A0A5K4FAS2_SCHMA Loading...

Tr-type G domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4FAS2, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,103 aa.

						>A0A5K4FAS2_SCHMA|A0A5K4FAS2
MDELSMYFSTSNETSKSKLNEKSAKSFTRPTNFRNDPQQRKSFRGHIKKNKTMDNSSDNAHNPFLSLNRAPNSRICGSYSCGSISTKMPHILPPEIEEGNIEYKRKLVDPTPNRFEQLVTQMKWRLNEGGGKAIYKLGVDDDGHVSGLRPSELISSLTTLERMAKRLNSTLHPLRECVIEPTTISSDKECRKAIEVLVRLAPTTNDGSPDLCVALVGGMDSGKSTLISVLTDGELDNARGKARLNLFRHLHEVQSGRTSSLSRELLGFDINGHVTNYKYADGRVYRRSTEEIVRMSSNLLTLLDLAGHSKYQRTTLAGIACNQPIIGILVISATIGLSSIGLDHIQLIYSLNLPMIIVLTKIDQLSNGIEQIKRIQTIYRQLVYQFKQIQNAWSYGLPSSSPLTSRTNSVLNHCQLNSIRGDFNDDHFMPPFFPVSSVTGQGIDNLMHFLSRLSCLNQSPLPALSISSSSSSLTTDSRSPEQQQRQQSIEFNKFSNENHIQLMFSKIHEQMKIIKTYRDFNGTLFWINQVYTQIPGVSNPVIVGRVQLGQLLNNQILWLGPDQFGDFYPVQIVSLMHNRQVHDIVYAGQSASMEVYFLPKSWNSMNDKQRQNILHSISSSTSLSLTSSSYRTMNDHKKSFSLFGSNNNDNDDNVCNDDNDNCTGNEENIPQNNKKNVNSLSSPSDIYQFYSPIKLRRGMILLTYPMLSTTYSSFTTPSPGLLPCTIDSSPLSSSSSFEFIWNEQLKSKHYINFTVVWTVKLKLIRRLPIVSFKLGNPPVILTPIPSIGQRVSIYAGCVCQTGVVLERIYQCKHEEEIQQNNLKDYIMNNNENHLDDTTYILLRFARHPELIEIGRQFILTWNGNLKTIGYAVELIDPLKHQYNLSLNTPSINSNTTTTTTDDVQDPNDYSKTNTSIINPISWINPKQNSLSFQEKDDYDWSILRMSFINRTITMNSSYHCNNEAIVNDPFGSMDNLHSSSPSSNLLLSSSLPSSNMEYHTNLINNEQFKMSTTNSLIPINHLTSLSELVQGHDIDVDDNTNNDNNNHNHTNDVNNVKQSSQSSIVHQKSSISSSGGVTISTSSPSSSNKKNKNKRRHRRKQKR
					

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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	41.4	Very low	36.6	Very low	194 Å²	194	124.9 Å²	124.9	96%	0.956	65%	0.65	S	S	*	*				0	-47.2	0	-84.7	-60.5	-151.2	0	0	109.8	E3 L4 S5	M1-E3 PolarHBondContact O-N 3.23Å; M1-L4 WeakPolarHBondContact O-CB 3.46Å; M1-L4 PolarHBondContact O-N 3.11Å; M1-S5 PolarHBondContact O-N 3.37Å
2	D	36.3	Very low	36.3	Very low	130 Å²	130	127.2 Å²	127.2	70%	0.695	66%	0.664	S	S	*	*	H	α-helix	trans	-65.3	-32.6	-169.5	-43.7	-58.4	0	0	0	113.9	L4 S5	D2-L4 VanDerWaalsContact C-N 3.25Å; D2-L4 PolarHBondContact O-N 2.79Å; D2-S5 PolarHBondContact O-N 3.33Å; D2-S5 VanDerWaalsContact O-N 3.16Å; D2-S5 PolarHBondContact O-OG 3.16Å
3	E	35.3	Very low	35.7	Very low	172 Å²	172	130.6 Å²	130.6	80%	0.804	67%	0.674	S	S	*	*	H	α-helix	trans	-62.9	-26.9	172.6	-65.8	-177.8	148.6	0	0	113.9	M1	M1-E3 PolarHBondContact O-N 3.23Å
4	L	42	Very low	35.2	Very low	71 Å²	71	130.6 Å²	130.6	37%	0.372	68%	0.683	S	S	.	*	H	α-helix	trans	-79.8	-27.9	176.2	-74.5	166.9	0	0	0	112.1	M1 D2 M6 Y7 F8 L250	M1-L4 WeakPolarHBondContact O-CB 3.46Å; M1-L4 PolarHBondContact O-N 3.11Å; D2-L4 VanDerWaalsContact C-N 3.25Å; D2-L4 PolarHBondContact O-N 2.79Å; L4-M6 VanDerWaalsContact C-N 3.27Å; L4-M6 PolarHBondContact O-N 2.98Å; L4-Y7 PolarHBondContact O-N 3.41Å; L4-F8 HydrophobicContact CD2-CE2 4.49Å; L4-F8 WeakPolarHBondContact O-CD2 3.34Å; L4-F8 PolarHBondContact O-N 2.95Å; L4-L250 HydrophobicContact CD2-CD1 4.43Å
5	S	39.3	Very low	34.7	Very low	71 Å²	71	128.4 Å²	128.4	50%	0.497	68%	0.683	S	S	.	*	H	α-helix	trans	-62.3	-37.6	174.9	73.8	0	0	0	0	111.4	M1 D2 F8 S9	M1-S5 PolarHBondContact O-N 3.37Å; D2-S5 PolarHBondContact O-N 3.33Å; D2-S5 VanDerWaalsContact O-N 3.16Å; D2-S5 PolarHBondContact O-OG 3.16Å; S5-F8 PolarHBondContact O-N 3.31Å; S5-S9 WeakPolarHBondContact O-CB 3.09Å; S5-S9 PolarHBondContact O-N 2.79Å; S5-S9 VanDerWaalsContact O-N 3.15Å; S5-S9 PolarHBondContact O-OG 3.23Å
6	M	36	Very low	34.2	Very low	129 Å²	129	133.8 Å²	133.8	64%	0.635	70%	0.699	S	S	*	*	H	α-helix	trans	-65.7	-35.9	174.1	-69.3	-122.4	-69.6	0	0	113	L4 T10	L4-M6 VanDerWaalsContact C-N 3.27Å; L4-M6 PolarHBondContact O-N 2.98Å; M6-T10 WeakPolarHBondContact O-CB 3.3Å; M6-T10 WeakPolarHBondContact O-CG2 3.47Å; M6-T10 PolarHBondContact O-N 2.73Å; M6-T10 PolarHBondContact O-OG1 3.34Å
7	Y	34.5	Very low	33.9	Very low	191 Å²	191	132.1 Å²	132.1	75%	0.749	70%	0.701	S	S	*	*	H	α-helix	trans	-72.4	-26.6	178.8	-98.4	-84.5	0	0	0	114.2	L4	L4-Y7 PolarHBondContact O-N 3.41Å
8	F	37.7	Very low	33.6	Very low	156 Å²	156	135.3 Å²	135.3	68%	0.684	71%	0.708	S	S	*	*	H	α-helix	trans	-98.3	-6.6	178.5	-71.5	-70.7	0	0	0	114.5	L4 S5	L4-F8 HydrophobicContact CD2-CE2 4.49Å; L4-F8 WeakPolarHBondContact O-CD2 3.34Å; L4-F8 PolarHBondContact O-N 2.95Å; S5-F8 PolarHBondContact O-N 3.31Å
9	S	36.5	Very low	33.5	Very low	82 Å²	82	137.8 Å²	137.8	57%	0.573	72%	0.721	S	S	*	*	H	α-helix	trans	-103.2	-11.6	176.5	52.2	0	0	0	0	114.4	S5 S11	S5-S9 WeakPolarHBondContact O-CB 3.09Å; S5-S9 PolarHBondContact O-N 2.79Å; S5-S9 VanDerWaalsContact O-N 3.15Å; S5-S9 PolarHBondContact O-OG 3.23Å; S9-S11 PolarHBondContact O-N 3.43Å
10	T	31.9	Very low	33.3	Very low	70 Å²	70	138.4 Å²	138.4	43%	0.429	73%	0.725	S	S	.	*	G	3₁₀ helix	trans	-89.6	6.7	-172.3	41.9	0	0	0	0	115.6	M6 N12	M6-T10 WeakPolarHBondContact O-CB 3.3Å; M6-T10 WeakPolarHBondContact O-CG2 3.47Å; M6-T10 PolarHBondContact O-N 2.73Å; M6-T10 PolarHBondContact O-OG1 3.34Å; T10-N12 PolarHBondContact O-N 3.39Å; T10-N12 VanDerWaalsContact O-N 3.15Å
11	S	32.2	Very low	33.3	Very low	108 Å²	108	138.6 Å²	138.6	76%	0.755	72%	0.722	S	S	*	*	G	3₁₀ helix	trans	-72.1	0.9	178.1	44.4	0	0	0	0	115.2	S9	S9-S11 PolarHBondContact O-N 3.43Å
12	N	33.2	Very low	32.8	Very low	152 Å²	152	137.2 Å²	137.2	81%	0.813	71%	0.711	S	S	*	*	G	3₁₀ helix	trans	-123.6	-1.8	175.1	-99.3	-13.3	0	0	0	115.8	T10	T10-N12 PolarHBondContact O-N 3.39Å; T10-N12 VanDerWaalsContact O-N 3.15Å
13	E	28.3	Very low	32.6	Very low	172 Å²	172	136.5 Å²	136.5	80%	0.804	72%	0.716	S	S	*	*			trans	-133.2	76.1	-176.1	-69.9	-160.8	146.5	0	0	114.4
14	T	28.5	Very low	32.3	Very low	130 Å²	130	132.8 Å²	132.8	80%	0.798	72%	0.715	S	S	*	*			trans	-142.1	80	166.7	42.2	0	0	0	0	113.1
15	S	28.1	Very low	31.9	Very low	98 Å²	98	139.5 Å²	139.5	69%	0.685	74%	0.741	S	S	*	*			trans	-156.2	38.7	166.7	54.2	0	0	0	0	116.3
16	K	26.8	Very low	31.3	Very low	214 Å²	214	141.1 Å²	141.1	93%	0.93	75%	0.752	S	S	*	*			trans	-139.7	97.9	163.9	-76.4	-173	180	169.2	0	112.7
17	S	28.3	Very low	31	Very low	106 Å²	106	144.8 Å²	144.8	74%	0.741	77%	0.765	S	S	*	*			trans	-153.5	138.7	151.9	88.3	0	0	0	0	111.8
18	K	28.9	Very low	31	Very low	190 Å²	190	141.5 Å²	141.5	83%	0.826	77%	0.765	S	S	*	*			trans	67.5	89.4	162.1	-57.2	178.7	-178.1	179	0	118.2
19	L	31.7	Very low	30.4	Very low	182 Å²	182	144.7 Å²	144.7	95%	0.953	77%	0.773	S	S	*	*				-134.4	132.7	124.4	-104	164.2	0	0	0	108
20	N	29.8	Very low	30.1	Very low	150 Å²	150	147 Å²	147	80%	0.802	79%	0.786	S	S	*	*			trans	-94.5	168.7	-172.9	-97.3	-11.4	0	0	0	111.6
21	E	32	Very low	29.8	Very low	143 Å²	143	148.6 Å²	148.6	67%	0.668	80%	0.795	S	S	*	*			trans	92.6	97.6	156.2	-52.9	-133.3	116.5	0	0	120.2
22	K	32.5	Very low	29.7	Very low	165 Å²	165	150.2 Å²	150.2	72%	0.717	80%	0.795	S	S	*	*				76.8	142	120.9	-68.8	166.6	178.8	160	0	120.9
23	S	31.4	Very low	29.7	Very low	114 Å²	114	151 Å²	151	80%	0.797	79%	0.792	S	S	*	*			trans	58.9	107.1	174.6	55.6	0	0	0	0	115.8
24	A	29.3	Very low	29.8	Very low	95 Å²	95	153.3 Å²	153.3	79%	0.785	79%	0.793	S	S	*	*			cis	65	87.3	49	0	0	0	0	0	114.5
25	K	32.5	Very low	30	Very low	212 Å²	212	154.3 Å²	154.3	92%	0.922	79%	0.794	S	S	*	*				-170.7	142.1	123.7	-100.3	159.4	-174.1	179.3	0	111.4
26	S	27.2	Very low	30	Very low	104 Å²	104	157.5 Å²	157.5	73%	0.727	80%	0.803	S	S	*	*			trans	-63.8	145.8	171.1	41.9	0	0	0	0	112.1
27	F	30.7	Very low	30.3	Very low	207 Å²	207	152.1 Å²	152.1	91%	0.908	79%	0.79	S	S	*	*			trans	-158.3	151.5	136.6	-116.5	-77.3	0	0	0	111.7
28	T	33.8	Very low	30.5	Very low	121 Å²	121	155.6 Å²	155.6	74%	0.742	80%	0.795	S	S	*	*			trans	-86.1	162.7	-172.7	38.8	0	0	0	0	113.7
29	R	23.8	Very low	30.7	Very low	224 Å²	224	155.9 Å²	155.9	85%	0.845	80%	0.799	S	S	*	*			trans	-8.1	148.8	168.1	-72.7	-178.6	172.6	178.1	-1.9	118.3
30	P	30.5	Very low	30.5	Very low	131 Å²	131	159.1 Å²	159.1	85%	0.851	80%	0.798	S	S	*	*				-131.5	146.6	109.7	37.2	-30.5	0	0	0	114.8
31	T	26.9	Very low	30.7	Very low	103 Å²	103	161.5 Å²	161.5	63%	0.632	80%	0.802	S	S	*	*			trans	-90	135.1	159.2	45	0	0	0	0	109.4
32	N	29.9	Very low	30.6	Very low	141 Å²	141	159.7 Å²	159.7	75%	0.754	81%	0.805	S	S	*	*			trans	172.3	161.6	141.6	-90.8	-24.4	0	0	0	112.4
33	F	32.8	Very low	30.4	Very low	168 Å²	168	162.3 Å²	162.3	74%	0.737	82%	0.816	S	S	*	*			trans	70.3	134.6	171.6	-61.4	-79	0	0	0	117
34	R	31.5	Very low	30.3	Very low	221 Å²	221	166.4 Å²	166.4	83%	0.834	82%	0.815	S	S	*	*			cis	-157.7	152.8	-16.8	-143.3	179	-158.9	161.9	0.7	108.1
35	N	30.8	Very low	30.4	Very low	152 Å²	152	165.8 Å²	165.8	81%	0.813	82%	0.817	S	S	*	*			trans	-73.4	142	171.8	-65.9	-35.9	0	0	0	111.1
36	D	30	Very low	30.3	Very low	164 Å²	164	162.9 Å²	162.9	88%	0.877	81%	0.806	S	S	*	*			trans	-128.2	122.6	153.8	-106.6	-28.1	0	0	0	109.5
37	P	31.5	Very low	30.6	Very low	101 Å²	101	165.6 Å²	165.6	66%	0.656	81%	0.811	S	S	*	*			trans	-95	175.4	174.9	36.6	-32.3	0	0	0	112.3
38	Q	32.9	Very low	30.6	Very low	180 Å²	180	165.1 Å²	165.1	84%	0.841	81%	0.809	S	S	*	*			trans	80.7	82.8	169.1	-47.7	-176.7	13.9	0	0	118.4
39	Q	32.6	Very low	30.4	Very low	196 Å²	196	168.9 Å²	168.9	92%	0.916	82%	0.815	S	S	*	*				-134.4	79.7	127.5	-74.6	-154.8	21.7	0	0	111.2
40	R	28.6	Very low	30.7	Very low	249 Å²	249	166.4 Å²	166.4	94%	0.94	82%	0.818	S	S	*	*			trans	-92	113.9	153.7	-85.8	-176.6	171.7	178	-1.6	107.6
41	K	32.7	Very low	30.6	Very low	200 Å²	200	169.9 Å²	169.9	87%	0.87	82%	0.82	S	S	*	*			trans	-118.7	116.5	158.1	-82.4	-173.2	176.3	177.6	0	109.6
42	S	29.9	Very low	30.9	Very low	105 Å²	105	171.2 Å²	171.2	73%	0.734	83%	0.828	S	S	*	*			trans	-72	131.7	179.3	49.4	0	0	0	0	111.9
43	F	29	Very low	30.8	Very low	220 Å²	220	172.4 Å²	172.4	97%	0.965	83%	0.831	S	S	*	*			trans	-88.2	104.2	148.3	-104.9	-92.3	0	0	0	108.3
44	R	29.1	Very low	30.7	Very low	201 Å²	201	171.7 Å²	171.7	76%	0.758	84%	0.835	S	S	*	*			trans	-135.4	79	174.7	-155.5	-175.7	-157.2	-142.8	10.3	109.7	H46	R44-H46 PolarHBondContact O-N 3.36Å
45	G	31.3	Very low	30.5	Very low	81 Å²	81	168.8 Å²	168.8	84%	0.835	84%	0.836	S	S	*	*			trans	-79.6	109.4	173.2	0	0	0	0	0	111
46	H	30.7	Very low	30.5	Very low	151 Å²	151	166.8 Å²	166.8	70%	0.699	83%	0.834	S	S	*	*			trans	-82.3	116.7	168.9	-91.7	-92.5	0	0	0	110.2	R44	R44-H46 PolarHBondContact O-N 3.36Å
47	I	33.6	Very low	30.5	Very low	161 Å²	161	163.3 Å²	163.3	83%	0.826	82%	0.823	S	S	*	*			trans	-131.3	110	150.3	-61.5	-173.8	0	0	0	110.4
48	K	31.3	Very low	30.6	Very low	198 Å²	198	165.1 Å²	165.1	86%	0.861	83%	0.827	S	S	*	*			trans	24.4	128.5	151.6	-63.4	177.7	178.2	176.9	0	120.8
49	K	28.8	Very low	30.4	Very low	200 Å²	200	163.6 Å²	163.6	87%	0.87	83%	0.825	S	S	*	*			trans	-50.3	145.9	154.9	-58.4	168.2	177.5	174.9	0	111.4
50	N	30.7	Very low	30.4	Very low	172 Å²	172	158.9 Å²	158.9	92%	0.92	82%	0.819	S	S	*	*			trans	-150.1	148.3	130.8	-102.7	-10.7	0	0	0	110.6
51	K	28.7	Very low	30.5	Very low	203 Å²	203	155.2 Å²	155.2	88%	0.883	81%	0.812	S	S	*	*			trans	-104.1	128.6	179.6	-97.7	-177.4	168	-174.2	0	109.2
52	T	31.7	Very low	30.4	Very low	131 Å²	131	153.8 Å²	153.8	80%	0.804	81%	0.814	S	S	*	*			trans	-175.3	110.8	151.2	35.1	0	0	0	0	104.2
53	M	27.7	Very low	30.3	Very low	167 Å²	167	153.6 Å²	153.6	82%	0.823	81%	0.81	S	S	*	*				40.1	96.1	80.3	-61.7	-63.7	-76.5	0	0	111.5
54	D	32.1	Very low	30.1	Very low	153 Å²	153	150.5 Å²	150.5	82%	0.818	80%	0.797	S	S	*	*				-174.6	162.5	115.6	-85.6	-21.7	0	0	0	112
55	N	26.8	Very low	30.1	Very low	159 Å²	159	149.3 Å²	149.3	85%	0.85	80%	0.804	S	S	*	*			trans	-93.6	143.8	-170.8	-52.2	-74.1	0	0	0	112.3
56	S	31.5	Very low	29.8	Very low	110 Å²	110	150.5 Å²	150.5	77%	0.769	80%	0.8	S	S	*	*			trans	179	129.7	133.5	54.8	0	0	0	0	113.8
57	S	30.1	Very low	29.7	Very low	92 Å²	92	148.8 Å²	148.8	64%	0.643	80%	0.796	S	S	*	*			trans	14.6	124.9	146.7	54.4	0	0	0	0	121.7
58	D	32.4	Very low	29.5	Very low	138 Å²	138	147.4 Å²	147.4	74%	0.738	79%	0.79	S	S	*	*				169	112.5	107.7	-86.9	-34.8	0	0	0	110.4
59	N	29.8	Very low	29.3	Very low	149 Å²	149	150.1 Å²	150.1	80%	0.797	80%	0.795	S	S	*	*				78.7	94.5	80.1	-81.6	-39.9	0	0	0	115.4
60	A	32	Very low	29.3	Very low	96 Å²	96	145.2 Å²	145.2	79%	0.793	79%	0.791	S	S	*	*			trans	-170.7	106.2	139.6	0	0	0	0	0	113.1
61	H	29.9	Very low	29.3	Very low	172 Å²	172	142.4 Å²	142.4	80%	0.796	78%	0.782	S	S	*	*			trans	32.8	104.3	154.2	-60.2	-60.2	0	0	0	122.2
62	N	30.7	Very low	29.1	Very low	171 Å²	171	140.6 Å²	140.6	91%	0.914	78%	0.782	S	S	*	*			trans	-153.6	88.1	141.3	-98	-40.8	0	0	0	110.2
63	P	28.2	Very low	28.9	Very low	100 Å²	100	139.4 Å²	139.4	65%	0.649	78%	0.779	S	S	*	*			trans	-93.6	112.5	178.3	33.1	-26.9	0	0	0	110.9
64	F	26	Very low	28.8	Very low	155 Å²	155	143.3 Å²	143.3	68%	0.68	79%	0.785	S	S	*	*			trans	177.9	40.7	145.8	-92.5	-56.5	0	0	0	113.2
65	L	27.8	Very low	28.5	Very low	176 Å²	176	144.2 Å²	144.2	92%	0.921	79%	0.788	S	S	*	*	S	Bend	trans	-140.4	69.9	172.1	-81.9	-179.5	0	0	0	113.5
66	S	25.8	Very low	28.4	Very low	107 Å²	107	142.9 Å²	142.9	75%	0.748	79%	0.79	S	S	*	*			trans	174.5	127.1	145.7	55.4	0	0	0	0	111.2
67	L	28.7	Very low	28.1	Very low	115 Å²	115	140.7 Å²	140.7	60%	0.602	79%	0.785	S	S	*	*				-177.2	111.3	127.5	-119.6	82.7	0	0	0	112.3	R631	L67-R631 PolarHBondContact O-NH2 3.25Å
68	N	29.7	Very low	28	Very low	131 Å²	131	139.5 Å²	139.5	70%	0.701	78%	0.776	S	S	*	*			trans	60.7	101.9	143.6	-52.4	-10.1	0	0	0	118.2
69	R	25.8	Very low	27.9	Very low	256 Å²	256	141.3 Å²	141.3	97%	0.966	77%	0.774	S	S	*	*				54.2	90	73	-155.5	-178.2	-162.5	-175.1	5.4	114
70	A	29.2	Very low	27.8	Very low	96 Å²	96	138.1 Å²	138.1	79%	0.793	76%	0.764	S	S	*	*			trans	-144.7	145.4	156.6	0	0	0	0	0	109
71	P	29.8	Very low	27.6	Very low	114 Å²	114	138 Å²	138	74%	0.74	76%	0.756	S	S	*	*			trans	-101.1	156.6	-166.6	37.8	-35	0	0	0	115.6
72	N	25.3	Very low	27.4	Very low	164 Å²	164	132.8 Å²	132.8	88%	0.877	75%	0.748	S	S	*	*			trans	52.5	85.7	149.3	-62.1	-8.7	0	0	0	120.2
73	S	27.7	Very low	27.4	Very low	107 Å²	107	129.9 Å²	129.9	75%	0.748	74%	0.742	S	S	*	*			trans	-151.3	104	147.8	63.2	0	0	0	0	113.9	I75	S73-I75 PolarHBondContact O-N 3.39Å
74	R	25.4	Very low	28.2	Very low	249 Å²	249	127.7 Å²	127.7	94%	0.94	72%	0.724	S	S	*	*			trans	35.1	72.5	152.6	-57	-178	-174.7	176.6	2.2	118.2	C76	R74-C76 PolarHBondContact O-N 3.21Å
75	I	26.6	Very low	29.1	Very low	171 Å²	171	125.9 Å²	125.9	88%	0.877	73%	0.73	S	S	*	*			trans	-85.7	81.9	159.7	-56.1	178.3	0	0	0	108.7	S73	S73-I75 PolarHBondContact O-N 3.39Å
76	C	23.7	Very low	30.3	Very low	131 Å²	131	121.3 Å²	121.3	89%	0.885	71%	0.71	S	S	*	*			trans	-147.3	81	169.9	-172.1	0	0	0	0	108.9	R74	R74-C76 PolarHBondContact O-N 3.21Å
77	G	25.2	Very low	32	Very low	65 Å²	65	125 Å²	125	67%	0.67	71%	0.712	S	S	*	*			trans	179.7	136	-178.7	0	0	0	0	0	113.3
78	S	27.5	Very low	33.9	Very low	67 Å²	67	119.6 Å²	119.6	47%	0.469	68%	0.684	S	S	.	*			trans	78.6	39.1	174.7	86.6	0	0	0	0	119.3	S80 K637	S78-S80 PolarHBondContact O-N 3.12Å; S78-K637 PolarHBondContact O-NZ 3.19Å; S78-K637 WeakPolarHBondContact OG-CD 3.36Å; S78-K637 PolarHBondContact OG-NZ 3.31Å
79	Y	31.3	Very low	36	Very low	175 Å²	175	116.1 Å²	116.1	69%	0.686	67%	0.669	S	S	*	*				-69.8	65.2	128.3	-65.7	-65.3	0	0	0	108.7	C81	Y79-C81 PolarHBondContact O-N 3.37Å; Y79-C81 VanDerWaalsContact O-N 3.13Å
80	S	27.9	Very low	38.1	Very low	83 Å²	83	109.9 Å²	109.9	58%	0.58	65%	0.65	S	S	*	*			trans	-66.3	108.8	163	49.6	0	0	0	0	105.7	S78 G82	S78-S80 PolarHBondContact O-N 3.12Å; S80-G82 VanDerWaalsContact C-N 3.3Å; S80-G82 PolarHBondContact O-N 2.65Å
81	C	26.5	Very low	40.2	Very low	93 Å²	93	112.3 Å²	112.3	63%	0.628	65%	0.648	S	S	*	*			trans	-58.1	93.4	175.8	178.4	0	0	0	0	109.1	Y79 S83	Y79-C81 PolarHBondContact O-N 3.37Å; Y79-C81 VanDerWaalsContact O-N 3.13Å; C81-S83 PolarHBondContact O-N 3.14Å
82	G	27	Very low	42.6	Very low	62 Å²	62	107.6 Å²	107.6	64%	0.639	62%	0.617	S	S	*	*			trans	-60.1	122.1	162.6	0	0	0	0	0	106.6	S80 I84	S80-G82 VanDerWaalsContact C-N 3.3Å; S80-G82 PolarHBondContact O-N 2.65Å; G82-I84 PolarHBondContact O-N 3.41Å
83	S	31.3	Very low	45.4	Very low	111 Å²	111	104 Å²	104	78%	0.776	60%	0.602	S	S	*	*			trans	-38.1	98.8	-166.9	50.5	0	0	0	0	113.9	C81 S85	C81-S83 PolarHBondContact O-N 3.14Å; S83-S85 PolarHBondContact O-N 3.36Å
84	I	44.4	Very low	48.1	Very low	53 Å²	53	102.8 Å²	102.8	27%	0.272	59%	0.592	S	S	.	*			trans	-71.2	94.9	176	-64.3	174.7	0	0	0	107.1	G82 T86 E176	G82-I84 PolarHBondContact O-N 3.41Å; I84-T86 PolarHBondContact O-N 3.41Å; I84-T86 VanDerWaalsContact O-N 3.16Å; I84-E176 HydrophobicContact CD1-CB 4.12Å
85	S	45.1	Very low	51	Low	117 Å²	117	92.9 Å²	92.9	82%	0.818	56%	0.556	S	S	*	*			trans	-71.9	-7.8	-167.2	-167.4	0	0	0	0	114.8	S83	S83-S85 PolarHBondContact O-N 3.36Å
86	T	53.4	Low	53.8	Low	80 Å²	80	90.7 Å²	90.7	49%	0.491	55%	0.545	S	S	.	.	S	Bend	trans	-137.7	134.1	-179.4	52.2	0	0	0	0	112	I84 R175	I84-T86 PolarHBondContact O-N 3.41Å; I84-T86 VanDerWaalsContact O-N 3.16Å; T86-R175 WeakPolarHBondContact O-CG 3.48Å; T86-R175 WeakPolarHBondContact OG1-CD 3.42Å; T86-R175 WeakPolarHBondContact OG1-CG 3.28Å
87	K	60.6	Low	56.6	Low	184 Å²	184	92.6 Å²	92.6	80%	0.8	54%	0.541	S	S	*	.	B	Isolated β-bridge	trans	-76	142.5	174.2	-66.7	-173.9	176.4	-174	0	110.2
88	M	69	Low	59.2	Low	2 Å²	2	96.8 Å²	96.8	1%	0.01	54%	0.543	C	S	.	.	P	Polyproline II helix	trans	-74.1	135.9	168.9	-170.3	-174	84.7	0	0	109.2	L92 V139 V145 R175 E176 C177 A193 E195	M88-L92 HydrophobicContact CE-CD1 4.21Å; M88-L92 HydrophobicContact SD-CD1 4.39Å; M88-V139 HydrophobicContact CE-CG2 3.92Å; M88-V145 HydrophobicContact CE-CG1 3.63Å; M88-V145 HydrophobicContact CE-CG2 3.97Å; M88-R175 HydrophobicContact CB-CB 3.93Å; M88-E176 PolarHBondContact N-O 2.85Å; M88-E176 VanDerWaalsContact N-O 3.14Å; M88-C177 HydrophobicContact CB-CB 3.98Å; M88-C177 HydrophobicContact CE-CB 4.18Å; M88-A193 HydrophobicContact CE-CB 3.72Å; M88-E195 HydrophobicContact SD-CB 4.15Å
89	P	74.2	Confident	61.8	Low	58 Å²	58	94.9 Å²	94.9	38%	0.377	53%	0.534	S	S	.	.	P	Polyproline II helix	trans	-65.6	147.1	179.3	27.4	-36.1	0	0	0	112.2	I91 L92	P89-I91 VanDerWaalsContact C-N 3.26Å; P89-I91 PolarHBondContact O-N 3.43Å; P89-L92 HydrophobicContact CG-CD2 3.77Å
90	H	69.4	Low	64.4	Low	125 Å²	125	88.8 Å²	88.8	58%	0.579	51%	0.514	S	S	*	.	S	Bend	trans	-73.2	-13.6	-178.7	-66.8	-82.5	0	0	0	114.4	V145 C177	H90-V145 WeakPolarHBondContact O-CG2 3.49Å; H90-C177 PolarHBondContact CE1-SG 3.37Å; H90-C177 PolarHBondContact ND1-SG 3.09Å; H90-C177 VanDerWaalsContact ND1-SG 3.45Å
91	I	73.9	Confident	67.4	Low	147 Å²	147	87.9 Å²	87.9	75%	0.754	50%	0.502	S	S	*	.	B	Isolated β-bridge	trans	-128.6	129.6	176.9	-57.1	174.8	0	0	0	106.9	P89	P89-I91 VanDerWaalsContact C-N 3.26Å; P89-I91 PolarHBondContact O-N 3.43Å
92	L	79.6	Confident	70.6	Confident	15 Å²	15	83.6 Å²	83.6	8%	0.079	47%	0.472	C	S	.	.			trans	-119.3	153.5	176.1	-68.8	170.3	0	0	0	109.6	M88 P89 Y103 K136 V139 G143 V145	M88-L92 HydrophobicContact CE-CD1 4.21Å; M88-L92 HydrophobicContact SD-CD1 4.39Å; P89-L92 HydrophobicContact CG-CD2 3.77Å; L92-Y103 HydrophobicContact CB-CE2 4.48Å; L92-K136 HydrophobicContact CD1-CD 3.55Å; L92-V139 HydrophobicContact CD1-CG1 3.82Å; L92-V139 HydrophobicContact CD1-CG2 3.94Å; L92-G143 PolarHBondContact N-O 3.47Å; L92-V145 HydrophobicContact CD1-CG2 4.15Å; L92-V145 HydrophobicContact CG-CG2 4.38Å
93	P	84.6	Confident	73.8	Confident	88 Å²	88	81 Å²	81	57%	0.571	44%	0.443	S	S	*	.	P	Polyproline II helix	trans	-64	153.7	166	30.5	-35.2	0	0	0	109.6	Y103	P93-Y103 WeakPolarHBondContact O-CE2 3.44Å; P93-Y103 PolarHBondContact O-OH 2.68Å
94	P	83.5	Confident	76.7	Confident	82 Å²	82	77 Å²	77	53%	0.532	41%	0.412	S	S	.	.	P	Polyproline II helix	trans	-56.6	154.4	175.1	25.6	-35.3	0	0	0	111.5
95	E	85.9	Confident	78.9	Confident	41 Å²	41	80.8 Å²	80.8	19%	0.192	42%	0.423	C	S	.	.	P	Polyproline II helix	trans	-62	137.5	178.7	-173.5	168.4	-170.6	0	0	111	E102 Y103 R125 D141	E95-E102 VanDerWaalsContact OE1-CA 3.26Å; E95-E102 WeakPolarHBondContact OE1-CA 3.32Å; E95-Y103 HydrophobicContact CB-CD2 3.78Å; E95-Y103 HydrophobicContact CB-CE2 4.14Å; E95-Y103 HydrophobicContact CB-CG 4.09Å; E95-Y103 VanDerWaalsContact CD-N 3.29Å; E95-Y103 HydrophobicContact CG-CG 4.37Å; E95-Y103 PolarHBondContact OE1-N 2.93Å; E95-Y103 WeakPolarHBondContact OE2-CB 3.33Å; E95-Y103 PolarHBondContact OE2-N 3.06Å; E95-R125 IonicContact OE1-CZ 3.43Å; E95-R125 IonicContact OE1-NH2 3.9Å; E95-R125 PolarHBondContact OE1-NH2 2.88Å; E95-D141 PolarHBondContact N-O 2.79Å
96	I	86.2	Confident	81.1	Confident	126 Å²	126	80.6 Å²	80.6	65%	0.646	41%	0.407	S	S	*	.	P	Polyproline II helix	trans	-94.2	124.2	169.1	-53.7	176.4	0	0	0	106.5	E98 R125	I96-E98 HydrophobicContact CG2-CB 4.34Å; I96-E98 WeakPolarHBondContact CG2-O 3.5Å; I96-E98 PolarHBondContact O-N 3.17Å; I96-R125 PolarHBondContact O-NH1 3.35Å; I96-R125 VanDerWaalsContact O-NH1 3.09Å; I96-R125 PolarHBondContact O-NH2 3.44Å
97	E	81.4	Confident	82.9	Confident	170 Å²	170	77.2 Å²	77.2	79%	0.794	39%	0.386	S	S	*	.	S	Bend	trans	-59	-34.4	178.3	-65.3	-170.9	170.7	0	0	111.2	W124 R125	E97-W124 WeakPolarHBondContact O-CH2 3.36Å; E97-W124 WeakPolarHBondContact O-CZ3 3.29Å; E97-R125 PolarHBondContact O-NH1 3.3Å; E97-R125 VanDerWaalsContact O-NH1 3.07Å
98	E	80.9	Confident	84.3	Confident	153 Å²	153	71 Å²	71	72%	0.715	36%	0.364	S	S	*	.	S	Bend	trans	-87.3	160.3	174.2	-64.5	-173.9	166.7	0	0	113.8	I96 R125	I96-E98 HydrophobicContact CG2-CB 4.34Å; I96-E98 WeakPolarHBondContact CG2-O 3.5Å; I96-E98 PolarHBondContact O-N 3.17Å; E98-R125 PolarHBondContact O-NH1 3.1Å; E98-R125 VanDerWaalsContact O-NH1 3.12Å
99	G	81.1	Confident	85.1	Confident	27 Å²	27	76.9 Å²	76.9	28%	0.278	40%	0.395	S	S	.	.	S	Bend	trans	84.8	-162	179.3	0	0	0	0	0	114.1	R125	G99-R125 WeakPolarHBondContact O-CD 3.42Å; G99-R125 PolarHBondContact O-NH1 3.13Å
100	N	86.8	Confident	85.9	Confident	48 Å²	48	75.3 Å²	75.3	26%	0.257	39%	0.385	S	S	.	.	S	Bend	trans	-112.4	14.3	-162.2	75.8	-36.3	0	0	0	115.8	R125 K132 A133 I134	N100-R125 WeakPolarHBondContact CB-O 3.35Å; N100-K132 WeakPolarHBondContact CB-O 3.37Å; N100-K132 PolarHBondContact ND2-O 2.92Å; N100-A133 CarbonylContact O-C 3.43Å; N100-A133 VanDerWaalsContact O-CA 3.27Å; N100-A133 WeakPolarHBondContact O-CA 3.45Å; N100-I134 PolarHBondContact O-N 3.33Å
101	I	90.9	Very high	87.1	Confident	64 Å²	64	73.9 Å²	73.9	33%	0.328	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	126.3	-179.9	-53.8	178.3	0	0	0	108.3	Y103 R125 I134	I101-Y103 HydrophobicContact CG2-CD1 4.19Å; I101-Y103 HydrophobicContact CG2-CE1 3.68Å; I101-R125 PolarHBondContact O-NE 2.98Å; I101-R125 PolarHBondContact O-NH1 3.45Å; I101-R125 PolarHBondContact O-NH2 2.86Å; I101-I134 CarbonylContact C-O 3.58Å; I101-I134 WeakPolarHBondContact CA-O 3.34Å; I101-I134 HydrophobicContact CG1-CB 4.35Å; I101-I134 HydrophobicContact CG2-CB 4.49Å
102	E	93.6	Very high	87.9	Confident	2 Å²	2	71.8 Å²	71.8	1%	0.009	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	130.1	-177.3	-175.6	76	-149.5	0	0	110.6	E95 K104 Q121 R125 I134 Y135 K136	E95-E102 VanDerWaalsContact OE1-CA 3.26Å; E95-E102 WeakPolarHBondContact OE1-CA 3.32Å; E102-K104 HydrophobicContact CG-CG 4.3Å; E102-K104 WeakPolarHBondContact OE1-CE 3.42Å; E102-K104 IonicContact OE1-NZ 3.35Å; E102-K104 PolarHBondContact OE1-NZ 3.34Å; E102-Q121 VanDerWaalsContact CD-CD 3.46Å; E102-Q121 PolarHBondContact OE1-NE2 2.82Å; E102-Q121 PolarHBondContact OE1-OE1 3Å; E102-Q121 PolarHBondContact OE2-NE2 3.16Å; E102-Q121 VanDerWaalsContact OE2-NE2 3.1Å; E102-R125 HydrophobicContact CB-CG 4.33Å; E102-R125 WeakPolarHBondContact OE2-CG 3.22Å; E102-R125 IonicContact OE2-CZ 2.61Å; E102-R125 IonicContact OE2-NE 2.68Å; E102-R125 PolarHBondContact OE2-NE 3.22Å; E102-R125 IonicContact OE2-NH2 3.34Å; E102-I134 PolarHBondContact N-O 2.89Å; E102-Y135 HydrophobicContact CB-CD1 4.14Å; E102-Y135 HydrophobicContact CB-CD2 4.22Å; E102-Y135 HydrophobicContact CB-CE1 3.97Å; E102-Y135 HydrophobicContact CB-CE2 4.03Å; E102-Y135 HydrophobicContact CB-CG 4.26Å; E102-Y135 HydrophobicContact CG-CD1 4.07Å; E102-Y135 HydrophobicContact CG-CE1 3.63Å; E102-Y135 HydrophobicContact CG-CE2 4.49Å; E102-Y135 CarbonylContact O-C 3.56Å; E102-Y135 WeakPolarHBondContact O-CA 3.44Å; E102-K136 PolarHBondContact O-N 3.37Å
103	Y	93.3	Very high	88.6	Confident	7 Å²	7	77.3 Å²	77.3	3%	0.027	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	139.1	173.2	-62.3	-2.5	0	0	0	110.4	L92 P93 E95 I101 K136 V139	L92-Y103 HydrophobicContact CB-CE2 4.48Å; P93-Y103 WeakPolarHBondContact O-CE2 3.44Å; P93-Y103 PolarHBondContact O-OH 2.68Å; E95-Y103 HydrophobicContact CB-CD2 3.78Å; E95-Y103 HydrophobicContact CB-CE2 4.14Å; E95-Y103 HydrophobicContact CB-CG 4.09Å; E95-Y103 VanDerWaalsContact CD-N 3.29Å; E95-Y103 HydrophobicContact CG-CG 4.37Å; E95-Y103 PolarHBondContact OE1-N 2.93Å; E95-Y103 WeakPolarHBondContact OE2-CB 3.33Å; E95-Y103 PolarHBondContact OE2-N 3.06Å; I101-Y103 HydrophobicContact CG2-CD1 4.19Å; I101-Y103 HydrophobicContact CG2-CE1 3.68Å; Y103-K136 HydrophobicContact CD1-CB 3.9Å; Y103-K136 HydrophobicContact CD1-CD 3.89Å; Y103-K136 HydrophobicContact CD1-CG 4.06Å; Y103-K136 HydrophobicContact CE1-CB 4.35Å; Y103-K136 HydrophobicContact CE1-CD 3.45Å; Y103-K136 VanDerWaalsContact CE1-CD 3.45Å; Y103-K136 HydrophobicContact CE1-CG 4.08Å; Y103-K136 PolarHBondContact OH-NZ 3.32Å; Y103-K136 VanDerWaalsContact OH-NZ 3.07Å; Y103-V139 HydrophobicContact CD2-CG1 3.71Å; Y103-V139 HydrophobicContact CE2-CG1 4.09Å; Y103-V139 HydrophobicContact CG-CG1 4.04Å
104	K	93.2	Very high	88.9	Confident	27 Å²	27	78.5 Å²	78.5	12%	0.117	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	117.4	174.7	-69.3	-69.5	155	-96.8	0	110.4	E102 K106 L107 K136 L137 G138 V139	E102-K104 HydrophobicContact CG-CG 4.3Å; E102-K104 WeakPolarHBondContact OE1-CE 3.42Å; E102-K104 IonicContact OE1-NZ 3.35Å; E102-K104 PolarHBondContact OE1-NZ 3.34Å; K104-K106 PolarHBondContact O-N 3.25Å; K104-L107 HydrophobicContact CB-CD2 4.25Å; K104-L107 HydrophobicContact CB-CG 4.18Å; K104-L107 HydrophobicContact CD-CD2 4.08Å; K104-L107 HydrophobicContact CG-CD2 4.01Å; K104-L107 HydrophobicContact CG-CG 4.36Å; K104-K136 PolarHBondContact N-O 2.83Å; K104-L137 HydrophobicContact CB-CD2 4.07Å; K104-L137 VanDerWaalsContact O-CA 3.31Å; K104-L137 WeakPolarHBondContact O-CA 3.42Å; K104-G138 PolarHBondContact O-N 2.58Å; K104-V139 CarbonylContact C-O 3.54Å
105	R	89.9	Confident	89.5	Confident	133 Å²	133	76 Å²	76	50%	0.502	39%	0.385	S	S	.	.	S	Bend	trans	-57	-48.5	172.6	175.7	164.2	41.4	116.4	3.2	111.9	G138 V139 D140 L148	R105-G138 WeakPolarHBondContact O-CA 3.49Å; R105-G138 PolarHBondContact O-N 3.45Å; R105-V139 WeakPolarHBondContact CA-O 3.36Å; R105-V139 PolarHBondContact N-O 3.43Å; R105-D140 WeakPolarHBondContact CB-OD1 3.44Å; R105-D140 WeakPolarHBondContact CD-OD1 3.06Å; R105-D140 IonicContact CZ-OD1 3.45Å; R105-D140 IonicContact NE-OD1 3.21Å; R105-D140 PolarHBondContact NE-OD1 3.31Å; R105-L148 WeakPolarHBondContact O-CD1 3.46Å; R105-L148 VanDerWaalsContact O-CD2 3.3Å; R105-L148 WeakPolarHBondContact O-CD2 3.22Å; R105-L148 WeakPolarHBondContact O-CG 3.44Å
106	K	91.7	Very high	89.8	Confident	113 Å²	113	77.7 Å²	77.7	49%	0.491	39%	0.393	S	S	.	.			trans	-152.7	150.2	176.4	65.4	-175.4	-179.1	177.9	0	114.1	K104 V108 L148	K104-K106 PolarHBondContact O-N 3.25Å; K106-V108 HydrophobicContact CB-CG2 4.43Å; K106-L148 HydrophobicContact CB-CD2 3.66Å
107	L	91.1	Very high	90.1	Very high	9 Å²	9	76.8 Å²	76.8	5%	0.047	39%	0.386	C	S	.	.			trans	-126.7	38.5	176.7	-65	177	0	0	0	111.7	K104 L118 L137 S156 T159 L160	K104-L107 HydrophobicContact CB-CD2 4.25Å; K104-L107 HydrophobicContact CB-CG 4.18Å; K104-L107 HydrophobicContact CD-CD2 4.08Å; K104-L107 HydrophobicContact CG-CD2 4.01Å; K104-L107 HydrophobicContact CG-CG 4.36Å; L107-L118 HydrophobicContact CD2-CD1 4.03Å; L107-L118 HydrophobicContact CD2-CD2 3.96Å; L107-L137 HydrophobicContact CD1-CD2 3.75Å; L107-L137 HydrophobicContact CG-CD2 4.28Å; L107-S156 PolarHBondContact N-OG 2.71Å; L107-T159 HydrophobicContact CB-CG2 4.22Å; L107-T159 WeakPolarHBondContact O-CB 3.48Å; L107-T159 WeakPolarHBondContact O-CG2 3.47Å; L107-T159 PolarHBondContact O-OG1 2.87Å; L107-L160 HydrophobicContact CD1-CB 4.41Å; L107-L160 HydrophobicContact CD1-CD1 3.97Å
108	V	89.9	Confident	90.8	Very high	55 Å²	55	68.9 Å²	68.9	33%	0.333	35%	0.349	S	S	.	.	S	Bend	trans	-76.3	125.6	178	-173.9	0	0	0	0	109.9	K106 E152	K106-V108 HydrophobicContact CB-CG2 4.43Å; V108-E152 HydrophobicContact CG2-CB 4.08Å; V108-E152 HydrophobicContact CG2-CG 4.41Å
109	D	86.4	Confident	91.4	Very high	124 Å²	124	62.1 Å²	62.1	66%	0.663	32%	0.318	S	S	*	.	S	Bend	trans	35.1	63.6	170.3	-61.3	-36.6	0	0	0	117.1
110	P	91.3	Very high	92	Very high	26 Å²	26	65.2 Å²	65.2	17%	0.169	33%	0.331	C	S	.	.			trans	-64.4	143.3	175.2	28.4	-35.8	0	0	0	111.8	R114 F115 L118 T159	P110-R114 HydrophobicContact CB-CB 4.09Å; P110-R114 HydrophobicContact CB-CG 4.02Å; P110-F115 HydrophobicContact CB-CB 4.5Å; P110-F115 HydrophobicContact CG-CB 4.22Å; P110-F115 HydrophobicContact CG-CD2 4.15Å; P110-L118 HydrophobicContact CB-CD1 3.98Å; P110-L118 HydrophobicContact CG-CD1 4.15Å; P110-T159 HydrophobicContact CG-CG2 3.63Å
111	T	93.4	Very high	92.3	Very high	94 Å²	94	65.7 Å²	65.7	58%	0.577	33%	0.332	S	S	*	.			trans	-58.6	154.5	169.6	63.4	0	0	0	0	110.8	N113 R114 F115	T111-N113 VanDerWaalsContact C-N 3.28Å; T111-N113 PolarHBondContact O-N 2.94Å; T111-R114 CarbonylContact O-C 3.51Å; T111-R114 WeakPolarHBondContact O-CA 3.45Å; T111-R114 WeakPolarHBondContact O-CB 3.36Å; T111-R114 PolarHBondContact O-N 3.36Å; T111-R114 WeakPolarHBondContact OG1-CB 3.39Å; T111-R114 PolarHBondContact OG1-N 3.33Å; T111-F115 PolarHBondContact O-N 3.35Å
112	P	92	Very high	92.4	Very high	104 Å²	104	62.7 Å²	62.7	68%	0.675	32%	0.317	S	S	*	.	H	α-helix	trans	-53.4	-41.9	-176.8	-29.3	36.1	0	0	0	113.9	R114 F115 E116	P112-R114 PolarHBondContact O-N 3.27Å; P112-F115 WeakPolarHBondContact O-CB 3.45Å; P112-F115 PolarHBondContact O-N 3.29Å; P112-E116 PolarHBondContact O-N 2.73Å; P112-E116 VanDerWaalsContact O-N 3.1Å
113	N	92.7	Very high	92.3	Very high	130 Å²	130	68.2 Å²	68.2	70%	0.695	34%	0.341	S	S	*	.	H	α-helix	trans	-64.8	-38.9	175.7	-66.5	-0.7	0	0	0	112.2	T111 Q117	T111-N113 VanDerWaalsContact C-N 3.28Å; T111-N113 PolarHBondContact O-N 2.94Å; N113-Q117 WeakPolarHBondContact O-CG 3.44Å; N113-Q117 PolarHBondContact O-N 2.84Å
114	R	92.3	Very high	92.1	Very high	114 Å²	114	73 Å²	73	43%	0.43	36%	0.359	S	S	.	.	H	α-helix	trans	-70.6	-33.9	176.2	-174.2	55.8	174.6	173.6	1.7	111.7	P110 T111 P112 Q117 L118	P110-R114 HydrophobicContact CB-CB 4.09Å; P110-R114 HydrophobicContact CB-CG 4.02Å; T111-R114 CarbonylContact O-C 3.51Å; T111-R114 WeakPolarHBondContact O-CA 3.45Å; T111-R114 WeakPolarHBondContact O-CB 3.36Å; T111-R114 PolarHBondContact O-N 3.36Å; T111-R114 WeakPolarHBondContact OG1-CB 3.39Å; T111-R114 PolarHBondContact OG1-N 3.33Å; P112-R114 PolarHBondContact O-N 3.27Å; R114-Q117 VanDerWaalsContact CD-OE1 3.23Å; R114-Q117 WeakPolarHBondContact O-CB 3.4Å; R114-Q117 PolarHBondContact O-N 3.46Å; R114-L118 HydrophobicContact CG-CD1 4.2Å; R114-L118 HydrophobicContact CG-CG 4.49Å; R114-L118 WeakPolarHBondContact O-CB 3.49Å; R114-L118 VanDerWaalsContact O-CG 3.24Å; R114-L118 WeakPolarHBondContact O-CG 3.42Å; R114-L118 PolarHBondContact O-N 2.88Å
115	F	95	Very high	91.9	Very high	29 Å²	29	72 Å²	72	13%	0.127	35%	0.354	C	S	.	.	H	α-helix	trans	-63.1	-45.8	174.8	-178.2	-98.3	0	0	0	111.6	P110 T111 P112 Q117 L118 V119 R162 M163	P110-F115 HydrophobicContact CB-CB 4.5Å; P110-F115 HydrophobicContact CG-CB 4.22Å; P110-F115 HydrophobicContact CG-CD2 4.15Å; T111-F115 PolarHBondContact O-N 3.35Å; P112-F115 WeakPolarHBondContact O-CB 3.45Å; P112-F115 PolarHBondContact O-N 3.29Å; F115-Q117 VanDerWaalsContact C-N 3.35Å; F115-Q117 PolarHBondContact O-N 3.07Å; F115-L118 PolarHBondContact O-N 2.97Å; F115-V119 HydrophobicContact CD1-CG2 4.19Å; F115-V119 HydrophobicContact CE1-CG2 3.84Å; F115-V119 HydrophobicContact CE2-CG2 4.5Å; F115-V119 HydrophobicContact CZ-CG2 4.01Å; F115-V119 VanDerWaalsContact O-CG2 3.29Å; F115-V119 WeakPolarHBondContact O-CG2 3.4Å; F115-V119 PolarHBondContact O-N 3.06Å; F115-R162 HydrophobicContact CE2-CB 3.75Å; F115-R162 HydrophobicContact CZ-CB 3.84Å; F115-M163 HydrophobicContact CD2-CG 4.16Å; F115-M163 HydrophobicContact CE2-CG 3.65Å; F115-M163 HydrophobicContact CZ-CG 4.25Å
116	E	92.7	Very high	91.7	Very high	77 Å²	77	65.9 Å²	65.9	36%	0.36	33%	0.331	S	S	.	.	H	α-helix	trans	-66.3	-34	175.9	-64.6	-64.2	173.9	0	0	112.9	P112 V119 T120 R166	P112-E116 PolarHBondContact O-N 2.73Å; P112-E116 VanDerWaalsContact O-N 3.1Å; E116-V119 PolarHBondContact O-N 2.93Å; E116-T120 WeakPolarHBondContact O-CB 3.48Å; E116-T120 PolarHBondContact O-N 3.31Å; E116-T120 PolarHBondContact O-OG1 3.02Å; E116-R166 IonicContact OE1-CZ 3.41Å; E116-R166 VanDerWaalsContact OE1-CZ 3.28Å; E116-R166 IonicContact OE1-NE 2.86Å; E116-R166 PolarHBondContact OE1-NE 3.36Å; E116-R166 VanDerWaalsContact OE1-NE 3.14Å; E116-R166 IonicContact OE1-NH2 2.69Å; E116-R166 PolarHBondContact OE1-NH2 2.92Å; E116-R166 IonicContact OE2-CZ 3.8Å; E116-R166 IonicContact OE2-NE 2.77Å; E116-R166 PolarHBondContact OE2-NE 3.47Å; E116-R166 IonicContact OE2-NH2 3.27Å
117	Q	93.5	Very high	91.3	Very high	107 Å²	107	65.5 Å²	65.5	50%	0.5	34%	0.335	S	S	.	.	H	α-helix	trans	-61.2	-47.5	170.1	-73	173.7	-2.6	0	0	111.7	N113 R114 F115 V119 T120 Q121	N113-Q117 WeakPolarHBondContact O-CG 3.44Å; N113-Q117 PolarHBondContact O-N 2.84Å; R114-Q117 VanDerWaalsContact CD-OE1 3.23Å; R114-Q117 WeakPolarHBondContact O-CB 3.4Å; R114-Q117 PolarHBondContact O-N 3.46Å; F115-Q117 VanDerWaalsContact C-N 3.35Å; F115-Q117 PolarHBondContact O-N 3.07Å; Q117-V119 PolarHBondContact O-N 2.74Å; Q117-T120 PolarHBondContact O-N 3.09Å; Q117-Q121 WeakPolarHBondContact O-CB 3.25Å; Q117-Q121 PolarHBondContact O-N 2.78Å
118	L	95.1	Very high	90.8	Very high	4 Å²	4	70 Å²	70	2%	0.021	36%	0.356	C	S	.	.	H	α-helix	trans	-63.1	-39.7	178.3	-72.1	167.3	0	0	0	111.8	L107 P110 R114 F115 T120 Q121 M122 M163	L107-L118 HydrophobicContact CD2-CD1 4.03Å; L107-L118 HydrophobicContact CD2-CD2 3.96Å; P110-L118 HydrophobicContact CB-CD1 3.98Å; P110-L118 HydrophobicContact CG-CD1 4.15Å; R114-L118 HydrophobicContact CG-CD1 4.2Å; R114-L118 HydrophobicContact CG-CG 4.49Å; R114-L118 WeakPolarHBondContact O-CB 3.49Å; R114-L118 VanDerWaalsContact O-CG 3.24Å; R114-L118 WeakPolarHBondContact O-CG 3.42Å; R114-L118 PolarHBondContact O-N 2.88Å; F115-L118 PolarHBondContact O-N 2.97Å; L118-T120 VanDerWaalsContact C-N 3.35Å; L118-Q121 PolarHBondContact O-N 3.2Å; L118-M122 WeakPolarHBondContact O-CB 3.34Å; L118-M122 PolarHBondContact O-N 3.33Å; L118-M163 HydrophobicContact CB-CE 3.69Å; L118-M163 HydrophobicContact CB-CG 4.49Å; L118-M163 HydrophobicContact CB-SD 3.79Å; L118-M163 HydrophobicContact CD1-SD 4.33Å; L118-M163 WeakPolarHBondContact O-CE 3.38Å
119	V	94.3	Very high	89.8	Confident	10 Å²	10	68.3 Å²	68.3	6%	0.061	35%	0.349	C	S	.	.	H	α-helix	trans	-62.3	-42.3	173.1	170.4	0	0	0	0	111	F115 E116 Q117 M122 K123 M163 R166 L167	F115-V119 HydrophobicContact CD1-CG2 4.19Å; F115-V119 HydrophobicContact CE1-CG2 3.84Å; F115-V119 HydrophobicContact CE2-CG2 4.5Å; F115-V119 HydrophobicContact CZ-CG2 4.01Å; F115-V119 VanDerWaalsContact O-CG2 3.29Å; F115-V119 WeakPolarHBondContact O-CG2 3.4Å; F115-V119 PolarHBondContact O-N 3.06Å; E116-V119 PolarHBondContact O-N 2.93Å; Q117-V119 PolarHBondContact O-N 2.74Å; V119-M122 PolarHBondContact O-N 3.41Å; V119-K123 WeakPolarHBondContact O-CB 3.44Å; V119-K123 PolarHBondContact O-N 2.92Å; V119-M163 HydrophobicContact CG2-CB 4.14Å; V119-M163 HydrophobicContact CG2-CG 3.99Å; V119-R166 HydrophobicContact CG1-CB 4.47Å; V119-R166 HydrophobicContact CG1-CG 4.21Å; V119-R166 HydrophobicContact CG2-CB 4.44Å; V119-L167 HydrophobicContact CG1-CD1 4.49Å; V119-L167 HydrophobicContact CG1-CD2 3.77Å; V119-L167 HydrophobicContact CG1-CG 4.04Å
120	T	92.5	Very high	88.8	Confident	93 Å²	93	63 Å²	63	57%	0.571	32%	0.324	S	S	*	.	H	α-helix	trans	-65.4	-40.8	177.1	-54.6	0	0	0	0	111.5	E116 Q117 L118 K123 W124	E116-T120 WeakPolarHBondContact O-CB 3.48Å; E116-T120 PolarHBondContact O-N 3.31Å; E116-T120 PolarHBondContact O-OG1 3.02Å; Q117-T120 PolarHBondContact O-N 3.09Å; L118-T120 VanDerWaalsContact C-N 3.35Å; T120-K123 WeakPolarHBondContact O-CB 3.44Å; T120-K123 PolarHBondContact O-N 3.32Å; T120-W124 PolarHBondContact O-N 2.88Å
121	Q	93.4	Very high	87.8	Confident	58 Å²	58	62 Å²	62	27%	0.271	32%	0.318	S	S	.	.	H	α-helix	trans	-63	-46.4	174.4	-174.3	178.1	39.4	0	0	112	E102 Q117 L118 K123 W124 R125	E102-Q121 VanDerWaalsContact CD-CD 3.46Å; E102-Q121 PolarHBondContact OE1-NE2 2.82Å; E102-Q121 PolarHBondContact OE1-OE1 3Å; E102-Q121 PolarHBondContact OE2-NE2 3.16Å; E102-Q121 VanDerWaalsContact OE2-NE2 3.1Å; Q117-Q121 WeakPolarHBondContact O-CB 3.25Å; Q117-Q121 PolarHBondContact O-N 2.78Å; L118-Q121 PolarHBondContact O-N 3.2Å; Q121-K123 VanDerWaalsContact C-N 3.31Å; Q121-K123 PolarHBondContact O-N 3.45Å; Q121-W124 PolarHBondContact O-N 3.19Å; Q121-W124 VanDerWaalsContact O-N 3.13Å; Q121-R125 PolarHBondContact O-N 2.94Å
122	M	93.3	Very high	87.2	Confident	0 Å²	0	60.6 Å²	60.6	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-60.3	-40.4	175.4	-176.6	-175.3	-95.4	0	0	111.9	L118 V119 W124 L126 Y135 L160 M163 A164 L167 V198	L118-M122 WeakPolarHBondContact O-CB 3.34Å; L118-M122 PolarHBondContact O-N 3.33Å; V119-M122 PolarHBondContact O-N 3.41Å; M122-W124 VanDerWaalsContact C-N 3.32Å; M122-W124 PolarHBondContact O-N 3.29Å; M122-L126 HydrophobicContact CG-CD1 3.96Å; M122-L126 HydrophobicContact CG-CG 4.43Å; M122-L126 VanDerWaalsContact O-CB 3.26Å; M122-L126 WeakPolarHBondContact O-CB 3.39Å; M122-L126 VanDerWaalsContact O-CG 3.26Å; M122-L126 WeakPolarHBondContact O-CG 3.47Å; M122-L126 PolarHBondContact O-N 3.22Å; M122-Y135 WeakPolarHBondContact CA-OH 3.49Å; M122-Y135 WeakPolarHBondContact CB-OH 3.47Å; M122-Y135 HydrophobicContact CE-CE2 4.25Å; M122-Y135 HydrophobicContact CG-CE2 4.23Å; M122-Y135 PolarHBondContact N-OH 3.11Å; M122-L160 HydrophobicContact CE-CD1 3.38Å; M122-L160 HydrophobicContact CE-CG 3.96Å; M122-M163 HydrophobicContact CB-CE 4.04Å; M122-M163 HydrophobicContact CE-CB 3.87Å; M122-M163 HydrophobicContact CE-CE 3.77Å; M122-M163 HydrophobicContact SD-CB 3.8Å; M122-M163 HydrophobicContact SD-CE 4.3Å; M122-A164 HydrophobicContact CE-CB 4.37Å; M122-A164 HydrophobicContact SD-CB 4.25Å; M122-L167 HydrophobicContact CB-CD1 3.81Å; M122-L167 HydrophobicContact CG-CD1 3.67Å; M122-L167 HydrophobicContact SD-CD1 3.84Å; M122-V198 HydrophobicContact CE-CG1 4.09Å; M122-V198 HydrophobicContact CE-CG2 3.84Å; M122-V198 HydrophobicContact CG-CG1 4.4Å; M122-V198 HydrophobicContact SD-CG1 4.08Å
123	K	90.6	Very high	87	Confident	118 Å²	118	55.6 Å²	55.6	51%	0.513	27%	0.272	S	S	.	.	H	α-helix	trans	-61.7	-39.8	174.6	-173.6	178.5	177.8	179.4	0	112	V119 T120 Q121 N127 L167	V119-K123 WeakPolarHBondContact O-CB 3.44Å; V119-K123 PolarHBondContact O-N 2.92Å; T120-K123 WeakPolarHBondContact O-CB 3.44Å; T120-K123 PolarHBondContact O-N 3.32Å; Q121-K123 VanDerWaalsContact C-N 3.31Å; Q121-K123 PolarHBondContact O-N 3.45Å; K123-N127 PolarHBondContact O-N 3.29Å; K123-L167 HydrophobicContact CB-CD1 3.9Å; K123-L167 HydrophobicContact CB-CD2 3.92Å; K123-L167 HydrophobicContact CD-CD2 4.25Å; K123-L167 HydrophobicContact CG-CD2 4.24Å
124	W	88.9	Confident	86.9	Confident	109 Å²	109	51 Å²	51	41%	0.413	25%	0.247	S	C	.	.	H	α-helix	trans	-68	-52.6	177.1	-175.5	73	0	0	0	111.8	E97 T120 Q121 M122 L126 N127 E128	E97-W124 WeakPolarHBondContact O-CH2 3.36Å; E97-W124 WeakPolarHBondContact O-CZ3 3.29Å; T120-W124 PolarHBondContact O-N 2.88Å; Q121-W124 PolarHBondContact O-N 3.19Å; Q121-W124 VanDerWaalsContact O-N 3.13Å; M122-W124 VanDerWaalsContact C-N 3.32Å; M122-W124 PolarHBondContact O-N 3.29Å; W124-L126 PolarHBondContact O-N 2.87Å; W124-N127 WeakPolarHBondContact O-CB 3.47Å; W124-N127 PolarHBondContact O-N 3.29Å; W124-E128 HydrophobicContact CD2-CG 4.08Å; W124-E128 HydrophobicContact CE3-CG 4.44Å; W124-E128 HydrophobicContact CH2-CG 4.41Å; W124-E128 HydrophobicContact CZ2-CG 3.97Å; W124-E128 WeakPolarHBondContact O-CG 3.48Å; W124-E128 PolarHBondContact O-N 3.39Å
125	R	90.6	Very high	87	Confident	5 Å²	5	45.6 Å²	45.6	2%	0.019	23%	0.226	C	C	.	.	H	α-helix	trans	-56.5	-36.4	175.3	-66.5	-66.3	-161.8	177.9	5.5	112.7	E95 I96 E97 E98 G99 N100 I101 E102 Q121 G129 A133	E95-R125 IonicContact OE1-CZ 3.43Å; E95-R125 IonicContact OE1-NH2 3.9Å; E95-R125 PolarHBondContact OE1-NH2 2.88Å; I96-R125 PolarHBondContact O-NH1 3.35Å; I96-R125 VanDerWaalsContact O-NH1 3.09Å; I96-R125 PolarHBondContact O-NH2 3.44Å; E97-R125 PolarHBondContact O-NH1 3.3Å; E97-R125 VanDerWaalsContact O-NH1 3.07Å; E98-R125 PolarHBondContact O-NH1 3.1Å; E98-R125 VanDerWaalsContact O-NH1 3.12Å; G99-R125 WeakPolarHBondContact O-CD 3.42Å; G99-R125 PolarHBondContact O-NH1 3.13Å; N100-R125 WeakPolarHBondContact CB-O 3.35Å; I101-R125 PolarHBondContact O-NE 2.98Å; I101-R125 PolarHBondContact O-NH1 3.45Å; I101-R125 PolarHBondContact O-NH2 2.86Å; E102-R125 HydrophobicContact CB-CG 4.33Å; E102-R125 WeakPolarHBondContact OE2-CG 3.22Å; E102-R125 IonicContact OE2-CZ 2.61Å; E102-R125 IonicContact OE2-NE 2.68Å; E102-R125 PolarHBondContact OE2-NE 3.22Å; E102-R125 IonicContact OE2-NH2 3.34Å; Q121-R125 PolarHBondContact O-N 2.94Å; R125-G129 PolarHBondContact O-N 3.41Å; R125-G129 VanDerWaalsContact O-N 3.08Å; R125-A133 HydrophobicContact CB-CB 3.87Å
126	L	85.7	Confident	86.9	Confident	4 Å²	4	44.8 Å²	44.8	2%	0.021	22%	0.223	C	C	.	.	H	α-helix	trans	-67.1	-39.2	174.2	-80.8	168.4	0	0	0	112.5	M122 W124 G130 G131 A133 L167 S169 V198	M122-L126 HydrophobicContact CG-CD1 3.96Å; M122-L126 HydrophobicContact CG-CG 4.43Å; M122-L126 VanDerWaalsContact O-CB 3.26Å; M122-L126 WeakPolarHBondContact O-CB 3.39Å; M122-L126 VanDerWaalsContact O-CG 3.26Å; M122-L126 WeakPolarHBondContact O-CG 3.47Å; M122-L126 PolarHBondContact O-N 3.22Å; W124-L126 PolarHBondContact O-N 2.87Å; L126-G130 PolarHBondContact O-N 2.85Å; L126-G131 VanDerWaalsContact O-CA 3.25Å; L126-G131 WeakPolarHBondContact O-CA 3.29Å; L126-G131 PolarHBondContact O-N 3.06Å; L126-A133 HydrophobicContact CD2-CB 3.95Å; L126-A133 HydrophobicContact CG-CB 4.03Å; L126-L167 HydrophobicContact CD1-CD1 3.95Å; L126-S169 WeakPolarHBondContact CD1-OG 3.49Å; L126-V198 HydrophobicContact CD1-CG1 4.14Å; L126-V198 HydrophobicContact CD2-CB 4.23Å; L126-V198 HydrophobicContact CD2-CG1 4.01Å; L126-V198 HydrophobicContact CG-CG1 4.39Å
127	N	81.8	Confident	87	Confident	106 Å²	106	41.1 Å²	41.1	57%	0.567	21%	0.206	S	C	*	.	H	α-helix	trans	-66.9	-49.4	176.2	-79.7	0.2	0	0	0	111.4	K123 W124 G129 G130	K123-N127 PolarHBondContact O-N 3.29Å; W124-N127 WeakPolarHBondContact O-CB 3.47Å; W124-N127 PolarHBondContact O-N 3.29Å; N127-G129 VanDerWaalsContact C-N 3.27Å; N127-G129 PolarHBondContact O-N 2.96Å; N127-G130 PolarHBondContact O-N 3.38Å; N127-G130 VanDerWaalsContact O-N 3.1Å
128	E	80.7	Confident	86.9	Confident	104 Å²	104	36 Å²	36	49%	0.486	18%	0.182	S	C	.	.	H	α-helix	trans	-55.3	-41.5	176.8	-68.8	-57.6	126.3	0	0	112	W124 G130	W124-E128 HydrophobicContact CD2-CG 4.08Å; W124-E128 HydrophobicContact CE3-CG 4.44Å; W124-E128 HydrophobicContact CH2-CG 4.41Å; W124-E128 HydrophobicContact CZ2-CG 3.97Å; W124-E128 WeakPolarHBondContact O-CG 3.48Å; W124-E128 PolarHBondContact O-N 3.39Å; E128-G130 VanDerWaalsContact C-N 3.28Å; E128-G130 PolarHBondContact O-N 2.88Å
129	G	68.9	Low	86.7	Confident	19 Å²	19	35.9 Å²	35.9	20%	0.196	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.9	16.6	179.7	0	0	0	0	0	115.8	R125 N127 G131 K132	R125-G129 PolarHBondContact O-N 3.41Å; R125-G129 VanDerWaalsContact O-N 3.08Å; N127-G129 VanDerWaalsContact C-N 3.27Å; N127-G129 PolarHBondContact O-N 2.96Å; G129-G131 PolarHBondContact O-N 3.39Å; G129-K132 WeakPolarHBondContact CA-O 3.39Å; G129-K132 PolarHBondContact O-N 3.3Å
130	G	66.3	Low	86.4	Confident	12 Å²	12	37 Å²	37	12%	0.124	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.7	49.2	179.8	0	0	0	0	0	112.4	L126 N127 E128 R294	L126-G130 PolarHBondContact O-N 2.85Å; N127-G130 PolarHBondContact O-N 3.38Å; N127-G130 VanDerWaalsContact O-N 3.1Å; E128-G130 VanDerWaalsContact C-N 3.28Å; E128-G130 PolarHBondContact O-N 2.88Å; G130-R294 VanDerWaalsContact C-NH2 3.28Å; G130-R294 PolarHBondContact O-NH1 3.4Å; G130-R294 VanDerWaalsContact O-NH1 3.08Å; G130-R294 PolarHBondContact O-NH2 3.2Å
131	G	70.9	Confident	86.2	Confident	6 Å²	6	37.2 Å²	37.2	6%	0.062	18%	0.184	C	C	.	.	S	Bend	trans	80.8	13.1	-178.8	0	0	0	0	0	115.3	L126 G129 R199 L200	L126-G131 VanDerWaalsContact O-CA 3.25Å; L126-G131 WeakPolarHBondContact O-CA 3.29Å; L126-G131 PolarHBondContact O-N 3.06Å; G129-G131 PolarHBondContact O-N 3.39Å; G131-R199 WeakPolarHBondContact O-CA 3.48Å; G131-L200 PolarHBondContact O-N 2.9Å
132	K	79.5	Confident	85.9	Confident	63 Å²	63	41 Å²	41	27%	0.274	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	122.6	-178.9	-63.9	172.1	-173.8	164.6	0	110.1	N100 G129 L197 V198	N100-K132 WeakPolarHBondContact CB-O 3.37Å; N100-K132 PolarHBondContact ND2-O 2.92Å; G129-K132 WeakPolarHBondContact CA-O 3.39Å; G129-K132 PolarHBondContact O-N 3.3Å; K132-L197 HydrophobicContact CB-CD1 4.16Å; K132-V198 CarbonylContact C-O 3.54Å; K132-V198 WeakPolarHBondContact CA-O 3.25Å
133	A	88.8	Confident	85.5	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	138.5	175	0	0	0	0	0	110.7	N100 R125 L126 Y135 V198	N100-A133 CarbonylContact O-C 3.43Å; N100-A133 VanDerWaalsContact O-CA 3.27Å; N100-A133 WeakPolarHBondContact O-CA 3.45Å; R125-A133 HydrophobicContact CB-CB 3.87Å; L126-A133 HydrophobicContact CD2-CB 3.95Å; L126-A133 HydrophobicContact CG-CB 4.03Å; A133-Y135 HydrophobicContact CB-CD2 4.42Å; A133-Y135 HydrophobicContact CB-CE2 4.13Å; A133-V198 HydrophobicContact CB-CB 4.29Å; A133-V198 PolarHBondContact N-O 2.94Å; A133-V198 WeakPolarHBondContact O-CA 3.38Å; A133-V198 WeakPolarHBondContact O-CB 3.34Å; A133-V198 PolarHBondContact O-N 3.37Å
134	I	90.8	Very high	85.4	Confident	33 Å²	33	41.5 Å²	41.5	17%	0.169	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	118.5	179.8	-62.4	173.6	0	0	0	108.7	N100 I101 E102 K136 E195 L197	N100-I134 PolarHBondContact O-N 3.33Å; I101-I134 CarbonylContact C-O 3.58Å; I101-I134 WeakPolarHBondContact CA-O 3.34Å; I101-I134 HydrophobicContact CG1-CB 4.35Å; I101-I134 HydrophobicContact CG2-CB 4.49Å; E102-I134 PolarHBondContact N-O 2.89Å; I134-K136 HydrophobicContact CG2-CG 4.5Å; I134-E195 HydrophobicContact CG2-CG 3.49Å; I134-E195 VanDerWaalsContact CG2-CG 3.49Å; I134-E195 WeakPolarHBondContact CG2-OE1 3.33Å; I134-L197 HydrophobicContact CG1-CD1 3.83Å
135	Y	94.2	Very high	85.3	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	124.7	176.6	-86.1	-110.2	0	0	0	110	E102 M122 A133 L160 M163 E195 V196 V198	E102-Y135 HydrophobicContact CB-CD1 4.14Å; E102-Y135 HydrophobicContact CB-CD2 4.22Å; E102-Y135 HydrophobicContact CB-CE1 3.97Å; E102-Y135 HydrophobicContact CB-CE2 4.03Å; E102-Y135 HydrophobicContact CB-CG 4.26Å; E102-Y135 HydrophobicContact CG-CD1 4.07Å; E102-Y135 HydrophobicContact CG-CE1 3.63Å; E102-Y135 HydrophobicContact CG-CE2 4.49Å; E102-Y135 CarbonylContact O-C 3.56Å; E102-Y135 WeakPolarHBondContact O-CA 3.44Å; M122-Y135 WeakPolarHBondContact CA-OH 3.49Å; M122-Y135 WeakPolarHBondContact CB-OH 3.47Å; M122-Y135 HydrophobicContact CE-CE2 4.25Å; M122-Y135 HydrophobicContact CG-CE2 4.23Å; M122-Y135 PolarHBondContact N-OH 3.11Å; A133-Y135 HydrophobicContact CB-CD2 4.42Å; A133-Y135 HydrophobicContact CB-CE2 4.13Å; Y135-L160 HydrophobicContact CD1-CD1 3.46Å; Y135-L160 VanDerWaalsContact CD1-CD1 3.46Å; Y135-L160 HydrophobicContact CD2-CD1 4.47Å; Y135-L160 HydrophobicContact CE1-CD1 3.8Å; Y135-L160 HydrophobicContact CG-CD1 3.84Å; Y135-M163 HydrophobicContact CE1-CE 4.41Å; Y135-E195 CarbonylContact O-C 3.58Å; Y135-E195 WeakPolarHBondContact O-CA 3.26Å; Y135-V196 PolarHBondContact N-O 3.42Å; Y135-V196 PolarHBondContact O-N 2.86Å; Y135-V198 HydrophobicContact CD2-CG2 3.46Å; Y135-V198 VanDerWaalsContact CD2-CG2 3.46Å; Y135-V198 HydrophobicContact CE2-CG2 3.93Å; Y135-V198 HydrophobicContact CG-CG2 4.25Å
136	K	92.9	Very high	85	Confident	13 Å²	13	37.6 Å²	37.6	6%	0.057	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	109.7	172.5	-57.3	-171.6	-160.4	162.2	0	109.6	L92 E102 Y103 K104 I134 V139 E195	L92-K136 HydrophobicContact CD1-CD 3.55Å; E102-K136 PolarHBondContact O-N 3.37Å; Y103-K136 HydrophobicContact CD1-CB 3.9Å; Y103-K136 HydrophobicContact CD1-CD 3.89Å; Y103-K136 HydrophobicContact CD1-CG 4.06Å; Y103-K136 HydrophobicContact CE1-CB 4.35Å; Y103-K136 HydrophobicContact CE1-CD 3.45Å; Y103-K136 VanDerWaalsContact CE1-CD 3.45Å; Y103-K136 HydrophobicContact CE1-CG 4.08Å; Y103-K136 PolarHBondContact OH-NZ 3.32Å; Y103-K136 VanDerWaalsContact OH-NZ 3.07Å; K104-K136 PolarHBondContact N-O 2.83Å; I134-K136 HydrophobicContact CG2-CG 4.5Å; K136-V139 HydrophobicContact CB-CB 4.27Å; K136-V139 HydrophobicContact CB-CG2 3.9Å; K136-E195 VanDerWaalsContact CE-OE1 3.26Å; K136-E195 WeakPolarHBondContact CE-OE1 3.19Å; K136-E195 HydrophobicContact CG-CB 4.35Å; K136-E195 HydrophobicContact CG-CG 4.02Å
137	L	93.5	Very high	85.1	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	137.8	-179	-55.2	-178	0	0	0	110.6	K104 L107 L148 L157 L160 A193 I194	K104-L137 HydrophobicContact CB-CD2 4.07Å; K104-L137 VanDerWaalsContact O-CA 3.31Å; K104-L137 WeakPolarHBondContact O-CA 3.42Å; L107-L137 HydrophobicContact CD1-CD2 3.75Å; L107-L137 HydrophobicContact CG-CD2 4.28Å; L137-L148 HydrophobicContact CB-CD1 4.25Å; L137-L157 HydrophobicContact CD1-CD2 3.81Å; L137-L157 HydrophobicContact CD1-CG 4.22Å; L137-L160 HydrophobicContact CD1-CD2 4.32Å; L137-A193 VanDerWaalsContact O-CA 3.3Å; L137-A193 WeakPolarHBondContact O-CA 3.31Å; L137-A193 WeakPolarHBondContact O-CB 3.3Å; L137-I194 HydrophobicContact CB-CG2 3.9Å; L137-I194 HydrophobicContact CD1-CG2 4.11Å; L137-I194 HydrophobicContact CG-CG2 4.29Å; L137-I194 PolarHBondContact N-O 2.87Å; L137-I194 PolarHBondContact O-N 3.41Å
138	G	91.4	Very high	85.5	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	79	25.2	-172.8	0	0	0	0	0	113.2	K104 R105 S146 G147	K104-G138 PolarHBondContact O-N 2.58Å; R105-G138 WeakPolarHBondContact O-CA 3.49Å; R105-G138 PolarHBondContact O-N 3.45Å; G138-S146 PolarHBondContact O-N 3.06Å; G138-S146 VanDerWaalsContact O-N 3.12Å; G138-G147 PolarHBondContact O-N 2.96Å
139	V	91.1	Very high	85.9	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	17%	0.168	C	C	.	.			trans	-125.1	132.5	175.7	-175.6	0	0	0	0	107.8	M88 L92 Y103 K104 R105 K136 H144 V145	M88-V139 HydrophobicContact CE-CG2 3.92Å; L92-V139 HydrophobicContact CD1-CG1 3.82Å; L92-V139 HydrophobicContact CD1-CG2 3.94Å; Y103-V139 HydrophobicContact CD2-CG1 3.71Å; Y103-V139 HydrophobicContact CE2-CG1 4.09Å; Y103-V139 HydrophobicContact CG-CG1 4.04Å; K104-V139 CarbonylContact C-O 3.54Å; R105-V139 WeakPolarHBondContact CA-O 3.36Å; R105-V139 PolarHBondContact N-O 3.43Å; K136-V139 HydrophobicContact CB-CB 4.27Å; K136-V139 HydrophobicContact CB-CG2 3.9Å; V139-H144 WeakPolarHBondContact CA-O 3.09Å; V139-V145 HydrophobicContact CG2-CG1 4.31Å; V139-V145 HydrophobicContact CG2-CG2 4.27Å
140	D	89.2	Confident	86.8	Confident	35 Å²	35	33.6 Å²	33.6	19%	0.187	18%	0.178	C	C	.	.			trans	-85.4	156.2	172.5	-70.2	-75.6	0	0	0	110.9	R105 D142 G143 H144 S146	R105-D140 WeakPolarHBondContact CB-OD1 3.44Å; R105-D140 WeakPolarHBondContact CD-OD1 3.06Å; R105-D140 IonicContact CZ-OD1 3.45Å; R105-D140 IonicContact NE-OD1 3.21Å; R105-D140 PolarHBondContact NE-OD1 3.31Å; D140-D142 PolarHBondContact O-N 3.42Å; D140-D142 VanDerWaalsContact O-N 3.07Å; D140-G143 WeakPolarHBondContact O-CA 3.21Å; D140-G143 PolarHBondContact O-N 2.83Å; D140-H144 PolarHBondContact N-O 3.31Å; D140-S146 VanDerWaalsContact OD2-CB 3.22Å; D140-S146 WeakPolarHBondContact OD2-CB 3.3Å; D140-S146 PolarHBondContact OD2-OG 2.8Å
141	D	87.9	Confident	87.8	Confident	96 Å²	96	36.6 Å²	36.6	51%	0.513	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-29	-169.8	-48.5	-1.4	0	0	0	112.6	E95 G143	E95-D141 PolarHBondContact N-O 2.79Å; D141-G143 PolarHBondContact O-N 2.92Å
142	D	87.1	Confident	88.9	Confident	139 Å²	139	38.9 Å²	38.9	74%	0.743	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.8	-5.8	173.1	-60.4	-42.3	0	0	0	114.6	D140	D140-D142 PolarHBondContact O-N 3.42Å; D140-D142 VanDerWaalsContact O-N 3.07Å
143	G	85.4	Confident	89.4	Confident	3 Å²	3	36.6 Å²	36.6	3%	0.031	20%	0.197	C	C	.	.	S	Bend	trans	88.3	5.2	-175	0	0	0	0	0	115	L92 D140 D141	L92-G143 PolarHBondContact N-O 3.47Å; D140-G143 WeakPolarHBondContact O-CA 3.21Å; D140-G143 PolarHBondContact O-N 2.83Å; D141-G143 PolarHBondContact O-N 2.92Å
144	H	87.1	Confident	89.6	Confident	124 Å²	124	41 Å²	41	57%	0.574	22%	0.22	S	C	*	.	B	Isolated β-bridge	trans	-75.4	128.5	175.6	-175.3	72.1	0	0	0	111.5	V139 D140 S146	V139-H144 WeakPolarHBondContact CA-O 3.09Å; D140-H144 PolarHBondContact N-O 3.31Å; H144-S146 PolarHBondContact O-N 3.29Å
145	V	86.8	Confident	89.7	Confident	11 Å²	11	41.2 Å²	41.2	7%	0.067	22%	0.224	C	C	.	.			trans	-91.2	87.9	-177.8	-170.1	0	0	0	0	109.5	M88 H90 L92 V139 I179 A193	M88-V145 HydrophobicContact CE-CG1 3.63Å; M88-V145 HydrophobicContact CE-CG2 3.97Å; H90-V145 WeakPolarHBondContact O-CG2 3.49Å; L92-V145 HydrophobicContact CD1-CG2 4.15Å; L92-V145 HydrophobicContact CG-CG2 4.38Å; V139-V145 HydrophobicContact CG2-CG1 4.31Å; V139-V145 HydrophobicContact CG2-CG2 4.27Å; V145-I179 HydrophobicContact CG1-CD1 4.22Å; V145-I179 WeakPolarHBondContact O-CD1 3.41Å; V145-A193 HydrophobicContact CG1-CB 3.42Å; V145-A193 VanDerWaalsContact CG1-CB 3.42Å
146	S	85.3	Confident	89.7	Confident	22 Å²	22	41.2 Å²	41.2	15%	0.154	22%	0.224	C	C	.	.			trans	-81.1	-23.6	-177.2	49.2	0	0	0	0	114.7	G138 D140 H144	G138-S146 PolarHBondContact O-N 3.06Å; G138-S146 VanDerWaalsContact O-N 3.12Å; D140-S146 VanDerWaalsContact OD2-CB 3.22Å; D140-S146 WeakPolarHBondContact OD2-CB 3.3Å; D140-S146 PolarHBondContact OD2-OG 2.8Å; H144-S146 PolarHBondContact O-N 3.29Å
147	G	87.3	Confident	89.7	Confident	8 Å²	8	41.8 Å²	41.8	8%	0.082	23%	0.228	C	C	.	.			trans	68.5	157.1	177.7	0	0	0	0	0	115.4	G138	G138-G147 PolarHBondContact O-N 2.96Å
148	L	89.5	Confident	89.7	Confident	3 Å²	3	44.4 Å²	44.4	2%	0.016	24%	0.244	C	C	.	.	B	Isolated β-bridge	trans	-110	148.8	179.4	-73.9	163.4	0	0	0	111.3	R105 K106 L137 E152 L153 R191 K192	R105-L148 WeakPolarHBondContact O-CD1 3.46Å; R105-L148 VanDerWaalsContact O-CD2 3.3Å; R105-L148 WeakPolarHBondContact O-CD2 3.22Å; R105-L148 WeakPolarHBondContact O-CG 3.44Å; K106-L148 HydrophobicContact CB-CD2 3.66Å; L137-L148 HydrophobicContact CB-CD1 4.25Å; L148-E152 HydrophobicContact CB-CB 4.32Å; L148-E152 HydrophobicContact CD2-CB 3.79Å; L148-L153 HydrophobicContact CB-CB 4.04Å; L148-L153 HydrophobicContact CD1-CD1 4.08Å; L148-R191 CarbonylContact O-C 3.56Å; L148-R191 WeakPolarHBondContact O-CA 3.48Å; L148-K192 PolarHBondContact N-O 3.35Å; L148-K192 PolarHBondContact O-N 2.91Å
149	R	89.4	Confident	89.9	Confident	76 Å²	76	44.4 Å²	44.4	29%	0.287	24%	0.244	S	C	.	.			trans	-65.7	153.2	165.3	-64.2	178.5	-179.3	-144.6	12.2	109.9	S151 E152 L153 D187 E189	R149-S151 VanDerWaalsContact C-N 3.26Å; R149-S151 PolarHBondContact O-N 3.37Å; R149-S151 VanDerWaalsContact O-N 3.15Å; R149-E152 HydrophobicContact CB-CB 4.49Å; R149-E152 HydrophobicContact CB-CG 4.22Å; R149-E152 PolarHBondContact N-OE2 2.96Å; R149-E152 PolarHBondContact O-N 3.1Å; R149-E152 VanDerWaalsContact O-N 3.08Å; R149-L153 WeakPolarHBondContact O-CB 3.36Å; R149-L153 PolarHBondContact O-N 2.91Å; R149-D187 IonicContact CZ-OD1 3.63Å; R149-D187 IonicContact CZ-OD2 3.96Å; R149-D187 IonicContact NE-OD2 2.8Å; R149-D187 IonicContact NH2-OD1 3.52Å; R149-D187 PolarHBondContact NH2-OD1 3.27Å; R149-D187 IonicContact NH2-OD2 3.77Å; R149-D187 PolarHBondContact NH2-OD2 3.21Å; R149-E189 VanDerWaalsContact CD-OE2 3.3Å; R149-E189 WeakPolarHBondContact CD-OE2 3.32Å; R149-E189 IonicContact CZ-OE2 3.88Å; R149-E189 IonicContact NE-OE2 3.26Å; R149-E189 IonicContact NH1-OE2 2.76Å; R149-E189 PolarHBondContact NH1-OE2 3.47Å
150	P	87.7	Confident	90	Very high	61 Å²	61	44.4 Å²	44.4	40%	0.396	24%	0.244	S	C	.	.	H	α-helix	trans	-54.6	-37.3	-178.1	-28.6	36.2	0	0	0	114.4	I154	P150-I154 WeakPolarHBondContact O-CD1 3.27Å; P150-I154 VanDerWaalsContact O-CG1 3.27Å; P150-I154 WeakPolarHBondContact O-CG1 3.3Å; P150-I154 PolarHBondContact O-N 3.21Å; P150-I154 VanDerWaalsContact O-N 3.09Å
151	S	89.1	Confident	90.2	Very high	76 Å²	76	45.9 Å²	45.9	53%	0.531	25%	0.249	S	C	.	.	H	α-helix	trans	-67.8	-44.3	175.7	49.8	0	0	0	0	113.2	R149 L153 I154 S155	R149-S151 VanDerWaalsContact C-N 3.26Å; R149-S151 PolarHBondContact O-N 3.37Å; R149-S151 VanDerWaalsContact O-N 3.15Å; S151-L153 VanDerWaalsContact C-N 3.32Å; S151-I154 PolarHBondContact O-N 2.83Å; S151-S155 WeakPolarHBondContact O-CB 3.45Å; S151-S155 PolarHBondContact O-N 3.43Å; S151-S155 PolarHBondContact O-OG 3.45Å
152	E	92.3	Very high	90.5	Very high	54 Å²	54	46.5 Å²	46.5	25%	0.252	24%	0.244	S	C	.	.	H	α-helix	trans	-66.2	-35.5	175.5	-63.3	-178	119	0	0	111.8	V108 L148 R149 S155 S156	V108-E152 HydrophobicContact CG2-CB 4.08Å; V108-E152 HydrophobicContact CG2-CG 4.41Å; L148-E152 HydrophobicContact CB-CB 4.32Å; L148-E152 HydrophobicContact CD2-CB 3.79Å; R149-E152 HydrophobicContact CB-CB 4.49Å; R149-E152 HydrophobicContact CB-CG 4.22Å; R149-E152 PolarHBondContact N-OE2 2.96Å; R149-E152 PolarHBondContact O-N 3.1Å; R149-E152 VanDerWaalsContact O-N 3.08Å; E152-S155 PolarHBondContact O-N 3.27Å; E152-S156 VanDerWaalsContact O-CB 3.26Å; E152-S156 WeakPolarHBondContact O-CB 3.32Å; E152-S156 PolarHBondContact O-N 3.47Å; E152-S156 PolarHBondContact O-OG 2.89Å
153	L	91.3	Very high	90.8	Very high	15 Å²	15	39.9 Å²	39.9	8%	0.079	21%	0.209	C	C	.	.	H	α-helix	trans	-65.3	-47.9	176.7	-178.9	62.3	0	0	0	111.3	L148 R149 S151 S155 S156 L157 K192 I194	L148-L153 HydrophobicContact CB-CB 4.04Å; L148-L153 HydrophobicContact CD1-CD1 4.08Å; R149-L153 WeakPolarHBondContact O-CB 3.36Å; R149-L153 PolarHBondContact O-N 2.91Å; S151-L153 VanDerWaalsContact C-N 3.32Å; L153-S155 VanDerWaalsContact C-N 3.32Å; L153-S155 PolarHBondContact O-N 2.87Å; L153-S156 PolarHBondContact O-N 3.26Å; L153-L157 HydrophobicContact CD1-CD1 4.24Å; L153-L157 HydrophobicContact CD1-CG 4.35Å; L153-L157 HydrophobicContact CG-CD1 4.08Å; L153-L157 WeakPolarHBondContact O-CB 3.33Å; L153-L157 WeakPolarHBondContact O-CG 3.25Å; L153-L157 PolarHBondContact O-N 3.25Å; L153-K192 HydrophobicContact CD2-CB 3.85Å; L153-K192 HydrophobicContact CD2-CD 4.3Å; L153-I194 HydrophobicContact CD1-CG2 3.66Å
154	I	91.7	Very high	91.1	Very high	93 Å²	93	39.8 Å²	39.8	48%	0.477	21%	0.208	S	C	.	.	H	α-helix	trans	-60.9	-42.6	175.4	-67.5	163.2	0	0	0	110.6	P150 S151 S156 L157 T158	P150-I154 WeakPolarHBondContact O-CD1 3.27Å; P150-I154 VanDerWaalsContact O-CG1 3.27Å; P150-I154 WeakPolarHBondContact O-CG1 3.3Å; P150-I154 PolarHBondContact O-N 3.21Å; P150-I154 VanDerWaalsContact O-N 3.09Å; S151-I154 PolarHBondContact O-N 2.83Å; I154-S156 VanDerWaalsContact C-N 3.32Å; I154-S156 PolarHBondContact O-N 3.22Å; I154-L157 PolarHBondContact O-N 3.26Å; I154-T158 WeakPolarHBondContact O-CB 3.4Å; I154-T158 WeakPolarHBondContact O-CG2 3.01Å; I154-T158 PolarHBondContact O-N 3.46Å; I154-T158 PolarHBondContact O-OG1 2.95Å
155	S	92.7	Very high	91.2	Very high	37 Å²	37	40 Å²	40	26%	0.259	21%	0.207	S	C	.	.	H	α-helix	trans	-66.8	-32.8	177.8	-52.9	0	0	0	0	112.7	S151 E152 L153 T158 T159	S151-S155 WeakPolarHBondContact O-CB 3.45Å; S151-S155 PolarHBondContact O-N 3.43Å; S151-S155 PolarHBondContact O-OG 3.45Å; E152-S155 PolarHBondContact O-N 3.27Å; L153-S155 VanDerWaalsContact C-N 3.32Å; L153-S155 PolarHBondContact O-N 2.87Å; S155-T158 WeakPolarHBondContact CA-OG1 3.42Å; S155-T158 PolarHBondContact O-OG1 3.34Å; S155-T158 VanDerWaalsContact O-OG1 3.1Å; S155-T159 WeakPolarHBondContact O-CB 3.24Å; S155-T159 PolarHBondContact O-N 3.1Å; S155-T159 PolarHBondContact O-OG1 3.03Å
156	S	95	Very high	91.3	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-74.2	-42.1	175	-61	0	0	0	0	112.1	L107 E152 L153 I154 T159 L160	L107-S156 PolarHBondContact N-OG 2.71Å; E152-S156 VanDerWaalsContact O-CB 3.26Å; E152-S156 WeakPolarHBondContact O-CB 3.32Å; E152-S156 PolarHBondContact O-N 3.47Å; E152-S156 PolarHBondContact O-OG 2.89Å; L153-S156 PolarHBondContact O-N 3.26Å; I154-S156 VanDerWaalsContact C-N 3.32Å; I154-S156 PolarHBondContact O-N 3.22Å; S156-T159 PolarHBondContact O-N 2.93Å; S156-L160 WeakPolarHBondContact O-CB 3.29Å; S156-L160 PolarHBondContact O-N 3.05Å
157	L	93.4	Very high	91.4	Very high	25 Å²	25	46.7 Å²	46.7	13%	0.131	23%	0.23	C	C	.	.	H	α-helix	trans	-66.2	-43	177	-75.5	170.7	0	0	0	112.1	L137 L153 I154 T159 L160 E161 I194 V196	L137-L157 HydrophobicContact CD1-CD2 3.81Å; L137-L157 HydrophobicContact CD1-CG 4.22Å; L153-L157 HydrophobicContact CD1-CD1 4.24Å; L153-L157 HydrophobicContact CD1-CG 4.35Å; L153-L157 HydrophobicContact CG-CD1 4.08Å; L153-L157 WeakPolarHBondContact O-CB 3.33Å; L153-L157 WeakPolarHBondContact O-CG 3.25Å; L153-L157 PolarHBondContact O-N 3.25Å; I154-L157 PolarHBondContact O-N 3.26Å; L157-T159 VanDerWaalsContact C-N 3.29Å; L157-T159 PolarHBondContact O-N 3.32Å; L157-L160 PolarHBondContact O-N 3.49Å; L157-E161 WeakPolarHBondContact O-CB 3.28Å; L157-E161 PolarHBondContact O-N 2.79Å; L157-I194 HydrophobicContact CD2-CG2 4.37Å; L157-V196 HydrophobicContact CD2-CG2 3.95Å
158	T	93.6	Very high	91.1	Very high	55 Å²	55	52.3 Å²	52.3	34%	0.337	26%	0.258	S	S	.	.	H	α-helix	trans	-64.7	-33.1	174.9	49.5	0	0	0	0	112.2	I154 S155 R162	I154-T158 WeakPolarHBondContact O-CB 3.4Å; I154-T158 WeakPolarHBondContact O-CG2 3.01Å; I154-T158 PolarHBondContact O-N 3.46Å; I154-T158 PolarHBondContact O-OG1 2.95Å; S155-T158 WeakPolarHBondContact CA-OG1 3.42Å; S155-T158 PolarHBondContact O-OG1 3.34Å; S155-T158 VanDerWaalsContact O-OG1 3.1Å; T158-R162 WeakPolarHBondContact O-CG 3.48Å; T158-R162 PolarHBondContact O-N 3.44Å
159	T	94.8	Very high	90.8	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-68.4	-44.8	171.1	-62.3	0	0	0	0	112.2	L107 P110 S155 S156 L157 E161 R162 M163	L107-T159 HydrophobicContact CB-CG2 4.22Å; L107-T159 WeakPolarHBondContact O-CB 3.48Å; L107-T159 WeakPolarHBondContact O-CG2 3.47Å; L107-T159 PolarHBondContact O-OG1 2.87Å; P110-T159 HydrophobicContact CG-CG2 3.63Å; S155-T159 WeakPolarHBondContact O-CB 3.24Å; S155-T159 PolarHBondContact O-N 3.1Å; S155-T159 PolarHBondContact O-OG1 3.03Å; S156-T159 PolarHBondContact O-N 2.93Å; L157-T159 VanDerWaalsContact C-N 3.29Å; L157-T159 PolarHBondContact O-N 3.32Å; T159-E161 VanDerWaalsContact C-N 3.27Å; T159-E161 PolarHBondContact O-N 3.04Å; T159-R162 WeakPolarHBondContact O-CB 3.4Å; T159-R162 PolarHBondContact O-N 3.2Å; T159-R162 PolarHBondContact OG1-NH2 3.38Å; T159-M163 HydrophobicContact CG2-SD 4.27Å; T159-M163 WeakPolarHBondContact O-CG 3.42Å; T159-M163 PolarHBondContact O-N 3.47Å
160	L	94.4	Very high	90.3	Very high	0 Å²	0	52 Å²	52	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-60.2	-38.2	174.3	-166.6	72.8	0	0	0	111.4	L107 M122 Y135 L137 S156 L157 M163 A164 L171 V196	L107-L160 HydrophobicContact CD1-CB 4.41Å; L107-L160 HydrophobicContact CD1-CD1 3.97Å; M122-L160 HydrophobicContact CE-CD1 3.38Å; M122-L160 HydrophobicContact CE-CG 3.96Å; Y135-L160 HydrophobicContact CD1-CD1 3.46Å; Y135-L160 VanDerWaalsContact CD1-CD1 3.46Å; Y135-L160 HydrophobicContact CD2-CD1 4.47Å; Y135-L160 HydrophobicContact CE1-CD1 3.8Å; Y135-L160 HydrophobicContact CG-CD1 3.84Å; L137-L160 HydrophobicContact CD1-CD2 4.32Å; S156-L160 WeakPolarHBondContact O-CB 3.29Å; S156-L160 PolarHBondContact O-N 3.05Å; L157-L160 PolarHBondContact O-N 3.49Å; L160-M163 HydrophobicContact CD1-CE 4.24Å; L160-M163 HydrophobicContact CD1-SD 4.5Å; L160-M163 WeakPolarHBondContact O-CB 3.41Å; L160-M163 PolarHBondContact O-N 3.48Å; L160-A164 WeakPolarHBondContact O-CB 3.34Å; L160-A164 PolarHBondContact O-N 2.86Å; L160-L171 HydrophobicContact CB-CD1 4.2Å; L160-L171 HydrophobicContact CD2-CD1 4.04Å; L160-L171 HydrophobicContact CD2-CD2 3.96Å; L160-L171 HydrophobicContact CG-CD1 4.02Å; L160-L171 HydrophobicContact CG-CD2 4.04Å; L160-V196 HydrophobicContact CD2-CB 4.14Å; L160-V196 HydrophobicContact CD2-CG1 4.04Å; L160-V196 HydrophobicContact CD2-CG2 4.49Å
161	E	92.9	Very high	90.1	Very high	66 Å²	66	51.2 Å²	51.2	31%	0.308	26%	0.258	S	S	.	.	H	α-helix	trans	-67.5	-39.3	176.6	-164.9	-168	164.7	0	0	111.8	L157 T159 M163 A164 K165 L171	L157-E161 WeakPolarHBondContact O-CB 3.28Å; L157-E161 PolarHBondContact O-N 2.79Å; T159-E161 VanDerWaalsContact C-N 3.27Å; T159-E161 PolarHBondContact O-N 3.04Å; E161-M163 VanDerWaalsContact C-N 3.35Å; E161-A164 PolarHBondContact O-N 2.58Å; E161-K165 HydrophobicContact CG-CD 4.38Å; E161-K165 WeakPolarHBondContact O-CB 3.36Å; E161-K165 VanDerWaalsContact O-CG 3.29Å; E161-K165 WeakPolarHBondContact O-CG 3.37Å; E161-K165 PolarHBondContact O-N 3.03Å; E161-K165 WeakPolarHBondContact OE1-CE 3.5Å; E161-K165 IonicContact OE1-NZ 2.62Å; E161-K165 PolarHBondContact OE1-NZ 3.42Å; E161-L171 HydrophobicContact CB-CD1 3.92Å; E161-L171 HydrophobicContact CG-CD1 4.38Å
162	R	93.3	Very high	89.6	Confident	108 Å²	108	51.3 Å²	51.3	41%	0.408	25%	0.25	S	C	.	.	H	α-helix	trans	-62.3	-40.9	171.7	-74	-176.9	-64.4	150	-7.6	111.9	F115 T158 T159 R166	F115-R162 HydrophobicContact CE2-CB 3.75Å; F115-R162 HydrophobicContact CZ-CB 3.84Å; T158-R162 WeakPolarHBondContact O-CG 3.48Å; T158-R162 PolarHBondContact O-N 3.44Å; T159-R162 WeakPolarHBondContact O-CB 3.4Å; T159-R162 PolarHBondContact O-N 3.2Å; T159-R162 PolarHBondContact OG1-NH2 3.38Å; R162-R166 PolarHBondContact O-N 3.25Å
163	M	93.9	Very high	89.1	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-64	-48.7	175.8	-66.6	161.8	50.7	0	0	111	F115 L118 V119 M122 Y135 T159 L160 E161 K165 R166 L167	F115-M163 HydrophobicContact CD2-CG 4.16Å; F115-M163 HydrophobicContact CE2-CG 3.65Å; F115-M163 HydrophobicContact CZ-CG 4.25Å; L118-M163 HydrophobicContact CB-CE 3.69Å; L118-M163 HydrophobicContact CB-CG 4.49Å; L118-M163 HydrophobicContact CB-SD 3.79Å; L118-M163 HydrophobicContact CD1-SD 4.33Å; L118-M163 WeakPolarHBondContact O-CE 3.38Å; V119-M163 HydrophobicContact CG2-CB 4.14Å; V119-M163 HydrophobicContact CG2-CG 3.99Å; M122-M163 HydrophobicContact CB-CE 4.04Å; M122-M163 HydrophobicContact CE-CB 3.87Å; M122-M163 HydrophobicContact CE-CE 3.77Å; M122-M163 HydrophobicContact SD-CB 3.8Å; M122-M163 HydrophobicContact SD-CE 4.3Å; Y135-M163 HydrophobicContact CE1-CE 4.41Å; T159-M163 HydrophobicContact CG2-SD 4.27Å; T159-M163 WeakPolarHBondContact O-CG 3.42Å; T159-M163 PolarHBondContact O-N 3.47Å; L160-M163 HydrophobicContact CD1-CE 4.24Å; L160-M163 HydrophobicContact CD1-SD 4.5Å; L160-M163 WeakPolarHBondContact O-CB 3.41Å; L160-M163 PolarHBondContact O-N 3.48Å; E161-M163 VanDerWaalsContact C-N 3.35Å; M163-K165 PolarHBondContact O-N 3.27Å; M163-R166 PolarHBondContact O-N 3.17Å; M163-R166 VanDerWaalsContact O-N 3.12Å; M163-L167 PolarHBondContact O-N 3.24Å
164	A	90.9	Very high	88.5	Confident	1 Å²	1	55 Å²	55	1%	0.008	28%	0.275	C	S	.	.	H	α-helix	trans	-61.3	-45	179.7	0	0	0	0	0	111.8	M122 L160 E161 R166 L167 N168 S169 L171 V198	M122-A164 HydrophobicContact CE-CB 4.37Å; M122-A164 HydrophobicContact SD-CB 4.25Å; L160-A164 WeakPolarHBondContact O-CB 3.34Å; L160-A164 PolarHBondContact O-N 2.86Å; E161-A164 PolarHBondContact O-N 2.58Å; A164-R166 VanDerWaalsContact C-N 3.26Å; A164-R166 PolarHBondContact O-N 3.09Å; A164-L167 CarbonylContact O-C 3.57Å; A164-L167 PolarHBondContact O-N 3.36Å; A164-N168 PolarHBondContact O-N 3.2Å; A164-S169 CarbonylContact C-O 3.57Å; A164-S169 WeakPolarHBondContact CB-O 3.24Å; A164-S169 WeakPolarHBondContact O-CB 3.39Å; A164-S169 PolarHBondContact O-N 2.85Å; A164-L171 HydrophobicContact CB-CD2 3.87Å; A164-L171 HydrophobicContact CB-CG 3.99Å; A164-V198 HydrophobicContact CB-CG1 4.41Å
165	K	89.5	Confident	88	Confident	129 Å²	129	54.2 Å²	54.2	56%	0.561	27%	0.266	S	S	*	.	H	α-helix	trans	-57.6	-35.6	174	-77.4	173.1	-178.1	168.8	0	113	E161 M163 L167 N168	E161-K165 HydrophobicContact CG-CD 4.38Å; E161-K165 WeakPolarHBondContact O-CB 3.36Å; E161-K165 VanDerWaalsContact O-CG 3.29Å; E161-K165 WeakPolarHBondContact O-CG 3.37Å; E161-K165 PolarHBondContact O-N 3.03Å; E161-K165 WeakPolarHBondContact OE1-CE 3.5Å; E161-K165 IonicContact OE1-NZ 2.62Å; E161-K165 PolarHBondContact OE1-NZ 3.42Å; M163-K165 PolarHBondContact O-N 3.27Å; K165-L167 PolarHBondContact O-N 2.87Å; K165-N168 PolarHBondContact O-N 3.32Å
166	R	88.8	Confident	87.7	Confident	143 Å²	143	54.5 Å²	54.5	54%	0.54	26%	0.263	S	S	.	.	H	α-helix	trans	-72.6	-16.1	178.2	-166.5	160.2	178.6	75.1	-12.9	113.5	E116 V119 R162 M163 A164	E116-R166 IonicContact OE1-CZ 3.41Å; E116-R166 VanDerWaalsContact OE1-CZ 3.28Å; E116-R166 IonicContact OE1-NE 2.86Å; E116-R166 PolarHBondContact OE1-NE 3.36Å; E116-R166 VanDerWaalsContact OE1-NE 3.14Å; E116-R166 IonicContact OE1-NH2 2.69Å; E116-R166 PolarHBondContact OE1-NH2 2.92Å; E116-R166 IonicContact OE2-CZ 3.8Å; E116-R166 IonicContact OE2-NE 2.77Å; E116-R166 PolarHBondContact OE2-NE 3.47Å; E116-R166 IonicContact OE2-NH2 3.27Å; V119-R166 HydrophobicContact CG1-CB 4.47Å; V119-R166 HydrophobicContact CG1-CG 4.21Å; V119-R166 HydrophobicContact CG2-CB 4.44Å; R162-R166 PolarHBondContact O-N 3.25Å; M163-R166 PolarHBondContact O-N 3.17Å; M163-R166 VanDerWaalsContact O-N 3.12Å; A164-R166 VanDerWaalsContact C-N 3.26Å; A164-R166 PolarHBondContact O-N 3.09Å
167	L	87.8	Confident	87.1	Confident	30 Å²	30	54.8 Å²	54.8	16%	0.157	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.6	11.3	175.4	-61.9	179.2	0	0	0	113.2	V119 M122 K123 L126 M163 A164 K165 S169 L200	V119-L167 HydrophobicContact CG1-CD1 4.49Å; V119-L167 HydrophobicContact CG1-CD2 3.77Å; V119-L167 HydrophobicContact CG1-CG 4.04Å; M122-L167 HydrophobicContact CB-CD1 3.81Å; M122-L167 HydrophobicContact CG-CD1 3.67Å; M122-L167 HydrophobicContact SD-CD1 3.84Å; K123-L167 HydrophobicContact CB-CD1 3.9Å; K123-L167 HydrophobicContact CB-CD2 3.92Å; K123-L167 HydrophobicContact CD-CD2 4.25Å; K123-L167 HydrophobicContact CG-CD2 4.24Å; L126-L167 HydrophobicContact CD1-CD1 3.95Å; M163-L167 PolarHBondContact O-N 3.24Å; A164-L167 CarbonylContact O-C 3.57Å; A164-L167 PolarHBondContact O-N 3.36Å; K165-L167 PolarHBondContact O-N 2.87Å; L167-S169 VanDerWaalsContact C-N 3.33Å; L167-S169 PolarHBondContact O-N 2.92Å; L167-S169 PolarHBondContact O-OG 3.27Å; L167-L200 WeakPolarHBondContact O-CD1 3.47Å
168	N	81.9	Confident	86.7	Confident	127 Å²	127	56.9 Å²	56.9	68%	0.679	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.8	53.6	-169.4	-63.6	-13.2	0	0	0	111.7	A164 K165 A201	A164-N168 PolarHBondContact O-N 3.2Å; K165-N168 PolarHBondContact O-N 3.32Å; N168-A201 WeakPolarHBondContact O-CA 3.28Å; N168-A201 WeakPolarHBondContact O-CB 3.25Å; N168-A201 PolarHBondContact O-N 2.78Å
169	S	82.2	Confident	86	Confident	11 Å²	11	56.3 Å²	56.3	8%	0.077	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	146.5	-178.9	-61.5	0	0	0	0	111.7	L126 A164 L167 R199	L126-S169 WeakPolarHBondContact CD1-OG 3.49Å; A164-S169 CarbonylContact C-O 3.57Å; A164-S169 WeakPolarHBondContact CB-O 3.24Å; A164-S169 WeakPolarHBondContact O-CB 3.39Å; A164-S169 PolarHBondContact O-N 2.85Å; L167-S169 VanDerWaalsContact C-N 3.33Å; L167-S169 PolarHBondContact O-N 2.92Å; L167-S169 PolarHBondContact O-OG 3.27Å; S169-R199 CarbonylContact C-O 3.57Å; S169-R199 WeakPolarHBondContact CA-O 3.47Å; S169-R199 WeakPolarHBondContact CB-O 3.33Å
170	T	78.6	Confident	84.8	Confident	60 Å²	60	64 Å²	64	37%	0.368	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	156.9	173.5	61.6	0	0	0	0	111.1	H172 V198 R199	T170-H172 PolarHBondContact OG1-NE2 2.84Å; T170-V198 WeakPolarHBondContact O-CA 3.27Å; T170-R199 PolarHBondContact N-O 3.02Å; T170-R199 PolarHBondContact O-N 2.78Å
171	L	83.5	Confident	83.4	Confident	45 Å²	45	67.1 Å²	67.1	24%	0.236	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	131.7	174.9	-63.7	-177.1	0	0	0	110.4	L160 E161 A164 V196 V198	L160-L171 HydrophobicContact CB-CD1 4.2Å; L160-L171 HydrophobicContact CD2-CD1 4.04Å; L160-L171 HydrophobicContact CD2-CD2 3.96Å; L160-L171 HydrophobicContact CG-CD1 4.02Å; L160-L171 HydrophobicContact CG-CD2 4.04Å; E161-L171 HydrophobicContact CB-CD1 3.92Å; E161-L171 HydrophobicContact CG-CD1 4.38Å; A164-L171 HydrophobicContact CB-CD2 3.87Å; A164-L171 HydrophobicContact CB-CG 3.99Å; L171-V196 HydrophobicContact CB-CG1 4Å; L171-V196 HydrophobicContact CD2-CG1 4.05Å; L171-V196 HydrophobicContact CG-CG1 4.46Å; L171-V198 HydrophobicContact CD2-CB 4.16Å; L171-V198 HydrophobicContact CD2-CG1 4.06Å; L171-V198 HydrophobicContact CD2-CG2 3.71Å
172	H	79.5	Confident	81.8	Confident	79 Å²	79	68.4 Å²	68.4	37%	0.366	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	108.4	175.8	-59.4	-87.4	0	0	0	109.1	T170 L174 L197	T170-H172 PolarHBondContact OG1-NE2 2.84Å; H172-L174 PolarHBondContact O-N 3.25Å; H172-L197 HydrophobicContact CB-CB 4.42Å; H172-L197 PolarHBondContact N-O 3.37Å; H172-L197 PolarHBondContact O-N 2.83Å
173	P	81.6	Confident	80.1	Confident	80 Å²	80	70.4 Å²	70.4	52%	0.519	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.8	131.4	173.4	27.4	-33.3	0	0	0	109.7	I194	P173-I194 HydrophobicContact CB-CD1 3.95Å
174	L	78.3	Confident	78.5	Confident	66 Å²	66	78 Å²	78	35%	0.346	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	-53.5	-178.9	-66.3	-172.9	0	0	0	112	H172 E195 L197	H172-L174 PolarHBondContact O-N 3.25Å; L174-E195 HydrophobicContact CB-CG 4.33Å; L174-E195 HydrophobicContact CD1-CG 4.26Å; L174-E195 PolarHBondContact N-O 2.88Å; L174-L197 HydrophobicContact CD1-CB 3.86Å; L174-L197 HydrophobicContact CD2-CB 3.82Å; L174-L197 HydrophobicContact CD2-CD2 4.11Å; L174-L197 HydrophobicContact CG-CB 3.73Å
175	R	82.4	Confident	76.9	Confident	77 Å²	77	80.4 Å²	80.4	29%	0.291	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	148.7	-172.6	-65.3	-170.8	-72.4	-162.3	-9.3	110.7	T86 M88 I194 E195	T86-R175 WeakPolarHBondContact O-CG 3.48Å; T86-R175 WeakPolarHBondContact OG1-CD 3.42Å; T86-R175 WeakPolarHBondContact OG1-CG 3.28Å; M88-R175 HydrophobicContact CB-CB 3.93Å; R175-I194 WeakPolarHBondContact O-CA 3.33Å; R175-I194 WeakPolarHBondContact O-CG1 3.44Å; R175-E195 HydrophobicContact CB-CB 4.34Å; R175-E195 IonicContact CZ-OE2 2.82Å; R175-E195 PolarHBondContact N-O 3.47Å; R175-E195 IonicContact NE-OE2 2.65Å; R175-E195 PolarHBondContact NE-OE2 2.89Å; R175-E195 IonicContact NH2-OE1 3.75Å; R175-E195 PolarHBondContact NH2-OE1 3.3Å; R175-E195 IonicContact NH2-OE2 3.58Å; R175-E195 PolarHBondContact NH2-OE2 2.9Å; R175-E195 PolarHBondContact O-N 3.28Å
176	E	84.9	Confident	75.3	Confident	43 Å²	43	80 Å²	80	20%	0.201	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	147.4	173	-166.2	-179.3	144	0	0	109.1	I84 M88 K192 A193	I84-E176 HydrophobicContact CD1-CB 4.12Å; M88-E176 PolarHBondContact N-O 2.85Å; M88-E176 VanDerWaalsContact N-O 3.14Å; E176-K192 VanDerWaalsContact OE1-CD 3.23Å; E176-K192 WeakPolarHBondContact OE1-CD 3.47Å; E176-K192 WeakPolarHBondContact OE1-CE 3.15Å; E176-K192 IonicContact OE1-NZ 3.74Å; E176-K192 PolarHBondContact OE1-NZ 3.48Å; E176-A193 WeakPolarHBondContact CA-O 3.27Å
177	C	83.8	Confident	73.9	Confident	6 Å²	6	74.8 Å²	74.8	4%	0.041	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	133.3	166.1	177.7	0	0	0	0	108.4	M88 H90 K192 A193	M88-C177 HydrophobicContact CB-CB 3.98Å; M88-C177 HydrophobicContact CE-CB 4.18Å; H90-C177 PolarHBondContact CE1-SG 3.37Å; H90-C177 PolarHBondContact ND1-SG 3.09Å; H90-C177 VanDerWaalsContact ND1-SG 3.45Å; C177-K192 WeakPolarHBondContact O-CA 3.46Å; C177-A193 PolarHBondContact N-O 3.39Å; C177-A193 PolarHBondContact O-N 2.84Å
178	V	83.9	Confident	72.6	Confident	68 Å²	68	82.9 Å²	82.9	41%	0.412	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	127.6	174.6	-175.5	0	0	0	0	107.4	C190 K192	V178-C190 WeakPolarHBondContact CG1-SG 3.27Å; V178-K192 HydrophobicContact CG2-CG 4.45Å
179	I	79.8	Confident	72	Confident	43 Å²	43	81.4 Å²	81.4	22%	0.221	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	113.1	176.9	-54	172.4	0	0	0	107.1	V145 R191	V145-I179 HydrophobicContact CG1-CD1 4.22Å; V145-I179 WeakPolarHBondContact O-CD1 3.41Å; I179-R191 HydrophobicContact CB-CB 4.31Å; I179-R191 PolarHBondContact N-O 3.45Å; I179-R191 PolarHBondContact O-N 3.33Å
180	E	69.9	Low	71.8	Confident	162 Å²	162	83.4 Å²	83.4	76%	0.757	46%	0.455	S	S	*	.			trans	-69	140.1	174.5	-66.1	-178.8	-177.4	0	0	110.1	T182	E180-T182 PolarHBondContact O-N 2.81Å; E180-T182 VanDerWaalsContact O-N 3.13Å
181	P	63.8	Low	72.2	Confident	65 Å²	65	84.5 Å²	84.5	42%	0.422	45%	0.452	S	S	.	.			trans	-66.6	114.6	-179	26.9	-33.3	0	0	0	110
182	T	60.6	Low	72.4	Confident	93 Å²	93	85.4 Å²	85.4	57%	0.571	45%	0.454	S	S	*	.			trans	-63.7	141.5	170.8	54.8	0	0	0	0	110	E180 I184 S185	E180-T182 PolarHBondContact O-N 2.81Å; E180-T182 VanDerWaalsContact O-N 3.13Å; T182-I184 PolarHBondContact O-N 2.79Å; T182-S185 PolarHBondContact O-N 2.85Å; T182-S185 VanDerWaalsContact O-N 3.16Å; T182-S185 PolarHBondContact O-OG 3.28Å
183	T	56.6	Low	72.9	Confident	151 Å²	151	81.7 Å²	81.7	93%	0.926	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-1.1	-176.6	47.8	0	0	0	0	115.6
184	I	60.3	Low	73.4	Confident	159 Å²	159	78.5 Å²	78.5	82%	0.815	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.3	-21.9	-175	-55	172.2	0	0	0	111.5	T182	T182-I184 PolarHBondContact O-N 2.79Å
185	S	57.6	Low	74	Confident	52 Å²	52	75.6 Å²	75.6	36%	0.364	40%	0.4	S	S	.	.	S	Bend	trans	-90.3	133.6	179.2	51.8	0	0	0	0	112.1	T182 D187	T182-S185 PolarHBondContact O-N 2.85Å; T182-S185 VanDerWaalsContact O-N 3.16Å; T182-S185 PolarHBondContact O-OG 3.28Å; S185-D187 PolarHBondContact O-N 2.72Å; S185-D187 VanDerWaalsContact O-N 3.09Å
186	S	55.9	Low	74.3	Confident	119 Å²	119	72.1 Å²	72.1	83%	0.832	39%	0.387	S	S	*	.	S	Bend	trans	-61.1	-16.6	176.7	54.9	0	0	0	0	114.7	K188	S186-K188 PolarHBondContact O-N 3.15Å
187	D	58.9	Low	74.4	Confident	35 Å²	35	70.7 Å²	70.7	19%	0.187	38%	0.381	C	S	.	.			trans	-80.5	103.9	176.2	-76.9	-4.4	0	0	0	110.6	R149 S185 E189 R191	R149-D187 IonicContact CZ-OD1 3.63Å; R149-D187 IonicContact CZ-OD2 3.96Å; R149-D187 IonicContact NE-OD2 2.8Å; R149-D187 IonicContact NH2-OD1 3.52Å; R149-D187 PolarHBondContact NH2-OD1 3.27Å; R149-D187 IonicContact NH2-OD2 3.77Å; R149-D187 PolarHBondContact NH2-OD2 3.21Å; S185-D187 PolarHBondContact O-N 2.72Å; S185-D187 VanDerWaalsContact O-N 3.09Å; D187-E189 PolarHBondContact O-N 3.04Å; D187-R191 IonicContact OD2-CZ 2.79Å; D187-R191 IonicContact OD2-NE 3.45Å; D187-R191 IonicContact OD2-NH2 3.44Å; D187-R191 PolarHBondContact OD2-NH2 3.03Å
188	K	61.1	Low	74.5	Confident	199 Å²	199	70.4 Å²	70.4	87%	0.865	38%	0.379	S	S	*	.			trans	-72.8	4.3	169.9	-65.1	-176	177.8	-179.2	0	113.8	S186	S186-K188 PolarHBondContact O-N 3.15Å
189	E	69.8	Low	74	Confident	96 Å²	96	70.3 Å²	70.3	45%	0.449	37%	0.371	S	S	.	.	S	Bend	trans	-93.1	130.1	-174.6	-67.9	-172.9	150.9	0	0	111.9	R149 D187 R191	R149-E189 VanDerWaalsContact CD-OE2 3.3Å; R149-E189 WeakPolarHBondContact CD-OE2 3.32Å; R149-E189 IonicContact CZ-OE2 3.88Å; R149-E189 IonicContact NE-OE2 3.26Å; R149-E189 IonicContact NH1-OE2 2.76Å; R149-E189 PolarHBondContact NH1-OE2 3.47Å; D187-E189 PolarHBondContact O-N 3.04Å; E189-R191 PolarHBondContact O-N 3.27Å
190	C	78	Confident	73.6	Confident	54 Å²	54	71.1 Å²	71.1	37%	0.365	38%	0.376	S	S	.	.	P	Polyproline II helix	trans	-61.8	127.6	172.9	177.8	0	0	0	0	111	V178	V178-C190 WeakPolarHBondContact CG1-SG 3.27Å
191	R	86.1	Confident	73.1	Confident	83 Å²	83	65 Å²	65	31%	0.313	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	150.7	179.6	-64.6	-174.8	-176.8	-179.1	2	111	L148 I179 D187 E189	L148-R191 CarbonylContact O-C 3.56Å; L148-R191 WeakPolarHBondContact O-CA 3.48Å; I179-R191 HydrophobicContact CB-CB 4.31Å; I179-R191 PolarHBondContact N-O 3.45Å; I179-R191 PolarHBondContact O-N 3.33Å; D187-R191 IonicContact OD2-CZ 2.79Å; D187-R191 IonicContact OD2-NE 3.45Å; D187-R191 IonicContact OD2-NH2 3.44Å; D187-R191 PolarHBondContact OD2-NH2 3.03Å; E189-R191 PolarHBondContact O-N 3.27Å
192	K	88.7	Confident	72.6	Confident	64 Å²	64	63.6 Å²	63.6	28%	0.278	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	136.2	-175.6	-71	179.7	167.1	-135.2	0	111.4	L148 L153 E176 C177 V178	L148-K192 PolarHBondContact N-O 3.35Å; L148-K192 PolarHBondContact O-N 2.91Å; L153-K192 HydrophobicContact CD2-CB 3.85Å; L153-K192 HydrophobicContact CD2-CD 4.3Å; E176-K192 VanDerWaalsContact OE1-CD 3.23Å; E176-K192 WeakPolarHBondContact OE1-CD 3.47Å; E176-K192 WeakPolarHBondContact OE1-CE 3.15Å; E176-K192 IonicContact OE1-NZ 3.74Å; E176-K192 PolarHBondContact OE1-NZ 3.48Å; C177-K192 WeakPolarHBondContact O-CA 3.46Å; V178-K192 HydrophobicContact CG2-CG 4.45Å
193	A	89.9	Confident	72.5	Confident	0 Å²	0	63.1 Å²	63.1	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	144.5	168	0	0	0	0	0	109.2	M88 L137 V145 E176 C177	M88-A193 HydrophobicContact CE-CB 3.72Å; L137-A193 VanDerWaalsContact O-CA 3.3Å; L137-A193 WeakPolarHBondContact O-CA 3.31Å; L137-A193 WeakPolarHBondContact O-CB 3.3Å; V145-A193 HydrophobicContact CG1-CB 3.42Å; V145-A193 VanDerWaalsContact CG1-CB 3.42Å; E176-A193 WeakPolarHBondContact CA-O 3.27Å; C177-A193 PolarHBondContact N-O 3.39Å; C177-A193 PolarHBondContact O-N 2.84Å
194	I	91.8	Very high	72.4	Confident	13 Å²	13	62.5 Å²	62.5	7%	0.067	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	140.2	-175.8	-165.5	173.5	0	0	0	110.9	L137 L153 L157 P173 R175 V196	L137-I194 HydrophobicContact CB-CG2 3.9Å; L137-I194 HydrophobicContact CD1-CG2 4.11Å; L137-I194 HydrophobicContact CG-CG2 4.29Å; L137-I194 PolarHBondContact N-O 2.87Å; L137-I194 PolarHBondContact O-N 3.41Å; L153-I194 HydrophobicContact CD1-CG2 3.66Å; L157-I194 HydrophobicContact CD2-CG2 4.37Å; P173-I194 HydrophobicContact CB-CD1 3.95Å; R175-I194 WeakPolarHBondContact O-CA 3.33Å; R175-I194 WeakPolarHBondContact O-CG1 3.44Å; I194-V196 HydrophobicContact CD1-CG2 4.23Å; I194-V196 HydrophobicContact CG1-CG2 4.09Å; I194-V196 HydrophobicContact CG2-CG2 4.04Å
195	E	90.3	Very high	72.9	Confident	6 Å²	6	56.1 Å²	56.1	3%	0.028	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	125.9	170.6	-176.5	174.1	-138.5	0	0	109	M88 I134 Y135 K136 L174 R175	M88-E195 HydrophobicContact SD-CB 4.15Å; I134-E195 HydrophobicContact CG2-CG 3.49Å; I134-E195 VanDerWaalsContact CG2-CG 3.49Å; I134-E195 WeakPolarHBondContact CG2-OE1 3.33Å; Y135-E195 CarbonylContact O-C 3.58Å; Y135-E195 WeakPolarHBondContact O-CA 3.26Å; K136-E195 VanDerWaalsContact CE-OE1 3.26Å; K136-E195 WeakPolarHBondContact CE-OE1 3.19Å; K136-E195 HydrophobicContact CG-CB 4.35Å; K136-E195 HydrophobicContact CG-CG 4.02Å; L174-E195 HydrophobicContact CB-CG 4.33Å; L174-E195 HydrophobicContact CD1-CG 4.26Å; L174-E195 PolarHBondContact N-O 2.88Å; R175-E195 HydrophobicContact CB-CB 4.34Å; R175-E195 IonicContact CZ-OE2 2.82Å; R175-E195 PolarHBondContact N-O 3.47Å; R175-E195 IonicContact NE-OE2 2.65Å; R175-E195 PolarHBondContact NE-OE2 2.89Å; R175-E195 IonicContact NH2-OE1 3.75Å; R175-E195 PolarHBondContact NH2-OE1 3.3Å; R175-E195 IonicContact NH2-OE2 3.58Å; R175-E195 PolarHBondContact NH2-OE2 2.9Å; R175-E195 PolarHBondContact O-N 3.28Å
196	V	89.9	Confident	73.6	Confident	3 Å²	3	58.6 Å²	58.6	2%	0.018	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	123.1	-173.9	-175.1	0	0	0	0	109.5	Y135 L157 L160 L171 I194 V198	Y135-V196 PolarHBondContact N-O 3.42Å; Y135-V196 PolarHBondContact O-N 2.86Å; L157-V196 HydrophobicContact CD2-CG2 3.95Å; L160-V196 HydrophobicContact CD2-CB 4.14Å; L160-V196 HydrophobicContact CD2-CG1 4.04Å; L160-V196 HydrophobicContact CD2-CG2 4.49Å; L171-V196 HydrophobicContact CB-CG1 4Å; L171-V196 HydrophobicContact CD2-CG1 4.05Å; L171-V196 HydrophobicContact CG-CG1 4.46Å; I194-V196 HydrophobicContact CD1-CG2 4.23Å; I194-V196 HydrophobicContact CG1-CG2 4.09Å; I194-V196 HydrophobicContact CG2-CG2 4.04Å; V196-V198 PolarHBondContact O-N 3.33Å
197	L	85.7	Confident	74.4	Confident	14 Å²	14	53.1 Å²	53.1	7%	0.073	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	110.4	172.3	179.2	60.3	0	0	0	109.9	K132 I134 H172 L174 R199	K132-L197 HydrophobicContact CB-CD1 4.16Å; I134-L197 HydrophobicContact CG1-CD1 3.83Å; H172-L197 HydrophobicContact CB-CB 4.42Å; H172-L197 PolarHBondContact N-O 3.37Å; H172-L197 PolarHBondContact O-N 2.83Å; L174-L197 HydrophobicContact CD1-CB 3.86Å; L174-L197 HydrophobicContact CD2-CB 3.82Å; L174-L197 HydrophobicContact CD2-CD2 4.11Å; L174-L197 HydrophobicContact CG-CB 3.73Å; L197-R199 HydrophobicContact CD2-CG 4.21Å; L197-R199 HydrophobicContact CG-CG 3.93Å
198	V	86	Confident	75.5	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	126.4	164.5	-164.8	0	0	0	0	107.6	M122 L126 K132 A133 Y135 A164 T170 L171 V196	M122-V198 HydrophobicContact CE-CG1 4.09Å; M122-V198 HydrophobicContact CE-CG2 3.84Å; M122-V198 HydrophobicContact CG-CG1 4.4Å; M122-V198 HydrophobicContact SD-CG1 4.08Å; L126-V198 HydrophobicContact CD1-CG1 4.14Å; L126-V198 HydrophobicContact CD2-CB 4.23Å; L126-V198 HydrophobicContact CD2-CG1 4.01Å; L126-V198 HydrophobicContact CG-CG1 4.39Å; K132-V198 CarbonylContact C-O 3.54Å; K132-V198 WeakPolarHBondContact CA-O 3.25Å; A133-V198 HydrophobicContact CB-CB 4.29Å; A133-V198 PolarHBondContact N-O 2.94Å; A133-V198 WeakPolarHBondContact O-CA 3.38Å; A133-V198 WeakPolarHBondContact O-CB 3.34Å; A133-V198 PolarHBondContact O-N 3.37Å; Y135-V198 HydrophobicContact CD2-CG2 3.46Å; Y135-V198 VanDerWaalsContact CD2-CG2 3.46Å; Y135-V198 HydrophobicContact CE2-CG2 3.93Å; Y135-V198 HydrophobicContact CG-CG2 4.25Å; A164-V198 HydrophobicContact CB-CG1 4.41Å; T170-V198 WeakPolarHBondContact O-CA 3.27Å; L171-V198 HydrophobicContact CD2-CB 4.16Å; L171-V198 HydrophobicContact CD2-CG1 4.06Å; L171-V198 HydrophobicContact CD2-CG2 3.71Å; V196-V198 PolarHBondContact O-N 3.33Å
199	R	72.8	Confident	76.7	Confident	65 Å²	65	43.6 Å²	43.6	25%	0.245	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	134.1	169.4	-61.7	-173.9	176.8	179.9	-0.8	108.4	G131 S169 T170 L197 A201	G131-R199 WeakPolarHBondContact O-CA 3.48Å; S169-R199 CarbonylContact C-O 3.57Å; S169-R199 WeakPolarHBondContact CA-O 3.47Å; S169-R199 WeakPolarHBondContact CB-O 3.33Å; T170-R199 PolarHBondContact N-O 3.02Å; T170-R199 PolarHBondContact O-N 2.78Å; L197-R199 HydrophobicContact CD2-CG 4.21Å; L197-R199 HydrophobicContact CG-CG 3.93Å; R199-A201 PolarHBondContact O-N 2.98Å
200	L	71.5	Confident	77.6	Confident	60 Å²	60	39.5 Å²	39.5	31%	0.314	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.2	129.3	163.9	-169.3	69.8	0	0	0	107.2	G131 L167	G131-L200 PolarHBondContact O-N 2.9Å; L167-L200 WeakPolarHBondContact O-CD1 3.47Å
201	A	61	Low	78.2	Confident	33 Å²	33	37 Å²	37	27%	0.273	20%	0.202	S	C	.	.	P	Polyproline II helix	trans	-59.4	145.3	175.2	0	0	0	0	0	108.3	N168 R199 T203	N168-A201 WeakPolarHBondContact O-CA 3.28Å; N168-A201 WeakPolarHBondContact O-CB 3.25Å; N168-A201 PolarHBondContact O-N 2.78Å; R199-A201 PolarHBondContact O-N 2.98Å; A201-T203 PolarHBondContact O-N 3.08Å
202	P	53.2	Low	78.5	Confident	36 Å²	36	33.1 Å²	33.1	23%	0.234	19%	0.187	C	C	.	.	P	Polyproline II helix	trans	-47	127.9	175.7	10.2	-24.3	0	0	0	110.7	T204 V581 H582	P202-T204 PolarHBondContact O-N 2.98Å; P202-T204 VanDerWaalsContact O-N 3.17Å; P202-V581 VanDerWaalsContact CB-O 3.31Å; P202-V581 WeakPolarHBondContact CB-O 3.37Å; P202-H582 HydrophobicContact CB-CB 4.36Å; P202-H582 WeakPolarHBondContact CB-ND1 3.49Å
203	T	58.5	Low	78.8	Confident	83 Å²	83	30.1 Å²	30.1	51%	0.509	17%	0.174	S	C	.	.	P	Polyproline II helix	trans	-51.8	125.8	153.9	41.1	0	0	0	0	106.3	A201 N205	A201-T203 PolarHBondContact O-N 3.08Å; T203-N205 PolarHBondContact O-N 2.99Å
204	T	54.8	Low	79.1	Confident	139 Å²	139	30.2 Å²	30.2	85%	0.853	18%	0.175	S	C	*	.			trans	-47.9	114.1	-173.7	21.2	0	0	0	0	109.5	P202 D206	P202-T204 PolarHBondContact O-N 2.98Å; P202-T204 VanDerWaalsContact O-N 3.17Å; T204-D206 PolarHBondContact O-N 2.79Å
205	N	70.8	Confident	79.3	Confident	25 Å²	25	29.8 Å²	29.8	13%	0.134	17%	0.173	C	C	.	.			trans	-63.7	111.1	177.7	-176.5	-0.2	0	0	0	106.9	T203 G207 I584 Y586 Q589	T203-N205 PolarHBondContact O-N 2.99Å; N205-G207 PolarHBondContact O-N 3.49Å; N205-G207 PolarHBondContact OD1-N 2.95Å; N205-G207 VanDerWaalsContact OD1-N 3.14Å; N205-I584 PolarHBondContact ND2-O 3.46Å; N205-Y586 HydrophobicContact CB-CE2 4.16Å; N205-Y586 WeakPolarHBondContact O-CE2 3.27Å; N205-Q589 PolarHBondContact ND2-OE1 2.98Å; N205-Q589 PolarHBondContact OD1-NE2 3.15Å
206	D	70.3	Confident	79.5	Confident	103 Å²	103	29.6 Å²	29.6	55%	0.551	17%	0.172	S	C	*	.			trans	-66.6	-18.6	-178.2	70.4	-21.2	0	0	0	111.7	T204 S208 R518	T204-D206 PolarHBondContact O-N 2.79Å; D206-S208 WeakPolarHBondContact OD1-CB 3.5Å; D206-S208 PolarHBondContact OD1-N 3.41Å; D206-S208 PolarHBondContact OD1-OG 3.2Å; D206-S208 VanDerWaalsContact OD2-CB 3.3Å; D206-S208 WeakPolarHBondContact OD2-CB 3.48Å; D206-S208 PolarHBondContact OD2-OG 2.92Å; D206-R518 PolarHBondContact O-NH1 3.15Å
207	G	74.1	Confident	79.7	Confident	5 Å²	5	29.4 Å²	29.4	5%	0.052	17%	0.171	C	C	.	.			trans	74.7	27.3	-173.9	0	0	0	0	0	112.7	N205	N205-G207 PolarHBondContact O-N 3.49Å; N205-G207 PolarHBondContact OD1-N 2.95Å; N205-G207 VanDerWaalsContact OD1-N 3.14Å
208	S	82.2	Confident	79.9	Confident	30 Å²	30	28.9 Å²	28.9	21%	0.21	17%	0.169	C	C	.	.	P	Polyproline II helix	trans	-64.6	131.6	165.9	55	0	0	0	0	110.1	D206 Q589	D206-S208 WeakPolarHBondContact OD1-CB 3.5Å; D206-S208 PolarHBondContact OD1-N 3.41Å; D206-S208 PolarHBondContact OD1-OG 3.2Å; D206-S208 VanDerWaalsContact OD2-CB 3.3Å; D206-S208 WeakPolarHBondContact OD2-CB 3.48Å; D206-S208 PolarHBondContact OD2-OG 2.92Å; S208-Q589 VanDerWaalsContact O-CG 3.32Å; S208-Q589 WeakPolarHBondContact O-CG 3.09Å; S208-Q589 PolarHBondContact O-NE2 2.9Å
209	P	85.3	Confident	80	Confident	3 Å²	3	31.8 Å²	31.8	2%	0.019	18%	0.183	C	C	.	.	P	Polyproline II helix	trans	-74.1	149.5	-179.6	30	-35.2	0	0	0	111.5	L211 N457 M511 I514 K515	P209-L211 PolarHBondContact O-N 3.41Å; P209-L211 VanDerWaalsContact O-N 3.11Å; P209-N457 WeakPolarHBondContact CD-OD1 3.33Å; P209-N457 PolarHBondContact O-ND2 2.71Å; P209-M511 HydrophobicContact CG-CB 4.48Å; P209-I514 HydrophobicContact CB-CB 4.45Å; P209-I514 HydrophobicContact CB-CG2 3.7Å; P209-I514 HydrophobicContact CG-CG2 4.35Å; P209-K515 HydrophobicContact CG-CG 4.38Å
210	D	88.6	Confident	80.8	Confident	11 Å²	11	32.4 Å²	32.4	6%	0.059	19%	0.191	C	C	.	.	P	Polyproline II helix	trans	-59.5	116.1	178	-73.1	8.6	0	0	0	111.4	C212 R263 R545 H577 G588 Q589 S590	D210-C212 PolarHBondContact O-N 2.84Å; D210-R263 IonicContact OD2-NH2 3.48Å; D210-R263 PolarHBondContact OD2-NH2 3.35Å; D210-R545 PolarHBondContact O-NH2 3.01Å; D210-H577 IonicContact OD1-CE1 3.58Å; D210-H577 PolarHBondContact OD1-CE1 2.94Å; D210-G588 WeakPolarHBondContact CB-O 3.44Å; D210-G588 PolarHBondContact N-O 3.4Å; D210-G588 VanDerWaalsContact N-O 3.16Å; D210-Q589 WeakPolarHBondContact OD1-CA 3.48Å; D210-S590 PolarHBondContact OD1-N 3.14Å; D210-S590 WeakPolarHBondContact OD2-CB 3.3Å; D210-S590 PolarHBondContact OD2-N 3.4Å; D210-S590 PolarHBondContact OD2-OG 2.93Å
211	L	91.2	Very high	81.8	Confident	2 Å²	2	29.8 Å²	29.8	1%	0.01	18%	0.178	C	C	.	.			trans	-80	101.3	167	-172.9	47.1	0	0	0	109.5	P209 L300 T301 I325 L453 M511	P209-L211 PolarHBondContact O-N 3.41Å; P209-L211 VanDerWaalsContact O-N 3.11Å; L211-L300 HydrophobicContact CB-CD1 4.14Å; L211-L300 HydrophobicContact CD2-CD1 3.79Å; L211-L300 HydrophobicContact CG-CD1 3.56Å; L211-T301 PolarHBondContact O-N 3.17Å; L211-I325 HydrophobicContact CD1-CB 4.15Å; L211-I325 HydrophobicContact CD1-CD1 3.85Å; L211-I325 HydrophobicContact CD1-CG2 4.42Å; L211-L453 HydrophobicContact CD2-CD1 4.33Å; L211-L453 HydrophobicContact CD2-CG 3.91Å; L211-L453 VanDerWaalsContact CD2-O 3.3Å; L211-L453 WeakPolarHBondContact CD2-O 3.46Å; L211-M511 HydrophobicContact CB-CE 4.16Å; L211-M511 HydrophobicContact CD1-CE 3.49Å; L211-M511 VanDerWaalsContact CD1-CE 3.49Å; L211-M511 HydrophobicContact CD2-CE 3.63Å; L211-M511 HydrophobicContact CG-CE 3.92Å
212	C	92.8	Very high	83.2	Confident	1 Å²	1	28.8 Å²	28.8	1%	0.007	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	125.3	-176.4	-177.1	0	0	0	0	110.6	D210 P324 I325	D210-C212 PolarHBondContact O-N 2.84Å; C212-P324 CarbonylContact O-C 3.57Å; C212-P324 WeakPolarHBondContact O-CA 3.35Å; C212-I325 PolarHBondContact O-N 3.36Å
213	V	94.9	Very high	85.2	Confident	0 Å²	0	27.5 Å²	27.5	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	123.6	-179.3	-179.3	0	0	0	0	109.8	L300 T301 L302 L303 I326 I328 L453	V213-L300 HydrophobicContact CG2-CD1 3.7Å; V213-L300 HydrophobicContact CG2-CG 4.43Å; V213-T301 PolarHBondContact N-O 2.66Å; V213-L302 HydrophobicContact CB-CD2 4.29Å; V213-L303 PolarHBondContact O-N 3.12Å; V213-I326 WeakPolarHBondContact CA-O 3.36Å; V213-I326 HydrophobicContact CG1-CB 4.34Å; V213-I326 HydrophobicContact CG2-CB 4.3Å; V213-I326 HydrophobicContact CG2-CD1 4.43Å; V213-I328 HydrophobicContact CG1-CD1 3.5Å; V213-I328 VanDerWaalsContact CG1-CD1 3.5Å; V213-I328 HydrophobicContact CG1-CG1 3.6Å; V213-L453 HydrophobicContact CG2-CD2 4.09Å
214	A	95.5	Very high	86.9	Confident	3 Å²	3	24 Å²	24	3%	0.025	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	121.3	-177.7	0	0	0	0	0	111.7	L303 L305 P324 I326 G327 I328	A214-L303 HydrophobicContact CB-CD2 4.32Å; A214-L305 HydrophobicContact CB-CD1 3.75Å; A214-P324 HydrophobicContact CB-CB 3.56Å; A214-P324 HydrophobicContact CB-CG 3.7Å; A214-I326 PolarHBondContact N-O 3.46Å; A214-G327 CarbonylContact O-C 3.55Å; A214-G327 WeakPolarHBondContact O-CA 3.46Å; A214-I328 PolarHBondContact O-N 3.2Å
215	L	96.1	Very high	88.7	Confident	4 Å²	4	18.2 Å²	18.2	2%	0.021	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	117.8	171.5	-73.4	83.2	0	0	0	109.7	K223 L226 I227 L302 L303 L305 I328 V330	L215-K223 HydrophobicContact CB-CB 4.46Å; L215-K223 HydrophobicContact CB-CD 4.41Å; L215-K223 HydrophobicContact CB-CG 4.31Å; L215-K223 WeakPolarHBondContact O-CD 3.47Å; L215-L226 HydrophobicContact CD2-CD2 4.29Å; L215-I227 HydrophobicContact CB-CD1 4.34Å; L215-I227 HydrophobicContact CD1-CD1 3.86Å; L215-I227 HydrophobicContact CD1-CG1 3.9Å; L215-I227 HydrophobicContact CD2-CD1 3.82Å; L215-I227 HydrophobicContact CD2-CG1 3.47Å; L215-I227 VanDerWaalsContact CD2-CG1 3.47Å; L215-I227 HydrophobicContact CG-CD1 4.2Å; L215-I227 HydrophobicContact CG-CG1 4.24Å; L215-L302 HydrophobicContact CD1-CB 4.22Å; L215-L302 HydrophobicContact CD1-CD2 4.29Å; L215-L303 PolarHBondContact N-O 3.05Å; L215-L305 WeakPolarHBondContact O-CB 3.41Å; L215-L305 PolarHBondContact O-N 2.86Å; L215-I328 CarbonylContact C-O 3.55Å; L215-I328 WeakPolarHBondContact CA-O 3.42Å; L215-I328 HydrophobicContact CG-CB 4.23Å; L215-I328 HydrophobicContact CG-CG2 4.46Å; L215-V330 HydrophobicContact CB-CG2 4.38Å; L215-V330 HydrophobicContact CD2-CG2 3.95Å; L215-V330 HydrophobicContact CG-CG2 4.42Å
216	V	94.6	Very high	89.9	Confident	1 Å²	1	17.1 Å²	17.1	1%	0.006	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	160.8	177.5	-61.6	0	0	0	0	112	L305 I328 L329 V330 H344 I348	V216-L305 HydrophobicContact CG1-CD1 3.56Å; V216-I328 PolarHBondContact N-O 2.7Å; V216-L329 HydrophobicContact CG2-CB 4.23Å; V216-L329 HydrophobicContact CG2-CD1 3.9Å; V216-V330 PolarHBondContact O-N 2.85Å; V216-H344 HydrophobicContact CB-CB 3.79Å; V216-H344 HydrophobicContact CG1-CB 4.34Å; V216-H344 HydrophobicContact CG2-CB 3.92Å; V216-I348 HydrophobicContact CB-CD1 4.28Å; V216-I348 HydrophobicContact CG1-CD1 3.97Å; V216-I348 HydrophobicContact CG2-CD1 3.36Å
217	G	93.2	Very high	91.1	Very high	0 Å²	0	12.2 Å²	12.2	0%	0	7%	0.073	C	C	.	.			trans	145.6	167.8	176	0	0	0	0	0	111.8	K223 G307 H344	G217-K223 PolarHBondContact O-NZ 2.9Å; G217-G307 VanDerWaalsContact O-CA 3.25Å; G217-G307 WeakPolarHBondContact O-CA 3.28Å; G217-H344 PolarHBondContact N-ND1 3.39Å; G217-H344 VanDerWaalsContact N-ND1 3.2Å
218	G	91	Very high	92	Very high	2 Å²	2	12 Å²	12	2%	0.021	7%	0.071	C	C	.	.			trans	-65.8	179.4	-178.7	0	0	0	0	0	114.7	S221 K223 G307 S338	G218-S221 PolarHBondContact O-OG 3.23Å; G218-K223 PolarHBondContact O-NZ 2.75Å; G218-G307 CarbonylContact C-O 3.59Å; G218-S338 WeakPolarHBondContact CA-OG 3.49Å
219	M	88.5	Confident	92.6	Very high	62 Å²	62	10.9 Å²	10.9	31%	0.305	6%	0.063	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.5	151.2	169.7	-166.6	171.9	66.9	0	0	110	S221 R257 G307	M219-S221 PolarHBondContact O-N 2.77Å; M219-R257 HydrophobicContact SD-CG 4.2Å; M219-R257 PolarHBondContact SD-NE 3.46Å; M219-G307 PolarHBondContact N-O 2.6Å
220	D	88.9	Confident	93	Very high	77 Å²	77	11 Å²	11	41%	0.412	6%	0.063	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.4	8.2	177.2	-51.4	-43.9	0	0	0	117	G222 I335 K361	D220-G222 PolarHBondContact O-N 3.38Å; D220-I335 HydrophobicContact CB-CD1 3.83Å; D220-K361 WeakPolarHBondContact O-CE 3.45Å; D220-K361 PolarHBondContact O-NZ 3.02Å
221	S	92.6	Very high	93.2	Very high	5 Å²	5	10.5 Å²	10.5	4%	0.035	6%	0.06	C	C	.	.	S	Bend	trans	-71.5	-9.5	169.8	75.8	0	0	0	0	114.1	G218 M219 K223 V330 T360	G218-S221 PolarHBondContact O-OG 3.23Å; M219-S221 PolarHBondContact O-N 2.77Å; S221-K223 PolarHBondContact OG-NZ 3.32Å; S221-V330 WeakPolarHBondContact CB-O 3.34Å; S221-V330 WeakPolarHBondContact O-CG1 3.43Å; S221-V330 PolarHBondContact OG-O 2.9Å; S221-T360 PolarHBondContact O-OG1 3.5Å
222	G	91.4	Very high	93.2	Very high	12 Å²	12	10.7 Å²	10.7	12%	0.124	6%	0.061	C	C	.	.			trans	84.8	16.3	173.6	0	0	0	0	0	116.1	D220 S224 T225 L226	D220-G222 PolarHBondContact O-N 3.38Å; G222-S224 PolarHBondContact O-N 3.42Å; G222-T225 WeakPolarHBondContact O-CB 3.36Å; G222-T225 PolarHBondContact O-N 3.48Å; G222-L226 WeakPolarHBondContact O-CB 3.39Å; G222-L226 PolarHBondContact O-N 3.09Å
223	K	93.5	Very high	93	Very high	10 Å²	10	11.2 Å²	11.2	4%	0.043	7%	0.066	C	C	.	.	H	α-helix	trans	-45.3	-61.6	177.2	-68.6	177.3	-63.7	-62.6	0	114	L215 G217 G218 S221 T225 L226 I227 D304 L305 V330	L215-K223 HydrophobicContact CB-CB 4.46Å; L215-K223 HydrophobicContact CB-CD 4.41Å; L215-K223 HydrophobicContact CB-CG 4.31Å; L215-K223 WeakPolarHBondContact O-CD 3.47Å; G217-K223 PolarHBondContact O-NZ 2.9Å; G218-K223 PolarHBondContact O-NZ 2.75Å; S221-K223 PolarHBondContact OG-NZ 3.32Å; K223-T225 VanDerWaalsContact C-N 3.3Å; K223-T225 PolarHBondContact O-N 3.19Å; K223-L226 WeakPolarHBondContact O-CB 3.4Å; K223-L226 PolarHBondContact O-N 2.71Å; K223-L226 VanDerWaalsContact O-N 3.15Å; K223-I227 WeakPolarHBondContact O-CG1 3.2Å; K223-I227 PolarHBondContact O-N 2.94Å; K223-D304 WeakPolarHBondContact CB-OD1 3.4Å; K223-L305 WeakPolarHBondContact CE-O 3.46Å; K223-V330 HydrophobicContact CG-CB 3.74Å; K223-V330 HydrophobicContact CG-CG1 4.32Å; K223-V330 HydrophobicContact CG-CG2 3.78Å
224	S	94	Very high	92.8	Very high	8 Å²	8	14.4 Å²	14.4	6%	0.056	8%	0.081	C	C	.	.	H	α-helix	trans	-63.3	-36.7	-178.5	-38.7	0	0	0	0	112.1	G222 S228 L246 T258 D304	G222-S224 PolarHBondContact O-N 3.42Å; S224-S228 PolarHBondContact O-N 3.29Å; S224-S228 VanDerWaalsContact O-N 3.07Å; S224-L246 WeakPolarHBondContact O-CD1 3.08Å; S224-T258 PolarHBondContact OG-OG1 3.26Å; S224-D304 WeakPolarHBondContact CB-OD2 3.43Å; S224-D304 PolarHBondContact OG-OD2 2.85Å
225	T	94.1	Very high	92.6	Very high	18 Å²	18	18.1 Å²	18.1	11%	0.11	10%	0.101	C	C	.	.	H	α-helix	trans	-61.4	-48.1	173.2	-52	0	0	0	0	110.7	G222 K223 S228 V229 D236 A242	G222-T225 WeakPolarHBondContact O-CB 3.36Å; G222-T225 PolarHBondContact O-N 3.48Å; K223-T225 VanDerWaalsContact C-N 3.3Å; K223-T225 PolarHBondContact O-N 3.19Å; T225-S228 PolarHBondContact O-N 3.42Å; T225-V229 WeakPolarHBondContact O-CG2 3.4Å; T225-V229 PolarHBondContact O-N 3.06Å; T225-D236 HydrophobicContact CG2-CB 3.57Å; T225-A242 HydrophobicContact CG2-CB 4.15Å
226	L	94.9	Very high	92.5	Very high	2 Å²	2	18.6 Å²	18.6	1%	0.01	10%	0.103	C	C	.	.	H	α-helix	trans	-59.7	-50.7	178.1	179.7	63.6	0	0	0	110.9	L215 G222 K223 S228 V229 L230 V330 V358 V435 L446	L215-L226 HydrophobicContact CD2-CD2 4.29Å; G222-L226 WeakPolarHBondContact O-CB 3.39Å; G222-L226 PolarHBondContact O-N 3.09Å; K223-L226 WeakPolarHBondContact O-CB 3.4Å; K223-L226 PolarHBondContact O-N 2.71Å; K223-L226 VanDerWaalsContact O-N 3.15Å; L226-S228 VanDerWaalsContact C-N 3.33Å; L226-S228 PolarHBondContact O-N 3.09Å; L226-V229 PolarHBondContact O-N 3.34Å; L226-V229 VanDerWaalsContact O-N 3.16Å; L226-L230 HydrophobicContact CD1-CD2 4.15Å; L226-L230 HydrophobicContact CD1-CG 4.28Å; L226-L230 HydrophobicContact CG-CG 4.45Å; L226-L230 WeakPolarHBondContact O-CG 3.25Å; L226-L230 PolarHBondContact O-N 2.69Å; L226-V330 HydrophobicContact CD2-CG2 4.33Å; L226-V358 HydrophobicContact CD2-CG1 3.85Å; L226-V435 HydrophobicContact CD1-CG2 4.3Å; L226-L446 HydrophobicContact CD1-CD2 4.31Å; L226-L446 HydrophobicContact CD2-CD2 4.37Å
227	I	95.3	Very high	92.4	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-54.7	-49.3	178.6	-65	166	0	0	0	110.5	L215 K223 V229 L230 T231 L246 E264 L302 D304	L215-I227 HydrophobicContact CB-CD1 4.34Å; L215-I227 HydrophobicContact CD1-CD1 3.86Å; L215-I227 HydrophobicContact CD1-CG1 3.9Å; L215-I227 HydrophobicContact CD2-CD1 3.82Å; L215-I227 HydrophobicContact CD2-CG1 3.47Å; L215-I227 VanDerWaalsContact CD2-CG1 3.47Å; L215-I227 HydrophobicContact CG-CD1 4.2Å; L215-I227 HydrophobicContact CG-CG1 4.24Å; K223-I227 WeakPolarHBondContact O-CG1 3.2Å; K223-I227 PolarHBondContact O-N 2.94Å; I227-V229 PolarHBondContact O-N 2.9Å; I227-L230 PolarHBondContact O-N 3.17Å; I227-L230 VanDerWaalsContact O-N 3.15Å; I227-T231 HydrophobicContact CG2-CG2 4.11Å; I227-T231 WeakPolarHBondContact O-CG2 3.42Å; I227-T231 PolarHBondContact O-N 2.81Å; I227-T231 PolarHBondContact O-OG1 3.1Å; I227-T231 VanDerWaalsContact O-OG1 3.07Å; I227-L246 HydrophobicContact CB-CD1 3.73Å; I227-L246 HydrophobicContact CG2-CD1 3.69Å; I227-L246 HydrophobicContact CG2-CD2 4.4Å; I227-E264 HydrophobicContact CG2-CB 4.19Å; I227-E264 HydrophobicContact CG2-CG 4.05Å; I227-L302 HydrophobicContact CG2-CB 4.42Å; I227-L302 HydrophobicContact CG2-CD1 4.3Å; I227-D304 HydrophobicContact CD1-CB 3.46Å; I227-D304 VanDerWaalsContact CD1-CB 3.46Å
228	S	93.4	Very high	92.1	Very high	1 Å²	1	25.5 Å²	25.5	1%	0.007	15%	0.149	C	C	.	.	H	α-helix	trans	-60.3	-44	178.8	166.9	0	0	0	0	112.3	S224 T225 L226 L230 T231 D232 A242	S224-S228 PolarHBondContact O-N 3.29Å; S224-S228 VanDerWaalsContact O-N 3.07Å; T225-S228 PolarHBondContact O-N 3.42Å; L226-S228 VanDerWaalsContact C-N 3.33Å; L226-S228 PolarHBondContact O-N 3.09Å; S228-L230 VanDerWaalsContact C-N 3.29Å; S228-L230 PolarHBondContact O-N 3.49Å; S228-T231 WeakPolarHBondContact CA-OG1 3.41Å; S228-T231 PolarHBondContact O-N 3.19Å; S228-T231 PolarHBondContact O-OG1 3.17Å; S228-D232 WeakPolarHBondContact O-CB 3.4Å; S228-D232 PolarHBondContact O-N 3.18Å; S228-D232 PolarHBondContact OG-OD2 3.37Å; S228-A242 VanDerWaalsContact CB-O 3.29Å; S228-A242 WeakPolarHBondContact CB-O 3.26Å; S228-A242 WeakPolarHBondContact OG-CA 3.24Å; S228-A242 WeakPolarHBondContact OG-CB 3.44Å; S228-A242 PolarHBondContact OG-O 2.82Å
229	V	94.4	Very high	91.9	Very high	7 Å²	7	35.8 Å²	35.8	4%	0.042	19%	0.187	C	C	.	.	H	α-helix	trans	-60.2	-41	176.2	176.8	0	0	0	0	111.1	T225 L226 I227 G233 E234 L235 D236 A242 I443	T225-V229 WeakPolarHBondContact O-CG2 3.4Å; T225-V229 PolarHBondContact O-N 3.06Å; L226-V229 PolarHBondContact O-N 3.34Å; L226-V229 VanDerWaalsContact O-N 3.16Å; I227-V229 PolarHBondContact O-N 2.9Å; V229-G233 PolarHBondContact O-N 3.37Å; V229-E234 WeakPolarHBondContact CG2-O 3.41Å; V229-L235 HydrophobicContact CG1-CD2 3.88Å; V229-D236 HydrophobicContact CG2-CB 4.46Å; V229-A242 HydrophobicContact CG2-CB 4.03Å; V229-I443 HydrophobicContact CG1-CD1 3.58Å
230	L	94.2	Very high	91.6	Very high	6 Å²	6	33.1 Å²	33.1	3%	0.031	18%	0.175	C	C	.	.	H	α-helix	trans	-68.4	-34	177.1	-56.8	-166.2	0	0	0	112.8	L226 I227 S228 L266 L302 I443 L446 M447 L450	L226-L230 HydrophobicContact CD1-CD2 4.15Å; L226-L230 HydrophobicContact CD1-CG 4.28Å; L226-L230 HydrophobicContact CG-CG 4.45Å; L226-L230 WeakPolarHBondContact O-CG 3.25Å; L226-L230 PolarHBondContact O-N 2.69Å; I227-L230 PolarHBondContact O-N 3.17Å; I227-L230 VanDerWaalsContact O-N 3.15Å; S228-L230 VanDerWaalsContact C-N 3.29Å; S228-L230 PolarHBondContact O-N 3.49Å; L230-L266 WeakPolarHBondContact O-CD1 3.35Å; L230-L302 HydrophobicContact CD1-CD1 4.38Å; L230-I443 HydrophobicContact CD2-CG2 3.68Å; L230-L446 HydrophobicContact CD1-CD2 4.31Å; L230-M447 HydrophobicContact CB-SD 4.19Å; L230-M447 HydrophobicContact CD1-SD 3.91Å; L230-M447 HydrophobicContact CD2-CG 4.22Å; L230-M447 HydrophobicContact CD2-SD 3.64Å; L230-M447 HydrophobicContact CG-SD 4.08Å; L230-L450 HydrophobicContact CD1-CD1 3.78Å
231	T	93	Very high	91.7	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-94.1	-26.4	-174.2	60.1	0	0	0	0	114.7	I227 S228 E264 N276 L302	I227-T231 HydrophobicContact CG2-CG2 4.11Å; I227-T231 WeakPolarHBondContact O-CG2 3.42Å; I227-T231 PolarHBondContact O-N 2.81Å; I227-T231 PolarHBondContact O-OG1 3.1Å; I227-T231 VanDerWaalsContact O-OG1 3.07Å; S228-T231 WeakPolarHBondContact CA-OG1 3.41Å; S228-T231 PolarHBondContact O-N 3.19Å; S228-T231 PolarHBondContact O-OG1 3.17Å; T231-E264 HydrophobicContact CG2-CB 3.87Å; T231-N276 VanDerWaalsContact O-CB 3.23Å; T231-N276 WeakPolarHBondContact O-CB 3.46Å; T231-N276 PolarHBondContact O-ND2 3.49Å; T231-L302 HydrophobicContact CG2-CD1 4.46Å
232	D	90.4	Very high	91.6	Very high	6 Å²	6	33.6 Å²	33.6	3%	0.032	17%	0.173	C	C	.	.	H	α-helix	trans	-103.9	-24.8	-175.4	-58.5	-34.7	0	0	0	112.3	S228 E234 N245 V284 R286	S228-D232 WeakPolarHBondContact O-CB 3.4Å; S228-D232 PolarHBondContact O-N 3.18Å; S228-D232 PolarHBondContact OG-OD2 3.37Å; D232-E234 PolarHBondContact O-N 2.87Å; D232-N245 VanDerWaalsContact OD2-CB 3.28Å; D232-N245 WeakPolarHBondContact OD2-CB 3.34Å; D232-N245 PolarHBondContact OD2-ND2 3Å; D232-V284 WeakPolarHBondContact O-CG1 3.43Å; D232-R286 VanDerWaalsContact OD1-CD 3.28Å; D232-R286 WeakPolarHBondContact OD1-CD 3.49Å; D232-R286 IonicContact OD1-CZ 3.79Å; D232-R286 IonicContact OD1-NE 2.78Å; D232-R286 PolarHBondContact OD1-NE 3.32Å; D232-R286 IonicContact OD1-NH1 3.6Å; D232-R286 PolarHBondContact OD1-NH1 3.13Å; D232-R286 IonicContact OD2-NH1 2.73Å
233	G	88.6	Confident	91.6	Very high	11 Å²	11	36.2 Å²	36.2	11%	0.113	18%	0.179	C	C	.	.			trans	79	1.3	-179.2	0	0	0	0	0	114.7	V229 Y277 Y279	V229-G233 PolarHBondContact O-N 3.37Å; G233-Y277 VanDerWaalsContact CA-CZ 3.42Å; G233-Y277 VanDerWaalsContact N-CD1 3.34Å; G233-Y277 VanDerWaalsContact N-CE1 3.32Å; G233-Y279 PolarHBondContact O-OH 3.38Å
234	E	91.3	Very high	91.4	Very high	67 Å²	67	39.8 Å²	39.8	31%	0.313	20%	0.199	S	C	.	.	P	Polyproline II helix	trans	-95.1	137	171.4	-64.7	-164.4	146.8	0	0	111.2	V229 D232 K241 V284	V229-E234 WeakPolarHBondContact CG2-O 3.41Å; D232-E234 PolarHBondContact O-N 2.87Å; E234-K241 IonicContact OE1-NZ 2.76Å; E234-K241 PolarHBondContact OE1-NZ 2.93Å; E234-K241 IonicContact OE2-NZ 3.55Å; E234-K241 PolarHBondContact OE2-NZ 2.93Å; E234-V284 HydrophobicContact CG-CB 4.22Å; E234-V284 HydrophobicContact CG-CG2 4.14Å
235	L	92.2	Very high	91	Very high	82 Å²	82	43 Å²	43	43%	0.429	22%	0.215	S	C	.	.	P	Polyproline II helix	trans	-74.2	151.3	171.9	-61.1	177.5	0	0	0	111.6	V229 I443	V229-L235 HydrophobicContact CG1-CD2 3.88Å; L235-I443 HydrophobicContact CD2-CD1 4.19Å
236	D	93.1	Very high	90.8	Very high	14 Å²	14	42.4 Å²	42.4	8%	0.075	21%	0.211	C	C	.	.	P	Polyproline II helix	trans	-76.7	138.4	177.9	-169.1	47.2	0	0	0	111.9	T225 V229 A238 G240 K241 A242 S437	T225-D236 HydrophobicContact CG2-CB 3.57Å; V229-D236 HydrophobicContact CG2-CB 4.46Å; D236-A238 PolarHBondContact O-N 2.94Å; D236-G240 VanDerWaalsContact OD1-C 3.23Å; D236-G240 WeakPolarHBondContact OD1-CA 3.27Å; D236-G240 PolarHBondContact OD1-N 3.09Å; D236-G240 WeakPolarHBondContact OD2-CA 3.08Å; D236-G240 PolarHBondContact OD2-N 3.41Å; D236-K241 PolarHBondContact OD1-N 3.27Å; D236-A242 HydrophobicContact CB-CB 3.93Å; D236-A242 PolarHBondContact OD1-N 3.01Å; D236-S437 PolarHBondContact N-O 3.48Å
237	N	92	Very high	90.4	Very high	85 Å²	85	43 Å²	43	46%	0.455	21%	0.214	S	C	.	.			trans	-81.4	24	-179.2	71	-11.3	0	0	0	113.9	R239 G240 K241	N237-R239 PolarHBondContact O-N 3.33Å; N237-R239 WeakPolarHBondContact OD1-CA 3.42Å; N237-R239 WeakPolarHBondContact OD1-CB 3.46Å; N237-R239 PolarHBondContact OD1-N 3.49Å; N237-G240 PolarHBondContact OD1-N 3.35Å; N237-K241 HydrophobicContact CB-CB 4.4Å; N237-K241 WeakPolarHBondContact OD1-CB 3.39Å; N237-K241 PolarHBondContact OD1-N 2.8Å
238	A	87	Confident	89.9	Confident	61 Å²	61	49.1 Å²	49.1	50%	0.504	24%	0.237	S	C	.	.	S	Bend	trans	55.4	0.3	-169.3	0	0	0	0	0	116.4	D236 V438	D236-A238 PolarHBondContact O-N 2.94Å; A238-V438 HydrophobicContact CB-CG1 4.29Å; A238-V438 HydrophobicContact CB-CG2 4.02Å
239	R	86.4	Confident	89.5	Confident	218 Å²	218	52.9 Å²	52.9	82%	0.823	25%	0.254	S	S	*	.	S	Bend	trans	-104	4.6	173.9	-60.2	-178	178.3	177.1	-0.2	112.2	N237	N237-R239 PolarHBondContact O-N 3.33Å; N237-R239 WeakPolarHBondContact OD1-CA 3.42Å; N237-R239 WeakPolarHBondContact OD1-CB 3.46Å; N237-R239 PolarHBondContact OD1-N 3.49Å
240	G	83.9	Confident	89.2	Confident	6 Å²	6	57 Å²	57	6%	0.062	28%	0.275	C	S	.	.	S	Bend	trans	76.4	37	-179.4	0	0	0	0	0	113.6	D236 N237 A242 R243	D236-G240 VanDerWaalsContact OD1-C 3.23Å; D236-G240 WeakPolarHBondContact OD1-CA 3.27Å; D236-G240 PolarHBondContact OD1-N 3.09Å; D236-G240 WeakPolarHBondContact OD2-CA 3.08Å; D236-G240 PolarHBondContact OD2-N 3.41Å; N237-G240 PolarHBondContact OD1-N 3.35Å; G240-A242 VanDerWaalsContact C-N 3.33Å; G240-R243 WeakPolarHBondContact O-CG 3.25Å
241	K	90	Very high	88.9	Confident	88 Å²	88	61.5 Å²	61.5	38%	0.383	30%	0.296	S	S	.	.	H	α-helix	trans	-56.1	-48	167.9	-176.7	-161.9	-178.8	-154	0	110.4	E234 D236 N237 R243 L244	E234-K241 IonicContact OE1-NZ 2.76Å; E234-K241 PolarHBondContact OE1-NZ 2.93Å; E234-K241 IonicContact OE2-NZ 3.55Å; E234-K241 PolarHBondContact OE2-NZ 2.93Å; D236-K241 PolarHBondContact OD1-N 3.27Å; N237-K241 HydrophobicContact CB-CB 4.4Å; N237-K241 WeakPolarHBondContact OD1-CB 3.39Å; N237-K241 PolarHBondContact OD1-N 2.8Å; K241-R243 PolarHBondContact O-N 3.38Å; K241-L244 WeakPolarHBondContact O-CB 3.48Å; K241-L244 PolarHBondContact O-N 3.45Å
242	A	91.1	Very high	88.6	Confident	3 Å²	3	61.5 Å²	61.5	3%	0.025	30%	0.296	C	S	.	.	H	α-helix	trans	-58.5	-53.9	-173.3	0	0	0	0	0	111.5	T225 S228 V229 D236 G240 L244 N245	T225-A242 HydrophobicContact CG2-CB 4.15Å; S228-A242 VanDerWaalsContact CB-O 3.29Å; S228-A242 WeakPolarHBondContact CB-O 3.26Å; S228-A242 WeakPolarHBondContact OG-CA 3.24Å; S228-A242 WeakPolarHBondContact OG-CB 3.44Å; S228-A242 PolarHBondContact OG-O 2.82Å; V229-A242 HydrophobicContact CG2-CB 4.03Å; D236-A242 HydrophobicContact CB-CB 3.93Å; D236-A242 PolarHBondContact OD1-N 3.01Å; G240-A242 VanDerWaalsContact C-N 3.33Å; A242-L244 PolarHBondContact O-N 2.82Å; A242-N245 WeakPolarHBondContact O-CB 3.27Å; A242-N245 PolarHBondContact O-N 2.92Å
243	R	90	Very high	88.5	Confident	67 Å²	67	64.4 Å²	64.4	25%	0.253	31%	0.314	S	S	.	.	H	α-helix	trans	-57.2	-20.6	-178.9	63.5	171.8	-175.3	-175.3	-0.8	115.2	G240 K241 N245 L246 F247 G256	G240-R243 WeakPolarHBondContact O-CG 3.25Å; K241-R243 PolarHBondContact O-N 3.38Å; R243-N245 PolarHBondContact O-N 2.99Å; R243-L246 PolarHBondContact O-N 3.34Å; R243-L246 VanDerWaalsContact O-N 3.16Å; R243-F247 HydrophobicContact CB-CZ 4.43Å; R243-F247 HydrophobicContact CG-CE2 4.35Å; R243-F247 HydrophobicContact CG-CZ 4.25Å; R243-F247 PolarHBondContact O-N 2.93Å; R243-G256 PolarHBondContact NH1-O 3.01Å
244	L	90.4	Very high	88.6	Confident	85 Å²	85	70.8 Å²	70.8	45%	0.445	34%	0.341	S	S	.	.	H	α-helix	trans	-62.5	-31.6	175.7	-64.1	174.5	0	0	0	111.7	K241 A242 L246 F247 V253	K241-L244 WeakPolarHBondContact O-CB 3.48Å; K241-L244 PolarHBondContact O-N 3.45Å; A242-L244 PolarHBondContact O-N 2.82Å; L244-L246 PolarHBondContact O-N 2.76Å; L244-F247 HydrophobicContact CD2-CD2 4.14Å; L244-F247 PolarHBondContact O-N 3.38Å; L244-V253 HydrophobicContact CD2-CG1 4.23Å
245	N	86.4	Confident	88.4	Confident	77 Å²	77	70.2 Å²	70.2	41%	0.412	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-14.7	177.6	-62.4	-12.6	0	0	0	113.4	D232 A242 R243	D232-N245 VanDerWaalsContact OD2-CB 3.28Å; D232-N245 WeakPolarHBondContact OD2-CB 3.34Å; D232-N245 PolarHBondContact OD2-ND2 3Å; A242-N245 WeakPolarHBondContact O-CB 3.27Å; A242-N245 PolarHBondContact O-N 2.92Å; R243-N245 PolarHBondContact O-N 2.99Å
246	L	88.3	Confident	88	Confident	5 Å²	5	67 Å²	67	3%	0.026	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.2	-17.5	178	-60.3	-173.9	0	0	0	114	S224 I227 R243 L244 R248 E264	S224-L246 WeakPolarHBondContact O-CD1 3.08Å; I227-L246 HydrophobicContact CB-CD1 3.73Å; I227-L246 HydrophobicContact CG2-CD1 3.69Å; I227-L246 HydrophobicContact CG2-CD2 4.4Å; R243-L246 PolarHBondContact O-N 3.34Å; R243-L246 VanDerWaalsContact O-N 3.16Å; L244-L246 PolarHBondContact O-N 2.76Å; L246-R248 PolarHBondContact O-N 3.14Å; L246-E264 HydrophobicContact CD2-CG 3.53Å
247	F	87.8	Confident	87.7	Confident	15 Å²	15	71.3 Å²	71.3	7%	0.066	35%	0.346	C	S	.	.			trans	-74.2	127.1	-177.6	-72.3	-13.4	0	0	0	110.6	R243 L244 E252 V253	R243-F247 HydrophobicContact CB-CZ 4.43Å; R243-F247 HydrophobicContact CG-CE2 4.35Å; R243-F247 HydrophobicContact CG-CZ 4.25Å; R243-F247 PolarHBondContact O-N 2.93Å; L244-F247 HydrophobicContact CD2-CD2 4.14Å; L244-F247 PolarHBondContact O-N 3.38Å; F247-E252 HydrophobicContact CB-CB 3.97Å; F247-E252 HydrophobicContact CD1-CB 3.92Å; F247-E252 HydrophobicContact CD2-CB 4.05Å; F247-E252 HydrophobicContact CE1-CB 4.37Å; F247-E252 HydrophobicContact CE2-CB 4.49Å; F247-E252 VanDerWaalsContact CE2-O 3.28Å; F247-E252 WeakPolarHBondContact CE2-O 3.44Å; F247-E252 HydrophobicContact CG-CB 3.73Å; F247-V253 HydrophobicContact CB-CG2 3.93Å; F247-V253 HydrophobicContact CD2-CG2 4.17Å
248	R	85.2	Confident	87.5	Confident	127 Å²	127	68.2 Å²	68.2	48%	0.479	33%	0.33	S	S	.	.			trans	-107.8	-11.2	-173.2	-63.6	174.6	-176.1	-170.8	-3.7	112.2	L246 E252 R263 E264	L246-R248 PolarHBondContact O-N 3.14Å; R248-E252 PolarHBondContact N-OE2 3.27Å; R248-R263 PolarHBondContact NH2-O 2.95Å; R248-E264 IonicContact CZ-OE1 2.71Å; R248-E264 IonicContact NH2-OE1 2.67Å; R248-E264 PolarHBondContact NH2-OE1 3.01Å
249	H	84.9	Confident	87.6	Confident	81 Å²	81	65.6 Å²	65.6	38%	0.375	31%	0.309	S	S	.	.	S	Bend	trans	-130.3	143.8	-177.2	-54.4	-46.4	0	0	0	112.5	H251 E252 V253	H249-H251 WeakPolarHBondContact CB-CE1 3.27Å; H249-H251 AromaticContact CD2-CE1 3.32Å; H249-H251 PolarHBondContact CD2-CE1 3.12Å; H249-H251 AromaticContact CD2-NE2 3.79Å; H249-H251 AromaticContact CG-CE1 3.25Å; H249-H251 PolarHBondContact O-N 3.22Å; H249-E252 HydrophobicContact CB-CG 4.15Å; H249-E252 PolarHBondContact N-OE2 2.98Å; H249-E252 WeakPolarHBondContact O-CB 3.45Å; H249-E252 PolarHBondContact O-N 3.14Å; H249-V253 PolarHBondContact O-N 3.34Å
250	L	87.5	Confident	87.6	Confident	92 Å²	92	56 Å²	56	48%	0.482	28%	0.275	S	S	.	.	H	α-helix	trans	-55.2	-37.6	-179.1	-177.9	62.2	0	0	0	112.7	L4 E252 V253 Q254	L4-L250 HydrophobicContact CD2-CD1 4.43Å; L250-E252 VanDerWaalsContact C-N 3.31Å; L250-E252 PolarHBondContact O-N 2.94Å; L250-V253 PolarHBondContact O-N 3.46Å; L250-Q254 HydrophobicContact CD1-CG 4.28Å; L250-Q254 HydrophobicContact CG-CG 4.28Å; L250-Q254 WeakPolarHBondContact O-CB 3.25Å; L250-Q254 VanDerWaalsContact O-CG 3.3Å; L250-Q254 WeakPolarHBondContact O-CG 3.37Å; L250-Q254 PolarHBondContact O-N 2.92Å
251	H	87.2	Confident	87.8	Confident	101 Å²	101	57.5 Å²	57.5	47%	0.468	28%	0.282	S	S	.	.	H	α-helix	trans	-71.5	-21.6	177.9	63.2	-96.2	0	0	0	113.7	H249 S255 S259	H249-H251 WeakPolarHBondContact CB-CE1 3.27Å; H249-H251 AromaticContact CD2-CE1 3.32Å; H249-H251 PolarHBondContact CD2-CE1 3.12Å; H249-H251 AromaticContact CD2-NE2 3.79Å; H249-H251 AromaticContact CG-CE1 3.25Å; H249-H251 PolarHBondContact O-N 3.22Å; H251-S255 WeakPolarHBondContact O-CB 3.43Å; H251-S255 PolarHBondContact O-N 3.26Å; H251-S255 PolarHBondContact O-OG 3.22Å; H251-S259 PolarHBondContact CD2-OG 2.81Å; H251-S259 WeakPolarHBondContact NE2-CB 3.33Å; H251-S259 PolarHBondContact NE2-OG 3.35Å
252	E	87.2	Confident	87.7	Confident	1 Å²	1	53.4 Å²	53.4	1%	0.005	26%	0.264	C	S	.	.	H	α-helix	trans	-72	-44.2	170.9	-61.2	179.6	142.5	0	0	110.1	F247 R248 H249 L250 G256 R257 S259 S260	F247-E252 HydrophobicContact CB-CB 3.97Å; F247-E252 HydrophobicContact CD1-CB 3.92Å; F247-E252 HydrophobicContact CD2-CB 4.05Å; F247-E252 HydrophobicContact CE1-CB 4.37Å; F247-E252 HydrophobicContact CE2-CB 4.49Å; F247-E252 VanDerWaalsContact CE2-O 3.28Å; F247-E252 WeakPolarHBondContact CE2-O 3.44Å; F247-E252 HydrophobicContact CG-CB 3.73Å; R248-E252 PolarHBondContact N-OE2 3.27Å; H249-E252 HydrophobicContact CB-CG 4.15Å; H249-E252 PolarHBondContact N-OE2 2.98Å; H249-E252 WeakPolarHBondContact O-CB 3.45Å; H249-E252 PolarHBondContact O-N 3.14Å; L250-E252 VanDerWaalsContact C-N 3.31Å; L250-E252 PolarHBondContact O-N 2.94Å; E252-G256 CarbonylContact O-C 3.4Å; E252-G256 VanDerWaalsContact O-CA 3.27Å; E252-G256 WeakPolarHBondContact O-CA 3.33Å; E252-G256 PolarHBondContact O-N 3.19Å; E252-R257 WeakPolarHBondContact CA-O 3.34Å; E252-R257 PolarHBondContact O-N 3.47Å; E252-S259 WeakPolarHBondContact CG-OG 3.21Å; E252-S259 PolarHBondContact OE1-N 3.37Å; E252-S259 PolarHBondContact OE1-OG 3.1Å; E252-S260 WeakPolarHBondContact OE1-CB 3.39Å; E252-S260 PolarHBondContact OE1-N 3.08Å; E252-S260 PolarHBondContact OE1-OG 2.87Å; E252-S260 PolarHBondContact OE2-OG 3.2Å
253	V	88.8	Confident	87.7	Confident	67 Å²	67	56.5 Å²	56.5	41%	0.406	28%	0.275	S	S	.	.	H	α-helix	trans	-61.5	-49.6	175	-178.2	0	0	0	0	111	L244 F247 H249 L250	L244-V253 HydrophobicContact CD2-CG1 4.23Å; F247-V253 HydrophobicContact CB-CG2 3.93Å; F247-V253 HydrophobicContact CD2-CG2 4.17Å; H249-V253 PolarHBondContact O-N 3.34Å; L250-V253 PolarHBondContact O-N 3.46Å
254	Q	89.1	Confident	87.8	Confident	145 Å²	145	54.5 Å²	54.5	68%	0.678	27%	0.268	S	S	*	.	H	α-helix	trans	-65.2	-41.2	-179.7	-72.9	172.4	-25.3	0	0	113.3	L250	L250-Q254 HydrophobicContact CD1-CG 4.28Å; L250-Q254 HydrophobicContact CG-CG 4.28Å; L250-Q254 WeakPolarHBondContact O-CB 3.25Å; L250-Q254 VanDerWaalsContact O-CG 3.3Å; L250-Q254 WeakPolarHBondContact O-CG 3.37Å; L250-Q254 PolarHBondContact O-N 2.92Å
255	S	87.6	Confident	87.9	Confident	55 Å²	55	51.2 Å²	51.2	39%	0.385	25%	0.251	S	S	.	.	H	α-helix	trans	-86.7	-14.2	-179	67.9	0	0	0	0	114	H251 R257	H251-S255 WeakPolarHBondContact O-CB 3.43Å; H251-S255 PolarHBondContact O-N 3.26Å; H251-S255 PolarHBondContact O-OG 3.22Å; S255-R257 PolarHBondContact O-N 3.04Å; S255-R257 PolarHBondContact OG-N 3.14Å
256	G	85.3	Confident	88.2	Confident	15 Å²	15	47.6 Å²	47.6	16%	0.155	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	65.1	16.2	-169.1	0	0	0	0	0	114.1	R243 E252	R243-G256 PolarHBondContact NH1-O 3.01Å; E252-G256 CarbonylContact O-C 3.4Å; E252-G256 VanDerWaalsContact O-CA 3.27Å; E252-G256 WeakPolarHBondContact O-CA 3.33Å; E252-G256 PolarHBondContact O-N 3.19Å
257	R	86.7	Confident	88.4	Confident	103 Å²	103	47.3 Å²	47.3	39%	0.389	23%	0.231	S	C	.	.			trans	-123.5	127.7	-172.7	-64.5	172.8	-176.6	-170.6	-1.1	111.7	M219 E252 S255 S259 H308	M219-R257 HydrophobicContact SD-CG 4.2Å; M219-R257 PolarHBondContact SD-NE 3.46Å; E252-R257 WeakPolarHBondContact CA-O 3.34Å; E252-R257 PolarHBondContact O-N 3.47Å; S255-R257 PolarHBondContact O-N 3.04Å; S255-R257 PolarHBondContact OG-N 3.14Å; R257-S259 PolarHBondContact O-N 2.59Å; R257-H308 PolarHBondContact NH1-CD2 3.07Å; R257-H308 PolarHBondContact NH1-NE2 3.36Å
258	T	87.4	Confident	88.4	Confident	20 Å²	20	46.7 Å²	46.7	12%	0.123	23%	0.228	C	C	.	.			trans	-62.2	126.8	172	-31	0	0	0	0	110.7	S224 D304 Y311	S224-T258 PolarHBondContact OG-OG1 3.26Å; T258-D304 WeakPolarHBondContact CG2-OD2 3.44Å; T258-Y311 WeakPolarHBondContact O-CD2 3.23Å
259	S	89	Confident	88.3	Confident	7 Å²	7	42.4 Å²	42.4	5%	0.049	21%	0.214	C	C	.	.			trans	-121.5	-27.8	-178.1	72.1	0	0	0	0	112.8	H251 E252 R257	H251-S259 PolarHBondContact CD2-OG 2.81Å; H251-S259 WeakPolarHBondContact NE2-CB 3.33Å; H251-S259 PolarHBondContact NE2-OG 3.35Å; E252-S259 WeakPolarHBondContact CG-OG 3.21Å; E252-S259 PolarHBondContact OE1-N 3.37Å; E252-S259 PolarHBondContact OE1-OG 3.1Å; R257-S259 PolarHBondContact O-N 2.59Å
260	S	86.2	Confident	88	Confident	17 Å²	17	45.3 Å²	45.3	12%	0.119	23%	0.231	C	C	.	.	S	Bend	trans	-100.1	171.4	179.4	67.8	0	0	0	0	111	E252	E252-S260 WeakPolarHBondContact OE1-CB 3.39Å; E252-S260 PolarHBondContact OE1-N 3.08Å; E252-S260 PolarHBondContact OE1-OG 2.87Å; E252-S260 PolarHBondContact OE2-OG 3.2Å
261	L	87.7	Confident	87.5	Confident	37 Å²	37	46.6 Å²	46.6	19%	0.194	24%	0.239	C	C	.	.	P	Polyproline II helix	trans	-96.8	116.2	171.7	-61.3	168.2	0	0	0	108.1	L303 L305 T314	L261-L303 HydrophobicContact CB-CD1 4.49Å; L261-L305 HydrophobicContact CD2-CD2 3.6Å; L261-T314 HydrophobicContact CD1-CG2 4.17Å; L261-T314 HydrophobicContact CD2-CG2 4.03Å; L261-T314 HydrophobicContact CG-CG2 3.66Å
262	S	88.6	Confident	86.9	Confident	2 Å²	2	42.8 Å²	42.8	1%	0.014	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	142.6	166.1	62.1	0	0	0	0	110.1	D304	S262-D304 PolarHBondContact O-N 2.92Å; S262-D304 WeakPolarHBondContact OG-CB 3.34Å
263	R	89.7	Confident	86.8	Confident	68 Å²	68	48.7 Å²	48.7	26%	0.257	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	117.4	170	-79.1	-176.4	62.9	156.2	-5.9	105.8	D210 R248 T301 L302 L303 N322 S590	D210-R263 IonicContact OD2-NH2 3.48Å; D210-R263 PolarHBondContact OD2-NH2 3.35Å; R248-R263 PolarHBondContact NH2-O 2.95Å; R263-T301 HydrophobicContact CB-CG2 4.36Å; R263-T301 HydrophobicContact CG-CG2 4.32Å; R263-L302 WeakPolarHBondContact CA-O 3.17Å; R263-L303 HydrophobicContact CG-CD1 3.76Å; R263-N322 WeakPolarHBondContact CD-OD1 3.41Å; R263-N322 PolarHBondContact NH1-OD1 3.32Å; R263-S590 PolarHBondContact NH1-OG 2.92Å; R263-S590 VanDerWaalsContact NH1-OG 3.07Å; R263-S590 PolarHBondContact NH2-OG 3.29Å
264	E	92.5	Very high	86.9	Confident	24 Å²	24	47.1 Å²	47.1	11%	0.112	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	145.4	176.9	-58	-59.2	127.3	0	0	109.4	I227 T231 L246 R248 R286 L302	I227-E264 HydrophobicContact CG2-CB 4.19Å; I227-E264 HydrophobicContact CG2-CG 4.05Å; T231-E264 HydrophobicContact CG2-CB 3.87Å; L246-E264 HydrophobicContact CD2-CG 3.53Å; R248-E264 IonicContact CZ-OE1 2.71Å; R248-E264 IonicContact NH2-OE1 2.67Å; R248-E264 PolarHBondContact NH2-OE1 3.01Å; E264-R286 IonicContact OE2-NH2 3.45Å; E264-R286 PolarHBondContact OE2-NH2 2.83Å; E264-L302 PolarHBondContact N-O 3.15Å; E264-L302 PolarHBondContact O-N 3.47Å
265	L	92.6	Very high	86.9	Confident	17 Å²	17	40.5 Å²	40.5	9%	0.089	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	126.5	-179.3	-168.7	70.2	0	0	0	108.9	N276 T289 I292 V293 L299 N578	L265-N276 PolarHBondContact O-ND2 2.72Å; L265-T289 HydrophobicContact CB-CG2 4.38Å; L265-T289 HydrophobicContact CD2-CG2 3.81Å; L265-I292 HydrophobicContact CD2-CG2 4.13Å; L265-I292 HydrophobicContact CG-CG2 4.43Å; L265-V293 HydrophobicContact CD2-CG2 3.49Å; L265-V293 VanDerWaalsContact CD2-CG2 3.49Å; L265-L299 HydrophobicContact CD1-CB 4.17Å; L265-L299 HydrophobicContact CD1-CD2 4.34Å; L265-L299 HydrophobicContact CD2-CD1 4.37Å; L265-L299 HydrophobicContact CD2-CD2 3.98Å; L265-L299 HydrophobicContact CG-CD2 4.13Å; L265-N578 HydrophobicContact CD2-CB 4.48Å
266	L	94	Very high	87.2	Confident	0 Å²	0	38 Å²	38	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	121.7	172.2	-179.3	64.1	0	0	0	108.6	L230 F268 V274 N276 L300 L302 M447 L450	L230-L266 WeakPolarHBondContact O-CD1 3.35Å; L266-F268 HydrophobicContact CD2-CE2 3.9Å; L266-F268 HydrophobicContact CD2-CZ 3.63Å; L266-F268 HydrophobicContact CG-CE2 3.95Å; L266-F268 HydrophobicContact CG-CZ 3.95Å; L266-V274 HydrophobicContact CD1-CG1 3.82Å; L266-N276 WeakPolarHBondContact CA-OD1 3.42Å; L266-L300 HydrophobicContact CB-CB 4.34Å; L266-L300 HydrophobicContact CD2-CD2 4.3Å; L266-L300 PolarHBondContact N-O 2.89Å; L266-L300 PolarHBondContact O-N 2.93Å; L266-L302 HydrophobicContact CB-CD1 4.45Å; L266-L302 HydrophobicContact CD2-CD1 4.36Å; L266-M447 HydrophobicContact CD1-CE 3.95Å; L266-M447 HydrophobicContact CD2-CE 3.85Å; L266-M447 HydrophobicContact CD2-SD 4.22Å; L266-M447 HydrophobicContact CG-CE 4.44Å; L266-L450 HydrophobicContact CD2-CD1 4.26Å
267	G	91.2	Very high	87.4	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	143.2	-177.6	0	0	0	0	0	113	V274 T275 N276 S296	G267-V274 WeakPolarHBondContact O-CA 3.43Å; G267-T275 VanDerWaalsContact C-OG1 3.22Å; G267-T275 WeakPolarHBondContact CA-OG1 3.42Å; G267-T275 PolarHBondContact O-N 2.8Å; G267-T275 PolarHBondContact O-OG1 3.29Å; G267-N276 PolarHBondContact N-OD1 3.24Å; G267-S296 VanDerWaalsContact CA-OG 3.23Å; G267-S296 WeakPolarHBondContact CA-OG 3.37Å
268	F	87.5	Confident	87.5	Confident	1 Å²	1	40 Å²	40	0%	0.004	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	140.3	177.4	-63.2	-79.4	0	0	0	111.2	L266 G272 H273 V274 S296 S297 N298 L300 M447 L450 S454	L266-F268 HydrophobicContact CD2-CE2 3.9Å; L266-F268 HydrophobicContact CD2-CZ 3.63Å; L266-F268 HydrophobicContact CG-CE2 3.95Å; L266-F268 HydrophobicContact CG-CZ 3.95Å; F268-G272 WeakPolarHBondContact CD1-O 3.48Å; F268-H273 CarbonylContact C-O 3.57Å; F268-H273 VanDerWaalsContact CA-O 3.27Å; F268-H273 WeakPolarHBondContact CA-O 3.34Å; F268-V274 HydrophobicContact CE1-CG2 4.24Å; F268-S296 CarbonylContact O-C 3.58Å; F268-S296 VanDerWaalsContact O-CA 3.27Å; F268-S296 WeakPolarHBondContact O-CA 3.46Å; F268-S296 WeakPolarHBondContact O-CB 3.18Å; F268-S297 PolarHBondContact O-N 3.16Å; F268-S297 PolarHBondContact O-OG 3.02Å; F268-N298 HydrophobicContact CB-CB 4.49Å; F268-N298 PolarHBondContact N-O 2.75Å; F268-N298 PolarHBondContact O-N 3.04Å; F268-L300 HydrophobicContact CE2-CB 4.44Å; F268-M447 HydrophobicContact CE1-CE 4.12Å; F268-M447 HydrophobicContact CZ-CE 4.26Å; F268-L450 HydrophobicContact CE2-CB 4.37Å; F268-L450 HydrophobicContact CZ-CB 3.9Å; F268-S454 WeakPolarHBondContact CD2-OG 3.14Å
269	D	83.9	Confident	87.4	Confident	37 Å²	37	46 Å²	46	20%	0.198	22%	0.224	C	C	.	.			trans	-76.4	175.6	167.5	84.2	-11.6	0	0	0	111.2	N271 G272 H273 T275 S297	D269-N271 PolarHBondContact O-N 3.27Å; D269-N271 VanDerWaalsContact OD1-C 3.3Å; D269-N271 WeakPolarHBondContact OD1-CA 3.5Å; D269-N271 WeakPolarHBondContact OD1-CB 3.36Å; D269-N271 PolarHBondContact OD1-N 2.77Å; D269-N271 PolarHBondContact OD2-ND2 3.01Å; D269-G272 PolarHBondContact O-N 3.48Å; D269-G272 PolarHBondContact OD1-N 2.78Å; D269-H273 PolarHBondContact N-O 2.98Å; D269-H273 IonicContact OD1-CG 3.39Å; D269-H273 PolarHBondContact OD1-N 3.1Å; D269-H273 IonicContact OD1-ND1 2.68Å; D269-H273 IonicContact OD2-ND1 3.06Å; D269-H273 PolarHBondContact OD2-ND1 3.13Å; D269-T275 HydrophobicContact CB-CG2 4.11Å; D269-S297 PolarHBondContact O-OG 3.44Å
270	I	79.3	Confident	87.1	Confident	142 Å²	142	47 Å²	47	73%	0.728	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-19.6	179.9	-168.5	165.8	0	0	0	113.4	S297	I270-S297 WeakPolarHBondContact CA-OG 3.44Å; I270-S297 PolarHBondContact N-OG 2.94Å; I270-S297 VanDerWaalsContact N-OG 3.13Å
271	N	75.4	Confident	86.9	Confident	120 Å²	120	53.5 Å²	53.5	64%	0.642	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.6	-6.2	177.3	-47.1	-66	0	0	0	112	D269 H273	D269-N271 PolarHBondContact O-N 3.27Å; D269-N271 VanDerWaalsContact OD1-C 3.3Å; D269-N271 WeakPolarHBondContact OD1-CA 3.5Å; D269-N271 WeakPolarHBondContact OD1-CB 3.36Å; D269-N271 PolarHBondContact OD1-N 2.77Å; D269-N271 PolarHBondContact OD2-ND2 3.01Å; N271-H273 WeakPolarHBondContact CB-ND1 3.45Å
272	G	75.1	Confident	86.3	Confident	21 Å²	21	55.9 Å²	55.9	22%	0.216	30%	0.3	C	S	.	.	S	Bend	trans	87.2	10.6	-178.5	0	0	0	0	0	116.1	F268 D269 S451	F268-G272 WeakPolarHBondContact CD1-O 3.48Å; D269-G272 PolarHBondContact O-N 3.48Å; D269-G272 PolarHBondContact OD1-N 2.78Å; G272-S451 WeakPolarHBondContact CA-OG 3.45Å; G272-S451 PolarHBondContact O-OG 3.29Å
273	H	84.9	Confident	85.9	Confident	124 Å²	124	63.1 Å²	63.1	57%	0.574	33%	0.327	S	S	*	.			trans	-80.8	153.4	174.3	-55.8	105.8	0	0	0	112.3	F268 D269 N271	F268-H273 CarbonylContact C-O 3.57Å; F268-H273 VanDerWaalsContact CA-O 3.27Å; F268-H273 WeakPolarHBondContact CA-O 3.34Å; D269-H273 PolarHBondContact N-O 2.98Å; D269-H273 IonicContact OD1-CG 3.39Å; D269-H273 PolarHBondContact OD1-N 3.1Å; D269-H273 IonicContact OD1-ND1 2.68Å; D269-H273 IonicContact OD2-ND1 3.06Å; D269-H273 PolarHBondContact OD2-ND1 3.13Å; N271-H273 WeakPolarHBondContact CB-ND1 3.45Å
274	V	91	Very high	85.7	Confident	34 Å²	34	61.9 Å²	61.9	21%	0.206	33%	0.327	C	S	.	.	B	Isolated β-bridge	trans	-75.4	129.6	-177.9	-173.4	0	0	0	0	111.7	L266 G267 F268 N276 Y277 M447	L266-V274 HydrophobicContact CD1-CG1 3.82Å; G267-V274 WeakPolarHBondContact O-CA 3.43Å; F268-V274 HydrophobicContact CE1-CG2 4.24Å; V274-N276 HydrophobicContact CG1-CB 3.82Å; V274-Y277 HydrophobicContact CB-CE1 4.38Å; V274-Y277 HydrophobicContact CG1-CD1 4.23Å; V274-Y277 HydrophobicContact CG1-CE1 3.61Å; V274-M447 HydrophobicContact CB-CE 4.49Å; V274-M447 HydrophobicContact CG1-CE 4.48Å; V274-M447 HydrophobicContact CG2-CE 3.23Å
275	T	90.5	Very high	85.3	Confident	7 Å²	7	65.7 Å²	65.7	4%	0.043	34%	0.341	C	S	.	.			trans	-99.2	-1.4	178.3	65	0	0	0	0	113.3	G267 D269 Y277 R287 M295 S296	G267-T275 VanDerWaalsContact C-OG1 3.22Å; G267-T275 WeakPolarHBondContact CA-OG1 3.42Å; G267-T275 PolarHBondContact O-N 2.8Å; G267-T275 PolarHBondContact O-OG1 3.29Å; D269-T275 HydrophobicContact CB-CG2 4.11Å; T275-Y277 VanDerWaalsContact C-N 3.34Å; T275-Y277 PolarHBondContact O-N 3.39Å; T275-R287 VanDerWaalsContact C-NH1 3.31Å; T275-R287 WeakPolarHBondContact O-CD 3.5Å; T275-R287 PolarHBondContact O-NH1 3.03Å; T275-M295 HydrophobicContact CG2-CB 4.37Å; T275-S296 PolarHBondContact OG1-OG 2.71Å
276	N	91.9	Very high	85	Confident	2 Å²	2	70.4 Å²	70.4	1%	0.011	36%	0.357	C	S	.	.	S	Bend	trans	-65.6	-32	-178.6	-78.6	46.3	0	0	0	114.9	T231 L265 L266 G267 V274 R287 I292	T231-N276 VanDerWaalsContact O-CB 3.23Å; T231-N276 WeakPolarHBondContact O-CB 3.46Å; T231-N276 PolarHBondContact O-ND2 3.49Å; L265-N276 PolarHBondContact O-ND2 2.72Å; L266-N276 WeakPolarHBondContact CA-OD1 3.42Å; G267-N276 PolarHBondContact N-OD1 3.24Å; V274-N276 HydrophobicContact CG1-CB 3.82Å; N276-R287 WeakPolarHBondContact O-CB 3.49Å; N276-R287 PolarHBondContact O-N 3.47Å; N276-I292 HydrophobicContact CB-CD1 4.13Å
277	Y	91.4	Very high	84.8	Confident	40 Å²	40	72.2 Å²	72.2	16%	0.157	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	159.5	-173.7	46.1	-94.8	0	0	0	111.7	G233 V274 T275 Y279 V284 Y285 R287	G233-Y277 VanDerWaalsContact CA-CZ 3.42Å; G233-Y277 VanDerWaalsContact N-CD1 3.34Å; G233-Y277 VanDerWaalsContact N-CE1 3.32Å; V274-Y277 HydrophobicContact CB-CE1 4.38Å; V274-Y277 HydrophobicContact CG1-CD1 4.23Å; V274-Y277 HydrophobicContact CG1-CE1 3.61Å; T275-Y277 VanDerWaalsContact C-N 3.34Å; T275-Y277 PolarHBondContact O-N 3.39Å; Y277-Y279 AromaticContact CD2-CE2 3.88Å; Y277-Y279 HydrophobicContact CD2-CE2 3.88Å; Y277-Y279 AromaticContact CE2-CE2 3.79Å; Y277-Y279 HydrophobicContact CE2-CE2 3.79Å; Y277-V284 HydrophobicContact CD2-CG1 4.33Å; Y277-V284 HydrophobicContact CG-CG1 4.26Å; Y277-Y285 CarbonylContact C-O 3.33Å; Y277-Y285 WeakPolarHBondContact CA-O 2.97Å; Y277-R287 PolarHBondContact O-NH1 3.02Å
278	K	87.8	Confident	84.5	Confident	120 Å²	120	74.1 Å²	74.1	52%	0.522	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	132.4	175.4	-166	-175	174.9	-169.8	0	109.7	Y285	K278-Y285 PolarHBondContact N-O 2.96Å; K278-Y285 PolarHBondContact O-N 3.42Å
279	Y	84.7	Confident	84.4	Confident	146 Å²	146	75.5 Å²	75.5	57%	0.573	39%	0.386	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.8	121.5	164.6	-59.1	-82.3	0	0	0	108.9	G233 Y277 R283 V284	G233-Y279 PolarHBondContact O-OH 3.38Å; Y277-Y279 AromaticContact CD2-CE2 3.88Å; Y277-Y279 HydrophobicContact CD2-CE2 3.88Å; Y277-Y279 AromaticContact CE2-CE2 3.79Å; Y277-Y279 HydrophobicContact CE2-CE2 3.79Å; Y279-R283 WeakPolarHBondContact CA-O 3.23Å; Y279-V284 HydrophobicContact CD1-CG2 3.87Å; Y279-V284 HydrophobicContact CE1-CB 4.48Å; Y279-V284 HydrophobicContact CE1-CG1 4.3Å; Y279-V284 HydrophobicContact CE1-CG2 3.55Å
280	A	82.6	Confident	84.3	Confident	28 Å²	28	75.3 Å²	75.3	23%	0.231	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	140.3	172.6	0	0	0	0	0	108.6	G282 R283 Y285	A280-G282 PolarHBondContact O-N 2.82Å; A280-R283 PolarHBondContact N-O 3.44Å; A280-R283 PolarHBondContact O-N 2.9Å; A280-R283 VanDerWaalsContact O-O 3.07Å; A280-Y285 HydrophobicContact CB-CD2 3.99Å; A280-Y285 HydrophobicContact CB-CE2 3.91Å
281	D	82.3	Confident	84.5	Confident	153 Å²	153	72 Å²	72	82%	0.818	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.1	33.5	176.9	-50.6	-26	0	0	0	114.9	R283	D281-R283 VanDerWaalsContact C-N 3.26Å; D281-R283 PolarHBondContact O-N 3.08Å
282	G	75.9	Confident	85.1	Confident	87 Å²	87	66.5 Å²	66.5	90%	0.897	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.9	7.8	-177.2	0	0	0	0	0	115.3	A280	A280-G282 PolarHBondContact O-N 2.82Å
283	R	80.6	Confident	85.7	Confident	154 Å²	154	66.5 Å²	66.5	58%	0.581	33%	0.332	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.2	154.6	179	-62.7	-178.7	-178.5	179.6	1.3	111.6	Y279 A280 D281 Y285	Y279-R283 WeakPolarHBondContact CA-O 3.23Å; A280-R283 PolarHBondContact N-O 3.44Å; A280-R283 PolarHBondContact O-N 2.9Å; A280-R283 VanDerWaalsContact O-O 3.07Å; D281-R283 VanDerWaalsContact C-N 3.26Å; D281-R283 PolarHBondContact O-N 3.08Å; R283-Y285 HydrophobicContact CB-CD2 4.41Å; R283-Y285 HydrophobicContact CB-CE2 3.81Å
284	V	83.9	Confident	85.5	Confident	42 Å²	42	64.8 Å²	64.8	26%	0.255	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	117.4	174.8	-165.4	0	0	0	0	108.7	D232 E234 Y277 Y279	D232-V284 WeakPolarHBondContact O-CG1 3.43Å; E234-V284 HydrophobicContact CG-CB 4.22Å; E234-V284 HydrophobicContact CG-CG2 4.14Å; Y277-V284 HydrophobicContact CD2-CG1 4.33Å; Y277-V284 HydrophobicContact CG-CG1 4.26Å; Y279-V284 HydrophobicContact CD1-CG2 3.87Å; Y279-V284 HydrophobicContact CE1-CB 4.48Å; Y279-V284 HydrophobicContact CE1-CG1 4.3Å; Y279-V284 HydrophobicContact CE1-CG2 3.55Å
285	Y	85.8	Confident	85	Confident	105 Å²	105	67.8 Å²	67.8	41%	0.412	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	111.6	175.5	-68.1	-91.4	0	0	0	109.2	Y277 K278 A280 R283	Y277-Y285 CarbonylContact C-O 3.33Å; Y277-Y285 WeakPolarHBondContact CA-O 2.97Å; K278-Y285 PolarHBondContact N-O 2.96Å; K278-Y285 PolarHBondContact O-N 3.42Å; A280-Y285 HydrophobicContact CB-CD2 3.99Å; A280-Y285 HydrophobicContact CB-CE2 3.91Å; R283-Y285 HydrophobicContact CB-CD2 4.41Å; R283-Y285 HydrophobicContact CB-CE2 3.81Å
286	R	86.4	Confident	84.7	Confident	115 Å²	115	68.4 Å²	68.4	43%	0.434	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	126.5	171.7	-178	177.9	177.3	165.5	-4	109.4	D232 E264	D232-R286 VanDerWaalsContact OD1-CD 3.28Å; D232-R286 WeakPolarHBondContact OD1-CD 3.49Å; D232-R286 IonicContact OD1-CZ 3.79Å; D232-R286 IonicContact OD1-NE 2.78Å; D232-R286 PolarHBondContact OD1-NE 3.32Å; D232-R286 IonicContact OD1-NH1 3.6Å; D232-R286 PolarHBondContact OD1-NH1 3.13Å; D232-R286 IonicContact OD2-NH1 2.73Å; E264-R286 IonicContact OE2-NH2 3.45Å; E264-R286 PolarHBondContact OE2-NH2 2.83Å
287	R	88	Confident	84.2	Confident	39 Å²	39	70.6 Å²	70.6	15%	0.147	35%	0.353	C	S	.	.	P	Polyproline II helix	trans	-79.1	154	176.5	-63.8	-162.8	-177	82.4	-4	111.5	T275 N276 Y277 E291 I292 M295	T275-R287 VanDerWaalsContact C-NH1 3.31Å; T275-R287 WeakPolarHBondContact O-CD 3.5Å; T275-R287 PolarHBondContact O-NH1 3.03Å; N276-R287 WeakPolarHBondContact O-CB 3.49Å; N276-R287 PolarHBondContact O-N 3.47Å; Y277-R287 PolarHBondContact O-NH1 3.02Å; R287-E291 HydrophobicContact CB-CB 4.03Å; R287-E291 WeakPolarHBondContact CB-OE2 3.32Å; R287-E291 WeakPolarHBondContact CG-OE2 3.3Å; R287-I292 HydrophobicContact CB-CG1 4.02Å; R287-M295 VanDerWaalsContact CD-SD 3.6Å; R287-M295 PolarHBondContact NE-SD 3.17Å
288	S	85.6	Confident	83.7	Confident	39 Å²	39	69.2 Å²	69.2	27%	0.273	35%	0.348	S	S	.	.	P	Polyproline II helix	trans	-65.2	155.4	169.6	67.3	0	0	0	0	111.4	E290 E291 I292	S288-E290 PolarHBondContact O-N 2.99Å; S288-E291 WeakPolarHBondContact CB-OE1 3.25Å; S288-E291 PolarHBondContact N-OE1 2.83Å; S288-E291 VanDerWaalsContact N-OE1 3.1Å; S288-E291 WeakPolarHBondContact O-CB 3.39Å; S288-E291 PolarHBondContact O-N 3.1Å; S288-E291 VanDerWaalsContact O-N 3.14Å; S288-E291 VanDerWaalsContact OG-CD 3.27Å; S288-E291 WeakPolarHBondContact OG-CG 3.37Å; S288-E291 PolarHBondContact OG-N 2.87Å; S288-E291 PolarHBondContact OG-OE1 3.04Å; S288-I292 VanDerWaalsContact O-CG1 3.31Å; S288-I292 WeakPolarHBondContact O-CG1 3.36Å; S288-I292 PolarHBondContact O-N 2.91Å
289	T	85.9	Confident	83.8	Confident	30 Å²	30	65.5 Å²	65.5	18%	0.184	33%	0.334	C	S	.	.	H	α-helix	trans	-57	-37.3	175.8	-51.3	0	0	0	0	111.1	L265 I292 V293 R579	L265-T289 HydrophobicContact CB-CG2 4.38Å; L265-T289 HydrophobicContact CD2-CG2 3.81Å; T289-I292 PolarHBondContact O-N 3.03Å; T289-V293 VanDerWaalsContact O-CG2 3.32Å; T289-V293 WeakPolarHBondContact O-CG2 3.5Å; T289-V293 PolarHBondContact O-N 2.69Å; T289-R579 HydrophobicContact CG2-CG 4.38Å; T289-R579 PolarHBondContact OG1-NH1 3.02Å
290	E	81.7	Confident	84.2	Confident	34 Å²	34	58.5 Å²	58.5	16%	0.159	31%	0.307	C	S	.	.	H	α-helix	trans	-62.9	-40.9	178	-67.4	82.1	167.3	0	0	112.4	S288 R294 R579 Q580	S288-E290 PolarHBondContact O-N 2.99Å; E290-R294 WeakPolarHBondContact O-CG 3.13Å; E290-R294 PolarHBondContact O-N 3.37Å; E290-R294 PolarHBondContact O-NH1 3.27Å; E290-R579 HydrophobicContact CG-CB 3.92Å; E290-R579 VanDerWaalsContact OE1-CB 3.3Å; E290-R579 WeakPolarHBondContact OE1-CB 3.33Å; E290-R579 WeakPolarHBondContact OE1-CD 3.32Å; E290-R579 IonicContact OE1-NH1 2.71Å; E290-R579 IonicContact OE2-NH1 3.1Å; E290-R579 PolarHBondContact OE2-NH1 3.04Å; E290-Q580 PolarHBondContact O-NE2 2.83Å
291	E	83.5	Confident	84.8	Confident	72 Å²	72	57.6 Å²	57.6	34%	0.336	30%	0.298	S	S	.	.	H	α-helix	trans	-67.5	-43.8	171	-75.4	156.8	-108.4	0	0	112.3	R287 S288 V293 R294 M295	R287-E291 HydrophobicContact CB-CB 4.03Å; R287-E291 WeakPolarHBondContact CB-OE2 3.32Å; R287-E291 WeakPolarHBondContact CG-OE2 3.3Å; S288-E291 WeakPolarHBondContact CB-OE1 3.25Å; S288-E291 PolarHBondContact N-OE1 2.83Å; S288-E291 VanDerWaalsContact N-OE1 3.1Å; S288-E291 WeakPolarHBondContact O-CB 3.39Å; S288-E291 PolarHBondContact O-N 3.1Å; S288-E291 VanDerWaalsContact O-N 3.14Å; S288-E291 VanDerWaalsContact OG-CD 3.27Å; S288-E291 WeakPolarHBondContact OG-CG 3.37Å; S288-E291 PolarHBondContact OG-N 2.87Å; S288-E291 PolarHBondContact OG-OE1 3.04Å; E291-V293 VanDerWaalsContact C-N 3.28Å; E291-V293 PolarHBondContact O-N 2.9Å; E291-R294 PolarHBondContact O-N 3.41Å; E291-M295 WeakPolarHBondContact O-CB 3.48Å; E291-M295 WeakPolarHBondContact O-CG 3.34Å; E291-M295 PolarHBondContact O-N 2.76Å
292	I	88	Confident	85.4	Confident	5 Å²	5	50.4 Å²	50.4	3%	0.026	26%	0.259	C	S	.	.	H	α-helix	trans	-55.5	-47.6	179.1	-66.6	169.5	0	0	0	109.6	L265 N276 R287 S288 T289 R294 M295 S296 L299	L265-I292 HydrophobicContact CD2-CG2 4.13Å; L265-I292 HydrophobicContact CG-CG2 4.43Å; N276-I292 HydrophobicContact CB-CD1 4.13Å; R287-I292 HydrophobicContact CB-CG1 4.02Å; S288-I292 VanDerWaalsContact O-CG1 3.31Å; S288-I292 WeakPolarHBondContact O-CG1 3.36Å; S288-I292 PolarHBondContact O-N 2.91Å; T289-I292 PolarHBondContact O-N 3.03Å; I292-R294 VanDerWaalsContact C-N 3.3Å; I292-R294 PolarHBondContact O-N 3.25Å; I292-M295 PolarHBondContact O-N 3.37Å; I292-S296 VanDerWaalsContact O-CB 3.29Å; I292-S296 WeakPolarHBondContact O-CB 3.33Å; I292-S296 PolarHBondContact O-N 3.36Å; I292-S296 PolarHBondContact O-OG 2.77Å; I292-L299 HydrophobicContact CG2-CD2 4.21Å
293	V	86.5	Confident	86.3	Confident	21 Å²	21	46.2 Å²	46.2	13%	0.127	22%	0.217	C	C	.	.	H	α-helix	trans	-63.3	-33.2	177.2	179.8	0	0	0	0	112.4	L265 T289 E291 L299 N578 Q580	L265-V293 HydrophobicContact CD2-CG2 3.49Å; L265-V293 VanDerWaalsContact CD2-CG2 3.49Å; T289-V293 VanDerWaalsContact O-CG2 3.32Å; T289-V293 WeakPolarHBondContact O-CG2 3.5Å; T289-V293 PolarHBondContact O-N 2.69Å; E291-V293 VanDerWaalsContact C-N 3.28Å; E291-V293 PolarHBondContact O-N 2.9Å; V293-L299 HydrophobicContact CB-CD1 4.36Å; V293-L299 HydrophobicContact CG1-CD1 4.09Å; V293-L299 HydrophobicContact CG2-CD1 3.97Å; V293-N578 HydrophobicContact CG2-CB 3.59Å; V293-Q580 HydrophobicContact CB-CG 4.28Å; V293-Q580 HydrophobicContact CG1-CG 4Å
294	R	80.7	Confident	86.9	Confident	88 Å²	88	39 Å²	39	33%	0.332	19%	0.189	S	C	.	.	H	α-helix	trans	-74.9	-33.6	176.3	-70.7	-173	-170.9	86.7	16.1	114.1	G130 E290 E291 I292 Q580	G130-R294 VanDerWaalsContact C-NH2 3.28Å; G130-R294 PolarHBondContact O-NH1 3.4Å; G130-R294 VanDerWaalsContact O-NH1 3.08Å; G130-R294 PolarHBondContact O-NH2 3.2Å; E290-R294 WeakPolarHBondContact O-CG 3.13Å; E290-R294 PolarHBondContact O-N 3.37Å; E290-R294 PolarHBondContact O-NH1 3.27Å; E291-R294 PolarHBondContact O-N 3.41Å; I292-R294 VanDerWaalsContact C-N 3.3Å; I292-R294 PolarHBondContact O-N 3.25Å; R294-Q580 VanDerWaalsContact CG-NE2 3.27Å
295	M	81.4	Confident	87.3	Confident	97 Å²	97	37 Å²	37	48%	0.478	18%	0.177	S	C	.	.	H	α-helix	trans	-90.9	-16	-173.4	-68.6	-169	63.1	0	0	113.4	T275 R287 E291 I292	T275-M295 HydrophobicContact CG2-CB 4.37Å; R287-M295 VanDerWaalsContact CD-SD 3.6Å; R287-M295 PolarHBondContact NE-SD 3.17Å; E291-M295 WeakPolarHBondContact O-CB 3.48Å; E291-M295 WeakPolarHBondContact O-CG 3.34Å; E291-M295 PolarHBondContact O-N 2.76Å; I292-M295 PolarHBondContact O-N 3.37Å
296	S	85	Confident	87.5	Confident	19 Å²	19	32 Å²	32	13%	0.133	16%	0.158	C	C	.	.			trans	-93.8	141.1	-177	-49.7	0	0	0	0	112.1	G267 F268 T275 I292 N298	G267-S296 VanDerWaalsContact CA-OG 3.23Å; G267-S296 WeakPolarHBondContact CA-OG 3.37Å; F268-S296 CarbonylContact O-C 3.58Å; F268-S296 VanDerWaalsContact O-CA 3.27Å; F268-S296 WeakPolarHBondContact O-CA 3.46Å; F268-S296 WeakPolarHBondContact O-CB 3.18Å; T275-S296 PolarHBondContact OG1-OG 2.71Å; I292-S296 VanDerWaalsContact O-CB 3.29Å; I292-S296 WeakPolarHBondContact O-CB 3.33Å; I292-S296 PolarHBondContact O-N 3.36Å; I292-S296 PolarHBondContact O-OG 2.77Å; S296-N298 WeakPolarHBondContact CB-O 3.41Å
297	S	80.1	Confident	87.5	Confident	49 Å²	49	27 Å²	27	34%	0.343	14%	0.142	S	C	.	.	S	Bend	trans	-86.2	-24.9	163.6	58	0	0	0	0	112.3	F268 D269 I270 Q458	F268-S297 PolarHBondContact O-N 3.16Å; F268-S297 PolarHBondContact O-OG 3.02Å; D269-S297 PolarHBondContact O-OG 3.44Å; I270-S297 WeakPolarHBondContact CA-OG 3.44Å; I270-S297 PolarHBondContact N-OG 2.94Å; I270-S297 VanDerWaalsContact N-OG 3.13Å; S297-Q458 PolarHBondContact O-NE2 2.73Å; S297-Q458 VanDerWaalsContact O-NE2 3.09Å
298	N	82.5	Confident	87.5	Confident	10 Å²	10	27.3 Å²	27.3	5%	0.053	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	143.1	179.1	-66.2	-62.3	0	0	0	111	F268 S296 S454 C455 Q458	F268-N298 HydrophobicContact CB-CB 4.49Å; F268-N298 PolarHBondContact N-O 2.75Å; F268-N298 PolarHBondContact O-N 3.04Å; S296-N298 WeakPolarHBondContact CB-O 3.41Å; N298-S454 VanDerWaalsContact CB-OG 3.27Å; N298-S454 WeakPolarHBondContact CB-OG 3.26Å; N298-S454 PolarHBondContact OD1-O 3.3Å; N298-C455 PolarHBondContact ND2-SG 3.03Å; N298-C455 VanDerWaalsContact ND2-SG 3.37Å; N298-Q458 PolarHBondContact ND2-NE2 3.37Å; N298-Q458 VanDerWaalsContact OD1-CD 3.3Å; N298-Q458 WeakPolarHBondContact OD1-CG 3.08Å; N298-Q458 PolarHBondContact OD1-NE2 3.19Å
299	L	89.8	Confident	87.5	Confident	42 Å²	42	28.3 Å²	28.3	22%	0.22	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	138.2	-176.5	-67.5	177.7	0	0	0	111.2	L265 I292 V293	L265-L299 HydrophobicContact CD1-CB 4.17Å; L265-L299 HydrophobicContact CD1-CD2 4.34Å; L265-L299 HydrophobicContact CD2-CD1 4.37Å; L265-L299 HydrophobicContact CD2-CD2 3.98Å; L265-L299 HydrophobicContact CG-CD2 4.13Å; I292-L299 HydrophobicContact CG2-CD2 4.21Å; V293-L299 HydrophobicContact CB-CD1 4.36Å; V293-L299 HydrophobicContact CG1-CD1 4.09Å; V293-L299 HydrophobicContact CG2-CD1 3.97Å
300	L	92.6	Very high	87.6	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	126.1	178.7	-173.7	69.2	0	0	0	109.3	L211 V213 L266 F268 L302 L450 L453	L211-L300 HydrophobicContact CB-CD1 4.14Å; L211-L300 HydrophobicContact CD2-CD1 3.79Å; L211-L300 HydrophobicContact CG-CD1 3.56Å; V213-L300 HydrophobicContact CG2-CD1 3.7Å; V213-L300 HydrophobicContact CG2-CG 4.43Å; L266-L300 HydrophobicContact CB-CB 4.34Å; L266-L300 HydrophobicContact CD2-CD2 4.3Å; L266-L300 PolarHBondContact N-O 2.89Å; L266-L300 PolarHBondContact O-N 2.93Å; F268-L300 HydrophobicContact CE2-CB 4.44Å; L300-L302 HydrophobicContact CD2-CD2 3.83Å; L300-L302 HydrophobicContact CG-CD2 4.18Å; L300-L450 HydrophobicContact CD2-CB 4.1Å; L300-L450 HydrophobicContact CD2-CD1 4.47Å; L300-L450 HydrophobicContact CD2-CD2 3.94Å; L300-L450 HydrophobicContact CD2-CG 4.38Å; L300-L453 HydrophobicContact CD1-CD2 4.32Å
301	T	93.9	Very high	87.9	Confident	8 Å²	8	34.8 Å²	34.8	5%	0.049	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	120.8	170.4	-66.5	0	0	0	0	109.8	L211 V213 R263	L211-T301 PolarHBondContact O-N 3.17Å; V213-T301 PolarHBondContact N-O 2.66Å; R263-T301 HydrophobicContact CB-CG2 4.36Å; R263-T301 HydrophobicContact CG-CG2 4.32Å
302	L	95.2	Very high	88	Confident	2 Å²	2	32.1 Å²	32.1	1%	0.01	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	127.5	168.4	-58.1	-176.4	0	0	0	109.7	V213 L215 I227 L230 T231 R263 E264 L266 L300	V213-L302 HydrophobicContact CB-CD2 4.29Å; L215-L302 HydrophobicContact CD1-CB 4.22Å; L215-L302 HydrophobicContact CD1-CD2 4.29Å; I227-L302 HydrophobicContact CG2-CB 4.42Å; I227-L302 HydrophobicContact CG2-CD1 4.3Å; L230-L302 HydrophobicContact CD1-CD1 4.38Å; T231-L302 HydrophobicContact CG2-CD1 4.46Å; R263-L302 WeakPolarHBondContact CA-O 3.17Å; E264-L302 PolarHBondContact N-O 3.15Å; E264-L302 PolarHBondContact O-N 3.47Å; L266-L302 HydrophobicContact CB-CD1 4.45Å; L266-L302 HydrophobicContact CD2-CD1 4.36Å; L300-L302 HydrophobicContact CD2-CD2 3.83Å; L300-L302 HydrophobicContact CG-CD2 4.18Å
303	L	94.4	Very high	88.1	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	113.7	177.9	175.2	69.5	0	0	0	109.5	V213 A214 L215 L261 R263 L305 N322	V213-L303 PolarHBondContact O-N 3.12Å; A214-L303 HydrophobicContact CB-CD2 4.32Å; L215-L303 PolarHBondContact N-O 3.05Å; L261-L303 HydrophobicContact CB-CD1 4.49Å; R263-L303 HydrophobicContact CG-CD1 3.76Å; L303-L305 HydrophobicContact CD2-CD2 3.87Å; L303-L305 HydrophobicContact CD2-CG 4.45Å; L303-L305 HydrophobicContact CG-CD2 3.9Å; L303-L305 HydrophobicContact CG-CG 4.29Å; L303-N322 HydrophobicContact CD2-CB 3.97Å
304	D	94.2	Very high	88.2	Confident	1 Å²	1	40.3 Å²	40.3	1%	0.005	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81	128.9	173.1	-161.8	12.4	0	0	0	110.2	K223 S224 I227 T258 S262	K223-D304 WeakPolarHBondContact CB-OD1 3.4Å; S224-D304 WeakPolarHBondContact CB-OD2 3.43Å; S224-D304 PolarHBondContact OG-OD2 2.85Å; I227-D304 HydrophobicContact CD1-CB 3.46Å; I227-D304 VanDerWaalsContact CD1-CB 3.46Å; T258-D304 WeakPolarHBondContact CG2-OD2 3.44Å; S262-D304 PolarHBondContact O-N 2.92Å; S262-D304 WeakPolarHBondContact OG-CB 3.34Å
305	L	92.4	Very high	88.8	Confident	1 Å²	1	36.1 Å²	36.1	1%	0.005	18%	0.181	C	C	.	.			trans	-115.2	136.2	178.7	-59.8	172.3	0	0	0	110.3	A214 L215 V216 K223 L261 L303 G307 T315 I319	A214-L305 HydrophobicContact CB-CD1 3.75Å; L215-L305 WeakPolarHBondContact O-CB 3.41Å; L215-L305 PolarHBondContact O-N 2.86Å; V216-L305 HydrophobicContact CG1-CD1 3.56Å; K223-L305 WeakPolarHBondContact CE-O 3.46Å; L261-L305 HydrophobicContact CD2-CD2 3.6Å; L303-L305 HydrophobicContact CD2-CD2 3.87Å; L303-L305 HydrophobicContact CD2-CG 4.45Å; L303-L305 HydrophobicContact CG-CD2 3.9Å; L303-L305 HydrophobicContact CG-CG 4.29Å; L305-G307 PolarHBondContact O-N 2.82Å; L305-T315 HydrophobicContact CB-CG2 3.92Å; L305-T315 HydrophobicContact CD1-CG2 4.25Å; L305-T315 HydrophobicContact CD2-CG2 4.41Å; L305-T315 HydrophobicContact CG-CG2 4.44Å; L305-I319 HydrophobicContact CD1-CD1 3.83Å; L305-I319 HydrophobicContact CD1-CG1 3.54Å; L305-I319 HydrophobicContact CD2-CG1 4.29Å
306	A	90.6	Very high	89.3	Confident	1 Å²	1	31.6 Å²	31.6	1%	0.008	16%	0.159	C	C	.	.			trans	-63.5	129.8	-176.6	0	0	0	0	0	111.6	Y311 T315	A306-Y311 VanDerWaalsContact CB-CB 3.48Å; A306-Y311 HydrophobicContact CB-CD2 4.35Å; A306-Y311 HydrophobicContact CB-CG 4.27Å; A306-T315 PolarHBondContact N-OG1 2.88Å; A306-T315 PolarHBondContact O-OG1 3.15Å
307	G	85.2	Confident	89.6	Confident	8 Å²	8	31.4 Å²	31.4	8%	0.082	16%	0.159	C	C	.	.			trans	-90.9	7.3	-175.8	0	0	0	0	0	115.8	G217 G218 M219 L305 I340	G217-G307 VanDerWaalsContact O-CA 3.25Å; G217-G307 WeakPolarHBondContact O-CA 3.28Å; G218-G307 CarbonylContact C-O 3.59Å; M219-G307 PolarHBondContact N-O 2.6Å; L305-G307 PolarHBondContact O-N 2.82Å; G307-I340 WeakPolarHBondContact O-CD1 2.97Å
308	H	88.1	Confident	90	Very high	46 Å²	46	29.1 Å²	29.1	21%	0.213	14%	0.142	C	C	.	.	S	Bend	trans	-115.5	137	-176	-173.2	-71.9	0	0	0	110.6	R257 K310 Y311	R257-H308 PolarHBondContact NH1-CD2 3.07Å; R257-H308 PolarHBondContact NH1-NE2 3.36Å; H308-K310 VanDerWaalsContact C-N 3.31Å; H308-K310 VanDerWaalsContact ND1-CB 3.27Å; H308-K310 WeakPolarHBondContact ND1-CB 3.27Å; H308-K310 PolarHBondContact ND1-N 3.37Å; H308-K310 VanDerWaalsContact ND1-N 3.18Å; H308-K310 PolarHBondContact O-N 2.97Å; H308-Y311 HydrophobicContact CB-CD2 4.09Å; H308-Y311 PolarHBondContact O-N 3.07Å
309	S	85.1	Confident	90.5	Very high	61 Å²	61	29 Å²	29	43%	0.427	14%	0.142	S	C	.	.	G	3₁₀ helix	trans	-51.5	-43.9	-175.4	55.3	0	0	0	0	113.7	Y311 Q312	S309-Y311 PolarHBondContact O-N 2.94Å; S309-Q312 WeakPolarHBondContact O-CB 3.08Å; S309-Q312 PolarHBondContact O-N 3.15Å
310	K	87.7	Confident	90.6	Very high	157 Å²	157	27.6 Å²	27.6	68%	0.683	14%	0.137	S	C	*	.	G	3₁₀ helix	trans	-45.9	-32.2	171.9	-172.4	176.8	-179.8	178	0	114.8	H308	H308-K310 VanDerWaalsContact C-N 3.31Å; H308-K310 VanDerWaalsContact ND1-CB 3.27Å; H308-K310 WeakPolarHBondContact ND1-CB 3.27Å; H308-K310 PolarHBondContact ND1-N 3.37Å; H308-K310 VanDerWaalsContact ND1-N 3.18Å; H308-K310 PolarHBondContact O-N 2.97Å
311	Y	88.3	Confident	90.4	Very high	43 Å²	43	28.5 Å²	28.5	17%	0.169	14%	0.143	C	C	.	.	G	3₁₀ helix	trans	-105.4	10.3	-178.2	-54.9	-57.5	0	0	0	113.2	T258 A306 H308 S309 R313 T314 T315	T258-Y311 WeakPolarHBondContact O-CD2 3.23Å; A306-Y311 VanDerWaalsContact CB-CB 3.48Å; A306-Y311 HydrophobicContact CB-CD2 4.35Å; A306-Y311 HydrophobicContact CB-CG 4.27Å; H308-Y311 HydrophobicContact CB-CD2 4.09Å; H308-Y311 PolarHBondContact O-N 3.07Å; S309-Y311 PolarHBondContact O-N 2.94Å; Y311-R313 PolarHBondContact O-N 3.2Å; Y311-T314 WeakPolarHBondContact O-CA 3.47Å; Y311-T314 VanDerWaalsContact O-CB 3.25Å; Y311-T314 WeakPolarHBondContact O-CB 3.48Å; Y311-T314 PolarHBondContact O-N 2.76Å; Y311-T315 PolarHBondContact O-N 2.83Å; Y311-T315 VanDerWaalsContact O-N 3.1Å
312	Q	87.1	Confident	90.1	Very high	16 Å²	16	28.8 Å²	28.8	8%	0.075	14%	0.144	C	C	.	.	H	α-helix	trans	-55.6	-37.1	-179.4	-174	-177.6	89.9	0	0	112.3	S309 T314 T315 L316 D343 G863 K866	S309-Q312 WeakPolarHBondContact O-CB 3.08Å; S309-Q312 PolarHBondContact O-N 3.15Å; Q312-T314 VanDerWaalsContact C-N 3.28Å; Q312-T314 PolarHBondContact O-N 3.32Å; Q312-T315 WeakPolarHBondContact O-CB 3.48Å; Q312-T315 PolarHBondContact O-N 3.37Å; Q312-T315 VanDerWaalsContact O-N 3.14Å; Q312-L316 HydrophobicContact CG-CD1 4.2Å; Q312-L316 HydrophobicContact CG-CG 4.29Å; Q312-L316 WeakPolarHBondContact O-CG 3.49Å; Q312-L316 PolarHBondContact O-N 2.86Å; Q312-D343 PolarHBondContact NE2-OD2 3.3Å; Q312-G863 PolarHBondContact OE1-O 2.8Å; Q312-K866 VanDerWaalsContact CD-CE 3.49Å
313	R	88.7	Confident	89.8	Confident	152 Å²	152	32.2 Å²	32.2	57%	0.574	16%	0.16	S	C	*	.	H	α-helix	trans	-57.3	-39.7	173.5	-69.3	-167.8	152.2	165.3	-6.8	113	Y311 A317 S792 Y794	Y311-R313 PolarHBondContact O-N 3.2Å; R313-A317 WeakPolarHBondContact O-CB 3.35Å; R313-A317 PolarHBondContact O-N 3.39Å; R313-A317 VanDerWaalsContact O-N 3.1Å; R313-S792 PolarHBondContact NH2-OG 3.44Å; R313-Y794 WeakPolarHBondContact CA-OH 3.39Å; R313-Y794 VanDerWaalsContact CB-OH 3.3Å; R313-Y794 WeakPolarHBondContact CB-OH 3.28Å; R313-Y794 VanDerWaalsContact CG-OH 3.25Å; R313-Y794 WeakPolarHBondContact CG-OH 3.31Å; R313-Y794 WeakPolarHBondContact O-CE1 3.5Å
314	T	89.7	Confident	89.7	Confident	45 Å²	45	32.4 Å²	32.4	28%	0.276	16%	0.161	S	C	.	.	H	α-helix	trans	-67.4	-43.7	175.9	-49.5	0	0	0	0	110.4	L261 Y311 Q312 A317 G318	L261-T314 HydrophobicContact CD1-CG2 4.17Å; L261-T314 HydrophobicContact CD2-CG2 4.03Å; L261-T314 HydrophobicContact CG-CG2 3.66Å; Y311-T314 WeakPolarHBondContact O-CA 3.47Å; Y311-T314 VanDerWaalsContact O-CB 3.25Å; Y311-T314 WeakPolarHBondContact O-CB 3.48Å; Y311-T314 PolarHBondContact O-N 2.76Å; Q312-T314 VanDerWaalsContact C-N 3.28Å; Q312-T314 PolarHBondContact O-N 3.32Å; T314-A317 PolarHBondContact O-N 2.82Å; T314-G318 PolarHBondContact O-N 3.19Å
315	T	92.1	Very high	89.5	Confident	0 Å²	0	32.8 Å²	32.8	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-61	-46.5	176.3	-65.7	0	0	0	0	112.6	L305 A306 Y311 Q312 G318 I319	L305-T315 HydrophobicContact CB-CG2 3.92Å; L305-T315 HydrophobicContact CD1-CG2 4.25Å; L305-T315 HydrophobicContact CD2-CG2 4.41Å; L305-T315 HydrophobicContact CG-CG2 4.44Å; A306-T315 PolarHBondContact N-OG1 2.88Å; A306-T315 PolarHBondContact O-OG1 3.15Å; Y311-T315 PolarHBondContact O-N 2.83Å; Y311-T315 VanDerWaalsContact O-N 3.1Å; Q312-T315 WeakPolarHBondContact O-CB 3.48Å; Q312-T315 PolarHBondContact O-N 3.37Å; Q312-T315 VanDerWaalsContact O-N 3.14Å; T315-G318 PolarHBondContact O-N 2.73Å; T315-I319 HydrophobicContact CG2-CD1 4.07Å; T315-I319 WeakPolarHBondContact O-CG1 3.45Å; T315-I319 PolarHBondContact O-N 2.87Å
316	L	92.6	Very high	89.6	Confident	2 Å²	2	32.8 Å²	32.8	1%	0.01	16%	0.163	C	C	.	.	H	α-helix	trans	-64.6	-43.9	178.3	-66.2	176.1	0	0	0	112.2	Q312 G318 I319 A320 L347 Y794 I858 T860	Q312-L316 HydrophobicContact CG-CD1 4.2Å; Q312-L316 HydrophobicContact CG-CG 4.29Å; Q312-L316 WeakPolarHBondContact O-CG 3.49Å; Q312-L316 PolarHBondContact O-N 2.86Å; L316-G318 VanDerWaalsContact C-N 3.3Å; L316-G318 PolarHBondContact O-N 2.94Å; L316-I319 PolarHBondContact O-N 2.87Å; L316-A320 WeakPolarHBondContact O-CB 3.35Å; L316-A320 PolarHBondContact O-N 2.9Å; L316-L347 HydrophobicContact CD2-CD1 4.05Å; L316-L347 HydrophobicContact CD2-CD2 3.5Å; L316-L347 HydrophobicContact CD2-CG 4.45Å; L316-Y794 HydrophobicContact CB-CD1 4.2Å; L316-Y794 HydrophobicContact CB-CD2 4.08Å; L316-Y794 HydrophobicContact CB-CE1 4.15Å; L316-Y794 HydrophobicContact CB-CE2 4.04Å; L316-Y794 HydrophobicContact CB-CG 4.17Å; L316-Y794 HydrophobicContact CD1-CD2 4.28Å; L316-Y794 HydrophobicContact CD1-CE2 3.87Å; L316-I858 HydrophobicContact CD2-CD1 4.36Å; L316-I858 HydrophobicContact CD2-CG2 4.34Å; L316-T860 HydrophobicContact CD1-CG2 3.47Å; L316-T860 VanDerWaalsContact CD1-CG2 3.47Å
317	A	90.6	Very high	89.7	Confident	16 Å²	16	32.7 Å²	32.7	13%	0.132	16%	0.162	C	C	.	.	H	α-helix	trans	-61.5	-39.6	171.9	0	0	0	0	0	111.7	R313 T314 A320 C321 Y794	R313-A317 WeakPolarHBondContact O-CB 3.35Å; R313-A317 PolarHBondContact O-N 3.39Å; R313-A317 VanDerWaalsContact O-N 3.1Å; T314-A317 PolarHBondContact O-N 2.82Å; A317-A320 PolarHBondContact O-N 2.91Å; A317-C321 WeakPolarHBondContact O-CB 3.17Å; A317-C321 PolarHBondContact O-N 3.2Å; A317-C321 PolarHBondContact O-SG 3.41Å; A317-Y794 HydrophobicContact CB-CD1 3.99Å; A317-Y794 HydrophobicContact CB-CE1 3.97Å
318	G	90.1	Very high	90.3	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-61.8	-43.6	177.7	0	0	0	0	0	113.2	T314 T315 L316 N322	T314-G318 PolarHBondContact O-N 3.19Å; T315-G318 PolarHBondContact O-N 2.73Å; L316-G318 VanDerWaalsContact C-N 3.3Å; L316-G318 PolarHBondContact O-N 2.94Å; G318-N322 WeakPolarHBondContact O-CB 3.31Å; G318-N322 PolarHBondContact O-N 2.91Å; G318-N322 PolarHBondContact O-ND2 2.86Å
319	I	91.9	Very high	90.6	Very high	8 Å²	8	30.4 Å²	30.4	4%	0.041	15%	0.15	C	C	.	.	H	α-helix	trans	-66.8	-48.4	175.5	-65.2	164.6	0	0	0	110.3	L305 T315 L316 Q323 P324 L347 L351	L305-I319 HydrophobicContact CD1-CD1 3.83Å; L305-I319 HydrophobicContact CD1-CG1 3.54Å; L305-I319 HydrophobicContact CD2-CG1 4.29Å; T315-I319 HydrophobicContact CG2-CD1 4.07Å; T315-I319 WeakPolarHBondContact O-CG1 3.45Å; T315-I319 PolarHBondContact O-N 2.87Å; L316-I319 PolarHBondContact O-N 2.87Å; I319-Q323 PolarHBondContact O-N 3.14Å; I319-P324 HydrophobicContact CG2-CG 4.15Å; I319-P324 WeakPolarHBondContact O-CD 3.46Å; I319-L347 HydrophobicContact CD1-CD2 3.49Å; I319-L347 VanDerWaalsContact CD1-CD2 3.49Å; I319-L347 HydrophobicContact CD1-CG 4.5Å; I319-L351 HydrophobicContact CG2-CD1 3.5Å
320	A	91.7	Very high	91.1	Very high	13 Å²	13	27.6 Å²	27.6	11%	0.107	13%	0.13	C	C	.	.	H	α-helix	trans	-63.4	-50.9	-179	0	0	0	0	0	112.9	L316 A317 Q323 G796	L316-A320 WeakPolarHBondContact O-CB 3.35Å; L316-A320 PolarHBondContact O-N 2.9Å; A317-A320 PolarHBondContact O-N 2.91Å; A320-Q323 WeakPolarHBondContact O-CG 3.21Å; A320-G796 CarbonylContact C-O 3.4Å; A320-G796 WeakPolarHBondContact O-CA 3.42Å
321	C	88.2	Confident	91.5	Very high	19 Å²	19	20.3 Å²	20.3	13%	0.128	10%	0.098	C	C	.	.	H	α-helix	trans	-69.5	-35.1	-175.3	-66.4	0	0	0	0	113.8	A317 N528 G796	A317-C321 WeakPolarHBondContact O-CB 3.17Å; A317-C321 PolarHBondContact O-N 3.2Å; A317-C321 PolarHBondContact O-SG 3.41Å; C321-N528 PolarHBondContact O-ND2 2.9Å; C321-G796 WeakPolarHBondContact CA-O 3.15Å; C321-G796 PolarHBondContact N-O 3.44Å; C321-G796 PolarHBondContact SG-O 3.5Å
322	N	87.6	Confident	91.8	Very high	14 Å²	14	18.3 Å²	18.3	8%	0.075	9%	0.091	C	C	.	.	H	α-helix	trans	-93.3	-16.2	-176.6	-62.7	-70.5	0	0	0	113.3	R263 L303 G318 R545	R263-N322 WeakPolarHBondContact CD-OD1 3.41Å; R263-N322 PolarHBondContact NH1-OD1 3.32Å; L303-N322 HydrophobicContact CD2-CB 3.97Å; G318-N322 WeakPolarHBondContact O-CB 3.31Å; G318-N322 PolarHBondContact O-N 2.91Å; G318-N322 PolarHBondContact O-ND2 2.86Å; N322-R545 PolarHBondContact O-NH1 2.9Å
323	Q	88.8	Confident	92	Very high	73 Å²	73	17.5 Å²	17.5	34%	0.341	9%	0.087	S	C	.	.			trans	43.5	68.7	-176.2	-65.4	170.1	-61.9	0	0	111.9	I319 A320 W526 R545	I319-Q323 PolarHBondContact O-N 3.14Å; A320-Q323 WeakPolarHBondContact O-CG 3.21Å; Q323-W526 HydrophobicContact CG-CZ3 4.45Å; Q323-R545 PolarHBondContact O-NH1 3.09Å; Q323-R545 VanDerWaalsContact O-NH1 3.08Å
324	P	92.5	Very high	92.1	Very high	5 Å²	5	13 Å²	13	3%	0.032	8%	0.077	C	C	.	.			trans	-63.3	141	175.7	30.1	-34.8	0	0	0	109.7	C212 A214 I319 L353	C212-P324 CarbonylContact O-C 3.57Å; C212-P324 WeakPolarHBondContact O-CA 3.35Å; A214-P324 HydrophobicContact CB-CB 3.56Å; A214-P324 HydrophobicContact CB-CG 3.7Å; I319-P324 HydrophobicContact CG2-CG 4.15Å; I319-P324 WeakPolarHBondContact O-CD 3.46Å; P324-L353 HydrophobicContact CG-CD1 4.17Å; P324-L353 WeakPolarHBondContact O-CD1 3.43Å; P324-L353 WeakPolarHBondContact O-CD2 3.33Å
325	I	91.5	Very high	92.1	Very high	9 Å²	9	15.4 Å²	15.4	5%	0.046	9%	0.087	C	C	.	.	S	Bend	trans	-84.9	-23.3	179.8	-60.1	169.5	0	0	0	110	L211 C212 P354 I507	L211-I325 HydrophobicContact CD1-CB 4.15Å; L211-I325 HydrophobicContact CD1-CD1 3.85Å; L211-I325 HydrophobicContact CD1-CG2 4.42Å; C212-I325 PolarHBondContact O-N 3.36Å; I325-P354 WeakPolarHBondContact O-CD 3.46Å; I325-I507 HydrophobicContact CG2-CG1 4.2Å; I325-I507 HydrophobicContact CG2-CG2 4.01Å
326	I	93.1	Very high	91.9	Very high	0 Å²	0	15.7 Å²	15.7	0%	0	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	145.8	-179	-52.3	172.7	0	0	0	110.2	V213 A214 I356 L453 I507	V213-I326 WeakPolarHBondContact CA-O 3.36Å; V213-I326 HydrophobicContact CG1-CB 4.34Å; V213-I326 HydrophobicContact CG2-CB 4.3Å; V213-I326 HydrophobicContact CG2-CD1 4.43Å; A214-I326 PolarHBondContact N-O 3.46Å; I326-I356 HydrophobicContact CG2-CD1 3.69Å; I326-I356 HydrophobicContact CG2-CG1 4.25Å; I326-L453 HydrophobicContact CD1-CD1 3.38Å; I326-L453 HydrophobicContact CD1-CD2 3.52Å; I326-L453 HydrophobicContact CD1-CG 4.06Å; I326-I507 HydrophobicContact CD1-CD1 3.4Å; I326-I507 HydrophobicContact CD1-CG1 4.3Å; I326-I507 HydrophobicContact CG1-CD1 3.79Å; I326-I507 HydrophobicContact CG1-CG1 4.26Å
327	G	94.3	Very high	91.7	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	124.6	166.7	0	0	0	0	0	113.1	A214 P354 M355 I356	A214-G327 CarbonylContact O-C 3.55Å; A214-G327 WeakPolarHBondContact O-CA 3.46Å; G327-P354 PolarHBondContact N-O 3.04Å; G327-M355 CarbonylContact O-C 3.56Å; G327-M355 VanDerWaalsContact O-CA 3.25Å; G327-M355 WeakPolarHBondContact O-CA 3.29Å; G327-M355 WeakPolarHBondContact O-CG 3.4Å; G327-I356 PolarHBondContact O-N 3.06Å
328	I	95.9	Very high	91.6	Very high	5 Å²	5	18.3 Å²	18.3	3%	0.026	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	112.3	166.8	-66.3	173.5	0	0	0	108.3	V213 A214 L215 V216 V330 I356 V358 L450	V213-I328 HydrophobicContact CG1-CD1 3.5Å; V213-I328 VanDerWaalsContact CG1-CD1 3.5Å; V213-I328 HydrophobicContact CG1-CG1 3.6Å; A214-I328 PolarHBondContact O-N 3.2Å; L215-I328 CarbonylContact C-O 3.55Å; L215-I328 WeakPolarHBondContact CA-O 3.42Å; L215-I328 HydrophobicContact CG-CB 4.23Å; L215-I328 HydrophobicContact CG-CG2 4.46Å; V216-I328 PolarHBondContact N-O 2.7Å; I328-V330 HydrophobicContact CG2-CG2 3.96Å; I328-V330 PolarHBondContact O-N 2.89Å; I328-I356 CarbonylContact C-O 3.57Å; I328-I356 WeakPolarHBondContact CA-O 3.11Å; I328-I356 HydrophobicContact CG1-CB 4.23Å; I328-I356 HydrophobicContact CG1-CD1 4.04Å; I328-V358 HydrophobicContact CG2-CB 4.17Å; I328-V358 HydrophobicContact CG2-CG2 3.59Å; I328-L450 HydrophobicContact CD1-CD2 4.16Å
329	L	95.5	Very high	91.4	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	109.6	171.8	178.8	71	0	0	0	110.2	V216 I331 L337 I345 M355 I356 I357 V358	V216-L329 HydrophobicContact CG2-CB 4.23Å; V216-L329 HydrophobicContact CG2-CD1 3.9Å; L329-I331 HydrophobicContact CD2-CD1 3.78Å; L329-I331 HydrophobicContact CD2-CG1 4.08Å; L329-I331 HydrophobicContact CG-CD1 4.19Å; L329-I331 HydrophobicContact CG-CG1 3.93Å; L329-L337 HydrophobicContact CD2-CD1 4.44Å; L329-I345 HydrophobicContact CD1-CG1 4.17Å; L329-I345 HydrophobicContact CD2-CD1 3.66Å; L329-I345 HydrophobicContact CD2-CG1 3.57Å; L329-I345 HydrophobicContact CG-CG1 4.47Å; L329-M355 HydrophobicContact CB-CG 4.3Å; L329-M355 HydrophobicContact CB-SD 3.99Å; L329-M355 HydrophobicContact CD2-SD 4.18Å; L329-I356 PolarHBondContact N-O 3.41Å; L329-I357 HydrophobicContact CD2-CG1 4.37Å; L329-I357 WeakPolarHBondContact O-CA 3.47Å; L329-V358 PolarHBondContact O-N 3.31Å
330	V	96.2	Very high	91.2	Very high	2 Å²	2	23.6 Å²	23.6	1%	0.012	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	120.9	177.2	-168.3	0	0	0	0	110.2	L215 V216 S221 K223 L226 I328 V358 T360	L215-V330 HydrophobicContact CB-CG2 4.38Å; L215-V330 HydrophobicContact CD2-CG2 3.95Å; L215-V330 HydrophobicContact CG-CG2 4.42Å; V216-V330 PolarHBondContact O-N 2.85Å; S221-V330 WeakPolarHBondContact CB-O 3.34Å; S221-V330 WeakPolarHBondContact O-CG1 3.43Å; S221-V330 PolarHBondContact OG-O 2.9Å; K223-V330 HydrophobicContact CG-CB 3.74Å; K223-V330 HydrophobicContact CG-CG1 4.32Å; K223-V330 HydrophobicContact CG-CG2 3.78Å; L226-V330 HydrophobicContact CD2-CG2 4.33Å; I328-V330 HydrophobicContact CG2-CG2 3.96Å; I328-V330 PolarHBondContact O-N 2.89Å; V330-V358 WeakPolarHBondContact CA-O 3.42Å; V330-T360 HydrophobicContact CG1-CG2 3.41Å; V330-T360 VanDerWaalsContact CG1-CG2 3.41Å
331	I	95.3	Very high	91.1	Very high	4 Å²	4	23 Å²	23	2%	0.021	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	141.2	-178	-54.2	178.8	0	0	0	108.6	L329 G336 L337 I357 V358 L359 T360 L382	L329-I331 HydrophobicContact CD2-CD1 3.78Å; L329-I331 HydrophobicContact CD2-CG1 4.08Å; L329-I331 HydrophobicContact CG-CD1 4.19Å; L329-I331 HydrophobicContact CG-CG1 3.93Å; I331-G336 WeakPolarHBondContact CG2-O 3.34Å; I331-L337 HydrophobicContact CD1-CD1 4.08Å; I331-L337 HydrophobicContact CG1-CD1 4.4Å; I331-I357 HydrophobicContact CD1-CG2 3.81Å; I331-I357 HydrophobicContact CG1-CG2 4.46Å; I331-V358 PolarHBondContact N-O 3.29Å; I331-L359 HydrophobicContact CB-CD1 3.98Å; I331-L359 HydrophobicContact CG2-CD1 3.84Å; I331-L359 CarbonylContact O-C 3.56Å; I331-L359 WeakPolarHBondContact O-CA 3.46Å; I331-T360 PolarHBondContact O-N 2.81Å; I331-T360 PolarHBondContact O-OG1 3.02Å; I331-L382 HydrophobicContact CD1-CD1 3.81Å; I331-L382 HydrophobicContact CD1-CD2 3.62Å; I331-L382 HydrophobicContact CD1-CG 4.29Å
332	S	94.1	Very high	91	Very high	1 Å²	1	23.2 Å²	23.2	1%	0.007	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	135.1	170.4	175	0	0	0	0	111	T334 I335 G336	S332-T334 PolarHBondContact O-N 3.11Å; S332-T334 PolarHBondContact OG-N 3.22Å; S332-T334 VanDerWaalsContact OG-N 3.15Å; S332-T334 PolarHBondContact OG-OG1 3.16Å; S332-I335 PolarHBondContact O-N 3.2Å; S332-G336 WeakPolarHBondContact O-CA 3.28Å; S332-G336 PolarHBondContact O-N 2.84Å
333	A	92.6	Very high	91	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-27.8	170.7	0	0	0	0	0	113.7	L359 T360 I362 L365 I378	A333-L359 HydrophobicContact CB-CD1 4.29Å; A333-L359 HydrophobicContact CB-CD2 4.11Å; A333-L359 HydrophobicContact CB-CG 4.07Å; A333-T360 VanDerWaalsContact CB-O 3.25Å; A333-T360 WeakPolarHBondContact CB-O 3.44Å; A333-T360 PolarHBondContact N-O 2.97Å; A333-I362 HydrophobicContact CB-CG2 4.32Å; A333-L365 HydrophobicContact CB-CD1 3.99Å; A333-L365 HydrophobicContact CB-CG 4.26Å; A333-I378 WeakPolarHBondContact O-CD1 3.41Å
334	T	90.2	Very high	91	Very high	58 Å²	58	21.3 Å²	21.3	36%	0.356	13%	0.126	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.5	-45.1	179.4	53.4	0	0	0	0	112.9	S332 Q364	S332-T334 PolarHBondContact O-N 3.11Å; S332-T334 PolarHBondContact OG-N 3.22Å; S332-T334 VanDerWaalsContact OG-N 3.15Å; S332-T334 PolarHBondContact OG-OG1 3.16Å; T334-Q364 HydrophobicContact CG2-CB 3.59Å; T334-Q364 HydrophobicContact CG2-CG 4.43Å; T334-Q364 VanDerWaalsContact CG2-OE1 3.28Å
335	I	89.4	Confident	90.8	Very high	95 Å²	95	21.1 Å²	21.1	49%	0.487	12%	0.124	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.6	-32.5	-177.4	-57.8	172	0	0	0	111.4	D220 S332	D220-I335 HydrophobicContact CB-CD1 3.83Å; S332-I335 PolarHBondContact O-N 3.2Å
336	G	88.8	Confident	90.6	Very high	6 Å²	6	21.1 Å²	21.1	6%	0.062	12%	0.124	C	C	.	.	B	Isolated β-bridge	trans	71	-157.3	-165.1	0	0	0	0	0	112.2	I331 S332 S338	I331-G336 WeakPolarHBondContact CG2-O 3.34Å; S332-G336 WeakPolarHBondContact O-CA 3.28Å; S332-G336 PolarHBondContact O-N 2.84Å; G336-S338 PolarHBondContact O-N 3.11Å
337	L	88.2	Confident	90.4	Very high	41 Å²	41	21.1 Å²	21.1	22%	0.215	12%	0.124	C	C	.	.	S	Bend	trans	-79.2	109.9	-176.5	-176.5	65.6	0	0	0	111.6	L329 I331 L342 I345 L382 Q385	L329-L337 HydrophobicContact CD2-CD1 4.44Å; I331-L337 HydrophobicContact CD1-CD1 4.08Å; I331-L337 HydrophobicContact CG1-CD1 4.4Å; L337-L342 HydrophobicContact CD2-CD2 3.51Å; L337-L342 HydrophobicContact CD2-CG 3.75Å; L337-L342 HydrophobicContact CG-CD2 4.33Å; L337-L342 HydrophobicContact CG-CG 4.02Å; L337-I345 HydrophobicContact CD1-CD1 3.89Å; L337-I345 HydrophobicContact CD2-CD1 3.96Å; L337-L382 HydrophobicContact CD1-CD2 4.46Å; L337-L382 HydrophobicContact CD2-CD2 3.96Å; L337-Q385 HydrophobicContact CD2-CB 4.41Å; L337-Q385 HydrophobicContact CD2-CG 4.17Å
338	S	88.2	Confident	90.2	Very high	32 Å²	32	21.4 Å²	21.4	22%	0.224	13%	0.125	C	C	.	.			trans	-73.7	160.7	174	64.3	0	0	0	0	113.7	G218 G336 I340 G341 L342	G218-S338 WeakPolarHBondContact CA-OG 3.49Å; G336-S338 PolarHBondContact O-N 3.11Å; S338-I340 VanDerWaalsContact C-N 3.33Å; S338-I340 PolarHBondContact O-N 3.5Å; S338-G341 CarbonylContact O-C 3.51Å; S338-G341 VanDerWaalsContact O-CA 3.28Å; S338-G341 WeakPolarHBondContact O-CA 3.29Å; S338-G341 PolarHBondContact O-N 2.62Å; S338-G341 PolarHBondContact OG-N 2.77Å; S338-G341 VanDerWaalsContact OG-N 3.09Å; S338-L342 PolarHBondContact O-N 2.95Å
339	S	84.9	Confident	89.7	Confident	87 Å²	87	24.8 Å²	24.8	61%	0.608	14%	0.138	S	C	*	.	H	α-helix	trans	-55.2	-43.3	171.9	51.6	0	0	0	0	113.2	G341 L342 D343	S339-G341 PolarHBondContact O-N 3.08Å; S339-L342 WeakPolarHBondContact O-CB 3.37Å; S339-L342 PolarHBondContact O-N 3.26Å; S339-L342 VanDerWaalsContact O-N 3.14Å; S339-D343 PolarHBondContact O-N 3.06Å
340	I	87.8	Confident	89.2	Confident	31 Å²	31	24.8 Å²	24.8	16%	0.159	14%	0.138	C	C	.	.	H	α-helix	trans	-65.2	-30.5	174.6	-62	172.6	0	0	0	111.3	G307 S338 D343 H344	G307-I340 WeakPolarHBondContact O-CD1 2.97Å; S338-I340 VanDerWaalsContact C-N 3.33Å; S338-I340 PolarHBondContact O-N 3.5Å; I340-D343 WeakPolarHBondContact O-CB 3.28Å; I340-H344 WeakPolarHBondContact CG2-CE1 3.36Å; I340-H344 PolarHBondContact O-N 3.36Å; I340-H344 VanDerWaalsContact O-N 3.11Å; I340-H344 PolarHBondContact O-ND1 3.31Å; I340-H344 VanDerWaalsContact O-ND1 3.14Å
341	G	89.2	Confident	88.7	Confident	1 Å²	1	25.7 Å²	25.7	1%	0.01	14%	0.143	C	C	.	.	H	α-helix	trans	-63.2	-46.1	170.1	0	0	0	0	0	112.5	S338 S339 H344 I345	S338-G341 CarbonylContact O-C 3.51Å; S338-G341 VanDerWaalsContact O-CA 3.28Å; S338-G341 WeakPolarHBondContact O-CA 3.29Å; S338-G341 PolarHBondContact O-N 2.62Å; S338-G341 PolarHBondContact OG-N 2.77Å; S338-G341 VanDerWaalsContact OG-N 3.09Å; S339-G341 PolarHBondContact O-N 3.08Å; G341-H344 PolarHBondContact O-N 3.02Å; G341-I345 WeakPolarHBondContact O-CG1 3.44Å; G341-I345 PolarHBondContact O-N 3.16Å
342	L	87.6	Confident	88.2	Confident	24 Å²	24	28.1 Å²	28.1	13%	0.126	16%	0.156	C	C	.	.	H	α-helix	trans	-61.2	-46.3	174.9	-73.7	159.7	0	0	0	112.1	L337 S338 S339 H344 I345 Q346 Q385 I389 F772	L337-L342 HydrophobicContact CD2-CD2 3.51Å; L337-L342 HydrophobicContact CD2-CG 3.75Å; L337-L342 HydrophobicContact CG-CD2 4.33Å; L337-L342 HydrophobicContact CG-CG 4.02Å; S338-L342 PolarHBondContact O-N 2.95Å; S339-L342 WeakPolarHBondContact O-CB 3.37Å; S339-L342 PolarHBondContact O-N 3.26Å; S339-L342 VanDerWaalsContact O-N 3.14Å; L342-H344 PolarHBondContact O-N 3.08Å; L342-I345 HydrophobicContact CD2-CD1 4.49Å; L342-I345 WeakPolarHBondContact O-CB 3.19Å; L342-I345 PolarHBondContact O-N 3.09Å; L342-I345 VanDerWaalsContact O-N 3.14Å; L342-Q346 WeakPolarHBondContact O-CG 3.36Å; L342-Q346 PolarHBondContact O-N 3.4Å; L342-Q385 HydrophobicContact CD2-CB 4.3Å; L342-Q385 HydrophobicContact CD2-CG 4.29Å; L342-I389 HydrophobicContact CD2-CD1 4.45Å; L342-F772 HydrophobicContact CD1-CD2 3.96Å; L342-F772 HydrophobicContact CD2-CD2 4.2Å; L342-F772 HydrophobicContact CD2-CE2 4Å
343	D	86.3	Confident	87.9	Confident	42 Å²	42	29.7 Å²	29.7	23%	0.225	16%	0.164	C	C	.	.	H	α-helix	trans	-52.3	-41.8	172.8	-95.1	28.8	0	0	0	112.3	Q312 S339 I340 L347 K866	Q312-D343 PolarHBondContact NE2-OD2 3.3Å; S339-D343 PolarHBondContact O-N 3.06Å; I340-D343 WeakPolarHBondContact O-CB 3.28Å; D343-L347 WeakPolarHBondContact O-CB 3.49Å; D343-L347 PolarHBondContact O-N 2.85Å; D343-L347 VanDerWaalsContact O-N 3.08Å; D343-K866 VanDerWaalsContact CG-NZ 3.26Å; D343-K866 IonicContact OD2-NZ 3.84Å; D343-K866 PolarHBondContact OD2-NZ 2.94Å
344	H	89.5	Confident	87.8	Confident	5 Å²	5	30.5 Å²	30.5	2%	0.023	17%	0.169	C	C	.	.	H	α-helix	trans	-76.1	-34.1	178.9	-66.2	153.8	0	0	0	113.1	V216 G217 I340 G341 L342 L347 I348	V216-H344 HydrophobicContact CB-CB 3.79Å; V216-H344 HydrophobicContact CG1-CB 4.34Å; V216-H344 HydrophobicContact CG2-CB 3.92Å; G217-H344 PolarHBondContact N-ND1 3.39Å; G217-H344 VanDerWaalsContact N-ND1 3.2Å; I340-H344 WeakPolarHBondContact CG2-CE1 3.36Å; I340-H344 PolarHBondContact O-N 3.36Å; I340-H344 VanDerWaalsContact O-N 3.11Å; I340-H344 PolarHBondContact O-ND1 3.31Å; I340-H344 VanDerWaalsContact O-ND1 3.14Å; G341-H344 PolarHBondContact O-N 3.02Å; L342-H344 PolarHBondContact O-N 3.08Å; H344-L347 PolarHBondContact O-N 3.27Å; H344-I348 WeakPolarHBondContact O-CG1 3.11Å; H344-I348 PolarHBondContact O-N 2.66Å
345	I	89.4	Confident	87.8	Confident	1 Å²	1	28.5 Å²	28.5	1%	0.005	16%	0.156	C	C	.	.	H	α-helix	trans	-58.1	-53.3	171.2	-71	166.6	0	0	0	109.5	L329 L337 G341 L342 L347 I348 Y349 M355 F386 I389	L329-I345 HydrophobicContact CD1-CG1 4.17Å; L329-I345 HydrophobicContact CD2-CD1 3.66Å; L329-I345 HydrophobicContact CD2-CG1 3.57Å; L329-I345 HydrophobicContact CG-CG1 4.47Å; L337-I345 HydrophobicContact CD1-CD1 3.89Å; L337-I345 HydrophobicContact CD2-CD1 3.96Å; G341-I345 WeakPolarHBondContact O-CG1 3.44Å; G341-I345 PolarHBondContact O-N 3.16Å; L342-I345 HydrophobicContact CD2-CD1 4.49Å; L342-I345 WeakPolarHBondContact O-CB 3.19Å; L342-I345 PolarHBondContact O-N 3.09Å; L342-I345 VanDerWaalsContact O-N 3.14Å; I345-L347 VanDerWaalsContact C-N 3.28Å; I345-L347 PolarHBondContact O-N 3.29Å; I345-I348 PolarHBondContact O-N 3.33Å; I345-Y349 WeakPolarHBondContact O-CB 3.21Å; I345-Y349 PolarHBondContact O-N 3.06Å; I345-M355 HydrophobicContact CB-CE 4.22Å; I345-M355 HydrophobicContact CG1-CE 4.23Å; I345-M355 HydrophobicContact CG1-SD 4.28Å; I345-M355 HydrophobicContact CG2-CE 4.1Å; I345-F386 HydrophobicContact CD1-CZ 4.29Å; I345-F386 HydrophobicContact CG1-CZ 4.38Å; I345-F386 HydrophobicContact CG2-CD1 4.35Å; I345-F386 HydrophobicContact CG2-CE1 3.76Å; I345-F386 HydrophobicContact CG2-CZ 4.14Å; I345-I389 HydrophobicContact CB-CD1 4.42Å; I345-I389 HydrophobicContact CG2-CD1 3.62Å
346	Q	86.6	Confident	88	Confident	8 Å²	8	24 Å²	24	4%	0.037	13%	0.133	C	C	.	.	H	α-helix	trans	-57.4	-43.5	178.6	-67.5	-176.8	19.5	0	0	111.1	L342 Y349 S350 I389 L767 P768	L342-Q346 WeakPolarHBondContact O-CG 3.36Å; L342-Q346 PolarHBondContact O-N 3.4Å; Q346-Y349 PolarHBondContact O-N 3.47Å; Q346-S350 VanDerWaalsContact O-CB 3.25Å; Q346-S350 WeakPolarHBondContact O-CB 3.29Å; Q346-S350 PolarHBondContact O-N 3.02Å; Q346-S350 PolarHBondContact O-OG 2.97Å; Q346-I389 HydrophobicContact CG-CD1 4.26Å; Q346-L767 HydrophobicContact CB-CD2 4.09Å; Q346-L767 HydrophobicContact CB-CG 4.43Å; Q346-P768 PolarHBondContact NE2-O 3.22Å; Q346-P768 VanDerWaalsContact NE2-O 3.08Å; Q346-P768 PolarHBondContact OE1-O 3.45Å; Q346-P768 VanDerWaalsContact OE1-O 3.1Å
347	L	88.5	Confident	88.2	Confident	1 Å²	1	23.7 Å²	23.7	1%	0.005	13%	0.13	C	C	.	.	H	α-helix	trans	-62.6	-48	-179.8	-177.5	67.6	0	0	0	113.1	L316 I319 D343 H344 I345 S350 L351 L767 I858 I868	L316-L347 HydrophobicContact CD2-CD1 4.05Å; L316-L347 HydrophobicContact CD2-CD2 3.5Å; L316-L347 HydrophobicContact CD2-CG 4.45Å; I319-L347 HydrophobicContact CD1-CD2 3.49Å; I319-L347 VanDerWaalsContact CD1-CD2 3.49Å; I319-L347 HydrophobicContact CD1-CG 4.5Å; D343-L347 WeakPolarHBondContact O-CB 3.49Å; D343-L347 PolarHBondContact O-N 2.85Å; D343-L347 VanDerWaalsContact O-N 3.08Å; H344-L347 PolarHBondContact O-N 3.27Å; I345-L347 VanDerWaalsContact C-N 3.28Å; I345-L347 PolarHBondContact O-N 3.29Å; L347-S350 WeakPolarHBondContact O-CB 3.31Å; L347-S350 PolarHBondContact O-N 2.82Å; L347-L351 HydrophobicContact CD1-CD1 4.31Å; L347-L351 HydrophobicContact CG-CD1 4.16Å; L347-L351 WeakPolarHBondContact O-CG 3.5Å; L347-L351 PolarHBondContact O-N 3.16Å; L347-L767 HydrophobicContact CB-CD2 4.38Å; L347-L767 HydrophobicContact CD1-CD2 4.44Å; L347-I858 HydrophobicContact CD1-CD1 4.18Å; L347-I858 HydrophobicContact CD1-CG2 4.45Å; L347-I868 HydrophobicContact CD1-CD1 4.21Å
348	I	89.8	Confident	88.6	Confident	5 Å²	5	21.8 Å²	21.8	3%	0.026	12%	0.12	C	C	.	.	H	α-helix	trans	-61.6	-45.6	178.2	-73.2	168.9	0	0	0	110.6	V216 H344 I345 S350 L351 N352 L353 M355	V216-I348 HydrophobicContact CB-CD1 4.28Å; V216-I348 HydrophobicContact CG1-CD1 3.97Å; V216-I348 HydrophobicContact CG2-CD1 3.36Å; H344-I348 WeakPolarHBondContact O-CG1 3.11Å; H344-I348 PolarHBondContact O-N 2.66Å; I345-I348 PolarHBondContact O-N 3.33Å; I348-S350 VanDerWaalsContact C-N 3.33Å; I348-S350 PolarHBondContact O-N 3.18Å; I348-L351 CarbonylContact O-C 3.57Å; I348-L351 PolarHBondContact O-N 3.42Å; I348-L351 VanDerWaalsContact O-N 3.14Å; I348-N352 PolarHBondContact O-N 3.32Å; I348-L353 HydrophobicContact CG2-CB 3.9Å; I348-L353 WeakPolarHBondContact CG2-O 3.4Å; I348-L353 PolarHBondContact O-N 3.49Å; I348-M355 HydrophobicContact CB-CE 3.72Å; I348-M355 HydrophobicContact CD1-CE 4.06Å; I348-M355 HydrophobicContact CG2-CB 4.23Å; I348-M355 HydrophobicContact CG2-CE 3.57Å; I348-M355 HydrophobicContact CG2-CG 4.46Å
349	Y	85.6	Confident	88.9	Confident	76 Å²	76	20.2 Å²	20.2	30%	0.298	11%	0.109	S	C	.	.	H	α-helix	trans	-62.1	-41.7	176.5	-167	-99.9	0	0	0	111.5	I345 Q346 L351 N352 W393 R765	I345-Y349 WeakPolarHBondContact O-CB 3.21Å; I345-Y349 PolarHBondContact O-N 3.06Å; Q346-Y349 PolarHBondContact O-N 3.47Å; Y349-L351 PolarHBondContact O-N 3.41Å; Y349-N352 PolarHBondContact O-N 3.14Å; Y349-W393 AromaticContact CD1-CD2 3.98Å; Y349-W393 HydrophobicContact CD1-CD2 3.98Å; Y349-W393 AromaticContact CD1-CE3 3.85Å; Y349-W393 HydrophobicContact CD1-CE3 3.85Å; Y349-W393 HydrophobicContact CD1-CZ3 4.1Å; Y349-W393 HydrophobicContact CE1-CB 4.4Å; Y349-W393 AromaticContact CE1-CD2 3.93Å; Y349-W393 HydrophobicContact CE1-CD2 3.93Å; Y349-W393 AromaticContact CE1-CE3 3.73Å; Y349-W393 HydrophobicContact CE1-CE3 3.73Å; Y349-W393 HydrophobicContact CE1-CG 4.21Å; Y349-W393 HydrophobicContact CE1-CZ3 4.35Å; Y349-R765 PolarHBondContact O-NH1 2.86Å; Y349-R765 VanDerWaalsContact O-NH1 3.1Å
350	S	84.5	Confident	89.4	Confident	0 Å²	0	16.1 Å²	16.1	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-61.2	-30	175.5	-56.5	0	0	0	0	112.9	Q346 L347 I348 W393 R765 L767 I868	Q346-S350 VanDerWaalsContact O-CB 3.25Å; Q346-S350 WeakPolarHBondContact O-CB 3.29Å; Q346-S350 PolarHBondContact O-N 3.02Å; Q346-S350 PolarHBondContact O-OG 2.97Å; L347-S350 WeakPolarHBondContact O-CB 3.31Å; L347-S350 PolarHBondContact O-N 2.82Å; I348-S350 VanDerWaalsContact C-N 3.33Å; I348-S350 PolarHBondContact O-N 3.18Å; S350-W393 WeakPolarHBondContact OG-CH2 3.37Å; S350-W393 VanDerWaalsContact OG-CZ2 3.27Å; S350-W393 WeakPolarHBondContact OG-CZ2 3.09Å; S350-R765 VanDerWaalsContact C-NH1 3.29Å; S350-R765 WeakPolarHBondContact O-CD 3.32Å; S350-R765 PolarHBondContact O-NH1 3.45Å; S350-L767 WeakPolarHBondContact OG-CD1 3.14Å; S350-L767 WeakPolarHBondContact OG-CG 3.49Å; S350-I868 VanDerWaalsContact CB-CD1 3.43Å
351	L	85.9	Confident	89.6	Confident	21 Å²	21	17.3 Å²	17.3	11%	0.11	9%	0.085	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.8	2.7	175.6	-67.7	167.1	0	0	0	113.6	I319 L347 I348 Y349 L353 I858 I868	I319-L351 HydrophobicContact CG2-CD1 3.5Å; L347-L351 HydrophobicContact CD1-CD1 4.31Å; L347-L351 HydrophobicContact CG-CD1 4.16Å; L347-L351 WeakPolarHBondContact O-CG 3.5Å; L347-L351 PolarHBondContact O-N 3.16Å; I348-L351 CarbonylContact O-C 3.57Å; I348-L351 PolarHBondContact O-N 3.42Å; I348-L351 VanDerWaalsContact O-N 3.14Å; Y349-L351 PolarHBondContact O-N 3.41Å; L351-L353 HydrophobicContact CB-CD1 4.08Å; L351-L353 HydrophobicContact CB-CG 3.91Å; L351-L353 HydrophobicContact CD1-CD1 4.32Å; L351-L353 PolarHBondContact O-N 3.35Å; L351-I858 HydrophobicContact CD1-CD1 4.45Å; L351-I858 HydrophobicContact CD2-CD1 4.39Å; L351-I858 HydrophobicContact CD2-CG1 4.36Å; L351-I868 HydrophobicContact CD2-CD1 3.64Å; L351-I868 HydrophobicContact CG-CD1 3.77Å
352	N	85.4	Confident	89.7	Confident	56 Å²	56	17.3 Å²	17.3	30%	0.299	9%	0.085	S	C	.	.	T	Hydrogen-bonded Turn	trans	60	17.8	-176.1	-66.4	-35.4	0	0	0	115.3	I348 Y349 K506 R765	I348-N352 PolarHBondContact O-N 3.32Å; Y349-N352 PolarHBondContact O-N 3.14Å; N352-K506 PolarHBondContact O-NZ 3.45Å; N352-R765 VanDerWaalsContact OD1-CZ 3.26Å; N352-R765 PolarHBondContact OD1-NH1 2.78Å; N352-R765 PolarHBondContact OD1-NH2 3.21Å
353	L	88.1	Confident	89.9	Confident	34 Å²	34	18.1 Å²	18.1	18%	0.178	9%	0.089	C	C	.	.			trans	-78.6	136	-178.8	-62.9	178.9	0	0	0	111.1	P324 I348 L351	P324-L353 HydrophobicContact CG-CD1 4.17Å; P324-L353 WeakPolarHBondContact O-CD1 3.43Å; P324-L353 WeakPolarHBondContact O-CD2 3.33Å; I348-L353 HydrophobicContact CG2-CB 3.9Å; I348-L353 WeakPolarHBondContact CG2-O 3.4Å; I348-L353 PolarHBondContact O-N 3.49Å; L351-L353 HydrophobicContact CB-CD1 4.08Å; L351-L353 HydrophobicContact CB-CG 3.91Å; L351-L353 HydrophobicContact CD1-CD1 4.32Å; L351-L353 PolarHBondContact O-N 3.35Å
354	P	90.2	Very high	90	Very high	16 Å²	16	20.9 Å²	20.9	10%	0.104	10%	0.101	C	C	.	.			trans	-55.1	149.2	165.8	-23.9	33.4	0	0	0	112.6	I325 G327 M503 K506 I507	I325-P354 WeakPolarHBondContact O-CD 3.46Å; G327-P354 PolarHBondContact N-O 3.04Å; P354-M503 HydrophobicContact CB-CG 3.8Å; P354-M503 HydrophobicContact CB-SD 3.86Å; P354-M503 HydrophobicContact CG-CG 4.38Å; P354-K506 HydrophobicContact CG-CD 4.41Å; P354-I507 HydrophobicContact CG-CG1 4.21Å
355	M	90.7	Very high	89.9	Confident	17 Å²	17	21.9 Å²	21.9	8%	0.084	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	147.8	-178.9	-164.4	-175.6	-62.9	0	0	111.4	G327 L329 I345 I348 F386 P430	G327-M355 CarbonylContact O-C 3.56Å; G327-M355 VanDerWaalsContact O-CA 3.25Å; G327-M355 WeakPolarHBondContact O-CA 3.29Å; G327-M355 WeakPolarHBondContact O-CG 3.4Å; L329-M355 HydrophobicContact CB-CG 4.3Å; L329-M355 HydrophobicContact CB-SD 3.99Å; L329-M355 HydrophobicContact CD2-SD 4.18Å; I345-M355 HydrophobicContact CB-CE 4.22Å; I345-M355 HydrophobicContact CG1-CE 4.23Å; I345-M355 HydrophobicContact CG1-SD 4.28Å; I345-M355 HydrophobicContact CG2-CE 4.1Å; I348-M355 HydrophobicContact CB-CE 3.72Å; I348-M355 HydrophobicContact CD1-CE 4.06Å; I348-M355 HydrophobicContact CG2-CB 4.23Å; I348-M355 HydrophobicContact CG2-CE 3.57Å; I348-M355 HydrophobicContact CG2-CG 4.46Å; M355-F386 HydrophobicContact CE-CE1 4.35Å; M355-F386 HydrophobicContact SD-CE1 4.04Å; M355-F386 HydrophobicContact SD-CZ 3.69Å; M355-P430 HydrophobicContact CB-CG 4.38Å; M355-P430 WeakPolarHBondContact O-CB 3.43Å
356	I	92.3	Very high	89.5	Confident	0 Å²	0	24.9 Å²	24.9	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	146	168.6	-60.1	150.7	0	0	0	107.3	I326 G327 I328 L329 V358 F433 F449 M503	I326-I356 HydrophobicContact CG2-CD1 3.69Å; I326-I356 HydrophobicContact CG2-CG1 4.25Å; G327-I356 PolarHBondContact O-N 3.06Å; I328-I356 CarbonylContact C-O 3.57Å; I328-I356 WeakPolarHBondContact CA-O 3.11Å; I328-I356 HydrophobicContact CG1-CB 4.23Å; I328-I356 HydrophobicContact CG1-CD1 4.04Å; L329-I356 PolarHBondContact N-O 3.41Å; I356-V358 HydrophobicContact CG2-CG2 4.45Å; I356-F433 HydrophobicContact CG2-CD2 3.65Å; I356-F433 HydrophobicContact CG2-CE2 3.69Å; I356-F449 HydrophobicContact CD1-CD1 4.37Å; I356-F449 HydrophobicContact CD1-CE1 3.3Å; I356-F449 HydrophobicContact CD1-CZ 3.49Å; I356-F449 VanDerWaalsContact CD1-CZ 3.49Å; I356-F449 HydrophobicContact CG1-CE1 4.19Å; I356-F449 HydrophobicContact CG1-CZ 4.02Å; I356-M503 HydrophobicContact CG1-CE 4.14Å; I356-M503 HydrophobicContact CG1-SD 4.16Å
357	I	93.8	Very high	89	Confident	0 Å²	0	31.4 Å²	31.4	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	128.4	178	-56	169	0	0	0	109.3	L329 I331 L382 F386 M429 P430 P431 F432 F433	L329-I357 HydrophobicContact CD2-CG1 4.37Å; L329-I357 WeakPolarHBondContact O-CA 3.47Å; I331-I357 HydrophobicContact CD1-CG2 3.81Å; I331-I357 HydrophobicContact CG1-CG2 4.46Å; I357-L382 HydrophobicContact CD1-CD1 4.41Å; I357-L382 HydrophobicContact CG2-CD1 4.18Å; I357-F386 HydrophobicContact CD1-CE2 3.6Å; I357-F386 HydrophobicContact CD1-CZ 4.01Å; I357-M429 HydrophobicContact CD1-SD 3.78Å; I357-P430 HydrophobicContact CD1-CB 3.98Å; I357-P430 HydrophobicContact CD1-CG 4.36Å; I357-P430 HydrophobicContact CG1-CB 4.02Å; I357-P431 PolarHBondContact N-O 3.44Å; I357-F432 HydrophobicContact CB-CD2 3.91Å; I357-F432 HydrophobicContact CG2-CD2 3.61Å; I357-F432 HydrophobicContact CG2-CE2 3.84Å; I357-F432 WeakPolarHBondContact O-CA 3.32Å; I357-F433 PolarHBondContact O-N 2.83Å
358	V	95.3	Very high	88.6	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	118	175.5	177.7	0	0	0	0	109	L226 I328 L329 V330 I331 I356 T360 F433 V435 L446	L226-V358 HydrophobicContact CD2-CG1 3.85Å; I328-V358 HydrophobicContact CG2-CB 4.17Å; I328-V358 HydrophobicContact CG2-CG2 3.59Å; L329-V358 PolarHBondContact O-N 3.31Å; V330-V358 WeakPolarHBondContact CA-O 3.42Å; I331-V358 PolarHBondContact N-O 3.29Å; I356-V358 HydrophobicContact CG2-CG2 4.45Å; V358-T360 HydrophobicContact CG1-CG2 4.22Å; V358-F433 CarbonylContact C-O 3.53Å; V358-F433 WeakPolarHBondContact CA-O 3.4Å; V358-F433 HydrophobicContact CG2-CB 4.37Å; V358-V435 HydrophobicContact CG1-CB 4.49Å; V358-V435 HydrophobicContact CG1-CG1 4.21Å; V358-V435 HydrophobicContact CG1-CG2 3.44Å; V358-V435 VanDerWaalsContact CG1-CG2 3.44Å; V358-L446 HydrophobicContact CG1-CD2 4.38Å; V358-L446 HydrophobicContact CG2-CD1 4.02Å; V358-L446 HydrophobicContact CG2-CD2 4.23Å
359	L	95.2	Very high	88.2	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	106.3	177.4	-173.4	74.5	0	0	0	109.6	I331 A333 I362 I375 I378 F432 F433 P434 V435	I331-L359 HydrophobicContact CB-CD1 3.98Å; I331-L359 HydrophobicContact CG2-CD1 3.84Å; I331-L359 CarbonylContact O-C 3.56Å; I331-L359 WeakPolarHBondContact O-CA 3.46Å; A333-L359 HydrophobicContact CB-CD1 4.29Å; A333-L359 HydrophobicContact CB-CD2 4.11Å; A333-L359 HydrophobicContact CB-CG 4.07Å; L359-I362 HydrophobicContact CD2-CG2 4.33Å; L359-I375 HydrophobicContact CD2-CB 4.45Å; L359-I375 HydrophobicContact CD2-CG1 3.84Å; L359-I375 HydrophobicContact CD2-CG2 4.29Å; L359-I378 HydrophobicContact CD1-CD1 4.24Å; L359-I378 HydrophobicContact CD1-CG2 4.05Å; L359-I378 HydrophobicContact CD2-CD1 4.35Å; L359-F432 HydrophobicContact CB-CE1 4.44Å; L359-F432 HydrophobicContact CB-CE2 4.19Å; L359-F432 HydrophobicContact CB-CZ 3.74Å; L359-F432 HydrophobicContact CD2-CZ 3.93Å; L359-F432 HydrophobicContact CG-CZ 4.35Å; L359-F433 PolarHBondContact N-O 2.95Å; L359-P434 WeakPolarHBondContact O-CA 3.3Å; L359-V435 PolarHBondContact O-N 3.17Å
360	T	94.8	Very high	88	Confident	1 Å²	1	39.7 Å²	39.7	1%	0.006	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	171.5	-179.2	65.3	0	0	0	0	112.4	S221 V330 I331 A333 V358 I362 V435	S221-T360 PolarHBondContact O-OG1 3.5Å; V330-T360 HydrophobicContact CG1-CG2 3.41Å; V330-T360 VanDerWaalsContact CG1-CG2 3.41Å; I331-T360 PolarHBondContact O-N 2.81Å; I331-T360 PolarHBondContact O-OG1 3.02Å; A333-T360 VanDerWaalsContact CB-O 3.25Å; A333-T360 WeakPolarHBondContact CB-O 3.44Å; A333-T360 PolarHBondContact N-O 2.97Å; V358-T360 HydrophobicContact CG1-CG2 4.22Å; T360-I362 VanDerWaalsContact C-N 3.3Å; T360-I362 PolarHBondContact O-N 2.61Å; T360-V435 CarbonylContact C-O 3.45Å; T360-V435 VanDerWaalsContact CA-O 3.28Å; T360-V435 WeakPolarHBondContact CA-O 3.41Å; T360-V435 HydrophobicContact CG2-CG2 3.99Å
361	K	93	Very high	88	Confident	56 Å²	56	40.2 Å²	40.2	24%	0.243	21%	0.213	C	C	.	.			trans	62.5	30.5	173.2	-57.2	-176.2	179.3	172.6	0	114.4	D220 D363 Q364 V435	D220-K361 WeakPolarHBondContact O-CE 3.45Å; D220-K361 PolarHBondContact O-NZ 3.02Å; K361-D363 VanDerWaalsContact CA-OD1 3.27Å; K361-D363 WeakPolarHBondContact CA-OD1 3.38Å; K361-D363 PolarHBondContact O-N 3.43Å; K361-Q364 HydrophobicContact CB-CG 4.21Å; K361-Q364 PolarHBondContact O-N 3.21Å; K361-Q364 VanDerWaalsContact O-N 3.09Å; K361-V435 PolarHBondContact N-O 2.93Å
362	I	92.1	Very high	88	Confident	1 Å²	1	40.3 Å²	40.3	1%	0.005	21%	0.213	C	C	.	.	G	3₁₀ helix	trans	-64.2	-19.6	176.1	65.7	179.2	0	0	0	113	A333 L359 T360 Q364 L365 Q371 I375 P434 Q441	A333-I362 HydrophobicContact CB-CG2 4.32Å; L359-I362 HydrophobicContact CD2-CG2 4.33Å; T360-I362 VanDerWaalsContact C-N 3.3Å; T360-I362 PolarHBondContact O-N 2.61Å; I362-Q364 PolarHBondContact O-N 2.8Å; I362-L365 WeakPolarHBondContact O-CB 3.46Å; I362-L365 PolarHBondContact O-N 3.47Å; I362-Q371 PolarHBondContact O-NE2 2.83Å; I362-I375 HydrophobicContact CG2-CD1 4.18Å; I362-P434 HydrophobicContact CD1-CB 4.37Å; I362-P434 HydrophobicContact CG2-CB 4.13Å; I362-Q441 HydrophobicContact CD1-CB 4.23Å; I362-Q441 HydrophobicContact CD1-CG 3.92Å
363	D	90.6	Very high	88.1	Confident	41 Å²	41	43.7 Å²	43.7	22%	0.219	23%	0.225	C	C	.	.	G	3₁₀ helix	trans	-65.4	-20.5	171.4	54.6	-76.6	0	0	0	114.1	K361 L365 S436 T439	K361-D363 VanDerWaalsContact CA-OD1 3.27Å; K361-D363 WeakPolarHBondContact CA-OD1 3.38Å; K361-D363 PolarHBondContact O-N 3.43Å; D363-L365 VanDerWaalsContact C-N 3.26Å; D363-S436 WeakPolarHBondContact CB-OG 3.39Å; D363-S436 VanDerWaalsContact OD1-CB 3.3Å; D363-S436 WeakPolarHBondContact OD1-CB 3.34Å; D363-S436 PolarHBondContact OD1-OG 3.46Å; D363-T439 HydrophobicContact CB-CG2 3.85Å
364	Q	89.2	Confident	88.1	Confident	100 Å²	100	46.7 Å²	46.7	47%	0.467	23%	0.234	S	C	.	.	G	3₁₀ helix	trans	-87.2	3.6	178	-56	-167.1	-29	0	0	112.7	T334 K361 I362	T334-Q364 HydrophobicContact CG2-CB 3.59Å; T334-Q364 HydrophobicContact CG2-CG 4.43Å; T334-Q364 VanDerWaalsContact CG2-OE1 3.28Å; K361-Q364 HydrophobicContact CB-CG 4.21Å; K361-Q364 PolarHBondContact O-N 3.21Å; K361-Q364 VanDerWaalsContact O-N 3.09Å; I362-Q364 PolarHBondContact O-N 2.8Å
365	L	87.5	Confident	88	Confident	26 Å²	26	46 Å²	46	14%	0.136	23%	0.23	C	C	.	.	S	Bend	trans	-99.2	149.5	174.3	-58.6	-178.4	0	0	0	110.3	A333 I362 D363 N367 Q371 R374 I375	A333-L365 HydrophobicContact CB-CD1 3.99Å; A333-L365 HydrophobicContact CB-CG 4.26Å; I362-L365 WeakPolarHBondContact O-CB 3.46Å; I362-L365 PolarHBondContact O-N 3.47Å; D363-L365 VanDerWaalsContact C-N 3.26Å; L365-N367 PolarHBondContact O-N 3.37Å; L365-Q371 HydrophobicContact CB-CB 4.15Å; L365-Q371 HydrophobicContact CB-CG 4.03Å; L365-Q371 HydrophobicContact CD1-CG 3.97Å; L365-R374 HydrophobicContact CD1-CB 4.05Å; L365-R374 HydrophobicContact CD1-CG 3.94Å; L365-R374 HydrophobicContact CD2-CG 3.93Å; L365-I375 HydrophobicContact CD1-CG1 4.32Å
366	S	79.6	Confident	87.8	Confident	64 Å²	64	49 Å²	49	45%	0.448	24%	0.243	S	C	.	.	P	Polyproline II helix	trans	-60.8	121.7	172.6	33.4	0	0	0	0	111.2	E370 Q371	S366-E370 VanDerWaalsContact CB-OE2 3.29Å; S366-E370 WeakPolarHBondContact CB-OE2 3.28Å; S366-E370 WeakPolarHBondContact OG-CB 3.48Å; S366-E370 PolarHBondContact OG-OE2 3.47Å; S366-Q371 WeakPolarHBondContact O-CB 3.45Å; S366-Q371 PolarHBondContact O-N 3.24Å
367	N	76.2	Confident	87.6	Confident	144 Å²	144	51.8 Å²	51.8	77%	0.77	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	142.5	-175.7	-72.8	-23.5	0	0	0	112.8	L365	L365-N367 PolarHBondContact O-N 3.37Å
368	G	79.9	Confident	87.4	Confident	17 Å²	17	51.9 Å²	51.9	18%	0.175	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	96	-136.1	176	0	0	0	0	0	113.6	E370 Q371 I372	G368-E370 VanDerWaalsContact C-N 3.28Å; G368-E370 PolarHBondContact O-N 2.87Å; G368-Q371 PolarHBondContact O-N 3.34Å; G368-I372 PolarHBondContact O-N 2.97Å
369	I	82.9	Confident	87	Confident	115 Å²	115	53.4 Å²	53.4	59%	0.59	27%	0.267	S	S	*	.	H	α-helix	trans	-63.3	-32.7	-167.9	-59.1	173.1	0	0	0	112.3	I372 K373	I369-I372 PolarHBondContact O-N 2.94Å; I369-K373 HydrophobicContact CG2-CD 4Å; I369-K373 HydrophobicContact CG2-CG 4.29Å; I369-K373 WeakPolarHBondContact O-CB 3.37Å; I369-K373 WeakPolarHBondContact O-CG 3.48Å; I369-K373 PolarHBondContact O-N 2.81Å
370	E	81.5	Confident	86.6	Confident	124 Å²	124	62.5 Å²	62.5	58%	0.579	30%	0.301	S	S	*	.	H	α-helix	trans	-69.9	-42.2	-179.8	-63.3	-167.1	152.6	0	0	112.6	S366 G368 I372 K373 R374	S366-E370 VanDerWaalsContact CB-OE2 3.29Å; S366-E370 WeakPolarHBondContact CB-OE2 3.28Å; S366-E370 WeakPolarHBondContact OG-CB 3.48Å; S366-E370 PolarHBondContact OG-OE2 3.47Å; G368-E370 VanDerWaalsContact C-N 3.28Å; G368-E370 PolarHBondContact O-N 2.87Å; E370-I372 VanDerWaalsContact C-N 3.33Å; E370-I372 PolarHBondContact O-N 3.21Å; E370-K373 PolarHBondContact O-N 2.64Å; E370-R374 WeakPolarHBondContact O-CB 3.46Å; E370-R374 PolarHBondContact O-N 2.68Å
371	Q	84.4	Confident	86.2	Confident	12 Å²	12	67 Å²	67	6%	0.056	32%	0.322	C	S	.	.	H	α-helix	trans	-53.6	-50.3	170.9	-174.4	-176.8	55.3	0	0	110.8	I362 L365 S366 G368 R374 I375	I362-Q371 PolarHBondContact O-NE2 2.83Å; L365-Q371 HydrophobicContact CB-CB 4.15Å; L365-Q371 HydrophobicContact CB-CG 4.03Å; L365-Q371 HydrophobicContact CD1-CG 3.97Å; S366-Q371 WeakPolarHBondContact O-CB 3.45Å; S366-Q371 PolarHBondContact O-N 3.24Å; G368-Q371 PolarHBondContact O-N 3.34Å; Q371-R374 PolarHBondContact O-N 3.35Å; Q371-I375 HydrophobicContact CG-CD1 3.93Å; Q371-I375 VanDerWaalsContact O-CG1 3.25Å; Q371-I375 WeakPolarHBondContact O-CG1 3.33Å; Q371-I375 PolarHBondContact O-N 3.05Å
372	I	85.3	Confident	85.8	Confident	23 Å²	23	64.4 Å²	64.4	12%	0.118	31%	0.311	C	S	.	.	H	α-helix	trans	-62.4	-48.4	179.6	-62.8	171.8	0	0	0	110.9	G368 I369 E370 R374 I375 Q376 F491	G368-I372 PolarHBondContact O-N 2.97Å; I369-I372 PolarHBondContact O-N 2.94Å; E370-I372 VanDerWaalsContact C-N 3.33Å; E370-I372 PolarHBondContact O-N 3.21Å; I372-R374 VanDerWaalsContact C-N 3.31Å; I372-R374 PolarHBondContact O-N 3.36Å; I372-I375 PolarHBondContact O-N 2.6Å; I372-Q376 HydrophobicContact CG2-CG 4.35Å; I372-Q376 WeakPolarHBondContact O-CB 3.49Å; I372-Q376 WeakPolarHBondContact O-CG 3.18Å; I372-Q376 PolarHBondContact O-N 3.28Å; I372-F491 HydrophobicContact CG1-CZ 4.3Å
373	K	87.5	Confident	85.5	Confident	127 Å²	127	66.7 Å²	66.7	55%	0.552	33%	0.325	S	S	*	.	H	α-helix	trans	-57.1	-41.6	176	-77.5	173.1	176.5	173.7	0	112.3	I369 E370 T377	I369-K373 HydrophobicContact CG2-CD 4Å; I369-K373 HydrophobicContact CG2-CG 4.29Å; I369-K373 WeakPolarHBondContact O-CB 3.37Å; I369-K373 WeakPolarHBondContact O-CG 3.48Å; I369-K373 PolarHBondContact O-N 2.81Å; E370-K373 PolarHBondContact O-N 2.64Å; K373-T377 WeakPolarHBondContact O-CB 3.46Å; K373-T377 PolarHBondContact O-N 2.98Å; K373-T377 PolarHBondContact O-OG1 3Å
374	R	87.4	Confident	85.1	Confident	97 Å²	97	70.1 Å²	70.1	37%	0.366	34%	0.336	S	S	.	.	H	α-helix	trans	-68.4	-43.5	178.9	-176.6	59.2	175.4	179.9	-1.1	111.5	L365 E370 Q371 I372 T377 I378	L365-R374 HydrophobicContact CD1-CB 4.05Å; L365-R374 HydrophobicContact CD1-CG 3.94Å; L365-R374 HydrophobicContact CD2-CG 3.93Å; E370-R374 WeakPolarHBondContact O-CB 3.46Å; E370-R374 PolarHBondContact O-N 2.68Å; Q371-R374 PolarHBondContact O-N 3.35Å; I372-R374 VanDerWaalsContact C-N 3.31Å; I372-R374 PolarHBondContact O-N 3.36Å; R374-T377 WeakPolarHBondContact O-CB 3.49Å; R374-T377 PolarHBondContact O-N 3.23Å; R374-I378 HydrophobicContact CG-CD1 4.23Å; R374-I378 WeakPolarHBondContact O-CG1 3.18Å; R374-I378 PolarHBondContact O-N 3.14Å
375	I	88.8	Confident	84.7	Confident	2 Å²	2	66.9 Å²	66.9	1%	0.01	32%	0.321	C	S	.	.	H	α-helix	trans	-61.6	-47.1	175.8	-67.7	172.1	0	0	0	110.4	L359 I362 L365 Q371 I372 T377 I378 Y379 F432 P434 F491	L359-I375 HydrophobicContact CD2-CB 4.45Å; L359-I375 HydrophobicContact CD2-CG1 3.84Å; L359-I375 HydrophobicContact CD2-CG2 4.29Å; I362-I375 HydrophobicContact CG2-CD1 4.18Å; L365-I375 HydrophobicContact CD1-CG1 4.32Å; Q371-I375 HydrophobicContact CG-CD1 3.93Å; Q371-I375 VanDerWaalsContact O-CG1 3.25Å; Q371-I375 WeakPolarHBondContact O-CG1 3.33Å; Q371-I375 PolarHBondContact O-N 3.05Å; I372-I375 PolarHBondContact O-N 2.6Å; I375-T377 VanDerWaalsContact C-N 3.29Å; I375-T377 PolarHBondContact O-N 2.97Å; I375-I378 PolarHBondContact O-N 2.84Å; I375-Y379 WeakPolarHBondContact O-CB 3.39Å; I375-Y379 PolarHBondContact O-N 3.17Å; I375-F432 HydrophobicContact CG2-CE1 3.84Å; I375-F432 HydrophobicContact CG2-CZ 4.19Å; I375-P434 HydrophobicContact CD1-CB 4.29Å; I375-F491 HydrophobicContact CD1-CE1 3.8Å; I375-F491 HydrophobicContact CD1-CZ 4.09Å
376	Q	87.2	Confident	84.3	Confident	79 Å²	79	66.8 Å²	66.8	37%	0.369	32%	0.319	S	S	.	.	H	α-helix	trans	-60	-37	174.5	-72.5	175.4	-3.8	0	0	112.6	I372 Y379 R380 F494	I372-Q376 HydrophobicContact CG2-CG 4.35Å; I372-Q376 WeakPolarHBondContact O-CB 3.49Å; I372-Q376 WeakPolarHBondContact O-CG 3.18Å; I372-Q376 PolarHBondContact O-N 3.28Å; Q376-Y379 PolarHBondContact O-N 3.04Å; Q376-R380 WeakPolarHBondContact O-CB 3.5Å; Q376-R380 WeakPolarHBondContact O-CG 2.96Å; Q376-R380 PolarHBondContact O-N 2.87Å; Q376-F494 HydrophobicContact CG-CZ 4.33Å
377	T	87.8	Confident	84.3	Confident	59 Å²	59	67.9 Å²	67.9	36%	0.362	32%	0.316	S	S	.	.	H	α-helix	trans	-65	-45.9	175.7	-58.2	0	0	0	0	111.4	K373 R374 I375 Y379 R380 Q381	K373-T377 WeakPolarHBondContact O-CB 3.46Å; K373-T377 PolarHBondContact O-N 2.98Å; K373-T377 PolarHBondContact O-OG1 3Å; R374-T377 WeakPolarHBondContact O-CB 3.49Å; R374-T377 PolarHBondContact O-N 3.23Å; I375-T377 VanDerWaalsContact C-N 3.29Å; I375-T377 PolarHBondContact O-N 2.97Å; T377-Y379 VanDerWaalsContact C-N 3.35Å; T377-R380 PolarHBondContact O-N 2.53Å; T377-Q381 WeakPolarHBondContact O-CG 3.38Å; T377-Q381 PolarHBondContact O-N 2.84Å
378	I	88.6	Confident	84.2	Confident	1 Å²	1	62.3 Å²	62.3	1%	0.005	29%	0.285	C	S	.	.	H	α-helix	trans	-65	-40.6	177.1	-65.9	168.3	0	0	0	110.5	A333 L359 R374 I375 Q381 L382	A333-I378 WeakPolarHBondContact O-CD1 3.41Å; L359-I378 HydrophobicContact CD1-CD1 4.24Å; L359-I378 HydrophobicContact CD1-CG2 4.05Å; L359-I378 HydrophobicContact CD2-CD1 4.35Å; R374-I378 HydrophobicContact CG-CD1 4.23Å; R374-I378 WeakPolarHBondContact O-CG1 3.18Å; R374-I378 PolarHBondContact O-N 3.14Å; I375-I378 PolarHBondContact O-N 2.84Å; I378-Q381 WeakPolarHBondContact O-CB 3.49Å; I378-Q381 PolarHBondContact O-N 3.17Å; I378-L382 HydrophobicContact CG2-CD1 4.02Å; I378-L382 WeakPolarHBondContact O-CG 3.25Å; I378-L382 PolarHBondContact O-N 3.35Å
379	Y	88.4	Confident	83.9	Confident	32 Å²	32	61.7 Å²	61.7	13%	0.125	28%	0.278	C	S	.	.	H	α-helix	trans	-59.5	-49.1	174.4	-177	-92.2	0	0	0	111.7	I375 Q376 T377 Q381 L382 V383 M429 F432 F494	I375-Y379 WeakPolarHBondContact O-CB 3.39Å; I375-Y379 PolarHBondContact O-N 3.17Å; Q376-Y379 PolarHBondContact O-N 3.04Å; T377-Y379 VanDerWaalsContact C-N 3.35Å; Y379-Q381 VanDerWaalsContact C-N 3.33Å; Y379-Q381 PolarHBondContact O-N 3.04Å; Y379-L382 WeakPolarHBondContact O-CA 3.47Å; Y379-L382 WeakPolarHBondContact O-CB 3.21Å; Y379-L382 PolarHBondContact O-N 2.97Å; Y379-V383 HydrophobicContact CD1-CG2 4.04Å; Y379-V383 HydrophobicContact CE1-CG2 3.74Å; Y379-V383 WeakPolarHBondContact O-CG2 3.45Å; Y379-V383 PolarHBondContact O-N 2.96Å; Y379-M429 HydrophobicContact CE2-CG 3.69Å; Y379-M429 HydrophobicContact CE2-SD 4.47Å; Y379-M429 WeakPolarHBondContact OH-CG 3.48Å; Y379-F432 HydrophobicContact CD2-CB 4.48Å; Y379-F432 HydrophobicContact CD2-CD1 4.38Å; Y379-F432 HydrophobicContact CD2-CD2 4.15Å; Y379-F432 HydrophobicContact CD2-CE2 4.5Å; Y379-F432 HydrophobicContact CD2-CG 4.09Å; Y379-F432 HydrophobicContact CE2-CB 4.35Å; Y379-F432 HydrophobicContact CE2-CG 4.44Å; Y379-F494 HydrophobicContact CD1-CE1 4.36Å; Y379-F494 HydrophobicContact CD2-CD1 4.03Å; Y379-F494 HydrophobicContact CD2-CE1 4.26Å; Y379-F494 AromaticContact CE2-CD1 3.95Å; Y379-F494 HydrophobicContact CE2-CD1 3.95Å; Y379-F494 HydrophobicContact CE2-CE1 4.45Å; Y379-F494 HydrophobicContact CG-CD1 4.44Å; Y379-F494 HydrophobicContact CG-CE1 4.21Å
380	R	86.4	Confident	83.4	Confident	191 Å²	191	58.8 Å²	58.8	72%	0.721	26%	0.261	S	S	*	.	H	α-helix	trans	-60.3	-39.6	175.3	-74.9	178.3	177.3	-156.6	-1.1	112.8	Q376 T377 L382 V383 Y384	Q376-R380 WeakPolarHBondContact O-CB 3.5Å; Q376-R380 WeakPolarHBondContact O-CG 2.96Å; Q376-R380 PolarHBondContact O-N 2.87Å; T377-R380 PolarHBondContact O-N 2.53Å; R380-L382 VanDerWaalsContact C-N 3.33Å; R380-V383 PolarHBondContact O-N 3.45Å; R380-Y384 PolarHBondContact O-N 3.03Å
381	Q	85	Confident	82.8	Confident	97 Å²	97	56.5 Å²	56.5	45%	0.453	25%	0.253	S	S	.	.	H	α-helix	trans	-61.3	-42.9	172.7	-73.9	174	-10.8	0	0	111.1	T377 I378 Y379 Y384 Q385	T377-Q381 WeakPolarHBondContact O-CG 3.38Å; T377-Q381 PolarHBondContact O-N 2.84Å; I378-Q381 WeakPolarHBondContact O-CB 3.49Å; I378-Q381 PolarHBondContact O-N 3.17Å; Y379-Q381 VanDerWaalsContact C-N 3.33Å; Y379-Q381 PolarHBondContact O-N 3.04Å; Q381-Y384 PolarHBondContact O-N 3.14Å; Q381-Q385 VanDerWaalsContact O-CG 3.26Å; Q381-Q385 WeakPolarHBondContact O-CG 3.45Å; Q381-Q385 PolarHBondContact O-N 2.54Å
382	L	86.6	Confident	81.8	Confident	1 Å²	1	56.6 Å²	56.6	1%	0.005	26%	0.256	C	S	.	.	H	α-helix	trans	-62.6	-47.8	175.4	-71.7	160.7	0	0	0	111.6	I331 L337 I357 I378 Y379 R380 Y384 Q385 F386 M429 F432	I331-L382 HydrophobicContact CD1-CD1 3.81Å; I331-L382 HydrophobicContact CD1-CD2 3.62Å; I331-L382 HydrophobicContact CD1-CG 4.29Å; L337-L382 HydrophobicContact CD1-CD2 4.46Å; L337-L382 HydrophobicContact CD2-CD2 3.96Å; I357-L382 HydrophobicContact CD1-CD1 4.41Å; I357-L382 HydrophobicContact CG2-CD1 4.18Å; I378-L382 HydrophobicContact CG2-CD1 4.02Å; I378-L382 WeakPolarHBondContact O-CG 3.25Å; I378-L382 PolarHBondContact O-N 3.35Å; Y379-L382 WeakPolarHBondContact O-CA 3.47Å; Y379-L382 WeakPolarHBondContact O-CB 3.21Å; Y379-L382 PolarHBondContact O-N 2.97Å; R380-L382 VanDerWaalsContact C-N 3.33Å; L382-Y384 VanDerWaalsContact C-N 3.27Å; L382-Y384 PolarHBondContact O-N 2.93Å; L382-Q385 PolarHBondContact O-N 3.22Å; L382-F386 HydrophobicContact CB-CD2 4.36Å; L382-F386 HydrophobicContact CB-CE2 4.44Å; L382-F386 HydrophobicContact CD2-CE2 4.2Å; L382-F386 VanDerWaalsContact O-CD2 3.25Å; L382-F386 WeakPolarHBondContact O-CD2 3.07Å; L382-F386 PolarHBondContact O-N 2.9Å; L382-M429 HydrophobicContact CB-CE 4.19Å; L382-F432 HydrophobicContact CD1-CD2 4.41Å; L382-F432 HydrophobicContact CD1-CE2 3.91Å
383	V	84.4	Confident	80.5	Confident	49 Å²	49	57.3 Å²	57.3	30%	0.297	26%	0.257	S	S	.	.	H	α-helix	trans	-51.1	-49.2	175	177	0	0	0	0	110.5	Y379 R380 Q385 F386 K387 M429	Y379-V383 HydrophobicContact CD1-CG2 4.04Å; Y379-V383 HydrophobicContact CE1-CG2 3.74Å; Y379-V383 WeakPolarHBondContact O-CG2 3.45Å; Y379-V383 PolarHBondContact O-N 2.96Å; R380-V383 PolarHBondContact O-N 3.45Å; V383-Q385 PolarHBondContact O-N 2.85Å; V383-F386 PolarHBondContact O-N 3.42Å; V383-K387 WeakPolarHBondContact O-CB 3.32Å; V383-K387 PolarHBondContact O-N 2.85Å; V383-M429 HydrophobicContact CB-CE 3.96Å; V383-M429 HydrophobicContact CG2-CE 3.4Å
384	Y	82	Confident	78.9	Confident	113 Å²	113	54.5 Å²	54.5	44%	0.443	25%	0.254	S	S	.	.	H	α-helix	trans	-61.2	-44	178.2	-174	-104.1	0	0	0	112.5	R380 Q381 L382 K387 Q388 N776	R380-Y384 PolarHBondContact O-N 3.03Å; Q381-Y384 PolarHBondContact O-N 3.14Å; L382-Y384 VanDerWaalsContact C-N 3.27Å; L382-Y384 PolarHBondContact O-N 2.93Å; Y384-K387 PolarHBondContact O-N 2.96Å; Y384-Q388 HydrophobicContact CD1-CG 4.34Å; Y384-Q388 HydrophobicContact CE1-CG 3.97Å; Y384-Q388 HydrophobicContact CE2-CG 4.41Å; Y384-Q388 WeakPolarHBondContact O-CB 3.25Å; Y384-Q388 WeakPolarHBondContact O-CG 3.28Å; Y384-Q388 PolarHBondContact O-N 3.21Å; Y384-Q388 PolarHBondContact OH-OE1 2.82Å; Y384-N776 PolarHBondContact OH-OD1 3.48Å
385	Q	80.6	Confident	76.8	Confident	32 Å²	32	59.5 Å²	59.5	15%	0.15	27%	0.274	C	S	.	.	H	α-helix	trans	-67.3	-41.5	178.4	-65.8	-62.5	-10.6	0	0	112.9	L337 L342 Q381 L382 V383 Q388 I389 F772	L337-Q385 HydrophobicContact CD2-CB 4.41Å; L337-Q385 HydrophobicContact CD2-CG 4.17Å; L342-Q385 HydrophobicContact CD2-CB 4.3Å; L342-Q385 HydrophobicContact CD2-CG 4.29Å; Q381-Q385 VanDerWaalsContact O-CG 3.26Å; Q381-Q385 WeakPolarHBondContact O-CG 3.45Å; Q381-Q385 PolarHBondContact O-N 2.54Å; L382-Q385 PolarHBondContact O-N 3.22Å; V383-Q385 PolarHBondContact O-N 2.85Å; Q385-Q388 PolarHBondContact O-N 3.04Å; Q385-Q388 VanDerWaalsContact OE1-NE2 3.15Å; Q385-I389 VanDerWaalsContact O-CG1 3.28Å; Q385-I389 WeakPolarHBondContact O-CG1 3.22Å; Q385-I389 PolarHBondContact O-N 2.87Å; Q385-F772 VanDerWaalsContact OE1-CD2 3.23Å
386	F	80.8	Confident	74.5	Confident	23 Å²	23	62.1 Å²	62.1	10%	0.101	30%	0.302	C	S	.	.	H	α-helix	trans	-64	-44.6	174.3	-82.1	-77.2	0	0	0	111.6	I345 M355 I357 L382 V383 Q388 I389 Q390 M429 P430	I345-F386 HydrophobicContact CD1-CZ 4.29Å; I345-F386 HydrophobicContact CG1-CZ 4.38Å; I345-F386 HydrophobicContact CG2-CD1 4.35Å; I345-F386 HydrophobicContact CG2-CE1 3.76Å; I345-F386 HydrophobicContact CG2-CZ 4.14Å; M355-F386 HydrophobicContact CE-CE1 4.35Å; M355-F386 HydrophobicContact SD-CE1 4.04Å; M355-F386 HydrophobicContact SD-CZ 3.69Å; I357-F386 HydrophobicContact CD1-CE2 3.6Å; I357-F386 HydrophobicContact CD1-CZ 4.01Å; L382-F386 HydrophobicContact CB-CD2 4.36Å; L382-F386 HydrophobicContact CB-CE2 4.44Å; L382-F386 HydrophobicContact CD2-CE2 4.2Å; L382-F386 VanDerWaalsContact O-CD2 3.25Å; L382-F386 WeakPolarHBondContact O-CD2 3.07Å; L382-F386 PolarHBondContact O-N 2.9Å; V383-F386 PolarHBondContact O-N 3.42Å; F386-Q388 PolarHBondContact O-N 2.98Å; F386-I389 PolarHBondContact O-N 2.83Å; F386-Q390 VanDerWaalsContact O-CB 3.31Å; F386-Q390 WeakPolarHBondContact O-CB 3.27Å; F386-Q390 PolarHBondContact O-N 3.24Å; F386-M429 HydrophobicContact CD2-CE 3.94Å; F386-M429 HydrophobicContact CD2-SD 4.18Å; F386-M429 HydrophobicContact CE2-SD 4.36Å; F386-P430 HydrophobicContact CE1-CG 4.23Å; F386-P430 HydrophobicContact CZ-CG 4.16Å
387	K	78	Confident	71.9	Confident	87 Å²	87	64.9 Å²	64.9	38%	0.378	32%	0.319	S	S	.	.	H	α-helix	trans	-62.3	-41	176.3	-165.5	159.8	-175.5	163.3	0	111.4	V383 Y384 Q390 N391 D425	V383-K387 WeakPolarHBondContact O-CB 3.32Å; V383-K387 PolarHBondContact O-N 2.85Å; Y384-K387 PolarHBondContact O-N 2.96Å; K387-Q390 PolarHBondContact O-N 2.86Å; K387-N391 VanDerWaalsContact O-CB 3.3Å; K387-N391 WeakPolarHBondContact O-CB 3.49Å; K387-N391 PolarHBondContact O-N 3.18Å; K387-N391 PolarHBondContact O-ND2 3.23Å; K387-N391 PolarHBondContact O-OD1 2.93Å; K387-D425 IonicContact NZ-OD1 2.66Å; K387-D425 PolarHBondContact NZ-OD1 2.93Å; K387-D425 IonicContact NZ-OD2 3.34Å; K387-D425 PolarHBondContact NZ-OD2 3.13Å
388	Q	74.9	Confident	69.1	Low	27 Å²	27	67 Å²	67	13%	0.126	33%	0.333	C	S	.	.	H	α-helix	trans	-64.4	-43.7	173.4	-75.7	-174.3	118.1	0	0	113.1	Y384 Q385 F386 N391 A392 F772	Y384-Q388 HydrophobicContact CD1-CG 4.34Å; Y384-Q388 HydrophobicContact CE1-CG 3.97Å; Y384-Q388 HydrophobicContact CE2-CG 4.41Å; Y384-Q388 WeakPolarHBondContact O-CB 3.25Å; Y384-Q388 WeakPolarHBondContact O-CG 3.28Å; Y384-Q388 PolarHBondContact O-N 3.21Å; Y384-Q388 PolarHBondContact OH-OE1 2.82Å; Q385-Q388 PolarHBondContact O-N 3.04Å; Q385-Q388 VanDerWaalsContact OE1-NE2 3.15Å; F386-Q388 PolarHBondContact O-N 2.98Å; Q388-N391 PolarHBondContact O-N 2.97Å; Q388-A392 WeakPolarHBondContact O-CB 3.43Å; Q388-A392 PolarHBondContact O-N 3.06Å; Q388-F772 HydrophobicContact CB-CE1 3.88Å; Q388-F772 HydrophobicContact CB-CZ 4.12Å; Q388-F772 HydrophobicContact CG-CE1 4.25Å; Q388-F772 VanDerWaalsContact NE2-CD1 3.27Å
389	I	74	Confident	66.2	Low	4 Å²	4	72.2 Å²	72.2	2%	0.021	37%	0.37	C	S	.	.	H	α-helix	trans	-65.2	-42.2	177.3	-68.7	167.1	0	0	0	110.3	L342 I345 Q346 Q385 F386 A392 W393 F772	L342-I389 HydrophobicContact CD2-CD1 4.45Å; I345-I389 HydrophobicContact CB-CD1 4.42Å; I345-I389 HydrophobicContact CG2-CD1 3.62Å; Q346-I389 HydrophobicContact CG-CD1 4.26Å; Q385-I389 VanDerWaalsContact O-CG1 3.28Å; Q385-I389 WeakPolarHBondContact O-CG1 3.22Å; Q385-I389 PolarHBondContact O-N 2.87Å; F386-I389 PolarHBondContact O-N 2.83Å; I389-A392 PolarHBondContact O-N 3.47Å; I389-W393 WeakPolarHBondContact O-CB 3.31Å; I389-W393 PolarHBondContact O-N 2.84Å; I389-W393 VanDerWaalsContact O-N 3.12Å; I389-F772 HydrophobicContact CG1-CZ 4.4Å
390	Q	71.7	Confident	63.4	Low	54 Å²	54	76.3 Å²	76.3	25%	0.252	40%	0.403	S	S	.	.	H	α-helix	trans	-63.5	-44.1	176.3	-173.8	176	8.5	0	0	111.9	F386 K387 W393 S394 F428	F386-Q390 VanDerWaalsContact O-CB 3.31Å; F386-Q390 WeakPolarHBondContact O-CB 3.27Å; F386-Q390 PolarHBondContact O-N 3.24Å; K387-Q390 PolarHBondContact O-N 2.86Å; Q390-W393 PolarHBondContact O-N 2.83Å; Q390-S394 WeakPolarHBondContact O-CB 3.44Å; Q390-S394 PolarHBondContact O-N 3.05Å; Q390-S394 PolarHBondContact O-OG 3.4Å; Q390-F428 VanDerWaalsContact CD-CE1 3.48Å; Q390-F428 HydrophobicContact CG-CE1 4.35Å; Q390-F428 VanDerWaalsContact OE1-CE1 3.31Å
391	N	68	Low	60.5	Low	77 Å²	77	70.9 Å²	70.9	41%	0.412	39%	0.394	S	S	.	.	H	α-helix	trans	-62.9	-49.4	175.8	-69.9	-5.4	0	0	0	111.2	K387 Q388 W393 S394 Y395	K387-N391 VanDerWaalsContact O-CB 3.3Å; K387-N391 WeakPolarHBondContact O-CB 3.49Å; K387-N391 PolarHBondContact O-N 3.18Å; K387-N391 PolarHBondContact O-ND2 3.23Å; K387-N391 PolarHBondContact O-OD1 2.93Å; Q388-N391 PolarHBondContact O-N 2.97Å; N391-W393 PolarHBondContact O-N 3.47Å; N391-S394 PolarHBondContact O-N 3.49Å; N391-Y395 WeakPolarHBondContact O-CD2 3.45Å; N391-Y395 PolarHBondContact O-N 3.41Å
392	A	63.6	Low	57.6	Low	13 Å²	13	72.5 Å²	72.5	11%	0.107	41%	0.413	C	S	.	.	H	α-helix	trans	-51.8	-30	175.2	0	0	0	0	0	113.3	Q388 I389 V779	Q388-A392 WeakPolarHBondContact O-CB 3.43Å; Q388-A392 PolarHBondContact O-N 3.06Å; I389-A392 PolarHBondContact O-N 3.47Å; A392-V779 HydrophobicContact CB-CB 4.3Å; A392-V779 HydrophobicContact CB-CG1 3.64Å; A392-V779 HydrophobicContact CB-CG2 3.68Å
393	W	59	Low	54.8	Low	38 Å²	38	79.4 Å²	79.4	14%	0.144	45%	0.449	C	S	.	.	H	α-helix	trans	-93.6	-21.2	178.7	-78.1	54.8	0	0	0	113.8	Y349 S350 I389 Q390 N391 G396 R765	Y349-W393 AromaticContact CD1-CD2 3.98Å; Y349-W393 HydrophobicContact CD1-CD2 3.98Å; Y349-W393 AromaticContact CD1-CE3 3.85Å; Y349-W393 HydrophobicContact CD1-CE3 3.85Å; Y349-W393 HydrophobicContact CD1-CZ3 4.1Å; Y349-W393 HydrophobicContact CE1-CB 4.4Å; Y349-W393 AromaticContact CE1-CD2 3.93Å; Y349-W393 HydrophobicContact CE1-CD2 3.93Å; Y349-W393 AromaticContact CE1-CE3 3.73Å; Y349-W393 HydrophobicContact CE1-CE3 3.73Å; Y349-W393 HydrophobicContact CE1-CG 4.21Å; Y349-W393 HydrophobicContact CE1-CZ3 4.35Å; S350-W393 WeakPolarHBondContact OG-CH2 3.37Å; S350-W393 VanDerWaalsContact OG-CZ2 3.27Å; S350-W393 WeakPolarHBondContact OG-CZ2 3.09Å; I389-W393 WeakPolarHBondContact O-CB 3.31Å; I389-W393 PolarHBondContact O-N 2.84Å; I389-W393 VanDerWaalsContact O-N 3.12Å; Q390-W393 PolarHBondContact O-N 2.83Å; N391-W393 PolarHBondContact O-N 3.47Å; W393-G396 PolarHBondContact O-N 2.94Å; W393-R765 HydrophobicContact CH2-CB 3.7Å; W393-R765 HydrophobicContact CH2-CG 3.62Å; W393-R765 HydrophobicContact CZ3-CB 4.11Å; W393-R765 VanDerWaalsContact CZ3-CD 3.46Å; W393-R765 HydrophobicContact CZ3-CG 3.47Å; W393-R765 VanDerWaalsContact CZ3-CG 3.47Å
394	S	54.2	Low	52	Low	69 Å²	69	83.6 Å²	83.6	48%	0.483	48%	0.475	S	S	.	.	H	α-helix	trans	-75.3	-25.9	178.3	-59.5	0	0	0	0	112.3	Q390 N391 G396 L397	Q390-S394 WeakPolarHBondContact O-CB 3.44Å; Q390-S394 PolarHBondContact O-N 3.05Å; Q390-S394 PolarHBondContact O-OG 3.4Å; N391-S394 PolarHBondContact O-N 3.49Å; S394-G396 PolarHBondContact O-N 3.45Å; S394-G396 VanDerWaalsContact O-N 3.1Å; S394-L397 PolarHBondContact O-N 3.49Å
395	Y	43.4	Very low	49.5	Very low	201 Å²	201	83.8 Å²	83.8	79%	0.788	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-5.8	171.2	-68.9	-71.5	0	0	0	114.3	N391	N391-Y395 WeakPolarHBondContact O-CD2 3.45Å; N391-Y395 PolarHBondContact O-N 3.41Å
396	G	39.3	Very low	46.8	Very low	58 Å²	58	93.7 Å²	93.7	60%	0.598	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.2	11.3	178	0	0	0	0	0	115.4	W393 S394	W393-G396 PolarHBondContact O-N 2.94Å; S394-G396 PolarHBondContact O-N 3.45Å; S394-G396 VanDerWaalsContact O-N 3.1Å
397	L	33.6	Very low	44.5	Very low	137 Å²	137	99.3 Å²	99.3	72%	0.717	57%	0.565	S	S	*	*	S	Bend	trans	-120	136.3	168.5	-99.8	77.7	0	0	0	109.1	S394 S399	S394-L397 PolarHBondContact O-N 3.49Å; L397-S399 PolarHBondContact O-N 2.81Å
398	P	28.7	Very low	42	Very low	104 Å²	104	102.6 Å²	102.6	68%	0.675	59%	0.587	S	S	*	*			trans	-63.3	123.2	176.8	25.7	-33.2	0	0	0	109.9	S400	P398-S400 PolarHBondContact O-N 3.31Å
399	S	27	Very low	39.7	Very low	110 Å²	110	106.4 Å²	106.4	77%	0.769	62%	0.617	S	S	*	*			trans	-63	106.5	164.9	54.9	0	0	0	0	108	L397 S401	L397-S399 PolarHBondContact O-N 2.81Å; S399-S401 PolarHBondContact O-N 3.41Å
400	S	29.1	Very low	37.4	Very low	117 Å²	117	112.3 Å²	112.3	82%	0.818	65%	0.653	S	S	*	*			trans	-61.9	103.7	166.8	22.3	0	0	0	0	107.7	P398	P398-S400 PolarHBondContact O-N 3.31Å
401	S	26.6	Very low	35.4	Very low	78 Å²	78	118 Å²	118	55%	0.545	68%	0.684	S	S	.	*			trans	-58.9	137.1	170.9	44	0	0	0	0	108.7	S399 L403	S399-S401 PolarHBondContact O-N 3.41Å; S401-L403 PolarHBondContact O-N 2.87Å; S401-L403 WeakPolarHBondContact OG-CD1 3.27Å
402	P	24.2	Very low	33.4	Very low	130 Å²	130	121 Å²	121	84%	0.844	70%	0.7	S	S	*	*			trans	-78	73.2	-178.7	32.3	-34.9	0	0	0	110.1
403	L	27.8	Very low	31.6	Very low	147 Å²	147	127 Å²	127	77%	0.77	73%	0.725	S	S	*	*			trans	-84.7	114.9	169.8	-86.9	108.2	0	0	0	111.1	S401	S401-L403 PolarHBondContact O-N 2.87Å; S401-L403 WeakPolarHBondContact OG-CD1 3.27Å
404	T	25.6	Very low	30	Very low	136 Å²	136	131.6 Å²	131.6	83%	0.834	76%	0.762	S	S	*	*			trans	-60	120.7	170.4	44.7	0	0	0	0	113.2
405	S	28.9	Very low	28.6	Very low	117 Å²	117	135.4 Å²	135.4	82%	0.818	77%	0.772	S	S	*	*			trans	-161.2	138.9	140.8	51.7	0	0	0	0	112.3
406	R	24.3	Very low	28	Very low	241 Å²	241	133.3 Å²	133.3	91%	0.909	77%	0.774	S	S	*	*			trans	-52.7	140.2	170	-61.8	154.9	170.9	168.4	-6	109
407	T	31.6	Very low	27.4	Very low	140 Å²	140	136.8 Å²	136.8	86%	0.859	78%	0.779	S	S	*	*				-151.5	163.1	78.6	38.2	0	0	0	0	114.3
408	N	25.7	Very low	27.1	Very low	156 Å²	156	135.2 Å²	135.2	83%	0.834	78%	0.779	S	S	*	*			trans	-78.6	145.1	-177.8	-54	-46.7	0	0	0	112.1
409	S	26.8	Very low	27.2	Very low	108 Å²	108	134.5 Å²	134.5	76%	0.755	77%	0.769	S	S	*	*				162.4	149.3	93.4	62	0	0	0	0	114.7
410	V	26.5	Very low	27.3	Very low	127 Å²	127	140.2 Å²	140.2	77%	0.77	77%	0.773	S	S	*	*			trans	55	84.5	161	-148.3	0	0	0	0	119.3
411	L	29.4	Very low	27.2	Very low	173 Å²	173	137.1 Å²	137.1	91%	0.906	76%	0.76	S	S	*	*				-169.6	144.9	109.1	-100.9	166.5	0	0	0	111.4
412	N	26	Very low	27.1	Very low	142 Å²	142	141.1 Å²	141.1	76%	0.759	78%	0.775	S	S	*	*			trans	-103.5	144.1	-155.4	-90.5	-26.5	0	0	0	114.8
413	H	25.1	Very low	27.5	Very low	137 Å²	137	140.9 Å²	140.9	63%	0.634	76%	0.761	S	S	*	*			trans	56.8	102.2	146.4	-77.5	-91.3	0	0	0	120.4
414	C	25.9	Very low	27.7	Very low	135 Å²	135	140.1 Å²	140.1	91%	0.912	76%	0.758	S	S	*	*				-140.4	130.3	113.6	-98.3	0	0	0	0	110.1	L416	C414-L416 PolarHBondContact O-N 2.86Å
415	Q	25.4	Very low	28.7	Very low	149 Å²	149	139.8 Å²	139.8	70%	0.696	75%	0.751	S	S	*	*			trans	-84	103.8	-164.5	-66.8	149.2	-45.4	0	0	112
416	L	29.5	Very low	29.7	Very low	157 Å²	157	138.7 Å²	138.7	82%	0.822	74%	0.736	S	S	*	*			trans	-130.8	-2.1	167.6	-97	169	0	0	0	114.9	C414	C414-L416 PolarHBondContact O-N 2.86Å
417	N	27.6	Very low	31	Very low	131 Å²	131	132.9 Å²	132.9	70%	0.701	72%	0.719	S	S	*	*	S	Bend	trans	-105.5	4.3	-177.8	-72.9	-24.8	0	0	0	114.6
418	S	27.6	Very low	32.4	Very low	104 Å²	104	131.1 Å²	131.1	73%	0.727	70%	0.7	S	S	*	*	S	Bend	trans	-91.1	3	-175.9	-57.6	0	0	0	0	114.8
419	I	31.5	Very low	34.8	Very low	89 Å²	89	124.3 Å²	124.3	46%	0.456	66%	0.663	S	S	.	*			trans	-120.1	79.3	175.9	-46.3	167.3	0	0	0	107.8	G421 F423	I419-G421 WeakPolarHBondContact CG2-O 3.25Å; I419-F423 HydrophobicContact CB-CD2 4.12Å; I419-F423 HydrophobicContact CB-CE1 4.13Å; I419-F423 HydrophobicContact CB-CE2 3.41Å; I419-F423 VanDerWaalsContact CB-CE2 3.41Å; I419-F423 HydrophobicContact CB-CZ 3.42Å; I419-F423 VanDerWaalsContact CB-CZ 3.42Å; I419-F423 HydrophobicContact CD1-CE1 3.98Å; I419-F423 HydrophobicContact CD1-CE2 4.47Å; I419-F423 HydrophobicContact CD1-CZ 3.6Å; I419-F423 HydrophobicContact CG1-CZ 4.09Å; I419-F423 HydrophobicContact CG2-CD1 3.85Å; I419-F423 HydrophobicContact CG2-CD2 3.64Å; I419-F423 HydrophobicContact CG2-CE1 3.58Å; I419-F423 HydrophobicContact CG2-CE2 3.39Å; I419-F423 HydrophobicContact CG2-CG 3.89Å; I419-F423 HydrophobicContact CG2-CZ 3.36Å; I419-F423 VanDerWaalsContact O-CD2 3.3Å; I419-F423 WeakPolarHBondContact O-CD2 3.4Å; I419-F423 WeakPolarHBondContact O-CE2 3.28Å
420	R	28.7	Very low	37.5	Very low	231 Å²	231	119.8 Å²	119.8	87%	0.872	63%	0.631	S	S	*	*			trans	-113.3	14.6	168.9	-83.7	-171.8	171.4	-168.6	-1.4	112.4
421	G	25.8	Very low	40.4	Very low	52 Å²	52	113.9 Å²	113.9	54%	0.536	60%	0.595	S	S	.	*	S	Bend	trans	-129.8	145.4	160.7	0	0	0	0	0	107.9	I419	I419-G421 WeakPolarHBondContact CG2-O 3.25Å
422	D	26	Very low	43.3	Very low	162 Å²	162	105.7 Å²	105.7	87%	0.866	55%	0.552	S	S	*	*			trans	57	78.3	179.4	-58.8	-13.4	0	0	0	116.4
423	F	31.4	Very low	46.4	Very low	125 Å²	125	99.6 Å²	99.6	55%	0.548	52%	0.519	S	S	.	.			trans	-130.2	123.5	165.8	-91.5	-41.3	0	0	0	113.2	I419 H427	I419-F423 HydrophobicContact CB-CD2 4.12Å; I419-F423 HydrophobicContact CB-CE1 4.13Å; I419-F423 HydrophobicContact CB-CE2 3.41Å; I419-F423 VanDerWaalsContact CB-CE2 3.41Å; I419-F423 HydrophobicContact CB-CZ 3.42Å; I419-F423 VanDerWaalsContact CB-CZ 3.42Å; I419-F423 HydrophobicContact CD1-CE1 3.98Å; I419-F423 HydrophobicContact CD1-CE2 4.47Å; I419-F423 HydrophobicContact CD1-CZ 3.6Å; I419-F423 HydrophobicContact CG1-CZ 4.09Å; I419-F423 HydrophobicContact CG2-CD1 3.85Å; I419-F423 HydrophobicContact CG2-CD2 3.64Å; I419-F423 HydrophobicContact CG2-CE1 3.58Å; I419-F423 HydrophobicContact CG2-CE2 3.39Å; I419-F423 HydrophobicContact CG2-CG 3.89Å; I419-F423 HydrophobicContact CG2-CZ 3.36Å; I419-F423 VanDerWaalsContact O-CD2 3.3Å; I419-F423 WeakPolarHBondContact O-CD2 3.4Å; I419-F423 WeakPolarHBondContact O-CE2 3.28Å; F423-H427 AromaticContact CD1-CD2 3.68Å; F423-H427 AromaticContact CD1-NE2 3.63Å; F423-H427 AromaticContact CE1-CD2 3.97Å; F423-H427 AromaticContact CE1-NE2 3.76Å
424	N	33.2	Very low	49.6	Very low	130 Å²	130	93.8 Å²	93.8	70%	0.695	49%	0.493	S	S	*	.			trans	-72.2	142.2	171.9	-61.4	-60.8	0	0	0	110.8	D426 H427	N424-D426 PolarHBondContact O-N 3.14Å; N424-H427 PolarHBondContact O-CD2 2.98Å
425	D	45.8	Very low	52.9	Low	129 Å²	129	87.4 Å²	87.4	69%	0.69	45%	0.45	S	S	*	.	G	3₁₀ helix	trans	-61.9	-2.1	-173.1	-109.6	-42.2	0	0	0	115.6	K387	K387-D425 IonicContact NZ-OD1 2.66Å; K387-D425 PolarHBondContact NZ-OD1 2.93Å; K387-D425 IonicContact NZ-OD2 3.34Å; K387-D425 PolarHBondContact NZ-OD2 3.13Å
426	D	49.4	Very low	56.2	Low	94 Å²	94	80.3 Å²	80.3	50%	0.503	42%	0.417	S	S	.	.	G	3₁₀ helix	trans	-83.9	-10.4	-170.6	-71.4	-41.4	0	0	0	115.2	N424 F428 N496	N424-D426 PolarHBondContact O-N 3.14Å; D426-F428 PolarHBondContact O-N 3.01Å; D426-F428 VanDerWaalsContact O-N 3.11Å; D426-N496 PolarHBondContact O-ND2 3.46Å
427	H	51.4	Low	59.2	Low	119 Å²	119	73.2 Å²	73.2	55%	0.551	38%	0.381	S	S	*	.	G	3₁₀ helix	trans	-68.9	-10	-169.9	-76.8	-60.8	0	0	0	116	F423 N424	F423-H427 AromaticContact CD1-CD2 3.68Å; F423-H427 AromaticContact CD1-NE2 3.63Å; F423-H427 AromaticContact CE1-CD2 3.97Å; F423-H427 AromaticContact CE1-NE2 3.76Å; N424-H427 PolarHBondContact O-CD2 2.98Å
428	F	62.5	Low	62.4	Low	104 Å²	104	69.2 Å²	69.2	46%	0.456	36%	0.361	S	S	.	.	G	3₁₀ helix	trans	-109.6	-3.2	-171.8	-150.5	-100.5	0	0	0	115.4	Q390 D426 P430	Q390-F428 VanDerWaalsContact CD-CE1 3.48Å; Q390-F428 HydrophobicContact CG-CE1 4.35Å; Q390-F428 VanDerWaalsContact OE1-CE1 3.31Å; D426-F428 PolarHBondContact O-N 3.01Å; D426-F428 VanDerWaalsContact O-N 3.11Å; F428-P430 WeakPolarHBondContact O-CD 3.48Å
429	M	75.5	Confident	65.5	Low	13 Å²	13	68.1 Å²	68.1	6%	0.064	35%	0.35	C	S	.	.	P	Polyproline II helix	trans	-79.9	125.8	-176.7	179.1	53.7	68.7	0	0	112.3	I357 Y379 L382 V383 F386 H499	I357-M429 HydrophobicContact CD1-SD 3.78Å; Y379-M429 HydrophobicContact CE2-CG 3.69Å; Y379-M429 HydrophobicContact CE2-SD 4.47Å; Y379-M429 WeakPolarHBondContact OH-CG 3.48Å; L382-M429 HydrophobicContact CB-CE 4.19Å; V383-M429 HydrophobicContact CB-CE 3.96Å; V383-M429 HydrophobicContact CG2-CE 3.4Å; F386-M429 HydrophobicContact CD2-CE 3.94Å; F386-M429 HydrophobicContact CD2-SD 4.18Å; F386-M429 HydrophobicContact CE2-SD 4.36Å; M429-H499 PolarHBondContact O-CE1 2.97Å; M429-H499 VanDerWaalsContact O-CE1 3.31Å; M429-H499 PolarHBondContact O-ND1 3.02Å
430	P	83.2	Confident	68.3	Low	12 Å²	12	64.7 Å²	64.7	8%	0.078	34%	0.337	C	S	.	.	P	Polyproline II helix	trans	-48.5	150.4	167.8	-35.3	39	0	0	0	115.2	M355 I357 F386 F428 F432	M355-P430 HydrophobicContact CB-CG 4.38Å; M355-P430 WeakPolarHBondContact O-CB 3.43Å; I357-P430 HydrophobicContact CD1-CB 3.98Å; I357-P430 HydrophobicContact CD1-CG 4.36Å; I357-P430 HydrophobicContact CG1-CB 4.02Å; F386-P430 HydrophobicContact CE1-CG 4.23Å; F386-P430 HydrophobicContact CZ-CG 4.16Å; F428-P430 WeakPolarHBondContact O-CD 3.48Å; P430-F432 PolarHBondContact O-N 3.22Å
431	P	87.4	Confident	71.3	Confident	3 Å²	3	57.3 Å²	57.3	2%	0.019	31%	0.312	C	S	.	.	P	Polyproline II helix	trans	-54.5	134.3	173.7	-25.8	35.5	0	0	0	112.1	I357 F433 I500 M503	I357-P431 PolarHBondContact N-O 3.44Å; P431-F433 HydrophobicContact CB-CE2 3.82Å; P431-F433 HydrophobicContact CB-CZ 4.32Å; P431-I500 HydrophobicContact CB-CD1 4.46Å; P431-I500 HydrophobicContact CB-CG1 4.14Å; P431-I500 HydrophobicContact CG-CD1 4.5Å; P431-I500 HydrophobicContact CG-CG1 3.67Å; P431-M503 HydrophobicContact CG-CE 3.89Å
432	F	89.9	Confident	74.3	Confident	2 Å²	2	55.9 Å²	55.9	1%	0.009	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	117.6	-170.1	-177.7	-88.8	0	0	0	111.8	I357 L359 I375 Y379 L382 P430 P434 F494	I357-F432 HydrophobicContact CB-CD2 3.91Å; I357-F432 HydrophobicContact CG2-CD2 3.61Å; I357-F432 HydrophobicContact CG2-CE2 3.84Å; I357-F432 WeakPolarHBondContact O-CA 3.32Å; L359-F432 HydrophobicContact CB-CE1 4.44Å; L359-F432 HydrophobicContact CB-CE2 4.19Å; L359-F432 HydrophobicContact CB-CZ 3.74Å; L359-F432 HydrophobicContact CD2-CZ 3.93Å; L359-F432 HydrophobicContact CG-CZ 4.35Å; I375-F432 HydrophobicContact CG2-CE1 3.84Å; I375-F432 HydrophobicContact CG2-CZ 4.19Å; Y379-F432 HydrophobicContact CD2-CB 4.48Å; Y379-F432 HydrophobicContact CD2-CD1 4.38Å; Y379-F432 HydrophobicContact CD2-CD2 4.15Å; Y379-F432 HydrophobicContact CD2-CE2 4.5Å; Y379-F432 HydrophobicContact CD2-CG 4.09Å; Y379-F432 HydrophobicContact CE2-CB 4.35Å; Y379-F432 HydrophobicContact CE2-CG 4.44Å; L382-F432 HydrophobicContact CD1-CD2 4.41Å; L382-F432 HydrophobicContact CD1-CE2 3.91Å; P430-F432 PolarHBondContact O-N 3.22Å; F432-P434 HydrophobicContact CE1-CB 4.47Å; F432-F494 HydrophobicContact CD1-CB 4.36Å
433	F	92.1	Very high	77.5	Confident	13 Å²	13	49 Å²	49	6%	0.057	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	107.1	-176.6	-61.5	-81.3	0	0	0	111.6	I356 I357 V358 L359 P431 V435 L446 F449	I356-F433 HydrophobicContact CG2-CD2 3.65Å; I356-F433 HydrophobicContact CG2-CE2 3.69Å; I357-F433 PolarHBondContact O-N 2.83Å; V358-F433 CarbonylContact C-O 3.53Å; V358-F433 WeakPolarHBondContact CA-O 3.4Å; V358-F433 HydrophobicContact CG2-CB 4.37Å; L359-F433 PolarHBondContact N-O 2.95Å; P431-F433 HydrophobicContact CB-CE2 3.82Å; P431-F433 HydrophobicContact CB-CZ 4.32Å; F433-V435 HydrophobicContact CB-CG1 4.39Å; F433-L446 HydrophobicContact CD2-CD1 4.19Å; F433-L446 HydrophobicContact CG-CD1 4.33Å; F433-F449 HydrophobicContact CE1-CB 4.25Å; F433-F449 HydrophobicContact CE2-CD1 4.42Å; F433-F449 HydrophobicContact CE2-CD2 4.26Å; F433-F449 HydrophobicContact CE2-CG 4.1Å; F433-F449 HydrophobicContact CZ-CB 3.82Å; F433-F449 HydrophobicContact CZ-CD1 4.48Å; F433-F449 AromaticContact CZ-CD2 3.82Å; F433-F449 HydrophobicContact CZ-CD2 3.82Å; F433-F449 AromaticContact CZ-CG 3.74Å; F433-F449 HydrophobicContact CZ-CG 3.74Å
434	P	92.7	Very high	80.2	Confident	16 Å²	16	49 Å²	49	10%	0.104	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	125.9	168.7	28.9	-28.1	0	0	0	110.3	L359 I362 I375 F432 F491	L359-P434 WeakPolarHBondContact O-CA 3.3Å; I362-P434 HydrophobicContact CD1-CB 4.37Å; I362-P434 HydrophobicContact CG2-CB 4.13Å; I375-P434 HydrophobicContact CD1-CB 4.29Å; F432-P434 HydrophobicContact CE1-CB 4.47Å; P434-F491 HydrophobicContact CB-CE1 4.33Å; P434-F491 HydrophobicContact CG-CD1 3.56Å; P434-F491 HydrophobicContact CG-CE1 3.8Å
435	V	94.1	Very high	82.9	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	25%	0.253	C	S	.	.			trans	-138	154.1	-176	-53.6	0	0	0	0	112.9	L226 V358 L359 T360 K361 F433 Q441 I443 L446	L226-V435 HydrophobicContact CD1-CG2 4.3Å; V358-V435 HydrophobicContact CG1-CB 4.49Å; V358-V435 HydrophobicContact CG1-CG1 4.21Å; V358-V435 HydrophobicContact CG1-CG2 3.44Å; V358-V435 VanDerWaalsContact CG1-CG2 3.44Å; L359-V435 PolarHBondContact O-N 3.17Å; T360-V435 CarbonylContact C-O 3.45Å; T360-V435 VanDerWaalsContact CA-O 3.28Å; T360-V435 WeakPolarHBondContact CA-O 3.41Å; T360-V435 HydrophobicContact CG2-CG2 3.99Å; K361-V435 PolarHBondContact N-O 2.93Å; F433-V435 HydrophobicContact CB-CG1 4.39Å; V435-Q441 CarbonylContact C-O 3.47Å; V435-Q441 VanDerWaalsContact CA-O 3.22Å; V435-Q441 WeakPolarHBondContact CA-O 3.45Å; V435-I443 HydrophobicContact CB-CG1 4.49Å; V435-L446 HydrophobicContact CG1-CB 4.43Å; V435-L446 HydrophobicContact CG1-CD2 4.38Å
436	S	94.3	Very high	85.1	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	22%	0.22	C	C	.	.			trans	-123.3	122.9	163.9	177.7	0	0	0	0	111.2	D363 V438 T439 G440 Q441 I443	D363-S436 WeakPolarHBondContact CB-OG 3.39Å; D363-S436 VanDerWaalsContact OD1-CB 3.3Å; D363-S436 WeakPolarHBondContact OD1-CB 3.34Å; D363-S436 PolarHBondContact OD1-OG 3.46Å; S436-V438 PolarHBondContact O-N 2.86Å; S436-V438 PolarHBondContact OG-N 3.39Å; S436-T439 WeakPolarHBondContact CB-OG1 3.16Å; S436-T439 PolarHBondContact OG-N 3.31Å; S436-T439 PolarHBondContact OG-OG1 2.65Å; S436-G440 VanDerWaalsContact O-CA 3.32Å; S436-G440 WeakPolarHBondContact O-CA 3.32Å; S436-G440 PolarHBondContact O-N 2.88Å; S436-Q441 PolarHBondContact N-O 2.84Å; S436-I443 WeakPolarHBondContact O-CD1 3.48Å
437	S	94	Very high	87	Confident	9 Å²	9	36.7 Å²	36.7	6%	0.063	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70	-10.8	169.1	-58.7	0	0	0	0	113.7	D236	D236-S437 PolarHBondContact N-O 3.48Å
438	V	93.9	Very high	88.7	Confident	47 Å²	47	36.6 Å²	36.6	29%	0.285	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.4	-46.5	-176.8	-178.6	0	0	0	0	111.1	A238 S436	A238-V438 HydrophobicContact CB-CG1 4.29Å; A238-V438 HydrophobicContact CB-CG2 4.02Å; S436-V438 PolarHBondContact O-N 2.86Å; S436-V438 PolarHBondContact OG-N 3.39Å
439	T	91.9	Very high	90	Very high	81 Å²	81	31.9 Å²	31.9	50%	0.497	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.9	-9.1	179.6	64.6	0	0	0	0	113.7	D363 S436 Q441	D363-T439 HydrophobicContact CB-CG2 3.85Å; S436-T439 WeakPolarHBondContact CB-OG1 3.16Å; S436-T439 PolarHBondContact OG-N 3.31Å; S436-T439 PolarHBondContact OG-OG1 2.65Å; T439-Q441 PolarHBondContact O-N 2.83Å; T439-Q441 WeakPolarHBondContact OG1-CB 3.31Å; T439-Q441 PolarHBondContact OG1-N 2.94Å
440	G	91	Very high	90.7	Very high	17 Å²	17	31.2 Å²	31.2	18%	0.175	18%	0.175	C	C	.	.			trans	77	-8.5	-173.8	0	0	0	0	0	114.4	S436 G442 I443	S436-G440 VanDerWaalsContact O-CA 3.32Å; S436-G440 WeakPolarHBondContact O-CA 3.32Å; S436-G440 PolarHBondContact O-N 2.88Å; G440-G442 PolarHBondContact O-N 3.45Å; G440-I443 WeakPolarHBondContact O-CB 3.49Å; G440-I443 WeakPolarHBondContact O-CG1 3.2Å; G440-I443 PolarHBondContact O-N 3.29Å; G440-I443 VanDerWaalsContact O-N 3.17Å
441	Q	91.5	Very high	90.9	Very high	76 Å²	76	31 Å²	31	36%	0.355	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.9	128.3	-177.4	-174.1	-178.9	2.7	0	0	111.3	I362 V435 S436 T439 I443	I362-Q441 HydrophobicContact CD1-CB 4.23Å; I362-Q441 HydrophobicContact CD1-CG 3.92Å; V435-Q441 CarbonylContact C-O 3.47Å; V435-Q441 VanDerWaalsContact CA-O 3.22Å; V435-Q441 WeakPolarHBondContact CA-O 3.45Å; S436-Q441 PolarHBondContact N-O 2.84Å; T439-Q441 PolarHBondContact O-N 2.83Å; T439-Q441 WeakPolarHBondContact OG1-CB 3.31Å; T439-Q441 PolarHBondContact OG1-N 2.94Å; Q441-I443 PolarHBondContact O-N 3.31Å
442	G	89	Confident	90.8	Very high	21 Å²	21	32.9 Å²	32.9	22%	0.216	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	77.7	-7.2	175.8	0	0	0	0	0	115.9	G440 D444 N445 L446	G440-G442 PolarHBondContact O-N 3.45Å; G442-D444 VanDerWaalsContact C-N 3.34Å; G442-D444 PolarHBondContact O-N 3.11Å; G442-N445 PolarHBondContact O-N 3.1Å; G442-L446 PolarHBondContact O-N 2.79Å
443	I	92.2	Very high	90.6	Very high	17 Å²	17	32.8 Å²	32.8	9%	0.087	18%	0.18	C	C	.	.	H	α-helix	trans	-63.1	-41	179.4	-64.6	-172.7	0	0	0	111	V229 L230 L235 V435 S436 G440 Q441 N445 L446 M447	V229-I443 HydrophobicContact CG1-CD1 3.58Å; L230-I443 HydrophobicContact CD2-CG2 3.68Å; L235-I443 HydrophobicContact CD2-CD1 4.19Å; V435-I443 HydrophobicContact CB-CG1 4.49Å; S436-I443 WeakPolarHBondContact O-CD1 3.48Å; G440-I443 WeakPolarHBondContact O-CB 3.49Å; G440-I443 WeakPolarHBondContact O-CG1 3.2Å; G440-I443 PolarHBondContact O-N 3.29Å; G440-I443 VanDerWaalsContact O-N 3.17Å; Q441-I443 PolarHBondContact O-N 3.31Å; I443-N445 VanDerWaalsContact C-N 3.29Å; I443-N445 PolarHBondContact O-N 2.75Å; I443-L446 WeakPolarHBondContact O-CB 3.45Å; I443-L446 PolarHBondContact O-N 3.45Å; I443-L446 VanDerWaalsContact O-N 3.09Å; I443-M447 HydrophobicContact CG2-CG 3.93Å; I443-M447 WeakPolarHBondContact O-CG 3.44Å; I443-M447 PolarHBondContact O-N 3.39Å
444	D	90.2	Very high	90.2	Very high	126 Å²	126	32.2 Å²	32.2	67%	0.674	18%	0.178	S	C	*	.	H	α-helix	trans	-59.2	-39.1	-179.4	-54.5	-44.7	0	0	0	112.6	G442 M447 H448	G442-D444 VanDerWaalsContact C-N 3.34Å; G442-D444 PolarHBondContact O-N 3.11Å; D444-M447 PolarHBondContact O-N 3.18Å; D444-H448 WeakPolarHBondContact O-CB 3.18Å; D444-H448 PolarHBondContact O-N 3.48Å
445	N	89	Confident	89.4	Confident	79 Å²	79	32.7 Å²	32.7	42%	0.422	18%	0.181	S	C	.	.	H	α-helix	trans	-65.1	-42	176.6	-71.1	-2.9	0	0	0	111.6	G442 I443 M447 F449	G442-N445 PolarHBondContact O-N 3.1Å; I443-N445 VanDerWaalsContact C-N 3.29Å; I443-N445 PolarHBondContact O-N 2.75Å; N445-M447 VanDerWaalsContact C-N 3.34Å; N445-F449 PolarHBondContact O-N 2.87Å; N445-F449 VanDerWaalsContact O-N 3.1Å
446	L	91.5	Very high	88.5	Confident	1 Å²	1	33.2 Å²	33.2	1%	0.005	18%	0.184	C	C	.	.	H	α-helix	trans	-64.4	-40.5	174	179.3	61.9	0	0	0	110.8	L226 L230 V358 F433 V435 G442 I443 F449 L450	L226-L446 HydrophobicContact CD1-CD2 4.31Å; L226-L446 HydrophobicContact CD2-CD2 4.37Å; L230-L446 HydrophobicContact CD1-CD2 4.31Å; V358-L446 HydrophobicContact CG1-CD2 4.38Å; V358-L446 HydrophobicContact CG2-CD1 4.02Å; V358-L446 HydrophobicContact CG2-CD2 4.23Å; F433-L446 HydrophobicContact CD2-CD1 4.19Å; F433-L446 HydrophobicContact CG-CD1 4.33Å; V435-L446 HydrophobicContact CG1-CB 4.43Å; V435-L446 HydrophobicContact CG1-CD2 4.38Å; G442-L446 PolarHBondContact O-N 2.79Å; I443-L446 WeakPolarHBondContact O-CB 3.45Å; I443-L446 PolarHBondContact O-N 3.45Å; I443-L446 VanDerWaalsContact O-N 3.09Å; L446-F449 WeakPolarHBondContact O-CB 3.3Å; L446-F449 PolarHBondContact O-N 2.95Å; L446-L450 HydrophobicContact CD1-CD1 4.45Å; L446-L450 HydrophobicContact CD1-CG 4.34Å; L446-L450 HydrophobicContact CG-CD1 4.19Å; L446-L450 HydrophobicContact CG-CG 4.46Å; L446-L450 VanDerWaalsContact O-CG 3.29Å; L446-L450 WeakPolarHBondContact O-CG 3.25Å; L446-L450 PolarHBondContact O-N 3.04Å
447	M	90	Very high	86.9	Confident	15 Å²	15	34 Å²	34	7%	0.074	19%	0.188	C	C	.	.	H	α-helix	trans	-69.9	-39.3	-179.9	-68.1	-58.3	-80.9	0	0	112.9	L230 L266 F268 V274 I443 D444 N445 F449 L450 S451	L230-M447 HydrophobicContact CB-SD 4.19Å; L230-M447 HydrophobicContact CD1-SD 3.91Å; L230-M447 HydrophobicContact CD2-CG 4.22Å; L230-M447 HydrophobicContact CD2-SD 3.64Å; L230-M447 HydrophobicContact CG-SD 4.08Å; L266-M447 HydrophobicContact CD1-CE 3.95Å; L266-M447 HydrophobicContact CD2-CE 3.85Å; L266-M447 HydrophobicContact CD2-SD 4.22Å; L266-M447 HydrophobicContact CG-CE 4.44Å; F268-M447 HydrophobicContact CE1-CE 4.12Å; F268-M447 HydrophobicContact CZ-CE 4.26Å; V274-M447 HydrophobicContact CB-CE 4.49Å; V274-M447 HydrophobicContact CG1-CE 4.48Å; V274-M447 HydrophobicContact CG2-CE 3.23Å; I443-M447 HydrophobicContact CG2-CG 3.93Å; I443-M447 WeakPolarHBondContact O-CG 3.44Å; I443-M447 PolarHBondContact O-N 3.39Å; D444-M447 PolarHBondContact O-N 3.18Å; N445-M447 VanDerWaalsContact C-N 3.34Å; M447-F449 VanDerWaalsContact C-N 3.32Å; M447-F449 PolarHBondContact O-N 3.35Å; M447-L450 PolarHBondContact O-N 3.14Å; M447-L450 HydrophobicContact SD-CD1 4.05Å; M447-S451 VanDerWaalsContact O-CB 3.24Å; M447-S451 WeakPolarHBondContact O-CB 3.24Å; M447-S451 PolarHBondContact O-N 3.26Å
448	H	87.4	Confident	85.2	Confident	117 Å²	117	37.1 Å²	37.1	54%	0.542	20%	0.202	S	C	.	.	H	α-helix	trans	-60.4	-41.4	170.7	176.2	-110.8	0	0	0	111.7	D444 S451 R452	D444-H448 WeakPolarHBondContact O-CB 3.18Å; D444-H448 PolarHBondContact O-N 3.48Å; H448-S451 PolarHBondContact O-N 2.95Å; H448-R452 WeakPolarHBondContact O-CG 3.48Å; H448-R452 PolarHBondContact O-N 3.13Å
449	F	89.6	Confident	82.9	Confident	4 Å²	4	39.7 Å²	39.7	2%	0.018	22%	0.222	C	C	.	.	H	α-helix	trans	-62.8	-47.8	172.9	170.7	-84.2	0	0	0	112.3	I356 F433 N445 L446 M447 S451 R452 L453 I500 M503 F504	I356-F449 HydrophobicContact CD1-CD1 4.37Å; I356-F449 HydrophobicContact CD1-CE1 3.3Å; I356-F449 HydrophobicContact CD1-CZ 3.49Å; I356-F449 VanDerWaalsContact CD1-CZ 3.49Å; I356-F449 HydrophobicContact CG1-CE1 4.19Å; I356-F449 HydrophobicContact CG1-CZ 4.02Å; F433-F449 HydrophobicContact CE1-CB 4.25Å; F433-F449 HydrophobicContact CE2-CD1 4.42Å; F433-F449 HydrophobicContact CE2-CD2 4.26Å; F433-F449 HydrophobicContact CE2-CG 4.1Å; F433-F449 HydrophobicContact CZ-CB 3.82Å; F433-F449 HydrophobicContact CZ-CD1 4.48Å; F433-F449 AromaticContact CZ-CD2 3.82Å; F433-F449 HydrophobicContact CZ-CD2 3.82Å; F433-F449 AromaticContact CZ-CG 3.74Å; F433-F449 HydrophobicContact CZ-CG 3.74Å; N445-F449 PolarHBondContact O-N 2.87Å; N445-F449 VanDerWaalsContact O-N 3.1Å; L446-F449 WeakPolarHBondContact O-CB 3.3Å; L446-F449 PolarHBondContact O-N 2.95Å; M447-F449 VanDerWaalsContact C-N 3.32Å; M447-F449 PolarHBondContact O-N 3.35Å; F449-S451 VanDerWaalsContact C-N 3.27Å; F449-S451 PolarHBondContact O-N 3.4Å; F449-R452 PolarHBondContact O-N 3.06Å; F449-L453 HydrophobicContact CE1-CB 4.39Å; F449-L453 HydrophobicContact CE1-CD2 4.23Å; F449-L453 WeakPolarHBondContact O-CB 3.49Å; F449-L453 PolarHBondContact O-N 3.1Å; F449-I500 HydrophobicContact CD2-CD1 4.39Å; F449-I500 HydrophobicContact CD2-CG2 4.33Å; F449-I500 HydrophobicContact CE2-CG1 4.34Å; F449-I500 HydrophobicContact CE2-CG2 3.99Å; F449-M503 HydrophobicContact CE2-CE 3.64Å; F449-M503 HydrophobicContact CZ-CE 3.5Å; F449-F504 HydrophobicContact CD2-CZ 4.08Å; F449-F504 AromaticContact CE2-CE1 3.62Å; F449-F504 HydrophobicContact CE2-CE1 3.62Å; F449-F504 AromaticContact CE2-CZ 3.61Å; F449-F504 HydrophobicContact CE2-CZ 3.61Å; F449-F504 AromaticContact CZ-CE1 3.69Å; F449-F504 HydrophobicContact CZ-CE1 3.69Å; F449-F504 HydrophobicContact CZ-CZ 4.05Å
450	L	90.5	Very high	80.7	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-65.2	-32.2	179.7	-68.4	177.8	0	0	0	112.2	L230 L266 F268 L300 I328 L446 M447 L453 S454	L230-L450 HydrophobicContact CD1-CD1 3.78Å; L266-L450 HydrophobicContact CD2-CD1 4.26Å; F268-L450 HydrophobicContact CE2-CB 4.37Å; F268-L450 HydrophobicContact CZ-CB 3.9Å; L300-L450 HydrophobicContact CD2-CB 4.1Å; L300-L450 HydrophobicContact CD2-CD1 4.47Å; L300-L450 HydrophobicContact CD2-CD2 3.94Å; L300-L450 HydrophobicContact CD2-CG 4.38Å; I328-L450 HydrophobicContact CD1-CD2 4.16Å; L446-L450 HydrophobicContact CD1-CD1 4.45Å; L446-L450 HydrophobicContact CD1-CG 4.34Å; L446-L450 HydrophobicContact CG-CD1 4.19Å; L446-L450 HydrophobicContact CG-CG 4.46Å; L446-L450 VanDerWaalsContact O-CG 3.29Å; L446-L450 WeakPolarHBondContact O-CG 3.25Å; L446-L450 PolarHBondContact O-N 3.04Å; M447-L450 PolarHBondContact O-N 3.14Å; M447-L450 HydrophobicContact SD-CD1 4.05Å; L450-L453 HydrophobicContact CD2-CD2 4.25Å; L450-L453 WeakPolarHBondContact O-CB 3.4Å; L450-L453 PolarHBondContact O-N 2.68Å; L450-S454 WeakPolarHBondContact O-CB 3.32Å; L450-S454 PolarHBondContact O-N 3.1Å
451	S	86.5	Confident	78.4	Confident	8 Å²	8	44.9 Å²	44.9	6%	0.056	25%	0.249	C	C	.	.	H	α-helix	trans	-65.5	-52.4	173.2	-177.2	0	0	0	0	111.7	G272 M447 H448 F449 L453 S454 C455	G272-S451 WeakPolarHBondContact CA-OG 3.45Å; G272-S451 PolarHBondContact O-OG 3.29Å; M447-S451 VanDerWaalsContact O-CB 3.24Å; M447-S451 WeakPolarHBondContact O-CB 3.24Å; M447-S451 PolarHBondContact O-N 3.26Å; H448-S451 PolarHBondContact O-N 2.95Å; F449-S451 VanDerWaalsContact C-N 3.27Å; F449-S451 PolarHBondContact O-N 3.4Å; S451-L453 PolarHBondContact O-N 3.41Å; S451-S454 PolarHBondContact O-N 3.22Å; S451-S454 PolarHBondContact O-OG 2.96Å; S451-C455 PolarHBondContact O-N 2.97Å; S451-C455 PolarHBondContact O-SG 3.46Å
452	R	85.3	Confident	75.9	Confident	42 Å²	42	45 Å²	45	16%	0.158	26%	0.256	C	S	.	.	H	α-helix	trans	-53.2	-43.2	172.4	-76.3	172.2	65.6	-172.1	0.9	111.7	H448 F449 C455 E497 F504	H448-R452 WeakPolarHBondContact O-CG 3.48Å; H448-R452 PolarHBondContact O-N 3.13Å; F449-R452 PolarHBondContact O-N 3.06Å; R452-C455 PolarHBondContact O-N 3.1Å; R452-E497 IonicContact CZ-OE1 3.89Å; R452-E497 IonicContact CZ-OE2 3.87Å; R452-E497 IonicContact NH1-OE1 2.58Å; R452-E497 PolarHBondContact NH1-OE1 3.47Å; R452-E497 IonicContact NH1-OE2 2.68Å; R452-E497 PolarHBondContact NH1-OE2 3.35Å; R452-E497 VanDerWaalsContact NH1-OE2 3.09Å; R452-E497 IonicContact NH2-OE1 2.61Å; R452-E497 IonicContact NH2-OE2 3.58Å; R452-E497 PolarHBondContact NH2-OE2 2.9Å; R452-F504 HydrophobicContact CB-CE2 3.94Å; R452-F504 HydrophobicContact CB-CZ 4.11Å
453	L	86.6	Confident	73.4	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-62.7	-42.9	177.3	175.2	69.3	0	0	0	112.1	L211 V213 L300 I326 F449 L450 S451 C455 L456 F504 I507	L211-L453 HydrophobicContact CD2-CD1 4.33Å; L211-L453 HydrophobicContact CD2-CG 3.91Å; L211-L453 VanDerWaalsContact CD2-O 3.3Å; L211-L453 WeakPolarHBondContact CD2-O 3.46Å; V213-L453 HydrophobicContact CG2-CD2 4.09Å; L300-L453 HydrophobicContact CD1-CD2 4.32Å; I326-L453 HydrophobicContact CD1-CD1 3.38Å; I326-L453 HydrophobicContact CD1-CD2 3.52Å; I326-L453 HydrophobicContact CD1-CG 4.06Å; F449-L453 HydrophobicContact CE1-CB 4.39Å; F449-L453 HydrophobicContact CE1-CD2 4.23Å; F449-L453 WeakPolarHBondContact O-CB 3.49Å; F449-L453 PolarHBondContact O-N 3.1Å; L450-L453 HydrophobicContact CD2-CD2 4.25Å; L450-L453 WeakPolarHBondContact O-CB 3.4Å; L450-L453 PolarHBondContact O-N 2.68Å; S451-L453 PolarHBondContact O-N 3.41Å; L453-C455 PolarHBondContact O-N 3.36Å; L453-L456 HydrophobicContact CD1-CD1 3.82Å; L453-L456 WeakPolarHBondContact O-CB 3.23Å; L453-L456 WeakPolarHBondContact O-CG 3.42Å; L453-L456 PolarHBondContact O-N 3.31Å; L453-F504 HydrophobicContact CB-CE1 4.05Å; L453-F504 HydrophobicContact CB-CZ 4.22Å; L453-F504 HydrophobicContact CD1-CD1 4.13Å; L453-F504 HydrophobicContact CD1-CE1 3.8Å; L453-I507 HydrophobicContact CD1-CD1 3.93Å
454	S	82.3	Confident	70.6	Confident	1 Å²	1	51.7 Å²	51.7	1%	0.007	30%	0.299	C	S	.	.	H	α-helix	trans	-62.9	-30.8	179.3	78.9	0	0	0	0	113.1	F268 N298 L450 S451 L456	F268-S454 WeakPolarHBondContact CD2-OG 3.14Å; N298-S454 VanDerWaalsContact CB-OG 3.27Å; N298-S454 WeakPolarHBondContact CB-OG 3.26Å; N298-S454 PolarHBondContact OD1-O 3.3Å; L450-S454 WeakPolarHBondContact O-CB 3.32Å; L450-S454 PolarHBondContact O-N 3.1Å; S451-S454 PolarHBondContact O-N 3.22Å; S451-S454 PolarHBondContact O-OG 2.96Å; S454-L456 VanDerWaalsContact C-N 3.28Å; S454-L456 PolarHBondContact O-N 2.57Å
455	C	76.2	Confident	67.7	Low	25 Å²	25	50.5 Å²	50.5	17%	0.169	30%	0.301	C	S	.	.	G	3₁₀ helix	trans	-72	-14.9	180	-61.1	0	0	0	0	114	N298 S451 R452 L453 N457 Q458	N298-C455 PolarHBondContact ND2-SG 3.03Å; N298-C455 VanDerWaalsContact ND2-SG 3.37Å; S451-C455 PolarHBondContact O-N 2.97Å; S451-C455 PolarHBondContact O-SG 3.46Å; R452-C455 PolarHBondContact O-N 3.1Å; L453-C455 PolarHBondContact O-N 3.36Å; C455-N457 PolarHBondContact O-N 3.3Å; C455-N457 VanDerWaalsContact O-N 3.08Å; C455-Q458 PolarHBondContact O-N 3.2Å
456	L	74.7	Confident	64.9	Low	11 Å²	11	51.7 Å²	51.7	6%	0.058	31%	0.306	C	S	.	.	G	3₁₀ helix	trans	-63.3	-16.8	-176.9	-63.4	-178.8	0	0	0	114.3	L453 S454 Q458 L461 F504 I507 H508 M511	L453-L456 HydrophobicContact CD1-CD1 3.82Å; L453-L456 WeakPolarHBondContact O-CB 3.23Å; L453-L456 WeakPolarHBondContact O-CG 3.42Å; L453-L456 PolarHBondContact O-N 3.31Å; S454-L456 VanDerWaalsContact C-N 3.28Å; S454-L456 PolarHBondContact O-N 2.57Å; L456-Q458 VanDerWaalsContact C-N 3.31Å; L456-L461 HydrophobicContact CD2-CD2 3.91Å; L456-F504 HydrophobicContact CD1-CB 3.85Å; L456-F504 HydrophobicContact CD1-CD1 3.77Å; L456-F504 HydrophobicContact CD1-CE1 4.43Å; L456-F504 HydrophobicContact CD1-CG 3.81Å; L456-F504 HydrophobicContact CD2-CB 4.01Å; L456-F504 HydrophobicContact CD2-CD2 4.26Å; L456-F504 HydrophobicContact CD2-CG 4.17Å; L456-I507 HydrophobicContact CD1-CB 4.21Å; L456-I507 HydrophobicContact CD1-CG2 3.87Å; L456-H508 PolarHBondContact O-ND1 3.36Å; L456-M511 HydrophobicContact CB-CE 4.24Å; L456-M511 HydrophobicContact CB-SD 3.98Å
457	N	61.4	Low	61.8	Low	16 Å²	16	57 Å²	57	9%	0.086	34%	0.343	C	S	.	.	G	3₁₀ helix	trans	-72.2	-23.3	174	-99.9	-19.2	0	0	0	113.1	P209 C455 M511 K515	P209-N457 WeakPolarHBondContact CD-OD1 3.33Å; P209-N457 PolarHBondContact O-ND2 2.71Å; C455-N457 PolarHBondContact O-N 3.3Å; C455-N457 VanDerWaalsContact O-N 3.08Å; N457-M511 PolarHBondContact OD1-SD 2.83Å; N457-M511 VanDerWaalsContact OD1-SD 3.38Å; N457-K515 PolarHBondContact O-NZ 3.38Å
458	Q	58.6	Low	58.8	Low	75 Å²	75	60.6 Å²	60.6	35%	0.35	37%	0.37	S	S	.	.	S	Bend	trans	-89.4	146.7	-177.3	-59.8	-171.4	-6.1	0	0	111.7	S297 N298 C455 L456	S297-Q458 PolarHBondContact O-NE2 2.73Å; S297-Q458 VanDerWaalsContact O-NE2 3.09Å; N298-Q458 PolarHBondContact ND2-NE2 3.37Å; N298-Q458 VanDerWaalsContact OD1-CD 3.3Å; N298-Q458 WeakPolarHBondContact OD1-CG 3.08Å; N298-Q458 PolarHBondContact OD1-NE2 3.19Å; C455-Q458 PolarHBondContact O-N 3.2Å; L456-Q458 VanDerWaalsContact C-N 3.31Å
459	S	46.5	Very low	55.8	Low	102 Å²	102	60.5 Å²	60.5	71%	0.713	38%	0.382	S	S	*	.	S	Bend	trans	-123.4	133.3	173.5	55.4	0	0	0	0	109.4
460	P	44.7	Very low	52.9	Low	119 Å²	119	65 Å²	65	77%	0.773	41%	0.414	S	S	*	.	S	Bend	cis	-75.7	158.7	1.3	32.5	-35.9	0	0	0	113.3
461	L	42	Very low	49.9	Very low	87 Å²	87	69.6 Å²	69.6	46%	0.455	45%	0.446	S	S	.	.	P	Polyproline II helix	trans	-58.6	131.1	170.8	-72.2	167.4	0	0	0	109.7	L456 A463	L456-L461 HydrophobicContact CD2-CD2 3.91Å; L461-A463 PolarHBondContact O-N 3.08Å
462	P	39	Very low	47	Very low	78 Å²	78	74.7 Å²	74.7	51%	0.506	48%	0.482	S	S	.	.	P	Polyproline II helix	trans	-56.6	138.3	171.1	-23.5	33.4	0	0	0	110.5	L464	P462-L464 PolarHBondContact O-N 3.27Å; P462-L464 VanDerWaalsContact O-N 3.07Å
463	A	36.7	Very low	44.4	Very low	90 Å²	90	79.2 Å²	79.2	74%	0.744	51%	0.509	S	S	*	.	P	Polyproline II helix	trans	-59.3	116.8	176.1	0	0	0	0	0	109.6	L461 S465	L461-A463 PolarHBondContact O-N 3.08Å; A463-S465 PolarHBondContact O-N 3.19Å
464	L	34.6	Very low	41.8	Very low	89 Å²	89	85.2 Å²	85.2	47%	0.466	55%	0.545	S	S	.	.			trans	-76.9	60.4	-174.8	-73.9	158.8	0	0	0	111.6	P462 Q501	P462-L464 PolarHBondContact O-N 3.27Å; P462-L464 VanDerWaalsContact O-N 3.07Å; L464-Q501 HydrophobicContact CD1-CG 4.32Å
465	S	29.2	Very low	39.2	Very low	102 Å²	102	91.3 Å²	91.3	71%	0.713	58%	0.582	S	S	*	*			trans	-93.3	104.8	170.8	59.4	0	0	0	0	110	A463 S467	A463-S465 PolarHBondContact O-N 3.19Å; S465-S467 PolarHBondContact O-N 3.35Å; S465-S467 VanDerWaalsContact O-N 3.13Å
466	I	30.4	Very low	37.1	Very low	104 Å²	104	97.3 Å²	97.3	53%	0.533	61%	0.613	S	S	.	*			trans	-63.7	114.3	163.3	-60.1	170.8	0	0	0	106.6	S468 E497	I466-S468 PolarHBondContact O-N 3.44Å; I466-E497 HydrophobicContact CD1-CG 3.74Å
467	S	25.4	Very low	35.3	Very low	111 Å²	111	102 Å²	102	78%	0.776	65%	0.647	S	S	*	*			trans	-66.3	85.6	163	54.1	0	0	0	0	107.7	S465 S469	S465-S467 PolarHBondContact O-N 3.35Å; S465-S467 VanDerWaalsContact O-N 3.13Å; S467-S469 PolarHBondContact O-N 3.44Å
468	S	26.5	Very low	34	Very low	92 Å²	92	113.3 Å²	113.3	64%	0.643	69%	0.689	S	S	*	*			trans	-62	102.8	167.5	49.5	0	0	0	0	106.8	I466 S470	I466-S468 PolarHBondContact O-N 3.44Å; S468-S470 PolarHBondContact O-N 3.4Å; S468-S470 PolarHBondContact O-OG 3.48Å
469	S	25.4	Very low	32.7	Very low	114 Å²	114	112.5 Å²	112.5	80%	0.797	69%	0.691	S	S	*	*			trans	-70.5	63.8	170.8	44.6	0	0	0	0	109.5	S467 S471	S467-S469 PolarHBondContact O-N 3.44Å; S469-S471 PolarHBondContact O-N 3.16Å
470	S	27.9	Very low	32.5	Very low	99 Å²	99	112.9 Å²	112.9	69%	0.692	69%	0.691	S	S	*	*			trans	-64.3	79.6	163.9	44.7	0	0	0	0	107.5	S468 S472	S468-S470 PolarHBondContact O-N 3.4Å; S468-S470 PolarHBondContact O-OG 3.48Å; S470-S472 PolarHBondContact O-N 3.29Å
471	S	28.3	Very low	32.1	Very low	96 Å²	96	114.2 Å²	114.2	67%	0.671	69%	0.687	S	S	*	*			trans	-63	104.4	167.6	34.5	0	0	0	0	107.2	S469 L473	S469-S471 PolarHBondContact O-N 3.16Å; S471-L473 PolarHBondContact O-N 3.32Å
472	S	26.5	Very low	31.8	Very low	115 Å²	115	114.8 Å²	114.8	80%	0.804	69%	0.687	S	S	*	*			trans	-68.5	68.6	171.9	42.7	0	0	0	0	110	S470 T474	S470-S472 PolarHBondContact O-N 3.29Å; S472-T474 PolarHBondContact O-N 3.26Å; S472-T474 VanDerWaalsContact O-N 3.11Å
473	L	29.7	Very low	31.7	Very low	138 Å²	138	117.4 Å²	117.4	72%	0.723	69%	0.693	S	S	*	*			trans	-77.2	96.6	169.4	-84.5	160.9	0	0	0	108.3	S471	S471-L473 PolarHBondContact O-N 3.32Å
474	T	31.3	Very low	31.6	Very low	126 Å²	126	120.4 Å²	120.4	77%	0.773	69%	0.692	S	S	*	*			trans	-45.2	138.9	161.3	46.2	0	0	0	0	110.4	S472 D476	S472-T474 PolarHBondContact O-N 3.26Å; S472-T474 VanDerWaalsContact O-N 3.11Å; T474-D476 PolarHBondContact O-N 2.85Å
475	T	28.2	Very low	31.4	Very low	128 Å²	128	124.8 Å²	124.8	79%	0.785	70%	0.702	S	S	*	*			trans	-53.3	119.2	173.3	47.5	0	0	0	0	111.2
476	D	32.8	Very low	31.6	Very low	151 Å²	151	125.6 Å²	125.6	81%	0.807	69%	0.694	S	S	*	*			trans	-174.5	144.1	132.9	-97.2	-26.7	0	0	0	114.1	T474	T474-D476 PolarHBondContact O-N 2.85Å
477	S	36.4	Very low	31.8	Very low	111 Å²	111	124.4 Å²	124.4	78%	0.776	69%	0.686	S	S	*	*			trans	64	139.5	172.6	75.7	0	0	0	0	118.3
478	R	33.8	Very low	32.2	Very low	253 Å²	253	122.3 Å²	122.3	96%	0.955	67%	0.672	S	S	*	*			trans	-97.4	130.9	-174.1	-64.2	171.4	176	164.5	-2.4	110.9
479	S	32.4	Very low	32.8	Very low	58 Å²	58	123.1 Å²	123.1	41%	0.406	67%	0.668	S	S	.	*			trans	-131.2	146.2	163.7	71.3	0	0	0	0	111.2	E481 Q482	S479-E481 PolarHBondContact O-N 3.27Å; S479-E481 VanDerWaalsContact O-N 3.16Å; S479-Q482 PolarHBondContact O-N 3.19Å
480	P	41.5	Very low	33.3	Very low	110 Å²	110	122.3 Å²	122.3	71%	0.714	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.3	-13.2	-173.4	24.4	-33.1	0	0	0	114.8	Q482 Q483	P480-Q482 VanDerWaalsContact C-N 3.26Å; P480-Q482 PolarHBondContact O-N 3.43Å; P480-Q483 PolarHBondContact O-N 3.3Å
481	E	36.7	Very low	34.1	Very low	147 Å²	147	119.4 Å²	119.4	69%	0.687	63%	0.627	S	S	*	*	H	α-helix	trans	-67.6	-22.8	177.6	-62.8	-175.6	146.6	0	0	113.5	S479 Q483 Q484	S479-E481 PolarHBondContact O-N 3.27Å; S479-E481 VanDerWaalsContact O-N 3.16Å; E481-Q483 VanDerWaalsContact C-N 3.27Å; E481-Q483 PolarHBondContact O-N 3.34Å; E481-Q484 PolarHBondContact O-N 2.81Å
482	Q	36.3	Very low	34.9	Very low	98 Å²	98	119.8 Å²	119.8	46%	0.458	62%	0.621	S	S	.	*	H	α-helix	trans	-68.5	-23.5	179.3	-69	-174.6	-8.2	0	0	113.2	S479 P480 R485 Q486	S479-Q482 PolarHBondContact O-N 3.19Å; P480-Q482 VanDerWaalsContact C-N 3.26Å; P480-Q482 PolarHBondContact O-N 3.43Å; Q482-R485 PolarHBondContact O-N 3.17Å; Q482-Q486 WeakPolarHBondContact O-CG 3.3Å; Q482-Q486 PolarHBondContact O-N 3.29Å
483	Q	35.4	Very low	36.2	Very low	133 Å²	133	122.3 Å²	122.3	62%	0.621	62%	0.617	S	S	*	*	H	α-helix	trans	-70.4	-33.8	178.2	-74.9	-178.3	-19.5	0	0	112.9	P480 E481 Q486 Q487	P480-Q483 PolarHBondContact O-N 3.3Å; E481-Q483 VanDerWaalsContact C-N 3.27Å; E481-Q483 PolarHBondContact O-N 3.34Å; Q483-Q486 PolarHBondContact O-N 2.79Å; Q483-Q487 PolarHBondContact O-N 2.87Å
484	Q	35.2	Very low	37.3	Very low	154 Å²	154	117.9 Å²	117.9	72%	0.72	59%	0.593	S	S	*	*	H	α-helix	trans	-68.9	-36.6	172.4	-73.1	-177.1	-6.1	0	0	111.5	E481 Q487 S488	E481-Q484 PolarHBondContact O-N 2.81Å; Q484-Q487 PolarHBondContact O-N 3.19Å; Q484-S488 PolarHBondContact O-N 2.76Å
485	R	30.8	Very low	38.5	Very low	180 Å²	180	113.6 Å²	113.6	68%	0.679	57%	0.568	S	S	*	*	H	α-helix	trans	-65	-39.4	172.6	-68.2	-169.7	178.9	-160.5	0.8	112.1	Q482 Q487 S488 I489	Q482-R485 PolarHBondContact O-N 3.17Å; R485-Q487 VanDerWaalsContact C-N 3.34Å; R485-Q487 PolarHBondContact O-N 3.35Å; R485-S488 PolarHBondContact O-N 3.26Å; R485-S488 VanDerWaalsContact O-N 3.14Å; R485-S488 PolarHBondContact O-OG 3.43Å; R485-I489 WeakPolarHBondContact O-CG1 3.16Å; R485-I489 PolarHBondContact O-N 2.9Å
486	Q	33.8	Very low	40.3	Very low	119 Å²	119	110.5 Å²	110.5	56%	0.556	55%	0.546	S	S	*	.	H	α-helix	trans	-62.3	-37.1	176	-76.8	170.6	-15.7	0	0	113	Q482 Q483 S488 I489 E490	Q482-Q486 WeakPolarHBondContact O-CG 3.3Å; Q482-Q486 PolarHBondContact O-N 3.29Å; Q483-Q486 PolarHBondContact O-N 2.79Å; Q486-S488 VanDerWaalsContact C-N 3.31Å; Q486-S488 PolarHBondContact O-N 3.45Å; Q486-I489 PolarHBondContact O-N 3.04Å; Q486-I489 VanDerWaalsContact O-N 3.12Å; Q486-E490 PolarHBondContact O-N 2.86Å
487	Q	33.1	Very low	42.3	Very low	79 Å²	79	106 Å²	106	37%	0.369	52%	0.52	S	S	.	.	H	α-helix	trans	-62.9	-36	173.6	-70.6	176.5	9.6	0	0	112.6	Q483 Q484 R485 I489 E490 F491	Q483-Q487 PolarHBondContact O-N 2.87Å; Q484-Q487 PolarHBondContact O-N 3.19Å; R485-Q487 VanDerWaalsContact C-N 3.34Å; R485-Q487 PolarHBondContact O-N 3.35Å; Q487-I489 VanDerWaalsContact C-N 3.26Å; Q487-I489 PolarHBondContact O-N 2.88Å; Q487-E490 PolarHBondContact O-N 3.41Å; Q487-F491 WeakPolarHBondContact O-CD2 3.41Å
488	S	34.7	Very low	44	Very low	68 Å²	68	106.8 Å²	106.8	48%	0.476	52%	0.516	S	S	.	.	H	α-helix	trans	-66.2	-26.6	174.6	74.7	0	0	0	0	113.5	Q484 R485 Q486	Q484-S488 PolarHBondContact O-N 2.76Å; R485-S488 PolarHBondContact O-N 3.26Å; R485-S488 VanDerWaalsContact O-N 3.14Å; R485-S488 PolarHBondContact O-OG 3.43Å; Q486-S488 VanDerWaalsContact C-N 3.31Å; Q486-S488 PolarHBondContact O-N 3.45Å
489	I	38.9	Very low	45.9	Very low	109 Å²	109	97 Å²	97	56%	0.559	48%	0.481	S	S	*	.	H	α-helix	trans	-77.4	-31.2	-179.6	-64.8	167.2	0	0	0	111.5	R485 Q486 Q487 F491 N492	R485-I489 WeakPolarHBondContact O-CG1 3.16Å; R485-I489 PolarHBondContact O-N 2.9Å; Q486-I489 PolarHBondContact O-N 3.04Å; Q486-I489 VanDerWaalsContact O-N 3.12Å; Q487-I489 VanDerWaalsContact C-N 3.26Å; Q487-I489 PolarHBondContact O-N 2.88Å; I489-F491 VanDerWaalsContact C-N 3.31Å; I489-F491 PolarHBondContact O-N 3.01Å; I489-N492 PolarHBondContact O-N 3.2Å
490	E	36	Very low	48.2	Very low	97 Å²	97	94.3 Å²	94.3	45%	0.453	46%	0.462	S	S	.	.	H	α-helix	trans	-66.6	-31	175.3	-69.7	-158.4	133.9	0	0	113.1	Q486 Q487 N492 K493	Q486-E490 PolarHBondContact O-N 2.86Å; Q487-E490 PolarHBondContact O-N 3.41Å; E490-N492 PolarHBondContact O-N 3.18Å; E490-K493 WeakPolarHBondContact O-CB 3.49Å; E490-K493 PolarHBondContact O-N 2.91Å
491	F	43.9	Very low	50.1	Low	38 Å²	38	93.7 Å²	93.7	17%	0.167	45%	0.449	C	S	.	.	H	α-helix	trans	-64.9	-26.6	177.5	-81.3	-71	0	0	0	113.6	I372 I375 P434 Q487 I489 K493	I372-F491 HydrophobicContact CG1-CZ 4.3Å; I375-F491 HydrophobicContact CD1-CE1 3.8Å; I375-F491 HydrophobicContact CD1-CZ 4.09Å; P434-F491 HydrophobicContact CB-CE1 4.33Å; P434-F491 HydrophobicContact CG-CD1 3.56Å; P434-F491 HydrophobicContact CG-CE1 3.8Å; Q487-F491 WeakPolarHBondContact O-CD2 3.41Å; I489-F491 VanDerWaalsContact C-N 3.31Å; I489-F491 PolarHBondContact O-N 3.01Å; F491-K493 VanDerWaalsContact C-N 3.26Å; F491-K493 PolarHBondContact O-N 2.8Å
492	N	46.3	Very low	52.2	Low	103 Å²	103	92 Å²	92	55%	0.551	44%	0.444	S	S	*	.	G	3₁₀ helix	trans	-72.6	-14.7	177.1	-72.1	-17.5	0	0	0	113.5	I489 E490 F494	I489-N492 PolarHBondContact O-N 3.2Å; E490-N492 PolarHBondContact O-N 3.18Å; N492-F494 VanDerWaalsContact C-N 3.27Å; N492-F494 PolarHBondContact O-N 3.07Å
493	K	52.4	Low	54.5	Low	168 Å²	168	87.7 Å²	87.7	73%	0.73	43%	0.425	S	S	*	.	G	3₁₀ helix	trans	-71.5	-12.4	179	-81	-175.8	172.6	176.8	0	115	E490 F491	E490-K493 WeakPolarHBondContact O-CB 3.49Å; E490-K493 PolarHBondContact O-N 2.91Å; F491-K493 VanDerWaalsContact C-N 3.26Å; F491-K493 PolarHBondContact O-N 2.8Å
494	F	53.8	Low	57	Low	46 Å²	46	81.8 Å²	81.8	20%	0.202	40%	0.397	C	S	.	.	G	3₁₀ helix	trans	-86.7	-2.2	-176.9	-69	-79.4	0	0	0	114.7	Q376 Y379 F432 N492	Q376-F494 HydrophobicContact CG-CZ 4.33Å; Y379-F494 HydrophobicContact CD1-CE1 4.36Å; Y379-F494 HydrophobicContact CD2-CD1 4.03Å; Y379-F494 HydrophobicContact CD2-CE1 4.26Å; Y379-F494 AromaticContact CE2-CD1 3.95Å; Y379-F494 HydrophobicContact CE2-CD1 3.95Å; Y379-F494 HydrophobicContact CE2-CE1 4.45Å; Y379-F494 HydrophobicContact CG-CD1 4.44Å; Y379-F494 HydrophobicContact CG-CE1 4.21Å; F432-F494 HydrophobicContact CD1-CB 4.36Å; N492-F494 VanDerWaalsContact C-N 3.27Å; N492-F494 PolarHBondContact O-N 3.07Å
495	S	56.2	Low	59.3	Low	36 Å²	36	77.1 Å²	77.1	25%	0.252	38%	0.381	S	S	.	.			trans	-103.5	97.7	178.2	-68.7	0	0	0	0	111.5	E497	S495-E497 PolarHBondContact O-N 2.84Å
496	N	66.4	Low	61.8	Low	62 Å²	62	72.3 Å²	72.3	33%	0.332	37%	0.365	S	S	.	.			trans	-69	91.2	168.7	-78.8	-20.2	0	0	0	109.6	D426 N498 H499 I500	D426-N496 PolarHBondContact O-ND2 3.46Å; N496-N498 PolarHBondContact O-N 3.1Å; N496-H499 HydrophobicContact CB-CB 3.93Å; N496-H499 WeakPolarHBondContact O-CA 3.04Å; N496-H499 WeakPolarHBondContact O-CB 3.34Å; N496-H499 PolarHBondContact O-N 2.91Å; N496-I500 PolarHBondContact O-N 2.9Å
497	E	73.4	Confident	64.3	Low	56 Å²	56	66.6 Å²	66.6	26%	0.262	34%	0.339	S	S	.	.	H	α-helix	trans	-53.9	-36.6	178.8	-81.1	-71.7	164.7	0	0	112.6	R452 I466 S495 H499 I500 Q501	R452-E497 IonicContact CZ-OE1 3.89Å; R452-E497 IonicContact CZ-OE2 3.87Å; R452-E497 IonicContact NH1-OE1 2.58Å; R452-E497 PolarHBondContact NH1-OE1 3.47Å; R452-E497 IonicContact NH1-OE2 2.68Å; R452-E497 PolarHBondContact NH1-OE2 3.35Å; R452-E497 VanDerWaalsContact NH1-OE2 3.09Å; R452-E497 IonicContact NH2-OE1 2.61Å; R452-E497 IonicContact NH2-OE2 3.58Å; R452-E497 PolarHBondContact NH2-OE2 2.9Å; I466-E497 HydrophobicContact CD1-CG 3.74Å; S495-E497 PolarHBondContact O-N 2.84Å; E497-H499 VanDerWaalsContact C-N 3.29Å; E497-H499 PolarHBondContact O-N 3.45Å; E497-I500 WeakPolarHBondContact O-CB 3.43Å; E497-I500 PolarHBondContact O-N 3.14Å; E497-I500 VanDerWaalsContact O-N 3.16Å; E497-Q501 WeakPolarHBondContact O-CB 3.19Å; E497-Q501 PolarHBondContact O-N 3.1Å
498	N	72.3	Confident	66.8	Low	128 Å²	128	65.4 Å²	65.4	68%	0.684	33%	0.333	S	S	*	.	H	α-helix	trans	-58.2	-38.7	173.2	-65.7	-7.2	0	0	0	112.6	N496 L502	N496-N498 PolarHBondContact O-N 3.1Å; N498-L502 WeakPolarHBondContact O-CB 3.47Å; N498-L502 PolarHBondContact O-N 3.19Å
499	H	74.2	Confident	69.2	Low	48 Å²	48	68.1 Å²	68.1	22%	0.222	34%	0.338	C	S	.	.	H	α-helix	trans	-75.4	-37.2	176.7	-171	-171.9	0	0	0	111.3	M429 N496 E497 Q501 L502 M503	M429-H499 PolarHBondContact O-CE1 2.97Å; M429-H499 VanDerWaalsContact O-CE1 3.31Å; M429-H499 PolarHBondContact O-ND1 3.02Å; N496-H499 HydrophobicContact CB-CB 3.93Å; N496-H499 WeakPolarHBondContact O-CA 3.04Å; N496-H499 WeakPolarHBondContact O-CB 3.34Å; N496-H499 PolarHBondContact O-N 2.91Å; E497-H499 VanDerWaalsContact C-N 3.29Å; E497-H499 PolarHBondContact O-N 3.45Å; H499-Q501 VanDerWaalsContact C-N 3.28Å; H499-Q501 PolarHBondContact O-N 3.19Å; H499-L502 PolarHBondContact O-N 3.21Å; H499-M503 VanDerWaalsContact O-CB 3.29Å; H499-M503 WeakPolarHBondContact O-CB 3.41Å; H499-M503 PolarHBondContact O-N 2.81Å
500	I	81.9	Confident	71.2	Confident	2 Å²	2	64.5 Å²	64.5	1%	0.01	32%	0.319	C	S	.	.	H	α-helix	trans	-58	-44.1	171.3	-68.2	171.1	0	0	0	110.3	P431 F449 N496 E497 M503 F504	P431-I500 HydrophobicContact CB-CD1 4.46Å; P431-I500 HydrophobicContact CB-CG1 4.14Å; P431-I500 HydrophobicContact CG-CD1 4.5Å; P431-I500 HydrophobicContact CG-CG1 3.67Å; F449-I500 HydrophobicContact CD2-CD1 4.39Å; F449-I500 HydrophobicContact CD2-CG2 4.33Å; F449-I500 HydrophobicContact CE2-CG1 4.34Å; F449-I500 HydrophobicContact CE2-CG2 3.99Å; N496-I500 PolarHBondContact O-N 2.9Å; E497-I500 WeakPolarHBondContact O-CB 3.43Å; E497-I500 PolarHBondContact O-N 3.14Å; E497-I500 VanDerWaalsContact O-N 3.16Å; I500-M503 PolarHBondContact O-N 3.05Å; I500-F504 HydrophobicContact CG2-CD1 4.46Å; I500-F504 HydrophobicContact CG2-CD2 3.97Å; I500-F504 HydrophobicContact CG2-CE1 4.12Å; I500-F504 HydrophobicContact CG2-CE2 3.56Å; I500-F504 HydrophobicContact CG2-CG 4.41Å; I500-F504 HydrophobicContact CG2-CZ 3.66Å; I500-F504 WeakPolarHBondContact O-CB 3.41Å; I500-F504 WeakPolarHBondContact O-CD1 3.18Å; I500-F504 VanDerWaalsContact O-CG 3.22Å; I500-F504 WeakPolarHBondContact O-CG 3.24Å; I500-F504 PolarHBondContact O-N 3.13Å
501	Q	80.6	Confident	73.5	Confident	96 Å²	96	60 Å²	60	45%	0.449	30%	0.298	S	S	.	.	H	α-helix	trans	-69.9	-39.6	-179	-162.9	162.7	11	0	0	112.6	L464 E497 H499 F504 S505	L464-Q501 HydrophobicContact CD1-CG 4.32Å; E497-Q501 WeakPolarHBondContact O-CB 3.19Å; E497-Q501 PolarHBondContact O-N 3.1Å; H499-Q501 VanDerWaalsContact C-N 3.28Å; H499-Q501 PolarHBondContact O-N 3.19Å; Q501-F504 PolarHBondContact O-N 3.36Å; Q501-S505 PolarHBondContact O-N 3.2Å
502	L	80.2	Confident	75.4	Confident	111 Å²	111	65 Å²	65	58%	0.581	32%	0.32	S	S	*	.	H	α-helix	trans	-65.1	-38.4	171.9	-178	66.3	0	0	0	112.5	N498 H499 S505 K506	N498-L502 WeakPolarHBondContact O-CB 3.47Å; N498-L502 PolarHBondContact O-N 3.19Å; H499-L502 PolarHBondContact O-N 3.21Å; L502-S505 PolarHBondContact O-OG 2.82Å; L502-K506 PolarHBondContact O-N 3.03Å
503	M	84.6	Confident	77.2	Confident	9 Å²	9	62.3 Å²	62.3	4%	0.044	31%	0.305	C	S	.	.	H	α-helix	trans	-63.6	-45.9	173.1	171.4	173	62.3	0	0	110.5	P354 I356 P431 F449 H499 I500 K506 I507	P354-M503 HydrophobicContact CB-CG 3.8Å; P354-M503 HydrophobicContact CB-SD 3.86Å; P354-M503 HydrophobicContact CG-CG 4.38Å; I356-M503 HydrophobicContact CG1-CE 4.14Å; I356-M503 HydrophobicContact CG1-SD 4.16Å; P431-M503 HydrophobicContact CG-CE 3.89Å; F449-M503 HydrophobicContact CE2-CE 3.64Å; F449-M503 HydrophobicContact CZ-CE 3.5Å; H499-M503 VanDerWaalsContact O-CB 3.29Å; H499-M503 WeakPolarHBondContact O-CB 3.41Å; H499-M503 PolarHBondContact O-N 2.81Å; I500-M503 PolarHBondContact O-N 3.05Å; M503-K506 PolarHBondContact O-N 3.07Å; M503-I507 HydrophobicContact CG-CD1 3.56Å; M503-I507 HydrophobicContact CG-CG1 4.49Å; M503-I507 VanDerWaalsContact O-CD1 3.28Å; M503-I507 WeakPolarHBondContact O-CD1 3.43Å; M503-I507 VanDerWaalsContact O-CG1 3.24Å; M503-I507 WeakPolarHBondContact O-CG1 3.5Å; M503-I507 PolarHBondContact O-N 3.07Å; M503-I507 HydrophobicContact SD-CD1 4.46Å
504	F	87.4	Confident	78.7	Confident	8 Å²	8	55.8 Å²	55.8	4%	0.035	28%	0.277	C	S	.	.	H	α-helix	trans	-64.1	-38.4	178.3	-72.2	-5.5	0	0	0	112.9	F449 R452 L453 L456 I500 Q501 I507 H508	F449-F504 HydrophobicContact CD2-CZ 4.08Å; F449-F504 AromaticContact CE2-CE1 3.62Å; F449-F504 HydrophobicContact CE2-CE1 3.62Å; F449-F504 AromaticContact CE2-CZ 3.61Å; F449-F504 HydrophobicContact CE2-CZ 3.61Å; F449-F504 AromaticContact CZ-CE1 3.69Å; F449-F504 HydrophobicContact CZ-CE1 3.69Å; F449-F504 HydrophobicContact CZ-CZ 4.05Å; R452-F504 HydrophobicContact CB-CE2 3.94Å; R452-F504 HydrophobicContact CB-CZ 4.11Å; L453-F504 HydrophobicContact CB-CE1 4.05Å; L453-F504 HydrophobicContact CB-CZ 4.22Å; L453-F504 HydrophobicContact CD1-CD1 4.13Å; L453-F504 HydrophobicContact CD1-CE1 3.8Å; L456-F504 HydrophobicContact CD1-CB 3.85Å; L456-F504 HydrophobicContact CD1-CD1 3.77Å; L456-F504 HydrophobicContact CD1-CE1 4.43Å; L456-F504 HydrophobicContact CD1-CG 3.81Å; L456-F504 HydrophobicContact CD2-CB 4.01Å; L456-F504 HydrophobicContact CD2-CD2 4.26Å; L456-F504 HydrophobicContact CD2-CG 4.17Å; I500-F504 HydrophobicContact CG2-CD1 4.46Å; I500-F504 HydrophobicContact CG2-CD2 3.97Å; I500-F504 HydrophobicContact CG2-CE1 4.12Å; I500-F504 HydrophobicContact CG2-CE2 3.56Å; I500-F504 HydrophobicContact CG2-CG 4.41Å; I500-F504 HydrophobicContact CG2-CZ 3.66Å; I500-F504 WeakPolarHBondContact O-CB 3.41Å; I500-F504 WeakPolarHBondContact O-CD1 3.18Å; I500-F504 VanDerWaalsContact O-CG 3.22Å; I500-F504 WeakPolarHBondContact O-CG 3.24Å; I500-F504 PolarHBondContact O-N 3.13Å; Q501-F504 PolarHBondContact O-N 3.36Å; F504-I507 HydrophobicContact CD1-CD1 4.34Å; F504-I507 PolarHBondContact O-N 3.41Å; F504-H508 WeakPolarHBondContact O-CB 3.38Å; F504-H508 PolarHBondContact O-N 3.3Å
505	S	84.6	Confident	80.1	Confident	56 Å²	56	57 Å²	57	39%	0.392	28%	0.283	S	S	.	.	H	α-helix	trans	-63.5	-46.2	175.4	66.8	0	0	0	0	111.5	Q501 L502 I507 H508 E509	Q501-S505 PolarHBondContact O-N 3.2Å; L502-S505 PolarHBondContact O-OG 2.82Å; S505-I507 VanDerWaalsContact C-N 3.34Å; S505-I507 PolarHBondContact O-N 2.82Å; S505-H508 PolarHBondContact O-N 2.88Å; S505-E509 WeakPolarHBondContact O-CG 3.48Å; S505-E509 PolarHBondContact O-N 2.88Å
506	K	83.7	Confident	81.4	Confident	79 Å²	79	59.5 Å²	59.5	34%	0.343	30%	0.296	S	S	.	.	H	α-helix	trans	-59.6	-42.4	175.9	-174.7	-177.4	172.8	-168.1	0	112.3	N352 P354 L502 M503 E509 Q510	N352-K506 PolarHBondContact O-NZ 3.45Å; P354-K506 HydrophobicContact CG-CD 4.41Å; L502-K506 PolarHBondContact O-N 3.03Å; M503-K506 PolarHBondContact O-N 3.07Å; K506-E509 PolarHBondContact O-N 3.23Å; K506-Q510 WeakPolarHBondContact O-CG 3.49Å; K506-Q510 PolarHBondContact O-N 2.7Å; K506-Q510 VanDerWaalsContact O-N 3.14Å
507	I	86	Confident	82.2	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-63.8	-43.7	176.7	-70	157.9	0	0	0	111	I325 I326 P354 L453 L456 M503 F504 S505 E509 Q510 M511	I325-I507 HydrophobicContact CG2-CG1 4.2Å; I325-I507 HydrophobicContact CG2-CG2 4.01Å; I326-I507 HydrophobicContact CD1-CD1 3.4Å; I326-I507 HydrophobicContact CD1-CG1 4.3Å; I326-I507 HydrophobicContact CG1-CD1 3.79Å; I326-I507 HydrophobicContact CG1-CG1 4.26Å; P354-I507 HydrophobicContact CG-CG1 4.21Å; L453-I507 HydrophobicContact CD1-CD1 3.93Å; L456-I507 HydrophobicContact CD1-CB 4.21Å; L456-I507 HydrophobicContact CD1-CG2 3.87Å; M503-I507 HydrophobicContact CG-CD1 3.56Å; M503-I507 HydrophobicContact CG-CG1 4.49Å; M503-I507 VanDerWaalsContact O-CD1 3.28Å; M503-I507 WeakPolarHBondContact O-CD1 3.43Å; M503-I507 VanDerWaalsContact O-CG1 3.24Å; M503-I507 WeakPolarHBondContact O-CG1 3.5Å; M503-I507 PolarHBondContact O-N 3.07Å; M503-I507 HydrophobicContact SD-CD1 4.46Å; F504-I507 HydrophobicContact CD1-CD1 4.34Å; F504-I507 PolarHBondContact O-N 3.41Å; S505-I507 VanDerWaalsContact C-N 3.34Å; S505-I507 PolarHBondContact O-N 2.82Å; I507-E509 PolarHBondContact O-N 2.83Å; I507-Q510 PolarHBondContact O-N 3Å; I507-M511 HydrophobicContact CG2-CE 3.73Å; I507-M511 HydrophobicContact CG2-CG 4.49Å; I507-M511 HydrophobicContact CG2-SD 4.1Å; I507-M511 WeakPolarHBondContact O-CG 3.42Å; I507-M511 PolarHBondContact O-N 2.78Å
508	H	85.6	Confident	82.6	Confident	53 Å²	53	58.7 Å²	58.7	25%	0.245	29%	0.286	C	S	.	.	H	α-helix	trans	-65.5	-36.8	179.6	-174.7	80.2	0	0	0	112.1	L456 F504 S505 M511 K512	L456-H508 PolarHBondContact O-ND1 3.36Å; F504-H508 WeakPolarHBondContact O-CB 3.38Å; F504-H508 PolarHBondContact O-N 3.3Å; S505-H508 PolarHBondContact O-N 2.88Å; H508-M511 PolarHBondContact O-N 3.17Å; H508-K512 WeakPolarHBondContact O-CB 3.49Å; H508-K512 PolarHBondContact O-N 3.37Å
509	E	84.2	Confident	82.7	Confident	125 Å²	125	58.6 Å²	58.6	58%	0.584	29%	0.286	S	S	*	.	H	α-helix	trans	-61.2	-46.3	171	-73.6	177.7	165.2	0	0	112	S505 K506 I507 M511 K512 I513	S505-E509 WeakPolarHBondContact O-CG 3.48Å; S505-E509 PolarHBondContact O-N 2.88Å; K506-E509 PolarHBondContact O-N 3.23Å; I507-E509 PolarHBondContact O-N 2.83Å; E509-M511 PolarHBondContact O-N 2.84Å; E509-K512 WeakPolarHBondContact O-CB 3.35Å; E509-K512 PolarHBondContact O-N 2.66Å; E509-K512 VanDerWaalsContact O-N 3.15Å; E509-I513 WeakPolarHBondContact O-CG1 3.01Å; E509-I513 PolarHBondContact O-N 2.82Å
510	Q	82.2	Confident	82.9	Confident	33 Å²	33	58.5 Å²	58.5	15%	0.154	29%	0.285	C	S	.	.	H	α-helix	trans	-62.4	-41.3	176	-70	-170.9	-43.6	0	0	112.4	K506 I507 K512 I513 I514 E738	K506-Q510 WeakPolarHBondContact O-CG 3.49Å; K506-Q510 PolarHBondContact O-N 2.7Å; K506-Q510 VanDerWaalsContact O-N 3.14Å; I507-Q510 PolarHBondContact O-N 3Å; Q510-K512 VanDerWaalsContact C-N 3.33Å; Q510-K512 PolarHBondContact O-N 3.18Å; Q510-I513 PolarHBondContact O-N 2.9Å; Q510-I514 WeakPolarHBondContact O-CG1 3.42Å; Q510-I514 PolarHBondContact O-N 2.86Å; Q510-E738 PolarHBondContact NE2-OE1 3.31Å
511	M	83.9	Confident	82.5	Confident	2 Å²	2	65.7 Å²	65.7	1%	0.01	32%	0.323	C	S	.	.	H	α-helix	trans	-61	-40.9	172.6	-71.5	170.9	169.4	0	0	112.1	P209 L211 L456 N457 I507 H508 E509 I514 K515	P209-M511 HydrophobicContact CG-CB 4.48Å; L211-M511 HydrophobicContact CB-CE 4.16Å; L211-M511 HydrophobicContact CD1-CE 3.49Å; L211-M511 VanDerWaalsContact CD1-CE 3.49Å; L211-M511 HydrophobicContact CD2-CE 3.63Å; L211-M511 HydrophobicContact CG-CE 3.92Å; L456-M511 HydrophobicContact CB-CE 4.24Å; L456-M511 HydrophobicContact CB-SD 3.98Å; N457-M511 PolarHBondContact OD1-SD 2.83Å; N457-M511 VanDerWaalsContact OD1-SD 3.38Å; I507-M511 HydrophobicContact CG2-CE 3.73Å; I507-M511 HydrophobicContact CG2-CG 4.49Å; I507-M511 HydrophobicContact CG2-SD 4.1Å; I507-M511 WeakPolarHBondContact O-CG 3.42Å; I507-M511 PolarHBondContact O-N 2.78Å; H508-M511 PolarHBondContact O-N 3.17Å; E509-M511 PolarHBondContact O-N 2.84Å; M511-I514 PolarHBondContact O-N 3.48Å; M511-K515 WeakPolarHBondContact O-CG 3.5Å; M511-K515 PolarHBondContact O-N 2.94Å
512	K	84.1	Confident	82.6	Confident	145 Å²	145	61.5 Å²	61.5	63%	0.63	31%	0.306	S	S	*	.	H	α-helix	trans	-63.5	-41.2	177.3	-172.7	179.6	-179.8	-178.1	0	111.4	H508 E509 Q510 K515 T516	H508-K512 WeakPolarHBondContact O-CB 3.49Å; H508-K512 PolarHBondContact O-N 3.37Å; E509-K512 WeakPolarHBondContact O-CB 3.35Å; E509-K512 PolarHBondContact O-N 2.66Å; E509-K512 VanDerWaalsContact O-N 3.15Å; Q510-K512 VanDerWaalsContact C-N 3.33Å; Q510-K512 PolarHBondContact O-N 3.18Å; K512-K515 PolarHBondContact O-N 2.91Å; K512-T516 PolarHBondContact O-N 3.27Å
513	I	83.9	Confident	83	Confident	46 Å²	46	56.5 Å²	56.5	24%	0.236	28%	0.28	C	S	.	.	H	α-helix	trans	-60.2	-50.8	173.4	-67.4	165	0	0	0	110.2	E509 Q510 K515 T516 Y517	E509-I513 WeakPolarHBondContact O-CG1 3.01Å; E509-I513 PolarHBondContact O-N 2.82Å; Q510-I513 PolarHBondContact O-N 2.9Å; I513-K515 VanDerWaalsContact C-N 3.27Å; I513-K515 PolarHBondContact O-N 3.49Å; I513-T516 WeakPolarHBondContact O-CB 3.29Å; I513-T516 PolarHBondContact O-N 3.43Å; I513-T516 PolarHBondContact O-OG1 3Å; I513-Y517 HydrophobicContact CG2-CE1 3.78Å; I513-Y517 HydrophobicContact CG2-CE2 4.49Å; I513-Y517 VanDerWaalsContact CG2-OH 3.24Å; I513-Y517 WeakPolarHBondContact CG2-OH 3.44Å
514	I	83.8	Confident	83.3	Confident	31 Å²	31	56.3 Å²	56.3	16%	0.159	28%	0.279	C	S	.	.	H	α-helix	trans	-58.8	-38.5	178.6	-64.1	163.4	0	0	0	111.5	P209 Q510 M511 T516 Y517	P209-I514 HydrophobicContact CB-CB 4.45Å; P209-I514 HydrophobicContact CB-CG2 3.7Å; P209-I514 HydrophobicContact CG-CG2 4.35Å; Q510-I514 WeakPolarHBondContact O-CG1 3.42Å; Q510-I514 PolarHBondContact O-N 2.86Å; M511-I514 PolarHBondContact O-N 3.48Å; I514-T516 VanDerWaalsContact C-N 3.25Å; I514-T516 PolarHBondContact O-N 2.99Å; I514-Y517 WeakPolarHBondContact O-CB 3.33Å; I514-Y517 PolarHBondContact O-N 2.68Å
515	K	83.3	Confident	83.6	Confident	72 Å²	72	55.9 Å²	55.9	31%	0.313	28%	0.277	S	S	.	.	H	α-helix	trans	-60.8	-30.2	174.9	-75.4	177.2	179.4	-177.7	0	112.9	P209 N457 M511 K512 I513 Y517 R518	P209-K515 HydrophobicContact CG-CG 4.38Å; N457-K515 PolarHBondContact O-NZ 3.38Å; M511-K515 WeakPolarHBondContact O-CG 3.5Å; M511-K515 PolarHBondContact O-N 2.94Å; K512-K515 PolarHBondContact O-N 2.91Å; I513-K515 VanDerWaalsContact C-N 3.27Å; I513-K515 PolarHBondContact O-N 3.49Å; K515-Y517 VanDerWaalsContact C-N 3.27Å; K515-Y517 PolarHBondContact O-N 3.37Å; K515-R518 WeakPolarHBondContact O-CB 3.19Å; K515-R518 PolarHBondContact O-N 2.88Å
516	T	83.3	Confident	84.1	Confident	87 Å²	87	53.3 Å²	53.3	53%	0.534	26%	0.259	S	S	.	.	H	α-helix	trans	-68.5	-24.4	174.6	70.4	0	0	0	0	113.4	K512 I513 I514 R518 D519	K512-T516 PolarHBondContact O-N 3.27Å; I513-T516 WeakPolarHBondContact O-CB 3.29Å; I513-T516 PolarHBondContact O-N 3.43Å; I513-T516 PolarHBondContact O-OG1 3Å; I514-T516 VanDerWaalsContact C-N 3.25Å; I514-T516 PolarHBondContact O-N 2.99Å; T516-R518 PolarHBondContact O-N 3.48Å; T516-D519 PolarHBondContact O-N 3.48Å
517	Y	83.7	Confident	84.6	Confident	29 Å²	29	49.6 Å²	49.6	11%	0.114	24%	0.243	C	C	.	.	G	3₁₀ helix	trans	-72.3	-16	179.6	-56.2	-13.2	0	0	0	112.7	I513 I514 K515 D519 F520 L548 G549 W741 N742 L745	I513-Y517 HydrophobicContact CG2-CE1 3.78Å; I513-Y517 HydrophobicContact CG2-CE2 4.49Å; I513-Y517 VanDerWaalsContact CG2-OH 3.24Å; I513-Y517 WeakPolarHBondContact CG2-OH 3.44Å; I514-Y517 WeakPolarHBondContact O-CB 3.33Å; I514-Y517 PolarHBondContact O-N 2.68Å; K515-Y517 VanDerWaalsContact C-N 3.27Å; K515-Y517 PolarHBondContact O-N 3.37Å; Y517-D519 VanDerWaalsContact C-N 3.3Å; Y517-D519 PolarHBondContact O-N 2.69Å; Y517-F520 WeakPolarHBondContact O-CB 3.26Å; Y517-F520 PolarHBondContact O-N 2.85Å; Y517-L548 HydrophobicContact CD2-CD2 4.33Å; Y517-L548 HydrophobicContact CG-CD2 4.07Å; Y517-G549 WeakPolarHBondContact O-CA 3.26Å; Y517-G549 PolarHBondContact O-N 3.02Å; Y517-W741 AromaticContact CZ-NE1 3.92Å; Y517-N742 PolarHBondContact OH-OD1 3.26Å; Y517-N742 VanDerWaalsContact OH-OD1 3.09Å; Y517-L745 HydrophobicContact CD1-CD1 3.73Å; Y517-L745 HydrophobicContact CE1-CD1 3.26Å
518	R	80.6	Confident	84.7	Confident	73 Å²	73	50.3 Å²	50.3	28%	0.275	25%	0.247	S	C	.	.	G	3₁₀ helix	trans	-56.7	-42.7	175.1	-178.1	-173.7	-178.5	148.3	0.9	112.3	D206 K515 T516 F520 G549 Y586	D206-R518 PolarHBondContact O-NH1 3.15Å; K515-R518 WeakPolarHBondContact O-CB 3.19Å; K515-R518 PolarHBondContact O-N 2.88Å; T516-R518 PolarHBondContact O-N 3.48Å; R518-F520 VanDerWaalsContact C-N 3.26Å; R518-F520 PolarHBondContact O-N 3.07Å; R518-G549 CarbonylContact O-C 3.51Å; R518-G549 WeakPolarHBondContact O-CA 3.32Å; R518-Y586 HydrophobicContact CG-CD1 3.6Å; R518-Y586 HydrophobicContact CG-CE1 4.25Å; R518-Y586 HydrophobicContact CG-CG 4.24Å; R518-Y586 PolarHBondContact NH2-OH 3.17Å
519	D	75.1	Confident	84.9	Confident	126 Å²	126	50.7 Å²	50.7	67%	0.674	25%	0.249	S	C	*	.	G	3₁₀ helix	trans	-91.6	12.7	-171.2	-53.4	-31.3	0	0	0	112.1	T516 Y517	T516-D519 PolarHBondContact O-N 3.48Å; Y517-D519 VanDerWaalsContact C-N 3.3Å; Y517-D519 PolarHBondContact O-N 2.69Å
520	F	79.1	Confident	85.2	Confident	45 Å²	45	46.4 Å²	46.4	20%	0.197	23%	0.231	C	C	.	.			trans	-70.8	133.2	176.5	-171.4	-96.8	0	0	0	110.8	Y517 R518 G522 L548 M706 L745 I751	Y517-F520 WeakPolarHBondContact O-CB 3.26Å; Y517-F520 PolarHBondContact O-N 2.85Å; R518-F520 VanDerWaalsContact C-N 3.26Å; R518-F520 PolarHBondContact O-N 3.07Å; F520-G522 WeakPolarHBondContact CD1-O 3.3Å; F520-G522 PolarHBondContact O-N 3.42Å; F520-L548 HydrophobicContact CB-CB 4.47Å; F520-L548 HydrophobicContact CD1-CB 4Å; F520-L548 HydrophobicContact CD1-CD1 4.4Å; F520-L548 HydrophobicContact CE1-CD1 4.33Å; F520-L548 HydrophobicContact CG-CB 4.39Å; F520-M706 HydrophobicContact CE1-CE 4.33Å; F520-M706 HydrophobicContact CE1-SD 4.06Å; F520-L745 HydrophobicContact CD2-CD2 4.04Å; F520-L745 HydrophobicContact CE2-CD2 3.9Å; F520-I751 HydrophobicContact CE1-CD1 4.35Å; F520-I751 HydrophobicContact CE2-CD1 4.19Å; F520-I751 HydrophobicContact CZ-CD1 3.79Å; F520-I751 HydrophobicContact CZ-CG1 4.18Å
521	N	73.4	Confident	85.6	Confident	153 Å²	153	50 Å²	50	82%	0.818	24%	0.244	S	C	*	.	S	Bend	trans	-76.7	62.4	179.5	-79.2	-18.5	0	0	0	112.2
522	G	81.4	Confident	85.7	Confident	8 Å²	8	54.4 Å²	54.4	8%	0.082	27%	0.271	C	S	.	.	S	Bend	trans	168.1	152.2	176.6	0	0	0	0	0	111	F520 L548 G549 T703	F520-G522 WeakPolarHBondContact CD1-O 3.3Å; F520-G522 PolarHBondContact O-N 3.42Å; G522-L548 CarbonylContact O-C 3.54Å; G522-G549 VanDerWaalsContact O-CA 3.3Å; G522-G549 WeakPolarHBondContact O-CA 3.29Å; G522-G549 PolarHBondContact O-N 3.08Å; G522-T703 VanDerWaalsContact CA-OG1 3.23Å; G522-T703 WeakPolarHBondContact CA-OG1 3.44Å
523	T	89.2	Confident	85.5	Confident	6 Å²	6	55 Å²	55	4%	0.037	28%	0.276	C	S	.	.			trans	-109.4	128.2	179	-41.7	0	0	0	0	110.7	V546 L548 Q550 L551 Q555 L702 T703	T523-V546 HydrophobicContact CG2-CG1 4.45Å; T523-L548 WeakPolarHBondContact CA-O 3.22Å; T523-Q550 WeakPolarHBondContact CG2-O 3.36Å; T523-Q550 PolarHBondContact OG1-O 2.88Å; T523-L551 HydrophobicContact CG2-CD2 3.72Å; T523-L551 HydrophobicContact CG2-CG 4.12Å; T523-Q555 PolarHBondContact OG1-NE2 3.12Å; T523-L702 WeakPolarHBondContact O-CA 3.38Å; T523-T703 PolarHBondContact N-OG1 3.17Å; T523-T703 PolarHBondContact O-N 3Å; T523-T703 WeakPolarHBondContact OG1-CG2 3.44Å
524	L	91.2	Very high	85.4	Confident	5 Å²	5	55.7 Å²	55.7	3%	0.026	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	119.5	170.3	178.4	67	0	0	0	108.9	Q547 L548 I700 L702 M706	L524-Q547 HydrophobicContact CB-CB 4.31Å; L524-Q547 HydrophobicContact CD2-CB 3.9Å; L524-Q547 HydrophobicContact CG-CB 4.03Å; L524-Q547 PolarHBondContact O-N 2.92Å; L524-L548 HydrophobicContact CB-CB 3.9Å; L524-L548 HydrophobicContact CB-CD1 4.02Å; L524-L548 HydrophobicContact CB-CG 4.12Å; L524-L548 HydrophobicContact CD2-CD1 3.8Å; L524-L548 HydrophobicContact CD2-CG 4.17Å; L524-L548 PolarHBondContact N-O 3.32Å; L524-L548 VanDerWaalsContact N-O 3.07Å; L524-L548 PolarHBondContact O-N 3.44Å; L524-I700 HydrophobicContact CD1-CG2 3.4Å; L524-L702 HydrophobicContact CD1-CD2 3.45Å; L524-L702 VanDerWaalsContact CD1-CD2 3.45Å; L524-M706 HydrophobicContact CB-CE 4.09Å; L524-M706 HydrophobicContact CB-SD 4.44Å
525	F	93.8	Very high	85	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	124.8	177.6	172.5	-91	0	0	0	111.4	I527 I542 R545 V546 L551 A591 M593 I700 L701	F525-I527 HydrophobicContact CD1-CG1 4.25Å; F525-I527 HydrophobicContact CE1-CG1 4.15Å; F525-I542 HydrophobicContact CE1-CG2 4.15Å; F525-R545 VanDerWaalsContact CD2-C 3.44Å; F525-R545 WeakPolarHBondContact CD2-O 3.45Å; F525-V546 HydrophobicContact CD2-CB 4.47Å; F525-V546 HydrophobicContact CD2-CG2 3.87Å; F525-V546 HydrophobicContact CE2-CG2 4.45Å; F525-L551 HydrophobicContact CB-CD2 4.41Å; F525-L551 HydrophobicContact CD2-CD1 3.81Å; F525-L551 HydrophobicContact CE2-CD1 4.13Å; F525-L551 HydrophobicContact CG-CD1 4.39Å; F525-A591 HydrophobicContact CE2-CB 3.78Å; F525-A591 HydrophobicContact CZ-CB 4.38Å; F525-M593 HydrophobicContact CD1-CE 3.92Å; F525-M593 HydrophobicContact CD2-CE 4.17Å; F525-M593 HydrophobicContact CE1-CE 3.65Å; F525-M593 HydrophobicContact CE1-SD 4.26Å; F525-M593 HydrophobicContact CE2-CE 3.93Å; F525-M593 HydrophobicContact CG-CE 4.14Å; F525-M593 HydrophobicContact CZ-CE 3.63Å; F525-I700 CarbonylContact O-C 3.59Å; F525-I700 VanDerWaalsContact O-CA 3.29Å; F525-I700 WeakPolarHBondContact O-CA 3.46Å; F525-I700 WeakPolarHBondContact O-CG2 3.33Å; F525-L701 HydrophobicContact CB-CB 4.23Å; F525-L701 HydrophobicContact CD1-CB 4.38Å; F525-L701 HydrophobicContact CD1-CD1 3.83Å; F525-L701 HydrophobicContact CD1-CG 4.39Å; F525-L701 HydrophobicContact CE1-CD1 4.3Å; F525-L701 PolarHBondContact N-O 3.14Å; F525-L701 PolarHBondContact O-N 2.85Å
526	W	94.3	Very high	84.4	Confident	2 Å²	2	61.5 Å²	61.5	1%	0.008	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	130.5	-177.9	-70.1	-6.6	0	0	0	112.3	Q323 N528 G544 R545 Q547 C797	Q323-W526 HydrophobicContact CG-CZ3 4.45Å; W526-N528 PolarHBondContact O-N 3.47Å; W526-G544 WeakPolarHBondContact O-CA 3.35Å; W526-R545 PolarHBondContact N-O 3.5Å; W526-R545 PolarHBondContact O-N 2.88Å; W526-Q547 HydrophobicContact CD2-CG 3.65Å; W526-Q547 VanDerWaalsContact CE2-CG 3.46Å; W526-Q547 HydrophobicContact CE3-CG 4.08Å; W526-Q547 HydrophobicContact CG-CG 3.98Å; W526-Q547 HydrophobicContact CH2-CG 3.91Å; W526-Q547 HydrophobicContact CZ2-CB 4.28Å; W526-Q547 VanDerWaalsContact CZ2-CD 3.44Å; W526-Q547 HydrophobicContact CZ2-CG 3.54Å; W526-Q547 HydrophobicContact CZ3-CG 4.22Å; W526-C797 HydrophobicContact CB-CB 3.83Å; W526-C797 HydrophobicContact CG-CB 4.24Å
527	I	94.2	Very high	84.2	Confident	0 Å²	0	59.5 Å²	59.5	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	110.1	-178.2	-57.7	175.9	0	0	0	110.7	F525 V530 I542 L559 G698 M699 L701	F525-I527 HydrophobicContact CD1-CG1 4.25Å; F525-I527 HydrophobicContact CE1-CG1 4.15Å; I527-V530 HydrophobicContact CG2-CG2 3.7Å; I527-I542 HydrophobicContact CB-CG2 4.05Å; I527-I542 HydrophobicContact CD1-CD1 4.12Å; I527-I542 HydrophobicContact CD1-CG2 3.6Å; I527-I542 HydrophobicContact CG1-CG2 3.5Å; I527-I542 VanDerWaalsContact CG1-CG2 3.5Å; I527-I542 HydrophobicContact CG2-CG2 3.51Å; I527-L559 HydrophobicContact CD1-CD1 3.4Å; I527-L559 VanDerWaalsContact CD1-CD1 3.4Å; I527-G698 PolarHBondContact O-N 3.28Å; I527-G698 VanDerWaalsContact O-N 3.09Å; I527-M699 WeakPolarHBondContact CB-O 3.48Å; I527-M699 HydrophobicContact CD1-CB 3.88Å; I527-M699 WeakPolarHBondContact CG1-O 3.48Å; I527-M699 PolarHBondContact N-O 2.82Å; I527-L701 HydrophobicContact CD1-CG 4.49Å
528	N	88.4	Confident	83.8	Confident	16 Å²	16	63.3 Å²	63.3	9%	0.086	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	-31	-179.3	-71.1	-14.6	0	0	0	112.4	C321 W526 V543 R697	C321-N528 PolarHBondContact O-ND2 2.9Å; W526-N528 PolarHBondContact O-N 3.47Å; N528-V543 PolarHBondContact N-O 2.85Å; N528-R697 WeakPolarHBondContact O-CD 3.42Å; N528-R697 VanDerWaalsContact O-CG 3.27Å; N528-R697 WeakPolarHBondContact O-CG 3.38Å; N528-R697 PolarHBondContact O-NE 2.95Å; N528-R697 VanDerWaalsContact O-NE 3.15Å
529	Q	89.5	Confident	83.9	Confident	61 Å²	61	61.2 Å²	61.2	29%	0.285	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	156.1	176.9	-52	-175.8	-8.9	0	0	111.2	Y531 V543	Q529-Y531 HydrophobicContact CB-CE2 4.3Å; Q529-Y531 PolarHBondContact OE1-OH 3.48Å; Q529-Y531 VanDerWaalsContact OE1-OH 3.12Å; Q529-V543 HydrophobicContact CB-CB 4.22Å; Q529-V543 PolarHBondContact N-O 2.9Å; Q529-V543 PolarHBondContact O-N 3.37Å
530	V	91.4	Very high	84.6	Confident	35 Å²	35	56 Å²	56	21%	0.212	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	134.5	-178.5	173.2	0	0	0	0	107.7	I527 T532 L695	I527-V530 HydrophobicContact CG2-CG2 3.7Å; V530-T532 HydrophobicContact CG1-CG2 4.35Å; V530-L695 HydrophobicContact CB-CB 4.48Å; V530-L695 HydrophobicContact CG1-CB 3.55Å; V530-L695 HydrophobicContact CG1-CD1 3.9Å; V530-L695 HydrophobicContact CG1-CG 4.36Å; V530-L695 HydrophobicContact CG2-CB 4.18Å
531	Y	89.9	Confident	85.2	Confident	108 Å²	108	54.7 Å²	54.7	42%	0.424	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	107.9	171.9	-63	-87.3	0	0	0	107.9	Q529 Q533 I534 P540 V541 V543	Q529-Y531 HydrophobicContact CB-CE2 4.3Å; Q529-Y531 PolarHBondContact OE1-OH 3.48Å; Q529-Y531 VanDerWaalsContact OE1-OH 3.12Å; Y531-Q533 VanDerWaalsContact C-N 3.32Å; Y531-I534 HydrophobicContact CG-CD1 4.09Å; Y531-I534 HydrophobicContact CG-CG1 4.45Å; Y531-P540 WeakPolarHBondContact O-CA 3.3Å; Y531-V541 PolarHBondContact N-O 2.88Å; Y531-V541 PolarHBondContact O-N 3.19Å; Y531-V543 HydrophobicContact CD2-CG2 4.03Å; Y531-V543 HydrophobicContact CE2-CG2 3.85Å
532	T	86	Confident	86.2	Confident	94 Å²	94	47.4 Å²	47.4	58%	0.577	29%	0.286	S	S	*	.	S	Bend	trans	-72.4	-27	-176.6	46.9	0	0	0	0	113.1	V530	V530-T532 HydrophobicContact CG1-CG2 4.35Å
533	Q	79.7	Confident	86.8	Confident	158 Å²	158	48.8 Å²	48.8	74%	0.738	29%	0.292	S	S	*	.			trans	-143.5	130.9	179.1	-66.2	176.3	-9	0	0	108.7	Y531	Y531-Q533 VanDerWaalsContact C-N 3.32Å
534	I	81.8	Confident	87	Confident	60 Å²	60	48.6 Å²	48.6	31%	0.308	29%	0.292	S	S	.	.	B	Isolated β-bridge	trans	-131.7	132.4	171.2	-62.3	-171.9	0	0	0	107.4	Y531 G536 V537 V541	Y531-I534 HydrophobicContact CG-CD1 4.09Å; Y531-I534 HydrophobicContact CG-CG1 4.45Å; I534-G536 PolarHBondContact O-N 3.22Å; I534-V537 HydrophobicContact CB-CB 4.22Å; I534-V537 HydrophobicContact CB-CG2 4.1Å; I534-V537 HydrophobicContact CG2-CG2 4Å; I534-V537 PolarHBondContact O-N 3.48Å; I534-V541 HydrophobicContact CD1-CB 3.74Å; I534-V541 HydrophobicContact CD1-CG1 4.13Å; I534-V541 HydrophobicContact CD1-CG2 3.86Å
535	P	76	Confident	87	Confident	133 Å²	133	48.8 Å²	48.8	86%	0.864	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.6	125.6	176.6	-26.1	35.1	0	0	0	112
536	G	70.8	Confident	87	Confident	92 Å²	92	48.8 Å²	48.8	95%	0.948	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.2	4.5	-178.7	0	0	0	0	0	115.8	I534	I534-G536 PolarHBondContact O-N 3.22Å
537	V	78.1	Confident	86.9	Confident	46 Å²	46	49.7 Å²	49.7	28%	0.279	30%	0.296	S	S	.	.	B	Isolated β-bridge	trans	-121.1	128.2	173.9	-169.7	0	0	0	0	108.9	I534 N539 V541 E594	I534-V537 HydrophobicContact CB-CB 4.22Å; I534-V537 HydrophobicContact CB-CG2 4.1Å; I534-V537 HydrophobicContact CG2-CG2 4Å; I534-V537 PolarHBondContact O-N 3.48Å; V537-N539 WeakPolarHBondContact CG1-O 3.48Å; V537-V541 HydrophobicContact CG1-CG2 3.88Å; V537-E594 HydrophobicContact CG1-CB 4.34Å; V537-E594 HydrophobicContact CG1-CG 3.73Å; V537-E594 WeakPolarHBondContact CG1-OE1 3.2Å
538	S	75.1	Confident	86.7	Confident	108 Å²	108	49.7 Å²	49.7	76%	0.755	30%	0.297	S	S	*	.	S	Bend	trans	-79.5	-28.8	-175.3	42.9	0	0	0	0	113.8	E594	S538-E594 PolarHBondContact OG-OE1 3.13Å
539	N	84.2	Confident	86.7	Confident	29 Å²	29	49 Å²	49	16%	0.155	29%	0.294	C	S	.	.	S	Bend	trans	-112.7	160.1	-174.7	-55.1	-77.2	0	0	0	111.3	V537 E594 Y596	V537-N539 WeakPolarHBondContact CG1-O 3.48Å; N539-E594 HydrophobicContact CB-CG 3.7Å; N539-E594 WeakPolarHBondContact CB-OE1 3.47Å; N539-E594 PolarHBondContact N-OE1 2.81Å; N539-E594 PolarHBondContact ND2-OE1 2.94Å; N539-Y596 WeakPolarHBondContact OD1-CD2 3.04Å
540	P	89.8	Confident	86.8	Confident	17 Å²	17	49.2 Å²	49.2	11%	0.11	29%	0.294	C	S	.	.			trans	-61.6	143.6	175.4	24.3	-33.6	0	0	0	111.9	Y531 V595 F597 L695	Y531-P540 WeakPolarHBondContact O-CA 3.3Å; P540-V595 PolarHBondContact O-N 3.21Å; P540-V595 VanDerWaalsContact O-N 3.13Å; P540-F597 HydrophobicContact CG-CD2 4.46Å; P540-F597 HydrophobicContact CG-CE2 3.9Å; P540-L695 HydrophobicContact CB-CD1 3.69Å; P540-L695 HydrophobicContact CG-CD1 3.89Å
541	V	92.1	Very high	86.8	Confident	17 Å²	17	47.5 Å²	47.5	10%	0.103	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	128.2	178	174.1	0	0	0	0	110	Y531 I534 V537 V543 M593 E594	Y531-V541 PolarHBondContact N-O 2.88Å; Y531-V541 PolarHBondContact O-N 3.19Å; I534-V541 HydrophobicContact CD1-CB 3.74Å; I534-V541 HydrophobicContact CD1-CG1 4.13Å; I534-V541 HydrophobicContact CD1-CG2 3.86Å; V537-V541 HydrophobicContact CG1-CG2 3.88Å; V541-V543 HydrophobicContact CG1-CG2 4.39Å; V541-M593 CarbonylContact C-O 3.29Å; V541-M593 VanDerWaalsContact CA-O 3.26Å; V541-M593 WeakPolarHBondContact CA-O 3.37Å; V541-E594 HydrophobicContact CG2-CB 4.31Å
542	I	94.1	Very high	86.7	Confident	1 Å²	1	44.6 Å²	44.6	1%	0.005	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	136.4	-177.6	-58.4	-171.3	0	0	0	108.5	F525 I527 L559 S592 M593 V595 L695	F525-I542 HydrophobicContact CE1-CG2 4.15Å; I527-I542 HydrophobicContact CB-CG2 4.05Å; I527-I542 HydrophobicContact CD1-CD1 4.12Å; I527-I542 HydrophobicContact CD1-CG2 3.6Å; I527-I542 HydrophobicContact CG1-CG2 3.5Å; I527-I542 VanDerWaalsContact CG1-CG2 3.5Å; I527-I542 HydrophobicContact CG2-CG2 3.51Å; I542-L559 HydrophobicContact CD1-CD1 4.33Å; I542-S592 CarbonylContact O-C 3.58Å; I542-S592 WeakPolarHBondContact O-CA 3.36Å; I542-M593 HydrophobicContact CB-CG 4.08Å; I542-M593 PolarHBondContact N-O 3.03Å; I542-M593 WeakPolarHBondContact O-CG 3.11Å; I542-M593 PolarHBondContact O-N 3.45Å; I542-V595 HydrophobicContact CB-CG2 4.09Å; I542-V595 HydrophobicContact CD1-CB 4.47Å; I542-V595 HydrophobicContact CD1-CG2 3.79Å; I542-V595 HydrophobicContact CG1-CG2 3.79Å; I542-L695 HydrophobicContact CD1-CD1 4.25Å; I542-L695 HydrophobicContact CD1-CD2 3.83Å; I542-L695 HydrophobicContact CG1-CD1 4.44Å
543	V	93.3	Very high	86.5	Confident	36 Å²	36	42.2 Å²	42.2	22%	0.218	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	137	-178.4	-170.2	0	0	0	0	110.4	N528 Q529 Y531 V541 A591	N528-V543 PolarHBondContact N-O 2.85Å; Q529-V543 HydrophobicContact CB-CB 4.22Å; Q529-V543 PolarHBondContact N-O 2.9Å; Q529-V543 PolarHBondContact O-N 3.37Å; Y531-V543 HydrophobicContact CD2-CG2 4.03Å; Y531-V543 HydrophobicContact CE2-CG2 3.85Å; V541-V543 HydrophobicContact CG1-CG2 4.39Å; V543-A591 WeakPolarHBondContact CA-O 3.05Å
544	G	92.8	Very high	86.6	Confident	3 Å²	3	39.5 Å²	39.5	3%	0.031	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-173.1	-166.5	-166.5	0	0	0	0	0	113.9	W526 S590 A591	W526-G544 WeakPolarHBondContact O-CA 3.35Å; G544-S590 CarbonylContact O-C 3.59Å; G544-S590 VanDerWaalsContact O-CA 3.28Å; G544-S590 WeakPolarHBondContact O-CA 3.41Å; G544-A591 PolarHBondContact N-O 3.09Å; G544-A591 PolarHBondContact O-N 3.45Å
545	R	92.8	Very high	86.8	Confident	8 Å²	8	38.5 Å²	38.5	3%	0.03	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	133.7	176.8	-163.3	177.7	-170.4	177.7	-2.5	110	D210 N322 Q323 F525 W526 G588 Q589	D210-R545 PolarHBondContact O-NH2 3.01Å; N322-R545 PolarHBondContact O-NH1 2.9Å; Q323-R545 PolarHBondContact O-NH1 3.09Å; Q323-R545 VanDerWaalsContact O-NH1 3.08Å; F525-R545 VanDerWaalsContact CD2-C 3.44Å; F525-R545 WeakPolarHBondContact CD2-O 3.45Å; W526-R545 PolarHBondContact N-O 3.5Å; W526-R545 PolarHBondContact O-N 2.88Å; R545-G588 VanDerWaalsContact CZ-O 3.28Å; R545-G588 PolarHBondContact NE-O 2.86Å; R545-G588 PolarHBondContact NH2-O 2.94Å; R545-Q589 WeakPolarHBondContact CA-O 3.5Å; R545-Q589 WeakPolarHBondContact CG-O 3.45Å
546	V	93.8	Very high	87.4	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	131.8	170.5	-168.4	0	0	0	0	107.9	T523 F525 L551 V585 Y586 A587 G588 Q589	T523-V546 HydrophobicContact CG2-CG1 4.45Å; F525-V546 HydrophobicContact CD2-CB 4.47Å; F525-V546 HydrophobicContact CD2-CG2 3.87Å; F525-V546 HydrophobicContact CE2-CG2 4.45Å; V546-L551 HydrophobicContact CG2-CD1 3.47Å; V546-L551 VanDerWaalsContact CG2-CD1 3.47Å; V546-L551 HydrophobicContact CG2-CG 3.89Å; V546-V585 HydrophobicContact CG2-CG1 4.11Å; V546-Y586 WeakPolarHBondContact CB-O 3.23Å; V546-A587 HydrophobicContact CG1-CB 4.44Å; V546-G588 PolarHBondContact O-N 3.12Å; V546-Q589 PolarHBondContact N-O 2.89Å
547	Q	91.2	Very high	88.4	Confident	21 Å²	21	29.7 Å²	29.7	10%	0.098	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	-39.6	-175.8	-67.5	-73.2	-27.8	0	0	111.6	L524 W526	L524-Q547 HydrophobicContact CB-CB 4.31Å; L524-Q547 HydrophobicContact CD2-CB 3.9Å; L524-Q547 HydrophobicContact CG-CB 4.03Å; L524-Q547 PolarHBondContact O-N 2.92Å; W526-Q547 HydrophobicContact CD2-CG 3.65Å; W526-Q547 VanDerWaalsContact CE2-CG 3.46Å; W526-Q547 HydrophobicContact CE3-CG 4.08Å; W526-Q547 HydrophobicContact CG-CG 3.98Å; W526-Q547 HydrophobicContact CH2-CG 3.91Å; W526-Q547 HydrophobicContact CZ2-CB 4.28Å; W526-Q547 VanDerWaalsContact CZ2-CD 3.44Å; W526-Q547 HydrophobicContact CZ2-CG 3.54Å; W526-Q547 HydrophobicContact CZ3-CG 4.22Å
548	L	89.8	Confident	89	Confident	1 Å²	1	27.7 Å²	27.7	1%	0.005	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	145.6	176.8	-57.1	168.8	0	0	0	109.3	Y517 F520 G522 T523 L524 M706 L745 I751	Y517-L548 HydrophobicContact CD2-CD2 4.33Å; Y517-L548 HydrophobicContact CG-CD2 4.07Å; F520-L548 HydrophobicContact CB-CB 4.47Å; F520-L548 HydrophobicContact CD1-CB 4Å; F520-L548 HydrophobicContact CD1-CD1 4.4Å; F520-L548 HydrophobicContact CE1-CD1 4.33Å; F520-L548 HydrophobicContact CG-CB 4.39Å; G522-L548 CarbonylContact O-C 3.54Å; T523-L548 WeakPolarHBondContact CA-O 3.22Å; L524-L548 HydrophobicContact CB-CB 3.9Å; L524-L548 HydrophobicContact CB-CD1 4.02Å; L524-L548 HydrophobicContact CB-CG 4.12Å; L524-L548 HydrophobicContact CD2-CD1 3.8Å; L524-L548 HydrophobicContact CD2-CG 4.17Å; L524-L548 PolarHBondContact N-O 3.32Å; L524-L548 VanDerWaalsContact N-O 3.07Å; L524-L548 PolarHBondContact O-N 3.44Å; L548-M706 HydrophobicContact CD1-CE 4.04Å; L548-L745 HydrophobicContact CD2-CD1 4.38Å; L548-L745 HydrophobicContact CD2-CD2 3.91Å; L548-I751 HydrophobicContact CD1-CD1 3.31Å
549	G	88.7	Confident	89.8	Confident	2 Å²	2	22.6 Å²	22.6	2%	0.021	12%	0.119	C	C	.	.	S	Bend	trans	68	-142.5	176.9	0	0	0	0	0	114.2	Y517 R518 G522 A587	Y517-G549 WeakPolarHBondContact O-CA 3.26Å; Y517-G549 PolarHBondContact O-N 3.02Å; R518-G549 CarbonylContact O-C 3.51Å; R518-G549 WeakPolarHBondContact O-CA 3.32Å; G522-G549 VanDerWaalsContact O-CA 3.3Å; G522-G549 WeakPolarHBondContact O-CA 3.29Å; G522-G549 PolarHBondContact O-N 3.08Å; G549-A587 WeakPolarHBondContact O-CB 3.36Å; G549-A587 PolarHBondContact O-N 3.48Å
550	Q	90.6	Very high	90	Very high	64 Å²	64	21.2 Å²	21.2	30%	0.299	11%	0.112	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	150	-177.6	63.3	-175.3	9.9	0	0	111.1	T523 L552 I584 V585 Y586	T523-Q550 WeakPolarHBondContact CG2-O 3.36Å; T523-Q550 PolarHBondContact OG1-O 2.88Å; Q550-L552 HydrophobicContact CG-CD2 4.47Å; Q550-I584 HydrophobicContact CB-CG2 4.08Å; Q550-V585 CarbonylContact C-O 3.54Å; Q550-V585 WeakPolarHBondContact CA-O 3.49Å; Q550-Y586 HydrophobicContact CB-CD1 3.86Å; Q550-Y586 HydrophobicContact CB-CE1 4.22Å; Q550-Y586 VanDerWaalsContact OE1-CE1 3.3Å
551	L	91.5	Very high	89.9	Confident	0 Å²	0	20.4 Å²	20.4	0%	0	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	133.1	167.8	-66.4	168.1	0	0	0	108.9	T523 F525 V546 L557 I572 L575 I584 V585 A591 M593	T523-L551 HydrophobicContact CG2-CD2 3.72Å; T523-L551 HydrophobicContact CG2-CG 4.12Å; F525-L551 HydrophobicContact CB-CD2 4.41Å; F525-L551 HydrophobicContact CD2-CD1 3.81Å; F525-L551 HydrophobicContact CE2-CD1 4.13Å; F525-L551 HydrophobicContact CG-CD1 4.39Å; V546-L551 HydrophobicContact CG2-CD1 3.47Å; V546-L551 VanDerWaalsContact CG2-CD1 3.47Å; V546-L551 HydrophobicContact CG2-CG 3.89Å; L551-L557 HydrophobicContact CD2-CD1 3.57Å; L551-I572 HydrophobicContact CD2-CD1 3.89Å; L551-L575 HydrophobicContact CB-CD1 3.75Å; L551-L575 HydrophobicContact CB-CD2 4.18Å; L551-L575 HydrophobicContact CD1-CD2 4.22Å; L551-L575 WeakPolarHBondContact O-CD1 3.05Å; L551-I584 VanDerWaalsContact O-CA 3.31Å; L551-I584 WeakPolarHBondContact O-CA 3.34Å; L551-V585 HydrophobicContact CB-CB 4.42Å; L551-V585 PolarHBondContact N-O 2.94Å; L551-V585 PolarHBondContact O-N 2.61Å; L551-A591 HydrophobicContact CD1-CB 4.03Å; L551-M593 HydrophobicContact CD1-CE 3.38Å; L551-M593 HydrophobicContact CD2-CE 3.93Å; L551-M593 HydrophobicContact CG-CE 4.3Å
552	L	89.4	Confident	89.6	Confident	47 Å²	47	19.8 Å²	19.8	25%	0.246	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	144.7	174	-57.3	173	0	0	0	110.4	Q550 Q555 L575 D583 I584	Q550-L552 HydrophobicContact CG-CD2 4.47Å; L552-Q555 HydrophobicContact CB-CB 4.14Å; L552-Q555 WeakPolarHBondContact O-CB 3.42Å; L552-Q555 PolarHBondContact O-N 2.88Å; L552-L575 VanDerWaalsContact C-CD1 3.46Å; L552-D583 WeakPolarHBondContact CA-O 3.29Å; L552-I584 HydrophobicContact CD2-CB 4.15Å; L552-I584 HydrophobicContact CD2-CD1 3.76Å; L552-I584 HydrophobicContact CD2-CG1 3.59Å; L552-I584 HydrophobicContact CD2-CG2 3.81Å
553	N	82.1	Confident	89	Confident	44 Å²	44	23.8 Å²	23.8	24%	0.235	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.6	144.7	173.3	-157.8	20.4	0	0	0	110.4	Q555 V573 S574 D583	N553-Q555 PolarHBondContact O-N 3.48Å; N553-V573 VanDerWaalsContact OD1-C 3.25Å; N553-V573 PolarHBondContact OD1-O 3.43Å; N553-S574 WeakPolarHBondContact OD1-CA 3.49Å; N553-S574 PolarHBondContact OD1-N 3.43Å; N553-D583 PolarHBondContact N-O 3.32Å
554	N	80.1	Confident	88.3	Confident	101 Å²	101	25.1 Å²	25.1	54%	0.54	12%	0.124	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.6	6	-167.6	-60.1	-56.1	0	0	0	116.6	Q571 I572	N554-Q571 PolarHBondContact OD1-NE2 3.18Å; N554-I572 WeakPolarHBondContact CA-O 3.38Å; N554-I572 PolarHBondContact N-O 2.64Å
555	Q	87.1	Confident	87.6	Confident	38 Å²	38	25.1 Å²	25.1	18%	0.178	12%	0.124	C	C	.	.			trans	-65.6	139.3	174.1	-167.2	177.3	9.2	0	0	111.1	T523 L552 N553 L557 I572	T523-Q555 PolarHBondContact OG1-NE2 3.12Å; L552-Q555 HydrophobicContact CB-CB 4.14Å; L552-Q555 WeakPolarHBondContact O-CB 3.42Å; L552-Q555 PolarHBondContact O-N 2.88Å; N553-Q555 PolarHBondContact O-N 3.48Å; Q555-L557 HydrophobicContact CG-CD2 4.06Å; Q555-L557 HydrophobicContact CG-CG 4.22Å; Q555-I572 HydrophobicContact CB-CD1 4.26Å; Q555-I572 PolarHBondContact O-N 2.92Å
556	I	88.2	Confident	86.9	Confident	41 Å²	41	25.8 Å²	25.8	21%	0.21	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	126.5	169.1	-58.5	173.6	0	0	0	108.4	P569 V570 Q571 L598	I556-P569 HydrophobicContact CG2-CB 4.4Å; I556-V570 WeakPolarHBondContact CA-O 3.21Å; I556-Q571 HydrophobicContact CG1-CB 4.43Å; I556-L598 HydrophobicContact CD1-CD1 4.05Å; I556-L598 HydrophobicContact CG1-CD1 4.26Å; I556-L598 HydrophobicContact CG2-CD1 3.96Å
557	L	91.6	Very high	86.4	Confident	0 Å²	0	26.3 Å²	26.3	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	166.7	177.5	-66.2	-178.7	0	0	0	111.1	L551 Q555 P569 V570 I572 L701 T703	L551-L557 HydrophobicContact CD2-CD1 3.57Å; Q555-L557 HydrophobicContact CG-CD2 4.06Å; Q555-L557 HydrophobicContact CG-CG 4.22Å; L557-P569 WeakPolarHBondContact O-CA 3.1Å; L557-V570 PolarHBondContact N-O 3.31Å; L557-V570 PolarHBondContact O-N 3.3Å; L557-I572 HydrophobicContact CD1-CD1 3.8Å; L557-I572 HydrophobicContact CG-CD1 4.42Å; L557-L701 HydrophobicContact CB-CB 4.3Å; L557-L701 HydrophobicContact CB-CD2 4.05Å; L557-L701 HydrophobicContact CD1-CB 3.95Å; L557-L701 HydrophobicContact CD1-CD1 4.36Å; L557-T703 HydrophobicContact CD2-CG2 3.63Å
558	W	89.9	Confident	86.2	Confident	3 Å²	3	27.4 Å²	27.4	1%	0.011	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	113.1	-179.1	-72.7	95	0	0	0	110.6	F567 P569 W602 L701 L702 Y704 L707	W558-F567 HydrophobicContact CB-CB 4.3Å; W558-F567 HydrophobicContact CB-CD1 4.21Å; W558-F567 HydrophobicContact CE3-CB 3.92Å; W558-P569 HydrophobicContact CE3-CB 4.37Å; W558-P569 HydrophobicContact CH2-CB 3.52Å; W558-P569 HydrophobicContact CH2-CG 3.71Å; W558-P569 HydrophobicContact CZ2-CB 3.85Å; W558-P569 HydrophobicContact CZ2-CG 4.48Å; W558-P569 HydrophobicContact CZ3-CB 3.86Å; W558-P569 VanDerWaalsContact CZ3-CD 3.42Å; W558-P569 HydrophobicContact CZ3-CG 3.97Å; W558-W602 HydrophobicContact CH2-CB 3.54Å; W558-W602 AromaticContact CH2-CD2 3.81Å; W558-W602 HydrophobicContact CH2-CD2 3.81Å; W558-W602 AromaticContact CH2-CE3 3.31Å; W558-W602 HydrophobicContact CH2-CE3 3.31Å; W558-W602 AromaticContact CH2-CG 3.96Å; W558-W602 HydrophobicContact CH2-CG 3.96Å; W558-W602 HydrophobicContact CH2-CZ3 4.2Å; W558-W602 HydrophobicContact CZ2-CD2 4.06Å; W558-W602 AromaticContact CZ2-CE3 3.27Å; W558-W602 HydrophobicContact CZ2-CE3 3.27Å; W558-W602 AromaticContact CZ2-CZ3 3.69Å; W558-W602 HydrophobicContact CZ2-CZ3 3.69Å; W558-W602 HydrophobicContact CZ3-CB 3.68Å; W558-W602 HydrophobicContact CZ3-CE3 4.43Å; W558-W602 HydrophobicContact CZ3-CG 4.35Å; W558-L701 CarbonylContact O-C 3.49Å; W558-L701 VanDerWaalsContact O-CA 3.31Å; W558-L701 WeakPolarHBondContact O-CA 3.37Å; W558-L702 HydrophobicContact CB-CB 4.32Å; W558-L702 WeakPolarHBondContact CB-O 3.46Å; W558-L702 PolarHBondContact N-O 2.87Å; W558-L702 PolarHBondContact O-N 3.35Å; W558-Y704 AromaticContact NE1-CD2 3.74Å; W558-L707 HydrophobicContact CB-CD2 3.97Å; W558-L707 HydrophobicContact CD2-CD2 3.49Å; W558-L707 VanDerWaalsContact CD2-CD2 3.49Å; W558-L707 HydrophobicContact CE3-CD2 3.73Å; W558-L707 HydrophobicContact CG-CB 4.41Å; W558-L707 HydrophobicContact CG-CD2 3.56Å
559	L	92	Very high	86	Confident	1 Å²	1	27.5 Å²	27.5	1%	0.005	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	121	-178.1	174.4	68.5	0	0	0	111.1	I527 I542 F567 Y568 V570 F597 L695 M699 L701	I527-L559 HydrophobicContact CD1-CD1 3.4Å; I527-L559 VanDerWaalsContact CD1-CD1 3.4Å; I542-L559 HydrophobicContact CD1-CD1 4.33Å; L559-F567 CarbonylContact O-C 3.54Å; L559-F567 VanDerWaalsContact O-CA 3.28Å; L559-F567 WeakPolarHBondContact O-CA 3.14Å; L559-Y568 PolarHBondContact N-O 2.98Å; L559-Y568 PolarHBondContact O-N 3.22Å; L559-V570 HydrophobicContact CB-CG1 3.94Å; L559-V570 HydrophobicContact CB-CG2 3.86Å; L559-V570 HydrophobicContact CD2-CG1 3.91Å; L559-F597 HydrophobicContact CD2-CE1 3.65Å; L559-F597 HydrophobicContact CD2-CZ 3.74Å; L559-L695 HydrophobicContact CD1-CD2 4.29Å; L559-L695 HydrophobicContact CD2-CD2 3.52Å; L559-L695 HydrophobicContact CG-CD2 4.42Å; L559-M699 HydrophobicContact CD1-CB 4.46Å; L559-M699 HydrophobicContact CD1-CE 4.12Å; L559-M699 HydrophobicContact CG-CE 3.93Å; L559-L701 HydrophobicContact CB-CD2 3.65Å; L559-L701 HydrophobicContact CD1-CD2 3.88Å; L559-L701 HydrophobicContact CD1-CG 4.3Å; L559-L701 HydrophobicContact CG-CD2 4.34Å
560	G	88.3	Confident	86.1	Confident	0 Å²	0	27.4 Å²	27.4	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	177.8	-167.6	179.3	0	0	0	0	0	112.1	F567 M699 I700	G560-F567 VanDerWaalsContact CA-CE1 3.42Å; G560-F567 VanDerWaalsContact N-CD1 3.26Å; G560-M699 CarbonylContact O-C 3.59Å; G560-M699 WeakPolarHBondContact O-CA 3.08Å; G560-I700 PolarHBondContact N-O 3.5Å; G560-I700 VanDerWaalsContact N-O 3.08Å; G560-I700 PolarHBondContact O-N 2.76Å; G560-I700 VanDerWaalsContact O-O 3.06Å
561	P	89.2	Confident	86	Confident	0 Å²	0	27 Å²	27	0%	0	13%	0.132	C	C	.	.			cis	-67.8	145.3	-13.2	28.7	-32.7	0	0	0	110.3	D566 F567 R696 V755 P848 L850	P561-D566 WeakPolarHBondContact CA-O 3.34Å; P561-F567 HydrophobicContact CB-CE2 4.24Å; P561-F567 HydrophobicContact CB-CZ 4.38Å; P561-R696 VanDerWaalsContact O-CZ 3.28Å; P561-R696 PolarHBondContact O-NH1 2.82Å; P561-R696 PolarHBondContact O-NH2 2.9Å; P561-V755 HydrophobicContact CB-CG1 3.93Å; P561-V755 HydrophobicContact CB-CG2 4.11Å; P561-V755 HydrophobicContact CG-CG1 4.4Å; P561-P848 WeakPolarHBondContact CG-O 3.19Å; P561-L850 HydrophobicContact CG-CB 4.43Å
562	D	84.8	Confident	85.9	Confident	4 Å²	4	27 Å²	27	2%	0.021	13%	0.132	C	C	.	.			trans	-75.8	-156.2	168.6	87.4	-30.7	0	0	0	111.6	F564 G565 D566 Y568 I693 R696	D562-F564 VanDerWaalsContact C-N 3.34Å; D562-F564 WeakPolarHBondContact OD1-CA 2.8Å; D562-F564 PolarHBondContact OD1-N 3.4Å; D562-F564 VanDerWaalsContact OD2-CD2 3.23Å; D562-F564 WeakPolarHBondContact OD2-CD2 3.2Å; D562-G565 PolarHBondContact OD1-N 3.21Å; D562-D566 PolarHBondContact N-O 3.22Å; D562-D566 PolarHBondContact OD1-N 2.88Å; D562-Y568 HydrophobicContact CB-CE2 4.22Å; D562-I693 HydrophobicContact CB-CG2 3.8Å; D562-R696 PolarHBondContact O-NH1 3.24Å; D562-R696 PolarHBondContact O-NH2 3.2Å
563	Q	82.4	Confident	85.7	Confident	85 Å²	85	27.3 Å²	27.3	40%	0.397	14%	0.136	S	C	.	.	S	Bend	trans	-77.2	-19.3	175.9	69.2	-173.9	7.9	0	0	113.6
564	F	78.6	Confident	85.9	Confident	64 Å²	64	26.1 Å²	26.1	28%	0.281	13%	0.131	S	C	.	.	S	Bend	trans	-98.2	-9.9	177	-53.8	-70	0	0	0	112.5	D562 L943 F947	D562-F564 VanDerWaalsContact C-N 3.34Å; D562-F564 WeakPolarHBondContact OD1-CA 2.8Å; D562-F564 PolarHBondContact OD1-N 3.4Å; D562-F564 VanDerWaalsContact OD2-CD2 3.23Å; D562-F564 WeakPolarHBondContact OD2-CD2 3.2Å; F564-L943 HydrophobicContact CD1-CD2 3.62Å; F564-L943 HydrophobicContact CE1-CD2 3.45Å; F564-L943 VanDerWaalsContact CE1-CD2 3.45Å; F564-F947 WeakPolarHBondContact O-CD2 3.23Å; F564-F947 WeakPolarHBondContact O-CE2 3.48Å
565	G	76.9	Confident	86.2	Confident	3 Å²	3	21.3 Å²	21.3	3%	0.031	11%	0.105	C	C	.	.	S	Bend	trans	94.7	6.9	-176.2	0	0	0	0	0	114.5	D562	D562-G565 PolarHBondContact OD1-N 3.21Å
566	D	78.7	Confident	86.3	Confident	23 Å²	23	21.6 Å²	21.6	12%	0.123	11%	0.107	C	C	.	.			trans	-78.9	157.6	-179.8	-65.4	-26.9	0	0	0	112	P561 D562 Y568 R950	P561-D566 WeakPolarHBondContact CA-O 3.34Å; D562-D566 PolarHBondContact N-O 3.22Å; D562-D566 PolarHBondContact OD1-N 2.88Å; D566-Y568 HydrophobicContact CB-CE2 3.82Å; D566-R950 IonicContact OD1-CZ 3.79Å; D566-R950 IonicContact OD1-NH1 2.77Å; D566-R950 PolarHBondContact OD1-NH1 2.87Å; D566-R950 IonicContact OD2-CZ 3.28Å; D566-R950 IonicContact OD2-NH1 3.14Å; D566-R950 PolarHBondContact OD2-NH1 3.13Å; D566-R950 IonicContact OD2-NH2 2.77Å
567	F	84.2	Confident	86.4	Confident	11 Å²	11	20.3 Å²	20.3	5%	0.048	10%	0.1	C	C	.	.			trans	-118.4	148	168.5	-72.1	-107.1	0	0	0	111.2	W558 L559 G560 P561 L702 L707 V755 L850	W558-F567 HydrophobicContact CB-CB 4.3Å; W558-F567 HydrophobicContact CB-CD1 4.21Å; W558-F567 HydrophobicContact CE3-CB 3.92Å; L559-F567 CarbonylContact O-C 3.54Å; L559-F567 VanDerWaalsContact O-CA 3.28Å; L559-F567 WeakPolarHBondContact O-CA 3.14Å; G560-F567 VanDerWaalsContact CA-CE1 3.42Å; G560-F567 VanDerWaalsContact N-CD1 3.26Å; P561-F567 HydrophobicContact CB-CE2 4.24Å; P561-F567 HydrophobicContact CB-CZ 4.38Å; F567-L702 HydrophobicContact CD1-CD1 4.41Å; F567-L702 HydrophobicContact CE1-CD1 3.73Å; F567-L702 HydrophobicContact CE1-CG 4.29Å; F567-L702 HydrophobicContact CZ-CD1 4.07Å; F567-L707 HydrophobicContact CB-CD1 3.9Å; F567-L707 HydrophobicContact CB-CD2 4.18Å; F567-L707 HydrophobicContact CD1-CD1 3.83Å; F567-L707 HydrophobicContact CD2-CD1 3.52Å; F567-L707 HydrophobicContact CE1-CD1 4.24Å; F567-L707 HydrophobicContact CE2-CD1 3.94Å; F567-L707 HydrophobicContact CG-CD1 3.47Å; F567-L707 VanDerWaalsContact CG-CD1 3.47Å; F567-L707 HydrophobicContact CZ-CD1 4.3Å; F567-V755 HydrophobicContact CE2-CG2 3.67Å; F567-V755 HydrophobicContact CZ-CG2 4.19Å; F567-L850 HydrophobicContact CE1-CD1 4.42Å; F567-L850 HydrophobicContact CZ-CD1 3.66Å
568	Y	85.5	Confident	86.1	Confident	44 Å²	44	21.7 Å²	21.7	17%	0.173	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	140.8	-176.2	-68	-100.8	0	0	0	111.3	L559 D562 D566 I693	L559-Y568 PolarHBondContact N-O 2.98Å; L559-Y568 PolarHBondContact O-N 3.22Å; D562-Y568 HydrophobicContact CB-CE2 4.22Å; D566-Y568 HydrophobicContact CB-CE2 3.82Å; Y568-I693 HydrophobicContact CD1-CD1 3.62Å; Y568-I693 HydrophobicContact CD1-CG1 4.37Å; Y568-I693 HydrophobicContact CD2-CD1 3.36Å; Y568-I693 HydrophobicContact CD2-CG1 3.7Å; Y568-I693 HydrophobicContact CE1-CD1 3.88Å; Y568-I693 HydrophobicContact CE1-CG1 4.16Å; Y568-I693 HydrophobicContact CE2-CD1 3.67Å; Y568-I693 HydrophobicContact CE2-CG1 3.48Å; Y568-I693 VanDerWaalsContact CE2-CG1 3.48Å; Y568-I693 HydrophobicContact CG-CD1 3.32Å; Y568-I693 HydrophobicContact CG-CG1 4.14Å
569	P	87.1	Confident	85.7	Confident	2 Å²	2	27.9 Å²	27.9	1%	0.013	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	127.4	-178.8	31	-29.1	0	0	0	109.8	I556 L557 W558 L598 K600 M605	I556-P569 HydrophobicContact CG2-CB 4.4Å; L557-P569 WeakPolarHBondContact O-CA 3.1Å; W558-P569 HydrophobicContact CE3-CB 4.37Å; W558-P569 HydrophobicContact CH2-CB 3.52Å; W558-P569 HydrophobicContact CH2-CG 3.71Å; W558-P569 HydrophobicContact CZ2-CB 3.85Å; W558-P569 HydrophobicContact CZ2-CG 4.48Å; W558-P569 HydrophobicContact CZ3-CB 3.86Å; W558-P569 VanDerWaalsContact CZ3-CD 3.42Å; W558-P569 HydrophobicContact CZ3-CG 3.97Å; P569-L598 HydrophobicContact CB-CD1 4.14Å; P569-L598 HydrophobicContact CG-CB 4.3Å; P569-L598 PolarHBondContact O-N 3.3Å; P569-K600 WeakPolarHBondContact CG-O 3.43Å; P569-M605 HydrophobicContact CG-CE 4.12Å
570	V	89.7	Confident	85	Confident	1 Å²	1	28.3 Å²	28.3	1%	0.006	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	140.5	-179	-59.3	0	0	0	0	110.2	I556 L557 L559 V595 Y596 F597 L701	I556-V570 WeakPolarHBondContact CA-O 3.21Å; L557-V570 PolarHBondContact N-O 3.31Å; L557-V570 PolarHBondContact O-N 3.3Å; L559-V570 HydrophobicContact CB-CG1 3.94Å; L559-V570 HydrophobicContact CB-CG2 3.86Å; L559-V570 HydrophobicContact CD2-CG1 3.91Å; V570-V595 HydrophobicContact CB-CG1 3.65Å; V570-V595 HydrophobicContact CG2-CG1 3.57Å; V570-Y596 CarbonylContact C-O 3.52Å; V570-Y596 VanDerWaalsContact CA-O 3.31Å; V570-Y596 WeakPolarHBondContact CA-O 3.33Å; V570-F597 HydrophobicContact CG1-CD1 3.65Å; V570-F597 HydrophobicContact CG1-CE1 3.85Å; V570-F597 HydrophobicContact CG1-CG 4.22Å; V570-L701 HydrophobicContact CG2-CD2 3.53Å
571	Q	88.8	Confident	84.6	Confident	56 Å²	56	29.8 Å²	29.8	26%	0.262	14%	0.142	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	132.7	177.6	-178.2	179.3	-15.2	0	0	110.1	N554 I556 V573 V595 Y596	N554-Q571 PolarHBondContact OD1-NE2 3.18Å; I556-Q571 HydrophobicContact CG1-CB 4.43Å; Q571-V573 PolarHBondContact O-N 3.04Å; Q571-V595 WeakPolarHBondContact O-CA 3.46Å; Q571-V595 WeakPolarHBondContact O-CG1 3.26Å; Q571-Y596 PolarHBondContact N-O 2.86Å; Q571-Y596 PolarHBondContact O-N 3.17Å
572	I	89.6	Confident	84.2	Confident	0 Å²	0	30.1 Å²	30.1	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	119.3	171.8	-61	-178.8	0	0	0	109.1	L551 N554 Q555 L557 L575 M593	L551-I572 HydrophobicContact CD2-CD1 3.89Å; N554-I572 WeakPolarHBondContact CA-O 3.38Å; N554-I572 PolarHBondContact N-O 2.64Å; Q555-I572 HydrophobicContact CB-CD1 4.26Å; Q555-I572 PolarHBondContact O-N 2.92Å; L557-I572 HydrophobicContact CD1-CD1 3.8Å; L557-I572 HydrophobicContact CG-CD1 4.42Å; I572-L575 HydrophobicContact CD1-CD2 4.17Å; I572-L575 HydrophobicContact CG2-CD1 4.37Å; I572-L575 HydrophobicContact CG2-CD2 3.5Å; I572-L575 VanDerWaalsContact CG2-CD2 3.5Å; I572-L575 HydrophobicContact CG2-CG 3.56Å; I572-M593 HydrophobicContact CD1-CE 4.47Å; I572-M593 HydrophobicContact CD1-SD 4.42Å; I572-M593 HydrophobicContact CG1-SD 4.4Å
573	V	85.9	Confident	84	Confident	52 Å²	52	34.5 Å²	34.5	32%	0.315	17%	0.167	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	-37	-179	-179.3	0	0	0	0	111.7	N553 Q571 E594	N553-V573 VanDerWaalsContact OD1-C 3.25Å; N553-V573 PolarHBondContact OD1-O 3.43Å; Q571-V573 PolarHBondContact O-N 3.04Å; V573-E594 HydrophobicContact CB-CB 4.17Å; V573-E594 HydrophobicContact CB-CG 4Å; V573-E594 HydrophobicContact CG1-CG 4.42Å; V573-E594 HydrophobicContact CG2-CG 4.43Å; V573-E594 PolarHBondContact N-O 2.89Å
574	S	84.9	Confident	84.2	Confident	19 Å²	19	33 Å²	33	13%	0.133	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	133.4	179	179.2	0	0	0	0	109.6	N553 M593 E594	N553-S574 WeakPolarHBondContact OD1-CA 3.49Å; N553-S574 PolarHBondContact OD1-N 3.43Å; S574-M593 VanDerWaalsContact O-CA 3.25Å; S574-M593 WeakPolarHBondContact O-CA 3.37Å; S574-E594 PolarHBondContact O-N 2.89Å
575	L	87.5	Confident	84.8	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	136.8	171.6	-73.4	-179.4	0	0	0	111	L551 L552 I572 V581 H582 V585 M593	L551-L575 HydrophobicContact CB-CD1 3.75Å; L551-L575 HydrophobicContact CB-CD2 4.18Å; L551-L575 HydrophobicContact CD1-CD2 4.22Å; L551-L575 WeakPolarHBondContact O-CD1 3.05Å; L552-L575 VanDerWaalsContact C-CD1 3.46Å; I572-L575 HydrophobicContact CD1-CD2 4.17Å; I572-L575 HydrophobicContact CG2-CD1 4.37Å; I572-L575 HydrophobicContact CG2-CD2 3.5Å; I572-L575 VanDerWaalsContact CG2-CD2 3.5Å; I572-L575 HydrophobicContact CG2-CG 3.56Å; L575-V581 WeakPolarHBondContact O-CA 3Å; L575-H582 VanDerWaalsContact CB-O 3.26Å; L575-H582 WeakPolarHBondContact CB-O 3.35Å; L575-H582 PolarHBondContact O-N 1.86Å; L575-H582 VanDerWaalsContact O-N 3.17Å; L575-V585 HydrophobicContact CB-CG2 4.34Å; L575-V585 HydrophobicContact CD1-CG2 4.39Å; L575-M593 HydrophobicContact CD2-CB 3.78Å; L575-M593 HydrophobicContact CD2-CE 4.17Å
576	M	88.6	Confident	85.5	Confident	44 Å²	44	31 Å²	31	22%	0.217	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	138.7	173.2	-64.2	173	68.5	0	0	111	R579 Q580 V581 A591 S592	M576-R579 WeakPolarHBondContact CE-O 3.48Å; M576-Q580 CarbonylContact C-O 3.53Å; M576-Q580 WeakPolarHBondContact CA-O 3.1Å; M576-Q580 WeakPolarHBondContact CB-O 3.44Å; M576-V581 HydrophobicContact CE-CG2 4.49Å; M576-V581 HydrophobicContact CG-CB 4.46Å; M576-V581 HydrophobicContact CG-CG2 3.9Å; M576-V581 HydrophobicContact SD-CG2 4.33Å; M576-A591 WeakPolarHBondContact O-CA 3.02Å; M576-S592 WeakPolarHBondContact CB-OG 3.27Å; M576-S592 PolarHBondContact N-O 2.78Å; M576-S592 PolarHBondContact O-N 3.32Å; M576-S592 PolarHBondContact O-OG 2.92Å
577	H	89.4	Confident	86.1	Confident	14 Å²	14	30 Å²	30	7%	0.065	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	133.5	173.6	170.2	59.4	0	0	0	107.9	D210 R579 Q580 V585 S590	D210-H577 IonicContact OD1-CE1 3.58Å; D210-H577 PolarHBondContact OD1-CE1 2.94Å; H577-R579 PolarHBondContact O-N 2.82Å; H577-Q580 PolarHBondContact N-O 2.82Å; H577-Q580 PolarHBondContact O-N 3.46Å; H577-V585 HydrophobicContact CB-CG1 4.26Å; H577-V585 HydrophobicContact CB-CG2 4.07Å; H577-S590 PolarHBondContact ND1-O 3.19Å
578	N	85.8	Confident	86.3	Confident	30 Å²	30	29.7 Å²	29.7	16%	0.16	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	44.5	39.4	-172.5	-62.5	-25.7	0	0	0	114.5	L265 V293 Q580	L265-N578 HydrophobicContact CD2-CB 4.48Å; V293-N578 HydrophobicContact CG2-CB 3.59Å; N578-Q580 PolarHBondContact O-N 2.75Å
579	R	81.9	Confident	86.6	Confident	132 Å²	132	27.6 Å²	27.6	50%	0.498	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	63.6	1.2	-173.8	-51.7	-169.2	-174	167.6	-1.8	117.2	T289 E290 M576 H577	T289-R579 HydrophobicContact CG2-CG 4.38Å; T289-R579 PolarHBondContact OG1-NH1 3.02Å; E290-R579 HydrophobicContact CG-CB 3.92Å; E290-R579 VanDerWaalsContact OE1-CB 3.3Å; E290-R579 WeakPolarHBondContact OE1-CB 3.33Å; E290-R579 WeakPolarHBondContact OE1-CD 3.32Å; E290-R579 IonicContact OE1-NH1 2.71Å; E290-R579 IonicContact OE2-NH1 3.1Å; E290-R579 PolarHBondContact OE2-NH1 3.04Å; M576-R579 WeakPolarHBondContact CE-O 3.48Å; H577-R579 PolarHBondContact O-N 2.82Å
580	Q	77.6	Confident	86.9	Confident	11 Å²	11	28.2 Å²	28.2	5%	0.051	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	146.4	167.2	-63.3	-166.1	-3.8	0	0	110.3	E290 V293 R294 M576 H577 N578 H582	E290-Q580 PolarHBondContact O-NE2 2.83Å; V293-Q580 HydrophobicContact CB-CG 4.28Å; V293-Q580 HydrophobicContact CG1-CG 4Å; R294-Q580 VanDerWaalsContact CG-NE2 3.27Å; M576-Q580 CarbonylContact C-O 3.53Å; M576-Q580 WeakPolarHBondContact CA-O 3.1Å; M576-Q580 WeakPolarHBondContact CB-O 3.44Å; H577-Q580 PolarHBondContact N-O 2.82Å; H577-Q580 PolarHBondContact O-N 3.46Å; N578-Q580 PolarHBondContact O-N 2.75Å; Q580-H582 PolarHBondContact O-CD2 3.47Å
581	V	79.8	Confident	87.1	Confident	30 Å²	30	28.3 Å²	28.3	18%	0.182	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	128	176.2	179.9	0	0	0	0	107.6	P202 L575 M576	P202-V581 VanDerWaalsContact CB-O 3.31Å; P202-V581 WeakPolarHBondContact CB-O 3.37Å; L575-V581 WeakPolarHBondContact O-CA 3Å; M576-V581 HydrophobicContact CE-CG2 4.49Å; M576-V581 HydrophobicContact CG-CB 4.46Å; M576-V581 HydrophobicContact CG-CG2 3.9Å; M576-V581 HydrophobicContact SD-CG2 4.33Å
582	H	80.5	Confident	87.3	Confident	8 Å²	8	27.2 Å²	27.2	4%	0.037	14%	0.141	C	C	.	.			trans	-130.2	146.4	176.5	-64.6	-88.1	0	0	0	110.3	P202 L575 Q580 I584 V585	P202-H582 HydrophobicContact CB-CB 4.36Å; P202-H582 WeakPolarHBondContact CB-ND1 3.49Å; L575-H582 VanDerWaalsContact CB-O 3.26Å; L575-H582 WeakPolarHBondContact CB-O 3.35Å; L575-H582 PolarHBondContact O-N 1.86Å; L575-H582 VanDerWaalsContact O-N 3.17Å; Q580-H582 PolarHBondContact O-CD2 3.47Å; H582-I584 VanDerWaalsContact C-N 3.3Å; H582-V585 HydrophobicContact CB-CG2 4.42Å
583	D	80.2	Confident	87.4	Confident	96 Å²	96	27.2 Å²	27.2	51%	0.513	14%	0.141	S	C	.	.	S	Bend	trans	-74.8	-24.5	174	-60.5	-52.8	0	0	0	112.4	L552 N553	L552-D583 WeakPolarHBondContact CA-O 3.29Å; N553-D583 PolarHBondContact N-O 3.32Å
584	I	87	Confident	87.7	Confident	52 Å²	52	26.2 Å²	26.2	27%	0.267	13%	0.133	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	135.4	-178.5	-43.1	-172.1	0	0	0	110.8	N205 Q550 L551 L552 H582 Y586	N205-I584 PolarHBondContact ND2-O 3.46Å; Q550-I584 HydrophobicContact CB-CG2 4.08Å; L551-I584 VanDerWaalsContact O-CA 3.31Å; L551-I584 WeakPolarHBondContact O-CA 3.34Å; L552-I584 HydrophobicContact CD2-CB 4.15Å; L552-I584 HydrophobicContact CD2-CD1 3.76Å; L552-I584 HydrophobicContact CD2-CG1 3.59Å; L552-I584 HydrophobicContact CD2-CG2 3.81Å; H582-I584 VanDerWaalsContact C-N 3.3Å; I584-Y586 HydrophobicContact CB-CE2 4.36Å; I584-Y586 HydrophobicContact CG2-CD1 4.04Å; I584-Y586 HydrophobicContact CG2-CE1 3.45Å; I584-Y586 VanDerWaalsContact CG2-CE1 3.45Å; I584-Y586 HydrophobicContact CG2-CE2 3.99Å; I584-Y586 VanDerWaalsContact CG2-CZ 3.42Å
585	V	91	Very high	88	Confident	0 Å²	0	25.3 Å²	25.3	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	136.4	171.2	-173.8	0	0	0	0	109.5	V546 Q550 L551 L575 H577 H582 Q589 A591	V546-V585 HydrophobicContact CG2-CG1 4.11Å; Q550-V585 CarbonylContact C-O 3.54Å; Q550-V585 WeakPolarHBondContact CA-O 3.49Å; L551-V585 HydrophobicContact CB-CB 4.42Å; L551-V585 PolarHBondContact N-O 2.94Å; L551-V585 PolarHBondContact O-N 2.61Å; L575-V585 HydrophobicContact CB-CG2 4.34Å; L575-V585 HydrophobicContact CD1-CG2 4.39Å; H577-V585 HydrophobicContact CB-CG1 4.26Å; H577-V585 HydrophobicContact CB-CG2 4.07Å; H582-V585 HydrophobicContact CB-CG2 4.42Å; V585-Q589 HydrophobicContact CG1-CB 3.78Å; V585-A591 HydrophobicContact CG1-CB 3.98Å
586	Y	91.8	Very high	88	Confident	25 Å²	25	28.6 Å²	28.6	10%	0.098	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	161.2	-166	-60.8	-75.8	0	0	0	113.7	N205 R518 V546 Q550 I584 G588 Q589	N205-Y586 HydrophobicContact CB-CE2 4.16Å; N205-Y586 WeakPolarHBondContact O-CE2 3.27Å; R518-Y586 HydrophobicContact CG-CD1 3.6Å; R518-Y586 HydrophobicContact CG-CE1 4.25Å; R518-Y586 HydrophobicContact CG-CG 4.24Å; R518-Y586 PolarHBondContact NH2-OH 3.17Å; V546-Y586 WeakPolarHBondContact CB-O 3.23Å; Q550-Y586 HydrophobicContact CB-CD1 3.86Å; Q550-Y586 HydrophobicContact CB-CE1 4.22Å; Q550-Y586 VanDerWaalsContact OE1-CE1 3.3Å; I584-Y586 HydrophobicContact CB-CE2 4.36Å; I584-Y586 HydrophobicContact CG2-CD1 4.04Å; I584-Y586 HydrophobicContact CG2-CE1 3.45Å; I584-Y586 VanDerWaalsContact CG2-CE1 3.45Å; I584-Y586 HydrophobicContact CG2-CE2 3.99Å; I584-Y586 VanDerWaalsContact CG2-CZ 3.42Å; Y586-G588 PolarHBondContact O-N 2.88Å; Y586-Q589 VanDerWaalsContact O-CB 3.29Å; Y586-Q589 WeakPolarHBondContact O-CB 3.35Å; Y586-Q589 PolarHBondContact O-N 2.89Å
587	A	91.1	Very high	87.9	Confident	3 Å²	3	27.7 Å²	27.7	3%	0.025	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	-47.3	136.4	172.7	0	0	0	0	0	112.5	V546 G549 Q589	V546-A587 HydrophobicContact CG1-CB 4.44Å; G549-A587 WeakPolarHBondContact O-CB 3.36Å; G549-A587 PolarHBondContact O-N 3.48Å; A587-Q589 VanDerWaalsContact C-N 3.34Å
588	G	89.3	Confident	87.4	Confident	4 Å²	4	28.7 Å²	28.7	4%	0.041	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	87.8	-14.8	-173.7	0	0	0	0	0	115	D210 R545 V546 Y586	D210-G588 WeakPolarHBondContact CB-O 3.44Å; D210-G588 PolarHBondContact N-O 3.4Å; D210-G588 VanDerWaalsContact N-O 3.16Å; R545-G588 VanDerWaalsContact CZ-O 3.28Å; R545-G588 PolarHBondContact NE-O 2.86Å; R545-G588 PolarHBondContact NH2-O 2.94Å; V546-G588 PolarHBondContact O-N 3.12Å; Y586-G588 PolarHBondContact O-N 2.88Å
589	Q	91.6	Very high	86.2	Confident	1 Å²	1	32.6 Å²	32.6	1%	0.005	17%	0.167	C	C	.	.			trans	-91.3	147.1	179.5	-62.8	-179.7	-30.6	0	0	113.2	N205 S208 D210 R545 V546 V585 Y586 A587	N205-Q589 PolarHBondContact ND2-OE1 2.98Å; N205-Q589 PolarHBondContact OD1-NE2 3.15Å; S208-Q589 VanDerWaalsContact O-CG 3.32Å; S208-Q589 WeakPolarHBondContact O-CG 3.09Å; S208-Q589 PolarHBondContact O-NE2 2.9Å; D210-Q589 WeakPolarHBondContact OD1-CA 3.48Å; R545-Q589 WeakPolarHBondContact CA-O 3.5Å; R545-Q589 WeakPolarHBondContact CG-O 3.45Å; V546-Q589 PolarHBondContact N-O 2.89Å; V585-Q589 HydrophobicContact CG1-CB 3.78Å; Y586-Q589 VanDerWaalsContact O-CB 3.29Å; Y586-Q589 WeakPolarHBondContact O-CB 3.35Å; Y586-Q589 PolarHBondContact O-N 2.89Å; A587-Q589 VanDerWaalsContact C-N 3.34Å
590	S	92.6	Very high	85	Confident	15 Å²	15	29.2 Å²	29.2	11%	0.105	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	126.9	171.8	-54.5	0	0	0	0	110.9	D210 R263 G544 H577	D210-S590 PolarHBondContact OD1-N 3.14Å; D210-S590 WeakPolarHBondContact OD2-CB 3.3Å; D210-S590 PolarHBondContact OD2-N 3.4Å; D210-S590 PolarHBondContact OD2-OG 2.93Å; R263-S590 PolarHBondContact NH1-OG 2.92Å; R263-S590 VanDerWaalsContact NH1-OG 3.07Å; R263-S590 PolarHBondContact NH2-OG 3.29Å; G544-S590 CarbonylContact O-C 3.59Å; G544-S590 VanDerWaalsContact O-CA 3.28Å; G544-S590 WeakPolarHBondContact O-CA 3.41Å; H577-S590 PolarHBondContact ND1-O 3.19Å
591	A	93.3	Very high	83.8	Confident	2 Å²	2	30.7 Å²	30.7	2%	0.017	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	147.3	-178.4	0	0	0	0	0	112	F525 V543 G544 L551 M576 V585	F525-A591 HydrophobicContact CE2-CB 3.78Å; F525-A591 HydrophobicContact CZ-CB 4.38Å; V543-A591 WeakPolarHBondContact CA-O 3.05Å; G544-A591 PolarHBondContact N-O 3.09Å; G544-A591 PolarHBondContact O-N 3.45Å; L551-A591 HydrophobicContact CD1-CB 4.03Å; M576-A591 WeakPolarHBondContact O-CA 3.02Å; V585-A591 HydrophobicContact CG1-CB 3.98Å
592	S	93.5	Very high	82.6	Confident	33 Å²	33	30.7 Å²	30.7	23%	0.231	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	129.3	162.4	54.7	0	0	0	0	108.8	I542 M576	I542-S592 CarbonylContact O-C 3.58Å; I542-S592 WeakPolarHBondContact O-CA 3.36Å; M576-S592 WeakPolarHBondContact CB-OG 3.27Å; M576-S592 PolarHBondContact N-O 2.78Å; M576-S592 PolarHBondContact O-N 3.32Å; M576-S592 PolarHBondContact O-OG 2.92Å
593	M	92.7	Very high	81.2	Confident	1 Å²	1	34.3 Å²	34.3	1%	0.005	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	139.5	-173.8	59.9	176	70.6	0	0	111.9	F525 V541 I542 L551 I572 S574 L575 V595 L701	F525-M593 HydrophobicContact CD1-CE 3.92Å; F525-M593 HydrophobicContact CD2-CE 4.17Å; F525-M593 HydrophobicContact CE1-CE 3.65Å; F525-M593 HydrophobicContact CE1-SD 4.26Å; F525-M593 HydrophobicContact CE2-CE 3.93Å; F525-M593 HydrophobicContact CG-CE 4.14Å; F525-M593 HydrophobicContact CZ-CE 3.63Å; V541-M593 CarbonylContact C-O 3.29Å; V541-M593 VanDerWaalsContact CA-O 3.26Å; V541-M593 WeakPolarHBondContact CA-O 3.37Å; I542-M593 HydrophobicContact CB-CG 4.08Å; I542-M593 PolarHBondContact N-O 3.03Å; I542-M593 WeakPolarHBondContact O-CG 3.11Å; I542-M593 PolarHBondContact O-N 3.45Å; L551-M593 HydrophobicContact CD1-CE 3.38Å; L551-M593 HydrophobicContact CD2-CE 3.93Å; L551-M593 HydrophobicContact CG-CE 4.3Å; I572-M593 HydrophobicContact CD1-CE 4.47Å; I572-M593 HydrophobicContact CD1-SD 4.42Å; I572-M593 HydrophobicContact CG1-SD 4.4Å; S574-M593 VanDerWaalsContact O-CA 3.25Å; S574-M593 WeakPolarHBondContact O-CA 3.37Å; L575-M593 HydrophobicContact CD2-CB 3.78Å; L575-M593 HydrophobicContact CD2-CE 4.17Å; M593-V595 HydrophobicContact CB-CG2 4.44Å; M593-V595 HydrophobicContact CG-CG2 3.7Å; M593-V595 HydrophobicContact SD-CG2 3.98Å; M593-L701 HydrophobicContact CE-CD1 3.96Å; M593-L701 HydrophobicContact SD-CD1 3.3Å; M593-L701 WeakPolarHBondContact SD-CD1 3.47Å
594	E	92.2	Very high	80.1	Confident	30 Å²	30	33 Å²	33	14%	0.14	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	133.1	165.3	-177.9	-179.2	-175.8	0	0	108.8	V537 S538 N539 V541 V573 S574	V537-E594 HydrophobicContact CG1-CB 4.34Å; V537-E594 HydrophobicContact CG1-CG 3.73Å; V537-E594 WeakPolarHBondContact CG1-OE1 3.2Å; S538-E594 PolarHBondContact OG-OE1 3.13Å; N539-E594 HydrophobicContact CB-CG 3.7Å; N539-E594 WeakPolarHBondContact CB-OE1 3.47Å; N539-E594 PolarHBondContact N-OE1 2.81Å; N539-E594 PolarHBondContact ND2-OE1 2.94Å; V541-E594 HydrophobicContact CG2-CB 4.31Å; V573-E594 HydrophobicContact CB-CB 4.17Å; V573-E594 HydrophobicContact CB-CG 4Å; V573-E594 HydrophobicContact CG1-CG 4.42Å; V573-E594 HydrophobicContact CG2-CG 4.43Å; V573-E594 PolarHBondContact N-O 2.89Å; S574-E594 PolarHBondContact O-N 2.89Å
595	V	90.7	Very high	78.8	Confident	1 Å²	1	31.4 Å²	31.4	1%	0.006	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	121.4	-170.6	-145	0	0	0	0	112.2	P540 I542 V570 Q571 M593	P540-V595 PolarHBondContact O-N 3.21Å; P540-V595 VanDerWaalsContact O-N 3.13Å; I542-V595 HydrophobicContact CB-CG2 4.09Å; I542-V595 HydrophobicContact CD1-CB 4.47Å; I542-V595 HydrophobicContact CD1-CG2 3.79Å; I542-V595 HydrophobicContact CG1-CG2 3.79Å; V570-V595 HydrophobicContact CB-CG1 3.65Å; V570-V595 HydrophobicContact CG2-CG1 3.57Å; Q571-V595 WeakPolarHBondContact O-CA 3.46Å; Q571-V595 WeakPolarHBondContact O-CG1 3.26Å; M593-V595 HydrophobicContact CB-CG2 4.44Å; M593-V595 HydrophobicContact CG-CG2 3.7Å; M593-V595 HydrophobicContact SD-CG2 3.98Å
596	Y	87.3	Confident	77.5	Confident	69 Å²	69	36.6 Å²	36.6	27%	0.271	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	130.1	177.4	178.8	-109.2	0	0	0	110.7	N539 V570 Q571 L598	N539-Y596 WeakPolarHBondContact OD1-CD2 3.04Å; V570-Y596 CarbonylContact C-O 3.52Å; V570-Y596 VanDerWaalsContact CA-O 3.31Å; V570-Y596 WeakPolarHBondContact CA-O 3.33Å; Q571-Y596 PolarHBondContact N-O 2.86Å; Q571-Y596 PolarHBondContact O-N 3.17Å; Y596-L598 HydrophobicContact CD1-CD2 4.08Å; Y596-L598 HydrophobicContact CE1-CD2 4.07Å
597	F	86.3	Confident	75.8	Confident	24 Å²	24	40.2 Å²	40.2	11%	0.105	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	125.1	175.1	-75.8	-91.2	0	0	0	110.4	P540 L559 V570 P692 I693 L695	P540-F597 HydrophobicContact CG-CD2 4.46Å; P540-F597 HydrophobicContact CG-CE2 3.9Å; L559-F597 HydrophobicContact CD2-CE1 3.65Å; L559-F597 HydrophobicContact CD2-CZ 3.74Å; V570-F597 HydrophobicContact CG1-CD1 3.65Å; V570-F597 HydrophobicContact CG1-CE1 3.85Å; V570-F597 HydrophobicContact CG1-CG 4.22Å; F597-P692 HydrophobicContact CB-CG 4.34Å; F597-P692 HydrophobicContact CD1-CG 3.74Å; F597-P692 HydrophobicContact CE1-CG 4.28Å; F597-P692 HydrophobicContact CG-CG 4.15Å; F597-I693 HydrophobicContact CD1-CD1 4.25Å; F597-I693 HydrophobicContact CE1-CD1 3.69Å; F597-L695 HydrophobicContact CE2-CD1 4.35Å; F597-L695 HydrophobicContact CZ-CD1 4.31Å; F597-L695 HydrophobicContact CZ-CD2 4Å; F597-L695 HydrophobicContact CZ-CG 4.16Å
598	L	80	Confident	74.2	Confident	36 Å²	36	48.6 Å²	48.6	19%	0.188	26%	0.259	C	S	.	.	P	Polyproline II helix	trans	-75.4	140.9	176.8	-67.1	171.4	0	0	0	110.1	I556 P569 Y596 K600	I556-L598 HydrophobicContact CD1-CD1 4.05Å; I556-L598 HydrophobicContact CG1-CD1 4.26Å; I556-L598 HydrophobicContact CG2-CD1 3.96Å; P569-L598 HydrophobicContact CB-CD1 4.14Å; P569-L598 HydrophobicContact CG-CB 4.3Å; P569-L598 PolarHBondContact O-N 3.3Å; Y596-L598 HydrophobicContact CD1-CD2 4.08Å; Y596-L598 HydrophobicContact CE1-CD2 4.07Å; L598-K600 PolarHBondContact O-N 3.11Å
599	P	59.7	Low	72.6	Confident	111 Å²	111	51 Å²	51	72%	0.721	27%	0.269	S	S	*	.	S	Bend	trans	-65.7	0.9	-167.8	-25.4	35.4	0	0	0	117.5
600	K	56	Low	71	Confident	62 Å²	62	53.1 Å²	53.1	27%	0.27	28%	0.277	S	S	.	.	S	Bend	trans	-133.5	131.6	-177.8	-60.2	-171.1	-177.2	-169.2	0	110.4	P569 L598 M605	P569-K600 WeakPolarHBondContact CG-O 3.43Å; L598-K600 PolarHBondContact O-N 3.11Å; K600-M605 HydrophobicContact CB-CE 3.98Å; K600-M605 HydrophobicContact CB-CG 3.87Å; K600-M605 HydrophobicContact CD-CG 4.28Å
601	S	54	Low	69.2	Low	42 Å²	42	57.3 Å²	57.3	29%	0.294	30%	0.295	S	S	.	.			trans	-67.7	157.4	164.9	62.2	0	0	0	0	110.4	N603 S604 M605	S601-N603 PolarHBondContact O-N 3.01Å; S601-N603 VanDerWaalsContact O-N 3.16Å; S601-S604 PolarHBondContact O-N 3.18Å; S601-M605 PolarHBondContact O-N 2.83Å
602	W	53.6	Low	67.3	Low	30 Å²	30	62.6 Å²	62.6	11%	0.114	32%	0.322	C	S	.	.	G	3₁₀ helix	trans	-51.2	-40.2	176.9	-175.5	-112.5	0	0	0	112.9	W558 S604 M605 R610 Y704	W558-W602 HydrophobicContact CH2-CB 3.54Å; W558-W602 AromaticContact CH2-CD2 3.81Å; W558-W602 HydrophobicContact CH2-CD2 3.81Å; W558-W602 AromaticContact CH2-CE3 3.31Å; W558-W602 HydrophobicContact CH2-CE3 3.31Å; W558-W602 AromaticContact CH2-CG 3.96Å; W558-W602 HydrophobicContact CH2-CG 3.96Å; W558-W602 HydrophobicContact CH2-CZ3 4.2Å; W558-W602 HydrophobicContact CZ2-CD2 4.06Å; W558-W602 AromaticContact CZ2-CE3 3.27Å; W558-W602 HydrophobicContact CZ2-CE3 3.27Å; W558-W602 AromaticContact CZ2-CZ3 3.69Å; W558-W602 HydrophobicContact CZ2-CZ3 3.69Å; W558-W602 HydrophobicContact CZ3-CB 3.68Å; W558-W602 HydrophobicContact CZ3-CE3 4.43Å; W558-W602 HydrophobicContact CZ3-CG 4.35Å; W602-S604 PolarHBondContact O-N 2.92Å; W602-M605 PolarHBondContact O-N 3.47Å; W602-R610 HydrophobicContact CD2-CG 4.45Å; W602-R610 HydrophobicContact CE3-CG 4.06Å; W602-R610 HydrophobicContact CH2-CB 3.87Å; W602-R610 HydrophobicContact CH2-CG 3.89Å; W602-R610 HydrophobicContact CZ2-CB 4.47Å; W602-R610 HydrophobicContact CZ2-CG 4.19Å; W602-R610 HydrophobicContact CZ3-CB 4.01Å; W602-R610 HydrophobicContact CZ3-CG 3.81Å; W602-R610 PolarHBondContact O-NE 3.1Å; W602-R610 PolarHBondContact O-NH2 2.86Å; W602-Y704 AromaticContact CH2-CD2 3.93Å; W602-Y704 HydrophobicContact CH2-CD2 3.93Å; W602-Y704 AromaticContact CH2-CE2 3.24Å; W602-Y704 HydrophobicContact CH2-CE2 3.24Å; W602-Y704 AromaticContact CH2-CZ 3.71Å; W602-Y704 HydrophobicContact CZ2-CD2 4.4Å; W602-Y704 AromaticContact CZ2-CE2 3.37Å; W602-Y704 HydrophobicContact CZ2-CE2 3.37Å; W602-Y704 AromaticContact CZ2-CZ 3.79Å; W602-Y704 WeakPolarHBondContact CZ2-OH 3.26Å; W602-Y704 HydrophobicContact CZ3-CD2 4.3Å; W602-Y704 HydrophobicContact CZ3-CE2 4Å
603	N	51.7	Low	65.4	Low	83 Å²	83	62 Å²	62	44%	0.444	32%	0.317	S	S	.	.	G	3₁₀ helix	trans	-72.7	-17.3	-177.4	-60	-12.9	0	0	0	112.6	S601 M954	S601-N603 PolarHBondContact O-N 3.01Å; S601-N603 VanDerWaalsContact O-N 3.16Å; N603-M954 WeakPolarHBondContact OD1-CE 3.49Å
604	S	57.1	Low	63.3	Low	69 Å²	69	63.5 Å²	63.5	48%	0.483	33%	0.325	S	S	.	.	G	3₁₀ helix	trans	-99.1	1.2	175.9	-175.2	0	0	0	0	113.5	S601 W602	S601-S604 PolarHBondContact O-N 3.18Å; W602-S604 PolarHBondContact O-N 2.92Å
605	M	59.2	Low	61	Low	18 Å²	18	68.1 Å²	68.1	9%	0.089	35%	0.346	C	S	.	.	S	Bend	trans	-94.1	127	176.2	-71	-179.7	168.6	0	0	110.9	P569 K600 S601 W602 Q609 R610 I613	P569-M605 HydrophobicContact CG-CE 4.12Å; K600-M605 HydrophobicContact CB-CE 3.98Å; K600-M605 HydrophobicContact CB-CG 3.87Å; K600-M605 HydrophobicContact CD-CG 4.28Å; S601-M605 PolarHBondContact O-N 2.83Å; W602-M605 PolarHBondContact O-N 3.47Å; M605-Q609 HydrophobicContact CB-CB 4.26Å; M605-R610 HydrophobicContact CB-CG 3.94Å; M605-R610 PolarHBondContact O-NE 2.89Å; M605-R610 VanDerWaalsContact O-NE 3.16Å; M605-I613 HydrophobicContact CE-CD1 3.63Å; M605-I613 HydrophobicContact SD-CD1 3.59Å; M605-I613 VanDerWaalsContact SD-CD1 3.59Å
606	N	63.1	Low	58.8	Low	109 Å²	109	70.6 Å²	70.6	58%	0.583	36%	0.363	S	S	*	.			trans	-64.2	155.1	170.3	-56.6	35.6	0	0	0	110.2	K608 Q609 R610	N606-K608 VanDerWaalsContact C-N 3.29Å; N606-K608 PolarHBondContact O-N 3.22Å; N606-K608 VanDerWaalsContact O-N 3.16Å; N606-Q609 WeakPolarHBondContact O-CA 3.39Å; N606-Q609 WeakPolarHBondContact O-CB 3.47Å; N606-Q609 PolarHBondContact O-N 3.45Å; N606-R610 PolarHBondContact O-N 3.14Å; N606-R610 VanDerWaalsContact O-N 3.09Å
607	D	56.7	Low	56.6	Low	102 Å²	102	69 Å²	69	55%	0.545	36%	0.359	S	S	.	.	H	α-helix	trans	-62	-32.3	-173.1	-56.3	-56.6	0	0	0	113.9	Q609 R610 Q611	D607-Q609 VanDerWaalsContact C-N 3.3Å; D607-Q609 PolarHBondContact O-N 2.74Å; D607-R610 WeakPolarHBondContact O-CB 3.17Å; D607-R610 PolarHBondContact O-N 3.48Å; D607-R610 IonicContact OD1-CZ 2.68Å; D607-R610 IonicContact OD1-NH1 3.96Å; D607-R610 PolarHBondContact OD1-NH1 2.94Å; D607-Q611 WeakPolarHBondContact O-CB 3.02Å; D607-Q611 VanDerWaalsContact O-CG 3.28Å; D607-Q611 WeakPolarHBondContact O-CG 3.26Å; D607-Q611 PolarHBondContact O-N 2.87Å
608	K	57.2	Low	54.1	Low	179 Å²	179	71.4 Å²	71.4	78%	0.778	38%	0.378	S	S	*	.	H	α-helix	trans	-59.9	-36.4	169.9	-70.9	-176.1	177.7	178.9	0	113.1	N606 N612	N606-K608 VanDerWaalsContact C-N 3.29Å; N606-K608 PolarHBondContact O-N 3.22Å; N606-K608 VanDerWaalsContact O-N 3.16Å; K608-N612 WeakPolarHBondContact O-CB 3.38Å; K608-N612 VanDerWaalsContact O-CG 3.24Å; K608-N612 PolarHBondContact O-N 3.43Å; K608-N612 PolarHBondContact O-OD1 3.33Å
609	Q	55.8	Low	51.8	Low	54 Å²	54	73.1 Å²	73.1	25%	0.252	39%	0.393	S	S	.	.	H	α-helix	trans	-72	-40.4	176.6	-70.9	167.5	6.7	0	0	110.8	M605 N606 D607 I613	M605-Q609 HydrophobicContact CB-CB 4.26Å; N606-Q609 WeakPolarHBondContact O-CA 3.39Å; N606-Q609 WeakPolarHBondContact O-CB 3.47Å; N606-Q609 PolarHBondContact O-N 3.45Å; D607-Q609 VanDerWaalsContact C-N 3.3Å; D607-Q609 PolarHBondContact O-N 2.74Å; Q609-I613 WeakPolarHBondContact O-CG1 3.41Å; Q609-I613 PolarHBondContact O-N 3.29Å
610	R	58.2	Low	50.6	Low	46 Å²	46	71.2 Å²	71.2	17%	0.174	38%	0.383	C	S	.	.	H	α-helix	trans	-58.9	-52.3	171.8	-61.9	176.7	176.7	160.3	-7.6	110.6	W602 M605 N606 D607 N612 I613 L614	W602-R610 HydrophobicContact CD2-CG 4.45Å; W602-R610 HydrophobicContact CE3-CG 4.06Å; W602-R610 HydrophobicContact CH2-CB 3.87Å; W602-R610 HydrophobicContact CH2-CG 3.89Å; W602-R610 HydrophobicContact CZ2-CB 4.47Å; W602-R610 HydrophobicContact CZ2-CG 4.19Å; W602-R610 HydrophobicContact CZ3-CB 4.01Å; W602-R610 HydrophobicContact CZ3-CG 3.81Å; W602-R610 PolarHBondContact O-NE 3.1Å; W602-R610 PolarHBondContact O-NH2 2.86Å; M605-R610 HydrophobicContact CB-CG 3.94Å; M605-R610 PolarHBondContact O-NE 2.89Å; M605-R610 VanDerWaalsContact O-NE 3.16Å; N606-R610 PolarHBondContact O-N 3.14Å; N606-R610 VanDerWaalsContact O-N 3.09Å; D607-R610 WeakPolarHBondContact O-CB 3.17Å; D607-R610 PolarHBondContact O-N 3.48Å; D607-R610 IonicContact OD1-CZ 2.68Å; D607-R610 IonicContact OD1-NH1 3.96Å; D607-R610 PolarHBondContact OD1-NH1 2.94Å; R610-N612 PolarHBondContact O-N 2.8Å; R610-I613 WeakPolarHBondContact O-CB 3.35Å; R610-I613 PolarHBondContact O-N 3.39Å; R610-I613 VanDerWaalsContact O-N 3.1Å; R610-L614 VanDerWaalsContact O-CG 3.31Å; R610-L614 WeakPolarHBondContact O-CG 3.35Å; R610-L614 PolarHBondContact O-N 3.01Å
611	Q	54.1	Low	49.6	Very low	102 Å²	102	72.7 Å²	72.7	48%	0.477	40%	0.397	S	S	.	.	H	α-helix	trans	-59.8	-40.6	179.8	-69.7	-66	-0.5	0	0	113.2	D607 I613 L614 H615	D607-Q611 WeakPolarHBondContact O-CB 3.02Å; D607-Q611 VanDerWaalsContact O-CG 3.28Å; D607-Q611 WeakPolarHBondContact O-CG 3.26Å; D607-Q611 PolarHBondContact O-N 2.87Å; Q611-I613 VanDerWaalsContact C-N 3.32Å; Q611-I613 PolarHBondContact O-N 2.91Å; Q611-L614 PolarHBondContact O-N 2.8Å; Q611-H615 PolarHBondContact O-CD2 3.32Å; Q611-H615 VanDerWaalsContact O-CD2 3.3Å; Q611-H615 PolarHBondContact O-N 3.07Å
612	N	54.2	Low	48.5	Very low	113 Å²	113	75.1 Å²	75.1	60%	0.604	41%	0.414	S	S	*	.	H	α-helix	trans	-62.5	-38.6	175.2	-74.1	-6.4	0	0	0	112.5	K608 R610 S616	K608-N612 WeakPolarHBondContact O-CB 3.38Å; K608-N612 VanDerWaalsContact O-CG 3.24Å; K608-N612 PolarHBondContact O-N 3.43Å; K608-N612 PolarHBondContact O-OD1 3.33Å; R610-N612 PolarHBondContact O-N 2.8Å; N612-S616 PolarHBondContact O-N 3.28Å; N612-S616 VanDerWaalsContact O-N 3.14Å
613	I	52.8	Low	47.3	Very low	21 Å²	21	80.8 Å²	80.8	11%	0.108	45%	0.446	C	S	.	.	H	α-helix	trans	-66	-43.4	173.6	-65.9	165.3	0	0	0	110	M605 Q609 R610 Q611 H615 S616 I617	M605-I613 HydrophobicContact CE-CD1 3.63Å; M605-I613 HydrophobicContact SD-CD1 3.59Å; M605-I613 VanDerWaalsContact SD-CD1 3.59Å; Q609-I613 WeakPolarHBondContact O-CG1 3.41Å; Q609-I613 PolarHBondContact O-N 3.29Å; R610-I613 WeakPolarHBondContact O-CB 3.35Å; R610-I613 PolarHBondContact O-N 3.39Å; R610-I613 VanDerWaalsContact O-N 3.1Å; Q611-I613 VanDerWaalsContact C-N 3.32Å; Q611-I613 PolarHBondContact O-N 2.91Å; I613-H615 PolarHBondContact O-N 2.82Å; I613-S616 PolarHBondContact O-N 3.09Å; I613-S616 VanDerWaalsContact O-N 3.14Å; I613-S616 PolarHBondContact O-OG 3.4Å; I613-I617 HydrophobicContact CG2-CD1 4Å; I613-I617 WeakPolarHBondContact O-CG1 3.27Å; I613-I617 PolarHBondContact O-N 2.68Å; I613-I617 VanDerWaalsContact O-N 3.14Å
614	L	50.3	Low	46.2	Very low	33 Å²	33	81.5 Å²	81.5	17%	0.173	46%	0.457	C	S	.	.	H	α-helix	trans	-61.4	-40.9	176.5	-63.5	172.8	0	0	0	112.9	R610 Q611 S616 I617 S618 Y704	R610-L614 VanDerWaalsContact O-CG 3.31Å; R610-L614 WeakPolarHBondContact O-CG 3.35Å; R610-L614 PolarHBondContact O-N 3.01Å; Q611-L614 PolarHBondContact O-N 2.8Å; L614-S616 VanDerWaalsContact C-N 3.33Å; L614-S616 PolarHBondContact O-N 2.96Å; L614-I617 PolarHBondContact O-N 3.1Å; L614-I617 VanDerWaalsContact O-N 3.17Å; L614-S618 PolarHBondContact O-N 3.06Å; L614-S618 PolarHBondContact O-OG 2.76Å; L614-Y704 HydrophobicContact CD1-CE1 4.42Å; L614-Y704 HydrophobicContact CD2-CD1 3.17Å; L614-Y704 HydrophobicContact CD2-CD2 4.29Å; L614-Y704 HydrophobicContact CD2-CE1 3.33Å; L614-Y704 HydrophobicContact CD2-CE2 4.43Å; L614-Y704 HydrophobicContact CD2-CG 3.67Å
615	H	43.6	Very low	44.7	Very low	127 Å²	127	85.3 Å²	85.3	59%	0.588	47%	0.471	S	S	*	.	H	α-helix	trans	-65	-33.3	173.9	-84.7	-72.9	0	0	0	112.9	Q611 I613 I617 S618 S619	Q611-H615 PolarHBondContact O-CD2 3.32Å; Q611-H615 VanDerWaalsContact O-CD2 3.3Å; Q611-H615 PolarHBondContact O-N 3.07Å; I613-H615 PolarHBondContact O-N 2.82Å; H615-I617 VanDerWaalsContact C-N 3.3Å; H615-I617 PolarHBondContact O-N 2.58Å; H615-S618 PolarHBondContact O-N 3.31Å; H615-S619 PolarHBondContact O-N 2.73Å; H615-S619 VanDerWaalsContact O-N 3.11Å; H615-S619 PolarHBondContact O-OG 3.49Å
616	S	44.9	Very low	43.2	Very low	52 Å²	52	90.8 Å²	90.8	36%	0.364	51%	0.506	S	S	.	.	H	α-helix	trans	-68.6	-28.1	173	77.7	0	0	0	0	113.3	N612 I613 L614 S619 S620	N612-S616 PolarHBondContact O-N 3.28Å; N612-S616 VanDerWaalsContact O-N 3.14Å; I613-S616 PolarHBondContact O-N 3.09Å; I613-S616 VanDerWaalsContact O-N 3.14Å; I613-S616 PolarHBondContact O-OG 3.4Å; L614-S616 VanDerWaalsContact C-N 3.33Å; L614-S616 PolarHBondContact O-N 2.96Å; S616-S619 PolarHBondContact O-OG 3.25Å; S616-S620 PolarHBondContact O-OG 3.06Å
617	I	41.1	Very low	41.4	Very low	37 Å²	37	90.7 Å²	90.7	19%	0.19	51%	0.514	C	S	.	.	H	α-helix	trans	-78.5	-35.1	175.1	-64.1	162.7	0	0	0	111	I613 L614 H615 S620 T621	I613-I617 HydrophobicContact CG2-CD1 4Å; I613-I617 WeakPolarHBondContact O-CG1 3.27Å; I613-I617 PolarHBondContact O-N 2.68Å; I613-I617 VanDerWaalsContact O-N 3.14Å; L614-I617 PolarHBondContact O-N 3.1Å; L614-I617 VanDerWaalsContact O-N 3.17Å; H615-I617 VanDerWaalsContact C-N 3.3Å; H615-I617 PolarHBondContact O-N 2.58Å; I617-S620 PolarHBondContact O-OG 3.12Å; I617-T621 PolarHBondContact O-OG1 2.65Å
618	S	32.4	Very low	39.9	Very low	73 Å²	73	89.8 Å²	89.8	51%	0.51	52%	0.516	S	S	.	.	H	α-helix	trans	-74.3	-28.2	179.3	-53.1	0	0	0	0	113.4	L614 H615 T621	L614-S618 PolarHBondContact O-N 3.06Å; L614-S618 PolarHBondContact O-OG 2.76Å; H615-S618 PolarHBondContact O-N 3.31Å; S618-T621 PolarHBondContact O-OG1 3.15Å
619	S	31.4	Very low	38.4	Very low	72 Å²	72	86.6 Å²	86.6	50%	0.503	52%	0.516	S	S	.	.	H	α-helix	trans	-84.8	-17.2	179.8	45	0	0	0	0	114.1	H615 S616	H615-S619 PolarHBondContact O-N 2.73Å; H615-S619 VanDerWaalsContact O-N 3.11Å; H615-S619 PolarHBondContact O-OG 3.49Å; S616-S619 PolarHBondContact O-OG 3.25Å
620	S	34.7	Very low	37	Very low	72 Å²	72	95.3 Å²	95.3	50%	0.503	55%	0.548	S	S	.	.	S	Bend	trans	-89.7	-9.3	176.3	40.5	0	0	0	0	113.7	S616 I617	S616-S620 PolarHBondContact O-OG 3.06Å; I617-S620 PolarHBondContact O-OG 3.12Å
621	T	35.2	Very low	35.5	Very low	93 Å²	93	101.2 Å²	101.2	57%	0.571	57%	0.57	S	S	*	*	S	Bend	trans	-102.4	-8.8	-175.2	37.1	0	0	0	0	114.8	I617 S618	I617-T621 PolarHBondContact O-OG1 2.65Å; S618-T621 PolarHBondContact O-OG1 3.15Å
622	S	31	Very low	34.2	Very low	92 Å²	92	102.7 Å²	102.7	64%	0.643	59%	0.587	S	S	*	*	S	Bend	trans	-93.1	2.6	-179.2	55.4	0	0	0	0	115.4
623	L	29.4	Very low	32.9	Very low	150 Å²	150	105.5 Å²	105.5	79%	0.785	60%	0.598	S	S	*	*	S	Bend	trans	-106.3	9.6	-170.9	-82.6	158.2	0	0	0	115.1
624	S	26.9	Very low	31.7	Very low	97 Å²	97	111.9 Å²	111.9	68%	0.678	63%	0.633	S	S	*	*	S	Bend	trans	-106.4	8.5	-174.7	54.7	0	0	0	0	115.4
625	L	26.5	Very low	30.6	Very low	149 Å²	149	117.3 Å²	117.3	78%	0.78	66%	0.662	S	S	*	*	S	Bend	trans	-118.4	134.7	175.7	-74.4	161.4	0	0	0	110.5
626	T	27.4	Very low	30	Very low	133 Å²	133	119.4 Å²	119.4	82%	0.816	67%	0.671	S	S	*	*			trans	75.5	108.7	-172.1	73.8	0	0	0	0	116.1
627	S	24.9	Very low	29.3	Very low	107 Å²	107	124.1 Å²	124.1	75%	0.748	69%	0.686	S	S	*	*	S	Bend	trans	-57.2	142	156.8	48.9	0	0	0	0	110.5
628	S	24.8	Very low	28.7	Very low	84 Å²	84	131.9 Å²	131.9	59%	0.587	72%	0.718	S	S	*	*			trans	87.6	59.3	177	77.9	0	0	0	0	118.9
629	S	27.6	Very low	28.6	Very low	112 Å²	112	132.5 Å²	132.5	78%	0.783	72%	0.722	S	S	*	*			trans	-157.1	65.5	150.7	-87.9	0	0	0	0	114.8	R631	S629-R631 PolarHBondContact O-N 3.45Å
630	Y	25.3	Very low	28.5	Very low	236 Å²	236	138.8 Å²	138.8	93%	0.925	74%	0.741	S	S	*	*			trans	-81.9	85.5	159.5	-85	-78	0	0	0	110.3
631	R	27.1	Very low	28.2	Very low	170 Å²	170	140.4 Å²	140.4	64%	0.642	75%	0.752	S	S	*	*			trans	-133.9	106.7	166.5	-83.1	-172	168	-177.7	-4.5	111.5	L67 S629	L67-R631 PolarHBondContact O-NH2 3.25Å; S629-R631 PolarHBondContact O-N 3.45Å
632	T	26.8	Very low	27.8	Very low	133 Å²	133	143.4 Å²	143.4	82%	0.816	76%	0.764	S	S	*	*			trans	44.9	92.1	148.3	55.4	0	0	0	0	118
633	M	27	Very low	27.6	Very low	173 Å²	173	147.5 Å²	147.5	85%	0.852	77%	0.77	S	S	*	*			trans	-127.8	65.7	156.9	-80.3	-66.6	176.4	0	0	110.8
634	N	26.8	Very low	27.4	Very low	154 Å²	154	143.8 Å²	143.8	82%	0.824	77%	0.768	S	S	*	*			trans	-88	87.9	157.7	-87.2	-19.6	0	0	0	107.3
635	D	28.5	Very low	27.3	Very low	147 Å²	147	144.3 Å²	144.3	79%	0.786	77%	0.772	S	S	*	*			trans	-170.6	36.5	161	-101.9	-22.9	0	0	0	116.4
636	H	31.1	Very low	27.4	Very low	171 Å²	171	145.2 Å²	145.2	79%	0.792	78%	0.778	S	S	*	*			trans	-131.3	66.7	169.3	-75.8	-65.9	0	0	0	113
637	K	29	Very low	27.3	Very low	152 Å²	152	145.7 Å²	145.7	66%	0.661	78%	0.775	S	S	*	*			trans	-119.4	22.7	174.1	-107.4	-167.6	-174.3	-175.2	0	114	S78	S78-K637 PolarHBondContact O-NZ 3.19Å; S78-K637 WeakPolarHBondContact OG-CD 3.36Å; S78-K637 PolarHBondContact OG-NZ 3.31Å
638	K	29	Very low	27.7	Very low	200 Å²	200	147.5 Å²	147.5	87%	0.87	78%	0.776	S	S	*	*	S	Bend	trans	-119.1	6.5	-173.1	-98	-174.3	175.5	-178.2	0	116.3
639	S	29.7	Very low	27.9	Very low	86 Å²	86	149.4 Å²	149.4	60%	0.601	78%	0.78	S	S	*	*	S	Bend	trans	-123.2	39.9	-170.1	60.9	0	0	0	0	114.8
640	F	29.5	Very low	28	Very low	203 Å²	203	150.8 Å²	150.8	89%	0.89	78%	0.779	S	S	*	*	S	Bend	trans	-142.1	16.6	168.7	-100.3	-74.6	0	0	0	114.7
641	S	28.1	Very low	28.4	Very low	106 Å²	106	146.1 Å²	146.1	74%	0.741	77%	0.77	S	S	*	*			trans	-104	73.3	171.3	56.9	0	0	0	0	110.3
642	L	27.4	Very low	28.5	Very low	156 Å²	156	144.4 Å²	144.4	82%	0.817	77%	0.773	S	S	*	*			trans	-143.9	48.6	-176.9	-109.9	163.1	0	0	0	112
643	F	26.1	Very low	28.6	Very low	179 Å²	179	144.4 Å²	144.4	79%	0.785	77%	0.768	S	S	*	*	S	Bend	trans	-143.4	93.9	163.9	-79.7	-72.4	0	0	0	108.5
644	G	25.2	Very low	28.8	Very low	71 Å²	71	142 Å²	142	73%	0.732	76%	0.763	S	S	*	*	S	Bend	trans	157.9	129.8	179.4	0	0	0	0	0	111.7
645	S	26.1	Very low	28.8	Very low	109 Å²	109	139.6 Å²	139.6	76%	0.762	76%	0.757	S	S	*	*			trans	64.5	89.6	169.6	-55.9	0	0	0	0	117.9
646	N	27.6	Very low	28.7	Very low	168 Å²	168	138.8 Å²	138.8	90%	0.898	75%	0.753	S	S	*	*			trans	-106.8	101	139.3	-87.1	9.2	0	0	0	107
647	N	26.2	Very low	28.7	Very low	143 Å²	143	136.4 Å²	136.4	77%	0.765	75%	0.746	S	S	*	*			trans	-113.4	107.3	165.2	-80	9.8	0	0	0	107.5
648	N	32.1	Very low	28.8	Very low	145 Å²	145	135.3 Å²	135.3	78%	0.775	75%	0.747	S	S	*	*			trans	-136.7	143.7	152.8	-68.9	36	0	0	0	103.5
649	D	30.8	Very low	28.8	Very low	124 Å²	124	131.8 Å²	131.8	66%	0.663	74%	0.738	S	S	*	*			cis	-176.8	153.3	-12	-96.4	-34.9	0	0	0	103.3
650	N	29	Very low	28.9	Very low	141 Å²	141	133.8 Å²	133.8	75%	0.754	74%	0.742	S	S	*	*			trans	77.5	147.6	159	-55.5	-19.8	0	0	0	121.3
651	D	33.2	Very low	28.9	Very low	138 Å²	138	130.5 Å²	130.5	74%	0.738	73%	0.734	S	S	*	*			trans	80.2	83	155.9	-52.4	-19.2	0	0	0	119.8
652	D	30.4	Very low	29	Very low	133 Å²	133	132 Å²	132	71%	0.711	74%	0.743	S	S	*	*				68.4	114.2	110.8	-79.5	16.1	0	0	0	122.4
653	N	28.4	Very low	29.1	Very low	133 Å²	133	130.8 Å²	130.8	71%	0.711	74%	0.742	S	S	*	*				87.9	119.9	124.3	-74	-40.9	0	0	0	122.3
654	V	29.9	Very low	29.4	Very low	122 Å²	122	125.5 Å²	125.5	74%	0.739	74%	0.738	S	S	*	*			trans	82.6	92.6	138.4	-178.3	0	0	0	0	118.5
655	C	26.6	Very low	29.7	Very low	105 Å²	105	129.5 Å²	129.5	71%	0.709	74%	0.743	S	S	*	*				47.3	128.7	116.8	-58.5	0	0	0	0	122.5
656	N	28.3	Very low	29.9	Very low	129 Å²	129	133.1 Å²	133.1	69%	0.69	75%	0.747	S	S	*	*				107.1	127	125.5	-84.9	40.1	0	0	0	121.7
657	D	30.1	Very low	30.2	Very low	122 Å²	122	131.5 Å²	131.5	65%	0.652	74%	0.735	S	S	*	*			trans	76.3	113.7	136	-51.8	-15.4	0	0	0	122.1
658	D	31.2	Very low	30.3	Very low	129 Å²	129	131.1 Å²	131.1	69%	0.69	73%	0.732	S	S	*	*				75	110.6	123	-71.2	1.2	0	0	0	123.6
659	N	29.8	Very low	30.3	Very low	126 Å²	126	131.2 Å²	131.2	67%	0.674	73%	0.731	S	S	*	*				86.1	139.7	121.1	-67.3	-35.2	0	0	0	123.3
660	D	30.8	Very low	30.2	Very low	127 Å²	127	130.9 Å²	130.9	68%	0.679	74%	0.736	S	S	*	*			trans	78	100.3	146.9	-70.2	-36.8	0	0	0	123.1
661	N	30.1	Very low	30	Very low	134 Å²	134	133.8 Å²	133.8	72%	0.717	75%	0.745	S	S	*	*				54.8	120	115.4	-73.4	-47.4	0	0	0	120.6
662	C	30.1	Very low	30	Very low	138 Å²	138	134.2 Å²	134.2	93%	0.932	75%	0.747	S	S	*	*				-157.4	156.5	123.9	-103.3	0	0	0	0	113.2
663	T	30.1	Very low	30	Very low	131 Å²	131	134 Å²	134	80%	0.804	75%	0.746	S	S	*	*			trans	-117.5	153.4	-160.5	50.7	0	0	0	0	114.6
664	G	32.2	Very low	29.8	Very low	68 Å²	68	137.9 Å²	137.9	70%	0.701	76%	0.757	S	S	*	*			trans	175.3	91.6	164.5	0	0	0	0	0	114.9
665	N	30.1	Very low	29.8	Very low	155 Å²	155	141.1 Å²	141.1	83%	0.829	76%	0.761	S	S	*	*				31.5	138.9	112.6	-56.5	0.7	0	0	0	117.9
666	E	30.8	Very low	29.8	Very low	185 Å²	185	143.8 Å²	143.8	86%	0.864	77%	0.768	S	S	*	*			cis	-137.3	-176.9	9.5	-64.3	-167.8	111.6	0	0	109.6
667	E	33.3	Very low	29.9	Very low	134 Å²	134	143.4 Å²	143.4	63%	0.626	77%	0.77	S	S	*	*			cis	-141.5	-146.8	5.2	-148	-94.6	94	0	0	109.1
668	N	29.7	Very low	29.6	Very low	135 Å²	135	145.7 Å²	145.7	72%	0.722	78%	0.782	S	S	*	*			trans	-131.5	174.3	-170.1	-63.7	-87.4	0	0	0	114.9
669	I	31.5	Very low	29.4	Very low	146 Å²	146	143.6 Å²	143.6	75%	0.749	78%	0.778	S	S	*	*			trans	136.7	121.2	135.2	-70.1	159.6	0	0	0	111.9
670	P	29.2	Very low	29.2	Very low	118 Å²	118	145.5 Å²	145.5	77%	0.766	79%	0.787	S	S	*	*				-134.3	136.6	-57.7	34.4	-14.7	0	0	0	113.5
671	Q	25	Very low	28.9	Very low	201 Å²	201	144.9 Å²	144.9	94%	0.939	79%	0.793	S	S	*	*			trans	-99.6	137.9	165	-76.4	-167.2	1	0	0	111.7
672	N	33.1	Very low	28.7	Very low	147 Å²	147	141.9 Å²	141.9	79%	0.786	78%	0.782	S	S	*	*			trans	-96.7	107.3	-164.9	-141.3	-3.7	0	0	0	112.9
673	N	29.1	Very low	28.6	Very low	128 Å²	128	141.3 Å²	141.3	68%	0.684	78%	0.777	S	S	*	*			trans	57.2	97.4	150.2	-63.6	-30.1	0	0	0	120.3
674	K	25.2	Very low	28.6	Very low	215 Å²	215	139 Å²	139	94%	0.935	77%	0.766	S	S	*	*			trans	-89.7	133.7	135.2	-79.4	-177.9	175.9	178	0	108.9
675	K	30.4	Very low	28.4	Very low	191 Å²	191	141.6 Å²	141.6	83%	0.83	76%	0.764	S	S	*	*			trans	-122.7	137.2	164.8	-86.6	-170.9	174.7	-176.5	0	110.1
676	N	25.5	Very low	28.3	Very low	160 Å²	160	141 Å²	141	86%	0.856	76%	0.759	S	S	*	*			trans	-31.3	128.6	178	-53.2	-13.8	0	0	0	116.4
677	V	30.2	Very low	28.1	Very low	122 Å²	122	141.2 Å²	141.2	74%	0.739	75%	0.753	S	S	*	*			trans	-142.8	106.3	139.4	-175.6	0	0	0	0	108.6
678	N	25.4	Very low	27.9	Very low	169 Å²	169	141.4 Å²	141.4	90%	0.904	75%	0.754	S	S	*	*			trans	-88.7	95.9	162.6	-80.6	-9.7	0	0	0	108.1
679	S	26.3	Very low	28.4	Very low	85 Å²	85	141.7 Å²	141.7	59%	0.594	75%	0.749	S	S	*	*	S	Bend	trans	176.1	140.2	157.7	28.6	0	0	0	0	112
680	L	24.4	Very low	29.2	Very low	166 Å²	166	143.9 Å²	143.9	87%	0.869	75%	0.75	S	S	*	*			trans	37.8	101.3	156.7	-76.5	71.6	0	0	0	118.5
681	S	26.2	Very low	30.5	Very low	114 Å²	114	140.4 Å²	140.4	80%	0.797	73%	0.728	S	S	*	*			trans	-162	157.2	134.1	-0.1	0	0	0	0	112.1
682	S	26	Very low	32.2	Very low	71 Å²	71	135 Å²	135	50%	0.497	71%	0.71	S	S	.	*			trans	-59.4	153.7	-171.7	37.6	0	0	0	0	116.3	S684	S682-S684 PolarHBondContact O-N 2.81Å; S682-S684 PolarHBondContact OG-OG 3.41Å
683	P	27.1	Very low	34.4	Very low	127 Å²	127	128.7 Å²	128.7	83%	0.825	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66	14.1	173.7	-20.2	33	0	0	0	116.4
684	S	29.3	Very low	37.1	Very low	81 Å²	81	131.6 Å²	131.6	57%	0.566	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84	-18.3	-171.1	47.9	0	0	0	0	114.8	S682	S682-S684 PolarHBondContact O-N 2.81Å; S682-S684 PolarHBondContact OG-OG 3.41Å
685	D	28.6	Very low	40.1	Very low	123 Å²	123	122.2 Å²	122.2	66%	0.658	64%	0.643	S	S	*	*	S	Bend	trans	-106.5	10.2	-159.4	-58.7	-8.5	0	0	0	114
686	I	28.2	Very low	43	Very low	143 Å²	143	115 Å²	115	73%	0.733	61%	0.61	S	S	*	*	S	Bend	trans	-102.6	-6.6	-168.9	-65.5	178	0	0	0	114.1
687	Y	27	Very low	45.9	Very low	190 Å²	190	114.9 Å²	114.9	75%	0.745	60%	0.598	S	S	*	*			trans	-105.9	55.3	177.6	-72.1	-74.6	0	0	0	114.4	F689	Y687-F689 VanDerWaalsContact C-N 3.33Å; Y687-F689 HydrophobicContact CD1-CD2 4.35Å; Y687-F689 AromaticContact CD1-CE2 3.71Å; Y687-F689 HydrophobicContact CD1-CE2 3.71Å; Y687-F689 HydrophobicContact CD1-CZ 4.3Å; Y687-F689 HydrophobicContact CE1-CE2 4.49Å; Y687-F689 HydrophobicContact CG-CE2 4.37Å; Y687-F689 PolarHBondContact O-N 2.86Å; Y687-F689 VanDerWaalsContact O-N 3.07Å
688	Q	29	Very low	48.5	Very low	137 Å²	137	109.1 Å²	109.1	64%	0.64	56%	0.563	S	S	*	*			trans	-72.6	91.9	154.5	-87	-174.6	-10.9	0	0	109.1	Y690	Q688-Y690 VanDerWaalsContact C-N 3.35Å; Q688-Y690 HydrophobicContact CB-CE2 4.24Å; Q688-Y690 WeakPolarHBondContact O-CD2 3.48Å; Q688-Y690 PolarHBondContact O-N 2.82Å
689	F	40.3	Very low	51.7	Low	142 Å²	142	101.1 Å²	101.1	62%	0.623	52%	0.52	S	S	*	.			trans	-65.2	93.5	169.6	-89.7	-88.6	0	0	0	109.9	Y687 S691	Y687-F689 VanDerWaalsContact C-N 3.33Å; Y687-F689 HydrophobicContact CD1-CD2 4.35Å; Y687-F689 AromaticContact CD1-CE2 3.71Å; Y687-F689 HydrophobicContact CD1-CE2 3.71Å; Y687-F689 HydrophobicContact CD1-CZ 4.3Å; Y687-F689 HydrophobicContact CE1-CE2 4.49Å; Y687-F689 HydrophobicContact CG-CE2 4.37Å; Y687-F689 PolarHBondContact O-N 2.86Å; Y687-F689 VanDerWaalsContact O-N 3.07Å; F689-S691 PolarHBondContact O-N 2.93Å
690	Y	47.2	Very low	54.9	Low	192 Å²	192	97.1 Å²	97.1	75%	0.753	49%	0.492	S	S	*	.			trans	-61.9	125.6	168.2	-79.2	-91.8	0	0	0	109.4	Q688	Q688-Y690 VanDerWaalsContact C-N 3.35Å; Q688-Y690 HydrophobicContact CB-CE2 4.24Å; Q688-Y690 WeakPolarHBondContact O-CD2 3.48Å; Q688-Y690 PolarHBondContact O-N 2.82Å
691	S	57.9	Low	58.2	Low	44 Å²	44	89.2 Å²	89.2	31%	0.308	45%	0.451	S	S	.	.			trans	-57.2	126.5	170.4	54.6	0	0	0	0	109.3	F689 I693	F689-S691 PolarHBondContact O-N 2.93Å; S691-I693 PolarHBondContact O-N 2.89Å; S691-I693 PolarHBondContact OG-O 3.24Å
692	P	60.9	Low	61.2	Low	87 Å²	87	83.8 Å²	83.8	57%	0.565	41%	0.413	S	S	*	.	S	Bend	trans	-65.5	-13.5	-173.8	22.8	-31.4	0	0	0	113.8	F597	F597-P692 HydrophobicContact CB-CG 4.34Å; F597-P692 HydrophobicContact CD1-CG 3.74Å; F597-P692 HydrophobicContact CE1-CG 4.28Å; F597-P692 HydrophobicContact CG-CG 4.15Å
693	I	78.4	Confident	64.1	Low	15 Å²	15	81.1 Å²	81.1	8%	0.077	39%	0.393	C	S	.	.	S	Bend	trans	-127	145.7	177	-48.7	99.5	0	0	0	109.7	D562 Y568 F597 S691 L695	D562-I693 HydrophobicContact CB-CG2 3.8Å; Y568-I693 HydrophobicContact CD1-CD1 3.62Å; Y568-I693 HydrophobicContact CD1-CG1 4.37Å; Y568-I693 HydrophobicContact CD2-CD1 3.36Å; Y568-I693 HydrophobicContact CD2-CG1 3.7Å; Y568-I693 HydrophobicContact CE1-CD1 3.88Å; Y568-I693 HydrophobicContact CE1-CG1 4.16Å; Y568-I693 HydrophobicContact CE2-CD1 3.67Å; Y568-I693 HydrophobicContact CE2-CG1 3.48Å; Y568-I693 VanDerWaalsContact CE2-CG1 3.48Å; Y568-I693 HydrophobicContact CG-CD1 3.32Å; Y568-I693 HydrophobicContact CG-CG1 4.14Å; F597-I693 HydrophobicContact CD1-CD1 4.25Å; F597-I693 HydrophobicContact CE1-CD1 3.69Å; S691-I693 PolarHBondContact O-N 2.89Å; S691-I693 PolarHBondContact OG-O 3.24Å; I693-L695 PolarHBondContact O-N 3.35Å
694	K	85.1	Confident	66.4	Low	190 Å²	190	76.9 Å²	76.9	83%	0.826	36%	0.361	S	S	*	.			trans	-70.7	95.2	166.2	-173	176.7	-177.9	176	0	110.5	R696	K694-R696 PolarHBondContact O-N 3.42Å
695	L	89.2	Confident	68.4	Low	18 Å²	18	76 Å²	76	9%	0.094	35%	0.354	C	S	.	.			trans	-52.1	132	173.3	-72.6	172.6	0	0	0	111.8	V530 P540 I542 L559 F597 I693	V530-L695 HydrophobicContact CB-CB 4.48Å; V530-L695 HydrophobicContact CG1-CB 3.55Å; V530-L695 HydrophobicContact CG1-CD1 3.9Å; V530-L695 HydrophobicContact CG1-CG 4.36Å; V530-L695 HydrophobicContact CG2-CB 4.18Å; P540-L695 HydrophobicContact CB-CD1 3.69Å; P540-L695 HydrophobicContact CG-CD1 3.89Å; I542-L695 HydrophobicContact CD1-CD1 4.25Å; I542-L695 HydrophobicContact CD1-CD2 3.83Å; I542-L695 HydrophobicContact CG1-CD1 4.44Å; L559-L695 HydrophobicContact CD1-CD2 4.29Å; L559-L695 HydrophobicContact CD2-CD2 3.52Å; L559-L695 HydrophobicContact CG-CD2 4.42Å; F597-L695 HydrophobicContact CE2-CD1 4.35Å; F597-L695 HydrophobicContact CZ-CD1 4.31Å; F597-L695 HydrophobicContact CZ-CD2 4Å; F597-L695 HydrophobicContact CZ-CG 4.16Å; I693-L695 PolarHBondContact O-N 3.35Å
696	R	90	Very high	70.6	Confident	38 Å²	38	70.6 Å²	70.6	14%	0.143	33%	0.325	C	S	.	.			trans	-137.3	160.3	177.6	71.4	175	-165.4	-73.1	1.3	112.3	P561 D562 K694 M699 H847 P848 E849	P561-R696 VanDerWaalsContact O-CZ 3.28Å; P561-R696 PolarHBondContact O-NH1 2.82Å; P561-R696 PolarHBondContact O-NH2 2.9Å; D562-R696 PolarHBondContact O-NH1 3.24Å; D562-R696 PolarHBondContact O-NH2 3.2Å; K694-R696 PolarHBondContact O-N 3.42Å; R696-M699 HydrophobicContact CG-CG 3.66Å; R696-M699 HydrophobicContact CG-SD 3.81Å; R696-M699 PolarHBondContact N-SD 3.02Å; R696-H847 PolarHBondContact NE-CD2 3.38Å; R696-P848 PolarHBondContact NH2-O 2.88Å; R696-E849 IonicContact NH2-OE1 3.5Å; R696-E849 IonicContact NH2-OE2 2.83Å
697	R	87.1	Confident	72.6	Confident	159 Å²	159	64.1 Å²	64.1	60%	0.6	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	146.7	166.4	-55.9	-178.7	178.5	-167.8	-2.1	109.7	N528 M699	N528-R697 WeakPolarHBondContact O-CD 3.42Å; N528-R697 VanDerWaalsContact O-CG 3.27Å; N528-R697 WeakPolarHBondContact O-CG 3.38Å; N528-R697 PolarHBondContact O-NE 2.95Å; N528-R697 VanDerWaalsContact O-NE 3.15Å; R697-M699 VanDerWaalsContact C-N 3.34Å
698	G	85.3	Confident	74.2	Confident	1 Å²	1	56.7 Å²	56.7	1%	0.01	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	95.6	-22.6	-174.4	0	0	0	0	0	113.7	I527 C797	I527-G698 PolarHBondContact O-N 3.28Å; I527-G698 VanDerWaalsContact O-N 3.09Å; G698-C797 WeakPolarHBondContact CA-O 3.48Å
699	M	92.2	Very high	75.8	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	24%	0.243	C	C	.	.			trans	-62.7	161.9	166.7	-64.9	179.2	81.6	0	0	111.3	I527 L559 G560 R696 R697	I527-M699 WeakPolarHBondContact CB-O 3.48Å; I527-M699 HydrophobicContact CD1-CB 3.88Å; I527-M699 WeakPolarHBondContact CG1-O 3.48Å; I527-M699 PolarHBondContact N-O 2.82Å; L559-M699 HydrophobicContact CD1-CB 4.46Å; L559-M699 HydrophobicContact CD1-CE 4.12Å; L559-M699 HydrophobicContact CG-CE 3.93Å; G560-M699 CarbonylContact O-C 3.59Å; G560-M699 WeakPolarHBondContact O-CA 3.08Å; R696-M699 HydrophobicContact CG-CG 3.66Å; R696-M699 HydrophobicContact CG-SD 3.81Å; R696-M699 PolarHBondContact N-SD 3.02Å; R697-M699 VanDerWaalsContact C-N 3.34Å
700	I	93.5	Very high	76.5	Confident	2 Å²	2	44.6 Å²	44.6	1%	0.01	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	150.4	-170.1	-66.1	-177.7	0	0	0	108.4	L524 F525 G560 L702 L850	L524-I700 HydrophobicContact CD1-CG2 3.4Å; F525-I700 CarbonylContact O-C 3.59Å; F525-I700 VanDerWaalsContact O-CA 3.29Å; F525-I700 WeakPolarHBondContact O-CA 3.46Å; F525-I700 WeakPolarHBondContact O-CG2 3.33Å; G560-I700 PolarHBondContact N-O 3.5Å; G560-I700 VanDerWaalsContact N-O 3.08Å; G560-I700 PolarHBondContact O-N 2.76Å; G560-I700 VanDerWaalsContact O-O 3.06Å; I700-L702 HydrophobicContact CG2-CD2 3.93Å; I700-L702 HydrophobicContact CG2-CG 4.12Å; I700-L850 HydrophobicContact CD1-CB 4.31Å; I700-L850 HydrophobicContact CD1-CD2 3.8Å
701	L	93	Very high	76.8	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	133.5	166	-70.3	166	0	0	0	110.1	F525 I527 L557 W558 L559 V570 M593	F525-L701 HydrophobicContact CB-CB 4.23Å; F525-L701 HydrophobicContact CD1-CB 4.38Å; F525-L701 HydrophobicContact CD1-CD1 3.83Å; F525-L701 HydrophobicContact CD1-CG 4.39Å; F525-L701 HydrophobicContact CE1-CD1 4.3Å; F525-L701 PolarHBondContact N-O 3.14Å; F525-L701 PolarHBondContact O-N 2.85Å; I527-L701 HydrophobicContact CD1-CG 4.49Å; L557-L701 HydrophobicContact CB-CB 4.3Å; L557-L701 HydrophobicContact CB-CD2 4.05Å; L557-L701 HydrophobicContact CD1-CB 3.95Å; L557-L701 HydrophobicContact CD1-CD1 4.36Å; W558-L701 CarbonylContact O-C 3.49Å; W558-L701 VanDerWaalsContact O-CA 3.31Å; W558-L701 WeakPolarHBondContact O-CA 3.37Å; L559-L701 HydrophobicContact CB-CD2 3.65Å; L559-L701 HydrophobicContact CD1-CD2 3.88Å; L559-L701 HydrophobicContact CD1-CG 4.3Å; L559-L701 HydrophobicContact CG-CD2 4.34Å; V570-L701 HydrophobicContact CG2-CD2 3.53Å; M593-L701 HydrophobicContact CE-CD1 3.96Å; M593-L701 HydrophobicContact SD-CD1 3.3Å; M593-L701 WeakPolarHBondContact SD-CD1 3.47Å
702	L	90.7	Very high	76	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	145.8	-179.5	-64.1	176.4	0	0	0	112.2	T523 L524 W558 F567 I700 M706 L707 T710 F753 L850	T523-L702 WeakPolarHBondContact O-CA 3.38Å; L524-L702 HydrophobicContact CD1-CD2 3.45Å; L524-L702 VanDerWaalsContact CD1-CD2 3.45Å; W558-L702 HydrophobicContact CB-CB 4.32Å; W558-L702 WeakPolarHBondContact CB-O 3.46Å; W558-L702 PolarHBondContact N-O 2.87Å; W558-L702 PolarHBondContact O-N 3.35Å; F567-L702 HydrophobicContact CD1-CD1 4.41Å; F567-L702 HydrophobicContact CE1-CD1 3.73Å; F567-L702 HydrophobicContact CE1-CG 4.29Å; F567-L702 HydrophobicContact CZ-CD1 4.07Å; I700-L702 HydrophobicContact CG2-CD2 3.93Å; I700-L702 HydrophobicContact CG2-CG 4.12Å; L702-M706 HydrophobicContact CB-CB 4.36Å; L702-M706 HydrophobicContact CD2-CB 4.19Å; L702-M706 HydrophobicContact CD2-CE 4.3Å; L702-L707 HydrophobicContact CD1-CD1 4.17Å; L702-T710 HydrophobicContact CD1-CG2 4.25Å; L702-F753 HydrophobicContact CD1-CE2 4.12Å; L702-F753 HydrophobicContact CD2-CE2 4.28Å; L702-L850 HydrophobicContact CD1-CD1 3.78Å
703	T	86.7	Confident	74.8	Confident	14 Å²	14	39.8 Å²	39.8	9%	0.086	20%	0.195	C	C	.	.			trans	-72.5	152.9	159.5	44.4	0	0	0	0	111.3	G522 T523 L557 M706 L707	G522-T703 VanDerWaalsContact CA-OG1 3.23Å; G522-T703 WeakPolarHBondContact CA-OG1 3.44Å; T523-T703 PolarHBondContact N-OG1 3.17Å; T523-T703 PolarHBondContact O-N 3Å; T523-T703 WeakPolarHBondContact OG1-CG2 3.44Å; L557-T703 HydrophobicContact CD2-CG2 3.63Å; T703-M706 WeakPolarHBondContact O-CA 3.49Å; T703-M706 WeakPolarHBondContact O-CB 3.38Å; T703-M706 PolarHBondContact O-N 3.43Å; T703-L707 PolarHBondContact O-N 2.85Å; T703-L707 VanDerWaalsContact O-N 3.11Å
704	Y	75.2	Confident	72.6	Confident	39 Å²	39	44.9 Å²	44.9	15%	0.153	22%	0.217	C	C	.	.	H	α-helix	trans	-53.5	-42.8	-177.3	-179.5	-97.6	0	0	0	115.8	W558 W602 L614 M706 L707 S708	W558-Y704 AromaticContact NE1-CD2 3.74Å; W602-Y704 AromaticContact CH2-CD2 3.93Å; W602-Y704 HydrophobicContact CH2-CD2 3.93Å; W602-Y704 AromaticContact CH2-CE2 3.24Å; W602-Y704 HydrophobicContact CH2-CE2 3.24Å; W602-Y704 AromaticContact CH2-CZ 3.71Å; W602-Y704 HydrophobicContact CZ2-CD2 4.4Å; W602-Y704 AromaticContact CZ2-CE2 3.37Å; W602-Y704 HydrophobicContact CZ2-CE2 3.37Å; W602-Y704 AromaticContact CZ2-CZ 3.79Å; W602-Y704 WeakPolarHBondContact CZ2-OH 3.26Å; W602-Y704 HydrophobicContact CZ3-CD2 4.3Å; W602-Y704 HydrophobicContact CZ3-CE2 4Å; L614-Y704 HydrophobicContact CD1-CE1 4.42Å; L614-Y704 HydrophobicContact CD2-CD1 3.17Å; L614-Y704 HydrophobicContact CD2-CD2 4.29Å; L614-Y704 HydrophobicContact CD2-CE1 3.33Å; L614-Y704 HydrophobicContact CD2-CE2 4.43Å; L614-Y704 HydrophobicContact CD2-CG 3.67Å; Y704-M706 PolarHBondContact O-N 3.25Å; Y704-L707 CarbonylContact O-C 3.49Å; Y704-L707 WeakPolarHBondContact O-CA 3.38Å; Y704-L707 WeakPolarHBondContact O-CB 3.25Å; Y704-L707 PolarHBondContact O-N 2.95Å; Y704-S708 PolarHBondContact O-N 2.85Å; Y704-S708 PolarHBondContact O-OG 2.9Å
705	P	71.1	Confident	69.8	Low	63 Å²	63	42.2 Å²	42.2	41%	0.409	22%	0.217	S	C	.	.	H	α-helix	trans	-58.9	-33.9	177	-26	36.6	0	0	0	113.3	S708 T709	P705-S708 WeakPolarHBondContact CA-OG 3.49Å; P705-S708 PolarHBondContact O-OG 2.82Å; P705-T709 PolarHBondContact O-N 2.95Å
706	M	74.5	Confident	66.8	Low	9 Å²	9	46.8 Å²	46.8	4%	0.044	25%	0.246	C	C	.	.	H	α-helix	trans	-74.6	-25.9	173.6	-67.5	-168	74.6	0	0	112.6	F520 L524 L548 L702 T703 Y704 T709 F753	F520-M706 HydrophobicContact CE1-CE 4.33Å; F520-M706 HydrophobicContact CE1-SD 4.06Å; L524-M706 HydrophobicContact CB-CE 4.09Å; L524-M706 HydrophobicContact CB-SD 4.44Å; L548-M706 HydrophobicContact CD1-CE 4.04Å; L702-M706 HydrophobicContact CB-CB 4.36Å; L702-M706 HydrophobicContact CD2-CB 4.19Å; L702-M706 HydrophobicContact CD2-CE 4.3Å; T703-M706 WeakPolarHBondContact O-CA 3.49Å; T703-M706 WeakPolarHBondContact O-CB 3.38Å; T703-M706 PolarHBondContact O-N 3.43Å; Y704-M706 PolarHBondContact O-N 3.25Å; M706-T709 PolarHBondContact O-OG1 3.01Å; M706-F753 HydrophobicContact CB-CZ 3.83Å; M706-F753 HydrophobicContact CE-CE1 3.79Å; M706-F753 HydrophobicContact CE-CZ 3.65Å; M706-F753 HydrophobicContact CG-CZ 4.4Å; M706-F753 WeakPolarHBondContact O-CE2 3.26Å; M706-F753 WeakPolarHBondContact O-CZ 3.12Å
707	L	70	Confident	63.6	Low	7 Å²	7	49.5 Å²	49.5	4%	0.037	27%	0.268	C	S	.	.	H	α-helix	trans	-76	-37.4	171.7	-171.8	69.9	0	0	0	111.6	W558 F567 L702 T703 Y704 T709 T710 Y711	W558-L707 HydrophobicContact CB-CD2 3.97Å; W558-L707 HydrophobicContact CD2-CD2 3.49Å; W558-L707 VanDerWaalsContact CD2-CD2 3.49Å; W558-L707 HydrophobicContact CE3-CD2 3.73Å; W558-L707 HydrophobicContact CG-CB 4.41Å; W558-L707 HydrophobicContact CG-CD2 3.56Å; F567-L707 HydrophobicContact CB-CD1 3.9Å; F567-L707 HydrophobicContact CB-CD2 4.18Å; F567-L707 HydrophobicContact CD1-CD1 3.83Å; F567-L707 HydrophobicContact CD2-CD1 3.52Å; F567-L707 HydrophobicContact CE1-CD1 4.24Å; F567-L707 HydrophobicContact CE2-CD1 3.94Å; F567-L707 HydrophobicContact CG-CD1 3.47Å; F567-L707 VanDerWaalsContact CG-CD1 3.47Å; F567-L707 HydrophobicContact CZ-CD1 4.3Å; L702-L707 HydrophobicContact CD1-CD1 4.17Å; T703-L707 PolarHBondContact O-N 2.85Å; T703-L707 VanDerWaalsContact O-N 3.11Å; Y704-L707 CarbonylContact O-C 3.49Å; Y704-L707 WeakPolarHBondContact O-CA 3.38Å; Y704-L707 WeakPolarHBondContact O-CB 3.25Å; Y704-L707 PolarHBondContact O-N 2.95Å; L707-T709 PolarHBondContact O-N 2.88Å; L707-T710 PolarHBondContact O-N 2.85Å; L707-T710 VanDerWaalsContact O-N 3.14Å; L707-T710 PolarHBondContact O-OG1 3.08Å; L707-Y711 HydrophobicContact CD1-CD2 4.45Å; L707-Y711 HydrophobicContact CD1-CE2 3.72Å; L707-Y711 HydrophobicContact CD2-CE2 4.33Å; L707-Y711 HydrophobicContact CG-CD2 4.26Å; L707-Y711 HydrophobicContact CG-CE2 3.82Å; L707-Y711 WeakPolarHBondContact O-CD2 3.3Å
708	S	61.6	Low	60.6	Low	33 Å²	33	45.5 Å²	45.5	23%	0.231	27%	0.265	C	S	.	.	H	α-helix	trans	-57.4	-41.3	175	35.2	0	0	0	0	111.5	Y704 P705 T710 Y711 S712	Y704-S708 PolarHBondContact O-N 2.85Å; Y704-S708 PolarHBondContact O-OG 2.9Å; P705-S708 WeakPolarHBondContact CA-OG 3.49Å; P705-S708 PolarHBondContact O-OG 2.82Å; S708-T710 VanDerWaalsContact C-N 3.29Å; S708-T710 PolarHBondContact O-N 3.42Å; S708-Y711 PolarHBondContact O-N 2.76Å; S708-Y711 VanDerWaalsContact O-N 3.14Å; S708-S712 WeakPolarHBondContact O-CB 3.33Å; S708-S712 PolarHBondContact O-N 3.11Å; S708-S712 PolarHBondContact O-OG 3.31Å; S708-S712 VanDerWaalsContact O-OG 3.1Å
709	T	62.1	Low	57.7	Low	21 Å²	21	52.2 Å²	52.2	13%	0.129	31%	0.308	C	S	.	.	H	α-helix	trans	-65.3	-24.8	178.7	50.4	0	0	0	0	114.2	P705 M706 L707 Y711 Y750 F753	P705-T709 PolarHBondContact O-N 2.95Å; M706-T709 PolarHBondContact O-OG1 3.01Å; L707-T709 PolarHBondContact O-N 2.88Å; T709-Y711 VanDerWaalsContact C-N 3.25Å; T709-Y711 PolarHBondContact O-N 3.45Å; T709-Y750 HydrophobicContact CG2-CD1 3.72Å; T709-Y750 HydrophobicContact CG2-CE1 3.95Å; T709-F753 WeakPolarHBondContact OG1-CZ 3.14Å
710	T	55.2	Low	54.6	Low	4 Å²	4	55.7 Å²	55.7	3%	0.025	34%	0.344	C	S	.	.	H	α-helix	trans	-68.3	-27.7	175.1	60.5	0	0	0	0	113	L702 L707 S708 F753 T754 L850	L702-T710 HydrophobicContact CD1-CG2 4.25Å; L707-T710 PolarHBondContact O-N 2.85Å; L707-T710 VanDerWaalsContact O-N 3.14Å; L707-T710 PolarHBondContact O-OG1 3.08Å; S708-T710 VanDerWaalsContact C-N 3.29Å; S708-T710 PolarHBondContact O-N 3.42Å; T710-F753 HydrophobicContact CG2-CD2 3.49Å; T710-F753 VanDerWaalsContact CG2-CD2 3.49Å; T710-F753 HydrophobicContact CG2-CE2 3.32Å; T710-F753 HydrophobicContact CG2-CZ 4.4Å; T710-T754 PolarHBondContact O-OG1 2.74Å; T710-L850 HydrophobicContact CG2-CD1 3.7Å
711	Y	54	Low	51.4	Low	106 Å²	106	62 Å²	62	42%	0.416	38%	0.377	S	S	.	.	H	α-helix	trans	-102.7	-28.5	-176.3	-62.6	-65.7	0	0	0	112.8	L707 S708 T709	L707-Y711 HydrophobicContact CD1-CD2 4.45Å; L707-Y711 HydrophobicContact CD1-CE2 3.72Å; L707-Y711 HydrophobicContact CD2-CE2 4.33Å; L707-Y711 HydrophobicContact CG-CD2 4.26Å; L707-Y711 HydrophobicContact CG-CE2 3.82Å; L707-Y711 WeakPolarHBondContact O-CD2 3.3Å; S708-Y711 PolarHBondContact O-N 2.76Å; S708-Y711 VanDerWaalsContact O-N 3.14Å; T709-Y711 VanDerWaalsContact C-N 3.25Å; T709-Y711 PolarHBondContact O-N 3.45Å
712	S	39.9	Very low	48.1	Very low	83 Å²	83	68.8 Å²	68.8	58%	0.58	41%	0.413	S	S	*	.	H	α-helix	trans	-91.6	3.1	-170.3	74.4	0	0	0	0	116	S708	S708-S712 WeakPolarHBondContact O-CB 3.33Å; S708-S712 PolarHBondContact O-N 3.11Å; S708-S712 PolarHBondContact O-OG 3.31Å; S708-S712 VanDerWaalsContact O-OG 3.1Å
713	S	36.8	Very low	45	Very low	33 Å²	33	74.6 Å²	74.6	23%	0.231	45%	0.45	C	S	.	.			trans	-99.2	102.4	-178.3	65.4	0	0	0	0	113.2	K879	S713-K879 PolarHBondContact O-NZ 3.32Å
714	F	31.5	Very low	42	Very low	122 Å²	122	79.3 Å²	79.3	54%	0.535	48%	0.483	S	S	.	.			trans	155.6	78.4	134.6	-78.2	-69.5	0	0	0	106.9	K879	F714-K879 HydrophobicContact CB-CD 4.41Å
715	T	25.2	Very low	39.6	Very low	135 Å²	135	82.3 Å²	82.3	83%	0.828	51%	0.506	S	S	*	.	P	Polyproline II helix	trans	-68.4	127.5	133.3	39.3	0	0	0	0	105.9
716	T	26.3	Very low	37.7	Very low	113 Å²	113	87 Å²	87	69%	0.693	53%	0.526	S	S	*	.	P	Polyproline II helix	trans	-60.9	130	171.6	44.8	0	0	0	0	108.1	S718	T716-S718 PolarHBondContact O-N 2.76Å
717	P	24.1	Very low	35.3	Very low	95 Å²	95	92.6 Å²	92.6	62%	0.617	56%	0.556	S	S	*	*	P	Polyproline II helix	trans	-57.5	137.9	163	27.6	-32.8	0	0	0	107.3
718	S	23.5	Very low	33.2	Very low	76 Å²	76	98.5 Å²	98.5	53%	0.531	60%	0.597	S	S	.	*	P	Polyproline II helix	trans	-52.6	138.7	175.2	45	0	0	0	0	110	T716 G720 L721	T716-S718 PolarHBondContact O-N 2.76Å; S718-G720 PolarHBondContact O-N 3.11Å; S718-L721 PolarHBondContact O-N 3.48Å
719	P	25.4	Very low	31.5	Very low	141 Å²	141	100.4 Å²	100.4	92%	0.916	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.8	99.9	-178.4	26.7	-33.9	0	0	0	109.5
720	G	27	Very low	29.8	Very low	74 Å²	74	106 Å²	106	76%	0.763	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	157.8	-18.5	-171.9	0	0	0	0	0	115.5	S718	S718-G720 PolarHBondContact O-N 3.11Å
721	L	25.1	Very low	28.4	Very low	133 Å²	133	112.8 Å²	112.8	70%	0.696	68%	0.683	S	S	*	*			trans	-114.4	99.1	176.3	-75	165.2	0	0	0	111.4	S718	S718-L721 PolarHBondContact O-N 3.48Å
722	L	24.2	Very low	27.1	Very low	144 Å²	144	111.9 Å²	111.9	75%	0.754	69%	0.692	S	S	*	*			trans	-63.2	129.7	175.9	-74.1	159.3	0	0	0	111.2	C724 T725	L722-C724 PolarHBondContact O-N 3.17Å; L722-T725 HydrophobicContact CD1-CG2 4.16Å
723	P	24.7	Very low	26.4	Very low	121 Å²	121	113.5 Å²	113.5	79%	0.786	70%	0.703	S	S	*	*	S	Bend	trans	-74.7	94.5	167.3	30.5	-31.6	0	0	0	109.4
724	C	25.5	Very low	26	Very low	114 Å²	114	116.4 Å²	116.4	77%	0.77	72%	0.724	S	S	*	*			trans	49.1	96.7	171.5	-58.8	0	0	0	0	115.3	L722 I726	L722-C724 PolarHBondContact O-N 3.17Å; C724-I726 PolarHBondContact O-N 3.14Å
725	T	24.7	Very low	26.1	Very low	102 Å²	102	113.5 Å²	113.5	63%	0.626	72%	0.718	S	S	*	*			trans	-55.7	111	158.6	42.5	0	0	0	0	109.2	L722 D727	L722-T725 HydrophobicContact CD1-CG2 4.16Å; T725-D727 PolarHBondContact O-N 3.45Å; T725-D727 VanDerWaalsContact O-N 3.09Å
726	I	29.7	Very low	26.3	Very low	162 Å²	162	110.7 Å²	110.7	83%	0.831	70%	0.704	S	S	*	*			trans	-75.2	97.6	169.6	-61.3	175.4	0	0	0	106.1	C724 S728	C724-I726 PolarHBondContact O-N 3.14Å; I726-S728 PolarHBondContact O-N 3.14Å
727	D	24.3	Very low	26.7	Very low	126 Å²	126	109.4 Å²	109.4	67%	0.674	69%	0.689	S	S	*	*			trans	-55.4	129.6	177.8	-77.4	-28.6	0	0	0	110.7	T725 S729	T725-D727 PolarHBondContact O-N 3.45Å; T725-D727 VanDerWaalsContact O-N 3.09Å; D727-S729 PolarHBondContact O-N 3.14Å; D727-S729 PolarHBondContact O-OG 3.4Å
728	S	25.9	Very low	27.2	Very low	131 Å²	131	107.7 Å²	107.7	92%	0.916	67%	0.673	S	S	*	*			trans	-70.8	72.3	-175.7	38.1	0	0	0	0	112	I726	I726-S728 PolarHBondContact O-N 3.14Å
729	S	26.7	Very low	27.7	Very low	72 Å²	72	109.4 Å²	109.4	50%	0.503	67%	0.671	S	S	.	*			trans	-114.9	131.3	173.2	56.5	0	0	0	0	111.3	D727 L731	D727-S729 PolarHBondContact O-N 3.14Å; D727-S729 PolarHBondContact O-OG 3.4Å; S729-L731 PolarHBondContact O-N 2.79Å; S729-L731 VanDerWaalsContact OG-CD1 3.3Å; S729-L731 WeakPolarHBondContact OG-CD1 3.39Å
730	P	25.4	Very low	28.3	Very low	140 Å²	140	106.6 Å²	106.6	91%	0.909	65%	0.648	S	S	*	*			trans	-83.2	85.4	-172.8	32.5	-34.8	0	0	0	111.4
731	L	25.9	Very low	29	Very low	145 Å²	145	105.3 Å²	105.3	76%	0.759	62%	0.62	S	S	*	*			trans	-88	144.6	177.2	-78.9	112.4	0	0	0	114.2	S729	S729-L731 PolarHBondContact O-N 2.79Å; S729-L731 VanDerWaalsContact OG-CD1 3.3Å; S729-L731 WeakPolarHBondContact OG-CD1 3.39Å
732	S	26.6	Very low	29.8	Very low	88 Å²	88	100.4 Å²	100.4	62%	0.615	59%	0.594	S	S	*	*			trans	-83.2	130.8	-157.3	52.4	0	0	0	0	116	S734	S732-S734 PolarHBondContact O-N 2.91Å
733	S	27.1	Very low	30.6	Very low	116 Å²	116	97.3 Å²	97.3	81%	0.811	58%	0.576	S	S	*	*	S	Bend	trans	34.9	53.3	140.1	66.5	0	0	0	0	118.5
734	S	28.4	Very low	31.6	Very low	95 Å²	95	93.3 Å²	93.3	66%	0.664	55%	0.547	S	S	*	.	S	Bend	trans	-148.2	166.8	158.5	54.6	0	0	0	0	108.3	S732 S736	S732-S734 PolarHBondContact O-N 2.91Å; S734-S736 PolarHBondContact O-N 3.12Å; S734-S736 PolarHBondContact O-OG 2.88Å
735	S	31.9	Very low	32.7	Very low	60 Å²	60	89 Å²	89	42%	0.42	52%	0.516	S	S	.	.			trans	-64	81.8	-162.7	35.8	0	0	0	0	115.3	F737 E738	S735-F737 PolarHBondContact O-N 3.02Å; S735-E738 VanDerWaalsContact CB-OE2 3.27Å; S735-E738 WeakPolarHBondContact CB-OE2 3.31Å; S735-E738 PolarHBondContact O-N 2.89Å; S735-E738 VanDerWaalsContact O-N 3.13Å; S735-E738 PolarHBondContact OG-OE2 3.41Å
736	S	30.2	Very low	33.6	Very low	76 Å²	76	90.2 Å²	90.2	53%	0.531	51%	0.512	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-6.3	-179.5	-33.7	0	0	0	0	115.7	S734 F739	S734-S736 PolarHBondContact O-N 3.12Å; S734-S736 PolarHBondContact O-OG 2.88Å; S736-F739 WeakPolarHBondContact O-CB 3.45Å
737	F	35.3	Very low	34.4	Very low	86 Å²	86	85.5 Å²	85.5	38%	0.377	49%	0.494	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.3	-24.3	-177.4	-59.4	-75.6	0	0	0	113.9	S735 F739 I764 Y870	S735-F737 PolarHBondContact O-N 3.02Å; F737-F739 PolarHBondContact O-N 3.14Å; F737-I764 HydrophobicContact CD1-CD1 4.34Å; F737-I764 HydrophobicContact CE1-CD1 4.03Å; F737-Y870 HydrophobicContact CB-CE2 3.95Å; F737-Y870 HydrophobicContact CD1-CD2 4.36Å; F737-Y870 AromaticContact CD1-CE2 3.73Å; F737-Y870 HydrophobicContact CD1-CE2 3.73Å; F737-Y870 AromaticContact CG-CE2 3.98Å; F737-Y870 HydrophobicContact CG-CE2 3.98Å
738	E	35	Very low	35.3	Very low	60 Å²	60	87.5 Å²	87.5	28%	0.28	50%	0.496	S	S	.	.	H	α-helix	trans	-64.5	-28.5	161.1	-83.4	169.2	149.1	0	0	109.7	Q510 S735 I740 W741 N742	Q510-E738 PolarHBondContact NE2-OE1 3.31Å; S735-E738 VanDerWaalsContact CB-OE2 3.27Å; S735-E738 WeakPolarHBondContact CB-OE2 3.31Å; S735-E738 PolarHBondContact O-N 2.89Å; S735-E738 VanDerWaalsContact O-N 3.13Å; S735-E738 PolarHBondContact OG-OE2 3.41Å; E738-I740 PolarHBondContact O-N 2.95Å; E738-W741 PolarHBondContact O-N 3.37Å; E738-N742 VanDerWaalsContact O-CB 3.27Å; E738-N742 WeakPolarHBondContact O-CB 3.48Å; E738-N742 PolarHBondContact O-N 2.91Å; E738-N742 PolarHBondContact O-ND2 2.98Å
739	F	32.8	Very low	36.3	Very low	111 Å²	111	87.9 Å²	87.9	49%	0.487	48%	0.484	S	S	.	.	H	α-helix	trans	-53.7	-47.2	179.1	-162	-104.1	0	0	0	113.3	S736 F737 W741 N742 E743	S736-F739 WeakPolarHBondContact O-CB 3.45Å; F737-F739 PolarHBondContact O-N 3.14Å; F739-W741 PolarHBondContact O-N 2.81Å; F739-N742 CarbonylContact O-C 3.59Å; F739-N742 PolarHBondContact O-N 2.81Å; F739-E743 HydrophobicContact CD1-CG 3.45Å; F739-E743 VanDerWaalsContact CD1-CG 3.45Å; F739-E743 HydrophobicContact CD2-CG 4.31Å; F739-E743 HydrophobicContact CE1-CG 3.29Å; F739-E743 HydrophobicContact CE2-CG 4.18Å; F739-E743 HydrophobicContact CG-CG 3.97Å; F739-E743 HydrophobicContact CZ-CG 3.69Å; F739-E743 VanDerWaalsContact CZ-OE1 3.27Å; F739-E743 WeakPolarHBondContact CZ-OE1 3.35Å; F739-E743 VanDerWaalsContact O-CB 3.25Å; F739-E743 WeakPolarHBondContact O-CB 3.38Å; F739-E743 WeakPolarHBondContact O-CG 3.45Å; F739-E743 PolarHBondContact O-N 3.1Å
740	I	37.5	Very low	37.4	Very low	83 Å²	83	91.8 Å²	91.8	43%	0.426	49%	0.488	S	S	.	.	H	α-helix	trans	-62.3	-44.9	-175.7	-61.8	173.9	0	0	0	112.1	E738 Q744	E738-I740 PolarHBondContact O-N 2.95Å; I740-Q744 WeakPolarHBondContact O-CG 3.43Å; I740-Q744 PolarHBondContact O-N 2.91Å; I740-Q744 VanDerWaalsContact O-N 3.14Å
741	W	41.4	Very low	39	Very low	46 Å²	46	85.5 Å²	85.5	17%	0.174	45%	0.447	C	S	.	.	H	α-helix	trans	-67.8	-43	177.1	-175.6	-107	0	0	0	111.2	Y517 E738 F739 E743 Q744 L745 I751 E852	Y517-W741 AromaticContact CZ-NE1 3.92Å; E738-W741 PolarHBondContact O-N 3.37Å; F739-W741 PolarHBondContact O-N 2.81Å; W741-E743 PolarHBondContact O-N 3Å; W741-Q744 PolarHBondContact O-N 3.14Å; W741-L745 HydrophobicContact CG-CD1 4.41Å; W741-L745 WeakPolarHBondContact O-CG 3.47Å; W741-L745 PolarHBondContact O-N 3.46Å; W741-I751 HydrophobicContact CH2-CD1 4.43Å; W741-I751 HydrophobicContact CH2-CG2 3.93Å; W741-I751 HydrophobicContact CZ3-CG2 3.68Å; W741-E852 HydrophobicContact CE3-CG 4.25Å; W741-E852 HydrophobicContact CH2-CB 4.14Å; W741-E852 HydrophobicContact CH2-CG 3.79Å; W741-E852 HydrophobicContact CZ3-CB 3.64Å; W741-E852 HydrophobicContact CZ3-CG 3.39Å
742	N	43.3	Very low	40.9	Very low	30 Å²	30	82 Å²	82	16%	0.16	43%	0.429	C	S	.	.	H	α-helix	trans	-67.1	-33.6	178.2	-67.7	-15.2	0	0	0	112.5	Y517 E738 F739 L745 K746	Y517-N742 PolarHBondContact OH-OD1 3.26Å; Y517-N742 VanDerWaalsContact OH-OD1 3.09Å; E738-N742 VanDerWaalsContact O-CB 3.27Å; E738-N742 WeakPolarHBondContact O-CB 3.48Å; E738-N742 PolarHBondContact O-N 2.91Å; E738-N742 PolarHBondContact O-ND2 2.98Å; F739-N742 CarbonylContact O-C 3.59Å; F739-N742 PolarHBondContact O-N 2.81Å; N742-L745 PolarHBondContact O-N 3.27Å; N742-K746 WeakPolarHBondContact O-CB 3.18Å; N742-K746 VanDerWaalsContact O-CG 3.26Å; N742-K746 WeakPolarHBondContact O-CG 3.41Å; N742-K746 PolarHBondContact O-N 2.97Å
743	E	40.9	Very low	43.3	Very low	80 Å²	80	78.2 Å²	78.2	37%	0.374	40%	0.401	S	S	.	.	H	α-helix	trans	-66.6	-46.9	174.3	-75.3	-79.4	105.4	0	0	111.4	F739 W741 L745 K746 S747	F739-E743 HydrophobicContact CD1-CG 3.45Å; F739-E743 VanDerWaalsContact CD1-CG 3.45Å; F739-E743 HydrophobicContact CD2-CG 4.31Å; F739-E743 HydrophobicContact CE1-CG 3.29Å; F739-E743 HydrophobicContact CE2-CG 4.18Å; F739-E743 HydrophobicContact CG-CG 3.97Å; F739-E743 HydrophobicContact CZ-CG 3.69Å; F739-E743 VanDerWaalsContact CZ-OE1 3.27Å; F739-E743 WeakPolarHBondContact CZ-OE1 3.35Å; F739-E743 VanDerWaalsContact O-CB 3.25Å; F739-E743 WeakPolarHBondContact O-CB 3.38Å; F739-E743 WeakPolarHBondContact O-CG 3.45Å; F739-E743 PolarHBondContact O-N 3.1Å; W741-E743 PolarHBondContact O-N 3Å; E743-L745 PolarHBondContact O-N 2.95Å; E743-K746 WeakPolarHBondContact O-CB 3.41Å; E743-K746 PolarHBondContact O-N 2.92Å; E743-K746 VanDerWaalsContact O-N 3.16Å; E743-K746 WeakPolarHBondContact OE1-CD 3.35Å; E743-K746 IonicContact OE1-NZ 3.81Å; E743-K746 PolarHBondContact OE1-NZ 2.67Å; E743-S747 PolarHBondContact O-N 3.16Å
744	Q	45.9	Very low	45.8	Very low	36 Å²	36	73.6 Å²	73.6	17%	0.168	37%	0.369	C	S	.	.	H	α-helix	trans	-57.9	-40	173.8	-73.1	-178.6	0.7	0	0	111.1	I740 W741 S747 I853	I740-Q744 WeakPolarHBondContact O-CG 3.43Å; I740-Q744 PolarHBondContact O-N 2.91Å; I740-Q744 VanDerWaalsContact O-N 3.14Å; W741-Q744 PolarHBondContact O-N 3.14Å; Q744-S747 WeakPolarHBondContact O-CB 3.33Å; Q744-S747 PolarHBondContact O-N 3.5Å; Q744-S747 PolarHBondContact O-OG 3.28Å; Q744-I853 PolarHBondContact OE1-O 3.43Å
745	L	48.7	Very low	48.5	Very low	23 Å²	23	69.7 Å²	69.7	12%	0.12	34%	0.34	C	S	.	.	H	α-helix	trans	-71.5	-36.3	175.4	-68.3	171.9	0	0	0	113.6	Y517 F520 L548 W741 N742 E743 S747 K748 I751	Y517-L745 HydrophobicContact CD1-CD1 3.73Å; Y517-L745 HydrophobicContact CE1-CD1 3.26Å; F520-L745 HydrophobicContact CD2-CD2 4.04Å; F520-L745 HydrophobicContact CE2-CD2 3.9Å; L548-L745 HydrophobicContact CD2-CD1 4.38Å; L548-L745 HydrophobicContact CD2-CD2 3.91Å; W741-L745 HydrophobicContact CG-CD1 4.41Å; W741-L745 WeakPolarHBondContact O-CG 3.47Å; W741-L745 PolarHBondContact O-N 3.46Å; N742-L745 PolarHBondContact O-N 3.27Å; E743-L745 PolarHBondContact O-N 2.95Å; L745-S747 PolarHBondContact O-N 2.86Å; L745-K748 PolarHBondContact O-N 3.41Å; L745-I751 HydrophobicContact CD2-CD1 3.54Å; L745-I751 HydrophobicContact CD2-CG1 4.03Å
746	K	43.8	Very low	51.1	Low	128 Å²	128	66.8 Å²	66.8	56%	0.557	32%	0.32	S	S	*	.	H	α-helix	trans	-61	-30.3	172.6	-77.9	174.6	-161.2	169.2	0	112.6	N742 E743 K748	N742-K746 WeakPolarHBondContact O-CB 3.18Å; N742-K746 VanDerWaalsContact O-CG 3.26Å; N742-K746 WeakPolarHBondContact O-CG 3.41Å; N742-K746 PolarHBondContact O-N 2.97Å; E743-K746 WeakPolarHBondContact O-CB 3.41Å; E743-K746 PolarHBondContact O-N 2.92Å; E743-K746 VanDerWaalsContact O-N 3.16Å; E743-K746 WeakPolarHBondContact OE1-CD 3.35Å; E743-K746 IonicContact OE1-NZ 3.81Å; E743-K746 PolarHBondContact OE1-NZ 2.67Å; K746-K748 PolarHBondContact O-N 3.32Å
747	S	46.3	Very low	53.9	Low	63 Å²	63	64.6 Å²	64.6	44%	0.441	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-10.2	177.3	83.5	0	0	0	0	113.9	E743 Q744 L745 H749	E743-S747 PolarHBondContact O-N 3.16Å; Q744-S747 WeakPolarHBondContact O-CB 3.33Å; Q744-S747 PolarHBondContact O-N 3.5Å; Q744-S747 PolarHBondContact O-OG 3.28Å; L745-S747 PolarHBondContact O-N 2.86Å; S747-H749 PolarHBondContact O-CD2 3.3Å; S747-H749 VanDerWaalsContact O-CD2 3.31Å; S747-H749 PolarHBondContact O-N 3.01Å
748	K	41.8	Very low	56.6	Low	168 Å²	168	61.1 Å²	61.1	73%	0.73	29%	0.286	S	S	*	.	S	Bend	trans	58.2	-10.5	177.9	-78.4	-171.9	175.4	-176.4	0	117.4	L745 K746	L745-K748 PolarHBondContact O-N 3.41Å; K746-K748 PolarHBondContact O-N 3.32Å
749	H	46.7	Very low	59.3	Low	140 Å²	140	58.3 Å²	58.3	65%	0.648	27%	0.273	S	S	*	.	S	Bend	trans	-122.8	-35	-165.7	-70.8	-66.9	0	0	0	115.5	S747	S747-H749 PolarHBondContact O-CD2 3.3Å; S747-H749 VanDerWaalsContact O-CD2 3.31Å; S747-H749 PolarHBondContact O-N 3.01Å
750	Y	49.6	Very low	62.1	Low	154 Å²	154	55.2 Å²	55.2	60%	0.604	26%	0.26	S	S	*	.			trans	-144.7	121.1	-177.2	-60.5	-76.1	0	0	0	113.5	T709	T709-Y750 HydrophobicContact CG2-CD1 3.72Å; T709-Y750 HydrophobicContact CG2-CE1 3.95Å
751	I	60.1	Low	64.7	Low	7 Å²	7	51.4 Å²	51.4	4%	0.036	24%	0.24	C	C	.	.			trans	-95.3	126.3	159.5	-52.2	172.9	0	0	0	106	F520 L548 W741 L745 F753 E852	F520-I751 HydrophobicContact CE1-CD1 4.35Å; F520-I751 HydrophobicContact CE2-CD1 4.19Å; F520-I751 HydrophobicContact CZ-CD1 3.79Å; F520-I751 HydrophobicContact CZ-CG1 4.18Å; L548-I751 HydrophobicContact CD1-CD1 3.31Å; W741-I751 HydrophobicContact CH2-CD1 4.43Å; W741-I751 HydrophobicContact CH2-CG2 3.93Å; W741-I751 HydrophobicContact CZ3-CG2 3.68Å; L745-I751 HydrophobicContact CD2-CD1 3.54Å; L745-I751 HydrophobicContact CD2-CG1 4.03Å; I751-F753 HydrophobicContact CB-CD1 3.8Å; I751-F753 HydrophobicContact CB-CE1 3.96Å; I751-F753 HydrophobicContact CG2-CD1 3.8Å; I751-F753 HydrophobicContact CG2-CE1 4.43Å; I751-F753 WeakPolarHBondContact O-CD1 3.44Å; I751-F753 WeakPolarHBondContact O-CE1 3.4Å; I751-F753 PolarHBondContact O-N 3.01Å; I751-E852 HydrophobicContact CG2-CB 4.33Å
752	N	65.3	Low	67	Low	71 Å²	71	52 Å²	52	38%	0.38	24%	0.244	S	C	.	.			trans	-83.3	97	178.4	-76.5	-14.7	0	0	0	109.9	E852 I853	N752-E852 WeakPolarHBondContact O-CA 3.3Å; N752-I853 HydrophobicContact CB-CD1 3.75Å; N752-I853 HydrophobicContact CB-CG1 4.14Å; N752-I853 PolarHBondContact O-N 2.76Å
753	F	76.7	Confident	69.2	Low	9 Å²	9	51 Å²	51	4%	0.039	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	142.4	171.6	59.1	-83.6	0	0	0	110.3	L702 M706 T709 T710 I751 L850 I851 E852	L702-F753 HydrophobicContact CD1-CE2 4.12Å; L702-F753 HydrophobicContact CD2-CE2 4.28Å; M706-F753 HydrophobicContact CB-CZ 3.83Å; M706-F753 HydrophobicContact CE-CE1 3.79Å; M706-F753 HydrophobicContact CE-CZ 3.65Å; M706-F753 HydrophobicContact CG-CZ 4.4Å; M706-F753 WeakPolarHBondContact O-CE2 3.26Å; M706-F753 WeakPolarHBondContact O-CZ 3.12Å; T709-F753 WeakPolarHBondContact OG1-CZ 3.14Å; T710-F753 HydrophobicContact CG2-CD2 3.49Å; T710-F753 VanDerWaalsContact CG2-CD2 3.49Å; T710-F753 HydrophobicContact CG2-CE2 3.32Å; T710-F753 HydrophobicContact CG2-CZ 4.4Å; I751-F753 HydrophobicContact CB-CD1 3.8Å; I751-F753 HydrophobicContact CB-CE1 3.96Å; I751-F753 HydrophobicContact CG2-CD1 3.8Å; I751-F753 HydrophobicContact CG2-CE1 4.43Å; I751-F753 WeakPolarHBondContact O-CD1 3.44Å; I751-F753 WeakPolarHBondContact O-CE1 3.4Å; I751-F753 PolarHBondContact O-N 3.01Å; F753-L850 HydrophobicContact CB-CD2 4.27Å; F753-L850 HydrophobicContact CD2-CD1 3.82Å; F753-L850 HydrophobicContact CD2-CD2 3.73Å; F753-L850 HydrophobicContact CD2-CG 3.97Å; F753-L850 HydrophobicContact CE2-CD1 4.22Å; F753-L850 HydrophobicContact CG-CD2 4.31Å; F753-I851 VanDerWaalsContact CA-O 3.3Å; F753-I851 WeakPolarHBondContact CA-O 3.4Å; F753-E852 HydrophobicContact CB-CB 3.94Å
754	T	80.2	Confident	70.9	Confident	20 Å²	20	50 Å²	50	12%	0.123	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	166.6	176.8	-169.6	0	0	0	0	110.6	T710 V756 L850 I851 L874	T710-T754 PolarHBondContact O-OG1 2.74Å; T754-V756 HydrophobicContact CG2-CG1 3.7Å; T754-V756 PolarHBondContact O-N 2.99Å; T754-L850 WeakPolarHBondContact O-CA 3.44Å; T754-I851 PolarHBondContact N-O 3.27Å; T754-I851 PolarHBondContact O-N 2.82Å; T754-I851 VanDerWaalsContact O-N 3.14Å; T754-L874 HydrophobicContact CG2-CB 3.88Å; T754-L874 HydrophobicContact CG2-CD1 4Å
755	V	84.6	Confident	72.3	Confident	12 Å²	12	50.8 Å²	50.8	7%	0.073	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	112.5	178.1	177.3	0	0	0	0	108.2	P561 F567 P848 L850	P561-V755 HydrophobicContact CB-CG1 3.93Å; P561-V755 HydrophobicContact CB-CG2 4.11Å; P561-V755 HydrophobicContact CG-CG1 4.4Å; F567-V755 HydrophobicContact CE2-CG2 3.67Å; F567-V755 HydrophobicContact CZ-CG2 4.19Å; V755-P848 HydrophobicContact CG1-CB 3.68Å; V755-P848 HydrophobicContact CG1-CG 4.06Å; V755-L850 HydrophobicContact CG2-CB 4.43Å; V755-L850 HydrophobicContact CG2-CD1 4.44Å
756	V	87.6	Confident	73.6	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	142.1	-176	-69.5	0	0	0	0	113.1	T754 T758 V759 F844 P848 E849 I851 L874	T754-V756 HydrophobicContact CG2-CG1 3.7Å; T754-V756 PolarHBondContact O-N 2.99Å; V756-T758 WeakPolarHBondContact CB-O 3.13Å; V756-V759 HydrophobicContact CG2-CB 4.42Å; V756-F844 HydrophobicContact CG2-CE2 4.46Å; V756-P848 WeakPolarHBondContact O-CA 3.44Å; V756-E849 PolarHBondContact N-O 3.31Å; V756-E849 PolarHBondContact O-N 3.07Å; V756-E849 VanDerWaalsContact O-N 3.12Å; V756-I851 HydrophobicContact CG2-CB 4.26Å; V756-I851 HydrophobicContact CG2-CD1 4.18Å; V756-I851 HydrophobicContact CG2-CG1 4.34Å; V756-L874 HydrophobicContact CG1-CB 3.88Å
757	W	88.8	Confident	75.2	Confident	30 Å²	30	46.5 Å²	46.5	11%	0.114	22%	0.215	C	C	.	.	S	Bend	trans	-84.4	-27.7	159.3	-75.2	99.4	0	0	0	112	R843 F844 P848 P877 W940	W757-R843 CarbonylContact O-C 3.47Å; W757-R843 VanDerWaalsContact O-CA 3.26Å; W757-R843 WeakPolarHBondContact O-CA 3.42Å; W757-F844 WeakPolarHBondContact O-CD2 3.21Å; W757-F844 PolarHBondContact O-N 3.07Å; W757-P848 HydrophobicContact CD2-CB 4Å; W757-P848 HydrophobicContact CG-CB 4.23Å; W757-P848 HydrophobicContact CZ2-CB 4.23Å; W757-P848 VanDerWaalsContact CZ2-CD 3.49Å; W757-P848 HydrophobicContact CZ2-CG 4.01Å; W757-P877 HydrophobicContact CB-CG 4.35Å; W757-W940 HydrophobicContact CH2-CH2 4.39Å; W757-W940 HydrophobicContact CH2-CZ3 4.18Å; W757-W940 HydrophobicContact CZ3-CH2 4.17Å; W757-W940 HydrophobicContact CZ3-CZ3 4.21Å
758	T	90.9	Very high	76.2	Confident	13 Å²	13	43.8 Å²	43.8	8%	0.08	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	135	-172.9	-52	0	0	0	0	111	V756 L805 L841 L842 I875	V756-T758 WeakPolarHBondContact CB-O 3.13Å; T758-L805 HydrophobicContact CG2-CD1 3.99Å; T758-L841 HydrophobicContact CG2-CD1 3.55Å; T758-L841 HydrophobicContact CG2-CD2 4.25Å; T758-L841 HydrophobicContact CG2-CG 3.72Å; T758-L842 CarbonylContact C-O 3.53Å; T758-L842 WeakPolarHBondContact CA-O 3.42Å; T758-I875 HydrophobicContact CG2-CB 4.4Å; T758-I875 CarbonylContact O-C 3.6Å; T758-I875 PolarHBondContact O-N 2.63Å
759	V	91.6	Very high	77.4	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	137.4	-177.6	59.6	0	0	0	0	110.6	V756 L761 L842 F844 I851 A871 L874	V756-V759 HydrophobicContact CG2-CB 4.42Å; V759-L761 HydrophobicContact CB-CD2 4.31Å; V759-L761 HydrophobicContact CG1-CD1 4.32Å; V759-L761 HydrophobicContact CG1-CD2 3.79Å; V759-L761 HydrophobicContact CG1-CG 4.02Å; V759-L761 HydrophobicContact CG2-CD2 3.6Å; V759-L761 HydrophobicContact CG2-CG 4.37Å; V759-L842 HydrophobicContact CG1-CB 4.35Å; V759-L842 HydrophobicContact CG1-CD2 4.21Å; V759-L842 PolarHBondContact N-O 3.19Å; V759-L842 PolarHBondContact O-N 3.01Å; V759-F844 HydrophobicContact CG1-CE2 3.85Å; V759-F844 HydrophobicContact CG1-CZ 4.13Å; V759-I851 HydrophobicContact CG1-CD1 4.47Å; V759-A871 HydrophobicContact CG2-CB 3.84Å; V759-L874 HydrophobicContact CG2-CD2 4.09Å
760	K	92	Very high	78.1	Confident	47 Å²	47	34 Å²	34	20%	0.204	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	119.9	172.6	-166.2	179.3	178.9	173	0	108.9	I840 L841 V872 E873	K760-I840 WeakPolarHBondContact CA-O 3.47Å; K760-L841 HydrophobicContact CB-CD1 4.24Å; K760-V872 PolarHBondContact O-N 2.87Å; K760-E873 HydrophobicContact CB-CB 3.62Å; K760-E873 HydrophobicContact CD-CB 3.74Å; K760-E873 HydrophobicContact CD-CG 4.46Å; K760-E873 WeakPolarHBondContact CD-OE2 3.31Å; K760-E873 WeakPolarHBondContact CE-OE2 3.35Å; K760-E873 HydrophobicContact CG-CB 4.33Å; K760-E873 PolarHBondContact N-O 3.19Å; K760-E873 IonicContact NZ-OE2 3.84Å; K760-E873 PolarHBondContact NZ-OE2 2.83Å; K760-E873 PolarHBondContact O-N 3.27Å
761	L	92.4	Very high	78.3	Confident	2 Å²	2	30 Å²	30	1%	0.01	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	122.5	-170.4	-61.4	-178.7	0	0	0	109.5	V759 I793 Y839 I840 L842 F857 A871	V759-L761 HydrophobicContact CB-CD2 4.31Å; V759-L761 HydrophobicContact CG1-CD1 4.32Å; V759-L761 HydrophobicContact CG1-CD2 3.79Å; V759-L761 HydrophobicContact CG1-CG 4.02Å; V759-L761 HydrophobicContact CG2-CD2 3.6Å; V759-L761 HydrophobicContact CG2-CG 4.37Å; L761-I793 HydrophobicContact CD1-CD1 3.92Å; L761-Y839 CarbonylContact O-C 3.54Å; L761-Y839 VanDerWaalsContact O-CA 3.25Å; L761-Y839 WeakPolarHBondContact O-CA 3.4Å; L761-I840 PolarHBondContact N-O 2.88Å; L761-I840 PolarHBondContact O-N 2.81Å; L761-L842 HydrophobicContact CD1-CB 3.84Å; L761-L842 HydrophobicContact CD1-CD1 3.77Å; L761-L842 HydrophobicContact CD1-CG 4.33Å; L761-L842 HydrophobicContact CG-CB 4.48Å; L761-F857 HydrophobicContact CB-CE1 3.61Å; L761-F857 HydrophobicContact CB-CZ 3.65Å; L761-F857 HydrophobicContact CD1-CD1 4.42Å; L761-F857 HydrophobicContact CD1-CD2 4.49Å; L761-F857 HydrophobicContact CD1-CE1 4.16Å; L761-F857 HydrophobicContact CD1-CE2 4.28Å; L761-F857 HydrophobicContact CD1-CZ 4.11Å; L761-F857 HydrophobicContact CD2-CD1 3.74Å; L761-F857 HydrophobicContact CD2-CE1 3.64Å; L761-F857 HydrophobicContact CD2-CZ 4.38Å; L761-F857 HydrophobicContact CG-CD1 4.45Å; L761-F857 HydrophobicContact CG-CE1 4Å; L761-F857 HydrophobicContact CG-CZ 4.26Å; L761-A871 HydrophobicContact CD2-CB 4.12Å
762	K	90.2	Very high	78.1	Confident	60 Å²	60	32 Å²	32	26%	0.261	16%	0.16	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	117.5	171.9	-177.8	171.7	-172.5	155.5	0	109.3	I764 Y839 G869 Y870 V872	K762-I764 HydrophobicContact CG-CG1 4.2Å; K762-Y839 HydrophobicContact CB-CD1 3.74Å; K762-Y839 HydrophobicContact CB-CE1 3.68Å; K762-Y839 HydrophobicContact CD-CE1 3.74Å; K762-Y839 HydrophobicContact CG-CD1 4.13Å; K762-Y839 HydrophobicContact CG-CE1 3.74Å; K762-Y839 PolarHBondContact NZ-OH 3.12Å; K762-G869 WeakPolarHBondContact O-CA 3.3Å; K762-Y870 PolarHBondContact N-O 3.36Å; K762-Y870 PolarHBondContact O-N 3.16Å; K762-V872 HydrophobicContact CB-CG2 3.54Å; K762-V872 HydrophobicContact CD-CG2 4.32Å
763	L	88.4	Confident	77.6	Confident	8 Å²	8	36.6 Å²	36.6	4%	0.042	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	138.7	169.4	-61.9	-171.2	0	0	0	109.4	I784 T838 I840 F857 T867	L763-I784 HydrophobicContact CD1-CG2 4.31Å; L763-T838 HydrophobicContact CD1-CG2 4.32Å; L763-T838 PolarHBondContact N-O 3.1Å; L763-I840 HydrophobicContact CD1-CD1 3.77Å; L763-I840 HydrophobicContact CD1-CG1 4.41Å; L763-I840 HydrophobicContact CD2-CD1 4.09Å; L763-I840 HydrophobicContact CG-CD1 4.06Å; L763-I840 HydrophobicContact CG-CG1 4.47Å; L763-F857 HydrophobicContact CD2-CE2 4.13Å; L763-F857 HydrophobicContact CD2-CZ 4Å; L763-T867 HydrophobicContact CD1-CG2 4.38Å; L763-T867 WeakPolarHBondContact CD2-OG1 3.34Å
764	I	76.9	Confident	76	Confident	59 Å²	59	45.2 Å²	45.2	30%	0.303	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	-38.7	179.4	-60.8	178.5	0	0	0	110.8	F737 K762 I868 Y870	F737-I764 HydrophobicContact CD1-CD1 4.34Å; F737-I764 HydrophobicContact CE1-CD1 4.03Å; K762-I764 HydrophobicContact CG-CG1 4.2Å; I764-I868 PolarHBondContact N-O 3.24Å; I764-Y870 HydrophobicContact CD1-CD2 3.27Å; I764-Y870 HydrophobicContact CD1-CE2 3.41Å; I764-Y870 VanDerWaalsContact CD1-CE2 3.41Å; I764-Y870 HydrophobicContact CD1-CG 4.5Å
765	R	75.5	Confident	74.6	Confident	52 Å²	52	46.6 Å²	46.6	20%	0.196	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	113.5	-176.2	-74.4	161.6	174.5	-148.3	-7.5	109.6	Y349 S350 N352 W393 T867 I868	Y349-R765 PolarHBondContact O-NH1 2.86Å; Y349-R765 VanDerWaalsContact O-NH1 3.1Å; S350-R765 VanDerWaalsContact C-NH1 3.29Å; S350-R765 WeakPolarHBondContact O-CD 3.32Å; S350-R765 PolarHBondContact O-NH1 3.45Å; N352-R765 VanDerWaalsContact OD1-CZ 3.26Å; N352-R765 PolarHBondContact OD1-NH1 2.78Å; N352-R765 PolarHBondContact OD1-NH2 3.21Å; W393-R765 HydrophobicContact CH2-CB 3.7Å; W393-R765 HydrophobicContact CH2-CG 3.62Å; W393-R765 HydrophobicContact CZ3-CB 4.11Å; W393-R765 VanDerWaalsContact CZ3-CD 3.46Å; W393-R765 HydrophobicContact CZ3-CG 3.47Å; W393-R765 VanDerWaalsContact CZ3-CG 3.47Å; R765-T867 CarbonylContact O-C 3.57Å; R765-T867 VanDerWaalsContact O-CA 3.28Å; R765-T867 WeakPolarHBondContact O-CA 3.44Å; R765-I868 HydrophobicContact CB-CB 4.29Å; R765-I868 PolarHBondContact N-O 2.82Å; R765-I868 PolarHBondContact O-N 3.09Å
766	R	76.8	Confident	73.1	Confident	57 Å²	57	52.7 Å²	52.7	22%	0.215	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	113.3	170.8	-62.2	-173	-168.9	176	11.9	106.9	P768 L781 T782 D836 T838 T867	R766-P768 WeakPolarHBondContact O-CD 3.42Å; R766-L781 HydrophobicContact CB-CB 4.23Å; R766-L781 HydrophobicContact CB-CD2 4.36Å; R766-T782 WeakPolarHBondContact CB-OG1 3.26Å; R766-T782 WeakPolarHBondContact CD-O 3.48Å; R766-D836 IonicContact NH2-OD2 3.9Å; R766-D836 PolarHBondContact NH2-OD2 2.84Å; R766-T838 PolarHBondContact NH2-OG1 3.09Å; R766-T867 HydrophobicContact CB-CG2 4.37Å; R766-T867 HydrophobicContact CG-CG2 4.07Å
767	L	76.2	Confident	71.5	Confident	5 Å²	5	54.3 Å²	54.3	3%	0.026	28%	0.283	C	S	.	.			trans	-69.5	120.8	-178	-83.7	74	0	0	0	107.9	Q346 L347 S350 I769 T782 K866 I868	Q346-L767 HydrophobicContact CB-CD2 4.09Å; Q346-L767 HydrophobicContact CB-CG 4.43Å; L347-L767 HydrophobicContact CB-CD2 4.38Å; L347-L767 HydrophobicContact CD1-CD2 4.44Å; S350-L767 WeakPolarHBondContact OG-CD1 3.14Å; S350-L767 WeakPolarHBondContact OG-CG 3.49Å; L767-I769 PolarHBondContact O-N 3.45Å; L767-T782 WeakPolarHBondContact O-CG2 3.37Å; L767-K866 HydrophobicContact CB-CB 4.22Å; L767-K866 HydrophobicContact CD1-CB 4.16Å; L767-K866 HydrophobicContact CD2-CB 3.95Å; L767-K866 HydrophobicContact CD2-CD 3.9Å; L767-K866 HydrophobicContact CG-CB 4.33Å; L767-K866 PolarHBondContact N-O 3.1Å; L767-K866 VanDerWaalsContact N-O 3.16Å; L767-I868 HydrophobicContact CD1-CG1 4.1Å
768	P	67.7	Low	69.9	Low	5 Å²	5	57.8 Å²	57.8	3%	0.032	31%	0.31	C	S	.	.			trans	-70.4	136.3	-172	28.4	-35.2	0	0	0	111.4	Q346 R766 V770 V779 I780	Q346-P768 PolarHBondContact NE2-O 3.22Å; Q346-P768 VanDerWaalsContact NE2-O 3.08Å; Q346-P768 PolarHBondContact OE1-O 3.45Å; Q346-P768 VanDerWaalsContact OE1-O 3.1Å; R766-P768 WeakPolarHBondContact O-CD 3.42Å; P768-V770 HydrophobicContact CB-CG2 3.64Å; P768-V770 HydrophobicContact CG-CG2 3.68Å; P768-V770 WeakPolarHBondContact O-CG2 3.43Å; P768-V770 PolarHBondContact O-N 3.05Å; P768-V779 HydrophobicContact CB-CG1 3.54Å; P768-V779 HydrophobicContact CG-CG1 4.33Å; P768-I780 CarbonylContact C-O 3.54Å; P768-I780 WeakPolarHBondContact CA-O 3.47Å
769	I	66.7	Low	68.4	Low	77 Å²	77	59.7 Å²	59.7	40%	0.395	32%	0.321	S	S	.	.			trans	-75.7	72.9	175.1	-48.1	173.5	0	0	0	108.2	L767 S771 I780 T782 L865	L767-I769 PolarHBondContact O-N 3.45Å; I769-S771 PolarHBondContact O-N 2.92Å; I769-I780 HydrophobicContact CD1-CG2 4.32Å; I769-I780 PolarHBondContact N-O 3.04Å; I769-T782 HydrophobicContact CG1-CG2 4.09Å; I769-L865 HydrophobicContact CD1-CD2 3.46Å; I769-L865 VanDerWaalsContact CD1-CD2 3.46Å; I769-L865 HydrophobicContact CG1-CD2 3.82Å
770	V	60.9	Low	67.1	Low	25 Å²	25	64.3 Å²	64.3	15%	0.152	34%	0.344	C	S	.	.			trans	-88.3	97.3	-173.6	-149.3	0	0	0	0	112.1	P768 F772 P777	P768-V770 HydrophobicContact CB-CG2 3.64Å; P768-V770 HydrophobicContact CG-CG2 3.68Å; P768-V770 WeakPolarHBondContact O-CG2 3.43Å; P768-V770 PolarHBondContact O-N 3.05Å; V770-F772 VanDerWaalsContact C-N 3.34Å; V770-F772 HydrophobicContact CB-CD2 3.92Å; V770-F772 HydrophobicContact CB-CE1 4.13Å; V770-F772 HydrophobicContact CB-CE2 3.5Å; V770-F772 HydrophobicContact CB-CG 4.44Å; V770-F772 HydrophobicContact CB-CZ 3.65Å; V770-F772 HydrophobicContact CG1-CD1 3.55Å; V770-F772 HydrophobicContact CG1-CD2 3.84Å; V770-F772 HydrophobicContact CG1-CE1 3.19Å; V770-F772 HydrophobicContact CG1-CE2 3.53Å; V770-F772 HydrophobicContact CG1-CG 3.88Å; V770-F772 HydrophobicContact CG1-CZ 3.22Å; V770-F772 HydrophobicContact CG2-CE2 4.21Å; V770-F772 HydrophobicContact CG2-CZ 4.1Å; V770-F772 PolarHBondContact O-N 3.4Å; V770-F772 VanDerWaalsContact O-N 3.12Å; V770-P777 HydrophobicContact CG1-CG 4.28Å
771	S	55.8	Low	65.9	Low	72 Å²	72	66.2 Å²	66.2	50%	0.503	36%	0.357	S	S	.	.			trans	-79.3	79.7	167.2	169.1	0	0	0	0	110.3	I769 K773	I769-S771 PolarHBondContact O-N 2.92Å; S771-K773 PolarHBondContact O-N 2.84Å
772	F	55.3	Low	65	Low	48 Å²	48	66.3 Å²	66.3	21%	0.211	36%	0.357	C	S	.	.			trans	-69.2	70.7	173.9	-61.6	-68.7	0	0	0	113	L342 Q385 Q388 I389 V770 P777	L342-F772 HydrophobicContact CD1-CD2 3.96Å; L342-F772 HydrophobicContact CD2-CD2 4.2Å; L342-F772 HydrophobicContact CD2-CE2 4Å; Q385-F772 VanDerWaalsContact OE1-CD2 3.23Å; Q388-F772 HydrophobicContact CB-CE1 3.88Å; Q388-F772 HydrophobicContact CB-CZ 4.12Å; Q388-F772 HydrophobicContact CG-CE1 4.25Å; Q388-F772 VanDerWaalsContact NE2-CD1 3.27Å; I389-F772 HydrophobicContact CG1-CZ 4.4Å; V770-F772 VanDerWaalsContact C-N 3.34Å; V770-F772 HydrophobicContact CB-CD2 3.92Å; V770-F772 HydrophobicContact CB-CE1 4.13Å; V770-F772 HydrophobicContact CB-CE2 3.5Å; V770-F772 HydrophobicContact CB-CG 4.44Å; V770-F772 HydrophobicContact CB-CZ 3.65Å; V770-F772 HydrophobicContact CG1-CD1 3.55Å; V770-F772 HydrophobicContact CG1-CD2 3.84Å; V770-F772 HydrophobicContact CG1-CE1 3.19Å; V770-F772 HydrophobicContact CG1-CE2 3.53Å; V770-F772 HydrophobicContact CG1-CG 3.88Å; V770-F772 HydrophobicContact CG1-CZ 3.22Å; V770-F772 HydrophobicContact CG2-CE2 4.21Å; V770-F772 HydrophobicContact CG2-CZ 4.1Å; V770-F772 PolarHBondContact O-N 3.4Å; V770-F772 VanDerWaalsContact O-N 3.12Å; F772-P777 HydrophobicContact CD1-CG 4.15Å
773	K	54.1	Low	64.5	Low	167 Å²	167	66.7 Å²	66.7	73%	0.726	37%	0.366	S	S	*	.			trans	-74.9	154.9	153.8	-65	-179.1	-178.5	178.1	0	108.1	S771 G775	S771-K773 PolarHBondContact O-N 2.84Å; K773-G775 PolarHBondContact O-N 2.79Å; K773-G775 VanDerWaalsContact O-N 3.1Å
774	L	43.7	Very low	64.2	Low	190 Å²	190	67.2 Å²	67.2	100%	0.995	37%	0.368	S	S	*	.	S	Bend	trans	-52.6	118.1	179.6	-102.8	68.8	0	0	0	111
775	G	50.8	Low	64.7	Low	49 Å²	49	64.4 Å²	64.4	51%	0.505	35%	0.354	S	S	.	.	S	Bend	trans	138.4	-176.1	-173.1	0	0	0	0	0	111.3	K773 P777	K773-G775 PolarHBondContact O-N 2.79Å; K773-G775 VanDerWaalsContact O-N 3.1Å; G775-P777 VanDerWaalsContact C-CD 3.49Å; G775-P777 WeakPolarHBondContact O-CD 3.36Å
776	N	53.5	Low	65.2	Low	141 Å²	141	64.8 Å²	64.8	75%	0.754	37%	0.365	S	S	*	.			trans	-97.8	86.3	166.4	-72	-12.2	0	0	0	108	Y384	Y384-N776 PolarHBondContact OH-OD1 3.48Å
777	P	52.4	Low	65.9	Low	33 Å²	33	67 Å²	67	21%	0.214	38%	0.38	C	S	.	.			trans	-65.1	145.2	174.2	30.3	-36.6	0	0	0	110	V770 F772 G775 V779	V770-P777 HydrophobicContact CG1-CG 4.28Å; F772-P777 HydrophobicContact CD1-CG 4.15Å; G775-P777 VanDerWaalsContact C-CD 3.49Å; G775-P777 WeakPolarHBondContact O-CD 3.36Å; P777-V779 PolarHBondContact O-N 2.8Å
778	P	55.7	Low	66.4	Low	104 Å²	104	69.1 Å²	69.1	68%	0.675	40%	0.402	S	S	*	.			trans	-59.2	135.8	171	25.6	-33.4	0	0	0	109.8	I780	P778-I780 PolarHBondContact O-N 3.39Å
779	V	59.6	Low	67.5	Low	52 Å²	52	70.7 Å²	70.7	32%	0.315	41%	0.409	S	S	.	.			trans	-76.3	90	176.5	178	0	0	0	0	108	A392 P768 P777 L781	A392-V779 HydrophobicContact CB-CB 4.3Å; A392-V779 HydrophobicContact CB-CG1 3.64Å; A392-V779 HydrophobicContact CB-CG2 3.68Å; P768-V779 HydrophobicContact CB-CG1 3.54Å; P768-V779 HydrophobicContact CG-CG1 4.33Å; P777-V779 PolarHBondContact O-N 2.8Å; V779-L781 PolarHBondContact O-N 3.23Å
780	I	64.3	Low	68.8	Low	97 Å²	97	72.5 Å²	72.5	50%	0.497	41%	0.411	S	S	.	.			trans	-76.8	111.5	176.4	-57.9	174.7	0	0	0	108.1	P768 I769 P778	P768-I780 CarbonylContact C-O 3.54Å; P768-I780 WeakPolarHBondContact CA-O 3.47Å; I769-I780 HydrophobicContact CD1-CG2 4.32Å; I769-I780 PolarHBondContact N-O 3.04Å; P778-I780 PolarHBondContact O-N 3.39Å
781	L	66.7	Low	70.4	Confident	88 Å²	88	71.3 Å²	71.3	46%	0.461	40%	0.404	S	S	.	.	P	Polyproline II helix	trans	-62.9	147.4	170.9	-63.1	177.6	0	0	0	109.9	R766 V779	R766-L781 HydrophobicContact CB-CB 4.23Å; R766-L781 HydrophobicContact CB-CD2 4.36Å; V779-L781 PolarHBondContact O-N 3.23Å
782	T	73.5	Confident	72.2	Confident	3 Å²	3	68.3 Å²	68.3	2%	0.018	38%	0.383	C	S	.	.	P	Polyproline II helix	trans	-54.7	133.8	170.1	48.8	0	0	0	0	109.8	R766 L767 I769 L865 T867	R766-T782 WeakPolarHBondContact CB-OG1 3.26Å; R766-T782 WeakPolarHBondContact CD-O 3.48Å; L767-T782 WeakPolarHBondContact O-CG2 3.37Å; I769-T782 HydrophobicContact CG1-CG2 4.09Å; T782-L865 HydrophobicContact CG2-CB 4.1Å; T782-L865 HydrophobicContact CG2-CD2 3.87Å; T782-T867 WeakPolarHBondContact OG1-CG2 3.43Å
783	P	79.2	Confident	74	Confident	68 Å²	68	66.1 Å²	66.1	44%	0.442	37%	0.373	S	S	.	.	P	Polyproline II helix	trans	-60.2	167.1	172.7	26.9	-35	0	0	0	110.6	W861 L865	P783-W861 WeakPolarHBondContact O-CH2 3.37Å; P783-W861 WeakPolarHBondContact O-CZ2 3.4Å; P783-L865 HydrophobicContact CG-CD1 3.85Å
784	I	83.6	Confident	76	Confident	20 Å²	20	58.5 Å²	58.5	10%	0.103	34%	0.34	C	S	.	.	P	Polyproline II helix	trans	-86.8	132.6	173.6	-54.4	153.5	0	0	0	107.7	L763 S786 R807 Y809 T838 I840	L763-I784 HydrophobicContact CD1-CG2 4.31Å; I784-S786 PolarHBondContact O-N 3.38Å; I784-R807 HydrophobicContact CG2-CG 4.09Å; I784-R807 PolarHBondContact O-NH1 2.76Å; I784-Y809 HydrophobicContact CD1-CD1 4.47Å; I784-Y809 HydrophobicContact CD1-CE1 3.35Å; I784-Y809 WeakPolarHBondContact CD1-OH 3.37Å; I784-T838 HydrophobicContact CD1-CG2 3.77Å; I784-T838 HydrophobicContact CG1-CG2 4.2Å; I784-T838 HydrophobicContact CG2-CG2 4.07Å; I784-I840 HydrophobicContact CG2-CD1 4Å; I784-I840 HydrophobicContact CG2-CG1 4.29Å
785	P	86.7	Confident	78.2	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	29%	0.293	C	S	.	.	P	Polyproline II helix	trans	-57.9	135.3	177.7	25.9	-36.3	0	0	0	111.2	V791 V804 R807 I840 L859 W861	P785-V791 HydrophobicContact CB-CG1 3.75Å; P785-V791 HydrophobicContact CG-CG1 4.16Å; P785-V804 HydrophobicContact CB-CG2 4.14Å; P785-V804 HydrophobicContact CG-CG2 4.07Å; P785-R807 WeakPolarHBondContact O-CD 3.13Å; P785-I840 HydrophobicContact CG-CD1 3.59Å; P785-L859 HydrophobicContact CG-CD2 4.1Å; P785-W861 HydrophobicContact CB-CD2 3.92Å; P785-W861 HydrophobicContact CB-CE3 4.3Å; P785-W861 HydrophobicContact CB-CG 4.14Å; P785-W861 HydrophobicContact CG-CD2 4.3Å; P785-W861 HydrophobicContact CG-CE3 4.2Å; P785-W861 HydrophobicContact CG-CZ3 4.4Å
786	S	87.1	Confident	80	Confident	60 Å²	60	47.5 Å²	47.5	42%	0.42	27%	0.272	S	S	.	.	P	Polyproline II helix	trans	-68.8	158.1	-176.2	-65.4	0	0	0	0	112.6	I784 G788 Q789 V804	I784-S786 PolarHBondContact O-N 3.38Å; S786-G788 PolarHBondContact O-N 3.25Å; S786-Q789 WeakPolarHBondContact O-CB 3.47Å; S786-Q789 PolarHBondContact O-N 3.2Å; S786-V804 WeakPolarHBondContact O-CB 3.36Å
787	I	89.6	Confident	81.8	Confident	104 Å²	104	40.9 Å²	40.9	53%	0.533	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.1	137.8	170.2	-64.8	170.7	0	0	0	109.3	Q789 L805 R807	I787-Q789 PolarHBondContact O-N 3.36Å; I787-L805 WeakPolarHBondContact CG2-O 3.49Å; I787-R807 HydrophobicContact CG1-CG 4.38Å
788	G	88.2	Confident	83.7	Confident	48 Å²	48	39.4 Å²	39.4	50%	0.495	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	77.3	-7.9	-172.5	0	0	0	0	0	114.9	S786 R790 V804	S786-G788 PolarHBondContact O-N 3.25Å; G788-R790 PolarHBondContact O-N 3.19Å; G788-V804 WeakPolarHBondContact CA-O 3.31Å; G788-V804 PolarHBondContact N-O 3.45Å
789	Q	91	Very high	85.4	Confident	39 Å²	39	37.2 Å²	37.2	18%	0.182	21%	0.214	C	C	.	.			trans	-71.4	132.9	-176.9	-167.3	166.1	17.1	0	0	111.8	S786 I787 V804 W861 N862	S786-Q789 WeakPolarHBondContact O-CB 3.47Å; S786-Q789 PolarHBondContact O-N 3.2Å; I787-Q789 PolarHBondContact O-N 3.36Å; Q789-V804 PolarHBondContact O-N 3.03Å; Q789-V804 VanDerWaalsContact O-N 3.1Å; Q789-W861 VanDerWaalsContact NE2-CD1 3.31Å; Q789-N862 PolarHBondContact NE2-ND2 3.26Å; Q789-N862 PolarHBondContact NE2-OD1 2.66Å
790	R	93.1	Very high	86.9	Confident	115 Å²	115	35 Å²	35	43%	0.434	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75	123.5	170.7	-75.6	-179.9	171	-79.3	4.1	110.1	G788 G802 V803 E934	G788-R790 PolarHBondContact O-N 3.19Å; R790-G802 WeakPolarHBondContact CA-O 3.36Å; R790-V803 HydrophobicContact CG-CG2 4.12Å; R790-E934 IonicContact CZ-OE1 3.15Å; R790-E934 IonicContact NE-OE1 3.05Å; R790-E934 PolarHBondContact NE-OE1 3.13Å; R790-E934 IonicContact NH2-OE1 3.82Å; R790-E934 PolarHBondContact NH2-OE1 2.98Å; R790-E934 IonicContact NH2-OE2 2.63Å; R790-E934 PolarHBondContact NH2-OE2 3.34Å
791	V	93.9	Very high	88.3	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	155.5	-176.6	-63.5	0	0	0	0	109.3	P785 T801 G802 V804 L842 L859 T860 W861	P785-V791 HydrophobicContact CB-CG1 3.75Å; P785-V791 HydrophobicContact CG-CG1 4.16Å; V791-T801 CarbonylContact O-C 3.54Å; V791-T801 VanDerWaalsContact O-CA 3.23Å; V791-T801 WeakPolarHBondContact O-CA 3.38Å; V791-G802 PolarHBondContact N-O 3.3Å; V791-G802 PolarHBondContact O-N 2.86Å; V791-V804 HydrophobicContact CG1-CG2 3.82Å; V791-V804 HydrophobicContact CG2-CG2 4.17Å; V791-L842 HydrophobicContact CG2-CD1 3.52Å; V791-L842 HydrophobicContact CG2-CG 4.31Å; V791-L859 HydrophobicContact CB-CD1 3.8Å; V791-L859 HydrophobicContact CB-CG 4.23Å; V791-L859 HydrophobicContact CG2-CD1 3.75Å; V791-T860 CarbonylContact C-O 3.53Å; V791-T860 WeakPolarHBondContact CA-O 3.47Å; V791-W861 HydrophobicContact CG1-CB 4.04Å
792	S	94	Very high	89.5	Confident	9 Å²	9	28.3 Å²	28.3	6%	0.063	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	122.5	173.9	-41.3	0	0	0	0	109.3	R313 Q800 L859 T860	R313-S792 PolarHBondContact NH2-OG 3.44Å; S792-Q800 WeakPolarHBondContact CA-O 3.5Å; S792-L859 CarbonylContact O-C 3.56Å; S792-T860 WeakPolarHBondContact CB-OG1 3.34Å; S792-T860 PolarHBondContact N-O 3.01Å; S792-T860 PolarHBondContact O-N 2.89Å; S792-T860 PolarHBondContact O-OG1 2.79Å
793	I	94.2	Very high	90.5	Very high	2 Å²	2	29.9 Å²	29.9	1%	0.01	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	133.5	-177	-179.6	171.8	0	0	0	110.4	L761 Q800 L842 F844 F857 L859	L761-I793 HydrophobicContact CD1-CD1 3.92Å; I793-Q800 WeakPolarHBondContact CG2-O 3.28Å; I793-Q800 PolarHBondContact N-O 3.26Å; I793-Q800 PolarHBondContact O-N 2.89Å; I793-Q800 VanDerWaalsContact O-N 3.13Å; I793-L842 HydrophobicContact CB-CD1 4.45Å; I793-L842 HydrophobicContact CD1-CD1 4.39Å; I793-L842 HydrophobicContact CD1-CD2 4.5Å; I793-L842 HydrophobicContact CG2-CD2 4.38Å; I793-F844 HydrophobicContact CD1-CE1 4.48Å; I793-F844 HydrophobicContact CD1-CZ 4.3Å; I793-F844 HydrophobicContact CG2-CD1 4.29Å; I793-F844 HydrophobicContact CG2-CE1 3.58Å; I793-F844 HydrophobicContact CG2-CZ 4.4Å; I793-F857 HydrophobicContact CD1-CB 4.11Å; I793-F857 HydrophobicContact CD1-CG 4.37Å; I793-F857 HydrophobicContact CG1-CB 4.01Å; I793-L859 HydrophobicContact CB-CD1 4.02Å
794	Y	94.3	Very high	91.2	Very high	6 Å²	6	26.7 Å²	26.7	2%	0.024	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	110.8	176.9	-57.7	-88.9	0	0	0	108.9	R313 L316 A317 V798 C799 F857 I858 T860	R313-Y794 WeakPolarHBondContact CA-OH 3.39Å; R313-Y794 VanDerWaalsContact CB-OH 3.3Å; R313-Y794 WeakPolarHBondContact CB-OH 3.28Å; R313-Y794 VanDerWaalsContact CG-OH 3.25Å; R313-Y794 WeakPolarHBondContact CG-OH 3.31Å; R313-Y794 WeakPolarHBondContact O-CE1 3.5Å; L316-Y794 HydrophobicContact CB-CD1 4.2Å; L316-Y794 HydrophobicContact CB-CD2 4.08Å; L316-Y794 HydrophobicContact CB-CE1 4.15Å; L316-Y794 HydrophobicContact CB-CE2 4.04Å; L316-Y794 HydrophobicContact CB-CG 4.17Å; L316-Y794 HydrophobicContact CD1-CD2 4.28Å; L316-Y794 HydrophobicContact CD1-CE2 3.87Å; A317-Y794 HydrophobicContact CB-CD1 3.99Å; A317-Y794 HydrophobicContact CB-CE1 3.97Å; Y794-V798 CarbonylContact C-O 3.57Å; Y794-V798 WeakPolarHBondContact CA-O 3.49Å; Y794-C799 HydrophobicContact CD1-CB 4.2Å; Y794-C799 HydrophobicContact CE1-CB 4.42Å; Y794-C799 WeakPolarHBondContact CE1-SG 3.42Å; Y794-F857 CarbonylContact O-C 3.57Å; Y794-F857 VanDerWaalsContact O-CA 3.24Å; Y794-F857 WeakPolarHBondContact O-CA 3.49Å; Y794-I858 PolarHBondContact N-O 3.13Å; Y794-I858 PolarHBondContact O-N 2.67Å; Y794-T860 HydrophobicContact CE2-CG2 4.27Å
795	A	91.8	Very high	91.5	Very high	1 Å²	1	29.2 Å²	29.2	1%	0.008	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	83.2	-176.4	0	0	0	0	0	110.4	C797 V798 R855 F857	A795-C797 PolarHBondContact O-N 3.05Å; A795-V798 HydrophobicContact CB-CB 4.26Å; A795-V798 PolarHBondContact N-O 3.22Å; A795-V798 PolarHBondContact O-N 2.85Å; A795-R855 HydrophobicContact CB-CG 3.88Å; A795-R855 PolarHBondContact O-NE 2.86Å; A795-R855 PolarHBondContact O-NH2 2.79Å; A795-F857 HydrophobicContact CB-CB 4.09Å
796	G	88.7	Confident	91.6	Very high	7 Å²	7	33.7 Å²	33.7	7%	0.072	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.6	-117.7	-167.1	0	0	0	0	0	112	A320 C321 V798 R855	A320-G796 CarbonylContact C-O 3.4Å; A320-G796 WeakPolarHBondContact O-CA 3.42Å; C321-G796 WeakPolarHBondContact CA-O 3.15Å; C321-G796 PolarHBondContact N-O 3.44Å; C321-G796 PolarHBondContact SG-O 3.5Å; G796-V798 VanDerWaalsContact C-N 3.33Å; G796-R855 VanDerWaalsContact CA-NH2 3.33Å
797	C	90.3	Very high	91.5	Very high	3 Å²	3	34.6 Å²	34.6	2%	0.02	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-19.2	175.6	55.2	0	0	0	0	114.7	W526 G698 A795 C799	W526-C797 HydrophobicContact CB-CB 3.83Å; W526-C797 HydrophobicContact CG-CB 4.24Å; G698-C797 WeakPolarHBondContact CA-O 3.48Å; A795-C797 PolarHBondContact O-N 3.05Å; C797-C799 PolarHBondContact O-N 2.86Å
798	V	92	Very high	91.1	Very high	1 Å²	1	32 Å²	32	1%	0.006	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	119.4	177.2	178.9	0	0	0	0	109	Y794 A795 G796 F844 E849	Y794-V798 CarbonylContact C-O 3.57Å; Y794-V798 WeakPolarHBondContact CA-O 3.49Å; A795-V798 HydrophobicContact CB-CB 4.26Å; A795-V798 PolarHBondContact N-O 3.22Å; A795-V798 PolarHBondContact O-N 2.85Å; G796-V798 VanDerWaalsContact C-N 3.33Å; V798-F844 HydrophobicContact CG1-CE1 4.04Å; V798-E849 HydrophobicContact CG1-CB 4.26Å; V798-E849 HydrophobicContact CG1-CG 3.85Å; V798-E849 HydrophobicContact CG2-CB 4.05Å; V798-E849 HydrophobicContact CG2-CG 4.32Å
799	C	91.2	Very high	90.5	Very high	58 Å²	58	34.8 Å²	34.8	39%	0.392	17%	0.168	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	87.6	178.2	170.6	0	0	0	0	108.8	Y794 C797	Y794-C799 HydrophobicContact CD1-CB 4.2Å; Y794-C799 HydrophobicContact CE1-CB 4.42Å; Y794-C799 WeakPolarHBondContact CE1-SG 3.42Å; C797-C799 PolarHBondContact O-N 2.86Å
800	Q	91.2	Very high	89	Confident	7 Å²	7	37.6 Å²	37.6	3%	0.033	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	157.3	-168.5	-174	135.9	-81.3	0	0	112	S792 I793 F844 R846 H847 E849	S792-Q800 WeakPolarHBondContact CA-O 3.5Å; I793-Q800 WeakPolarHBondContact CG2-O 3.28Å; I793-Q800 PolarHBondContact N-O 3.26Å; I793-Q800 PolarHBondContact O-N 2.89Å; I793-Q800 VanDerWaalsContact O-N 3.13Å; Q800-F844 HydrophobicContact CB-CD1 4.27Å; Q800-F844 HydrophobicContact CG-CD1 4.17Å; Q800-R846 VanDerWaalsContact OE1-CZ 3.28Å; Q800-H847 PolarHBondContact NE2-O 2.82Å; Q800-E849 PolarHBondContact NE2-OE1 3.03Å; Q800-E849 VanDerWaalsContact NE2-OE1 3.11Å
801	T	93.8	Very high	86.8	Confident	43 Å²	43	34.9 Å²	34.9	26%	0.264	18%	0.179	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	137.6	164.7	48	0	0	0	0	110.9	V791 A845	V791-T801 CarbonylContact O-C 3.54Å; V791-T801 VanDerWaalsContact O-CA 3.23Å; V791-T801 WeakPolarHBondContact O-CA 3.38Å; T801-A845 WeakPolarHBondContact O-CB 3.3Å; T801-A845 PolarHBondContact O-N 2.88Å
802	G	93.1	Very high	84.6	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	175.4	167.6	0	0	0	0	0	111.9	R790 V791 R843	R790-G802 WeakPolarHBondContact CA-O 3.36Å; V791-G802 PolarHBondContact N-O 3.3Å; V791-G802 PolarHBondContact O-N 2.86Å; G802-R843 CarbonylContact C-O 3.16Å; G802-R843 WeakPolarHBondContact CA-O 3.46Å
803	V	94.1	Very high	82.1	Confident	36 Å²	36	44.7 Å²	44.7	22%	0.218	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	132.6	172.4	-178.3	0	0	0	0	107.8	R790 L805 R843	R790-V803 HydrophobicContact CG-CG2 4.12Å; V803-L805 PolarHBondContact O-N 2.66Å; V803-R843 PolarHBondContact N-O 2.76Å; V803-R843 PolarHBondContact O-N 2.81Å
804	V	92.9	Very high	79.4	Confident	1 Å²	1	50.9 Å²	50.9	1%	0.006	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	119.4	171.9	174	0	0	0	0	108.9	P785 S786 G788 Q789 V791 R807 I840	P785-V804 HydrophobicContact CB-CG2 4.14Å; P785-V804 HydrophobicContact CG-CG2 4.07Å; S786-V804 WeakPolarHBondContact O-CB 3.36Å; G788-V804 WeakPolarHBondContact CA-O 3.31Å; G788-V804 PolarHBondContact N-O 3.45Å; Q789-V804 PolarHBondContact O-N 3.03Å; Q789-V804 VanDerWaalsContact O-N 3.1Å; V791-V804 HydrophobicContact CG1-CG2 3.82Å; V791-V804 HydrophobicContact CG2-CG2 4.17Å; V804-R807 HydrophobicContact CG1-CG 4.41Å; V804-I840 HydrophobicContact CB-CG2 4.49Å; V804-I840 HydrophobicContact CG1-CG2 4.05Å; V804-I840 HydrophobicContact CG2-CG2 3.94Å
805	L	91.2	Very high	76.7	Confident	74 Å²	74	59.5 Å²	59.5	39%	0.387	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	-40.4	176	-60.5	-173.8	0	0	0	111.7	T758 I787 V803 L841 R843	T758-L805 HydrophobicContact CG2-CD1 3.99Å; I787-L805 WeakPolarHBondContact CG2-O 3.49Å; V803-L805 PolarHBondContact O-N 2.66Å; L805-L841 HydrophobicContact CB-CB 4.34Å; L805-L841 HydrophobicContact CB-CD2 4.17Å; L805-L841 HydrophobicContact CB-CG 4.28Å; L805-L841 HydrophobicContact CD1-CD2 4.21Å; L805-L841 HydrophobicContact CD1-CG 4.38Å; L805-L841 PolarHBondContact N-O 2.77Å; L805-R843 HydrophobicContact CD1-CB 3.89Å; L805-R843 HydrophobicContact CD2-CB 4.15Å; L805-R843 HydrophobicContact CG-CB 3.99Å
806	E	88.3	Confident	74.1	Confident	93 Å²	93	65.5 Å²	65.5	44%	0.435	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	151.4	-172.7	-164.4	178.8	174.9	0	0	110.8	I808 L841	E806-I808 HydrophobicContact CG-CG1 4.14Å; E806-L841 HydrophobicContact CB-CB 3.87Å; E806-L841 HydrophobicContact CB-CD2 4.42Å; E806-L841 PolarHBondContact O-N 3.21Å
807	R	84.6	Confident	71.9	Confident	79 Å²	79	68 Å²	68	30%	0.298	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	120.8	166.7	-66.8	-174.6	-68.2	-161.6	6.5	108.2	I784 P785 I787 V804 Y809	I784-R807 HydrophobicContact CG2-CG 4.09Å; I784-R807 PolarHBondContact O-NH1 2.76Å; P785-R807 WeakPolarHBondContact O-CD 3.13Å; I787-R807 HydrophobicContact CG1-CG 4.38Å; V804-R807 HydrophobicContact CG1-CG 4.41Å; R807-Y809 HydrophobicContact CB-CE2 4Å
808	I	82	Confident	69.5	Low	50 Å²	50	76.1 Å²	76.1	26%	0.256	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	120.9	177.8	-56.5	164.4	0	0	0	107	E806 Y839	E806-I808 HydrophobicContact CG-CG1 4.14Å; I808-Y839 PolarHBondContact N-O 3.37Å; I808-Y839 PolarHBondContact O-N 3.2Å
809	Y	74.5	Confident	67.2	Low	107 Å²	107	84.3 Å²	84.3	42%	0.42	41%	0.406	S	S	.	.			trans	-98.4	133.6	173.1	-61.4	-90.6	0	0	0	107.8	I784 R807 D836 T838	I784-Y809 HydrophobicContact CD1-CD1 4.47Å; I784-Y809 HydrophobicContact CD1-CE1 3.35Å; I784-Y809 WeakPolarHBondContact CD1-OH 3.37Å; R807-Y809 HydrophobicContact CB-CE2 4Å; Y809-D836 VanDerWaalsContact CD1-OD2 3.31Å; Y809-D836 WeakPolarHBondContact CD1-OD2 3.29Å; Y809-T838 HydrophobicContact CD1-CG2 4.43Å; Y809-T838 HydrophobicContact CE1-CG2 4.28Å
810	Q	59.7	Low	64.5	Low	97 Å²	97	87.7 Å²	87.7	45%	0.453	42%	0.42	S	S	.	.			trans	-127.2	102.3	175.7	-171.6	176.7	20.6	0	0	107.8	T837 Y839	Q810-T837 PolarHBondContact N-O 3Å; Q810-T837 PolarHBondContact O-OG1 3.21Å; Q810-Y839 HydrophobicContact CB-CE2 4.07Å; Q810-Y839 VanDerWaalsContact OE1-CE2 3.26Å; Q810-Y839 PolarHBondContact OE1-OH 3.44Å
811	C	47	Very low	62	Low	59 Å²	59	93.4 Å²	93.4	40%	0.399	45%	0.451	S	S	.	.			trans	-77.2	129.4	173.5	-74.3	0	0	0	0	109.2	H813 E814	C811-H813 PolarHBondContact O-N 2.97Å; C811-E814 HydrophobicContact CB-CG 4.48Å
812	K	47.4	Very low	59.5	Low	138 Å²	138	96.6 Å²	96.6	60%	0.6	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75	-7.4	179.5	-69.9	179.7	-178	168.3	0	114.9
813	H	41.7	Very low	56.9	Low	77 Å²	77	104.8 Å²	104.8	36%	0.356	50%	0.501	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.2	13.8	-172.6	-72.7	-80.8	0	0	0	114.5	C811 E815 E816 I817	C811-H813 PolarHBondContact O-N 2.97Å; H813-E815 PolarHBondContact O-N 2.84Å; H813-E815 VanDerWaalsContact O-N 3.1Å; H813-E816 IonicContact CE1-OE2 2.74Å; H813-E816 PolarHBondContact CE1-OE2 2.86Å; H813-E816 IonicContact CG-OE2 3.09Å; H813-E816 IonicContact ND1-OE2 3.55Å; H813-E816 PolarHBondContact ND1-OE2 2.84Å; H813-E816 PolarHBondContact O-N 2.84Å; H813-I817 HydrophobicContact CB-CD1 3.85Å; H813-I817 HydrophobicContact CB-CG1 4.18Å; H813-I817 WeakPolarHBondContact O-CD1 3.43Å; H813-I817 VanDerWaalsContact O-CG1 3.25Å; H813-I817 WeakPolarHBondContact O-CG1 3.15Å; H813-I817 PolarHBondContact O-N 2.81Å
814	E	37.4	Very low	54.3	Low	131 Å²	131	107.9 Å²	107.9	61%	0.612	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-20.1	-177.6	-72.2	-174.7	155.4	0	0	114.3	C811	C811-E814 HydrophobicContact CB-CG 4.48Å
815	E	37.7	Very low	51.7	Low	188 Å²	188	114.9 Å²	114.9	88%	0.879	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.8	-25.7	172.8	-66	-176.8	166.5	0	0	113.6	H813	H813-E815 PolarHBondContact O-N 2.84Å; H813-E815 VanDerWaalsContact O-N 3.1Å
816	E	37.4	Very low	49.3	Very low	126 Å²	126	117.1 Å²	117.1	59%	0.589	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.3	-26.3	178	-69.2	-178.4	142.7	0	0	112.9	H813 Q818 Q819	H813-E816 IonicContact CE1-OE2 2.74Å; H813-E816 PolarHBondContact CE1-OE2 2.86Å; H813-E816 IonicContact CG-OE2 3.09Å; H813-E816 IonicContact ND1-OE2 3.55Å; H813-E816 PolarHBondContact ND1-OE2 2.84Å; H813-E816 PolarHBondContact O-N 2.84Å; E816-Q818 VanDerWaalsContact C-N 3.25Å; E816-Q818 PolarHBondContact O-N 2.69Å; E816-Q819 PolarHBondContact O-N 3.3Å
817	I	41.4	Very low	46.8	Very low	60 Å²	60	120.1 Å²	120.1	31%	0.308	57%	0.571	S	S	.	*	G	3₁₀ helix	trans	-69.7	-20	-175.1	-72	165.2	0	0	0	112.6	H813 Q819 N820 L822	H813-I817 HydrophobicContact CB-CD1 3.85Å; H813-I817 HydrophobicContact CB-CG1 4.18Å; H813-I817 WeakPolarHBondContact O-CD1 3.43Å; H813-I817 VanDerWaalsContact O-CG1 3.25Å; H813-I817 WeakPolarHBondContact O-CG1 3.15Å; H813-I817 PolarHBondContact O-N 2.81Å; I817-Q819 PolarHBondContact O-N 3.03Å; I817-N820 PolarHBondContact O-N 3.38Å; I817-L822 HydrophobicContact CG2-CD1 3.54Å
818	Q	40.6	Very low	44.4	Very low	173 Å²	173	122.6 Å²	122.6	81%	0.808	59%	0.59	S	S	*	*	G	3₁₀ helix	trans	-69.8	-10.5	179.2	-62.8	-170.6	25	0	0	114.4	E816	E816-Q818 VanDerWaalsContact C-N 3.25Å; E816-Q818 PolarHBondContact O-N 2.69Å
819	Q	43.1	Very low	42.1	Very low	174 Å²	174	123.8 Å²	123.8	81%	0.813	60%	0.597	S	S	*	*	G	3₁₀ helix	trans	-104.4	-10.6	179.5	-77.5	-178.8	-13.5	0	0	115.2	E816 I817	E816-Q819 PolarHBondContact O-N 3.3Å; I817-Q819 PolarHBondContact O-N 3.03Å
820	N	35.2	Very low	40.1	Very low	129 Å²	129	125.3 Å²	125.3	69%	0.69	61%	0.613	S	S	*	*	S	Bend	trans	-129.4	137.8	-175.1	-73.6	-56.8	0	0	0	112.5	I817 L822	I817-N820 PolarHBondContact O-N 3.38Å; N820-L822 PolarHBondContact O-N 3.17Å; N820-L822 VanDerWaalsContact O-N 3.09Å
821	N	37.8	Very low	38.9	Very low	127 Å²	127	129.4 Å²	129.4	68%	0.679	63%	0.631	S	S	*	*			trans	-55.5	113.2	-171.1	-75.8	-39.9	0	0	0	113.3	K823 D824	N821-K823 PolarHBondContact O-N 3.41Å; N821-D824 PolarHBondContact O-N 2.92Å; N821-D824 VanDerWaalsContact O-N 3.1Å
822	L	42.2	Very low	38.4	Very low	109 Å²	109	132.7 Å²	132.7	57%	0.571	65%	0.645	S	S	*	*	H	α-helix	trans	-53.4	-24	-177.1	-159.6	74.3	0	0	0	114.5	I817 N820 I826	I817-L822 HydrophobicContact CG2-CD1 3.54Å; N820-L822 PolarHBondContact O-N 3.17Å; N820-L822 VanDerWaalsContact O-N 3.09Å; L822-I826 HydrophobicContact CG-CD1 4.15Å; L822-I826 WeakPolarHBondContact O-CD1 3.38Å; L822-I826 WeakPolarHBondContact O-CG1 3.28Å
823	K	38.9	Very low	37.8	Very low	172 Å²	172	133.8 Å²	133.8	75%	0.748	65%	0.652	S	S	*	*	H	α-helix	trans	-73.7	-34.9	-179.2	-69.5	-176.2	177.1	179.1	0	113.6	N821 M827	N821-K823 PolarHBondContact O-N 3.41Å; K823-M827 WeakPolarHBondContact O-CG 3.08Å; K823-M827 PolarHBondContact O-N 3.21Å
824	D	38.9	Very low	37.7	Very low	101 Å²	101	135.4 Å²	135.4	54%	0.54	66%	0.663	S	S	.	*	H	α-helix	trans	-79.6	-26.5	-174.9	-61.1	-38.8	0	0	0	112.2	N821 N828	N821-D824 PolarHBondContact O-N 2.92Å; N821-D824 VanDerWaalsContact O-N 3.1Å; D824-N828 PolarHBondContact O-ND2 3.1Å
825	Y	38.9	Very low	37.9	Very low	148 Å²	148	133.1 Å²	133.1	58%	0.58	66%	0.655	S	S	*	*	H	α-helix	trans	-76.1	-32.2	178	-149.8	-90.1	0	0	0	113	N829	Y825-N829 PolarHBondContact O-ND2 2.81Å
826	I	41.1	Very low	38.6	Very low	122 Å²	122	125.6 Å²	125.6	63%	0.626	62%	0.621	S	S	*	*	H	α-helix	trans	-79.6	-31.5	-179	-66.6	172.6	0	0	0	111.7	L822	L822-I826 HydrophobicContact CG-CD1 4.15Å; L822-I826 WeakPolarHBondContact O-CD1 3.38Å; L822-I826 WeakPolarHBondContact O-CG1 3.28Å
827	M	35.1	Very low	39.8	Very low	156 Å²	156	120.5 Å²	120.5	77%	0.768	60%	0.598	S	S	*	*	H	α-helix	trans	-83.7	-20.3	-175.4	-67.7	-69	-73.7	0	0	114.7	K823	K823-M827 WeakPolarHBondContact O-CG 3.08Å; K823-M827 PolarHBondContact O-N 3.21Å
828	N	35.1	Very low	41.6	Very low	130 Å²	130	117.6 Å²	117.6	70%	0.695	58%	0.583	S	S	*	*	H	α-helix	trans	-102.3	-14	-175.2	-76.1	-48.8	0	0	0	115	D824	D824-N828 PolarHBondContact O-ND2 3.1Å
829	N	32.4	Very low	43.8	Very low	75 Å²	75	110.6 Å²	110.6	40%	0.401	55%	0.55	S	S	.	.			trans	-102.9	86.2	-177.1	-78.6	-38.3	0	0	0	112.1	Y825 E831	Y825-N829 PolarHBondContact O-ND2 2.81Å; N829-E831 PolarHBondContact O-N 2.84Å
830	N	33.6	Very low	46.1	Very low	140 Å²	140	102.3 Å²	102.3	75%	0.749	51%	0.511	S	S	*	.			trans	-62.1	93.2	173	-80.3	-39.8	0	0	0	112.4	N832	N830-N832 PolarHBondContact O-N 2.91Å; N830-N832 PolarHBondContact O-ND2 3.46Å
831	E	34.7	Very low	48.8	Very low	182 Å²	182	97.4 Å²	97.4	85%	0.85	48%	0.484	S	S	*	.	S	Bend	trans	53.3	-3.7	156.1	-61.3	-166.1	135.1	0	0	120.2	N829	N829-E831 PolarHBondContact O-N 2.84Å
832	N	35.6	Very low	51.5	Low	129 Å²	129	91.3 Å²	91.3	69%	0.69	45%	0.452	S	S	*	.			trans	-122.7	-0.9	-165.4	-65.7	-77.8	0	0	0	115.8	N830	N830-N832 PolarHBondContact O-N 2.91Å; N830-N832 PolarHBondContact O-ND2 3.46Å
833	H	34.8	Very low	53.9	Low	160 Å²	160	90.5 Å²	90.5	74%	0.741	44%	0.441	S	S	*	.			trans	-118.3	91.2	175	-96.6	-72.9	0	0	0	110.7
834	L	39.2	Very low	56.5	Low	111 Å²	111	82.3 Å²	82.3	58%	0.581	41%	0.406	S	S	*	.			trans	-135.4	124	159.4	-70.6	94.1	0	0	0	110.2	D836	L834-D836 HydrophobicContact CB-CB 3.6Å; L834-D836 PolarHBondContact O-N 3.36Å
835	D	43.2	Very low	58.9	Low	84 Å²	84	78.9 Å²	78.9	45%	0.449	39%	0.391	S	S	.	.			trans	-70	47	164.6	-104.4	-62.3	0	0	0	111.2	T837	D835-T837 PolarHBondContact O-N 3.04Å; D835-T837 VanDerWaalsContact O-N 3.08Å
836	D	51.6	Low	61.1	Low	29 Å²	29	78.5 Å²	78.5	16%	0.155	39%	0.389	C	S	.	.			trans	-81.8	96.6	-155.2	-141.2	22.7	0	0	0	110.6	R766 Y809 L834 T838	R766-D836 IonicContact NH2-OD2 3.9Å; R766-D836 PolarHBondContact NH2-OD2 2.84Å; Y809-D836 VanDerWaalsContact CD1-OD2 3.31Å; Y809-D836 WeakPolarHBondContact CD1-OD2 3.29Å; L834-D836 HydrophobicContact CB-CB 3.6Å; L834-D836 PolarHBondContact O-N 3.36Å; D836-T838 PolarHBondContact O-N 3.37Å; D836-T838 PolarHBondContact O-OG1 3.3Å; D836-T838 PolarHBondContact OD2-OG1 3.25Å
837	T	61.7	Low	63.4	Low	19 Å²	19	74.8 Å²	74.8	12%	0.117	37%	0.369	C	S	.	.			trans	-70.2	77.1	161.9	38.1	0	0	0	0	109.5	Q810 D835 Y839	Q810-T837 PolarHBondContact N-O 3Å; Q810-T837 PolarHBondContact O-OG1 3.21Å; D835-T837 PolarHBondContact O-N 3.04Å; D835-T837 VanDerWaalsContact O-N 3.08Å; T837-Y839 WeakPolarHBondContact O-CD2 3.08Å; T837-Y839 WeakPolarHBondContact O-CE2 3.42Å
838	T	79.7	Confident	66	Low	0 Å²	0	67.3 Å²	67.3	0%	0	33%	0.332	C	S	.	.			trans	-75.5	126.3	175.3	-41.9	0	0	0	0	110	L763 R766 I784 Y809 D836	L763-T838 HydrophobicContact CD1-CG2 4.32Å; L763-T838 PolarHBondContact N-O 3.1Å; R766-T838 PolarHBondContact NH2-OG1 3.09Å; I784-T838 HydrophobicContact CD1-CG2 3.77Å; I784-T838 HydrophobicContact CG1-CG2 4.2Å; I784-T838 HydrophobicContact CG2-CG2 4.07Å; Y809-T838 HydrophobicContact CD1-CG2 4.43Å; Y809-T838 HydrophobicContact CE1-CG2 4.28Å; D836-T838 PolarHBondContact O-N 3.37Å; D836-T838 PolarHBondContact O-OG1 3.3Å; D836-T838 PolarHBondContact OD2-OG1 3.25Å
839	Y	88.2	Confident	68.6	Low	26 Å²	26	61.3 Å²	61.3	10%	0.102	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	144.8	168.1	-52.2	-101	0	0	0	110.1	L761 K762 I808 Q810 T837 V872	L761-Y839 CarbonylContact O-C 3.54Å; L761-Y839 VanDerWaalsContact O-CA 3.25Å; L761-Y839 WeakPolarHBondContact O-CA 3.4Å; K762-Y839 HydrophobicContact CB-CD1 3.74Å; K762-Y839 HydrophobicContact CB-CE1 3.68Å; K762-Y839 HydrophobicContact CD-CE1 3.74Å; K762-Y839 HydrophobicContact CG-CD1 4.13Å; K762-Y839 HydrophobicContact CG-CE1 3.74Å; K762-Y839 PolarHBondContact NZ-OH 3.12Å; I808-Y839 PolarHBondContact N-O 3.37Å; I808-Y839 PolarHBondContact O-N 3.2Å; Q810-Y839 HydrophobicContact CB-CE2 4.07Å; Q810-Y839 VanDerWaalsContact OE1-CE2 3.26Å; Q810-Y839 PolarHBondContact OE1-OH 3.44Å; T837-Y839 WeakPolarHBondContact O-CD2 3.08Å; T837-Y839 WeakPolarHBondContact O-CE2 3.42Å; Y839-V872 HydrophobicContact CE1-CG2 4.38Å
840	I	90.6	Very high	71.3	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	130.5	173.9	-73.1	175.1	0	0	0	107.9	K760 L761 L763 I784 P785 V804 L842 L859	K760-I840 WeakPolarHBondContact CA-O 3.47Å; L761-I840 PolarHBondContact N-O 2.88Å; L761-I840 PolarHBondContact O-N 2.81Å; L763-I840 HydrophobicContact CD1-CD1 3.77Å; L763-I840 HydrophobicContact CD1-CG1 4.41Å; L763-I840 HydrophobicContact CD2-CD1 4.09Å; L763-I840 HydrophobicContact CG-CD1 4.06Å; L763-I840 HydrophobicContact CG-CG1 4.47Å; I784-I840 HydrophobicContact CG2-CD1 4Å; I784-I840 HydrophobicContact CG2-CG1 4.29Å; P785-I840 HydrophobicContact CG-CD1 3.59Å; V804-I840 HydrophobicContact CB-CG2 4.49Å; V804-I840 HydrophobicContact CG1-CG2 4.05Å; V804-I840 HydrophobicContact CG2-CG2 3.94Å; I840-L842 HydrophobicContact CG2-CB 4.24Å; I840-L859 HydrophobicContact CD1-CD2 4.11Å
841	L	92.3	Very high	74	Confident	25 Å²	25	51.3 Å²	51.3	13%	0.131	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	116.3	165.1	-167.8	64.8	0	0	0	108.8	T758 K760 L805 E806 I875	T758-L841 HydrophobicContact CG2-CD1 3.55Å; T758-L841 HydrophobicContact CG2-CD2 4.25Å; T758-L841 HydrophobicContact CG2-CG 3.72Å; K760-L841 HydrophobicContact CB-CD1 4.24Å; L805-L841 HydrophobicContact CB-CB 4.34Å; L805-L841 HydrophobicContact CB-CD2 4.17Å; L805-L841 HydrophobicContact CB-CG 4.28Å; L805-L841 HydrophobicContact CD1-CD2 4.21Å; L805-L841 HydrophobicContact CD1-CG 4.38Å; L805-L841 PolarHBondContact N-O 2.77Å; E806-L841 HydrophobicContact CB-CB 3.87Å; E806-L841 HydrophobicContact CB-CD2 4.42Å; E806-L841 PolarHBondContact O-N 3.21Å; L841-I875 HydrophobicContact CD1-CD1 3.7Å; L841-I875 HydrophobicContact CD1-CG1 4.36Å
842	L	93.4	Very high	76.4	Confident	0 Å²	0	43 Å²	43	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	129	-174.9	-178.3	152.2	0	0	0	110.4	T758 V759 L761 V791 I793 I840 F844 L859	T758-L842 CarbonylContact C-O 3.53Å; T758-L842 WeakPolarHBondContact CA-O 3.42Å; V759-L842 HydrophobicContact CG1-CB 4.35Å; V759-L842 HydrophobicContact CG1-CD2 4.21Å; V759-L842 PolarHBondContact N-O 3.19Å; V759-L842 PolarHBondContact O-N 3.01Å; L761-L842 HydrophobicContact CD1-CB 3.84Å; L761-L842 HydrophobicContact CD1-CD1 3.77Å; L761-L842 HydrophobicContact CD1-CG 4.33Å; L761-L842 HydrophobicContact CG-CB 4.48Å; V791-L842 HydrophobicContact CG2-CD1 3.52Å; V791-L842 HydrophobicContact CG2-CG 4.31Å; I793-L842 HydrophobicContact CB-CD1 4.45Å; I793-L842 HydrophobicContact CD1-CD1 4.39Å; I793-L842 HydrophobicContact CD1-CD2 4.5Å; I793-L842 HydrophobicContact CG2-CD2 4.38Å; I840-L842 HydrophobicContact CG2-CB 4.24Å; L842-F844 HydrophobicContact CD2-CD1 4.45Å; L842-F844 HydrophobicContact CD2-CE1 4.25Å; L842-F844 HydrophobicContact CD2-CE2 4.45Å; L842-F844 HydrophobicContact CD2-CZ 4.19Å; L842-L859 HydrophobicContact CD1-CD1 3.63Å
843	R	93	Very high	78.8	Confident	92 Å²	92	38.5 Å²	38.5	35%	0.347	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	134.1	171.3	174.8	174.5	169.6	-176.2	-4.2	111.7	W757 G802 V803 L805	W757-R843 CarbonylContact O-C 3.47Å; W757-R843 VanDerWaalsContact O-CA 3.26Å; W757-R843 WeakPolarHBondContact O-CA 3.42Å; G802-R843 CarbonylContact C-O 3.16Å; G802-R843 WeakPolarHBondContact CA-O 3.46Å; V803-R843 PolarHBondContact N-O 2.76Å; V803-R843 PolarHBondContact O-N 2.81Å; L805-R843 HydrophobicContact CD1-CB 3.89Å; L805-R843 HydrophobicContact CD2-CB 4.15Å; L805-R843 HydrophobicContact CG-CB 3.99Å
844	F	92.6	Very high	81.1	Confident	0 Å²	0	31.7 Å²	31.7	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70	137.5	173.4	-69.6	-74.9	0	0	0	111.9	V756 W757 V759 I793 V798 Q800 L842 H847 E849 I851	V756-F844 HydrophobicContact CG2-CE2 4.46Å; W757-F844 WeakPolarHBondContact O-CD2 3.21Å; W757-F844 PolarHBondContact O-N 3.07Å; V759-F844 HydrophobicContact CG1-CE2 3.85Å; V759-F844 HydrophobicContact CG1-CZ 4.13Å; I793-F844 HydrophobicContact CD1-CE1 4.48Å; I793-F844 HydrophobicContact CD1-CZ 4.3Å; I793-F844 HydrophobicContact CG2-CD1 4.29Å; I793-F844 HydrophobicContact CG2-CE1 3.58Å; I793-F844 HydrophobicContact CG2-CZ 4.4Å; V798-F844 HydrophobicContact CG1-CE1 4.04Å; Q800-F844 HydrophobicContact CB-CD1 4.27Å; Q800-F844 HydrophobicContact CG-CD1 4.17Å; L842-F844 HydrophobicContact CD2-CD1 4.45Å; L842-F844 HydrophobicContact CD2-CE1 4.25Å; L842-F844 HydrophobicContact CD2-CE2 4.45Å; L842-F844 HydrophobicContact CD2-CZ 4.19Å; F844-H847 WeakPolarHBondContact CB-O 3.47Å; F844-E849 HydrophobicContact CD1-CG 4.06Å; F844-E849 HydrophobicContact CE1-CG 4.18Å; F844-E849 HydrophobicContact CE2-CB 4.47Å; F844-E849 HydrophobicContact CG-CG 4.28Å; F844-E849 HydrophobicContact CZ-CB 4.49Å; F844-I851 HydrophobicContact CE2-CD1 3.51Å; F844-I851 HydrophobicContact CZ-CD1 3.37Å
845	A	89.4	Confident	83.5	Confident	28 Å²	28	27.2 Å²	27.2	23%	0.231	13%	0.131	C	C	.	.	S	Bend	trans	-91.8	-15.5	-170.3	0	0	0	0	0	115.8	T801	T801-A845 WeakPolarHBondContact O-CB 3.3Å; T801-A845 PolarHBondContact O-N 2.88Å
846	R	86.8	Confident	85.7	Confident	141 Å²	141	26.4 Å²	26.4	53%	0.532	13%	0.125	S	C	.	.	S	Bend	trans	-124.6	-50.4	-173.8	-55.9	-176.1	-58.9	-166.4	-2	113.8	Q800	Q800-R846 VanDerWaalsContact OE1-CZ 3.28Å
847	H	87.8	Confident	87.7	Confident	43 Å²	43	25.1 Å²	25.1	20%	0.199	12%	0.118	C	C	.	.	S	Bend	trans	-137.9	153.5	-175.4	-55.6	-50.9	0	0	0	109.3	R696 Q800 F844	R696-H847 PolarHBondContact NE-CD2 3.38Å; Q800-H847 PolarHBondContact NE2-O 2.82Å; F844-H847 WeakPolarHBondContact CB-O 3.47Å
848	P	89.3	Confident	89.2	Confident	0 Å²	0	24.4 Å²	24.4	0%	0	11%	0.113	C	C	.	.			trans	-71.5	150.7	166.6	33.3	-30.9	0	0	0	108.8	P561 R696 V755 V756 W757	P561-P848 WeakPolarHBondContact CG-O 3.19Å; R696-P848 PolarHBondContact NH2-O 2.88Å; V755-P848 HydrophobicContact CG1-CB 3.68Å; V755-P848 HydrophobicContact CG1-CG 4.06Å; V756-P848 WeakPolarHBondContact O-CA 3.44Å; W757-P848 HydrophobicContact CD2-CB 4Å; W757-P848 HydrophobicContact CG-CB 4.23Å; W757-P848 HydrophobicContact CZ2-CB 4.23Å; W757-P848 VanDerWaalsContact CZ2-CD 3.49Å; W757-P848 HydrophobicContact CZ2-CG 4.01Å
849	E	90.9	Very high	89.8	Confident	4 Å²	4	24.4 Å²	24.4	2%	0.019	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	146.3	-178.9	-56.9	-64.3	168.7	0	0	109.3	R696 V756 V798 Q800 F844 I851	R696-E849 IonicContact NH2-OE1 3.5Å; R696-E849 IonicContact NH2-OE2 2.83Å; V756-E849 PolarHBondContact N-O 3.31Å; V756-E849 PolarHBondContact O-N 3.07Å; V756-E849 VanDerWaalsContact O-N 3.12Å; V798-E849 HydrophobicContact CG1-CB 4.26Å; V798-E849 HydrophobicContact CG1-CG 3.85Å; V798-E849 HydrophobicContact CG2-CB 4.05Å; V798-E849 HydrophobicContact CG2-CG 4.32Å; Q800-E849 PolarHBondContact NE2-OE1 3.03Å; Q800-E849 VanDerWaalsContact NE2-OE1 3.11Å; F844-E849 HydrophobicContact CD1-CG 4.06Å; F844-E849 HydrophobicContact CE1-CG 4.18Å; F844-E849 HydrophobicContact CE2-CB 4.47Å; F844-E849 HydrophobicContact CG-CG 4.28Å; F844-E849 HydrophobicContact CZ-CB 4.49Å; E849-I851 HydrophobicContact CB-CD1 4.49Å; E849-I851 HydrophobicContact CB-CG1 4.4Å
850	L	89.2	Confident	90	Very high	2 Å²	2	23.7 Å²	23.7	1%	0.01	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	123.7	174.7	-178.9	148.8	0	0	0	108.9	P561 F567 I700 L702 T710 F753 T754 V755	P561-L850 HydrophobicContact CG-CB 4.43Å; F567-L850 HydrophobicContact CE1-CD1 4.42Å; F567-L850 HydrophobicContact CZ-CD1 3.66Å; I700-L850 HydrophobicContact CD1-CB 4.31Å; I700-L850 HydrophobicContact CD1-CD2 3.8Å; L702-L850 HydrophobicContact CD1-CD1 3.78Å; T710-L850 HydrophobicContact CG2-CD1 3.7Å; F753-L850 HydrophobicContact CB-CD2 4.27Å; F753-L850 HydrophobicContact CD2-CD1 3.82Å; F753-L850 HydrophobicContact CD2-CD2 3.73Å; F753-L850 HydrophobicContact CD2-CG 3.97Å; F753-L850 HydrophobicContact CE2-CD1 4.22Å; F753-L850 HydrophobicContact CG-CD2 4.31Å; T754-L850 WeakPolarHBondContact O-CA 3.44Å; V755-L850 HydrophobicContact CG2-CB 4.43Å; V755-L850 HydrophobicContact CG2-CD1 4.44Å
851	I	89.8	Confident	90	Very high	3 Å²	3	24.2 Å²	24.2	2%	0.015	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	132	-174.1	-61	-176.8	0	0	0	109.6	F753 T754 V756 V759 F844 E849 R855 A871 L874	F753-I851 VanDerWaalsContact CA-O 3.3Å; F753-I851 WeakPolarHBondContact CA-O 3.4Å; T754-I851 PolarHBondContact N-O 3.27Å; T754-I851 PolarHBondContact O-N 2.82Å; T754-I851 VanDerWaalsContact O-N 3.14Å; V756-I851 HydrophobicContact CG2-CB 4.26Å; V756-I851 HydrophobicContact CG2-CD1 4.18Å; V756-I851 HydrophobicContact CG2-CG1 4.34Å; V759-I851 HydrophobicContact CG1-CD1 4.47Å; F844-I851 HydrophobicContact CE2-CD1 3.51Å; F844-I851 HydrophobicContact CZ-CD1 3.37Å; E849-I851 HydrophobicContact CB-CD1 4.49Å; E849-I851 HydrophobicContact CB-CG1 4.4Å; I851-R855 HydrophobicContact CG2-CB 3.77Å; I851-R855 HydrophobicContact CG2-CG 4.04Å; I851-A871 HydrophobicContact CG2-CB 3.94Å; I851-L874 HydrophobicContact CB-CD2 4.09Å; I851-L874 HydrophobicContact CG2-CD2 3.86Å; I851-L874 WeakPolarHBondContact O-CD1 3.47Å
852	E	86.1	Confident	89.5	Confident	6 Å²	6	28.4 Å²	28.4	3%	0.028	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	151.2	167.7	58.2	-104	-150.6	0	0	114.2	W741 I751 N752 F753 R855	W741-E852 HydrophobicContact CE3-CG 4.25Å; W741-E852 HydrophobicContact CH2-CB 4.14Å; W741-E852 HydrophobicContact CH2-CG 3.79Å; W741-E852 HydrophobicContact CZ3-CB 3.64Å; W741-E852 HydrophobicContact CZ3-CG 3.39Å; I751-E852 HydrophobicContact CG2-CB 4.33Å; N752-E852 WeakPolarHBondContact O-CA 3.3Å; F753-E852 HydrophobicContact CB-CB 3.94Å; E852-R855 HydrophobicContact CG-CB 4.02Å; E852-R855 VanDerWaalsContact O-CB 3.26Å; E852-R855 WeakPolarHBondContact O-CB 3.26Å; E852-R855 PolarHBondContact O-N 2.86Å; E852-R855 WeakPolarHBondContact OE1-CD 3.27Å; E852-R855 IonicContact OE1-CZ 3.94Å; E852-R855 IonicContact OE1-NE 2.71Å; E852-R855 IonicContact OE1-NH1 3.42Å; E852-R855 PolarHBondContact OE1-NH1 3.42Å; E852-R855 WeakPolarHBondContact OE2-CD 3.42Å; E852-R855 IonicContact OE2-NE 3.87Å
853	I	85.1	Confident	88.5	Confident	36 Å²	36	31.4 Å²	31.4	19%	0.185	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.8	136.9	162.8	-59.9	179.8	0	0	0	108.3	Q744 N752 L874	Q744-I853 PolarHBondContact OE1-O 3.43Å; N752-I853 HydrophobicContact CB-CD1 3.75Å; N752-I853 HydrophobicContact CB-CG1 4.14Å; N752-I853 PolarHBondContact O-N 2.76Å; I853-L874 HydrophobicContact CG1-CD1 3.79Å; I853-L874 HydrophobicContact CG1-CG 3.93Å
854	G	84	Confident	87.6	Confident	17 Å²	17	31.8 Å²	31.8	18%	0.175	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	86.2	-0.9	-172.8	0	0	0	0	0	114.6	Q856 Y870 A871	G854-Q856 PolarHBondContact O-N 3.09Å; G854-Q856 VanDerWaalsContact O-N 3.14Å; G854-Y870 VanDerWaalsContact O-CD1 3.27Å; G854-Y870 WeakPolarHBondContact O-CD1 3.47Å; G854-A871 PolarHBondContact N-O 3.5Å
855	R	88.5	Confident	86.9	Confident	17 Å²	17	33 Å²	33	6%	0.064	18%	0.182	C	C	.	.			trans	-53.3	116.7	175.8	-167.3	80.2	-175.5	135.8	-10.9	112	A795 G796 I851 E852 Y870 A871	A795-R855 HydrophobicContact CB-CG 3.88Å; A795-R855 PolarHBondContact O-NE 2.86Å; A795-R855 PolarHBondContact O-NH2 2.79Å; G796-R855 VanDerWaalsContact CA-NH2 3.33Å; I851-R855 HydrophobicContact CG2-CB 3.77Å; I851-R855 HydrophobicContact CG2-CG 4.04Å; E852-R855 HydrophobicContact CG-CB 4.02Å; E852-R855 VanDerWaalsContact O-CB 3.26Å; E852-R855 WeakPolarHBondContact O-CB 3.26Å; E852-R855 PolarHBondContact O-N 2.86Å; E852-R855 WeakPolarHBondContact OE1-CD 3.27Å; E852-R855 IonicContact OE1-CZ 3.94Å; E852-R855 IonicContact OE1-NE 2.71Å; E852-R855 IonicContact OE1-NH1 3.42Å; E852-R855 PolarHBondContact OE1-NH1 3.42Å; E852-R855 WeakPolarHBondContact OE2-CD 3.42Å; E852-R855 IonicContact OE2-NE 3.87Å; R855-Y870 CarbonylContact O-C 3.55Å; R855-Y870 WeakPolarHBondContact O-CA 3.43Å; R855-A871 HydrophobicContact CB-CB 3.9Å; R855-A871 PolarHBondContact O-N 3.08Å
856	Q	90.5	Very high	86.8	Confident	66 Å²	66	32 Å²	32	31%	0.308	17%	0.173	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	136.3	170.7	-161.6	175.9	50.5	0	0	110.6	G854 I868 G869 Y870	G854-Q856 PolarHBondContact O-N 3.09Å; G854-Q856 VanDerWaalsContact O-N 3.14Å; Q856-I868 HydrophobicContact CG-CG2 4.06Å; Q856-G869 WeakPolarHBondContact CA-O 3.44Å; Q856-Y870 VanDerWaalsContact CA-CD1 3.45Å; Q856-Y870 HydrophobicContact CB-CD1 3.67Å; Q856-Y870 HydrophobicContact CB-CE1 3.54Å; Q856-Y870 HydrophobicContact CG-CD1 3.91Å; Q856-Y870 HydrophobicContact CG-CE1 3.48Å; Q856-Y870 VanDerWaalsContact CG-CE1 3.48Å; Q856-Y870 PolarHBondContact NE2-OH 2.85Å
857	F	92.7	Very high	86.9	Confident	3 Å²	3	25.3 Å²	25.3	1%	0.013	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	152.5	172.9	69	-92.4	0	0	0	112.2	L761 L763 I793 Y794 A795 L859 I868 G869 Y870	L761-F857 HydrophobicContact CB-CE1 3.61Å; L761-F857 HydrophobicContact CB-CZ 3.65Å; L761-F857 HydrophobicContact CD1-CD1 4.42Å; L761-F857 HydrophobicContact CD1-CD2 4.49Å; L761-F857 HydrophobicContact CD1-CE1 4.16Å; L761-F857 HydrophobicContact CD1-CE2 4.28Å; L761-F857 HydrophobicContact CD1-CZ 4.11Å; L761-F857 HydrophobicContact CD2-CD1 3.74Å; L761-F857 HydrophobicContact CD2-CE1 3.64Å; L761-F857 HydrophobicContact CD2-CZ 4.38Å; L761-F857 HydrophobicContact CG-CD1 4.45Å; L761-F857 HydrophobicContact CG-CE1 4Å; L761-F857 HydrophobicContact CG-CZ 4.26Å; L763-F857 HydrophobicContact CD2-CE2 4.13Å; L763-F857 HydrophobicContact CD2-CZ 4Å; I793-F857 HydrophobicContact CD1-CB 4.11Å; I793-F857 HydrophobicContact CD1-CG 4.37Å; I793-F857 HydrophobicContact CG1-CB 4.01Å; Y794-F857 CarbonylContact O-C 3.57Å; Y794-F857 VanDerWaalsContact O-CA 3.24Å; Y794-F857 WeakPolarHBondContact O-CA 3.49Å; A795-F857 HydrophobicContact CB-CB 4.09Å; F857-L859 HydrophobicContact CD2-CB 3.92Å; F857-L859 HydrophobicContact CE2-CB 3.85Å; F857-I868 WeakPolarHBondContact O-CA 3.41Å; F857-I868 WeakPolarHBondContact O-CG2 3.11Å; F857-G869 VanDerWaalsContact CD1-C 3.48Å; F857-G869 WeakPolarHBondContact CD1-O 3.18Å; F857-G869 VanDerWaalsContact CZ-CA 3.5Å; F857-G869 PolarHBondContact N-O 2.71Å; F857-G869 PolarHBondContact O-N 3.36Å; F857-Y870 VanDerWaalsContact CE1-N 3.26Å
858	I	93.2	Very high	87	Confident	4 Å²	4	23.4 Å²	23.4	2%	0.021	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	124.4	161.4	-51.7	159.6	0	0	0	106.8	L316 L347 L351 Y794 T860 T867 I868	L316-I858 HydrophobicContact CD2-CD1 4.36Å; L316-I858 HydrophobicContact CD2-CG2 4.34Å; L347-I858 HydrophobicContact CD1-CD1 4.18Å; L347-I858 HydrophobicContact CD1-CG2 4.45Å; L351-I858 HydrophobicContact CD1-CD1 4.45Å; L351-I858 HydrophobicContact CD2-CD1 4.39Å; L351-I858 HydrophobicContact CD2-CG1 4.36Å; Y794-I858 PolarHBondContact N-O 3.13Å; Y794-I858 PolarHBondContact O-N 2.67Å; I858-T860 HydrophobicContact CG2-CG2 4.28Å; I858-T867 WeakPolarHBondContact CA-O 3.38Å; I858-I868 HydrophobicContact CG1-CD1 4.05Å; I858-I868 HydrophobicContact CG1-CG1 4.21Å; I858-I868 HydrophobicContact CG2-CG1 4.48Å
859	L	93.2	Very high	87	Confident	0 Å²	0	23.4 Å²	23.4	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	137.7	176.3	-169.3	71	0	0	0	109.3	P785 V791 S792 I793 I840 L842 F857 W861 K866 T867	P785-L859 HydrophobicContact CG-CD2 4.1Å; V791-L859 HydrophobicContact CB-CD1 3.8Å; V791-L859 HydrophobicContact CB-CG 4.23Å; V791-L859 HydrophobicContact CG2-CD1 3.75Å; S792-L859 CarbonylContact O-C 3.56Å; I793-L859 HydrophobicContact CB-CD1 4.02Å; I840-L859 HydrophobicContact CD1-CD2 4.11Å; L842-L859 HydrophobicContact CD1-CD1 3.63Å; F857-L859 HydrophobicContact CD2-CB 3.92Å; F857-L859 HydrophobicContact CE2-CB 3.85Å; L859-W861 HydrophobicContact CD2-CE3 4.42Å; L859-W861 HydrophobicContact CD2-CZ3 4.41Å; L859-W861 HydrophobicContact CG-CE3 4.33Å; L859-K866 CarbonylContact O-C 3.57Å; L859-K866 VanDerWaalsContact O-CA 3.28Å; L859-K866 WeakPolarHBondContact O-CA 3.48Å; L859-T867 PolarHBondContact N-O 3.48Å; L859-T867 PolarHBondContact O-N 3.2Å
860	T	91.7	Very high	86.9	Confident	10 Å²	10	25 Å²	25	6%	0.061	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	146	179	61	0	0	0	0	113.6	L316 V791 S792 Y794 I858 L865 K866	L316-T860 HydrophobicContact CD1-CG2 3.47Å; L316-T860 VanDerWaalsContact CD1-CG2 3.47Å; V791-T860 CarbonylContact C-O 3.53Å; V791-T860 WeakPolarHBondContact CA-O 3.47Å; S792-T860 WeakPolarHBondContact CB-OG1 3.34Å; S792-T860 PolarHBondContact N-O 3.01Å; S792-T860 PolarHBondContact O-N 2.89Å; S792-T860 PolarHBondContact O-OG1 2.79Å; Y794-T860 HydrophobicContact CE2-CG2 4.27Å; I858-T860 HydrophobicContact CG2-CG2 4.28Å; T860-L865 WeakPolarHBondContact CA-O 3.2Å; T860-L865 WeakPolarHBondContact CB-O 3.23Å; T860-K866 HydrophobicContact CG2-CB 4.45Å; T860-K866 HydrophobicContact CG2-CG 3.77Å
861	W	89.9	Confident	87	Confident	11 Å²	11	25 Å²	25	4%	0.042	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.9	170.6	176	68.3	96.7	0	0	0	111.1	P783 P785 Q789 V791 L859 G863 N864 L865 T867	P783-W861 WeakPolarHBondContact O-CH2 3.37Å; P783-W861 WeakPolarHBondContact O-CZ2 3.4Å; P785-W861 HydrophobicContact CB-CD2 3.92Å; P785-W861 HydrophobicContact CB-CE3 4.3Å; P785-W861 HydrophobicContact CB-CG 4.14Å; P785-W861 HydrophobicContact CG-CD2 4.3Å; P785-W861 HydrophobicContact CG-CE3 4.2Å; P785-W861 HydrophobicContact CG-CZ3 4.4Å; Q789-W861 VanDerWaalsContact NE2-CD1 3.31Å; V791-W861 HydrophobicContact CG1-CB 4.04Å; L859-W861 HydrophobicContact CD2-CE3 4.42Å; L859-W861 HydrophobicContact CD2-CZ3 4.41Å; L859-W861 HydrophobicContact CG-CE3 4.33Å; W861-G863 PolarHBondContact O-N 2.87Å; W861-G863 VanDerWaalsContact O-N 3.07Å; W861-N864 PolarHBondContact O-N 2.95Å; W861-L865 HydrophobicContact CD2-CB 4.04Å; W861-L865 HydrophobicContact CG-CB 4.46Å; W861-L865 HydrophobicContact CH2-CB 4.13Å; W861-L865 HydrophobicContact CZ2-CB 3.56Å; W861-L865 HydrophobicContact CZ2-CD1 3.98Å; W861-L865 HydrophobicContact CZ2-CG 4.39Å; W861-L865 PolarHBondContact N-O 2.82Å; W861-L865 VanDerWaalsContact N-O 3.13Å; W861-L865 VanDerWaalsContact NE1-CD1 3.35Å; W861-L865 WeakPolarHBondContact O-CB 3.47Å; W861-L865 PolarHBondContact O-N 3.35Å; W861-T867 HydrophobicContact CH2-CG2 3.64Å; W861-T867 HydrophobicContact CZ3-CG2 3.92Å
862	N	83.4	Confident	86.9	Confident	113 Å²	113	27.8 Å²	27.8	60%	0.604	16%	0.162	S	C	*	.	T	Hydrogen-bonded Turn	trans	48.4	36.9	-177.4	-65.1	-1.3	0	0	0	114.1	Q789 N864 L865	Q789-N862 PolarHBondContact NE2-ND2 3.26Å; Q789-N862 PolarHBondContact NE2-OD1 2.66Å; N862-N864 PolarHBondContact O-N 3.16Å; N862-L865 HydrophobicContact CB-CD1 4.12Å; N862-L865 HydrophobicContact CB-CG 4.44Å
863	G	70.6	Confident	86.8	Confident	63 Å²	63	31 Å²	31	65%	0.649	18%	0.178	S	C	*	.	T	Hydrogen-bonded Turn	trans	76.2	-35.7	176.4	0	0	0	0	0	116.2	Q312 W861	Q312-G863 PolarHBondContact OE1-O 2.8Å; W861-G863 PolarHBondContact O-N 2.87Å; W861-G863 VanDerWaalsContact O-N 3.07Å
864	N	74.4	Confident	86.8	Confident	100 Å²	100	30 Å²	30	54%	0.535	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-133.4	-19.6	-170.8	-64.6	-43	0	0	0	115.4	W861 N862 K866	W861-N864 PolarHBondContact O-N 2.95Å; N862-N864 PolarHBondContact O-N 3.16Å; N864-K866 WeakPolarHBondContact O-CE 3.49Å
865	L	79.5	Confident	86.5	Confident	26 Å²	26	30.6 Å²	30.6	14%	0.136	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	139.6	-173.9	-59.5	179.1	0	0	0	110.6	I769 T782 P783 T860 W861 N862	I769-L865 HydrophobicContact CD1-CD2 3.46Å; I769-L865 VanDerWaalsContact CD1-CD2 3.46Å; I769-L865 HydrophobicContact CG1-CD2 3.82Å; T782-L865 HydrophobicContact CG2-CB 4.1Å; T782-L865 HydrophobicContact CG2-CD2 3.87Å; P783-L865 HydrophobicContact CG-CD1 3.85Å; T860-L865 WeakPolarHBondContact CA-O 3.2Å; T860-L865 WeakPolarHBondContact CB-O 3.23Å; W861-L865 HydrophobicContact CD2-CB 4.04Å; W861-L865 HydrophobicContact CG-CB 4.46Å; W861-L865 HydrophobicContact CH2-CB 4.13Å; W861-L865 HydrophobicContact CZ2-CB 3.56Å; W861-L865 HydrophobicContact CZ2-CD1 3.98Å; W861-L865 HydrophobicContact CZ2-CG 4.39Å; W861-L865 PolarHBondContact N-O 2.82Å; W861-L865 VanDerWaalsContact N-O 3.13Å; W861-L865 VanDerWaalsContact NE1-CD1 3.35Å; W861-L865 WeakPolarHBondContact O-CB 3.47Å; W861-L865 PolarHBondContact O-N 3.35Å; N862-L865 HydrophobicContact CB-CD1 4.12Å; N862-L865 HydrophobicContact CB-CG 4.44Å
866	K	87.3	Confident	85.4	Confident	7 Å²	7	31 Å²	31	3%	0.03	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	136.6	-170	-63.6	158.2	-163.7	159.4	0	111.9	Q312 D343 L767 L859 T860 N864	Q312-K866 VanDerWaalsContact CD-CE 3.49Å; D343-K866 VanDerWaalsContact CG-NZ 3.26Å; D343-K866 IonicContact OD2-NZ 3.84Å; D343-K866 PolarHBondContact OD2-NZ 2.94Å; L767-K866 HydrophobicContact CB-CB 4.22Å; L767-K866 HydrophobicContact CD1-CB 4.16Å; L767-K866 HydrophobicContact CD2-CB 3.95Å; L767-K866 HydrophobicContact CD2-CD 3.9Å; L767-K866 HydrophobicContact CG-CB 4.33Å; L767-K866 PolarHBondContact N-O 3.1Å; L767-K866 VanDerWaalsContact N-O 3.16Å; L859-K866 CarbonylContact O-C 3.57Å; L859-K866 VanDerWaalsContact O-CA 3.28Å; L859-K866 WeakPolarHBondContact O-CA 3.48Å; T860-K866 HydrophobicContact CG2-CB 4.45Å; T860-K866 HydrophobicContact CG2-CG 3.77Å; N864-K866 WeakPolarHBondContact O-CE 3.49Å
867	T	88.2	Confident	83.5	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	156.5	166.4	53.6	0	0	0	0	110.9	L763 R765 R766 T782 I858 L859 W861	L763-T867 HydrophobicContact CD1-CG2 4.38Å; L763-T867 WeakPolarHBondContact CD2-OG1 3.34Å; R765-T867 CarbonylContact O-C 3.57Å; R765-T867 VanDerWaalsContact O-CA 3.28Å; R765-T867 WeakPolarHBondContact O-CA 3.44Å; R766-T867 HydrophobicContact CB-CG2 4.37Å; R766-T867 HydrophobicContact CG-CG2 4.07Å; T782-T867 WeakPolarHBondContact OG1-CG2 3.43Å; I858-T867 WeakPolarHBondContact CA-O 3.38Å; L859-T867 PolarHBondContact N-O 3.48Å; L859-T867 PolarHBondContact O-N 3.2Å; W861-T867 HydrophobicContact CH2-CG2 3.64Å; W861-T867 HydrophobicContact CZ3-CG2 3.92Å
868	I	88.7	Confident	81.1	Confident	3 Å²	3	31.5 Å²	31.5	2%	0.015	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	143.1	172.1	-57.3	-164.7	0	0	0	109.4	L347 S350 L351 I764 R765 L767 Q856 F857 I858	L347-I868 HydrophobicContact CD1-CD1 4.21Å; S350-I868 VanDerWaalsContact CB-CD1 3.43Å; L351-I868 HydrophobicContact CD2-CD1 3.64Å; L351-I868 HydrophobicContact CG-CD1 3.77Å; I764-I868 PolarHBondContact N-O 3.24Å; R765-I868 HydrophobicContact CB-CB 4.29Å; R765-I868 PolarHBondContact N-O 2.82Å; R765-I868 PolarHBondContact O-N 3.09Å; L767-I868 HydrophobicContact CD1-CG1 4.1Å; Q856-I868 HydrophobicContact CG-CG2 4.06Å; F857-I868 WeakPolarHBondContact O-CA 3.41Å; F857-I868 WeakPolarHBondContact O-CG2 3.11Å; I858-I868 HydrophobicContact CG1-CD1 4.05Å; I858-I868 HydrophobicContact CG1-CG1 4.21Å; I858-I868 HydrophobicContact CG2-CG1 4.48Å
869	G	89.3	Confident	78.6	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.9	-169.4	179.5	0	0	0	0	0	112.3	K762 Q856 F857	K762-G869 WeakPolarHBondContact O-CA 3.3Å; Q856-G869 WeakPolarHBondContact CA-O 3.44Å; F857-G869 VanDerWaalsContact CD1-C 3.48Å; F857-G869 WeakPolarHBondContact CD1-O 3.18Å; F857-G869 VanDerWaalsContact CZ-CA 3.5Å; F857-G869 PolarHBondContact N-O 2.71Å; F857-G869 PolarHBondContact O-N 3.36Å
870	Y	89.9	Confident	75.9	Confident	38 Å²	38	41.5 Å²	41.5	15%	0.149	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	152	173	-50.5	-80.8	0	0	0	112.3	F737 K762 I764 G854 R855 Q856 F857	F737-Y870 HydrophobicContact CB-CE2 3.95Å; F737-Y870 HydrophobicContact CD1-CD2 4.36Å; F737-Y870 AromaticContact CD1-CE2 3.73Å; F737-Y870 HydrophobicContact CD1-CE2 3.73Å; F737-Y870 AromaticContact CG-CE2 3.98Å; F737-Y870 HydrophobicContact CG-CE2 3.98Å; K762-Y870 PolarHBondContact N-O 3.36Å; K762-Y870 PolarHBondContact O-N 3.16Å; I764-Y870 HydrophobicContact CD1-CD2 3.27Å; I764-Y870 HydrophobicContact CD1-CE2 3.41Å; I764-Y870 VanDerWaalsContact CD1-CE2 3.41Å; I764-Y870 HydrophobicContact CD1-CG 4.5Å; G854-Y870 VanDerWaalsContact O-CD1 3.27Å; G854-Y870 WeakPolarHBondContact O-CD1 3.47Å; R855-Y870 CarbonylContact O-C 3.55Å; R855-Y870 WeakPolarHBondContact O-CA 3.43Å; Q856-Y870 VanDerWaalsContact CA-CD1 3.45Å; Q856-Y870 HydrophobicContact CB-CD1 3.67Å; Q856-Y870 HydrophobicContact CB-CE1 3.54Å; Q856-Y870 HydrophobicContact CG-CD1 3.91Å; Q856-Y870 HydrophobicContact CG-CE1 3.48Å; Q856-Y870 VanDerWaalsContact CG-CE1 3.48Å; Q856-Y870 PolarHBondContact NE2-OH 2.85Å; F857-Y870 VanDerWaalsContact CE1-N 3.26Å
871	A	90.8	Very high	73	Confident	3 Å²	3	45.9 Å²	45.9	3%	0.025	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	133	168	0	0	0	0	0	110.4	V759 L761 I851 G854 R855	V759-A871 HydrophobicContact CG2-CB 3.84Å; L761-A871 HydrophobicContact CD2-CB 4.12Å; I851-A871 HydrophobicContact CG2-CB 3.94Å; G854-A871 PolarHBondContact N-O 3.5Å; R855-A871 HydrophobicContact CB-CB 3.9Å; R855-A871 PolarHBondContact O-N 3.08Å
872	V	87.4	Confident	70.1	Confident	61 Å²	61	51.2 Å²	51.2	37%	0.37	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	-39.9	-178.5	175.6	0	0	0	0	111.7	K760 K762 Y839	K760-V872 PolarHBondContact O-N 2.87Å; K762-V872 HydrophobicContact CB-CG2 3.54Å; K762-V872 HydrophobicContact CD-CG2 4.32Å; Y839-V872 HydrophobicContact CE1-CG2 4.38Å
873	E	85.4	Confident	67.5	Low	74 Å²	74	51.7 Å²	51.7	35%	0.346	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	134.7	-176.6	-151	-176.5	130.2	0	0	109.3	K760	K760-E873 HydrophobicContact CB-CB 3.62Å; K760-E873 HydrophobicContact CD-CB 3.74Å; K760-E873 HydrophobicContact CD-CG 4.46Å; K760-E873 WeakPolarHBondContact CD-OE2 3.31Å; K760-E873 WeakPolarHBondContact CE-OE2 3.35Å; K760-E873 HydrophobicContact CG-CB 4.33Å; K760-E873 PolarHBondContact N-O 3.19Å; K760-E873 IonicContact NZ-OE2 3.84Å; K760-E873 PolarHBondContact NZ-OE2 2.83Å; K760-E873 PolarHBondContact O-N 3.27Å
874	L	83.6	Confident	65.5	Low	15 Å²	15	53.2 Å²	53.2	8%	0.079	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	106.5	-176.5	-58.9	177.5	0	0	0	107.7	T754 V756 V759 I851 I853	T754-L874 HydrophobicContact CG2-CB 3.88Å; T754-L874 HydrophobicContact CG2-CD1 4Å; V756-L874 HydrophobicContact CG1-CB 3.88Å; V759-L874 HydrophobicContact CG2-CD2 4.09Å; I851-L874 HydrophobicContact CB-CD2 4.09Å; I851-L874 HydrophobicContact CG2-CD2 3.86Å; I851-L874 WeakPolarHBondContact O-CD1 3.47Å; I853-L874 HydrophobicContact CG1-CD1 3.79Å; I853-L874 HydrophobicContact CG1-CG 3.93Å
875	I	78.3	Confident	63.3	Low	28 Å²	28	52.1 Å²	52.1	14%	0.144	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	105.4	-172.4	-52.5	-160	0	0	0	110.1	T758 L841	T758-I875 HydrophobicContact CG2-CB 4.4Å; T758-I875 CarbonylContact O-C 3.6Å; T758-I875 PolarHBondContact O-N 2.63Å; L841-I875 HydrophobicContact CD1-CD1 3.7Å; L841-I875 HydrophobicContact CD1-CG1 4.36Å
876	D	64.9	Low	60.9	Low	27 Å²	27	57.4 Å²	57.4	14%	0.144	29%	0.292	C	S	.	.			trans	-74	120.1	164	-179	-3.1	0	0	0	109.2	L878 K879	D876-L878 PolarHBondContact O-N 3.05Å; D876-L878 WeakPolarHBondContact OD1-CB 3.48Å; D876-L878 WeakPolarHBondContact OD1-CG 3.26Å; D876-L878 PolarHBondContact OD1-N 2.84Å; D876-K879 PolarHBondContact O-N 2.82Å
877	P	50.8	Low	58	Low	59 Å²	59	64.1 Å²	64.1	38%	0.383	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-13.5	177.3	24.5	-35.1	0	0	0	114.6	W757	W757-P877 HydrophobicContact CB-CG 4.35Å
878	L	42.9	Very low	55	Low	20 Å²	20	69.6 Å²	69.6	11%	0.105	36%	0.361	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-35.3	177.6	-60.9	-174.1	0	0	0	114.2	D876 F947 I948 T951	D876-L878 PolarHBondContact O-N 3.05Å; D876-L878 WeakPolarHBondContact OD1-CB 3.48Å; D876-L878 WeakPolarHBondContact OD1-CG 3.26Å; D876-L878 PolarHBondContact OD1-N 2.84Å; L878-F947 HydrophobicContact CD1-CD1 3.66Å; L878-F947 HydrophobicContact CD1-CE1 4.02Å; L878-F947 HydrophobicContact CD2-CD1 4.32Å; L878-F947 HydrophobicContact CG-CD1 3.98Å; L878-F947 HydrophobicContact CG-CE1 4.34Å; L878-I948 HydrophobicContact CD2-CD1 4.48Å; L878-I948 HydrophobicContact CD2-CG1 3.47Å; L878-I948 VanDerWaalsContact CD2-CG1 3.47Å; L878-T951 HydrophobicContact CD1-CG2 3.83Å; L878-T951 WeakPolarHBondContact CD1-OG1 3.09Å
879	K	40.6	Very low	52	Low	91 Å²	91	74.8 Å²	74.8	40%	0.396	40%	0.395	S	S	.	.	H	α-helix	trans	-78.2	-26.5	-167.8	-67	-173.4	-177.5	-176.7	0	114.2	S713 F714 D876 Q881	S713-K879 PolarHBondContact O-NZ 3.32Å; F714-K879 HydrophobicContact CB-CD 4.41Å; D876-K879 PolarHBondContact O-N 2.82Å; K879-Q881 PolarHBondContact O-N 3.04Å
880	H	37.5	Very low	48.9	Very low	123 Å²	123	80.2 Å²	80.2	57%	0.569	43%	0.433	S	S	*	.	H	α-helix	trans	-76.8	-13.4	-178.4	-94.4	-71.1	0	0	0	115.7
881	Q	30.1	Very low	45.9	Very low	101 Å²	101	85.7 Å²	85.7	47%	0.472	46%	0.463	S	S	.	.	H	α-helix	trans	-92.3	-29	179.2	-73.6	-174.9	-25.5	0	0	113.8	K879 N883 L884	K879-Q881 PolarHBondContact O-N 3.04Å; Q881-N883 VanDerWaalsContact C-N 3.32Å; Q881-N883 PolarHBondContact O-N 3.16Å; Q881-L884 PolarHBondContact O-N 3.41Å
882	Y	29.1	Very low	42.8	Very low	124 Å²	124	93 Å²	93	49%	0.486	50%	0.502	S	S	.	.	H	α-helix	trans	-68.1	-27.2	-178.5	-86.8	-85.8	0	0	0	114.1	L884 S885	Y882-L884 VanDerWaalsContact C-N 3.31Å; Y882-L884 PolarHBondContact O-N 3.14Å; Y882-S885 PolarHBondContact O-OG 3.12Å; Y882-S885 VanDerWaalsContact O-OG 3.12Å
883	N	29.3	Very low	39.9	Very low	123 Å²	123	95.3 Å²	95.3	66%	0.658	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80	-6.7	176.1	-73.8	-5.9	0	0	0	114.1	Q881	Q881-N883 VanDerWaalsContact C-N 3.32Å; Q881-N883 PolarHBondContact O-N 3.16Å
884	L	28.8	Very low	37.1	Very low	94 Å²	94	98.9 Å²	98.9	49%	0.492	54%	0.543	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.3	-12.7	172.1	-92.6	82.2	0	0	0	113.4	Q881 Y882	Q881-L884 PolarHBondContact O-N 3.41Å; Y882-L884 VanDerWaalsContact C-N 3.31Å; Y882-L884 PolarHBondContact O-N 3.14Å
885	S	27.9	Very low	34.4	Very low	77 Å²	77	103.9 Å²	103.9	54%	0.538	57%	0.574	S	S	.	*	S	Bend	trans	-100.7	2.6	-174.6	53.5	0	0	0	0	115.3	Y882	Y882-S885 PolarHBondContact O-OG 3.12Å; Y882-S885 VanDerWaalsContact O-OG 3.12Å
886	L	28.5	Very low	31.9	Very low	138 Å²	138	108 Å²	108	72%	0.723	60%	0.601	S	S	*	*	S	Bend	trans	-111.9	-4.1	-178.4	-84.9	156.8	0	0	0	114.4
887	N	26.2	Very low	30.1	Very low	147 Å²	147	112.2 Å²	112.2	79%	0.786	63%	0.627	S	S	*	*			trans	-118.4	63.1	179	-75.3	-21	0	0	0	111.6
888	T	25.2	Very low	29	Very low	115 Å²	115	115.2 Å²	115.2	71%	0.706	65%	0.645	S	S	*	*			trans	-114.8	109.9	165.8	49.5	0	0	0	0	109.4	S890	T888-S890 PolarHBondContact O-N 3.25Å
889	P	25.2	Very low	28.2	Very low	112 Å²	112	119.5 Å²	119.5	73%	0.727	67%	0.672	S	S	*	*			trans	-68.3	131.1	176.1	28.5	-32.9	0	0	0	109.9	I891	P889-I891 PolarHBondContact O-N 3.23Å
890	S	24.2	Very low	27.7	Very low	114 Å²	114	120.6 Å²	120.6	80%	0.797	69%	0.686	S	S	*	*			trans	-65.4	111.9	173.9	52.4	0	0	0	0	110.5	T888	T888-S890 PolarHBondContact O-N 3.25Å
891	I	27.5	Very low	27.3	Very low	153 Å²	153	121.1 Å²	121.1	79%	0.785	69%	0.693	S	S	*	*			trans	-125	117.9	168.6	-61.3	-177.6	0	0	0	108.2	P889	P889-I891 PolarHBondContact O-N 3.23Å
892	N	26.2	Very low	27.2	Very low	156 Å²	156	123 Å²	123	83%	0.834	71%	0.707	S	S	*	*			trans	-66.3	131.5	-177.2	-69.3	-33.2	0	0	0	111.2
893	S	25.5	Very low	27.3	Very low	111 Å²	111	122.7 Å²	122.7	78%	0.776	72%	0.717	S	S	*	*			trans	-77.7	124.1	167.6	55.5	0	0	0	0	110.8
894	N	26	Very low	27.3	Very low	149 Å²	149	125.9 Å²	125.9	80%	0.797	73%	0.728	S	S	*	*			trans	-150.2	136.1	152.4	-98.3	-25.5	0	0	0	111.4
895	T	27.9	Very low	27.4	Very low	119 Å²	119	127.9 Å²	127.9	73%	0.73	74%	0.739	S	S	*	*			trans	64.3	94.6	153.8	48.3	0	0	0	0	121.5
896	T	26.7	Very low	27.9	Very low	116 Å²	116	128.8 Å²	128.8	71%	0.712	74%	0.744	S	S	*	*				66.3	112.1	116.7	54.6	0	0	0	0	123.6
897	T	26.3	Very low	27.8	Very low	115 Å²	115	129 Å²	129	71%	0.706	75%	0.745	S	S	*	*				74.9	133.4	125.6	57.7	0	0	0	0	123.9
898	T	26.5	Very low	27.9	Very low	122 Å²	122	128.2 Å²	128.2	75%	0.748	74%	0.741	S	S	*	*			trans	66.8	141	144	49.5	0	0	0	0	119.5
899	T	27.8	Very low	27.9	Very low	110 Å²	110	132.2 Å²	132.2	68%	0.675	75%	0.745	S	S	*	*			cis	-174.7	152.8	-15.3	17.3	0	0	0	0	107.1
900	T	28.6	Very low	27.9	Very low	113 Å²	113	131 Å²	131	69%	0.693	74%	0.739	S	S	*	*			trans	57	148.4	152.6	54.3	0	0	0	0	119.2
901	D	29.2	Very low	28	Very low	134 Å²	134	133 Å²	133	72%	0.717	73%	0.733	S	S	*	*			cis	-163.1	176.2	-8.9	-94.9	-23.7	0	0	0	108.9
902	D	29.2	Very low	27.8	Very low	142 Å²	142	130.9 Å²	130.9	76%	0.759	73%	0.728	S	S	*	*			trans	74.7	105	152.8	-65.4	-25.2	0	0	0	125.1
903	V	31.7	Very low	27.7	Very low	116 Å²	116	128.5 Å²	128.5	70%	0.703	72%	0.715	S	S	*	*				51.7	112.6	112.4	178.1	0	0	0	0	121.1
904	Q	29.4	Very low	27.8	Very low	191 Å²	191	130.3 Å²	130.3	89%	0.893	72%	0.722	S	S	*	*				179.2	149	108.8	-119	149.7	34	0	0	114.7
905	D	30.4	Very low	27.7	Very low	135 Å²	135	128.2 Å²	128.2	72%	0.722	72%	0.718	S	S	*	*			trans	-90.8	-167	-177.7	-78.5	-54	0	0	0	113.3
906	P	38.2	Very low	27.6	Very low	97 Å²	97	129.8 Å²	129.8	63%	0.63	72%	0.721	S	S	*	*				-135.1	177.4	-64.1	40.7	-25.1	0	0	0	113.8
907	N	25.7	Very low	27.6	Very low	141 Å²	141	131.8 Å²	131.8	75%	0.754	73%	0.726	S	S	*	*			trans	160.6	162.8	133.3	-83.7	-30.8	0	0	0	114.9
908	D	27.7	Very low	27.4	Very low	131 Å²	131	132.5 Å²	132.5	70%	0.701	73%	0.725	S	S	*	*			trans	81	89	163.1	-67.5	-13.7	0	0	0	122.8
909	Y	26.7	Very low	27.3	Very low	200 Å²	200	132 Å²	132	78%	0.784	72%	0.724	S	S	*	*				45.9	106.4	120	-79.5	-83.1	0	0	0	122.4
910	S	25.4	Very low	27.3	Very low	87 Å²	87	133.5 Å²	133.5	61%	0.608	73%	0.726	S	S	*	*				77.2	108.2	129.4	70.2	0	0	0	0	121.2
911	K	25	Very low	26.9	Very low	155 Å²	155	132.2 Å²	132.2	67%	0.674	72%	0.722	S	S	*	*				-169.4	125.3	118.2	-105.9	164.2	-175.3	175.1	0	113.9	N1005 E1006	K911-N1005 CarbonylContact O-C 3.36Å; K911-N1005 VanDerWaalsContact O-C 3.29Å; K911-E1006 CarbonylContact C-O 3.49Å; K911-E1006 PolarHBondContact N-O 2.97Å; K911-E1006 CarbonylContact O-C 3.49Å; K911-E1006 PolarHBondContact O-N 3.44Å
912	T	24.5	Very low	26.7	Very low	109 Å²	109	136.5 Å²	136.5	67%	0.669	73%	0.728	S	S	*	*			trans	35.7	105.1	148.4	51.3	0	0	0	0	119.5	N1005	T912-N1005 PolarHBondContact O-N 2.98Å; T912-N1005 VanDerWaalsContact O-N 3.1Å
913	N	22.7	Very low	26.4	Very low	106 Å²	106	136.1 Å²	136.1	57%	0.567	73%	0.725	S	S	*	*			trans	-163.9	109.5	134.2	-108.5	-5.9	0	0	0	111.5	S915 N1005	N913-S915 PolarHBondContact O-N 3.16Å; N913-N1005 PolarHBondContact ND2-N 2.86Å; N913-N1005 VanDerWaalsContact ND2-N 3.11Å; N913-N1005 PolarHBondContact ND2-OD1 3.33Å
914	T	27.8	Very low	26	Very low	149 Å²	149	136.9 Å²	136.9	91%	0.914	73%	0.725	S	S	*	*			trans	-83.8	96.5	172.3	28.2	0	0	0	0	109.4	I916	T914-I916 PolarHBondContact O-N 3.34Å
915	S	25.4	Very low	25.9	Very low	104 Å²	104	134.1 Å²	134.1	73%	0.727	72%	0.724	S	S	*	*			trans	-63.4	130.1	-175.4	53.8	0	0	0	0	113.3	N913 I917	N913-S915 PolarHBondContact O-N 3.16Å; S915-I917 PolarHBondContact O-N 3.43Å
916	I	24.4	Very low	25.6	Very low	152 Å²	152	136.9 Å²	136.9	78%	0.779	73%	0.729	S	S	*	*			trans	-45	124.1	160.4	-65.2	162.3	0	0	0	109.3	T914 N918	T914-I916 PolarHBondContact O-N 3.34Å; I916-N918 PolarHBondContact O-N 3Å
917	I	26.8	Very low	24.9	Very low	159 Å²	159	140.8 Å²	140.8	82%	0.815	74%	0.739	S	S	*	*			trans	-73.4	99.7	177.7	-61.4	176	0	0	0	108.2	S915	S915-I917 PolarHBondContact O-N 3.43Å
918	N	22	Very low	24.8	Very low	130 Å²	130	141.5 Å²	141.5	70%	0.695	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-56	135.9	169	-80	-31.9	0	0	0	110	I916 I920	I916-N918 PolarHBondContact O-N 3Å; N918-I920 PolarHBondContact O-N 3Å
919	P	25.2	Very low	24.6	Very low	111 Å²	111	141 Å²	141	72%	0.721	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-63.1	129.2	174.4	26.9	-33.2	0	0	0	109.8	S921	P919-S921 PolarHBondContact O-N 3.41Å
920	I	26.8	Very low	24.5	Very low	142 Å²	142	138.4 Å²	138.4	73%	0.728	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-54.8	125.4	-170.5	-66.1	163.1	0	0	0	111.3	N918 W922	N918-I920 PolarHBondContact O-N 3Å; I920-W922 PolarHBondContact O-N 3.49Å
921	S	21.5	Very low	24.4	Very low	85 Å²	85	139.8 Å²	139.8	59%	0.594	76%	0.758	S	S	*	*			trans	-67	114.3	177.7	52.8	0	0	0	0	111.9	P919 I923	P919-S921 PolarHBondContact O-N 3.41Å; S921-I923 PolarHBondContact O-N 3.45Å
922	W	25.2	Very low	24.4	Very low	224 Å²	224	140.3 Å²	140.3	85%	0.848	76%	0.761	S	S	*	*			trans	-77.9	68.7	171.2	-82.4	56	0	0	0	111.3	I920	I920-W922 PolarHBondContact O-N 3.49Å
923	I	22.4	Very low	24.4	Very low	135 Å²	135	143.1 Å²	143.1	69%	0.692	77%	0.766	S	S	*	*			trans	-119.3	83.4	176.3	-53.8	177.3	0	0	0	110	S921	S921-I923 PolarHBondContact O-N 3.45Å
924	N	23.6	Very low	24.7	Very low	132 Å²	132	143.4 Å²	143.4	71%	0.706	76%	0.764	S	S	*	*			trans	163.9	109.5	139	-92.9	-44.7	0	0	0	112	K926	N924-K926 PolarHBondContact O-N 2.86Å
925	P	25.6	Very low	24.7	Very low	133 Å²	133	140.9 Å²	140.9	86%	0.864	74%	0.74	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.1	52.8	175.1	36.4	-36	0	0	0	111.9
926	K	24.9	Very low	25	Very low	193 Å²	193	142.2 Å²	142.2	84%	0.839	74%	0.739	S	S	*	*	T	Hydrogen-bonded Turn	trans	-139.9	-3.8	-179.2	-76.3	-164.5	175.9	179.7	0	117.4	N924	N924-K926 PolarHBondContact O-N 2.86Å
927	Q	23.5	Very low	25.3	Very low	178 Å²	178	142.6 Å²	142.6	83%	0.832	74%	0.743	S	S	*	*	S	Bend	trans	-137.5	77.3	-179.7	-70.5	-175.9	-13	0	0	112.8
928	N	24.5	Very low	25.8	Very low	156 Å²	156	142.6 Å²	142.6	83%	0.834	73%	0.734	S	S	*	*			trans	-170.1	70.7	152.7	-103.2	-27.1	0	0	0	110.4	L930	N928-L930 VanDerWaalsContact C-N 3.31Å; N928-L930 PolarHBondContact O-N 3.5Å
929	S	22.6	Very low	26.7	Very low	122 Å²	122	140.4 Å²	140.4	85%	0.853	72%	0.722	S	S	*	*			trans	-80.2	71.3	177.9	57.6	0	0	0	0	112.1	S931	S929-S931 PolarHBondContact O-N 3.24Å
930	L	25.2	Very low	27.6	Very low	145 Å²	145	140.8 Å²	140.8	76%	0.759	71%	0.709	S	S	*	*			trans	-85	101.7	163.1	-99.5	141.7	0	0	0	108.6	N928 F932	N928-L930 VanDerWaalsContact C-N 3.31Å; N928-L930 PolarHBondContact O-N 3.5Å; L930-F932 VanDerWaalsContact C-N 3.35Å; L930-F932 PolarHBondContact O-N 3.43Å
931	S	21.9	Very low	28.2	Very low	115 Å²	115	137.7 Å²	137.7	80%	0.804	70%	0.7	S	S	*	*			trans	-75.3	74.6	-170.3	43.6	0	0	0	0	113.6	S929 Q933	S929-S931 PolarHBondContact O-N 3.24Å; S931-Q933 PolarHBondContact O-N 2.75Å
932	F	26.7	Very low	29.4	Very low	167 Å²	167	139.1 Å²	139.1	73%	0.732	70%	0.7	S	S	*	*			trans	-76.1	98.7	166.9	-98.8	-94.4	0	0	0	111.2	L930 E934	L930-F932 VanDerWaalsContact C-N 3.35Å; L930-F932 PolarHBondContact O-N 3.43Å; F932-E934 HydrophobicContact CD1-CG 4.46Å; F932-E934 PolarHBondContact O-N 3.12Å; F932-E934 VanDerWaalsContact O-N 3.1Å
933	Q	23.3	Very low	30.3	Very low	167 Å²	167	130.4 Å²	130.4	78%	0.78	67%	0.67	S	S	*	*			trans	-75.9	84.1	166.2	-75.1	-170.4	-10.2	0	0	110.7	S931	S931-Q933 PolarHBondContact O-N 2.75Å
934	E	29.2	Very low	31.1	Very low	113 Å²	113	130.2 Å²	130.2	53%	0.528	66%	0.661	S	S	.	*			trans	-89.5	143.6	161.9	-65.8	-165.4	160.1	0	0	110.3	R790 F932	R790-E934 IonicContact CZ-OE1 3.15Å; R790-E934 IonicContact NE-OE1 3.05Å; R790-E934 PolarHBondContact NE-OE1 3.13Å; R790-E934 IonicContact NH2-OE1 3.82Å; R790-E934 PolarHBondContact NH2-OE1 2.98Å; R790-E934 IonicContact NH2-OE2 2.63Å; R790-E934 PolarHBondContact NH2-OE2 3.34Å; F932-E934 HydrophobicContact CD1-CG 4.46Å; F932-E934 PolarHBondContact O-N 3.12Å; F932-E934 VanDerWaalsContact O-N 3.1Å
935	K	27.7	Very low	32	Very low	95 Å²	95	128.7 Å²	128.7	41%	0.413	65%	0.65	S	S	.	*			trans	-108.6	21.1	-163.6	-85.5	160	176.7	160.1	0	114	R1103	K935-R1103 HydrophobicContact CD-CB 4.03Å; K935-R1103 HydrophobicContact CD-CG 4.26Å; K935-R1103 PolarHBondContact NZ-OXT 2.83Å
936	D	31.1	Very low	32.9	Very low	132 Å²	132	123.8 Å²	123.8	71%	0.706	62%	0.619	S	S	*	*			trans	-108.3	108.3	178.7	-62.5	-29.3	0	0	0	108.5	Y938	D936-Y938 VanDerWaalsContact C-N 3.27Å; D936-Y938 HydrophobicContact CB-CD2 4.37Å; D936-Y938 PolarHBondContact O-N 3.05Å
937	D	32.1	Very low	33.5	Very low	160 Å²	160	116.2 Å²	116.2	86%	0.856	59%	0.587	S	S	*	*			trans	-70.1	73.9	-176.1	-67	-46.2	0	0	0	112.1
938	Y	37.3	Very low	34.3	Very low	159 Å²	159	109 Å²	109	62%	0.624	55%	0.553	S	S	*	*			trans	-114.9	110.3	172.7	-83.9	-81.3	0	0	0	111.4	D936 W940	D936-Y938 VanDerWaalsContact C-N 3.27Å; D936-Y938 HydrophobicContact CB-CD2 4.37Å; D936-Y938 PolarHBondContact O-N 3.05Å; Y938-W940 PolarHBondContact O-N 3.25Å
939	D	40.9	Very low	35.1	Very low	85 Å²	85	106.1 Å²	106.1	46%	0.455	54%	0.538	S	S	.	.			trans	-75.5	95	175.6	-171.5	-3.8	0	0	0	111.3	S941 I942	D939-S941 PolarHBondContact O-N 2.98Å; D939-S941 VanDerWaalsContact O-N 3.13Å; D939-S941 WeakPolarHBondContact OD1-CB 3.19Å; D939-S941 PolarHBondContact OD1-N 3.29Å; D939-S941 PolarHBondContact OD1-OG 3.12Å; D939-I942 HydrophobicContact CB-CD1 4.08Å; D939-I942 HydrophobicContact CB-CG1 4.33Å; D939-I942 PolarHBondContact O-N 2.61Å; D939-I942 WeakPolarHBondContact OD2-CD1 3.39Å; D939-I942 WeakPolarHBondContact OD2-CG1 3.22Å
940	W	43.9	Very low	36	Very low	119 Å²	119	104.1 Å²	104.1	45%	0.451	51%	0.512	S	S	.	.	H	α-helix	trans	-57.4	-22.9	176.8	-71.8	96.2	0	0	0	113.9	W757 Y938 L943 R944	W757-W940 HydrophobicContact CH2-CH2 4.39Å; W757-W940 HydrophobicContact CH2-CZ3 4.18Å; W757-W940 HydrophobicContact CZ3-CH2 4.17Å; W757-W940 HydrophobicContact CZ3-CZ3 4.21Å; Y938-W940 PolarHBondContact O-N 3.25Å; W940-L943 HydrophobicContact CE3-CD1 4.49Å; W940-R944 WeakPolarHBondContact O-CB 3.17Å; W940-R944 PolarHBondContact O-N 3.2Å
941	S	38	Very low	36.5	Very low	77 Å²	77	99.3 Å²	99.3	54%	0.538	49%	0.488	S	S	.	.	H	α-helix	trans	-64.5	-45.7	-180	-35.7	0	0	0	0	111	D939 R944 M945	D939-S941 PolarHBondContact O-N 2.98Å; D939-S941 VanDerWaalsContact O-N 3.13Å; D939-S941 WeakPolarHBondContact OD1-CB 3.19Å; D939-S941 PolarHBondContact OD1-N 3.29Å; D939-S941 PolarHBondContact OD1-OG 3.12Å; S941-R944 PolarHBondContact O-N 2.83Å; S941-M945 PolarHBondContact O-N 2.9Å
942	I	47.3	Very low	37.2	Very low	114 Å²	114	97.6 Å²	97.6	59%	0.585	47%	0.469	S	S	*	.	H	α-helix	trans	-69.7	-45.1	-178.1	-59.9	174.7	0	0	0	110.2	D939 R944 M945 S946	D939-I942 HydrophobicContact CB-CD1 4.08Å; D939-I942 HydrophobicContact CB-CG1 4.33Å; D939-I942 PolarHBondContact O-N 2.61Å; D939-I942 WeakPolarHBondContact OD2-CD1 3.39Å; D939-I942 WeakPolarHBondContact OD2-CG1 3.22Å; I942-R944 VanDerWaalsContact C-N 3.35Å; I942-R944 PolarHBondContact O-N 2.86Å; I942-M945 PolarHBondContact O-N 3.15Å; I942-S946 PolarHBondContact O-N 2.88Å
943	L	44.4	Very low	37.7	Very low	42 Å²	42	93.6 Å²	93.6	22%	0.22	46%	0.459	C	S	.	.	H	α-helix	trans	-58.9	-46.5	176.1	-67	175.3	0	0	0	111.3	F564 W940 S946 F947	F564-L943 HydrophobicContact CD1-CD2 3.62Å; F564-L943 HydrophobicContact CE1-CD2 3.45Å; F564-L943 VanDerWaalsContact CE1-CD2 3.45Å; W940-L943 HydrophobicContact CE3-CD1 4.49Å; L943-S946 PolarHBondContact O-N 3.37Å; L943-S946 PolarHBondContact O-OG 3.14Å; L943-F947 PolarHBondContact O-N 2.65Å; L943-F947 VanDerWaalsContact O-N 3.16Å
944	R	39.2	Very low	38.2	Very low	131 Å²	131	88 Å²	88	49%	0.494	43%	0.433	S	S	.	.	H	α-helix	trans	-61.5	-45.7	177.6	-177.2	175.5	174.3	-148.2	-2.1	112	W940 S941 I942 F947 I948	W940-R944 WeakPolarHBondContact O-CB 3.17Å; W940-R944 PolarHBondContact O-N 3.2Å; S941-R944 PolarHBondContact O-N 2.83Å; I942-R944 VanDerWaalsContact C-N 3.35Å; I942-R944 PolarHBondContact O-N 2.86Å; R944-F947 PolarHBondContact O-N 3.16Å; R944-I948 HydrophobicContact CG-CD1 3.84Å; R944-I948 WeakPolarHBondContact O-CD1 3.3Å; R944-I948 VanDerWaalsContact O-CG1 3.26Å; R944-I948 WeakPolarHBondContact O-CG1 3.39Å; R944-I948 PolarHBondContact O-N 3.07Å
945	M	41.7	Very low	38.2	Very low	99 Å²	99	87.1 Å²	87.1	49%	0.488	43%	0.432	S	S	.	.	H	α-helix	trans	-68.6	-35.7	179	-79.3	-64.3	152.6	0	0	113.5	S941 I942 F947 I948 N949	S941-M945 PolarHBondContact O-N 2.9Å; I942-M945 PolarHBondContact O-N 3.15Å; M945-F947 VanDerWaalsContact C-N 3.3Å; M945-F947 PolarHBondContact O-N 2.94Å; M945-I948 HydrophobicContact CE-CD1 3.68Å; M945-I948 PolarHBondContact O-N 3.26Å; M945-I948 HydrophobicContact SD-CD1 3.93Å; M945-N949 WeakPolarHBondContact O-CB 3.35Å; M945-N949 VanDerWaalsContact O-CG 3.27Å; M945-N949 PolarHBondContact O-N 2.84Å
946	S	44.9	Very low	38.3	Very low	31 Å²	31	85.7 Å²	85.7	22%	0.217	43%	0.434	C	S	.	.	H	α-helix	trans	-63	-38.1	173.9	75.3	0	0	0	0	112.2	I942 L943 R950	I942-S946 PolarHBondContact O-N 2.88Å; L943-S946 PolarHBondContact O-N 3.37Å; L943-S946 PolarHBondContact O-OG 3.14Å; S946-R950 WeakPolarHBondContact O-CB 3.22Å; S946-R950 VanDerWaalsContact O-CD 3.3Å; S946-R950 WeakPolarHBondContact O-CD 3.41Å; S946-R950 WeakPolarHBondContact O-CG 3.5Å; S946-R950 PolarHBondContact O-N 3.34Å
947	F	38.4	Very low	38.4	Very low	34 Å²	34	82.6 Å²	82.6	15%	0.149	42%	0.423	C	S	.	.	H	α-helix	trans	-72.7	-40.3	178.5	-152.7	-107.5	0	0	0	112.1	F564 L878 L943 R944 M945 T951	F564-F947 WeakPolarHBondContact O-CD2 3.23Å; F564-F947 WeakPolarHBondContact O-CE2 3.48Å; L878-F947 HydrophobicContact CD1-CD1 3.66Å; L878-F947 HydrophobicContact CD1-CE1 4.02Å; L878-F947 HydrophobicContact CD2-CD1 4.32Å; L878-F947 HydrophobicContact CG-CD1 3.98Å; L878-F947 HydrophobicContact CG-CE1 4.34Å; L943-F947 PolarHBondContact O-N 2.65Å; L943-F947 VanDerWaalsContact O-N 3.16Å; R944-F947 PolarHBondContact O-N 3.16Å; M945-F947 VanDerWaalsContact C-N 3.3Å; M945-F947 PolarHBondContact O-N 2.94Å; F947-T951 PolarHBondContact O-N 2.64Å; F947-T951 VanDerWaalsContact O-N 3.14Å; F947-T951 PolarHBondContact O-OG1 2.93Å
948	I	40	Very low	38.3	Very low	26 Å²	26	81.8 Å²	81.8	13%	0.133	41%	0.409	C	S	.	.	H	α-helix	trans	-58.1	-56.3	172.4	-71.8	163.5	0	0	0	110.6	L878 R944 M945 R950 T951 I952	L878-I948 HydrophobicContact CD2-CD1 4.48Å; L878-I948 HydrophobicContact CD2-CG1 3.47Å; L878-I948 VanDerWaalsContact CD2-CG1 3.47Å; R944-I948 HydrophobicContact CG-CD1 3.84Å; R944-I948 WeakPolarHBondContact O-CD1 3.3Å; R944-I948 VanDerWaalsContact O-CG1 3.26Å; R944-I948 WeakPolarHBondContact O-CG1 3.39Å; R944-I948 PolarHBondContact O-N 3.07Å; M945-I948 HydrophobicContact CE-CD1 3.68Å; M945-I948 PolarHBondContact O-N 3.26Å; M945-I948 HydrophobicContact SD-CD1 3.93Å; I948-R950 VanDerWaalsContact C-N 3.25Å; I948-R950 PolarHBondContact O-N 2.9Å; I948-T951 PolarHBondContact O-N 2.98Å; I948-T951 VanDerWaalsContact O-N 3.12Å; I948-I952 HydrophobicContact CG2-CD1 3.67Å; I948-I952 WeakPolarHBondContact O-CG1 3.41Å; I948-I952 PolarHBondContact O-N 2.97Å
949	N	40.5	Very low	37.9	Very low	95 Å²	95	81.1 Å²	81.1	51%	0.508	41%	0.411	S	S	.	.	H	α-helix	trans	-62.8	-31.7	-174.2	-69.9	-11.8	0	0	0	112.7	M945 T953	M945-N949 WeakPolarHBondContact O-CB 3.35Å; M945-N949 VanDerWaalsContact O-CG 3.27Å; M945-N949 PolarHBondContact O-N 2.84Å; N949-T953 PolarHBondContact O-N 2.8Å; N949-T953 VanDerWaalsContact O-N 3.12Å; N949-T953 PolarHBondContact O-OG1 3.45Å
950	R	41.8	Very low	37.1	Very low	81 Å²	81	82.3 Å²	82.3	31%	0.306	42%	0.424	S	S	.	.	H	α-helix	trans	-72.6	-38.9	175.4	-72.9	169.8	-170.9	-170.9	0.2	113.1	D566 S946 I948 I952 T953 M954	D566-R950 IonicContact OD1-CZ 3.79Å; D566-R950 IonicContact OD1-NH1 2.77Å; D566-R950 PolarHBondContact OD1-NH1 2.87Å; D566-R950 IonicContact OD2-CZ 3.28Å; D566-R950 IonicContact OD2-NH1 3.14Å; D566-R950 PolarHBondContact OD2-NH1 3.13Å; D566-R950 IonicContact OD2-NH2 2.77Å; S946-R950 WeakPolarHBondContact O-CB 3.22Å; S946-R950 VanDerWaalsContact O-CD 3.3Å; S946-R950 WeakPolarHBondContact O-CD 3.41Å; S946-R950 WeakPolarHBondContact O-CG 3.5Å; S946-R950 PolarHBondContact O-N 3.34Å; I948-R950 VanDerWaalsContact C-N 3.25Å; I948-R950 PolarHBondContact O-N 2.9Å; R950-I952 VanDerWaalsContact C-N 3.34Å; R950-T953 WeakPolarHBondContact CA-OG1 3.41Å; R950-T953 PolarHBondContact O-N 3.03Å; R950-T953 PolarHBondContact O-OG1 3.16Å; R950-M954 WeakPolarHBondContact O-CG 3.28Å; R950-M954 PolarHBondContact O-N 3.28Å
951	T	36.9	Very low	36.3	Very low	43 Å²	43	83.6 Å²	83.6	26%	0.264	44%	0.44	S	S	.	.	H	α-helix	trans	-69.2	-36.8	178.5	-52.3	0	0	0	0	111	L878 F947 I948 N955	L878-T951 HydrophobicContact CD1-CG2 3.83Å; L878-T951 WeakPolarHBondContact CD1-OG1 3.09Å; F947-T951 PolarHBondContact O-N 2.64Å; F947-T951 VanDerWaalsContact O-N 3.14Å; F947-T951 PolarHBondContact O-OG1 2.93Å; I948-T951 PolarHBondContact O-N 2.98Å; I948-T951 VanDerWaalsContact O-N 3.12Å; T951-N955 PolarHBondContact O-N 3.36Å; T951-N955 VanDerWaalsContact O-N 3.09Å
952	I	36	Very low	35.8	Very low	80 Å²	80	87 Å²	87	41%	0.41	45%	0.453	S	S	.	.	H	α-helix	trans	-64.6	-46.3	173.2	-64.7	168	0	0	0	111.3	I948 R950 M954 N955 S956	I948-I952 HydrophobicContact CG2-CD1 3.67Å; I948-I952 WeakPolarHBondContact O-CG1 3.41Å; I948-I952 PolarHBondContact O-N 2.97Å; R950-I952 VanDerWaalsContact C-N 3.34Å; I952-M954 VanDerWaalsContact C-N 3.33Å; I952-M954 PolarHBondContact O-N 3.29Å; I952-N955 PolarHBondContact O-N 3.09Å; I952-S956 PolarHBondContact O-N 2.77Å; I952-S956 PolarHBondContact O-OG 2.77Å
953	T	37	Very low	34.7	Very low	83 Å²	83	90.7 Å²	90.7	51%	0.509	47%	0.467	S	S	.	.	H	α-helix	trans	-70.2	-24.8	-179.3	40.1	0	0	0	0	114.3	N949 R950 S956 S957	N949-T953 PolarHBondContact O-N 2.8Å; N949-T953 VanDerWaalsContact O-N 3.12Å; N949-T953 PolarHBondContact O-OG1 3.45Å; R950-T953 WeakPolarHBondContact CA-OG1 3.41Å; R950-T953 PolarHBondContact O-N 3.03Å; R950-T953 PolarHBondContact O-OG1 3.16Å; T953-S956 PolarHBondContact O-OG 2.79Å; T953-S957 PolarHBondContact O-N 3.16Å; T953-S957 PolarHBondContact O-OG 3.04Å
954	M	33	Very low	33.9	Very low	48 Å²	48	93.2 Å²	93.2	24%	0.236	50%	0.495	C	S	.	.	H	α-helix	trans	-74.4	-45.4	169.1	-70	-65.9	173.9	0	0	111.4	N603 R950 I952 S956 S957 Y958	N603-M954 WeakPolarHBondContact OD1-CE 3.49Å; R950-M954 WeakPolarHBondContact O-CG 3.28Å; R950-M954 PolarHBondContact O-N 3.28Å; I952-M954 VanDerWaalsContact C-N 3.33Å; I952-M954 PolarHBondContact O-N 3.29Å; M954-S956 VanDerWaalsContact C-N 3.33Å; M954-S956 PolarHBondContact O-N 2.83Å; M954-S957 PolarHBondContact O-N 3.36Å; M954-S957 PolarHBondContact O-OG 3.45Å; M954-Y958 VanDerWaalsContact O-CD2 3.29Å; M954-Y958 WeakPolarHBondContact O-CD2 3.36Å; M954-Y958 PolarHBondContact O-N 3.2Å
955	N	31.1	Very low	33.2	Very low	96 Å²	96	94.9 Å²	94.9	51%	0.513	51%	0.511	S	S	.	.	H	α-helix	trans	-64.8	-34.1	178.7	-75.7	-6.6	0	0	0	113.1	T951 I952 S957	T951-N955 PolarHBondContact O-N 3.36Å; T951-N955 VanDerWaalsContact O-N 3.09Å; I952-N955 PolarHBondContact O-N 3.09Å; N955-S957 VanDerWaalsContact C-N 3.35Å
956	S	29.6	Very low	32.5	Very low	65 Å²	65	96 Å²	96	46%	0.455	52%	0.523	S	S	.	.	H	α-helix	trans	-70.6	-27.4	175.8	63.5	0	0	0	0	113.6	I952 T953 M954	I952-S956 PolarHBondContact O-N 2.77Å; I952-S956 PolarHBondContact O-OG 2.77Å; T953-S956 PolarHBondContact O-OG 2.79Å; M954-S956 VanDerWaalsContact C-N 3.33Å; M954-S956 PolarHBondContact O-N 2.83Å
957	S	32.6	Very low	31.7	Very low	67 Å²	67	101.8 Å²	101.8	47%	0.469	55%	0.552	S	S	.	*	H	α-helix	trans	-81.5	-17.4	178.2	43.4	0	0	0	0	114	T953 M954 N955	T953-S957 PolarHBondContact O-N 3.16Å; T953-S957 PolarHBondContact O-OG 3.04Å; M954-S957 PolarHBondContact O-N 3.36Å; M954-S957 PolarHBondContact O-OG 3.45Å; N955-S957 VanDerWaalsContact C-N 3.35Å
958	Y	29.8	Very low	31.1	Very low	142 Å²	142	107.7 Å²	107.7	56%	0.557	59%	0.585	S	S	*	*	H	α-helix	trans	-86.5	-15.1	170.1	-76.4	-74.2	0	0	0	114.3	M954	M954-Y958 VanDerWaalsContact O-CD2 3.29Å; M954-Y958 WeakPolarHBondContact O-CD2 3.36Å; M954-Y958 PolarHBondContact O-N 3.2Å
959	H	27.9	Very low	30.7	Very low	146 Å²	146	111.7 Å²	111.7	68%	0.676	61%	0.613	S	S	*	*	H	α-helix	trans	-92.9	-10.7	-176.3	-105.5	-71.1	0	0	0	115.8	N961	H959-N961 VanDerWaalsContact C-N 3.32Å; H959-N961 PolarHBondContact O-N 3.13Å
960	C	25.8	Very low	30.1	Very low	109 Å²	109	117 Å²	117	74%	0.736	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.8	12.6	-174.8	-74.5	0	0	0	0	116.8
961	N	26.8	Very low	29.4	Very low	146 Å²	146	116.4 Å²	116.4	78%	0.781	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123.2	7.6	-175.5	-77.1	-26.9	0	0	0	115.6	H959	H959-N961 VanDerWaalsContact C-N 3.32Å; H959-N961 PolarHBondContact O-N 3.13Å
962	N	26.3	Very low	29.1	Very low	150 Å²	150	119.3 Å²	119.3	80%	0.802	67%	0.673	S	S	*	*	S	Bend	trans	-121.2	7.2	-174.7	-83.9	-8.3	0	0	0	115.6
963	E	25.7	Very low	28.7	Very low	190 Å²	190	123.3 Å²	123.3	89%	0.888	69%	0.692	S	S	*	*			trans	-127.8	75.9	178.5	-69.3	-174.8	170.5	0	0	111.2
964	A	26.4	Very low	28.3	Very low	96 Å²	96	124.8 Å²	124.8	79%	0.793	70%	0.697	S	S	*	*			trans	-154.8	41.2	177.2	0	0	0	0	0	113.9
965	I	24.8	Very low	28.1	Very low	165 Å²	165	127.8 Å²	127.8	85%	0.846	71%	0.714	S	S	*	*			trans	-137.3	141.7	167.1	-56.4	-179.9	0	0	0	108
966	V	26.4	Very low	28	Very low	122 Å²	122	129.3 Å²	129.3	74%	0.739	72%	0.721	S	S	*	*			trans	101.5	88.1	-176.2	-176.2	0	0	0	0	113.4
967	N	28.8	Very low	28	Very low	153 Å²	153	134.1 Å²	134.1	82%	0.818	74%	0.736	S	S	*	*			trans	170.5	106.9	130	-84.4	-30.3	0	0	0	109.5
968	D	26.9	Very low	27.9	Very low	159 Å²	159	135.2 Å²	135.2	85%	0.85	74%	0.744	S	S	*	*			trans	-66.4	159.8	167.9	-68.4	-45.6	0	0	0	110.7
969	P	31.3	Very low	27.9	Very low	110 Å²	110	133.6 Å²	133.6	71%	0.714	75%	0.753	S	S	*	*				-141.5	136.9	95.7	32.9	-17.3	0	0	0	115.7
970	F	26.9	Very low	27.9	Very low	206 Å²	206	132 Å²	132	90%	0.904	76%	0.759	S	S	*	*			trans	37	128.2	139.8	-68.4	-91.7	0	0	0	120.9
971	G	28	Very low	28.5	Very low	69 Å²	69	132.8 Å²	132.8	71%	0.711	76%	0.762	S	S	*	*			trans	167.7	48.1	156.2	0	0	0	0	0	120.9
972	S	29.2	Very low	28.6	Very low	103 Å²	103	131.5 Å²	131.5	72%	0.72	77%	0.765	S	S	*	*			trans	47.2	124.5	150.7	61.5	0	0	0	0	121.9
973	M	27.3	Very low	28.9	Very low	164 Å²	164	129 Å²	129	81%	0.808	76%	0.759	S	S	*	*			trans	66.7	144.4	134.4	-61.4	176.3	78.3	0	0	117
974	D	30	Very low	29	Very low	115 Å²	115	127.1 Å²	127.1	62%	0.615	76%	0.755	S	S	*	*			cis	-174.7	162.2	4.6	-116.7	22.7	0	0	0	105.1
975	N	28.2	Very low	29.1	Very low	110 Å²	110	129.8 Å²	129.8	59%	0.588	76%	0.755	S	S	*	*			cis	-171.7	161.4	-8.7	-143.9	-34.7	0	0	0	106.7
976	L	28.2	Very low	29.2	Very low	129 Å²	129	129 Å²	129	68%	0.675	75%	0.752	S	S	*	*			trans	65.7	149.7	158.7	-50	165.4	0	0	0	116.6
977	H	30.4	Very low	29.4	Very low	165 Å²	165	130.5 Å²	130.5	76%	0.764	76%	0.755	S	S	*	*			cis	-155.8	161.8	0.2	-98.3	-45	0	0	0	105.3
978	S	30.5	Very low	29.3	Very low	91 Å²	91	127.3 Å²	127.3	64%	0.636	75%	0.745	S	S	*	*			cis	-172.5	149.2	4.5	43.9	0	0	0	0	110.4
979	S	30.6	Very low	29.5	Very low	108 Å²	108	125.2 Å²	125.2	76%	0.755	74%	0.742	S	S	*	*			trans	51.3	142.9	143	62.5	0	0	0	0	122.4
980	S	27.6	Very low	29.4	Very low	113 Å²	113	125.6 Å²	125.6	79%	0.79	75%	0.748	S	S	*	*			cis	-173.7	165.8	-9.6	45.6	0	0	0	0	110.8
981	P	37.3	Very low	29.5	Very low	124 Å²	124	123.3 Å²	123.3	81%	0.805	74%	0.744	S	S	*	*			trans	-119.3	177.8	-166.6	42.5	-31.5	0	0	0	116.2
982	S	30.5	Very low	29.7	Very low	120 Å²	120	125.9 Å²	125.9	84%	0.839	75%	0.748	S	S	*	*			trans	-179.1	153.7	159.4	17.1	0	0	0	0	109.5
983	S	32.3	Very low	29.6	Very low	98 Å²	98	126.2 Å²	126.2	69%	0.685	75%	0.75	S	S	*	*			cis	-162.5	129.2	-1.5	49.3	0	0	0	0	113.1
984	N	26.7	Very low	29.8	Very low	150 Å²	150	124 Å²	124	80%	0.802	75%	0.751	S	S	*	*				58.8	137.8	124.5	-60.9	-15.3	0	0	0	126.1
985	L	29.6	Very low	29.5	Very low	152 Å²	152	126.5 Å²	126.5	80%	0.796	76%	0.764	S	S	*	*			trans	136.2	107.8	140.4	-73.2	160.7	0	0	0	110.4
986	L	26.9	Very low	29.4	Very low	149 Å²	149	129.4 Å²	129.4	78%	0.78	78%	0.777	S	S	*	*				58.4	133	69.9	-65.8	168.6	0	0	0	112.2
987	L	29.3	Very low	29.2	Very low	153 Å²	153	130.8 Å²	130.8	80%	0.801	78%	0.78	S	S	*	*			cis	-142.2	-160.6	16.4	-73.6	93.8	0	0	0	110.5
988	S	28.3	Very low	29.1	Very low	86 Å²	86	133.3 Å²	133.3	60%	0.601	78%	0.784	S	S	*	*				-179.2	174.2	-69.1	80.7	0	0	0	0	110.2
989	S	30	Very low	28.8	Very low	114 Å²	114	136.1 Å²	136.1	80%	0.797	79%	0.787	S	S	*	*			trans	72.9	145.7	173.7	76.5	0	0	0	0	117.9
990	S	28.6	Very low	28.5	Very low	118 Å²	118	136.2 Å²	136.2	83%	0.825	78%	0.783	S	S	*	*			cis	-163.5	160.1	-11.8	41.6	0	0	0	0	113.4
991	L	30.4	Very low	28.3	Very low	158 Å²	158	137.1 Å²	137.1	83%	0.827	78%	0.779	S	S	*	*			trans	-66.1	179.5	177.8	-87.7	154.2	0	0	0	115
992	P	31.9	Very low	27.7	Very low	123 Å²	123	138 Å²	138	80%	0.799	78%	0.776	S	S	*	*			cis	-150.5	-167.6	34.6	44.6	-21.1	0	0	0	120
993	S	28.1	Very low	27.5	Very low	110 Å²	110	138.3 Å²	138.3	77%	0.769	77%	0.767	S	S	*	*			trans	-107.2	162.2	-167.2	54	0	0	0	0	116.5
994	S	30.3	Very low	27.1	Very low	117 Å²	117	138.7 Å²	138.7	82%	0.818	76%	0.761	S	S	*	*			trans	-161.7	133.8	150	58.5	0	0	0	0	114
995	N	24.3	Very low	27	Very low	168 Å²	168	135.2 Å²	135.2	90%	0.898	74%	0.743	S	S	*	*			trans	-87.9	155.1	168.4	-71.2	-18.1	0	0	0	111.3
996	M	26.6	Very low	26.8	Very low	171 Å²	171	134 Å²	134	84%	0.842	73%	0.733	S	S	*	*			trans	-157.7	141.7	134.2	-145.2	172.1	178.1	0	0	112.7
997	E	23.6	Very low	26.7	Very low	158 Å²	158	133.8 Å²	133.8	74%	0.738	73%	0.728	S	S	*	*			trans	-88.7	160	179.5	-56.2	165.4	129.7	0	0	111.8
998	Y	28	Very low	26.4	Very low	218 Å²	218	134.8 Å²	134.8	86%	0.855	73%	0.726	S	S	*	*			trans	-149.9	126.4	142.6	-95.9	-70.1	0	0	0	112.3
999	H	24.5	Very low	26.2	Very low	150 Å²	150	138.6 Å²	138.6	69%	0.694	73%	0.732	S	S	*	*			trans	-64.8	172.9	159.9	-74	-109.2	0	0	0	110.1
1000	T	24.2	Very low	25.9	Very low	110 Å²	110	140.5 Å²	140.5	68%	0.675	73%	0.73	S	S	*	*			cis	-171.8	137	32.8	-12.7	0	0	0	0	110.8
1001	N	23.9	Very low	25.7	Very low	133 Å²	133	138.6 Å²	138.6	71%	0.711	72%	0.717	S	S	*	*				62.1	143.7	122.2	-83.9	-3.3	0	0	0	127.2
1002	L	24.6	Very low	25.4	Very low	141 Å²	141	137 Å²	137	74%	0.738	71%	0.714	S	S	*	*			trans	73.2	148	149.2	-89	93.4	0	0	0	120.3
1003	I	24.6	Very low	25	Very low	127 Å²	127	136.4 Å²	136.4	65%	0.651	71%	0.708	S	S	*	*			cis	-172	154.8	-29.3	-127.7	-179.3	0	0	0	110.5
1004	N	24.2	Very low	24.8	Very low	106 Å²	106	138.2 Å²	138.2	57%	0.567	71%	0.709	S	S	*	*			trans	64	128.7	163.1	-67	1.4	0	0	0	120
1005	N	25.6	Very low	24.5	Very low	77 Å²	77	138.2 Å²	138.2	41%	0.412	71%	0.709	S	S	.	*				65.7	137.4	71.8	-81.5	14.4	0	0	0	112.3	K911 T912 N913	K911-N1005 CarbonylContact O-C 3.36Å; K911-N1005 VanDerWaalsContact O-C 3.29Å; T912-N1005 PolarHBondContact O-N 2.98Å; T912-N1005 VanDerWaalsContact O-N 3.1Å; N913-N1005 PolarHBondContact ND2-N 2.86Å; N913-N1005 VanDerWaalsContact ND2-N 3.11Å; N913-N1005 PolarHBondContact ND2-OD1 3.33Å
1006	E	24.8	Very low	24.5	Very low	126 Å²	126	138 Å²	138	59%	0.589	71%	0.707	S	S	*	*			cis	-150.2	-179.9	18.1	-137.7	153.6	-120.9	0	0	116.2	K911	K911-E1006 CarbonylContact C-O 3.49Å; K911-E1006 PolarHBondContact N-O 2.97Å; K911-E1006 CarbonylContact O-C 3.49Å; K911-E1006 PolarHBondContact O-N 3.44Å
1007	Q	26.2	Very low	24.5	Very low	145 Å²	145	136.8 Å²	136.8	68%	0.678	70%	0.702	S	S	*	*			trans	-71	173.2	-171.9	-55.9	172.3	2.2	0	0	113.8
1008	F	22.2	Very low	24.6	Very low	174 Å²	174	134.3 Å²	134.3	76%	0.763	70%	0.7	S	S	*	*				-154.8	149.2	119.2	-116.2	-76.7	0	0	0	113.1
1009	K	24	Very low	24.6	Very low	167 Å²	167	131.4 Å²	131.4	73%	0.726	70%	0.698	S	S	*	*			trans	-99.8	162	177.7	-77.2	173.4	174.1	170.1	0	111.5
1010	M	23.6	Very low	24.6	Very low	153 Å²	153	130.4 Å²	130.4	75%	0.754	70%	0.697	S	S	*	*			trans	150.8	152.4	132.5	-83	-70.3	-168.1	0	0	108.6
1011	S	24.5	Very low	24.7	Very low	78 Å²	78	133.6 Å²	133.6	55%	0.545	70%	0.704	S	S	.	*			cis	-175	-167.2	-28.2	54.4	0	0	0	0	107.8
1012	T	24.5	Very low	24.9	Very low	125 Å²	125	134.9 Å²	134.9	77%	0.767	71%	0.71	S	S	*	*			trans	70.4	155.4	171.1	76.2	0	0	0	0	117.3
1013	T	23.3	Very low	25	Very low	111 Å²	111	134.7 Å²	134.7	68%	0.681	72%	0.716	S	S	*	*			cis	-158.7	161.1	-43.4	31.1	0	0	0	0	107.5
1014	N	23.2	Very low	25	Very low	147 Å²	147	133.5 Å²	133.5	79%	0.786	72%	0.718	S	S	*	*			trans	40.3	107.6	148.3	-57.9	-14	0	0	0	120.4
1015	S	25.1	Very low	25.2	Very low	117 Å²	117	136.7 Å²	136.7	82%	0.818	73%	0.734	S	S	*	*				-167.4	109.8	121.1	25.3	0	0	0	0	113.2
1016	L	23.8	Very low	25.3	Very low	164 Å²	164	138.4 Å²	138.4	86%	0.859	75%	0.753	S	S	*	*			trans	-17.7	128.6	134.8	-71.6	145.8	0	0	0	116
1017	I	25.8	Very low	25.4	Very low	145 Å²	145	140.8 Å²	140.8	74%	0.744	76%	0.764	S	S	*	*			trans	-152.2	125.6	131.1	-89	138.1	0	0	0	106.9	I1019	I1017-I1019 HydrophobicContact CG2-CD1 4.39Å; I1017-I1019 HydrophobicContact CG2-CG1 3.96Å
1018	P	26	Very low	25.4	Very low	106 Å²	106	142 Å²	142	69%	0.688	77%	0.774	S	S	*	*			trans	-89.9	134.2	169.9	33.9	-29.5	0	0	0	110.4
1019	I	28.1	Very low	25.8	Very low	158 Å²	158	140.8 Å²	140.8	81%	0.81	78%	0.781	S	S	*	*			trans	-117.8	102	166.1	-61.9	-176.3	0	0	0	108.7	I1017	I1017-I1019 HydrophobicContact CG2-CD1 4.39Å; I1017-I1019 HydrophobicContact CG2-CG1 3.96Å
1020	N	25.1	Very low	25.9	Very low	128 Å²	128	142.5 Å²	142.5	68%	0.684	79%	0.791	S	S	*	*			trans	-63.4	169.4	166	-68	-44.3	0	0	0	110.7
1021	H	25.6	Very low	26	Very low	177 Å²	177	138.3 Å²	138.3	82%	0.819	79%	0.787	S	S	*	*			trans	86	81.3	-178.2	-55.6	-83.5	0	0	0	116.2
1022	L	27.9	Very low	26.2	Very low	160 Å²	160	142.2 Å²	142.2	84%	0.838	80%	0.796	S	S	*	*				-168.1	38.8	125.8	-100.5	158.8	0	0	0	112.7
1023	T	26	Very low	26.5	Very low	138 Å²	138	143.1 Å²	143.1	85%	0.847	80%	0.797	S	S	*	*			trans	-108.2	63.5	176.8	44.9	0	0	0	0	111.2
1024	S	26.1	Very low	26.9	Very low	101 Å²	101	143.5 Å²	143.5	71%	0.706	79%	0.793	S	S	*	*			trans	-155.3	29	-177.8	59.1	0	0	0	0	116.2
1025	L	27.2	Very low	27.1	Very low	173 Å²	173	144.3 Å²	144.3	91%	0.906	80%	0.797	S	S	*	*	S	Bend	trans	-135.1	26	174.5	-76.1	178.7	0	0	0	114.8
1026	S	29	Very low	27.6	Very low	114 Å²	114	144.8 Å²	144.8	80%	0.797	80%	0.795	S	S	*	*	S	Bend	trans	-122.5	0.2	177.8	55.4	0	0	0	0	115.6
1027	E	26.6	Very low	27.8	Very low	176 Å²	176	143.8 Å²	143.8	82%	0.822	79%	0.791	S	S	*	*	S	Bend	trans	-133.7	79.9	-177	-66.6	-170.7	148	0	0	111.7
1028	L	26	Very low	28.2	Very low	170 Å²	170	143.4 Å²	143.4	89%	0.89	79%	0.79	S	S	*	*			trans	-169.4	44.3	164.7	-112.5	161.9	0	0	0	115.9
1029	V	30	Very low	28.5	Very low	149 Å²	149	144.2 Å²	144.2	90%	0.903	79%	0.789	S	S	*	*			trans	-143.5	63.6	159.4	-163.4	0	0	0	0	111.8
1030	Q	26.2	Very low	28.7	Very low	203 Å²	203	141.9 Å²	141.9	95%	0.949	78%	0.782	S	S	*	*			trans	-145	115.6	159.8	-74.7	-166	8.8	0	0	110.7
1031	G	26.7	Very low	29.2	Very low	65 Å²	65	142.7 Å²	142.7	67%	0.67	79%	0.786	S	S	*	*			trans	123	126	160.4	0	0	0	0	0	116
1032	H	27.9	Very low	29.6	Very low	160 Å²	160	140.2 Å²	140.2	74%	0.741	78%	0.779	S	S	*	*			trans	67.8	145.1	170.5	-57	-79.7	0	0	0	114.5
1033	D	31.2	Very low	30	Very low	144 Å²	144	138.3 Å²	138.3	77%	0.77	77%	0.77	S	S	*	*			cis	-116	144.5	21.1	-57.2	-56.1	0	0	0	111.8
1034	I	30.3	Very low	30.5	Very low	118 Å²	118	137.8 Å²	137.8	61%	0.605	76%	0.762	S	S	*	*				66.7	90	61.6	-52.3	176.6	0	0	0	112.7	V1036	I1034-V1036 HydrophobicContact CG2-CG2 3.95Å
1035	D	28.2	Very low	31.1	Very low	164 Å²	164	139.1 Å²	139.1	88%	0.877	76%	0.761	S	S	*	*			trans	-70.6	130.2	162.7	-54.5	-65.5	0	0	0	110.3
1036	V	35.4	Very low	31.6	Very low	127 Å²	127	137.1 Å²	137.1	77%	0.77	75%	0.751	S	S	*	*			trans	-137.8	128.5	164.1	-178.7	0	0	0	0	108.3	I1034	I1034-V1036 HydrophobicContact CG2-CG2 3.95Å
1037	D	29.4	Very low	32	Very low	143 Å²	143	139.9 Å²	139.9	77%	0.765	75%	0.751	S	S	*	*			trans	-76.9	175	179.8	-65.1	-64.3	0	0	0	113.7
1038	D	34	Very low	32.4	Very low	138 Å²	138	137.5 Å²	137.5	74%	0.738	74%	0.744	S	S	*	*			trans	87.1	107.5	152.1	-74.3	-23.4	0	0	0	121.8
1039	N	32.4	Very low	33	Very low	122 Å²	122	136.9 Å²	136.9	65%	0.652	74%	0.736	S	S	*	*				81.9	98.1	121.5	-63.8	-35.8	0	0	0	122.6
1040	T	31.7	Very low	33.3	Very low	109 Å²	109	134.5 Å²	134.5	67%	0.669	72%	0.722	S	S	*	*				59.5	146.9	120.1	60.2	0	0	0	0	122.8
1041	N	34.8	Very low	33.6	Very low	146 Å²	146	131.2 Å²	131.2	78%	0.781	71%	0.711	S	S	*	*			trans	81.2	142.9	161.8	-56.7	-21	0	0	0	116.4
1042	N	34.6	Very low	34	Very low	124 Å²	124	135.1 Å²	135.1	66%	0.663	72%	0.717	S	S	*	*			cis	-167.8	167.9	-25.5	-153.3	37.9	0	0	0	107.6
1043	D	37.1	Very low	34.6	Very low	121 Å²	121	132.8 Å²	132.8	65%	0.647	71%	0.713	S	S	*	*			trans	66.2	154.2	157.9	-60.6	-49.2	0	0	0	119.5
1044	N	36.6	Very low	34.7	Very low	127 Å²	127	132.4 Å²	132.4	68%	0.679	71%	0.711	S	S	*	*			cis	-168.3	168.1	-38	-122	-45.1	0	0	0	109.9
1045	N	37.1	Very low	34.9	Very low	129 Å²	129	133.3 Å²	133.3	69%	0.69	72%	0.718	S	S	*	*			trans	72.8	117.2	164.2	-60.1	-37.6	0	0	0	119.1
1046	N	37.4	Very low	35.1	Very low	131 Å²	131	130.9 Å²	130.9	70%	0.701	71%	0.708	S	S	*	*				77.3	120.6	74.5	-70.7	-29.3	0	0	0	113.1
1047	H	39.2	Very low	34.7	Very low	171 Å²	171	133.8 Å²	133.8	79%	0.792	71%	0.71	S	S	*	*				-166.8	-178.7	62.7	-111	-44	0	0	0	115.2
1048	N	34.7	Very low	34.8	Very low	127 Å²	127	135.7 Å²	135.7	68%	0.679	72%	0.715	S	S	*	*			trans	-90.9	160	-171.8	-49	-49.3	0	0	0	114.1
1049	H	38.4	Very low	34.5	Very low	157 Å²	157	133.8 Å²	133.8	73%	0.727	71%	0.713	S	S	*	*				179.1	121.6	106.1	-106.3	-77.1	0	0	0	116.9
1050	T	35.3	Very low	34.3	Very low	98 Å²	98	133 Å²	133	60%	0.601	72%	0.717	S	S	*	*			trans	39.4	123	135.4	52.4	0	0	0	0	125
1051	N	33.2	Very low	34.3	Very low	135 Å²	135	137 Å²	137	72%	0.722	73%	0.728	S	S	*	*				95.8	146	122.3	-67.4	10.1	0	0	0	123.1
1052	D	36.1	Very low	33.8	Very low	146 Å²	146	135.1 Å²	135.1	78%	0.781	73%	0.726	S	S	*	*			trans	73.4	144.6	158.8	-59.5	-19.2	0	0	0	119.7
1053	V	38.8	Very low	33.6	Very low	111 Å²	111	135.1 Å²	135.1	67%	0.673	74%	0.735	S	S	*	*			cis	-164.3	149.7	-28.9	118.4	0	0	0	0	108.1
1054	N	35	Very low	33.1	Very low	136 Å²	136	136.7 Å²	136.7	73%	0.727	74%	0.742	S	S	*	*			trans	66.9	131.2	163.5	-72.1	-16.9	0	0	0	123.8
1055	N	32.7	Very low	32.9	Very low	138 Å²	138	137 Å²	137	74%	0.738	75%	0.749	S	S	*	*			trans	87.7	105.6	136.7	-74.7	-13.5	0	0	0	124.3
1056	V	33.2	Very low	32.5	Very low	112 Å²	112	138.7 Å²	138.7	68%	0.679	75%	0.752	S	S	*	*				73.7	108.5	123.2	-178.5	0	0	0	0	119.4
1057	K	27.7	Very low	32.2	Very low	188 Å²	188	141.9 Å²	141.9	82%	0.817	76%	0.763	S	S	*	*			trans	57.1	109.1	151.7	-64.9	170.7	-177.8	177.1	0	117.9
1058	Q	30.1	Very low	31.6	Very low	183 Å²	183	143.3 Å²	143.3	86%	0.855	77%	0.766	S	S	*	*				-176.2	161.6	103.2	-98.4	173.3	11.7	0	0	112.9
1059	S	29.2	Very low	31.5	Very low	99 Å²	99	143.2 Å²	143.2	69%	0.692	78%	0.776	S	S	*	*			trans	47	112.2	153.1	59.5	0	0	0	0	121.3
1060	S	26.6	Very low	31.1	Very low	105 Å²	105	141.1 Å²	141.1	73%	0.734	78%	0.779	S	S	*	*			trans	22.3	123	130.9	58.3	0	0	0	0	120.4
1061	Q	31.7	Very low	31	Very low	193 Å²	193	144.1 Å²	144.1	90%	0.902	79%	0.79	S	S	*	*				-169.7	164.5	118.8	-104.9	170.6	28.4	0	0	112.2
1062	S	25.1	Very low	31	Very low	106 Å²	106	142.8 Å²	142.8	74%	0.741	79%	0.791	S	S	*	*			trans	-76.9	145.2	178.2	49.3	0	0	0	0	113.4
1063	S	29.8	Very low	31	Very low	124 Å²	124	141 Å²	141	87%	0.867	79%	0.789	S	S	*	*			trans	-172.5	160.7	135.3	29.3	0	0	0	0	113.6
1064	I	27.9	Very low	30.8	Very low	155 Å²	155	140.9 Å²	140.9	80%	0.795	79%	0.794	S	S	*	*			trans	-74.4	152.5	177.9	-65.3	147.7	0	0	0	110.2
1065	V	31.4	Very low	30.8	Very low	133 Å²	133	138.3 Å²	138.3	81%	0.806	80%	0.8	S	S	*	*				178	148.3	128.3	149	0	0	0	0	112.1
1066	H	30	Very low	30.8	Very low	165 Å²	165	135.5 Å²	135.5	76%	0.764	80%	0.803	S	S	*	*			trans	-56.4	155.4	177.2	-72.6	-92.8	0	0	0	115.4
1067	Q	30.2	Very low	30.8	Very low	197 Å²	197	137 Å²	137	92%	0.921	81%	0.812	S	S	*	*			trans	-141.3	127.5	133.2	-108.3	173.5	12.2	0	0	111.3
1068	K	27.1	Very low	30.9	Very low	201 Å²	201	134.4 Å²	134.4	87%	0.874	81%	0.812	S	S	*	*			trans	-103.4	142.3	158.8	-88.7	179.6	168.7	176.8	0	107
1069	S	32.4	Very low	31.1	Very low	125 Å²	125	133.8 Å²	133.8	87%	0.874	81%	0.813	S	S	*	*			trans	-141.1	149.9	153.6	57.4	0	0	0	0	109
1070	S	29.7	Very low	31.1	Very low	114 Å²	114	133.8 Å²	133.8	80%	0.797	81%	0.813	S	S	*	*			trans	-143.8	137.9	-164.2	52.6	0	0	0	0	110.6
1071	I	34.1	Very low	31.5	Very low	161 Å²	161	135.1 Å²	135.1	83%	0.826	82%	0.817	S	S	*	*			trans	-131.9	110.5	172	-64.1	-178.3	0	0	0	107.8
1072	S	33	Very low	31.6	Very low	107 Å²	107	131 Å²	131	75%	0.748	81%	0.809	S	S	*	*			trans	4.8	151.6	140.4	62.7	0	0	0	0	118.9
1073	S	34.7	Very low	31.9	Very low	107 Å²	107	131.2 Å²	131.2	75%	0.748	81%	0.811	S	S	*	*			cis	-161.9	-169.3	14.5	76.7	0	0	0	0	109
1074	S	36.1	Very low	32.3	Very low	110 Å²	110	131.6 Å²	131.6	77%	0.769	81%	0.811	S	S	*	*			cis	-163.7	166.3	-9.7	31.1	0	0	0	0	109.1
1075	G	34.9	Very low	32.3	Very low	82 Å²	82	129.8 Å²	129.8	85%	0.845	81%	0.812	S	S	*	*			trans	81	130.6	166.9	0	0	0	0	0	116
1076	G	31.5	Very low	32.5	Very low	78 Å²	78	128.7 Å²	128.7	80%	0.804	81%	0.81	S	S	*	*			cis	128.8	105.8	-3.9	0	0	0	0	0	112.6
1077	V	33.9	Very low	32.6	Very low	144 Å²	144	125.7 Å²	125.7	87%	0.873	81%	0.807	S	S	*	*			trans	-175.3	130.7	143.4	149.4	0	0	0	0	107.8
1078	T	28.8	Very low	32.8	Very low	133 Å²	133	123.4 Å²	123.4	82%	0.816	80%	0.802	S	S	*	*			trans	-117.2	142.4	176.6	39.9	0	0	0	0	110.3
1079	I	35.6	Very low	33.2	Very low	170 Å²	170	122.8 Å²	122.8	87%	0.872	80%	0.799	S	S	*	*			trans	-136.2	136.9	150.5	-61.7	-174.4	0	0	0	108
1080	S	29.1	Very low	33.3	Very low	99 Å²	99	126 Å²	126	69%	0.692	80%	0.797	S	S	*	*			trans	-111.9	-166	-170.5	57.1	0	0	0	0	112.2
1081	T	34.4	Very low	33.5	Very low	133 Å²	133	127.8 Å²	127.8	82%	0.816	80%	0.797	S	S	*	*			trans	100.5	140.5	176.2	69.8	0	0	0	0	115.6
1082	S	33.9	Very low	33.7	Very low	107 Å²	107	130.2 Å²	130.2	75%	0.748	80%	0.802	S	S	*	*			cis	-169.1	139.8	-29.2	44.4	0	0	0	0	107.9
1083	S	32.2	Very low	33.6	Very low	111 Å²	111	132.5 Å²	132.5	78%	0.776	81%	0.806	S	S	*	*			trans	-79.3	169.2	170.3	48.9	0	0	0	0	111.8
1084	P	36.6	Very low	33.6	Very low	132 Å²	132	136.4 Å²	136.4	86%	0.857	81%	0.81	S	S	*	*				-142.8	171.8	114.2	37.4	-23.6	0	0	0	115.3
1085	S	29.7	Very low	33.5	Very low	117 Å²	117	142.1 Å²	142.1	82%	0.818	81%	0.814	S	S	*	*			trans	-127.1	148	-168.1	56	0	0	0	0	113.7
1086	S	35.3	Very low	33.3	Very low	110 Å²	110	149.7 Å²	149.7	77%	0.769	82%	0.817	S	S	*	*			trans	-171.9	114.2	153.4	54.3	0	0	0	0	109.6
1087	S	31.8	Very low	33.5	Very low	101 Å²	101	154 Å²	154	71%	0.706	82%	0.816	S	S	*	*				86.6	103.2	53.1	75	0	0	0	0	115.4
1088	N	35	Very low	33.4	Very low	150 Å²	150	157.6 Å²	157.6	80%	0.802	81%	0.814	S	S	*	*			trans	179.2	107	140.7	-93.7	-34.4	0	0	0	110.1
1089	K	33.7	Very low	33.8	Very low	187 Å²	187	162.9 Å²	162.9	81%	0.813	82%	0.819	S	S	*	*				62.6	104.1	83.6	-85.1	-175.3	175	172.2	0	116.2
1090	K	35.7	Very low	33.6	Very low	193 Å²	193	164.4 Å²	164.4	84%	0.839	82%	0.819	S	S	*	*				172.9	118.9	107.8	-92.8	170.1	-175.8	175.4	0	115.4
1091	N	33.4	Very low	33.7	Very low	151 Å²	151	168.2 Å²	168.2	81%	0.807	83%	0.826	S	S	*	*			trans	32.8	127.8	137.4	-59.1	-5.9	0	0	0	122.2
1092	K	37.6	Very low	33.8	Very low	212 Å²	212	171.4 Å²	171.4	92%	0.922	83%	0.829	S	S	*	*				-164.7	149.1	96.1	-103.6	169.1	-176.7	174.7	0	114
1093	N	31.7	Very low	33.8	Very low	156 Å²	156	178 Å²	178	83%	0.834	84%	0.837	S	S	*	*			trans	-94	172.7	-170.3	-82.6	-33.3	0	0	0	114.9
1094	K	35.4	Very low	33.9	Very low	189 Å²	189	181.4 Å²	181.4	82%	0.822	84%	0.84	S	S	*	*			trans	102.6	133.7	164.5	-60.2	169.8	-179	177.5	0	113.1
1095	R	33.2	Very low	33.7	Very low	230 Å²	230	184 Å²	184	87%	0.868	84%	0.84	S	S	*	*			cis	-157.5	134.9	11.4	-127.7	167.6	177.4	171.8	-4.1	110.7
1096	R	31.2	Very low	33.9	Very low	240 Å²	240	187.7 Å²	187.7	91%	0.906	84%	0.841	S	S	*	*			trans	-89.5	135.2	158.7	-96.2	-179.6	166.1	178.8	-3.7	108.5
1097	H	36.1	Very low	33.9	Very low	169 Å²	169	192.3 Å²	192.3	78%	0.782	85%	0.845	S	S	*	*			trans	-168	121.7	145.2	-102.6	-28.2	0	0	0	115.5
1098	R	31.5	Very low	34	Very low	220 Å²	220	198 Å²	198	83%	0.83	85%	0.854	S	S	*	*			trans	33.6	119.5	134.9	-73.2	179.5	162.6	176.4	-6.3	121.4
1099	R	35.9	Very low	33.9	Very low	244 Å²	244	201.2 Å²	201.2	92%	0.921	86%	0.857	S	S	*	*				171.4	125.1	122.3	-94.3	163.2	174.1	174.7	-2.2	105.6
1100	K	31.8	Very low	33.9	Very low	202 Å²	202	202.2 Å²	202.2	88%	0.878	86%	0.86	S	S	*	*			cis	53	119.1	37.4	-99.5	-165.4	-179.5	-173.4	0	114.8
1101	Q	31.3	Very low	33.8	Very low	178 Å²	178	202.9 Å²	202.9	83%	0.832	86%	0.862	S	S	*	*			trans	91.7	135.1	170.3	-67.2	-170.6	-17.7	0	0	119.8
1102	K	36.6	Very low	33.8	Very low	200 Å²	200	207.3 Å²	207.3	87%	0.87	87%	0.866	S	S	*	*			trans	70.4	126.2	173.4	-55.9	175.6	-176.5	-178.5	0	113.9
1103	R	33.7	Very low	33.5	Very low	247 Å²	247	206.8 Å²	206.8	93%	0.932	86%	0.861	S	S	*	*			cis	-117.6	0	8.2	-110.8	-175.7	165.1	-175	-3.2	111.4	K935	K935-R1103 HydrophobicContact CD-CB 4.03Å; K935-R1103 HydrophobicContact CD-CG 4.26Å; K935-R1103 PolarHBondContact NZ-OXT 2.83Å

Retrieved 1,103 of 1,103 residues in 477.1 ms (Link to these results)

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