---------------------------------------------------------------------------------- |HEADER CHROMOSOMAL PROTEIN 02-JAN-87 1UBQ 1UBQ 3| |COMPND UBIQUITIN 1UBQ 4| ---------------------------------------------------------------------------------- Num. of tiles per residue = 5.0 (1 by 1) Initial atom = 5-th, Distance between tiles = 1.440 Average distance between CA atoms = 3.809 Average error between a tile and a CA atom = 3.288 [ No. ] ser. name res chn num ( x, y, z) occu. id [ 1] 1 N MET - 1 ( 27.340, 24.430, 2.614) 1.000 1UBQ [ 2] 2 CA MET - 1 ( 26.266, 25.413, 2.842) 1.000 1UBQ [ 3] 3 C MET - 1 ( 26.913, 26.639, 3.531) 1.000 1UBQ [ 4] 9 N GLN - 2 ( 26.335, 27.770, 3.258) 1.000 1UBQ [ 5] 10 CA GLN - 2 ( 26.850, 29.021, 3.898) 1.000 1UBQ [ 6] 11 C GLN - 2 ( 26.100, 29.253, 5.202) 1.000 1UBQ [ 7] 18 N ILE - 3 ( 26.849, 29.656, 6.217) 1.000 1UBQ [ 8] 19 CW ILE - 3 ( 26.235, 30.058, 7.497) 1.000 1UBQ [ 9] 20 C ILE - 3 ( 26.882, 31.428, 7.862) 1.000 1UBQ [ 10] 26 N PHE - 4 ( 26.214, 32.097, 8.771) 1.000 1UBQ [ 11] 27 CW PHE - 4 ( 26.772, 33.436, 9.197) 1.000 1UBQ [ 12] 28 C PHE - 4 ( 27.151, 33.362, 10.650) 1.000 1UBQ [ 13] 37 N VAL - 5 ( 28.260, 33.943, 11.096) 1.000 1UBQ [ 14] 38 CW VAL - 5 ( 28.605, 33.965, 12.503) 1.000 1UBQ [ 15] 39 C VAL - 5 ( 28.638, 35.461, 12.900) 1.000 1UBQ [ 16] 44 N LYS - 6 ( 27.751, 35.867, 13.740) 1.000 1UBQ [ 17] 45 CW LYS - 6 ( 27.691, 37.315, 14.143) 1.000 1UBQ [ 18] 46 C LYS - 6 ( 28.469, 37.475, 15.420) 1.000 1UBQ [ 19] 53 N THR - 7 ( 29.426, 38.430, 15.446) 1.000 1UBQ [ 20] 54 CW THR - 7 ( 30.225, 38.643, 16.662) 1.000 1UBQ [ 21] 55 C THR - 7 ( 29.664, 39.839, 17.434) 1.000 1UBQ [ 22] 60 N LEU - 8 ( 30.132, 40.069, 18.642) 1.000 1UBQ [ 23] 61 CA LEU - 8 ( 29.607, 41.180, 19.467) 1.000 1UBQ [ 24] 62 C LEU - 8 ( 30.075, 42.538, 18.984) 1.000 1UBQ [ 25] 68 N THR - 9 ( 30.991, 42.571, 17.998) 1.000 1UBQ [ 26] 69 CA THR - 9 ( 31.422, 43.940, 17.553) 1.000 1UBQ [ 27] 70 C THR - 9 ( 30.755, 44.351, 16.277) 1.000 1UBQ [ 28] 75 N GLY - 10 ( 29.721, 43.673, 15.885) 1.000 1UBQ [ 29] 76 CY GLY - 10 ( 28.978, 43.960, 14.678) 1.000 1UBQ [ 30] 77 C GLY - 10 ( 29.604, 43.507, 13.393) 1.000 1UBQ [ 31] 79 N LYS - 11 ( 30.563, 42.623, 13.495) 1.000 1UBQ [ 32] 80 CW LYS - 11 ( 31.191, 42.012, 12.331) 1.000 1UBQ [ 33] 81 C LYS - 11 ( 30.459, 40.666, 12.130) 1.000 1UBQ [ 34] 88 N THR - 12 ( 30.163, 40.338, 10.886) 1.000 1UBQ [ 35] 89 CW THR - 12 ( 29.542, 39.020, 10.653) 1.000 1UBQ [ 36] 90 C THR - 12 ( 30.494, 38.261, 9.729) 1.000 1UBQ [ 37] 95 N ILE - 13 ( 30.795, 37.015, 10.095) 1.000 1UBQ [ 38] 96 CW ILE - 13 ( 31.720, 36.289, 9.176) 1.000 1UBQ [ 39] 97 C ILE - 13 ( 30.955, 35.211, 8.459) 1.000 1UBQ [ 40] 103 N THR - 14 ( 31.244, 34.986, 7.197) 1.000 1UBQ [ 41] 104 CW THR - 14 ( 30.505, 33.884, 6.512) 1.000 1UBQ [ 42] 105 C THR - 14 ( 31.409, 32.680, 6.446) 1.000 1UBQ [ 43] 110 N LEU - 15 ( 30.884, 31.485, 6.666) 1.000 1UBQ [ 44] 111 CW LEU - 15 ( 31.677, 30.275, 6.639) 1.000 1UBQ [ 45] 112 C LEU - 15 ( 31.022, 29.288, 5.665) 1.000 1UBQ [ 46] 118 N GLU - 16 ( 31.834, 28.412, 5.125) 1.000 1UBQ [ 47] 119 CW GLU - 16 ( 31.220, 27.341, 4.275) 1.000 1UBQ [ 48] 120 C GLU - 16 ( 31.440, 26.079, 5.080) 1.000 1UBQ [ 49] 127 N VAL - 17 ( 30.310, 25.458, 5.384) 1.000 1UBQ [ 50] 128 CW VAL - 17 ( 30.288, 24.245, 6.193) 1.000 1UBQ [ 51] 129 C VAL - 17 ( 29.279, 23.227, 5.641) 1.000 1UBQ [ 52] 134 N GLU - 18 ( 29.380, 22.057, 6.232) 1.000 1UBQ [ 53] 135 CW GLU - 18 ( 28.468, 20.940, 5.980) 1.000 1UBQ [ 54] 136 C GLU - 18 ( 27.819, 20.609, 7.316) 1.000 1UBQ [ 55] 143 N PRO - 19 ( 26.559, 20.220, 7.288) 1.000 1UBQ [ 56] 144 CY PRO - 19 ( 25.829, 19.825, 8.494) 1.000 1UBQ [ 57] 145 C PRO - 19 ( 26.541, 18.732, 9.251) 1.000 1UBQ [ 58] 150 N SER - 20 ( 27.361, 17.959, 8.559) 1.000 1UBQ [ 59] 151 CY SER - 20 ( 28.054, 16.835, 9.210) 1.000 1UBQ [ 60] 152 C SER - 20 ( 29.258, 17.318, 9.984) 1.000 1UBQ [ 61] 156 N ASP - 21 ( 29.599, 18.599, 9.828) 1.000 1UBQ [ 62] 157 CA ASP - 21 ( 30.796, 19.083, 10.566) 1.000 1UBQ [ 63] 158 C ASP - 21 ( 30.491, 19.162, 12.040) 1.000 1UBQ [ 64] 164 N THR - 22 ( 31.510, 18.936, 12.852) 1.000 1UBQ [ 65] 165 CW THR - 22 ( 31.398, 19.064, 14.286) 1.000 1UBQ [ 66] 166 C THR - 22 ( 31.593, 20.553, 14.655) 1.000 1UBQ [ 67] 171 N ILE - 23 ( 31.113, 20.863, 15.860) 1.000 1UBQ [ 68] 172 CY ILE - 23 ( 31.288, 22.201, 16.417) 1.000 1UBQ [ 69] 173 C ILE - 23 ( 32.776, 22.519, 16.577) 1.000 1UBQ [ 70] 179 N GLU - 24 ( 33.548, 21.526, 16.950) 1.000 1UBQ [ 71] 180 CR GLU - 24 ( 35.031, 21.722, 17.069) 1.000 1UBQ [ 72] 181 C GLU - 24 ( 35.615, 22.190, 15.759) 1.000 1UBQ [ 73] 188 N ASN - 25 ( 35.139, 21.624, 14.662) 1.000 1UBQ [ 74] 189 CR ASN - 25 ( 35.590, 21.945, 13.302) 1.000 1UBQ [ 75] 190 C ASN - 25 ( 35.238, 23.382, 12.920) 1.000 1UBQ [ 76] 196 N VAL - 26 ( 34.007, 23.745, 13.250) 1.000 1UBQ [ 77] 197 CR VAL - 26 ( 33.533, 25.097, 12.978) 1.000 1UBQ [ 78] 198 C VAL - 26 ( 34.441, 26.099, 13.684) 1.000 1UBQ [ 79] 203 N LYS - 27 ( 34.734, 25.822, 14.949) 1.000 1UBQ [ 80] 204 CR LYS - 27 ( 35.596, 26.715, 15.736) 1.000 1UBQ [ 81] 205 C LYS - 27 ( 36.975, 26.826, 15.107) 1.000 1UBQ [ 82] 212 N ALA - 28 ( 37.499, 25.743, 14.571) 1.000 1UBQ [ 83] 213 CR ALA - 28 ( 38.794, 25.761, 13.880) 1.000 1UBQ [ 84] 214 C ALA - 28 ( 38.728, 26.591, 12.611) 1.000 1UBQ [ 85] 217 N LYS - 29 ( 37.633, 26.543, 11.867) 1.000 1UBQ [ 86] 218 CR LYS - 29 ( 37.471, 27.391, 10.668) 1.000 1UBQ [ 87] 219 C LYS - 29 ( 37.441, 28.882, 11.052) 1.000 1UBQ [ 88] 226 N ILE - 30 ( 36.811, 29.170, 12.192) 1.000 1UBQ [ 89] 227 CR ILE - 30 ( 36.731, 30.570, 12.645) 1.000 1UBQ [ 90] 228 C ILE - 30 ( 38.148, 30.981, 13.069) 1.000 1UBQ [ 91] 234 N GLN - 31 ( 38.883, 30.110, 13.713) 1.000 1UBQ [ 92] 235 CR GLN - 31 ( 40.269, 30.508, 14.115) 1.000 1UBQ [ 93] 236 C GLN - 31 ( 41.092, 30.808, 12.851) 1.000 1UBQ [ 94] 243 N ASP - 32 ( 41.001, 29.878, 11.931) 1.000 1UBQ [ 95] 244 CR ASP - 32 ( 41.718, 30.022, 10.643) 1.000 1UBQ [ 96] 245 C ASP - 32 ( 41.399, 31.338, 9.967) 1.000 1UBQ [ 97] 251 N LYS - 33 ( 40.117, 31.750, 9.988) 1.000 1UBQ [ 98] 252 CW LYS - 33 ( 39.808, 32.994, 9.233) 1.000 1UBQ [ 99] 253 C LYS - 33 ( 39.837, 34.271, 9.995) 1.000 1UBQ [ 100] 260 N GLU - 34 ( 39.655, 34.335, 11.285) 1.000 1UBQ [ 101] 261 CW GLU - 34 ( 39.676, 35.547, 12.072) 1.000 1UBQ [ 102] 262 C GLU - 34 ( 40.675, 35.527, 13.200) 1.000 1UBQ [ 103] 269 N GLY - 35 ( 41.317, 34.393, 13.432) 1.000 1UBQ [ 104] 270 CY GLY - 35 ( 42.345, 34.269, 14.431) 1.000 1UBQ [ 105] 271 C GLY - 35 ( 41.949, 34.076, 15.842) 1.000 1UBQ [ 106] 273 N ILE - 36 ( 40.642, 33.916, 16.112) 1.000 1UBQ [ 107] 274 CW ILE - 36 ( 40.226, 33.716, 17.509) 1.000 1UBQ [ 108] 275 C ILE - 36 ( 40.449, 32.278, 17.945) 1.000 1UBQ [ 109] 281 N PRO - 37 ( 41.189, 32.085, 19.031) 1.000 1UBQ [ 110] 282 CW PRO - 37 ( 41.461, 30.751, 19.594) 1.000 1UBQ [ 111] 283 C PRO - 37 ( 40.168, 30.026, 19.918) 1.000 1UBQ [ 112] 288 N PRO - 38 ( 40.059, 28.758, 19.607) 1.000 1UBQ [ 113] 289 CY PRO - 38 ( 38.817, 28.020, 19.889) 1.000 1UBQ [ 114] 290 C PRO - 38 ( 38.421, 28.048, 21.341) 1.000 1UBQ [ 115] 295 N ASP - 39 ( 39.374, 28.090, 22.240) 1.000 1UBQ [ 116] 296 CR ASP - 39 ( 39.063, 28.063, 23.695) 1.000 1UBQ [ 117] 297 C ASP - 39 ( 38.365, 29.335, 24.159) 1.000 1UBQ [ 118] 303 N GLN - 40 ( 38.419, 30.373, 23.341) 1.000 1UBQ [ 119] 304 CY GLN - 40 ( 37.738, 31.637, 23.712) 1.000 1UBQ [ 120] 305 C GLN - 40 ( 36.334, 31.742, 23.087) 1.000 1UBQ [ 121] 312 N GLN - 41 ( 36.000, 30.860, 22.172) 1.000 1UBQ [ 122] 313 CA GLN - 41 ( 34.738, 30.875, 21.473) 1.000 1UBQ [ 123] 314 C GLN - 41 ( 33.589, 30.189, 22.181) 1.000 1UBQ [ 124] 321 N ARG - 42 ( 32.478, 30.917, 22.269) 1.000 1UBQ [ 125] 322 CW ARG - 42 ( 31.200, 30.329, 22.780) 1.000 1UBQ [ 126] 323 C ARG - 42 ( 30.210, 30.509, 21.650) 1.000 1UBQ [ 127] 332 N LEU - 43 ( 29.694, 29.436, 21.054) 1.000 1UBQ [ 128] 333 CW LEU - 43 ( 28.762, 29.573, 19.906) 1.000 1UBQ [ 129] 334 C LEU - 43 ( 27.331, 29.317, 20.364) 1.000 1UBQ [ 130] 340 N ILE - 44 ( 26.436, 30.232, 20.004) 1.000 1UBQ [ 131] 341 CW ILE - 44 ( 25.034, 30.170, 20.401) 1.000 1UBQ [ 132] 342 C ILE - 44 ( 24.101, 30.149, 19.196) 1.000 1UBQ [ 133] 348 N PHE - 45 ( 23.141, 29.187, 19.241) 1.000 1UBQ [ 134] 349 CW PHE - 45 ( 22.126, 29.062, 18.183) 1.000 1UBQ [ 135] 350 C PHE - 45 ( 20.835, 28.629, 18.904) 1.000 1UBQ [ 136] 359 N ALA - 46 ( 19.810, 29.378, 18.578) 1.000 1UBQ [ 137] 360 CY ALA - 46 ( 18.443, 29.143, 19.083) 1.000 1UBQ [ 138] 361 C ALA - 46 ( 18.453, 28.941, 20.591) 1.000 1UBQ [ 139] 364 N GLY - 47 ( 19.172, 29.808, 21.243) 1.000 1UBQ [ 140] 365 CY GLY - 47 ( 19.399, 29.894, 22.655) 1.000 1UBQ [ 141] 366 C GLY - 47 ( 20.083, 28.729, 23.321) 1.000 1UBQ [ 142] 368 N LYS - 48 ( 20.801, 27.931, 22.578) 1.000 1UBQ [ 143] 369 CA LYS - 48 ( 21.550, 26.796, 23.133) 1.000 1UBQ [ 144] 370 C LYS - 48 ( 23.046, 27.087, 22.913) 1.000 1UBQ [ 145] 377 N GLN - 49 ( 23.880, 26.727, 23.851) 1.000 1UBQ [ 146] 378 CW GLN - 49 ( 25.349, 26.872, 23.643) 1.000 1UBQ [ 147] 379 C GLN - 49 ( 25.743, 25.586, 22.922) 1.000 1UBQ [ 148] 386 N LEU - 50 ( 26.465, 25.689, 21.833) 1.000 1UBQ [ 149] 387 CW LEU - 50 ( 26.826, 24.521, 21.012) 1.000 1UBQ [ 150] 388 C LEU - 50 ( 27.994, 23.781, 21.643) 1.000 1UBQ [ 151] 394 N GLU - 51 ( 27.942, 22.448, 21.648) 1.000 1UBQ [ 152] 395 CW GLU - 51 ( 29.015, 21.657, 22.288) 1.000 1UBQ [ 153] 396 C GLU - 51 ( 29.942, 21.106, 21.240) 1.000 1UBQ [ 154] 403 N ASP - 52 ( 31.233, 21.090, 21.459) 1.000 1UBQ [ 155] 404 CY ASP - 52 ( 32.262, 20.670, 20.514) 1.000 1UBQ [ 156] 405 C ASP - 52 ( 32.128, 19.364, 19.750) 1.000 1UBQ [ 157] 411 N GLY - 53 ( 31.697, 18.311, 20.406) 1.000 1UBQ [ 158] 412 CY GLY - 53 ( 31.568, 16.962, 19.825) 1.000 1UBQ [ 159] 413 C GLY - 53 ( 30.320, 16.698, 19.051) 1.000 1UBQ [ 160] 415 N ARG - 54 ( 29.340, 17.594, 19.076) 1.000 1UBQ [ 161] 416 CA ARG - 54 ( 28.108, 17.439, 18.276) 1.000 1UBQ [ 162] 417 C ARG - 54 ( 28.375, 17.999, 16.887) 1.000 1UBQ [ 163] 426 N THR - 55 ( 27.510, 17.689, 15.954) 1.000 1UBQ [ 164] 427 CW THR - 55 ( 27.574, 18.192, 14.563) 1.000 1UBQ [ 165] 428 C THR - 55 ( 26.482, 19.280, 14.432) 1.000 1UBQ [ 166] 433 N LEU - 56 ( 26.585, 20.063, 13.378) 1.000 1UBQ [ 167] 434 CY LEU - 56 ( 25.594, 21.109, 13.072) 1.000 1UBQ [ 168] 435 C LEU - 56 ( 24.241, 20.436, 12.857) 1.000 1UBQ [ 169] 441 N SER - 57 ( 24.240, 19.233, 12.246) 1.000 1UBQ [ 170] 442 CR SER - 57 ( 22.924, 18.583, 12.025) 1.000 1UBQ [ 171] 443 C SER - 57 ( 22.229, 18.244, 13.325) 1.000 1UBQ [ 172] 447 N ASP - 58 ( 22.997, 17.978, 14.366) 1.000 1UBQ [ 173] 448 CR ASP - 58 ( 22.418, 17.638, 15.693) 1.000 1UBQ [ 174] 449 C ASP - 58 ( 21.460, 18.737, 16.163) 1.000 1UBQ [ 175] 455 N TYR - 59 ( 21.846, 19.954, 15.905) 1.000 1UBQ [ 176] 456 CY TYR - 59 ( 21.079, 21.149, 16.251) 1.000 1UBQ [ 177] 457 C TYR - 59 ( 20.142, 21.590, 15.149) 1.000 1UBQ [ 178] 467 N ASN - 60 ( 19.993, 20.884, 14.049) 1.000 1UBQ [ 179] 468 CY ASN - 60 ( 19.065, 21.352, 12.999) 1.000 1UBQ [ 180] 469 C ASN - 60 ( 19.442, 22.745, 12.510) 1.000 1UBQ [ 181] 475 N ILE - 61 ( 20.717, 22.964, 12.260) 1.000 1UBQ [ 182] 476 CW ILE - 61 ( 21.184, 24.263, 11.690) 1.000 1UBQ [ 183] 477 C ILE - 61 ( 21.110, 24.111, 10.173) 1.000 1UBQ [ 184] 483 N GLN - 62 ( 20.291, 24.875, 9.507) 1.000 1UBQ [ 185] 484 CW GLN - 62 ( 20.081, 24.773, 8.033) 1.000 1UBQ [ 186] 485 C GLN - 62 ( 20.822, 25.914, 7.332) 1.000 1UBQ [ 187] 492 N LYS - 63 ( 20.924, 25.862, 6.006) 1.000 1UBQ [ 188] 493 CW LYS - 63 ( 21.656, 26.847, 5.240) 1.000 1UBQ [ 189] 494 C LYS - 63 ( 21.127, 28.240, 5.574) 1.000 1UBQ [ 190] 501 N GLU - 64 ( 22.099, 29.163, 5.605) 1.000 1UBQ [ 191] 502 CY GLU - 64 ( 21.907, 30.563, 5.881) 1.000 1UBQ [ 192] 503 C GLU - 64 ( 21.466, 30.953, 7.261) 1.000 1UBQ [ 193] 510 N SER - 65 ( 21.674, 30.034, 8.191) 1.000 1UBQ [ 194] 511 CW SER - 65 ( 21.419, 30.253, 9.620) 1.000 1UBQ [ 195] 512 C SER - 65 ( 22.504, 31.228, 10.136) 1.000 1UBQ [ 196] 516 N THR - 66 ( 22.241, 31.873, 11.241) 1.000 1UBQ [ 197] 517 CW THR - 66 ( 23.212, 32.762, 11.891) 1.000 1UBQ [ 198] 518 C THR - 66 ( 23.509, 32.224, 13.290) 1.000 1UBQ [ 199] 523 N LEU - 67 ( 24.790, 32.021, 13.618) 1.000 1UBQ [ 200] 524 CW LEU - 67 ( 25.149, 31.609, 14.980) 1.000 1UBQ [ 201] 525 C LEU - 67 ( 25.698, 32.876, 15.669) 1.000 1UBQ [ 202] 531 N HIS - 68 ( 25.621, 32.945, 16.950) 1.000 1UBQ [ 203] 532 CW HIS - 68 ( 26.179, 34.127, 17.650) 1.000 1UBQ [ 204] 533 C HIS - 68 ( 27.475, 33.651, 18.304) 1.000 1UBQ [ 205] 541 N LEU - 69 ( 28.525, 34.447, 18.189) 1.000 1UBQ [ 206] 542 CW LEU - 69 ( 29.801, 34.145, 18.829) 1.000 1UBQ [ 207] 543 C LEU - 69 ( 30.052, 35.042, 20.004) 1.000 1UBQ [ 208] 549 N VAL - 70 ( 30.124, 34.533, 21.191) 1.000 1UBQ [ 209] 550 CW VAL - 70 ( 30.479, 35.369, 22.374) 1.000 1UBQ [ 210] 551 C VAL - 70 ( 31.901, 34.910, 22.728) 1.000 1UBQ [ 211] 556 N LEU - 71 ( 32.763, 35.831, 23.090) 1.000 1UBQ [ 212] 557 CW LEU - 71 ( 34.145, 35.472, 23.481) 1.000 1UBQ [ 213] 558 C LEU - 71 ( 34.239, 35.353, 24.979) 1.000 1UBQ [ 214] 564 N ARG - 72 ( 34.930, 34.384, 25.451) 1.000 1UBQ [ 215] 565 CW ARG - 72 ( 35.161, 34.174, 26.896) 1.000 1UBQ [ 216] 566 C ARG - 72 ( 36.671, 34.296, 27.089) 1.000 1UBQ [ 217] 575 N LEU - 73 ( 37.197, 35.397, 27.513) 0.450 1UBQ [ 218] 576 CW LEU - 73 ( 38.668, 35.502, 27.680) 0.450 1UBQ [ 219] 577 C LEU - 73 ( 39.076, 34.931, 29.031) 0.450 1UBQ [ 220] 583 N ARG - 74 ( 40.294, 34.412, 29.045) 0.450 1UBQ [ 221] 584 CW ARG - 74 ( 40.873, 33.802, 30.253) 0.450 1UBQ [ 222] 585 C ARG - 74 ( 41.765, 34.829, 30.944) 0.450 1UBQ [ 223] 594 N GLY - 75 ( 41.165, 35.531, 31.898) 0.250 1UBQ [ 224] 595 CA GLY - 75 ( 41.845, 36.550, 32.686) 0.250 1UBQ [ 225] 596 C GLY - 75 ( 41.251, 37.941, 32.588) 0.250 1UBQ [ 226] 598 N GLY - 76 ( 40.946, 38.472, 33.757) 0.250 1UBQ [ 227] 599 CA GLY - 76 ( 40.373, 39.813, 33.944) 0.250 1UBQ [ 228] 600 C GLY - 76 ( 40.031, 39.992, 35.432) 0.250 1UBQ ( 27.127, 28.856, 2.571 ) ( -1.494, -0.447, 1.431 ) ( 1.890, 0.060, 0.950 ) ( -0.407, 1.881, -0.881 ) ( 0.010, -1.494, -1.499 ) [1] x^0 y^0 z^-1 w^0 [zxy], code= D, atom= 2 (CA) center= ( 26.266, 25.413, 2.842), error= 2.987978 against atom [2] direction= ( 0.584, 3.608, 1.056) [2] x^0 y^0 z^0 w^0 [xyz], code= D, atom= 5 (CA) center= ( 26.850, 29.021, 3.898), error= 0.000000 against atom [5] direction= ( -0.031, 4.645, 4.655) [3] x^1 y^0 z^0 w^0 [yzx], code= D, atom= 8 (CA) center= ( 26.235, 30.058, 7.497), error= 2.979133 against atom [8] direction= ( -0.078, 4.415, 5.299) [4] x^1 y^1 z^0 w^0 [zxy], code= D, atom= 11 (CA) center= ( 26.772, 33.436, 9.197), error= 3.221412 against atom [11] direction= ( 2.370, 3.907, 5.006) [5] x^1 y^1 z^1 w^0 [xyz], code= D, atom= 14 (CA) center= ( 28.605, 33.965, 12.503), error= 3.499699 against atom [14] direction= ( 0.919, 3.879, 4.946) [6] x^2 y^1 z^1 w^0 [yzx], code= D, atom= 17 (CA) center= ( 27.691, 37.315, 14.143), error= 3.318982 against atom [17] direction= ( 1.620, 4.678, 4.159) [7] x^2 y^2 z^1 w^0 [zxy], code= D, atom= 20 (CA) center= ( 30.225, 38.643, 16.662), error= 2.955928 against atom [20] direction= ( 1.916, 3.865, 5.324) [8] x^2 y^2 z^2 w^0 [xyz], code= D, atom= 23 (CA) center= ( 29.607, 41.180, 19.467), error= 3.144658 against atom [23] direction= ( 1.197, 5.297, 0.891) [9] x^3 y^2 z^2 w^0 [yzx], code= D, atom= 26 (CA) center= ( 31.422, 43.940, 17.553), error= 3.741273 against atom [26] direction= ( -0.629, 2.780, -4.789) [10] x^3 y^3 z^2 w^0 [zxy], code= D, atom= 29 (CA) center= ( 28.978, 43.960, 14.678), error= 3.694793 against atom [29] direction= ( -0.231, -1.928, -5.222) [11] x^3 y^3 z^3 w^0 [xyz], code= D, atom= 32 (CA) center= ( 31.191, 42.012, 12.331), error= 3.160726 against atom [32] direction= ( 0.564, -4.940, -4.025) [12] x^4 y^3 z^3 w^0 [yzx], code= D, atom= 35 (CA) center= ( 29.542, 39.020, 10.653), error= 2.962798 against atom [35] direction= ( 0.529, -5.723, -3.155) [13] x^4 y^4 z^3 w^0 [zxy], code= D, atom= 38 (CA) center= ( 31.720, 36.289, 9.176), error= 3.042407 against atom [38] direction= ( 0.963, -5.136, -4.141) [14] x^4 y^4 z^4 w^0 [xyz], code= D, atom= 41 (CA) center= ( 30.505, 33.884, 6.512), error= 3.476107 against atom [41] direction= ( -0.043, -6.014, -2.537) [15] x^5 y^4 z^4 w^0 [yzx], code= D, atom= 44 (CA) center= ( 31.677, 30.275, 6.639), error= 3.530483 against atom [44] direction= ( 0.715, -6.543, -2.237) [16] x^5 y^5 z^4 w^0 [zxy], code= D, atom= 47 (CA) center= ( 31.220, 27.341, 4.275), error= 3.161071 against atom [47] direction= ( -1.389, -6.030, -0.446) [17] x^5 y^5 z^5 w^0 [xyz], code= D, atom= 50 (CA) center= ( 30.288, 24.245, 6.193), error= 2.979205 against atom [50] direction= ( -2.752, -6.401, 1.705) [18] x^6 y^5 z^5 w^0 [yzx], code= D, atom= 53 (CA) center= ( 28.468, 20.940, 5.980), error= 2.971997 against atom [53] direction= ( -4.459, -4.420, 2.301) [19] x^6 y^6 z^5 w^0 [zxy], code= D, atom= 56 (CA) center= ( 25.829, 19.825, 8.494), error= 3.151111 against atom [56] direction= ( -0.414, -4.105, 3.230) [20] x^6 y^6 z^6 w^0 [xyz], code= D, atom= 59 (CA) center= ( 28.054, 16.835, 9.210), error= 3.662099 against atom [59] direction= ( 4.967, -0.742, 2.072) [21] x^7 y^6 z^6 w^0 [yzx], code= D, atom= 62 (CA) center= ( 30.796, 19.083, 10.566), error= 3.438690 against atom [62] direction= ( 3.344, 2.229, 5.076) [22] x^7 y^7 z^6 w^0 [zxy], code= D, atom= 65 (CA) center= ( 31.398, 19.064, 14.286), error= 3.303146 against atom [65] direction= ( 0.492, 3.118, 5.851) [23] x^7 y^7 z^7 w^0 [xyz], code= D, atom= 68 (CA) center= ( 31.288, 22.201, 16.417), error= 2.938055 against atom [68] direction= ( 3.633, 2.658, 2.783) [24] x^8 y^7 z^7 w^0 [yzx], code= D, atom= 71 (CA) center= ( 35.031, 21.722, 17.069), error= 3.617960 against atom [71] direction= ( 4.302, -0.256, -3.115) [25] x^8 y^8 z^7 w^0 [zxy], code= D, atom= 74 (CA) center= ( 35.590, 21.945, 13.302), error= 3.476814 against atom [74] direction= ( -1.498, 3.375, -4.091) [26] x^8 y^8 z^8 w^0 [xyz], code= D, atom= 77 (CA) center= ( 33.533, 25.097, 12.978), error= 3.676485 against atom [77] direction= ( 0.006, 4.770, 2.434) [27] x^9 y^8 z^8 w^0 [yzx], code= D, atom= 80 (CA) center= ( 35.596, 26.715, 15.736), error= 3.437644 against atom [80] direction= ( 5.261, 0.664, 0.902) [28] x^9 y^9 z^8 w^-1 [wzx], code= U, atom= 83 (CA) center= ( 38.794, 25.761, 13.880), error= 3.040227 against atom [83] direction= ( 1.875, 0.676, -5.068) [29] x^9 y^9 z^8 w^-1 [wzy], code= D, atom= 86 (CA) center= ( 37.471, 27.391, 10.668), error= 3.033863 against atom [86] direction= ( -2.063, 4.809, -1.235) [30] x^9 y^9 z^8 w^0 [zyw], code= D, atom= 89 (CA) center= ( 36.731, 30.570, 12.645), error= 3.775357 against atom [89] direction= ( 2.798, 3.117, 3.447) [31] x^9 y^9 z^9 w^0 [ywz], code= D, atom= 92 (CA) center= ( 40.269, 30.508, 14.115), error= 3.752279 against atom [92] direction= ( 4.987, -0.548, -2.002) [32] x^9 y^10 z^9 w^0 [wzy], code= D, atom= 95 (CA) center= ( 41.718, 30.022, 10.643), error= 3.744314 against atom [95] direction= ( -0.461, 2.486, -4.882) [33] x^9 y^10 z^9 w^1 [zyw], code= D, atom= 98 (CA) center= ( 39.808, 32.994, 9.233), error= 3.573450 against atom [98] direction= ( -2.042, 5.525, 1.429) [34] x^9 y^10 z^10 w^1 [ywz], code= D, atom= 101 (CA) center= ( 39.676, 35.547, 12.072), error= 3.334221 against atom [101] direction= ( 2.537, 1.275, 5.198) [35] x^9 y^11 z^10 w^1 [wzy], code= D, atom= 104 (CA) center= ( 42.345, 34.269, 14.431), error= 3.303102 against atom [104] direction= ( 0.550, -1.831, 5.437) [36] x^9 y^11 z^10 w^2 [zyw], code= D, atom= 107 (CA) center= ( 40.226, 33.716, 17.509), error= 3.479891 against atom [107] direction= ( -0.884, -3.518, 5.163) [37] x^9 y^11 z^11 w^2 [ywz], code= D, atom= 110 (CA) center= ( 41.461, 30.751, 19.594), error= 3.053761 against atom [110] direction= ( -1.409, -5.696, 2.380) [38] x^9 y^12 z^11 w^2 [wzy], code= D, atom= 113 (CA) center= ( 38.817, 28.020, 19.889), error= 3.540573 against atom [113] direction= ( -2.398, -2.688, 4.101) [39] x^9 y^12 z^11 w^3 [zyw], code= D, atom= 116 (CA) center= ( 39.063, 28.063, 23.695), error= 3.746923 against atom [116] direction= ( -1.079, 3.617, 3.823) [40] x^9 y^12 z^12 w^3 [ywz], code= D, atom= 119 (CA) center= ( 37.738, 31.637, 23.712), error= 3.215729 against atom [119] direction= ( -4.325, 2.812, -2.222) [41] x^9 y^13 z^12 w^3 [wzy], code= D, atom= 122 (CA) center= ( 34.738, 30.875, 21.473), error= 3.597908 against atom [122] direction= ( -6.538, -1.308, -0.932) [42] x^9 y^13 z^12 w^4 [zyw], code= D, atom= 125 (CA) center= ( 31.200, 30.329, 22.780), error= 3.116449 against atom [125] direction= ( -5.976, -1.302, -1.567) [43] x^9 y^13 z^13 w^4 [ywz], code= D, atom= 128 (CA) center= ( 28.762, 29.573, 19.906), error= 3.484177 against atom [128] direction= ( -6.166, -0.159, -2.379) [44] x^9 y^14 z^13 w^4 [wzy], code= D, atom= 131 (CA) center= ( 25.034, 30.170, 20.401), error= 3.491088 against atom [131] direction= ( -6.636, -0.511, -1.723) [45] x^9 y^14 z^13 w^5 [zyw], code= D, atom= 134 (CA) center= ( 22.126, 29.062, 18.183), error= 3.182057 against atom [134] direction= ( -6.591, -1.027, -1.318) [46] x^9 y^14 z^14 w^5 [ywz], code= D, atom= 137 (CA) center= ( 18.443, 29.143, 19.083), error= 2.993333 against atom [137] direction= ( -2.727, 0.832, 4.472) [47] x^9 y^15 z^14 w^5 [wzy], code= D, atom= 140 (CA) center= ( 19.399, 29.894, 22.655), error= 3.252617 against atom [140] direction= ( 3.107, -2.347, 4.050) [48] x^8 y^15 z^14 w^6 [xzy], code= U, atom= 143 (CA) center= ( 21.550, 26.796, 23.133), error= 2.961560 against atom [143] direction= ( 5.950, -3.022, 0.988) [49] x^8 y^14 z^14 w^6 [yxz], code= U, atom= 146 (CA) center= ( 25.349, 26.872, 23.643), error= 3.460793 against atom [146] direction= ( 5.276, -2.275, -2.121) [50] x^8 y^14 z^13 w^6 [zyx], code= U, atom= 149 (CA) center= ( 26.826, 24.521, 21.012), error= 3.433900 against atom [149] direction= ( 3.666, -5.215, -1.355) [51] x^7 y^14 z^13 w^6 [xzy], code= U, atom= 152 (CA) center= ( 29.015, 21.657, 22.288), error= 3.382398 against atom [152] direction= ( 5.436, -3.851, -0.498) [52] x^7 y^13 z^13 w^6 [yxz], code= U, atom= 155 (CA) center= ( 32.262, 20.670, 20.514), error= 3.223547 against atom [155] direction= ( 2.553, -4.695, -2.463) [53] x^7 y^13 z^12 w^6 [zyx], code= U, atom= 158 (CA) center= ( 31.568, 16.962, 19.825), error= 3.238064 against atom [158] direction= ( -4.154, -3.231, -2.238) [54] x^6 y^13 z^12 w^6 [xzy], code= U, atom= 161 (CA) center= ( 28.108, 17.439, 18.276), error= 3.407558 against atom [161] direction= ( -3.994, 1.230, -5.262) [55] x^6 y^12 z^12 w^6 [yxz], code= U, atom= 164 (CA) center= ( 27.574, 18.192, 14.563), error= 3.481978 against atom [164] direction= ( -2.514, 3.670, -5.204) [56] x^6 y^12 z^11 w^6 [zyx], code= U, atom= 167 (CA) center= ( 25.594, 21.109, 13.072), error= 3.463325 against atom [167] direction= ( -4.650, 0.391, -2.538) [57] x^5 y^12 z^11 w^6 [xzy], code= U, atom= 170 (CA) center= ( 22.924, 18.583, 12.025), error= 3.565800 against atom [170] direction= ( -3.176, -3.471, 2.621) [58] x^5 y^11 z^11 w^6 [yxz], code= U, atom= 173 (CA) center= ( 22.418, 17.638, 15.693), error= 3.509247 against atom [173] direction= ( -1.845, 2.566, 4.226) [59] x^5 y^11 z^10 w^6 [zyx], code= U, atom= 176 (CA) center= ( 21.079, 21.149, 16.251), error= 3.655219 against atom [176] direction= ( -3.353, 3.714, -2.694) [60] x^4 y^11 z^10 w^6 [xzy], code= U, atom= 179 (CA) center= ( 19.065, 21.352, 12.999), error= 3.433220 against atom [179] direction= ( 0.105, 3.114, -4.561) [61] x^4 y^10 z^10 w^6 [yxz], code= U, atom= 182 (CA) center= ( 21.184, 24.263, 11.690), error= 3.606209 against atom [182] direction= ( 1.016, 3.421, -4.966) [62] x^4 y^10 z^9 w^6 [zyx], code= U, atom= 185 (CA) center= ( 20.081, 24.773, 8.033), error= 3.203770 against atom [185] direction= ( 0.472, 2.584, -6.450) [63] x^3 y^10 z^9 w^6 [xzy], code= U, atom= 188 (CA) center= ( 21.656, 26.847, 5.240), error= 2.977766 against atom [188] direction= ( 1.826, 5.790, -2.152) [64] x^3 y^9 z^9 w^6 [yxz], code= U, atom= 191 (CA) center= ( 21.907, 30.563, 5.881), error= 3.175899 against atom [191] direction= ( -0.237, 3.406, 4.380) [65] x^3 y^9 z^8 w^6 [zyx], code= U, atom= 194 (CA) center= ( 21.419, 30.253, 9.620), error= 3.628972 against atom [194] direction= ( 1.305, 2.199, 6.010) [66] x^2 y^9 z^8 w^6 [xzy], code= U, atom= 197 (CA) center= ( 23.212, 32.762, 11.891), error= 3.063997 against atom [197] direction= ( 3.730, 1.356, 5.360) [67] x^2 y^8 z^8 w^6 [yxz], code= U, atom= 200 (CA) center= ( 25.149, 31.609, 14.980), error= 2.989187 against atom [200] direction= ( 2.967, 1.365, 5.759) [68] x^2 y^8 z^7 w^6 [zyx], code= U, atom= 203 (CA) center= ( 26.179, 34.127, 17.650), error= 3.079715 against atom [203] direction= ( 4.652, 2.536, 3.849) [69] x^1 y^8 z^7 w^6 [xzy], code= U, atom= 206 (CA) center= ( 29.801, 34.145, 18.829), error= 3.448774 against atom [206] direction= ( 4.300, 1.242, 4.724) [70] x^1 y^7 z^7 w^6 [yxz], code= U, atom= 209 (CA) center= ( 30.479, 35.369, 22.374), error= 3.477943 against atom [209] direction= ( 4.344, 1.327, 4.652) [71] x^1 y^7 z^6 w^6 [zyx], code= U, atom= 212 (CA) center= ( 34.145, 35.472, 23.481), error= 3.569334 against atom [212] direction= ( 4.682, -1.195, 4.522) [72] x^0 y^7 z^6 w^6 [xzy], code= U, atom= 215 (CA) center= ( 35.161, 34.174, 26.896), error= 3.503839 against atom [215] direction= ( 4.523, 0.030, 4.199) [73] x^0 y^6 z^6 w^6 [yxz], code= U, atom= 218 (CA) center= ( 38.668, 35.502, 27.680), error= 3.402082 against atom [218] direction= ( 5.712, -0.372, 3.357) [74] x^0 y^6 z^5 w^6 [zyx], code= U, atom= 221 (CA) center= ( 40.873, 33.802, 30.253), error= 3.044966 against atom [221] direction= ( 3.177, 1.048, 5.006) [75] x^-1 y^6 z^5 w^6 [xzy], code= U, atom= 224 (CA) center= ( 41.845, 36.550, 32.686), error= 3.134290 against atom [224] direction= ( -0.500, 6.011, 3.691) [76] x^-1 y^5 z^5 w^6 [yxz], code= U, atom= 227 (CA) center= ( 40.373, 39.813, 33.944), error= 3.137021 against atom [227] direction= ( -1.472, 3.263, 1.258)