1 HEADER TRANSLATION,PROTEIN BINDING 10-DEC-14 2MX4
2 TITLE NMR STRUCTURE OF PHOSPHORYLATED 4E-BP2
4 COMPND 2 MOLECULE: EUKARYOTIC TRANSLATION INITIATION FACTOR 4E-BINDING PROTEIN
7 COMPND 5 FRAGMENT: RESIDUES 18-62;
8 COMPND 6 SYNONYM: 4E-BP2, EIF4E-BINDING PROTEIN 2;
9 COMPND 7 ENGINEERED: YES
11 SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;
12 SOURCE 3 ORGANISM_COMMON: HUMAN;
13 SOURCE 4 ORGANISM_TAXID: 9606;
14 SOURCE 5 GENE: EIF4EBP2;
15 SOURCE 6 EXPRESSION_SYSTEM: ESCHERICHIA COLI;
16 SOURCE 7 EXPRESSION_SYSTEM_TAXID: 562;
17 SOURCE 8 EXPRESSION_SYSTEM_VECTOR: PET SUMO
18 KEYWDS PHOSPHORYLATION, INTRINSIC DISORDER, TRANSLATION, PROTEIN BINDING,
19 KEYWDS 2 TRANSLATION,PROTEIN BINDING
22 AUTHOR A.BAH,J.FORMAN-KAY,R.VERNON,Z.SIDDIQUI,M.KRZEMINSKI,R.MUHANDIRAM,
23 AUTHOR 2 C.ZHAO,N.SONENBERG,L.KAY
24 REVDAT 2 18-MAR-15 2MX4 1 JRNL
25 REVDAT 1 07-JAN-15 2MX4 0
26 JRNL AUTH A.BAH,R.M.VERNON,Z.SIDDIQUI,M.KRZEMINSKI,R.MUHANDIRAM,
27 JRNL AUTH 2 C.ZHAO,N.SONENBERG,L.E.KAY,J.D.FORMAN-KAY
28 JRNL TITL FOLDING OF AN INTRINSICALLY DISORDERED PROTEIN BY
29 JRNL TITL 2 PHOSPHORYLATION AS A REGULATORY SWITCH.
30 JRNL REF NATURE V. 519 106 2015
31 JRNL REFN ISSN 0028-0836
33 JRNL DOI 10.1038/NATURE13999
35 REMARK 2 RESOLUTION. NOT APPLICABLE.
38 REMARK 3 PROGRAM : CS-ROSETTA
39 REMARK 3 AUTHORS : LANGE AND BAKER
41 REMARK 3 OTHER REFINEMENT REMARKS: NULL
43 REMARK 4 2MX4 COMPLIES WITH FORMAT V. 3.30, 13-JUL-11
45 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 22-DEC-14.
46 REMARK 100 THE RCSB ID CODE IS RCSB104153.
48 REMARK 210 EXPERIMENTAL DETAILS
49 REMARK 210 EXPERIMENT TYPE : NMR
50 REMARK 210 TEMPERATURE (KELVIN) : 20
52 REMARK 210 IONIC STRENGTH : 0.150
53 REMARK 210 PRESSURE : AMBIENT
54 REMARK 210 SAMPLE CONTENTS : 1 MM [U-99% 13C; U-99% 15N]
55 REMARK 210 PHOSPHORYLATED 4E-BP2, 2 MM DTT,
56 REMARK 210 100 MM SODIUM CHLORIDE, 30 MM
57 REMARK 210 SODIUM PHOSPHATE, 1 MM EDTA, 1 MM
58 REMARK 210 BENZAMIDINE, 90% H2O/10% D2O
60 REMARK 210 NMR EXPERIMENTS CONDUCTED : 2D 1H-15N HSQC; 3D HNCO; 3D
61 REMARK 210 H(CCO)NH; 3D 1H-15N NOESY; 3D
62 REMARK 210 CBCA(CO)NH; 3D 1H-13C NOESY
63 REMARK 210 SPECTROMETER FIELD STRENGTH : 500 MHZ; 600 MHZ; 800 MHZ
64 REMARK 210 SPECTROMETER MODEL : INOVA
65 REMARK 210 SPECTROMETER MANUFACTURER : VARIAN
67 REMARK 210 STRUCTURE DETERMINATION.
68 REMARK 210 SOFTWARE USED : NMRPIPE
69 REMARK 210 METHOD USED : SIMULATED ANNEALING
71 REMARK 210 CONFORMERS, NUMBER CALCULATED : 20359
72 REMARK 210 CONFORMERS, NUMBER SUBMITTED : 20
73 REMARK 210 CONFORMERS, SELECTION CRITERIA : STRUCTURES WITH THE LOWEST ENERGY
75 REMARK 210 BEST REPRESENTATIVE CONFORMER IN THIS ENSEMBLE : 1
77 REMARK 210 REMARK: NULL
80 REMARK 215 THE COORDINATES IN THIS ENTRY WERE GENERATED FROM SOLUTION
81 REMARK 215 NMR DATA. PROTEIN DATA BANK CONVENTIONS REQUIRE THAT
82 REMARK 215 CRYST1 AND SCALE RECORDS BE INCLUDED, BUT THE VALUES ON
83 REMARK 215 THESE RECORDS ARE MEANINGLESS.
85 REMARK 300 BIOMOLECULE: 1
86 REMARK 300 SEE REMARK 350 FOR THE AUTHOR PROVIDED AND/OR PROGRAM
87 REMARK 300 GENERATED ASSEMBLY INFORMATION FOR THE STRUCTURE IN
88 REMARK 300 THIS ENTRY. THE REMARK MAY ALSO PROVIDE INFORMATION ON
89 REMARK 300 BURIED SURFACE AREA.
91 REMARK 350 COORDINATES FOR A COMPLETE MULTIMER REPRESENTING THE KNOWN
92 REMARK 350 BIOLOGICALLY SIGNIFICANT OLIGOMERIZATION STATE OF THE
93 REMARK 350 MOLECULE CAN BE GENERATED BY APPLYING BIOMT TRANSFORMATIONS
94 REMARK 350 GIVEN BELOW. BOTH NON-CRYSTALLOGRAPHIC AND
95 REMARK 350 CRYSTALLOGRAPHIC OPERATIONS ARE GIVEN.
97 REMARK 350 BIOMOLECULE: 1
98 REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: MONOMERIC
99 REMARK 350 APPLY THE FOLLOWING TO CHAINS: A
100 REMARK 350 BIOMT1 1 1.000000 0.000000 0.000000 0.00000
101 REMARK 350 BIOMT2 1 0.000000 1.000000 0.000000 0.00000
102 REMARK 350 BIOMT3 1 0.000000 0.000000 1.000000 0.00000
104 REMARK 500 GEOMETRY AND STEREOCHEMISTRY
105 REMARK 500 SUBTOPIC: TORSION ANGLES
107 REMARK 500 TORSION ANGLES OUTSIDE THE EXPECTED RAMACHANDRAN REGIONS:
108 REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER;
109 REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE).
111 REMARK 500 STANDARD TABLE:
112 REMARK 500 FORMAT:(10X,I3,1X,A3,1X,A1,I4,A1,4X,F7.2,3X,F7.2)
114 REMARK 500 EXPECTED VALUES: GJ KLEYWEGT AND TA JONES (1996). PHI/PSI-
115 REMARK 500 CHOLOGY: RAMACHANDRAN REVISITED. STRUCTURE 4, 1395 - 1400
117 REMARK 500 M RES CSSEQI PSI PHI
118 REMARK 500 11 PRO A 31 -176.10 -67.77
119 REMARK 500 14 PHE A 58 41.74 -105.34
121 REMARK 500 REMARK: NULL
123 REMARK 900 RELATED ENTRIES
124 REMARK 900 RELATED ID: 19905 RELATED DB: BMRB
125 REMARK 900 CHEMICAL SHIFTS OF FULL LENGTH PHOSPHORYLATED 4E-BP2
126 REMARK 900 RELATED ID: 19114 RELATED DB: BMRB
127 REMARK 900 CHEMICAL SHIFTS OF FULL LENGTH NON-PHOSPHORYLATED 4E-BP2
128 DBREF 2MX4 A 18 62 UNP Q13542 4EBP2_HUMAN 18 62
129 SEQRES 1 A 45 PRO THR ARG THR VAL ALA ILE SER ASP ALA ALA GLN LEU
130 SEQRES 2 A 45 PRO HIS ASP TYR CYS THR TPO PRO GLY GLY THR LEU PHE
131 SEQRES 3 A 45 SER THR TPO PRO GLY GLY THR ARG ILE ILE TYR ASP ARG
132 SEQRES 4 A 45 LYS PHE LEU LEU ASP ARG
133 MODRES 2MX4 TPO A 37 THR PHOSPHOTHREONINE
134 MODRES 2MX4 TPO A 46 THR PHOSPHOTHREONINE
137 HETNAM TPO PHOSPHOTHREONINE
138 HETSYN TPO PHOSPHONOTHREONINE
139 FORMUL 1 TPO 2(C4 H10 N O6 P)
140 SHEET 1 A 4 THR A 19 ILE A 24 0
141 SHEET 2 A 4 ARG A 51 ARG A 56 1 O ASP A 55 N ILE A 24
142 SHEET 3 A 4 LEU A 42 THR A 45 -1 N SER A 44 O ILE A 52
143 SHEET 4 A 4 CYS A 35 THR A 36 -1 N CYS A 35 O PHE A 43
144 LINK C THR A 36 N TPO A 37 1555 1555 1.33
145 LINK C TPO A 37 N PRO A 38 1555 1555 1.33
146 LINK C THR A 45 N TPO A 46 1555 1555 1.33
147 LINK C TPO A 46 N PRO A 47 1555 1555 1.33
148 CISPEP 1 HIS A 32 ASP A 33 6 6.79
149 CISPEP 2 HIS A 32 ASP A 33 8 2.95
150 CISPEP 3 HIS A 32 ASP A 33 9 4.85
151 CISPEP 4 HIS A 32 ASP A 33 10 4.65
152 CISPEP 5 HIS A 32 ASP A 33 14 -0.55
153 CRYST1 1.000 1.000 1.000 90.00 90.00 90.00 P 1 1
154 ORIGX1 1.000000 0.000000 0.000000 0.00000
155 ORIGX2 0.000000 1.000000 0.000000 0.00000
156 ORIGX3 0.000000 0.000000 1.000000 0.00000
157 SCALE1 1.000000 0.000000 0.000000 0.00000
158 SCALE2 0.000000 1.000000 0.000000 0.00000
159 SCALE3 0.000000 0.000000 1.000000 0.00000
161 ATOM 1 N PRO A 18 0.592 -0.732 -0.717 1.00 0.00 N
162 ATOM 2 CA PRO A 18 1.885 -0.592 -0.059 1.00 0.00 C
163 ATOM 3 C PRO A 18 2.362 0.854 -0.085 1.00 0.00 C
164 ATOM 4 O PRO A 18 1.950 1.639 -0.940 1.00 0.00 O
165 ATOM 5 CB PRO A 18 2.811 -1.519 -0.853 1.00 0.00 C
166 ATOM 6 CG PRO A 18 2.241 -1.522 -2.230 1.00 0.00 C
167 ATOM 7 CD PRO A 18 0.751 -1.431 -2.046 1.00 0.00 C
168 ATOM 8 H2 PRO A 18 0.497 -1.331 -1.512 1.00 0.00 H
169 ATOM 9 H3 PRO A 18 -0.194 -1.080 -0.205 1.00 0.00 H
170 ATOM 10 HA PRO A 18 1.853 -0.860 1.007 1.00 0.00 H
171 ATOM 11 HB2 PRO A 18 3.848 -1.150 -0.852 1.00 0.00 H
172 ATOM 12 HB3 PRO A 18 2.829 -2.533 -0.427 1.00 0.00 H
173 ATOM 13 HG2 PRO A 18 2.620 -0.673 -2.819 1.00 0.00 H
174 ATOM 14 HG3 PRO A 18 2.518 -2.438 -2.773 1.00 0.00 H
175 ATOM 15 HD2 PRO A 18 0.266 -0.857 -2.849 1.00 0.00 H
176 ATOM 16 HD3 PRO A 18 0.273 -2.422 -2.027 1.00 0.00 H
177 ATOM 17 N THR A 19 3.234 1.202 0.856 1.00 0.00 N
178 ATOM 18 CA THR A 19 3.762 2.558 0.948 1.00 0.00 C
179 ATOM 19 C THR A 19 5.252 2.592 0.634 1.00 0.00 C
180 ATOM 20 O THR A 19 6.030 1.814 1.188 1.00 0.00 O
181 ATOM 21 CB THR A 19 3.528 3.161 2.345 1.00 0.00 C
182 ATOM 22 OG1 THR A 19 2.121 3.213 2.618 1.00 0.00 O
183 ATOM 23 CG2 THR A 19 4.107 4.566 2.424 1.00 0.00 C
184 ATOM 24 H THR A 19 3.538 0.509 1.525 1.00 0.00 H
185 ATOM 25 HA THR A 19 3.276 3.194 0.207 1.00 0.00 H
186 ATOM 26 HB THR A 19 4.010 2.528 3.090 1.00 0.00 H
187 ATOM 27 HG1 THR A 19 1.978 3.588 3.490 1.00 0.00 H
188 ATOM 28 HG21 THR A 19 3.625 5.199 1.680 1.00 0.00 H
189 ATOM 29 HG22 THR A 19 3.932 4.975 3.418 1.00 0.00 H
190 ATOM 30 HG23 THR A 19 5.179 4.528 2.228 1.00 0.00 H
191 ATOM 31 N ARG A 20 5.644 3.496 -0.256 1.00 0.00 N
192 ATOM 32 CA ARG A 20 7.042 3.634 -0.643 1.00 0.00 C
193 ATOM 33 C ARG A 20 7.554 5.042 -0.369 1.00 0.00 C
194 ATOM 34 O ARG A 20 6.926 6.027 -0.758 1.00 0.00 O
195 ATOM 35 CB ARG A 20 7.281 3.227 -2.090 1.00 0.00 C
196 ATOM 36 CG ARG A 20 8.713 3.393 -2.574 1.00 0.00 C
197 ATOM 37 CD ARG A 20 8.939 2.961 -3.976 1.00 0.00 C
198 ATOM 38 NE ARG A 20 10.298 3.154 -4.455 1.00 0.00 N
199 ATOM 39 CZ ARG A 20 10.745 2.770 -5.666 1.00 0.00 C
200 ATOM 40 NH1 ARG A 20 9.958 2.137 -6.509 1.00 0.00 N
201 ATOM 41 NH2 ARG A 20 12.005 3.024 -5.977 1.00 0.00 N
202 ATOM 42 H ARG A 20 4.955 4.103 -0.676 1.00 0.00 H
203 ATOM 43 HA ARG A 20 7.659 2.959 -0.048 1.00 0.00 H
204 ATOM 44 HB2 ARG A 20 6.991 2.181 -2.178 1.00 0.00 H
205 ATOM 45 HB3 ARG A 20 6.621 3.839 -2.705 1.00 0.00 H
206 ATOM 46 HG2 ARG A 20 8.984 4.446 -2.500 1.00 0.00 H
207 ATOM 47 HG3 ARG A 20 9.366 2.804 -1.930 1.00 0.00 H
208 ATOM 48 HD2 ARG A 20 8.713 1.898 -4.059 1.00 0.00 H
209 ATOM 49 HD3 ARG A 20 8.277 3.525 -4.633 1.00 0.00 H
210 ATOM 50 HE ARG A 20 11.089 3.583 -3.993 1.00 0.00 H
211 ATOM 51 HH11 ARG A 20 9.003 1.936 -6.249 1.00 0.00 H
212 ATOM 52 HH12 ARG A 20 10.313 1.858 -7.412 1.00 0.00 H
213 ATOM 53 HH21 ARG A 20 12.601 3.495 -5.310 1.00 0.00 H
214 ATOM 54 HH22 ARG A 20 12.365 2.746 -6.877 1.00 0.00 H
215 ATOM 55 N THR A 21 8.697 5.131 0.302 1.00 0.00 N
216 ATOM 56 CA THR A 21 9.298 6.420 0.626 1.00 0.00 C
217 ATOM 57 C THR A 21 10.409 6.770 -0.356 1.00 0.00 C
218 ATOM 58 O THR A 21 11.394 6.042 -0.480 1.00 0.00 O
219 ATOM 59 CB THR A 21 9.867 6.436 2.057 1.00 0.00 C
220 ATOM 60 OG1 THR A 21 8.811 6.196 2.996 1.00 0.00 O
221 ATOM 61 CG2 THR A 21 10.513 7.779 2.358 1.00 0.00 C
222 ATOM 62 H THR A 21 9.161 4.284 0.597 1.00 0.00 H
223 ATOM 63 HA THR A 21 8.550 7.208 0.539 1.00 0.00 H
224 ATOM 64 HB THR A 21 10.612 5.646 2.150 1.00 0.00 H
225 ATOM 65 HG1 THR A 21 9.168 6.206 3.887 1.00 0.00 H
226 ATOM 66 HG21 THR A 21 9.769 8.570 2.266 1.00 0.00 H
227 ATOM 67 HG22 THR A 21 10.910 7.771 3.373 1.00 0.00 H
228 ATOM 68 HG23 THR A 21 11.324 7.959 1.652 1.00 0.00 H
229 ATOM 69 N VAL A 22 10.244 7.891 -1.052 1.00 0.00 N
230 ATOM 70 CA VAL A 22 11.247 8.355 -2.004 1.00 0.00 C
231 ATOM 71 C VAL A 22 11.648 9.796 -1.721 1.00 0.00 C
232 ATOM 72 O VAL A 22 10.795 10.670 -1.568 1.00 0.00 O
233 ATOM 73 CB VAL A 22 10.741 8.247 -3.455 1.00 0.00 C
234 ATOM 74 CG1 VAL A 22 11.773 8.810 -4.422 1.00 0.00 C
235 ATOM 75 CG2 VAL A 22 10.420 6.802 -3.802 1.00 0.00 C
236 ATOM 76 H VAL A 22 9.404 8.434 -0.918 1.00 0.00 H
237 ATOM 77 HA VAL A 22 12.172 7.784 -1.916 1.00 0.00 H
238 ATOM 78 HB VAL A 22 9.812 8.810 -3.549 1.00 0.00 H
239 ATOM 79 HG11 VAL A 22 11.399 8.726 -5.443 1.00 0.00 H
240 ATOM 80 HG12 VAL A 22 11.957 9.858 -4.187 1.00 0.00 H
241 ATOM 81 HG13 VAL A 22 12.702 8.247 -4.329 1.00 0.00 H
242 ATOM 82 HG21 VAL A 22 9.647 6.429 -3.130 1.00 0.00 H
243 ATOM 83 HG22 VAL A 22 10.063 6.744 -4.830 1.00 0.00 H
244 ATOM 84 HG23 VAL A 22 11.319 6.195 -3.695 1.00 0.00 H
245 ATOM 85 N ALA A 23 12.953 10.040 -1.654 1.00 0.00 N
246 ATOM 86 CA ALA A 23 13.471 11.386 -1.443 1.00 0.00 C
247 ATOM 87 C ALA A 23 13.737 12.089 -2.768 1.00 0.00 C
248 ATOM 88 O ALA A 23 14.162 11.462 -3.739 1.00 0.00 O
249 ATOM 89 CB ALA A 23 14.737 11.340 -0.601 1.00 0.00 C
250 ATOM 90 H ALA A 23 13.602 9.273 -1.752 1.00 0.00 H
251 ATOM 91 HA ALA A 23 12.720 11.971 -0.911 1.00 0.00 H
252 ATOM 92 HB1 ALA A 23 15.493 10.746 -1.112 1.00 0.00 H
253 ATOM 93 HB2 ALA A 23 15.112 12.353 -0.452 1.00 0.00 H
254 ATOM 94 HB3 ALA A 23 14.515 10.891 0.368 1.00 0.00 H
255 ATOM 95 N ILE A 24 13.484 13.393 -2.803 1.00 0.00 N
256 ATOM 96 CA ILE A 24 13.758 14.195 -3.988 1.00 0.00 C
257 ATOM 97 C ILE A 24 14.763 15.299 -3.685 1.00 0.00 C
258 ATOM 98 O ILE A 24 14.473 16.225 -2.929 1.00 0.00 O
259 ATOM 99 CB ILE A 24 12.473 14.825 -4.554 1.00 0.00 C
260 ATOM 100 CG1 ILE A 24 11.472 13.735 -4.947 1.00 0.00 C
261 ATOM 101 CG2 ILE A 24 12.795 15.712 -5.747 1.00 0.00 C
262 ATOM 102 CD1 ILE A 24 10.108 14.265 -5.325 1.00 0.00 C
263 ATOM 103 H ILE A 24 13.091 13.839 -1.986 1.00 0.00 H
264 ATOM 104 HA ILE A 24 14.236 13.591 -4.759 1.00 0.00 H
265 ATOM 105 HB ILE A 24 11.997 15.421 -3.776 1.00 0.00 H
266 ATOM 106 HG12 ILE A 24 11.898 13.192 -5.790 1.00 0.00 H
267 ATOM 107 HG13 ILE A 24 11.376 13.062 -4.095 1.00 0.00 H
268 ATOM 108 HG21 ILE A 24 11.875 16.148 -6.135 1.00 0.00 H
269 ATOM 109 HG22 ILE A 24 13.472 16.507 -5.438 1.00 0.00 H
270 ATOM 110 HG23 ILE A 24 13.270 15.115 -6.526 1.00 0.00 H
271 ATOM 111 HD11 ILE A 24 10.202 14.938 -6.177 1.00 0.00 H
272 ATOM 112 HD12 ILE A 24 9.454 13.435 -5.591 1.00 0.00 H
273 ATOM 113 HD13 ILE A 24 9.681 14.807 -4.480 1.00 0.00 H
274 ATOM 114 N SER A 25 15.946 15.195 -4.281 1.00 0.00 N
275 ATOM 115 CA SER A 25 17.030 16.130 -4.001 1.00 0.00 C
276 ATOM 116 C SER A 25 17.410 16.921 -5.246 1.00 0.00 C
277 ATOM 117 O SER A 25 18.365 17.697 -5.233 1.00 0.00 O
278 ATOM 118 CB SER A 25 18.235 15.385 -3.461 1.00 0.00 C
279 ATOM 119 OG SER A 25 18.694 14.408 -4.354 1.00 0.00 O
280 ATOM 120 H SER A 25 16.100 14.449 -4.944 1.00 0.00 H
281 ATOM 121 HA SER A 25 16.811 16.812 -3.180 1.00 0.00 H
282 ATOM 122 HB2 SER A 25 19.035 16.102 -3.279 1.00 0.00 H
283 ATOM 123 HB3 SER A 25 17.958 14.907 -2.523 1.00 0.00 H
284 ATOM 124 HG SER A 25 17.944 13.938 -4.725 1.00 0.00 H
285 ATOM 125 N ASP A 26 16.655 16.721 -6.321 1.00 0.00 N
286 ATOM 126 CA ASP A 26 16.902 17.427 -7.573 1.00 0.00 C
287 ATOM 127 C ASP A 26 15.651 17.465 -8.440 1.00 0.00 C
288 ATOM 128 O ASP A 26 14.755 16.633 -8.292 1.00 0.00 O
289 ATOM 129 CB ASP A 26 18.053 16.773 -8.340 1.00 0.00 C
290 ATOM 130 CG ASP A 26 18.730 17.683 -9.357 1.00 0.00 C
291 ATOM 131 OD1 ASP A 26 18.345 18.826 -9.451 1.00 0.00 O
292 ATOM 132 OD2 ASP A 26 19.722 17.283 -9.916 1.00 0.00 O
293 ATOM 133 H ASP A 26 15.892 16.062 -6.270 1.00 0.00 H
294 ATOM 134 HA ASP A 26 17.167 18.465 -7.365 1.00 0.00 H
295 ATOM 135 HB2 ASP A 26 18.809 16.328 -7.694 1.00 0.00 H
296 ATOM 136 HB3 ASP A 26 17.511 15.985 -8.863 1.00 0.00 H
297 ATOM 137 N ALA A 27 15.593 18.436 -9.345 1.00 0.00 N
298 ATOM 138 CA ALA A 27 14.478 18.549 -10.279 1.00 0.00 C
299 ATOM 139 C ALA A 27 14.449 17.372 -11.245 1.00 0.00 C
300 ATOM 140 O ALA A 27 13.398 17.024 -11.783 1.00 0.00 O
301 ATOM 141 CB ALA A 27 14.556 19.863 -11.041 1.00 0.00 C
302 ATOM 142 H ALA A 27 16.341 19.114 -9.387 1.00 0.00 H
303 ATOM 143 HA ALA A 27 13.546 18.529 -9.714 1.00 0.00 H
304 ATOM 144 HB1 ALA A 27 15.490 19.906 -11.598 1.00 0.00 H
305 ATOM 145 HB2 ALA A 27 13.717 19.931 -11.733 1.00 0.00 H
306 ATOM 146 HB3 ALA A 27 14.514 20.695 -10.337 1.00 0.00 H
307 ATOM 147 N ALA A 28 15.609 16.762 -11.462 1.00 0.00 N
308 ATOM 148 CA ALA A 28 15.695 15.532 -12.240 1.00 0.00 C
309 ATOM 149 C ALA A 28 14.970 14.388 -11.543 1.00 0.00 C
310 ATOM 150 O ALA A 28 14.439 13.488 -12.193 1.00 0.00 O
311 ATOM 151 CB ALA A 28 17.149 15.165 -12.494 1.00 0.00 C
312 ATOM 152 H ALA A 28 16.454 17.161 -11.078 1.00 0.00 H
313 ATOM 153 HA ALA A 28 15.204 15.691 -13.199 1.00 0.00 H
314 ATOM 154 HB1 ALA A 28 17.659 15.019 -11.543 1.00 0.00 H
315 ATOM 155 HB2 ALA A 28 17.196 14.245 -13.076 1.00 0.00 H
316 ATOM 156 HB3 ALA A 28 17.637 15.969 -13.047 1.00 0.00 H
317 ATOM 157 N GLN A 29 14.951 14.428 -10.215 1.00 0.00 N
318 ATOM 158 CA GLN A 29 14.298 13.390 -9.426 1.00 0.00 C
319 ATOM 159 C GLN A 29 12.836 13.732 -9.168 1.00 0.00 C
320 ATOM 160 O GLN A 29 12.023 12.851 -8.886 1.00 0.00 O
321 ATOM 161 CB GLN A 29 15.025 13.192 -8.093 1.00 0.00 C
322 ATOM 162 CG GLN A 29 16.478 12.769 -8.234 1.00 0.00 C
323 ATOM 163 CD GLN A 29 17.181 12.662 -6.894 1.00 0.00 C
324 ATOM 164 OE1 GLN A 29 16.575 12.873 -5.839 1.00 0.00 O
325 ATOM 165 NE2 GLN A 29 18.469 12.339 -6.928 1.00 0.00 N
326 ATOM 166 H GLN A 29 15.400 15.198 -9.739 1.00 0.00 H
327 ATOM 167 HA GLN A 29 14.304 12.452 -9.980 1.00 0.00 H
328 ATOM 168 HB2 GLN A 29 14.967 14.141 -7.559 1.00 0.00 H
329 ATOM 169 HB3 GLN A 29 14.471 12.432 -7.542 1.00 0.00 H
330 ATOM 170 HG2 GLN A 29 16.788 11.920 -8.842 1.00 0.00 H
331 ATOM 171 HG3 GLN A 29 16.791 13.694 -8.716 1.00 0.00 H
332 ATOM 172 HE21 GLN A 29 18.922 12.178 -7.804 1.00 0.00 H
333 ATOM 173 HE22 GLN A 29 18.986 12.254 -6.074 1.00 0.00 H
334 ATOM 174 N LEU A 30 12.508 15.015 -9.267 1.00 0.00 N
335 ATOM 175 CA LEU A 30 11.121 15.459 -9.187 1.00 0.00 C
336 ATOM 176 C LEU A 30 10.289 14.873 -10.321 1.00 0.00 C
337 ATOM 177 O LEU A 30 10.569 15.110 -11.496 1.00 0.00 O
338 ATOM 178 CB LEU A 30 11.053 16.992 -9.213 1.00 0.00 C
339 ATOM 179 CG LEU A 30 9.667 17.588 -8.934 1.00 0.00 C
340 ATOM 180 CD1 LEU A 30 9.274 17.339 -7.484 1.00 0.00 C
341 ATOM 181 CD2 LEU A 30 9.684 19.078 -9.239 1.00 0.00 C
342 ATOM 182 H LEU A 30 13.237 15.701 -9.400 1.00 0.00 H
343 ATOM 183 HA LEU A 30 10.675 15.101 -8.260 1.00 0.00 H
344 ATOM 184 HB2 LEU A 30 11.728 17.212 -8.387 1.00 0.00 H
345 ATOM 185 HB3 LEU A 30 11.463 17.398 -10.136 1.00 0.00 H
346 ATOM 186 HG LEU A 30 8.966 17.114 -9.621 1.00 0.00 H
347 ATOM 187 HD11 LEU A 30 8.289 17.766 -7.295 1.00 0.00 H
348 ATOM 188 HD12 LEU A 30 9.246 16.266 -7.293 1.00 0.00 H
349 ATOM 189 HD13 LEU A 30 10.004 17.807 -6.824 1.00 0.00 H
350 ATOM 190 HD21 LEU A 30 9.940 19.232 -10.287 1.00 0.00 H
351 ATOM 191 HD22 LEU A 30 8.699 19.501 -9.042 1.00 0.00 H
352 ATOM 192 HD23 LEU A 30 10.424 19.572 -8.609 1.00 0.00 H
353 ATOM 193 N PRO A 31 9.265 14.108 -9.961 1.00 0.00 N
354 ATOM 194 CA PRO A 31 8.355 13.533 -10.946 1.00 0.00 C
355 ATOM 195 C PRO A 31 7.673 14.620 -11.767 1.00 0.00 C
356 ATOM 196 O PRO A 31 7.738 15.802 -11.426 1.00 0.00 O
357 ATOM 197 CB PRO A 31 7.354 12.731 -10.108 1.00 0.00 C
358 ATOM 198 CG PRO A 31 8.063 12.483 -8.820 1.00 0.00 C
359 ATOM 199 CD PRO A 31 8.910 13.706 -8.589 1.00 0.00 C
360 ATOM 200 HA PRO A 31 8.871 12.902 -11.684 1.00 0.00 H
361 ATOM 201 HB2 PRO A 31 6.422 13.292 -9.948 1.00 0.00 H
362 ATOM 202 HB3 PRO A 31 7.082 11.786 -10.600 1.00 0.00 H
363 ATOM 203 HG2 PRO A 31 7.350 12.335 -7.996 1.00 0.00 H
364 ATOM 204 HG3 PRO A 31 8.684 11.577 -8.876 1.00 0.00 H
365 ATOM 205 HD2 PRO A 31 8.359 14.501 -8.065 1.00 0.00 H
366 ATOM 206 HD3 PRO A 31 9.804 13.486 -7.987 1.00 0.00 H
367 ATOM 207 N HIS A 32 7.021 14.214 -12.851 1.00 0.00 N
368 ATOM 208 CA HIS A 32 6.300 15.150 -13.705 1.00 0.00 C
369 ATOM 209 C HIS A 32 4.793 14.954 -13.587 1.00 0.00 C
370 ATOM 210 O HIS A 32 4.014 15.653 -14.234 1.00 0.00 O
371 ATOM 211 CB HIS A 32 6.735 14.994 -15.166 1.00 0.00 C
372 ATOM 212 CG HIS A 32 8.127 15.473 -15.433 1.00 0.00 C
373 ATOM 213 ND1 HIS A 32 8.736 15.339 -16.664 1.00 0.00 N
374 ATOM 214 CD2 HIS A 32 9.028 16.086 -14.631 1.00 0.00 C
375 ATOM 215 CE1 HIS A 32 9.954 15.849 -16.606 1.00 0.00 C
376 ATOM 216 NE2 HIS A 32 10.155 16.308 -15.383 1.00 0.00 N
377 ATOM 217 H HIS A 32 7.025 13.233 -13.089 1.00 0.00 H
378 ATOM 218 HA HIS A 32 6.506 16.170 -13.386 1.00 0.00 H
379 ATOM 219 HB2 HIS A 32 6.705 13.943 -15.457 1.00 0.00 H
380 ATOM 220 HB3 HIS A 32 6.076 15.569 -15.817 1.00 0.00 H
381 ATOM 221 HD1 HIS A 32 8.311 14.993 -17.500 1.00 0.00 H
382 ATOM 222 HD2 HIS A 32 9.000 16.395 -13.586 1.00 0.00 H
383 ATOM 223 HE1 HIS A 32 10.602 15.841 -17.482 1.00 0.00 H
384 ATOM 224 N ASP A 33 4.389 14.000 -12.755 1.00 0.00 N
385 ATOM 225 CA ASP A 33 2.979 13.664 -12.602 1.00 0.00 C
386 ATOM 226 C ASP A 33 2.597 13.545 -11.132 1.00 0.00 C
387 ATOM 227 O ASP A 33 1.533 13.024 -10.797 1.00 0.00 O
388 ATOM 228 CB ASP A 33 2.655 12.360 -13.336 1.00 0.00 C
389 ATOM 229 CG ASP A 33 3.383 11.136 -12.795 1.00 0.00 C
390 ATOM 230 OD1 ASP A 33 4.106 11.274 -11.837 1.00 0.00 O
391 ATOM 231 OD2 ASP A 33 3.092 10.052 -13.242 1.00 0.00 O
392 ATOM 232 H ASP A 33 5.077 13.494 -12.216 1.00 0.00 H
393 ATOM 233 HA ASP A 33 2.362 14.460 -13.020 1.00 0.00 H
394 ATOM 234 HB2 ASP A 33 1.587 12.149 -13.396 1.00 0.00 H
395 ATOM 235 HB3 ASP A 33 3.036 12.600 -14.329 1.00 0.00 H
396 ATOM 236 N TYR A 34 3.472 14.031 -10.258 1.00 0.00 N
397 ATOM 237 CA TYR A 34 3.227 13.982 -8.822 1.00 0.00 C
398 ATOM 238 C TYR A 34 2.080 14.903 -8.426 1.00 0.00 C
399 ATOM 239 O TYR A 34 1.727 15.822 -9.164 1.00 0.00 O
400 ATOM 240 CB TYR A 34 4.493 14.361 -8.050 1.00 0.00 C
401 ATOM 241 CG TYR A 34 4.845 15.830 -8.132 1.00 0.00 C
402 ATOM 242 CD1 TYR A 34 4.209 16.761 -7.325 1.00 0.00 C
403 ATOM 243 CD2 TYR A 34 5.814 16.281 -9.017 1.00 0.00 C
404 ATOM 244 CE1 TYR A 34 4.525 18.105 -7.396 1.00 0.00 C
405 ATOM 245 CE2 TYR A 34 6.139 17.621 -9.097 1.00 0.00 C
406 ATOM 246 CZ TYR A 34 5.493 18.530 -8.285 1.00 0.00 C
407 ATOM 247 OH TYR A 34 5.814 19.866 -8.359 1.00 0.00 O
408 ATOM 248 H TYR A 34 4.328 14.445 -10.597 1.00 0.00 H
409 ATOM 249 HA TYR A 34 2.932 12.974 -8.531 1.00 0.00 H
410 ATOM 250 HB2 TYR A 34 4.331 14.084 -7.007 1.00 0.00 H
411 ATOM 251 HB3 TYR A 34 5.310 13.769 -8.460 1.00 0.00 H
412 ATOM 252 HD1 TYR A 34 3.446 16.418 -6.626 1.00 0.00 H
413 ATOM 253 HD2 TYR A 34 6.320 15.557 -9.655 1.00 0.00 H
414 ATOM 254 HE1 TYR A 34 4.017 18.826 -6.756 1.00 0.00 H
415 ATOM 255 HE2 TYR A 34 6.903 17.956 -9.799 1.00 0.00 H
416 ATOM 256 HH TYR A 34 5.305 20.409 -7.752 1.00 0.00 H
417 ATOM 257 N CYS A 35 1.499 14.649 -7.258 1.00 0.00 N
418 ATOM 258 CA CYS A 35 0.535 15.567 -6.666 1.00 0.00 C
419 ATOM 259 C CYS A 35 0.999 16.043 -5.295 1.00 0.00 C
420 ATOM 260 O CYS A 35 1.885 15.445 -4.687 1.00 0.00 O
421 ATOM 261 CB CYS A 35 -0.721 14.705 -6.540 1.00 0.00 C
422 ATOM 262 SG CYS A 35 -1.344 14.056 -8.109 1.00 0.00 S
423 ATOM 263 H CYS A 35 1.733 13.796 -6.769 1.00 0.00 H
424 ATOM 264 HA CYS A 35 0.307 16.424 -7.300 1.00 0.00 H
425 ATOM 265 HB2 CYS A 35 -0.520 13.836 -5.912 1.00 0.00 H
426 ATOM 266 HB3 CYS A 35 -1.535 15.286 -6.108 1.00 0.00 H
427 ATOM 267 HG CYS A 35 -2.378 13.403 -7.588 1.00 0.00 H
428 ATOM 268 N THR A 36 0.393 17.124 -4.814 1.00 0.00 N
429 ATOM 269 CA THR A 36 0.786 17.720 -3.542 1.00 0.00 C
430 ATOM 270 C THR A 36 -0.433 18.067 -2.698 1.00 0.00 C
431 ATOM 271 O THR A 36 -1.401 18.644 -3.194 1.00 0.00 O
432 ATOM 272 CB THR A 36 1.633 18.988 -3.750 1.00 0.00 C
433 ATOM 273 OG1 THR A 36 2.792 18.670 -4.531 1.00 0.00 O
434 ATOM 274 CG2 THR A 36 2.069 19.564 -2.411 1.00 0.00 C
435 ATOM 275 H THR A 36 -0.358 17.544 -5.343 1.00 0.00 H
436 ATOM 276 HA THR A 36 1.367 17.003 -2.963 1.00 0.00 H
437 ATOM 277 HB THR A 36 1.036 19.728 -4.285 1.00 0.00 H
438 ATOM 278 HG1 THR A 36 3.317 19.464 -4.659 1.00 0.00 H
439 ATOM 279 HG21 THR A 36 2.666 18.825 -1.876 1.00 0.00 H
440 ATOM 280 HG22 THR A 36 2.666 20.460 -2.579 1.00 0.00 H
441 ATOM 281 HG23 THR A 36 1.189 19.817 -1.820 1.00 0.00 H
442 ATOM 282 N TPO A 37 -0.381 17.712 -1.418 1.00 0.00 N
443 ATOM 283 CA TPO A 37 -1.467 18.015 -0.494 1.00 0.00 C
444 ATOM 284 CB TPO A 37 -1.524 17.001 0.663 1.00 0.00 C
445 ATOM 285 CG2 TPO A 37 -1.498 15.578 0.127 1.00 0.00 C
446 ATOM 286 OG1 TPO A 37 -0.402 17.201 1.533 1.00 0.00 O
447 ATOM 287 P TPO A 37 -0.450 16.693 3.063 1.00 0.00 P
448 ATOM 288 O1P TPO A 37 0.909 17.063 3.714 1.00 0.00 O
449 ATOM 289 O2P TPO A 37 -0.668 15.157 3.033 1.00 0.00 O
450 ATOM 290 O3P TPO A 37 -1.631 17.422 3.755 1.00 0.00 O
451 ATOM 291 C TPO A 37 -1.325 19.419 0.081 1.00 0.00 C
452 ATOM 292 O TPO A 37 -0.260 20.031 -0.005 1.00 0.00 O
453 ATOM 293 H TPO A 37 0.433 17.220 -1.077 1.00 0.00 H
454 ATOM 294 HA TPO A 37 -2.419 17.994 -1.024 1.00 0.00 H
455 ATOM 295 HB TPO A 37 -2.442 17.160 1.228 1.00 0.00 H
456 ATOM 296 HG21 TPO A 37 -1.539 14.876 0.960 1.00 0.00 H
457 ATOM 297 HG22 TPO A 37 -2.356 15.420 -0.525 1.00 0.00 H
458 ATOM 298 HG23 TPO A 37 -0.579 15.420 -0.436 1.00 0.00 H
459 ATOM 299 N PRO A 38 -2.405 19.925 0.668 1.00 0.00 N
460 ATOM 300 CA PRO A 38 -2.415 21.271 1.226 1.00 0.00 C
461 ATOM 301 C PRO A 38 -1.284 21.459 2.231 1.00 0.00 C
462 ATOM 302 O PRO A 38 -0.760 22.561 2.391 1.00 0.00 O
463 ATOM 303 CB PRO A 38 -3.794 21.396 1.880 1.00 0.00 C
464 ATOM 304 CG PRO A 38 -4.659 20.463 1.103 1.00 0.00 C
465 ATOM 305 CD PRO A 38 -3.772 19.297 0.752 1.00 0.00 C
466 ATOM 306 HA PRO A 38 -2.249 22.048 0.466 1.00 0.00 H
467 ATOM 307 HB2 PRO A 38 -3.762 21.119 2.943 1.00 0.00 H
468 ATOM 308 HB3 PRO A 38 -4.173 22.427 1.827 1.00 0.00 H
469 ATOM 309 HG2 PRO A 38 -5.525 20.136 1.697 1.00 0.00 H
470 ATOM 310 HG3 PRO A 38 -5.054 20.946 0.198 1.00 0.00 H
471 ATOM 311 HD2 PRO A 38 -3.802 18.507 1.517 1.00 0.00 H
472 ATOM 312 HD3 PRO A 38 -4.058 18.830 -0.202 1.00 0.00 H
473 ATOM 313 N GLY A 39 -0.915 20.376 2.906 1.00 0.00 N
474 ATOM 314 CA GLY A 39 0.155 20.419 3.896 1.00 0.00 C
475 ATOM 315 C GLY A 39 1.508 20.656 3.237 1.00 0.00 C
476 ATOM 316 O GLY A 39 2.427 21.188 3.859 1.00 0.00 O
477 ATOM 317 H GLY A 39 -1.385 19.500 2.728 1.00 0.00 H
478 ATOM 318 HA2 GLY A 39 -0.043 21.228 4.600 1.00 0.00 H
479 ATOM 319 HA3 GLY A 39 0.182 19.471 4.432 1.00 0.00 H
480 ATOM 320 N GLY A 40 1.623 20.258 1.975 1.00 0.00 N
481 ATOM 321 CA GLY A 40 2.835 20.500 1.203 1.00 0.00 C
482 ATOM 322 C GLY A 40 3.669 19.231 1.073 1.00 0.00 C
483 ATOM 323 O GLY A 40 4.895 19.289 0.987 1.00 0.00 O
484 ATOM 324 H GLY A 40 0.850 19.775 1.538 1.00 0.00 H
485 ATOM 325 HA2 GLY A 40 2.560 20.847 0.207 1.00 0.00 H
486 ATOM 326 HA3 GLY A 40 3.429 21.266 1.701 1.00 0.00 H
487 ATOM 327 N THR A 41 2.995 18.087 1.061 1.00 0.00 N
488 ATOM 328 CA THR A 41 3.667 16.804 0.887 1.00 0.00 C
489 ATOM 329 C THR A 41 3.375 16.211 -0.485 1.00 0.00 C
490 ATOM 330 O THR A 41 2.221 16.131 -0.904 1.00 0.00 O
491 ATOM 331 CB THR A 41 3.248 15.794 1.972 1.00 0.00 C
492 ATOM 332 OG1 THR A 41 3.602 16.303 3.264 1.00 0.00 O
493 ATOM 333 CG2 THR A 41 3.938 14.457 1.751 1.00 0.00 C
494 ATOM 334 H THR A 41 1.992 18.105 1.176 1.00 0.00 H
495 ATOM 335 HA THR A 41 4.747 16.944 0.940 1.00 0.00 H
496 ATOM 336 HB THR A 41 2.167 15.656 1.929 1.00 0.00 H
497 ATOM 337 HG1 THR A 41 2.828 16.691 3.678 1.00 0.00 H
498 ATOM 338 HG21 THR A 41 5.017 14.593 1.794 1.00 0.00 H
499 ATOM 339 HG22 THR A 41 3.629 13.756 2.527 1.00 0.00 H
500 ATOM 340 HG23 THR A 41 3.660 14.062 0.773 1.00 0.00 H
501 ATOM 341 N LEU A 42 4.428 15.794 -1.180 1.00 0.00 N
502 ATOM 342 CA LEU A 42 4.288 15.229 -2.517 1.00 0.00 C
503 ATOM 343 C LEU A 42 3.955 13.744 -2.453 1.00 0.00 C
504 ATOM 344 O LEU A 42 4.423 13.029 -1.568 1.00 0.00 O
505 ATOM 345 CB LEU A 42 5.573 15.453 -3.324 1.00 0.00 C
506 ATOM 346 CG LEU A 42 5.678 16.818 -4.019 1.00 0.00 C
507 ATOM 347 CD1 LEU A 42 5.841 17.920 -2.982 1.00 0.00 C
508 ATOM 348 CD2 LEU A 42 6.852 16.807 -4.986 1.00 0.00 C
509 ATOM 349 H LEU A 42 5.349 15.872 -0.772 1.00 0.00 H
510 ATOM 350 HA LEU A 42 3.459 15.711 -3.032 1.00 0.00 H
511 ATOM 351 HB2 LEU A 42 6.302 15.388 -2.518 1.00 0.00 H
512 ATOM 352 HB3 LEU A 42 5.747 14.649 -4.037 1.00 0.00 H
513 ATOM 353 HG LEU A 42 4.766 16.954 -4.602 1.00 0.00 H
514 ATOM 354 HD11 LEU A 42 5.914 18.885 -3.485 1.00 0.00 H
515 ATOM 355 HD12 LEU A 42 4.979 17.924 -2.315 1.00 0.00 H
516 ATOM 356 HD13 LEU A 42 6.747 17.743 -2.403 1.00 0.00 H
517 ATOM 357 HD21 LEU A 42 6.700 16.030 -5.735 1.00 0.00 H
518 ATOM 358 HD22 LEU A 42 6.925 17.777 -5.480 1.00 0.00 H
519 ATOM 359 HD23 LEU A 42 7.773 16.608 -4.438 1.00 0.00 H
520 ATOM 360 N PHE A 43 3.142 13.284 -3.399 1.00 0.00 N
521 ATOM 361 CA PHE A 43 2.782 11.874 -3.481 1.00 0.00 C
522 ATOM 362 C PHE A 43 2.388 11.488 -4.901 1.00 0.00 C
523 ATOM 363 O PHE A 43 1.958 12.331 -5.687 1.00 0.00 O
524 ATOM 364 CB PHE A 43 1.639 11.558 -2.514 1.00 0.00 C
525 ATOM 365 CG PHE A 43 0.333 12.198 -2.889 1.00 0.00 C
526 ATOM 366 CD1 PHE A 43 0.066 13.515 -2.548 1.00 0.00 C
527 ATOM 367 CD2 PHE A 43 -0.632 11.483 -3.584 1.00 0.00 C
528 ATOM 368 CE1 PHE A 43 -1.136 14.104 -2.891 1.00 0.00 C
529 ATOM 369 CE2 PHE A 43 -1.834 12.070 -3.929 1.00 0.00 C
530 ATOM 370 CZ PHE A 43 -2.086 13.381 -3.583 1.00 0.00 C
531 ATOM 371 H PHE A 43 2.764 13.929 -4.079 1.00 0.00 H
532 ATOM 372 HA PHE A 43 3.642 11.256 -3.218 1.00 0.00 H
533 ATOM 373 HB2 PHE A 43 1.462 10.484 -2.481 1.00 0.00 H
534 ATOM 374 HB3 PHE A 43 1.885 11.915 -1.514 1.00 0.00 H
535 ATOM 375 HD1 PHE A 43 0.817 14.087 -2.003 1.00 0.00 H
536 ATOM 376 HD2 PHE A 43 -0.433 10.445 -3.856 1.00 0.00 H
537 ATOM 377 HE1 PHE A 43 -1.333 15.141 -2.618 1.00 0.00 H
538 ATOM 378 HE2 PHE A 43 -2.583 11.497 -4.475 1.00 0.00 H
539 ATOM 379 HZ PHE A 43 -3.033 13.845 -3.855 1.00 0.00 H
540 ATOM 380 N SER A 44 2.537 10.208 -5.223 1.00 0.00 N
541 ATOM 381 CA SER A 44 2.060 9.677 -6.495 1.00 0.00 C
542 ATOM 382 C SER A 44 1.776 8.183 -6.396 1.00 0.00 C
543 ATOM 383 O SER A 44 2.519 7.441 -5.754 1.00 0.00 O
544 ATOM 384 CB SER A 44 3.074 9.949 -7.588 1.00 0.00 C
545 ATOM 385 OG SER A 44 2.631 9.504 -8.841 1.00 0.00 O
546 ATOM 386 H SER A 44 2.994 9.586 -4.570 1.00 0.00 H
547 ATOM 387 HA SER A 44 1.182 10.197 -6.878 1.00 0.00 H
548 ATOM 388 HB2 SER A 44 3.253 11.024 -7.637 1.00 0.00 H
549 ATOM 389 HB3 SER A 44 4.004 9.439 -7.338 1.00 0.00 H
550 ATOM 390 HG SER A 44 3.121 9.955 -9.532 1.00 0.00 H
551 ATOM 391 N THR A 45 0.695 7.749 -7.035 1.00 0.00 N
552 ATOM 392 CA THR A 45 0.310 6.343 -7.021 1.00 0.00 C
553 ATOM 393 C THR A 45 0.395 5.735 -8.414 1.00 0.00 C
554 ATOM 394 O THR A 45 -0.146 6.281 -9.375 1.00 0.00 O
555 ATOM 395 CB THR A 45 -1.118 6.153 -6.475 1.00 0.00 C
556 ATOM 396 OG1 THR A 45 -1.196 6.675 -5.142 1.00 0.00 O
557 ATOM 397 CG2 THR A 45 -1.491 4.678 -6.461 1.00 0.00 C
558 ATOM 398 H THR A 45 0.125 8.410 -7.544 1.00 0.00 H
559 ATOM 399 HA THR A 45 1.001 5.778 -6.395 1.00 0.00 H
560 ATOM 400 HB THR A 45 -1.815 6.697 -7.111 1.00 0.00 H
561 ATOM 401 HG1 THR A 45 -0.986 7.613 -5.154 1.00 0.00 H
562 ATOM 402 HG21 THR A 45 -0.796 4.134 -5.824 1.00 0.00 H
563 ATOM 403 HG22 THR A 45 -2.503 4.565 -6.073 1.00 0.00 H
564 ATOM 404 HG23 THR A 45 -1.443 4.281 -7.475 1.00 0.00 H
565 ATOM 405 N TPO A 46 1.079 4.600 -8.519 1.00 0.00 N
566 ATOM 406 CA TPO A 46 1.292 3.949 -9.806 1.00 0.00 C
567 ATOM 407 CB TPO A 46 2.661 3.247 -9.864 1.00 0.00 C
568 ATOM 408 CG2 TPO A 46 3.761 4.183 -9.390 1.00 0.00 C
569 ATOM 409 OG1 TPO A 46 2.639 2.081 -9.031 1.00 0.00 O
570 ATOM 410 P TPO A 46 3.656 0.858 -9.303 1.00 0.00 P
571 ATOM 411 O1P TPO A 46 3.368 -0.227 -8.233 1.00 0.00 O
572 ATOM 412 O2P TPO A 46 5.095 1.420 -9.174 1.00 0.00 O
573 ATOM 413 O3P TPO A 46 3.374 0.335 -10.735 1.00 0.00 O
574 ATOM 414 C TPO A 46 0.197 2.929 -10.095 1.00 0.00 C
575 ATOM 415 O TPO A 46 -0.546 2.530 -9.198 1.00 0.00 O
576 ATOM 416 H TPO A 46 1.460 4.177 -7.684 1.00 0.00 H
577 ATOM 417 HA TPO A 46 1.243 4.688 -10.605 1.00 0.00 H
578 ATOM 418 HB TPO A 46 2.860 2.944 -10.892 1.00 0.00 H
579 ATOM 419 HG21 TPO A 46 4.721 3.670 -9.439 1.00 0.00 H
580 ATOM 420 HG22 TPO A 46 3.787 5.066 -10.029 1.00 0.00 H
581 ATOM 421 HG23 TPO A 46 3.563 4.486 -8.362 1.00 0.00 H
582 ATOM 422 N PRO A 47 0.102 2.512 -11.353 1.00 0.00 N
583 ATOM 423 CA PRO A 47 -0.957 1.608 -11.782 1.00 0.00 C
584 ATOM 424 C PRO A 47 -0.945 0.319 -10.969 1.00 0.00 C
585 ATOM 425 O PRO A 47 -1.983 -0.317 -10.780 1.00 0.00 O
586 ATOM 426 CB PRO A 47 -0.658 1.357 -13.264 1.00 0.00 C
587 ATOM 427 CG PRO A 47 0.067 2.581 -13.708 1.00 0.00 C
588 ATOM 428 CD PRO A 47 0.905 2.998 -12.530 1.00 0.00 C
589 ATOM 429 HA PRO A 47 -1.963 2.028 -11.632 1.00 0.00 H
590 ATOM 430 HB2 PRO A 47 -0.043 0.456 -13.404 1.00 0.00 H
591 ATOM 431 HB3 PRO A 47 -1.583 1.210 -13.842 1.00 0.00 H
592 ATOM 432 HG2 PRO A 47 0.695 2.374 -14.588 1.00 0.00 H
593 ATOM 433 HG3 PRO A 47 -0.636 3.377 -13.995 1.00 0.00 H
594 ATOM 434 HD2 PRO A 47 1.904 2.538 -12.546 1.00 0.00 H
595 ATOM 435 HD3 PRO A 47 1.054 4.088 -12.490 1.00 0.00 H
596 ATOM 436 N GLY A 48 0.234 -0.061 -10.491 1.00 0.00 N
597 ATOM 437 CA GLY A 48 0.386 -1.282 -9.707 1.00 0.00 C
598 ATOM 438 C GLY A 48 -0.368 -1.185 -8.387 1.00 0.00 C
599 ATOM 439 O GLY A 48 -0.751 -2.200 -7.804 1.00 0.00 O
600 ATOM 440 H GLY A 48 1.047 0.510 -10.675 1.00 0.00 H
601 ATOM 441 HA2 GLY A 48 -0.006 -2.123 -10.279 1.00 0.00 H
602 ATOM 442 HA3 GLY A 48 1.443 -1.443 -9.501 1.00 0.00 H
603 ATOM 443 N GLY A 49 -0.579 0.041 -7.919 1.00 0.00 N
604 ATOM 444 CA GLY A 49 -1.340 0.275 -6.698 1.00 0.00 C
605 ATOM 445 C GLY A 49 -0.444 0.801 -5.583 1.00 0.00 C
606 ATOM 446 O GLY A 49 -0.927 1.204 -4.525 1.00 0.00 O
607 ATOM 447 H GLY A 49 -0.202 0.831 -8.423 1.00 0.00 H
608 ATOM 448 HA2 GLY A 49 -2.122 1.006 -6.900 1.00 0.00 H
609 ATOM 449 HA3 GLY A 49 -1.794 -0.662 -6.376 1.00 0.00 H
610 ATOM 450 N THR A 50 0.861 0.797 -5.829 1.00 0.00 N
611 ATOM 451 CA THR A 50 1.826 1.280 -4.849 1.00 0.00 C
612 ATOM 452 C THR A 50 1.701 2.785 -4.647 1.00 0.00 C
613 ATOM 453 O THR A 50 1.680 3.550 -5.610 1.00 0.00 O
614 ATOM 454 CB THR A 50 3.272 0.949 -5.267 1.00 0.00 C
615 ATOM 455 OG1 THR A 50 3.418 -0.471 -5.402 1.00 0.00 O
616 ATOM 456 CG2 THR A 50 4.258 1.459 -4.228 1.00 0.00 C
617 ATOM 457 H THR A 50 1.194 0.450 -6.717 1.00 0.00 H
618 ATOM 458 HA THR A 50 1.629 0.821 -3.880 1.00 0.00 H
619 ATOM 459 HB THR A 50 3.479 1.420 -6.227 1.00 0.00 H
620 ATOM 460 HG1 THR A 50 3.435 -0.703 -6.334 1.00 0.00 H
621 ATOM 461 HG21 THR A 50 4.051 0.988 -3.268 1.00 0.00 H
622 ATOM 462 HG22 THR A 50 5.273 1.216 -4.542 1.00 0.00 H
623 ATOM 463 HG23 THR A 50 4.156 2.540 -4.131 1.00 0.00 H
624 ATOM 464 N ARG A 51 1.615 3.202 -3.388 1.00 0.00 N
625 ATOM 465 CA ARG A 51 1.521 4.618 -3.056 1.00 0.00 C
626 ATOM 466 C ARG A 51 2.872 5.174 -2.623 1.00 0.00 C
627 ATOM 467 O ARG A 51 3.399 4.804 -1.574 1.00 0.00 O
628 ATOM 468 CB ARG A 51 0.446 4.894 -2.015 1.00 0.00 C
629 ATOM 469 CG ARG A 51 -0.966 4.527 -2.442 1.00 0.00 C
630 ATOM 470 CD ARG A 51 -1.989 4.690 -1.377 1.00 0.00 C
631 ATOM 471 NE ARG A 51 -3.332 4.292 -1.766 1.00 0.00 N
632 ATOM 472 CZ ARG A 51 -4.419 4.390 -0.976 1.00 0.00 C
633 ATOM 473 NH1 ARG A 51 -4.322 4.836 0.257 1.00 0.00 N
634 ATOM 474 NH2 ARG A 51 -5.584 4.003 -1.465 1.00 0.00 N
635 ATOM 475 H ARG A 51 1.617 2.521 -2.642 1.00 0.00 H
636 ATOM 476 HA ARG A 51 1.220 5.185 -3.937 1.00 0.00 H
637 ATOM 477 HB2 ARG A 51 0.712 4.324 -1.125 1.00 0.00 H
638 ATOM 478 HB3 ARG A 51 0.487 5.959 -1.789 1.00 0.00 H
639 ATOM 479 HG2 ARG A 51 -1.252 5.164 -3.280 1.00 0.00 H
640 ATOM 480 HG3 ARG A 51 -0.973 3.484 -2.759 1.00 0.00 H
641 ATOM 481 HD2 ARG A 51 -1.706 4.082 -0.519 1.00 0.00 H
642 ATOM 482 HD3 ARG A 51 -2.031 5.738 -1.083 1.00 0.00 H
643 ATOM 483 HE ARG A 51 -3.661 3.899 -2.638 1.00 0.00 H
644 ATOM 484 HH11 ARG A 51 -3.420 5.111 0.622 1.00 0.00 H
645 ATOM 485 HH12 ARG A 51 -5.148 4.902 0.834 1.00 0.00 H
646 ATOM 486 HH21 ARG A 51 -5.639 3.646 -2.409 1.00 0.00 H
647 ATOM 487 HH22 ARG A 51 -6.414 4.066 -0.894 1.00 0.00 H
648 ATOM 488 N ILE A 52 3.427 6.065 -3.437 1.00 0.00 N
649 ATOM 489 CA ILE A 52 4.751 6.620 -3.176 1.00 0.00 C
650 ATOM 490 C ILE A 52 4.655 7.993 -2.525 1.00 0.00 C
651 ATOM 491 O ILE A 52 4.101 8.928 -3.104 1.00 0.00 O
652 ATOM 492 CB ILE A 52 5.580 6.732 -4.469 1.00 0.00 C
653 ATOM 493 CG1 ILE A 52 5.737 5.357 -5.124 1.00 0.00 C
654 ATOM 494 CG2 ILE A 52 6.942 7.343 -4.175 1.00 0.00 C
655 ATOM 495 CD1 ILE A 52 6.339 5.406 -6.510 1.00 0.00 C
656 ATOM 496 H ILE A 52 2.921 6.366 -4.257 1.00 0.00 H
657 ATOM 497 HA ILE A 52 5.288 6.008 -2.453 1.00 0.00 H
658 ATOM 498 HB ILE A 52 5.046 7.360 -5.180 1.00 0.00 H
659 ATOM 499 HG12 ILE A 52 6.372 4.758 -4.473 1.00 0.00 H
660 ATOM 500 HG13 ILE A 52 4.744 4.908 -5.175 1.00 0.00 H
661 ATOM 501 HG21 ILE A 52 7.515 7.415 -5.099 1.00 0.00 H
662 ATOM 502 HG22 ILE A 52 6.810 8.339 -3.752 1.00 0.00 H
663 ATOM 503 HG23 ILE A 52 7.477 6.714 -3.464 1.00 0.00 H
664 ATOM 504 HD11 ILE A 52 7.331 5.854 -6.460 1.00 0.00 H
665 ATOM 505 HD12 ILE A 52 6.418 4.395 -6.909 1.00 0.00 H
666 ATOM 506 HD13 ILE A 52 5.703 6.005 -7.163 1.00 0.00 H
667 ATOM 507 N ILE A 53 5.194 8.108 -1.316 1.00 0.00 N
668 ATOM 508 CA ILE A 53 5.264 9.391 -0.627 1.00 0.00 C
669 ATOM 509 C ILE A 53 6.640 10.026 -0.785 1.00 0.00 C
670 ATOM 510 O ILE A 53 7.660 9.401 -0.496 1.00 0.00 O
671 ATOM 511 CB ILE A 53 4.944 9.246 0.871 1.00 0.00 C
672 ATOM 512 CG1 ILE A 53 3.526 8.702 1.064 1.00 0.00 C
673 ATOM 513 CG2 ILE A 53 5.107 10.581 1.582 1.00 0.00 C
674 ATOM 514 CD1 ILE A 53 3.208 8.317 2.491 1.00 0.00 C
675 ATOM 515 H ILE A 53 5.566 7.285 -0.863 1.00 0.00 H
676 ATOM 516 HA ILE A 53 4.576 10.107 -1.077 1.00 0.00 H
677 ATOM 517 HB ILE A 53 5.622 8.515 1.311 1.00 0.00 H
678 ATOM 518 HG12 ILE A 53 2.834 9.476 0.734 1.00 0.00 H
679 ATOM 519 HG13 ILE A 53 3.423 7.828 0.421 1.00 0.00 H
680 ATOM 520 HG21 ILE A 53 4.876 10.460 2.640 1.00 0.00 H
681 ATOM 521 HG22 ILE A 53 6.133 10.929 1.472 1.00 0.00 H
682 ATOM 522 HG23 ILE A 53 4.427 11.313 1.143 1.00 0.00 H
683 ATOM 523 HD11 ILE A 53 3.308 9.190 3.136 1.00 0.00 H
684 ATOM 524 HD12 ILE A 53 2.186 7.941 2.548 1.00 0.00 H
685 ATOM 525 HD13 ILE A 53 3.899 7.541 2.822 1.00 0.00 H
686 ATOM 526 N TYR A 54 6.661 11.274 -1.242 1.00 0.00 N
687 ATOM 527 CA TYR A 54 7.908 11.935 -1.605 1.00 0.00 C
688 ATOM 528 C TYR A 54 8.344 12.920 -0.528 1.00 0.00 C
689 ATOM 529 O TYR A 54 7.527 13.665 0.012 1.00 0.00 O
690 ATOM 530 CB TYR A 54 7.762 12.656 -2.947 1.00 0.00 C
691 ATOM 531 CG TYR A 54 7.554 11.726 -4.123 1.00 0.00 C
692 ATOM 532 CD1 TYR A 54 8.623 11.057 -4.698 1.00 0.00 C
693 ATOM 533 CD2 TYR A 54 6.289 11.523 -4.655 1.00 0.00 C
694 ATOM 534 CE1 TYR A 54 8.441 10.207 -5.771 1.00 0.00 C
695 ATOM 535 CE2 TYR A 54 6.094 10.675 -5.728 1.00 0.00 C
696 ATOM 536 CZ TYR A 54 7.173 10.019 -6.284 1.00 0.00 C
697 ATOM 537 OH TYR A 54 6.985 9.174 -7.354 1.00 0.00 O
698 ATOM 538 H TYR A 54 5.791 11.777 -1.341 1.00 0.00 H
699 ATOM 539 HA TYR A 54 8.707 11.197 -1.693 1.00 0.00 H
700 ATOM 540 HB2 TYR A 54 6.906 13.329 -2.860 1.00 0.00 H
701 ATOM 541 HB3 TYR A 54 8.669 13.238 -3.101 1.00 0.00 H
702 ATOM 542 HD1 TYR A 54 9.622 11.210 -4.288 1.00 0.00 H
703 ATOM 543 HD2 TYR A 54 5.441 12.044 -4.211 1.00 0.00 H
704 ATOM 544 HE1 TYR A 54 9.294 9.689 -6.209 1.00 0.00 H
705 ATOM 545 HE2 TYR A 54 5.095 10.524 -6.136 1.00 0.00 H
706 ATOM 546 HH TYR A 54 7.801 8.772 -7.663 1.00 0.00 H
707 ATOM 547 N ASP A 55 9.636 12.919 -0.219 1.00 0.00 N
708 ATOM 548 CA ASP A 55 10.227 13.964 0.607 1.00 0.00 C
709 ATOM 549 C ASP A 55 11.030 14.946 -0.236 1.00 0.00 C
710 ATOM 550 O ASP A 55 12.175 14.675 -0.600 1.00 0.00 O
711 ATOM 551 CB ASP A 55 11.118 13.350 1.691 1.00 0.00 C
712 ATOM 552 CG ASP A 55 11.748 14.365 2.636 1.00 0.00 C
713 ATOM 553 OD1 ASP A 55 11.585 15.540 2.410 1.00 0.00 O
714 ATOM 554 OD2 ASP A 55 12.251 13.962 3.658 1.00 0.00 O
715 ATOM 555 H ASP A 55 10.224 12.175 -0.567 1.00 0.00 H
716 ATOM 556 HA ASP A 55 9.440 14.543 1.091 1.00 0.00 H
717 ATOM 557 HB2 ASP A 55 10.622 12.573 2.273 1.00 0.00 H
718 ATOM 558 HB3 ASP A 55 11.894 12.902 1.070 1.00 0.00 H
719 ATOM 559 N ARG A 56 10.425 16.087 -0.543 1.00 0.00 N
720 ATOM 560 CA ARG A 56 11.018 17.046 -1.468 1.00 0.00 C
721 ATOM 561 C ARG A 56 12.084 17.889 -0.778 1.00 0.00 C
722 ATOM 562 O ARG A 56 11.789 18.950 -0.228 1.00 0.00 O
723 ATOM 563 CB ARG A 56 9.970 17.917 -2.143 1.00 0.00 C
724 ATOM 564 CG ARG A 56 10.509 18.851 -3.215 1.00 0.00 C
725 ATOM 565 CD ARG A 56 9.461 19.569 -3.985 1.00 0.00 C
726 ATOM 566 NE ARG A 56 9.971 20.432 -5.037 1.00 0.00 N
727 ATOM 567 CZ ARG A 56 9.207 21.046 -5.962 1.00 0.00 C
728 ATOM 568 NH1 ARG A 56 7.905 20.864 -5.994 1.00 0.00 N
729 ATOM 569 NH2 ARG A 56 9.804 21.817 -6.854 1.00 0.00 N
730 ATOM 570 H ARG A 56 9.529 16.298 -0.124 1.00 0.00 H
731 ATOM 571 HA ARG A 56 11.519 16.514 -2.278 1.00 0.00 H
732 ATOM 572 HB2 ARG A 56 9.236 17.245 -2.588 1.00 0.00 H
733 ATOM 573 HB3 ARG A 56 9.494 18.506 -1.359 1.00 0.00 H
734 ATOM 574 HG2 ARG A 56 11.144 19.598 -2.737 1.00 0.00 H
735 ATOM 575 HG3 ARG A 56 11.102 18.266 -3.918 1.00 0.00 H
736 ATOM 576 HD2 ARG A 56 8.804 18.837 -4.454 1.00 0.00 H
737 ATOM 577 HD3 ARG A 56 8.883 20.191 -3.302 1.00 0.00 H
738 ATOM 578 HE ARG A 56 10.924 20.705 -5.242 1.00 0.00 H
739 ATOM 579 HH11 ARG A 56 7.466 20.257 -5.315 1.00 0.00 H
740 ATOM 580 HH12 ARG A 56 7.351 21.333 -6.695 1.00 0.00 H
741 ATOM 581 HH21 ARG A 56 10.809 21.932 -6.826 1.00 0.00 H
742 ATOM 582 HH22 ARG A 56 9.256 22.287 -7.558 1.00 0.00 H
743 ATOM 583 N LYS A 57 13.323 17.411 -0.812 1.00 0.00 N
744 ATOM 584 CA LYS A 57 14.441 18.140 -0.226 1.00 0.00 C
745 ATOM 585 C LYS A 57 14.986 19.184 -1.192 1.00 0.00 C
746 ATOM 586 O LYS A 57 15.634 20.146 -0.781 1.00 0.00 O
747 ATOM 587 CB LYS A 57 15.554 17.174 0.185 1.00 0.00 C
748 ATOM 588 CG LYS A 57 15.154 16.176 1.263 1.00 0.00 C
749 ATOM 589 CD LYS A 57 16.298 15.229 1.594 1.00 0.00 C
750 ATOM 590 CE LYS A 57 15.900 14.232 2.672 1.00 0.00 C
751 ATOM 591 NZ LYS A 57 17.021 13.323 3.032 1.00 0.00 N
752 ATOM 592 H LYS A 57 13.494 16.520 -1.256 1.00 0.00 H
753 ATOM 593 HA LYS A 57 14.106 18.681 0.660 1.00 0.00 H
754 ATOM 594 HB2 LYS A 57 15.857 16.635 -0.714 1.00 0.00 H
755 ATOM 595 HB3 LYS A 57 16.387 17.778 0.542 1.00 0.00 H
756 ATOM 596 HG2 LYS A 57 14.868 16.729 2.158 1.00 0.00 H
757 ATOM 597 HG3 LYS A 57 14.299 15.601 0.904 1.00 0.00 H
758 ATOM 598 HD2 LYS A 57 16.577 14.692 0.686 1.00 0.00 H
759 ATOM 599 HD3 LYS A 57 17.147 15.819 1.941 1.00 0.00 H
760 ATOM 600 HE2 LYS A 57 15.586 14.790 3.553 1.00 0.00 H
761 ATOM 601 HE3 LYS A 57 15.061 13.643 2.298 1.00 0.00 H
762 ATOM 602 HZ1 LYS A 57 17.798 13.869 3.379 1.00 0.00 H
763 ATOM 603 HZ2 LYS A 57 16.716 12.680 3.748 1.00 0.00 H
764 ATOM 604 HZ3 LYS A 57 17.312 12.806 2.215 1.00 0.00 H
765 ATOM 605 N PHE A 58 14.718 18.989 -2.479 1.00 0.00 N
766 ATOM 606 CA PHE A 58 15.113 19.953 -3.499 1.00 0.00 C
767 ATOM 607 C PHE A 58 14.594 21.346 -3.172 1.00 0.00 C
768 ATOM 608 O PHE A 58 15.362 22.304 -3.099 1.00 0.00 O
769 ATOM 609 CB PHE A 58 14.611 19.512 -4.875 1.00 0.00 C
770 ATOM 610 CG PHE A 58 14.871 20.513 -5.965 1.00 0.00 C
771 ATOM 611 CD1 PHE A 58 16.158 20.728 -6.434 1.00 0.00 C
772 ATOM 612 CD2 PHE A 58 13.831 21.240 -6.522 1.00 0.00 C
773 ATOM 613 CE1 PHE A 58 16.399 21.649 -7.436 1.00 0.00 C
774 ATOM 614 CE2 PHE A 58 14.068 22.160 -7.525 1.00 0.00 C
775 ATOM 615 CZ PHE A 58 15.354 22.364 -7.982 1.00 0.00 C
776 ATOM 616 H PHE A 58 14.227 18.151 -2.758 1.00 0.00 H
777 ATOM 617 HA PHE A 58 16.202 20.027 -3.534 1.00 0.00 H
778 ATOM 618 HB2 PHE A 58 15.101 18.588 -5.177 1.00 0.00 H
779 ATOM 619 HB3 PHE A 58 13.532 19.357 -4.846 1.00 0.00 H
780 ATOM 620 HD1 PHE A 58 16.984 20.161 -6.003 1.00 0.00 H
781 ATOM 621 HD2 PHE A 58 12.814 21.078 -6.161 1.00 0.00 H
782 ATOM 622 HE1 PHE A 58 17.415 21.809 -7.796 1.00 0.00 H
783 ATOM 623 HE2 PHE A 58 13.242 22.724 -7.955 1.00 0.00 H
784 ATOM 624 HZ PHE A 58 15.544 23.090 -8.772 1.00 0.00 H
785 ATOM 625 N LEU A 59 13.284 21.453 -2.976 1.00 0.00 N
786 ATOM 626 CA LEU A 59 12.667 22.714 -2.584 1.00 0.00 C
787 ATOM 627 C LEU A 59 12.733 22.915 -1.076 1.00 0.00 C
788 ATOM 628 O LEU A 59 12.219 22.100 -0.309 1.00 0.00 O
789 ATOM 629 CB LEU A 59 11.213 22.765 -3.067 1.00 0.00 C
790 ATOM 630 CG LEU A 59 10.438 24.031 -2.674 1.00 0.00 C
791 ATOM 631 CD1 LEU A 59 11.065 25.252 -3.332 1.00 0.00 C
792 ATOM 632 CD2 LEU A 59 8.981 23.883 -3.085 1.00 0.00 C
793 ATOM 633 H LEU A 59 12.700 20.637 -3.100 1.00 0.00 H
794 ATOM 634 HA LEU A 59 13.217 23.543 -3.031 1.00 0.00 H
795 ATOM 635 HB2 LEU A 59 11.382 22.752 -4.142 1.00 0.00 H
796 ATOM 636 HB3 LEU A 59 10.659 21.874 -2.775 1.00 0.00 H
797 ATOM 637 HG LEU A 59 10.472 24.106 -1.586 1.00 0.00 H
798 ATOM 638 HD11 LEU A 59 10.508 26.145 -3.046 1.00 0.00 H
799 ATOM 639 HD12 LEU A 59 12.100 25.351 -3.005 1.00 0.00 H
800 ATOM 640 HD13 LEU A 59 11.035 25.137 -4.415 1.00 0.00 H
801 ATOM 641 HD21 LEU A 59 8.546 23.021 -2.581 1.00 0.00 H
802 ATOM 642 HD22 LEU A 59 8.432 24.783 -2.804 1.00 0.00 H
803 ATOM 643 HD23 LEU A 59 8.920 23.742 -4.164 1.00 0.00 H
804 ATOM 644 N LEU A 60 13.368 24.004 -0.656 1.00 0.00 N
805 ATOM 645 CA LEU A 60 13.463 24.336 0.760 1.00 0.00 C
806 ATOM 646 C LEU A 60 12.249 25.132 1.222 1.00 0.00 C
807 ATOM 647 O LEU A 60 11.731 24.912 2.317 1.00 0.00 O
808 ATOM 648 CB LEU A 60 14.752 25.122 1.035 1.00 0.00 C
809 ATOM 649 CG LEU A 60 16.053 24.366 0.740 1.00 0.00 C
810 ATOM 650 CD1 LEU A 60 17.250 25.283 0.952 1.00 0.00 C
811 ATOM 651 CD2 LEU A 60 16.145 23.142 1.640 1.00 0.00 C
812 ATOM 652 H LEU A 60 13.795 24.617 -1.335 1.00 0.00 H
813 ATOM 653 HA LEU A 60 13.475 23.421 1.351 1.00 0.00 H
814 ATOM 654 HB2 LEU A 60 14.620 25.933 0.319 1.00 0.00 H
815 ATOM 655 HB3 LEU A 60 14.769 25.529 2.045 1.00 0.00 H
816 ATOM 656 HG LEU A 60 15.999 24.017 -0.292 1.00 0.00 H
817 ATOM 657 HD11 LEU A 60 18.170 24.737 0.740 1.00 0.00 H
818 ATOM 658 HD12 LEU A 60 17.175 26.139 0.282 1.00 0.00 H
819 ATOM 659 HD13 LEU A 60 17.263 25.629 1.985 1.00 0.00 H
820 ATOM 660 HD21 LEU A 60 15.294 22.486 1.451 1.00 0.00 H
821 ATOM 661 HD22 LEU A 60 17.070 22.605 1.429 1.00 0.00 H
822 ATOM 662 HD23 LEU A 60 16.137 23.456 2.684 1.00 0.00 H
823 ATOM 663 N ASP A 61 11.799 26.057 0.381 1.00 0.00 N
824 ATOM 664 CA ASP A 61 10.624 26.864 0.687 1.00 0.00 C
825 ATOM 665 C ASP A 61 9.342 26.143 0.288 1.00 0.00 C
826 ATOM 666 O ASP A 61 8.671 26.533 -0.667 1.00 0.00 O
827 ATOM 667 CB ASP A 61 10.705 28.220 -0.019 1.00 0.00 C
828 ATOM 668 CG ASP A 61 9.625 29.209 0.394 1.00 0.00 C
829 ATOM 669 OD1 ASP A 61 8.892 28.913 1.309 1.00 0.00 O
830 ATOM 670 OD2 ASP A 61 9.638 30.312 -0.098 1.00 0.00 O
831 ATOM 671 H ASP A 61 12.284 26.205 -0.492 1.00 0.00 H
832 ATOM 672 HA ASP A 61 10.562 27.034 1.762 1.00 0.00 H
833 ATOM 673 HB2 ASP A 61 11.683 28.694 0.064 1.00 0.00 H
834 ATOM 674 HB3 ASP A 61 10.538 27.909 -1.051 1.00 0.00 H
835 ATOM 675 N ARG A 62 9.007 25.091 1.026 1.00 0.00 N
836 ATOM 676 CA ARG A 62 7.792 24.328 0.766 1.00 0.00 C
837 ATOM 677 C ARG A 62 6.585 24.970 1.437 1.00 0.00 C
838 ATOM 678 O ARG A 62 6.044 25.912 0.927 1.00 0.00 O
839 ATOM 679 CB ARG A 62 7.936 22.866 1.162 1.00 0.00 C
840 ATOM 680 CG ARG A 62 8.929 22.072 0.327 1.00 0.00 C
841 ATOM 681 CD ARG A 62 9.127 20.671 0.778 1.00 0.00 C
842 ATOM 682 NE ARG A 62 9.891 20.536 2.007 1.00 0.00 N
843 ATOM 683 CZ ARG A 62 10.090 19.375 2.661 1.00 0.00 C
844 ATOM 684 NH1 ARG A 62 9.555 18.254 2.230 1.00 0.00 N
845 ATOM 685 NH2 ARG A 62 10.820 19.395 3.763 1.00 0.00 N
846 ATOM 686 OXT ARG A 62 6.174 24.535 2.478 1.00 0.00 O
847 ATOM 687 H ARG A 62 9.610 24.810 1.787 1.00 0.00 H
848 ATOM 688 HA ARG A 62 7.584 24.318 -0.303 1.00 0.00 H
849 ATOM 689 HB2 ARG A 62 8.248 22.848 2.205 1.00 0.00 H
850 ATOM 690 HB3 ARG A 62 6.949 22.412 1.071 1.00 0.00 H
851 ATOM 691 HG2 ARG A 62 8.573 22.046 -0.703 1.00 0.00 H
852 ATOM 692 HG3 ARG A 62 9.895 22.577 0.365 1.00 0.00 H
853 ATOM 693 HD2 ARG A 62 8.153 20.213 0.948 1.00 0.00 H
854 ATOM 694 HD3 ARG A 62 9.656 20.120 0.002 1.00 0.00 H
855 ATOM 695 HE ARG A 62 10.372 21.242 2.548 1.00 0.00 H
856 ATOM 696 HH11 ARG A 62 8.985 18.258 1.396 1.00 0.00 H
857 ATOM 697 HH12 ARG A 62 9.716 17.394 2.734 1.00 0.00 H
858 ATOM 698 HH21 ARG A 62 11.209 20.268 4.091 1.00 0.00 H
859 ATOM 699 HH22 ARG A 62 10.984 18.539 4.271 1.00 0.00 H
projects / unres4.git / blob