A0A5K4FAB2_SCHMA Loading...

SH2 domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4FAB2, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,089 aa.

						>A0A5K4FAB2_SCHMA|A0A5K4FAB2
MTTVWTASNIRRQDGRYNSLSRSLGSLMSIVLDEDKSPSVLIFSNQSPRETNLQTSVSVGDQVGDENILPLNGLSFRSLQTDSSSSIAFVGKKIKREYQSAFVLPDKQTIGIIRQEAFMTEEGLAQVTLSLCVSTNLDSLQVSKSERICDYLDTDYWASILLASTESHDAELLGYMGPEYTSRKPNRFNFERSESRRRKREIVLVQEEIEDSDEKDSVGKFDSSNILPESVTVYEKLYPKGKEESDSQTSRLILHPPPPFPPPQLPESPLPSPPKTLKVSERNASPKPQPISSRNSCQPKEQAPIIGRAEPPGKTKPIVSSPKSKENFEKLKRQWNNRIAQMQEHLDNQYRDTPTSLPQTYTEGHRGSTVTSILPTVDKRSSDPYVKSRISSTDRRSSPEQAYDHQSLPDRTSMDHGSDKENFIFQGFDYISSSLPGSGDLVDPVTERCEKDAQFIYSQARLFVNQQNIGRLSPRKLSVDRGGHHPTTTETRGKVTDELPGHRRHPPPPLSPNAKEDMHYPRDGTVSRSRISDGSKAATPLTPTRHSLRNLGDDSEKRKRQQKVFDDEFRNANGEPMPLDPRKPNTQFNYGILPHPDEYNYLAEAEKQKPSIDFASELSYDSSLYGKTSQGSCRKQPPIKHYDKYKDKKSDKPHRHPPPPQPIDHDQTKRLDDKPSPKLDRRSRHGIVSGDENYYVNVPGSGPPGVRPPYNGHKRSLQDLSERSGPHSAYDPRLGDTINQPSKPRTSDRISDQIPDYYDQYTSDESDYDDSGESDEELKPPALRTITQTRRRSEPEPSNNYPPVQLRRPSKGQKTGQSITSIRDSLISPEGMSIPSTPGYENIYGIYYDDKTGKYMKGLDHDHSNGMSQERISRPRSKHTTATSRSSGYYGINGSKHSLIISTKRRTLSGLTGTHPSKHRSSSMNTLWFGDHPVPSERTLSPATPVRLSNIQIQAQAELERRHRSSSHGHSLDRKSVYSTGMTESHLSKGLSDYHQGYEGIGYSYDNRGRLIHGGACLPERSASRKRRLLDGHESLSRVWIPQSGEQYPVKQIPDRTASSLTNRDERQAQLDNSAMAFALRDFTVPKIR
					

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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	28.7	Very low	24.4	Very low	234 Å²	234	148.5 Å²	148.5	100%	1.153	79%	0.793	S	S	*	*				0	135.4	0	-76.9	165.8	148.4	0	0	107.8
2	T	30.9	Very low	24.4	Very low	140 Å²	140	150.9 Å²	150.9	86%	0.859	78%	0.783	S	S	*	*			trans	-118.5	101.4	169.4	-49	0	0	0	0	106.4	V4	T2-V4 PolarHBondContact O-N 3.48Å
3	T	23.7	Very low	24.4	Very low	96 Å²	96	153.2 Å²	153.2	59%	0.589	79%	0.787	S	S	*	*			trans	-76.7	109.6	-172.3	-48.3	0	0	0	0	109.6	W5	T3-W5 HydrophobicContact CG2-CD2 4.4Å; T3-W5 HydrophobicContact CG2-CG 4.47Å; T3-W5 HydrophobicContact CG2-CZ2 4.27Å; T3-W5 PolarHBondContact O-N 3.01Å
4	V	23.7	Very low	24.7	Very low	125 Å²	125	149.9 Å²	149.9	76%	0.758	77%	0.772	S	S	*	*			trans	-79	111	173.3	179.8	0	0	0	0	108.3	T2	T2-V4 PolarHBondContact O-N 3.48Å
5	W	21.7	Very low	25.1	Very low	229 Å²	229	144.6 Å²	144.6	87%	0.867	77%	0.769	S	S	*	*			trans	-95.2	92.7	177.8	-66.6	86.2	0	0	0	110.3	T3 A7	T3-W5 HydrophobicContact CG2-CD2 4.4Å; T3-W5 HydrophobicContact CG2-CG 4.47Å; T3-W5 HydrophobicContact CG2-CZ2 4.27Å; T3-W5 PolarHBondContact O-N 3.01Å; W5-A7 PolarHBondContact O-N 3.43Å
6	T	26.6	Very low	25.6	Very low	110 Å²	110	150.1 Å²	150.1	68%	0.675	78%	0.775	S	S	*	*			trans	-72.6	113.1	167.2	44	0	0	0	0	109.8	S8	T6-S8 PolarHBondContact O-N 3.24Å; T6-S8 PolarHBondContact O-OG 2.86Å
7	A	23.8	Very low	25.6	Very low	105 Å²	105	153.7 Å²	153.7	87%	0.868	78%	0.779	S	S	*	*			trans	-55	107.8	-178.4	0	0	0	0	0	111.4	W5	W5-A7 PolarHBondContact O-N 3.43Å
8	S	21.4	Very low	25.5	Very low	91 Å²	91	154.8 Å²	154.8	64%	0.636	79%	0.787	S	S	*	*			trans	-122.2	118.3	-174	-57.6	0	0	0	0	108.9	T6	T6-S8 PolarHBondContact O-N 3.24Å; T6-S8 PolarHBondContact O-OG 2.86Å
9	N	20.5	Very low	25.5	Very low	156 Å²	156	151.4 Å²	151.4	83%	0.834	78%	0.778	S	S	*	*			trans	65.1	106.5	-171	-61.7	-57.9	0	0	0	116.1
10	I	26	Very low	25.6	Very low	126 Å²	126	153.3 Å²	153.3	65%	0.646	79%	0.789	S	S	*	*			trans	-110.5	97.8	146.4	-62.2	169.6	0	0	0	105.9	N45	I10-N45 VanDerWaalsContact CD1-ND2 3.3Å; I10-N45 WeakPolarHBondContact CD1-ND2 3.29Å
11	R	21.2	Very low	25.5	Very low	222 Å²	222	149.6 Å²	149.6	84%	0.838	78%	0.777	S	S	*	*			trans	-95	92.5	-179.7	-173.4	-172.1	-172.1	-158.7	4.5	109.5
12	R	24.4	Very low	25.3	Very low	177 Å²	177	150 Å²	150	67%	0.668	77%	0.766	S	S	*	*			trans	-66.3	142.7	166.7	-80.7	173.8	163.3	-96.6	0.9	110	D14	R12-D14 WeakPolarHBondContact CB-OD2 3.36Å; R12-D14 WeakPolarHBondContact CD-OD2 3.38Å; R12-D14 IonicContact NH1-OD2 2.81Å; R12-D14 PolarHBondContact NH1-OD2 3.12Å; R12-D14 PolarHBondContact O-N 3.03Å
13	Q	24.8	Very low	25.1	Very low	180 Å²	180	147.8 Å²	147.8	84%	0.841	76%	0.756	S	S	*	*			trans	-90.3	36.2	173.9	-70	-155.9	26.1	0	0	112.3	G15	Q13-G15 PolarHBondContact O-N 3.45Å
14	D	28.1	Very low	25.3	Very low	108 Å²	108	149.8 Å²	149.8	58%	0.578	76%	0.762	S	S	*	*			trans	-82.1	73.1	179.9	-61.8	-36.1	0	0	0	109.5	R12 R16	R12-D14 WeakPolarHBondContact CB-OD2 3.36Å; R12-D14 WeakPolarHBondContact CD-OD2 3.38Å; R12-D14 IonicContact NH1-OD2 2.81Å; R12-D14 PolarHBondContact NH1-OD2 3.12Å; R12-D14 PolarHBondContact O-N 3.03Å; D14-R16 PolarHBondContact O-N 3.23Å
15	G	31.3	Very low	25.4	Very low	70 Å²	70	146 Å²	146	72%	0.722	75%	0.749	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73	73.1	-163.5	0	0	0	0	0	116.2	Q13	Q13-G15 PolarHBondContact O-N 3.45Å
16	R	33.1	Very low	25.5	Very low	232 Å²	232	140.4 Å²	140.4	88%	0.875	75%	0.745	S	S	*	*	T	Hydrogen-bonded Turn	trans	-169.1	-13.3	147.7	-104.4	151.3	-153	-121.9	5.1	116.9	D14	D14-R16 PolarHBondContact O-N 3.23Å
17	Y	25.7	Very low	25.6	Very low	212 Å²	212	140.9 Å²	140.9	83%	0.831	74%	0.743	S	S	*	*			trans	-105.9	70.8	-171.6	-65.9	-71.4	0	0	0	114.6	S19	Y17-S19 PolarHBondContact O-N 2.88Å
18	N	24.5	Very low	25.6	Very low	174 Å²	174	140.8 Å²	140.8	93%	0.93	73%	0.725	S	S	*	*			trans	-83.4	87.5	169.1	-84.6	-17.2	0	0	0	111.3
19	S	24.7	Very low	25.8	Very low	89 Å²	89	139.5 Å²	139.5	62%	0.622	72%	0.716	S	S	*	*			trans	-144.3	113	167.5	58.9	0	0	0	0	111.6	Y17 S21	Y17-S19 PolarHBondContact O-N 2.88Å; S19-S21 VanDerWaalsContact C-N 3.3Å; S19-S21 PolarHBondContact O-N 2.96Å
20	L	26.7	Very low	26	Very low	189 Å²	189	137.2 Å²	137.2	99%	0.99	70%	0.703	S	S	*	*			trans	-71.7	73.9	179.9	-81.6	159.1	0	0	0	112.1
21	S	23.8	Very low	26.3	Very low	77 Å²	77	134.7 Å²	134.7	54%	0.538	69%	0.693	S	S	.	*			trans	-170.4	89.8	165.6	41.2	0	0	0	0	113.5	S19	S19-S21 VanDerWaalsContact C-N 3.3Å; S19-S21 PolarHBondContact O-N 2.96Å
22	R	24.1	Very low	26.6	Very low	242 Å²	242	130.6 Å²	130.6	91%	0.913	69%	0.687	S	S	*	*			trans	-160.6	152.1	148.1	-125.3	130.7	-82.1	-115.1	2.7	111.9
23	S	26.8	Very low	27	Very low	93 Å²	93	126 Å²	126	65%	0.65	68%	0.676	S	S	*	*			trans	-69.6	174.1	-172.3	-168	0	0	0	0	113.6	G25 S26	S23-G25 PolarHBondContact O-N 3.02Å; S23-S26 PolarHBondContact O-N 3Å
24	L	28.4	Very low	27.7	Very low	138 Å²	138	126.3 Å²	126.3	72%	0.723	68%	0.677	S	S	*	*	G	3₁₀ helix	trans	-56.7	-8.6	-174.9	-75.9	162.6	0	0	0	116.2	S26 L27	L24-S26 PolarHBondContact O-N 2.91Å; L24-L27 HydrophobicContact CD2-CD1 3.93Å; L24-L27 PolarHBondContact O-N 2.75Å
25	G	25.3	Very low	28	Very low	47 Å²	47	128.5 Å²	128.5	49%	0.485	69%	0.689	S	S	.	*	G	3₁₀ helix	trans	-54.8	-23.3	173.2	0	0	0	0	0	114.1	S23 L27 M28	S23-G25 PolarHBondContact O-N 3.02Å; G25-L27 PolarHBondContact O-N 3.1Å; G25-L27 VanDerWaalsContact O-N 3.13Å; G25-M28 PolarHBondContact O-N 3.01Å
26	S	25.6	Very low	28.1	Very low	111 Å²	111	131.8 Å²	131.8	78%	0.776	68%	0.684	S	S	*	*	G	3₁₀ helix	trans	-68.9	-3	174.4	-168.9	0	0	0	0	115.1	S23 L24	S23-S26 PolarHBondContact O-N 3Å; L24-S26 PolarHBondContact O-N 2.91Å
27	L	27.3	Very low	27.8	Very low	120 Å²	120	125.1 Å²	125.1	63%	0.628	67%	0.673	S	S	*	*	G	3₁₀ helix	trans	-82.6	-13.7	165.8	-82.1	164.9	0	0	0	113	L24 G25	L24-L27 HydrophobicContact CD2-CD1 3.93Å; L24-L27 PolarHBondContact O-N 2.75Å; G25-L27 PolarHBondContact O-N 3.1Å; G25-L27 VanDerWaalsContact O-N 3.13Å
28	M	24.8	Very low	27.7	Very low	102 Å²	102	119.3 Å²	119.3	50%	0.502	66%	0.661	S	S	.	*			trans	-107.1	94.4	-177.2	-62	170	70.2	0	0	109	G25 I30 V40	G25-M28 PolarHBondContact O-N 3.01Å; M28-I30 PolarHBondContact O-N 3.3Å; M28-I30 VanDerWaalsContact O-N 3.14Å; M28-V40 HydrophobicContact CE-CG1 3.91Å; M28-V40 HydrophobicContact CG-CG1 4.47Å
29	S	24.3	Very low	27.8	Very low	65 Å²	65	114.5 Å²	114.5	46%	0.455	64%	0.641	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-77.8	94.9	166.8	-168.7	0	0	0	0	108	V31	S29-V31 PolarHBondContact O-N 3.4Å; S29-V31 VanDerWaalsContact O-N 3.1Å
30	I	26.5	Very low	27.8	Very low	108 Å²	108	114.1 Å²	114.1	55%	0.554	63%	0.634	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-67.5	107.1	166.8	-54.4	175.7	0	0	0	106.2	M28 L32 P38	M28-I30 PolarHBondContact O-N 3.3Å; M28-I30 VanDerWaalsContact O-N 3.14Å; I30-L32 HydrophobicContact CG2-CD2 3.71Å; I30-L32 HydrophobicContact CG2-CG 4.04Å; I30-L32 PolarHBondContact O-N 2.84Å; I30-P38 HydrophobicContact CG2-CB 4.3Å
31	V	30.6	Very low	27.7	Very low	73 Å²	73	108.4 Å²	108.4	44%	0.442	61%	0.605	S	S	.	*			trans	-80.7	104.6	165.7	179.9	0	0	0	0	105.8	S29 D33 L41	S29-V31 PolarHBondContact O-N 3.4Å; S29-V31 VanDerWaalsContact O-N 3.1Å; V31-D33 PolarHBondContact O-N 3.48Å; V31-L41 HydrophobicContact CG2-CD1 4.11Å
32	L	27.3	Very low	27.7	Very low	135 Å²	135	109.6 Å²	109.6	71%	0.707	60%	0.604	S	S	*	*			trans	-79.4	100.2	167	-63.1	173.9	0	0	0	107.1	I30	I30-L32 HydrophobicContact CG2-CD2 3.71Å; I30-L32 HydrophobicContact CG2-CG 4.04Å; I30-L32 PolarHBondContact O-N 2.84Å
33	D	33.5	Very low	27.7	Very low	80 Å²	80	104.5 Å²	104.5	43%	0.428	59%	0.589	S	S	.	*			trans	-104.8	106.6	163.1	-169.1	34.6	0	0	0	103.8	V31 D35 K36	V31-D33 PolarHBondContact O-N 3.48Å; D33-D35 PolarHBondContact O-N 3.05Å; D33-K36 PolarHBondContact O-N 3.31Å; D33-K36 VanDerWaalsContact O-O 3.13Å; D33-K36 IonicContact OD2-NZ 2.9Å; D33-K36 PolarHBondContact OD2-NZ 3.48Å
34	E	39	Very low	27.6	Very low	187 Å²	187	104.1 Å²	104.1	87%	0.874	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.4	-23.2	-156.8	-59.7	-141.4	135.4	0	0	114
35	D	34.9	Very low	27.3	Very low	154 Å²	154	103.5 Å²	103.5	82%	0.824	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.9	6.3	178.1	-54.7	-53.4	0	0	0	114.3	D33	D33-D35 PolarHBondContact O-N 3.05Å
36	K	32.7	Very low	27.2	Very low	140 Å²	140	108.9 Å²	108.9	61%	0.609	60%	0.596	S	S	*	*	S	Bend	trans	-139	138.4	-179.3	-64.1	-172.4	-161.2	71.4	0	114	D33	D33-K36 PolarHBondContact O-N 3.31Å; D33-K36 VanDerWaalsContact O-O 3.13Å; D33-K36 IonicContact OD2-NZ 2.9Å; D33-K36 PolarHBondContact OD2-NZ 3.48Å
37	S	26.7	Very low	27.1	Very low	92 Å²	92	108.3 Å²	108.3	64%	0.643	59%	0.592	S	S	*	*			trans	-52	134.8	-178.5	-44.8	0	0	0	0	112.7	S39	S37-S39 PolarHBondContact O-N 3.35Å
38	P	25.5	Very low	27.1	Very low	89 Å²	89	108.2 Å²	108.2	58%	0.578	60%	0.598	S	S	*	*			trans	-69.2	95.1	-165.2	26.3	-35.8	0	0	0	113.2	I30	I30-P38 HydrophobicContact CG2-CB 4.3Å
39	S	24.6	Very low	27.2	Very low	73 Å²	73	114.3 Å²	114.3	51%	0.51	62%	0.616	S	S	.	*			trans	-76.9	129.1	-178.2	71.5	0	0	0	0	113.2	S37 L41	S37-S39 PolarHBondContact O-N 3.35Å; S39-L41 PolarHBondContact O-N 2.98Å
40	V	25.5	Very low	27.3	Very low	81 Å²	81	119.5 Å²	119.5	49%	0.491	63%	0.633	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-85.3	93.6	-175.5	-176.9	0	0	0	0	111.4	M28 I42	M28-V40 HydrophobicContact CE-CG1 3.91Å; M28-V40 HydrophobicContact CG-CG1 4.47Å; V40-I42 HydrophobicContact CG1-CG1 4.27Å; V40-I42 PolarHBondContact O-N 3.27Å; V40-I42 VanDerWaalsContact O-N 3.07Å
41	L	24.2	Very low	27.4	Very low	70 Å²	70	120.4 Å²	120.4	37%	0.366	64%	0.644	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-77.4	90.3	178.2	-70.2	177	0	0	0	112.9	V31 S39 F43	V31-L41 HydrophobicContact CG2-CD1 4.11Å; S39-L41 PolarHBondContact O-N 2.98Å; L41-F43 HydrophobicContact CB-CE2 4.2Å; L41-F43 WeakPolarHBondContact O-CD2 3.46Å; L41-F43 PolarHBondContact O-N 3.42Å
42	I	25.1	Very low	27.1	Very low	102 Å²	102	123 Å²	123	52%	0.523	66%	0.655	S	S	.	*			trans	-76.2	114.2	166.5	-54.2	179	0	0	0	109.6	V40	V40-I42 HydrophobicContact CG1-CG1 4.27Å; V40-I42 PolarHBondContact O-N 3.27Å; V40-I42 VanDerWaalsContact O-N 3.07Å
43	F	23.7	Very low	27.2	Very low	135 Å²	135	124 Å²	124	59%	0.592	66%	0.66	S	S	*	*			trans	-83.6	118.1	173.1	-70	-87.7	0	0	0	111	L41	L41-F43 HydrophobicContact CB-CE2 4.2Å; L41-F43 WeakPolarHBondContact O-CD2 3.46Å; L41-F43 PolarHBondContact O-N 3.42Å
44	S	23.6	Very low	26.8	Very low	85 Å²	85	128.3 Å²	128.3	59%	0.594	68%	0.678	S	S	*	*			trans	-89	130.8	163.7	-176	0	0	0	0	108.9	Q46	S44-Q46 PolarHBondContact O-N 3.16Å
45	N	22.4	Very low	26.1	Very low	125 Å²	125	125.4 Å²	125.4	67%	0.668	67%	0.673	S	S	*	*			trans	-75.8	46.4	178.2	-83.8	-3.6	0	0	0	113	I10 S47	I10-N45 VanDerWaalsContact CD1-ND2 3.3Å; I10-N45 WeakPolarHBondContact CD1-ND2 3.29Å; N45-S47 PolarHBondContact O-N 3.47Å
46	Q	24.4	Very low	25.5	Very low	160 Å²	160	123.4 Å²	123.4	75%	0.748	67%	0.671	S	S	*	*			trans	-81.3	94.1	154	-64.8	-170.1	32	0	0	107.6	S44 P48	S44-Q46 PolarHBondContact O-N 3.16Å; Q46-P48 VanDerWaalsContact O-CD 3.27Å; Q46-P48 WeakPolarHBondContact O-CD 3.45Å
47	S	23	Very low	25.1	Very low	98 Å²	98	123.1 Å²	123.1	69%	0.685	68%	0.681	S	S	*	*			trans	-52.2	120	158	177.4	0	0	0	0	107.4	N45 R49	N45-S47 PolarHBondContact O-N 3.47Å; S47-R49 PolarHBondContact O-N 3.27Å
48	P	28	Very low	24.9	Very low	119 Å²	119	123.6 Å²	123.6	77%	0.773	68%	0.684	S	S	*	*			trans	-64.7	101.1	-179.4	-21.6	34.1	0	0	0	109.7	Q46 E50	Q46-P48 VanDerWaalsContact O-CD 3.27Å; Q46-P48 WeakPolarHBondContact O-CD 3.45Å; P48-E50 PolarHBondContact O-N 2.89Å
49	R	26.3	Very low	24.8	Very low	229 Å²	229	126.5 Å²	126.5	86%	0.864	70%	0.7	S	S	*	*			trans	-77.4	74.5	175	-88.8	-170.7	162.6	-163.6	-5.3	110.2	S47 T51	S47-R49 PolarHBondContact O-N 3.27Å; R49-T51 VanDerWaalsContact C-N 3.25Å; R49-T51 PolarHBondContact O-N 2.88Å
50	E	25.6	Very low	24.8	Very low	174 Å²	174	125.8 Å²	125.8	81%	0.813	70%	0.704	S	S	*	*			trans	35.4	43.5	148.8	-63.9	178.1	-167.4	0	0	117.7	P48 N52	P48-E50 PolarHBondContact O-N 2.89Å; E50-N52 VanDerWaalsContact C-N 3.31Å; E50-N52 PolarHBondContact O-N 3.01Å; E50-N52 VanDerWaalsContact O-N 3.11Å
51	T	29.8	Very low	24.9	Very low	128 Å²	128	129.4 Å²	129.4	79%	0.785	72%	0.721	S	S	*	*			trans	-77.7	91	156.7	52.1	0	0	0	0	107.1	R49 L53	R49-T51 VanDerWaalsContact C-N 3.25Å; R49-T51 PolarHBondContact O-N 2.88Å; T51-L53 PolarHBondContact O-N 3.45Å
52	N	24.3	Very low	24.9	Very low	128 Å²	128	135 Å²	135	68%	0.684	75%	0.745	S	S	*	*			trans	-56.4	97	-175.5	-87.7	-89.7	0	0	0	112.2	E50	E50-N52 VanDerWaalsContact C-N 3.31Å; E50-N52 PolarHBondContact O-N 3.01Å; E50-N52 VanDerWaalsContact O-N 3.11Å
53	L	29.2	Very low	24.9	Very low	154 Å²	154	137.1 Å²	137.1	81%	0.806	76%	0.763	S	S	*	*			trans	-109.5	107.6	156	-68.3	179.2	0	0	0	106.7	T51 T55	T51-L53 PolarHBondContact O-N 3.45Å; L53-T55 VanDerWaalsContact C-N 3.29Å; L53-T55 PolarHBondContact O-N 3.03Å
54	Q	23.4	Very low	24.7	Very low	172 Å²	172	133.8 Å²	133.8	80%	0.804	77%	0.766	S	S	*	*			trans	-78.5	76.2	-177	-70.9	-179.2	-21.7	0	0	111.1
55	T	25.9	Very low	24.8	Very low	126 Å²	126	136.2 Å²	136.2	77%	0.773	77%	0.772	S	S	*	*			trans	-108.9	58.2	157.4	31.1	0	0	0	0	109.7	L53 V57	L53-T55 VanDerWaalsContact C-N 3.29Å; L53-T55 PolarHBondContact O-N 3.03Å; T55-V57 PolarHBondContact O-N 3.11Å
56	S	22	Very low	24.9	Very low	111 Å²	111	138.6 Å²	138.6	78%	0.776	78%	0.779	S	S	*	*			trans	-71.3	71.7	169	55.1	0	0	0	0	110.6	S58	S56-S58 PolarHBondContact O-N 2.88Å
57	V	24.8	Very low	25.1	Very low	135 Å²	135	137.4 Å²	137.4	82%	0.818	78%	0.778	S	S	*	*			trans	-74.3	103.5	160.3	-176.8	0	0	0	0	106	T55	T55-V57 PolarHBondContact O-N 3.11Å
58	S	22.7	Very low	25.2	Very low	102 Å²	102	140.5 Å²	140.5	71%	0.713	79%	0.785	S	S	*	*			trans	-61.3	138.8	179.9	-170.1	0	0	0	0	110.1	S56 G60	S56-S58 PolarHBondContact O-N 2.88Å; S58-G60 PolarHBondContact O-N 2.81Å
59	V	23.5	Very low	25.2	Very low	149 Å²	149	142.1 Å²	142.1	90%	0.903	79%	0.786	S	S	*	*			trans	-64.3	107	163.1	-179.3	0	0	0	0	106.3
60	G	23.2	Very low	25.2	Very low	59 Å²	59	136 Å²	136	61%	0.608	78%	0.777	S	S	*	*			trans	-128.5	91.5	-170.5	0	0	0	0	0	109.9	S58 Q62	S58-G60 PolarHBondContact O-N 2.81Å; G60-Q62 PolarHBondContact O-N 2.97Å
61	D	27.8	Very low	25.2	Very low	156 Å²	156	135.3 Å²	135.3	83%	0.834	78%	0.778	S	S	*	*			trans	-45.8	100	175.7	-173.3	22	0	0	0	112.4
62	Q	24.4	Very low	25.1	Very low	188 Å²	188	136.9 Å²	136.9	88%	0.879	78%	0.781	S	S	*	*			trans	-142.9	125.3	169.7	-78.7	-165	78.1	0	0	110.5	G60	G60-Q62 PolarHBondContact O-N 2.97Å
63	V	24.1	Very low	25.2	Very low	147 Å²	147	133.8 Å²	133.8	89%	0.891	78%	0.78	S	S	*	*			trans	-94.4	124.9	177.6	175.9	0	0	0	0	108.7
64	G	20.8	Very low	25.2	Very low	64 Å²	64	132.9 Å²	132.9	66%	0.66	78%	0.775	S	S	*	*			trans	155.9	144.9	169.7	0	0	0	0	0	115.9
65	D	24.6	Very low	25.2	Very low	136 Å²	136	130.1 Å²	130.1	73%	0.727	78%	0.775	S	S	*	*			trans	57.3	77	155.7	-60.2	0.5	0	0	0	119.5	N67	D65-N67 PolarHBondContact O-N 2.87Å; D65-N67 PolarHBondContact O-ND2 3.31Å
66	E	25.7	Very low	25.2	Very low	176 Å²	176	132.3 Å²	132.3	82%	0.822	77%	0.774	S	S	*	*				38	62.7	111.3	-59.7	-57.1	148.6	0	0	117
67	N	29.2	Very low	25.5	Very low	135 Å²	135	134.4 Å²	134.4	72%	0.722	77%	0.765	S	S	*	*			trans	-118.4	96.2	169.7	-85.3	-93.1	0	0	0	110.9	D65 L69	D65-N67 PolarHBondContact O-N 2.87Å; D65-N67 PolarHBondContact O-ND2 3.31Å; N67-L69 PolarHBondContact O-N 2.98Å
68	I	24.1	Very low	25.6	Very low	162 Å²	162	132.5 Å²	132.5	83%	0.831	76%	0.757	S	S	*	*			trans	-66	90.6	177.4	-56	171.6	0	0	0	109.2
69	L	28.8	Very low	25.9	Very low	153 Å²	153	131.3 Å²	131.3	80%	0.801	74%	0.743	S	S	*	*			trans	-77.9	125.4	173	-70.6	175	0	0	0	109.8	N67	N67-L69 PolarHBondContact O-N 2.98Å
70	P	25.2	Very low	26.2	Very low	102 Å²	102	133.1 Å²	133.1	66%	0.662	74%	0.741	S	S	*	*			trans	-66.6	155.2	-173.5	25.8	-34.4	0	0	0	113	N72	P70-N72 PolarHBondContact O-N 3.17Å
71	L	26.6	Very low	26.6	Very low	158 Å²	158	132.6 Å²	132.6	83%	0.827	73%	0.726	S	S	*	*	S	Bend	trans	-70.5	38.7	-159.9	-156.6	71.6	0	0	0	116.8	G73	L71-G73 VanDerWaalsContact C-N 3.34Å
72	N	26.9	Very low	26.6	Very low	161 Å²	161	131.7 Å²	131.7	86%	0.861	72%	0.722	S	S	*	*			trans	-96.5	26.5	177.3	-72.7	-34.4	0	0	0	112.8	P70	P70-N72 PolarHBondContact O-N 3.17Å
73	G	25.5	Very low	27	Very low	64 Å²	64	127.1 Å²	127.1	66%	0.66	71%	0.71	S	S	*	*			trans	-116.2	11.9	-166.2	0	0	0	0	0	116.9	L71 S75	L71-G73 VanDerWaalsContact C-N 3.34Å; G73-S75 PolarHBondContact O-N 3.38Å
74	L	29.3	Very low	27.3	Very low	134 Å²	134	125 Å²	125	70%	0.702	70%	0.702	S	S	*	*			trans	-68.4	92.5	179.3	-68.8	180	0	0	0	111.4	F76	L74-F76 VanDerWaalsContact O-CD2 3.25Å; L74-F76 WeakPolarHBondContact O-CD2 3.14Å; L74-F76 PolarHBondContact O-N 2.69Å
75	S	24	Very low	27.8	Very low	114 Å²	114	124.6 Å²	124.6	80%	0.797	69%	0.689	S	S	*	*			trans	-70.7	91.2	-177.5	-172.3	0	0	0	0	112	G73 R77	G73-S75 PolarHBondContact O-N 3.38Å; S75-R77 PolarHBondContact O-N 2.68Å
76	F	25.6	Very low	28.1	Very low	173 Å²	173	123.7 Å²	123.7	76%	0.759	69%	0.693	S	S	*	*			trans	-61.5	94.1	174	-65.9	-81.9	0	0	0	111.8	L74 S78	L74-F76 VanDerWaalsContact O-CD2 3.25Å; L74-F76 WeakPolarHBondContact O-CD2 3.14Å; L74-F76 PolarHBondContact O-N 2.69Å; F76-S78 PolarHBondContact O-N 3.14Å; F76-S78 VanDerWaalsContact O-N 3.17Å
77	R	29.2	Very low	28.8	Very low	155 Å²	155	121 Å²	121	59%	0.585	68%	0.683	S	S	*	*			trans	-78.3	98.5	174.6	-169.4	179.9	-174	-152.1	0.5	110.4	S75 L79	S75-R77 PolarHBondContact O-N 2.68Å; R77-L79 PolarHBondContact O-N 3.45Å; R77-L79 VanDerWaalsContact O-N 3.13Å
78	S	25.8	Very low	29.2	Very low	94 Å²	94	118.8 Å²	118.8	66%	0.657	68%	0.684	S	S	*	*			trans	-57.8	115.3	175.8	62	0	0	0	0	111.6	F76	F76-S78 PolarHBondContact O-N 3.14Å; F76-S78 VanDerWaalsContact O-N 3.17Å
79	L	29.5	Very low	30.3	Very low	78 Å²	78	113.5 Å²	113.5	41%	0.408	66%	0.655	S	S	.	*	B	Isolated β-bridge	trans	-95.4	124.1	174.3	-73.2	170.8	0	0	0	110.3	R77	R77-L79 PolarHBondContact O-N 3.45Å; R77-L79 VanDerWaalsContact O-N 3.13Å
80	Q	30.9	Very low	31.1	Very low	186 Å²	186	112.3 Å²	112.3	87%	0.869	65%	0.654	S	S	*	*			trans	-97.3	99.4	175.9	-174.7	-179.5	-6.7	0	0	109
81	T	29.9	Very low	32.4	Very low	48 Å²	48	109.1 Å²	109.1	29%	0.294	64%	0.64	S	S	.	*			trans	-113.9	132.6	-179.9	53	0	0	0	0	111.2
82	D	28.5	Very low	34	Very low	138 Å²	138	106.3 Å²	106.3	74%	0.738	62%	0.621	S	S	*	*			trans	-66.1	137.5	164.5	-62	-40.2	0	0	0	109.4	S84	D82-S84 PolarHBondContact O-N 3.37Å
83	S	33.6	Very low	36.1	Very low	91 Å²	91	102 Å²	102	64%	0.636	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.3	6.5	-162	-21.2	0	0	0	0	116.8	E201	S83-E201 VanDerWaalsContact CB-OE2 3.29Å; S83-E201 WeakPolarHBondContact CB-OE2 3.3Å; S83-E201 PolarHBondContact OG-OE2 3.21Å
84	S	28.9	Very low	38.2	Very low	104 Å²	104	100.1 Å²	100.1	73%	0.727	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.6	-3.7	-179.7	51.6	0	0	0	0	114.6	D82 S86	D82-S84 PolarHBondContact O-N 3.37Å; S84-S86 PolarHBondContact O-N 3.1Å
85	S	32.9	Very low	40.4	Very low	54 Å²	54	96.9 Å²	96.9	38%	0.378	55%	0.549	S	S	.	.			trans	-77.3	65.3	177.6	61.1	0	0	0	0	112.7	I87	S85-I87 PolarHBondContact O-N 2.87Å
86	S	31	Very low	42.8	Very low	117 Å²	117	95.6 Å²	95.6	82%	0.818	53%	0.527	S	S	*	.			trans	-74	69.4	168.3	64.3	0	0	0	0	110.7	S84	S84-S86 PolarHBondContact O-N 3.1Å
87	I	38.9	Very low	45.5	Very low	120 Å²	120	88.5 Å²	88.5	62%	0.615	50%	0.496	S	S	*	.			trans	-70.5	151.5	170.9	-63	175.3	0	0	0	108.4	S85 F89	S85-I87 PolarHBondContact O-N 2.87Å; I87-F89 HydrophobicContact CB-CE2 4.15Å; I87-F89 HydrophobicContact CB-CZ 4.16Å; I87-F89 WeakPolarHBondContact O-CD2 3.34Å; I87-F89 PolarHBondContact O-N 2.73Å
88	A	39.1	Very low	47.8	Very low	89 Å²	89	84.4 Å²	84.4	74%	0.736	48%	0.481	S	S	*	.			trans	-75.9	81	-174.4	0	0	0	0	0	112	V90	A88-V90 PolarHBondContact O-N 2.88Å
89	F	46.2	Very low	50.4	Low	51 Å²	51	83.4 Å²	83.4	22%	0.224	47%	0.466	C	S	.	.			trans	-74.8	39.1	175.7	-59.6	-74.2	0	0	0	113.5	I87 G91 K92 I94 T120 V205	I87-F89 HydrophobicContact CB-CE2 4.15Å; I87-F89 HydrophobicContact CB-CZ 4.16Å; I87-F89 WeakPolarHBondContact O-CD2 3.34Å; I87-F89 PolarHBondContact O-N 2.73Å; F89-G91 PolarHBondContact O-N 3.21Å; F89-K92 HydrophobicContact CB-CB 4.26Å; F89-K92 HydrophobicContact CD1-CB 4.45Å; F89-K92 PolarHBondContact O-N 3.17Å; F89-K92 VanDerWaalsContact O-N 3.12Å; F89-I94 HydrophobicContact CB-CD1 3.74Å; F89-I94 HydrophobicContact CB-CG1 3.68Å; F89-I94 HydrophobicContact CD2-CD1 3.86Å; F89-I94 HydrophobicContact CD2-CG1 4.14Å; F89-I94 HydrophobicContact CG-CD1 4.07Å; F89-I94 HydrophobicContact CG-CG1 3.96Å; F89-T120 WeakPolarHBondContact O-CG2 3.48Å; F89-T120 PolarHBondContact O-OG1 2.78Å; F89-V205 HydrophobicContact CE1-CG2 4.31Å
90	V	46.7	Very low	52.6	Low	127 Å²	127	82.2 Å²	82.2	77%	0.77	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	127.1	174.2	-176.9	0	0	0	0	108	A88 K92	A88-V90 PolarHBondContact O-N 2.88Å; V90-K92 VanDerWaalsContact C-N 3.29Å; V90-K92 PolarHBondContact O-N 2.84Å
91	G	52.6	Low	54.9	Low	36 Å²	36	75.6 Å²	75.6	37%	0.371	44%	0.441	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.6	3.3	-174.9	0	0	0	0	0	115.4	F89 T120 E121	F89-G91 PolarHBondContact O-N 3.21Å; G91-T120 PolarHBondContact N-OG1 2.86Å; G91-T120 VanDerWaalsContact N-OG1 3.16Å; G91-E121 VanDerWaalsContact CA-OE1 3.27Å; G91-E121 WeakPolarHBondContact CA-OE1 3.27Å
92	K	60.1	Low	57.2	Low	98 Å²	98	77.2 Å²	77.2	43%	0.426	44%	0.444	S	S	.	.	S	Bend	trans	-117.4	131.8	-177.8	-66	-167.7	176.2	-177.1	0	112.7	F89 V90 I94 T120 E207	F89-K92 HydrophobicContact CB-CB 4.26Å; F89-K92 HydrophobicContact CD1-CB 4.45Å; F89-K92 PolarHBondContact O-N 3.17Å; F89-K92 VanDerWaalsContact O-N 3.12Å; V90-K92 VanDerWaalsContact C-N 3.29Å; V90-K92 PolarHBondContact O-N 2.84Å; K92-I94 PolarHBondContact O-N 2.95Å; K92-I94 VanDerWaalsContact O-N 3.12Å; K92-T120 PolarHBondContact N-OG1 3.25Å; K92-E207 IonicContact NZ-OE1 2.95Å; K92-E207 PolarHBondContact NZ-OE1 3.07Å
93	K	69.2	Low	59.7	Low	70 Å²	70	75.8 Å²	75.8	30%	0.304	44%	0.44	S	S	.	.			trans	-64.7	102.9	174.5	-177.6	169.7	-159.9	157.9	0	110.9	K95 F118 M119 E208	K93-K95 HydrophobicContact CG-CG 4.4Å; K93-K95 PolarHBondContact O-N 3.5Å; K93-F118 WeakPolarHBondContact CA-O 3.12Å; K93-M119 HydrophobicContact CB-SD 3.99Å; K93-M119 HydrophobicContact CD-CE 4.35Å; K93-M119 HydrophobicContact CD-SD 3.44Å; K93-M119 WeakPolarHBondContact CD-SD 3.36Å; K93-M119 WeakPolarHBondContact CE-SD 3.17Å; K93-M119 HydrophobicContact CG-SD 3.47Å; K93-M119 WeakPolarHBondContact CG-SD 3.49Å; K93-E208 IonicContact NZ-OE2 3.57Å
94	I	69.6	Low	61.9	Low	26 Å²	26	74.5 Å²	74.5	13%	0.133	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	106.1	-179.7	-45.8	177.8	0	0	0	108.9	F89 K92 R96 A117 F118 T120	F89-I94 HydrophobicContact CB-CD1 3.74Å; F89-I94 HydrophobicContact CB-CG1 3.68Å; F89-I94 HydrophobicContact CD2-CD1 3.86Å; F89-I94 HydrophobicContact CD2-CG1 4.14Å; F89-I94 HydrophobicContact CG-CD1 4.07Å; F89-I94 HydrophobicContact CG-CG1 3.96Å; K92-I94 PolarHBondContact O-N 2.95Å; K92-I94 VanDerWaalsContact O-N 3.12Å; I94-R96 HydrophobicContact CG2-CG 4.24Å; I94-A117 CarbonylContact O-C 3.52Å; I94-A117 WeakPolarHBondContact O-CA 3.35Å; I94-F118 HydrophobicContact CB-CB 4.33Å; I94-F118 HydrophobicContact CD1-CD1 4.23Å; I94-F118 PolarHBondContact N-O 2.84Å; I94-F118 PolarHBondContact O-N 3.17Å; I94-T120 HydrophobicContact CD1-CG2 4.41Å
95	K	76.3	Confident	64.3	Low	66 Å²	66	76.2 Å²	76.2	29%	0.287	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	130.6	167.7	-61	177	-175.2	175.3	0	109.9	K93 E116 A117	K93-K95 HydrophobicContact CG-CG 4.4Å; K93-K95 PolarHBondContact O-N 3.5Å; K95-E116 CarbonylContact C-O 3.55Å; K95-E116 WeakPolarHBondContact CA-O 3.29Å; K95-A117 HydrophobicContact CG-CB 4.28Å
96	R	74.8	Confident	66.7	Low	86 Å²	86	77.9 Å²	77.9	33%	0.325	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	138.9	172.5	-55.5	-171.6	-171.8	105	6.9	110	I94 Y98 Q115 E116	I94-R96 HydrophobicContact CG2-CG 4.24Å; R96-Y98 HydrophobicContact CB-CE2 4.1Å; R96-Y98 WeakPolarHBondContact CD-OH 3.26Å; R96-Q115 CarbonylContact O-C 3.54Å; R96-Q115 VanDerWaalsContact O-CA 3.3Å; R96-Q115 WeakPolarHBondContact O-CA 3.28Å; R96-E116 HydrophobicContact CB-CB 4.39Å; R96-E116 IonicContact CZ-OE2 2.89Å; R96-E116 PolarHBondContact N-O 2.88Å; R96-E116 IonicContact NH1-OE2 3.97Å; R96-E116 PolarHBondContact NH1-OE2 3.13Å; R96-E116 PolarHBondContact O-N 2.77Å
97	E	81.6	Confident	69.1	Low	25 Å²	25	80.3 Å²	80.3	12%	0.117	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	128.1	174.5	-167.8	174.1	116.2	0	0	112.5	Q99 I113 Q115 I202	E97-Q99 HydrophobicContact CG-CG 4.27Å; E97-Q99 WeakPolarHBondContact OE1-CG 3.42Å; E97-Q99 PolarHBondContact OE1-NE2 2.8Å; E97-I113 VanDerWaalsContact CD-CG2 3.44Å; E97-I113 HydrophobicContact CG-CG2 3.47Å; E97-I113 VanDerWaalsContact CG-CG2 3.47Å; E97-Q115 HydrophobicContact CB-CG 4.31Å; E97-Q115 HydrophobicContact CG-CG 3.89Å; E97-Q115 WeakPolarHBondContact OE2-CG 3.43Å; E97-Q115 PolarHBondContact OE2-NE2 3.3Å; E97-I202 PolarHBondContact N-O 3.1Å; E97-I202 PolarHBondContact O-N 3.34Å
98	Y	77.6	Confident	71.2	Confident	69 Å²	69	78.4 Å²	78.4	27%	0.271	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	108.4	174.5	-53.4	-77.8	0	0	0	109.5	R96 I113 R114 E116 E201	R96-Y98 HydrophobicContact CB-CE2 4.1Å; R96-Y98 WeakPolarHBondContact CD-OH 3.26Å; Y98-I113 WeakPolarHBondContact O-CA 3.45Å; Y98-R114 HydrophobicContact CD2-CB 4.46Å; Y98-R114 HydrophobicContact CD2-CG 4.42Å; Y98-R114 PolarHBondContact N-O 2.92Å; Y98-R114 PolarHBondContact O-N 2.74Å; Y98-E116 HydrophobicContact CE2-CG 4.05Å; Y98-E201 HydrophobicContact CD1-CG 4.28Å; Y98-E201 HydrophobicContact CE1-CG 3.96Å; Y98-E201 WeakPolarHBondContact CE1-OE1 3.46Å; Y98-E201 PolarHBondContact OH-OE1 3.1Å
99	Q	80.3	Confident	73	Confident	72 Å²	72	74.6 Å²	74.6	34%	0.336	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	138.6	174.2	-61.8	-175.7	-7	0	0	110.8	E97 I113	E97-Q99 HydrophobicContact CG-CG 4.27Å; E97-Q99 WeakPolarHBondContact OE1-CG 3.42Å; E97-Q99 PolarHBondContact OE1-NE2 2.8Å; Q99-I113 HydrophobicContact CG-CD1 4.32Å; Q99-I113 HydrophobicContact CG-CG1 4.22Å; Q99-I113 HydrophobicContact CG-CG2 4.37Å
100	S	76.4	Confident	74.6	Confident	54 Å²	54	74.3 Å²	74.3	38%	0.378	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	148.8	172	61.7	0	0	0	0	111	I112	S100-I112 PolarHBondContact N-O 3.05Å; S100-I112 PolarHBondContact O-N 3.25Å; S100-I112 PolarHBondContact OG-O 3.35Å
101	A	78.1	Confident	76.1	Confident	46 Å²	46	68.3 Å²	68.3	38%	0.38	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	138.7	-177.9	0	0	0	0	0	110.9	T109 I110 L137 L140	A101-T109 HydrophobicContact CB-CG2 3.89Å; A101-I110 CarbonylContact C-O 3.48Å; A101-I110 WeakPolarHBondContact CA-O 3.24Å; A101-L137 HydrophobicContact CB-CD1 3.61Å; A101-L140 HydrophobicContact CB-CD1 4.32Å
102	F	78.3	Confident	77.4	Confident	82 Å²	82	68.6 Å²	68.6	36%	0.36	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	110	-177.3	-59	-97.7	0	0	0	109.1	T109 I110 I112	F102-T109 WeakPolarHBondContact O-CA 3.37Å; F102-I110 HydrophobicContact CB-CB 4.39Å; F102-I110 PolarHBondContact N-O 2.86Å; F102-I110 PolarHBondContact O-N 2.7Å; F102-I112 HydrophobicContact CD2-CD1 4.2Å; F102-I112 HydrophobicContact CD2-CG1 4.32Å; F102-I112 HydrophobicContact CE2-CD1 3.67Å; F102-I112 HydrophobicContact CE2-CG1 4.06Å
103	V	82	Confident	78.3	Confident	108 Å²	108	64.4 Å²	64.4	66%	0.655	33%	0.33	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.4	120.8	175.3	-172.4	0	0	0	0	109	Q108 T109	V103-Q108 CarbonylContact C-O 3.58Å; V103-Q108 WeakPolarHBondContact CA-O 3.29Å; V103-T109 HydrophobicContact CG2-CG2 4.4Å
104	L	80.4	Confident	78.7	Confident	65 Å²	65	64.8 Å²	64.8	34%	0.34	33%	0.329	S	S	.	.			trans	-80.4	164.9	176.7	-64.4	-172.5	0	0	0	111.7	D106 K107 Q108 I110	L104-D106 WeakPolarHBondContact CB-OD1 3.12Å; L104-D106 PolarHBondContact O-N 2.81Å; L104-K107 WeakPolarHBondContact O-CA 3.44Å; L104-K107 PolarHBondContact O-N 3.28Å; L104-Q108 HydrophobicContact CB-CB 4.42Å; L104-Q108 WeakPolarHBondContact CB-O 3.15Å; L104-Q108 HydrophobicContact CD1-CB 4.22Å; L104-Q108 PolarHBondContact N-O 2.83Å; L104-I110 HydrophobicContact CD1-CD1 4.05Å; L104-I110 HydrophobicContact CD1-CG1 4.2Å; L104-I110 HydrophobicContact CD2-CD1 4.14Å; L104-I110 HydrophobicContact CG-CD1 4.28Å; L104-I110 HydrophobicContact CG-CG1 4.31Å
105	P	77.7	Confident	79.2	Confident	139 Å²	139	67.5 Å²	67.5	90%	0.903	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-26.7	-178.5	-24.7	35.8	0	0	0	114.9	K107	P105-K107 PolarHBondContact O-N 2.88Å
106	D	84.9	Confident	79.3	Confident	90 Å²	90	66.2 Å²	66.2	48%	0.481	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.7	2.2	175.6	65.6	-6.2	0	0	0	113.7	L104 Q108	L104-D106 WeakPolarHBondContact CB-OD1 3.12Å; L104-D106 PolarHBondContact O-N 2.81Å; D106-Q108 VanDerWaalsContact C-N 3.33Å; D106-Q108 WeakPolarHBondContact OD1-CB 3.36Å; D106-Q108 PolarHBondContact OD1-N 3.31Å; D106-Q108 WeakPolarHBondContact OD2-CG 3.21Å; D106-Q108 PolarHBondContact OD2-NE2 2.8Å
107	K	81.4	Confident	79.5	Confident	167 Å²	167	62.8 Å²	62.8	73%	0.726	33%	0.327	S	S	*	.	S	Bend	trans	74.7	5.5	-175.5	-45.9	166.7	-172.4	168.5	0	115.4	L104 P105	L104-K107 WeakPolarHBondContact O-CA 3.44Å; L104-K107 PolarHBondContact O-N 3.28Å; P105-K107 PolarHBondContact O-N 2.88Å
108	Q	81.3	Confident	79	Confident	81 Å²	81	65.4 Å²	65.4	38%	0.379	34%	0.338	S	S	.	.			trans	-63	143.8	166.2	-67.7	-171	64.4	0	0	110	V103 L104 D106 V133	V103-Q108 CarbonylContact C-O 3.58Å; V103-Q108 WeakPolarHBondContact CA-O 3.29Å; L104-Q108 HydrophobicContact CB-CB 4.42Å; L104-Q108 WeakPolarHBondContact CB-O 3.15Å; L104-Q108 HydrophobicContact CD1-CB 4.22Å; L104-Q108 PolarHBondContact N-O 2.83Å; D106-Q108 VanDerWaalsContact C-N 3.33Å; D106-Q108 WeakPolarHBondContact OD1-CB 3.36Å; D106-Q108 PolarHBondContact OD1-N 3.31Å; D106-Q108 WeakPolarHBondContact OD2-CG 3.21Å; D106-Q108 PolarHBondContact OD2-NE2 2.8Å; Q108-V133 HydrophobicContact CB-CG1 4.39Å; Q108-V133 VanDerWaalsContact OE1-CG1 3.32Å
109	T	76.8	Confident	78.9	Confident	9 Å²	9	64.5 Å²	64.5	6%	0.055	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	111.3	177.7	-58.5	0	0	0	0	109.4	A101 F102 V103 G111 S134 L137	A101-T109 HydrophobicContact CB-CG2 3.89Å; F102-T109 WeakPolarHBondContact O-CA 3.37Å; V103-T109 HydrophobicContact CG2-CG2 4.4Å; T109-G111 PolarHBondContact O-N 3.41Å; T109-S134 WeakPolarHBondContact CA-O 3.29Å; T109-S134 VanDerWaalsContact CB-O 3.29Å; T109-S134 WeakPolarHBondContact CB-O 3.31Å; T109-S134 PolarHBondContact N-O 3.4Å; T109-S134 PolarHBondContact O-N 2.96Å; T109-L137 HydrophobicContact CG2-CD1 4.14Å
110	I	79.8	Confident	78.3	Confident	45 Å²	45	63.2 Å²	63.2	23%	0.231	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	113.5	169.2	-56.6	180	0	0	0	108	A101 F102 L104 I112 L131 C132 V133	A101-I110 CarbonylContact C-O 3.48Å; A101-I110 WeakPolarHBondContact CA-O 3.24Å; F102-I110 HydrophobicContact CB-CB 4.39Å; F102-I110 PolarHBondContact N-O 2.86Å; F102-I110 PolarHBondContact O-N 2.7Å; L104-I110 HydrophobicContact CD1-CD1 4.05Å; L104-I110 HydrophobicContact CD1-CG1 4.2Å; L104-I110 HydrophobicContact CD2-CD1 4.14Å; L104-I110 HydrophobicContact CG-CD1 4.28Å; L104-I110 HydrophobicContact CG-CG1 4.31Å; I110-I112 HydrophobicContact CG2-CG1 4.28Å; I110-L131 HydrophobicContact CG2-CD1 3.45Å; I110-L131 VanDerWaalsContact CG2-CD1 3.45Å; I110-C132 CarbonylContact C-O 3.58Å; I110-C132 WeakPolarHBondContact CA-O 3.43Å; I110-V133 HydrophobicContact CG1-CG2 4.31Å
111	G	79.4	Confident	77.8	Confident	0 Å²	0	68.3 Å²	68.3	0%	0	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	134.9	168.1	0	0	0	0	0	111.4	T109 C132	T109-G111 PolarHBondContact O-N 3.41Å; G111-C132 PolarHBondContact N-O 2.79Å; G111-C132 PolarHBondContact O-N 2.83Å; G111-C132 PolarHBondContact O-SG 3.46Å
112	I	79.7	Confident	77.6	Confident	42 Å²	42	71.9 Å²	71.9	22%	0.215	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	116.9	169.4	-44.9	-176.6	0	0	0	107.9	S100 F102 I110 S130 L131	S100-I112 PolarHBondContact N-O 3.05Å; S100-I112 PolarHBondContact O-N 3.25Å; S100-I112 PolarHBondContact OG-O 3.35Å; F102-I112 HydrophobicContact CD2-CD1 4.2Å; F102-I112 HydrophobicContact CD2-CG1 4.32Å; F102-I112 HydrophobicContact CE2-CD1 3.67Å; F102-I112 HydrophobicContact CE2-CG1 4.06Å; I110-I112 HydrophobicContact CG2-CG1 4.28Å; I112-S130 WeakPolarHBondContact CA-O 3.48Å; I112-L131 HydrophobicContact CD1-CD1 4.38Å; I112-L131 HydrophobicContact CG1-CD1 3.84Å
113	I	78.6	Confident	77.1	Confident	10 Å²	10	70.6 Å²	70.6	5%	0.051	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	134.6	170.7	-52.5	-169.3	0	0	0	108.2	E97 Y98 Q99 Q115 S130 L140 V142	E97-I113 VanDerWaalsContact CD-CG2 3.44Å; E97-I113 HydrophobicContact CG-CG2 3.47Å; E97-I113 VanDerWaalsContact CG-CG2 3.47Å; Y98-I113 WeakPolarHBondContact O-CA 3.45Å; Q99-I113 HydrophobicContact CG-CD1 4.32Å; Q99-I113 HydrophobicContact CG-CG1 4.22Å; Q99-I113 HydrophobicContact CG-CG2 4.37Å; I113-Q115 HydrophobicContact CG2-CG 4.3Å; I113-S130 PolarHBondContact N-O 3.23Å; I113-S130 PolarHBondContact O-N 3.5Å; I113-L140 HydrophobicContact CD1-CD2 4.03Å; I113-L140 HydrophobicContact CG1-CD2 4.07Å; I113-V142 HydrophobicContact CD1-CG2 3.81Å; I113-V142 HydrophobicContact CG1-CG2 4.39Å
114	R	78.3	Confident	76.4	Confident	78 Å²	78	70.4 Å²	70.4	29%	0.294	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	113.2	172.7	180	174.8	179.6	-94.6	-7.8	109.1	Y98 E116 V127 T128 L129	Y98-R114 HydrophobicContact CD2-CB 4.46Å; Y98-R114 HydrophobicContact CD2-CG 4.42Å; Y98-R114 PolarHBondContact N-O 2.92Å; Y98-R114 PolarHBondContact O-N 2.74Å; R114-E116 IonicContact CZ-OE1 3.63Å; R114-E116 IonicContact NH1-OE1 2.72Å; R114-E116 PolarHBondContact NH1-OE1 2.87Å; R114-E116 IonicContact NH2-OE1 2.65Å; R114-E116 PolarHBondContact NH2-OE1 2.9Å; R114-V127 HydrophobicContact CG-CG1 4.08Å; R114-T128 WeakPolarHBondContact CA-O 3.25Å; R114-L129 HydrophobicContact CB-CD2 3.68Å; R114-L129 HydrophobicContact CG-CD2 3.62Å
115	Q	78.7	Confident	76.1	Confident	84 Å²	84	71 Å²	71	39%	0.393	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	123.6	173.3	-69.3	172.1	-13.8	0	0	109.1	R96 E97 I113 V127 T128	R96-Q115 CarbonylContact O-C 3.54Å; R96-Q115 VanDerWaalsContact O-CA 3.3Å; R96-Q115 WeakPolarHBondContact O-CA 3.28Å; E97-Q115 HydrophobicContact CB-CG 4.31Å; E97-Q115 HydrophobicContact CG-CG 3.89Å; E97-Q115 WeakPolarHBondContact OE2-CG 3.43Å; E97-Q115 PolarHBondContact OE2-NE2 3.3Å; I113-Q115 HydrophobicContact CG2-CG 4.3Å; Q115-V127 CarbonylContact O-C 3.59Å; Q115-V127 WeakPolarHBondContact O-CA 3.41Å; Q115-T128 PolarHBondContact N-O 3.48Å; Q115-T128 PolarHBondContact O-N 3.27Å
116	E	79.7	Confident	76.1	Confident	38 Å²	38	70.5 Å²	70.5	18%	0.178	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	128.7	165.1	-62.4	-177.3	158.6	0	0	108.3	K95 R96 Y98 R114 Q126 V127	K95-E116 CarbonylContact C-O 3.55Å; K95-E116 WeakPolarHBondContact CA-O 3.29Å; R96-E116 HydrophobicContact CB-CB 4.39Å; R96-E116 IonicContact CZ-OE2 2.89Å; R96-E116 PolarHBondContact N-O 2.88Å; R96-E116 IonicContact NH1-OE2 3.97Å; R96-E116 PolarHBondContact NH1-OE2 3.13Å; R96-E116 PolarHBondContact O-N 2.77Å; Y98-E116 HydrophobicContact CE2-CG 4.05Å; R114-E116 IonicContact CZ-OE1 3.63Å; R114-E116 IonicContact NH1-OE1 2.72Å; R114-E116 PolarHBondContact NH1-OE1 2.87Å; R114-E116 IonicContact NH2-OE1 2.65Å; R114-E116 PolarHBondContact NH2-OE1 2.9Å; E116-Q126 WeakPolarHBondContact CA-O 3.23Å; E116-V127 HydrophobicContact CG-CG2 4.41Å
117	A	77.9	Confident	75.9	Confident	15 Å²	15	69.7 Å²	69.7	12%	0.124	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	126.5	165.6	0	0	0	0	0	109.4	I94 K95 Q126	I94-A117 CarbonylContact O-C 3.52Å; I94-A117 WeakPolarHBondContact O-CA 3.35Å; K95-A117 HydrophobicContact CG-CB 4.28Å; A117-Q126 HydrophobicContact CB-CB 4.34Å; A117-Q126 PolarHBondContact N-O 2.88Å; A117-Q126 PolarHBondContact O-N 2.97Å
118	F	72.5	Confident	75.8	Confident	80 Å²	80	63.9 Å²	63.9	35%	0.351	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	117.5	179.3	-172.5	-118.5	0	0	0	110.8	K93 I94 T120 L124 A125	K93-F118 WeakPolarHBondContact CA-O 3.12Å; I94-F118 HydrophobicContact CB-CB 4.33Å; I94-F118 HydrophobicContact CD1-CD1 4.23Å; I94-F118 PolarHBondContact N-O 2.84Å; I94-F118 PolarHBondContact O-N 3.17Å; F118-T120 HydrophobicContact CD1-CG2 3.77Å; F118-T120 HydrophobicContact CE1-CG2 3.78Å; F118-L124 WeakPolarHBondContact CD2-O 3.39Å; F118-A125 HydrophobicContact CD2-CB 3.95Å; F118-A125 HydrophobicContact CE2-CB 4.42Å
119	M	73.9	Confident	75.7	Confident	49 Å²	49	64.2 Å²	64.2	24%	0.241	35%	0.346	C	S	.	.			trans	-92.8	98.8	177.9	-58.7	-67.6	-73.1	0	0	107.6	K93 E121 E122 G123 L124	K93-M119 HydrophobicContact CB-SD 3.99Å; K93-M119 HydrophobicContact CD-CE 4.35Å; K93-M119 HydrophobicContact CD-SD 3.44Å; K93-M119 WeakPolarHBondContact CD-SD 3.36Å; K93-M119 WeakPolarHBondContact CE-SD 3.17Å; K93-M119 HydrophobicContact CG-SD 3.47Å; K93-M119 WeakPolarHBondContact CG-SD 3.49Å; M119-E121 PolarHBondContact O-N 2.95Å; M119-E122 HydrophobicContact CB-CB 4.03Å; M119-E122 HydrophobicContact CB-CG 4.2Å; M119-E122 WeakPolarHBondContact CB-OE2 3.43Å; M119-E122 HydrophobicContact CE-CG 4.45Å; M119-E122 VanDerWaalsContact CE-OE2 3.23Å; M119-E122 WeakPolarHBondContact CE-OE2 3.2Å; M119-E122 WeakPolarHBondContact CG-OE2 3.49Å; M119-G123 WeakPolarHBondContact O-CA 3.43Å; M119-G123 PolarHBondContact O-N 2.76Å; M119-L124 HydrophobicContact CB-CB 4.26Å; M119-L124 HydrophobicContact CG-CB 4.47Å; M119-L124 PolarHBondContact N-O 2.98Å; M119-L124 PolarHBondContact O-N 2.78Å
120	T	67.7	Low	75.8	Confident	46 Å²	46	64.3 Å²	64.3	28%	0.282	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-26.2	-171.7	49.4	0	0	0	0	114.2	F89 G91 K92 I94 F118	F89-T120 WeakPolarHBondContact O-CG2 3.48Å; F89-T120 PolarHBondContact O-OG1 2.78Å; G91-T120 PolarHBondContact N-OG1 2.86Å; G91-T120 VanDerWaalsContact N-OG1 3.16Å; K92-T120 PolarHBondContact N-OG1 3.25Å; I94-T120 HydrophobicContact CD1-CG2 4.41Å; F118-T120 HydrophobicContact CD1-CG2 3.77Å; F118-T120 HydrophobicContact CE1-CG2 3.78Å
121	E	66.4	Low	75.9	Confident	161 Å²	161	68 Å²	68	75%	0.752	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.5	-43.9	-175.7	-51.1	-157.4	139.3	0	0	112.1	G91 M119 G123	G91-E121 VanDerWaalsContact CA-OE1 3.27Å; G91-E121 WeakPolarHBondContact CA-OE1 3.27Å; M119-E121 PolarHBondContact O-N 2.95Å; E121-G123 PolarHBondContact O-N 2.98Å
122	E	73.2	Confident	75.7	Confident	121 Å²	121	69.4 Å²	69.4	57%	0.565	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.8	-18.5	175.4	-52.6	177.3	141.7	0	0	112.6	M119 L124	M119-E122 HydrophobicContact CB-CB 4.03Å; M119-E122 HydrophobicContact CB-CG 4.2Å; M119-E122 WeakPolarHBondContact CB-OE2 3.43Å; M119-E122 HydrophobicContact CE-CG 4.45Å; M119-E122 VanDerWaalsContact CE-OE2 3.23Å; M119-E122 WeakPolarHBondContact CE-OE2 3.2Å; M119-E122 WeakPolarHBondContact CG-OE2 3.49Å; E122-L124 HydrophobicContact CB-CB 4.28Å; E122-L124 HydrophobicContact CB-CD1 4.11Å; E122-L124 HydrophobicContact CB-CG 3.86Å; E122-L124 PolarHBondContact O-N 3.23Å
123	G	68.7	Low	75.7	Confident	54 Å²	54	71.3 Å²	71.3	56%	0.557	39%	0.389	S	S	*	.			trans	73.3	6.4	-171.7	0	0	0	0	0	114.3	M119 E121	M119-G123 WeakPolarHBondContact O-CA 3.43Å; M119-G123 PolarHBondContact O-N 2.76Å; E121-G123 PolarHBondContact O-N 2.98Å
124	L	67.2	Low	75.4	Confident	105 Å²	105	72.2 Å²	72.2	55%	0.55	40%	0.396	S	S	.	.			trans	-83.4	138.7	-174.5	-62.8	-179.2	0	0	0	112.5	F118 M119 E122	F118-L124 WeakPolarHBondContact CD2-O 3.39Å; M119-L124 HydrophobicContact CB-CB 4.26Å; M119-L124 HydrophobicContact CG-CB 4.47Å; M119-L124 PolarHBondContact N-O 2.98Å; M119-L124 PolarHBondContact O-N 2.78Å; E122-L124 HydrophobicContact CB-CB 4.28Å; E122-L124 HydrophobicContact CB-CD1 4.11Å; E122-L124 HydrophobicContact CB-CG 3.86Å; E122-L124 PolarHBondContact O-N 3.23Å
125	A	74.9	Confident	74.9	Confident	78 Å²	78	73.3 Å²	73.3	65%	0.645	41%	0.412	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.9	111.7	174.7	0	0	0	0	0	109.8	F118	F118-A125 HydrophobicContact CD2-CB 3.95Å; F118-A125 HydrophobicContact CE2-CB 4.42Å
126	Q	77.9	Confident	73.9	Confident	128 Å²	128	74.1 Å²	74.1	60%	0.598	42%	0.419	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.6	135.3	173.6	-173.4	-179.3	25.5	0	0	109.3	E116 A117	E116-Q126 WeakPolarHBondContact CA-O 3.23Å; A117-Q126 HydrophobicContact CB-CB 4.34Å; A117-Q126 PolarHBondContact N-O 2.88Å; A117-Q126 PolarHBondContact O-N 2.97Å
127	V	80	Confident	72.8	Confident	73 Å²	73	76.9 Å²	76.9	44%	0.442	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	108.2	173.8	-175.9	0	0	0	0	109.1	R114 Q115 E116	R114-V127 HydrophobicContact CG-CG1 4.08Å; Q115-V127 CarbonylContact O-C 3.59Å; Q115-V127 WeakPolarHBondContact O-CA 3.41Å; E116-V127 HydrophobicContact CG-CG2 4.41Å
128	T	80.1	Confident	72	Confident	45 Å²	45	83.5 Å²	83.5	28%	0.276	47%	0.468	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	130.2	174.4	-53.8	0	0	0	0	109.1	R114 Q115	R114-T128 WeakPolarHBondContact CA-O 3.25Å; Q115-T128 PolarHBondContact N-O 3.48Å; Q115-T128 PolarHBondContact O-N 3.27Å
129	L	79.2	Confident	71.1	Confident	87 Å²	87	82.7 Å²	82.7	46%	0.455	47%	0.472	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	121.9	171.1	-73	170.4	0	0	0	108.5	R114	R114-L129 HydrophobicContact CB-CD2 3.68Å; R114-L129 HydrophobicContact CG-CD2 3.62Å
130	S	78.1	Confident	70	Confident	12 Å²	12	81.7 Å²	81.7	8%	0.084	47%	0.468	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	120	177.9	-54.3	0	0	0	0	109.5	I112 I113	I112-S130 WeakPolarHBondContact CA-O 3.48Å; I113-S130 PolarHBondContact N-O 3.23Å; I113-S130 PolarHBondContact O-N 3.5Å
131	L	81.5	Confident	69.5	Low	123 Å²	123	87 Å²	87	64%	0.644	49%	0.489	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.6	136.9	174.4	-174.3	67.9	0	0	0	108.6	I110 I112	I110-L131 HydrophobicContact CG2-CD1 3.45Å; I110-L131 VanDerWaalsContact CG2-CD1 3.45Å; I112-L131 HydrophobicContact CD1-CD1 4.38Å; I112-L131 HydrophobicContact CG1-CD1 3.84Å
132	C	76.2	Confident	68.8	Low	29 Å²	29	81.7 Å²	81.7	20%	0.196	47%	0.467	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	152.4	172.6	53.7	0	0	0	0	110	I110 G111 L140	I110-C132 CarbonylContact C-O 3.58Å; I110-C132 WeakPolarHBondContact CA-O 3.43Å; G111-C132 PolarHBondContact N-O 2.79Å; G111-C132 PolarHBondContact O-N 2.83Å; G111-C132 PolarHBondContact O-SG 3.46Å; C132-L140 VanDerWaalsContact SG-CD2 3.55Å
133	V	78.6	Confident	67.9	Low	81 Å²	81	81.4 Å²	81.4	49%	0.491	48%	0.479	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	123.2	176.2	-172.3	0	0	0	0	107.8	Q108 I110	Q108-V133 HydrophobicContact CB-CG1 4.39Å; Q108-V133 VanDerWaalsContact OE1-CG1 3.32Å; I110-V133 HydrophobicContact CG1-CG2 4.31Å
134	S	72.7	Confident	67	Low	29 Å²	29	85.6 Å²	85.6	20%	0.203	48%	0.482	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	154.9	177.9	179.5	0	0	0	0	111.4	T109 N136 S139	T109-S134 WeakPolarHBondContact CA-O 3.29Å; T109-S134 VanDerWaalsContact CB-O 3.29Å; T109-S134 WeakPolarHBondContact CB-O 3.31Å; T109-S134 PolarHBondContact N-O 3.4Å; T109-S134 PolarHBondContact O-N 2.96Å; S134-N136 VanDerWaalsContact C-N 3.29Å; S134-N136 PolarHBondContact OG-N 3.34Å; S134-N136 VanDerWaalsContact OG-N 3.1Å; S134-N136 PolarHBondContact OG-O 3.36Å; S134-S139 PolarHBondContact OG-OG 3.46Å
135	T	67.2	Low	66.1	Low	102 Å²	102	84.8 Å²	84.8	63%	0.626	49%	0.485	S	S	*	.	S	Bend	trans	-75.7	-16.1	169.7	51.7	0	0	0	0	113.1
136	N	58.9	Low	65	Low	100 Å²	100	85.7 Å²	85.7	54%	0.535	48%	0.476	S	S	.	.			trans	-129.6	123.9	-174	-71.3	-75.8	0	0	0	112.7	S134 D138 S139	S134-N136 VanDerWaalsContact C-N 3.29Å; S134-N136 PolarHBondContact OG-N 3.34Å; S134-N136 VanDerWaalsContact OG-N 3.1Å; S134-N136 PolarHBondContact OG-O 3.36Å; N136-D138 VanDerWaalsContact C-N 3.26Å; N136-D138 PolarHBondContact O-N 3.12Å; N136-S139 PolarHBondContact O-N 2.85Å; N136-S139 VanDerWaalsContact O-N 3.14Å; N136-S139 PolarHBondContact O-OG 3.19Å
137	L	56.8	Low	63.6	Low	96 Å²	96	87.4 Å²	87.4	50%	0.503	48%	0.477	S	S	.	.	G	3₁₀ helix	trans	-60.7	-29.4	-175.6	-174	66.6	0	0	0	114	A101 T109 L140	A101-L137 HydrophobicContact CB-CD1 3.61Å; T109-L137 HydrophobicContact CG2-CD1 4.14Å; L137-L140 HydrophobicContact CD1-CD1 3.92Å; L137-L140 VanDerWaalsContact O-CB 3.23Å; L137-L140 WeakPolarHBondContact O-CB 3.43Å
138	D	59.6	Low	62.4	Low	155 Å²	155	87.9 Å²	87.9	83%	0.829	48%	0.476	S	S	*	.	G	3₁₀ helix	trans	-84.2	-13.3	-177.7	-52.9	-53.4	0	0	0	113	N136 L140	N136-D138 VanDerWaalsContact C-N 3.26Å; N136-D138 PolarHBondContact O-N 3.12Å; D138-L140 PolarHBondContact O-N 3.49Å
139	S	54.6	Low	61.1	Low	63 Å²	63	89.8 Å²	89.8	44%	0.441	49%	0.49	S	S	.	.	G	3₁₀ helix	trans	-87.7	12.5	174.9	66.8	0	0	0	0	113.6	S134 N136 Q141	S134-S139 PolarHBondContact OG-OG 3.46Å; N136-S139 PolarHBondContact O-N 2.85Å; N136-S139 VanDerWaalsContact O-N 3.14Å; N136-S139 PolarHBondContact O-OG 3.19Å; S139-Q141 PolarHBondContact O-N 3.37Å
140	L	51.4	Low	60	Low	28 Å²	28	89.6 Å²	89.6	15%	0.147	49%	0.49	C	S	.	.			trans	-80.5	44.6	-173.4	-150.7	154.9	0	0	0	111.3	A101 I113 C132 L137 D138	A101-L140 HydrophobicContact CB-CD1 4.32Å; I113-L140 HydrophobicContact CD1-CD2 4.03Å; I113-L140 HydrophobicContact CG1-CD2 4.07Å; C132-L140 VanDerWaalsContact SG-CD2 3.55Å; L137-L140 HydrophobicContact CD1-CD1 3.92Å; L137-L140 VanDerWaalsContact O-CB 3.23Å; L137-L140 WeakPolarHBondContact O-CB 3.43Å; D138-L140 PolarHBondContact O-N 3.49Å
141	Q	55.3	Low	58.9	Low	158 Å²	158	96.7 Å²	96.7	74%	0.738	52%	0.516	S	S	*	.			trans	-90.6	124.6	173.1	-70.2	-71	1.7	0	0	108.9	S139 S143	S139-Q141 PolarHBondContact O-N 3.37Å; Q141-S143 VanDerWaalsContact C-N 3.28Å; Q141-S143 PolarHBondContact O-N 2.95Å
142	V	53.4	Low	57.7	Low	48 Å²	48	94.1 Å²	94.1	29%	0.291	50%	0.502	S	S	.	.			trans	-80.4	80.6	176.8	-179.7	0	0	0	0	108.5	I113 K144	I113-V142 HydrophobicContact CD1-CG2 3.81Å; I113-V142 HydrophobicContact CG1-CG2 4.39Å; V142-K144 VanDerWaalsContact CG1-O 3.29Å; V142-K144 WeakPolarHBondContact CG1-O 3.18Å; V142-K144 PolarHBondContact O-N 3.18Å
143	S	52.9	Low	56.9	Low	115 Å²	115	98.9 Å²	98.9	80%	0.804	53%	0.525	S	S	*	.	S	Bend	trans	-69.8	-17.9	176.6	57	0	0	0	0	113.3	Q141	Q141-S143 VanDerWaalsContact C-N 3.28Å; Q141-S143 PolarHBondContact O-N 2.95Å
144	K	49.9	Very low	56.1	Low	143 Å²	143	102.2 Å²	102.2	62%	0.622	55%	0.546	S	S	*	.			trans	-135.8	118.4	171.6	-63.3	-170.9	-179.9	-176.4	0	110.1	V142 E146	V142-K144 VanDerWaalsContact CG1-O 3.29Å; V142-K144 WeakPolarHBondContact CG1-O 3.18Å; V142-K144 PolarHBondContact O-N 3.18Å; K144-E146 VanDerWaalsContact C-N 3.33Å; K144-E146 HydrophobicContact CB-CG 4.17Å; K144-E146 WeakPolarHBondContact CD-OE1 3.35Å; K144-E146 IonicContact NZ-OE1 3.7Å; K144-E146 PolarHBondContact O-N 2.87Å
145	S	49.8	Very low	55.5	Low	87 Å²	87	103.8 Å²	103.8	61%	0.608	55%	0.553	S	S	*	*			trans	-92.7	66.1	170.1	60.7	0	0	0	0	110.2	R147	S145-R147 PolarHBondContact O-N 3.48Å
146	E	50.1	Low	55.2	Low	97 Å²	97	107.6 Å²	107.6	45%	0.453	56%	0.557	S	S	.	*			trans	-66	127.9	171.9	-65.6	155.6	171.5	0	0	108.2	K144 Y151	K144-E146 VanDerWaalsContact C-N 3.33Å; K144-E146 HydrophobicContact CB-CG 4.17Å; K144-E146 WeakPolarHBondContact CD-OE1 3.35Å; K144-E146 IonicContact NZ-OE1 3.7Å; K144-E146 PolarHBondContact O-N 2.87Å; E146-Y151 HydrophobicContact CB-CE2 3.71Å; E146-Y151 VanDerWaalsContact CD-OH 3.29Å; E146-Y151 HydrophobicContact CG-CE2 4.41Å; E146-Y151 PolarHBondContact OE2-OH 2.63Å
147	R	50.1	Low	55.5	Low	165 Å²	165	110.6 Å²	110.6	62%	0.623	56%	0.561	S	S	*	*			trans	-84.5	144.6	-173.9	-48.7	171.5	-67.6	-168.3	3.2	108.7	S145 C149 D150	S145-R147 PolarHBondContact O-N 3.48Å; R147-C149 PolarHBondContact O-N 3.01Å; R147-D150 WeakPolarHBondContact CB-OD2 3.33Å; R147-D150 WeakPolarHBondContact CG-OD2 3.47Å; R147-D150 IonicContact CZ-OD1 3.77Å; R147-D150 VanDerWaalsContact CZ-OD1 3.25Å; R147-D150 IonicContact CZ-OD2 2.82Å; R147-D150 PolarHBondContact N-OD2 3.41Å; R147-D150 IonicContact NE-OD1 2.95Å; R147-D150 PolarHBondContact NE-OD1 2.79Å; R147-D150 IonicContact NE-OD2 3.43Å; R147-D150 PolarHBondContact NE-OD2 2.87Å; R147-D150 IonicContact NH2-OD1 3.86Å; R147-D150 PolarHBondContact NH2-OD1 2.91Å; R147-D150 IonicContact NH2-OD2 3.69Å; R147-D150 WeakPolarHBondContact O-CB 3.44Å; R147-D150 PolarHBondContact O-N 3.39Å
148	I	53.2	Low	55.5	Low	82 Å²	82	106.4 Å²	106.4	42%	0.421	54%	0.54	S	S	.	.	G	3₁₀ helix	trans	-57.3	-34.9	174.7	-62.2	175.6	0	0	0	110.5	D150 Y151 L152 L162	I148-D150 PolarHBondContact O-N 3.2Å; I148-D150 VanDerWaalsContact O-N 3.17Å; I148-Y151 PolarHBondContact O-N 2.79Å; I148-Y151 VanDerWaalsContact O-N 3.1Å; I148-L152 HydrophobicContact CG2-CD1 3.76Å; I148-L152 HydrophobicContact CG2-CG 3.92Å; I148-L152 WeakPolarHBondContact O-CG 3Å; I148-L152 PolarHBondContact O-N 3.34Å; I148-L162 HydrophobicContact CB-CD1 4.42Å; I148-L162 HydrophobicContact CG2-CD1 4.1Å
149	C	53.6	Low	55.2	Low	85 Å²	85	102 Å²	102	57%	0.574	52%	0.522	S	S	*	.	G	3₁₀ helix	trans	-63	-15.1	174.1	-48.3	0	0	0	0	115.1	R147	R147-C149 PolarHBondContact O-N 3.01Å
150	D	56.2	Low	55	Low	84 Å²	84	101.8 Å²	101.8	45%	0.449	51%	0.514	S	S	.	.	G	3₁₀ helix	trans	-89.2	-10.8	177.2	-52.3	-37.8	0	0	0	111.9	R147 I148	R147-D150 WeakPolarHBondContact CB-OD2 3.33Å; R147-D150 WeakPolarHBondContact CG-OD2 3.47Å; R147-D150 IonicContact CZ-OD1 3.77Å; R147-D150 VanDerWaalsContact CZ-OD1 3.25Å; R147-D150 IonicContact CZ-OD2 2.82Å; R147-D150 PolarHBondContact N-OD2 3.41Å; R147-D150 IonicContact NE-OD1 2.95Å; R147-D150 PolarHBondContact NE-OD1 2.79Å; R147-D150 IonicContact NE-OD2 3.43Å; R147-D150 PolarHBondContact NE-OD2 2.87Å; R147-D150 IonicContact NH2-OD1 3.86Å; R147-D150 PolarHBondContact NH2-OD1 2.91Å; R147-D150 IonicContact NH2-OD2 3.69Å; R147-D150 WeakPolarHBondContact O-CB 3.44Å; R147-D150 PolarHBondContact O-N 3.39Å; I148-D150 PolarHBondContact O-N 3.2Å; I148-D150 VanDerWaalsContact O-N 3.17Å
151	Y	54.3	Low	55.2	Low	161 Å²	161	105 Å²	105	63%	0.631	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.6	-12.5	178.8	-68.3	-57.4	0	0	0	114.7	E146 I148	E146-Y151 HydrophobicContact CB-CE2 3.71Å; E146-Y151 VanDerWaalsContact CD-OH 3.29Å; E146-Y151 HydrophobicContact CG-CE2 4.41Å; E146-Y151 PolarHBondContact OE2-OH 2.63Å; I148-Y151 PolarHBondContact O-N 2.79Å; I148-Y151 VanDerWaalsContact O-N 3.1Å
152	L	57	Low	55	Low	69 Å²	69	101.5 Å²	101.5	36%	0.361	52%	0.517	S	S	.	.	S	Bend	trans	-76.7	122.9	165.3	-67.2	172.6	0	0	0	107.7	I148 A158 L162	I148-L152 HydrophobicContact CG2-CD1 3.76Å; I148-L152 HydrophobicContact CG2-CG 3.92Å; I148-L152 WeakPolarHBondContact O-CG 3Å; I148-L152 PolarHBondContact O-N 3.34Å; L152-A158 HydrophobicContact CB-CB 4.22Å; L152-A158 HydrophobicContact CD1-CB 3.83Å; L152-A158 HydrophobicContact CD2-CB 3.89Å; L152-A158 HydrophobicContact CG-CB 4.18Å; L152-L162 HydrophobicContact CD1-CD1 3.51Å; L152-L162 HydrophobicContact CD1-CG 4.23Å
153	D	59.3	Low	54.5	Low	128 Å²	128	103 Å²	103	68%	0.684	53%	0.534	S	S	*	.			trans	-50.9	160	160.9	-69.5	-58.9	0	0	0	109.9	D155	D153-D155 PolarHBondContact O-N 3.26Å
154	T	61	Low	53.9	Low	152 Å²	152	99.4 Å²	99.4	93%	0.933	51%	0.51	S	S	*	.	S	Bend	trans	-67.7	20.7	-177.1	50.9	0	0	0	0	114.5	Y156	T154-Y156 PolarHBondContact O-N 2.83Å
155	D	60.1	Low	53.4	Low	62 Å²	62	99.9 Å²	99.9	33%	0.332	53%	0.525	S	S	.	.			trans	-61	122.8	176.4	-75	-36.2	0	0	0	111.7	D153 W157 A158 S159	D153-D155 PolarHBondContact O-N 3.26Å; D155-W157 HydrophobicContact CB-CD2 3.9Å; D155-W157 HydrophobicContact CB-CE3 4.22Å; D155-W157 HydrophobicContact CB-CG 4.49Å; D155-W157 HydrophobicContact CB-CH2 3.97Å; D155-W157 HydrophobicContact CB-CZ2 3.64Å; D155-W157 HydrophobicContact CB-CZ3 4.26Å; D155-W157 VanDerWaalsContact CG-CH2 3.41Å; D155-W157 PolarHBondContact O-N 3.32Å; D155-W157 VanDerWaalsContact O-N 3.15Å; D155-W157 WeakPolarHBondContact OD2-CH2 3.27Å; D155-W157 WeakPolarHBondContact OD2-CZ2 3.36Å; D155-A158 PolarHBondContact O-N 2.96Å; D155-S159 PolarHBondContact O-N 2.9Å; D155-S159 PolarHBondContact O-OG 2.74Å
156	Y	61.8	Low	52.7	Low	181 Å²	181	101.6 Å²	101.6	71%	0.71	52%	0.523	S	S	*	.	H	α-helix	trans	-56.2	-31.8	-176.4	-178.1	-115.3	0	0	0	113.5	T154 A158 S159 I160	T154-Y156 PolarHBondContact O-N 2.83Å; Y156-A158 VanDerWaalsContact C-N 3.35Å; Y156-A158 PolarHBondContact O-N 3.04Å; Y156-S159 PolarHBondContact O-OG 2.87Å; Y156-I160 HydrophobicContact CD1-CD1 3.77Å; Y156-I160 HydrophobicContact CD2-CD1 4.39Å; Y156-I160 HydrophobicContact CE1-CD1 3.48Å; Y156-I160 VanDerWaalsContact CE1-CD1 3.48Å; Y156-I160 HydrophobicContact CE2-CD1 4.14Å; Y156-I160 HydrophobicContact CG-CD1 4.22Å; Y156-I160 WeakPolarHBondContact O-CD1 3.36Å; Y156-I160 VanDerWaalsContact O-CG1 3.26Å; Y156-I160 WeakPolarHBondContact O-CG1 3.22Å; Y156-I160 PolarHBondContact O-N 3.3Å
157	W	64.4	Low	52.2	Low	163 Å²	163	101.5 Å²	101.5	62%	0.617	53%	0.533	S	S	*	.	H	α-helix	trans	-68.4	-33.3	176.8	64.1	72.1	0	0	0	113	D155 L161	D155-W157 HydrophobicContact CB-CD2 3.9Å; D155-W157 HydrophobicContact CB-CE3 4.22Å; D155-W157 HydrophobicContact CB-CG 4.49Å; D155-W157 HydrophobicContact CB-CH2 3.97Å; D155-W157 HydrophobicContact CB-CZ2 3.64Å; D155-W157 HydrophobicContact CB-CZ3 4.26Å; D155-W157 VanDerWaalsContact CG-CH2 3.41Å; D155-W157 PolarHBondContact O-N 3.32Å; D155-W157 VanDerWaalsContact O-N 3.15Å; D155-W157 WeakPolarHBondContact OD2-CH2 3.27Å; D155-W157 WeakPolarHBondContact OD2-CZ2 3.36Å; W157-L161 WeakPolarHBondContact O-CB 3.49Å; W157-L161 WeakPolarHBondContact O-CG 3.47Å; W157-L161 PolarHBondContact O-N 2.82Å
158	A	56.5	Low	51.8	Low	8 Å²	8	95.8 Å²	95.8	7%	0.066	51%	0.513	C	S	.	.	H	α-helix	trans	-79.6	-36.8	-172.6	0	0	0	0	0	111	L152 D155 Y156 L161 L162	L152-A158 HydrophobicContact CB-CB 4.22Å; L152-A158 HydrophobicContact CD1-CB 3.83Å; L152-A158 HydrophobicContact CD2-CB 3.89Å; L152-A158 HydrophobicContact CG-CB 4.18Å; D155-A158 PolarHBondContact O-N 2.96Å; Y156-A158 VanDerWaalsContact C-N 3.35Å; Y156-A158 PolarHBondContact O-N 3.04Å; A158-L161 PolarHBondContact O-N 3.33Å; A158-L162 PolarHBondContact O-N 2.91Å
159	S	53.3	Low	51.6	Low	64 Å²	64	94.8 Å²	94.8	45%	0.448	51%	0.509	S	S	.	.	H	α-helix	trans	-67	-39.2	169.7	41.7	0	0	0	0	112.3	D155 Y156 L161 L162 A163	D155-S159 PolarHBondContact O-N 2.9Å; D155-S159 PolarHBondContact O-OG 2.74Å; Y156-S159 PolarHBondContact O-OG 2.87Å; S159-L161 PolarHBondContact O-N 2.77Å; S159-L162 PolarHBondContact O-N 2.82Å; S159-A163 VanDerWaalsContact O-CB 3.25Å; S159-A163 WeakPolarHBondContact O-CB 3.34Å; S159-A163 PolarHBondContact O-N 2.76Å
160	I	52.2	Low	51.3	Low	57 Å²	57	94.2 Å²	94.2	29%	0.292	51%	0.511	S	S	.	.	H	α-helix	trans	-59.7	-44.6	171.1	-73.7	167.8	0	0	0	111.9	Y156 L162 A163 S164	Y156-I160 HydrophobicContact CD1-CD1 3.77Å; Y156-I160 HydrophobicContact CD2-CD1 4.39Å; Y156-I160 HydrophobicContact CE1-CD1 3.48Å; Y156-I160 VanDerWaalsContact CE1-CD1 3.48Å; Y156-I160 HydrophobicContact CE2-CD1 4.14Å; Y156-I160 HydrophobicContact CG-CD1 4.22Å; Y156-I160 WeakPolarHBondContact O-CD1 3.36Å; Y156-I160 VanDerWaalsContact O-CG1 3.26Å; Y156-I160 WeakPolarHBondContact O-CG1 3.22Å; Y156-I160 PolarHBondContact O-N 3.3Å; I160-L162 PolarHBondContact O-N 2.9Å; I160-A163 PolarHBondContact O-N 2.87Å; I160-S164 WeakPolarHBondContact O-CB 3.33Å; I160-S164 PolarHBondContact O-N 3.31Å; I160-S164 VanDerWaalsContact O-N 3.08Å; I160-S164 PolarHBondContact O-OG 3.24Å
161	L	54.4	Low	50.7	Low	95 Å²	95	95.3 Å²	95.3	50%	0.497	51%	0.513	S	S	.	.	H	α-helix	trans	-62.3	-23.8	179.6	-88.5	166.2	0	0	0	114.1	W157 A158 S159 L172	W157-L161 WeakPolarHBondContact O-CB 3.49Å; W157-L161 WeakPolarHBondContact O-CG 3.47Å; W157-L161 PolarHBondContact O-N 2.82Å; A158-L161 PolarHBondContact O-N 3.33Å; S159-L161 PolarHBondContact O-N 2.77Å; L161-L172 HydrophobicContact CD2-CD1 3.58Å; L161-L172 HydrophobicContact CG-CD1 4.11Å
162	L	50.6	Low	50.5	Low	85 Å²	85	90.3 Å²	90.3	45%	0.445	50%	0.497	S	S	.	.	H	α-helix	trans	-97.4	-31.5	175.8	-66.2	-176.5	0	0	0	113.5	I148 L152 A158 S159 I160	I148-L162 HydrophobicContact CB-CD1 4.42Å; I148-L162 HydrophobicContact CG2-CD1 4.1Å; L152-L162 HydrophobicContact CD1-CD1 3.51Å; L152-L162 HydrophobicContact CD1-CG 4.23Å; A158-L162 PolarHBondContact O-N 2.91Å; S159-L162 PolarHBondContact O-N 2.82Å; I160-L162 PolarHBondContact O-N 2.9Å
163	A	44.6	Very low	50.2	Low	79 Å²	79	90.1 Å²	90.1	65%	0.653	50%	0.496	S	S	*	.	H	α-helix	trans	-82.5	-17.6	-178.1	0	0	0	0	0	114	S159 I160 T165	S159-A163 VanDerWaalsContact O-CB 3.25Å; S159-A163 WeakPolarHBondContact O-CB 3.34Å; S159-A163 PolarHBondContact O-N 2.76Å; I160-A163 PolarHBondContact O-N 2.87Å; A163-T165 PolarHBondContact O-N 3.45Å; A163-T165 VanDerWaalsContact O-N 3.17Å
164	S	38.6	Very low	49.4	Very low	40 Å²	40	86.8 Å²	86.8	28%	0.28	49%	0.492	S	S	.	.			trans	-74.3	103.8	-179.8	40.5	0	0	0	0	112.1	I160 E166	I160-S164 WeakPolarHBondContact O-CB 3.33Å; I160-S164 PolarHBondContact O-N 3.31Å; I160-S164 VanDerWaalsContact O-N 3.08Å; I160-S164 PolarHBondContact O-OG 3.24Å; S164-E166 VanDerWaalsContact C-N 3.26Å
165	T	39.9	Very low	48.7	Very low	154 Å²	154	88.3 Å²	88.3	95%	0.945	48%	0.482	S	S	*	.			trans	-75.9	-15.3	171.4	53.8	0	0	0	0	113	A163	A163-T165 PolarHBondContact O-N 3.45Å; A163-T165 VanDerWaalsContact O-N 3.17Å
166	E	34.9	Very low	48	Very low	122 Å²	122	89.9 Å²	89.9	57%	0.57	49%	0.488	S	S	*	.	S	Bend	trans	-94.5	156.7	170.9	54.3	166.5	-130.2	0	0	111.9	S164 H168	S164-E166 VanDerWaalsContact C-N 3.26Å; E166-H168 PolarHBondContact O-N 2.82Å; E166-H168 IonicContact OE1-CE1 2.62Å; E166-H168 IonicContact OE1-CG 3.46Å; E166-H168 IonicContact OE1-ND1 3.51Å; E166-H168 PolarHBondContact OE1-ND1 3.13Å
167	S	41	Very low	47	Very low	96 Å²	96	82.8 Å²	82.8	67%	0.671	47%	0.47	S	S	*	.			trans	-77.2	67.2	-178.2	66.4	0	0	0	0	112.4	D169 A170	S167-D169 PolarHBondContact O-N 3.03Å; S167-D169 VanDerWaalsContact O-N 3.1Å; S167-A170 PolarHBondContact O-N 3.48Å
168	H	40.8	Very low	46.2	Very low	44 Å²	44	79.1 Å²	79.1	20%	0.204	47%	0.467	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-2.5	-177	-146.4	82	0	0	0	113.2	E166 A170 E171 L172	E166-H168 PolarHBondContact O-N 2.82Å; E166-H168 IonicContact OE1-CE1 2.62Å; E166-H168 IonicContact OE1-CG 3.46Å; E166-H168 IonicContact OE1-ND1 3.51Å; E166-H168 PolarHBondContact OE1-ND1 3.13Å; H168-A170 PolarHBondContact O-N 3.1Å; H168-E171 VanDerWaalsContact CE1-CD 3.49Å; H168-E171 IonicContact CE1-OE1 2.83Å; H168-E171 IonicContact CE1-OE2 2.74Å; H168-E171 PolarHBondContact CE1-OE2 2.95Å; H168-E171 IonicContact NE2-OE2 3.9Å; H168-E171 PolarHBondContact O-N 3.21Å; H168-L172 PolarHBondContact O-N 2.95Å; H168-L172 VanDerWaalsContact O-N 3.09Å
169	D	49.9	Very low	45.8	Very low	61 Å²	61	87.4 Å²	87.4	33%	0.326	51%	0.505	S	S	.	.	H	α-helix	trans	-37	-39.5	161.3	-63.8	-21.7	0	0	0	113	S167 L173 R1038	S167-D169 PolarHBondContact O-N 3.03Å; S167-D169 VanDerWaalsContact O-N 3.1Å; D169-L173 WeakPolarHBondContact O-CB 3.34Å; D169-L173 WeakPolarHBondContact O-CD1 3.29Å; D169-L173 VanDerWaalsContact O-CG 3.26Å; D169-L173 WeakPolarHBondContact O-CG 3.45Å; D169-L173 PolarHBondContact O-N 3.01Å; D169-R1038 WeakPolarHBondContact OD2-CB 3.2Å
170	A	47.3	Very low	45.3	Very low	74 Å²	74	91.2 Å²	91.2	61%	0.612	51%	0.51	S	S	*	.	H	α-helix	trans	-71.8	-30.6	-175.2	0	0	0	0	0	113.4	S167 H168 G174	S167-A170 PolarHBondContact O-N 3.48Å; H168-A170 PolarHBondContact O-N 3.1Å; A170-G174 PolarHBondContact O-N 3.17Å
171	E	43.3	Very low	44.8	Very low	106 Å²	106	91.1 Å²	91.1	50%	0.495	51%	0.512	S	S	.	.	H	α-helix	trans	-87.5	-37.5	177.4	-60.8	-162.8	-162.4	0	0	110.6	H168 L173 G174 Y175	H168-E171 VanDerWaalsContact CE1-CD 3.49Å; H168-E171 IonicContact CE1-OE1 2.83Å; H168-E171 IonicContact CE1-OE2 2.74Å; H168-E171 PolarHBondContact CE1-OE2 2.95Å; H168-E171 IonicContact NE2-OE2 3.9Å; H168-E171 PolarHBondContact O-N 3.21Å; E171-L173 VanDerWaalsContact C-N 3.3Å; E171-L173 PolarHBondContact O-N 2.87Å; E171-G174 CarbonylContact O-C 3.57Å; E171-G174 VanDerWaalsContact O-CA 3.29Å; E171-G174 WeakPolarHBondContact O-CA 3.13Å; E171-G174 PolarHBondContact O-N 2.99Å; E171-Y175 WeakPolarHBondContact O-CD2 3.39Å; E171-Y175 PolarHBondContact O-N 3.17Å
172	L	49.2	Very low	44.1	Very low	57 Å²	57	90.9 Å²	90.9	30%	0.298	52%	0.519	S	S	.	.	H	α-helix	trans	-60	-37.3	168.9	-75.3	167	0	0	0	112.5	L161 H168 G174 Y175 M176	L161-L172 HydrophobicContact CD2-CD1 3.58Å; L161-L172 HydrophobicContact CG-CD1 4.11Å; H168-L172 PolarHBondContact O-N 2.95Å; H168-L172 VanDerWaalsContact O-N 3.09Å; L172-G174 PolarHBondContact O-N 2.87Å; L172-Y175 PolarHBondContact O-N 2.68Å; L172-M176 WeakPolarHBondContact O-CB 3.09Å; L172-M176 WeakPolarHBondContact O-CG 3.4Å; L172-M176 PolarHBondContact O-N 3.43Å
173	L	51	Low	43.6	Very low	64 Å²	64	97.4 Å²	97.4	34%	0.335	54%	0.537	S	S	.	.	H	α-helix	trans	-71.6	-8.6	169.5	-79.2	166.6	0	0	0	114.3	D169 E171 T181	D169-L173 WeakPolarHBondContact O-CB 3.34Å; D169-L173 WeakPolarHBondContact O-CD1 3.29Å; D169-L173 VanDerWaalsContact O-CG 3.26Å; D169-L173 WeakPolarHBondContact O-CG 3.45Å; D169-L173 PolarHBondContact O-N 3.01Å; E171-L173 VanDerWaalsContact C-N 3.3Å; E171-L173 PolarHBondContact O-N 2.87Å; L173-T181 WeakPolarHBondContact O-CG2 3.49Å
174	G	43.4	Very low	43.3	Very low	58 Å²	58	102.2 Å²	102.2	60%	0.598	54%	0.543	S	S	*	.	H	α-helix	trans	-89.3	-39.7	167.8	0	0	0	0	0	112.4	A170 E171 L172	A170-G174 PolarHBondContact O-N 3.17Å; E171-G174 CarbonylContact O-C 3.57Å; E171-G174 VanDerWaalsContact O-CA 3.29Å; E171-G174 WeakPolarHBondContact O-CA 3.13Å; E171-G174 PolarHBondContact O-N 2.99Å; L172-G174 PolarHBondContact O-N 2.87Å
175	Y	44.5	Very low	43.3	Very low	185 Å²	185	105.4 Å²	105.4	73%	0.725	56%	0.563	S	S	*	*	H	α-helix	trans	-69.1	-38.8	174.1	-73.1	-68.8	0	0	0	112.7	E171 L172 G177	E171-Y175 WeakPolarHBondContact O-CD2 3.39Å; E171-Y175 PolarHBondContact O-N 3.17Å; L172-Y175 PolarHBondContact O-N 2.68Å; Y175-G177 PolarHBondContact O-N 2.72Å
176	M	46.5	Very low	43.2	Very low	95 Å²	95	102.7 Å²	102.7	47%	0.468	54%	0.543	S	S	.	.	S	Bend	trans	-71.9	99.2	167.7	-63.7	-138	78.7	0	0	109	L172 Y180	L172-M176 WeakPolarHBondContact O-CB 3.09Å; L172-M176 WeakPolarHBondContact O-CG 3.4Å; L172-M176 PolarHBondContact O-N 3.43Å; M176-Y180 HydrophobicContact CB-CD2 4.23Å; M176-Y180 HydrophobicContact CB-CG 4.33Å; M176-Y180 HydrophobicContact CE-CD1 4.29Å; M176-Y180 HydrophobicContact CE-CD2 4.06Å; M176-Y180 HydrophobicContact CE-CE1 4.24Å; M176-Y180 HydrophobicContact CE-CE2 4.03Å; M176-Y180 HydrophobicContact CE-CG 4.21Å
177	G	39.8	Very low	43.5	Very low	31 Å²	31	105.7 Å²	105.7	32%	0.32	55%	0.549	S	S	.	.			trans	-52.1	165.2	-169.9	0	0	0	0	0	115.7	Y175 E179 Y180	Y175-G177 PolarHBondContact O-N 2.72Å; G177-E179 PolarHBondContact O-N 3.05Å; G177-Y180 PolarHBondContact O-N 2.9Å
178	P	48.2	Very low	43.2	Very low	86 Å²	86	110 Å²	110	56%	0.558	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.1	-10.3	-159.4	21.3	-34.1	0	0	0	116.7	T181	P178-T181 VanDerWaalsContact CA-OG1 3.3Å; P178-T181 WeakPolarHBondContact CA-OG1 3.5Å; P178-T181 PolarHBondContact O-N 2.66Å; P178-T181 PolarHBondContact O-OG1 3.03Å
179	E	49.4	Very low	42.9	Very low	183 Å²	183	114.4 Å²	114.4	86%	0.855	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.1	-36.5	169.6	-61.4	-179.3	-147	0	0	112.5	G177	G177-E179 PolarHBondContact O-N 3.05Å
180	Y	42.1	Very low	42.4	Very low	144 Å²	144	118.9 Å²	118.9	57%	0.565	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.9	-23.3	175.2	-62.8	-80.5	0	0	0	112.2	M176 G177 S182	M176-Y180 HydrophobicContact CB-CD2 4.23Å; M176-Y180 HydrophobicContact CB-CG 4.33Å; M176-Y180 HydrophobicContact CE-CD1 4.29Å; M176-Y180 HydrophobicContact CE-CD2 4.06Å; M176-Y180 HydrophobicContact CE-CE1 4.24Å; M176-Y180 HydrophobicContact CE-CE2 4.03Å; M176-Y180 HydrophobicContact CE-CG 4.21Å; G177-Y180 PolarHBondContact O-N 2.9Å; Y180-S182 PolarHBondContact O-N 3.43Å; Y180-S182 VanDerWaalsContact O-N 3.15Å
181	T	42	Very low	41.9	Very low	55 Å²	55	124.4 Å²	124.4	34%	0.337	61%	0.611	S	S	.	*	S	Bend	trans	-79.8	93.6	173.5	69.6	0	0	0	0	110.7	L173 P178 R183	L173-T181 WeakPolarHBondContact O-CG2 3.49Å; P178-T181 VanDerWaalsContact CA-OG1 3.3Å; P178-T181 WeakPolarHBondContact CA-OG1 3.5Å; P178-T181 PolarHBondContact O-N 2.66Å; P178-T181 PolarHBondContact O-OG1 3.03Å; T181-R183 PolarHBondContact O-N 2.89Å
182	S	39.4	Very low	41.5	Very low	90 Å²	90	130.8 Å²	130.8	63%	0.629	63%	0.631	S	S	*	*			trans	-58.8	103.8	178	65.7	0	0	0	0	111	Y180 K184	Y180-S182 PolarHBondContact O-N 3.43Å; Y180-S182 VanDerWaalsContact O-N 3.15Å; S182-K184 PolarHBondContact O-N 3.17Å
183	R	40.5	Very low	40.8	Very low	222 Å²	222	132 Å²	132	84%	0.838	64%	0.644	S	S	*	*	S	Bend	trans	-58.6	-4.2	-167.5	-74.7	-169.4	175.3	-160.9	-0.1	116.7	T181	T181-R183 PolarHBondContact O-N 2.89Å
184	K	38.3	Very low	40.1	Very low	180 Å²	180	135.5 Å²	135.5	78%	0.783	66%	0.658	S	S	*	*	S	Bend	trans	-137.8	124.9	169.1	-64.5	-178.2	-177.7	174.4	0	109.2	S182 N186	S182-K184 PolarHBondContact O-N 3.17Å; K184-N186 PolarHBondContact O-N 3.07Å; K184-N186 VanDerWaalsContact O-N 3.14Å
185	P	38.8	Very low	39.7	Very low	107 Å²	107	138.6 Å²	138.6	70%	0.695	67%	0.671	S	S	*	*			trans	-71	110	-178	27.6	-33.8	0	0	0	110.9	R187	P185-R187 PolarHBondContact O-N 3.47Å; P185-R187 VanDerWaalsContact O-N 3.08Å
186	N	36.7	Very low	39.1	Very low	97 Å²	97	141.2 Å²	141.2	52%	0.519	68%	0.68	S	S	.	*			trans	-66	106.5	178.2	-176.3	0.9	0	0	0	110.8	K184 F188	K184-N186 PolarHBondContact O-N 3.07Å; K184-N186 VanDerWaalsContact O-N 3.14Å; N186-F188 PolarHBondContact OD1-N 3.45Å
187	R	41.6	Very low	38.9	Very low	185 Å²	185	145 Å²	145	70%	0.698	69%	0.689	S	S	*	*			trans	-88.2	-13.4	-177.8	-70.1	-170.6	-178.1	-178.4	3	114.8	P185 N189	P185-R187 PolarHBondContact O-N 3.47Å; P185-R187 VanDerWaalsContact O-N 3.08Å; R187-N189 VanDerWaalsContact C-N 3.33Å; R187-N189 PolarHBondContact O-N 3.16Å
188	F	35.5	Very low	38.6	Very low	187 Å²	187	155.3 Å²	155.3	82%	0.82	72%	0.718	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.1	-16.4	-159	-154.6	-101.8	0	0	0	115.3	N186	N186-F188 PolarHBondContact OD1-N 3.45Å
189	N	33.5	Very low	38.3	Very low	136 Å²	136	159.3 Å²	159.3	73%	0.727	73%	0.727	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.2	9	-174	-69.8	-6.5	0	0	0	114.9	R187	R187-N189 VanDerWaalsContact C-N 3.33Å; R187-N189 PolarHBondContact O-N 3.16Å
190	F	40.4	Very low	37.5	Very low	154 Å²	154	159.3 Å²	159.3	68%	0.675	72%	0.719	S	S	*	*	S	Bend	trans	-90.3	-11.8	-169.7	-131.7	-87.5	0	0	0	115.9
191	E	35.7	Very low	36.9	Very low	191 Å²	191	154.9 Å²	154.9	89%	0.893	70%	0.703	S	S	*	*	S	Bend	trans	-94.8	-6	-163.8	-160.5	164.9	-159.2	0	0	115.4
192	R	35.5	Very low	36.6	Very low	240 Å²	240	154.2 Å²	154.2	91%	0.906	70%	0.697	S	S	*	*	S	Bend	trans	-108.6	15.5	-164.2	-133.4	175.7	-165	-106.1	2.1	117.8
193	S	33.4	Very low	36.3	Very low	82 Å²	82	151.2 Å²	151.2	57%	0.573	68%	0.675	S	S	*	*	S	Bend	trans	-134.8	11.7	-169.6	-62.9	0	0	0	0	117.5
194	E	37.9	Very low	35.8	Very low	137 Å²	137	143.7 Å²	143.7	64%	0.64	65%	0.651	S	S	*	*	S	Bend	trans	-80.2	-41.7	175.5	-68	-122.2	114.2	0	0	112.9	R196 R197	E194-R196 PolarHBondContact O-N 3.47Å; E194-R197 PolarHBondContact O-N 2.83Å
195	S	33.8	Very low	35.4	Very low	124 Å²	124	138.8 Å²	138.8	87%	0.867	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.9	2.9	-160.8	-35.2	0	0	0	0	117.6
196	R	32.2	Very low	34.9	Very low	240 Å²	240	138 Å²	138	91%	0.906	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-136.2	5.4	-175.7	-105.1	178.8	66.9	178.2	-0.8	115.6	E194 R198	E194-R196 PolarHBondContact O-N 3.47Å; R196-R198 PolarHBondContact O-N 2.88Å; R196-R198 VanDerWaalsContact O-N 3.1Å
197	R	41.7	Very low	34.5	Very low	175 Å²	175	139.5 Å²	139.5	66%	0.66	63%	0.627	S	S	*	*			trans	-83.3	83.2	-178.3	-76.5	176.7	162.3	165.9	-5.1	112.5	E194 K199	E194-R197 PolarHBondContact O-N 2.83Å; R197-K199 VanDerWaalsContact C-N 3.26Å; R197-K199 PolarHBondContact O-N 3.39Å
198	R	33.8	Very low	34	Very low	246 Å²	246	136.2 Å²	136.2	93%	0.928	62%	0.619	S	S	*	*			trans	-68.2	82.9	161.5	-76	-176.5	173.2	175.3	-3.1	109.7	R196	R196-R198 PolarHBondContact O-N 2.88Å; R196-R198 VanDerWaalsContact O-N 3.1Å
199	K	41.9	Very low	33.9	Very low	171 Å²	171	133 Å²	133	74%	0.743	61%	0.61	S	S	*	*			trans	-64.5	139.3	164.1	-69.1	-173.2	177	-175.1	0	108.8	R197	R197-K199 VanDerWaalsContact C-N 3.26Å; R197-K199 PolarHBondContact O-N 3.39Å
200	R	33.6	Very low	33.9	Very low	183 Å²	183	134.6 Å²	134.6	69%	0.691	61%	0.613	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-111.9	133.1	164.5	-71.2	175.5	171.3	162.5	-6.4	106.9
201	E	30	Very low	33.7	Very low	50 Å²	50	134.3 Å²	134.3	23%	0.234	62%	0.618	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-115.1	132.9	171.2	-179.1	167.7	-161.4	0	0	106.4	S83 Y98 V203	S83-E201 VanDerWaalsContact CB-OE2 3.29Å; S83-E201 WeakPolarHBondContact CB-OE2 3.3Å; S83-E201 PolarHBondContact OG-OE2 3.21Å; Y98-E201 HydrophobicContact CD1-CG 4.28Å; Y98-E201 HydrophobicContact CE1-CG 3.96Å; Y98-E201 WeakPolarHBondContact CE1-OE1 3.46Å; Y98-E201 PolarHBondContact OH-OE1 3.1Å; E201-V203 HydrophobicContact CG-CG2 4.43Å
202	I	35.3	Very low	33.5	Very low	41 Å²	41	129.9 Å²	129.9	21%	0.21	61%	0.609	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-125.9	118.5	-178.9	-55.5	178.1	0	0	0	106.7	E97 L204	E97-I202 PolarHBondContact N-O 3.1Å; E97-I202 PolarHBondContact O-N 3.34Å; I202-L204 HydrophobicContact CG2-CD2 4.2Å; I202-L204 HydrophobicContact CG2-CG 4.22Å
203	V	31.5	Very low	33.6	Very low	27 Å²	27	125.9 Å²	125.9	16%	0.164	61%	0.605	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-106.5	115.1	177.6	-176.2	0	0	0	0	107.6	E201 V205	E201-V203 HydrophobicContact CG-CG2 4.43Å; V203-V205 HydrophobicContact CG1-CG2 4.32Å
204	L	31.6	Very low	33.6	Very low	64 Å²	64	129.1 Å²	129.1	34%	0.335	61%	0.611	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-104.8	106	175.9	-64.8	178.4	0	0	0	108	I202	I202-L204 HydrophobicContact CG2-CD2 4.2Å; I202-L204 HydrophobicContact CG2-CG 4.22Å
205	V	29.3	Very low	33.3	Very low	77 Å²	77	130.3 Å²	130.3	47%	0.467	61%	0.614	S	S	.	*			trans	-87.6	126.1	169.6	-176.6	0	0	0	0	107.4	F89 V203	F89-V205 HydrophobicContact CE1-CG2 4.31Å; V203-V205 HydrophobicContact CG1-CG2 4.32Å
206	Q	27.6	Very low	33.2	Very low	92 Å²	92	131.8 Å²	131.8	43%	0.43	61%	0.612	S	S	.	*			trans	-117	132.2	171	-174.9	-170.4	-16.6	0	0	107.1	E208	Q206-E208 HydrophobicContact CG-CG 4.24Å; Q206-E208 VanDerWaalsContact NE2-CG 3.26Å; Q206-E208 PolarHBondContact NE2-OE1 3.14Å
207	E	28.7	Very low	33.1	Very low	128 Å²	128	126 Å²	126	60%	0.598	61%	0.609	S	S	*	*			trans	-101.6	114.5	170.1	-59	-170.3	134.2	0	0	106.4	K92	K92-E207 IonicContact NZ-OE1 2.95Å; K92-E207 PolarHBondContact NZ-OE1 3.07Å
208	E	30.7	Very low	32.6	Very low	115 Å²	115	124.9 Å²	124.9	54%	0.537	62%	0.621	S	S	.	*			trans	-96	112.5	170.1	-71.2	165.8	169.4	0	0	104.5	K93 Q206	K93-E208 IonicContact NZ-OE2 3.57Å; Q206-E208 HydrophobicContact CG-CG 4.24Å; Q206-E208 VanDerWaalsContact NE2-CG 3.26Å; Q206-E208 PolarHBondContact NE2-OE1 3.14Å
209	I	33.7	Very low	32.4	Very low	121 Å²	121	116.1 Å²	116.1	62%	0.621	61%	0.607	S	S	*	*			trans	-86.8	131.8	173.9	-63.1	176.1	0	0	0	106.8	D211	I209-D211 PolarHBondContact O-N 2.9Å; I209-D211 VanDerWaalsContact O-N 3.12Å
210	E	34	Very low	31.6	Very low	168 Å²	168	117.6 Å²	117.6	79%	0.785	61%	0.614	S	S	*	*			trans	-78.6	91.6	173.9	-64.2	-174.5	140.7	0	0	109.4	S212	E210-S212 VanDerWaalsContact C-N 3.26Å; E210-S212 PolarHBondContact O-N 3.19Å; E210-S212 PolarHBondContact O-OG 3.13Å
211	D	35.8	Very low	31.4	Very low	148 Å²	148	118.7 Å²	118.7	79%	0.791	62%	0.624	S	S	*	*			trans	-62.1	86.3	174	-71.4	-25	0	0	0	110.3	I209 D213	I209-D211 PolarHBondContact O-N 2.9Å; I209-D211 VanDerWaalsContact O-N 3.12Å; D211-D213 VanDerWaalsContact C-N 3.28Å; D211-D213 PolarHBondContact O-N 3.06Å; D211-D213 VanDerWaalsContact O-N 3.13Å
212	S	32.2	Very low	31.2	Very low	99 Å²	99	123.6 Å²	123.6	69%	0.692	65%	0.651	S	S	*	*			trans	-89.7	46	-167.5	-62.1	0	0	0	0	113	E210	E210-S212 VanDerWaalsContact C-N 3.26Å; E210-S212 PolarHBondContact O-N 3.19Å; E210-S212 PolarHBondContact O-OG 3.13Å
213	D	37	Very low	30.7	Very low	156 Å²	156	127.4 Å²	127.4	83%	0.834	68%	0.682	S	S	*	*			trans	-100.8	83.4	-180	-89	-44.6	0	0	0	113.3	D211	D211-D213 VanDerWaalsContact C-N 3.28Å; D211-D213 PolarHBondContact O-N 3.06Å; D211-D213 VanDerWaalsContact O-N 3.13Å
214	E	33.6	Very low	30.5	Very low	149 Å²	149	130.8 Å²	130.8	70%	0.696	71%	0.707	S	S	*	*			trans	20.1	101.7	130.6	-153.7	-162.5	-124.6	0	0	118.9
215	K	31.8	Very low	30.3	Very low	163 Å²	163	134.6 Å²	134.6	71%	0.709	73%	0.728	S	S	*	*				-177.7	157.6	112.4	-100.2	165.4	-145.7	72.5	0	116.8
216	D	30.7	Very low	30.5	Very low	155 Å²	155	139.2 Å²	139.2	83%	0.829	75%	0.748	S	S	*	*			trans	-58.2	131.6	178.6	-54.9	-86.5	0	0	0	114.9
217	S	31.2	Very low	30.5	Very low	119 Å²	119	141.8 Å²	141.8	83%	0.832	76%	0.764	S	S	*	*			trans	-139	110.1	149.9	-174.2	0	0	0	0	109.1	G219	S217-G219 PolarHBondContact O-N 2.87Å
218	V	29.6	Very low	30.6	Very low	151 Å²	151	141 Å²	141	92%	0.915	77%	0.77	S	S	*	*			trans	-78.3	113.5	-179.9	176	0	0	0	0	109.2
219	G	29.8	Very low	30.5	Very low	62 Å²	62	144.3 Å²	144.3	64%	0.639	79%	0.785	S	S	*	*			trans	-155.8	118.4	173.4	0	0	0	0	0	112	S217 F221	S217-G219 PolarHBondContact O-N 2.87Å; G219-F221 PolarHBondContact O-N 2.87Å
220	K	25.9	Very low	30.2	Very low	202 Å²	202	143.3 Å²	143.3	88%	0.878	79%	0.789	S	S	*	*			trans	-69.1	126	162.3	-70.8	-177.2	177.6	-176.5	0	108
221	F	28.5	Very low	30	Very low	205 Å²	205	141.6 Å²	141.6	90%	0.899	79%	0.79	S	S	*	*			trans	-130.3	125.5	159.6	-114.5	-93.8	0	0	0	108.7	G219	G219-F221 PolarHBondContact O-N 2.87Å
222	D	27.1	Very low	29.4	Very low	153 Å²	153	140 Å²	140	82%	0.818	79%	0.785	S	S	*	*			trans	-76.9	153.3	-176.7	-79.7	-63.2	0	0	0	112.1	S224	D222-S224 PolarHBondContact O-N 2.87Å
223	S	24.3	Very low	29.2	Very low	122 Å²	122	141.3 Å²	141.3	85%	0.853	79%	0.789	S	S	*	*	S	Bend	trans	-64.5	110.9	-175	-54.8	0	0	0	0	113.3
224	S	27.9	Very low	28.5	Very low	97 Å²	97	144.3 Å²	144.3	68%	0.678	79%	0.79	S	S	*	*				177.3	154.4	129.2	47.7	0	0	0	0	113.5	D222	D222-S224 PolarHBondContact O-N 2.87Å
225	N	27.7	Very low	28.1	Very low	145 Å²	145	145.2 Å²	145.2	78%	0.775	79%	0.794	S	S	*	*			trans	61.3	77.3	159.1	-52.3	-35.5	0	0	0	118.3
226	I	31.8	Very low	27.8	Very low	174 Å²	174	145.4 Å²	145.4	89%	0.892	80%	0.795	S	S	*	*			trans	-110.6	86.4	141.7	-57.2	-179.2	0	0	0	107.4
227	L	28.5	Very low	27.4	Very low	146 Å²	146	144.9 Å²	144.9	76%	0.764	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-85.6	129.5	168.8	-157.2	158.7	0	0	0	106.2	E229	L227-E229 PolarHBondContact O-N 2.9Å
228	P	29.9	Very low	27.1	Very low	112 Å²	112	148 Å²	148	73%	0.727	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-59.4	129.2	-171.1	21.7	-33.4	0	0	0	112
229	E	29.6	Very low	27.1	Very low	183 Å²	183	146.6 Å²	146.6	86%	0.855	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-65	143.4	-172.8	-167.5	171.9	-175.8	0	0	112.1	L227 V231	L227-E229 PolarHBondContact O-N 2.9Å; E229-V231 PolarHBondContact O-N 3.19Å; E229-V231 VanDerWaalsContact O-N 3.1Å
230	S	27.3	Very low	26.8	Very low	101 Å²	101	152.3 Å²	152.3	71%	0.706	79%	0.788	S	S	*	*			trans	-73.6	103.7	-169.7	55.2	0	0	0	0	112.6	T232	S230-T232 PolarHBondContact O-N 2.9Å; S230-T232 VanDerWaalsContact O-N 3.12Å
231	V	28.9	Very low	26.8	Very low	132 Å²	132	146 Å²	146	80%	0.8	78%	0.78	S	S	*	*			trans	-63.4	110.8	170.5	179.9	0	0	0	0	110	E229 V233	E229-V231 PolarHBondContact O-N 3.19Å; E229-V231 VanDerWaalsContact O-N 3.1Å; V231-V233 HydrophobicContact CG1-CG2 4.34Å; V231-V233 PolarHBondContact O-N 3.41Å
232	T	23.4	Very low	26.9	Very low	113 Å²	113	145.8 Å²	145.8	69%	0.693	78%	0.779	S	S	*	*			trans	-82.3	111.4	177.9	40.9	0	0	0	0	110.8	S230	S230-T232 PolarHBondContact O-N 2.9Å; S230-T232 VanDerWaalsContact O-N 3.12Å
233	V	27.7	Very low	26.8	Very low	127 Å²	127	146.9 Å²	146.9	77%	0.77	78%	0.779	S	S	*	*			trans	-99.8	117.1	175.3	-177.9	0	0	0	0	109.1	V231 E235	V231-V233 HydrophobicContact CG1-CG2 4.34Å; V231-V233 PolarHBondContact O-N 3.41Å; V233-E235 PolarHBondContact O-N 3.02Å
234	Y	23.4	Very low	26.9	Very low	219 Å²	219	149.5 Å²	149.5	86%	0.859	78%	0.778	S	S	*	*			trans	-70.7	111.4	179.3	-79.9	-94.7	0	0	0	111.6	K236	Y234-K236 PolarHBondContact O-N 2.87Å
235	E	24.6	Very low	26.7	Very low	169 Å²	169	149.7 Å²	149.7	79%	0.79	78%	0.779	S	S	*	*			trans	-70.5	123	170.6	-173.3	174.3	-174.4	0	0	110.7	V233 L237	V233-E235 PolarHBondContact O-N 3.02Å; E235-L237 PolarHBondContact O-N 2.85Å
236	K	25.4	Very low	26.6	Very low	166 Å²	166	149.5 Å²	149.5	72%	0.722	78%	0.778	S	S	*	*			trans	-85	76.4	-173.8	-166.9	172.1	-178.3	173.8	0	111.7	Y234 Y238	Y234-K236 PolarHBondContact O-N 2.87Å; K236-Y238 HydrophobicContact CG-CE2 4.44Å; K236-Y238 PolarHBondContact O-N 3.12Å
237	L	22.9	Very low	26.4	Very low	145 Å²	145	145.8 Å²	145.8	76%	0.759	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-54.7	132.1	174.1	-67.4	170.4	0	0	0	111.9	E235	E235-L237 PolarHBondContact O-N 2.85Å
238	Y	25.6	Very low	26.3	Very low	183 Å²	183	148 Å²	148	72%	0.718	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-103.8	151.4	163.6	-74.6	-86	0	0	0	110.1	K236	K236-Y238 HydrophobicContact CG-CE2 4.44Å; K236-Y238 PolarHBondContact O-N 3.12Å
239	P	28.7	Very low	26.1	Very low	123 Å²	123	148.9 Å²	148.9	80%	0.799	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-78.7	150.9	-155.2	-17.9	33.7	0	0	0	115.2
240	K	23.6	Very low	26	Very low	181 Å²	181	145.9 Å²	145.9	79%	0.787	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-58	133.6	167.2	-80.1	-169.2	169.2	-164	0	111.4
241	G	26.2	Very low	25.7	Very low	70 Å²	70	152.8 Å²	152.8	72%	0.722	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-66	153.8	154.3	0	0	0	0	0	110.6
242	K	30.2	Very low	25.5	Very low	200 Å²	200	153.8 Å²	153.8	87%	0.87	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-81.8	147.6	-171	-64.9	-174	175.9	-172.7	0	113.4
243	E	24.4	Very low	25.5	Very low	176 Å²	176	156.1 Å²	156.1	82%	0.822	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-99.6	124.1	167.7	-64.7	162.4	144.8	0	0	108.3
244	E	26.3	Very low	25.4	Very low	177 Å²	177	156 Å²	156	83%	0.827	79%	0.789	S	S	*	*			trans	-159.8	160.9	172.3	-157.7	158.2	-150.8	0	0	110.6
245	S	24.1	Very low	25.5	Very low	101 Å²	101	154.6 Å²	154.6	71%	0.706	79%	0.79	S	S	*	*			trans	70.8	112	177.1	64.9	0	0	0	0	119.9
246	D	26.4	Very low	25.5	Very low	141 Å²	141	151 Å²	151	75%	0.754	78%	0.781	S	S	*	*				76.2	106.8	126.9	-75	-63.4	0	0	0	124.9
247	S	26.9	Very low	25.7	Very low	97 Å²	97	147.8 Å²	147.8	68%	0.678	78%	0.777	S	S	*	*				69.5	129.2	106.1	-60.8	0	0	0	0	122.7
248	Q	27.2	Very low	26	Very low	191 Å²	191	146.5 Å²	146.5	89%	0.893	78%	0.777	S	S	*	*			trans	75.9	132	152.3	-69.1	-172.9	-1.6	0	0	121.5
249	T	25.6	Very low	26.4	Very low	132 Å²	132	143.5 Å²	143.5	81%	0.81	78%	0.78	S	S	*	*			trans	-58	127.8	165.4	46	0	0	0	0	113.6
250	S	26.4	Very low	26.2	Very low	120 Å²	120	146.5 Å²	146.5	84%	0.839	78%	0.781	S	S	*	*			trans	-161.9	148.9	133.9	-89.1	0	0	0	0	112
251	R	22.4	Very low	26.7	Very low	245 Å²	245	143.3 Å²	143.3	93%	0.925	78%	0.779	S	S	*	*			trans	-72.1	127.1	162.1	-71	175.3	172.2	174.1	-3.3	108.1
252	L	23.9	Very low	27	Very low	153 Å²	153	145.5 Å²	145.5	80%	0.801	78%	0.78	S	S	*	*				-173.1	123.7	126.9	-101.8	168.5	0	0	0	110.6	L254	L252-L254 HydrophobicContact CD2-CD1 4.45Å
253	I	23.8	Very low	27	Very low	163 Å²	163	140.5 Å²	140.5	84%	0.836	77%	0.768	S	S	*	*			trans	-73.4	125.6	153.6	-63.1	166.1	0	0	0	105.8
254	L	26	Very low	27.1	Very low	123 Å²	123	139.6 Å²	139.6	64%	0.644	76%	0.764	S	S	*	*			trans	-170.2	96.6	155.5	-107.4	165.3	0	0	0	112	L252 P256	L252-L254 HydrophobicContact CD2-CD1 4.45Å; L254-P256 HydrophobicContact CD2-CB 4.49Å; L254-P256 HydrophobicContact CD2-CG 4.13Å
255	H	23.9	Very low	27	Very low	191 Å²	191	139.4 Å²	139.4	88%	0.884	77%	0.768	S	S	*	*			trans	-124.2	97.2	146.5	-100.3	-71	0	0	0	107.8
256	P	25.3	Very low	27.7	Very low	94 Å²	94	140 Å²	140	61%	0.61	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-72.7	159	169.5	31.6	-30.8	0	0	0	110.2	L254	L254-P256 HydrophobicContact CD2-CB 4.49Å; L254-P256 HydrophobicContact CD2-CG 4.13Å
257	P	29.3	Very low	27.6	Very low	97 Å²	97	141.5 Å²	141.5	63%	0.63	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-87.9	166.6	-164.4	35.8	-38.2	0	0	0	114.3
258	P	30.5	Very low	27.8	Very low	119 Å²	119	141.6 Å²	141.6	77%	0.773	77%	0.773	S	S	*	*	S	Bend	trans	-58.9	156.4	157.2	28.2	-34.9	0	0	0	111.8
259	P	32.8	Very low	28.2	Very low	120 Å²	120	137.8 Å²	137.8	78%	0.779	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-97.2	153.1	-138	-12.6	32.3	0	0	0	117.8
260	F	25.9	Very low	28.5	Very low	185 Å²	185	138.8 Å²	138.8	81%	0.811	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-57.3	162.4	148.4	-69.5	-85.8	0	0	0	110.7
261	P	33.3	Very low	28.7	Very low	114 Å²	114	139 Å²	139	74%	0.74	76%	0.763	S	S	*	*			cis	-148.3	-155.1	39.5	38.4	-12.3	0	0	0	114.2
262	P	33.2	Very low	28.9	Very low	116 Å²	116	132.4 Å²	132.4	75%	0.753	75%	0.754	S	S	*	*				-123.8	-135.1	-69.8	42.8	-25.9	0	0	0	112.3
263	P	29.2	Very low	29.4	Very low	95 Å²	95	130.8 Å²	130.8	62%	0.617	75%	0.753	S	S	*	*			trans	-130.4	-162	-133.5	34.6	-7.7	0	0	0	116.7
264	Q	26	Very low	29.9	Very low	158 Å²	158	129.1 Å²	129.1	74%	0.738	75%	0.753	S	S	*	*			trans	86.8	111.3	162.7	-60.9	173.9	-21.1	0	0	119.2
265	L	24.5	Very low	29.8	Very low	172 Å²	172	132.2 Å²	132.2	90%	0.901	76%	0.761	S	S	*	*				28.1	158.6	125.5	-71.1	170.9	0	0	0	121.9
266	P	39	Very low	30.2	Very low	115 Å²	115	129.9 Å²	129.9	75%	0.747	76%	0.76	S	S	*	*			trans	-119.2	168.3	-137.7	43.3	-35.1	0	0	0	116.4
267	E	23.8	Very low	30	Very low	171 Å²	171	132.6 Å²	132.6	80%	0.799	77%	0.769	S	S	*	*			trans	-157.1	-176.5	153.1	-134.8	173.3	-164.9	0	0	113.5
268	S	31.5	Very low	30	Very low	100 Å²	100	137.4 Å²	137.4	70%	0.699	78%	0.78	S	S	*	*			trans	-145.6	155.1	176.6	71.4	0	0	0	0	107.7
269	P	36	Very low	29.6	Very low	110 Å²	110	138.2 Å²	138.2	71%	0.714	78%	0.782	S	S	*	*			cis	-155.5	-162.1	49.3	43	-19.7	0	0	0	116.5
270	L	31.8	Very low	29.1	Very low	153 Å²	153	137.5 Å²	137.5	80%	0.801	78%	0.78	S	S	*	*			trans	16.6	144.3	143.5	-75	161.7	0	0	0	120.8
271	P	31.7	Very low	29.4	Very low	125 Å²	125	137.1 Å²	137.1	81%	0.812	78%	0.781	S	S	*	*				-152.2	-165.9	59.7	43.3	-22.9	0	0	0	117.3
272	S	25.7	Very low	29.1	Very low	106 Å²	106	141.6 Å²	141.6	74%	0.741	78%	0.783	S	S	*	*			trans	-118.7	157.8	174.6	60.4	0	0	0	0	112.9
273	P	34.7	Very low	28.8	Very low	120 Å²	120	143.7 Å²	143.7	78%	0.779	79%	0.788	S	S	*	*			trans	-148.7	-170.5	134.4	42.1	-26.7	0	0	0	112
274	P	34.9	Very low	29	Very low	128 Å²	128	144.3 Å²	144.3	83%	0.831	80%	0.801	S	S	*	*			cis	-122.8	-170.6	-10.5	33	-13	0	0	0	113.9
275	K	22.5	Very low	29.1	Very low	188 Å²	188	142.4 Å²	142.4	82%	0.817	81%	0.805	S	S	*	*			trans	-105.8	144.1	-177.4	-56	162.2	-176	168.9	0	112.1
276	T	31.9	Very low	29.6	Very low	141 Å²	141	139 Å²	139	87%	0.865	79%	0.793	S	S	*	*			trans	-141.8	131.4	149	34.7	0	0	0	0	106.9
277	L	22.1	Very low	28.9	Very low	152 Å²	152	142.5 Å²	142.5	80%	0.796	80%	0.797	S	S	*	*			cis	77.3	77	25.2	-70.3	172.4	0	0	0	117
278	K	28.2	Very low	29.1	Very low	197 Å²	197	140 Å²	140	86%	0.857	80%	0.795	S	S	*	*			trans	-164.6	131	134.2	-96.9	156.1	-177.1	-177.8	0	106.3
279	V	23.8	Very low	28.7	Very low	136 Å²	136	143.4 Å²	143.4	82%	0.824	80%	0.8	S	S	*	*				66.2	130.4	58.5	178.2	0	0	0	0	111.5
280	S	22.2	Very low	28.4	Very low	105 Å²	105	143.1 Å²	143.1	73%	0.734	80%	0.798	S	S	*	*			cis	174.8	107.9	-26.5	158.1	0	0	0	0	108.2
281	E	32.1	Very low	28.3	Very low	177 Å²	177	144.3 Å²	144.3	83%	0.827	80%	0.803	S	S	*	*			trans	-170.3	159.8	171.2	-117.5	161	-153.3	0	0	111.8
282	R	25.9	Very low	28.3	Very low	208 Å²	208	143.6 Å²	143.6	79%	0.785	80%	0.801	S	S	*	*				-162.1	116.3	-52.4	178.3	-173.9	-69.8	175.6	1.2	108.1
283	N	28.2	Very low	28.6	Very low	160 Å²	160	142.5 Å²	142.5	86%	0.856	79%	0.794	S	S	*	*			trans	32	111.9	160.3	-57.1	-9.9	0	0	0	121.4
284	A	33.2	Very low	28.3	Very low	108 Å²	108	149 Å²	149	89%	0.893	80%	0.803	S	S	*	*			trans	-156.3	158.1	143.3	0	0	0	0	0	111.8
285	S	26.5	Very low	28.1	Very low	119 Å²	119	150 Å²	150	83%	0.832	80%	0.801	S	S	*	*			trans	-161.5	167.4	-178.2	-142.1	0	0	0	0	108.8
286	P	35.6	Very low	28.2	Very low	99 Å²	99	146 Å²	146	64%	0.643	80%	0.797	S	S	*	*			cis	-141.3	-176.4	8.6	43.8	-25.8	0	0	0	117.4
287	K	23.9	Very low	28	Very low	189 Å²	189	145.1 Å²	145.1	82%	0.822	80%	0.795	S	S	*	*			trans	74.9	155.5	163.4	-62.1	175	178.2	177	0	118.5
288	P	28.4	Very low	28	Very low	118 Å²	118	146.9 Å²	146.9	77%	0.766	80%	0.799	S	S	*	*			cis	-98.7	141.5	-24	35.1	-25.8	0	0	0	110.9
289	Q	24.2	Very low	28.1	Very low	172 Å²	172	143 Å²	143	80%	0.804	80%	0.795	S	S	*	*				61.2	128.9	72.9	-71.1	-69.3	-7.7	0	0	114.2
290	P	29.4	Very low	28.3	Very low	104 Å²	104	144.7 Å²	144.7	68%	0.675	79%	0.791	S	S	*	*			trans	-103.4	155.5	-151.2	39.3	-37	0	0	0	116.5
291	I	30.1	Very low	28.6	Very low	178 Å²	178	146.8 Å²	146.8	91%	0.913	79%	0.789	S	S	*	*			trans	-140.7	92.8	148.9	18.4	173.4	0	0	0	107.8	S293	I291-S293 PolarHBondContact O-N 2.78Å
292	S	31.3	Very low	28.3	Very low	110 Å²	110	146.9 Å²	146.9	77%	0.769	79%	0.789	S	S	*	*			trans	-78.1	108.6	-171.3	-159.1	0	0	0	0	112.1
293	S	32.1	Very low	28.3	Very low	83 Å²	83	140.8 Å²	140.8	58%	0.58	78%	0.784	S	S	*	*			trans	45.4	92.7	141.3	61.4	0	0	0	0	117.5	I291	I291-S293 PolarHBondContact O-N 2.78Å
294	R	27.6	Very low	28.6	Very low	256 Å²	256	139 Å²	139	97%	0.966	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-85.8	117.3	151.6	-168.2	176.3	-172.4	176	2.9	108.1	S296	R294-S296 PolarHBondContact O-N 2.72Å
295	N	29.8	Very low	28.5	Very low	150 Å²	150	140.6 Å²	140.6	80%	0.802	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-55.7	127.9	-159.7	-57.9	-3.7	0	0	0	115.4
296	S	25.3	Very low	28.9	Very low	105 Å²	105	142.9 Å²	142.9	73%	0.734	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-82.9	143.5	147	55.2	0	0	0	0	110	R294	R294-S296 PolarHBondContact O-N 2.72Å
297	C	27	Very low	28.6	Very low	121 Å²	121	140.6 Å²	140.6	82%	0.818	77%	0.768	S	S	*	*				168.3	142.1	128.9	-91.5	0	0	0	0	111.4
298	Q	23	Very low	28.9	Very low	189 Å²	189	143.4 Å²	143.4	88%	0.883	77%	0.774	S	S	*	*			trans	-81.6	132.8	167.8	-71.8	-86.5	-8.7	0	0	109.6
299	P	30.8	Very low	29.2	Very low	117 Å²	117	142.1 Å²	142.1	76%	0.76	77%	0.773	S	S	*	*			trans	-96.4	115.7	159.3	30.9	-22.4	0	0	0	110.4
300	K	27.9	Very low	29.6	Very low	170 Å²	170	142.2 Å²	142.2	74%	0.739	77%	0.773	S	S	*	*			trans	-63.4	163	156.7	-94.1	178	148.7	-129.2	0	110
301	E	28.9	Very low	29.9	Very low	149 Å²	149	142.6 Å²	142.6	70%	0.696	78%	0.776	S	S	*	*			trans	45.4	87.3	148.1	-67.3	159.6	-134.8	0	0	117.4
302	Q	24.8	Very low	30.5	Very low	179 Å²	179	139.5 Å²	139.5	84%	0.836	77%	0.767	S	S	*	*				-160.8	138.3	116.2	-106.5	160.6	28.1	0	0	111.2
303	A	26.4	Very low	30.8	Very low	81 Å²	81	137.2 Å²	137.2	67%	0.669	76%	0.762	S	S	*	*			trans	-64.5	140.7	164.4	0	0	0	0	0	108.4	I305	A303-I305 VanDerWaalsContact C-N 3.35Å; A303-I305 PolarHBondContact O-N 3.36Å
304	P	33.5	Very low	31.2	Very low	122 Å²	122	143.2 Å²	143.2	79%	0.792	78%	0.777	S	S	*	*			trans	-68.4	93.1	-177	27.4	-34.4	0	0	0	110.6	I306	P304-I306 PolarHBondContact O-N 3.2Å
305	I	32.7	Very low	31.7	Very low	142 Å²	142	136.3 Å²	136.3	73%	0.728	76%	0.764	S	S	*	*			trans	-54	121.6	160	-56.8	175.7	0	0	0	105.6	A303 G307	A303-I305 VanDerWaalsContact C-N 3.35Å; A303-I305 PolarHBondContact O-N 3.36Å; I305-G307 PolarHBondContact O-N 3.44Å
306	I	34.1	Very low	32.1	Very low	167 Å²	167	138.2 Å²	138.2	86%	0.856	77%	0.765	S	S	*	*			trans	-77.7	59.1	172.3	-49.2	-179.7	0	0	0	108.3	P304	P304-I306 PolarHBondContact O-N 3.2Å
307	G	30.3	Very low	32.9	Very low	51 Å²	51	138.5 Å²	138.5	53%	0.526	76%	0.764	S	S	.	*			trans	-61.4	143.8	155.7	0	0	0	0	0	107.6	I305 A309	I305-G307 PolarHBondContact O-N 3.44Å; G307-A309 PolarHBondContact O-N 3.36Å
308	R	30.6	Very low	33.8	Very low	247 Å²	247	140.9 Å²	140.9	93%	0.932	77%	0.767	S	S	*	*			trans	-27.9	108.7	-175.1	-68.7	175.3	171.7	133.7	-4.3	112.5	E310	R308-E310 PolarHBondContact O-N 2.87Å
309	A	33.6	Very low	35.1	Very low	91 Å²	91	137.6 Å²	137.6	75%	0.752	76%	0.76	S	S	*	*			trans	-60.4	112.8	161.9	0	0	0	0	0	106.9	G307	G307-A309 PolarHBondContact O-N 3.36Å
310	E	31.9	Very low	36.4	Very low	174 Å²	174	135.5 Å²	135.5	81%	0.813	75%	0.748	S	S	*	*			trans	-54.7	143.4	168.9	-79.4	-170.5	109.8	0	0	109.1	R308	R308-E310 PolarHBondContact O-N 2.87Å
311	P	37.3	Very low	38.5	Very low	113 Å²	113	130.3 Å²	130.3	73%	0.734	73%	0.733	S	S	*	*			trans	-57	132.3	178.6	25	-33.6	0	0	0	108.8	G313	P311-G313 PolarHBondContact O-N 2.99Å
312	P	42.4	Very low	40.8	Very low	112 Å²	112	128.6 Å²	128.6	73%	0.727	74%	0.735	S	S	*	*			trans	-71.5	75.9	-170	27.7	-35.5	0	0	0	112.3	K314	P312-K314 PolarHBondContact O-N 3.49Å; P312-K314 VanDerWaalsContact O-N 3.15Å
313	G	37.7	Very low	43.6	Very low	63 Å²	63	127.4 Å²	127.4	65%	0.649	73%	0.727	S	S	*	*			trans	-67.9	106.7	179.2	0	0	0	0	0	111.3	P311 T315	P311-G313 PolarHBondContact O-N 2.99Å; G313-T315 VanDerWaalsContact C-N 3.28Å; G313-T315 PolarHBondContact O-N 2.98Å
314	K	40.3	Very low	46	Very low	208 Å²	208	126 Å²	126	90%	0.904	71%	0.712	S	S	*	*	S	Bend	trans	64.3	20.4	163.5	-51.2	179.3	-177.9	178.9	0	115.9	P312 K316	P312-K314 PolarHBondContact O-N 3.49Å; P312-K314 VanDerWaalsContact O-N 3.15Å; K314-K316 PolarHBondContact O-N 3.33Å; K314-K316 VanDerWaalsContact O-N 3.07Å
315	T	38.4	Very low	48.6	Very low	112 Å²	112	126.7 Å²	126.7	69%	0.687	70%	0.702	S	S	*	*			trans	-60.3	112.9	158.1	43.5	0	0	0	0	108.6	G313	G313-T315 VanDerWaalsContact C-N 3.28Å; G313-T315 PolarHBondContact O-N 2.98Å
316	K	37.9	Very low	51.3	Low	189 Å²	189	126 Å²	126	82%	0.822	70%	0.696	S	S	*	*			trans	-51.3	145.8	173.4	-64.9	-178.6	-179.1	-178.8	0	109.4	K314 I318	K314-K316 PolarHBondContact O-N 3.33Å; K314-K316 VanDerWaalsContact O-N 3.07Å; K316-I318 PolarHBondContact O-N 2.88Å
317	P	41.1	Very low	53.9	Low	111 Å²	111	123 Å²	123	72%	0.721	68%	0.682	S	S	*	*			trans	-52.3	139.4	-176.1	21.6	-33.9	0	0	0	110.5	V319	P317-V319 PolarHBondContact O-N 3.36Å
318	I	47.1	Very low	56.8	Low	171 Å²	171	126.6 Å²	126.6	88%	0.877	68%	0.683	S	S	*	*			trans	-70.6	83.2	177.4	-55.3	176.5	0	0	0	107.5	K316 S320	K316-I318 PolarHBondContact O-N 2.88Å; I318-S320 PolarHBondContact O-N 3.2Å; I318-S320 VanDerWaalsContact O-N 3.13Å
319	V	48.9	Very low	59.7	Low	121 Å²	121	117.5 Å²	117.5	73%	0.733	65%	0.651	S	S	*	*	P	Polyproline II helix	trans	-54.6	119.6	169.8	178.5	0	0	0	0	106.4	P317 S321	P317-V319 PolarHBondContact O-N 3.36Å; V319-S321 PolarHBondContact O-N 2.98Å; V319-S321 VanDerWaalsContact O-N 3.09Å
320	S	58.5	Low	62.5	Low	72 Å²	72	119 Å²	119	50%	0.503	64%	0.641	S	S	.	*	P	Polyproline II helix	trans	-54	120.7	174.4	38.7	0	0	0	0	108	I318	I318-S320 PolarHBondContact O-N 3.2Å; I318-S320 VanDerWaalsContact O-N 3.13Å
321	S	72.9	Confident	65.4	Low	62 Å²	62	116.3 Å²	116.3	43%	0.434	63%	0.631	S	S	.	*	P	Polyproline II helix	trans	-53.6	146.2	-176.6	67	0	0	0	0	109.5	V319 K323 S324 K325	V319-S321 PolarHBondContact O-N 2.98Å; V319-S321 VanDerWaalsContact O-N 3.09Å; S321-K323 PolarHBondContact O-N 3.48Å; S321-S324 PolarHBondContact N-OG 3.45Å; S321-S324 PolarHBondContact O-N 2.83Å; S321-S324 PolarHBondContact O-OG 3.35Å; S321-S324 VanDerWaalsContact O-OG 3.07Å; S321-S324 PolarHBondContact OG-N 3.36Å; S321-S324 PolarHBondContact OG-OG 2.95Å; S321-K325 PolarHBondContact O-N 3.1Å; S321-K325 VanDerWaalsContact O-N 3.14Å
322	P	77.4	Confident	68.1	Low	112 Å²	112	115.4 Å²	115.4	73%	0.727	62%	0.616	S	S	*	*	H	α-helix	trans	-50.5	-38.1	-178.3	-30.9	36.4	0	0	0	112.5	S324 K325 E326	P322-S324 PolarHBondContact O-N 3.02Å; P322-K325 PolarHBondContact O-N 3.13Å; P322-E326 VanDerWaalsContact O-CB 3.3Å; P322-E326 WeakPolarHBondContact O-CB 3.48Å; P322-E326 PolarHBondContact O-N 2.83Å
323	K	82.3	Confident	70.5	Confident	155 Å²	155	117.5 Å²	117.5	67%	0.674	61%	0.609	S	S	*	*	H	α-helix	trans	-62.6	-35.4	173.8	-62.5	-172.6	176.6	-173.5	0	114.6	S321 N327	S321-K323 PolarHBondContact O-N 3.48Å; K323-N327 VanDerWaalsContact O-CB 3.31Å; K323-N327 WeakPolarHBondContact O-CB 3.39Å; K323-N327 PolarHBondContact O-N 2.82Å; K323-N327 PolarHBondContact O-ND2 3.34Å
324	S	78.3	Confident	73.2	Confident	51 Å²	51	120.1 Å²	120.1	36%	0.357	61%	0.605	S	S	.	*	H	α-helix	trans	-78.1	-32.3	177.2	68.3	0	0	0	0	112.6	S321 P322 F328	S321-S324 PolarHBondContact N-OG 3.45Å; S321-S324 PolarHBondContact O-N 2.83Å; S321-S324 PolarHBondContact O-OG 3.35Å; S321-S324 VanDerWaalsContact O-OG 3.07Å; S321-S324 PolarHBondContact OG-N 3.36Å; S321-S324 PolarHBondContact OG-OG 2.95Å; P322-S324 PolarHBondContact O-N 3.02Å; S324-F328 PolarHBondContact O-N 3.27Å
325	K	86.9	Confident	75.6	Confident	136 Å²	136	117.8 Å²	117.8	59%	0.591	59%	0.59	S	S	*	*	H	α-helix	trans	-65.4	-43.5	167.7	-173.4	177.8	179.6	-179.3	0	111.4	S321 P322 F328 E329	S321-K325 PolarHBondContact O-N 3.1Å; S321-K325 VanDerWaalsContact O-N 3.14Å; P322-K325 PolarHBondContact O-N 3.13Å; K325-F328 PolarHBondContact O-N 2.95Å; K325-E329 PolarHBondContact O-N 3.35Å
326	E	89.1	Confident	78.2	Confident	127 Å²	127	116.8 Å²	116.8	59%	0.593	58%	0.581	S	S	*	*	H	α-helix	trans	-60.6	-46.9	175.1	-173.2	-173.3	174	0	0	111.8	P322 F328 E329 K330	P322-E326 VanDerWaalsContact O-CB 3.3Å; P322-E326 WeakPolarHBondContact O-CB 3.48Å; P322-E326 PolarHBondContact O-N 2.83Å; E326-F328 VanDerWaalsContact C-N 3.33Å; E326-F328 PolarHBondContact O-N 2.93Å; E326-E329 PolarHBondContact O-N 3.48Å; E326-K330 WeakPolarHBondContact O-CB 3.05Å; E326-K330 PolarHBondContact O-N 2.64Å
327	N	89.2	Confident	80.8	Confident	104 Å²	104	112.8 Å²	112.8	56%	0.556	57%	0.568	S	S	*	*	H	α-helix	trans	-59.8	-40	175	-78.9	-19.4	0	0	0	112.5	K323 K330 L331	K323-N327 VanDerWaalsContact O-CB 3.31Å; K323-N327 WeakPolarHBondContact O-CB 3.39Å; K323-N327 PolarHBondContact O-N 2.82Å; K323-N327 PolarHBondContact O-ND2 3.34Å; N327-K330 PolarHBondContact O-N 2.9Å; N327-L331 WeakPolarHBondContact O-CB 3.4Å; N327-L331 PolarHBondContact O-N 2.86Å
328	F	91.3	Very high	83.3	Confident	128 Å²	128	115.1 Å²	115.1	56%	0.561	56%	0.563	S	S	*	*	H	α-helix	trans	-63.9	-48.3	175.9	178.5	-98.3	0	0	0	111.9	S324 K325 E326 K330 L331 K332	S324-F328 PolarHBondContact O-N 3.27Å; K325-F328 PolarHBondContact O-N 2.95Å; E326-F328 VanDerWaalsContact C-N 3.33Å; E326-F328 PolarHBondContact O-N 2.93Å; F328-K330 VanDerWaalsContact C-N 3.26Å; F328-K330 PolarHBondContact O-N 2.96Å; F328-L331 PolarHBondContact O-N 2.69Å; F328-K332 HydrophobicContact CE1-CD 4.17Å; F328-K332 VanDerWaalsContact O-CB 3.31Å; F328-K332 WeakPolarHBondContact O-CB 3.36Å; F328-K332 PolarHBondContact O-N 3.12Å
329	E	91.5	Very high	85.4	Confident	55 Å²	55	111 Å²	111	26%	0.257	54%	0.541	S	S	.	.	H	α-helix	trans	-67	-26.2	176.2	-69.4	-62	149.2	0	0	112.6	K325 E326 K332 R333	K325-E329 PolarHBondContact O-N 3.35Å; E326-E329 PolarHBondContact O-N 3.48Å; E329-K332 VanDerWaalsContact CD-NZ 3.29Å; E329-K332 IonicContact OE1-NZ 2.64Å; E329-K332 PolarHBondContact OE1-NZ 2.88Å; E329-K332 WeakPolarHBondContact OE2-CD 3.44Å; E329-K332 IonicContact OE2-NZ 3.12Å; E329-K332 PolarHBondContact OE2-NZ 2.86Å; E329-R333 WeakPolarHBondContact O-CB 3.31Å; E329-R333 VanDerWaalsContact O-CG 3.27Å; E329-R333 WeakPolarHBondContact O-CG 3.35Å; E329-R333 PolarHBondContact O-N 3.35Å; E329-R333 PolarHBondContact O-NH1 2.85Å
330	K	92.2	Very high	87.3	Confident	124 Å²	124	108 Å²	108	54%	0.539	53%	0.529	S	S	.	.	H	α-helix	trans	-70.7	-44.6	171.3	-170.8	172.6	-176.7	173.9	0	111.7	E326 N327 F328 R333 Q334	E326-K330 WeakPolarHBondContact O-CB 3.05Å; E326-K330 PolarHBondContact O-N 2.64Å; N327-K330 PolarHBondContact O-N 2.9Å; F328-K330 VanDerWaalsContact C-N 3.26Å; F328-K330 PolarHBondContact O-N 2.96Å; K330-R333 PolarHBondContact O-N 2.86Å; K330-Q334 WeakPolarHBondContact O-CG 3.38Å; K330-Q334 PolarHBondContact O-N 3.33Å
331	L	93.6	Very high	88.8	Confident	117 Å²	117	110.8 Å²	110.8	61%	0.613	54%	0.535	S	S	*	.	H	α-helix	trans	-63.1	-42.1	176.2	-159.8	82.3	0	0	0	111.5	N327 F328 Q334 W335	N327-L331 WeakPolarHBondContact O-CB 3.4Å; N327-L331 PolarHBondContact O-N 2.86Å; F328-L331 PolarHBondContact O-N 2.69Å; L331-Q334 PolarHBondContact O-N 3.24Å; L331-W335 PolarHBondContact O-N 2.85Å
332	K	93.9	Very high	89.3	Confident	93 Å²	93	113 Å²	113	40%	0.404	54%	0.539	S	S	.	.	H	α-helix	trans	-62.8	-42	175.5	179.6	175.3	157.9	-147	0	112.4	F328 E329 W335 N336	F328-K332 HydrophobicContact CE1-CD 4.17Å; F328-K332 VanDerWaalsContact O-CB 3.31Å; F328-K332 WeakPolarHBondContact O-CB 3.36Å; F328-K332 PolarHBondContact O-N 3.12Å; E329-K332 VanDerWaalsContact CD-NZ 3.29Å; E329-K332 IonicContact OE1-NZ 2.64Å; E329-K332 PolarHBondContact OE1-NZ 2.88Å; E329-K332 WeakPolarHBondContact OE2-CD 3.44Å; E329-K332 IonicContact OE2-NZ 3.12Å; E329-K332 PolarHBondContact OE2-NZ 2.86Å; K332-W335 PolarHBondContact O-N 3.3Å; K332-N336 PolarHBondContact O-N 3.17Å; K332-N336 PolarHBondContact O-OD1 2.98Å
333	R	93.3	Very high	89.7	Confident	156 Å²	156	112.3 Å²	112.3	59%	0.589	53%	0.526	S	S	*	.	H	α-helix	trans	-62.9	-43.7	170.8	-74.9	177.5	-173	106.8	-8.8	112.2	E329 K330 W335 N336 N337	E329-R333 WeakPolarHBondContact O-CB 3.31Å; E329-R333 VanDerWaalsContact O-CG 3.27Å; E329-R333 WeakPolarHBondContact O-CG 3.35Å; E329-R333 PolarHBondContact O-N 3.35Å; E329-R333 PolarHBondContact O-NH1 2.85Å; K330-R333 PolarHBondContact O-N 2.86Å; R333-W335 VanDerWaalsContact C-N 3.32Å; R333-W335 PolarHBondContact O-N 3.42Å; R333-N336 PolarHBondContact O-N 3.35Å; R333-N337 WeakPolarHBondContact O-CB 3.3Å; R333-N337 VanDerWaalsContact O-CG 3.28Å; R333-N337 PolarHBondContact O-N 3.43Å; R333-N337 PolarHBondContact O-OD1 3.4Å
334	Q	93.7	Very high	89.8	Confident	119 Å²	119	110.5 Å²	110.5	56%	0.556	52%	0.52	S	S	*	.	H	α-helix	trans	-61.3	-39.7	176	-75.1	179.6	-43.4	0	0	112.4	K330 L331 R338	K330-Q334 WeakPolarHBondContact O-CG 3.38Å; K330-Q334 PolarHBondContact O-N 3.33Å; L331-Q334 PolarHBondContact O-N 3.24Å; Q334-R338 PolarHBondContact O-N 2.69Å; Q334-R338 VanDerWaalsContact O-N 3.12Å
335	W	90.7	Very high	90.1	Very high	159 Å²	159	114.1 Å²	114.1	60%	0.602	53%	0.531	S	S	*	.	H	α-helix	trans	-62.8	-51.3	174	-176.1	-93.8	0	0	0	111.8	L331 K332 R333 N337 R338 I339	L331-W335 PolarHBondContact O-N 2.85Å; K332-W335 PolarHBondContact O-N 3.3Å; R333-W335 VanDerWaalsContact C-N 3.32Å; R333-W335 PolarHBondContact O-N 3.42Å; W335-N337 VanDerWaalsContact C-N 3.34Å; W335-N337 PolarHBondContact O-N 3.15Å; W335-R338 WeakPolarHBondContact O-CB 3.41Å; W335-R338 PolarHBondContact O-N 2.82Å; W335-R338 VanDerWaalsContact O-N 3.11Å; W335-I339 HydrophobicContact CZ2-CD1 4.31Å; W335-I339 WeakPolarHBondContact O-CG1 3.29Å; W335-I339 PolarHBondContact O-N 3.11Å
336	N	93.1	Very high	89.8	Confident	91 Å²	91	111.4 Å²	111.4	49%	0.487	52%	0.523	S	S	.	.	H	α-helix	trans	-60.3	-42.6	180	-71.1	10.6	0	0	0	112.1	K332 R333 R338 I339 A340	K332-N336 PolarHBondContact O-N 3.17Å; K332-N336 PolarHBondContact O-OD1 2.98Å; R333-N336 PolarHBondContact O-N 3.35Å; N336-R338 VanDerWaalsContact C-N 3.31Å; N336-R338 PolarHBondContact O-N 2.98Å; N336-I339 PolarHBondContact O-N 3.4Å; N336-A340 PolarHBondContact O-N 3.5Å
337	N	93	Very high	89.2	Confident	104 Å²	104	109 Å²	109	56%	0.556	51%	0.514	S	S	*	.	H	α-helix	trans	-62	-37.6	176	-71.9	17.8	0	0	0	112.1	R333 W335 A340 Q341	R333-N337 WeakPolarHBondContact O-CB 3.3Å; R333-N337 VanDerWaalsContact O-CG 3.28Å; R333-N337 PolarHBondContact O-N 3.43Å; R333-N337 PolarHBondContact O-OD1 3.4Å; W335-N337 VanDerWaalsContact C-N 3.34Å; W335-N337 PolarHBondContact O-N 3.15Å; N337-A340 PolarHBondContact O-N 3.17Å; N337-Q341 WeakPolarHBondContact O-CG 3.16Å; N337-Q341 PolarHBondContact O-N 3.18Å
338	R	93.1	Very high	88.6	Confident	160 Å²	160	108 Å²	108	60%	0.604	51%	0.509	S	S	*	.	H	α-helix	trans	-66.3	-39.1	175.6	-179	177.9	176.9	166.6	1.5	112.2	Q334 W335 N336 M342	Q334-R338 PolarHBondContact O-N 2.69Å; Q334-R338 VanDerWaalsContact O-N 3.12Å; W335-R338 WeakPolarHBondContact O-CB 3.41Å; W335-R338 PolarHBondContact O-N 2.82Å; W335-R338 VanDerWaalsContact O-N 3.11Å; N336-R338 VanDerWaalsContact C-N 3.31Å; N336-R338 PolarHBondContact O-N 2.98Å; R338-M342 WeakPolarHBondContact O-CG 3.49Å; R338-M342 PolarHBondContact O-N 2.98Å
339	I	90	Very high	87.5	Confident	84 Å²	84	108.2 Å²	108.2	43%	0.431	51%	0.511	S	S	.	.	H	α-helix	trans	-65.7	-43.4	174.7	-62	-60.5	0	0	0	110.5	W335 N336 M342 Q343	W335-I339 HydrophobicContact CZ2-CD1 4.31Å; W335-I339 WeakPolarHBondContact O-CG1 3.29Å; W335-I339 PolarHBondContact O-N 3.11Å; N336-I339 PolarHBondContact O-N 3.4Å; I339-M342 PolarHBondContact O-N 3.39Å; I339-Q343 PolarHBondContact O-N 3.33Å
340	A	90.1	Very high	85.9	Confident	58 Å²	58	114.3 Å²	114.3	48%	0.479	53%	0.534	S	S	.	.	H	α-helix	trans	-59.8	-47.5	176.1	0	0	0	0	0	112.3	N336 N337 M342 Q343 E344	N336-A340 PolarHBondContact O-N 3.5Å; N337-A340 PolarHBondContact O-N 3.17Å; A340-M342 VanDerWaalsContact C-N 3.31Å; A340-M342 PolarHBondContact O-N 3.27Å; A340-Q343 PolarHBondContact O-N 3.39Å; A340-Q343 VanDerWaalsContact O-N 3.14Å; A340-E344 WeakPolarHBondContact O-CB 3.33Å; A340-E344 PolarHBondContact O-N 3.23Å
341	Q	88.8	Confident	84.2	Confident	132 Å²	132	118.4 Å²	118.4	62%	0.617	55%	0.546	S	S	*	.	H	α-helix	trans	-62.5	-35.2	176.1	-74.6	178.1	-22.8	0	0	113.1	N337 H345	N337-Q341 WeakPolarHBondContact O-CG 3.16Å; N337-Q341 PolarHBondContact O-N 3.18Å; Q341-H345 WeakPolarHBondContact O-CB 3.48Å; Q341-H345 PolarHBondContact O-N 3.02Å
342	M	84.2	Confident	82.1	Confident	107 Å²	107	119.8 Å²	119.8	53%	0.527	55%	0.553	S	S	.	*	H	α-helix	trans	-68.4	-36.5	173.9	-78.5	-178.3	57.6	0	0	112.3	R338 I339 A340 L346	R338-M342 WeakPolarHBondContact O-CG 3.49Å; R338-M342 PolarHBondContact O-N 2.98Å; I339-M342 PolarHBondContact O-N 3.39Å; A340-M342 VanDerWaalsContact C-N 3.31Å; A340-M342 PolarHBondContact O-N 3.27Å; M342-L346 WeakPolarHBondContact O-CG 3.48Å; M342-L346 PolarHBondContact O-N 3.06Å
343	Q	84.6	Confident	80	Confident	99 Å²	99	119.9 Å²	119.9	46%	0.463	56%	0.562	S	S	.	*	H	α-helix	trans	-70.4	-46.8	175.9	-170.7	61.1	51.5	0	0	111.2	I339 A340 H345 L346 D347	I339-Q343 PolarHBondContact O-N 3.33Å; A340-Q343 PolarHBondContact O-N 3.39Å; A340-Q343 VanDerWaalsContact O-N 3.14Å; Q343-H345 VanDerWaalsContact C-N 3.28Å; Q343-H345 PolarHBondContact O-N 3.46Å; Q343-L346 WeakPolarHBondContact O-CB 3.34Å; Q343-L346 PolarHBondContact O-N 2.9Å; Q343-D347 PolarHBondContact NE2-OD1 3.47Å; Q343-D347 VanDerWaalsContact O-CG 3.28Å; Q343-D347 PolarHBondContact O-N 2.57Å
344	E	85.7	Confident	77.5	Confident	116 Å²	116	118.2 Å²	118.2	54%	0.542	57%	0.571	S	S	.	*	H	α-helix	trans	-55.3	-42	175.3	-176.7	-174.1	174.9	0	0	112	A340 L346 D347 N348	A340-E344 WeakPolarHBondContact O-CB 3.33Å; A340-E344 PolarHBondContact O-N 3.23Å; E344-L346 VanDerWaalsContact C-N 3.32Å; E344-L346 PolarHBondContact O-N 3.05Å; E344-D347 PolarHBondContact O-N 3.38Å; E344-N348 WeakPolarHBondContact O-CB 3.37Å; E344-N348 VanDerWaalsContact O-CG 3.25Å; E344-N348 PolarHBondContact O-N 3.13Å; E344-N348 PolarHBondContact O-ND2 3.39Å
345	H	83.5	Confident	74.9	Confident	127 Å²	127	119.3 Å²	119.3	59%	0.588	59%	0.586	S	S	*	*	H	α-helix	trans	-65.7	-32.4	176.8	-170.8	63.8	0	0	0	113.3	Q341 Q343	Q341-H345 WeakPolarHBondContact O-CB 3.48Å; Q341-H345 PolarHBondContact O-N 3.02Å; Q343-H345 VanDerWaalsContact C-N 3.28Å; Q343-H345 PolarHBondContact O-N 3.46Å
346	L	80.6	Confident	72.4	Confident	79 Å²	79	117 Å²	117	41%	0.414	59%	0.594	S	S	.	*	H	α-helix	trans	-74	-46.6	173.2	-68.6	167.9	0	0	0	111.2	M342 Q343 E344 N348 Q349 Y350	M342-L346 WeakPolarHBondContact O-CG 3.48Å; M342-L346 PolarHBondContact O-N 3.06Å; Q343-L346 WeakPolarHBondContact O-CB 3.34Å; Q343-L346 PolarHBondContact O-N 2.9Å; E344-L346 VanDerWaalsContact C-N 3.32Å; E344-L346 PolarHBondContact O-N 3.05Å; L346-N348 VanDerWaalsContact C-N 3.32Å; L346-N348 PolarHBondContact O-N 2.92Å; L346-Q349 WeakPolarHBondContact O-CB 3.33Å; L346-Q349 PolarHBondContact O-N 2.9Å; L346-Q349 VanDerWaalsContact O-N 3.12Å; L346-Y350 WeakPolarHBondContact O-CD2 3.33Å; L346-Y350 PolarHBondContact O-N 2.76Å
347	D	77.9	Confident	69.5	Low	77 Å²	77	120.4 Å²	120.4	41%	0.412	61%	0.612	S	S	.	*	H	α-helix	trans	-64.1	-37.4	-176.6	-64.9	-15.9	0	0	0	111.8	Q343 E344 Q349 Y350 R351	Q343-D347 PolarHBondContact NE2-OD1 3.47Å; Q343-D347 VanDerWaalsContact O-CG 3.28Å; Q343-D347 PolarHBondContact O-N 2.57Å; E344-D347 PolarHBondContact O-N 3.38Å; D347-Q349 PolarHBondContact O-N 2.94Å; D347-Y350 PolarHBondContact O-N 3.24Å; D347-Y350 VanDerWaalsContact O-N 3.16Å; D347-R351 PolarHBondContact O-N 2.88Å
348	N	76	Confident	66.8	Low	83 Å²	83	121 Å²	121	44%	0.444	62%	0.622	S	S	.	*	H	α-helix	trans	-65	-36	174.4	-72.6	-23.8	0	0	0	112.4	E344 L346 Y350 R351 D352	E344-N348 WeakPolarHBondContact O-CB 3.37Å; E344-N348 VanDerWaalsContact O-CG 3.25Å; E344-N348 PolarHBondContact O-N 3.13Å; E344-N348 PolarHBondContact O-ND2 3.39Å; L346-N348 VanDerWaalsContact C-N 3.32Å; L346-N348 PolarHBondContact O-N 2.92Å; N348-Y350 PolarHBondContact O-N 2.94Å; N348-R351 PolarHBondContact O-N 2.83Å; N348-R351 VanDerWaalsContact O-N 3.11Å; N348-D352 PolarHBondContact O-N 2.8Å
349	Q	67.3	Low	64	Low	132 Å²	132	122.4 Å²	122.4	62%	0.617	64%	0.635	S	S	*	*	H	α-helix	trans	-62.7	-25.4	173.5	-76.3	-166.3	-32.4	0	0	113.3	L346 D347	L346-Q349 WeakPolarHBondContact O-CB 3.33Å; L346-Q349 PolarHBondContact O-N 2.9Å; L346-Q349 VanDerWaalsContact O-N 3.12Å; D347-Q349 PolarHBondContact O-N 2.94Å
350	Y	58.9	Low	61.2	Low	184 Å²	184	125 Å²	125	72%	0.722	66%	0.655	S	S	*	*	H	α-helix	trans	-85.2	-22.6	174.3	-71	-72.5	0	0	0	113.6	L346 D347 N348	L346-Y350 WeakPolarHBondContact O-CD2 3.33Å; L346-Y350 PolarHBondContact O-N 2.76Å; D347-Y350 PolarHBondContact O-N 3.24Å; D347-Y350 VanDerWaalsContact O-N 3.16Å; N348-Y350 PolarHBondContact O-N 2.94Å
351	R	55.8	Low	58.2	Low	210 Å²	210	132.7 Å²	132.7	79%	0.792	67%	0.673	S	S	*	*	H	α-helix	trans	-79.6	-32.2	-176.6	-80.3	-69	-179.2	-164.1	0	114.4	D347 N348 T353	D347-R351 PolarHBondContact O-N 2.88Å; N348-R351 PolarHBondContact O-N 2.83Å; N348-R351 VanDerWaalsContact O-N 3.11Å; R351-T353 PolarHBondContact O-N 2.9Å; R351-T353 VanDerWaalsContact O-N 3.13Å
352	D	50.8	Low	55.6	Low	145 Å²	145	133 Å²	133	78%	0.775	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.4	14.9	-179.6	-69.2	-21.5	0	0	0	114	N348 P354	N348-D352 PolarHBondContact O-N 2.8Å; D352-P354 WeakPolarHBondContact O-CD 3.12Å
353	T	47.9	Very low	53.1	Low	96 Å²	96	137.7 Å²	137.7	59%	0.589	71%	0.705	S	S	*	*	S	Bend	trans	-92	108.4	172.9	-56.7	0	0	0	0	109.9	R351 T355	R351-T353 PolarHBondContact O-N 2.9Å; R351-T353 VanDerWaalsContact O-N 3.13Å; T353-T355 PolarHBondContact O-N 2.9Å
354	P	41.7	Very low	50.4	Low	120 Å²	120	135.7 Å²	135.7	78%	0.779	71%	0.711	S	S	*	*			trans	-71	123.3	-173.8	27.2	-34.5	0	0	0	112.6	D352 S356	D352-P354 WeakPolarHBondContact O-CD 3.12Å; P354-S356 PolarHBondContact O-N 3.46Å
355	T	39.9	Very low	48	Very low	143 Å²	143	137.9 Å²	137.9	88%	0.877	72%	0.721	S	S	*	*			trans	-70.5	105.8	179.8	-50.6	0	0	0	0	112.1	T353	T353-T355 PolarHBondContact O-N 2.9Å
356	S	37.6	Very low	45.6	Very low	109 Å²	109	144 Å²	144	76%	0.762	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-77.6	142.2	169.3	56.7	0	0	0	0	112.2	P354	P354-S356 PolarHBondContact O-N 3.46Å
357	L	31.4	Very low	43.1	Very low	163 Å²	163	141.5 Å²	141.5	85%	0.853	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-66.5	158.8	-175.4	-78.6	164.8	0	0	0	114.3
358	P	37.8	Very low	40.9	Very low	118 Å²	118	141.8 Å²	141.8	77%	0.766	74%	0.74	S	S	*	*	P	Polyproline II helix	trans	-78.1	146.4	-170.5	31.6	-36.2	0	0	0	113.6
359	Q	34.3	Very low	38.8	Very low	188 Å²	188	142.6 Å²	142.6	88%	0.879	75%	0.748	S	S	*	*			trans	-104.4	140.9	158.7	-74.7	-172.6	-51.1	0	0	109.9
360	T	31.4	Very low	37	Very low	139 Å²	139	141.5 Å²	141.5	85%	0.853	75%	0.75	S	S	*	*			trans	-68.6	142.9	-174.6	-45.2	0	0	0	0	111.9
361	Y	26.7	Very low	35.6	Very low	219 Å²	219	137.7 Å²	137.7	86%	0.859	75%	0.746	S	S	*	*			trans	-65.9	135.6	177.4	-75.5	-106.6	0	0	0	111.9
362	T	34.5	Very low	34.2	Very low	139 Å²	139	131.8 Å²	131.8	85%	0.853	74%	0.737	S	S	*	*			trans	-115.7	136.2	155.4	51.2	0	0	0	0	108.9
363	E	31.8	Very low	33.2	Very low	205 Å²	205	133 Å²	133	96%	0.958	74%	0.741	S	S	*	*			trans	-88.7	115.2	-168.4	-176.1	166.4	-163.3	0	0	111.3
364	G	27.6	Very low	32.3	Very low	58 Å²	58	135.4 Å²	135.4	60%	0.598	75%	0.75	S	S	*	*			trans	178.8	146.2	178.4	0	0	0	0	0	114.3
365	H	34	Very low	31.8	Very low	161 Å²	161	135.1 Å²	135.1	75%	0.745	75%	0.748	S	S	*	*			trans	47.4	70.1	168.5	-56.7	-61.4	0	0	0	117.2	G367	H365-G367 PolarHBondContact O-N 3.12Å
366	R	33.7	Very low	31.4	Very low	257 Å²	257	134.9 Å²	134.9	97%	0.97	75%	0.747	S	S	*	*	S	Bend	trans	-56.1	96.5	161.3	-72.3	-176.3	178.8	172.8	2.1	110.7
367	G	28.8	Very low	31.2	Very low	25 Å²	25	135.4 Å²	135.4	26%	0.258	75%	0.745	S	S	.	*			trans	142.8	45.4	169.2	0	0	0	0	0	118.5	H365 R684 H685	H365-G367 PolarHBondContact O-N 3.12Å; G367-R684 WeakPolarHBondContact O-CD 3.25Å; G367-R684 PolarHBondContact O-NH1 3.14Å; G367-H685 PolarHBondContact O-CE1 3.44Å
368	S	31	Very low	31.1	Very low	83 Å²	83	133.8 Å²	133.8	58%	0.58	74%	0.737	S	S	*	*			trans	-136.1	94.2	150.5	-161	0	0	0	0	111.3	V370	S368-V370 VanDerWaalsContact C-N 3.27Å; S368-V370 PolarHBondContact O-N 3.16Å
369	T	31.5	Very low	30.8	Very low	101 Å²	101	137.1 Å²	137.1	62%	0.62	74%	0.74	S	S	*	*			trans	-76	84.1	173.4	-18.2	0	0	0	0	108.4	T371 R684	T369-T371 PolarHBondContact O-N 3.49Å; T369-T371 VanDerWaalsContact O-N 3.12Å; T369-R684 PolarHBondContact OG1-NH2 3.33Å
370	V	30.6	Very low	30.6	Very low	109 Å²	109	138 Å²	138	66%	0.661	74%	0.735	S	S	*	*			trans	-63.2	108.2	174.4	177.7	0	0	0	0	108.2	S368 S372	S368-V370 VanDerWaalsContact C-N 3.27Å; S368-V370 PolarHBondContact O-N 3.16Å; V370-S372 PolarHBondContact O-N 2.74Å
371	T	28.6	Very low	30.5	Very low	103 Å²	103	137.4 Å²	137.4	63%	0.632	74%	0.736	S	S	*	*			trans	-91.9	80.1	178.7	47.8	0	0	0	0	110.3	T369	T369-T371 PolarHBondContact O-N 3.49Å; T369-T371 VanDerWaalsContact O-N 3.12Å
372	S	27.7	Very low	30.8	Very low	87 Å²	87	131.8 Å²	131.8	61%	0.608	73%	0.729	S	S	*	*			trans	-123.4	63.6	175.7	61.2	0	0	0	0	111.5	V370 L374	V370-S372 PolarHBondContact O-N 2.74Å; S372-L374 PolarHBondContact O-N 3.23Å
373	I	28.9	Very low	30.6	Very low	169 Å²	169	132 Å²	132	87%	0.867	73%	0.725	S	S	*	*			trans	-87	73.6	162.7	-51.7	178.5	0	0	0	107.4
374	L	29.4	Very low	30.9	Very low	148 Å²	148	128 Å²	128	78%	0.775	72%	0.717	S	S	*	*			trans	-110.8	119.7	163.6	-74.7	176	0	0	0	106.9	S372 T376	S372-L374 PolarHBondContact O-N 3.23Å; L374-T376 PolarHBondContact O-N 3.4Å; L374-T376 VanDerWaalsContact O-N 3.15Å
375	P	30.3	Very low	30.9	Very low	114 Å²	114	135.6 Å²	135.6	74%	0.74	73%	0.729	S	S	*	*			trans	-63.7	115.7	173.3	-20.4	32.6	0	0	0	109.8	V377	P375-V377 PolarHBondContact O-N 3.01Å
376	T	32.1	Very low	30.9	Very low	138 Å²	138	134.6 Å²	134.6	85%	0.847	73%	0.734	S	S	*	*			trans	-63.5	109.4	169.4	-56.4	0	0	0	0	108.3	L374 D378	L374-T376 PolarHBondContact O-N 3.4Å; L374-T376 VanDerWaalsContact O-N 3.15Å; T376-D378 PolarHBondContact O-N 2.87Å
377	V	32.7	Very low	30.5	Very low	120 Å²	120	132.4 Å²	132.4	73%	0.727	73%	0.731	S	S	*	*			trans	-68.3	101.2	177	179.9	0	0	0	0	108.5	P375 K379	P375-V377 PolarHBondContact O-N 3.01Å; V377-K379 PolarHBondContact O-N 3.42Å; V377-K379 VanDerWaalsContact O-N 3.15Å
378	D	29.2	Very low	30.4	Very low	129 Å²	129	135.6 Å²	135.6	69%	0.69	75%	0.75	S	S	*	*			trans	-68	111.1	-178.5	-169.4	0.3	0	0	0	110.7	T376 R380	T376-D378 PolarHBondContact O-N 2.87Å; D378-R380 VanDerWaalsContact C-N 3.27Å; D378-R380 PolarHBondContact O-N 3.36Å
379	K	31.1	Very low	30.2	Very low	187 Å²	187	142.2 Å²	142.2	81%	0.813	76%	0.762	S	S	*	*			trans	-84.3	61.9	-174.1	-72.9	-162.2	173.4	-172.1	0	112.1	V377	V377-K379 PolarHBondContact O-N 3.42Å; V377-K379 VanDerWaalsContact O-N 3.15Å
380	R	31.1	Very low	30.2	Very low	208 Å²	208	145.7 Å²	145.7	79%	0.785	78%	0.775	S	S	*	*			trans	-134.7	40.9	175.6	-72.9	-178.3	-173	-117.7	-3.8	114.7	D378 S382	D378-R380 VanDerWaalsContact C-N 3.27Å; D378-R380 PolarHBondContact O-N 3.36Å; R380-S382 PolarHBondContact O-N 3.17Å
381	S	29.5	Very low	30	Very low	125 Å²	125	145.6 Å²	145.6	87%	0.874	78%	0.779	S	S	*	*			trans	-74.9	93	157	59.1	0	0	0	0	109.9
382	S	31.9	Very low	29.9	Very low	101 Å²	101	146.5 Å²	146.5	71%	0.706	79%	0.79	S	S	*	*			trans	-143.5	127.3	173.8	58	0	0	0	0	110.5	R380	R380-S382 PolarHBondContact O-N 3.17Å
383	D	30.6	Very low	30	Very low	144 Å²	144	148.7 Å²	148.7	77%	0.77	80%	0.8	S	S	*	*			trans	-61.2	148.9	-166.6	-72.4	-78.8	0	0	0	115.9	Y385	D383-Y385 PolarHBondContact O-N 2.71Å
384	P	38.8	Very low	29.7	Very low	122 Å²	122	147.3 Å²	147.3	79%	0.792	79%	0.794	S	S	*	*	S	Bend	trans	-78.1	51.4	-178.6	35.1	-38.2	0	0	0	113.2
385	Y	28	Very low	29.6	Very low	216 Å²	216	151.7 Å²	151.7	85%	0.847	80%	0.8	S	S	*	*			trans	-129.5	20.1	-176	-102.7	-72.5	0	0	0	116.5	D383	D383-Y385 PolarHBondContact O-N 2.71Å
386	V	32.7	Very low	29.2	Very low	141 Å²	141	156.7 Å²	156.7	86%	0.855	81%	0.805	S	S	*	*			trans	-121.8	89.3	166.7	-171.7	0	0	0	0	110.9
387	K	25.4	Very low	29	Very low	210 Å²	210	155.1 Å²	155.1	91%	0.913	80%	0.799	S	S	*	*			trans	-123.4	69.2	176.3	-168.1	179.6	-178.7	177.1	0	111.8
388	S	26.4	Very low	28.4	Very low	93 Å²	93	154.3 Å²	154.3	65%	0.65	80%	0.799	S	S	*	*			trans	-170.2	162.2	158.4	58	0	0	0	0	111.8
389	R	27.2	Very low	28.6	Very low	222 Å²	222	153.8 Å²	153.8	84%	0.838	80%	0.803	S	S	*	*			trans	66.1	74.4	169.1	-45.8	-174.4	-158	-163.5	5.9	118.1
390	I	32.8	Very low	28.3	Very low	174 Å²	174	153 Å²	153	89%	0.892	80%	0.801	S	S	*	*				-132.3	134.8	103.9	-62.1	93.5	0	0	0	106.1
391	S	26.6	Very low	28.2	Very low	106 Å²	106	150.8 Å²	150.8	74%	0.741	80%	0.8	S	S	*	*			trans	-97.8	148.4	175.2	-63.3	0	0	0	0	110.5
392	S	25.7	Very low	27.8	Very low	123 Å²	123	149.2 Å²	149.2	86%	0.86	80%	0.795	S	S	*	*			trans	-58.2	141.4	169.7	-45.5	0	0	0	0	111.4
393	T	29.4	Very low	27.8	Very low	133 Å²	133	154.7 Å²	154.7	82%	0.816	80%	0.801	S	S	*	*			trans	-151.1	132.2	163.3	-60.7	0	0	0	0	108.7
394	D	23.4	Very low	27.6	Very low	140 Å²	140	154.4 Å²	154.4	75%	0.749	80%	0.8	S	S	*	*			trans	-75.4	178	-174.7	-59.8	-84.6	0	0	0	114.7
395	R	26.4	Very low	26.9	Very low	239 Å²	239	156.3 Å²	156.3	90%	0.902	80%	0.798	S	S	*	*			trans	98.8	149.1	158.2	-58.2	176.5	-178.2	-138.2	-2.4	116.5
396	R	22.5	Very low	26.8	Very low	220 Å²	220	154.4 Å²	154.4	83%	0.83	80%	0.797	S	S	*	*			cis	-169.9	163.5	-25.5	-176.2	171.7	-179.2	-129.5	1.2	107.5
397	S	28	Very low	26.6	Very low	104 Å²	104	153.6 Å²	153.6	73%	0.727	80%	0.797	S	S	*	*			trans	71.7	118.3	156	31.5	0	0	0	0	118.6
398	S	20.9	Very low	26.4	Very low	104 Å²	104	151.5 Å²	151.5	73%	0.727	80%	0.795	S	S	*	*			trans	-94.2	151.3	154.8	174.5	0	0	0	0	109.6
399	P	33.1	Very low	26.6	Very low	118 Å²	118	152.6 Å²	152.6	77%	0.766	80%	0.8	S	S	*	*			trans	-100.6	125.4	141.7	33.7	-23.9	0	0	0	109.2
400	E	23.1	Very low	26.4	Very low	169 Å²	169	149.2 Å²	149.2	79%	0.79	80%	0.798	S	S	*	*			cis	78.5	137.4	39.5	-155.7	169.7	-118.8	0	0	113.8
401	Q	29.9	Very low	26.1	Very low	163 Å²	163	152.6 Å²	152.6	76%	0.762	80%	0.8	S	S	*	*			trans	72.3	119.6	-169.9	-51.2	178.4	13	0	0	114.3
402	A	21.9	Very low	26	Very low	91 Å²	91	154.2 Å²	154.2	75%	0.752	81%	0.806	S	S	*	*			cis	80	86	6.8	0	0	0	0	0	118
403	Y	30.3	Very low	26.1	Very low	217 Å²	217	153.4 Å²	153.4	85%	0.851	80%	0.8	S	S	*	*			trans	-154.1	172.8	148.8	-83.7	-78.9	0	0	0	107.4
404	D	27.3	Very low	26	Very low	138 Å²	138	154.4 Å²	154.4	74%	0.738	80%	0.797	S	S	*	*				-168.2	159.4	-64.7	-152.7	-19	0	0	0	104.8
405	H	23.7	Very low	26.1	Very low	162 Å²	162	152.8 Å²	152.8	75%	0.75	79%	0.789	S	S	*	*			trans	-53.6	162	-162.7	-80.9	-87.9	0	0	0	121.3
406	Q	26	Very low	26.2	Very low	176 Å²	176	149.9 Å²	149.9	82%	0.822	79%	0.785	S	S	*	*			trans	76.1	107.8	150.4	-73.6	163.7	61.5	0	0	120.6
407	S	29.3	Very low	26.3	Very low	124 Å²	124	143.3 Å²	143.3	87%	0.867	79%	0.786	S	S	*	*				-177.9	153.9	101.3	40.5	0	0	0	0	112.7
408	L	20.7	Very low	26.4	Very low	166 Å²	166	143.3 Å²	143.3	87%	0.869	79%	0.786	S	S	*	*			trans	-109.6	140.8	178	-116	162.5	0	0	0	109.4
409	P	31.5	Very low	26.5	Very low	116 Å²	116	144.5 Å²	144.5	75%	0.753	78%	0.784	S	S	*	*			trans	-133.4	134.9	150.7	35.4	-22.8	0	0	0	113.1
410	D	21.9	Very low	26.4	Very low	150 Å²	150	148.1 Å²	148.1	80%	0.802	79%	0.788	S	S	*	*			trans	-66.9	136.6	165.5	-66.1	-67.5	0	0	0	111.6
411	R	26.8	Very low	26.4	Very low	245 Å²	245	148.4 Å²	148.4	93%	0.925	79%	0.789	S	S	*	*				-172.7	148.8	109.8	-103.4	171.9	171.9	121	1	113.9
412	T	24.5	Very low	26.2	Very low	141 Å²	141	146.7 Å²	146.7	87%	0.865	79%	0.785	S	S	*	*			trans	-84.4	142	175.7	45.2	0	0	0	0	112.1
413	S	28.1	Very low	26.3	Very low	105 Å²	105	150.9 Å²	150.9	73%	0.734	79%	0.786	S	S	*	*			trans	179.2	111.8	149.2	174	0	0	0	0	112.4
414	M	27	Very low	26	Very low	154 Å²	154	148.7 Å²	148.7	76%	0.759	79%	0.788	S	S	*	*			trans	47.5	143.1	132	-49	-80.4	79.9	0	0	122
415	D	25.6	Very low	25.8	Very low	107 Å²	107	150.7 Å²	150.7	57%	0.572	79%	0.79	S	S	*	*			cis	-162.1	166.4	-29.8	-143.4	-13.8	0	0	0	111.8
416	H	28.3	Very low	25.9	Very low	177 Å²	177	150.1 Å²	150.1	82%	0.819	79%	0.788	S	S	*	*			trans	27	109.5	161	-63.3	-15.6	0	0	0	120.6
417	G	25.6	Very low	25.9	Very low	82 Å²	82	146 Å²	146	85%	0.845	79%	0.792	S	S	*	*			trans	-134.5	145.6	161.2	0	0	0	0	0	111.6
418	S	29.2	Very low	25.6	Very low	105 Å²	105	145.9 Å²	145.9	73%	0.734	78%	0.777	S	S	*	*			trans	-74.7	152.4	-167.8	55.6	0	0	0	0	116.7
419	D	23.9	Very low	26.1	Very low	128 Å²	128	146 Å²	146	68%	0.684	78%	0.778	S	S	*	*			trans	53.3	102.6	150.4	-55.2	-16.1	0	0	0	119.9
420	K	31	Very low	25.8	Very low	195 Å²	195	149.3 Å²	149.3	85%	0.848	78%	0.777	S	S	*	*				-175.8	162.7	106.1	-94.8	155.3	-148.3	84.7	0	114.3
421	E	23.1	Very low	26.2	Very low	175 Å²	175	150.3 Å²	150.3	82%	0.818	78%	0.78	S	S	*	*			trans	-61.5	129.2	174.6	-53.7	171.4	141	0	0	111.8
422	N	25	Very low	26.2	Very low	126 Å²	126	143.3 Å²	143.3	67%	0.674	77%	0.769	S	S	*	*				169	141.6	114.5	-92.4	-75.1	0	0	0	112.7
423	F	24.1	Very low	26.2	Very low	179 Å²	179	141.9 Å²	141.9	79%	0.785	77%	0.765	S	S	*	*			trans	17	107	159.9	-65.4	-91	0	0	0	120.2
424	I	23.8	Very low	26.4	Very low	172 Å²	172	142.2 Å²	142.2	88%	0.882	77%	0.767	S	S	*	*			trans	-129	146.9	141.3	-71.9	-170.6	0	0	0	109.5
425	F	22.7	Very low	26.4	Very low	180 Å²	180	143 Å²	143	79%	0.789	77%	0.773	S	S	*	*			trans	-98.5	-179.6	-174.7	-119.9	-100.8	0	0	0	111.2
426	Q	25.8	Very low	26.7	Very low	149 Å²	149	144.1 Å²	144.1	70%	0.696	79%	0.787	S	S	*	*			trans	71.5	92.6	166.1	-59.8	173.7	13.6	0	0	117.5	F428	Q426-F428 HydrophobicContact CB-CD2 4.04Å; Q426-F428 HydrophobicContact CG-CD2 3.6Å; Q426-F428 HydrophobicContact CG-CE2 3.74Å
427	G	25.3	Very low	26.7	Very low	89 Å²	89	139.2 Å²	139.2	92%	0.918	78%	0.784	S	S	*	*				-92.9	114.1	123.6	0	0	0	0	0	107.8
428	F	24.5	Very low	27	Very low	123 Å²	123	141.3 Å²	141.3	54%	0.539	79%	0.786	S	S	.	*			trans	-106.1	132.7	171.2	-103.3	-71.3	0	0	0	108	Q426 Y430	Q426-F428 HydrophobicContact CB-CD2 4.04Å; Q426-F428 HydrophobicContact CG-CD2 3.6Å; Q426-F428 HydrophobicContact CG-CE2 3.74Å; F428-Y430 HydrophobicContact CB-CD2 4.27Å; F428-Y430 HydrophobicContact CB-CE2 4.43Å; F428-Y430 AromaticContact CD1-CD2 3.64Å; F428-Y430 HydrophobicContact CD1-CD2 3.64Å; F428-Y430 AromaticContact CD1-CE2 3.39Å; F428-Y430 HydrophobicContact CD1-CE2 3.39Å; F428-Y430 HydrophobicContact CD2-CE2 4.32Å; F428-Y430 HydrophobicContact CE1-CD2 4.15Å; F428-Y430 AromaticContact CE1-CE2 3.5Å; F428-Y430 HydrophobicContact CE1-CE2 3.5Å; F428-Y430 AromaticContact CE1-CZ 3.91Å; F428-Y430 HydrophobicContact CE2-CE2 4.41Å; F428-Y430 HydrophobicContact CG-CD2 4.11Å; F428-Y430 AromaticContact CG-CE2 3.85Å; F428-Y430 HydrophobicContact CG-CE2 3.85Å; F428-Y430 HydrophobicContact CZ-CE2 4.03Å
429	D	29.7	Very low	26.8	Very low	169 Å²	169	139.2 Å²	139.2	90%	0.904	78%	0.781	S	S	*	*			trans	-121.5	120.7	150.4	-94.2	-50.6	0	0	0	108.5
430	Y	25.3	Very low	27.2	Very low	184 Å²	184	141 Å²	141	72%	0.722	79%	0.791	S	S	*	*			trans	-91	115.2	-176.9	-97.4	-99.5	0	0	0	110.2	F428	F428-Y430 HydrophobicContact CB-CD2 4.27Å; F428-Y430 HydrophobicContact CB-CE2 4.43Å; F428-Y430 AromaticContact CD1-CD2 3.64Å; F428-Y430 HydrophobicContact CD1-CD2 3.64Å; F428-Y430 AromaticContact CD1-CE2 3.39Å; F428-Y430 HydrophobicContact CD1-CE2 3.39Å; F428-Y430 HydrophobicContact CD2-CE2 4.32Å; F428-Y430 HydrophobicContact CE1-CD2 4.15Å; F428-Y430 AromaticContact CE1-CE2 3.5Å; F428-Y430 HydrophobicContact CE1-CE2 3.5Å; F428-Y430 AromaticContact CE1-CZ 3.91Å; F428-Y430 HydrophobicContact CE2-CE2 4.41Å; F428-Y430 HydrophobicContact CG-CD2 4.11Å; F428-Y430 AromaticContact CG-CE2 3.85Å; F428-Y430 HydrophobicContact CG-CE2 3.85Å; F428-Y430 HydrophobicContact CZ-CE2 4.03Å
431	I	31.4	Very low	27.2	Very low	171 Å²	171	138.7 Å²	138.7	88%	0.877	79%	0.787	S	S	*	*			trans	-123.1	129.3	150.3	-61.5	-175.1	0	0	0	109.5
432	S	26.8	Very low	27.7	Very low	99 Å²	99	137.2 Å²	137.2	69%	0.692	79%	0.789	S	S	*	*			trans	-62.2	137.6	-169.2	-51.1	0	0	0	0	114.8
433	S	25.2	Very low	28	Very low	111 Å²	111	138.1 Å²	138.1	78%	0.776	79%	0.794	S	S	*	*			trans	-11.2	121.6	150.7	55.7	0	0	0	0	118.1
434	S	30.6	Very low	28.4	Very low	111 Å²	111	135.4 Å²	135.4	78%	0.776	80%	0.795	S	S	*	*				-174.5	113.1	123.1	35.5	0	0	0	0	114.4
435	L	28.4	Very low	28.8	Very low	170 Å²	170	132.6 Å²	132.6	89%	0.89	79%	0.785	S	S	*	*			trans	54.8	147.4	159.6	-90.6	61.8	0	0	0	121
436	P	31.8	Very low	29.5	Very low	131 Å²	131	128.9 Å²	128.9	85%	0.851	78%	0.778	S	S	*	*			trans	-88.4	143.6	179.7	35.5	-33.8	0	0	0	113
437	G	28.4	Very low	30.1	Very low	74 Å²	74	126.8 Å²	126.8	76%	0.763	77%	0.768	S	S	*	*			trans	-118	149.8	167.4	0	0	0	0	0	111.7
438	S	30.5	Very low	30.6	Very low	126 Å²	126	128.1 Å²	128.1	88%	0.881	75%	0.745	S	S	*	*			trans	-54	142.9	165.1	-154.9	0	0	0	0	109.5
439	G	26.3	Very low	31.3	Very low	62 Å²	62	125.4 Å²	125.4	64%	0.639	74%	0.741	S	S	*	*			cis	101.2	100	20	0	0	0	0	0	108.7
440	D	32.6	Very low	31.9	Very low	165 Å²	165	126.4 Å²	126.4	88%	0.882	74%	0.74	S	S	*	*			trans	-154.3	152.1	178.3	-127.9	-27.7	0	0	0	109.5
441	L	30.3	Very low	32.9	Very low	146 Å²	146	125.2 Å²	125.2	76%	0.764	74%	0.738	S	S	*	*			trans	-96.8	143.1	-169.7	-85	68.9	0	0	0	113.5
442	V	34.2	Very low	33.2	Very low	144 Å²	144	124.3 Å²	124.3	87%	0.873	74%	0.736	S	S	*	*			trans	-143.5	118.7	153.7	-80.6	0	0	0	0	111.1
443	D	29.9	Very low	33.7	Very low	145 Å²	145	123.5 Å²	123.5	78%	0.775	73%	0.734	S	S	*	*			trans	-85.3	135.8	177	-79.1	-54.3	0	0	0	112.5
444	P	32.9	Very low	34.2	Very low	123 Å²	123	126.4 Å²	126.4	80%	0.799	74%	0.736	S	S	*	*			trans	-89.2	143.1	178	33.2	-33.6	0	0	0	114.7
445	V	32	Very low	34.4	Very low	113 Å²	113	130.1 Å²	130.1	69%	0.685	74%	0.738	S	S	*	*			trans	-133.1	156.5	-176.1	-174.7	0	0	0	0	111.3	I754	V445-I754 HydrophobicContact CG1-CG1 4.32Å
446	T	38.3	Very low	34.6	Very low	102 Å²	102	129.1 Å²	129.1	63%	0.626	73%	0.732	S	S	*	*			trans	-150	-129.4	170.4	-41.7	0	0	0	0	111.6	I754	T446-I754 WeakPolarHBondContact O-CD1 3.41Å; T446-I754 VanDerWaalsContact O-CG1 3.22Å; T446-I754 WeakPolarHBondContact O-CG1 3.33Å
447	E	37.5	Very low	34.4	Very low	104 Å²	104	133.9 Å²	133.9	49%	0.486	74%	0.735	S	S	.	*			trans	-126.9	140.8	176.8	-62.7	-175.5	117.8	0	0	111.8	Q753 I754	E447-Q753 CarbonylContact O-C 3.03Å; E447-Q753 WeakPolarHBondContact O-CA 3.4Å; E447-Q753 PolarHBondContact O-N 3.08Å; E447-I754 VanDerWaalsContact C-N 3.32Å; E447-I754 PolarHBondContact O-N 2.89Å
448	R	35.4	Very low	34.5	Very low	117 Å²	117	135.1 Å²	135.1	44%	0.442	73%	0.732	S	S	.	*			trans	-122.1	122.7	172.5	-170.6	-160.7	-114.3	167.7	4.4	111.1	I754 D756	R448-I754 HydrophobicContact CB-CB 4.12Å; R448-I754 HydrophobicContact CB-CD1 4.35Å; R448-I754 HydrophobicContact CB-CG1 4.42Å; R448-I754 WeakPolarHBondContact CB-O 3.43Å; R448-I754 WeakPolarHBondContact CG-O 3.39Å; R448-I754 PolarHBondContact NE-O 3.36Å; R448-D756 VanDerWaalsContact CZ-N 3.32Å; R448-D756 PolarHBondContact NH1-O 2.91Å; R448-D756 VanDerWaalsContact NH2-N 3.19Å; R448-D756 PolarHBondContact NH2-O 3.04Å
449	C	40.7	Very low	34.5	Very low	67 Å²	67	138.4 Å²	138.4	45%	0.453	73%	0.733	S	S	.	*			trans	-121.4	159.1	170.5	-51.7	0	0	0	0	111.9	D752	C449-D752 VanDerWaalsContact CB-OD1 3.31Å; C449-D752 WeakPolarHBondContact CB-OD1 3.4Å; C449-D752 VanDerWaalsContact CB-OD2 3.3Å; C449-D752 WeakPolarHBondContact CB-OD2 3.29Å; C449-D752 PolarHBondContact N-OD1 3.49Å; C449-D752 PolarHBondContact N-OD2 3.4Å; C449-D752 PolarHBondContact SG-OD1 3.29Å
450	E	40.7	Very low	34.9	Very low	189 Å²	189	139 Å²	139	88%	0.883	73%	0.733	S	S	*	*			trans	-98.4	126.8	174.5	-63.1	174.2	120.4	0	0	108.6
451	K	46.7	Very low	35	Very low	159 Å²	159	141.8 Å²	141.8	69%	0.691	73%	0.731	S	S	*	*			trans	-97.1	116.9	173	-87.7	172.1	169.6	156.4	0	109.7	A453 S751	K451-A453 PolarHBondContact O-N 3.15Å; K451-A453 VanDerWaalsContact O-N 3.13Å; K451-S751 VanDerWaalsContact CE-CB 3.47Å; K451-S751 WeakPolarHBondContact CE-OG 3.23Å; K451-S751 PolarHBondContact NZ-OG 3.07Å
452	D	38	Very low	35.2	Very low	153 Å²	153	141.8 Å²	141.8	82%	0.818	73%	0.731	S	S	*	*			trans	-58	112.1	178.1	-69.9	-55.6	0	0	0	111.8	Q454	D452-Q454 PolarHBondContact O-N 2.86Å
453	A	38.4	Very low	35.2	Very low	81 Å²	81	144.4 Å²	144.4	67%	0.669	73%	0.731	S	S	*	*			trans	-80.1	85.8	-178.4	0	0	0	0	0	111.5	K451 F455	K451-A453 PolarHBondContact O-N 3.15Å; K451-A453 VanDerWaalsContact O-N 3.13Å; A453-F455 WeakPolarHBondContact O-CD2 3.47Å; A453-F455 PolarHBondContact O-N 2.88Å
454	Q	33.8	Very low	35.6	Very low	172 Å²	172	143.4 Å²	143.4	80%	0.804	73%	0.729	S	S	*	*			trans	-71.5	122	171.8	-64.8	-172.7	0.7	0	0	111	D452	D452-Q454 PolarHBondContact O-N 2.86Å
455	F	35.9	Very low	35.4	Very low	189 Å²	189	143.6 Å²	143.6	83%	0.829	72%	0.724	S	S	*	*			trans	-88.1	109.4	178	-72	-91.9	0	0	0	111.1	A453	A453-F455 WeakPolarHBondContact O-CD2 3.47Å; A453-F455 PolarHBondContact O-N 2.88Å
456	I	31.4	Very low	35.5	Very low	149 Å²	149	145.9 Å²	145.9	76%	0.764	73%	0.727	S	S	*	*			trans	-95.1	120.7	171.1	-58.4	176.8	0	0	0	108.8	S458	I456-S458 PolarHBondContact O-N 2.91Å
457	Y	28.8	Very low	35.4	Very low	231 Å²	231	148.9 Å²	148.9	91%	0.906	73%	0.734	S	S	*	*			trans	-72.2	113.3	172.4	-96	-95.8	0	0	0	110.6
458	S	30.3	Very low	35.2	Very low	101 Å²	101	151.9 Å²	151.9	71%	0.706	75%	0.753	S	S	*	*			trans	-106.7	122	169.1	54.8	0	0	0	0	110.8	I456 A460	I456-S458 PolarHBondContact O-N 2.91Å; S458-A460 PolarHBondContact O-N 3.22Å
459	Q	30.3	Very low	35.1	Very low	194 Å²	194	154.2 Å²	154.2	91%	0.907	77%	0.773	S	S	*	*			trans	-78.9	61.7	179.5	-67.3	-171.5	4.3	0	0	112.2	R461	Q459-R461 PolarHBondContact O-N 3.23Å; Q459-R461 VanDerWaalsContact O-N 3.08Å
460	A	34.9	Very low	34.5	Very low	76 Å²	76	154.2 Å²	154.2	63%	0.628	78%	0.784	S	S	*	*			trans	-75.5	93.1	174.7	0	0	0	0	0	110.9	S458 L462	S458-A460 PolarHBondContact O-N 3.22Å; A460-L462 PolarHBondContact O-N 3.15Å; A460-L462 VanDerWaalsContact O-N 3.12Å
461	R	33.9	Very low	34.2	Very low	223 Å²	223	157.5 Å²	157.5	84%	0.842	79%	0.788	S	S	*	*			trans	-62.1	109.5	170.7	-78.7	179.1	167.3	162	-5	110.1	Q459 F463	Q459-R461 PolarHBondContact O-N 3.23Å; Q459-R461 VanDerWaalsContact O-N 3.08Å; R461-F463 PolarHBondContact O-N 3.24Å
462	L	35.6	Very low	33.4	Very low	146 Å²	146	157.9 Å²	157.9	76%	0.764	80%	0.797	S	S	*	*			trans	-80.4	109	177.5	-69	173.6	0	0	0	110.9	A460 V464	A460-L462 PolarHBondContact O-N 3.15Å; A460-L462 VanDerWaalsContact O-N 3.12Å; L462-V464 PolarHBondContact O-N 2.93Å
463	F	34.7	Very low	32.8	Very low	199 Å²	199	156.3 Å²	156.3	87%	0.873	80%	0.798	S	S	*	*			trans	-75.4	118.3	169.6	-75.4	-90.9	0	0	0	110.5	R461	R461-F463 PolarHBondContact O-N 3.24Å
464	V	36.9	Very low	32.9	Very low	123 Å²	123	158.3 Å²	158.3	75%	0.745	80%	0.804	S	S	*	*			trans	-88.3	112.6	174.8	-179.3	0	0	0	0	109.3	L462 Q466	L462-V464 PolarHBondContact O-N 2.93Å; V464-Q466 PolarHBondContact O-N 3.06Å
465	N	29.3	Very low	32.6	Very low	127 Å²	127	162.2 Å²	162.2	68%	0.679	81%	0.811	S	S	*	*			trans	-72.8	120	173.9	-176	-13.2	0	0	0	110.2	Q467	N465-Q467 WeakPolarHBondContact OD1-CG 3.16Å; N465-Q467 PolarHBondContact OD1-N 2.62Å
466	Q	34.5	Very low	32.2	Very low	162 Å²	162	163.4 Å²	163.4	76%	0.757	82%	0.816	S	S	*	*			trans	-87.2	-2.4	-167.7	-57.9	-177.8	4.4	0	0	114.8	V464 N468	V464-Q466 PolarHBondContact O-N 3.06Å; Q466-N468 PolarHBondContact O-N 3.08Å
467	Q	36.2	Very low	31.9	Very low	165 Å²	165	164.5 Å²	164.5	77%	0.771	82%	0.823	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.9	14.6	-164.1	-71.9	-175.6	-23.5	0	0	117.8	N465	N465-Q467 WeakPolarHBondContact OD1-CG 3.16Å; N465-Q467 PolarHBondContact OD1-N 2.62Å
468	N	32.6	Very low	31.9	Very low	166 Å²	166	158.8 Å²	158.8	89%	0.888	82%	0.817	S	S	*	*	T	Hydrogen-bonded Turn	trans	-132.3	32.1	-179	-89.1	-58.2	0	0	0	114.7	Q466	Q466-N468 PolarHBondContact O-N 3.08Å
469	I	34	Very low	31.6	Very low	167 Å²	167	160.1 Å²	160.1	86%	0.856	82%	0.82	S	S	*	*			trans	-101	106.9	166.4	-58	178.4	0	0	0	109
470	G	28.4	Very low	31.3	Very low	66 Å²	66	156.4 Å²	156.4	68%	0.68	81%	0.807	S	S	*	*			trans	125.6	99.2	161.9	0	0	0	0	0	117.2
471	R	34.5	Very low	30.8	Very low	258 Å²	258	162.7 Å²	162.7	97%	0.974	81%	0.814	S	S	*	*			trans	-138.9	134.9	135.9	-73.9	-157.6	175.4	-133.2	-5.1	109.6
472	L	28.3	Very low	30.3	Very low	167 Å²	167	156 Å²	156	87%	0.874	81%	0.814	S	S	*	*			trans	-104.3	155.6	-169	-61.2	160.5	0	0	0	111.5
473	S	27.1	Very low	29.7	Very low	121 Å²	121	152.1 Å²	152.1	85%	0.846	81%	0.81	S	S	*	*				173.2	142.1	124.8	-79.3	0	0	0	0	113.7
474	P	38.9	Very low	29.3	Very low	122 Å²	122	150.8 Å²	150.8	79%	0.792	81%	0.806	S	S	*	*			trans	-102.1	160.8	-177.3	38.9	-35.2	0	0	0	114.6
475	R	27.8	Very low	28.8	Very low	254 Å²	254	151.5 Å²	151.5	96%	0.958	80%	0.801	S	S	*	*			trans	-139.3	160.9	165.2	-76	-163.3	167	-178.4	-4.1	113
476	K	27.4	Very low	29	Very low	214 Å²	214	151.1 Å²	151.1	93%	0.93	81%	0.805	S	S	*	*			trans	-102.7	175.3	-149.7	-62.2	-175.8	177	-175.9	0	115.9
477	L	26	Very low	28.5	Very low	172 Å²	172	148.9 Å²	148.9	90%	0.901	80%	0.803	S	S	*	*			trans	-88.6	153.7	-176.3	-60	164.3	0	0	0	114.7
478	S	27.4	Very low	28	Very low	111 Å²	111	147.5 Å²	147.5	78%	0.776	81%	0.806	S	S	*	*			trans	-162.8	120.4	157.8	53	0	0	0	0	107.7
479	V	24.3	Very low	27.7	Very low	130 Å²	130	146 Å²	146	79%	0.788	80%	0.803	S	S	*	*			cis	92	144.5	44.7	175.5	0	0	0	0	112.8
480	D	25	Very low	27.1	Very low	115 Å²	115	143.5 Å²	143.5	62%	0.615	79%	0.788	S	S	*	*			trans	77.7	147.7	176.2	-90.1	-4.6	0	0	0	119
481	R	23.1	Very low	27.2	Very low	209 Å²	209	147 Å²	147	79%	0.789	80%	0.796	S	S	*	*			cis	-165.1	143.4	-20.2	-161.4	176.9	-78.3	-167.9	4.6	112.6
482	G	23.4	Very low	26.5	Very low	82 Å²	82	145 Å²	145	85%	0.845	79%	0.789	S	S	*	*			trans	73.8	166.6	158.5	0	0	0	0	0	118.1
483	G	23	Very low	26.5	Very low	65 Å²	65	140.4 Å²	140.4	67%	0.67	78%	0.782	S	S	*	*			cis	173.3	164.9	-9.4	0	0	0	0	0	114.8
484	H	27.1	Very low	26.4	Very low	170 Å²	170	144.5 Å²	144.5	79%	0.787	78%	0.784	S	S	*	*			trans	82.9	168.7	164.6	-61.4	-75.8	0	0	0	121.8
485	H	26.6	Very low	25.6	Very low	138 Å²	138	144.5 Å²	144.5	64%	0.639	78%	0.782	S	S	*	*			trans	-165.1	155	-143.8	36.1	-116.3	0	0	0	111.5	T487	H485-T487 HydrophobicContact CB-CG2 4.42Å
486	P	32.8	Very low	25.6	Very low	119 Å²	119	138.3 Å²	138.3	77%	0.773	77%	0.772	S	S	*	*				-147.6	151.5	100	35.3	-17.5	0	0	0	113.9
487	T	24.5	Very low	25.4	Very low	115 Å²	115	134.6 Å²	134.6	71%	0.706	76%	0.763	S	S	*	*			cis	79.1	134.2	28.2	70.4	0	0	0	0	115.8	H485	H485-T487 HydrophobicContact CB-CG2 4.42Å
488	T	25.4	Very low	25.3	Very low	136 Å²	136	133.3 Å²	133.3	83%	0.834	75%	0.752	S	S	*	*			cis	-108.6	-117.8	11.4	50	0	0	0	0	114.2
489	T	27	Very low	25.5	Very low	135 Å²	135	134.6 Å²	134.6	83%	0.828	75%	0.749	S	S	*	*			cis	-145	-168	2.7	-165.9	0	0	0	0	112.7
490	E	21.8	Very low	26.4	Very low	114 Å²	114	134.1 Å²	134.1	53%	0.533	75%	0.749	S	S	.	*			trans	-136	161.3	-158.4	-111.8	-87.2	49.8	0	0	115.7	R492	E490-R492 WeakPolarHBondContact OE2-CD 3.2Å; E490-R492 IonicContact OE2-CZ 3.01Å; E490-R492 IonicContact OE2-NE 3.8Å; E490-R492 IonicContact OE2-NH1 3.25Å; E490-R492 PolarHBondContact OE2-NH1 3.43Å
491	T	30.5	Very low	26.4	Very low	140 Å²	140	131.8 Å²	131.8	86%	0.859	75%	0.752	S	S	*	*			trans	-166	123.6	174.4	-70.9	0	0	0	0	111.9
492	R	20.2	Very low	27	Very low	216 Å²	216	131.2 Å²	131.2	82%	0.815	76%	0.758	S	S	*	*			trans	-157.5	92.6	-156.4	-166.9	156.7	168.5	-171.5	-5.5	117.2	E490	E490-R492 WeakPolarHBondContact OE2-CD 3.2Å; E490-R492 IonicContact OE2-CZ 3.01Å; E490-R492 IonicContact OE2-NE 3.8Å; E490-R492 IonicContact OE2-NH1 3.25Å; E490-R492 PolarHBondContact OE2-NH1 3.43Å
493	G	27.3	Very low	27.3	Very low	71 Å²	71	138.7 Å²	138.7	73%	0.732	76%	0.76	S	S	*	*			trans	-155.4	120.9	166.2	0	0	0	0	0	112.5
494	K	25.7	Very low	27.6	Very low	207 Å²	207	147.5 Å²	147.5	90%	0.9	77%	0.774	S	S	*	*				85.8	139.7	64.4	-80	-171.2	176.6	-169.5	0	113.5
495	V	21.3	Very low	27.9	Very low	122 Å²	122	147.9 Å²	147.9	74%	0.739	78%	0.775	S	S	*	*			cis	164.4	164.9	-28.4	146	0	0	0	0	107.4
496	T	27.1	Very low	28.2	Very low	123 Å²	123	146.9 Å²	146.9	76%	0.755	78%	0.781	S	S	*	*			trans	91.9	151.8	179.3	70.4	0	0	0	0	117.8
497	D	23.4	Very low	28.1	Very low	137 Å²	137	147 Å²	147	73%	0.733	78%	0.782	S	S	*	*			cis	-166.1	161.5	-40.3	-105.6	-29.1	0	0	0	113
498	E	25.3	Very low	28.5	Very low	145 Å²	145	147.1 Å²	147.1	68%	0.678	79%	0.785	S	S	*	*			trans	54.2	121.8	148.2	-66.6	-74.5	81.6	0	0	125.8
499	L	31.4	Very low	28.7	Very low	138 Å²	138	146.4 Å²	146.4	72%	0.723	78%	0.782	S	S	*	*			trans	57.5	173	130.8	-67	-173.6	0	0	0	123.9
500	P	42.8	Very low	29	Very low	119 Å²	119	148.5 Å²	148.5	77%	0.773	79%	0.787	S	S	*	*			cis	-126.9	-168.2	-26.4	27.1	-4.6	0	0	0	113.5
501	G	24.3	Very low	29.5	Very low	66 Å²	66	148.5 Å²	148.5	68%	0.68	80%	0.8	S	S	*	*			trans	-139	174.6	177.7	0	0	0	0	0	116.6
502	H	36.8	Very low	29.8	Very low	197 Å²	197	147.9 Å²	147.9	91%	0.912	80%	0.799	S	S	*	*			trans	-141.9	146.2	-175.9	-74.1	-38.4	0	0	0	115.4
503	R	28.5	Very low	30.3	Very low	239 Å²	239	145.5 Å²	145.5	90%	0.902	80%	0.802	S	S	*	*			trans	-111.7	141.3	165.4	-68.6	174.5	168.8	-179.1	-3.5	109.7
504	R	31	Very low	30.7	Very low	251 Å²	251	146.5 Å²	146.5	95%	0.947	80%	0.803	S	S	*	*			trans	-149.4	178.8	152.4	-72.7	-152.3	174.9	-156	-4.4	111.6
505	H	31.7	Very low	30.8	Very low	177 Å²	177	144 Å²	144	82%	0.819	79%	0.793	S	S	*	*			trans	-105.1	164.6	-148.5	-71.4	-98.1	0	0	0	116
506	P	32.7	Very low	31.2	Very low	117 Å²	117	146.4 Å²	146.4	76%	0.76	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-77.6	166.6	-176.4	31.3	-37.4	0	0	0	115.8
507	P	32.4	Very low	31.2	Very low	121 Å²	121	147.6 Å²	147.6	79%	0.786	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-93	166.2	-167.1	37.1	-37.6	0	0	0	116.2
508	P	31.2	Very low	31.6	Very low	119 Å²	119	150.2 Å²	150.2	77%	0.773	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-92.7	163.9	-175.3	37.3	-37.1	0	0	0	115.5
509	P	30.5	Very low	31.8	Very low	120 Å²	120	151.8 Å²	151.8	78%	0.779	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-92.2	165.6	178.5	37.6	-36.1	0	0	0	114.4
510	L	33.9	Very low	31.2	Very low	179 Å²	179	154.5 Å²	154.5	94%	0.937	82%	0.816	S	S	*	*			trans	-132.6	160.8	169.7	-74.4	174.2	0	0	0	111.3
511	S	31.2	Very low	30.7	Very low	115 Å²	115	155 Å²	155	80%	0.804	82%	0.819	S	S	*	*			trans	-106.9	158.4	-154.1	46.5	0	0	0	0	116
512	P	36.1	Very low	30.8	Very low	127 Å²	127	162.1 Å²	162.1	83%	0.825	83%	0.826	S	S	*	*			trans	-112.3	134.6	-174	37.8	-27.1	0	0	0	114.7
513	N	32.7	Very low	30.5	Very low	165 Å²	165	159.1 Å²	159.1	88%	0.882	82%	0.817	S	S	*	*			trans	-165.2	125.8	143.1	-156.2	0.4	0	0	0	112.7
514	A	33.9	Very low	30.6	Very low	92 Å²	92	151.8 Å²	151.8	76%	0.76	82%	0.816	S	S	*	*			trans	164.8	132.6	154.5	0	0	0	0	0	108.7
515	K	28	Very low	30.4	Very low	156 Å²	156	146.3 Å²	146.3	68%	0.678	81%	0.81	S	S	*	*			trans	-124.8	175.3	171.7	-79.7	-167.6	172.4	-170.3	0	109.6
516	E	29.7	Very low	30.2	Very low	172 Å²	172	144.5 Å²	144.5	80%	0.804	81%	0.811	S	S	*	*			trans	93	114.1	161.3	-66.4	164.3	-158.1	0	0	117.8
517	D	27.8	Very low	29.9	Very low	148 Å²	148	144 Å²	144	79%	0.791	81%	0.81	S	S	*	*			trans	59.4	109.8	142.8	-58.9	3.4	0	0	0	122.3
518	M	31.2	Very low	29.3	Very low	192 Å²	192	148.6 Å²	148.6	95%	0.946	81%	0.812	S	S	*	*			trans	-148.3	142.9	133.4	-103.9	-59.2	169.2	0	0	112
519	H	29.3	Very low	29.2	Very low	177 Å²	177	148.7 Å²	148.7	82%	0.819	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-79.2	156.8	-165.8	-102.4	-97.9	0	0	0	116.4
520	Y	19.8	Very low	28.9	Very low	195 Å²	195	152.7 Å²	152.7	77%	0.765	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-53.1	137	166.3	-79.4	-103.1	0	0	0	114
521	P	32.9	Very low	28.4	Very low	129 Å²	129	150.9 Å²	150.9	84%	0.838	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-83.3	122.9	159.3	32.3	-29.8	0	0	0	110.8
522	R	25.7	Very low	28.3	Very low	217 Å²	217	151 Å²	151	82%	0.819	81%	0.806	S	S	*	*			trans	-104.6	136.8	-178.2	179.7	177.7	179.1	176.8	2.2	111.9
523	D	29.8	Very low	27.7	Very low	134 Å²	134	152.3 Å²	152.3	72%	0.717	81%	0.806	S	S	*	*			trans	39.4	73.8	159.7	-55.1	-39.5	0	0	0	118
524	G	31.7	Very low	27.3	Very low	85 Å²	85	147.9 Å²	147.9	88%	0.876	80%	0.799	S	S	*	*			trans	-100.7	72.7	175.3	0	0	0	0	0	115
525	T	26.2	Very low	27	Very low	135 Å²	135	148.7 Å²	148.7	83%	0.828	80%	0.799	S	S	*	*			trans	-85.8	113.3	168.5	44.2	0	0	0	0	111.5
526	V	27.9	Very low	26.9	Very low	139 Å²	139	150.9 Å²	150.9	84%	0.842	81%	0.809	S	S	*	*			trans	-170.6	154.1	157.1	126.6	0	0	0	0	113
527	S	26.6	Very low	26.8	Very low	106 Å²	106	147.5 Å²	147.5	74%	0.741	81%	0.81	S	S	*	*			trans	57.5	88.3	163.4	-72.3	0	0	0	0	121	S529	S527-S529 PolarHBondContact O-N 3.27Å
528	R	19.4	Very low	26.9	Very low	218 Å²	218	145.3 Å²	145.3	82%	0.823	81%	0.812	S	S	*	*			trans	-42.2	121.9	145.5	172.9	-170.6	-170.1	-172.3	8.7	112.9
529	S	29.3	Very low	26.6	Very low	122 Å²	122	142.8 Å²	142.8	85%	0.853	81%	0.808	S	S	*	*			trans	-79	157.4	159.7	-74.1	0	0	0	0	111.8	S527	S527-S529 PolarHBondContact O-N 3.27Å
530	R	22.8	Very low	27	Very low	203 Å²	203	139 Å²	139	77%	0.766	80%	0.8	S	S	*	*			trans	-130	139.2	-162.2	-143.9	-174.5	-165.4	172.9	4.2	111.3
531	I	24.7	Very low	27.4	Very low	142 Å²	142	138.3 Å²	138.3	73%	0.728	81%	0.808	S	S	*	*			trans	47.8	127.1	162.3	48.5	174	0	0	0	120.9
532	S	28.6	Very low	27.1	Very low	118 Å²	118	137.7 Å²	137.7	83%	0.825	80%	0.802	S	S	*	*			trans	-134.3	124.8	137.2	58.2	0	0	0	0	107.9
533	D	23.8	Very low	27.4	Very low	154 Å²	154	133.3 Å²	133.3	82%	0.824	80%	0.802	S	S	*	*			trans	-75.4	153	-177.6	-72.3	-70	0	0	0	113.3
534	G	24.3	Very low	27.3	Very low	72 Å²	72	132.8 Å²	132.8	74%	0.742	80%	0.803	S	S	*	*			trans	-154.5	2.7	-164.2	0	0	0	0	0	120.7
535	S	27.4	Very low	26.9	Very low	109 Å²	109	139.6 Å²	139.6	76%	0.762	80%	0.803	S	S	*	*			trans	63	128.3	166.9	-69.5	0	0	0	0	121.7
536	K	26.1	Very low	27.1	Very low	202 Å²	202	142.7 Å²	142.7	88%	0.878	81%	0.807	S	S	*	*			trans	66.3	107.5	144.9	-63.6	175.6	-179.7	178.5	0	120.8
537	A	27.2	Very low	26.9	Very low	101 Å²	101	140.8 Å²	140.8	84%	0.835	80%	0.8	S	S	*	*				146.1	154.3	116	0	0	0	0	0	114.1
538	A	29.7	Very low	27.1	Very low	101 Å²	101	143.6 Å²	143.6	84%	0.835	81%	0.806	S	S	*	*			trans	61.8	79.3	169.2	0	0	0	0	0	118.2
539	T	26	Very low	27.3	Very low	139 Å²	139	143.2 Å²	143.2	85%	0.853	81%	0.805	S	S	*	*			trans	-76	176.5	164.4	-3.4	0	0	0	0	112
540	P	36.7	Very low	27.3	Very low	99 Å²	99	144.5 Å²	144.5	64%	0.643	80%	0.802	S	S	*	*				-121.2	-175.6	-115.6	43.3	-28.9	0	0	0	114.9
541	L	29.5	Very low	27.8	Very low	179 Å²	179	143.1 Å²	143.1	94%	0.937	81%	0.808	S	S	*	*			trans	-120.7	126.4	156.7	-72.1	177.2	0	0	0	110.9
542	T	26.7	Very low	28	Very low	117 Å²	117	138.7 Å²	138.7	72%	0.718	80%	0.798	S	S	*	*			trans	-96.9	136.1	-169.2	-33.8	0	0	0	0	111.3
543	P	32	Very low	28.4	Very low	125 Å²	125	139.7 Å²	139.7	81%	0.812	79%	0.794	S	S	*	*			trans	-74.5	145.5	-178.6	30.3	-35.9	0	0	0	112.7
544	T	27.2	Very low	29.5	Very low	122 Å²	122	136.7 Å²	136.7	75%	0.748	78%	0.778	S	S	*	*			trans	-123.8	114	-178.6	-64.1	0	0	0	0	112.7
545	R	23.8	Very low	30.7	Very low	229 Å²	229	137 Å²	137	86%	0.864	77%	0.769	S	S	*	*			trans	41.4	107.1	156.9	-66.7	-178.8	169.9	-174.7	-2.9	119.3
546	H	30.1	Very low	32.1	Very low	200 Å²	200	136.8 Å²	136.8	93%	0.926	76%	0.756	S	S	*	*			trans	-114.1	130.1	134.1	-73.2	-74.6	0	0	0	109
547	S	23.3	Very low	33.5	Very low	98 Å²	98	133.6 Å²	133.6	69%	0.685	74%	0.742	S	S	*	*			trans	-163.9	113.1	175.6	-177.3	0	0	0	0	111.2
548	L	30.5	Very low	34.7	Very low	165 Å²	165	136.5 Å²	136.5	86%	0.864	73%	0.731	S	S	*	*			trans	173.4	91.4	163.4	-97.2	153.2	0	0	0	104.6
549	R	24.8	Very low	36.1	Very low	211 Å²	211	138.3 Å²	138.3	80%	0.796	72%	0.72	S	S	*	*				56.4	96.9	79.5	-66.6	-168.2	177	-165.8	-0.3	113.7
550	N	28.7	Very low	37.8	Very low	148 Å²	148	140.6 Å²	140.6	79%	0.791	71%	0.713	S	S	*	*				164	112.4	115.2	-81.8	-11.6	0	0	0	112
551	L	33	Very low	38.3	Very low	174 Å²	174	142.7 Å²	142.7	91%	0.911	71%	0.714	S	S	*	*				178.7	130.9	123.7	-119.8	64.5	0	0	0	111.6
552	G	28.2	Very low	39.4	Very low	49 Å²	49	139.9 Å²	139.9	51%	0.505	70%	0.697	S	S	.	*			trans	-92.4	-172.9	146.4	0	0	0	0	0	109.5
553	D	36.8	Very low	41.2	Very low	140 Å²	140	140 Å²	140	75%	0.749	69%	0.687	S	S	*	*			cis	-142.1	100.2	4.4	-74.9	-56.3	0	0	0	110.2
554	D	47.5	Very low	42.6	Very low	90 Å²	90	138.4 Å²	138.4	48%	0.481	68%	0.675	S	S	.	*	S	Bend	trans	-127.7	-2.9	-179.6	-149.8	39.9	0	0	0	113.1	R558	D554-R558 PolarHBondContact O-N 3.34Å; D554-R558 IonicContact OD2-NH1 2.66Å; D554-R558 PolarHBondContact OD2-NH1 3.32Å
555	S	49.2	Very low	43.8	Very low	78 Å²	78	138.8 Å²	138.8	55%	0.545	67%	0.666	S	S	.	*	H	α-helix	trans	-74.8	-41.4	177.7	49.8	0	0	0	0	112.9	R558 K559	S555-R558 PolarHBondContact O-N 2.76Å; S555-K559 PolarHBondContact O-N 3.48Å
556	E	56.6	Low	45.2	Very low	105 Å²	105	131.1 Å²	131.1	49%	0.491	64%	0.643	S	S	.	*	H	α-helix	trans	-67.1	-37.2	178	-86.5	-62.8	115.8	0	0	112.6	K559 R560	E556-K559 PolarHBondContact O-N 2.73Å; E556-R560 PolarHBondContact O-N 3.14Å
557	K	56.5	Low	46.6	Very low	136 Å²	136	126.2 Å²	126.2	59%	0.591	62%	0.623	S	S	*	*	H	α-helix	trans	-62.7	-47	173.5	-71.8	179.1	-178.5	169.8	0	111.2	R560 Q561	K557-R560 PolarHBondContact O-N 3.15Å; K557-Q561 WeakPolarHBondContact O-CG 3.48Å; K557-Q561 PolarHBondContact O-N 2.8Å
558	R	51.9	Low	48.4	Very low	161 Å²	161	128.4 Å²	128.4	61%	0.608	62%	0.623	S	S	*	*	H	α-helix	trans	-59.5	-45.1	173.1	-86.9	-173.1	168.1	84	-2	112.4	D554 S555 R560 Q561 Q562	D554-R558 PolarHBondContact O-N 3.34Å; D554-R558 IonicContact OD2-NH1 2.66Å; D554-R558 PolarHBondContact OD2-NH1 3.32Å; S555-R558 PolarHBondContact O-N 2.76Å; R558-R560 PolarHBondContact O-N 2.86Å; R558-Q561 PolarHBondContact O-N 3.5Å; R558-Q562 VanDerWaalsContact O-CB 3.31Å; R558-Q562 WeakPolarHBondContact O-CB 3.44Å; R558-Q562 PolarHBondContact O-N 2.99Å
559	K	59.8	Low	49.7	Very low	140 Å²	140	125 Å²	125	61%	0.609	60%	0.601	S	S	*	*	H	α-helix	trans	-59.3	-43.1	176.4	-91.6	-174.9	171.8	-177.6	0	113	S555 E556 Q562 K563	S555-K559 PolarHBondContact O-N 3.48Å; E556-K559 PolarHBondContact O-N 2.73Å; K559-Q562 PolarHBondContact O-N 3.1Å; K559-K563 WeakPolarHBondContact O-CB 3.26Å; K559-K563 PolarHBondContact O-N 2.94Å
560	R	60.2	Low	51.4	Low	187 Å²	187	121.5 Å²	121.5	71%	0.706	59%	0.588	S	S	*	*	H	α-helix	trans	-66.5	-43.6	177.7	-76.5	-178.6	172.3	-110.2	0.2	112.1	E556 K557 R558 K563 V564	E556-R560 PolarHBondContact O-N 3.14Å; K557-R560 PolarHBondContact O-N 3.15Å; R558-R560 PolarHBondContact O-N 2.86Å; R560-K563 PolarHBondContact O-N 3.36Å; R560-V564 WeakPolarHBondContact O-CG2 3.25Å; R560-V564 PolarHBondContact O-N 2.84Å; R560-V564 VanDerWaalsContact O-N 3.16Å
561	Q	48.7	Very low	52.9	Low	142 Å²	142	117.4 Å²	117.4	66%	0.664	57%	0.566	S	S	*	*	H	α-helix	trans	-63.2	-43.2	174.9	-72.6	177.1	-12.2	0	0	111.8	K557 R558 V564 F565	K557-Q561 WeakPolarHBondContact O-CG 3.48Å; K557-Q561 PolarHBondContact O-N 2.8Å; R558-Q561 PolarHBondContact O-N 3.5Å; Q561-V564 PolarHBondContact O-N 3.43Å; Q561-F565 WeakPolarHBondContact O-CB 3.23Å; Q561-F565 PolarHBondContact O-N 3.09Å
562	Q	52.4	Low	54.4	Low	121 Å²	121	114.3 Å²	114.3	57%	0.565	57%	0.565	S	S	*	*	H	α-helix	trans	-67	-40	178.2	-175.1	167.7	0.4	0	0	112.3	R558 K559 V564 F565 D566	R558-Q562 VanDerWaalsContact O-CB 3.31Å; R558-Q562 WeakPolarHBondContact O-CB 3.44Å; R558-Q562 PolarHBondContact O-N 2.99Å; K559-Q562 PolarHBondContact O-N 3.1Å; Q562-V564 PolarHBondContact O-N 2.82Å; Q562-F565 CarbonylContact O-C 3.55Å; Q562-F565 WeakPolarHBondContact O-CB 3.07Å; Q562-F565 PolarHBondContact O-N 2.97Å; Q562-F565 VanDerWaalsContact O-N 3.17Å; Q562-D566 PolarHBondContact O-N 2.9Å
563	K	64.4	Low	56	Low	119 Å²	119	119.2 Å²	119.2	52%	0.517	58%	0.58	S	S	.	*	H	α-helix	trans	-64.6	-40.4	176.5	-162.6	-167.4	-175.7	-61.6	0	112.2	K559 R560 F565 D566 D567	K559-K563 WeakPolarHBondContact O-CB 3.26Å; K559-K563 PolarHBondContact O-N 2.94Å; R560-K563 PolarHBondContact O-N 3.36Å; K563-F565 VanDerWaalsContact C-N 3.28Å; K563-F565 PolarHBondContact O-N 3.38Å; K563-D566 PolarHBondContact O-N 3.35Å; K563-D567 IonicContact NZ-OD1 3.77Å; K563-D567 PolarHBondContact NZ-OD1 2.91Å; K563-D567 IonicContact NZ-OD2 2.68Å; K563-D567 PolarHBondContact NZ-OD2 2.79Å; K563-D567 WeakPolarHBondContact O-CB 3.44Å; K563-D567 PolarHBondContact O-N 3.36Å
564	V	61.1	Low	56.6	Low	91 Å²	91	114 Å²	114	55%	0.552	56%	0.559	S	S	*	*	H	α-helix	trans	-61.1	-40.4	173.9	173.5	0	0	0	0	110.6	R560 Q561 Q562 D567 E568	R560-V564 WeakPolarHBondContact O-CG2 3.25Å; R560-V564 PolarHBondContact O-N 2.84Å; R560-V564 VanDerWaalsContact O-N 3.16Å; Q561-V564 PolarHBondContact O-N 3.43Å; Q562-V564 PolarHBondContact O-N 2.82Å; V564-D567 PolarHBondContact O-N 2.92Å; V564-E568 VanDerWaalsContact O-CB 3.22Å; V564-E568 WeakPolarHBondContact O-CB 3.47Å; V564-E568 PolarHBondContact O-N 2.85Å
565	F	51.9	Low	56.9	Low	130 Å²	130	115.7 Å²	115.7	57%	0.57	56%	0.564	S	S	*	*	H	α-helix	trans	-65.3	-39.2	175.2	-169.9	-90.5	0	0	0	113.2	Q561 Q562 K563 F569	Q561-F565 WeakPolarHBondContact O-CB 3.23Å; Q561-F565 PolarHBondContact O-N 3.09Å; Q562-F565 CarbonylContact O-C 3.55Å; Q562-F565 WeakPolarHBondContact O-CB 3.07Å; Q562-F565 PolarHBondContact O-N 2.97Å; Q562-F565 VanDerWaalsContact O-N 3.17Å; K563-F565 VanDerWaalsContact C-N 3.28Å; K563-F565 PolarHBondContact O-N 3.38Å; F565-F569 HydrophobicContact CD2-CE2 4.32Å; F565-F569 HydrophobicContact CE2-CD2 4.48Å; F565-F569 HydrophobicContact CE2-CE2 4.13Å
566	D	52.7	Low	56.7	Low	69 Å²	69	116.2 Å²	116.2	37%	0.369	57%	0.565	S	S	.	*	H	α-helix	trans	-70.5	-34.6	175.8	-72.7	-43	0	0	0	112.5	Q562 K563 R570	Q562-D566 PolarHBondContact O-N 2.9Å; K563-D566 PolarHBondContact O-N 3.35Å; D566-R570 WeakPolarHBondContact O-CD 3.47Å; D566-R570 WeakPolarHBondContact O-CG 3.3Å
567	D	60.7	Low	56.4	Low	96 Å²	96	116.5 Å²	116.5	51%	0.513	57%	0.568	S	S	.	*	H	α-helix	trans	-76.9	-33.5	177.8	-67.3	-24.5	0	0	0	112	K563 V564	K563-D567 IonicContact NZ-OD1 3.77Å; K563-D567 PolarHBondContact NZ-OD1 2.91Å; K563-D567 IonicContact NZ-OD2 2.68Å; K563-D567 PolarHBondContact NZ-OD2 2.79Å; K563-D567 WeakPolarHBondContact O-CB 3.44Å; K563-D567 PolarHBondContact O-N 3.36Å; V564-D567 PolarHBondContact O-N 2.92Å
568	E	60.8	Low	55.8	Low	145 Å²	145	115.5 Å²	115.5	68%	0.678	58%	0.576	S	S	*	*	H	α-helix	trans	-76.6	-26.2	-174.8	-174.1	169.6	-134.8	0	0	114	V564	V564-E568 VanDerWaalsContact O-CB 3.22Å; V564-E568 WeakPolarHBondContact O-CB 3.47Å; V564-E568 PolarHBondContact O-N 2.85Å
569	F	57.2	Low	55.5	Low	94 Å²	94	114.8 Å²	114.8	41%	0.412	58%	0.583	S	S	.	*	S	Bend	trans	-103.2	3	-177.4	-74.7	-88.5	0	0	0	114.8	F565 P576 M577	F565-F569 HydrophobicContact CD2-CE2 4.32Å; F565-F569 HydrophobicContact CE2-CD2 4.48Å; F565-F569 HydrophobicContact CE2-CE2 4.13Å; F569-P576 WeakPolarHBondContact O-CA 3.4Å; F569-M577 PolarHBondContact O-N 3.36Å
570	R	60.7	Low	54.6	Low	137 Å²	137	112.6 Å²	112.6	52%	0.517	58%	0.578	S	S	.	*	B	Isolated β-bridge	trans	-111.9	145.5	176.2	-69.3	179.1	-174.6	-105.4	3.5	111.8	D566 G574 E575	D566-R570 WeakPolarHBondContact O-CD 3.47Å; D566-R570 WeakPolarHBondContact O-CG 3.3Å; R570-G574 WeakPolarHBondContact CD-O 3.33Å; R570-G574 PolarHBondContact NH1-O 3.05Å; R570-E575 CarbonylContact C-O 3.59Å; R570-E575 WeakPolarHBondContact CA-O 3.27Å
571	N	60.1	Low	53.9	Low	62 Å²	62	109.6 Å²	109.6	33%	0.332	58%	0.583	S	S	.	*			trans	-80.8	175.6	169.7	65.6	42.6	0	0	0	111.8	N573 G574 E575 M577	N571-N573 PolarHBondContact O-N 2.9Å; N571-N573 PolarHBondContact OD1-N 3.29Å; N571-G574 PolarHBondContact O-N 3.4Å; N571-G574 PolarHBondContact OD1-N 3.46Å; N571-E575 VanDerWaalsContact CG-O 3.3Å; N571-E575 PolarHBondContact N-O 3.12Å; N571-E575 PolarHBondContact ND2-O 3.08Å; N571-E575 PolarHBondContact OD1-N 3.39Å; N571-M577 HydrophobicContact CB-CG 4.15Å; N571-M577 HydrophobicContact CB-SD 3.84Å
572	A	65.4	Low	53.1	Low	108 Å²	108	113.2 Å²	113.2	89%	0.893	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.4	-16.8	-176.8	0	0	0	0	0	115.1
573	N	62.3	Low	52.2	Low	153 Å²	153	115.5 Å²	115.5	82%	0.818	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.9	2.6	176.3	-63.5	-8.2	0	0	0	112.6	N571	N571-N573 PolarHBondContact O-N 2.9Å; N571-N573 PolarHBondContact OD1-N 3.29Å
574	G	47.8	Very low	50.6	Low	29 Å²	29	115.6 Å²	115.6	30%	0.299	61%	0.611	S	S	.	*	S	Bend	trans	86.6	-0.2	179.7	0	0	0	0	0	115.2	R570 N571	R570-G574 WeakPolarHBondContact CD-O 3.33Å; R570-G574 PolarHBondContact NH1-O 3.05Å; N571-G574 PolarHBondContact O-N 3.4Å; N571-G574 PolarHBondContact OD1-N 3.46Å
575	E	54.2	Low	49.3	Very low	126 Å²	126	118 Å²	118	59%	0.589	62%	0.621	S	S	*	*	P	Polyproline II helix	trans	-82.2	143.9	179.3	-76.1	-64.9	121.4	0	0	111.8	R570 N571	R570-E575 CarbonylContact C-O 3.59Å; R570-E575 WeakPolarHBondContact CA-O 3.27Å; N571-E575 VanDerWaalsContact CG-O 3.3Å; N571-E575 PolarHBondContact N-O 3.12Å; N571-E575 PolarHBondContact ND2-O 3.08Å; N571-E575 PolarHBondContact OD1-N 3.39Å
576	P	46.3	Very low	48.4	Very low	89 Å²	89	117.1 Å²	117.1	58%	0.578	63%	0.626	S	S	*	*	B	Isolated β-bridge	trans	-70.7	136.8	-179.1	29.7	-34.3	0	0	0	112	F569	F569-P576 WeakPolarHBondContact O-CA 3.4Å
577	M	48.8	Very low	47.2	Very low	111 Å²	111	122.6 Å²	122.6	55%	0.547	65%	0.65	S	S	.	*	P	Polyproline II helix	trans	-78.8	134.8	179.5	-75.7	-66.7	-71.1	0	0	112.2	F569 N571	F569-M577 PolarHBondContact O-N 3.36Å; N571-M577 HydrophobicContact CB-CG 4.15Å; N571-M577 HydrophobicContact CB-SD 3.84Å
578	P	43.8	Very low	45.8	Very low	116 Å²	116	126.3 Å²	126.3	75%	0.753	66%	0.661	S	S	*	*	P	Polyproline II helix	trans	-71.7	141.7	179.9	28.8	-34.5	0	0	0	112.3
579	L	46.6	Very low	44.2	Very low	146 Å²	146	127.1 Å²	127.1	76%	0.764	67%	0.67	S	S	*	*	P	Polyproline II helix	trans	-79.9	126	-176.3	-64.5	167.1	0	0	0	112.1	P581	L579-P581 WeakPolarHBondContact O-CD 3.46Å
580	D	39.8	Very low	43	Very low	93 Å²	93	132.2 Å²	132.2	50%	0.497	69%	0.688	S	S	.	*	P	Polyproline II helix	trans	-80.2	117.9	172	176.8	9.3	0	0	0	111.2	R582	D580-R582 PolarHBondContact O-N 3.4Å; D580-R582 WeakPolarHBondContact OD1-CB 3.48Å; D580-R582 PolarHBondContact OD1-N 3.07Å
581	P	46.1	Very low	41.6	Very low	125 Å²	125	128.5 Å²	128.5	81%	0.812	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.1	-9	-179.9	-20.7	34.3	0	0	0	115.5	L579 K583	L579-P581 WeakPolarHBondContact O-CD 3.46Å; P581-K583 VanDerWaalsContact C-N 3.32Å; P581-K583 PolarHBondContact O-N 3.21Å
582	R	32.8	Very low	40.1	Very low	218 Å²	218	133.2 Å²	133.2	82%	0.823	72%	0.717	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82	2.3	-172.4	-68.9	-166.4	175.2	86.3	-3	115.9	D580	D580-R582 PolarHBondContact O-N 3.4Å; D580-R582 WeakPolarHBondContact OD1-CB 3.48Å; D580-R582 PolarHBondContact OD1-N 3.07Å
583	K	33.9	Very low	38.5	Very low	168 Å²	168	135.4 Å²	135.4	73%	0.73	71%	0.712	S	S	*	*	S	Bend	trans	-109.2	121.2	174.2	-67.2	-179.9	-177.6	175.3	0	110.6	P581 N585	P581-K583 VanDerWaalsContact C-N 3.32Å; P581-K583 PolarHBondContact O-N 3.21Å; K583-N585 PolarHBondContact O-N 3.35Å
584	P	29.6	Very low	36.9	Very low	121 Å²	121	133.3 Å²	133.3	79%	0.786	71%	0.707	S	S	*	*			trans	-66.6	121.7	176.1	27.6	-33.1	0	0	0	109.7	T586	P584-T586 PolarHBondContact O-N 2.79Å
585	N	33.3	Very low	35.9	Very low	141 Å²	141	138.5 Å²	138.5	75%	0.754	72%	0.724	S	S	*	*			trans	-82.1	107	-173.5	-167.7	-5.8	0	0	0	111.4	K583 Q587	K583-N585 PolarHBondContact O-N 3.35Å; N585-Q587 PolarHBondContact O-N 3.49Å
586	T	32.6	Very low	35.3	Very low	112 Å²	112	138.5 Å²	138.5	69%	0.687	73%	0.734	S	S	*	*			trans	-76.2	110	-178.1	-49.6	0	0	0	0	111.6	P584	P584-T586 PolarHBondContact O-N 2.79Å
587	Q	29	Very low	34.9	Very low	185 Å²	185	140.2 Å²	140.2	86%	0.864	74%	0.738	S	S	*	*			trans	34.9	85.2	162.1	-68	-170.1	-25.5	0	0	117.4	N585	N585-Q587 PolarHBondContact O-N 3.49Å
588	F	30.6	Very low	34.3	Very low	173 Å²	173	143.3 Å²	143.3	76%	0.759	75%	0.752	S	S	*	*			trans	-96.7	122.6	154.3	-91.9	-89.8	0	0	0	111.3	Y590	F588-Y590 PolarHBondContact O-N 3.09Å; F588-Y590 VanDerWaalsContact O-N 3.13Å
589	N	26.7	Very low	33.9	Very low	162 Å²	162	144.6 Å²	144.6	87%	0.866	74%	0.743	S	S	*	*			trans	-82.1	87	-172.6	-174.8	18.8	0	0	0	110.9	G591	N589-G591 PolarHBondContact O-N 3.13Å; N589-G591 VanDerWaalsContact O-N 3.1Å
590	Y	33	Very low	33.9	Very low	201 Å²	201	142.5 Å²	142.5	79%	0.788	73%	0.732	S	S	*	*			trans	-65.9	109.4	174.3	-87.4	-84.4	0	0	0	111	F588	F588-Y590 PolarHBondContact O-N 3.09Å; F588-Y590 VanDerWaalsContact O-N 3.13Å
591	G	30.6	Very low	33.9	Very low	60 Å²	60	146.4 Å²	146.4	62%	0.619	74%	0.741	S	S	*	*			trans	-56.1	140.5	163.6	0	0	0	0	0	110.3	N589 L593	N589-G591 PolarHBondContact O-N 3.13Å; N589-G591 VanDerWaalsContact O-N 3.1Å; G591-L593 PolarHBondContact O-N 2.75Å
592	I	29.6	Very low	34	Very low	161 Å²	161	146.7 Å²	146.7	83%	0.826	74%	0.735	S	S	*	*			trans	-57.8	106.8	-171.5	-59.6	161.4	0	0	0	110.4
593	L	31.6	Very low	34.9	Very low	153 Å²	153	138.7 Å²	138.7	80%	0.801	72%	0.715	S	S	*	*	P	Polyproline II helix	trans	-72.7	121	155.7	-72.3	175.7	0	0	0	106.9	G591 H595	G591-L593 PolarHBondContact O-N 2.75Å; L593-H595 PolarHBondContact O-N 2.95Å
594	P	28.5	Very low	35.6	Very low	109 Å²	109	134.7 Å²	134.7	71%	0.708	70%	0.699	S	S	*	*	P	Polyproline II helix	trans	-69.5	124.9	-174.1	27.1	-33.7	0	0	0	110.5
595	H	27.8	Very low	36.3	Very low	139 Å²	139	131.5 Å²	131.5	64%	0.644	68%	0.683	S	S	*	*	P	Polyproline II helix	trans	-62.7	131	165.3	-126.5	-89	0	0	0	108.2	L593 D597 E598	L593-H595 PolarHBondContact O-N 2.95Å; H595-D597 IonicContact CE1-OD2 3.8Å; H595-D597 IonicContact ND1-OD2 2.76Å; H595-D597 PolarHBondContact ND1-OD2 3.47Å; H595-D597 PolarHBondContact O-N 3.4Å; H595-E598 PolarHBondContact O-N 3.36Å
596	P	40.2	Very low	37.2	Very low	125 Å²	125	130.9 Å²	130.9	81%	0.812	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.8	-1.9	-172.8	27.5	-35.4	0	0	0	114.6
597	D	38.6	Very low	38.2	Very low	125 Å²	125	134.1 Å²	134.1	67%	0.668	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.1	-12.7	-174.1	-49.3	-72.2	0	0	0	114.1	H595 Y599	H595-D597 IonicContact CE1-OD2 3.8Å; H595-D597 IonicContact ND1-OD2 2.76Å; H595-D597 PolarHBondContact ND1-OD2 3.47Å; H595-D597 PolarHBondContact O-N 3.4Å; D597-Y599 VanDerWaalsContact C-N 3.32Å; D597-Y599 PolarHBondContact O-N 3.07Å
598	E	36.1	Very low	39	Very low	176 Å²	176	132.4 Å²	132.4	82%	0.822	67%	0.672	S	S	*	*			trans	-82.7	70.5	-179.2	-69.1	-159.3	175	0	0	112.9	H595 N600	H595-E598 PolarHBondContact O-N 3.36Å; E598-N600 PolarHBondContact O-N 3.36Å; E598-N600 VanDerWaalsContact O-N 3.11Å
599	Y	34.4	Very low	39.3	Very low	144 Å²	144	130.4 Å²	130.4	57%	0.565	66%	0.663	S	S	*	*			trans	-65.2	109.1	171	-157.6	-95.1	0	0	0	110.5	D597 Y601	D597-Y599 VanDerWaalsContact C-N 3.32Å; D597-Y599 PolarHBondContact O-N 3.07Å; Y599-Y601 VanDerWaalsContact C-N 3.35Å; Y599-Y601 HydrophobicContact CD1-CE2 4.47Å; Y599-Y601 WeakPolarHBondContact O-CD2 3.41Å; Y599-Y601 PolarHBondContact O-N 3.02Å
600	N	48.3	Very low	39.7	Very low	102 Å²	102	127.4 Å²	127.4	55%	0.545	65%	0.653	S	S	.	*			trans	-76.8	80.3	-172.8	-173	-8.4	0	0	0	112.5	E598 L602 A603	E598-N600 PolarHBondContact O-N 3.36Å; E598-N600 VanDerWaalsContact O-N 3.11Å; N600-L602 PolarHBondContact O-N 3.25Å; N600-L602 VanDerWaalsContact O-N 3.07Å; N600-L602 PolarHBondContact OD1-N 3.12Å; N600-A603 HydrophobicContact CB-CB 4.35Å; N600-A603 PolarHBondContact O-N 2.92Å; N600-A603 PolarHBondContact OD1-N 3.09Å
601	Y	39.3	Very low	39.9	Very low	175 Å²	175	123.4 Å²	123.4	69%	0.686	65%	0.654	S	S	*	*	H	α-helix	trans	-50.9	-30.5	179.6	-76.9	-84.4	0	0	0	114.6	Y599 E604 A605	Y599-Y601 VanDerWaalsContact C-N 3.35Å; Y599-Y601 HydrophobicContact CD1-CE2 4.47Å; Y599-Y601 WeakPolarHBondContact O-CD2 3.41Å; Y599-Y601 PolarHBondContact O-N 3.02Å; Y601-E604 PolarHBondContact O-N 3.49Å; Y601-A605 VanDerWaalsContact O-CB 3.29Å; Y601-A605 WeakPolarHBondContact O-CB 3.48Å; Y601-A605 PolarHBondContact O-N 2.92Å
602	L	48.3	Very low	40.2	Very low	131 Å²	131	124.7 Å²	124.7	69%	0.686	65%	0.646	S	S	*	*	H	α-helix	trans	-68.8	-38.6	178.7	-66.2	174.1	0	0	0	111.9	N600 E604 A605 E606	N600-L602 PolarHBondContact O-N 3.25Å; N600-L602 VanDerWaalsContact O-N 3.07Å; N600-L602 PolarHBondContact OD1-N 3.12Å; L602-E604 VanDerWaalsContact C-N 3.26Å; L602-E604 PolarHBondContact O-N 3.19Å; L602-A605 PolarHBondContact O-N 3.27Å; L602-E606 PolarHBondContact O-N 3.36Å; L602-E606 VanDerWaalsContact O-N 3.15Å
603	A	50.6	Low	40.4	Very low	49 Å²	49	123.2 Å²	123.2	41%	0.405	64%	0.64	S	S	.	*	H	α-helix	trans	-71.9	-17.4	180	0	0	0	0	0	113.7	N600	N600-A603 HydrophobicContact CB-CB 4.35Å; N600-A603 PolarHBondContact O-N 2.92Å; N600-A603 PolarHBondContact OD1-N 3.09Å
604	E	49.7	Very low	40.3	Very low	84 Å²	84	125.3 Å²	125.3	39%	0.393	64%	0.643	S	S	.	*	H	α-helix	trans	-92.9	-37.8	170.3	-166.2	170.1	-123.9	0	0	111.7	Y601 L602 E606 K607 Q608	Y601-E604 PolarHBondContact O-N 3.49Å; L602-E604 VanDerWaalsContact C-N 3.26Å; L602-E604 PolarHBondContact O-N 3.19Å; E604-E606 VanDerWaalsContact C-N 3.27Å; E604-E606 PolarHBondContact O-N 3.12Å; E604-K607 WeakPolarHBondContact O-CB 3.48Å; E604-K607 PolarHBondContact O-N 3.35Å; E604-Q608 WeakPolarHBondContact O-CG 3.4Å; E604-Q608 PolarHBondContact O-N 3.21Å; E604-Q608 VanDerWaalsContact O-N 3.1Å
605	A	43.2	Very low	40.8	Very low	54 Å²	54	124.6 Å²	124.6	45%	0.446	65%	0.646	S	S	.	*	H	α-helix	trans	-59.8	-32.9	175.9	0	0	0	0	0	113.3	Y601 L602 Q608	Y601-A605 VanDerWaalsContact O-CB 3.29Å; Y601-A605 WeakPolarHBondContact O-CB 3.48Å; Y601-A605 PolarHBondContact O-N 2.92Å; L602-A605 PolarHBondContact O-N 3.27Å; A605-Q608 PolarHBondContact O-N 3.33Å
606	E	52.4	Low	41.3	Very low	128 Å²	128	122.1 Å²	122.1	60%	0.598	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.6	-30.6	173.2	-65.3	-135.8	103	0	0	113.4	L602 E604 Q608 K609	L602-E606 PolarHBondContact O-N 3.36Å; L602-E606 VanDerWaalsContact O-N 3.15Å; E604-E606 VanDerWaalsContact C-N 3.27Å; E604-E606 PolarHBondContact O-N 3.12Å; E606-Q608 VanDerWaalsContact C-N 3.29Å; E606-K609 PolarHBondContact O-N 2.97Å; E606-K609 IonicContact OE1-NZ 2.76Å; E606-K609 PolarHBondContact OE1-NZ 3.34Å
607	K	54.9	Low	41	Very low	181 Å²	181	123.2 Å²	123.2	79%	0.787	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.5	-19.2	174.8	-63.6	176.5	-175.6	176.7	0	113	E604	E604-K607 WeakPolarHBondContact O-CB 3.48Å; E604-K607 PolarHBondContact O-N 3.35Å
608	Q	44.8	Very low	40.5	Very low	148 Å²	148	126 Å²	126	69%	0.692	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.7	-1.1	177.1	-68.6	-80.6	-11.1	0	0	113.1	E604 A605 E606 P610	E604-Q608 WeakPolarHBondContact O-CG 3.4Å; E604-Q608 PolarHBondContact O-N 3.21Å; E604-Q608 VanDerWaalsContact O-N 3.1Å; A605-Q608 PolarHBondContact O-N 3.33Å; E606-Q608 VanDerWaalsContact C-N 3.29Å; Q608-P610 VanDerWaalsContact O-CD 3.31Å; Q608-P610 WeakPolarHBondContact O-CD 3.5Å
609	K	36.4	Very low	40.3	Very low	131 Å²	131	122.3 Å²	122.3	57%	0.57	65%	0.646	S	S	*	*	S	Bend	trans	-74.4	116.5	170.6	-67.8	173.3	-177.1	173	0	109.2	E606 S611	E606-K609 PolarHBondContact O-N 2.97Å; E606-K609 IonicContact OE1-NZ 2.76Å; E606-K609 PolarHBondContact OE1-NZ 3.34Å; K609-S611 PolarHBondContact O-N 2.67Å
610	P	35.9	Very low	40	Very low	99 Å²	99	125.7 Å²	125.7	64%	0.643	66%	0.659	S	S	*	*			trans	-64.3	136.7	167.6	28.5	-33.6	0	0	0	109.2	Q608 I612	Q608-P610 VanDerWaalsContact O-CD 3.31Å; Q608-P610 WeakPolarHBondContact O-CD 3.5Å; P610-I612 HydrophobicContact CB-CG1 4.28Å; P610-I612 HydrophobicContact CG-CD1 4.1Å; P610-I612 HydrophobicContact CG-CG1 4.21Å; P610-I612 PolarHBondContact O-N 3.47Å
611	S	37.1	Very low	39.3	Very low	117 Å²	117	126 Å²	126	82%	0.818	66%	0.661	S	S	*	*			trans	-74.3	81.6	171.1	-173.6	0	0	0	0	109.1	K609 D613	K609-S611 PolarHBondContact O-N 2.67Å; S611-D613 PolarHBondContact O-N 2.97Å
612	I	36.8	Very low	38.7	Very low	88 Å²	88	124.2 Å²	124.2	45%	0.451	67%	0.674	S	S	.	*			trans	-77.7	113.2	176	-75.3	175.2	0	0	0	109.1	P610 F614	P610-I612 HydrophobicContact CB-CG1 4.28Å; P610-I612 HydrophobicContact CG-CD1 4.1Å; P610-I612 HydrophobicContact CG-CG1 4.21Å; P610-I612 PolarHBondContact O-N 3.47Å; I612-F614 HydrophobicContact CB-CE2 4.48Å; I612-F614 HydrophobicContact CG2-CD2 4Å; I612-F614 HydrophobicContact CG2-CE2 4.04Å; I612-F614 HydrophobicContact CG2-CG 4.41Å; I612-F614 HydrophobicContact CG2-CZ 4.48Å; I612-F614 WeakPolarHBondContact O-CD2 3.15Å; I612-F614 PolarHBondContact O-N 3.47Å
613	D	34.1	Very low	38	Very low	130 Å²	130	122.1 Å²	122.1	70%	0.695	67%	0.67	S	S	*	*			trans	-69.6	107.4	165.4	-70.9	-46.2	0	0	0	108.6	S611 A615	S611-D613 PolarHBondContact O-N 2.97Å; D613-A615 PolarHBondContact O-N 2.8Å
614	F	29.4	Very low	37	Very low	197 Å²	197	128.1 Å²	128.1	86%	0.864	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.4	30.9	-172.1	-98.4	-83.7	0	0	0	115.1	I612	I612-F614 HydrophobicContact CB-CE2 4.48Å; I612-F614 HydrophobicContact CG2-CD2 4Å; I612-F614 HydrophobicContact CG2-CE2 4.04Å; I612-F614 HydrophobicContact CG2-CG 4.41Å; I612-F614 HydrophobicContact CG2-CZ 4.48Å; I612-F614 WeakPolarHBondContact O-CD2 3.15Å; I612-F614 PolarHBondContact O-N 3.47Å
615	A	37.6	Very low	36	Very low	94 Å²	94	134.4 Å²	134.4	78%	0.777	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.2	-3.8	-178.5	0	0	0	0	0	114.3	D613	D613-A615 PolarHBondContact O-N 2.8Å
616	S	39.9	Very low	35.1	Very low	87 Å²	87	135.5 Å²	135.5	61%	0.608	73%	0.733	S	S	*	*	S	Bend	trans	-128	-3.7	-159.7	-54.9	0	0	0	0	117.5
617	E	32.2	Very low	34.1	Very low	148 Å²	148	138.4 Å²	138.4	69%	0.692	74%	0.743	S	S	*	*	S	Bend	trans	-110.2	20.1	-177	-64.3	-155.1	163.5	0	0	115.1
618	L	29.6	Very low	32.8	Very low	184 Å²	184	136.3 Å²	136.3	96%	0.963	75%	0.746	S	S	*	*	S	Bend	trans	-109.3	54.3	166	-69.6	-179.3	0	0	0	111.6
619	S	31.7	Very low	32	Very low	97 Å²	97	134.4 Å²	134.4	68%	0.678	75%	0.749	S	S	*	*			trans	-149.7	42.8	174.9	59.7	0	0	0	0	113.6	D621	S619-D621 VanDerWaalsContact C-N 3.3Å; S619-D621 PolarHBondContact O-N 3.1Å
620	Y	28.7	Very low	31.5	Very low	216 Å²	216	137.2 Å²	137.2	85%	0.847	76%	0.764	S	S	*	*			trans	-76.7	83.7	169.7	-96	-78	0	0	0	112.4
621	D	32.5	Very low	31.1	Very low	109 Å²	109	135.9 Å²	135.9	58%	0.583	77%	0.768	S	S	*	*			trans	60.2	80.3	136.3	-157.2	0.5	0	0	0	119.1	S619 S623	S619-D621 VanDerWaalsContact C-N 3.3Å; S619-D621 PolarHBondContact O-N 3.1Å; D621-S623 WeakPolarHBondContact OD1-CA 3.21Å; D621-S623 VanDerWaalsContact OD1-CB 3.27Å; D621-S623 WeakPolarHBondContact OD1-CB 3.43Å; D621-S623 PolarHBondContact OD1-N 3.44Å; D621-S623 PolarHBondContact OD1-OG 3.43Å
622	S	27.8	Very low	30.7	Very low	136 Å²	136	136 Å²	136	95%	0.951	77%	0.769	S	S	*	*			trans	-104.1	62.4	147.3	-71.5	0	0	0	0	110.2
623	S	33.3	Very low	30.3	Very low	87 Å²	87	137.8 Å²	137.8	61%	0.608	79%	0.788	S	S	*	*			trans	-115.6	22	-179.1	76.7	0	0	0	0	115.3	D621 Y625	D621-S623 WeakPolarHBondContact OD1-CA 3.21Å; D621-S623 VanDerWaalsContact OD1-CB 3.27Å; D621-S623 WeakPolarHBondContact OD1-CB 3.43Å; D621-S623 PolarHBondContact OD1-N 3.44Å; D621-S623 PolarHBondContact OD1-OG 3.43Å; S623-Y625 PolarHBondContact O-N 2.9Å
624	L	28.6	Very low	30.1	Very low	176 Å²	176	143.1 Å²	143.1	92%	0.921	80%	0.799	S	S	*	*			trans	-72.9	45.2	177.1	-155.8	80.8	0	0	0	114.3
625	Y	29.8	Very low	30.3	Very low	216 Å²	216	143.5 Å²	143.5	85%	0.847	80%	0.8	S	S	*	*			trans	-139.7	88.8	170.8	-106.5	-77.2	0	0	0	110.5	S623	S623-Y625 PolarHBondContact O-N 2.9Å
626	G	23.8	Very low	29.7	Very low	77 Å²	77	147.7 Å²	147.7	79%	0.794	80%	0.803	S	S	*	*			trans	-73.5	135.7	179.9	0	0	0	0	0	113.2
627	K	32	Very low	29.1	Very low	188 Å²	188	149 Å²	149	82%	0.817	81%	0.809	S	S	*	*			trans	-134.6	109.2	165.2	-71.3	-171.2	178.2	176.2	0	111.7
628	T	27.3	Very low	29	Very low	138 Å²	138	147.4 Å²	147.4	85%	0.847	81%	0.812	S	S	*	*			trans	20.7	129.5	152	54.6	0	0	0	0	120.4
629	S	26.9	Very low	29.2	Very low	108 Å²	108	146.7 Å²	146.7	76%	0.755	81%	0.808	S	S	*	*			trans	-61.3	148.2	165.6	58.8	0	0	0	0	114.4
630	Q	27.5	Very low	28.9	Very low	189 Å²	189	150.1 Å²	150.1	88%	0.883	81%	0.81	S	S	*	*			trans	145.3	124.2	148	-82.7	-64.6	-16.9	0	0	109
631	G	27.4	Very low	28.8	Very low	71 Å²	71	148.6 Å²	148.6	73%	0.732	81%	0.81	S	S	*	*			trans	164.9	70.5	-174.8	0	0	0	0	0	114.6
632	S	28.4	Very low	28.5	Very low	119 Å²	119	152.5 Å²	152.5	83%	0.832	82%	0.819	S	S	*	*			trans	-53.8	142.4	-178.8	-175.5	0	0	0	0	113.9	R634	S632-R634 PolarHBondContact O-N 3.34Å
633	C	27.7	Very low	28.4	Very low	126 Å²	126	151.4 Å²	151.4	85%	0.851	80%	0.802	S	S	*	*			trans	-61.3	102.5	-175.8	-54.3	0	0	0	0	113
634	R	30.3	Very low	28.1	Very low	243 Å²	243	155.1 Å²	155.1	92%	0.917	81%	0.807	S	S	*	*			trans	-89.6	113.4	172.2	-151.5	173.3	-168.7	-179.5	3.2	110	S632 Q636	S632-R634 PolarHBondContact O-N 3.34Å; R634-Q636 PolarHBondContact O-N 3.01Å
635	K	32.5	Very low	28.5	Very low	204 Å²	204	157.8 Å²	157.8	89%	0.887	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-59.3	126.1	-174	-61.5	176	-178.9	176.4	0	112.1
636	Q	25.7	Very low	28.3	Very low	182 Å²	182	155.5 Å²	155.5	85%	0.85	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-80.3	143	154.1	-70.2	-174	-7.1	0	0	109.4	R634	R634-Q636 PolarHBondContact O-N 3.01Å
637	P	28.3	Very low	28.6	Very low	114 Å²	114	156.2 Å²	156.2	74%	0.74	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-78.9	155.4	178.9	32.3	-34.8	0	0	0	112.2
638	P	28.7	Very low	28.4	Very low	116 Å²	116	155.8 Å²	155.8	75%	0.753	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-82.7	122.2	-174.9	-4.5	23.1	0	0	0	111.9	K640	P638-K640 PolarHBondContact O-N 2.9Å
639	I	33.6	Very low	28.4	Very low	169 Å²	169	158.4 Å²	158.4	87%	0.867	79%	0.785	S	S	*	*			trans	-75.3	112.8	167.6	-61	175.5	0	0	0	108.3
640	K	25.7	Very low	28.5	Very low	168 Å²	168	158.3 Å²	158.3	73%	0.73	78%	0.784	S	S	*	*			trans	-99.7	130.1	168.2	-65.6	-178.2	179.4	-178.7	0	109.2	P638	P638-K640 PolarHBondContact O-N 2.9Å
641	H	26.9	Very low	29	Very low	184 Å²	184	157.2 Å²	157.2	85%	0.852	78%	0.784	S	S	*	*			trans	-142.1	154.4	156.6	-129	-94	0	0	0	110.8
642	Y	26.3	Very low	29.1	Very low	192 Å²	192	162.9 Å²	162.9	75%	0.753	79%	0.788	S	S	*	*			trans	-100.5	162.1	-154.9	-84	-89	0	0	0	116.3
643	D	26.6	Very low	29.8	Very low	113 Å²	113	162.2 Å²	162.2	60%	0.604	78%	0.781	S	S	*	*			trans	-12.3	146.3	154.9	-82.5	-86.8	0	0	0	121.1
644	K	26.7	Very low	30.2	Very low	164 Å²	164	164.7 Å²	164.7	71%	0.713	78%	0.78	S	S	*	*			trans	57.3	93.2	138.1	-62.8	166.3	-173.4	157.6	0	120.2
645	Y	36.2	Very low	30.2	Very low	233 Å²	233	164 Å²	164	91%	0.914	78%	0.777	S	S	*	*				-139.7	130.9	119.5	-75.5	-80.7	0	0	0	106.1
646	K	26.8	Very low	30	Very low	168 Å²	168	162.5 Å²	162.5	73%	0.73	77%	0.773	S	S	*	*			cis	75.5	111.7	25.2	-99.8	-71	173.6	-179.6	0	115.7
647	D	28.8	Very low	30.8	Very low	92 Å²	92	159.8 Å²	159.8	49%	0.492	77%	0.772	S	S	.	*			trans	79.1	106.4	157	-81.3	27	0	0	0	122
648	K	27.5	Very low	31.9	Very low	179 Å²	179	159.6 Å²	159.6	78%	0.778	77%	0.77	S	S	*	*				90.4	150.9	121.3	-71	170	179.7	146.3	0	122.1
649	K	28.8	Very low	32.4	Very low	193 Å²	193	159.9 Å²	159.9	84%	0.839	77%	0.772	S	S	*	*			trans	74.2	98.3	162.1	-73.3	-179	177.9	-174.5	0	119.1
650	S	28.8	Very low	32.9	Very low	106 Å²	106	157.3 Å²	157.3	74%	0.741	77%	0.766	S	S	*	*			trans	-2.1	134.8	130.6	54.9	0	0	0	0	118.9
651	D	36.4	Very low	33.2	Very low	166 Å²	166	157.6 Å²	157.6	89%	0.888	77%	0.77	S	S	*	*			trans	-148.3	170.3	137.1	-117.7	-37	0	0	0	113.1
652	K	30	Very low	34	Very low	189 Å²	189	153.6 Å²	153.6	82%	0.822	76%	0.76	S	S	*	*			trans	-135.4	173.8	179.7	-86	-177.6	178.5	178.2	0	108.5
653	P	44.5	Very low	34.6	Very low	105 Å²	105	151.2 Å²	151.2	68%	0.682	76%	0.759	S	S	*	*			cis	-130	176	-34	37.7	-23.5	0	0	0	111.9
654	H	35.8	Very low	35.1	Very low	178 Å²	178	152.5 Å²	152.5	82%	0.824	77%	0.766	S	S	*	*			trans	-162.8	-173.6	145.3	-109.8	-45.8	0	0	0	115.4
655	R	29.7	Very low	35.7	Very low	228 Å²	228	151.7 Å²	151.7	86%	0.86	77%	0.765	S	S	*	*			trans	-86.8	165.1	-152.6	-67.9	169.4	172.3	167.6	-4	117.2
656	H	28.8	Very low	35.7	Very low	173 Å²	173	146 Å²	146	80%	0.801	75%	0.75	S	S	*	*			trans	-61.3	173.8	163.1	-70	-66.8	0	0	0	114.4
657	P	41.5	Very low	36	Very low	126 Å²	126	143.1 Å²	143.1	82%	0.818	74%	0.739	S	S	*	*			cis	-138.1	172.4	22.1	37	-14.6	0	0	0	120.9
658	P	52.8	Low	36.3	Very low	110 Å²	110	142.3 Å²	142.3	71%	0.714	74%	0.738	S	S	*	*			trans	-132.3	-175.5	-165.9	44.7	-27.2	0	0	0	117.9
659	P	38	Very low	36.5	Very low	122 Å²	122	139.7 Å²	139.7	79%	0.792	73%	0.726	S	S	*	*			trans	-117.6	179.6	-175.3	42.4	-31.4	0	0	0	117.8
660	P	43.4	Very low	36.5	Very low	115 Å²	115	135.2 Å²	135.2	75%	0.747	70%	0.704	S	S	*	*			trans	-135.1	-169.2	-169.9	40.4	-20.2	0	0	0	118.1
661	Q	33.9	Very low	36.6	Very low	174 Å²	174	131.9 Å²	131.9	81%	0.813	68%	0.678	S	S	*	*			trans	82.4	155.4	165.2	-56.1	-92.6	5.9	0	0	118.8
662	P	42.6	Very low	36.6	Very low	99 Å²	99	125.7 Å²	125.7	64%	0.643	65%	0.645	S	S	*	*			cis	-143.8	-173.5	-48.5	41	-22.7	0	0	0	118.7
663	I	39.5	Very low	36.9	Very low	142 Å²	142	121.4 Å²	121.4	73%	0.728	63%	0.631	S	S	*	*			trans	120.6	156.8	155.6	-138	164.9	0	0	0	122.7	Y768	I663-Y768 HydrophobicContact CD1-CE2 3.95Å
664	D	36.7	Very low	36.7	Very low	140 Å²	140	123.2 Å²	123.2	75%	0.749	63%	0.628	S	S	*	*			trans	-160.1	-171.1	176.1	-152.9	-167.1	0	0	0	110.8
665	H	40	Very low	36.7	Very low	148 Å²	148	119.1 Å²	119.1	69%	0.685	62%	0.617	S	S	*	*			cis	-144.6	-138.2	9.9	-152.7	56.1	0	0	0	111.6
666	D	34.5	Very low	37.1	Very low	112 Å²	112	111.9 Å²	111.9	60%	0.599	60%	0.602	S	S	*	*			cis	-151.1	-125.8	1.7	-179.2	58.8	0	0	0	115
667	Q	34.3	Very low	37.7	Very low	109 Å²	109	107.9 Å²	107.9	51%	0.509	59%	0.591	S	S	.	*			trans	-143.4	-163.6	-152.5	-60.2	171.4	80.2	0	0	116.7	K669	Q667-K669 PolarHBondContact O-NZ 3.31Å
668	T	33.9	Very low	37.4	Very low	75 Å²	75	105.1 Å²	105.1	46%	0.46	57%	0.566	S	S	.	*				-154.4	-105.6	74.1	-28.2	0	0	0	0	113.7	K1026	T668-K1026 WeakPolarHBondContact O-CE 3.4Å; T668-K1026 PolarHBondContact O-NZ 2.83Å
669	K	33	Very low	36.5	Very low	123 Å²	123	102.4 Å²	102.4	54%	0.535	55%	0.545	S	S	.	.			cis	-153.7	-178.7	-7.7	-103.4	100.9	-163.7	158.3	0	110.1	Q667 H915	Q667-K669 PolarHBondContact O-NZ 3.31Å; K669-H915 HydrophobicContact CB-CB 4.23Å; K669-H915 HydrophobicContact CG-CB 4.01Å
670	R	29.4	Very low	36.4	Very low	99 Å²	99	100.1 Å²	100.1	37%	0.374	53%	0.526	S	S	.	.			trans	-137.7	-140.2	-175.8	-68.8	-175.6	-71.9	154.2	-4.2	114.3	D672 T912 G913 T914 H915	R670-D672 WeakPolarHBondContact CB-OD2 3.39Å; R670-D672 WeakPolarHBondContact CD-OD1 3.26Å; R670-D672 VanDerWaalsContact CD-OD2 3.28Å; R670-D672 WeakPolarHBondContact CD-OD2 3.22Å; R670-D672 IonicContact CZ-OD1 3.05Å; R670-D672 IonicContact CZ-OD2 2.65Å; R670-D672 IonicContact NE-OD1 2.98Å; R670-D672 IonicContact NE-OD2 2.77Å; R670-D672 PolarHBondContact NE-OD2 3.3Å; R670-D672 VanDerWaalsContact NE-OD2 3.12Å; R670-D672 IonicContact NH1-OD1 3.84Å; R670-D672 PolarHBondContact NH1-OD1 3.02Å; R670-D672 IonicContact NH1-OD2 2.7Å; R670-D672 PolarHBondContact NH1-OD2 3.39Å; R670-D672 IonicContact NH2-OD2 3.15Å; R670-T912 CarbonylContact C-O 3.58Å; R670-G913 CarbonylContact O-C 3.55Å; R670-G913 WeakPolarHBondContact O-CA 3.37Å; R670-T914 PolarHBondContact O-N 3.12Å; R670-H915 VanDerWaalsContact C-CA 3.5Å; R670-H915 HydrophobicContact CB-CB 4.29Å; R670-H915 VanDerWaalsContact CB-CD2 3.46Å; R670-H915 WeakPolarHBondContact CB-CD2 3.5Å; R670-H915 PolarHBondContact N-CD2 3.45Å; R670-H915 VanDerWaalsContact N-CD2 3.29Å; R670-H915 PolarHBondContact NE-CD2 3.32Å; R670-H915 PolarHBondContact NE-NE2 3.41Å; R670-H915 PolarHBondContact NH2-CE1 2.78Å; R670-H915 PolarHBondContact NH2-NE2 2.88Å; R670-H915 VanDerWaalsContact NH2-NE2 3.16Å; R670-H915 PolarHBondContact O-N 3.16Å
671	L	30.7	Very low	35.9	Very low	36 Å²	36	100 Å²	100	19%	0.188	51%	0.511	C	S	.	.			cis	-101.7	151.8	10.5	-53.4	69.7	0	0	0	112.5	S909 T912 T914 H915 P916	L671-S909 CarbonylContact O-C 3.04Å; L671-S909 WeakPolarHBondContact O-CA 3.45Å; L671-T912 WeakPolarHBondContact CD1-O 3.49Å; L671-T912 WeakPolarHBondContact CD1-OG1 3.41Å; L671-T912 PolarHBondContact N-O 3.02Å; L671-T914 WeakPolarHBondContact CD1-OG1 3.44Å; L671-H915 VanDerWaalsContact CD1-N 3.29Å; L671-P916 HydrophobicContact CB-CG 3.82Å; L671-P916 HydrophobicContact CD2-CB 3.86Å; L671-P916 HydrophobicContact CD2-CG 3.96Å; L671-P916 HydrophobicContact CG-CB 3.94Å; L671-P916 HydrophobicContact CG-CG 3.64Å
672	D	35.9	Very low	35.9	Very low	36 Å²	36	99.5 Å²	99.5	19%	0.193	50%	0.501	C	S	.	.			cis	67.5	164.3	35.5	-36.8	-60.8	0	0	0	114.7	R670 P916	R670-D672 WeakPolarHBondContact CB-OD2 3.39Å; R670-D672 WeakPolarHBondContact CD-OD1 3.26Å; R670-D672 VanDerWaalsContact CD-OD2 3.28Å; R670-D672 WeakPolarHBondContact CD-OD2 3.22Å; R670-D672 IonicContact CZ-OD1 3.05Å; R670-D672 IonicContact CZ-OD2 2.65Å; R670-D672 IonicContact NE-OD1 2.98Å; R670-D672 IonicContact NE-OD2 2.77Å; R670-D672 PolarHBondContact NE-OD2 3.3Å; R670-D672 VanDerWaalsContact NE-OD2 3.12Å; R670-D672 IonicContact NH1-OD1 3.84Å; R670-D672 PolarHBondContact NH1-OD1 3.02Å; R670-D672 IonicContact NH1-OD2 2.7Å; R670-D672 PolarHBondContact NH1-OD2 3.39Å; R670-D672 IonicContact NH2-OD2 3.15Å; D672-P916 HydrophobicContact CB-CG 3.69Å; D672-P916 VanDerWaalsContact OD2-CD 3.23Å; D672-P916 WeakPolarHBondContact OD2-CD 3.3Å
673	D	37	Very low	35.5	Very low	99 Å²	99	99.2 Å²	99.2	53%	0.529	50%	0.502	S	S	.	.			cis	-157.9	-172.2	-7.3	-140.6	-16.4	0	0	0	107.1
674	K	38.8	Very low	35.3	Very low	144 Å²	144	98.2 Å²	98.2	63%	0.626	49%	0.489	S	S	*	.			cis	-144.9	-139	0.4	-134	-42.5	151.8	-66.3	0	107.7
675	P	36.5	Very low	35.2	Very low	91 Å²	91	97.8 Å²	97.8	59%	0.591	48%	0.483	S	S	*	.			cis	-104.5	-138.7	-10.1	29.6	-5.9	0	0	0	111.2
676	S	39.1	Very low	34.7	Very low	77 Å²	77	94 Å²	94	54%	0.538	48%	0.484	S	S	.	.			cis	-163.8	-164	3.6	-143.3	0	0	0	0	107.7
677	P	39.5	Very low	34.7	Very low	89 Å²	89	95.3 Å²	95.3	58%	0.578	49%	0.489	S	S	*	.			cis	-129.1	-132.9	-14.8	42.2	-21.7	0	0	0	112.8	L927	P677-L927 HydrophobicContact CB-CD2 4.47Å
678	K	35.2	Very low	34.6	Very low	67 Å²	67	96.5 Å²	96.5	29%	0.291	50%	0.503	S	S	.	.			trans	-156.6	172.4	-178.9	-65.8	-175	-176.9	-178.6	0	110.7	M924 N925 L927 F929	K678-M924 VanDerWaalsContact CE-O 3.23Å; K678-M924 WeakPolarHBondContact CE-O 3.24Å; K678-M924 PolarHBondContact NZ-O 3.48Å; K678-N925 PolarHBondContact NZ-OD1 3.38Å; K678-L927 HydrophobicContact CB-CD2 3.99Å; K678-L927 HydrophobicContact CD-CD1 4.39Å; K678-L927 HydrophobicContact CD-CD2 4.07Å; K678-L927 HydrophobicContact CG-CD2 3.87Å; K678-F929 HydrophobicContact CB-CZ 4.37Å
679	L	34	Very low	34.7	Very low	54 Å²	54	99.1 Å²	99.1	28%	0.283	53%	0.525	S	S	.	.			cis	-171.4	-164.6	-29.3	-94	166.3	0	0	0	107.7	R681 L959	L679-R681 VanDerWaalsContact CD2-NH2 3.33Å; L679-L959 HydrophobicContact CD2-CD1 4.41Å
680	D	37.3	Very low	35.2	Very low	73 Å²	73	96.8 Å²	96.8	39%	0.39	54%	0.536	S	S	.	.			cis	-146.8	-157.5	10.3	-134.9	83.1	0	0	0	111.6	L948 Q956	D680-L948 WeakPolarHBondContact O-CD1 3.45Å; D680-Q956 WeakPolarHBondContact O-CB 3.29Å; D680-Q956 VanDerWaalsContact O-CD 3.28Å; D680-Q956 WeakPolarHBondContact O-CG 3.47Å; D680-Q956 PolarHBondContact O-OE1 3.06Å; D680-Q956 VanDerWaalsContact O-OE1 3.12Å
681	R	32.3	Very low	35.3	Very low	113 Å²	113	99.9 Å²	99.9	43%	0.426	56%	0.56	S	S	.	*				-145.1	-175.2	-129.8	-39.9	177	170	90.5	-2.5	123.8	L679 Q956	L679-R681 VanDerWaalsContact CD2-NH2 3.33Å; R681-Q956 VanDerWaalsContact CG-NE2 3.29Å
682	R	34.5	Very low	35.4	Very low	163 Å²	163	106.7 Å²	106.7	62%	0.615	59%	0.59	S	S	*	*			trans	89.1	161.3	149.1	-73.6	169.2	177.1	179.7	-1.7	120.4
683	S	33.7	Very low	35.3	Very low	94 Å²	94	112.3 Å²	112.3	66%	0.657	62%	0.621	S	S	*	*			cis	-174.5	-178.3	-14.3	-92.2	0	0	0	0	110
684	R	34.9	Very low	34.7	Very low	120 Å²	120	117.3 Å²	117.3	45%	0.453	63%	0.633	S	S	.	*			cis	-167.7	163.6	-2.5	-122.4	-169.2	-129.5	-70.2	-1.3	112.2	G367 T369	G367-R684 WeakPolarHBondContact O-CD 3.25Å; G367-R684 PolarHBondContact O-NH1 3.14Å; T369-R684 PolarHBondContact OG1-NH2 3.33Å
685	H	34.7	Very low	34.4	Very low	132 Å²	132	121.2 Å²	121.2	61%	0.611	65%	0.646	S	S	*	*			trans	56.5	169.2	155.7	-76.2	40.1	0	0	0	122.5	G367	G367-H685 PolarHBondContact O-CE1 3.44Å
686	G	30.6	Very low	33.9	Very low	69 Å²	69	122 Å²	122	71%	0.711	65%	0.649	S	S	*	*			cis	126.5	139.9	-8.3	0	0	0	0	0	115.3
687	I	33.3	Very low	33.3	Very low	138 Å²	138	125.2 Å²	125.2	71%	0.708	66%	0.66	S	S	*	*			cis	-132	-123	1.1	-36.1	-179.3	0	0	0	112.7
688	V	31.9	Very low	32.7	Very low	134 Å²	134	127.1 Å²	127.1	81%	0.812	67%	0.67	S	S	*	*			cis	-158.5	-169	7.9	-142.9	0	0	0	0	111.8
689	S	35.7	Very low	32.4	Very low	130 Å²	130	129.9 Å²	129.9	91%	0.909	70%	0.695	S	S	*	*			trans	-138.2	170.1	-174.2	-53.8	0	0	0	0	117.8
690	G	43.9	Very low	32.1	Very low	74 Å²	74	130.8 Å²	130.8	76%	0.763	72%	0.717	S	S	*	*			trans	-168	174.1	173.3	0	0	0	0	0	115.2
691	D	32.7	Very low	32.1	Very low	165 Å²	165	133 Å²	133	88%	0.882	74%	0.738	S	S	*	*			trans	-98.3	167.6	-158.6	-66.9	-57	0	0	0	119.6
692	E	32.3	Very low	31.8	Very low	178 Å²	178	130.9 Å²	130.9	83%	0.832	75%	0.752	S	S	*	*			trans	-10.7	134.7	169.6	-68.2	-70.5	129.8	0	0	120
693	N	33.7	Very low	31.7	Very low	155 Å²	155	129.1 Å²	129.1	83%	0.829	76%	0.761	S	S	*	*			trans	-155.1	155.1	157.1	-118.9	-73.3	0	0	0	113.3
694	Y	23.4	Very low	31.6	Very low	203 Å²	203	130.9 Å²	130.9	80%	0.796	77%	0.771	S	S	*	*			trans	-59.2	139	-176.5	-85.2	-117.1	0	0	0	113.3
695	Y	32.9	Very low	31.4	Very low	226 Å²	226	128.7 Å²	128.7	89%	0.886	79%	0.785	S	S	*	*			trans	-150.3	119.5	135.4	-121.8	-75.6	0	0	0	113.1
696	V	25.9	Very low	31.4	Very low	107 Å²	107	129 Å²	129	65%	0.648	80%	0.796	S	S	*	*			trans	-83.5	117	172.4	174.4	0	0	0	0	109.6
697	N	27.9	Very low	31.1	Very low	146 Å²	146	137 Å²	137	78%	0.781	81%	0.805	S	S	*	*			trans	-152.6	129.2	142.8	-103.7	-50.4	0	0	0	109.3	P699	N697-P699 WeakPolarHBondContact O-CD 3.3Å
698	V	26.6	Very low	31.3	Very low	128 Å²	128	136 Å²	136	78%	0.776	81%	0.807	S	S	*	*			trans	-78.1	125	-155.8	179.6	0	0	0	0	113	G700	V698-G700 PolarHBondContact O-N 3.25Å
699	P	27.6	Very low	31.4	Very low	126 Å²	126	135.3 Å²	135.3	82%	0.818	81%	0.805	S	S	*	*			trans	-73.3	122.7	171.2	-16.7	31.9	0	0	0	112.4	N697	N697-P699 WeakPolarHBondContact O-CD 3.3Å
700	G	29	Very low	31	Very low	73 Å²	73	138.2 Å²	138.2	75%	0.753	80%	0.798	S	S	*	*			trans	-102.6	92.4	177.6	0	0	0	0	0	113.6	V698	V698-G700 PolarHBondContact O-N 3.25Å
701	S	35.9	Very low	30.6	Very low	118 Å²	118	142.2 Å²	142.2	83%	0.825	80%	0.802	S	S	*	*			trans	21	101.8	158.3	61.1	0	0	0	0	119
702	G	26.5	Very low	30.4	Very low	70 Å²	70	137.5 Å²	137.5	72%	0.722	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-92.2	131.5	153.7	0	0	0	0	0	110.4
703	P	32.4	Very low	30.6	Very low	126 Å²	126	137.8 Å²	137.8	82%	0.818	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-70.6	143.4	178.5	28.7	-34.2	0	0	0	111.7
704	P	32.6	Very low	30.6	Very low	131 Å²	131	140.6 Å²	140.6	85%	0.851	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-83	139.8	-174.8	32.3	-34.8	0	0	0	113.1
705	G	30.2	Very low	31.3	Very low	73 Å²	73	142.2 Å²	142.2	75%	0.753	80%	0.802	S	S	*	*			trans	96	104.4	160.1	0	0	0	0	0	116.7
706	V	33.9	Very low	31.4	Very low	140 Å²	140	135.6 Å²	135.6	85%	0.848	79%	0.789	S	S	*	*				179.4	130.5	124.8	149.6	0	0	0	0	107.4
707	R	24.9	Very low	32.1	Very low	237 Å²	237	138.8 Å²	138.8	89%	0.894	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-83.7	125.5	173.9	-78.3	176.1	166.3	160.5	-6.6	110.2
708	P	36.3	Very low	32.6	Very low	117 Å²	117	139 Å²	139	76%	0.76	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-69.7	136	160.9	-15.2	30.9	0	0	0	110.2
709	P	34.8	Very low	33.3	Very low	118 Å²	118	139.2 Å²	139.2	77%	0.766	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-77.5	144.9	179.4	30.6	-34.4	0	0	0	112.7	N711	P709-N711 PolarHBondContact O-N 2.9Å
710	Y	27.7	Very low	34	Very low	192 Å²	192	141.6 Å²	141.6	75%	0.753	80%	0.8	S	S	*	*			trans	-83	97	-174	-151.1	-93.4	0	0	0	111.3	D748	Y710-D748 PolarHBondContact OH-OD2 3.01Å
711	N	35.8	Very low	34.4	Very low	158 Å²	158	143.5 Å²	143.5	85%	0.845	80%	0.801	S	S	*	*			trans	-93.7	113	-179.5	-115.6	-10.9	0	0	0	111.4	P709 H713	P709-N711 PolarHBondContact O-N 2.9Å; N711-H713 PolarHBondContact O-N 3.36Å
712	G	27	Very low	34.2	Very low	65 Å²	65	146.4 Å²	146.4	67%	0.67	80%	0.802	S	S	*	*			trans	-80.3	109.3	-176.6	0	0	0	0	0	113.5
713	H	37.3	Very low	34.7	Very low	185 Å²	185	154.3 Å²	154.3	86%	0.856	81%	0.81	S	S	*	*			trans	-125.6	130.6	165.3	-90.4	16.3	0	0	0	111.1	N711	N711-H713 PolarHBondContact O-N 3.36Å
714	K	34.1	Very low	34.6	Very low	213 Å²	213	153.6 Å²	153.6	93%	0.926	81%	0.808	S	S	*	*			trans	-78.5	128.9	-176.6	-58.4	177.4	-177.6	179	0	109.6
715	R	37.5	Very low	34.4	Very low	238 Å²	238	150.5 Å²	150.5	90%	0.898	80%	0.8	S	S	*	*			trans	-109.4	149.5	163.1	-69.5	-170.1	174.3	-150.4	-1.4	109.6
716	S	34.9	Very low	34.6	Very low	86 Å²	86	152.3 Å²	152.3	60%	0.601	80%	0.798	S	S	*	*			trans	-77.4	151.1	-171.1	36.4	0	0	0	0	113.1	Q718	S716-Q718 PolarHBondContact O-N 2.91Å
717	L	40.8	Very low	34.4	Very low	175 Å²	175	154.5 Å²	154.5	92%	0.916	80%	0.799	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86	54.9	-172.2	-148.9	165.3	0	0	0	111.3
718	Q	39	Very low	34.9	Very low	149 Å²	149	149 Å²	149	70%	0.696	80%	0.797	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.9	-38.3	-178.3	-119.6	73.5	40.7	0	0	112.9	S716 L720	S716-Q718 PolarHBondContact O-N 2.91Å; Q718-L720 VanDerWaalsContact C-N 3.32Å; Q718-L720 PolarHBondContact O-N 3.05Å; Q718-L720 VanDerWaalsContact O-N 3.09Å
719	D	41.6	Very low	34.7	Very low	134 Å²	134	148.4 Å²	148.4	72%	0.717	80%	0.802	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.4	21.9	-157.9	-56	-19	0	0	0	115.9
720	L	40.9	Very low	34.6	Very low	176 Å²	176	152.3 Å²	152.3	92%	0.921	80%	0.803	S	S	*	*	T	Hydrogen-bonded Turn	trans	-133.7	15.4	-175.5	-72.7	177.2	0	0	0	115.4	Q718	Q718-L720 VanDerWaalsContact C-N 3.32Å; Q718-L720 PolarHBondContact O-N 3.05Å; Q718-L720 VanDerWaalsContact O-N 3.09Å
721	S	38.8	Very low	35	Very low	113 Å²	113	147.3 Å²	147.3	79%	0.79	79%	0.789	S	S	*	*	S	Bend	trans	-85.5	-7	178.2	-164.9	0	0	0	0	114.8
722	E	31.9	Very low	35.5	Very low	179 Å²	179	145.2 Å²	145.2	84%	0.836	78%	0.784	S	S	*	*			trans	-119.7	78	-167.2	-68.6	-172.6	-162.2	0	0	113.8
723	R	37	Very low	36.1	Very low	235 Å²	235	152.4 Å²	152.4	89%	0.887	79%	0.791	S	S	*	*			trans	-162.9	118.7	150	-107	145.1	-166	-95.6	-1.1	112.3
724	S	29.9	Very low	36.2	Very low	111 Å²	111	150.5 Å²	150.5	78%	0.776	79%	0.786	S	S	*	*			trans	13.2	133.1	149.1	55	0	0	0	0	118.6
725	G	27.8	Very low	35.9	Very low	66 Å²	66	143.6 Å²	143.6	68%	0.68	78%	0.776	S	S	*	*			cis	104.6	130.5	30.5	0	0	0	0	0	109.8
726	P	35.4	Very low	35.5	Very low	111 Å²	111	139.9 Å²	139.9	72%	0.721	77%	0.774	S	S	*	*			trans	-82.3	173.7	-166.8	32.7	-36.3	0	0	0	114.6
727	H	29.3	Very low	35.2	Very low	186 Å²	186	141.9 Å²	141.9	86%	0.861	78%	0.783	S	S	*	*			trans	80.3	91.2	174.4	-47.3	-74.5	0	0	0	117.4
728	S	34.2	Very low	34.6	Very low	123 Å²	123	140.9 Å²	140.9	86%	0.86	78%	0.777	S	S	*	*			trans	-151.1	136.8	133.7	-170.4	0	0	0	0	109.5
729	A	32.2	Very low	34.2	Very low	104 Å²	104	140.6 Å²	140.6	86%	0.86	78%	0.78	S	S	*	*			trans	-98.2	118.3	173.6	0	0	0	0	0	108.5
730	Y	32.9	Very low	33.2	Very low	199 Å²	199	142.6 Å²	142.6	78%	0.78	79%	0.785	S	S	*	*			trans	-110.5	111.3	177.2	-164.3	-95.4	0	0	0	109.2	P732	Y730-P732 WeakPolarHBondContact O-CD 3.17Å
731	D	37.4	Very low	32.6	Very low	88 Å²	88	139.2 Å²	139.2	47%	0.471	77%	0.773	S	S	.	*			trans	-84.1	113	173.7	-174.8	-15.1	0	0	0	109	R733	D731-R733 PolarHBondContact O-N 3.34Å; D731-R733 VanDerWaalsContact O-N 3.1Å; D731-R733 WeakPolarHBondContact OD1-CB 3.29Å; D731-R733 WeakPolarHBondContact OD1-CD 3.31Å; D731-R733 VanDerWaalsContact OD1-CG 3.23Å; D731-R733 WeakPolarHBondContact OD1-CG 3.41Å; D731-R733 PolarHBondContact OD1-N 3.1Å; D731-R733 VanDerWaalsContact OD1-N 3.08Å
732	P	45.4	Very low	32.1	Very low	113 Å²	113	138.9 Å²	138.9	73%	0.734	77%	0.771	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.7	8.3	-175	33.5	-37.3	0	0	0	114	Y730 L734	Y730-P732 WeakPolarHBondContact O-CD 3.17Å; P732-L734 VanDerWaalsContact C-N 3.34Å
733	R	39.1	Very low	31.8	Very low	216 Å²	216	139.8 Å²	139.8	82%	0.815	77%	0.772	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.3	-7.8	178.4	-65.9	170.6	-178.4	170.5	1.9	114.4	D731	D731-R733 PolarHBondContact O-N 3.34Å; D731-R733 VanDerWaalsContact O-N 3.1Å; D731-R733 WeakPolarHBondContact OD1-CB 3.29Å; D731-R733 WeakPolarHBondContact OD1-CD 3.31Å; D731-R733 VanDerWaalsContact OD1-CG 3.23Å; D731-R733 WeakPolarHBondContact OD1-CG 3.41Å; D731-R733 PolarHBondContact OD1-N 3.1Å; D731-R733 VanDerWaalsContact OD1-N 3.08Å
734	L	39.5	Very low	31.3	Very low	145 Å²	145	134.8 Å²	134.8	76%	0.759	77%	0.77	S	S	*	*	S	Bend	trans	-98.9	95.1	-177.3	-70.1	179	0	0	0	113	P732	P732-L734 VanDerWaalsContact C-N 3.34Å
735	G	28.3	Very low	31.1	Very low	69 Å²	69	140.3 Å²	140.3	71%	0.711	77%	0.774	S	S	*	*			trans	72.1	118.1	135.5	0	0	0	0	0	118.6
736	D	28.4	Very low	31	Very low	159 Å²	159	142.9 Å²	142.9	85%	0.85	78%	0.777	S	S	*	*			trans	-50.7	137.6	172	-55.9	-79.1	0	0	0	114.6
737	T	30.3	Very low	30.4	Very low	129 Å²	129	142.9 Å²	142.9	79%	0.791	78%	0.779	S	S	*	*			trans	-157.7	123.2	133.2	-0.9	0	0	0	0	111.2	N739	T737-N739 PolarHBondContact O-N 3.44Å
738	I	27.5	Very low	30.3	Very low	154 Å²	154	139.5 Å²	139.5	79%	0.79	77%	0.767	S	S	*	*			trans	-76.9	109.2	-179.8	-60.1	170.8	0	0	0	109.5
739	N	30	Very low	29.9	Very low	142 Å²	142	143.5 Å²	143.5	76%	0.759	76%	0.764	S	S	*	*			trans	-127.3	108.5	164.2	-85.3	-62.7	0	0	0	109.5	T737 P741	T737-N739 PolarHBondContact O-N 3.44Å; N739-P741 VanDerWaalsContact O-CD 3.31Å; N739-P741 WeakPolarHBondContact O-CD 3.29Å
740	Q	21.4	Very low	29.7	Very low	176 Å²	176	143.1 Å²	143.1	82%	0.822	75%	0.746	S	S	*	*			trans	-94.3	121.2	172.5	-74.6	-164.9	53.1	0	0	111.4
741	P	28.3	Very low	29.5	Very low	106 Å²	106	136.4 Å²	136.4	69%	0.688	73%	0.729	S	S	*	*			trans	-109.7	120.4	152.7	33.5	-26.6	0	0	0	111.5	N739	N739-P741 VanDerWaalsContact O-CD 3.31Å; N739-P741 WeakPolarHBondContact O-CD 3.29Å
742	S	28.7	Very low	29.1	Very low	106 Å²	106	134 Å²	134	74%	0.741	72%	0.716	S	S	*	*			trans	27	109.9	150.7	57.8	0	0	0	0	119.6	P744	S742-P744 VanDerWaalsContact O-CD 3.32Å; S742-P744 WeakPolarHBondContact O-CD 3.37Å
743	K	23.9	Very low	28.3	Very low	198 Å²	198	135.3 Å²	135.3	86%	0.861	71%	0.712	S	S	*	*			trans	-61.5	123.1	167	-58.5	170.1	-176.7	174.4	0	112.1
744	P	27.9	Very low	27.7	Very low	129 Å²	129	126.6 Å²	126.6	84%	0.838	68%	0.681	S	S	*	*			trans	-75.3	161.5	149.2	32.9	-31.7	0	0	0	110	S742	S742-P744 VanDerWaalsContact O-CD 3.32Å; S742-P744 WeakPolarHBondContact O-CD 3.37Å
745	R	24.6	Very low	27.3	Very low	227 Å²	227	124.4 Å²	124.4	86%	0.857	68%	0.676	S	S	*	*			trans	-124.1	127.7	-163.9	-154.8	-178.2	-179.3	178.5	0	112.1
746	T	25.5	Very low	27.4	Very low	121 Å²	121	123.7 Å²	123.7	74%	0.742	66%	0.655	S	S	*	*			trans	46.3	106.6	152.1	54.7	0	0	0	0	120.2
747	S	24.6	Very low	27.3	Very low	111 Å²	111	122.8 Å²	122.8	78%	0.776	64%	0.641	S	S	*	*			trans	-172.8	147.6	133.3	26.8	0	0	0	0	107.7
748	D	26.4	Very low	27.2	Very low	114 Å²	114	123.4 Å²	123.4	61%	0.61	63%	0.63	S	S	*	*			cis	-157.5	164.6	-14	-116.9	-9.3	0	0	0	108.7	Y710	Y710-D748 PolarHBondContact OH-OD2 3.01Å
749	R	26.2	Very low	27.3	Very low	207 Å²	207	119.7 Å²	119.7	78%	0.781	61%	0.612	S	S	*	*			trans	63.6	115.4	168.1	-71.9	179.5	155.6	133.1	-3.6	117.5
750	I	27.5	Very low	27.3	Very low	97 Å²	97	121.3 Å²	121.3	50%	0.497	62%	0.615	S	S	.	*				66.8	112.1	72.9	-64	168.7	0	0	0	112.1
751	S	28.1	Very low	27.7	Very low	58 Å²	58	122.7 Å²	122.7	41%	0.406	61%	0.614	S	S	.	*			trans	174.2	131.9	144.8	166.9	0	0	0	0	109.5	K451	K451-S751 VanDerWaalsContact CE-CB 3.47Å; K451-S751 WeakPolarHBondContact CE-OG 3.23Å; K451-S751 PolarHBondContact NZ-OG 3.07Å
752	D	30.1	Very low	28.1	Very low	37 Å²	37	123.1 Å²	123.1	20%	0.198	62%	0.615	C	S	.	*			cis	-173	155.2	-13.7	-81.9	-56.1	0	0	0	107.4	C449	C449-D752 VanDerWaalsContact CB-OD1 3.31Å; C449-D752 WeakPolarHBondContact CB-OD1 3.4Å; C449-D752 VanDerWaalsContact CB-OD2 3.3Å; C449-D752 WeakPolarHBondContact CB-OD2 3.29Å; C449-D752 PolarHBondContact N-OD1 3.49Å; C449-D752 PolarHBondContact N-OD2 3.4Å; C449-D752 PolarHBondContact SG-OD1 3.29Å
753	Q	28.4	Very low	28.1	Very low	140 Å²	140	121.6 Å²	121.6	65%	0.654	60%	0.604	S	S	*	*				176	115.6	115	-96.1	155.6	94.8	0	0	112.9	E447	E447-Q753 CarbonylContact O-C 3.03Å; E447-Q753 WeakPolarHBondContact O-CA 3.4Å; E447-Q753 PolarHBondContact O-N 3.08Å
754	I	26.6	Very low	28.5	Very low	33 Å²	33	119 Å²	119	17%	0.169	60%	0.6	C	S	.	*			trans	-89.5	129.8	134.7	-39.9	151.2	0	0	0	106	V445 T446 E447 R448 D756	V445-I754 HydrophobicContact CG1-CG1 4.32Å; T446-I754 WeakPolarHBondContact O-CD1 3.41Å; T446-I754 VanDerWaalsContact O-CG1 3.22Å; T446-I754 WeakPolarHBondContact O-CG1 3.33Å; E447-I754 VanDerWaalsContact C-N 3.32Å; E447-I754 PolarHBondContact O-N 2.89Å; R448-I754 HydrophobicContact CB-CB 4.12Å; R448-I754 HydrophobicContact CB-CD1 4.35Å; R448-I754 HydrophobicContact CB-CG1 4.42Å; R448-I754 WeakPolarHBondContact CB-O 3.43Å; R448-I754 WeakPolarHBondContact CG-O 3.39Å; R448-I754 PolarHBondContact NE-O 3.36Å; I754-D756 HydrophobicContact CB-CB 4.07Å; I754-D756 HydrophobicContact CG2-CB 4.05Å; I754-D756 PolarHBondContact O-N 3.15Å
755	P	30.1	Very low	28.8	Very low	99 Å²	99	121.7 Å²	121.7	64%	0.643	60%	0.601	S	S	*	*			trans	-69.1	59.5	151.3	-21	35.9	0	0	0	110.4	Y757	P755-Y757 PolarHBondContact O-N 3.08Å; P755-Y757 VanDerWaalsContact O-N 3.11Å
756	D	30.5	Very low	29.3	Very low	54 Å²	54	116.5 Å²	116.5	29%	0.289	60%	0.599	S	S	.	*			trans	-56	115.1	-174.4	-126.1	-8.9	0	0	0	110.4	R448 I754 Y758	R448-D756 VanDerWaalsContact CZ-N 3.32Å; R448-D756 PolarHBondContact NH1-O 2.91Å; R448-D756 VanDerWaalsContact NH2-N 3.19Å; R448-D756 PolarHBondContact NH2-O 3.04Å; I754-D756 HydrophobicContact CB-CB 4.07Å; I754-D756 HydrophobicContact CG2-CB 4.05Å; I754-D756 PolarHBondContact O-N 3.15Å; D756-Y758 HydrophobicContact CB-CD2 4.17Å
757	Y	27.6	Very low	30	Very low	141 Å²	141	118.2 Å²	118.2	55%	0.553	60%	0.604	S	S	*	*			trans	-153.2	77.8	178	-107.7	-73.7	0	0	0	106.4	P755 S967	P755-Y757 PolarHBondContact O-N 3.08Å; P755-Y757 VanDerWaalsContact O-N 3.11Å; Y757-S967 PolarHBondContact OH-OG 3.04Å
758	Y	28	Very low	30.6	Very low	141 Å²	141	121 Å²	121	55%	0.553	60%	0.599	S	S	*	*				57	126.1	62.5	-97	-77.6	0	0	0	114.1	D756	D756-Y758 HydrophobicContact CB-CD2 4.17Å
759	D	28.8	Very low	30.9	Very low	77 Å²	77	123.3 Å²	123.3	41%	0.412	61%	0.611	S	S	.	*			trans	50.5	101	156.4	-62.9	-23.4	0	0	0	119.5	H968	D759-H968 VanDerWaalsContact CB-CE1 3.49Å; D759-H968 WeakPolarHBondContact CB-CE1 3.49Å; D759-H968 IonicContact OD2-CE1 3.68Å; D759-H968 PolarHBondContact OD2-CE1 2.78Å
760	Q	29.9	Very low	31.6	Very low	175 Å²	175	120.7 Å²	120.7	82%	0.818	61%	0.613	S	S	*	*			trans	-124.2	69.9	136.1	-131.7	97.9	111.2	0	0	111	T762	Q760-T762 VanDerWaalsContact C-N 3.28Å; Q760-T762 PolarHBondContact O-N 2.73Å; Q760-T762 VanDerWaalsContact O-N 3.16Å
761	Y	30.9	Very low	32	Very low	205 Å²	205	120.9 Å²	120.9	80%	0.804	62%	0.622	S	S	*	*			trans	-77.5	80	157.1	-94.7	-73.4	0	0	0	109.8	S763	Y761-S763 PolarHBondContact O-OG 2.99Å
762	T	36.1	Very low	32.2	Very low	115 Å²	115	121.8 Å²	121.8	71%	0.706	64%	0.641	S	S	*	*			trans	-90.3	105.4	147.5	49.5	0	0	0	0	105.4	Q760	Q760-T762 VanDerWaalsContact C-N 3.28Å; Q760-T762 PolarHBondContact O-N 2.73Å; Q760-T762 VanDerWaalsContact O-N 3.16Å
763	S	29.4	Very low	32.5	Very low	75 Å²	75	128.8 Å²	128.8	52%	0.524	67%	0.673	S	S	.	*			cis	54.1	136.9	47.6	-45.5	0	0	0	0	111.6	Y761	Y761-S763 PolarHBondContact O-OG 2.99Å
764	D	32.2	Very low	32.7	Very low	144 Å²	144	127 Å²	127	77%	0.77	68%	0.675	S	S	*	*			trans	71	135.5	169.7	-46.7	-33.5	0	0	0	114.2
765	E	32.6	Very low	33.2	Very low	185 Å²	185	132.4 Å²	132.4	86%	0.864	71%	0.705	S	S	*	*			cis	-140.7	153.1	-4.2	-102.5	141.7	152	0	0	109.2
766	S	35.5	Very low	33.6	Very low	117 Å²	117	134 Å²	134	82%	0.818	70%	0.704	S	S	*	*			trans	-107.4	108.1	168.2	62.3	0	0	0	0	109.9
767	D	40.8	Very low	34.2	Very low	157 Å²	157	139.2 Å²	139.2	84%	0.84	73%	0.726	S	S	*	*			trans	-134.5	161.7	156.1	-108.1	-36.5	0	0	0	108.7
768	Y	36.1	Very low	34.6	Very low	171 Å²	171	139.9 Å²	139.9	67%	0.671	74%	0.739	S	S	*	*			trans	-79.4	159.1	-152.4	-81.1	-96.8	0	0	0	116.5	I663	I663-Y768 HydrophobicContact CD1-CE2 3.95Å
769	D	33.8	Very low	35.3	Very low	161 Å²	161	140 Å²	140	86%	0.861	74%	0.742	S	S	*	*			trans	-52.1	133.3	159.3	-54.1	-86.5	0	0	0	111.5
770	D	40.4	Very low	35.6	Very low	153 Å²	153	141.8 Å²	141.8	82%	0.818	76%	0.758	S	S	*	*				-140.6	151.3	120.1	-155.3	-13	0	0	0	109.5	G772	D770-G772 PolarHBondContact O-N 3.37Å
771	S	35.9	Very low	35.8	Very low	100 Å²	100	139.4 Å²	139.4	70%	0.699	76%	0.758	S	S	*	*			trans	-62.6	114.6	-172	46.5	0	0	0	0	113.5	E773	S771-E773 VanDerWaalsContact C-N 3.34Å; S771-E773 PolarHBondContact O-N 2.98Å
772	G	32.9	Very low	35.8	Very low	77 Å²	77	134 Å²	134	79%	0.794	76%	0.755	S	S	*	*			trans	-67.2	94.4	156.5	0	0	0	0	0	109.3	D770 S774	D770-G772 PolarHBondContact O-N 3.37Å; G772-S774 PolarHBondContact O-N 2.83Å
773	E	35.9	Very low	36	Very low	185 Å²	185	137 Å²	137	86%	0.864	77%	0.766	S	S	*	*			trans	-53.9	129.9	172.9	-171.9	169.6	-154.6	0	0	109.5	S771 D775	S771-E773 VanDerWaalsContact C-N 3.34Å; S771-E773 PolarHBondContact O-N 2.98Å; E773-D775 PolarHBondContact O-N 3.42Å
774	S	33.2	Very low	35.9	Very low	102 Å²	102	144.7 Å²	144.7	71%	0.713	78%	0.783	S	S	*	*			trans	-74.8	95.4	-167.6	55.7	0	0	0	0	111.6	G772 E776	G772-S774 PolarHBondContact O-N 2.83Å; S774-E776 PolarHBondContact O-N 2.76Å
775	D	36.9	Very low	35.7	Very low	147 Å²	147	143.8 Å²	143.8	79%	0.786	78%	0.783	S	S	*	*			trans	-72.9	77.4	168.5	-155.4	13.2	0	0	0	109.2	E773 E777	E773-D775 PolarHBondContact O-N 3.42Å; D775-E777 PolarHBondContact O-N 3.46Å
776	E	39.3	Very low	35.6	Very low	133 Å²	133	141.9 Å²	141.9	62%	0.621	78%	0.777	S	S	*	*			trans	-50.3	122.5	179.5	173.5	84.8	-165	0	0	110.2	S774 L778 K779	S774-E776 PolarHBondContact O-N 2.76Å; E776-L778 PolarHBondContact O-N 3.03Å; E776-L778 VanDerWaalsContact O-N 3.08Å; E776-K779 IonicContact OE1-NZ 3.94Å; E776-K779 PolarHBondContact OE1-NZ 3.41Å; E776-K779 VanDerWaalsContact OE1-NZ 3.11Å
777	E	41.6	Very low	35.1	Very low	163 Å²	163	142.7 Å²	142.7	76%	0.762	78%	0.777	S	S	*	*			trans	-43.5	114.5	-174	-169.5	179.7	-133.7	0	0	112	D775 K779	D775-E777 PolarHBondContact O-N 3.46Å; E777-K779 VanDerWaalsContact C-N 3.33Å; E777-K779 PolarHBondContact O-N 2.93Å
778	L	36.6	Very low	34.6	Very low	155 Å²	155	143.6 Å²	143.6	81%	0.812	78%	0.777	S	S	*	*			trans	-62.3	81.8	-163.1	-72.3	172.9	0	0	0	113.8	E776	E776-L778 PolarHBondContact O-N 3.03Å; E776-L778 VanDerWaalsContact O-N 3.08Å
779	K	41.9	Very low	34.2	Very low	143 Å²	143	141.8 Å²	141.8	62%	0.622	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-62.7	132.1	175.8	-70.5	176.5	-173.8	76.9	0	110.2	E776 E777	E776-K779 IonicContact OE1-NZ 3.94Å; E776-K779 PolarHBondContact OE1-NZ 3.41Å; E776-K779 VanDerWaalsContact OE1-NZ 3.11Å; E777-K779 VanDerWaalsContact C-N 3.33Å; E777-K779 PolarHBondContact O-N 2.93Å
780	P	35.5	Very low	33.8	Very low	115 Å²	115	143.9 Å²	143.9	75%	0.747	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-62.3	150.6	177.1	26.2	-34.2	0	0	0	111.3	A782	P780-A782 PolarHBondContact O-N 3.07Å
781	P	34.3	Very low	33.2	Very low	125 Å²	125	148.1 Å²	148.1	81%	0.812	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-61	133.1	-169.6	23.4	-34.2	0	0	0	112.6	L783	P781-L783 PolarHBondContact O-N 3.5Å
782	A	31.9	Very low	32.9	Very low	90 Å²	90	152.7 Å²	152.7	74%	0.744	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-58.6	123.1	-169.6	0	0	0	0	0	113.6	P780 R784	P780-A782 PolarHBondContact O-N 3.07Å; A782-R784 PolarHBondContact O-N 3.12Å
783	L	38.3	Very low	32.7	Very low	179 Å²	179	153.6 Å²	153.6	94%	0.937	78%	0.78	S	S	*	*			trans	-66.2	113.1	164.4	-71.1	177.1	0	0	0	109.1	P781	P781-L783 PolarHBondContact O-N 3.5Å
784	R	27.8	Very low	32.2	Very low	237 Å²	237	153.9 Å²	153.9	89%	0.894	78%	0.781	S	S	*	*			trans	-73.3	130.1	177.2	-49.8	169.6	-170.5	127.7	3	108.7	A782	A782-R784 PolarHBondContact O-N 3.12Å
785	T	29.2	Very low	32.2	Very low	124 Å²	124	154.5 Å²	154.5	76%	0.761	78%	0.783	S	S	*	*			trans	167.8	118.2	136.9	-76.7	0	0	0	0	112.9
786	I	29.9	Very low	31.5	Very low	145 Å²	145	156.3 Å²	156.3	74%	0.744	79%	0.787	S	S	*	*			trans	59.5	126.8	153	-62.1	168.3	0	0	0	119.9
787	T	24.4	Very low	31.2	Very low	134 Å²	134	156.2 Å²	156.2	82%	0.822	80%	0.798	S	S	*	*			trans	-69.3	137.1	170.7	47.2	0	0	0	0	114
788	Q	31.3	Very low	30.4	Very low	177 Å²	177	153.6 Å²	153.6	83%	0.827	80%	0.798	S	S	*	*			trans	-129.8	108.9	163.7	-67.6	-165.7	2.9	0	0	113.3
789	T	27.6	Very low	29.8	Very low	133 Å²	133	153.3 Å²	153.3	82%	0.816	80%	0.797	S	S	*	*			trans	22.4	91.4	149	54.4	0	0	0	0	121
790	R	24.1	Very low	29.1	Very low	205 Å²	205	153 Å²	153	77%	0.774	80%	0.802	S	S	*	*			trans	4.2	118.1	133.2	-174.9	-171	-172	-162.5	5.4	118.2
791	R	29	Very low	28.7	Very low	241 Å²	241	157.5 Å²	157.5	91%	0.909	81%	0.806	S	S	*	*			trans	-126.6	110.5	135.8	-68.6	-172.4	177	-160.6	-0.5	106.5
792	R	28.9	Very low	28.3	Very low	196 Å²	196	156.2 Å²	156.2	74%	0.74	80%	0.797	S	S	*	*				52.3	102.3	93.5	-73.8	-170.3	-178.5	-115	8.7	111.6
793	S	28.2	Very low	28.1	Very low	97 Å²	97	157.4 Å²	157.4	68%	0.678	80%	0.797	S	S	*	*			cis	97.3	106.5	33.1	75.7	0	0	0	0	114
794	E	27.2	Very low	27.6	Very low	190 Å²	190	155.8 Å²	155.8	89%	0.888	80%	0.795	S	S	*	*			trans	-163.5	158.6	152.2	-115.3	178.4	135.6	0	0	109.1
795	P	32.3	Very low	27.3	Very low	116 Å²	116	151.8 Å²	151.8	75%	0.753	79%	0.786	S	S	*	*				-125.9	163.5	-93.3	39.3	-27.7	0	0	0	115.5
796	E	22.9	Very low	27	Very low	184 Å²	184	153.4 Å²	153.4	86%	0.86	79%	0.789	S	S	*	*			trans	-76.1	150.6	167.3	-69.5	-167.9	140.3	0	0	112.6	S798	E796-S798 PolarHBondContact O-N 2.89Å
797	P	31.6	Very low	26.7	Very low	132 Å²	132	158.1 Å²	158.1	86%	0.857	80%	0.798	S	S	*	*			trans	-73.3	106.7	171	30.4	-33.5	0	0	0	111.1
798	S	26	Very low	26.5	Very low	108 Å²	108	163.2 Å²	163.2	76%	0.755	80%	0.802	S	S	*	*			trans	-75.3	138.2	177.5	61.4	0	0	0	0	113.3	E796	E796-S798 PolarHBondContact O-N 2.89Å
799	N	23	Very low	26.2	Very low	149 Å²	149	160.8 Å²	160.8	80%	0.797	80%	0.801	S	S	*	*			trans	14.4	137.4	148.7	-73.8	-32.8	0	0	0	119.5
800	N	27.3	Very low	26.1	Very low	137 Å²	137	160 Å²	160	73%	0.733	80%	0.802	S	S	*	*				-161.1	158.8	124.3	-108.7	-41.8	0	0	0	115.5
801	Y	28.4	Very low	25.9	Very low	208 Å²	208	160.6 Å²	160.6	82%	0.816	81%	0.81	S	S	*	*			trans	78.3	146.5	170.8	-60.1	-59.4	0	0	0	118.8
802	P	25.9	Very low	25.7	Very low	98 Å²	98	152.3 Å²	152.3	64%	0.636	80%	0.799	S	S	*	*				-126.7	165.4	-129.4	40.9	-27.3	0	0	0	115.9	V804	P802-V804 PolarHBondContact O-N 3.33Å
803	P	26.1	Very low	25.4	Very low	115 Å²	115	151.2 Å²	151.2	75%	0.747	80%	0.802	S	S	*	*			trans	-72	111	179.8	28.8	-35.5	0	0	0	112.9	Q805	P803-Q805 PolarHBondContact O-N 2.79Å
804	V	28.8	Very low	25.2	Very low	145 Å²	145	155.4 Å²	155.4	88%	0.879	81%	0.808	S	S	*	*			trans	-76	101.6	171	-179.6	0	0	0	0	109.9	P802	P802-V804 PolarHBondContact O-N 3.33Å
805	Q	21.8	Very low	25.2	Very low	154 Å²	154	153.8 Å²	153.8	72%	0.72	81%	0.812	S	S	*	*			trans	-83.4	165	169.4	-61.5	-169.3	16.9	0	0	111.8	P803	P803-Q805 PolarHBondContact O-N 2.79Å
806	L	21.8	Very low	24.8	Very low	158 Å²	158	151.9 Å²	151.9	83%	0.827	81%	0.814	S	S	*	*			trans	67.6	98.6	162	-65.8	149.7	0	0	0	117.8
807	R	23.4	Very low	24.8	Very low	244 Å²	244	152 Å²	152	92%	0.921	81%	0.814	S	S	*	*				-155.5	132.4	102.4	-112.9	170.8	176.5	142.2	-1.1	112.7
808	R	21	Very low	24.3	Very low	241 Å²	241	150.5 Å²	150.5	91%	0.909	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-96.1	122.4	165.1	-70.8	179	176.8	167.6	-1.3	108.9
809	P	24.8	Very low	24.5	Very low	125 Å²	125	153.1 Å²	153.1	81%	0.812	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-67.4	157.3	155.3	-16.1	31.6	0	0	0	110.5
810	S	25	Very low	24.6	Very low	118 Å²	118	150.9 Å²	150.9	83%	0.825	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-92.3	168.9	-176.9	51.7	0	0	0	0	113.1	G812	S810-G812 PolarHBondContact O-N 3.09Å
811	K	21.6	Very low	24.4	Very low	216 Å²	216	149.4 Å²	149.4	94%	0.939	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-69.2	119.9	172.9	-65.8	174.7	178.2	175.9	0	110.9
812	G	23.7	Very low	24.3	Very low	67 Å²	67	146.4 Å²	146.4	69%	0.691	80%	0.8	S	S	*	*			trans	-145.5	113.2	156.5	0	0	0	0	0	107.2	S810	S810-G812 PolarHBondContact O-N 3.09Å
813	Q	22.9	Very low	24.5	Very low	173 Å²	173	152.5 Å²	152.5	81%	0.808	81%	0.81	S	S	*	*				66.6	105.4	70.8	-72.2	-153.3	-27.2	0	0	115
814	K	23.5	Very low	24.5	Very low	185 Å²	185	153.6 Å²	153.6	80%	0.804	81%	0.809	S	S	*	*			trans	43.3	103.9	133	-57.5	179.1	178.4	-176.6	0	118.5
815	T	26.5	Very low	24.2	Very low	156 Å²	156	152.2 Å²	152.2	96%	0.957	81%	0.807	S	S	*	*				-152.9	138.6	125.4	16.5	0	0	0	0	108.9
816	G	24.7	Very low	24.7	Very low	77 Å²	77	152.6 Å²	152.6	79%	0.794	81%	0.813	S	S	*	*			trans	176	49.2	-169.4	0	0	0	0	0	111.9
817	Q	22.4	Very low	25.1	Very low	185 Å²	185	152 Å²	152	86%	0.864	81%	0.808	S	S	*	*			trans	-141.3	155.3	176.1	-75.1	-169.4	-42.6	0	0	109.8
818	S	22.4	Very low	25.1	Very low	101 Å²	101	145.7 Å²	145.7	71%	0.706	80%	0.802	S	S	*	*			trans	53.8	99.7	166.3	61.3	0	0	0	0	119
819	I	30.1	Very low	25.6	Very low	163 Å²	163	140.2 Å²	140.2	84%	0.836	80%	0.798	S	S	*	*				-145.1	93.2	129.2	-38.9	175.3	0	0	0	105.8
820	T	24.4	Very low	25.6	Very low	102 Å²	102	143.4 Å²	143.4	63%	0.626	80%	0.802	S	S	*	*				48.1	89.2	81.9	66.2	0	0	0	0	113.9
821	S	23	Very low	25.7	Very low	107 Å²	107	140.9 Å²	140.9	75%	0.748	79%	0.794	S	S	*	*				83	-171.8	98.2	71	0	0	0	0	114.4
822	I	26.5	Very low	26.2	Very low	145 Å²	145	139.3 Å²	139.3	74%	0.744	79%	0.793	S	S	*	*			trans	80.3	80.8	-177.4	-46.4	168.8	0	0	0	114.8
823	R	29.4	Very low	26.3	Very low	225 Å²	225	141.8 Å²	141.8	85%	0.849	80%	0.8	S	S	*	*				-170.6	96.6	120.9	-104.3	162.1	-174.5	174	4.7	113
824	D	26.4	Very low	26.6	Very low	138 Å²	138	140.9 Å²	140.9	74%	0.738	80%	0.799	S	S	*	*				59.4	93.8	125.6	-46.2	-26.1	0	0	0	118.9
825	S	23.6	Very low	26.8	Very low	117 Å²	117	137.7 Å²	137.7	82%	0.818	80%	0.797	S	S	*	*			trans	-33.9	132.5	155.6	-45.1	0	0	0	0	115.8
826	L	31.2	Very low	26.8	Very low	162 Å²	162	135.9 Å²	135.9	85%	0.848	79%	0.79	S	S	*	*			trans	-139.8	114	138.6	-76.9	-176	0	0	0	110
827	I	31.1	Very low	27.1	Very low	144 Å²	144	138.7 Å²	138.7	74%	0.738	79%	0.792	S	S	*	*			trans	23.5	113.5	159.6	-63.6	69.2	0	0	0	117
828	S	23.6	Very low	27.4	Very low	113 Å²	113	136.1 Å²	136.1	79%	0.79	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-81.6	132.1	148.2	-66.1	0	0	0	0	109.3	E830	S828-E830 PolarHBondContact O-N 3.05Å
829	P	30.5	Very low	27.8	Very low	126 Å²	126	134.6 Å²	134.6	82%	0.818	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-70.4	127.3	169.3	29.2	-32.4	0	0	0	109.8
830	E	26.2	Very low	27.7	Very low	191 Å²	191	138.2 Å²	138.2	89%	0.893	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-86.3	149	-175.2	-174.7	171.9	-161.8	0	0	111.9	S828	S828-E830 PolarHBondContact O-N 3.05Å
831	G	27.1	Very low	28.1	Very low	65 Å²	65	141.7 Å²	141.7	67%	0.67	81%	0.806	S	S	*	*			trans	70.5	82.6	154.2	0	0	0	0	0	118.8
832	M	30.2	Very low	28.4	Very low	183 Å²	183	142.6 Å²	142.6	90%	0.901	80%	0.802	S	S	*	*			trans	-122.4	77.5	148.6	-72.7	-169.1	74	0	0	110
833	S	25.7	Very low	29.1	Very low	120 Å²	120	142.1 Å²	142.1	84%	0.839	80%	0.8	S	S	*	*			trans	-75.2	133.4	172.8	41.3	0	0	0	0	111
834	I	29.5	Very low	29.4	Very low	154 Å²	154	141.9 Å²	141.9	79%	0.79	80%	0.8	S	S	*	*			trans	-113.1	136.5	177.3	-65.5	179.6	0	0	0	107.1
835	P	27.9	Very low	30.2	Very low	118 Å²	118	136.3 Å²	136.3	77%	0.766	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-83.6	154.2	-145.6	30.8	-37.4	0	0	0	115.6	T837	P835-T837 PolarHBondContact O-N 3.43Å
836	S	26.7	Very low	31.9	Very low	117 Å²	117	136.4 Å²	136.4	82%	0.818	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-61.5	123.9	176.2	-47.9	0	0	0	0	112.8	P838	S836-P838 WeakPolarHBondContact O-CD 3.34Å
837	T	31.4	Very low	34.2	Very low	137 Å²	137	134.8 Å²	134.8	84%	0.84	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-74.5	122.9	159.3	37.4	0	0	0	0	109.5	P835	P835-T837 PolarHBondContact O-N 3.43Å
838	P	29.4	Very low	35.6	Very low	131 Å²	131	133 Å²	133	85%	0.851	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-72.7	155.5	-178.7	-17.7	31.8	0	0	0	113.2	S836	S836-P838 WeakPolarHBondContact O-CD 3.34Å
839	G	28.9	Very low	37.7	Very low	68 Å²	68	129.1 Å²	129.1	70%	0.701	70%	0.704	S	S	*	*			trans	130.5	-5.8	150.3	0	0	0	0	0	119.4
840	Y	29.2	Very low	39.4	Very low	240 Å²	240	129.7 Å²	129.7	94%	0.941	70%	0.701	S	S	*	*			trans	-108.9	86	172.1	-87.6	-83.4	0	0	0	111.5
841	E	32.8	Very low	41.5	Very low	174 Å²	174	130 Å²	130	81%	0.813	70%	0.699	S	S	*	*			trans	-69.4	138.1	173.4	-64.2	-175.9	151.1	0	0	111	I843	E841-I843 PolarHBondContact O-N 3.42Å
842	N	29.4	Very low	43.9	Very low	127 Å²	127	130.8 Å²	130.8	68%	0.679	69%	0.691	S	S	*	*			trans	-85.8	79.1	-169.6	-169.2	2.6	0	0	0	111.9	Y844 G845	N842-Y844 PolarHBondContact O-N 2.96Å; N842-G845 PolarHBondContact O-N 2.8Å
843	I	41.2	Very low	45	Very low	134 Å²	134	123.9 Å²	123.9	69%	0.687	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.3	-16.5	-176.3	-66.1	172	0	0	0	113.5	E841	E841-I843 PolarHBondContact O-N 3.42Å
844	Y	35.6	Very low	46.6	Very low	220 Å²	220	125.1 Å²	125.1	86%	0.863	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120.6	51.7	179.7	-64.4	-75.2	0	0	0	113	N842	N842-Y844 PolarHBondContact O-N 2.96Å
845	G	42.6	Very low	48.3	Very low	21 Å²	21	126 Å²	126	22%	0.216	65%	0.651	C	S	.	*	S	Bend	trans	-135.9	152.4	175.3	0	0	0	0	0	114.3	N842 G858	N842-G845 PolarHBondContact O-N 2.8Å; G845-G858 PolarHBondContact O-N 3.44Å
846	I	59.4	Low	49.8	Very low	120 Å²	120	124.5 Å²	124.5	62%	0.615	64%	0.635	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-79.3	120.4	149.6	-57.7	174.2	0	0	0	105.1	Y855 M856 K857	I846-Y855 HydrophobicContact CG2-CD1 4.19Å; I846-Y855 HydrophobicContact CG2-CG 4.47Å; I846-M856 WeakPolarHBondContact CA-O 3.49Å; I846-M856 WeakPolarHBondContact CG2-O 3.43Å; I846-K857 HydrophobicContact CG1-CB 4.48Å; I846-K857 HydrophobicContact CG1-CG 4.32Å
847	Y	78.7	Confident	51.4	Low	127 Å²	127	124.9 Å²	124.9	50%	0.498	62%	0.622	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-110.7	155.9	178	65.7	-90.5	0	0	0	110.5	D849 Y855 M856	Y847-D849 HydrophobicContact CE2-CB 4.41Å; Y847-Y855 CarbonylContact O-C 3.56Å; Y847-Y855 WeakPolarHBondContact O-CA 3.41Å; Y847-M856 PolarHBondContact N-O 2.84Å; Y847-M856 PolarHBondContact O-N 3.48Å; Y847-M856 VanDerWaalsContact O-O 3.11Å
848	Y	60.7	Low	52.4	Low	107 Å²	107	119.4 Å²	119.4	42%	0.42	59%	0.593	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-86	127.2	173.6	-166.8	-109.2	0	0	0	108.7	D850 G853 Y855	Y848-D850 VanDerWaalsContact CD1-OD1 3.32Å; Y848-D850 WeakPolarHBondContact CD1-OD1 3.44Å; Y848-G853 PolarHBondContact OH-O 3.02Å; Y848-Y855 AromaticContact CD2-CD1 3.93Å; Y848-Y855 HydrophobicContact CD2-CD1 3.93Å; Y848-Y855 AromaticContact CD2-CD2 3.68Å; Y848-Y855 HydrophobicContact CD2-CD2 3.68Å; Y848-Y855 AromaticContact CD2-CE1 3.82Å; Y848-Y855 HydrophobicContact CD2-CE1 3.82Å; Y848-Y855 AromaticContact CD2-CE2 3.54Å; Y848-Y855 HydrophobicContact CD2-CE2 3.54Å; Y848-Y855 AromaticContact CD2-CG 3.87Å; Y848-Y855 HydrophobicContact CD2-CG 3.87Å; Y848-Y855 AromaticContact CD2-CZ 3.61Å; Y848-Y855 HydrophobicContact CE2-CD2 4.08Å; Y848-Y855 AromaticContact CE2-CE2 3.87Å; Y848-Y855 HydrophobicContact CE2-CE2 3.87Å; Y848-Y855 HydrophobicContact CG-CE1 4.26Å
849	D	67.4	Low	53	Low	31 Å²	31	121 Å²	121	17%	0.166	59%	0.593	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-97.7	106.3	171.2	170	36.4	0	0	0	109.6	Y847 K851 T852 G853 K854 M856	Y847-D849 HydrophobicContact CE2-CB 4.41Å; D849-K851 PolarHBondContact O-N 3.18Å; D849-K851 VanDerWaalsContact O-N 3.13Å; D849-K851 WeakPolarHBondContact OD1-CB 3.3Å; D849-K851 PolarHBondContact OD1-N 3.21Å; D849-T852 PolarHBondContact O-N 3.24Å; D849-T852 VanDerWaalsContact OD2-CB 3.29Å; D849-T852 WeakPolarHBondContact OD2-CB 3.44Å; D849-T852 WeakPolarHBondContact OD2-CG2 3.31Å; D849-T852 PolarHBondContact OD2-N 3.03Å; D849-T852 VanDerWaalsContact OD2-N 3.08Å; D849-T852 PolarHBondContact OD2-OG1 3.47Å; D849-G853 PolarHBondContact O-N 3Å; D849-K854 PolarHBondContact N-O 2.95Å; D849-K854 PolarHBondContact O-N 3.37Å; D849-M856 HydrophobicContact CB-CG 4.33Å; D849-M856 HydrophobicContact CB-SD 4.36Å
850	D	67.5	Low	53.6	Low	139 Å²	139	122.8 Å²	122.8	74%	0.743	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59	-22.6	178.4	-61.9	-46.2	0	0	0	113	Y848	Y848-D850 VanDerWaalsContact CD1-OD1 3.32Å; Y848-D850 WeakPolarHBondContact CD1-OD1 3.44Å
851	K	70.8	Confident	53.7	Low	198 Å²	198	119.5 Å²	119.5	86%	0.861	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.1	-31.4	-179	-60.4	174.7	-177	171.4	0	113	D849	D849-K851 PolarHBondContact O-N 3.18Å; D849-K851 VanDerWaalsContact O-N 3.13Å; D849-K851 WeakPolarHBondContact OD1-CB 3.3Å; D849-K851 PolarHBondContact OD1-N 3.21Å
852	T	76.9	Confident	53.6	Low	80 Å²	80	118.1 Å²	118.1	49%	0.491	58%	0.578	S	S	.	*	T	Hydrogen-bonded Turn	trans	-103.3	-7	175.1	58.7	0	0	0	0	113.6	D849 K854	D849-T852 PolarHBondContact O-N 3.24Å; D849-T852 VanDerWaalsContact OD2-CB 3.29Å; D849-T852 WeakPolarHBondContact OD2-CB 3.44Å; D849-T852 WeakPolarHBondContact OD2-CG2 3.31Å; D849-T852 PolarHBondContact OD2-N 3.03Å; D849-T852 VanDerWaalsContact OD2-N 3.08Å; D849-T852 PolarHBondContact OD2-OG1 3.47Å; T852-K854 VanDerWaalsContact C-N 3.25Å; T852-K854 PolarHBondContact O-N 3.13Å
853	G	53.1	Low	53.5	Low	39 Å²	39	121.5 Å²	121.5	40%	0.402	59%	0.589	S	S	.	*	T	Hydrogen-bonded Turn	trans	65.4	27	-178.9	0	0	0	0	0	113.2	Y848 D849	Y848-G853 PolarHBondContact OH-O 3.02Å; D849-G853 PolarHBondContact O-N 3Å
854	K	59.1	Low	52.8	Low	145 Å²	145	119.9 Å²	119.9	63%	0.63	59%	0.59	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-140.1	148.3	-169.8	-72.7	178.6	-175.5	175	0	112.1	D849 T852 M856	D849-K854 PolarHBondContact N-O 2.95Å; D849-K854 PolarHBondContact O-N 3.37Å; T852-K854 VanDerWaalsContact C-N 3.25Å; T852-K854 PolarHBondContact O-N 3.13Å; K854-M856 PolarHBondContact O-N 2.9Å
855	Y	64.9	Low	52.4	Low	172 Å²	172	117.1 Å²	117.1	68%	0.675	59%	0.59	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-71	118.4	169.6	-72.6	-82.3	0	0	0	110.1	I846 Y847 Y848	I846-Y855 HydrophobicContact CG2-CD1 4.19Å; I846-Y855 HydrophobicContact CG2-CG 4.47Å; Y847-Y855 CarbonylContact O-C 3.56Å; Y847-Y855 WeakPolarHBondContact O-CA 3.41Å; Y848-Y855 AromaticContact CD2-CD1 3.93Å; Y848-Y855 HydrophobicContact CD2-CD1 3.93Å; Y848-Y855 AromaticContact CD2-CD2 3.68Å; Y848-Y855 HydrophobicContact CD2-CD2 3.68Å; Y848-Y855 AromaticContact CD2-CE1 3.82Å; Y848-Y855 HydrophobicContact CD2-CE1 3.82Å; Y848-Y855 AromaticContact CD2-CE2 3.54Å; Y848-Y855 HydrophobicContact CD2-CE2 3.54Å; Y848-Y855 AromaticContact CD2-CG 3.87Å; Y848-Y855 HydrophobicContact CD2-CG 3.87Å; Y848-Y855 AromaticContact CD2-CZ 3.61Å; Y848-Y855 HydrophobicContact CE2-CD2 4.08Å; Y848-Y855 AromaticContact CE2-CE2 3.87Å; Y848-Y855 HydrophobicContact CE2-CE2 3.87Å; Y848-Y855 HydrophobicContact CG-CE1 4.26Å
856	M	59.4	Low	51.6	Low	87 Å²	87	119.8 Å²	119.8	43%	0.429	62%	0.618	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-107.4	138.5	173.7	-66	-162.3	70.1	0	0	110	I846 Y847 D849 K854	I846-M856 WeakPolarHBondContact CA-O 3.49Å; I846-M856 WeakPolarHBondContact CG2-O 3.43Å; Y847-M856 PolarHBondContact N-O 2.84Å; Y847-M856 PolarHBondContact O-N 3.48Å; Y847-M856 VanDerWaalsContact O-O 3.11Å; D849-M856 HydrophobicContact CB-CG 4.33Å; D849-M856 HydrophobicContact CB-SD 4.36Å; K854-M856 PolarHBondContact O-N 2.9Å
857	K	61.6	Low	50.2	Low	126 Å²	126	123 Å²	123	55%	0.548	63%	0.633	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-80.2	134.1	169.3	-167.9	-169.8	172.7	-162.7	0	108.3	I846 D860	I846-K857 HydrophobicContact CG1-CB 4.48Å; I846-K857 HydrophobicContact CG1-CG 4.32Å; K857-D860 WeakPolarHBondContact CE-OD1 3.35Å; K857-D860 WeakPolarHBondContact CE-OD2 3.2Å; K857-D860 IonicContact NZ-OD1 3.61Å; K857-D860 PolarHBondContact NZ-OD1 3.36Å; K857-D860 IonicContact NZ-OD2 2.72Å; K857-D860 PolarHBondContact NZ-OD2 2.99Å
858	G	51.6	Low	47.9	Very low	21 Å²	21	122.2 Å²	122.2	22%	0.216	65%	0.645	C	S	.	*			trans	-55	152.7	170	0	0	0	0	0	112.3	G845 D860	G845-G858 PolarHBondContact O-N 3.44Å; G858-D860 PolarHBondContact O-N 2.94Å
859	L	42.8	Very low	46.4	Very low	164 Å²	164	126.6 Å²	126.6	86%	0.859	67%	0.67	S	S	*	*			trans	-64	114.4	-173.5	-135	76.5	0	0	0	111.1	H861	L859-H861 PolarHBondContact O-N 2.89Å
860	D	40	Very low	44.5	Very low	107 Å²	107	132.7 Å²	132.7	57%	0.572	70%	0.697	S	S	*	*			trans	-67.6	114.9	170.9	-65.1	-66.9	0	0	0	109.4	K857 G858 D862	K857-D860 WeakPolarHBondContact CE-OD1 3.35Å; K857-D860 WeakPolarHBondContact CE-OD2 3.2Å; K857-D860 IonicContact NZ-OD1 3.61Å; K857-D860 PolarHBondContact NZ-OD1 3.36Å; K857-D860 IonicContact NZ-OD2 2.72Å; K857-D860 PolarHBondContact NZ-OD2 2.99Å; G858-D860 PolarHBondContact O-N 2.94Å; D860-D862 PolarHBondContact O-N 2.81Å
861	H	32.8	Very low	42.4	Very low	170 Å²	170	137.4 Å²	137.4	79%	0.787	70%	0.704	S	S	*	*			trans	-84.6	93.9	173	-121.4	30.4	0	0	0	110.5	L859	L859-H861 PolarHBondContact O-N 2.89Å
862	D	29.1	Very low	40.6	Very low	146 Å²	146	134.9 Å²	134.9	78%	0.781	70%	0.699	S	S	*	*			trans	32.2	99.7	163.6	-67.7	-39.9	0	0	0	118.9	D860	D860-D862 PolarHBondContact O-N 2.81Å
863	H	28.4	Very low	38.3	Very low	197 Å²	197	136.1 Å²	136.1	91%	0.912	71%	0.711	S	S	*	*			trans	-84.1	118.7	158.3	-70.3	-29.6	0	0	0	111.6
864	S	27	Very low	36.9	Very low	101 Å²	101	145.9 Å²	145.9	71%	0.706	74%	0.736	S	S	*	*			trans	-142.6	147	157.1	70.5	0	0	0	0	109.9
865	N	26.3	Very low	35.4	Very low	161 Å²	161	144.7 Å²	144.7	86%	0.861	74%	0.743	S	S	*	*			cis	-119.4	150.2	-8.5	-90.9	-54.9	0	0	0	110.1
866	G	25.5	Very low	33.5	Very low	78 Å²	78	147.5 Å²	147.5	80%	0.804	75%	0.752	S	S	*	*			trans	-78.7	145.2	-175.1	0	0	0	0	0	114.3
867	M	30.4	Very low	32	Very low	188 Å²	188	148.2 Å²	148.2	93%	0.926	77%	0.766	S	S	*	*			trans	-115.2	139.8	147.2	-67.7	-149.2	-61.4	0	0	109
868	S	30.3	Very low	30.6	Very low	109 Å²	109	151 Å²	151	76%	0.762	78%	0.778	S	S	*	*			trans	-37.7	124.9	-168.3	48.3	0	0	0	0	117	E870	S868-E870 VanDerWaalsContact C-N 3.26Å; S868-E870 PolarHBondContact O-N 3.5Å
869	Q	29.5	Very low	29.4	Very low	199 Å²	199	158.5 Å²	158.5	93%	0.93	81%	0.807	S	S	*	*			trans	-68.9	84.4	154.2	-72.4	-172.2	-0.3	0	0	109.6
870	E	28	Very low	28.9	Very low	159 Å²	159	156 Å²	156	74%	0.743	80%	0.799	S	S	*	*			trans	-68.8	131.6	172.5	-170.6	167.8	-136.1	0	0	110.2	S868 I872	S868-E870 VanDerWaalsContact C-N 3.26Å; S868-E870 PolarHBondContact O-N 3.5Å; E870-I872 VanDerWaalsContact C-N 3.27Å; E870-I872 PolarHBondContact O-N 3.07Å
871	R	23.2	Very low	28.3	Very low	238 Å²	238	156.4 Å²	156.4	90%	0.898	81%	0.805	S	S	*	*			trans	-75.8	74.1	-176.3	-72.5	-175	176.9	176.7	-0	111.9	S873	R871-S873 PolarHBondContact O-N 2.99Å; R871-S873 VanDerWaalsContact O-N 3.1Å
872	I	33	Very low	28.3	Very low	146 Å²	146	153.1 Å²	153.1	75%	0.749	81%	0.807	S	S	*	*			trans	-69	109.5	171.1	-57.7	178.1	0	0	0	108.6	E870	E870-I872 VanDerWaalsContact C-N 3.27Å; E870-I872 PolarHBondContact O-N 3.07Å
873	S	27.4	Very low	28.4	Very low	106 Å²	106	152 Å²	152	74%	0.741	81%	0.806	S	S	*	*			trans	-61.2	145.3	179.7	-68.9	0	0	0	0	111.6	R871 P875	R871-S873 PolarHBondContact O-N 2.99Å; R871-S873 VanDerWaalsContact O-N 3.1Å; S873-P875 WeakPolarHBondContact O-CD 3.08Å; S873-P875 VanDerWaalsContact O-N 3.13Å
874	R	24.2	Very low	28.3	Very low	243 Å²	243	147 Å²	147	92%	0.917	79%	0.793	S	S	*	*			trans	-43.3	114.9	-175.8	-67.8	178.7	176.1	-178.2	-3.1	112.3	R876	R874-R876 PolarHBondContact O-N 3.41Å
875	P	28.8	Very low	28.3	Very low	121 Å²	121	153.7 Å²	153.7	79%	0.786	80%	0.803	S	S	*	*			trans	-65.3	106	161	26.9	-31.1	0	0	0	107.8	S873	S873-P875 WeakPolarHBondContact O-CD 3.08Å; S873-P875 VanDerWaalsContact O-N 3.13Å
876	R	24.2	Very low	28.4	Very low	230 Å²	230	151.7 Å²	151.7	87%	0.868	80%	0.801	S	S	*	*			trans	-50.6	139.1	171.7	167.9	177.4	166.3	149.3	-3.8	109.2	R874 K878	R874-R876 PolarHBondContact O-N 3.41Å; R876-K878 PolarHBondContact O-N 2.96Å
877	S	29	Very low	28.7	Very low	103 Å²	103	154.1 Å²	154.1	72%	0.72	81%	0.806	S	S	*	*			trans	-44.3	116.3	-177.1	-171.9	0	0	0	0	112.2
878	K	30.6	Very low	28.6	Very low	185 Å²	185	147.9 Å²	147.9	80%	0.804	79%	0.79	S	S	*	*			trans	-128.3	135.1	158.5	-72.9	-166.5	174.1	-169.8	0	105.9	R876 T880	R876-K878 PolarHBondContact O-N 2.96Å; K878-T880 PolarHBondContact O-N 3.25Å
879	H	27.6	Very low	28.4	Very low	178 Å²	178	153.8 Å²	153.8	82%	0.824	80%	0.798	S	S	*	*			trans	-63.5	102.7	-174.5	-63	-97.2	0	0	0	110	T881	H879-T881 PolarHBondContact O-N 3.36Å; H879-T881 VanDerWaalsContact O-N 3.12Å
880	T	30.9	Very low	28.4	Very low	112 Å²	112	155.5 Å²	155.5	69%	0.687	80%	0.797	S	S	*	*			trans	-79	94.9	176.3	179.7	0	0	0	0	109.3	K878 A882	K878-T880 PolarHBondContact O-N 3.25Å; T880-A882 PolarHBondContact O-N 3.06Å
881	T	29	Very low	28.6	Very low	114 Å²	114	151.2 Å²	151.2	70%	0.699	80%	0.795	S	S	*	*			trans	-52	131.5	168.3	-49.5	0	0	0	0	108.7	H879 T883	H879-T881 PolarHBondContact O-N 3.36Å; H879-T881 VanDerWaalsContact O-N 3.12Å; T881-T883 PolarHBondContact O-N 2.81Å
882	A	31.1	Very low	28.9	Very low	101 Å²	101	148 Å²	148	84%	0.835	79%	0.794	S	S	*	*	S	Bend	trans	-74.7	61	-163.3	0	0	0	0	0	114.8	T880	T880-A882 PolarHBondContact O-N 3.06Å
883	T	31.3	Very low	29.2	Very low	123 Å²	123	147.4 Å²	147.4	76%	0.755	79%	0.793	S	S	*	*			trans	-136.2	29.6	178.2	52.8	0	0	0	0	112.7	T881	T881-T883 PolarHBondContact O-N 2.81Å
884	S	27.6	Very low	29.8	Very low	91 Å²	91	144.4 Å²	144.4	64%	0.636	78%	0.778	S	S	*	*			trans	-99.8	117.6	166.3	56.9	0	0	0	0	110.3	S886	S884-S886 PolarHBondContact O-N 2.95Å
885	R	26.6	Very low	30.6	Very low	243 Å²	243	136.9 Å²	136.9	92%	0.917	76%	0.763	S	S	*	*			trans	-87.1	98.2	-174.9	-61.7	171.8	74.2	-169.9	4.8	110.9	S887	R885-S887 PolarHBondContact O-N 3.48Å
886	S	28.8	Very low	31.6	Very low	118 Å²	118	139.2 Å²	139.2	83%	0.825	76%	0.761	S	S	*	*			trans	-72.7	108.2	164.6	43.7	0	0	0	0	109.9	S884	S884-S886 PolarHBondContact O-N 2.95Å
887	S	31.5	Very low	32.4	Very low	129 Å²	129	132.4 Å²	132.4	90%	0.902	74%	0.738	S	S	*	*			trans	-69	131.3	168.7	-169	0	0	0	0	109.3	R885	R885-S887 PolarHBondContact O-N 3.48Å
888	G	28.1	Very low	33	Very low	58 Å²	58	128.6 Å²	128.6	60%	0.598	71%	0.712	S	S	*	*			trans	158.3	-26.3	171.4	0	0	0	0	0	118.2
889	Y	27.2	Very low	34.5	Very low	233 Å²	233	123.8 Å²	123.8	91%	0.914	70%	0.695	S	S	*	*			trans	-121	116.2	-173.2	-81.4	-87.3	0	0	0	114	G891	Y889-G891 PolarHBondContact O-N 3.48Å; Y889-G891 VanDerWaalsContact O-N 3.15Å
890	Y	27.8	Very low	36.2	Very low	235 Å²	235	118.3 Å²	118.3	92%	0.922	67%	0.671	S	S	*	*			trans	-70.4	100.3	170.7	-73.9	-92.3	0	0	0	110.2	I892	Y890-I892 PolarHBondContact O-N 3.12Å
891	G	32.2	Very low	37.5	Very low	68 Å²	68	115.3 Å²	115.3	70%	0.701	65%	0.65	S	S	*	*	P	Polyproline II helix	trans	-71.1	120.8	173.7	0	0	0	0	0	111.4	Y889 N893	Y889-G891 PolarHBondContact O-N 3.48Å; Y889-G891 VanDerWaalsContact O-N 3.15Å; G891-N893 PolarHBondContact O-N 3.41Å
892	I	30.7	Very low	39.2	Very low	172 Å²	172	112.1 Å²	112.1	88%	0.882	63%	0.632	S	S	*	*	P	Polyproline II helix	trans	-60.4	134	178	-61.5	170.2	0	0	0	109.7	Y890	Y890-I892 PolarHBondContact O-N 3.12Å
893	N	39.4	Very low	40.6	Very low	133 Å²	133	110 Å²	110	71%	0.711	61%	0.609	S	S	*	*	P	Polyproline II helix	trans	-62.1	146	-176.8	-76.5	-56.9	0	0	0	112.3	G891	G891-N893 PolarHBondContact O-N 3.41Å
894	G	39.4	Very low	42.3	Very low	42 Å²	42	107 Å²	107	43%	0.433	59%	0.585	S	S	.	*	P	Polyproline II helix	trans	-62.5	158.8	174.5	0	0	0	0	0	112.8	K896	G894-K896 PolarHBondContact O-N 3.11Å
895	S	40.2	Very low	43.6	Very low	85 Å²	85	108.9 Å²	108.9	59%	0.594	58%	0.579	S	S	*	*	P	Polyproline II helix	trans	-48.7	128.6	-175.2	-176.4	0	0	0	0	112.5	H897	S895-H897 VanDerWaalsContact C-N 3.27Å; S895-H897 PolarHBondContact OG-CD2 3.34Å; S895-H897 PolarHBondContact OG-N 3.29Å
896	K	49.7	Very low	45.4	Very low	171 Å²	171	104.7 Å²	104.7	74%	0.743	56%	0.563	S	S	*	*	S	Bend	trans	-83.6	-0.5	177.7	-64.8	-176.2	177.9	-178.1	0	113.3	G894	G894-K896 PolarHBondContact O-N 3.11Å
897	H	41	Very low	46.8	Very low	86 Å²	86	100 Å²	100	40%	0.398	53%	0.529	S	S	.	.	S	Bend	trans	-101	19.2	-164.5	-52.1	-72.5	0	0	0	113.5	S895 Q1043	S895-H897 VanDerWaalsContact C-N 3.27Å; S895-H897 PolarHBondContact OG-CD2 3.34Å; S895-H897 PolarHBondContact OG-N 3.29Å; H897-Q1043 PolarHBondContact O-N 2.79Å
898	S	43	Very low	47.9	Very low	24 Å²	24	98.8 Å²	98.8	17%	0.168	51%	0.512	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.4	142.2	176.9	60.1	0	0	0	0	114.3	W1040 I1041	S898-W1040 VanDerWaalsContact CB-CE3 3.47Å; S898-W1040 WeakPolarHBondContact OG-CH2 3.3Å; S898-W1040 VanDerWaalsContact OG-CZ3 3.25Å; S898-W1040 WeakPolarHBondContact OG-CZ3 3.21Å; S898-I1041 CarbonylContact C-O 3.54Å; S898-I1041 WeakPolarHBondContact CA-O 3.29Å
899	L	62	Low	49	Very low	84 Å²	84	96.8 Å²	96.8	44%	0.44	49%	0.488	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	126.7	167.4	175.2	63	0	0	0	109	I901 I1041	L899-I901 HydrophobicContact CD2-CG1 4.38Å; L899-I901 HydrophobicContact CG-CG1 4.27Å; L899-I1041 HydrophobicContact CB-CB 4.31Å; L899-I1041 HydrophobicContact CD2-CD1 4.47Å; L899-I1041 PolarHBondContact N-O 3.1Å; L899-I1041 PolarHBondContact O-N 3.08Å
900	I	62.5	Low	49.8	Very low	63 Å²	63	87.2 Å²	87.2	32%	0.323	46%	0.461	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	105	178.5	-57.8	-179.5	0	0	0	109	R1038 W1040	I900-R1038 HydrophobicContact CG2-CG 3.73Å; I900-W1040 HydrophobicContact CD1-CZ2 4.14Å; I900-W1040 HydrophobicContact CG1-CD2 4.42Å; I900-W1040 HydrophobicContact CG1-CG 4.42Å
901	I	58	Low	50.7	Low	48 Å²	48	81.5 Å²	81.5	25%	0.246	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	113.3	173.3	-58.4	-175	0	0	0	108.1	L899 R1038 V1039 I1041	L899-I901 HydrophobicContact CD2-CG1 4.38Å; L899-I901 HydrophobicContact CG-CG1 4.27Å; I901-R1038 CarbonylContact O-C 3.51Å; I901-R1038 WeakPolarHBondContact O-CA 3.42Å; I901-V1039 HydrophobicContact CB-CB 4.46Å; I901-V1039 PolarHBondContact N-O 2.99Å; I901-V1039 PolarHBondContact O-N 3.43Å; I901-I1041 HydrophobicContact CD1-CD1 3.58Å; I901-I1041 HydrophobicContact CG1-CD1 4.17Å
902	S	65	Low	51.2	Low	48 Å²	48	81.5 Å²	81.5	34%	0.336	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	125.8	171.7	50.6	0	0	0	0	110.9	S1037	S902-S1037 WeakPolarHBondContact CA-O 3.4Å
903	T	61.7	Low	51.3	Low	55 Å²	55	76.8 Å²	76.8	34%	0.337	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	138.1	168.4	67.2	0	0	0	0	108.8	S1035 L1036 S1037	T903-S1035 CarbonylContact O-C 3.55Å; T903-S1035 VanDerWaalsContact O-CA 3.3Å; T903-S1035 WeakPolarHBondContact O-CA 3.43Å; T903-L1036 PolarHBondContact O-N 2.92Å; T903-L1036 WeakPolarHBondContact OG1-CB 3.39Å; T903-S1037 WeakPolarHBondContact CG2-OG 3.34Å; T903-S1037 PolarHBondContact N-O 3.4Å; T903-S1037 PolarHBondContact OG1-N 3.15Å; T903-S1037 PolarHBondContact OG1-O 3.04Å; T903-S1037 PolarHBondContact OG1-OG 3.05Å
904	K	65.3	Low	50.9	Low	60 Å²	60	75.5 Å²	75.5	26%	0.261	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	136.4	174.1	-76.1	177.4	163.6	-162.3	0	108.8	D1031 H1033 E1034	K904-D1031 IonicContact NZ-OD2 2.99Å; K904-D1031 PolarHBondContact NZ-OD2 2.65Å; K904-H1033 HydrophobicContact CB-CB 4.47Å; K904-H1033 HydrophobicContact CD-CB 3.88Å; K904-H1033 HydrophobicContact CG-CB 4.45Å; K904-E1034 VanDerWaalsContact CA-O 3.23Å; K904-E1034 WeakPolarHBondContact CA-O 3.34Å
905	R	55	Low	50.5	Low	132 Å²	132	76.4 Å²	76.4	50%	0.498	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	159	156.1	66.9	179	-179.7	-137.2	-11.6	109.4	H1033 E1034 L1036	R905-H1033 WeakPolarHBondContact O-CA 3.45Å; R905-H1033 PolarHBondContact O-ND1 2.84Å; R905-E1034 HydrophobicContact CG-CG 3.52Å; R905-E1034 IonicContact CZ-OE1 3.2Å; R905-E1034 IonicContact CZ-OE2 3.83Å; R905-E1034 PolarHBondContact N-O 3.1Å; R905-E1034 IonicContact NE-OE1 3.05Å; R905-E1034 PolarHBondContact NE-OE1 2.95Å; R905-E1034 IonicContact NE-OE2 2.69Å; R905-E1034 PolarHBondContact NE-OE2 3.22Å; R905-E1034 VanDerWaalsContact NH2-CD 3.25Å; R905-E1034 IonicContact NH2-OE1 3.12Å; R905-E1034 PolarHBondContact NH2-OE1 3.08Å; R905-E1034 IonicContact NH2-OE2 2.64Å; R905-E1034 PolarHBondContact NH2-OE2 3.18Å; R905-E1034 PolarHBondContact O-N 3.12Å; R905-L1036 HydrophobicContact CB-CD1 3.93Å; R905-L1036 HydrophobicContact CB-CG 4.34Å; R905-L1036 HydrophobicContact CG-CD1 4.07Å; R905-L1036 HydrophobicContact CG-CD2 4.02Å; R905-L1036 HydrophobicContact CG-CG 4.05Å
906	R	64.2	Low	50.4	Low	155 Å²	155	74.6 Å²	74.6	59%	0.585	40%	0.402	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.6	121.8	170.3	-155.7	172.6	-135.7	177.5	2.1	106.6	G1032 H1033	R906-G1032 CarbonylContact C-O 3.56Å; R906-G1032 WeakPolarHBondContact CA-O 3.41Å; R906-G1032 WeakPolarHBondContact CG-O 3.46Å; R906-H1033 WeakPolarHBondContact CA-ND1 3.3Å
907	T	59.2	Low	49.6	Very low	18 Å²	18	70.9 Å²	70.9	11%	0.11	40%	0.398	C	S	.	.	P	Polyproline II helix	trans	-68.4	152.7	170.9	47.7	0	0	0	0	108.2	S909 G910 G1032 H1033 E1034	T907-S909 WeakPolarHBondContact CB-OG 3.42Å; T907-S909 PolarHBondContact O-N 3Å; T907-S909 PolarHBondContact OG1-OG 3.29Å; T907-G910 PolarHBondContact O-N 2.89Å; T907-G910 VanDerWaalsContact O-N 3.09Å; T907-G1032 PolarHBondContact N-O 3.41Å; T907-G1032 WeakPolarHBondContact OG1-CA 3.33Å; T907-G1032 PolarHBondContact OG1-O 3.41Å; T907-G1032 VanDerWaalsContact OG1-O 3.12Å; T907-H1033 PolarHBondContact OG1-N 3.4Å; T907-E1034 HydrophobicContact CG2-CB 3.72Å; T907-E1034 HydrophobicContact CG2-CG 3.76Å; T907-E1034 VanDerWaalsContact CG2-OE1 3.29Å; T907-E1034 WeakPolarHBondContact CG2-OE1 3.3Å
908	L	54.1	Low	49.4	Very low	105 Å²	105	76.7 Å²	76.7	55%	0.55	42%	0.422	S	S	.	.	G	3₁₀ helix	trans	-55.1	-32.3	165.3	-57.7	-178.6	0	0	0	110.4	G910 L911	L908-G910 PolarHBondContact O-N 3.37Å; L908-L911 PolarHBondContact O-N 2.82Å; L908-L911 VanDerWaalsContact O-N 3.12Å
909	S	52.3	Low	49.1	Very low	15 Å²	15	83.5 Å²	83.5	11%	0.105	45%	0.451	C	S	.	.	G	3₁₀ helix	trans	-52	-15.8	174	90.4	0	0	0	0	116.4	L671 T907 L1029	L671-S909 CarbonylContact O-C 3.04Å; L671-S909 WeakPolarHBondContact O-CA 3.45Å; T907-S909 WeakPolarHBondContact CB-OG 3.42Å; T907-S909 PolarHBondContact O-N 3Å; T907-S909 PolarHBondContact OG1-OG 3.29Å; S909-L1029 WeakPolarHBondContact OG-CA 3.38Å; S909-L1029 PolarHBondContact OG-O 3.28Å
910	G	42.6	Very low	47.7	Very low	33 Å²	33	91.1 Å²	91.1	34%	0.34	47%	0.474	S	S	.	.	G	3₁₀ helix	trans	-97.4	-9.5	-179.1	0	0	0	0	0	116.5	T907 L908	T907-G910 PolarHBondContact O-N 2.89Å; T907-G910 VanDerWaalsContact O-N 3.09Å; L908-G910 PolarHBondContact O-N 3.37Å
911	L	47.6	Very low	46.4	Very low	115 Å²	115	92.3 Å²	92.3	60%	0.602	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.5	-26	-171.1	-85.6	163.7	0	0	0	114.1	L908	L908-L911 PolarHBondContact O-N 2.82Å; L908-L911 VanDerWaalsContact O-N 3.12Å
912	T	43	Very low	45.5	Very low	67 Å²	67	95.5 Å²	95.5	41%	0.411	51%	0.514	S	S	.	.			trans	-148.1	104.3	-174	49.5	0	0	0	0	110.9	R670 L671 T914	R670-T912 CarbonylContact C-O 3.58Å; L671-T912 WeakPolarHBondContact CD1-O 3.49Å; L671-T912 WeakPolarHBondContact CD1-OG1 3.41Å; L671-T912 PolarHBondContact N-O 3.02Å; T912-T914 VanDerWaalsContact C-N 3.33Å; T912-T914 PolarHBondContact O-N 2.98Å; T912-T914 VanDerWaalsContact O-N 3.08Å
913	G	33.1	Very low	44.1	Very low	73 Å²	73	98 Å²	98	75%	0.753	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.6	36.5	-167.4	0	0	0	0	0	117.6	R670	R670-G913 CarbonylContact O-C 3.55Å; R670-G913 WeakPolarHBondContact O-CA 3.37Å
914	T	30.6	Very low	42.7	Very low	107 Å²	107	99.5 Å²	99.5	66%	0.656	54%	0.536	S	S	*	.	T	Hydrogen-bonded Turn	trans	-121	-8.2	-170.1	43.9	0	0	0	0	118.4	R670 L671 T912	R670-T914 PolarHBondContact O-N 3.12Å; L671-T914 WeakPolarHBondContact CD1-OG1 3.44Å; T912-T914 VanDerWaalsContact C-N 3.33Å; T912-T914 PolarHBondContact O-N 2.98Å; T912-T914 VanDerWaalsContact O-N 3.08Å
915	H	31.1	Very low	41.2	Very low	61 Å²	61	103 Å²	103	28%	0.282	56%	0.558	S	S	.	*			trans	65.8	137.2	-170.4	-151.5	-90.6	0	0	0	113.2	K669 R670 L671 S917	K669-H915 HydrophobicContact CB-CB 4.23Å; K669-H915 HydrophobicContact CG-CB 4.01Å; R670-H915 VanDerWaalsContact C-CA 3.5Å; R670-H915 HydrophobicContact CB-CB 4.29Å; R670-H915 VanDerWaalsContact CB-CD2 3.46Å; R670-H915 WeakPolarHBondContact CB-CD2 3.5Å; R670-H915 PolarHBondContact N-CD2 3.45Å; R670-H915 VanDerWaalsContact N-CD2 3.29Å; R670-H915 PolarHBondContact NE-CD2 3.32Å; R670-H915 PolarHBondContact NE-NE2 3.41Å; R670-H915 PolarHBondContact NH2-CE1 2.78Å; R670-H915 PolarHBondContact NH2-NE2 2.88Å; R670-H915 VanDerWaalsContact NH2-NE2 3.16Å; R670-H915 PolarHBondContact O-N 3.16Å; L671-H915 VanDerWaalsContact CD1-N 3.29Å; H915-S917 PolarHBondContact O-N 3.06Å; H915-S917 VanDerWaalsContact O-N 3.1Å
916	P	37.6	Very low	40.1	Very low	47 Å²	47	101.9 Å²	101.9	31%	0.305	57%	0.566	S	S	.	*			trans	-85.9	101.1	179.4	10.6	5.7	0	0	0	104.7	L671 D672 K918	L671-P916 HydrophobicContact CB-CG 3.82Å; L671-P916 HydrophobicContact CD2-CB 3.86Å; L671-P916 HydrophobicContact CD2-CG 3.96Å; L671-P916 HydrophobicContact CG-CB 3.94Å; L671-P916 HydrophobicContact CG-CG 3.64Å; D672-P916 HydrophobicContact CB-CG 3.69Å; D672-P916 VanDerWaalsContact OD2-CD 3.23Å; D672-P916 WeakPolarHBondContact OD2-CD 3.3Å; P916-K918 PolarHBondContact O-N 3.37Å
917	S	33.3	Very low	38.6	Very low	93 Å²	93	97 Å²	97	65%	0.65	55%	0.551	S	S	*	*			trans	-66	82.5	176.6	50.7	0	0	0	0	110	H915 H919	H915-S917 PolarHBondContact O-N 3.06Å; H915-S917 VanDerWaalsContact O-N 3.1Å; S917-H919 PolarHBondContact O-CD2 2.64Å; S917-H919 PolarHBondContact O-N 3.46Å
918	K	36.9	Very low	37.3	Very low	208 Å²	208	106.6 Å²	106.6	90%	0.904	59%	0.585	S	S	*	*	S	Bend	trans	46.4	22.1	166.5	-62.1	-178.4	179.6	176.7	0	117	P916 R920	P916-K918 PolarHBondContact O-N 3.37Å; K918-R920 PolarHBondContact O-N 2.65Å
919	H	35.3	Very low	36.2	Very low	166 Å²	166	107.8 Å²	107.8	77%	0.769	59%	0.586	S	S	*	*			trans	-78.1	93.6	174.8	-93.9	-78.1	0	0	0	111.8	S917 S921	S917-H919 PolarHBondContact O-CD2 2.64Å; S917-H919 PolarHBondContact O-N 3.46Å; H919-S921 VanDerWaalsContact C-N 3.3Å; H919-S921 PolarHBondContact O-N 3.1Å
920	R	32.9	Very low	35.7	Very low	244 Å²	244	110.3 Å²	110.3	92%	0.921	61%	0.614	S	S	*	*			trans	-75.9	76.9	174.7	-169	179.7	-168.7	-123.9	8.6	110.2	K918 S922	K918-R920 PolarHBondContact O-N 2.65Å; R920-S922 PolarHBondContact O-N 3.27Å
921	S	35.6	Very low	35.7	Very low	89 Å²	89	116.9 Å²	116.9	62%	0.622	64%	0.641	S	S	*	*			trans	-48.3	118.6	-177.6	-60.5	0	0	0	0	112.5	H919 S923	H919-S921 VanDerWaalsContact C-N 3.3Å; H919-S921 PolarHBondContact O-N 3.1Å; S921-S923 PolarHBondContact O-N 2.95Å
922	S	39.7	Very low	34.8	Very low	115 Å²	115	119 Å²	119	80%	0.804	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.3	-1.6	-169.4	48.9	0	0	0	0	115.1	R920 M924	R920-S922 PolarHBondContact O-N 3.27Å; S922-M924 PolarHBondContact O-N 3.17Å; S922-M924 VanDerWaalsContact O-N 3.08Å
923	S	35.4	Very low	34.2	Very low	101 Å²	101	121.4 Å²	121.4	71%	0.706	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70	1.1	-179.1	51.1	0	0	0	0	115.3	S921 N925	S921-S923 PolarHBondContact O-N 2.95Å; S923-N925 PolarHBondContact O-N 3.4Å
924	M	32.8	Very low	34.7	Very low	86 Å²	86	124.2 Å²	124.2	42%	0.424	67%	0.667	S	S	.	*	T	Hydrogen-bonded Turn	trans	-72	18.7	177.4	-100.8	-174.2	71.6	0	0	115.3	K678 S922 L927	K678-M924 VanDerWaalsContact CE-O 3.23Å; K678-M924 WeakPolarHBondContact CE-O 3.24Å; K678-M924 PolarHBondContact NZ-O 3.48Å; S922-M924 PolarHBondContact O-N 3.17Å; S922-M924 VanDerWaalsContact O-N 3.08Å; M924-L927 WeakPolarHBondContact O-CD1 3.27Å
925	N	33	Very low	34.9	Very low	134 Å²	134	123.4 Å²	123.4	72%	0.717	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.3	-14.1	177.9	-86.9	-7.5	0	0	0	115.7	K678 S923 L927	K678-N925 PolarHBondContact NZ-OD1 3.38Å; S923-N925 PolarHBondContact O-N 3.4Å; N925-L927 PolarHBondContact O-N 2.85Å
926	T	31.8	Very low	35.3	Very low	108 Å²	108	124.2 Å²	124.2	66%	0.663	68%	0.676	S	S	*	*			trans	-100.3	64.8	173.5	-41.1	0	0	0	0	110.9
927	L	33.5	Very low	35.9	Very low	51 Å²	51	130.6 Å²	130.6	27%	0.267	70%	0.702	S	S	.	*			trans	-81	124.5	166.2	-84.7	71	0	0	0	108.3	P677 K678 M924 N925 F929	P677-L927 HydrophobicContact CB-CD2 4.47Å; K678-L927 HydrophobicContact CB-CD2 3.99Å; K678-L927 HydrophobicContact CD-CD1 4.39Å; K678-L927 HydrophobicContact CD-CD2 4.07Å; K678-L927 HydrophobicContact CG-CD2 3.87Å; M924-L927 WeakPolarHBondContact O-CD1 3.27Å; N925-L927 PolarHBondContact O-N 2.85Å; L927-F929 HydrophobicContact CB-CD2 4.47Å; L927-F929 HydrophobicContact CB-CE2 3.9Å; L927-F929 WeakPolarHBondContact O-CD2 3.48Å
928	W	30.5	Very low	36.2	Very low	221 Å²	221	137.7 Å²	137.7	84%	0.837	71%	0.714	S	S	*	*			trans	-89.3	141.8	171.3	-63	71.8	0	0	0	108.7
929	F	32.1	Very low	36.4	Very low	130 Å²	130	132.4 Å²	132.4	57%	0.57	70%	0.7	S	S	*	*			trans	-117.9	62.2	-169.2	-77	-101.5	0	0	0	112	K678 L927	K678-F929 HydrophobicContact CB-CZ 4.37Å; L927-F929 HydrophobicContact CB-CD2 4.47Å; L927-F929 HydrophobicContact CB-CE2 3.9Å; L927-F929 WeakPolarHBondContact O-CD2 3.48Å
930	G	41.4	Very low	36.6	Very low	67 Å²	67	130.3 Å²	130.3	69%	0.691	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	60.6	-156.7	178.8	0	0	0	0	0	113.6	H932	G930-H932 PolarHBondContact O-N 3Å
931	D	43.4	Very low	36.8	Very low	171 Å²	171	122.1 Å²	122.1	91%	0.914	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.8	16	-176.6	-59.3	-54.8	0	0	0	113.8	P933	D931-P933 WeakPolarHBondContact O-CD 3.48Å
932	H	27.6	Very low	37.5	Very low	160 Å²	160	124.4 Å²	124.4	74%	0.741	69%	0.687	S	S	*	*	S	Bend	trans	-80.4	116.5	170.3	-65.4	-38	0	0	0	110	G930 V934	G930-H932 PolarHBondContact O-N 3Å; H932-V934 PolarHBondContact O-N 3.44Å
933	P	31.5	Very low	37.7	Very low	117 Å²	117	123 Å²	123	76%	0.76	68%	0.682	S	S	*	*	P	Polyproline II helix	trans	-63.1	128.1	178.7	25.8	-33.5	0	0	0	109.9	D931 P935	D931-P933 WeakPolarHBondContact O-CD 3.48Å; P933-P935 WeakPolarHBondContact O-CD 3.31Å
934	V	42	Very low	38	Very low	133 Å²	133	123 Å²	123	81%	0.806	68%	0.678	S	S	*	*	P	Polyproline II helix	trans	-53	121.6	177.8	178.4	0	0	0	0	108.9	H932 S936	H932-V934 PolarHBondContact O-N 3.44Å; V934-S936 PolarHBondContact O-N 3.12Å
935	P	35.7	Very low	38.5	Very low	89 Å²	89	124.5 Å²	124.5	58%	0.578	69%	0.694	S	S	*	*			trans	-58.1	111.3	-177.8	-27.5	35.8	0	0	0	111.1	P933	P933-P935 WeakPolarHBondContact O-CD 3.31Å
936	S	39.3	Very low	39.8	Very low	79 Å²	79	123.7 Å²	123.7	55%	0.552	69%	0.694	S	S	*	*			trans	-60	142.7	176.6	65.9	0	0	0	0	110	V934 R938 T939	V934-S936 PolarHBondContact O-N 3.12Å; S936-R938 PolarHBondContact O-N 3.5Å; S936-T939 PolarHBondContact O-N 3.4Å; S936-T939 PolarHBondContact O-OG1 2.91Å; S936-T939 VanDerWaalsContact O-OG1 3.09Å
937	E	50.4	Low	41	Very low	181 Å²	181	130.3 Å²	130.3	85%	0.846	71%	0.706	S	S	*	*	G	3₁₀ helix	trans	-48	-26.6	-168.5	-58.6	172.7	149.2	0	0	115.2	T939	E937-T939 PolarHBondContact O-N 2.84Å
938	R	39.8	Very low	42.8	Very low	241 Å²	241	130.2 Å²	130.2	91%	0.909	71%	0.706	S	S	*	*	G	3₁₀ helix	trans	-74.8	-13.1	-177.5	-65.2	-174.8	176.8	-175	-1.2	115.9	S936	S936-R938 PolarHBondContact O-N 3.5Å
939	T	41.2	Very low	45	Very low	97 Å²	97	122.2 Å²	122.2	60%	0.595	68%	0.684	S	S	*	*	G	3₁₀ helix	trans	-95.8	-4.3	179	50.8	0	0	0	0	114.2	S936 E937 S941	S936-T939 PolarHBondContact O-N 3.4Å; S936-T939 PolarHBondContact O-OG1 2.91Å; S936-T939 VanDerWaalsContact O-OG1 3.09Å; E937-T939 PolarHBondContact O-N 2.84Å; T939-S941 VanDerWaalsContact C-N 3.33Å; T939-S941 PolarHBondContact O-N 3.37Å
940	L	38.9	Very low	47.2	Very low	122 Å²	122	121.8 Å²	121.8	64%	0.639	69%	0.688	S	S	*	*			trans	-83.2	72.6	179.3	-65.4	177.4	0	0	0	111.8	P942	L940-P942 WeakPolarHBondContact O-CD 3.44Å
941	S	36.9	Very low	48.8	Very low	73 Å²	73	124.7 Å²	124.7	51%	0.51	69%	0.686	S	S	.	*			trans	-67.7	124.9	164.3	-176.9	0	0	0	0	109.7	T939 A943 T944	T939-S941 VanDerWaalsContact C-N 3.33Å; T939-S941 PolarHBondContact O-N 3.37Å; S941-A943 PolarHBondContact O-N 2.83Å; S941-T944 PolarHBondContact O-OG1 2.77Å
942	P	51.8	Low	50.5	Low	137 Å²	137	120.4 Å²	120.4	89%	0.89	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.3	-11.5	-175.3	-25.8	35.5	0	0	0	115.9	L940	L940-P942 WeakPolarHBondContact O-CD 3.44Å
943	A	42.1	Very low	52.9	Low	86 Å²	86	116.9 Å²	116.9	71%	0.711	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.5	-14	-172.8	0	0	0	0	0	115	S941 P945	S941-A943 PolarHBondContact O-N 2.83Å; A943-P945 WeakPolarHBondContact O-CD 3.4Å
944	T	42	Very low	55.1	Low	100 Å²	100	117.7 Å²	117.7	61%	0.613	64%	0.64	S	S	*	*	S	Bend	trans	-106.6	102.1	-178.9	49.6	0	0	0	0	111	S941 V946	S941-T944 PolarHBondContact O-OG1 2.77Å; T944-V946 PolarHBondContact O-N 2.7Å
945	P	44.7	Very low	56.7	Low	118 Å²	118	114 Å²	114	77%	0.766	62%	0.623	S	S	*	*			trans	-64.3	133.7	176.3	26.4	-33.6	0	0	0	110.6	A943 R947	A943-P945 WeakPolarHBondContact O-CD 3.4Å; P945-R947 PolarHBondContact O-N 2.91Å; P945-R947 VanDerWaalsContact O-N 3.13Å
946	V	60	Low	58.7	Low	117 Å²	117	110.4 Å²	110.4	71%	0.709	60%	0.599	S	S	*	*			trans	-62.4	115.2	-178.8	178.5	0	0	0	0	109.5	T944 L948	T944-V946 PolarHBondContact O-N 2.7Å; V946-L948 HydrophobicContact CG1-CD2 4.4Å; V946-L948 PolarHBondContact O-N 3.43Å
947	R	56.7	Low	60.4	Low	246 Å²	246	108.3 Å²	108.3	93%	0.928	59%	0.586	S	S	*	*			trans	-72.8	89.5	173.9	-79.4	-176.2	168.3	170.8	-3.5	110	P945	P945-R947 PolarHBondContact O-N 2.91Å; P945-R947 VanDerWaalsContact O-N 3.13Å
948	L	72	Confident	61.9	Low	49 Å²	49	103.3 Å²	103.3	26%	0.257	56%	0.562	S	S	.	*			trans	-62.3	143.9	167.5	-62.4	170.8	0	0	0	110.1	D680 V946 Q952 I953	D680-L948 WeakPolarHBondContact O-CD1 3.45Å; V946-L948 HydrophobicContact CG1-CD2 4.4Å; V946-L948 PolarHBondContact O-N 3.43Å; L948-Q952 VanDerWaalsContact CA-OE1 3.3Å; L948-Q952 HydrophobicContact CB-CB 4.15Å; L948-Q952 HydrophobicContact CD2-CB 4.38Å; L948-I953 HydrophobicContact CB-CD1 4.34Å; L948-I953 HydrophobicContact CB-CG1 3.82Å
949	S	75.5	Confident	63.5	Low	54 Å²	54	94.3 Å²	94.3	38%	0.378	53%	0.532	S	S	.	.			trans	-72.6	158.3	173.3	73.6	0	0	0	0	111.3	I951 Q952 I953	S949-I951 PolarHBondContact O-N 2.96Å; S949-I951 VanDerWaalsContact O-N 3.1Å; S949-Q952 WeakPolarHBondContact O-CB 3.12Å; S949-Q952 PolarHBondContact O-N 3.41Å; S949-Q952 WeakPolarHBondContact OG-CG 3.23Å; S949-Q952 PolarHBondContact OG-N 2.7Å; S949-I953 WeakPolarHBondContact O-CG1 3.09Å; S949-I953 PolarHBondContact O-N 2.94Å
950	N	77.6	Confident	65.2	Low	121 Å²	121	92.6 Å²	92.6	65%	0.647	52%	0.517	S	S	*	.	H	α-helix	trans	-54.1	-34.8	179.3	-73.1	-10.4	0	0	0	112.7	I953 Q954	N950-I953 PolarHBondContact O-N 2.91Å; N950-Q954 WeakPolarHBondContact O-CB 3.46Å; N950-Q954 WeakPolarHBondContact O-CG 3.5Å; N950-Q954 PolarHBondContact O-N 3.2Å
951	I	76.3	Confident	66.6	Low	127 Å²	127	94.1 Å²	94.1	65%	0.651	52%	0.515	S	S	*	.	H	α-helix	trans	-75.2	-32	179.6	-136.6	165.2	0	0	0	112.1	S949 A955	S949-I951 PolarHBondContact O-N 2.96Å; S949-I951 VanDerWaalsContact O-N 3.1Å; I951-A955 VanDerWaalsContact O-CB 3.3Å; I951-A955 WeakPolarHBondContact O-CB 3.28Å; I951-A955 PolarHBondContact O-N 3.4Å
952	Q	78.1	Confident	67.9	Low	81 Å²	81	98.2 Å²	98.2	38%	0.379	52%	0.519	S	S	.	.	H	α-helix	trans	-67.3	-43.1	169.9	-71.6	168.4	-19.6	0	0	110.8	L948 S949 Q954 A955 Q956	L948-Q952 VanDerWaalsContact CA-OE1 3.3Å; L948-Q952 HydrophobicContact CB-CB 4.15Å; L948-Q952 HydrophobicContact CD2-CB 4.38Å; S949-Q952 WeakPolarHBondContact O-CB 3.12Å; S949-Q952 PolarHBondContact O-N 3.41Å; S949-Q952 WeakPolarHBondContact OG-CG 3.23Å; S949-Q952 PolarHBondContact OG-N 2.7Å; Q952-Q954 VanDerWaalsContact C-N 3.34Å; Q952-Q954 PolarHBondContact O-N 2.67Å; Q952-A955 PolarHBondContact O-N 3.41Å; Q952-Q956 WeakPolarHBondContact O-CB 3.31Å; Q952-Q956 PolarHBondContact O-N 2.86Å
953	I	78.1	Confident	68.5	Low	86 Å²	86	98.1 Å²	98.1	44%	0.441	51%	0.506	S	S	.	.	H	α-helix	trans	-62.5	-41.5	175.9	-63.5	168.6	0	0	0	110.8	L948 S949 N950 A957	L948-I953 HydrophobicContact CB-CD1 4.34Å; L948-I953 HydrophobicContact CB-CG1 3.82Å; S949-I953 WeakPolarHBondContact O-CG1 3.09Å; S949-I953 PolarHBondContact O-N 2.94Å; N950-I953 PolarHBondContact O-N 2.91Å; I953-A957 VanDerWaalsContact O-CB 3.32Å; I953-A957 WeakPolarHBondContact O-CB 3.46Å; I953-A957 PolarHBondContact O-N 2.8Å
954	Q	77.2	Confident	69.2	Low	135 Å²	135	102.1 Å²	102.1	63%	0.631	50%	0.503	S	S	*	.	H	α-helix	trans	-65.2	-48.4	173.9	-77.1	-178.7	-4.7	0	0	112.3	N950 Q952 Q956 A957 E958	N950-Q954 WeakPolarHBondContact O-CB 3.46Å; N950-Q954 WeakPolarHBondContact O-CG 3.5Å; N950-Q954 PolarHBondContact O-N 3.2Å; Q952-Q954 VanDerWaalsContact C-N 3.34Å; Q952-Q954 PolarHBondContact O-N 2.67Å; Q954-Q956 VanDerWaalsContact C-N 3.28Å; Q954-Q956 PolarHBondContact O-N 3.01Å; Q954-A957 PolarHBondContact O-N 2.87Å; Q954-E958 VanDerWaalsContact O-CB 3.22Å; Q954-E958 WeakPolarHBondContact O-CB 3.23Å; Q954-E958 PolarHBondContact O-N 3.45Å
955	A	76.6	Confident	69.8	Low	54 Å²	54	100.7 Å²	100.7	45%	0.446	50%	0.497	S	S	.	.	H	α-helix	trans	-62	-36.2	177.9	0	0	0	0	0	112.3	I951 Q952 L959	I951-A955 VanDerWaalsContact O-CB 3.3Å; I951-A955 WeakPolarHBondContact O-CB 3.28Å; I951-A955 PolarHBondContact O-N 3.4Å; Q952-A955 PolarHBondContact O-N 3.41Å; A955-L959 WeakPolarHBondContact O-CB 3.48Å; A955-L959 WeakPolarHBondContact O-CG 3.19Å; A955-L959 PolarHBondContact O-N 2.87Å
956	Q	76.8	Confident	70.2	Confident	15 Å²	15	99.6 Å²	99.6	7%	0.07	49%	0.492	C	S	.	.	H	α-helix	trans	-65.1	-47.4	172.8	176.7	57.9	28.7	0	0	111.9	D680 R681 Q952 Q954 E958 L959 E960	D680-Q956 WeakPolarHBondContact O-CB 3.29Å; D680-Q956 VanDerWaalsContact O-CD 3.28Å; D680-Q956 WeakPolarHBondContact O-CG 3.47Å; D680-Q956 PolarHBondContact O-OE1 3.06Å; D680-Q956 VanDerWaalsContact O-OE1 3.12Å; R681-Q956 VanDerWaalsContact CG-NE2 3.29Å; Q952-Q956 WeakPolarHBondContact O-CB 3.31Å; Q952-Q956 PolarHBondContact O-N 2.86Å; Q954-Q956 VanDerWaalsContact C-N 3.28Å; Q954-Q956 PolarHBondContact O-N 3.01Å; Q956-E958 VanDerWaalsContact C-N 3.33Å; Q956-E958 PolarHBondContact O-N 2.89Å; Q956-L959 PolarHBondContact O-N 2.99Å; Q956-E960 PolarHBondContact NE2-OE1 3.39Å; Q956-E960 WeakPolarHBondContact O-CB 3.24Å; Q956-E960 PolarHBondContact O-N 3.23Å
957	A	76.1	Confident	69.5	Low	35 Å²	35	97.6 Å²	97.6	29%	0.289	48%	0.484	S	S	.	.	H	α-helix	trans	-67.3	-33.2	177.5	0	0	0	0	0	112.5	I953 Q954 R961	I953-A957 VanDerWaalsContact O-CB 3.32Å; I953-A957 WeakPolarHBondContact O-CB 3.46Å; I953-A957 PolarHBondContact O-N 2.8Å; Q954-A957 PolarHBondContact O-N 2.87Å; A957-R961 WeakPolarHBondContact O-CB 3.37Å; A957-R961 WeakPolarHBondContact O-CG 3.48Å; A957-R961 PolarHBondContact O-N 3.23Å
958	E	80.7	Confident	68.9	Low	75 Å²	75	89.4 Å²	89.4	35%	0.35	46%	0.456	S	S	.	.	H	α-helix	trans	-68.1	-44.7	173.7	-178.2	60.5	-162.7	0	0	111.4	Q954 Q956 R961 R962	Q954-E958 VanDerWaalsContact O-CB 3.22Å; Q954-E958 WeakPolarHBondContact O-CB 3.23Å; Q954-E958 PolarHBondContact O-N 3.45Å; Q956-E958 VanDerWaalsContact C-N 3.33Å; Q956-E958 PolarHBondContact O-N 2.89Å; E958-R961 PolarHBondContact O-N 3.04Å; E958-R962 WeakPolarHBondContact O-CB 3.34Å; E958-R962 VanDerWaalsContact O-CG 3.25Å; E958-R962 WeakPolarHBondContact O-CG 3.44Å; E958-R962 PolarHBondContact O-N 2.85Å; E958-R962 IonicContact OE1-CZ 3.32Å; E958-R962 IonicContact OE1-NE 2.73Å; E958-R962 PolarHBondContact OE1-NE 2.86Å; E958-R962 IonicContact OE1-NH2 3.48Å; E958-R962 PolarHBondContact OE1-NH2 3.14Å
959	L	74.1	Confident	67.3	Low	53 Å²	53	89.9 Å²	89.9	28%	0.277	47%	0.472	S	S	.	.	H	α-helix	trans	-65.1	-42.6	172.6	-81.8	167.6	0	0	0	112.2	L679 A955 Q956 R962 H963	L679-L959 HydrophobicContact CD2-CD1 4.41Å; A955-L959 WeakPolarHBondContact O-CB 3.48Å; A955-L959 WeakPolarHBondContact O-CG 3.19Å; A955-L959 PolarHBondContact O-N 2.87Å; Q956-L959 PolarHBondContact O-N 2.99Å; L959-R962 PolarHBondContact O-N 3.09Å; L959-H963 WeakPolarHBondContact O-CB 3.37Å; L959-H963 PolarHBondContact O-CD2 3.39Å; L959-H963 PolarHBondContact O-N 2.91Å
960	E	77.2	Confident	65.4	Low	60 Å²	60	94.2 Å²	94.2	28%	0.28	49%	0.486	S	S	.	.	H	α-helix	trans	-66.3	-36.9	175.4	-80.1	-165.5	-139.3	0	0	112.5	Q956 H963 R964	Q956-E960 PolarHBondContact NE2-OE1 3.39Å; Q956-E960 WeakPolarHBondContact O-CB 3.24Å; Q956-E960 PolarHBondContact O-N 3.23Å; E960-H963 PolarHBondContact O-N 2.97Å; E960-R964 WeakPolarHBondContact O-CB 3.43Å; E960-R964 WeakPolarHBondContact O-CG 3.14Å; E960-R964 PolarHBondContact O-N 3.4Å; E960-R964 IonicContact OE2-CZ 2.28Å; E960-R964 IonicContact OE2-NE 3.33Å; E960-R964 IonicContact OE2-NH2 3.68Å; E960-R964 PolarHBondContact OE2-NH2 2.94Å
961	R	67.4	Low	63.4	Low	154 Å²	154	92.7 Å²	92.7	58%	0.581	49%	0.485	S	S	*	.	H	α-helix	trans	-58.8	-53.9	168.9	-86.2	-174.1	-96.1	-117.7	1.4	110.6	A957 E958 H963 R964 S965	A957-R961 WeakPolarHBondContact O-CB 3.37Å; A957-R961 WeakPolarHBondContact O-CG 3.48Å; A957-R961 PolarHBondContact O-N 3.23Å; E958-R961 PolarHBondContact O-N 3.04Å; R961-H963 VanDerWaalsContact C-N 3.29Å; R961-H963 PolarHBondContact O-N 2.97Å; R961-R964 PolarHBondContact O-N 3.25Å; R961-R964 VanDerWaalsContact O-N 3.14Å; R961-S965 WeakPolarHBondContact O-CB 3.49Å; R961-S965 PolarHBondContact O-N 3.01Å; R961-S965 PolarHBondContact O-OG 3.07Å
962	R	65.7	Low	61.7	Low	159 Å²	159	94.8 Å²	94.8	60%	0.6	50%	0.496	S	S	*	.	H	α-helix	trans	-56.7	-40.8	178.6	-70.8	169.6	-171.4	-153.7	3.9	112.4	E958 L959 S966	E958-R962 WeakPolarHBondContact O-CB 3.34Å; E958-R962 VanDerWaalsContact O-CG 3.25Å; E958-R962 WeakPolarHBondContact O-CG 3.44Å; E958-R962 PolarHBondContact O-N 2.85Å; E958-R962 IonicContact OE1-CZ 3.32Å; E958-R962 IonicContact OE1-NE 2.73Å; E958-R962 PolarHBondContact OE1-NE 2.86Å; E958-R962 IonicContact OE1-NH2 3.48Å; E958-R962 PolarHBondContact OE1-NH2 3.14Å; L959-R962 PolarHBondContact O-N 3.09Å; R962-S966 VanDerWaalsContact O-CB 3.29Å; R962-S966 WeakPolarHBondContact O-CB 3.47Å; R962-S966 PolarHBondContact O-N 3.3Å
963	H	62.8	Low	59.7	Low	136 Å²	136	97.3 Å²	97.3	63%	0.63	51%	0.513	S	S	*	.	H	α-helix	trans	-71.9	-35.4	177.2	-72.4	-52	0	0	0	113.7	L959 E960 R961 S966	L959-H963 WeakPolarHBondContact O-CB 3.37Å; L959-H963 PolarHBondContact O-CD2 3.39Å; L959-H963 PolarHBondContact O-N 2.91Å; E960-H963 PolarHBondContact O-N 2.97Å; R961-H963 VanDerWaalsContact C-N 3.29Å; R961-H963 PolarHBondContact O-N 2.97Å; H963-S966 PolarHBondContact O-N 2.81Å
964	R	58.4	Low	57.6	Low	170 Å²	170	100.6 Å²	100.6	64%	0.642	52%	0.52	S	S	*	.	H	α-helix	trans	-75.9	-27.3	175	-68.1	173.2	-163.2	-146.1	10.7	113	E960 R961 S967	E960-R964 WeakPolarHBondContact O-CB 3.43Å; E960-R964 WeakPolarHBondContact O-CG 3.14Å; E960-R964 PolarHBondContact O-N 3.4Å; E960-R964 IonicContact OE2-CZ 2.28Å; E960-R964 IonicContact OE2-NE 3.33Å; E960-R964 IonicContact OE2-NH2 3.68Å; E960-R964 PolarHBondContact OE2-NH2 2.94Å; R961-R964 PolarHBondContact O-N 3.25Å; R961-R964 VanDerWaalsContact O-N 3.14Å; R964-S967 PolarHBondContact O-OG 3.32Å
965	S	53.8	Low	55.6	Low	69 Å²	69	103 Å²	103	48%	0.483	53%	0.528	S	S	.	.	H	α-helix	trans	-83.8	-17.3	172.1	-60.6	0	0	0	0	113	R961 S967 H968	R961-S965 WeakPolarHBondContact O-CB 3.49Å; R961-S965 PolarHBondContact O-N 3.01Å; R961-S965 PolarHBondContact O-OG 3.07Å; S965-S967 PolarHBondContact O-N 2.85Å; S965-S967 VanDerWaalsContact O-N 3.09Å; S965-H968 PolarHBondContact O-N 3.45Å
966	S	52.6	Low	53.4	Low	96 Å²	96	105.2 Å²	105.2	67%	0.671	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-10.6	-177.9	-172.3	0	0	0	0	114.5	R962 H963	R962-S966 VanDerWaalsContact O-CB 3.29Å; R962-S966 WeakPolarHBondContact O-CB 3.47Å; R962-S966 PolarHBondContact O-N 3.3Å; H963-S966 PolarHBondContact O-N 2.81Å
967	S	46.9	Very low	51.4	Low	75 Å²	75	111 Å²	111	52%	0.524	58%	0.576	S	S	.	*	T	Hydrogen-bonded Turn	trans	-87.6	-14	173.2	47.6	0	0	0	0	113.9	Y757 R964 S965	Y757-S967 PolarHBondContact OH-OG 3.04Å; R964-S967 PolarHBondContact O-OG 3.32Å; S965-S967 PolarHBondContact O-N 2.85Å; S965-S967 VanDerWaalsContact O-N 3.09Å
968	H	42.2	Very low	49.2	Very low	74 Å²	74	119.4 Å²	119.4	34%	0.343	60%	0.602	S	S	.	*	S	Bend	trans	-121	116.7	177.6	-157.3	37.2	0	0	0	110.6	D759 S965 H970 R974	D759-H968 VanDerWaalsContact CB-CE1 3.49Å; D759-H968 WeakPolarHBondContact CB-CE1 3.49Å; D759-H968 IonicContact OD2-CE1 3.68Å; D759-H968 PolarHBondContact OD2-CE1 2.78Å; S965-H968 PolarHBondContact O-N 3.45Å; H968-H970 PolarHBondContact O-N 2.82Å; H968-R974 PolarHBondContact NE2-NH2 2.9Å; H968-R974 VanDerWaalsContact NE2-NH2 3.18Å
969	G	39.5	Very low	46.9	Very low	58 Å²	58	120.4 Å²	120.4	60%	0.598	62%	0.617	S	S	*	*			trans	-55.2	136.3	-170.1	0	0	0	0	0	113.3	S971	G969-S971 PolarHBondContact O-N 3.42Å
970	H	34.5	Very low	44.6	Very low	146 Å²	146	125.6 Å²	125.6	68%	0.676	65%	0.651	S	S	*	*			trans	-52.7	136	178.4	-67.2	-66.2	0	0	0	111	H968 L972 D973	H968-H970 PolarHBondContact O-N 2.82Å; H970-L972 PolarHBondContact O-N 3.05Å; H970-D973 PolarHBondContact O-N 2.93Å
971	S	37.1	Very low	42.1	Very low	89 Å²	89	124.6 Å²	124.6	62%	0.622	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.2	-11.4	-173.7	-155.3	0	0	0	0	115	G969	G969-S971 PolarHBondContact O-N 3.42Å
972	L	39.8	Very low	40.1	Very low	170 Å²	170	125.2 Å²	125.2	89%	0.89	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.5	-20.7	174.8	-58.8	179.1	0	0	0	114	H970	H970-L972 PolarHBondContact O-N 3.05Å
973	D	36.8	Very low	38.4	Very low	135 Å²	135	123.9 Å²	123.9	72%	0.722	68%	0.678	S	S	*	*	S	Bend	trans	-93.4	2.3	173.9	-78.5	-52.6	0	0	0	112.9	H970 K975	H970-D973 PolarHBondContact O-N 2.93Å; D973-K975 PolarHBondContact O-N 3.06Å
974	R	33.3	Very low	36.9	Very low	155 Å²	155	124.4 Å²	124.4	59%	0.585	68%	0.681	S	S	*	*			trans	-69.3	78.1	167.5	-70.1	-172.3	-179.9	-161.7	1.2	110.5	H968 S976	H968-R974 PolarHBondContact NE2-NH2 2.9Å; H968-R974 VanDerWaalsContact NE2-NH2 3.18Å; R974-S976 PolarHBondContact O-N 2.9Å
975	K	34.4	Very low	35.6	Very low	185 Å²	185	121.1 Å²	121.1	80%	0.804	68%	0.684	S	S	*	*			trans	-48.7	124.6	156.6	-64.8	171.7	-175.7	167.1	0	107.3	D973 V977	D973-K975 PolarHBondContact O-N 3.06Å; K975-V977 PolarHBondContact O-N 2.72Å
976	S	32.3	Very low	34.3	Very low	101 Å²	101	125.3 Å²	125.3	71%	0.706	70%	0.696	S	S	*	*			trans	-70.2	93.2	176.8	-178.9	0	0	0	0	109.9	R974 Y978	R974-S976 PolarHBondContact O-N 2.9Å; S976-Y978 PolarHBondContact O-N 3.46Å
977	V	33.5	Very low	33.3	Very low	135 Å²	135	128.6 Å²	128.6	82%	0.818	71%	0.705	S	S	*	*			trans	-77.2	-0.6	170.1	-170.9	0	0	0	0	111	K975 S979	K975-V977 PolarHBondContact O-N 2.72Å; V977-S979 PolarHBondContact O-N 2.84Å
978	Y	31.2	Very low	32.7	Very low	213 Å²	213	130.6 Å²	130.6	84%	0.835	72%	0.719	S	S	*	*			trans	-66.9	107.3	172.9	-78.3	-68.5	0	0	0	112.4	S976	S976-Y978 PolarHBondContact O-N 3.46Å
979	S	30.6	Very low	32	Very low	95 Å²	95	137.8 Å²	137.8	66%	0.664	75%	0.749	S	S	*	*			trans	72	82.6	152.1	-147.5	0	0	0	0	117	V977 G981	V977-S979 PolarHBondContact O-N 2.84Å; S979-G981 PolarHBondContact O-N 3.32Å; S979-G981 WeakPolarHBondContact OG-CA 3.25Å
980	T	26.5	Very low	31.4	Very low	162 Å²	162	138.2 Å²	138.2	99%	0.994	75%	0.753	S	S	*	*			trans	-62.9	79.2	139.3	-57.7	0	0	0	0	108.3
981	G	24.8	Very low	31.1	Very low	40 Å²	40	139.7 Å²	139.7	41%	0.412	77%	0.766	S	S	.	*			trans	-152	82	-165.1	0	0	0	0	0	115.3	S979	S979-G981 PolarHBondContact O-N 3.32Å; S979-G981 WeakPolarHBondContact OG-CA 3.25Å
982	M	25	Very low	30.7	Very low	167 Å²	167	140 Å²	140	82%	0.823	77%	0.768	S	S	*	*			trans	43.5	78.8	147.2	-60.8	-80	82.7	0	0	118.3
983	T	30	Very low	30.4	Very low	130 Å²	130	138.9 Å²	138.9	80%	0.798	76%	0.762	S	S	*	*			trans	-128.1	85.5	147.7	58.4	0	0	0	0	110.2	S985	T983-S985 VanDerWaalsContact C-N 3.29Å; T983-S985 PolarHBondContact O-N 3.28Å
984	E	30.8	Very low	30	Very low	147 Å²	147	142.7 Å²	142.7	69%	0.687	77%	0.768	S	S	*	*			trans	-71	86	164.9	-72.4	-158.2	153.6	0	0	109.4	H986	E984-H986 PolarHBondContact O-N 2.95Å; E984-H986 IonicContact OE2-CE1 3.11Å; E984-H986 PolarHBondContact OE2-CE1 3.01Å
985	S	32.9	Very low	30	Very low	101 Å²	101	143.4 Å²	143.4	71%	0.706	78%	0.778	S	S	*	*			trans	-69.4	101.3	169.5	55.9	0	0	0	0	109.3	T983 L987	T983-S985 VanDerWaalsContact C-N 3.29Å; T983-S985 PolarHBondContact O-N 3.28Å; S985-L987 PolarHBondContact O-N 3.12Å
986	H	26.6	Very low	29.7	Very low	158 Å²	158	144.9 Å²	144.9	73%	0.731	79%	0.788	S	S	*	*			trans	-70.7	51.7	-173.5	-64.7	-55.5	0	0	0	115.1	E984	E984-H986 PolarHBondContact O-N 2.95Å; E984-H986 IonicContact OE2-CE1 3.11Å; E984-H986 PolarHBondContact OE2-CE1 3.01Å
987	L	30.7	Very low	29.4	Very low	165 Å²	165	142.6 Å²	142.6	86%	0.864	78%	0.78	S	S	*	*			trans	-128.6	39	-179.4	-70.6	178	0	0	0	113.9	S985	S985-L987 PolarHBondContact O-N 3.12Å
988	S	33.8	Very low	29.2	Very low	117 Å²	117	146.9 Å²	146.9	82%	0.818	78%	0.783	S	S	*	*			trans	-166.7	74.3	159.4	45.4	0	0	0	0	112.4
989	K	28.2	Very low	29.3	Very low	224 Å²	224	146.1 Å²	146.1	97%	0.974	79%	0.787	S	S	*	*			trans	-123.3	58.7	170.8	-154.3	164.4	-168.7	165.5	0	111.8
990	G	26.7	Very low	29.5	Very low	67 Å²	67	145 Å²	145	69%	0.691	79%	0.79	S	S	*	*	S	Bend	trans	-143.7	126.2	176.7	0	0	0	0	0	111.5
991	L	28.6	Very low	30.1	Very low	178 Å²	178	141.6 Å²	141.6	93%	0.932	77%	0.765	S	S	*	*			trans	53.2	88.4	163.4	-61.2	171.2	0	0	0	117.2
992	S	27.8	Very low	30.6	Very low	95 Å²	95	142.5 Å²	142.5	66%	0.664	77%	0.774	S	S	*	*			trans	-68.7	177.9	147.3	63.7	0	0	0	0	111.4
993	D	34.1	Very low	31.5	Very low	146 Å²	146	140.5 Å²	140.5	78%	0.781	76%	0.759	S	S	*	*	S	Bend	trans	88.7	11.9	163.9	-56.3	10.5	0	0	0	118.4
994	Y	27.9	Very low	32.1	Very low	216 Å²	216	137.2 Å²	137.2	85%	0.847	74%	0.741	S	S	*	*	S	Bend	trans	-129.1	145.3	156.5	-91.6	-90.2	0	0	0	113.2
995	H	32.9	Very low	33.1	Very low	170 Å²	170	137 Å²	137	79%	0.787	74%	0.735	S	S	*	*			trans	58.9	81.5	179.3	-67.4	-73.3	0	0	0	117.8	G997	H995-G997 VanDerWaalsContact C-N 3.26Å; H995-G997 PolarHBondContact O-N 3.37Å
996	Q	29.2	Very low	34	Very low	215 Å²	215	134.6 Å²	134.6	100%	1.005	71%	0.714	S	S	*	*			trans	-67	82.8	154.4	-176.3	132.3	35.5	0	0	110.6
997	G	26.6	Very low	35.3	Very low	53 Å²	53	135.6 Å²	135.6	55%	0.546	72%	0.724	S	S	.	*			trans	-153.9	97.6	-174.8	0	0	0	0	0	114.5	H995	H995-G997 VanDerWaalsContact C-N 3.26Å; H995-G997 PolarHBondContact O-N 3.37Å
998	Y	29.2	Very low	36.8	Very low	225 Å²	225	137.6 Å²	137.6	88%	0.882	72%	0.721	S	S	*	*			trans	60.5	119.9	169.2	-73.1	-100.7	0	0	0	117.2	G1000	Y998-G1000 PolarHBondContact O-N 2.82Å; Y998-G1000 VanDerWaalsContact O-N 3.12Å
999	E	32	Very low	37.1	Very low	198 Å²	198	134.7 Å²	134.7	93%	0.925	71%	0.709	S	S	*	*			trans	-60.9	112	154.5	-67.6	177.3	132.8	0	0	108.1
1000	G	35	Very low	38.3	Very low	70 Å²	70	132.1 Å²	132.1	72%	0.722	69%	0.693	S	S	*	*			trans	-68.6	133.8	-179.1	0	0	0	0	0	111.3	Y998 G1002	Y998-G1000 PolarHBondContact O-N 2.82Å; Y998-G1000 VanDerWaalsContact O-N 3.12Å; G1000-G1002 PolarHBondContact O-N 2.72Å
1001	I	40.4	Very low	39.7	Very low	92 Å²	92	132.7 Å²	132.7	47%	0.472	68%	0.68	S	S	.	*			trans	-64.9	107.4	172.8	-58.1	168.3	0	0	0	107.8	Y1003	I1001-Y1003 VanDerWaalsContact C-N 3.28Å; I1001-Y1003 HydrophobicContact CB-CD2 4.29Å; I1001-Y1003 HydrophobicContact CB-CE2 3.87Å; I1001-Y1003 HydrophobicContact CG2-CD1 4.18Å; I1001-Y1003 HydrophobicContact CG2-CD2 4Å; I1001-Y1003 HydrophobicContact CG2-CE1 3.81Å; I1001-Y1003 HydrophobicContact CG2-CE2 3.62Å; I1001-Y1003 HydrophobicContact CG2-CG 4.28Å; I1001-Y1003 WeakPolarHBondContact O-CD2 3.46Å; I1001-Y1003 PolarHBondContact O-N 3.19Å
1002	G	34	Very low	41	Very low	59 Å²	59	128.5 Å²	128.5	61%	0.608	66%	0.658	S	S	*	*			trans	-72.2	75.4	-178.4	0	0	0	0	0	112.6	G1000 S1004	G1000-G1002 PolarHBondContact O-N 2.72Å; G1002-S1004 PolarHBondContact O-N 2.86Å
1003	Y	43.3	Very low	42	Very low	125 Å²	125	133 Å²	133	49%	0.49	67%	0.668	S	S	.	*			trans	-69.7	90.8	168.9	-63.4	-68.3	0	0	0	110	I1001 L1011	I1001-Y1003 VanDerWaalsContact C-N 3.28Å; I1001-Y1003 HydrophobicContact CB-CD2 4.29Å; I1001-Y1003 HydrophobicContact CB-CE2 3.87Å; I1001-Y1003 HydrophobicContact CG2-CD1 4.18Å; I1001-Y1003 HydrophobicContact CG2-CD2 4Å; I1001-Y1003 HydrophobicContact CG2-CE1 3.81Å; I1001-Y1003 HydrophobicContact CG2-CE2 3.62Å; I1001-Y1003 HydrophobicContact CG2-CG 4.28Å; I1001-Y1003 WeakPolarHBondContact O-CD2 3.46Å; I1001-Y1003 PolarHBondContact O-N 3.19Å; Y1003-L1011 HydrophobicContact CD1-CD1 4.02Å; Y1003-L1011 HydrophobicContact CG-CD1 4.45Å
1004	S	44	Very low	42.3	Very low	60 Å²	60	127.3 Å²	127.3	42%	0.42	64%	0.644	S	S	.	*			trans	-82.5	139	171.1	48.4	0	0	0	0	111.1	G1002 I1012	G1002-S1004 PolarHBondContact O-N 2.86Å; S1004-I1012 WeakPolarHBondContact O-CB 3.35Å; S1004-I1012 PolarHBondContact O-N 3.47Å
1005	Y	51.7	Low	42.8	Very low	143 Å²	143	118.4 Å²	118.4	56%	0.561	62%	0.618	S	S	*	*	B	Isolated β-bridge	trans	-114.5	148.4	176.2	-67.5	-95.9	0	0	0	109.5	G1009 R1010 L1011	Y1005-G1009 WeakPolarHBondContact CD1-O 3.22Å; Y1005-R1010 CarbonylContact C-O 3.59Å; Y1005-R1010 VanDerWaalsContact CA-O 3.3Å; Y1005-R1010 WeakPolarHBondContact CA-O 3.37Å; Y1005-L1011 HydrophobicContact CD1-CB 4.44Å; Y1005-L1011 HydrophobicContact CD1-CD1 4.18Å; Y1005-L1011 HydrophobicContact CD2-CD1 4.48Å; Y1005-L1011 HydrophobicContact CE1-CB 4.24Å; Y1005-L1011 HydrophobicContact CE1-CD1 3.71Å; Y1005-L1011 HydrophobicContact CE2-CD1 4.03Å
1006	D	51.7	Low	43.3	Very low	51 Å²	51	112 Å²	112	27%	0.273	60%	0.595	S	S	.	*			trans	-77	171.3	170.6	85.5	-13.8	0	0	0	111.5	R1008 G1009 R1010 I1012	D1006-R1008 PolarHBondContact O-N 2.94Å; D1006-R1008 VanDerWaalsContact OD1-C 3.23Å; D1006-R1008 VanDerWaalsContact OD1-CA 3.24Å; D1006-R1008 WeakPolarHBondContact OD1-CA 3.4Å; D1006-R1008 VanDerWaalsContact OD1-CB 3.3Å; D1006-R1008 WeakPolarHBondContact OD1-CB 3.32Å; D1006-R1008 PolarHBondContact OD1-N 2.63Å; D1006-G1009 PolarHBondContact O-N 3.08Å; D1006-G1009 PolarHBondContact OD1-N 2.86Å; D1006-G1009 VanDerWaalsContact OD1-N 3.07Å; D1006-R1010 PolarHBondContact N-O 3.13Å; D1006-R1010 WeakPolarHBondContact OD1-CB 3.49Å; D1006-R1010 PolarHBondContact OD1-N 3.13Å; D1006-I1012 HydrophobicContact CB-CD1 4.29Å; D1006-I1012 HydrophobicContact CB-CG1 4.22Å
1007	N	54.5	Low	43.8	Very low	178 Å²	178	106.3 Å²	106.3	95%	0.952	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.7	2.2	178.2	-52.2	27.6	0	0	0	113.8
1008	R	60.6	Low	44.9	Very low	207 Å²	207	109.9 Å²	109.9	78%	0.781	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.3	8.6	178.5	-50.7	179.8	178.1	-145.3	-0.9	111.9	D1006 R1010	D1006-R1008 PolarHBondContact O-N 2.94Å; D1006-R1008 VanDerWaalsContact OD1-C 3.23Å; D1006-R1008 VanDerWaalsContact OD1-CA 3.24Å; D1006-R1008 WeakPolarHBondContact OD1-CA 3.4Å; D1006-R1008 VanDerWaalsContact OD1-CB 3.3Å; D1006-R1008 WeakPolarHBondContact OD1-CB 3.32Å; D1006-R1008 PolarHBondContact OD1-N 2.63Å; R1008-R1010 VanDerWaalsContact C-N 3.32Å; R1008-R1010 HydrophobicContact CB-CG 4.48Å; R1008-R1010 PolarHBondContact O-N 3.23Å
1009	G	41.6	Very low	45.8	Very low	56 Å²	56	103.9 Å²	103.9	58%	0.577	57%	0.572	S	S	*	*	S	Bend	trans	75.9	13.6	-179.2	0	0	0	0	0	114.7	Y1005 D1006	Y1005-G1009 WeakPolarHBondContact CD1-O 3.22Å; D1006-G1009 PolarHBondContact O-N 3.08Å; D1006-G1009 PolarHBondContact OD1-N 2.86Å; D1006-G1009 VanDerWaalsContact OD1-N 3.07Å
1010	R	53.3	Low	47	Very low	171 Å²	171	100.2 Å²	100.2	65%	0.645	56%	0.555	S	S	*	*	P	Polyproline II helix	trans	-85.2	134.9	176.9	-59.9	178.4	167.9	-161.4	-7.6	110.1	Y1005 D1006 R1008 I1012	Y1005-R1010 CarbonylContact C-O 3.59Å; Y1005-R1010 VanDerWaalsContact CA-O 3.3Å; Y1005-R1010 WeakPolarHBondContact CA-O 3.37Å; D1006-R1010 PolarHBondContact N-O 3.13Å; D1006-R1010 WeakPolarHBondContact OD1-CB 3.49Å; D1006-R1010 PolarHBondContact OD1-N 3.13Å; R1008-R1010 VanDerWaalsContact C-N 3.32Å; R1008-R1010 HydrophobicContact CB-CG 4.48Å; R1008-R1010 PolarHBondContact O-N 3.23Å; R1010-I1012 PolarHBondContact O-N 3.4Å
1011	L	56.3	Low	47.7	Very low	79 Å²	79	102.7 Å²	102.7	41%	0.414	54%	0.542	S	S	.	.	B	Isolated β-bridge	trans	-67.9	116	177.3	-168.8	74.6	0	0	0	110.3	Y1003 Y1005	Y1003-L1011 HydrophobicContact CD1-CD1 4.02Å; Y1003-L1011 HydrophobicContact CG-CD1 4.45Å; Y1005-L1011 HydrophobicContact CD1-CB 4.44Å; Y1005-L1011 HydrophobicContact CD1-CD1 4.18Å; Y1005-L1011 HydrophobicContact CD2-CD1 4.48Å; Y1005-L1011 HydrophobicContact CE1-CB 4.24Å; Y1005-L1011 HydrophobicContact CE1-CD1 3.71Å; Y1005-L1011 HydrophobicContact CE2-CD1 4.03Å
1012	I	54.9	Low	48.4	Very low	89 Å²	89	101 Å²	101	46%	0.456	54%	0.539	S	S	.	.	P	Polyproline II helix	trans	-73.6	137.1	169.3	-49.2	176	0	0	0	106.4	S1004 D1006 R1010 G1014	S1004-I1012 WeakPolarHBondContact O-CB 3.35Å; S1004-I1012 PolarHBondContact O-N 3.47Å; D1006-I1012 HydrophobicContact CB-CD1 4.29Å; D1006-I1012 HydrophobicContact CB-CG1 4.22Å; R1010-I1012 PolarHBondContact O-N 3.4Å; I1012-G1014 VanDerWaalsContact C-N 3.3Å; I1012-G1014 PolarHBondContact O-N 3.22Å
1013	H	48.9	Very low	49.7	Very low	189 Å²	189	101 Å²	101	88%	0.875	53%	0.532	S	S	*	.	S	Bend	trans	-64.6	71.8	-161.8	-65.8	-58.4	0	0	0	116.4
1014	G	39.4	Very low	50.7	Low	28 Å²	28	97 Å²	97	29%	0.289	52%	0.523	S	S	.	.			trans	-99.3	13.2	177.7	0	0	0	0	0	115.2	I1012 A1016	I1012-G1014 VanDerWaalsContact C-N 3.3Å; I1012-G1014 PolarHBondContact O-N 3.22Å; G1014-A1016 PolarHBondContact O-N 3.25Å
1015	G	39.5	Very low	51.3	Low	28 Å²	28	100.1 Å²	100.1	29%	0.289	53%	0.525	S	S	.	.			trans	-63.1	131	-180	0	0	0	0	0	112.3	R1021	G1015-R1021 PolarHBondContact O-NE 3.24Å; G1015-R1021 PolarHBondContact O-NH2 3.39Å
1016	A	43.3	Very low	51.9	Low	37 Å²	37	97 Å²	97	31%	0.306	52%	0.515	S	S	.	.	S	Bend	trans	21.5	107.3	172.3	0	0	0	0	0	116.3	G1014 R1021	G1014-A1016 PolarHBondContact O-N 3.25Å; A1016-R1021 HydrophobicContact CB-CG 4.37Å; A1016-R1021 WeakPolarHBondContact O-CG 3.39Å; A1016-R1021 PolarHBondContact O-NE 3.47Å
1017	C	39.6	Very low	52.3	Low	95 Å²	95	101.8 Å²	101.8	64%	0.642	53%	0.529	S	S	*	.			trans	-46.8	145.3	-177.2	-63.8	0	0	0	0	112.9	P1019 E1020 R1021	C1017-P1019 VanDerWaalsContact C-N 3.27Å; C1017-P1019 WeakPolarHBondContact O-CD 3.3Å; C1017-E1020 PolarHBondContact O-N 3.43Å; C1017-R1021 PolarHBondContact O-N 3.12Å
1018	L	49.7	Very low	52.5	Low	127 Å²	127	100 Å²	100	67%	0.665	51%	0.509	S	S	*	.	H	α-helix	trans	-46.8	-38.4	-174.3	-70.5	172.1	0	0	0	115.1	E1020 R1021 S1022	L1018-E1020 VanDerWaalsContact C-N 3.34Å; L1018-E1020 PolarHBondContact O-N 2.98Å; L1018-R1021 PolarHBondContact O-N 3.11Å; L1018-S1022 VanDerWaalsContact O-CB 3.31Å; L1018-S1022 WeakPolarHBondContact O-CB 3.37Å; L1018-S1022 PolarHBondContact O-N 3.21Å; L1018-S1022 PolarHBondContact O-OG 3.16Å
1019	P	48.9	Very low	52.5	Low	99 Å²	99	93.7 Å²	93.7	64%	0.643	49%	0.49	S	S	*	.	H	α-helix	trans	-55.8	-40.6	173.2	-28	37.2	0	0	0	114.4	C1017 S1022 A1023	C1017-P1019 VanDerWaalsContact C-N 3.27Å; C1017-P1019 WeakPolarHBondContact O-CD 3.3Å; P1019-S1022 PolarHBondContact O-N 3.39Å; P1019-A1023 VanDerWaalsContact O-CB 3.24Å; P1019-A1023 WeakPolarHBondContact O-CB 3.43Å; P1019-A1023 PolarHBondContact O-N 3.43Å
1020	E	56.4	Low	53.2	Low	122 Å²	122	97.2 Å²	97.2	57%	0.57	50%	0.495	S	S	*	.	H	α-helix	trans	-70	-44.8	179.4	-67.7	-158.7	117.3	0	0	112.1	C1017 L1018 S1022 A1023 S1024	C1017-E1020 PolarHBondContact O-N 3.43Å; L1018-E1020 VanDerWaalsContact C-N 3.34Å; L1018-E1020 PolarHBondContact O-N 2.98Å; E1020-S1022 VanDerWaalsContact C-N 3.26Å; E1020-S1022 PolarHBondContact O-N 3.5Å; E1020-A1023 PolarHBondContact O-N 2.77Å; E1020-S1024 VanDerWaalsContact O-CB 3.3Å; E1020-S1024 WeakPolarHBondContact O-CB 3.37Å; E1020-S1024 PolarHBondContact O-N 2.86Å
1021	R	50.1	Low	54	Low	121 Å²	121	93 Å²	93	46%	0.457	49%	0.486	S	S	.	.	H	α-helix	trans	-60.5	-40.3	175.9	-57.6	-169.7	-167	-154.6	16.6	110.6	G1015 A1016 C1017 L1018 R1025	G1015-R1021 PolarHBondContact O-NE 3.24Å; G1015-R1021 PolarHBondContact O-NH2 3.39Å; A1016-R1021 HydrophobicContact CB-CG 4.37Å; A1016-R1021 WeakPolarHBondContact O-CG 3.39Å; A1016-R1021 PolarHBondContact O-NE 3.47Å; C1017-R1021 PolarHBondContact O-N 3.12Å; L1018-R1021 PolarHBondContact O-N 3.11Å; R1021-R1025 WeakPolarHBondContact O-CB 3.44Å; R1021-R1025 WeakPolarHBondContact O-CG 3.07Å; R1021-R1025 PolarHBondContact O-N 3.19Å; R1021-R1025 PolarHBondContact O-NE 2.99Å
1022	S	55.3	Low	54.5	Low	57 Å²	57	89.4 Å²	89.4	40%	0.399	47%	0.468	S	S	.	.	H	α-helix	trans	-73.5	-36.9	178	-66.8	0	0	0	0	113.1	L1018 P1019 E1020 R1025 K1026	L1018-S1022 VanDerWaalsContact O-CB 3.31Å; L1018-S1022 WeakPolarHBondContact O-CB 3.37Å; L1018-S1022 PolarHBondContact O-N 3.21Å; L1018-S1022 PolarHBondContact O-OG 3.16Å; P1019-S1022 PolarHBondContact O-N 3.39Å; E1020-S1022 VanDerWaalsContact C-N 3.26Å; E1020-S1022 PolarHBondContact O-N 3.5Å; S1022-R1025 PolarHBondContact O-N 3.06Å; S1022-R1025 PolarHBondContact OG-NH2 3.1Å; S1022-R1025 VanDerWaalsContact OG-NH2 3.1Å; S1022-K1026 VanDerWaalsContact O-CB 3.29Å; S1022-K1026 WeakPolarHBondContact O-CB 3.42Å; S1022-K1026 PolarHBondContact O-N 3.15Å
1023	A	60.9	Low	55.2	Low	58 Å²	58	86.7 Å²	86.7	48%	0.479	45%	0.453	S	S	.	.	H	α-helix	trans	-65.1	-40.2	171.2	0	0	0	0	0	112	P1019 E1020 K1026 R1027	P1019-A1023 VanDerWaalsContact O-CB 3.24Å; P1019-A1023 WeakPolarHBondContact O-CB 3.43Å; P1019-A1023 PolarHBondContact O-N 3.43Å; E1020-A1023 PolarHBondContact O-N 2.77Å; A1023-K1026 PolarHBondContact O-N 3Å; A1023-R1027 WeakPolarHBondContact O-CB 3.19Å; A1023-R1027 PolarHBondContact O-N 2.99Å
1024	S	63.2	Low	55.9	Low	41 Å²	41	80.7 Å²	80.7	29%	0.287	43%	0.425	S	S	.	.	H	α-helix	trans	-65.3	-42.2	175.5	-165.1	0	0	0	0	111.7	E1020 R1027 R1028	E1020-S1024 VanDerWaalsContact O-CB 3.3Å; E1020-S1024 WeakPolarHBondContact O-CB 3.37Å; E1020-S1024 PolarHBondContact O-N 2.86Å; S1024-R1027 PolarHBondContact O-N 3.06Å; S1024-R1028 WeakPolarHBondContact O-CG 3.34Å; S1024-R1028 PolarHBondContact O-N 3.23Å
1025	R	57.4	Low	57.2	Low	126 Å²	126	82.7 Å²	82.7	48%	0.475	44%	0.435	S	S	.	.	H	α-helix	trans	-63	-48.8	171.1	-76	179.2	-70.4	-148.4	5.5	112.2	R1021 S1022 R1027 R1028 L1029	R1021-R1025 WeakPolarHBondContact O-CB 3.44Å; R1021-R1025 WeakPolarHBondContact O-CG 3.07Å; R1021-R1025 PolarHBondContact O-N 3.19Å; R1021-R1025 PolarHBondContact O-NE 2.99Å; S1022-R1025 PolarHBondContact O-N 3.06Å; S1022-R1025 PolarHBondContact OG-NH2 3.1Å; S1022-R1025 VanDerWaalsContact OG-NH2 3.1Å; R1025-R1027 VanDerWaalsContact C-N 3.29Å; R1025-R1027 PolarHBondContact O-N 3.15Å; R1025-R1028 PolarHBondContact O-N 3.3Å; R1025-R1028 VanDerWaalsContact O-N 3.12Å; R1025-L1029 WeakPolarHBondContact O-CG 3.46Å; R1025-L1029 PolarHBondContact O-N 3.5Å
1026	K	63.4	Low	58.1	Low	77 Å²	77	85.5 Å²	85.5	34%	0.335	44%	0.443	S	S	.	.	H	α-helix	trans	-57.6	-40.9	177.3	-167.6	175	-173.2	-177.4	0	111.5	T668 S1022 A1023 L1029 L1030	T668-K1026 WeakPolarHBondContact O-CE 3.4Å; T668-K1026 PolarHBondContact O-NZ 2.83Å; S1022-K1026 VanDerWaalsContact O-CB 3.29Å; S1022-K1026 WeakPolarHBondContact O-CB 3.42Å; S1022-K1026 PolarHBondContact O-N 3.15Å; A1023-K1026 PolarHBondContact O-N 3Å; K1026-L1029 PolarHBondContact O-N 2.82Å; K1026-L1030 HydrophobicContact CG-CD1 4.35Å; K1026-L1030 VanDerWaalsContact O-CG 3.3Å; K1026-L1030 WeakPolarHBondContact O-CG 3.46Å; K1026-L1030 PolarHBondContact O-N 3.14Å
1027	R	61.3	Low	58.8	Low	152 Å²	152	86.3 Å²	86.3	57%	0.574	45%	0.446	S	S	*	.	H	α-helix	trans	-66.7	-38.7	175.5	-171.4	171.6	64.9	108.1	-0.6	113.4	A1023 S1024 R1025 L1030 D1031	A1023-R1027 WeakPolarHBondContact O-CB 3.19Å; A1023-R1027 PolarHBondContact O-N 2.99Å; S1024-R1027 PolarHBondContact O-N 3.06Å; R1025-R1027 VanDerWaalsContact C-N 3.29Å; R1025-R1027 PolarHBondContact O-N 3.15Å; R1027-L1030 PolarHBondContact O-N 3.47Å; R1027-D1031 WeakPolarHBondContact O-CB 3.39Å; R1027-D1031 PolarHBondContact O-N 3.09Å
1028	R	58.8	Low	59.7	Low	141 Å²	141	86.9 Å²	86.9	53%	0.532	44%	0.435	S	S	.	.	H	α-helix	trans	-65.8	-40.8	173.6	-72.7	169.6	177.1	161.6	-2.6	112	S1024 R1025 L1030 D1031 G1032	S1024-R1028 WeakPolarHBondContact O-CG 3.34Å; S1024-R1028 PolarHBondContact O-N 3.23Å; R1025-R1028 PolarHBondContact O-N 3.3Å; R1025-R1028 VanDerWaalsContact O-N 3.12Å; R1028-L1030 VanDerWaalsContact C-N 3.33Å; R1028-L1030 PolarHBondContact O-N 3.12Å; R1028-D1031 PolarHBondContact O-N 3.06Å; R1028-G1032 PolarHBondContact O-N 2.79Å
1029	L	60.1	Low	59.8	Low	75 Å²	75	84.7 Å²	84.7	39%	0.393	43%	0.426	S	S	.	.	H	α-helix	trans	-63.1	-38.9	176.1	-70.1	169.4	0	0	0	112	S909 R1025 K1026 G1032	S909-L1029 WeakPolarHBondContact OG-CA 3.38Å; S909-L1029 PolarHBondContact OG-O 3.28Å; R1025-L1029 WeakPolarHBondContact O-CG 3.46Å; R1025-L1029 PolarHBondContact O-N 3.5Å; K1026-L1029 PolarHBondContact O-N 2.82Å; L1029-G1032 PolarHBondContact O-N 2.93Å
1030	L	57.5	Low	60	Low	129 Å²	129	85.3 Å²	85.3	68%	0.675	42%	0.416	S	S	*	.	H	α-helix	trans	-72	-33.1	175.1	-72.8	168.2	0	0	0	114	K1026 R1027 R1028 G1032	K1026-L1030 HydrophobicContact CG-CD1 4.35Å; K1026-L1030 VanDerWaalsContact O-CG 3.3Å; K1026-L1030 WeakPolarHBondContact O-CG 3.46Å; K1026-L1030 PolarHBondContact O-N 3.14Å; R1027-L1030 PolarHBondContact O-N 3.47Å; R1028-L1030 VanDerWaalsContact C-N 3.33Å; R1028-L1030 PolarHBondContact O-N 3.12Å; L1030-G1032 PolarHBondContact O-N 2.83Å
1031	D	68.3	Low	59.7	Low	84 Å²	84	82.9 Å²	82.9	45%	0.449	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-13.4	173.1	-166.9	52.7	0	0	0	111.9	K904 R1027 R1028 H1033	K904-D1031 IonicContact NZ-OD2 2.99Å; K904-D1031 PolarHBondContact NZ-OD2 2.65Å; R1027-D1031 WeakPolarHBondContact O-CB 3.39Å; R1027-D1031 PolarHBondContact O-N 3.09Å; R1028-D1031 PolarHBondContact O-N 3.06Å; D1031-H1033 PolarHBondContact O-CD2 3.32Å; D1031-H1033 VanDerWaalsContact O-CD2 3.22Å; D1031-H1033 PolarHBondContact O-N 3.39Å
1032	G	68.7	Low	59.2	Low	3 Å²	3	81.8 Å²	81.8	3%	0.031	42%	0.415	C	S	.	.	T	Hydrogen-bonded Turn	trans	65.4	19.1	-178.2	0	0	0	0	0	113.8	R906 T907 R1028 L1029 L1030	R906-G1032 CarbonylContact C-O 3.56Å; R906-G1032 WeakPolarHBondContact CA-O 3.41Å; R906-G1032 WeakPolarHBondContact CG-O 3.46Å; T907-G1032 PolarHBondContact N-O 3.41Å; T907-G1032 WeakPolarHBondContact OG1-CA 3.33Å; T907-G1032 PolarHBondContact OG1-O 3.41Å; T907-G1032 VanDerWaalsContact OG1-O 3.12Å; R1028-G1032 PolarHBondContact O-N 2.79Å; L1029-G1032 PolarHBondContact O-N 2.93Å; L1030-G1032 PolarHBondContact O-N 2.83Å
1033	H	67.8	Low	58.6	Low	32 Å²	32	84.1 Å²	84.1	15%	0.148	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	132	-170.7	-80.6	-70.5	0	0	0	111.9	K904 R905 R906 T907 D1031	K904-H1033 HydrophobicContact CB-CB 4.47Å; K904-H1033 HydrophobicContact CD-CB 3.88Å; K904-H1033 HydrophobicContact CG-CB 4.45Å; R905-H1033 WeakPolarHBondContact O-CA 3.45Å; R905-H1033 PolarHBondContact O-ND1 2.84Å; R906-H1033 WeakPolarHBondContact CA-ND1 3.3Å; T907-H1033 PolarHBondContact OG1-N 3.4Å; D1031-H1033 PolarHBondContact O-CD2 3.32Å; D1031-H1033 VanDerWaalsContact O-CD2 3.22Å; D1031-H1033 PolarHBondContact O-N 3.39Å
1034	E	65.2	Low	57.8	Low	63 Å²	63	87.2 Å²	87.2	29%	0.294	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	138.7	168.3	66.1	-164.1	123.3	0	0	109.5	K904 R905 T907	K904-E1034 VanDerWaalsContact CA-O 3.23Å; K904-E1034 WeakPolarHBondContact CA-O 3.34Å; R905-E1034 HydrophobicContact CG-CG 3.52Å; R905-E1034 IonicContact CZ-OE1 3.2Å; R905-E1034 IonicContact CZ-OE2 3.83Å; R905-E1034 PolarHBondContact N-O 3.1Å; R905-E1034 IonicContact NE-OE1 3.05Å; R905-E1034 PolarHBondContact NE-OE1 2.95Å; R905-E1034 IonicContact NE-OE2 2.69Å; R905-E1034 PolarHBondContact NE-OE2 3.22Å; R905-E1034 VanDerWaalsContact NH2-CD 3.25Å; R905-E1034 IonicContact NH2-OE1 3.12Å; R905-E1034 PolarHBondContact NH2-OE1 3.08Å; R905-E1034 IonicContact NH2-OE2 2.64Å; R905-E1034 PolarHBondContact NH2-OE2 3.18Å; R905-E1034 PolarHBondContact O-N 3.12Å; T907-E1034 HydrophobicContact CG2-CB 3.72Å; T907-E1034 HydrophobicContact CG2-CG 3.76Å; T907-E1034 VanDerWaalsContact CG2-OE1 3.29Å; T907-E1034 WeakPolarHBondContact CG2-OE1 3.3Å
1035	S	66.6	Low	56.8	Low	69 Å²	69	87.6 Å²	87.6	48%	0.483	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	132	171.6	-65.2	0	0	0	0	109.5	T903	T903-S1035 CarbonylContact O-C 3.55Å; T903-S1035 VanDerWaalsContact O-CA 3.3Å; T903-S1035 WeakPolarHBondContact O-CA 3.43Å
1036	L	58.7	Low	55.9	Low	88 Å²	88	90.5 Å²	90.5	46%	0.461	47%	0.467	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	-38.3	174.6	-69.1	177.2	0	0	0	111.9	T903 R905	T903-L1036 PolarHBondContact O-N 2.92Å; T903-L1036 WeakPolarHBondContact OG1-CB 3.39Å; R905-L1036 HydrophobicContact CB-CD1 3.93Å; R905-L1036 HydrophobicContact CB-CG 4.34Å; R905-L1036 HydrophobicContact CG-CD1 4.07Å; R905-L1036 HydrophobicContact CG-CD2 4.02Å; R905-L1036 HydrophobicContact CG-CG 4.05Å
1037	S	56.2	Low	54.6	Low	53 Å²	53	95.8 Å²	95.8	37%	0.371	49%	0.493	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155	159.7	175.1	65.9	0	0	0	0	111.2	S902 T903	S902-S1037 WeakPolarHBondContact CA-O 3.4Å; T903-S1037 WeakPolarHBondContact CG2-OG 3.34Å; T903-S1037 PolarHBondContact N-O 3.4Å; T903-S1037 PolarHBondContact OG1-N 3.15Å; T903-S1037 PolarHBondContact OG1-O 3.04Å; T903-S1037 PolarHBondContact OG1-OG 3.05Å
1038	R	59.5	Low	53.1	Low	108 Å²	108	97.6 Å²	97.6	41%	0.408	50%	0.501	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	74.2	-179.4	-168.4	-174.6	-176.3	-163.5	-3.1	112.2	D169 I900 I901 W1040	D169-R1038 WeakPolarHBondContact OD2-CB 3.2Å; I900-R1038 HydrophobicContact CG2-CG 3.73Å; I901-R1038 CarbonylContact O-C 3.51Å; I901-R1038 WeakPolarHBondContact O-CA 3.42Å; R1038-W1040 PolarHBondContact O-N 2.81Å
1039	V	51	Low	51.9	Low	80 Å²	80	96.8 Å²	96.8	49%	0.485	51%	0.514	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.6	126	178.6	-174.2	0	0	0	0	110.7	I901 I1041	I901-V1039 HydrophobicContact CB-CB 4.46Å; I901-V1039 PolarHBondContact N-O 2.99Å; I901-V1039 PolarHBondContact O-N 3.43Å; V1039-I1041 HydrophobicContact CG1-CG1 4.29Å
1040	W	54.4	Low	50.7	Low	113 Å²	113	99.5 Å²	99.5	43%	0.428	53%	0.533	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	128.7	165.8	-110.9	75.6	0	0	0	109.4	S898 I900 R1038	S898-W1040 VanDerWaalsContact CB-CE3 3.47Å; S898-W1040 WeakPolarHBondContact OG-CH2 3.3Å; S898-W1040 VanDerWaalsContact OG-CZ3 3.25Å; S898-W1040 WeakPolarHBondContact OG-CZ3 3.21Å; I900-W1040 HydrophobicContact CD1-CZ2 4.14Å; I900-W1040 HydrophobicContact CG1-CD2 4.42Å; I900-W1040 HydrophobicContact CG1-CG 4.42Å; R1038-W1040 PolarHBondContact O-N 2.81Å
1041	I	50.3	Low	49.4	Very low	70 Å²	70	102.3 Å²	102.3	36%	0.359	54%	0.54	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	103.6	168.1	-59.9	176.6	0	0	0	106.4	S898 L899 I901 V1039 Q1043	S898-I1041 CarbonylContact C-O 3.54Å; S898-I1041 WeakPolarHBondContact CA-O 3.29Å; L899-I1041 HydrophobicContact CB-CB 4.31Å; L899-I1041 HydrophobicContact CD2-CD1 4.47Å; L899-I1041 PolarHBondContact N-O 3.1Å; L899-I1041 PolarHBondContact O-N 3.08Å; I901-I1041 HydrophobicContact CD1-CD1 3.58Å; I901-I1041 HydrophobicContact CG1-CD1 4.17Å; V1039-I1041 HydrophobicContact CG1-CG1 4.29Å; I1041-Q1043 PolarHBondContact O-N 2.85Å
1042	P	38.5	Very low	47.5	Very low	99 Å²	99	107.5 Å²	107.5	64%	0.643	56%	0.561	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-62.7	132.2	169.5	27.7	-32.7	0	0	0	108.7
1043	Q	44	Very low	45.9	Very low	106 Å²	106	115 Å²	115	50%	0.495	60%	0.599	S	S	.	*			trans	-96.6	114.6	171.8	-65.4	-170.5	-60.4	0	0	107.3	H897 I1041 G1045	H897-Q1043 PolarHBondContact O-N 2.79Å; I1041-Q1043 PolarHBondContact O-N 2.85Å; Q1043-G1045 PolarHBondContact O-N 3.13Å
1044	S	43	Very low	44	Very low	123 Å²	123	118.4 Å²	118.4	86%	0.86	62%	0.624	S	S	*	*			trans	-52.6	112.1	175.1	49	0	0	0	0	109.3	E1046	S1044-E1046 PolarHBondContact O-N 3.36Å
1045	G	42.9	Very low	42.2	Very low	49 Å²	49	122.5 Å²	122.5	51%	0.505	65%	0.648	S	S	.	*	P	Polyproline II helix	trans	-64.7	132.5	-170.5	0	0	0	0	0	112.1	Q1043	Q1043-G1045 PolarHBondContact O-N 3.13Å
1046	E	38.6	Very low	40.6	Very low	186 Å²	186	130.4 Å²	130.4	87%	0.869	67%	0.667	S	S	*	*	P	Polyproline II helix	trans	-52.3	141.6	162.1	-64.5	179.7	143.5	0	0	109.4	S1044 Y1048	S1044-E1046 PolarHBondContact O-N 3.36Å; E1046-Y1048 PolarHBondContact O-N 2.95Å
1047	Q	34.4	Very low	39.4	Very low	189 Å²	189	131.6 Å²	131.6	88%	0.883	68%	0.678	S	S	*	*	P	Polyproline II helix	trans	-56.7	128.6	-167.9	-68.1	171.3	-31.2	0	0	111.7
1048	Y	30.7	Very low	39	Very low	190 Å²	190	133.5 Å²	133.5	75%	0.745	70%	0.697	S	S	*	*	P	Polyproline II helix	trans	-54.3	131.4	168.3	-77.5	-89.4	0	0	0	109.3	E1046 V1050	E1046-Y1048 PolarHBondContact O-N 2.95Å; Y1048-V1050 VanDerWaalsContact C-N 3.32Å; Y1048-V1050 PolarHBondContact O-N 3.45Å
1049	P	33.7	Very low	38.1	Very low	123 Å²	123	132 Å²	132	80%	0.799	70%	0.703	S	S	*	*			trans	-68.9	93	175.3	27.8	-33.4	0	0	0	109.2	K1051	P1049-K1051 PolarHBondContact O-N 2.88Å
1050	V	33.7	Very low	37.6	Very low	132 Å²	132	132.2 Å²	132.2	80%	0.8	71%	0.708	S	S	*	*			trans	-55	125.4	169.3	177.8	0	0	0	0	107.2	Y1048 Q1052	Y1048-V1050 VanDerWaalsContact C-N 3.32Å; Y1048-V1050 PolarHBondContact O-N 3.45Å; V1050-Q1052 PolarHBondContact O-N 3.06Å
1051	K	32.2	Very low	37.1	Very low	188 Å²	188	132.7 Å²	132.7	82%	0.817	72%	0.718	S	S	*	*			trans	-54.2	125.8	-175.4	-64.6	177.4	-178.8	176.9	0	109.2	P1049 I1053	P1049-K1051 PolarHBondContact O-N 2.88Å; K1051-I1053 PolarHBondContact O-N 3.17Å
1052	Q	27.5	Very low	37	Very low	194 Å²	194	133.9 Å²	133.9	91%	0.907	73%	0.729	S	S	*	*			trans	-63	103.7	179.1	-68.3	176.3	-6.2	0	0	109.5	V1050	V1050-Q1052 PolarHBondContact O-N 3.06Å
1053	I	34.4	Very low	37.5	Very low	160 Å²	160	132 Å²	132	82%	0.821	71%	0.714	S	S	*	*			trans	-78.4	124.6	161.7	-61.4	176.2	0	0	0	105.5	K1051	K1051-I1053 PolarHBondContact O-N 3.17Å
1054	P	28.5	Very low	37.9	Very low	104 Å²	104	135.3 Å²	135.3	68%	0.675	72%	0.722	S	S	*	*			trans	-73	145.2	-166.8	28.3	-35.5	0	0	0	113.1
1055	D	27.9	Very low	38.7	Very low	149 Å²	149	134.8 Å²	134.8	80%	0.797	71%	0.709	S	S	*	*			trans	32.5	99.1	153.3	-57.2	-26.4	0	0	0	118.8
1056	R	31.9	Very low	39.3	Very low	235 Å²	235	137.7 Å²	137.7	89%	0.887	71%	0.71	S	S	*	*				-163.2	137.1	127.1	-107.5	152.2	-165.1	-140.7	0.4	115.4
1057	T	34.7	Very low	40	Very low	113 Å²	113	136.2 Å²	136.2	69%	0.693	70%	0.696	S	S	*	*			trans	62.9	130	156.9	51.1	0	0	0	0	119.2	S1059	T1057-S1059 PolarHBondContact O-N 3.23Å
1058	A	46.7	Very low	41.2	Very low	92 Å²	92	131.4 Å²	131.4	76%	0.76	67%	0.674	S	S	*	*	G	3₁₀ helix	trans	-78.9	27.9	-174.8	0	0	0	0	0	115.3
1059	S	41.6	Very low	42.5	Very low	77 Å²	77	124.4 Å²	124.4	54%	0.538	66%	0.655	S	S	.	*	G	3₁₀ helix	trans	-86.3	0.1	179.9	48	0	0	0	0	114.3	T1057 T1062	T1057-S1059 PolarHBondContact O-N 3.23Å; S1059-T1062 PolarHBondContact O-OG1 3.39Å
1060	S	40.6	Very low	43.3	Very low	85 Å²	85	125 Å²	125	59%	0.594	65%	0.647	S	S	*	*	G	3₁₀ helix	trans	-80.8	-18.9	178.5	59.3	0	0	0	0	114.3	N1063 R1064	S1060-N1063 PolarHBondContact O-N 3.02Å; S1060-R1064 PolarHBondContact O-N 2.77Å; S1060-R1064 VanDerWaalsContact O-N 3.17Å
1061	L	43.4	Very low	44.6	Very low	122 Å²	122	123.7 Å²	123.7	64%	0.639	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.5	-47.1	179.2	-77.4	170.4	0	0	0	111.9	N1063 R1064 D1065	L1061-N1063 PolarHBondContact O-N 2.87Å; L1061-R1064 WeakPolarHBondContact O-CB 3.32Å; L1061-R1064 PolarHBondContact O-N 3.18Å; L1061-D1065 PolarHBondContact O-N 2.8Å
1062	T	49	Very low	46	Very low	95 Å²	95	118.6 Å²	118.6	58%	0.583	62%	0.617	S	S	*	*	H	α-helix	trans	-59	-36	173.6	51.2	0	0	0	0	111.7	S1059 R1064 D1065 E1066	S1059-T1062 PolarHBondContact O-OG1 3.39Å; T1062-R1064 VanDerWaalsContact C-N 3.25Å; T1062-R1064 PolarHBondContact O-N 2.28Å; T1062-D1065 PolarHBondContact O-N 3.15Å; T1062-E1066 PolarHBondContact O-N 2.58Å
1063	N	47.5	Very low	47.5	Very low	59 Å²	59	114.6 Å²	114.6	32%	0.316	60%	0.602	S	S	.	*	H	α-helix	trans	-73.8	-13	178	-151.6	-115.3	0	0	0	113.4	S1060 L1061 E1066 R1067	S1060-N1063 PolarHBondContact O-N 3.02Å; L1061-N1063 PolarHBondContact O-N 2.87Å; N1063-E1066 PolarHBondContact ND2-OE2 2.9Å; N1063-R1067 WeakPolarHBondContact O-CB 3.47Å; N1063-R1067 VanDerWaalsContact O-CD 3.27Å; N1063-R1067 WeakPolarHBondContact O-CD 3.45Å; N1063-R1067 WeakPolarHBondContact O-CG 3.36Å; N1063-R1067 PolarHBondContact O-N 3.04Å; N1063-R1067 PolarHBondContact OD1-NE 2.94Å; N1063-R1067 PolarHBondContact OD1-NH2 2.75Å
1064	R	52	Low	48.5	Very low	176 Å²	176	110.1 Å²	110.1	66%	0.664	59%	0.585	S	S	*	*	H	α-helix	trans	-74.7	-45.5	168.9	-177.5	177.3	177.6	134.4	3.6	110.6	S1060 L1061 T1062 R1067 Q1068	S1060-R1064 PolarHBondContact O-N 2.77Å; S1060-R1064 VanDerWaalsContact O-N 3.17Å; L1061-R1064 WeakPolarHBondContact O-CB 3.32Å; L1061-R1064 PolarHBondContact O-N 3.18Å; T1062-R1064 VanDerWaalsContact C-N 3.25Å; T1062-R1064 PolarHBondContact O-N 2.28Å; R1064-R1067 PolarHBondContact O-N 3.35Å; R1064-Q1068 PolarHBondContact O-N 3.19Å
1065	D	60.6	Low	49.9	Very low	113 Å²	113	108 Å²	108	60%	0.604	58%	0.576	S	S	*	*	H	α-helix	trans	-71.8	-36.2	-178.4	-59.1	-26.4	0	0	0	111	L1061 T1062 R1067 Q1068 A1069	L1061-D1065 PolarHBondContact O-N 2.8Å; T1062-D1065 PolarHBondContact O-N 3.15Å; D1065-R1067 VanDerWaalsContact C-N 3.35Å; D1065-R1067 PolarHBondContact O-N 3.38Å; D1065-Q1068 PolarHBondContact O-N 3.37Å; D1065-A1069 VanDerWaalsContact O-CB 3.29Å; D1065-A1069 WeakPolarHBondContact O-CB 3.4Å; D1065-A1069 PolarHBondContact O-N 3.24Å
1066	E	56	Low	50.6	Low	109 Å²	109	106.2 Å²	106.2	51%	0.509	56%	0.564	S	S	.	*	H	α-helix	trans	-59.8	-41.4	167.3	-76.2	-176	124.4	0	0	112.7	T1062 N1063 A1069 Q1070	T1062-E1066 PolarHBondContact O-N 2.58Å; N1063-E1066 PolarHBondContact ND2-OE2 2.9Å; E1066-A1069 PolarHBondContact O-N 2.8Å; E1066-Q1070 WeakPolarHBondContact O-CB 3.36Å; E1066-Q1070 WeakPolarHBondContact O-CG 3.22Å; E1066-Q1070 PolarHBondContact O-N 3.11Å
1067	R	53.2	Low	51.4	Low	155 Å²	155	97.7 Å²	97.7	59%	0.585	54%	0.544	S	S	*	.	H	α-helix	trans	-71	-37.2	178.1	-77	171	-163.7	-114.8	-0.3	112.3	N1063 R1064 D1065 Q1070 L1071	N1063-R1067 WeakPolarHBondContact O-CB 3.47Å; N1063-R1067 VanDerWaalsContact O-CD 3.27Å; N1063-R1067 WeakPolarHBondContact O-CD 3.45Å; N1063-R1067 WeakPolarHBondContact O-CG 3.36Å; N1063-R1067 PolarHBondContact O-N 3.04Å; N1063-R1067 PolarHBondContact OD1-NE 2.94Å; N1063-R1067 PolarHBondContact OD1-NH2 2.75Å; R1064-R1067 PolarHBondContact O-N 3.35Å; D1065-R1067 VanDerWaalsContact C-N 3.35Å; D1065-R1067 PolarHBondContact O-N 3.38Å; R1067-Q1070 PolarHBondContact O-N 3.03Å; R1067-L1071 WeakPolarHBondContact O-CB 3.23Å; R1067-L1071 VanDerWaalsContact O-CG 3.31Å; R1067-L1071 WeakPolarHBondContact O-CG 3.33Å; R1067-L1071 PolarHBondContact O-N 2.96Å
1068	Q	59.7	Low	52.4	Low	89 Å²	89	98.9 Å²	98.9	42%	0.416	54%	0.54	S	S	.	.	H	α-helix	trans	-64.7	-46.9	172.8	-168.3	61.4	56.4	0	0	109.6	R1064 D1065 Q1070 L1071 D1072	R1064-Q1068 PolarHBondContact O-N 3.19Å; D1065-Q1068 PolarHBondContact O-N 3.37Å; Q1068-Q1070 VanDerWaalsContact C-N 3.28Å; Q1068-Q1070 PolarHBondContact O-N 3.16Å; Q1068-L1071 CarbonylContact O-C 3.39Å; Q1068-L1071 PolarHBondContact O-N 3.05Å; Q1068-D1072 PolarHBondContact NE2-OD1 3.02Å; Q1068-D1072 WeakPolarHBondContact O-CB 3.35Å; Q1068-D1072 PolarHBondContact O-N 2.79Å
1069	A	57.5	Low	52.5	Low	43 Å²	43	98.7 Å²	98.7	36%	0.355	54%	0.538	S	S	.	.	H	α-helix	trans	-60.2	-33.2	173.5	0	0	0	0	0	113.1	D1065 E1066 N1073	D1065-A1069 VanDerWaalsContact O-CB 3.29Å; D1065-A1069 WeakPolarHBondContact O-CB 3.4Å; D1065-A1069 PolarHBondContact O-N 3.24Å; E1066-A1069 PolarHBondContact O-N 2.8Å; A1069-N1073 WeakPolarHBondContact O-CB 3.22Å; A1069-N1073 PolarHBondContact O-N 3.39Å; A1069-N1073 PolarHBondContact O-ND2 2.84Å
1070	Q	51.6	Low	52.6	Low	135 Å²	135	101.4 Å²	101.4	63%	0.631	55%	0.546	S	S	*	.	H	α-helix	trans	-72.2	-35.9	172.1	-78.2	-178.1	2	0	0	112.9	E1066 R1067 Q1068 S1074	E1066-Q1070 WeakPolarHBondContact O-CB 3.36Å; E1066-Q1070 WeakPolarHBondContact O-CG 3.22Å; E1066-Q1070 PolarHBondContact O-N 3.11Å; R1067-Q1070 PolarHBondContact O-N 3.03Å; Q1068-Q1070 VanDerWaalsContact C-N 3.28Å; Q1068-Q1070 PolarHBondContact O-N 3.16Å; Q1070-S1074 VanDerWaalsContact O-CB 3.24Å; Q1070-S1074 WeakPolarHBondContact O-CB 3.29Å; Q1070-S1074 PolarHBondContact O-N 2.9Å; Q1070-S1074 PolarHBondContact O-OG 2.87Å
1071	L	61	Low	52.4	Low	104 Å²	104	103.6 Å²	103.6	55%	0.545	54%	0.541	S	S	.	.	H	α-helix	trans	-68	-43.7	173.3	-72.8	170.2	0	0	0	111.1	R1067 Q1068 S1074 A1075	R1067-L1071 WeakPolarHBondContact O-CB 3.23Å; R1067-L1071 VanDerWaalsContact O-CG 3.31Å; R1067-L1071 WeakPolarHBondContact O-CG 3.33Å; R1067-L1071 PolarHBondContact O-N 2.96Å; Q1068-L1071 CarbonylContact O-C 3.39Å; Q1068-L1071 PolarHBondContact O-N 3.05Å; L1071-S1074 WeakPolarHBondContact CA-OG 3.42Å; L1071-S1074 PolarHBondContact O-N 2.88Å; L1071-S1074 PolarHBondContact O-OG 2.76Å; L1071-S1074 VanDerWaalsContact O-OG 3.13Å; L1071-A1075 VanDerWaalsContact O-CB 3.28Å; L1071-A1075 WeakPolarHBondContact O-CB 3.3Å; L1071-A1075 PolarHBondContact O-N 3.24Å
1072	D	61.9	Low	52.1	Low	82 Å²	82	103.2 Å²	103.2	44%	0.439	54%	0.54	S	S	.	.	H	α-helix	trans	-67.3	-42.6	177.7	-58.8	-16.7	0	0	0	110.7	Q1068 A1075 M1076	Q1068-D1072 PolarHBondContact NE2-OD1 3.02Å; Q1068-D1072 WeakPolarHBondContact O-CB 3.35Å; Q1068-D1072 PolarHBondContact O-N 2.79Å; D1072-A1075 PolarHBondContact O-N 3.33Å; D1072-M1076 VanDerWaalsContact O-CB 3.26Å; D1072-M1076 WeakPolarHBondContact O-CB 3.44Å; D1072-M1076 WeakPolarHBondContact O-CG 3.31Å; D1072-M1076 PolarHBondContact O-N 3.08Å
1073	N	57.2	Low	52.2	Low	109 Å²	109	105.5 Å²	105.5	58%	0.583	54%	0.542	S	S	*	.	H	α-helix	trans	-67.6	-32.1	173.7	-78.8	-49.9	0	0	0	113	A1069 A1077	A1069-N1073 WeakPolarHBondContact O-CB 3.22Å; A1069-N1073 PolarHBondContact O-N 3.39Å; A1069-N1073 PolarHBondContact O-ND2 2.84Å; N1073-A1077 WeakPolarHBondContact O-CB 3.27Å; N1073-A1077 PolarHBondContact O-N 2.99Å
1074	S	56.6	Low	51.8	Low	66 Å²	66	108 Å²	108	46%	0.462	56%	0.559	S	S	.	*	H	α-helix	trans	-80.1	-31.8	176.4	55	0	0	0	0	112.7	Q1070 L1071 A1077 F1078	Q1070-S1074 VanDerWaalsContact O-CB 3.24Å; Q1070-S1074 WeakPolarHBondContact O-CB 3.29Å; Q1070-S1074 PolarHBondContact O-N 2.9Å; Q1070-S1074 PolarHBondContact O-OG 2.87Å; L1071-S1074 WeakPolarHBondContact CA-OG 3.42Å; L1071-S1074 PolarHBondContact O-N 2.88Å; L1071-S1074 PolarHBondContact O-OG 2.76Å; L1071-S1074 VanDerWaalsContact O-OG 3.13Å; S1074-A1077 CarbonylContact O-C 3.55Å; S1074-A1077 PolarHBondContact O-N 3.37Å; S1074-F1078 WeakPolarHBondContact O-CB 3.49Å; S1074-F1078 PolarHBondContact O-N 3.49Å
1075	A	56.6	Low	51.2	Low	60 Å²	60	104.5 Å²	104.5	50%	0.496	56%	0.557	S	S	.	*	H	α-helix	trans	-64.7	-45.9	167	0	0	0	0	0	111	L1071 D1072 A1077 F1078 A1079	L1071-A1075 VanDerWaalsContact O-CB 3.28Å; L1071-A1075 WeakPolarHBondContact O-CB 3.3Å; L1071-A1075 PolarHBondContact O-N 3.24Å; D1072-A1075 PolarHBondContact O-N 3.33Å; A1075-A1077 PolarHBondContact O-N 3.32Å; A1075-F1078 PolarHBondContact O-N 3.01Å; A1075-F1078 VanDerWaalsContact O-N 3.12Å; A1075-A1079 WeakPolarHBondContact O-CB 3.31Å; A1075-A1079 PolarHBondContact O-N 3.29Å
1076	M	43	Very low	50.5	Low	112 Å²	112	105.1 Å²	105.1	55%	0.552	57%	0.567	S	S	*	*	H	α-helix	trans	-58.2	-45.7	170.6	-76.3	-86.2	-76.4	0	0	111.7	D1072 F1078 A1079 L1080	D1072-M1076 VanDerWaalsContact O-CB 3.26Å; D1072-M1076 WeakPolarHBondContact O-CB 3.44Å; D1072-M1076 WeakPolarHBondContact O-CG 3.31Å; D1072-M1076 PolarHBondContact O-N 3.08Å; M1076-F1078 PolarHBondContact O-N 3.32Å; M1076-A1079 PolarHBondContact O-N 2.85Å; M1076-L1080 HydrophobicContact CE-CD1 4.24Å; M1076-L1080 WeakPolarHBondContact O-CB 3.32Å; M1076-L1080 VanDerWaalsContact O-CG 3.29Å; M1076-L1080 WeakPolarHBondContact O-CG 3.33Å; M1076-L1080 PolarHBondContact O-N 3.11Å
1077	A	49.8	Very low	49.6	Very low	55 Å²	55	109.3 Å²	109.3	46%	0.455	58%	0.584	S	S	.	*	H	α-helix	trans	-74.6	-2.9	177.3	0	0	0	0	0	114.5	N1073 S1074 A1075 R1081	N1073-A1077 WeakPolarHBondContact O-CB 3.27Å; N1073-A1077 PolarHBondContact O-N 2.99Å; S1074-A1077 CarbonylContact O-C 3.55Å; S1074-A1077 PolarHBondContact O-N 3.37Å; A1075-A1077 PolarHBondContact O-N 3.32Å; A1077-R1081 WeakPolarHBondContact O-CB 3.49Å
1078	F	55.1	Low	49.1	Very low	138 Å²	138	108.5 Å²	108.5	61%	0.605	59%	0.59	S	S	*	*	H	α-helix	trans	-97	-43.9	168.1	-160	-84	0	0	0	110.5	S1074 A1075 M1076 R1081 F1083	S1074-F1078 WeakPolarHBondContact O-CB 3.49Å; S1074-F1078 PolarHBondContact O-N 3.49Å; A1075-F1078 PolarHBondContact O-N 3.01Å; A1075-F1078 VanDerWaalsContact O-N 3.12Å; M1076-F1078 PolarHBondContact O-N 3.32Å; F1078-R1081 WeakPolarHBondContact O-CB 3.36Å; F1078-R1081 PolarHBondContact O-N 2.73Å; F1078-F1083 HydrophobicContact CE1-CZ 4.17Å; F1078-F1083 HydrophobicContact CZ-CZ 4.13Å
1079	A	49.8	Very low	47.9	Very low	89 Å²	89	119.4 Å²	119.4	74%	0.736	63%	0.627	S	S	*	*	H	α-helix	trans	-68.3	-33.1	175.8	0	0	0	0	0	113.5	A1075 M1076 R1081	A1075-A1079 WeakPolarHBondContact O-CB 3.31Å; A1075-A1079 PolarHBondContact O-N 3.29Å; M1076-A1079 PolarHBondContact O-N 2.85Å; A1079-R1081 VanDerWaalsContact C-N 3.31Å
1080	L	42.1	Very low	47.4	Very low	133 Å²	133	123.2 Å²	123.2	70%	0.696	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.1	10.1	172.8	-60.1	173.1	0	0	0	112.5	M1076 D1082	M1076-L1080 HydrophobicContact CE-CD1 4.24Å; M1076-L1080 WeakPolarHBondContact O-CB 3.32Å; M1076-L1080 VanDerWaalsContact O-CG 3.29Å; M1076-L1080 WeakPolarHBondContact O-CG 3.33Å; M1076-L1080 PolarHBondContact O-N 3.11Å; L1080-D1082 PolarHBondContact O-N 3.29Å
1081	R	37.3	Very low	47.2	Very low	132 Å²	132	122.6 Å²	122.6	50%	0.498	64%	0.641	S	S	.	*			trans	-80.3	105.3	179	-154.8	177.1	-173.9	97	-2	108.9	A1077 F1078 A1079 F1083	A1077-R1081 WeakPolarHBondContact O-CB 3.49Å; F1078-R1081 WeakPolarHBondContact O-CB 3.36Å; F1078-R1081 PolarHBondContact O-N 2.73Å; A1079-R1081 VanDerWaalsContact C-N 3.31Å; R1081-F1083 HydrophobicContact CB-CD2 4.42Å; R1081-F1083 HydrophobicContact CB-CE2 3.92Å; R1081-F1083 HydrophobicContact CB-CZ 4.15Å; R1081-F1083 HydrophobicContact CG-CZ 4.4Å; R1081-F1083 WeakPolarHBondContact O-CD2 2.99Å; R1081-F1083 WeakPolarHBondContact O-CE2 3.22Å; R1081-F1083 PolarHBondContact O-N 3.41Å
1082	D	36.6	Very low	46.4	Very low	114 Å²	114	123.6 Å²	123.6	61%	0.61	65%	0.647	S	S	*	*			trans	-71.3	90.4	-179.6	-146.6	-30.7	0	0	0	110.5	L1080 T1084 V1085	L1080-D1082 PolarHBondContact O-N 3.29Å; D1082-T1084 PolarHBondContact O-N 3.19Å; D1082-T1084 WeakPolarHBondContact OD1-CB 3.48Å; D1082-T1084 WeakPolarHBondContact OD1-CG2 3.42Å; D1082-T1084 PolarHBondContact OD1-OG1 3.19Å; D1082-V1085 PolarHBondContact O-N 3.41Å
1083	F	51.6	Low	45.5	Very low	143 Å²	143	126.1 Å²	126.1	63%	0.627	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67	0.9	-178.8	-70.7	-81.4	0	0	0	113.4	F1078 R1081 V1085	F1078-F1083 HydrophobicContact CE1-CZ 4.17Å; F1078-F1083 HydrophobicContact CZ-CZ 4.13Å; R1081-F1083 HydrophobicContact CB-CD2 4.42Å; R1081-F1083 HydrophobicContact CB-CE2 3.92Å; R1081-F1083 HydrophobicContact CB-CZ 4.15Å; R1081-F1083 HydrophobicContact CG-CZ 4.4Å; R1081-F1083 WeakPolarHBondContact O-CD2 2.99Å; R1081-F1083 WeakPolarHBondContact O-CE2 3.22Å; R1081-F1083 PolarHBondContact O-N 3.41Å; F1083-V1085 VanDerWaalsContact C-N 3.28Å; F1083-V1085 PolarHBondContact O-N 3.23Å
1084	T	38.3	Very low	44.8	Very low	111 Å²	111	127.1 Å²	127.1	68%	0.681	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.9	-11.1	175.8	61.3	0	0	0	0	114	D1082 P1086	D1082-T1084 PolarHBondContact O-N 3.19Å; D1082-T1084 WeakPolarHBondContact OD1-CB 3.48Å; D1082-T1084 WeakPolarHBondContact OD1-CG2 3.42Å; D1082-T1084 PolarHBondContact OD1-OG1 3.19Å; T1084-P1086 VanDerWaalsContact O-CD 3.29Å; T1084-P1086 WeakPolarHBondContact O-CD 3.43Å
1085	V	39.2	Very low	44	Very low	102 Å²	102	131.2 Å²	131.2	62%	0.618	68%	0.677	S	S	*	*	S	Bend	trans	-84.6	108.8	178.8	-176.1	0	0	0	0	111.2	D1082 F1083 K1087	D1082-V1085 PolarHBondContact O-N 3.41Å; F1083-V1085 VanDerWaalsContact C-N 3.28Å; F1083-V1085 PolarHBondContact O-N 3.23Å; V1085-K1087 VanDerWaalsContact C-N 3.33Å; V1085-K1087 PolarHBondContact O-N 3.23Å
1086	P	46.1	Very low	43.1	Very low	126 Å²	126	136.3 Å²	136.3	82%	0.818	69%	0.69	S	S	*	*	S	Bend	trans	-84.6	67.9	-167	35.3	-36.6	0	0	0	112.4	T1084	T1084-P1086 VanDerWaalsContact O-CD 3.29Å; T1084-P1086 WeakPolarHBondContact O-CD 3.43Å
1087	K	38	Very low	43.1	Very low	197 Å²	197	138.2 Å²	138.2	86%	0.857	70%	0.701	S	S	*	*			trans	-153.7	21.9	-179.8	-119.6	161.9	-168.6	172.7	0	117.8	V1085	V1085-K1087 VanDerWaalsContact C-N 3.33Å; V1085-K1087 PolarHBondContact O-N 3.23Å
1088	I	41.1	Very low	42.5	Very low	139 Å²	139	145.1 Å²	145.1	71%	0.713	72%	0.721	S	S	*	*			trans	-120.3	138.3	162.3	-56.7	-179.2	0	0	0	107.5
1089	R	34.8	Very low	41.4	Very low	317 Å²	317	145.7 Å²	145.7	100%	1.196	73%	0.732	S	S	*	*			trans	-111.9	0	178.2	-90.1	-175.3	173.3	172.4	-2.6	109.9

Retrieved 1,089 of 1,089 residues in 245.5 ms (Link to these results)

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