.01Å; E1150-V1202 WeakPolarHBondContact OE1-CB 3.45Å
1203	Q	88.1	Confident	90.4	Very high	52 Å²	52	37.9 Å²	37.9	24%	0.243	20%	0.195	C	C	.	.			trans	-73.2	166.7	178.4	-45.2	102.6	-92	0	0	113.1	E1121 Y1122 V1124 S1201	E1121-Q1203 HydrophobicContact CB-CB 4.22Å; Y1122-Q1203 HydrophobicContact CD2-CB 3.82Å; Y1122-Q1203 HydrophobicContact CD2-CG 3.97Å; Y1122-Q1203 HydrophobicContact CE2-CB 3.62Å; Y1122-Q1203 HydrophobicContact CE2-CG 3.9Å; Y1122-Q1203 HydrophobicContact CG-CB 4.47Å; Y1122-Q1203 WeakPolarHBondContact O-CB 3.19Å; Y1122-Q1203 VanDerWaalsContact O-CG 3.25Å; Y1122-Q1203 WeakPolarHBondContact O-CG 3.28Å; Y1122-Q1203 PolarHBondContact O-NE2 2.68Å; V1124-Q1203 VanDerWaalsContact CG1-CD 3.46Å; V1124-Q1203 HydrophobicContact CG1-CG 3.89Å; S1201-Q1203 PolarHBondContact O-N 3.3Å; S1201-Q1203 VanDerWaalsContact O-N 3.12Å
1204	R	91.1	Very high	90.1	Very high	92 Å²	92	39.7 Å²	39.7	35%	0.347	20%	0.204	S	C	.	.			trans	-141.8	-178.2	178.8	-67.4	-65.6	179.4	-96.7	-0.8	109.7	E1121 Y1122 E1148 G1206	E1121-R1204 VanDerWaalsContact CA-O 3.26Å; E1121-R1204 WeakPolarHBondContact CA-O 3.35Å; Y1122-R1204 WeakPolarHBondContact CD1-O 3.31Å; Y1122-R1204 HydrophobicContact CE1-CB 3.99Å; Y1122-R1204 WeakPolarHBondContact CE1-O 3.32Å; Y1122-R1204 VanDerWaalsContact CZ-N 3.32Å; Y1122-R1204 PolarHBondContact N-O 3.13Å; Y1122-R1204 PolarHBondContact OH-N 2.78Å; E1148-R1204 HydrophobicContact CG-CB 4.1Å; E1148-R1204 HydrophobicContact CG-CG 4.32Å; E1148-R1204 WeakPolarHBondContact O-CB 3.4Å; R1204-G1206 PolarHBondContact O-N 2.99Å; R1204-G1206 VanDerWaalsContact O-N 3.1Å
1205	K	87.4	Confident	89.9	Confident	93 Å²	93	40.1 Å²	40.1	40%	0.404	21%	0.206	S	C	.	.			trans	-59.7	-21.6	-178.8	-54.7	-166.1	-165	82.4	0	114.1	W1118 E1148	W1118-K1205 VanDerWaalsContact CD1-O 3.31Å; E1148-K1205 IonicContact OE2-NZ 2.68Å; E1148-K1205 PolarHBondContact OE2-NZ 2.91Å
1206	G	90	Very high	89.6	Confident	0 Å²	0	40 Å²	40	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	88.2	-138.2	-178.1	0	0	0	0	0	111.6	T1115 Y1122 E1148 R1204	T1115-G1206 WeakPolarHBondContact OG1-CA 3.12Å; Y1122-G1206 VanDerWaalsContact CD1-CA 3.4Å; E1148-G1206 CarbonylContact C-O 3.58Å; E1148-G1206 PolarHBondContact N-O 2.91Å; E1148-G1206 WeakPolarHBondContact O-CA 3.13Å; E1148-G1206 PolarHBondContact O-N 3.16Å; R1204-G1206 PolarHBondContact O-N 2.99Å; R1204-G1206 VanDerWaalsContact O-N 3.1Å
1207	F	92.4	Very high	89.2	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	155.8	178	65	-98.5	0	0	0	112.7	I1113 I1114 T1115 W1130 F1144 D1146 F1147 L1149 V1160 L1194 F1196 A1209	I1113-F1207 HydrophobicContact CG2-CE2 4.15Å; I1114-F1207 WeakPolarHBondContact CA-O 3.16Å; T1115-F1207 HydrophobicContact CG2-CD1 3.29Å; T1115-F1207 HydrophobicContact CG2-CD2 4.37Å; T1115-F1207 HydrophobicContact CG2-CE1 3.25Å; T1115-F1207 HydrophobicContact CG2-CE2 4.38Å; T1115-F1207 HydrophobicContact CG2-CG 3.87Å; T1115-F1207 HydrophobicContact CG2-CZ 3.85Å; T1115-F1207 PolarHBondContact N-O 2.7Å; T1115-F1207 PolarHBondContact OG1-N 3.46Å; T1115-F1207 PolarHBondContact OG1-O 3.27Å; W1130-F1207 HydrophobicContact CH2-CE1 4.46Å; W1130-F1207 AromaticContact CH2-CZ 3.71Å; W1130-F1207 HydrophobicContact CH2-CZ 3.71Å; W1130-F1207 AromaticContact CZ3-CZ 3.75Å; W1130-F1207 HydrophobicContact CZ3-CZ 3.75Å; F1144-F1207 HydrophobicContact CD1-CB 4.07Å; F1144-F1207 AromaticContact CD1-CD2 3.94Å; F1144-F1207 HydrophobicContact CD1-CD2 3.94Å; F1144-F1207 HydrophobicContact CD1-CG 4.13Å; F1144-F1207 HydrophobicContact CE1-CB 4.32Å; F1144-F1207 HydrophobicContact CE1-CD1 4.48Å; F1144-F1207 AromaticContact CE1-CD2 3.62Å; F1144-F1207 HydrophobicContact CE1-CD2 3.62Å; F1144-F1207 HydrophobicContact CE1-CE2 4.01Å; F1144-F1207 AromaticContact CE1-CG 3.89Å; F1144-F1207 HydrophobicContact CE1-CG 3.89Å; D1146-F1207 WeakPolarHBondContact O-CA 3.27Å; D1146-F1207 VanDerWaalsContact O-CB 3.31Å; D1146-F1207 WeakPolarHBondContact O-CB 3.28Å; F1147-F1207 HydrophobicContact CB-CB 4.37Å; F1147-F1207 HydrophobicContact CD2-CB 3.68Å; F1147-F1207 HydrophobicContact CD2-CD1 4.43Å; F1147-F1207 HydrophobicContact CD2-CG 4.22Å; F1147-F1207 HydrophobicContact CE2-CB 4.41Å; F1147-F1207 HydrophobicContact CE2-CD1 4.35Å; F1147-F1207 HydrophobicContact CG-CB 4.35Å; L1149-F1207 HydrophobicContact CD2-CD1 4.49Å; V1160-F1207 HydrophobicContact CG2-CD1 3.69Å; V1160-F1207 HydrophobicContact CG2-CE1 3.2Å; V1160-F1207 HydrophobicContact CG2-CZ 3.98Å; L1194-F1207 HydrophobicContact CD2-CE2 4.28Å; L1194-F1207 HydrophobicContact CD2-CZ 4.32Å; F1196-F1207 HydrophobicContact CB-CE1 4.09Å; F1196-F1207 HydrophobicContact CB-CZ 4.4Å; F1196-F1207 HydrophobicContact CD2-CE1 4.2Å; F1196-F1207 HydrophobicContact CG-CE1 4.09Å; F1207-A1209 HydrophobicContact CD2-CB 4.34Å
1208	R	91.5	Very high	88.9	Confident	87 Å²	87	42.6 Å²	42.6	33%	0.328	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	122.5	167.1	175.8	176.4	-177.5	-99.8	-8.3	107.8	E1112 I1114 W1118 A1145 D1146	E1112-R1208 HydrophobicContact CG-CG 4.31Å; E1112-R1208 WeakPolarHBondContact OE1-CD 3.34Å; E1112-R1208 IonicContact OE1-CZ 3.19Å; E1112-R1208 IonicContact OE1-NE 3.59Å; E1112-R1208 PolarHBondContact OE1-NE 3.38Å; E1112-R1208 IonicContact OE1-NH2 2.74Å; E1112-R1208 IonicContact OE2-CZ 3.73Å; E1112-R1208 IonicContact OE2-NE 2.66Å; E1112-R1208 PolarHBondContact OE2-NE 3.06Å; E1112-R1208 IonicContact OE2-NH2 2.71Å; E1112-R1208 PolarHBondContact OE2-NH2 3.03Å; I1114-R1208 HydrophobicContact CG2-CB 4.04Å; I1114-R1208 HydrophobicContact CG2-CG 3.89Å; W1118-R1208 HydrophobicContact CD2-CB 4.07Å; W1118-R1208 HydrophobicContact CH2-CB 4.48Å; W1118-R1208 VanDerWaalsContact CH2-CD 3.48Å; W1118-R1208 HydrophobicContact CZ2-CB 3.98Å; A1145-R1208 WeakPolarHBondContact CA-O 3.34Å; A1145-R1208 HydrophobicContact CB-CG 4.31Å; A1145-R1208 WeakPolarHBondContact CB-O 3.26Å; A1145-R1208 PolarHBondContact N-O 3.03Å; D1146-R1208 HydrophobicContact CB-CB 4.3Å; D1146-R1208 PolarHBondContact N-O 2.98Å; D1146-R1208 VanDerWaalsContact N-O 3.08Å; D1146-R1208 PolarHBondContact O-N 2.62Å
1209	A	92.1	Very high	88.7	Confident	1 Å²	1	42.3 Å²	42.3	1%	0.008	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	149.7	179.1	0	0	0	0	0	111.2	E1112 I1113 V1142 I1143 F1144 F1207	E1112-A1209 WeakPolarHBondContact CA-O 3.08Å; I1113-A1209 PolarHBondContact N-O 3.49Å; I1113-A1209 PolarHBondContact O-N 2.9Å; V1142-A1209 HydrophobicContact CG1-CB 3.87Å; I1143-A1209 CarbonylContact O-C 3.56Å; I1143-A1209 WeakPolarHBondContact O-CA 3.32Å; F1144-A1209 HydrophobicContact CD1-CB 3.7Å; F1144-A1209 HydrophobicContact CE1-CB 3.97Å; F1144-A1209 HydrophobicContact CG-CB 4.18Å; F1207-A1209 HydrophobicContact CD2-CB 4.34Å
1210	Q	92.5	Very high	88.6	Confident	108 Å²	108	43.8 Å²	43.8	51%	0.505	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	133	171.8	-169.8	178.5	2	0	0	108.6	G1111 V1142 I1143 T1212	G1111-Q1210 WeakPolarHBondContact O-CA 3.34Å; G1111-Q1210 WeakPolarHBondContact O-CG 3.44Å; V1142-Q1210 WeakPolarHBondContact CA-O 3.18Å; I1143-Q1210 PolarHBondContact N-O 2.79Å; I1143-Q1210 PolarHBondContact O-N 3.43Å; Q1210-T1212 HydrophobicContact CG-CG2 4.42Å
1211	H	92.5	Very high	88.4	Confident	2 Å²	2	40.4 Å²	40.4	1%	0.009	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	144.9	168.1	84.8	-90.8	0	0	0	110.6	I1106 S1108 D1110 G1111 I1113 I1132 K1141 V1142	I1106-H1211 WeakPolarHBondContact CG2-CE1 3.18Å; S1108-H1211 PolarHBondContact O-NE2 2.8Å; S1108-H1211 PolarHBondContact OG-CE1 3.21Å; S1108-H1211 PolarHBondContact OG-NE2 2.76Å; D1110-H1211 VanDerWaalsContact C-CE1 3.43Å; D1110-H1211 VanDerWaalsContact CA-O 3.27Å; D1110-H1211 WeakPolarHBondContact CA-O 3.36Å; G1111-H1211 VanDerWaalsContact CA-CE1 3.43Å; G1111-H1211 WeakPolarHBondContact CA-CE1 3.2Å; G1111-H1211 PolarHBondContact N-CE1 2.67Å; G1111-H1211 VanDerWaalsContact N-CE1 3.3Å; G1111-H1211 PolarHBondContact N-O 3.22Å; G1111-H1211 PolarHBondContact O-N 3.35Å; I1113-H1211 HydrophobicContact CD1-CB 4.36Å; I1132-H1211 HydrophobicContact CD1-CB 4.1Å; K1141-H1211 CarbonylContact O-C 3.57Å; K1141-H1211 VanDerWaalsContact O-CA 3.25Å; K1141-H1211 WeakPolarHBondContact O-CA 3.34Å; V1142-H1211 HydrophobicContact CG2-CB 4.22Å
1212	T	90.2	Very high	88.5	Confident	40 Å²	40	40.2 Å²	40.2	25%	0.245	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	144.8	176.8	58.6	0	0	0	0	109.9	P1109 D1110 K1141 Q1210	P1109-T1212 CarbonylContact O-C 3.49Å; D1110-T1212 HydrophobicContact CB-CG2 4.32Å; K1141-T1212 WeakPolarHBondContact CB-O 3.45Å; K1141-T1212 PolarHBondContact N-O 2.67Å; K1141-T1212 PolarHBondContact O-N 2.97Å; Q1210-T1212 HydrophobicContact CG-CG2 4.42Å
1213	T	88.1	Confident	88.5	Confident	28 Å²	28	40.5 Å²	40.5	17%	0.172	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	124.2	175.6	-57.9	0	0	0	0	111	P1109 V1134 H1138 R1139 A1232	P1109-T1213 VanDerWaalsContact CA-OG1 3.32Å; P1109-T1213 WeakPolarHBondContact CA-OG1 3.44Å; P1109-T1213 VanDerWaalsContact O-CB 3.29Å; P1109-T1213 WeakPolarHBondContact O-CB 3.46Å; P1109-T1213 PolarHBondContact O-N 3.32Å; P1109-T1213 PolarHBondContact O-OG1 3.24Å; V1134-T1213 HydrophobicContact CB-CG2 3.99Å; V1134-T1213 HydrophobicContact CG1-CG2 4.32Å; V1134-T1213 WeakPolarHBondContact CG1-OG1 3.4Å; V1134-T1213 HydrophobicContact CG2-CG2 4.08Å; H1138-T1213 HydrophobicContact CB-CG2 3.31Å; R1139-T1213 WeakPolarHBondContact O-CA 3.27Å; T1213-A1232 HydrophobicContact CG2-CB 3.62Å
1214	I	88.5	Confident	88.3	Confident	46 Å²	46	43 Å²	43	24%	0.236	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	140.6	168.4	-47.2	179	0	0	0	108.6	H1138 R1139 K1141 I1186	H1138-I1214 CarbonylContact C-O 3.53Å; H1138-I1214 WeakPolarHBondContact CA-O 3.31Å; H1138-I1214 WeakPolarHBondContact CB-O 3.2Å; R1139-I1214 PolarHBondContact N-O 3.16Å; R1139-I1214 PolarHBondContact O-N 3.15Å; K1141-I1214 HydrophobicContact CB-CD1 3.75Å; K1141-I1214 HydrophobicContact CB-CG1 3.81Å; K1141-I1214 HydrophobicContact CD-CD1 3.85Å; K1141-I1214 HydrophobicContact CD-CG1 4.22Å; K1141-I1214 HydrophobicContact CG-CD1 4.08Å; I1186-I1214 HydrophobicContact CD1-CD1 4Å; I1186-I1214 HydrophobicContact CG1-CD1 4.34Å; I1186-I1214 HydrophobicContact CG2-CD1 4.36Å
1215	C	88	Confident	88	Confident	9 Å²	9	40 Å²	40	6%	0.061	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	166	168.8	63.5	0	0	0	0	113.8	R1139 C1245 W1247	R1139-C1215 PolarHBondContact NH2-O 3.06Å; C1215-C1245 HydrophobicContact CB-CB 3.6Å; C1215-C1245 WeakPolarHBondContact CB-SG 3.15Å; C1215-C1245 VanDerWaalsContact SG-CA 3.52Å; C1215-C1245 WeakPolarHBondContact SG-CB 3.41Å; C1215-C1245 CovalentContact SG-SG 2.02Å; C1215-C1245 PolarHBondContact SG-SG 3.5Å; C1215-W1247 HydrophobicContact CB-CZ2 4.21Å
1216	G	86.2	Confident	88	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	21%	0.212	C	C	.	.			trans	77.9	157.9	-177.1	0	0	0	0	0	113.8	G1137 R1139 Y1246	G1137-G1216 CarbonylContact O-C 3.54Å; G1137-G1216 PolarHBondContact O-N 2.99Å; R1139-G1216 WeakPolarHBondContact CD-O 3.5Å; R1139-G1216 WeakPolarHBondContact CG-O 3.34Å; R1139-G1216 PolarHBondContact NE-O 3.46Å; G1216-Y1246 CarbonylContact C-O 3.56Å; G1216-Y1246 WeakPolarHBondContact CA-O 3.4Å
1217	G	83.8	Confident	87.8	Confident	11 Å²	11	40.3 Å²	40.3	11%	0.113	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	158	176.2	-178.9	0	0	0	0	0	112.6	Y1246 W1247 T1248	G1217-Y1246 PolarHBondContact N-O 2.92Å; G1217-W1247 WeakPolarHBondContact O-CA 3.05Å; G1217-T1248 PolarHBondContact O-N 3Å
1218	H	85.5	Confident	87.7	Confident	89 Å²	89	40.3 Å²	40.3	41%	0.412	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	137.6	172.4	-167.3	-81.2	0	0	0	110.8	T1250	H1218-T1250 PolarHBondContact CE1-OG1 3.12Å; H1218-T1250 VanDerWaalsContact NE2-CG2 3.34Å; H1218-T1250 WeakPolarHBondContact NE2-CG2 3.45Å
1219	L	87.6	Confident	87.6	Confident	8 Å²	8	39.6 Å²	39.6	4%	0.042	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	126.5	-179	-75.4	179.1	0	0	0	110.8	G1137 L1228 T1248 I1249 T1250 Y1329	G1137-L1219 VanDerWaalsContact CA-CD2 3.48Å; L1219-L1228 HydrophobicContact CD1-CB 4.42Å; L1219-L1228 HydrophobicContact CD1-CD1 4.2Å; L1219-L1228 HydrophobicContact CD1-CD2 4.28Å; L1219-T1248 PolarHBondContact N-O 2.94Å; L1219-I1249 HydrophobicContact CB-CB 4.38Å; L1219-I1249 HydrophobicContact CB-CG1 4.19Å; L1219-I1249 HydrophobicContact CB-CG2 4.14Å; L1219-I1249 HydrophobicContact CD1-CD1 4.46Å; L1219-I1249 HydrophobicContact CD1-CG1 4.15Å; L1219-I1249 CarbonylContact O-C 3.57Å; L1219-I1249 VanDerWaalsContact O-CA 3.32Å; L1219-I1249 WeakPolarHBondContact O-CA 3.3Å; L1219-T1250 PolarHBondContact O-N 3.35Å; L1219-Y1329 HydrophobicContact CB-CE2 4.36Å; L1219-Y1329 HydrophobicContact CD1-CE1 3.97Å
1220	T	87.8	Confident	87.5	Confident	75 Å²	75	39.5 Å²	39.5	46%	0.46	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	115.2	171	56	0	0	0	0	109.8	Q1226 T1250	T1220-Q1226 PolarHBondContact O-NE2 3.11Å; T1220-Q1226 PolarHBondContact O-OE1 3Å; T1220-Q1226 VanDerWaalsContact O-OE1 3.12Å; T1220-T1250 CarbonylContact C-O 3.47Å; T1220-T1250 WeakPolarHBondContact CA-O 3.5Å
1221	A	86.1	Confident	87.1	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	128.8	174.9	0	0	0	0	0	110.8	I1249 T1250 K1252 V1258 Y1329 M1331	A1221-I1249 HydrophobicContact CB-CG2 4.2Å; A1221-T1250 WeakPolarHBondContact CB-O 3.44Å; A1221-T1250 PolarHBondContact N-O 3.02Å; A1221-K1252 WeakPolarHBondContact O-CB 3.32Å; A1221-K1252 PolarHBondContact O-N 2.9Å; A1221-V1258 HydrophobicContact CB-CG2 3.99Å; A1221-Y1329 HydrophobicContact CB-CD2 3.79Å; A1221-Y1329 HydrophobicContact CB-CE2 4.23Å; A1221-M1331 HydrophobicContact CB-CB 4.01Å; A1221-M1331 WeakPolarHBondContact O-CB 3.35Å
1222	D	87.3	Confident	86.5	Confident	40 Å²	40	36.1 Å²	36.1	21%	0.214	21%	0.21	C	C	.	.			trans	-101.4	168.5	172.8	-148.5	-40.6	0	0	0	111.1	V1224 K1252 M1331	D1222-V1224 PolarHBondContact O-N 3.4Å; D1222-K1252 HydrophobicContact CB-CD 4.29Å; D1222-K1252 IonicContact OD1-NZ 3.79Å; D1222-K1252 VanDerWaalsContact OD2-CD 3.29Å; D1222-K1252 WeakPolarHBondContact OD2-CD 3.48Å; D1222-K1252 WeakPolarHBondContact OD2-CE 3.33Å; D1222-K1252 IonicContact OD2-NZ 3.8Å; D1222-K1252 PolarHBondContact OD2-NZ 2.96Å; D1222-M1331 WeakPolarHBondContact O-CB 3.46Å; D1222-M1331 PolarHBondContact O-N 3.32Å
1223	S	81.8	Confident	86	Confident	69 Å²	69	37.8 Å²	37.8	48%	0.483	21%	0.213	S	C	.	.	S	Bend	trans	-56	-23.6	168.5	54.3	0	0	0	0	113.9	Q1330	S1223-Q1330 PolarHBondContact O-NE2 2.89Å
1224	V	84.6	Confident	85.5	Confident	106 Å²	106	38.3 Å²	38.3	64%	0.642	21%	0.213	S	C	*	.	S	Bend	trans	-92.8	129.7	168.7	179.7	0	0	0	0	109.2	D1222 Q1226	D1222-V1224 PolarHBondContact O-N 3.4Å; V1224-Q1226 PolarHBondContact O-N 3.01Å
1225	A	84.3	Confident	84.4	Confident	29 Å²	29	38.2 Å²	38.2	24%	0.24	22%	0.223	C	C	.	.			trans	-68.6	115.6	-176.7	0	0	0	0	0	112.5	Q1328 Y1329 Q1330	A1225-Q1328 HydrophobicContact CB-CG 3.87Å; A1225-Q1328 VanDerWaalsContact CB-NE2 3.34Å; A1225-Y1329 CarbonylContact C-O 3.55Å; A1225-Y1329 WeakPolarHBondContact CA-O 3.34Å; A1225-Q1330 HydrophobicContact CB-CB 3.92Å; A1225-Q1330 HydrophobicContact CB-CG 3.99Å
1226	Q	87.2	Confident	83.4	Confident	59 Å²	59	44.4 Å²	44.4	28%	0.276	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	163.2	-177	-68.4	156.8	-61.6	0	0	111.4	T1220 V1224 Q1328 Y1329	T1220-Q1226 PolarHBondContact O-NE2 3.11Å; T1220-Q1226 PolarHBondContact O-OE1 3Å; T1220-Q1226 VanDerWaalsContact O-OE1 3.12Å; V1224-Q1226 PolarHBondContact O-N 3.01Å; Q1226-Q1328 CarbonylContact O-C 3.53Å; Q1226-Q1328 VanDerWaalsContact O-CA 3.26Å; Q1226-Q1328 WeakPolarHBondContact O-CA 3.25Å; Q1226-Q1328 VanDerWaalsContact O-CG 3.32Å; Q1226-Q1328 WeakPolarHBondContact O-CG 3.1Å; Q1226-Y1329 HydrophobicContact CB-CD1 4.34Å; Q1226-Y1329 HydrophobicContact CB-CD2 4.34Å; Q1226-Y1329 HydrophobicContact CB-CE1 3.75Å; Q1226-Y1329 HydrophobicContact CB-CE2 3.76Å; Q1226-Y1329 WeakPolarHBondContact CB-OH 3.35Å; Q1226-Y1329 HydrophobicContact CG-CE2 4.45Å; Q1226-Y1329 PolarHBondContact N-O 3.27Å; Q1226-Y1329 PolarHBondContact O-N 2.96Å; Q1226-Y1329 VanDerWaalsContact OE1-CE2 3.27Å
1227	T	87.1	Confident	82.8	Confident	40 Å²	40	49 Å²	49	25%	0.245	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	135	-176.9	-52.3	0	0	0	0	112	Y1229 Q1326 A1327	T1227-Y1229 HydrophobicContact CG2-CD1 4.4Å; T1227-Y1229 HydrophobicContact CG2-CD2 4.35Å; T1227-Y1229 HydrophobicContact CG2-CE1 3.84Å; T1227-Y1229 HydrophobicContact CG2-CE2 3.77Å; T1227-Y1229 VanDerWaalsContact CG2-CZ 3.48Å; T1227-Q1326 HydrophobicContact CG2-CG 3.68Å; T1227-A1327 CarbonylContact C-O 3.54Å; T1227-A1327 WeakPolarHBondContact CA-O 3.41Å
1228	L	89.7	Confident	82.7	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	141.2	168.6	167.1	62.6	0	0	0	109.2	L1219 W1247 L1312 F1325 A1327 Y1329	L1219-L1228 HydrophobicContact CD1-CB 4.42Å; L1219-L1228 HydrophobicContact CD1-CD1 4.2Å; L1219-L1228 HydrophobicContact CD1-CD2 4.28Å; L1228-W1247 HydrophobicContact CD1-CD2 4.22Å; L1228-W1247 HydrophobicContact CD1-CG 4.24Å; L1228-W1247 HydrophobicContact CD1-CZ2 4.13Å; L1228-W1247 VanDerWaalsContact CD1-NE1 3.3Å; L1228-W1247 HydrophobicContact CD2-CD2 4.18Å; L1228-W1247 HydrophobicContact CD2-CG 4.18Å; L1228-L1312 HydrophobicContact CD2-CD2 3.76Å; L1228-F1325 HydrophobicContact CD2-CE2 4.44Å; L1228-F1325 HydrophobicContact CG-CE2 4.49Å; L1228-A1327 PolarHBondContact N-O 2.84Å; L1228-A1327 PolarHBondContact O-N 3.41Å; L1228-Y1329 HydrophobicContact CB-CD1 4.05Å; L1228-Y1329 HydrophobicContact CB-CE1 4.08Å
1229	Y	89.3	Confident	82.7	Confident	71 Å²	71	47 Å²	47	28%	0.278	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	149.4	173.7	-58	-80.6	0	0	0	109.9	T1135 H1138 T1227 H1231 F1234 Q1326	T1135-Y1229 HydrophobicContact CG2-CD2 3.89Å; T1135-Y1229 HydrophobicContact CG2-CE2 4.4Å; H1138-Y1229 PolarHBondContact CE1-O 2.81Å; T1227-Y1229 HydrophobicContact CG2-CD1 4.4Å; T1227-Y1229 HydrophobicContact CG2-CD2 4.35Å; T1227-Y1229 HydrophobicContact CG2-CE1 3.84Å; T1227-Y1229 HydrophobicContact CG2-CE2 3.77Å; T1227-Y1229 VanDerWaalsContact CG2-CZ 3.48Å; Y1229-H1231 VanDerWaalsContact C-N 3.3Å; Y1229-H1231 PolarHBondContact O-N 3.05Å; Y1229-F1234 HydrophobicContact CD1-CB 4.05Å; Y1229-F1234 AromaticContact CD1-CD1 3.37Å; Y1229-F1234 HydrophobicContact CD1-CD1 3.37Å; Y1229-F1234 AromaticContact CD1-CE1 3.99Å; Y1229-F1234 HydrophobicContact CD1-CE1 3.99Å; Y1229-F1234 AromaticContact CD1-CG 3.78Å; Y1229-F1234 HydrophobicContact CD1-CG 3.78Å; Y1229-F1234 AromaticContact CE1-CD1 3.78Å; Y1229-F1234 HydrophobicContact CE1-CD1 3.78Å; Y1229-F1234 HydrophobicContact CE1-CE1 4.21Å; Y1229-F1234 HydrophobicContact CG-CB 4.32Å; Y1229-F1234 HydrophobicContact CG-CD1 4.4Å; Y1229-F1234 HydrophobicContact CG-CG 4.47Å; Y1229-Q1326 HydrophobicContact CD1-CB 4.16Å; Y1229-Q1326 HydrophobicContact CD1-CG 3.87Å; Y1229-Q1326 HydrophobicContact CE1-CB 4.31Å; Y1229-Q1326 HydrophobicContact CE1-CG 3.62Å
1230	S	88.9	Confident	82.4	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	30%	0.297	C	S	.	.	S	Bend	trans	-61.7	-37.2	177.8	60.4	0	0	0	0	113.4	F1325	S1230-F1325 PolarHBondContact N-O 2.76Å; S1230-F1325 PolarHBondContact OG-N 2.93Å
1231	H	85.5	Confident	82.2	Confident	11 Å²	11	52.1 Å²	52.1	5%	0.051	29%	0.294	C	S	.	.	S	Bend	trans	-147	160.4	179.9	68.1	-68.6	0	0	0	110.9	H1138 Y1229 K1233 F1234 D1238 K1323	H1138-H1231 VanDerWaalsContact NE2-CA 3.29Å; H1138-H1231 WeakPolarHBondContact NE2-CA 3.47Å; Y1229-H1231 VanDerWaalsContact C-N 3.3Å; Y1229-H1231 PolarHBondContact O-N 3.05Å; H1231-K1233 PolarHBondContact NE2-O 3.02Å; H1231-K1233 PolarHBondContact O-N 2.84Å; H1231-F1234 VanDerWaalsContact CE1-CA 3.46Å; H1231-F1234 WeakPolarHBondContact CE1-CA 3.36Å; H1231-F1234 PolarHBondContact NE2-N 3.16Å; H1231-F1234 WeakPolarHBondContact O-CB 3.25Å; H1231-F1234 PolarHBondContact O-N 2.8Å; H1231-D1238 PolarHBondContact NE2-O 3.45Å; H1231-K1323 PolarHBondContact CE1-O 3.01Å
1232	A	80.1	Confident	82.2	Confident	28 Å²	28	57.1 Å²	57.1	23%	0.231	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-10.3	-169.3	0	0	0	0	0	115.3	P1109 H1138 T1213	P1109-A1232 HydrophobicContact CB-CB 4.22Å; H1138-A1232 PolarHBondContact NE2-N 3.31Å; H1138-A1232 VanDerWaalsContact NE2-N 3.15Å; T1213-A1232 HydrophobicContact CG2-CB 3.62Å
1233	K	78	Confident	82	Confident	74 Å²	74	56.3 Å²	56.3	32%	0.322	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115	23.4	-179.8	-58.6	-178.2	-179.5	178.8	0	112	P1109 D1110 H1231 G1235 D1236 L1237	P1109-K1233 HydrophobicContact CG-CG 4.41Å; D1110-K1233 WeakPolarHBondContact OD1-CE 3.27Å; D1110-K1233 IonicContact OD1-NZ 2.68Å; D1110-K1233 PolarHBondContact OD1-NZ 2.84Å; H1231-K1233 PolarHBondContact NE2-O 3.02Å; H1231-K1233 PolarHBondContact O-N 2.84Å; K1233-G1235 PolarHBondContact O-N 2.84Å; K1233-D1236 PolarHBondContact O-N 3.1Å; K1233-L1237 HydrophobicContact CB-CB 4.27Å; K1233-L1237 HydrophobicContact CB-CD1 4.37Å; K1233-L1237 HydrophobicContact CD-CD1 3.81Å; K1233-L1237 PolarHBondContact O-N 3.19Å
1234	F	77.4	Confident	82.4	Confident	40 Å²	40	58.6 Å²	58.6	18%	0.175	32%	0.319	C	S	.	.	B	Isolated β-bridge	trans	-58.6	130.7	-179.3	175.6	-86.2	0	0	0	111.7	Y1229 H1231 Y1264 K1323 Q1326	Y1229-F1234 HydrophobicContact CD1-CB 4.05Å; Y1229-F1234 AromaticContact CD1-CD1 3.37Å; Y1229-F1234 HydrophobicContact CD1-CD1 3.37Å; Y1229-F1234 AromaticContact CD1-CE1 3.99Å; Y1229-F1234 HydrophobicContact CD1-CE1 3.99Å; Y1229-F1234 AromaticContact CD1-CG 3.78Å; Y1229-F1234 HydrophobicContact CD1-CG 3.78Å; Y1229-F1234 AromaticContact CE1-CD1 3.78Å; Y1229-F1234 HydrophobicContact CE1-CD1 3.78Å; Y1229-F1234 HydrophobicContact CE1-CE1 4.21Å; Y1229-F1234 HydrophobicContact CG-CB 4.32Å; Y1229-F1234 HydrophobicContact CG-CD1 4.4Å; Y1229-F1234 HydrophobicContact CG-CG 4.47Å; H1231-F1234 VanDerWaalsContact CE1-CA 3.46Å; H1231-F1234 WeakPolarHBondContact CE1-CA 3.36Å; H1231-F1234 PolarHBondContact NE2-N 3.16Å; H1231-F1234 WeakPolarHBondContact O-CB 3.25Å; H1231-F1234 PolarHBondContact O-N 2.8Å; F1234-Y1264 AromaticContact CE2-CD1 3.85Å; F1234-Y1264 HydrophobicContact CE2-CD1 3.85Å; F1234-Y1264 HydrophobicContact CE2-CE1 4.33Å; F1234-Y1264 AromaticContact CZ-CD1 3.59Å; F1234-Y1264 HydrophobicContact CZ-CD1 3.59Å; F1234-Y1264 HydrophobicContact CZ-CE1 4.27Å; F1234-Y1264 AromaticContact CZ-CG 4Å; F1234-Y1264 HydrophobicContact CZ-CG 4Å; F1234-K1323 WeakPolarHBondContact CD2-O 3.17Å; F1234-K1323 VanDerWaalsContact CE2-O 3.28Å; F1234-K1323 WeakPolarHBondContact CE2-O 3.3Å; F1234-Q1326 HydrophobicContact CE1-CB 3.84Å; F1234-Q1326 HydrophobicContact CZ-CB 3.78Å
1235	G	65.3	Low	82.8	Confident	43 Å²	43	53.5 Å²	53.5	44%	0.443	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	103.4	-63.5	-169.3	0	0	0	0	0	110.4	K1233 K1323	K1233-G1235 PolarHBondContact O-N 2.84Å; G1235-K1323 PolarHBondContact O-NZ 2.84Å
1236	D	68.7	Low	83.2	Confident	139 Å²	139	56.4 Å²	56.4	74%	0.743	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-52.8	-177.1	-51.9	-32.9	0	0	0	111.5	K1233 K1323	K1233-D1236 PolarHBondContact O-N 3.1Å; D1236-K1323 VanDerWaalsContact C-NZ 3.35Å; D1236-K1323 PolarHBondContact O-NZ 2.66Å
1237	L	72.9	Confident	83.4	Confident	97 Å²	97	53.6 Å²	53.6	51%	0.508	28%	0.28	S	S	.	.	B	Isolated β-bridge	trans	-114.9	-178.7	-176	-65.5	-178.6	0	0	0	112.2	K1233 K1323	K1233-L1237 HydrophobicContact CB-CB 4.27Å; K1233-L1237 HydrophobicContact CB-CD1 4.37Å; K1233-L1237 HydrophobicContact CD-CD1 3.81Å; K1233-L1237 PolarHBondContact O-N 3.19Å; L1237-K1323 VanDerWaalsContact C-NZ 3.31Å; L1237-K1323 WeakPolarHBondContact O-CD 3.41Å; L1237-K1323 WeakPolarHBondContact O-CE 3.27Å; L1237-K1323 PolarHBondContact O-NZ 3.43Å
1238	D	82.4	Confident	83.6	Confident	51 Å²	51	53.1 Å²	53.1	27%	0.273	28%	0.277	S	S	.	.	P	Polyproline II helix	trans	-94.3	162.1	166.8	-64.6	-56	0	0	0	109.4	R995 H1231 G1322 K1323	R995-D1238 IonicContact CZ-OD1 2.94Å; R995-D1238 IonicContact CZ-OD2 3.44Å; R995-D1238 IonicContact NH1-OD1 3.53Å; R995-D1238 IonicContact NH1-OD2 2.76Å; R995-D1238 PolarHBondContact NH1-OD2 2.73Å; R995-D1238 IonicContact NH2-OD1 2.86Å; R995-D1238 PolarHBondContact NH2-OD1 3.07Å; R995-D1238 IonicContact NH2-OD2 2.56Å; R995-D1238 PolarHBondContact NH2-OD2 3.14Å; H1231-D1238 PolarHBondContact NE2-O 3.45Å; D1238-G1322 VanDerWaalsContact CA-O 3.25Å; D1238-G1322 WeakPolarHBondContact CA-O 3.31Å; D1238-G1322 VanDerWaalsContact CB-O 3.24Å; D1238-G1322 WeakPolarHBondContact CB-O 3.26Å; D1238-K1323 WeakPolarHBondContact OD1-CE 3.31Å; D1238-K1323 PolarHBondContact OD1-N 3.5Å
1239	Y	83.7	Confident	83.7	Confident	6 Å²	6	53.1 Å²	53.1	2%	0.024	28%	0.277	C	S	.	.	P	Polyproline II helix	trans	-69.7	154.4	171.4	58.1	-98.4	0	0	0	111.4	E1268 D1276 F1314 G1322 G1324	Y1239-E1268 PolarHBondContact OH-N 2.81Å; Y1239-D1276 WeakPolarHBondContact CE2-OD2 3.39Å; Y1239-D1276 PolarHBondContact OH-OD2 2.79Å; Y1239-F1314 HydrophobicContact CD1-CE1 4.39Å; Y1239-F1314 AromaticContact CD1-CZ 3.91Å; Y1239-F1314 HydrophobicContact CD1-CZ 3.91Å; Y1239-F1314 HydrophobicContact CD2-CE1 4.01Å; Y1239-F1314 AromaticContact CD2-CZ 3.73Å; Y1239-F1314 HydrophobicContact CD2-CZ 3.73Å; Y1239-F1314 AromaticContact CE1-CZ 3.91Å; Y1239-F1314 HydrophobicContact CE1-CZ 3.91Å; Y1239-F1314 HydrophobicContact CE2-CE1 4.45Å; Y1239-F1314 AromaticContact CE2-CZ 3.74Å; Y1239-F1314 HydrophobicContact CE2-CZ 3.74Å; Y1239-F1314 AromaticContact CG-CE1 3.99Å; Y1239-F1314 HydrophobicContact CG-CE1 3.99Å; Y1239-F1314 AromaticContact CG-CZ 3.83Å; Y1239-F1314 HydrophobicContact CG-CZ 3.83Å; Y1239-F1314 AromaticContact CZ-CZ 3.83Å; Y1239-G1322 WeakPolarHBondContact CD1-O 3.31Å; Y1239-G1322 VanDerWaalsContact CE1-C 3.48Å; Y1239-G1322 VanDerWaalsContact CE1-N 3.34Å; Y1239-G1322 WeakPolarHBondContact CE1-O 3.36Å; Y1239-G1322 PolarHBondContact N-O 2.79Å; Y1239-G1322 PolarHBondContact OH-N 2.86Å; Y1239-G1324 VanDerWaalsContact CD1-CA 3.44Å
1240	E	82.5	Confident	83.8	Confident	133 Å²	133	50.5 Å²	50.5	62%	0.621	27%	0.269	S	S	*	.	P	Polyproline II helix	trans	-80.5	153.4	-177.6	-48.9	168.4	142.9	0	0	110.9	Q1243 S1316	E1240-Q1243 HydrophobicContact CB-CG 3.93Å; E1240-Q1243 WeakPolarHBondContact O-CG 3.45Å; E1240-Q1243 PolarHBondContact OE2-NE2 2.9Å; E1240-S1316 PolarHBondContact O-OG 2.8Å
1241	S	84	Confident	83.8	Confident	58 Å²	58	51.7 Å²	51.7	41%	0.406	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.6	153.7	170.6	62.9	0	0	0	0	111.6	Q1243 D1317	S1241-Q1243 VanDerWaalsContact C-N 3.26Å; S1241-Q1243 PolarHBondContact O-N 2.89Å; S1241-D1317 CarbonylContact C-O 3.57Å; S1241-D1317 WeakPolarHBondContact CA-O 3.49Å; S1241-D1317 VanDerWaalsContact CB-O 3.29Å; S1241-D1317 WeakPolarHBondContact CB-O 3.25Å
1242	N	86.2	Confident	83.9	Confident	105 Å²	105	56.9 Å²	56.9	56%	0.561	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.7	24.4	-176.1	-59	-99.4	0	0	0	114.7	S1316 D1317 D1318	N1242-S1316 WeakPolarHBondContact CA-O 3.43Å; N1242-S1316 PolarHBondContact N-OG 2.72Å; N1242-D1317 PolarHBondContact N-O 2.8Å; N1242-D1318 WeakPolarHBondContact ND2-CA 3.38Å; N1242-D1318 WeakPolarHBondContact ND2-CB 3.36Å
1243	Q	83.1	Confident	84.1	Confident	24 Å²	24	60 Å²	60	11%	0.112	31%	0.311	C	S	.	.			trans	-76.3	139.6	174.1	-74.5	-170.5	-11.8	0	0	111	E1240 S1241 V1315 S1316	E1240-Q1243 HydrophobicContact CB-CG 3.93Å; E1240-Q1243 WeakPolarHBondContact O-CG 3.45Å; E1240-Q1243 PolarHBondContact OE2-NE2 2.9Å; S1241-Q1243 VanDerWaalsContact C-N 3.26Å; S1241-Q1243 PolarHBondContact O-N 2.89Å; Q1243-V1315 WeakPolarHBondContact O-CA 3.42Å; Q1243-S1316 PolarHBondContact N-OG 3.37Å; Q1243-S1316 PolarHBondContact O-N 2.86Å
1244	Q	90.4	Very high	83.8	Confident	116 Å²	116	63.6 Å²	63.6	54%	0.542	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	95.3	175.2	-66.1	-172.2	-1.3	0	0	108.3	Y1246 V1315	Q1244-Y1246 HydrophobicContact CB-CE1 4.49Å; Q1244-Y1246 PolarHBondContact OE1-OH 3.2Å; Q1244-V1315 HydrophobicContact CG-CG1 4.42Å
1245	C	91.5	Very high	84	Confident	0 Å²	0	68.4 Å²	68.4	0%	0	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	126.1	-169.4	-48.6	0	0	0	0	110.2	C1215 W1247 F1314	C1215-C1245 HydrophobicContact CB-CB 3.6Å; C1215-C1245 WeakPolarHBondContact CB-SG 3.15Å; C1215-C1245 VanDerWaalsContact SG-CA 3.52Å; C1215-C1245 WeakPolarHBondContact SG-CB 3.41Å; C1215-C1245 CovalentContact SG-SG 2.02Å; C1215-C1245 PolarHBondContact SG-SG 3.5Å; C1245-W1247 HydrophobicContact CB-CE3 4.31Å; C1245-W1247 HydrophobicContact CB-CH2 3.24Å; C1245-W1247 HydrophobicContact CB-CZ2 3.76Å; C1245-W1247 HydrophobicContact CB-CZ3 3.55Å; C1245-F1314 HydrophobicContact CB-CB 4.17Å; C1245-F1314 HydrophobicContact CB-CD1 4.41Å; C1245-F1314 PolarHBondContact N-O 2.96Å; C1245-F1314 PolarHBondContact O-N 2.81Å
1246	Y	92.6	Very high	85	Confident	89 Å²	89	68.4 Å²	68.4	35%	0.349	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	124.1	-177.6	-46.1	-51.9	0	0	0	110.4	G1216 G1217 Q1244 Y1311 L1312 Q1313	G1216-Y1246 CarbonylContact C-O 3.56Å; G1216-Y1246 WeakPolarHBondContact CA-O 3.4Å; G1217-Y1246 PolarHBondContact N-O 2.92Å; Q1244-Y1246 HydrophobicContact CB-CE1 4.49Å; Q1244-Y1246 PolarHBondContact OE1-OH 3.2Å; Y1246-Y1311 WeakPolarHBondContact CD1-OH 3.22Å; Y1246-L1312 CarbonylContact C-O 3.14Å; Y1246-L1312 WeakPolarHBondContact CA-O 3.27Å; Y1246-Q1313 HydrophobicContact CD1-CB 4.35Å; Y1246-Q1313 HydrophobicContact CD1-CG 4.25Å; Y1246-Q1313 HydrophobicContact CE1-CG 4.13Å
1247	W	92.6	Very high	86	Confident	0 Å²	0	62 Å²	62	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	130.8	176.1	-56.4	-92.2	0	0	0	111	G1137 C1215 G1217 L1228 C1245 Y1311 L1312 F1314 F1325	G1137-W1247 PolarHBondContact O-NE1 3.15Å; C1215-W1247 HydrophobicContact CB-CZ2 4.21Å; G1217-W1247 WeakPolarHBondContact O-CA 3.05Å; L1228-W1247 HydrophobicContact CD1-CD2 4.22Å; L1228-W1247 HydrophobicContact CD1-CG 4.24Å; L1228-W1247 HydrophobicContact CD1-CZ2 4.13Å; L1228-W1247 VanDerWaalsContact CD1-NE1 3.3Å; L1228-W1247 HydrophobicContact CD2-CD2 4.18Å; L1228-W1247 HydrophobicContact CD2-CG 4.18Å; C1245-W1247 HydrophobicContact CB-CE3 4.31Å; C1245-W1247 HydrophobicContact CB-CH2 3.24Å; C1245-W1247 HydrophobicContact CB-CZ2 3.76Å; C1245-W1247 HydrophobicContact CB-CZ3 3.55Å; W1247-Y1311 CarbonylContact O-C 3.58Å; W1247-Y1311 WeakPolarHBondContact O-CA 3.41Å; W1247-L1312 HydrophobicContact CB-CB 4.28Å; W1247-L1312 HydrophobicContact CE3-CB 3.86Å; W1247-L1312 PolarHBondContact N-O 3.19Å; W1247-L1312 PolarHBondContact O-N 3.1Å; W1247-F1314 HydrophobicContact CH2-CB 4Å; W1247-F1314 HydrophobicContact CZ3-CB 3.64Å; W1247-F1325 HydrophobicContact CH2-CE2 4.47Å; W1247-F1325 AromaticContact CH2-CZ 3.68Å; W1247-F1325 HydrophobicContact CH2-CZ 3.68Å; W1247-F1325 AromaticContact CZ3-CZ 3.78Å; W1247-F1325 HydrophobicContact CZ3-CZ 3.78Å
1248	T	91.6	Very high	86.8	Confident	30 Å²	30	57.3 Å²	57.3	18%	0.184	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	121	166.5	-59.6	0	0	0	0	107.9	G1217 L1219 T1250 G1284 L1310	G1217-T1248 PolarHBondContact O-N 3Å; L1219-T1248 PolarHBondContact N-O 2.94Å; T1248-T1250 HydrophobicContact CG2-CG2 4.06Å; T1248-G1284 WeakPolarHBondContact CG2-O 2.87Å; T1248-G1284 PolarHBondContact OG1-O 3.27Å; T1248-L1310 CarbonylContact C-O 3.25Å; T1248-L1310 WeakPolarHBondContact CA-O 3.32Å
1249	I	91.5	Very high	87.2	Confident	0 Å²	0	56 Å²	56	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	119.6	177.3	-41.6	-179.9	0	0	0	108.7	L1219 A1221 V1258 L1260 Q1309 L1310 L1312 Y1329	L1219-I1249 HydrophobicContact CB-CB 4.38Å; L1219-I1249 HydrophobicContact CB-CG1 4.19Å; L1219-I1249 HydrophobicContact CB-CG2 4.14Å; L1219-I1249 HydrophobicContact CD1-CD1 4.46Å; L1219-I1249 HydrophobicContact CD1-CG1 4.15Å; L1219-I1249 CarbonylContact O-C 3.57Å; L1219-I1249 VanDerWaalsContact O-CA 3.32Å; L1219-I1249 WeakPolarHBondContact O-CA 3.3Å; A1221-I1249 HydrophobicContact CB-CG2 4.2Å; I1249-V1258 HydrophobicContact CB-CG1 4.28Å; I1249-V1258 HydrophobicContact CG2-CG1 3.76Å; I1249-V1258 HydrophobicContact CG2-CG2 4.01Å; I1249-L1260 HydrophobicContact CD1-CD1 4.22Å; I1249-Q1309 CarbonylContact O-C 3.54Å; I1249-Q1309 VanDerWaalsContact O-CA 3.31Å; I1249-Q1309 WeakPolarHBondContact O-CA 3.21Å; I1249-L1310 HydrophobicContact CB-CB 4.46Å; I1249-L1310 PolarHBondContact N-O 3.06Å; I1249-L1310 PolarHBondContact O-N 2.79Å; I1249-L1312 HydrophobicContact CD1-CD1 3.83Å; I1249-L1312 HydrophobicContact CD1-CD2 4.44Å; I1249-L1312 HydrophobicContact CG1-CD1 4.21Å; I1249-Y1329 HydrophobicContact CD1-CG 4.33Å; I1249-Y1329 HydrophobicContact CG2-CD2 3.69Å; I1249-Y1329 HydrophobicContact CG2-CE2 4.25Å; I1249-Y1329 HydrophobicContact CG2-CG 4.21Å
1250	T	90.9	Very high	87.6	Confident	16 Å²	16	55.7 Å²	55.7	10%	0.098	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	156.1	176.6	74.2	0	0	0	0	110.3	H1218 L1219 T1220 A1221 T1248 Q1309	H1218-T1250 PolarHBondContact CE1-OG1 3.12Å; H1218-T1250 VanDerWaalsContact NE2-CG2 3.34Å; H1218-T1250 WeakPolarHBondContact NE2-CG2 3.45Å; L1219-T1250 PolarHBondContact O-N 3.35Å; T1220-T1250 CarbonylContact C-O 3.47Å; T1220-T1250 WeakPolarHBondContact CA-O 3.5Å; A1221-T1250 WeakPolarHBondContact CB-O 3.44Å; A1221-T1250 PolarHBondContact N-O 3.02Å; T1248-T1250 HydrophobicContact CG2-CG2 4.06Å; T1250-Q1309 HydrophobicContact CG2-CG 4.02Å
1251	P	90	Very high	88	Confident	25 Å²	25	52.6 Å²	52.6	16%	0.162	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	153.9	169.3	33.5	-34.7	0	0	0	109.8	L1253 H1256 G1308 M1331	P1251-L1253 WeakPolarHBondContact CB-O 3.34Å; P1251-H1256 HydrophobicContact CB-CB 4.06Å; P1251-G1308 WeakPolarHBondContact CD-O 3.39Å; P1251-M1331 HydrophobicContact CB-CG 3.83Å; P1251-M1331 HydrophobicContact CB-SD 4.01Å
1252	K	86.8	Confident	88.3	Confident	120 Å²	120	50.2 Å²	50.2	52%	0.522	25%	0.25	S	C	.	.	S	Bend	trans	-77.8	-20.5	174.1	179.1	-177.7	177.7	-169.5	0	113.3	A1221 D1222 M1331	A1221-K1252 WeakPolarHBondContact O-CB 3.32Å; A1221-K1252 PolarHBondContact O-N 2.9Å; D1222-K1252 HydrophobicContact CB-CD 4.29Å; D1222-K1252 IonicContact OD1-NZ 3.79Å; D1222-K1252 VanDerWaalsContact OD2-CD 3.29Å; D1222-K1252 WeakPolarHBondContact OD2-CD 3.48Å; D1222-K1252 WeakPolarHBondContact OD2-CE 3.33Å; D1222-K1252 IonicContact OD2-NZ 3.8Å; D1222-K1252 PolarHBondContact OD2-NZ 2.96Å; K1252-M1331 HydrophobicContact CB-SD 3.97Å; K1252-M1331 PolarHBondContact N-SD 2.76Å; K1252-M1331 VanDerWaalsContact N-SD 3.41Å
1253	L	84.5	Confident	88.2	Confident	94 Å²	94	48.8 Å²	48.8	49%	0.492	24%	0.242	S	C	.	.	S	Bend	trans	-124	144.2	176.5	-63.9	177.8	0	0	0	110	P1251 M1331	P1251-L1253 WeakPolarHBondContact CB-O 3.34Å; L1253-M1331 HydrophobicContact CB-CE 4.21Å; L1253-M1331 HydrophobicContact CB-SD 3.83Å; L1253-M1331 HydrophobicContact CD1-CE 3.81Å; L1253-M1331 HydrophobicContact CG-CE 3.94Å; L1253-M1331 HydrophobicContact CG-SD 4.11Å; L1253-M1331 PolarHBondContact N-SD 3.35Å
1254	D	72.4	Confident	88.5	Confident	150 Å²	150	52.1 Å²	52.1	80%	0.802	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	162.1	166	-59.2	-57.7	0	0	0	111.1	H1256	D1254-H1256 PolarHBondContact O-N 2.67Å; D1254-H1256 VanDerWaalsContact O-N 3.16Å; D1254-H1256 PolarHBondContact O-ND1 2.76Å
1255	N	80.4	Confident	88.5	Confident	140 Å²	140	47 Å²	47	75%	0.749	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.2	24.7	-173	-66.3	-19.6	0	0	0	115.1	Y1334	N1255-Y1334 VanDerWaalsContact O-CD2 3.31Å; N1255-Y1334 WeakPolarHBondContact O-CD2 3.24Å
1256	H	86.1	Confident	88.4	Confident	44 Å²	44	48.2 Å²	48.2	20%	0.204	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	166.6	167.8	-65.2	68.8	0	0	0	110.7	P1251 D1254 M1331 I1332 Y1334	P1251-H1256 HydrophobicContact CB-CB 4.06Å; D1254-H1256 PolarHBondContact O-N 2.67Å; D1254-H1256 VanDerWaalsContact O-N 3.16Å; D1254-H1256 PolarHBondContact O-ND1 2.76Å; H1256-M1331 HydrophobicContact CB-CG 3.43Å; H1256-M1331 VanDerWaalsContact CB-CG 3.43Å; H1256-M1331 HydrophobicContact CB-SD 3.86Å; H1256-I1332 WeakPolarHBondContact CA-O 3.49Å; H1256-I1332 WeakPolarHBondContact CB-O 3.39Å; H1256-Y1334 VanDerWaalsContact O-CE2 3.23Å; H1256-Y1334 WeakPolarHBondContact O-CE2 3.3Å
1257	T	89.6	Confident	88.3	Confident	3 Å²	3	44.2 Å²	44.2	2%	0.018	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	165.4	177.3	-171.5	0	0	0	0	111.4	L1304 S1305 M1331 I1332 Y1334	T1257-L1304 HydrophobicContact CG2-CD1 3.65Å; T1257-L1304 HydrophobicContact CG2-CG 4.45Å; T1257-S1305 WeakPolarHBondContact OG1-CB 3.24Å; T1257-S1305 PolarHBondContact OG1-O 2.65Å; T1257-M1331 WeakPolarHBondContact O-CA 3.45Å; T1257-I1332 HydrophobicContact CG2-CG1 4.11Å; T1257-I1332 PolarHBondContact N-O 2.79Å; T1257-I1332 PolarHBondContact O-N 3.34Å; T1257-Y1334 HydrophobicContact CG2-CD1 4.17Å; T1257-Y1334 HydrophobicContact CG2-CE1 4.41Å
1258	V	90.3	Very high	88.1	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	126.2	179.6	177.5	0	0	0	0	111	A1221 I1249 S1305 G1308 L1310	A1221-V1258 HydrophobicContact CB-CG2 3.99Å; I1249-V1258 HydrophobicContact CB-CG1 4.28Å; I1249-V1258 HydrophobicContact CG2-CG1 3.76Å; I1249-V1258 HydrophobicContact CG2-CG2 4.01Å; V1258-S1305 PolarHBondContact O-N 3.18Å; V1258-G1308 WeakPolarHBondContact CG2-O 3.48Å; V1258-G1308 PolarHBondContact N-O 2.98Å; V1258-L1310 HydrophobicContact CB-CD1 4.35Å; V1258-L1310 HydrophobicContact CB-CG 4.4Å; V1258-L1310 HydrophobicContact CG1-CD1 3.81Å; V1258-L1310 HydrophobicContact CG1-CG 4.29Å
1259	L	91.4	Very high	87.8	Confident	23 Å²	23	51.5 Å²	51.5	12%	0.12	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	139.1	161.2	-168.3	70.1	0	0	0	109.3	T1302 F1303 L1304 Y1329 Q1330 I1332 L1338	L1259-T1302 HydrophobicContact CD1-CG2 3.63Å; L1259-T1302 HydrophobicContact CG-CG2 4.09Å; L1259-F1303 WeakPolarHBondContact CA-O 3.5Å; L1259-L1304 HydrophobicContact CD1-CD1 4.31Å; L1259-Y1329 CarbonylContact O-C 3.37Å; L1259-Y1329 VanDerWaalsContact O-CA 3.22Å; L1259-Y1329 WeakPolarHBondContact O-CA 3.3Å; L1259-Q1330 PolarHBondContact N-O 3.49Å; L1259-Q1330 PolarHBondContact O-N 3.38Å; L1259-I1332 HydrophobicContact CB-CD1 3.8Å; L1259-I1332 HydrophobicContact CB-CG1 4.14Å; L1259-I1332 HydrophobicContact CD1-CD1 4.09Å; L1259-I1332 HydrophobicContact CD2-CD1 4.43Å; L1259-I1332 HydrophobicContact CG-CD1 4.33Å; L1259-L1338 HydrophobicContact CD1-CD1 4.37Å; L1259-L1338 HydrophobicContact CD1-CD2 4.23Å
1260	L	91.3	Very high	87.4	Confident	0 Å²	0	53 Å²	53	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	116.1	175.7	177.8	72.4	0	0	0	110.3	I1249 F1262 V1280 T1302 F1303 L1310 L1312 A1327 Q1328	I1249-L1260 HydrophobicContact CD1-CD1 4.22Å; L1260-F1262 HydrophobicContact CD2-CE2 3.86Å; L1260-F1262 HydrophobicContact CD2-CZ 4.1Å; L1260-F1262 HydrophobicContact CG-CE2 4.02Å; L1260-F1262 HydrophobicContact CG-CZ 4.46Å; L1260-V1280 HydrophobicContact CD2-CG1 4.1Å; L1260-T1302 CarbonylContact O-C 3.59Å; L1260-T1302 WeakPolarHBondContact O-CA 3.27Å; L1260-F1303 HydrophobicContact CB-CB 4.39Å; L1260-F1303 HydrophobicContact CD2-CD2 4.15Å; L1260-F1303 PolarHBondContact N-O 3.05Å; L1260-F1303 PolarHBondContact O-N 3.41Å; L1260-L1310 HydrophobicContact CB-CD1 3.57Å; L1260-L1310 HydrophobicContact CD2-CD1 3.92Å; L1260-L1310 HydrophobicContact CG-CD1 4.36Å; L1260-L1312 HydrophobicContact CD2-CD1 4.12Å; L1260-L1312 HydrophobicContact CD2-CD2 4.06Å; L1260-L1312 HydrophobicContact CD2-CG 4.36Å; L1260-A1327 HydrophobicContact CD1-CB 3.86Å; L1260-Q1328 CarbonylContact C-O 3.6Å; L1260-Q1328 WeakPolarHBondContact CA-O 3.25Å
1261	K	90.8	Very high	86.8	Confident	67 Å²	67	58.8 Å²	58.8	29%	0.291	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	126.7	179.5	-179.5	165.2	-179.1	175.3	0	109.9	T1302 Q1328 E1342	K1261-T1302 HydrophobicContact CB-CG2 4.07Å; K1261-T1302 WeakPolarHBondContact CG-OG1 3.25Å; K1261-Q1328 PolarHBondContact N-O 3.24Å; K1261-Q1328 PolarHBondContact O-N 3.1Å; K1261-E1342 IonicContact NZ-OE1 3.11Å; K1261-E1342 PolarHBondContact NZ-OE1 2.88Å; K1261-E1342 IonicContact NZ-OE2 3.94Å; K1261-E1342 PolarHBondContact NZ-OE2 3.37Å
1262	F	89.9	Confident	86.5	Confident	9 Å²	9	64 Å²	64	4%	0.039	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	138.5	175.6	-72	-94.9	0	0	0	110.7	L1260 F1265 L1278 L1299 P1300 F1303 F1325 A1327	L1260-F1262 HydrophobicContact CD2-CE2 3.86Å; L1260-F1262 HydrophobicContact CD2-CZ 4.1Å; L1260-F1262 HydrophobicContact CG-CE2 4.02Å; L1260-F1262 HydrophobicContact CG-CZ 4.46Å; F1262-F1265 AromaticContact CD1-CD2 3.93Å; F1262-F1265 HydrophobicContact CD1-CD2 3.93Å; F1262-F1265 HydrophobicContact CE1-CD2 4.24Å; F1262-F1265 HydrophobicContact CE1-CE2 4.42Å; F1262-L1278 HydrophobicContact CE1-CD2 3.43Å; F1262-L1278 VanDerWaalsContact CE1-CD2 3.43Å; F1262-L1278 HydrophobicContact CZ-CD2 3.46Å; F1262-L1278 VanDerWaalsContact CZ-CD2 3.46Å; F1262-L1299 HydrophobicContact CB-CD2 4.08Å; F1262-P1300 HydrophobicContact CD1-CG 4.28Å; F1262-P1300 HydrophobicContact CD2-CB 3.7Å; F1262-P1300 HydrophobicContact CD2-CG 3.99Å; F1262-P1300 HydrophobicContact CE2-CB 4.07Å; F1262-P1300 HydrophobicContact CE2-CG 4.33Å; F1262-P1300 HydrophobicContact CG-CB 4.15Å; F1262-P1300 HydrophobicContact CG-CG 3.98Å; F1262-F1303 HydrophobicContact CD2-CE2 4.29Å; F1262-F1303 HydrophobicContact CE2-CD2 4.07Å; F1262-F1303 AromaticContact CE2-CE2 3.82Å; F1262-F1303 HydrophobicContact CE2-CE2 3.82Å; F1262-F1325 HydrophobicContact CD1-CB 4.36Å; F1262-F1325 HydrophobicContact CD1-CD2 4.49Å; F1262-F1325 HydrophobicContact CE1-CB 4.44Å; F1262-F1325 AromaticContact CE1-CD2 3.95Å; F1262-F1325 HydrophobicContact CE1-CD2 3.95Å; F1262-F1325 HydrophobicContact CE1-CG 4.26Å; F1262-A1327 HydrophobicContact CD1-CB 3.81Å; F1262-A1327 HydrophobicContact CE1-CB 3.72Å; F1262-A1327 HydrophobicContact CG-CB 4.34Å; F1262-A1327 HydrophobicContact CZ-CB 4.17Å
1263	L	85.4	Confident	86.4	Confident	75 Å²	75	59.4 Å²	59.4	39%	0.393	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	-33.5	179.4	-58.9	-176.7	0	0	0	111.7	Q1326 Q1328	L1263-Q1326 HydrophobicContact CB-CG 4.31Å; L1263-Q1326 HydrophobicContact CD1-CG 4.44Å; L1263-Q1326 PolarHBondContact N-O 3.17Å; L1263-Q1328 HydrophobicContact CD1-CB 4.03Å; L1263-Q1328 HydrophobicContact CG-CB 4.19Å
1264	Y	89.5	Confident	86.4	Confident	93 Å²	93	58.6 Å²	58.6	37%	0.365	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	143.9	173.8	-172.9	-88	0	0	0	109.6	F1234 E1266 K1323 G1324 F1325 Q1326	F1234-Y1264 AromaticContact CE2-CD1 3.85Å; F1234-Y1264 HydrophobicContact CE2-CD1 3.85Å; F1234-Y1264 HydrophobicContact CE2-CE1 4.33Å; F1234-Y1264 AromaticContact CZ-CD1 3.59Å; F1234-Y1264 HydrophobicContact CZ-CD1 3.59Å; F1234-Y1264 HydrophobicContact CZ-CE1 4.27Å; F1234-Y1264 AromaticContact CZ-CG 4Å; F1234-Y1264 HydrophobicContact CZ-CG 4Å; Y1264-E1266 HydrophobicContact CE1-CB 3.77Å; Y1264-E1266 PolarHBondContact OH-OE2 3.15Å; Y1264-K1323 HydrophobicContact CE1-CB 3.86Å; Y1264-G1324 WeakPolarHBondContact CD1-O 3.36Å; Y1264-F1325 VanDerWaalsContact O-CA 3.26Å; Y1264-F1325 WeakPolarHBondContact O-CA 3.49Å; Y1264-F1325 WeakPolarHBondContact O-CB 3.19Å; Y1264-Q1326 PolarHBondContact N-O 2.78Å; Y1264-Q1326 VanDerWaalsContact N-O 3.16Å; Y1264-Q1326 PolarHBondContact O-N 2.9Å
1265	F	90.4	Very high	87.1	Confident	8 Å²	8	57.4 Å²	57.4	4%	0.035	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	111.4	178.6	-161.9	-90	0	0	0	110.9	F1262 V1267 L1278 F1294 G1296 R1297 L1299 P1300 F1325	F1262-F1265 AromaticContact CD1-CD2 3.93Å; F1262-F1265 HydrophobicContact CD1-CD2 3.93Å; F1262-F1265 HydrophobicContact CE1-CD2 4.24Å; F1262-F1265 HydrophobicContact CE1-CE2 4.42Å; F1265-V1267 HydrophobicContact CD1-CG2 4.46Å; F1265-V1267 HydrophobicContact CE1-CB 4.01Å; F1265-V1267 HydrophobicContact CE1-CG2 3.82Å; F1265-V1267 HydrophobicContact CE2-CG2 4.11Å; F1265-V1267 HydrophobicContact CZ-CB 4.19Å; F1265-V1267 HydrophobicContact CZ-CG2 3.61Å; F1265-L1278 HydrophobicContact CE2-CB 4.12Å; F1265-L1278 HydrophobicContact CE2-CD2 3.84Å; F1265-L1278 HydrophobicContact CZ-CB 4.21Å; F1265-F1294 HydrophobicContact CE1-CB 4.13Å; F1265-F1294 HydrophobicContact CE2-CB 4.33Å; F1265-F1294 HydrophobicContact CZ-CB 3.64Å; F1265-G1296 VanDerWaalsContact CD1-O 3.25Å; F1265-G1296 WeakPolarHBondContact CD1-O 3.2Å; F1265-G1296 WeakPolarHBondContact CE1-O 3.47Å; F1265-R1297 CarbonylContact O-C 3.51Å; F1265-R1297 WeakPolarHBondContact O-CA 3.43Å; F1265-L1299 HydrophobicContact CB-CD2 4.07Å; F1265-P1300 HydrophobicContact CD1-CG 4.47Å; F1265-P1300 HydrophobicContact CD2-CG 3.71Å; F1265-P1300 HydrophobicContact CE2-CG 3.8Å; F1265-P1300 HydrophobicContact CG-CG 4.09Å; F1265-P1300 HydrophobicContact CZ-CG 4.23Å; F1265-F1325 HydrophobicContact CD2-CB 3.54Å; F1265-F1325 HydrophobicContact CD2-CG 4.28Å; F1265-F1325 HydrophobicContact CE2-CB 4.06Å; F1265-F1325 HydrophobicContact CE2-CD1 4.23Å; F1265-F1325 HydrophobicContact CE2-CG 4.35Å; F1265-F1325 HydrophobicContact CG-CB 4.35Å
1266	E	89.3	Confident	87.6	Confident	27 Å²	27	50.8 Å²	50.8	13%	0.126	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	92.5	169.9	178.4	172	-130.6	0	0	109	Y1264 R1297 K1323 G1324	Y1264-E1266 HydrophobicContact CE1-CB 3.77Å; Y1264-E1266 PolarHBondContact OH-OE2 3.15Å; E1266-R1297 HydrophobicContact CB-CG 4.32Å; E1266-R1297 HydrophobicContact CG-CG 3.98Å; E1266-R1297 IonicContact OE1-CZ 3.16Å; E1266-R1297 IonicContact OE1-NE 3.21Å; E1266-R1297 PolarHBondContact OE1-NE 3.33Å; E1266-R1297 IonicContact OE1-NH2 2.72Å; E1266-R1297 PolarHBondContact OE1-NH2 3.46Å; E1266-K1323 HydrophobicContact CB-CB 4.34Å; E1266-K1323 WeakPolarHBondContact OE2-CB 3.29Å; E1266-K1323 WeakPolarHBondContact OE2-CG 3.25Å; E1266-G1324 PolarHBondContact N-O 3.47Å; E1266-G1324 VanDerWaalsContact O-CA 3.23Å; E1266-G1324 WeakPolarHBondContact O-CA 3.49Å; E1266-G1324 PolarHBondContact O-N 2.79Å
1267	V	89.4	Confident	88	Confident	5 Å²	5	50.3 Å²	50.3	3%	0.03	25%	0.249	C	C	.	.			trans	-107.1	164.1	169.6	177.5	0	0	0	0	107.6	F1265 D1276 C1295 G1296 F1314	F1265-V1267 HydrophobicContact CD1-CG2 4.46Å; F1265-V1267 HydrophobicContact CE1-CB 4.01Å; F1265-V1267 HydrophobicContact CE1-CG2 3.82Å; F1265-V1267 HydrophobicContact CE2-CG2 4.11Å; F1265-V1267 HydrophobicContact CZ-CB 4.19Å; F1265-V1267 HydrophobicContact CZ-CG2 3.61Å; V1267-D1276 HydrophobicContact CG1-CB 3.44Å; V1267-D1276 VanDerWaalsContact CG1-CB 3.44Å; V1267-C1295 HydrophobicContact CG1-CB 4.21Å; V1267-G1296 PolarHBondContact N-O 3.11Å; V1267-G1296 CarbonylContact O-C 3.49Å; V1267-G1296 WeakPolarHBondContact O-CA 3.39Å; V1267-G1296 PolarHBondContact O-N 3.49Å; V1267-F1314 HydrophobicContact CG1-CE2 4.08Å; V1267-F1314 HydrophobicContact CG2-CE2 3.95Å
1268	E	88.7	Confident	88.2	Confident	34 Å²	34	50.2 Å²	50.2	16%	0.159	25%	0.248	C	C	.	.			trans	-53.5	143.6	175.4	-155.9	-161	-176.3	0	0	111.8	Y1239 Y1275 D1276 C1295 G1296 I1320	Y1239-E1268 PolarHBondContact OH-N 2.81Å; E1268-Y1275 WeakPolarHBondContact OE2-CB 3.19Å; E1268-Y1275 VanDerWaalsContact OE2-CD2 3.32Å; E1268-Y1275 WeakPolarHBondContact OE2-CD2 3.22Å; E1268-D1276 HydrophobicContact CB-CB 3.86Å; E1268-C1295 VanDerWaalsContact O-CB 3.29Å; E1268-C1295 WeakPolarHBondContact O-CB 3.43Å; E1268-G1296 PolarHBondContact O-N 2.96Å; E1268-I1320 HydrophobicContact CG-CB 4.16Å; E1268-I1320 HydrophobicContact CG-CG2 4.39Å
1269	E	86	Confident	88.3	Confident	149 Å²	149	53.7 Å²	53.7	70%	0.696	26%	0.261	S	S	*	.			trans	-101	100.1	-171.9	-166.6	170	165.8	0	0	111.7
1270	E	83.4	Confident	88.4	Confident	31 Å²	31	52.6 Å²	52.6	15%	0.145	26%	0.256	C	S	.	.			trans	-126.9	142.3	179.5	-163.6	-79.4	109.2	0	0	110.8	L1272 C1273 T1274 Y1275 C1295	E1270-L1272 VanDerWaalsContact C-N 3.26Å; E1270-L1272 PolarHBondContact O-N 2.95Å; E1270-L1272 PolarHBondContact OE1-N 3.44Å; E1270-L1272 VanDerWaalsContact OE2-C 3.31Å; E1270-L1272 WeakPolarHBondContact OE2-CA 3.34Å; E1270-L1272 WeakPolarHBondContact OE2-CB 3.45Å; E1270-L1272 PolarHBondContact OE2-N 2.97Å; E1270-L1272 VanDerWaalsContact OE2-N 3.09Å; E1270-C1273 PolarHBondContact O-N 3.25Å; E1270-C1273 PolarHBondContact OE2-N 2.97Å; E1270-T1274 WeakPolarHBondContact OE2-CB 3.38Å; E1270-T1274 PolarHBondContact OE2-N 3.01Å; E1270-T1274 PolarHBondContact OE2-OG1 2.9Å; E1270-Y1275 HydrophobicContact CB-CD2 4.18Å; E1270-Y1275 HydrophobicContact CG-CD2 3.81Å; E1270-Y1275 HydrophobicContact CG-CE2 3.79Å; E1270-Y1275 HydrophobicContact CG-CG 4.26Å; E1270-C1295 PolarHBondContact O-SG 3.49Å
1271	T	77.5	Confident	88.5	Confident	137 Å²	137	53.5 Å²	53.5	84%	0.84	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-24.7	-175.3	53.4	0	0	0	0	116.6
1272	L	83.4	Confident	88.5	Confident	134 Å²	134	51 Å²	51	70%	0.702	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-117.2	0.1	179.8	-59.3	175.5	0	0	0	112.9	E1270 T1274	E1270-L1272 VanDerWaalsContact C-N 3.26Å; E1270-L1272 PolarHBondContact O-N 2.95Å; E1270-L1272 PolarHBondContact OE1-N 3.44Å; E1270-L1272 VanDerWaalsContact OE2-C 3.31Å; E1270-L1272 WeakPolarHBondContact OE2-CA 3.34Å; E1270-L1272 WeakPolarHBondContact OE2-CB 3.45Å; E1270-L1272 PolarHBondContact OE2-N 2.97Å; E1270-L1272 VanDerWaalsContact OE2-N 3.09Å; L1272-T1274 HydrophobicContact CB-CG2 3.68Å
1273	C	84.5	Confident	88.5	Confident	25 Å²	25	51 Å²	51	17%	0.169	25%	0.252	C	S	.	.			trans	48.6	54.6	-170.5	-57.7	0	0	0	0	113	E1270 Y1277 C1295	E1270-C1273 PolarHBondContact O-N 3.25Å; E1270-C1273 PolarHBondContact OE2-N 2.97Å; C1273-Y1277 VanDerWaalsContact O-CD1 3.26Å; C1273-Y1277 WeakPolarHBondContact O-CD1 3.44Å; C1273-C1295 WeakPolarHBondContact CA-SG 3.5Å; C1273-C1295 HydrophobicContact CB-CB 3.58Å; C1273-C1295 WeakPolarHBondContact CB-SG 3.25Å; C1273-C1295 WeakPolarHBondContact SG-CB 3.47Å; C1273-C1295 PolarHBondContact SG-N 3.35Å; C1273-C1295 CovalentContact SG-SG 2.04Å; C1273-C1295 PolarHBondContact SG-SG 3.49Å
1274	T	85.2	Confident	88.4	Confident	77 Å²	77	48.6 Å²	48.6	47%	0.472	25%	0.245	S	C	.	.			trans	-104.6	-21.5	-175.8	54.8	0	0	0	0	115.6	E1270 L1272	E1270-T1274 WeakPolarHBondContact OE2-CB 3.38Å; E1270-T1274 PolarHBondContact OE2-N 3.01Å; E1270-T1274 PolarHBondContact OE2-OG1 2.9Å; L1272-T1274 HydrophobicContact CB-CG2 3.68Å
1275	Y	86.1	Confident	88.3	Confident	125 Å²	125	46.8 Å²	46.8	49%	0.49	24%	0.242	S	C	.	.	S	Bend	trans	-80.5	-100.9	170.2	-52.7	-24.6	0	0	0	108.6	E1268 E1270 Y1277	E1268-Y1275 WeakPolarHBondContact OE2-CB 3.19Å; E1268-Y1275 VanDerWaalsContact OE2-CD2 3.32Å; E1268-Y1275 WeakPolarHBondContact OE2-CD2 3.22Å; E1270-Y1275 HydrophobicContact CB-CD2 4.18Å; E1270-Y1275 HydrophobicContact CG-CD2 3.81Å; E1270-Y1275 HydrophobicContact CG-CE2 3.79Å; E1270-Y1275 HydrophobicContact CG-CG 4.26Å; Y1275-Y1277 WeakPolarHBondContact O-CD1 3.43Å
1276	D	91.9	Very high	88	Confident	1 Å²	1	49.6 Å²	49.6	1%	0.005	26%	0.261	C	S	.	.	S	Bend	trans	-80.7	138.1	170.2	-63.7	-11.6	0	0	0	112.5	Y1239 V1267 E1268 C1295 V1315 S1316 D1317	Y1239-D1276 WeakPolarHBondContact CE2-OD2 3.39Å; Y1239-D1276 PolarHBondContact OH-OD2 2.79Å; V1267-D1276 HydrophobicContact CG1-CB 3.44Å; V1267-D1276 VanDerWaalsContact CG1-CB 3.44Å; E1268-D1276 HydrophobicContact CB-CB 3.86Å; D1276-C1295 WeakPolarHBondContact O-CB 3.26Å; D1276-V1315 WeakPolarHBondContact CA-O 3.43Å; D1276-S1316 WeakPolarHBondContact OD1-CA 3.22Å; D1276-S1316 WeakPolarHBondContact OD1-CB 3.43Å; D1276-D1317 PolarHBondContact OD1-N 3.43Å
1277	Y	93.4	Very high	87.9	Confident	34 Å²	34	55.3 Å²	55.3	13%	0.133	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.1	149.9	175.4	56.1	-94.4	0	0	0	114.4	C1273 Y1275 R1279 F1294 F1314 V1315	C1273-Y1277 VanDerWaalsContact O-CD1 3.26Å; C1273-Y1277 WeakPolarHBondContact O-CD1 3.44Å; Y1275-Y1277 WeakPolarHBondContact O-CD1 3.43Å; Y1277-R1279 HydrophobicContact CD2-CG 3.89Å; Y1277-R1279 HydrophobicContact CE2-CG 4.31Å; Y1277-R1279 VanDerWaalsContact CZ-CZ 3.43Å; Y1277-R1279 VanDerWaalsContact CZ-NH1 3.33Å; Y1277-R1279 VanDerWaalsContact CZ-NH2 3.33Å; Y1277-R1279 PolarHBondContact OH-NH1 3.32Å; Y1277-F1294 WeakPolarHBondContact CA-O 3.12Å; Y1277-F1314 WeakPolarHBondContact O-CA 3.44Å; Y1277-F1314 WeakPolarHBondContact O-CD2 3.23Å; Y1277-V1315 HydrophobicContact CD2-CB 4.41Å; Y1277-V1315 HydrophobicContact CE1-CB 4.14Å; Y1277-V1315 HydrophobicContact CE1-CG1 4.39Å; Y1277-V1315 HydrophobicContact CE2-CB 3.86Å; Y1277-V1315 HydrophobicContact CE2-CG2 3.78Å; Y1277-V1315 PolarHBondContact N-O 3.44Å; Y1277-V1315 PolarHBondContact O-N 2.76Å
1278	L	93.9	Very high	87.6	Confident	0 Å²	0	56 Å²	56	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	123.4	161.4	177.9	66.6	0	0	0	110	F1262 F1265 V1280 G1293 F1294 L1312 Q1313 F1314 F1325	F1262-L1278 HydrophobicContact CE1-CD2 3.43Å; F1262-L1278 VanDerWaalsContact CE1-CD2 3.43Å; F1262-L1278 HydrophobicContact CZ-CD2 3.46Å; F1262-L1278 VanDerWaalsContact CZ-CD2 3.46Å; F1265-L1278 HydrophobicContact CE2-CB 4.12Å; F1265-L1278 HydrophobicContact CE2-CD2 3.84Å; F1265-L1278 HydrophobicContact CZ-CB 4.21Å; L1278-V1280 HydrophobicContact CD2-CG2 4.5Å; L1278-V1280 HydrophobicContact CG-CG2 4.4Å; L1278-G1293 CarbonylContact O-C 3.22Å; L1278-G1293 WeakPolarHBondContact O-CA 3.48Å; L1278-F1294 PolarHBondContact N-O 2.75Å; L1278-F1294 PolarHBondContact O-N 3.4Å; L1278-L1312 HydrophobicContact CD1-CB 4.24Å; L1278-Q1313 CarbonylContact C-O 3.38Å; L1278-Q1313 WeakPolarHBondContact CA-O 3.05Å; L1278-F1314 HydrophobicContact CB-CD2 4.28Å; L1278-F1314 HydrophobicContact CD1-CB 3.96Å; L1278-F1325 HydrophobicContact CB-CE1 4.36Å; L1278-F1325 HydrophobicContact CD1-CE1 3.99Å; L1278-F1325 HydrophobicContact CD1-CZ 3.91Å; L1278-F1325 HydrophobicContact CD2-CD1 4.07Å; L1278-F1325 HydrophobicContact CD2-CD2 4.43Å; L1278-F1325 HydrophobicContact CD2-CE1 3.93Å; L1278-F1325 HydrophobicContact CD2-CE2 4.29Å; L1278-F1325 HydrophobicContact CD2-CG 4.33Å; L1278-F1325 HydrophobicContact CD2-CZ 4.04Å; L1278-F1325 HydrophobicContact CG-CE1 4.32Å
1279	R	93.7	Very high	87.5	Confident	73 Å²	73	61.1 Å²	61.1	28%	0.275	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	138.7	168.6	-70.8	172.7	-169.9	141.6	8.2	110.6	Y1277 F1281 L1290 G1292 L1312 Q1313	Y1277-R1279 HydrophobicContact CD2-CG 3.89Å; Y1277-R1279 HydrophobicContact CE2-CG 4.31Å; Y1277-R1279 VanDerWaalsContact CZ-CZ 3.43Å; Y1277-R1279 VanDerWaalsContact CZ-NH1 3.33Å; Y1277-R1279 VanDerWaalsContact CZ-NH2 3.33Å; Y1277-R1279 PolarHBondContact OH-NH1 3.32Å; R1279-F1281 HydrophobicContact CB-CD2 4.32Å; R1279-F1281 HydrophobicContact CB-CE2 3.59Å; R1279-F1281 HydrophobicContact CB-CZ 4.2Å; R1279-L1290 HydrophobicContact CB-CD1 3.94Å; R1279-L1290 HydrophobicContact CG-CD1 4.21Å; R1279-G1292 WeakPolarHBondContact CA-O 3.23Å; R1279-L1312 WeakPolarHBondContact O-CA 3.49Å; R1279-Q1313 HydrophobicContact CB-CB 4.43Å; R1279-Q1313 PolarHBondContact N-O 3.32Å; R1279-Q1313 PolarHBondContact O-N 2.86Å
1280	V	93.3	Very high	87.7	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	128	177.7	-171.2	0	0	0	0	108.8	L1260 L1278 L1291 G1292 F1294 F1303 L1312	L1260-V1280 HydrophobicContact CD2-CG1 4.1Å; L1278-V1280 HydrophobicContact CD2-CG2 4.5Å; L1278-V1280 HydrophobicContact CG-CG2 4.4Å; V1280-L1291 HydrophobicContact CG1-CD1 4.3Å; V1280-L1291 WeakPolarHBondContact O-CB 3.39Å; V1280-L1291 PolarHBondContact O-N 3.47Å; V1280-G1292 PolarHBondContact N-O 3.43Å; V1280-G1292 PolarHBondContact O-N 2.83Å; V1280-F1294 HydrophobicContact CG2-CD2 4.35Å; V1280-F1294 HydrophobicContact CG2-CE2 4.13Å; V1280-F1303 HydrophobicContact CG1-CD2 4.34Å; V1280-F1303 HydrophobicContact CG1-CG 4.45Å; V1280-F1303 HydrophobicContact CG2-CE2 4.25Å; V1280-L1312 HydrophobicContact CG1-CD1 4.32Å; V1280-L1312 HydrophobicContact CG1-CG 4.46Å; V1280-L1312 HydrophobicContact CG2-CG 4.43Å
1281	F	93.4	Very high	88	Confident	20 Å²	20	59.1 Å²	59.1	9%	0.088	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	143.8	-178.7	-58.7	-108.3	0	0	0	110.2	R1279 K1289 L1290 L1310 Y1311 Q1313	R1279-F1281 HydrophobicContact CB-CD2 4.32Å; R1279-F1281 HydrophobicContact CB-CE2 3.59Å; R1279-F1281 HydrophobicContact CB-CZ 4.2Å; F1281-K1289 WeakPolarHBondContact CA-O 3.41Å; F1281-L1290 HydrophobicContact CD1-CB 3.99Å; F1281-L1290 HydrophobicContact CD1-CD1 4.06Å; F1281-L1290 HydrophobicContact CD2-CD1 4.27Å; F1281-L1290 HydrophobicContact CE1-CB 4.06Å; F1281-L1290 HydrophobicContact CE1-CD1 3.84Å; F1281-L1290 HydrophobicContact CE1-CG 4.49Å; F1281-L1290 HydrophobicContact CE2-CD1 4.07Å; F1281-L1290 HydrophobicContact CG-CD1 4.28Å; F1281-L1290 HydrophobicContact CZ-CD1 3.85Å; F1281-L1310 WeakPolarHBondContact O-CA 3.46Å; F1281-Y1311 HydrophobicContact CB-CD1 4.43Å; F1281-Y1311 AromaticContact CD2-CD1 3.76Å; F1281-Y1311 HydrophobicContact CD2-CD1 3.76Å; F1281-Y1311 HydrophobicContact CD2-CE1 4.4Å; F1281-Y1311 HydrophobicContact CE2-CD1 4.27Å; F1281-Y1311 HydrophobicContact CE2-CE1 4.48Å; F1281-Y1311 HydrophobicContact CG-CD1 4.28Å; F1281-Y1311 PolarHBondContact N-O 2.83Å; F1281-Y1311 PolarHBondContact O-N 3.33Å; F1281-Q1313 HydrophobicContact CE2-CB 4.18Å
1282	D	91.2	Very high	88.4	Confident	13 Å²	13	53.3 Å²	53.3	7%	0.07	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	103.6	172.5	-168.7	-10.2	0	0	0	109	G1288 K1289 L1291 S1305 N1306 S1307	D1282-G1288 CarbonylContact O-C 3.53Å; D1282-G1288 WeakPolarHBondContact O-CA 3.44Å; D1282-K1289 HydrophobicContact CB-CB 4.3Å; D1282-K1289 PolarHBondContact N-O 2.85Å; D1282-K1289 PolarHBondContact O-N 3.22Å; D1282-L1291 HydrophobicContact CB-CD1 4.07Å; D1282-L1291 HydrophobicContact CB-CD2 3.91Å; D1282-L1291 HydrophobicContact CB-CG 3.95Å; D1282-S1305 PolarHBondContact OD1-OG 3.07Å; D1282-N1306 PolarHBondContact OD1-N 3.34Å; D1282-N1306 VanDerWaalsContact OD1-N 3.12Å; D1282-N1306 VanDerWaalsContact OD2-CB 3.26Å; D1282-N1306 WeakPolarHBondContact OD2-CB 3.46Å; D1282-N1306 PolarHBondContact OD2-N 3.39Å; D1282-N1306 PolarHBondContact OD2-ND2 3.48Å; D1282-S1307 VanDerWaalsContact OD1-CB 3.25Å; D1282-S1307 WeakPolarHBondContact OD1-CB 3.27Å; D1282-S1307 PolarHBondContact OD1-N 3.17Å; D1282-S1307 PolarHBondContact OD1-OG 2.9Å
1283	G	89	Confident	88.6	Confident	10 Å²	10	48.8 Å²	48.8	10%	0.103	26%	0.263	C	S	.	.	S	Bend	trans	142.7	167.6	-169.3	0	0	0	0	0	111.1	S1307 Q1309 L1310 Y1311	G1283-S1307 WeakPolarHBondContact CA-OG 3.09Å; G1283-S1307 PolarHBondContact N-OG 3.41Å; G1283-Q1309 PolarHBondContact N-O 2.66Å; G1283-Q1309 VanDerWaalsContact N-O 3.1Å; G1283-L1310 CarbonylContact O-C 3.49Å; G1283-L1310 WeakPolarHBondContact O-CA 3.48Å; G1283-Y1311 WeakPolarHBondContact O-CB 3.44Å; G1283-Y1311 PolarHBondContact O-N 2.85Å
1284	G	84.5	Confident	89	Confident	24 Å²	24	49.5 Å²	49.5	25%	0.247	26%	0.263	C	S	.	.	S	Bend	trans	-82.1	-9.4	178.3	0	0	0	0	0	115.2	T1248 Q1309	T1248-G1284 WeakPolarHBondContact CG2-O 2.87Å; T1248-G1284 PolarHBondContact OG1-O 3.27Å; G1284-Q1309 VanDerWaalsContact CA-OE1 3.23Å
1285	D	87	Confident	89.3	Confident	56 Å²	56	46.4 Å²	46.4	30%	0.299	25%	0.245	S	C	.	.	S	Bend	trans	-141.6	169.5	-172.8	94.3	-17.5	0	0	0	111.4	K1287 G1288	D1285-K1287 PolarHBondContact O-N 3.35Å; D1285-K1287 VanDerWaalsContact O-N 3.11Å; D1285-K1287 WeakPolarHBondContact OD1-CA 3.4Å; D1285-K1287 VanDerWaalsContact OD1-CB 3.22Å; D1285-K1287 WeakPolarHBondContact OD1-CB 3.41Å; D1285-K1287 PolarHBondContact OD1-N 3.18Å; D1285-K1287 WeakPolarHBondContact OD2-CG 3.4Å; D1285-K1287 IonicContact OD2-NZ 2.63Å; D1285-K1287 PolarHBondContact OD2-NZ 3.45Å; D1285-G1288 PolarHBondContact O-N 3Å; D1285-G1288 PolarHBondContact OD1-N 2.86Å
1286	P	83.9	Confident	89.5	Confident	66 Å²	66	40.6 Å²	40.6	43%	0.429	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.4	5.1	-178.5	28.6	-33.6	0	0	0	114.9	Y1311	P1286-Y1311 HydrophobicContact CB-CD1 4.12Å; P1286-Y1311 HydrophobicContact CB-CE1 3.66Å; P1286-Y1311 HydrophobicContact CG-CE1 4.08Å
1287	K	86	Confident	89.2	Confident	147 Å²	147	48.7 Å²	48.7	64%	0.639	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.8	-9.2	166.9	-45.3	-174.1	-159.2	87.2	0	111.7	D1285	D1285-K1287 PolarHBondContact O-N 3.35Å; D1285-K1287 VanDerWaalsContact O-N 3.11Å; D1285-K1287 WeakPolarHBondContact OD1-CA 3.4Å; D1285-K1287 VanDerWaalsContact OD1-CB 3.22Å; D1285-K1287 WeakPolarHBondContact OD1-CB 3.41Å; D1285-K1287 PolarHBondContact OD1-N 3.18Å; D1285-K1287 WeakPolarHBondContact OD2-CG 3.4Å; D1285-K1287 IonicContact OD2-NZ 2.63Å; D1285-K1287 PolarHBondContact OD2-NZ 3.45Å
1288	G	83.3	Confident	88.9	Confident	19 Å²	19	52 Å²	52	20%	0.196	28%	0.277	C	S	.	.	S	Bend	trans	-57.2	166	169.6	0	0	0	0	0	112.8	D1282 D1285 L1290	D1282-G1288 CarbonylContact O-C 3.53Å; D1282-G1288 WeakPolarHBondContact O-CA 3.44Å; D1285-G1288 PolarHBondContact O-N 3Å; D1285-G1288 PolarHBondContact OD1-N 2.86Å; G1288-L1290 PolarHBondContact O-N 3.3Å
1289	K	87.9	Confident	88.5	Confident	143 Å²	143	56.7 Å²	56.7	62%	0.622	30%	0.301	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.6	114	-178.8	174.8	-168.7	170.6	-166.5	0	109.7	F1281 D1282 L1291	F1281-K1289 WeakPolarHBondContact CA-O 3.41Å; D1282-K1289 HydrophobicContact CB-CB 4.3Å; D1282-K1289 PolarHBondContact N-O 2.85Å; D1282-K1289 PolarHBondContact O-N 3.22Å; K1289-L1291 PolarHBondContact O-N 3.45Å; K1289-L1291 VanDerWaalsContact O-N 3.14Å
1290	L	89.4	Confident	88.2	Confident	89 Å²	89	53.7 Å²	53.7	47%	0.466	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-54.6	118.7	172.4	-177.9	66.1	0	0	0	110.4	R1279 F1281 G1288 G1292	R1279-L1290 HydrophobicContact CB-CD1 3.94Å; R1279-L1290 HydrophobicContact CG-CD1 4.21Å; F1281-L1290 HydrophobicContact CD1-CB 3.99Å; F1281-L1290 HydrophobicContact CD1-CD1 4.06Å; F1281-L1290 HydrophobicContact CD2-CD1 4.27Å; F1281-L1290 HydrophobicContact CE1-CB 4.06Å; F1281-L1290 HydrophobicContact CE1-CD1 3.84Å; F1281-L1290 HydrophobicContact CE1-CG 4.49Å; F1281-L1290 HydrophobicContact CE2-CD1 4.07Å; F1281-L1290 HydrophobicContact CG-CD1 4.28Å; F1281-L1290 HydrophobicContact CZ-CD1 3.85Å; G1288-L1290 PolarHBondContact O-N 3.3Å; L1290-G1292 WeakPolarHBondContact CD1-O 3.37Å
1291	L	88.9	Confident	87.7	Confident	48 Å²	48	59.7 Å²	59.7	25%	0.251	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	-29.1	175.2	-62.9	-179.5	0	0	0	111.6	V1280 D1282 K1289 F1303 L1310	V1280-L1291 HydrophobicContact CG1-CD1 4.3Å; V1280-L1291 WeakPolarHBondContact O-CB 3.39Å; V1280-L1291 PolarHBondContact O-N 3.47Å; D1282-L1291 HydrophobicContact CB-CD1 4.07Å; D1282-L1291 HydrophobicContact CB-CD2 3.91Å; D1282-L1291 HydrophobicContact CB-CG 3.95Å; K1289-L1291 PolarHBondContact O-N 3.45Å; K1289-L1291 VanDerWaalsContact O-N 3.14Å; L1291-F1303 HydrophobicContact CB-CD1 3.96Å; L1291-F1303 HydrophobicContact CB-CE1 4.09Å; L1291-F1303 HydrophobicContact CD1-CB 4.12Å; L1291-F1303 HydrophobicContact CD1-CD1 3.86Å; L1291-F1303 HydrophobicContact CD1-CG 4.22Å; L1291-L1310 HydrophobicContact CD1-CD2 3.95Å
1292	G	86.4	Confident	87.4	Confident	16 Å²	16	61.5 Å²	61.5	17%	0.165	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	169.9	168.1	170.9	0	0	0	0	0	113.4	R1279 V1280 L1290 F1294	R1279-G1292 WeakPolarHBondContact CA-O 3.23Å; V1280-G1292 PolarHBondContact N-O 3.43Å; V1280-G1292 PolarHBondContact O-N 2.83Å; L1290-G1292 WeakPolarHBondContact CD1-O 3.37Å; G1292-F1294 VanDerWaalsContact C-CE2 3.42Å
1293	G	88.1	Confident	87.3	Confident	39 Å²	39	61.8 Å²	61.8	40%	0.402	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	141	167.5	0	0	0	0	0	109.6	L1278	L1278-G1293 CarbonylContact O-C 3.22Å; L1278-G1293 WeakPolarHBondContact O-CA 3.48Å
1294	F	92.8	Very high	87.2	Confident	40 Å²	40	64.3 Å²	64.3	18%	0.175	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	139.1	-168.5	-51.7	-76.3	0	0	0	110.8	F1265 Y1277 L1278 V1280 G1292 P1300 F1303	F1265-F1294 HydrophobicContact CE1-CB 4.13Å; F1265-F1294 HydrophobicContact CE2-CB 4.33Å; F1265-F1294 HydrophobicContact CZ-CB 3.64Å; Y1277-F1294 WeakPolarHBondContact CA-O 3.12Å; L1278-F1294 PolarHBondContact N-O 2.75Å; L1278-F1294 PolarHBondContact O-N 3.4Å; V1280-F1294 HydrophobicContact CG2-CD2 4.35Å; V1280-F1294 HydrophobicContact CG2-CE2 4.13Å; G1292-F1294 VanDerWaalsContact C-CE2 3.42Å; F1294-P1300 HydrophobicContact CB-CG 3.95Å; F1294-P1300 HydrophobicContact CD1-CB 3.94Å; F1294-P1300 HydrophobicContact CD1-CG 4.09Å; F1294-P1300 HydrophobicContact CD2-CB 4.18Å; F1294-P1300 HydrophobicContact CD2-CG 4.24Å; F1294-P1300 HydrophobicContact CE1-CB 4.18Å; F1294-P1300 HydrophobicContact CE2-CB 4.41Å; F1294-P1300 HydrophobicContact CG-CB 3.96Å; F1294-P1300 HydrophobicContact CG-CG 3.79Å; F1294-P1300 HydrophobicContact CZ-CB 4.43Å; F1294-F1303 HydrophobicContact CE1-CZ 4.33Å; F1294-F1303 HydrophobicContact CE2-CE1 4.4Å; F1294-F1303 HydrophobicContact CE2-CE2 4.19Å; F1294-F1303 AromaticContact CE2-CZ 3.58Å; F1294-F1303 HydrophobicContact CE2-CZ 3.58Å; F1294-F1303 HydrophobicContact CZ-CE1 4.07Å; F1294-F1303 HydrophobicContact CZ-CE2 4.37Å; F1294-F1303 AromaticContact CZ-CZ 3.41Å; F1294-F1303 HydrophobicContact CZ-CZ 3.41Å; F1294-F1303 VanDerWaalsContact CZ-CZ 3.41Å
1295	C	91.9	Very high	87.3	Confident	12 Å²	12	63.3 Å²	63.3	8%	0.081	34%	0.337	C	S	.	.			trans	-151	179.9	175.5	67.8	0	0	0	0	108.6	V1267 E1268 E1270 C1273 D1276	V1267-C1295 HydrophobicContact CG1-CB 4.21Å; E1268-C1295 VanDerWaalsContact O-CB 3.29Å; E1268-C1295 WeakPolarHBondContact O-CB 3.43Å; E1270-C1295 PolarHBondContact O-SG 3.49Å; C1273-C1295 WeakPolarHBondContact CA-SG 3.5Å; C1273-C1295 HydrophobicContact CB-CB 3.58Å; C1273-C1295 WeakPolarHBondContact CB-SG 3.25Å; C1273-C1295 WeakPolarHBondContact SG-CB 3.47Å; C1273-C1295 PolarHBondContact SG-N 3.35Å; C1273-C1295 CovalentContact SG-SG 2.04Å; C1273-C1295 PolarHBondContact SG-SG 3.49Å; D1276-C1295 WeakPolarHBondContact O-CB 3.26Å
1296	G	89.9	Confident	87.2	Confident	2 Å²	2	66.1 Å²	66.1	2%	0.021	35%	0.352	C	S	.	.	T	Hydrogen-bonded Turn	trans	68.5	-154	-175.7	0	0	0	0	0	113.9	F1265 V1267 E1268	F1265-G1296 VanDerWaalsContact CD1-O 3.25Å; F1265-G1296 WeakPolarHBondContact CD1-O 3.2Å; F1265-G1296 WeakPolarHBondContact CE1-O 3.47Å; V1267-G1296 PolarHBondContact N-O 3.11Å; V1267-G1296 CarbonylContact O-C 3.49Å; V1267-G1296 WeakPolarHBondContact O-CA 3.39Å; V1267-G1296 PolarHBondContact O-N 3.49Å; E1268-G1296 PolarHBondContact O-N 2.96Å
1297	R	86.4	Confident	87.2	Confident	171 Å²	171	65.8 Å²	65.8	65%	0.645	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.9	4.5	-170.5	-72.8	168.5	165.2	165.9	-5.2	115.5	F1265 E1266	F1265-R1297 CarbonylContact O-C 3.51Å; F1265-R1297 WeakPolarHBondContact O-CA 3.43Å; E1266-R1297 HydrophobicContact CB-CG 4.32Å; E1266-R1297 HydrophobicContact CG-CG 3.98Å; E1266-R1297 IonicContact OE1-CZ 3.16Å; E1266-R1297 IonicContact OE1-NE 3.21Å; E1266-R1297 PolarHBondContact OE1-NE 3.33Å; E1266-R1297 IonicContact OE1-NH2 2.72Å; E1266-R1297 PolarHBondContact OE1-NH2 3.46Å
1298	T	85.4	Confident	87.2	Confident	104 Å²	104	58.9 Å²	58.9	64%	0.638	32%	0.322	S	S	*	.	P	Polyproline II helix	trans	-85.6	120.5	179.8	52.1	0	0	0	0	110.9	P1300	T1298-P1300 WeakPolarHBondContact O-CD 3.48Å
1299	L	85.5	Confident	87.6	Confident	98 Å²	98	61.5 Å²	61.5	51%	0.513	33%	0.329	S	S	.	.	P	Polyproline II helix	trans	-54.1	121.9	173.4	-76.7	166.1	0	0	0	111.1	F1262 F1265	F1262-L1299 HydrophobicContact CB-CD2 4.08Å; F1265-L1299 HydrophobicContact CB-CD2 4.07Å
1300	P	88.7	Confident	87.8	Confident	11 Å²	11	54.7 Å²	54.7	7%	0.071	30%	0.299	C	S	.	.	P	Polyproline II helix	trans	-62.7	154.4	173	-22.5	33	0	0	0	112.1	F1262 F1265 F1294 T1298 F1303	F1262-P1300 HydrophobicContact CD1-CG 4.28Å; F1262-P1300 HydrophobicContact CD2-CB 3.7Å; F1262-P1300 HydrophobicContact CD2-CG 3.99Å; F1262-P1300 HydrophobicContact CE2-CB 4.07Å; F1262-P1300 HydrophobicContact CE2-CG 4.33Å; F1262-P1300 HydrophobicContact CG-CB 4.15Å; F1262-P1300 HydrophobicContact CG-CG 3.98Å; F1265-P1300 HydrophobicContact CD1-CG 4.47Å; F1265-P1300 HydrophobicContact CD2-CG 3.71Å; F1265-P1300 HydrophobicContact CE2-CG 3.8Å; F1265-P1300 HydrophobicContact CG-CG 4.09Å; F1265-P1300 HydrophobicContact CZ-CG 4.23Å; F1294-P1300 HydrophobicContact CB-CG 3.95Å; F1294-P1300 HydrophobicContact CD1-CB 3.94Å; F1294-P1300 HydrophobicContact CD1-CG 4.09Å; F1294-P1300 HydrophobicContact CD2-CB 4.18Å; F1294-P1300 HydrophobicContact CD2-CG 4.24Å; F1294-P1300 HydrophobicContact CE1-CB 4.18Å; F1294-P1300 HydrophobicContact CE2-CB 4.41Å; F1294-P1300 HydrophobicContact CG-CB 3.96Å; F1294-P1300 HydrophobicContact CG-CG 3.79Å; F1294-P1300 HydrophobicContact CZ-CB 4.43Å; T1298-P1300 WeakPolarHBondContact O-CD 3.48Å; P1300-F1303 HydrophobicContact CB-CE2 4.01Å; P1300-F1303 HydrophobicContact CB-CZ 4.27Å
1301	N	83.4	Confident	88	Confident	126 Å²	126	51.6 Å²	51.6	67%	0.674	28%	0.281	S	S	*	.	P	Polyproline II helix	trans	-57.9	161.1	175.8	-71.5	-27.1	0	0	0	112.2	F1303	N1301-F1303 HydrophobicContact CB-CZ 4.41Å; N1301-F1303 WeakPolarHBondContact O-CD2 3.24Å; N1301-F1303 WeakPolarHBondContact O-CE2 3.47Å; N1301-F1303 PolarHBondContact O-N 3.49Å
1302	T	86.7	Confident	88.2	Confident	57 Å²	57	49.3 Å²	49.3	35%	0.35	27%	0.269	S	S	.	.	P	Polyproline II helix	trans	-74.1	126.4	168.1	-60.6	0	0	0	0	109.5	L1259 L1260 K1261	L1259-T1302 HydrophobicContact CD1-CG2 3.63Å; L1259-T1302 HydrophobicContact CG-CG2 4.09Å; L1260-T1302 CarbonylContact O-C 3.59Å; L1260-T1302 WeakPolarHBondContact O-CA 3.27Å; K1261-T1302 HydrophobicContact CB-CG2 4.07Å; K1261-T1302 WeakPolarHBondContact CG-OG1 3.25Å
1303	F	88.3	Confident	88.6	Confident	20 Å²	20	50 Å²	50	9%	0.088	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	140.9	179.1	-56.4	-77	0	0	0	111.2	L1259 L1260 F1262 V1280 L1291 F1294 P1300 N1301	L1259-F1303 WeakPolarHBondContact CA-O 3.5Å; L1260-F1303 HydrophobicContact CB-CB 4.39Å; L1260-F1303 HydrophobicContact CD2-CD2 4.15Å; L1260-F1303 PolarHBondContact N-O 3.05Å; L1260-F1303 PolarHBondContact O-N 3.41Å; F1262-F1303 HydrophobicContact CD2-CE2 4.29Å; F1262-F1303 HydrophobicContact CE2-CD2 4.07Å; F1262-F1303 AromaticContact CE2-CE2 3.82Å; F1262-F1303 HydrophobicContact CE2-CE2 3.82Å; V1280-F1303 HydrophobicContact CG1-CD2 4.34Å; V1280-F1303 HydrophobicContact CG1-CG 4.45Å; V1280-F1303 HydrophobicContact CG2-CE2 4.25Å; L1291-F1303 HydrophobicContact CB-CD1 3.96Å; L1291-F1303 HydrophobicContact CB-CE1 4.09Å; L1291-F1303 HydrophobicContact CD1-CB 4.12Å; L1291-F1303 HydrophobicContact CD1-CD1 3.86Å; L1291-F1303 HydrophobicContact CD1-CG 4.22Å; F1294-F1303 HydrophobicContact CE1-CZ 4.33Å; F1294-F1303 HydrophobicContact CE2-CE1 4.4Å; F1294-F1303 HydrophobicContact CE2-CE2 4.19Å; F1294-F1303 AromaticContact CE2-CZ 3.58Å; F1294-F1303 HydrophobicContact CE2-CZ 3.58Å; F1294-F1303 HydrophobicContact CZ-CE1 4.07Å; F1294-F1303 HydrophobicContact CZ-CE2 4.37Å; F1294-F1303 AromaticContact CZ-CZ 3.41Å; F1294-F1303 HydrophobicContact CZ-CZ 3.41Å; F1294-F1303 VanDerWaalsContact CZ-CZ 3.41Å; P1300-F1303 HydrophobicContact CB-CE2 4.01Å; P1300-F1303 HydrophobicContact CB-CZ 4.27Å; N1301-F1303 HydrophobicContact CB-CZ 4.41Å; N1301-F1303 WeakPolarHBondContact O-CD2 3.24Å; N1301-F1303 WeakPolarHBondContact O-CE2 3.47Å; N1301-F1303 PolarHBondContact O-N 3.49Å
1304	L	87.7	Confident	88.9	Confident	62 Å²	62	48.2 Å²	48.2	33%	0.325	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	125.4	168.4	-178.4	67.7	0	0	0	107.1	T1257 L1259 I1332	T1257-L1304 HydrophobicContact CG2-CD1 3.65Å; T1257-L1304 HydrophobicContact CG2-CG 4.45Å; L1259-L1304 HydrophobicContact CD1-CD1 4.31Å; L1304-I1332 HydrophobicContact CD1-CD1 3.49Å; L1304-I1332 VanDerWaalsContact CD1-CD1 3.49Å; L1304-I1332 HydrophobicContact CD1-CG1 4.31Å
1305	S	86.9	Confident	89	Confident	3 Å²	3	47.2 Å²	47.2	2%	0.021	25%	0.247	C	C	.	.			trans	-71.4	138.8	174.6	176	0	0	0	0	111.5	T1257 V1258 D1282 S1307 G1308 Q1309	T1257-S1305 WeakPolarHBondContact OG1-CB 3.24Å; T1257-S1305 PolarHBondContact OG1-O 2.65Å; V1258-S1305 PolarHBondContact O-N 3.18Å; D1282-S1305 PolarHBondContact OD1-OG 3.07Å; S1305-S1307 PolarHBondContact OG-N 3.3Å; S1305-S1307 PolarHBondContact OG-OG 3.1Å; S1305-G1308 WeakPolarHBondContact OG-CA 3.28Å; S1305-G1308 PolarHBondContact OG-N 3.49Å; S1305-Q1309 WeakPolarHBondContact CB-O 3.42Å; S1305-Q1309 PolarHBondContact OG-N 3.43Å; S1305-Q1309 PolarHBondContact OG-O 2.9Å
1306	N	84	Confident	88.9	Confident	116 Å²	116	46.9 Å²	46.9	62%	0.62	25%	0.245	S	C	*	.	S	Bend	trans	-98.2	-22.5	171.6	-52.9	-91.6	0	0	0	111.2	D1282	D1282-N1306 PolarHBondContact OD1-N 3.34Å; D1282-N1306 VanDerWaalsContact OD1-N 3.12Å; D1282-N1306 VanDerWaalsContact OD2-CB 3.26Å; D1282-N1306 WeakPolarHBondContact OD2-CB 3.46Å; D1282-N1306 PolarHBondContact OD2-N 3.39Å; D1282-N1306 PolarHBondContact OD2-ND2 3.48Å
1307	S	84.9	Confident	88.9	Confident	59 Å²	59	48.4 Å²	48.4	41%	0.413	25%	0.253	S	S	.	.	S	Bend	trans	-85.1	-6.9	173.2	64.1	0	0	0	0	114.1	D1282 G1283 S1305 Q1309	D1282-S1307 VanDerWaalsContact OD1-CB 3.25Å; D1282-S1307 WeakPolarHBondContact OD1-CB 3.27Å; D1282-S1307 PolarHBondContact OD1-N 3.17Å; D1282-S1307 PolarHBondContact OD1-OG 2.9Å; G1283-S1307 WeakPolarHBondContact CA-OG 3.09Å; G1283-S1307 PolarHBondContact N-OG 3.41Å; S1305-S1307 PolarHBondContact OG-N 3.3Å; S1305-S1307 PolarHBondContact OG-OG 3.1Å; S1307-Q1309 VanDerWaalsContact C-N 3.26Å; S1307-Q1309 PolarHBondContact O-N 2.89Å; S1307-Q1309 PolarHBondContact OG-N 3.38Å; S1307-Q1309 PolarHBondContact OG-O 3.23Å; S1307-Q1309 VanDerWaalsContact OG-O 3.05Å
1308	G	85.3	Confident	88.8	Confident	2 Å²	2	46 Å²	46	2%	0.021	25%	0.252	C	S	.	.	S	Bend	trans	88.4	-26.2	-170	0	0	0	0	0	113.7	P1251 V1258 S1305 Y1334	P1251-G1308 WeakPolarHBondContact CD-O 3.39Å; V1258-G1308 WeakPolarHBondContact CG2-O 3.48Å; V1258-G1308 PolarHBondContact N-O 2.98Å; S1305-G1308 WeakPolarHBondContact OG-CA 3.28Å; S1305-G1308 PolarHBondContact OG-N 3.49Å; G1308-Y1334 WeakPolarHBondContact CA-OH 3.44Å; G1308-Y1334 PolarHBondContact N-OH 3.44Å
1309	Q	90.5	Very high	88.3	Confident	74 Å²	74	44.8 Å²	44.8	35%	0.346	25%	0.245	S	C	.	.			trans	-115.8	157.2	-175.2	-55.9	-176.7	2.8	0	0	112.5	I1249 T1250 G1283 G1284 S1305 S1307	I1249-Q1309 CarbonylContact O-C 3.54Å; I1249-Q1309 VanDerWaalsContact O-CA 3.31Å; I1249-Q1309 WeakPolarHBondContact O-CA 3.21Å; T1250-Q1309 HydrophobicContact CG2-CG 4.02Å; G1283-Q1309 PolarHBondContact N-O 2.66Å; G1283-Q1309 VanDerWaalsContact N-O 3.1Å; G1284-Q1309 VanDerWaalsContact CA-OE1 3.23Å; S1305-Q1309 WeakPolarHBondContact CB-O 3.42Å; S1305-Q1309 PolarHBondContact OG-N 3.43Å; S1305-Q1309 PolarHBondContact OG-O 2.9Å; S1307-Q1309 VanDerWaalsContact C-N 3.26Å; S1307-Q1309 PolarHBondContact O-N 2.89Å; S1307-Q1309 PolarHBondContact OG-N 3.38Å; S1307-Q1309 PolarHBondContact OG-O 3.23Å; S1307-Q1309 VanDerWaalsContact OG-O 3.05Å
1310	L	92.9	Very high	87.7	Confident	0 Å²	0	45 Å²	45	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	140.5	170.8	-65.4	176.8	0	0	0	110.8	T1248 I1249 V1258 L1260 F1281 G1283 L1291 L1312	T1248-L1310 CarbonylContact C-O 3.25Å; T1248-L1310 WeakPolarHBondContact CA-O 3.32Å; I1249-L1310 HydrophobicContact CB-CB 4.46Å; I1249-L1310 PolarHBondContact N-O 3.06Å; I1249-L1310 PolarHBondContact O-N 2.79Å; V1258-L1310 HydrophobicContact CB-CD1 4.35Å; V1258-L1310 HydrophobicContact CB-CG 4.4Å; V1258-L1310 HydrophobicContact CG1-CD1 3.81Å; V1258-L1310 HydrophobicContact CG1-CG 4.29Å; L1260-L1310 HydrophobicContact CB-CD1 3.57Å; L1260-L1310 HydrophobicContact CD2-CD1 3.92Å; L1260-L1310 HydrophobicContact CG-CD1 4.36Å; F1281-L1310 WeakPolarHBondContact O-CA 3.46Å; G1283-L1310 CarbonylContact O-C 3.49Å; G1283-L1310 WeakPolarHBondContact O-CA 3.48Å; L1291-L1310 HydrophobicContact CD1-CD2 3.95Å; L1310-L1312 HydrophobicContact CB-CD1 3.96Å
1311	Y	93.7	Very high	87.2	Confident	23 Å²	23	45.2 Å²	45.2	9%	0.09	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	123.7	172.2	177.1	-93.2	0	0	0	109.5	Y1246 W1247 F1281 G1283 P1286 Q1313	Y1246-Y1311 WeakPolarHBondContact CD1-OH 3.22Å; W1247-Y1311 CarbonylContact O-C 3.58Å; W1247-Y1311 WeakPolarHBondContact O-CA 3.41Å; F1281-Y1311 HydrophobicContact CB-CD1 4.43Å; F1281-Y1311 AromaticContact CD2-CD1 3.76Å; F1281-Y1311 HydrophobicContact CD2-CD1 3.76Å; F1281-Y1311 HydrophobicContact CD2-CE1 4.4Å; F1281-Y1311 HydrophobicContact CE2-CD1 4.27Å; F1281-Y1311 HydrophobicContact CE2-CE1 4.48Å; F1281-Y1311 HydrophobicContact CG-CD1 4.28Å; F1281-Y1311 PolarHBondContact N-O 2.83Å; F1281-Y1311 PolarHBondContact O-N 3.33Å; G1283-Y1311 WeakPolarHBondContact O-CB 3.44Å; G1283-Y1311 PolarHBondContact O-N 2.85Å; P1286-Y1311 HydrophobicContact CB-CD1 4.12Å; P1286-Y1311 HydrophobicContact CB-CE1 3.66Å; P1286-Y1311 HydrophobicContact CG-CE1 4.08Å; Y1311-Q1313 HydrophobicContact CE1-CB 4.09Å
1312	L	93.9	Very high	87.2	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	131.4	-178.6	-74.4	66.6	0	0	0	109.1	L1228 Y1246 W1247 I1249 L1260 L1278 R1279 V1280 L1310	L1228-L1312 HydrophobicContact CD2-CD2 3.76Å; Y1246-L1312 CarbonylContact C-O 3.14Å; Y1246-L1312 WeakPolarHBondContact CA-O 3.27Å; W1247-L1312 HydrophobicContact CB-CB 4.28Å; W1247-L1312 HydrophobicContact CE3-CB 3.86Å; W1247-L1312 PolarHBondContact N-O 3.19Å; W1247-L1312 PolarHBondContact O-N 3.1Å; I1249-L1312 HydrophobicContact CD1-CD1 3.83Å; I1249-L1312 HydrophobicContact CD1-CD2 4.44Å; I1249-L1312 HydrophobicContact CG1-CD1 4.21Å; L1260-L1312 HydrophobicContact CD2-CD1 4.12Å; L1260-L1312 HydrophobicContact CD2-CD2 4.06Å; L1260-L1312 HydrophobicContact CD2-CG 4.36Å; L1278-L1312 HydrophobicContact CD1-CB 4.24Å; R1279-L1312 WeakPolarHBondContact O-CA 3.49Å; V1280-L1312 HydrophobicContact CG1-CD1 4.32Å; V1280-L1312 HydrophobicContact CG1-CG 4.46Å; V1280-L1312 HydrophobicContact CG2-CG 4.43Å; L1310-L1312 HydrophobicContact CB-CD1 3.96Å
1313	Q	94.3	Very high	87.1	Confident	32 Å²	32	39.1 Å²	39.1	15%	0.15	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	107.5	176.5	166.7	176.8	92.3	0	0	108.7	Y1246 L1278 R1279 F1281 Y1311 V1315	Y1246-Q1313 HydrophobicContact CD1-CB 4.35Å; Y1246-Q1313 HydrophobicContact CD1-CG 4.25Å; Y1246-Q1313 HydrophobicContact CE1-CG 4.13Å; L1278-Q1313 CarbonylContact C-O 3.38Å; L1278-Q1313 WeakPolarHBondContact CA-O 3.05Å; R1279-Q1313 HydrophobicContact CB-CB 4.43Å; R1279-Q1313 PolarHBondContact N-O 3.32Å; R1279-Q1313 PolarHBondContact O-N 2.86Å; F1281-Q1313 HydrophobicContact CE2-CB 4.18Å; Y1311-Q1313 HydrophobicContact CE1-CB 4.09Å; Q1313-V1315 HydrophobicContact CG-CG2 3.98Å
1314	F	94.8	Very high	87.1	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	133.4	167.1	178.3	-118.3	0	0	0	109.4	Y1239 C1245 W1247 V1267 Y1277 L1278 F1325	Y1239-F1314 HydrophobicContact CD1-CE1 4.39Å; Y1239-F1314 AromaticContact CD1-CZ 3.91Å; Y1239-F1314 HydrophobicContact CD1-CZ 3.91Å; Y1239-F1314 HydrophobicContact CD2-CE1 4.01Å; Y1239-F1314 AromaticContact CD2-CZ 3.73Å; Y1239-F1314 HydrophobicContact CD2-CZ 3.73Å; Y1239-F1314 AromaticContact CE1-CZ 3.91Å; Y1239-F1314 HydrophobicContact CE1-CZ 3.91Å; Y1239-F1314 HydrophobicContact CE2-CE1 4.45Å; Y1239-F1314 AromaticContact CE2-CZ 3.74Å; Y1239-F1314 HydrophobicContact CE2-CZ 3.74Å; Y1239-F1314 AromaticContact CG-CE1 3.99Å; Y1239-F1314 HydrophobicContact CG-CE1 3.99Å; Y1239-F1314 AromaticContact CG-CZ 3.83Å; Y1239-F1314 HydrophobicContact CG-CZ 3.83Å; Y1239-F1314 AromaticContact CZ-CZ 3.83Å; C1245-F1314 HydrophobicContact CB-CB 4.17Å; C1245-F1314 HydrophobicContact CB-CD1 4.41Å; C1245-F1314 PolarHBondContact N-O 2.96Å; C1245-F1314 PolarHBondContact O-N 2.81Å; W1247-F1314 HydrophobicContact CH2-CB 4Å; W1247-F1314 HydrophobicContact CZ3-CB 3.64Å; V1267-F1314 HydrophobicContact CG1-CE2 4.08Å; V1267-F1314 HydrophobicContact CG2-CE2 3.95Å; Y1277-F1314 WeakPolarHBondContact O-CA 3.44Å; Y1277-F1314 WeakPolarHBondContact O-CD2 3.23Å; L1278-F1314 HydrophobicContact CB-CD2 4.28Å; L1278-F1314 HydrophobicContact CD1-CB 3.96Å; F1314-F1325 HydrophobicContact CB-CE1 3.99Å; F1314-F1325 HydrophobicContact CB-CZ 4.29Å; F1314-F1325 HydrophobicContact CD1-CE1 4.34Å; F1314-F1325 HydrophobicContact CD2-CD1 4.49Å; F1314-F1325 AromaticContact CD2-CE1 3.82Å; F1314-F1325 HydrophobicContact CD2-CE1 3.82Å; F1314-F1325 HydrophobicContact CE2-CE1 4.4Å; F1314-F1325 AromaticContact CG-CE1 3.8Å; F1314-F1325 HydrophobicContact CG-CE1 3.8Å
1315	V	93.8	Very high	87.3	Confident	19 Å²	19	35.2 Å²	35.2	12%	0.115	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	135.2	176.3	179.5	0	0	0	0	107.8	Q1243 Q1244 D1276 Y1277 Q1313	Q1243-V1315 WeakPolarHBondContact O-CA 3.42Å; Q1244-V1315 HydrophobicContact CG-CG1 4.42Å; D1276-V1315 WeakPolarHBondContact CA-O 3.43Å; Y1277-V1315 HydrophobicContact CD2-CB 4.41Å; Y1277-V1315 HydrophobicContact CE1-CB 4.14Å; Y1277-V1315 HydrophobicContact CE1-CG1 4.39Å; Y1277-V1315 HydrophobicContact CE2-CB 3.86Å; Y1277-V1315 HydrophobicContact CE2-CG2 3.78Å; Y1277-V1315 PolarHBondContact N-O 3.44Å; Y1277-V1315 PolarHBondContact O-N 2.76Å; Q1313-V1315 HydrophobicContact CG-CG2 3.98Å
1316	S	91.1	Very high	87.4	Confident	6 Å²	6	37.3 Å²	37.3	4%	0.042	20%	0.204	C	C	.	.			trans	-114.8	150.8	165.1	59	0	0	0	0	112.7	E1240 N1242 Q1243 D1276	E1240-S1316 PolarHBondContact O-OG 2.8Å; N1242-S1316 WeakPolarHBondContact CA-O 3.43Å; N1242-S1316 PolarHBondContact N-OG 2.72Å; Q1243-S1316 PolarHBondContact N-OG 3.37Å; Q1243-S1316 PolarHBondContact O-N 2.86Å; D1276-S1316 WeakPolarHBondContact OD1-CA 3.22Å; D1276-S1316 WeakPolarHBondContact OD1-CB 3.43Å
1317	D	88.4	Confident	87.7	Confident	34 Å²	34	31.8 Å²	31.8	18%	0.182	18%	0.175	C	C	.	.			trans	-79	-170.7	177.9	92.2	-36	0	0	0	111.9	S1241 N1242 D1276 T1319 I1320	S1241-D1317 CarbonylContact C-O 3.57Å; S1241-D1317 WeakPolarHBondContact CA-O 3.49Å; S1241-D1317 VanDerWaalsContact CB-O 3.29Å; S1241-D1317 WeakPolarHBondContact CB-O 3.25Å; N1242-D1317 PolarHBondContact N-O 2.8Å; D1276-D1317 PolarHBondContact OD1-N 3.43Å; D1317-T1319 VanDerWaalsContact C-N 3.28Å; D1317-T1319 VanDerWaalsContact CG-N 3.25Å; D1317-T1319 VanDerWaalsContact CG-OG1 3.28Å; D1317-T1319 PolarHBondContact O-N 3.46Å; D1317-T1319 VanDerWaalsContact OD1-CA 3.29Å; D1317-T1319 WeakPolarHBondContact OD1-CA 3.44Å; D1317-T1319 PolarHBondContact OD1-N 2.81Å; D1317-T1319 PolarHBondContact OD1-OG1 3.43Å; D1317-T1319 WeakPolarHBondContact OD2-CB 3.23Å; D1317-T1319 PolarHBondContact OD2-N 3.18Å; D1317-T1319 PolarHBondContact OD2-OG1 2.75Å; D1317-I1320 PolarHBondContact OD1-N 3.31Å
1318	D	83.8	Confident	88	Confident	119 Å²	119	32 Å²	32	64%	0.636	17%	0.17	S	C	*	.	S	Bend	trans	-84.7	9.8	175.5	71.3	-42.3	0	0	0	115.4	N1242	N1242-D1318 WeakPolarHBondContact ND2-CA 3.38Å; N1242-D1318 WeakPolarHBondContact ND2-CB 3.36Å
1319	T	75.9	Confident	88.3	Confident	79 Å²	79	32.2 Å²	32.2	49%	0.485	17%	0.17	S	C	.	.	S	Bend	trans	-124.6	-101.2	-173	77	0	0	0	0	115.7	D1317 G1321	D1317-T1319 VanDerWaalsContact C-N 3.28Å; D1317-T1319 VanDerWaalsContact CG-N 3.25Å; D1317-T1319 VanDerWaalsContact CG-OG1 3.28Å; D1317-T1319 PolarHBondContact O-N 3.46Å; D1317-T1319 VanDerWaalsContact OD1-CA 3.29Å; D1317-T1319 WeakPolarHBondContact OD1-CA 3.44Å; D1317-T1319 PolarHBondContact OD1-N 2.81Å; D1317-T1319 PolarHBondContact OD1-OG1 3.43Å; D1317-T1319 WeakPolarHBondContact OD2-CB 3.23Å; D1317-T1319 PolarHBondContact OD2-N 3.18Å; D1317-T1319 PolarHBondContact OD2-OG1 2.75Å; T1319-G1321 PolarHBondContact O-N 2.82Å
1320	I	73.1	Confident	88.4	Confident	102 Å²	102	31.5 Å²	31.5	52%	0.523	17%	0.167	S	C	.	.			trans	-93.1	87.3	-150.3	-53.8	-176	0	0	0	114.4	E1268 D1317 G1322	E1268-I1320 HydrophobicContact CG-CB 4.16Å; E1268-I1320 HydrophobicContact CG-CG2 4.39Å; D1317-I1320 PolarHBondContact OD1-N 3.31Å; I1320-G1322 PolarHBondContact O-N 2.8Å
1321	G	78	Confident	88.2	Confident	16 Å²	16	32.1 Å²	32.1	17%	0.165	17%	0.169	C	C	.	.			trans	-67.7	124.1	173.8	0	0	0	0	0	115.5	R995 T1319	R995-G1321 PolarHBondContact NH1-O 2.69Å; T1319-G1321 PolarHBondContact O-N 2.82Å
1322	G	84.3	Confident	87.8	Confident	8 Å²	8	31.2 Å²	31.2	8%	0.082	17%	0.166	C	C	.	.			trans	-97.4	-173	169.5	0	0	0	0	0	114.4	D1238 Y1239 I1320 G1324	D1238-G1322 VanDerWaalsContact CA-O 3.25Å; D1238-G1322 WeakPolarHBondContact CA-O 3.31Å; D1238-G1322 VanDerWaalsContact CB-O 3.24Å; D1238-G1322 WeakPolarHBondContact CB-O 3.26Å; Y1239-G1322 WeakPolarHBondContact CD1-O 3.31Å; Y1239-G1322 VanDerWaalsContact CE1-C 3.48Å; Y1239-G1322 VanDerWaalsContact CE1-N 3.34Å; Y1239-G1322 WeakPolarHBondContact CE1-O 3.36Å; Y1239-G1322 PolarHBondContact N-O 2.79Å; Y1239-G1322 PolarHBondContact OH-N 2.86Å; I1320-G1322 PolarHBondContact O-N 2.8Å; G1322-G1324 PolarHBondContact O-N 2.82Å
1323	K	84.2	Confident	87.3	Confident	47 Å²	47	33.5 Å²	33.5	20%	0.204	18%	0.181	C	C	.	.			trans	-68.9	-19.2	178.6	-77.3	-78	158.5	-173.5	0	113.8	H1231 F1234 G1235 D1236 L1237 D1238 Y1264 E1266	H1231-K1323 PolarHBondContact CE1-O 3.01Å; F1234-K1323 WeakPolarHBondContact CD2-O 3.17Å; F1234-K1323 VanDerWaalsContact CE2-O 3.28Å; F1234-K1323 WeakPolarHBondContact CE2-O 3.3Å; G1235-K1323 PolarHBondContact O-NZ 2.84Å; D1236-K1323 VanDerWaalsContact C-NZ 3.35Å; D1236-K1323 PolarHBondContact O-NZ 2.66Å; L1237-K1323 VanDerWaalsContact C-NZ 3.31Å; L1237-K1323 WeakPolarHBondContact O-CD 3.41Å; L1237-K1323 WeakPolarHBondContact O-CE 3.27Å; L1237-K1323 PolarHBondContact O-NZ 3.43Å; D1238-K1323 WeakPolarHBondContact OD1-CE 3.31Å; D1238-K1323 PolarHBondContact OD1-N 3.5Å; Y1264-K1323 HydrophobicContact CE1-CB 3.86Å; E1266-K1323 HydrophobicContact CB-CB 4.34Å; E1266-K1323 WeakPolarHBondContact OE2-CB 3.29Å; E1266-K1323 WeakPolarHBondContact OE2-CG 3.25Å
1324	G	88	Confident	86.4	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	82	-148.8	178.5	0	0	0	0	0	112.8	Y1239 Y1264 E1266 G1322	Y1239-G1324 VanDerWaalsContact CD1-CA 3.44Å; Y1264-G1324 WeakPolarHBondContact CD1-O 3.36Å; E1266-G1324 PolarHBondContact N-O 3.47Å; E1266-G1324 VanDerWaalsContact O-CA 3.23Å; E1266-G1324 WeakPolarHBondContact O-CA 3.49Å; E1266-G1324 PolarHBondContact O-N 2.79Å; G1322-G1324 PolarHBondContact O-N 2.82Å
1325	F	91.3	Very high	85.2	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	152.7	-173.9	62.4	-97.4	0	0	0	113.5	L1228 S1230 W1247 F1262 Y1264 F1265 L1278 F1314	L1228-F1325 HydrophobicContact CD2-CE2 4.44Å; L1228-F1325 HydrophobicContact CG-CE2 4.49Å; S1230-F1325 PolarHBondContact N-O 2.76Å; S1230-F1325 PolarHBondContact OG-N 2.93Å; W1247-F1325 HydrophobicContact CH2-CE2 4.47Å; W1247-F1325 AromaticContact CH2-CZ 3.68Å; W1247-F1325 HydrophobicContact CH2-CZ 3.68Å; W1247-F1325 AromaticContact CZ3-CZ 3.78Å; W1247-F1325 HydrophobicContact CZ3-CZ 3.78Å; F1262-F1325 HydrophobicContact CD1-CB 4.36Å; F1262-F1325 HydrophobicContact CD1-CD2 4.49Å; F1262-F1325 HydrophobicContact CE1-CB 4.44Å; F1262-F1325 AromaticContact CE1-CD2 3.95Å; F1262-F1325 HydrophobicContact CE1-CD2 3.95Å; F1262-F1325 HydrophobicContact CE1-CG 4.26Å; Y1264-F1325 VanDerWaalsContact O-CA 3.26Å; Y1264-F1325 WeakPolarHBondContact O-CA 3.49Å; Y1264-F1325 WeakPolarHBondContact O-CB 3.19Å; F1265-F1325 HydrophobicContact CD2-CB 3.54Å; F1265-F1325 HydrophobicContact CD2-CG 4.28Å; F1265-F1325 HydrophobicContact CE2-CB 4.06Å; F1265-F1325 HydrophobicContact CE2-CD1 4.23Å; F1265-F1325 HydrophobicContact CE2-CG 4.35Å; F1265-F1325 HydrophobicContact CG-CB 4.35Å; L1278-F1325 HydrophobicContact CB-CE1 4.36Å; L1278-F1325 HydrophobicContact CD1-CE1 3.99Å; L1278-F1325 HydrophobicContact CD1-CZ 3.91Å; L1278-F1325 HydrophobicContact CD2-CD1 4.07Å; L1278-F1325 HydrophobicContact CD2-CD2 4.43Å; L1278-F1325 HydrophobicContact CD2-CE1 3.93Å; L1278-F1325 HydrophobicContact CD2-CE2 4.29Å; L1278-F1325 HydrophobicContact CD2-CG 4.33Å; L1278-F1325 HydrophobicContact CD2-CZ 4.04Å; L1278-F1325 HydrophobicContact CG-CE1 4.32Å; F1314-F1325 HydrophobicContact CB-CE1 3.99Å; F1314-F1325 HydrophobicContact CB-CZ 4.29Å; F1314-F1325 HydrophobicContact CD1-CE1 4.34Å; F1314-F1325 HydrophobicContact CD2-CD1 4.49Å; F1314-F1325 AromaticContact CD2-CE1 3.82Å; F1314-F1325 HydrophobicContact CD2-CE1 3.82Å; F1314-F1325 HydrophobicContact CE2-CE1 4.4Å; F1314-F1325 AromaticContact CG-CE1 3.8Å; F1314-F1325 HydrophobicContact CG-CE1 3.8Å
1326	Q	89.8	Confident	83.9	Confident	47 Å²	47	46.9 Å²	46.9	22%	0.22	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	124.6	166.7	-178.1	-177.7	15.8	0	0	107.7	T1227 Y1229 F1234 L1263 Y1264	T1227-Q1326 HydrophobicContact CG2-CG 3.68Å; Y1229-Q1326 HydrophobicContact CD1-CB 4.16Å; Y1229-Q1326 HydrophobicContact CD1-CG 3.87Å; Y1229-Q1326 HydrophobicContact CE1-CB 4.31Å; Y1229-Q1326 HydrophobicContact CE1-CG 3.62Å; F1234-Q1326 HydrophobicContact CE1-CB 3.84Å; F1234-Q1326 HydrophobicContact CZ-CB 3.78Å; L1263-Q1326 HydrophobicContact CB-CG 4.31Å; L1263-Q1326 HydrophobicContact CD1-CG 4.44Å; L1263-Q1326 PolarHBondContact N-O 3.17Å; Y1264-Q1326 PolarHBondContact N-O 2.78Å; Y1264-Q1326 VanDerWaalsContact N-O 3.16Å; Y1264-Q1326 PolarHBondContact O-N 2.9Å
1327	A	90.5	Very high	82.2	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	147.3	178.1	0	0	0	0	0	110.5	T1227 L1228 L1260 F1262	T1227-A1327 CarbonylContact C-O 3.54Å; T1227-A1327 WeakPolarHBondContact CA-O 3.41Å; L1228-A1327 PolarHBondContact N-O 2.84Å; L1228-A1327 PolarHBondContact O-N 3.41Å; L1260-A1327 HydrophobicContact CD1-CB 3.86Å; F1262-A1327 HydrophobicContact CD1-CB 3.81Å; F1262-A1327 HydrophobicContact CE1-CB 3.72Å; F1262-A1327 HydrophobicContact CG-CB 4.34Å; F1262-A1327 HydrophobicContact CZ-CB 4.17Å
1328	Q	90	Very high	80.5	Confident	65 Å²	65	57.3 Å²	57.3	30%	0.304	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	131.9	174.8	-166.1	175.9	30.6	0	0	109.1	A1225 Q1226 L1260 K1261 L1263	A1225-Q1328 HydrophobicContact CB-CG 3.87Å; A1225-Q1328 VanDerWaalsContact CB-NE2 3.34Å; Q1226-Q1328 CarbonylContact O-C 3.53Å; Q1226-Q1328 VanDerWaalsContact O-CA 3.26Å; Q1226-Q1328 WeakPolarHBondContact O-CA 3.25Å; Q1226-Q1328 VanDerWaalsContact O-CG 3.32Å; Q1226-Q1328 WeakPolarHBondContact O-CG 3.1Å; L1260-Q1328 CarbonylContact C-O 3.6Å; L1260-Q1328 WeakPolarHBondContact CA-O 3.25Å; K1261-Q1328 PolarHBondContact N-O 3.24Å; K1261-Q1328 PolarHBondContact O-N 3.1Å; L1263-Q1328 HydrophobicContact CD1-CB 4.03Å; L1263-Q1328 HydrophobicContact CG-CB 4.19Å
1329	Y	92.8	Very high	78.7	Confident	5 Å²	5	55.8 Å²	55.8	2%	0.02	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	142.7	-179.9	67.2	-85.8	0	0	0	111.2	L1219 A1221 A1225 Q1226 L1228 I1249 L1259	L1219-Y1329 HydrophobicContact CB-CE2 4.36Å; L1219-Y1329 HydrophobicContact CD1-CE1 3.97Å; A1221-Y1329 HydrophobicContact CB-CD2 3.79Å; A1221-Y1329 HydrophobicContact CB-CE2 4.23Å; A1225-Y1329 CarbonylContact C-O 3.55Å; A1225-Y1329 WeakPolarHBondContact CA-O 3.34Å; Q1226-Y1329 HydrophobicContact CB-CD1 4.34Å; Q1226-Y1329 HydrophobicContact CB-CD2 4.34Å; Q1226-Y1329 HydrophobicContact CB-CE1 3.75Å; Q1226-Y1329 HydrophobicContact CB-CE2 3.76Å; Q1226-Y1329 WeakPolarHBondContact CB-OH 3.35Å; Q1226-Y1329 HydrophobicContact CG-CE2 4.45Å; Q1226-Y1329 PolarHBondContact N-O 3.27Å; Q1226-Y1329 PolarHBondContact O-N 2.96Å; Q1226-Y1329 VanDerWaalsContact OE1-CE2 3.27Å; L1228-Y1329 HydrophobicContact CB-CD1 4.05Å; L1228-Y1329 HydrophobicContact CB-CE1 4.08Å; I1249-Y1329 HydrophobicContact CD1-CG 4.33Å; I1249-Y1329 HydrophobicContact CG2-CD2 3.69Å; I1249-Y1329 HydrophobicContact CG2-CE2 4.25Å; I1249-Y1329 HydrophobicContact CG2-CG 4.21Å; L1259-Y1329 CarbonylContact O-C 3.37Å; L1259-Y1329 VanDerWaalsContact O-CA 3.22Å; L1259-Y1329 WeakPolarHBondContact O-CA 3.3Å
1330	Q	91.2	Very high	76.8	Confident	60 Å²	60	61.3 Å²	61.3	28%	0.28	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	143.8	-174.1	-169.1	178.5	7.9	0	0	110.7	S1223 A1225 L1259 I1332	S1223-Q1330 PolarHBondContact O-NE2 2.89Å; A1225-Q1330 HydrophobicContact CB-CB 3.92Å; A1225-Q1330 HydrophobicContact CB-CG 3.99Å; L1259-Q1330 PolarHBondContact N-O 3.49Å; L1259-Q1330 PolarHBondContact O-N 3.38Å; Q1330-I1332 HydrophobicContact CG-CG2 4.49Å
1331	M	90.1	Very high	74.9	Confident	12 Å²	12	64.6 Å²	64.6	6%	0.059	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	128.5	170.4	180	-173.5	77.5	0	0	110.1	A1221 D1222 P1251 K1252 L1253 H1256 T1257	A1221-M1331 HydrophobicContact CB-CB 4.01Å; A1221-M1331 WeakPolarHBondContact O-CB 3.35Å; D1222-M1331 WeakPolarHBondContact O-CB 3.46Å; D1222-M1331 PolarHBondContact O-N 3.32Å; P1251-M1331 HydrophobicContact CB-CG 3.83Å; P1251-M1331 HydrophobicContact CB-SD 4.01Å; K1252-M1331 HydrophobicContact CB-SD 3.97Å; K1252-M1331 PolarHBondContact N-SD 2.76Å; K1252-M1331 VanDerWaalsContact N-SD 3.41Å; L1253-M1331 HydrophobicContact CB-CE 4.21Å; L1253-M1331 HydrophobicContact CB-SD 3.83Å; L1253-M1331 HydrophobicContact CD1-CE 3.81Å; L1253-M1331 HydrophobicContact CG-CE 3.94Å; L1253-M1331 HydrophobicContact CG-SD 4.11Å; L1253-M1331 PolarHBondContact N-SD 3.35Å; H1256-M1331 HydrophobicContact CB-CG 3.43Å; H1256-M1331 VanDerWaalsContact CB-CG 3.43Å; H1256-M1331 HydrophobicContact CB-SD 3.86Å; T1257-M1331 WeakPolarHBondContact O-CA 3.45Å
1332	I	85.6	Confident	72.7	Confident	5 Å²	5	71 Å²	71	3%	0.026	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	151.1	177.7	49.4	167.2	0	0	0	110.5	H1256 T1257 L1259 L1304 Q1330 F1336	H1256-I1332 WeakPolarHBondContact CA-O 3.49Å; H1256-I1332 WeakPolarHBondContact CB-O 3.39Å; T1257-I1332 HydrophobicContact CG2-CG1 4.11Å; T1257-I1332 PolarHBondContact N-O 2.79Å; T1257-I1332 PolarHBondContact O-N 3.34Å; L1259-I1332 HydrophobicContact CB-CD1 3.8Å; L1259-I1332 HydrophobicContact CB-CG1 4.14Å; L1259-I1332 HydrophobicContact CD1-CD1 4.09Å; L1259-I1332 HydrophobicContact CD2-CD1 4.43Å; L1259-I1332 HydrophobicContact CG-CD1 4.33Å; L1304-I1332 HydrophobicContact CD1-CD1 3.49Å; L1304-I1332 VanDerWaalsContact CD1-CD1 3.49Å; L1304-I1332 HydrophobicContact CD1-CG1 4.31Å; Q1330-I1332 HydrophobicContact CG-CG2 4.49Å; I1332-F1336 HydrophobicContact CB-CB 4Å; I1332-F1336 HydrophobicContact CB-CD1 4.2Å; I1332-F1336 HydrophobicContact CB-CD2 4.36Å; I1332-F1336 HydrophobicContact CB-CG 3.94Å; I1332-F1336 HydrophobicContact CD1-CB 4.09Å; I1332-F1336 HydrophobicContact CD1-CD1 3.43Å; I1332-F1336 VanDerWaalsContact CD1-CD1 3.43Å; I1332-F1336 HydrophobicContact CD1-CE1 4.1Å; I1332-F1336 HydrophobicContact CD1-CG 3.95Å; I1332-F1336 HydrophobicContact CG1-CB 4.43Å; I1332-F1336 HydrophobicContact CG1-CD1 4.39Å; I1332-F1336 HydrophobicContact CG2-CD1 4.28Å; I1332-F1336 HydrophobicContact CG2-CD2 4.33Å; I1332-F1336 HydrophobicContact CG2-CE1 4.43Å; I1332-F1336 HydrophobicContact CG2-CE2 4.48Å; I1332-F1336 HydrophobicContact CG2-CG 4.23Å
1333	P	82.1	Confident	70.1	Confident	48 Å²	48	76.1 Å²	76.1	31%	0.312	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.6	151.3	175.4	-26.1	35.7	0	0	0	112.9	D1335 F1336	P1333-D1335 WeakPolarHBondContact CB-OD1 3.21Å; P1333-D1335 PolarHBondContact O-N 3.26Å; P1333-F1336 WeakPolarHBondContact O-CB 3.5Å; P1333-F1336 PolarHBondContact O-N 2.92Å
1334	Y	76.5	Confident	67.4	Low	120 Å²	120	79.9 Å²	79.9	47%	0.471	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-25.2	176.6	-84.2	-73.2	0	0	0	113.8	N1255 H1256 T1257 G1308 F1336	N1255-Y1334 VanDerWaalsContact O-CD2 3.31Å; N1255-Y1334 WeakPolarHBondContact O-CD2 3.24Å; H1256-Y1334 VanDerWaalsContact O-CE2 3.23Å; H1256-Y1334 WeakPolarHBondContact O-CE2 3.3Å; T1257-Y1334 HydrophobicContact CG2-CD1 4.17Å; T1257-Y1334 HydrophobicContact CG2-CE1 4.41Å; G1308-Y1334 WeakPolarHBondContact CA-OH 3.44Å; G1308-Y1334 PolarHBondContact N-OH 3.44Å; Y1334-F1336 VanDerWaalsContact C-N 3.31Å
1335	D	68.7	Low	64.9	Low	129 Å²	129	85.2 Å²	85.2	69%	0.69	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.2	0.7	175.4	64.2	-56.2	0	0	0	113.7	P1333 K1337	P1333-D1335 WeakPolarHBondContact CB-OD1 3.21Å; P1333-D1335 PolarHBondContact O-N 3.26Å; D1335-K1337 PolarHBondContact O-N 3.49Å
1336	F	66.2	Low	61.9	Low	83 Å²	83	93.3 Å²	93.3	36%	0.364	46%	0.461	S	S	.	.			trans	-64.8	92.5	177.9	-171.9	-91.9	0	0	0	111.7	I1332 P1333 Y1334 L1338	I1332-F1336 HydrophobicContact CB-CB 4Å; I1332-F1336 HydrophobicContact CB-CD1 4.2Å; I1332-F1336 HydrophobicContact CB-CD2 4.36Å; I1332-F1336 HydrophobicContact CB-CG 3.94Å; I1332-F1336 HydrophobicContact CD1-CB 4.09Å; I1332-F1336 HydrophobicContact CD1-CD1 3.43Å; I1332-F1336 VanDerWaalsContact CD1-CD1 3.43Å; I1332-F1336 HydrophobicContact CD1-CE1 4.1Å; I1332-F1336 HydrophobicContact CD1-CG 3.95Å; I1332-F1336 HydrophobicContact CG1-CB 4.43Å; I1332-F1336 HydrophobicContact CG1-CD1 4.39Å; I1332-F1336 HydrophobicContact CG2-CD1 4.28Å; I1332-F1336 HydrophobicContact CG2-CD2 4.33Å; I1332-F1336 HydrophobicContact CG2-CE1 4.43Å; I1332-F1336 HydrophobicContact CG2-CE2 4.48Å; I1332-F1336 HydrophobicContact CG2-CG 4.23Å; P1333-F1336 WeakPolarHBondContact O-CB 3.5Å; P1333-F1336 PolarHBondContact O-N 2.92Å; Y1334-F1336 VanDerWaalsContact C-N 3.31Å; F1336-L1338 HydrophobicContact CE1-CD2 4.44Å; F1336-L1338 HydrophobicContact CE1-CG 4.47Å; F1336-L1338 PolarHBondContact O-N 2.84Å; F1336-L1338 VanDerWaalsContact O-N 3.13Å
1337	K	55.4	Low	59	Low	194 Å²	194	96.3 Å²	96.3	84%	0.843	48%	0.482	S	S	*	.			trans	-71.1	105	167.7	-70.7	165.5	-174.2	162.1	0	108.5	D1335	D1335-K1337 PolarHBondContact O-N 3.49Å
1338	L	53	Low	55.9	Low	64 Å²	64	104 Å²	104	34%	0.335	52%	0.523	S	S	.	.			trans	-38.2	127.7	165.3	-90.1	159	0	0	0	110.1	L1259 F1336 K1340	L1259-L1338 HydrophobicContact CD1-CD1 4.37Å; L1259-L1338 HydrophobicContact CD1-CD2 4.23Å; F1336-L1338 HydrophobicContact CE1-CD2 4.44Å; F1336-L1338 HydrophobicContact CE1-CG 4.47Å; F1336-L1338 PolarHBondContact O-N 2.84Å; F1336-L1338 VanDerWaalsContact O-N 3.13Å; L1338-K1340 PolarHBondContact O-N 3.3Å
1339	P	45.5	Very low	53.1	Low	87 Å²	87	106.5 Å²	106.5	57%	0.565	54%	0.542	S	S	*	.			trans	-53.7	124.6	-179.3	-28.1	35.3	0	0	0	110.9	H1341 E1342	P1339-H1341 PolarHBondContact O-N 3.07Å; P1339-E1342 PolarHBondContact O-N 3.01Å
1340	K	36.6	Very low	50.1	Low	196 Å²	196	113 Å²	113	85%	0.852	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.2	46.6	177.8	-69.9	-167.5	170.3	-168.6	0	112.4	L1338	L1338-K1340 PolarHBondContact O-N 3.3Å
1341	H	32.5	Very low	47.2	Very low	171 Å²	171	119.1 Å²	119.1	79%	0.792	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-147.6	12.7	179.6	-114.1	-67	0	0	0	113.6	P1339	P1339-H1341 PolarHBondContact O-N 3.07Å
1342	E	33.1	Very low	44.5	Very low	150 Å²	150	125.9 Å²	125.9	70%	0.701	64%	0.64	S	S	*	*	S	Bend	trans	-126.2	17.6	159.1	-148.1	-179.6	-131.4	0	0	111.8	K1261 P1339	K1261-E1342 IonicContact NZ-OE1 3.11Å; K1261-E1342 PolarHBondContact NZ-OE1 2.88Å; K1261-E1342 IonicContact NZ-OE2 3.94Å; K1261-E1342 PolarHBondContact NZ-OE2 3.37Å; P1339-E1342 PolarHBondContact O-N 3.01Å
1343	I	29.5	Very low	42.1	Very low	115 Å²	115	131 Å²	131	59%	0.59	67%	0.674	S	S	*	*	S	Bend	trans	-127.3	133.5	169.8	-57.8	176.1	0	0	0	106.6
1344	D	27.6	Very low	39.6	Very low	126 Å²	126	132.9 Å²	132.9	67%	0.674	69%	0.688	S	S	*	*			trans	55.7	78.9	-170.8	-76.4	11.5	0	0	0	116.6	Q1346	D1344-Q1346 VanDerWaalsContact C-C 3.47Å; D1344-Q1346 CarbonylContact C-O 3.6Å; D1344-Q1346 WeakPolarHBondContact CA-O 3.34Å; D1344-Q1346 VanDerWaalsContact CB-O 3.28Å; D1344-Q1346 WeakPolarHBondContact CB-O 3.38Å
1345	S	34	Very low	37.5	Very low	113 Å²	113	135.4 Å²	135.4	79%	0.79	70%	0.704	S	S	*	*			trans	-145.1	92.1	149.3	-76.4	0	0	0	0	110.2
1346	Q	28.3	Very low	35.7	Very low	170 Å²	170	135 Å²	135	79%	0.794	71%	0.711	S	S	*	*	S	Bend	cis	-17	113.8	-6.4	-41.8	176.2	33.3	0	0	114.7	D1344	D1344-Q1346 VanDerWaalsContact C-C 3.47Å; D1344-Q1346 CarbonylContact C-O 3.6Å; D1344-Q1346 WeakPolarHBondContact CA-O 3.34Å; D1344-Q1346 VanDerWaalsContact CB-O 3.28Å; D1344-Q1346 WeakPolarHBondContact CB-O 3.38Å
1347	V	29.8	Very low	33.9	Very low	109 Å²	109	136.5 Å²	136.5	66%	0.661	73%	0.732	S	S	*	*			cis	-152.7	150.6	43.7	169	0	0	0	0	110.9
1348	L	26.2	Very low	33.3	Very low	163 Å²	163	132.4 Å²	132.4	85%	0.853	73%	0.725	S	S	*	*			trans	-99.3	153	166.8	-169.3	77.9	0	0	0	109.8
1349	V	30	Very low	32.2	Very low	117 Å²	117	134.8 Å²	134.8	71%	0.709	75%	0.747	S	S	*	*			trans	100.6	120.1	-176.4	174.8	0	0	0	0	110.9
1350	N	30.3	Very low	31.5	Very low	141 Å²	141	135.5 Å²	135.5	75%	0.754	76%	0.755	S	S	*	*			cis	-154.7	167.2	10	-116.8	1.2	0	0	0	113
1351	Q	30.8	Very low	31.2	Very low	188 Å²	188	131 Å²	131	88%	0.879	75%	0.748	S	S	*	*			trans	-100.4	165.1	158.3	-79.3	-176.7	-26.9	0	0	111.5
1352	I	32.4	Very low	31	Very low	154 Å²	154	128.2 Å²	128.2	79%	0.79	75%	0.748	S	S	*	*			trans	-132.4	167.5	-168	-24.5	176.8	0	0	0	108.8
1353	P	36.5	Very low	30.8	Very low	112 Å²	112	126.2 Å²	126.2	73%	0.727	75%	0.75	S	S	*	*				-154.2	144.3	91.2	37.8	-18.4	0	0	0	118.3
1354	S	28	Very low	30.8	Very low	89 Å²	89	125.7 Å²	125.7	62%	0.622	76%	0.756	S	S	*	*			trans	58.6	158	144.9	72.8	0	0	0	0	121
1355	H	32.6	Very low	30.8	Very low	172 Å²	172	124.8 Å²	124.8	80%	0.796	76%	0.76	S	S	*	*			cis	-141.1	164.1	12.4	-94.4	-79.9	0	0	0	113.9
1356	S	31.3	Very low	30.5	Very low	121 Å²	121	125.2 Å²	125.2	85%	0.846	76%	0.763	S	S	*	*			trans	75.8	157.2	154.7	68.9	0	0	0	0	122.5
1357	S	29	Very low	30.5	Very low	114 Å²	114	122.1 Å²	122.1	80%	0.797	76%	0.76	S	S	*	*			trans	-145.5	-170.7	-164.6	-40.2	0	0	0	0	109.1
1358	P	42.5	Very low	30.3	Very low	108 Å²	108	122.6 Å²	122.6	70%	0.701	77%	0.769	S	S	*	*			cis	-138	-168.4	-6.3	42.7	-24.1	0	0	0	115.7
1359	S	30.3	Very low	30.4	Very low	114 Å²	114	120.7 Å²	120.7	80%	0.797	77%	0.766	S	S	*	*			trans	68.8	147.7	160.4	63.5	0	0	0	0	119.5
1360	S	30.8	Very low	30.3	Very low	103 Å²	103	120.7 Å²	120.7	72%	0.72	77%	0.771	S	S	*	*			cis	-162.1	162.5	-13	51.6	0	0	0	0	113.6
1361	S	29.3	Very low	30.2	Very low	102 Å²	102	118.2 Å²	118.2	71%	0.713	77%	0.765	S	S	*	*			trans	64.7	111.6	152.7	58.2	0	0	0	0	123.6
1362	S	28.1	Very low	29.9	Very low	112 Å²	112	115.1 Å²	115.1	78%	0.783	76%	0.759	S	S	*	*				98.6	136	124.9	78	0	0	0	0	123.8
1363	S	29.7	Very low	29.5	Very low	108 Å²	108	118.1 Å²	118.1	76%	0.755	76%	0.761	S	S	*	*			trans	85.6	119.8	154.3	72.8	0	0	0	0	122.8
1364	S	29.8	Very low	28.9	Very low	103 Å²	103	123.7 Å²	123.7	72%	0.72	77%	0.77	S	S	*	*			trans	63.5	96.5	144.7	49	0	0	0	0	123.5
1365	S	28	Very low	28.8	Very low	108 Å²	108	122.4 Å²	122.4	76%	0.755	77%	0.77	S	S	*	*				98.5	130.1	115.8	76.3	0	0	0	0	122
1366	S	27.1	Very low	28.4	Very low	122 Å²	122	122 Å²	122	85%	0.853	77%	0.766	S	S	*	*			trans	67.5	137.8	172.2	77	0	0	0	0	116.5
1367	S	27.4	Very low	28.2	Very low	105 Å²	105	124.5 Å²	124.5	73%	0.734	77%	0.77	S	S	*	*			cis	-149.3	166.8	5.4	54.2	0	0	0	0	111.9
1368	S	25.5	Very low	28	Very low	119 Å²	119	125.4 Å²	125.4	83%	0.832	76%	0.762	S	S	*	*			trans	76.3	153.6	-166.2	-38.7	0	0	0	0	112.6
1369	P	29.7	Very low	27.1	Very low	122 Å²	122	128.9 Å²	128.9	79%	0.792	77%	0.771	S	S	*	*			cis	-122.5	-164.1	15.2	44.3	-30.8	0	0	0	114.2
1370	S	27.7	Very low	26.8	Very low	118 Å²	118	131.3 Å²	131.3	83%	0.825	77%	0.774	S	S	*	*			trans	-55.5	134.5	170.1	-43.8	0	0	0	0	112.9
1371	S	26.7	Very low	26.5	Very low	88 Å²	88	133.7 Å²	133.7	62%	0.615	77%	0.774	S	S	*	*			trans	-129.4	139.9	160.1	103.7	0	0	0	0	107
1372	V	25.5	Very low	26.3	Very low	124 Å²	124	137.5 Å²	137.5	75%	0.752	78%	0.78	S	S	*	*			cis	60.4	94.5	43.9	-172.3	0	0	0	0	110.5
1373	Y	24.7	Very low	26.1	Very low	217 Å²	217	140.1 Å²	140.1	85%	0.851	77%	0.774	S	S	*	*			trans	-125.2	105.9	161.9	-117.6	-83.5	0	0	0	109.2
1374	Y	23.4	Very low	25.8	Very low	229 Å²	229	143 Å²	143	90%	0.898	78%	0.776	S	S	*	*			trans	-70.1	128.6	155.5	-103.9	-101.2	0	0	0	107.3
1375	G	25.2	Very low	25.8	Very low	62 Å²	62	142.6 Å²	142.6	64%	0.639	77%	0.77	S	S	*	*			trans	-144.3	39.9	-167.3	0	0	0	0	0	114.9	N1377	G1375-N1377 PolarHBondContact O-N 2.98Å
1376	K	25.9	Very low	25.7	Very low	164 Å²	164	145.5 Å²	145.5	71%	0.713	77%	0.77	S	S	*	*			trans	31.3	80.6	169.4	-74.4	-165.5	166.1	-144.6	0	116.9	E1378	K1376-E1378 WeakPolarHBondContact CD-OE1 3.46Å; K1376-E1378 VanDerWaalsContact CE-OE1 3.25Å; K1376-E1378 WeakPolarHBondContact CE-OE1 3.47Å; K1376-E1378 IonicContact NZ-OE1 3.49Å; K1376-E1378 PolarHBondContact NZ-OE1 3.47Å; K1376-E1378 IonicContact NZ-OE2 2.8Å; K1376-E1378 PolarHBondContact O-N 3.3Å
1377	N	26.3	Very low	25.6	Very low	172 Å²	172	146.9 Å²	146.9	92%	0.92	76%	0.762	S	S	*	*			trans	-84	88.4	146.8	-78.7	-6.8	0	0	0	108.3	G1375	G1375-N1377 PolarHBondContact O-N 2.98Å
1378	E	23.9	Very low	25.6	Very low	133 Å²	133	145.4 Å²	145.4	62%	0.621	76%	0.763	S	S	*	*			trans	-79.7	158.6	162.1	-76.2	169.5	-171.9	0	0	109.5	K1376	K1376-E1378 WeakPolarHBondContact CD-OE1 3.46Å; K1376-E1378 VanDerWaalsContact CE-OE1 3.25Å; K1376-E1378 WeakPolarHBondContact CE-OE1 3.47Å; K1376-E1378 IonicContact NZ-OE1 3.49Å; K1376-E1378 PolarHBondContact NZ-OE1 3.47Å; K1376-E1378 IonicContact NZ-OE2 2.8Å; K1376-E1378 PolarHBondContact O-N 3.3Å
1379	M	24.9	Very low	25.5	Very low	182 Å²	182	147.4 Å²	147.4	90%	0.897	77%	0.765	S	S	*	*			trans	71.1	56.8	173.8	-52.8	-56.5	-74.4	0	0	118.1
1380	L	23.9	Very low	25.3	Very low	164 Å²	164	151.7 Å²	151.7	86%	0.859	77%	0.765	S	S	*	*	S	Bend	trans	-146.4	67.4	142.2	-118.2	-175.2	0	0	0	113.5
1381	Q	24.2	Very low	25.2	Very low	154 Å²	154	156.9 Å²	156.9	72%	0.72	77%	0.768	S	S	*	*			trans	172.7	111.7	147.4	-101	170.4	71.1	0	0	112.2
1382	Q	25.7	Very low	25	Very low	182 Å²	182	159.1 Å²	159.1	85%	0.85	77%	0.773	S	S	*	*				-167.7	115.8	124.8	-105	164.8	13.6	0	0	112.3
1383	Y	23.8	Very low	24.8	Very low	167 Å²	167	162.3 Å²	162.3	66%	0.655	78%	0.777	S	S	*	*			trans	22	140.9	141.7	-57.3	-96.5	0	0	0	119.6
1384	Q	22.3	Very low	25.4	Very low	169 Å²	169	157.1 Å²	157.1	79%	0.79	77%	0.77	S	S	*	*			cis	-160	176.5	10.5	-105.3	-100.1	-47.8	0	0	110.6
1385	P	31	Very low	25.7	Very low	93 Å²	93	152.5 Å²	152.5	60%	0.604	77%	0.768	S	S	*	*			trans	-96.8	159.6	-152.9	38	-37.8	0	0	0	117
1386	F	26	Very low	25.6	Very low	170 Å²	170	153.3 Å²	153.3	75%	0.746	77%	0.769	S	S	*	*			trans	-146.3	157.8	163.8	-116.4	-98.5	0	0	0	112.6	K111	K111-F1386 HydrophobicContact CD-CE1 3.56Å; K111-F1386 HydrophobicContact CD-CZ 3.82Å; K111-F1386 HydrophobicContact CG-CE1 4.27Å
1387	H	24.6	Very low	25.6	Very low	151 Å²	151	158.1 Å²	158.1	70%	0.699	78%	0.782	S	S	*	*			trans	-71.6	164.6	-166	-66	-134.9	0	0	0	115.7
1388	G	25.8	Very low	25.6	Very low	73 Å²	73	153.5 Å²	153.5	75%	0.753	78%	0.776	S	S	*	*			trans	-155.1	-58	178	0	0	0	0	0	120.9
1389	N	25.2	Very low	25.6	Very low	162 Å²	162	154.2 Å²	154.2	87%	0.866	79%	0.789	S	S	*	*			trans	72.3	150.4	-176.2	-76.2	-24.8	0	0	0	120.6
1390	R	24.3	Very low	25.6	Very low	211 Å²	211	148 Å²	148	80%	0.796	77%	0.772	S	S	*	*			trans	64.9	105.4	159.3	-73.1	180	173.8	-170.7	-2.9	120.4
1391	Y	25.4	Very low	25.9	Very low	227 Å²	227	150.6 Å²	150.6	89%	0.89	77%	0.771	S	S	*	*				-147.5	154.5	91.9	-68.7	-73.6	0	0	0	106.4
1392	L	22.6	Very low	26	Very low	135 Å²	135	146.8 Å²	146.8	71%	0.707	75%	0.754	S	S	*	*			cis	81.3	90.7	32.1	-88.1	99.4	0	0	0	117.3
1393	F	21.8	Very low	25.9	Very low	191 Å²	191	143.7 Å²	143.7	84%	0.838	74%	0.735	S	S	*	*			trans	74.9	159.7	148	-75.8	-89.2	0	0	0	120.8
1394	P	36.4	Very low	25.9	Very low	109 Å²	109	144.6 Å²	144.6	71%	0.708	74%	0.738	S	S	*	*			trans	-99.8	-157.3	-165.1	46.2	-40.2	0	0	0	110.9
1395	P	31.2	Very low	26	Very low	132 Å²	132	140.8 Å²	140.8	86%	0.857	72%	0.719	S	S	*	*			cis	-126	-111.1	-1.1	38.1	-16	0	0	0	115.5
1396	A	23.4	Very low	25.7	Very low	79 Å²	79	138.9 Å²	138.9	65%	0.653	72%	0.716	S	S	*	*			trans	-124.2	153.7	-146.8	0	0	0	0	0	116.9
1397	W	25	Very low	25.7	Very low	264 Å²	264	136.4 Å²	136.4	100%	1	71%	0.711	S	S	*	*			trans	70.9	157.1	166.6	-66.2	12.9	0	0	0	117.5
1398	G	25.3	Very low	25.6	Very low	76 Å²	76	136.5 Å²	136.5	78%	0.784	71%	0.714	S	S	*	*			trans	118.8	73.4	166.8	0	0	0	0	0	117.1
1399	T	25.9	Very low	25.6	Very low	148 Å²	148	143.8 Å²	143.8	91%	0.908	72%	0.718	S	S	*	*			trans	-54.8	149.1	166.9	51	0	0	0	0	113.3
1400	G	24.6	Very low	25.5	Very low	52 Å²	52	140.4 Å²	140.4	54%	0.536	71%	0.707	S	S	.	*			trans	171.3	-6.2	163.8	0	0	0	0	0	123	N591	N591-G1400 PolarHBondContact ND2-O 3.18Å
1401	R	29.2	Very low	25.6	Very low	218 Å²	218	134.1 Å²	134.1	82%	0.823	70%	0.696	S	S	*	*			trans	-4.2	116.6	171.7	-178.3	-148.2	-155.3	154.9	11.1	117.5
1402	I	25.8	Very low	25.7	Very low	73 Å²	73	130.3 Å²	130.3	37%	0.374	69%	0.686	S	S	.	*			trans	-157.2	145.7	164.1	-96.3	131.5	0	0	0	107	N591 E592	N591-I1402 HydrophobicContact CB-CB 4.04Å; N591-I1402 HydrophobicContact CB-CD1 3.93Å; N591-I1402 HydrophobicContact CB-CG1 4.38Å; N591-I1402 HydrophobicContact CB-CG2 3.51Å; N591-I1402 WeakPolarHBondContact ND2-CD1 3.47Å; N591-I1402 WeakPolarHBondContact O-CG2 3.37Å; N591-I1402 VanDerWaalsContact OD1-CB 3.3Å; N591-I1402 WeakPolarHBondContact OD1-CB 3.28Å; N591-I1402 VanDerWaalsContact OD1-CG2 3.24Å; N591-I1402 WeakPolarHBondContact OD1-CG2 3.29Å; E592-I1402 VanDerWaalsContact C-CG2 3.47Å; E592-I1402 CarbonylContact O-C 3.5Å; E592-I1402 WeakPolarHBondContact O-CG2 3.49Å
1403	R	24.2	Very low	25.8	Very low	118 Å²	118	130.6 Å²	130.6	45%	0.445	69%	0.686	S	S	.	*			cis	-125.1	-118.9	-4.3	72.5	35.9	-156.1	-154.8	16.6	111.6	N591 E592 N593 M594	N591-R1403 PolarHBondContact O-NE 3.37Å; N591-R1403 PolarHBondContact O-NH2 3.08Å; E592-R1403 PolarHBondContact O-N 3.06Å; N593-R1403 VanDerWaalsContact C-CA 3.5Å; N593-R1403 CarbonylContact O-C 3.49Å; M594-R1403 HydrophobicContact CB-CB 3.61Å; M594-R1403 HydrophobicContact CB-CG 3.64Å; M594-R1403 HydrophobicContact CE-CB 4.26Å; M594-R1403 HydrophobicContact CG-CB 3.58Å; M594-R1403 HydrophobicContact CG-CG 4.15Å; M594-R1403 PolarHBondContact O-NH1 2.97Å; M594-R1403 HydrophobicContact SD-CB 3.87Å; M594-R1403 HydrophobicContact SD-CG 4.35Å
1404	Y	25.1	Very low	26.1	Very low	185 Å²	185	127 Å²	127	73%	0.725	68%	0.679	S	S	*	*			trans	-157.2	-64.3	179	-127.9	10.6	0	0	0	124.7	N593 M594	N593-Y1404 PolarHBondContact O-N 3.41Å; M594-Y1404 HydrophobicContact CE-CD2 3.7Å; M594-Y1404 HydrophobicContact CE-CG 3.94Å
1405	F	23.8	Very low	25.8	Very low	89 Å²	89	129.6 Å²	129.6	39%	0.39	68%	0.682	S	S	.	*			trans	-83.9	179.6	-161.9	-53.3	-71.4	0	0	0	114.6	Y595 P597	Y595-F1405 HydrophobicContact CD1-CB 3.64Å; Y595-F1405 AromaticContact CD1-CD2 3.88Å; Y595-F1405 HydrophobicContact CD1-CD2 3.88Å; Y595-F1405 HydrophobicContact CD1-CG 4.25Å; Y595-F1405 HydrophobicContact CD2-CB 3.99Å; Y595-F1405 VanDerWaalsContact CD2-O 3.28Å; Y595-F1405 WeakPolarHBondContact CD2-O 3.44Å; Y595-F1405 HydrophobicContact CE1-CB 3.84Å; Y595-F1405 HydrophobicContact CE2-CB 4.2Å; Y595-F1405 WeakPolarHBondContact CE2-O 3.44Å; Y595-F1405 HydrophobicContact CG-CB 3.71Å; Y595-F1405 HydrophobicContact CG-CD2 4Å; Y595-F1405 HydrophobicContact CG-CG 4.37Å; Y595-F1405 WeakPolarHBondContact O-CE2 3.38Å; P597-F1405 HydrophobicContact CB-CZ 4.29Å; P597-F1405 HydrophobicContact CG-CE2 4.35Å; P597-F1405 HydrophobicContact CG-CZ 4.09Å
1406	G	24.6	Very low	25.7	Very low	53 Å²	53	126.9 Å²	126.9	55%	0.546	66%	0.66	S	S	.	*			cis	-167.6	-174.1	-0.1	0	0	0	0	0	110.9
1407	D	25.5	Very low	25.9	Very low	118 Å²	118	132.8 Å²	132.8	63%	0.631	67%	0.667	S	S	*	*			cis	-156.8	178	3.3	-155.6	4.3	0	0	0	111.9
1408	M	23.2	Very low	26.1	Very low	154 Å²	154	127.4 Å²	127.4	76%	0.759	65%	0.653	S	S	*	*			trans	-34.4	142.8	-179.5	-57.1	168.1	-152.9	0	0	118.9
1409	R	25.5	Very low	26	Very low	225 Å²	225	128.5 Å²	128.5	85%	0.849	65%	0.649	S	S	*	*				-172	137.8	93.7	-93.9	-173.8	167.9	160.2	-4.1	110.9
1410	S	23.9	Very low	26.3	Very low	91 Å²	91	128 Å²	128	64%	0.636	65%	0.646	S	S	*	*				78.6	145.8	64.5	108.4	0	0	0	0	112.5
1411	S	25.1	Very low	26.3	Very low	79 Å²	79	136.7 Å²	136.7	55%	0.552	66%	0.662	S	S	*	*			cis	-171.1	178.4	-2.4	28	0	0	0	0	111.6
1412	E	26.8	Very low	26.6	Very low	148 Å²	148	130.9 Å²	130.9	69%	0.692	65%	0.653	S	S	*	*			trans	72.4	160.5	147.8	-75.7	148.2	150.2	0	0	118.5
1413	M	26.7	Very low	26.6	Very low	141 Å²	141	136.3 Å²	136.3	70%	0.695	67%	0.674	S	S	*	*			cis	-146.7	131.7	2.3	-121.7	147.7	-176.5	0	0	109.1
1414	T	27.4	Very low	26.7	Very low	115 Å²	115	137.2 Å²	137.2	71%	0.706	69%	0.688	S	S	*	*				68.1	169.3	97.1	72.9	0	0	0	0	116
1415	E	30.1	Very low	26.7	Very low	163 Å²	163	138.3 Å²	138.3	76%	0.762	69%	0.692	S	S	*	*			cis	-131.2	-157.6	3.3	-54	-174.5	111.9	0	0	110.3
1416	N	28	Very low	27.3	Very low	75 Å²	75	142 Å²	142	40%	0.401	71%	0.71	S	S	.	*			cis	-153.9	-164.9	-7.1	-147.4	-40	0	0	0	109.9	Q1418	N1416-Q1418 PolarHBondContact OD1-NE2 3.27Å
1417	Y	29.1	Very low	27.6	Very low	203 Å²	203	145.2 Å²	145.2	80%	0.796	72%	0.721	S	S	*	*			trans	67.9	97.7	171.9	-67.4	-75.2	0	0	0	116.1
1418	Q	27.7	Very low	27.7	Very low	152 Å²	152	143.6 Å²	143.6	71%	0.71	72%	0.719	S	S	*	*			cis	68.5	140.1	46.7	-52.3	-171.5	25.6	0	0	113.7	N1416	N1416-Q1418 PolarHBondContact OD1-NE2 3.27Å
1419	S	24.5	Very low	27.8	Very low	98 Å²	98	145.8 Å²	145.8	69%	0.685	72%	0.72	S	S	*	*			cis	-167	153.1	-8.9	165.4	0	0	0	0	109.1
1420	T	31.3	Very low	27.7	Very low	138 Å²	138	141.6 Å²	141.6	85%	0.847	71%	0.711	S	S	*	*			trans	171.3	156.8	134.1	32.3	0	0	0	0	114.2
1421	R	25.7	Very low	27.8	Very low	235 Å²	235	145.2 Å²	145.2	89%	0.887	72%	0.717	S	S	*	*			trans	-123.3	-173.8	166.7	-88.1	-173.3	176.7	-170.8	1	106.2
1422	P	33.8	Very low	27.9	Very low	96 Å²	96	146 Å²	146	62%	0.623	72%	0.718	S	S	*	*			cis	-152.7	-170.9	25	33.9	-5.7	0	0	0	118.3
1423	F	27.6	Very low	28	Very low	187 Å²	187	147.1 Å²	147.1	82%	0.82	72%	0.721	S	S	*	*			trans	60.2	138.5	168.1	-53.1	-67.9	0	0	0	118
1424	N	26.1	Very low	28.2	Very low	136 Å²	136	148.1 Å²	148.1	73%	0.727	72%	0.724	S	S	*	*			cis	89.9	143.1	15.5	-152.7	20.7	0	0	0	116.4
1425	Y	23.5	Very low	28.3	Very low	208 Å²	208	147.6 Å²	147.6	82%	0.816	73%	0.725	S	S	*	*			trans	83.8	119.9	-179.9	-82.3	-90.6	0	0	0	121.6
1426	H	37.3	Very low	27.9	Very low	166 Å²	166	145 Å²	145	77%	0.769	73%	0.725	S	S	*	*			trans	-63.3	163.2	147.9	-120.5	-118.5	0	0	0	109.8
1427	P	30.3	Very low	28	Very low	121 Å²	121	146.6 Å²	146.6	79%	0.786	74%	0.739	S	S	*	*				-149	-160.8	54.8	42.1	-20	0	0	0	116.6
1428	S	27.8	Very low	28.1	Very low	84 Å²	84	143.8 Å²	143.8	59%	0.587	74%	0.737	S	S	*	*			trans	-102.7	-152	-165.8	53.8	0	0	0	0	114.2
1429	Y	25.8	Very low	28.1	Very low	200 Å²	200	143.5 Å²	143.5	78%	0.784	74%	0.735	S	S	*	*			trans	82.4	138	-179.6	-68.5	-114.6	0	0	0	113.2
1430	Q	24.3	Very low	28.3	Very low	138 Å²	138	146.2 Å²	146.2	65%	0.645	74%	0.737	S	S	*	*			cis	-164.3	-178.3	-3.9	-132.7	-168.8	22.2	0	0	108.6
1431	H	24.8	Very low	28.2	Very low	166 Å²	166	144.8 Å²	144.8	77%	0.769	73%	0.729	S	S	*	*			cis	-163.1	-164.8	-0	-157.3	11.5	0	0	0	111
1432	V	27.1	Very low	28.2	Very low	95 Å²	95	142.4 Å²	142.4	58%	0.576	73%	0.733	S	S	*	*			trans	79.2	114.6	147.5	162.5	0	0	0	0	120.9
1433	K	30.3	Very low	28	Very low	173 Å²	173	142.2 Å²	142.2	75%	0.752	73%	0.732	S	S	*	*			trans	73.2	141.4	156.3	-71.4	165.6	-167.5	172.2	0	118.1
1434	Q	30.6	Very low	28	Very low	161 Å²	161	141 Å²	141	75%	0.752	73%	0.731	S	S	*	*			cis	-152.1	144.3	3.8	-138.4	150.4	-21.2	0	0	114.9
1435	S	29	Very low	27.9	Very low	104 Å²	104	141.1 Å²	141.1	73%	0.727	73%	0.73	S	S	*	*			trans	47.2	108.8	149.5	55.1	0	0	0	0	122.2
1436	S	21.9	Very low	28	Very low	109 Å²	109	140 Å²	140	76%	0.762	73%	0.726	S	S	*	*			trans	-53.9	165.1	136.4	54.5	0	0	0	0	112.4
1437	P	29.7	Very low	27.5	Very low	109 Å²	109	136.6 Å²	136.6	71%	0.708	72%	0.72	S	S	*	*			cis	-145.4	-155.3	35.3	35.7	-10.3	0	0	0	115.1
1438	I	30.1	Very low	27.3	Very low	144 Å²	144	137.4 Å²	137.4	74%	0.738	71%	0.714	S	S	*	*			trans	77	132	165	-60	159	0	0	0	114.8
1439	Q	29.4	Very low	27.1	Very low	146 Å²	146	139 Å²	139	68%	0.682	72%	0.715	S	S	*	*			cis	-162.9	173.2	-21.1	-116.5	172.7	0.4	0	0	107.9
1440	Q	28.3	Very low	27.1	Very low	154 Å²	154	136.1 Å²	136.1	72%	0.72	71%	0.714	S	S	*	*			trans	32.3	134.9	143.6	-60	169.3	9.1	0	0	120.6
1441	T	28.5	Very low	27.2	Very low	109 Å²	109	134.8 Å²	134.8	67%	0.669	71%	0.71	S	S	*	*			cis	-167.1	130.2	-7	28	0	0	0	0	106	P1443	T1441-P1443 VanDerWaalsContact O-CD 3.28Å; T1441-P1443 WeakPolarHBondContact O-CD 3.31Å
1442	N	26.9	Very low	27.1	Very low	184 Å²	184	136.8 Å²	136.8	98%	0.984	71%	0.712	S	S	*	*			trans	-113.9	77.5	-178.9	-84.8	-27.7	0	0	0	115.3
1443	P	29.9	Very low	27.2	Very low	93 Å²	93	138.7 Å²	138.7	60%	0.604	72%	0.715	S	S	*	*			trans	-114.9	151.5	159	38.8	-29.9	0	0	0	112.9	T1441	T1441-P1443 VanDerWaalsContact O-CD 3.28Å; T1441-P1443 WeakPolarHBondContact O-CD 3.31Å
1444	M	25.8	Very low	27.1	Very low	162 Å²	162	139.7 Å²	139.7	80%	0.798	71%	0.714	S	S	*	*			trans	61.3	124.9	145.1	-62.8	-75.5	-164.9	0	0	121.2
1445	I	25.7	Very low	27.2	Very low	137 Å²	137	142.2 Å²	142.2	70%	0.703	72%	0.717	S	S	*	*				70.3	132.2	129.7	-63	175.7	0	0	0	117.8
1446	Y	24.8	Very low	27.4	Very low	185 Å²	185	143.8 Å²	143.8	73%	0.725	72%	0.717	S	S	*	*			cis	-158.4	153.5	-3.3	-134.8	-130.3	0	0	0	110.3
1447	S	26.5	Very low	27.9	Very low	94 Å²	94	142.1 Å²	142.1	66%	0.657	72%	0.717	S	S	*	*			trans	43.8	139.4	145.1	73	0	0	0	0	124
1448	Q	25.5	Very low	28	Very low	139 Å²	139	147.9 Å²	147.9	65%	0.65	73%	0.725	S	S	*	*			trans	89.5	118.3	142.6	-86.9	-166.2	14.3	0	0	121.3
1449	N	25	Very low	27.8	Very low	116 Å²	116	148.4 Å²	148.4	62%	0.62	73%	0.728	S	S	*	*			trans	73.7	146.2	141.6	-57.6	-25.2	0	0	0	118.6
1450	N	24.8	Very low	28.1	Very low	141 Å²	141	146.7 Å²	146.7	75%	0.754	73%	0.73	S	S	*	*			trans	72.7	148.5	148.6	-68.4	-2.7	0	0	0	116.7
1451	I	25.9	Very low	28.2	Very low	110 Å²	110	145.5 Å²	145.5	56%	0.564	73%	0.733	S	S	*	*			cis	-156.2	168.7	-15.2	-119.1	167.1	0	0	0	107.5
1452	Y	24.3	Very low	28	Very low	207 Å²	207	147 Å²	147	81%	0.812	74%	0.737	S	S	*	*			trans	-32	159.2	158.7	-51	-111	0	0	0	114.3
1453	Q	29.1	Very low	28	Very low	136 Å²	136	148.3 Å²	148.3	64%	0.636	73%	0.728	S	S	*	*				170.2	161.8	125.2	-92.2	154.5	49.6	0	0	109.8
1454	R	28.4	Very low	27.9	Very low	194 Å²	194	149.4 Å²	149.4	73%	0.732	73%	0.729	S	S	*	*			cis	-150	147.2	8.5	-148.8	168.2	-88.8	-173	-1.1	107.5
1455	R	32.8	Very low	27.9	Very low	213 Å²	213	149.1 Å²	149.1	80%	0.804	73%	0.73	S	S	*	*				171.6	165.6	90.9	-97.4	-177.3	-150.5	-163.9	3.7	108.3
1456	D	32.3	Very low	28.1	Very low	138 Å²	138	147 Å²	147	74%	0.738	73%	0.728	S	S	*	*			cis	-145	174.5	10.6	-122.6	-36.7	0	0	0	112.7
1457	G	33	Very low	28.3	Very low	74 Å²	74	146.1 Å²	146.1	76%	0.763	73%	0.73	S	S	*	*			trans	83.4	136.2	163	0	0	0	0	0	117.1
1458	R	31.3	Very low	28.2	Very low	229 Å²	229	147.9 Å²	147.9	86%	0.864	73%	0.732	S	S	*	*			trans	-119.8	136.9	174.6	-76.8	177.4	171.5	171.1	-4.2	110.3
1459	L	26	Very low	28.3	Very low	156 Å²	156	147.2 Å²	147.2	82%	0.817	74%	0.739	S	S	*	*				34.1	154	127.6	-60.1	169.5	0	0	0	120.7
1460	P	34.4	Very low	28.2	Very low	110 Å²	110	152 Å²	152	71%	0.714	75%	0.749	S	S	*	*			cis	-136.6	179.3	-19.6	36.6	-18.3	0	0	0	113.7
1461	V	30.5	Very low	28.2	Very low	128 Å²	128	156.8 Å²	156.8	78%	0.776	76%	0.756	S	S	*	*				168	141.4	126.5	154.8	0	0	0	0	111.3
1462	N	26.2	Very low	28.1	Very low	141 Å²	141	160.1 Å²	160.1	75%	0.754	77%	0.767	S	S	*	*			trans	9.7	138.1	163.1	-71.9	-23.5	0	0	0	123.8
1463	R	25.6	Very low	28	Very low	211 Å²	211	153.9 Å²	153.9	80%	0.796	76%	0.758	S	S	*	*				97.5	117.4	129.1	-89.1	-170.2	157.9	170.4	0.1	122.1
1464	D	27.4	Very low	27.9	Very low	117 Å²	117	155.8 Å²	155.8	63%	0.626	76%	0.761	S	S	*	*				92.9	131.7	129.5	-61.5	-17.9	0	0	0	121.5
1465	N	27.5	Very low	27.9	Very low	155 Å²	155	152.2 Å²	152.2	83%	0.829	76%	0.761	S	S	*	*			trans	69.6	137.6	159.4	-65.9	-28.8	0	0	0	118.4
1466	S	28.7	Very low	27.5	Very low	93 Å²	93	152.7 Å²	152.7	65%	0.65	76%	0.764	S	S	*	*			cis	-160.2	173.5	-3.7	60.5	0	0	0	0	112.6
1467	Q	29.1	Very low	27.2	Very low	167 Å²	167	150.2 Å²	150.2	78%	0.78	76%	0.755	S	S	*	*			trans	66	111.2	164.5	-59	-172.9	13.9	0	0	116.3
1468	L	25.1	Very low	26.8	Very low	131 Å²	131	155.7 Å²	155.7	69%	0.686	76%	0.761	S	S	*	*				76	148.4	76.8	-72.1	173	0	0	0	113.2	W1470	L1468-W1470 VanDerWaalsContact CD2-CD1 3.45Å
1469	P	27.1	Very low	26.5	Very low	124 Å²	124	149.2 Å²	149.2	81%	0.805	76%	0.757	S	S	*	*			cis	-111.2	165.1	14.4	40.3	-32.7	0	0	0	115.9
1470	W	23.4	Very low	26.4	Very low	217 Å²	217	151.7 Å²	151.7	82%	0.822	76%	0.761	S	S	*	*			trans	-77.3	134.4	172.8	-69.8	82.3	0	0	0	111.9	L1468	L1468-W1470 VanDerWaalsContact CD2-CD1 3.45Å
1471	R	23.8	Very low	26.3	Very low	241 Å²	241	151.1 Å²	151.1	91%	0.909	76%	0.76	S	S	*	*			trans	-103.3	118.7	151.5	-98.3	-171.2	174	-173.4	-0.1	109.2
1472	F	23.7	Very low	26.2	Very low	180 Å²	180	150.8 Å²	150.8	79%	0.789	76%	0.76	S	S	*	*			trans	-135	130.8	142	-99.3	-73.5	0	0	0	109.1
1473	A	23.5	Very low	26.1	Very low	76 Å²	76	148.7 Å²	148.7	63%	0.628	76%	0.756	S	S	*	*			trans	-89.4	118.5	174.3	0	0	0	0	0	109.8
1474	Y	26.8	Very low	26.1	Very low	176 Å²	176	145.1 Å²	145.1	69%	0.69	76%	0.758	S	S	*	*			trans	-142.2	119	149.2	-75.4	-69.5	0	0	0	104.1	P1477	Y1474-P1477 HydrophobicContact CD1-CG 3.9Å; Y1474-P1477 HydrophobicContact CE1-CG 3.87Å
1475	T	28.6	Very low	26.2	Very low	120 Å²	120	146.7 Å²	146.7	74%	0.736	77%	0.765	S	S	*	*			cis	50.2	67.6	20.7	70.8	0	0	0	0	111.4	P1477	T1475-P1477 WeakPolarHBondContact O-CD 3.14Å
1476	Y	24.5	Very low	26.2	Very low	223 Å²	223	148.9 Å²	148.9	88%	0.875	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-56.9	123.1	-170.3	-99.8	-85	0	0	0	114.1
1477	P	24.4	Very low	26.1	Very low	85 Å²	85	151.4 Å²	151.4	55%	0.552	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-75.9	154.6	150	-0.8	21.3	0	0	0	109.3	Y1474 T1475	Y1474-P1477 HydrophobicContact CD1-CG 3.9Å; Y1474-P1477 HydrophobicContact CE1-CG 3.87Å; T1475-P1477 WeakPolarHBondContact O-CD 3.14Å
1478	Q	25	Very low	26	Very low	190 Å²	190	149.3 Å²	149.3	89%	0.888	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-80.6	164.1	-178.3	-72.1	-173.4	-15.2	0	0	115
1479	A	25.3	Very low	25.9	Very low	93 Å²	93	147.2 Å²	147.2	77%	0.769	76%	0.764	S	S	*	*			trans	76.3	129.4	161.2	0	0	0	0	0	117.2
1480	K	24.6	Very low	25.8	Very low	207 Å²	207	147.1 Å²	147.1	90%	0.9	76%	0.761	S	S	*	*				-153.4	168.5	64.7	-87.6	172.6	177.4	177.5	0	115.5
1481	S	31	Very low	25.9	Very low	99 Å²	99	143.5 Å²	143.5	69%	0.692	76%	0.758	S	S	*	*			trans	-91.7	171.6	-178.3	54.4	0	0	0	0	114.6
1482	P	28.6	Very low	26	Very low	121 Å²	121	138.3 Å²	138.3	79%	0.786	75%	0.748	S	S	*	*				-127.7	139.4	117.6	36.2	-29.3	0	0	0	111.5
1483	S	23.9	Very low	26.1	Very low	96 Å²	96	135.7 Å²	135.7	67%	0.671	74%	0.742	S	S	*	*			cis	83.6	106.1	31.1	81.6	0	0	0	0	116
1484	T	25.8	Very low	26.3	Very low	136 Å²	136	140.3 Å²	140.3	83%	0.834	75%	0.748	S	S	*	*			trans	-160.8	151.8	145.3	-52.2	0	0	0	0	108.4
1485	I	29	Very low	26.4	Very low	150 Å²	150	142.4 Å²	142.4	77%	0.769	75%	0.754	S	S	*	*			trans	69.7	123.3	178.1	-48.8	-174.2	0	0	0	114.2
1486	R	28	Very low	26.3	Very low	202 Å²	202	141.1 Å²	141.1	76%	0.762	75%	0.75	S	S	*	*			cis	-153.4	124.5	-13.4	-114.4	-178.2	177	-176.3	-0	107
1487	Q	27.2	Very low	26.3	Very low	145 Å²	145	137.9 Å²	137.9	68%	0.678	75%	0.748	S	S	*	*				94.5	140.5	104.6	-90.4	176.9	-34.2	0	0	116.4
1488	T	26.2	Very low	27	Very low	124 Å²	124	138.7 Å²	138.7	76%	0.761	75%	0.753	S	S	*	*			trans	37.4	116.1	151.6	55	0	0	0	0	119.9
1489	A	24.1	Very low	27.1	Very low	87 Å²	87	134 Å²	134	72%	0.719	74%	0.742	S	S	*	*				94.2	159.4	56.4	0	0	0	0	0	114.2
1490	T	25	Very low	27.2	Very low	121 Å²	121	139 Å²	139	74%	0.742	74%	0.742	S	S	*	*			trans	60.5	112.1	172.1	50.5	0	0	0	0	120.3
1491	N	25	Very low	27.2	Very low	142 Å²	142	133 Å²	133	76%	0.759	73%	0.726	S	S	*	*				71.8	147.3	125.6	-61.7	-3.1	0	0	0	123.4
1492	N	26.8	Very low	27	Very low	132 Å²	132	133.2 Å²	133.2	71%	0.706	72%	0.724	S	S	*	*			trans	83.9	99.3	145.2	-70.3	-3.6	0	0	0	122.9
1493	L	25	Very low	27	Very low	125 Å²	125	138.3 Å²	138.3	65%	0.654	73%	0.729	S	S	*	*				80.7	144.2	115.6	-69.3	168.2	0	0	0	121.6
1494	F	28.1	Very low	27.1	Very low	173 Å²	173	138.6 Å²	138.6	76%	0.759	73%	0.731	S	S	*	*			trans	67.8	140	157.9	-62.3	-47.9	0	0	0	118.6
1495	R	27.9	Very low	27.1	Very low	219 Å²	219	137.5 Å²	137.5	83%	0.826	73%	0.729	S	S	*	*			cis	-155.6	173	-12.1	-149.6	172.3	174.4	173.3	-2.2	111.1
1496	S	26.9	Very low	27.1	Very low	93 Å²	93	141.7 Å²	141.7	65%	0.65	74%	0.735	S	S	*	*			trans	-29.7	143.4	174.5	50.2	0	0	0	0	118.7
1497	N	25	Very low	27.1	Very low	156 Å²	156	139.9 Å²	139.9	83%	0.834	74%	0.739	S	S	*	*				69.3	147.7	59.1	-102.6	5.3	0	0	0	115.7
1498	P	39.6	Very low	26.9	Very low	101 Å²	101	138.1 Å²	138.1	66%	0.656	74%	0.743	S	S	*	*				-146.4	-165.7	-124.2	41.9	-20	0	0	0	117.3
1499	S	26.5	Very low	26.9	Very low	92 Å²	92	140.5 Å²	140.5	64%	0.643	74%	0.743	S	S	*	*			trans	86.8	171.8	140.2	74.4	0	0	0	0	121.5
1500	Y	27.5	Very low	27	Very low	197 Å²	197	144.2 Å²	144.2	77%	0.773	75%	0.745	S	S	*	*			trans	79.5	143.4	-176.4	-64.6	-94	0	0	0	117.5
1501	S	25.1	Very low	27.3	Very low	81 Å²	81	145.1 Å²	145.1	57%	0.566	75%	0.751	S	S	*	*			cis	-171.6	147.4	-30.7	50.2	0	0	0	0	110.5
1502	T	25.9	Very low	27.4	Very low	105 Å²	105	142.4 Å²	142.4	64%	0.644	75%	0.748	S	S	*	*			trans	-81.8	145.8	170.9	50.7	0	0	0	0	113.3	R232	R232-T1502 PolarHBondContact NH1-O 2.7Å; R232-T1502 PolarHBondContact NH2-O 2.88Å; R232-T1502 VanDerWaalsContact NH2-O 3.1Å; R232-T1502 PolarHBondContact NH2-OG1 3.35Å
1503	Y	27.7	Very low	27.5	Very low	228 Å²	228	143.4 Å²	143.4	89%	0.894	75%	0.752	S	S	*	*			trans	-120.4	156.3	160.6	-122.3	-82.1	0	0	0	108.7
1504	S	26.9	Very low	27.6	Very low	102 Å²	102	146.3 Å²	146.3	71%	0.713	76%	0.762	S	S	*	*			trans	-122.7	132.3	177.7	-179.6	0	0	0	0	111.1
1505	S	24.9	Very low	27.4	Very low	113 Å²	113	143.2 Å²	143.2	79%	0.79	76%	0.762	S	S	*	*				171.7	132.2	128.2	43.1	0	0	0	0	111.9
1506	R	29.2	Very low	27.5	Very low	238 Å²	238	142.4 Å²	142.4	90%	0.898	76%	0.764	S	S	*	*			trans	-152.7	128	155.8	-72.1	-172.7	177.4	-179.4	-0.9	107.6
1507	L	29.3	Very low	27.4	Very low	163 Å²	163	143 Å²	143	85%	0.853	77%	0.769	S	S	*	*				-179.3	132.3	112.9	-121.7	82	0	0	0	111.3
1508	S	22.2	Very low	28	Very low	109 Å²	109	141.3 Å²	141.3	76%	0.762	77%	0.766	S	S	*	*			trans	-161.9	161.7	139.9	63	0	0	0	0	107.8
1509	K	27	Very low	27.3	Very low	173 Å²	173	143.7 Å²	143.7	75%	0.752	77%	0.772	S	S	*	*			trans	70.6	140.3	-158.8	-54.8	-177.3	178.3	-178.1	0	112.6
1510	Q	26.2	Very low	27.2	Very low	166 Å²	166	146.2 Å²	146.2	78%	0.776	77%	0.773	S	S	*	*			cis	-159.9	119.3	-1.4	-126.7	167.3	-38.2	0	0	112.1
1511	T	30.6	Very low	27.1	Very low	139 Å²	139	144.7 Å²	144.7	85%	0.853	77%	0.771	S	S	*	*			trans	177.6	123.7	149.7	26.2	0	0	0	0	105.6
1512	A	26.2	Very low	27	Very low	85 Å²	85	147.2 Å²	147.2	70%	0.702	78%	0.777	S	S	*	*			cis	61	88.9	48.7	0	0	0	0	0	110.7
1513	I	30.1	Very low	27	Very low	153 Å²	153	149.9 Å²	149.9	79%	0.785	78%	0.782	S	S	*	*				-161.3	146.3	72.7	-91.9	160.3	0	0	0	112.2
1514	Q	26.9	Very low	26.8	Very low	186 Å²	186	143.7 Å²	143.7	87%	0.869	77%	0.768	S	S	*	*			trans	38.5	118	161.1	-69.5	173.4	-5.1	0	0	121.3
1515	S	23.5	Very low	26.6	Very low	108 Å²	108	143.3 Å²	143.3	76%	0.755	76%	0.762	S	S	*	*			trans	-94.8	150.1	146.7	54.5	0	0	0	0	110.6
1516	K	29.5	Very low	26.7	Very low	202 Å²	202	140.2 Å²	140.2	88%	0.878	74%	0.738	S	S	*	*				-173.2	165.1	121.8	-104.1	175.6	-178.4	-175.3	0	114.3
1517	S	25.1	Very low	26.6	Very low	106 Å²	106	133.1 Å²	133.1	74%	0.741	72%	0.715	S	S	*	*			trans	-68.3	162.8	-173	44.6	0	0	0	0	115.5
1518	P	38.3	Very low	27.1	Very low	120 Å²	120	127.4 Å²	127.4	78%	0.779	69%	0.688	S	S	*	*			trans	-93.3	173.1	-175.7	39.4	-37.9	0	0	0	113.8
1519	I	25.5	Very low	27.2	Very low	151 Å²	151	129 Å²	129	77%	0.774	69%	0.688	S	S	*	*			trans	-163.8	141.9	137.2	-102.6	155.3	0	0	0	109.3
1520	E	24.1	Very low	27.4	Very low	146 Å²	146	125 Å²	125	68%	0.682	68%	0.682	S	S	*	*			trans	18.4	149.1	154.2	-48.4	178.8	133.9	0	0	121
1521	F	24.4	Very low	28	Very low	165 Å²	165	122.1 Å²	122.1	72%	0.724	68%	0.677	S	S	*	*			cis	-163.8	169.8	44.3	-114.1	-61.2	0	0	0	113.9
1522	L	24.8	Very low	28	Very low	133 Å²	133	122.9 Å²	122.9	70%	0.696	68%	0.675	S	S	*	*			trans	58.3	121.1	157.3	-98.3	69.4	0	0	0	119.2
1523	H	24.6	Very low	28	Very low	162 Å²	162	126.1 Å²	126.1	75%	0.75	68%	0.68	S	S	*	*				74.7	140.5	88.8	-88.6	-117.3	0	0	0	115.8
1524	T	24	Very low	27.8	Very low	97 Å²	97	123.2 Å²	123.2	60%	0.595	67%	0.673	S	S	*	*			cis	-159.7	144	-12.1	-0.9	0	0	0	0	111.4
1525	T	22.6	Very low	27.8	Very low	95 Å²	95	122.2 Å²	122.2	58%	0.583	67%	0.668	S	S	*	*			trans	23	115.9	151.3	53.8	0	0	0	0	122.3	H46	H46-T1525 PolarHBondContact CE1-O 2.8Å
1526	T	26.9	Very low	28.1	Very low	47 Å²	47	123.2 Å²	123.2	29%	0.288	67%	0.666	S	S	.	*				-178.5	173.1	127.4	47.2	0	0	0	0	112.3	F44 H46	F44-T1526 HydrophobicContact CB-CG2 3.98Å; F44-T1526 CarbonylContact O-C 3.56Å; F44-T1526 WeakPolarHBondContact O-CA 3.45Å; F44-T1526 WeakPolarHBondContact O-CB 3.05Å; F44-T1526 VanDerWaalsContact O-CG2 3.31Å; F44-T1526 WeakPolarHBondContact O-CG2 3.14Å; H46-T1526 HydrophobicContact CB-CG2 4.48Å; H46-T1526 PolarHBondContact CD2-OG1 3.3Å; H46-T1526 PolarHBondContact CE1-OG1 3.3Å; H46-T1526 PolarHBondContact NE2-OG1 2.54Å
1527	Q	26.4	Very low	28	Very low	89 Å²	89	119.1 Å²	119.1	42%	0.416	66%	0.657	S	S	.	*			trans	-150.3	-67.8	-164.3	-57.1	89.7	1.9	0	0	122.5	Y43 F44	Y43-Q1527 HydrophobicContact CD1-CB 3.56Å; Y43-Q1527 HydrophobicContact CD1-CG 3.9Å; Y43-Q1527 HydrophobicContact CD2-CB 3.91Å; Y43-Q1527 HydrophobicContact CD2-CG 3.47Å; Y43-Q1527 VanDerWaalsContact CD2-CG 3.47Å; Y43-Q1527 HydrophobicContact CE1-CB 4.13Å; Y43-Q1527 HydrophobicContact CE1-CG 4.09Å; Y43-Q1527 HydrophobicContact CE2-CB 4.45Å; Y43-Q1527 HydrophobicContact CE2-CG 3.72Å; Y43-Q1527 HydrophobicContact CG-CB 3.44Å; Y43-Q1527 VanDerWaalsContact CG-CB 3.44Å; Y43-Q1527 HydrophobicContact CG-CG 3.59Å; F44-Q1527 VanDerWaalsContact N-OE1 3.16Å; F44-Q1527 PolarHBondContact O-N 3.24Å
1528	P	39.9	Very low	28.2	Very low	43 Å²	43	121 Å²	121	28%	0.279	66%	0.658	S	S	.	*			trans	-111.2	-146.9	-137.6	49.9	-42.4	0	0	0	115.4	Y43 F44 I45	Y43-P1528 VanDerWaalsContact CB-CG 3.42Å; Y43-P1528 HydrophobicContact CD1-CB 4.03Å; Y43-P1528 HydrophobicContact CG-CB 4.32Å; F44-P1528 WeakPolarHBondContact O-CD 3.42Å; I45-P1528 WeakPolarHBondContact CD1-O 3.25Å
1529	D	24.4	Very low	27.8	Very low	144 Å²	144	122.4 Å²	122.4	77%	0.77	66%	0.659	S	S	*	*			cis	-127.2	-159.1	38.3	-143.4	-42.2	0	0	0	115
1530	S	32.5	Very low	27.9	Very low	88 Å²	88	120 Å²	120	62%	0.615	66%	0.655	S	S	*	*			trans	-152.9	170.3	179.9	-66	0	0	0	0	112.2
1531	P	37.8	Very low	28.1	Very low	106 Å²	106	124.6 Å²	124.6	69%	0.688	67%	0.666	S	S	*	*			cis	-140.4	-173.8	4	47.1	-30.6	0	0	0	116.4
1532	L	29.8	Very low	28.2	Very low	155 Å²	155	126.1 Å²	126.1	81%	0.812	67%	0.672	S	S	*	*			trans	64	163.3	157.5	-65.6	169.8	0	0	0	118.2
1533	L	26.6	Very low	28.6	Very low	152 Å²	152	125.5 Å²	125.5	80%	0.796	68%	0.676	S	S	*	*			cis	-138.2	-175	2.6	-158.5	115.8	0	0	0	110.4
1534	S	26.3	Very low	28.6	Very low	92 Å²	92	129.4 Å²	129.4	64%	0.643	69%	0.685	S	S	*	*			trans	-134.5	162	-171.3	61.4	0	0	0	0	115
1535	Q	28.1	Very low	29	Very low	165 Å²	165	132.2 Å²	132.2	77%	0.771	69%	0.694	S	S	*	*				165.5	165.2	123.5	-90.5	-171.5	13.6	0	0	115.3
1536	N	29.1	Very low	29	Very low	130 Å²	130	133.4 Å²	133.4	70%	0.695	71%	0.706	S	S	*	*			trans	82.3	136.1	157.5	-70	-42.3	0	0	0	121
1537	T	26.8	Very low	29	Very low	115 Å²	115	136 Å²	136	71%	0.706	73%	0.726	S	S	*	*			cis	-167.4	-179.2	-32	4.8	0	0	0	0	110.4
1538	I	30.2	Very low	28.9	Very low	147 Å²	147	138.4 Å²	138.4	75%	0.754	75%	0.747	S	S	*	*			trans	113.9	104.3	155.3	-58.4	175	0	0	0	117.7
1539	N	29	Very low	28.3	Very low	148 Å²	148	148 Å²	148	79%	0.791	78%	0.778	S	S	*	*			trans	35.8	149.3	130.8	-60.4	-23.9	0	0	0	123
1540	S	26.9	Very low	28.3	Very low	100 Å²	100	149.6 Å²	149.6	70%	0.699	78%	0.781	S	S	*	*			cis	-177.9	157.7	-10.7	56	0	0	0	0	112.2
1541	R	29.3	Very low	28	Very low	244 Å²	244	151.5 Å²	151.5	92%	0.921	79%	0.788	S	S	*	*			trans	157.2	145.3	153.6	-91.2	165.8	-169.8	-156.5	5.8	109.4
1542	K	27.4	Very low	27.4	Very low	196 Å²	196	157.6 Å²	157.6	85%	0.852	80%	0.798	S	S	*	*			cis	-167.8	140.9	-26.7	-148.1	179.4	-172.7	-179.3	0	108.6
1543	P	33.1	Very low	27.5	Very low	120 Å²	120	156.4 Å²	156.4	78%	0.779	80%	0.799	S	S	*	*			trans	-113	160	-173.3	39.9	-34.4	0	0	0	116.8
1544	R	24.6	Very low	27.6	Very low	245 Å²	245	152.7 Å²	152.7	93%	0.925	80%	0.798	S	S	*	*			trans	-176.3	159.1	155	-100.3	168.3	-172.3	-166.6	1.3	106.8
1545	I	31.5	Very low	27.7	Very low	155 Å²	155	159.8 Å²	159.8	80%	0.795	81%	0.81	S	S	*	*			cis	-143.4	153	39.2	-68	168.3	0	0	0	110.7
1546	S	22.3	Very low	27.6	Very low	120 Å²	120	158.1 Å²	158.1	84%	0.839	81%	0.811	S	S	*	*			trans	-135.2	163	144.5	73.6	0	0	0	0	109
1547	S	27.1	Very low	27.5	Very low	101 Å²	101	158.1 Å²	158.1	71%	0.706	82%	0.816	S	S	*	*			trans	-155.2	131.8	178.5	60.4	0	0	0	0	113.3
1548	T	24.6	Very low	27.6	Very low	140 Å²	140	161.1 Å²	161.1	86%	0.859	82%	0.821	S	S	*	*			trans	-138	146.2	165.5	37.9	0	0	0	0	110
1549	W	27.3	Very low	27.6	Very low	245 Å²	245	161.6 Å²	161.6	93%	0.928	82%	0.82	S	S	*	*			trans	-134.3	161.5	174.2	-82.6	90.8	0	0	0	109.8
1550	H	24.2	Very low	27.7	Very low	178 Å²	178	160.4 Å²	160.4	82%	0.824	82%	0.82	S	S	*	*			trans	-146.1	176	-174.1	-99.4	-2.4	0	0	0	111.4
1551	V	25.4	Very low	27.6	Very low	127 Å²	127	162.9 Å²	162.9	77%	0.77	82%	0.821	S	S	*	*			trans	82.4	126.3	-179.3	-174.5	0	0	0	0	112
1552	R	26.1	Very low	27.5	Very low	235 Å²	235	159.1 Å²	159.1	89%	0.887	82%	0.818	S	S	*	*			cis	-149.6	172.2	4.2	-117.2	161.5	-163	-172.7	6.6	111.3
1553	P	32.7	Very low	27.3	Very low	130 Å²	130	155.8 Å²	155.8	84%	0.844	81%	0.81	S	S	*	*			trans	-116.5	173.9	-163.9	42.6	-34.6	0	0	0	117.4
1554	G	27.1	Very low	27.2	Very low	74 Å²	74	158.1 Å²	158.1	76%	0.763	81%	0.814	S	S	*	*			trans	-163	138.3	166.8	0	0	0	0	0	115.7
1555	R	29.5	Very low	27.3	Very low	240 Å²	240	151.5 Å²	151.5	91%	0.906	80%	0.8	S	S	*	*			trans	13.6	121.4	169.3	-67.5	178	175.3	168.2	-1.8	119.8
1556	V	25.2	Very low	27	Very low	131 Å²	131	152.3 Å²	152.3	79%	0.794	81%	0.806	S	S	*	*				75.6	117.4	62.1	173.9	0	0	0	0	114.7
1557	V	28.1	Very low	27.3	Very low	130 Å²	130	157.4 Å²	157.4	79%	0.788	81%	0.807	S	S	*	*				-165	128.6	117.3	146.1	0	0	0	0	111.8
1558	H	28.3	Very low	27.3	Very low	178 Å²	178	159.8 Å²	159.8	82%	0.824	81%	0.81	S	S	*	*			trans	41.4	125.1	159.8	-76.1	-72.1	0	0	0	126.8
1559	Q	29.8	Very low	27.3	Very low	157 Å²	157	160 Å²	160	73%	0.734	81%	0.805	S	S	*	*			trans	-90.2	171.2	138.9	-58.8	175.9	-39.5	0	0	110.2
1560	P	31.2	Very low	27.4	Very low	122 Å²	122	157.2 Å²	157.2	79%	0.792	80%	0.802	S	S	*	*				-137.3	141.4	90.9	27.1	-8.4	0	0	0	113.4
1561	Q	25	Very low	27.7	Very low	152 Å²	152	153.8 Å²	153.8	71%	0.71	80%	0.796	S	S	*	*				61.7	124	75.6	-75.8	-156.9	-7.2	0	0	117.3
1562	L	27.4	Very low	27.9	Very low	165 Å²	165	155.4 Å²	155.4	86%	0.864	80%	0.8	S	S	*	*				-160.6	147	119.2	-110.8	167.5	0	0	0	112
1563	N	24	Very low	28.1	Very low	127 Å²	127	148.6 Å²	148.6	68%	0.679	79%	0.788	S	S	*	*			trans	-121.7	144.8	176	-71	-46	0	0	0	110	V1565	N1563-V1565 HydrophobicContact CB-CG2 4.09Å
1564	I	29.9	Very low	27.9	Very low	168 Å²	168	151.5 Å²	151.5	86%	0.862	79%	0.788	S	S	*	*			trans	-141.1	93.1	152.1	-55.5	-179.8	0	0	0	104.9
1565	V	27.5	Very low	27.9	Very low	106 Å²	106	156.1 Å²	156.1	64%	0.642	80%	0.795	S	S	*	*				64	110.9	67.2	-174.9	0	0	0	0	113.1	N1563	N1563-V1565 HydrophobicContact CB-CG2 4.09Å
1566	N	25.4	Very low	27.9	Very low	172 Å²	172	155.6 Å²	155.6	92%	0.92	80%	0.795	S	S	*	*			trans	-135.1	138.9	144.7	-115.7	-23.7	0	0	0	107.9
1567	R	27.1	Very low	28.2	Very low	228 Å²	228	157.8 Å²	157.8	86%	0.86	80%	0.797	S	S	*	*			trans	-140.2	118.5	-174.3	-120.6	-170.1	-174.1	-163.5	2.5	112.2
1568	I	27.2	Very low	28.1	Very low	150 Å²	150	156.9 Å²	156.9	77%	0.769	80%	0.796	S	S	*	*			trans	10.5	113.8	145.8	-54	173.8	0	0	0	116.8
1569	I	25.6	Very low	28.5	Very low	146 Å²	146	154 Å²	154	75%	0.749	79%	0.793	S	S	*	*				24.3	117.6	129.7	-37.7	172.9	0	0	0	117.5
1570	Q	28	Very low	29	Very low	185 Å²	185	151.7 Å²	151.7	86%	0.864	79%	0.792	S	S	*	*				-178.2	154.1	114.7	-97.1	-178.4	15.8	0	0	112.1
1571	P	31.7	Very low	29	Very low	107 Å²	107	157.9 Å²	157.9	70%	0.695	80%	0.799	S	S	*	*			trans	-92.7	153.8	-170.7	36.5	-35.8	0	0	0	114.8
1572	N	30.1	Very low	29.1	Very low	160 Å²	160	155.7 Å²	155.7	86%	0.856	80%	0.801	S	S	*	*			trans	37.3	131.8	142.9	-65.2	-13.5	0	0	0	121.3
1573	S	29.3	Very low	29.4	Very low	92 Å²	92	156.4 Å²	156.4	64%	0.643	80%	0.803	S	S	*	*			cis	-166.4	167.8	-4.7	68.6	0	0	0	0	112
1574	K	28.5	Very low	29.6	Very low	192 Å²	192	161.1 Å²	161.1	84%	0.835	81%	0.812	S	S	*	*			trans	59.4	116	161.1	-62.7	177.5	-177.9	178.7	0	118.2
1575	N	27.1	Very low	29.6	Very low	171 Å²	171	164.3 Å²	164.3	91%	0.914	81%	0.813	S	S	*	*			trans	-153.9	157.5	133.8	-114.7	-33.4	0	0	0	111.3
1576	Y	30.1	Very low	29.8	Very low	228 Å²	228	168.2 Å²	168.2	89%	0.894	82%	0.824	S	S	*	*			trans	-80.9	163.6	-177.5	-105.2	-107.1	0	0	0	113.2
1577	Q	30.6	Very low	29.9	Very low	178 Å²	178	164.6 Å²	164.6	83%	0.832	82%	0.818	S	S	*	*			trans	-74.9	162.4	172.1	-58.3	161.9	-19.8	0	0	109.9
1578	S	27.5	Very low	29.9	Very low	110 Å²	110	164 Å²	164	77%	0.769	82%	0.822	S	S	*	*			cis	-160.5	168.8	6.8	7.4	0	0	0	0	111.1
1579	P	35.5	Very low	30.3	Very low	119 Å²	119	161.8 Å²	161.8	77%	0.773	82%	0.82	S	S	*	*			trans	-106.4	-146.4	-178.8	45.9	-37.5	0	0	0	110.6
1580	P	40.9	Very low	30.7	Very low	108 Å²	108	163.5 Å²	163.5	70%	0.701	82%	0.824	S	S	*	*			cis	-135.7	174.7	-21.7	40.4	-24.6	0	0	0	115.2
1581	R	31.3	Very low	30.7	Very low	251 Å²	251	162.3 Å²	162.3	95%	0.947	82%	0.823	S	S	*	*				-175.3	175.5	126.1	-104.9	174.8	-176.6	-168.4	2.1	114.1
1582	S	26.8	Very low	30.8	Very low	107 Å²	107	167.4 Å²	167.4	75%	0.748	83%	0.83	S	S	*	*			trans	-143.6	149.8	-156.6	61.3	0	0	0	0	115.3
1583	I	32.8	Very low	30.8	Very low	179 Å²	179	167.4 Å²	167.4	92%	0.918	83%	0.825	S	S	*	*			trans	-130.1	155.1	155.3	-66.6	-175.2	0	0	0	109.3
1584	R	28.9	Very low	30.8	Very low	226 Å²	226	172 Å²	172	85%	0.853	84%	0.836	S	S	*	*			trans	-159.1	132.7	-165	171.7	-166.8	-175.2	-169.3	5.6	111.5
1585	R	29.3	Very low	30.8	Very low	236 Å²	236	171.5 Å²	171.5	89%	0.891	83%	0.834	S	S	*	*			trans	171.9	170.1	142.8	-98.7	160.3	-174.4	-156.4	1.7	114.1
1586	Q	32.1	Very low	30.9	Very low	187 Å²	187	171.4 Å²	171.4	87%	0.874	83%	0.828	S	S	*	*			trans	65.8	116.5	-179.1	-55.5	-176.9	1.3	0	0	114.1
1587	A	27	Very low	30.8	Very low	96 Å²	96	167.1 Å²	167.1	79%	0.793	83%	0.825	S	S	*	*			cis	78.3	89.3	-3.9	0	0	0	0	0	119.6
1588	K	28.6	Very low	30.5	Very low	215 Å²	215	166.4 Å²	166.4	94%	0.935	82%	0.822	S	S	*	*				-163.2	157.2	113.1	-111.7	-178.2	179.1	-175.2	0	112.5
1589	S	35.2	Very low	30.6	Very low	105 Å²	105	170.4 Å²	170.4	73%	0.734	83%	0.829	S	S	*	*			trans	-103.6	129	-179	50	0	0	0	0	112.5
1590	H	34.8	Very low	30.3	Very low	182 Å²	182	171.9 Å²	171.9	84%	0.843	83%	0.83	S	S	*	*			trans	-140.4	96.2	154.5	-98.7	-96.1	0	0	0	107.2
1591	L	26.4	Very low	30	Very low	159 Å²	159	171.1 Å²	171.1	83%	0.832	83%	0.825	S	S	*	*				79.1	48.1	84.1	-153	107.7	0	0	0	114
1592	Y	35.1	Very low	29.8	Very low	214 Å²	214	168.6 Å²	168.6	84%	0.839	82%	0.821	S	S	*	*			trans	-135.6	128.9	163.1	-107.5	-95.3	0	0	0	111.2
1593	Q	28.4	Very low	30.1	Very low	161 Å²	161	168.3 Å²	168.3	75%	0.752	82%	0.819	S	S	*	*			trans	39.3	100.6	159.6	-72.3	165.6	-28	0	0	121.6
1594	Q	30.2	Very low	30	Very low	189 Å²	189	165.5 Å²	165.5	88%	0.883	81%	0.812	S	S	*	*			trans	49.6	112.7	133.9	-72.4	174.6	-42.2	0	0	122.1
1595	K	29.1	Very low	29.9	Very low	180 Å²	180	162.7 Å²	162.7	78%	0.783	81%	0.811	S	S	*	*			trans	-71.2	145.2	137.4	-73.4	-170.6	172.2	-170.8	0	108.9
1596	Q	28.3	Very low	29.8	Very low	170 Å²	170	163.3 Å²	163.3	79%	0.794	81%	0.813	S	S	*	*				38.5	111.5	83.9	-57.1	174.6	-17.4	0	0	111.9
1597	T	28.5	Very low	29.4	Very low	137 Å²	137	164.3 Å²	164.3	84%	0.84	82%	0.815	S	S	*	*			cis	-148.1	122.3	29.2	45.9	0	0	0	0	112.8
1598	E	23.6	Very low	29.4	Very low	163 Å²	163	164.8 Å²	164.8	76%	0.762	80%	0.801	S	S	*	*			trans	-140.6	131.6	151.3	-143.3	174.7	-137.9	0	0	105.6	N1600	E1598-N1600 PolarHBondContact O-N 2.84Å
1599	Q	30.3	Very low	29.6	Very low	195 Å²	195	161.4 Å²	161.4	91%	0.911	80%	0.798	S	S	*	*			trans	-92.9	95.4	-177.8	-77.5	-176.3	-25.8	0	0	109.6
1600	N	29	Very low	29.4	Very low	149 Å²	149	162.1 Å²	162.1	80%	0.797	80%	0.797	S	S	*	*			trans	64.9	129.4	-166.5	-66.1	-39.9	0	0	0	112.8	E1598	E1598-N1600 PolarHBondContact O-N 2.84Å
1601	P	33.9	Very low	29	Very low	92 Å²	92	156.3 Å²	156.3	60%	0.597	78%	0.775	S	S	*	*				-131.8	172.5	79.7	38.6	-29.6	0	0	0	115.5
1602	K	27.5	Very low	29.2	Very low	199 Å²	199	153.5 Å²	153.5	87%	0.865	76%	0.758	S	S	*	*			trans	74.7	98.6	177.2	-56.9	-177.8	-178.7	178.1	0	116.8
1603	S	33.9	Very low	29	Very low	100 Å²	100	151.6 Å²	151.6	70%	0.699	75%	0.749	S	S	*	*			trans	-72	172.7	143	63	0	0	0	0	110.1
1604	P	30.5	Very low	29.3	Very low	120 Å²	120	148.6 Å²	148.6	78%	0.779	74%	0.738	S	S	*	*				-139.3	124.6	87.2	33.6	-17.7	0	0	0	115.2
1605	M	25.4	Very low	29.6	Very low	168 Å²	168	148.7 Å²	148.7	83%	0.828	73%	0.73	S	S	*	*			trans	40.9	103.4	142.8	-54.9	-175.7	-170.4	0	0	120
1606	R	28	Very low	30	Very low	248 Å²	248	145.6 Å²	145.6	94%	0.936	73%	0.732	S	S	*	*				-142.2	38	126.1	-142.6	175	-174	172.2	1.6	115.2	H1608	R1606-H1608 PolarHBondContact O-N 3.42Å
1607	F	24.3	Very low	30.3	Very low	209 Å²	209	143.5 Å²	143.5	92%	0.917	73%	0.733	S	S	*	*			trans	-72.7	106.8	152.8	-102	-81.5	0	0	0	108.2
1608	H	27.3	Very low	31.6	Very low	105 Å²	105	142.3 Å²	142.3	49%	0.486	73%	0.727	S	S	.	*			trans	-161	78	167.7	-114.1	-22.6	0	0	0	112.7	R1606 T1611 Q1612	R1606-H1608 PolarHBondContact O-N 3.42Å; H1608-T1611 HydrophobicContact CB-CG2 3.49Å; H1608-T1611 VanDerWaalsContact CB-CG2 3.49Å; H1608-T1611 PolarHBondContact ND1-N 2.78Å; H1608-Q1612 PolarHBondContact CD2-NE2 2.84Å; H1608-Q1612 WeakPolarHBondContact NE2-CG 3.28Å
1609	V	32.1	Very low	31.9	Very low	144 Å²	144	141.8 Å²	141.8	87%	0.873	73%	0.729	S	S	*	*	S	Bend	trans	-124.6	107.7	151.7	169.3	0	0	0	0	103.4
1610	V	30.4	Very low	31.9	Very low	120 Å²	120	141.3 Å²	141.3	73%	0.727	72%	0.724	S	S	*	*	S	Bend	cis	-133.3	104	-3.9	177.9	0	0	0	0	104.4
1611	T	26.7	Very low	31.9	Very low	61 Å²	61	139.8 Å²	139.8	37%	0.374	73%	0.725	S	S	.	*				49.8	125.4	95.7	58.9	0	0	0	0	113.8	H1608	H1608-T1611 HydrophobicContact CB-CG2 3.49Å; H1608-T1611 VanDerWaalsContact CB-CG2 3.49Å; H1608-T1611 PolarHBondContact ND1-N 2.78Å
1612	Q	30.2	Very low	31.7	Very low	100 Å²	100	139.5 Å²	139.5	47%	0.467	74%	0.738	S	S	.	*			cis	179.8	175.4	4.2	-128.6	167.5	9.9	0	0	111.9	H1608	H1608-Q1612 PolarHBondContact CD2-NE2 2.84Å; H1608-Q1612 WeakPolarHBondContact NE2-CG 3.28Å
1613	R	32.1	Very low	31.7	Very low	173 Å²	173	133.3 Å²	133.3	65%	0.653	73%	0.731	S	S	*	*			trans	72.4	160.8	141.6	-74	171.6	-164.3	-179.2	15.3	118.5
1614	D	34.4	Very low	31.3	Very low	98 Å²	98	134 Å²	134	52%	0.524	74%	0.736	S	S	.	*			cis	-144.3	140.9	-8.4	-113.2	-25	0	0	0	109
1615	R	35.4	Very low	31	Very low	191 Å²	191	136.4 Å²	136.4	72%	0.721	74%	0.737	S	S	*	*				62.8	161.4	83	-70.4	-171.4	-159.5	125	-21.8	116.6
1616	S	38.3	Very low	30.8	Very low	116 Å²	116	137.7 Å²	137.7	81%	0.811	73%	0.733	S	S	*	*			trans	-141.3	141.1	166.6	-43.5	0	0	0	0	109.9
1617	P	34.8	Very low	31	Very low	126 Å²	126	132.6 Å²	132.6	82%	0.818	72%	0.717	S	S	*	*				-122.6	170.3	124.7	-2.2	23.6	0	0	0	112.9
1618	P	55.1	Low	31.4	Very low	111 Å²	111	131.3 Å²	131.3	72%	0.721	71%	0.714	S	S	*	*			trans	-125.9	165.8	-156.7	39.7	-25.9	0	0	0	117
1619	L	29.7	Very low	31.7	Very low	153 Å²	153	137.3 Å²	137.3	80%	0.801	73%	0.733	S	S	*	*				173	157.5	117.1	-95.2	165.4	0	0	0	116.7
1620	F	30.2	Very low	31.9	Very low	185 Å²	185	135.1 Å²	135.1	81%	0.811	72%	0.724	S	S	*	*			trans	86.7	134.1	159.7	-87.7	-74	0	0	0	124.2
1621	S	30.5	Very low	31.9	Very low	117 Å²	117	138.3 Å²	138.3	82%	0.818	73%	0.733	S	S	*	*			trans	80	131.6	167.3	75.9	0	0	0	0	120.1
1622	G	29.7	Very low	32.5	Very low	85 Å²	85	140 Å²	140	88%	0.876	75%	0.745	S	S	*	*			trans	72.1	136.9	174.6	0	0	0	0	0	115.7
1623	G	26.9	Very low	32.4	Very low	69 Å²	69	142.2 Å²	142.2	71%	0.711	76%	0.759	S	S	*	*			cis	116.9	61.2	16.3	0	0	0	0	0	110.9
1624	S	24.6	Very low	32.4	Very low	115 Å²	115	138.1 Å²	138.1	80%	0.804	76%	0.757	S	S	*	*				91.1	125.9	86.8	67.3	0	0	0	0	116.1
1625	Q	24	Very low	32.4	Very low	170 Å²	170	144.2 Å²	144.2	79%	0.794	77%	0.773	S	S	*	*			trans	88.6	142.3	152.6	-136.6	-176.1	77	0	0	120
1626	W	23.1	Very low	32.1	Very low	196 Å²	196	139.5 Å²	139.5	74%	0.742	77%	0.769	S	S	*	*			trans	68.6	157.3	172.9	-63.7	80.9	0	0	0	119.8
1627	K	31.3	Very low	31.8	Very low	141 Å²	141	143.6 Å²	143.6	61%	0.613	77%	0.767	S	S	*	*			cis	-165.8	-170.4	-45.9	-142.7	-178.8	-93.1	176.7	0	109.8
1628	Q	33.3	Very low	31.5	Very low	182 Å²	182	146.5 Å²	146.5	85%	0.85	76%	0.762	S	S	*	*			trans	-64.3	173	174.9	-67.7	168.1	-38.8	0	0	114
1629	R	32.5	Very low	30.4	Very low	231 Å²	231	147.4 Å²	147.4	87%	0.872	76%	0.76	S	S	*	*			trans	68.9	130.6	-131.8	-67.6	-178.2	167.1	175.9	-4.4	110
1630	S	37.6	Very low	30.5	Very low	98 Å²	98	146.3 Å²	146.3	69%	0.685	76%	0.755	S	S	*	*			cis	85.2	122.6	28.8	83.5	0	0	0	0	114.4
1631	M	30.1	Very low	30.5	Very low	186 Å²	186	148 Å²	148	92%	0.916	76%	0.756	S	S	*	*			trans	65.4	163.4	178.1	-91.8	-163.1	178.4	0	0	115.7
1632	P	39.2	Very low	30.7	Very low	97 Å²	97	146.4 Å²	146.4	63%	0.63	75%	0.75	S	S	*	*			cis	-142.5	-173.3	-26.6	39.8	-22.2	0	0	0	114.9
1633	L	28	Very low	30.7	Very low	146 Å²	146	149.4 Å²	149.4	76%	0.764	74%	0.744	S	S	*	*			trans	64.5	118.8	154	-71.1	167.5	0	0	0	118.8
1634	S	32.9	Very low	30.7	Very low	88 Å²	88	155.6 Å²	155.6	62%	0.615	75%	0.752	S	S	*	*				83	149	82.3	102	0	0	0	0	113.4
1635	R	33.1	Very low	30.9	Very low	225 Å²	225	156.8 Å²	156.8	85%	0.849	75%	0.754	S	S	*	*			cis	-165.1	167.3	11.6	-113.2	151.9	175.5	-174.9	-2.2	105.4
1636	S	30	Very low	31.2	Very low	93 Å²	93	159.3 Å²	159.3	65%	0.65	76%	0.763	S	S	*	*			cis	-179.2	-179.1	-9	46.3	0	0	0	0	109.4
1637	R	30.5	Very low	31.6	Very low	201 Å²	201	157.5 Å²	157.5	76%	0.758	76%	0.764	S	S	*	*			trans	84.1	141.8	170.7	-58.8	-169.7	166.7	-179.2	-5.4	115.6
1638	W	30.2	Very low	31.6	Very low	188 Å²	188	158.4 Å²	158.4	71%	0.712	77%	0.772	S	S	*	*			cis	-148	140.3	-1.9	-111.3	-12.8	0	0	0	113.3
1639	D	30.9	Very low	31.5	Very low	129 Å²	129	157.1 Å²	157.1	69%	0.69	77%	0.768	S	S	*	*			trans	63	119.8	131.5	-56.2	-0.5	0	0	0	125.2
1640	D	31.1	Very low	31.5	Very low	130 Å²	130	152.7 Å²	152.7	70%	0.695	76%	0.762	S	S	*	*			trans	85.5	129.8	132.7	-129.6	34.3	0	0	0	124
1641	R	32.2	Very low	31.1	Very low	222 Å²	222	156.1 Å²	156.1	84%	0.838	77%	0.767	S	S	*	*			trans	66.6	130	162.6	-65.1	171.4	-159.2	-150	0.2	118.1
1642	A	33.5	Very low	31.1	Very low	83 Å²	83	154.1 Å²	154.1	69%	0.686	76%	0.757	S	S	*	*			cis	-164.5	156.4	10.1	0	0	0	0	0	114.9
1643	I	29.8	Very low	30.6	Very low	147 Å²	147	158.2 Å²	158.2	75%	0.754	77%	0.766	S	S	*	*			trans	69.9	122.4	149.1	-68.1	162.4	0	0	0	119.7
1644	K	27.4	Very low	30.8	Very low	199 Å²	199	159.2 Å²	159.2	87%	0.865	77%	0.766	S	S	*	*			trans	62.1	124.8	166.7	-68.5	165.9	-177.3	-178.8	0	115.2
1645	T	28.7	Very low	30.6	Very low	140 Å²	140	165.1 Å²	165.1	86%	0.859	78%	0.778	S	S	*	*			cis	-111.7	153.1	31.1	-9.7	0	0	0	0	116
1646	F	29.7	Very low	30.4	Very low	224 Å²	224	159.6 Å²	159.6	98%	0.982	77%	0.772	S	S	*	*			trans	-141.5	0	144.2	-143.4	-67.3	0	0	0	106.7

Retrieved 1,646 of 1,646 residues in 808.2 ms (Link to these results)

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