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*** noca_cutoff10_2 ***elNémo ID: 21011307364221970Job options:ID = 21011307364221970 JOBID = noca_cutoff10_2 USERID = unknown PRIVAT = 0 NMODES = 5 DQMIN = -100 DQMAX = 100 DQSTEP = 20 DOGRAPHS = on DOPROJMODS = 0 DORMSD = 0 NRBL = 0 CUTOFF = 10 CAONLY = 0 Input data for this run:HEADER noca_cutoff10_2 REMARK GENERATED BY TRJCONV TITLE Protein in water t= 700200.00000 step= 350100000 REMARK THIS IS A SIMULATION BOX CRYST1 80.320 80.320 80.319 60.00 60.00 90.00 P 1 1 MODEL 1 ATOM 1 CA ALA 2 180.030 230.840 86.070 1.00 0.00 C ATOM 2 CA CYS 3 180.290 229.880 89.860 1.00 0.00 C ATOM 3 CA PRO 4 183.990 229.280 90.780 1.00 0.00 C ATOM 4 CA LEU 5 183.970 225.430 90.240 1.00 0.00 C ATOM 5 CA GLU 6 182.330 225.990 86.760 1.00 0.00 C ATOM 6 CA LYS 7 185.400 228.270 85.850 1.00 0.00 C ATOM 7 CA ALA 8 187.830 225.690 87.590 1.00 0.00 C ATOM 8 CA LEU 9 186.720 222.940 85.240 1.00 0.00 C ATOM 9 CA ASP 10 186.610 225.290 82.200 1.00 0.00 C ATOM 10 CA VAL 11 190.270 226.470 82.850 1.00 0.00 C ATOM 11 CA MET 12 191.340 222.770 83.720 1.00 0.00 C ATOM 12 CA VAL 13 189.860 221.660 80.290 1.00 0.00 C ATOM 13 CA SER 14 191.130 224.600 78.150 1.00 0.00 C ATOM 14 CA THR 15 194.640 224.500 79.940 1.00 0.00 C ATOM 15 CA PHE 16 195.130 221.140 78.120 1.00 0.00 C ATOM 16 CA HIS 17 194.440 222.800 74.690 1.00 0.00 C ATOM 17 CA LYS 18 196.920 225.660 75.840 1.00 0.00 C ATOM 18 CA TYR 19 199.710 222.990 75.470 1.00 0.00 C ATOM 19 CA SER 20 198.260 220.020 73.450 1.00 0.00 C ATOM 20 CA GLY 21 197.450 220.400 69.610 1.00 0.00 C ATOM 21 CA LYS 22 193.980 221.050 67.980 1.00 0.00 C ATOM 22 CA GLU 23 194.050 218.260 65.410 1.00 0.00 C ATOM 23 CA GLY 24 195.250 214.510 64.920 1.00 0.00 C ATOM 24 CA ASP 25 197.270 213.520 68.080 1.00 0.00 C ATOM 25 CA LYS 26 195.170 215.940 70.150 1.00 0.00 C ATOM 26 CA PHE 27 194.160 213.400 72.800 1.00 0.00 C ATOM 27 CA LYS 28 197.360 213.150 74.890 1.00 0.00 C ATOM 28 CA LEU 29 200.130 215.480 76.250 1.00 0.00 C ATOM 29 CA ASN 30 203.860 214.570 76.470 1.00 0.00 C ATOM 30 CA LYS 31 205.340 214.510 80.010 1.00 0.00 C ATOM 31 CA SER 32 208.250 217.040 79.060 1.00 0.00 C ATOM 32 CA GLU 33 205.530 219.420 77.920 1.00 0.00 C ATOM 33 CA LEU 34 203.550 218.720 81.270 1.00 0.00 C ATOM 34 CA LYS 35 206.780 219.780 83.080 1.00 0.00 C ATOM 35 CA GLU 36 206.360 223.240 81.360 1.00 0.00 C ATOM 36 CA LEU 37 202.640 223.360 82.550 1.00 0.00 C ATOM 37 CA LEU 38 203.330 222.420 86.240 1.00 0.00 C ATOM 38 CA THR 39 205.860 225.350 86.710 1.00 0.00 C ATOM 39 CA ARG 40 203.880 227.840 84.460 1.00 0.00 C ATOM 40 CA GLU 41 200.340 227.120 85.810 1.00 0.00 C ATOM 41 CA LEU 42 201.220 226.190 89.580 1.00 0.00 C ATOM 42 CA PRO 43 204.490 228.340 90.250 1.00 0.00 C ATOM 43 CA SER 44 203.900 228.510 94.030 1.00 0.00 C ATOM 44 CA PHE 45 201.070 225.840 94.770 1.00 0.00 C ATOM 45 CA LEU 46 203.590 223.200 93.350 1.00 0.00 C ATOM 46 CA GLY 47 206.550 223.510 95.580 1.00 0.00 C ATOM 47 CA LYS 48 205.260 225.630 98.560 1.00 0.00 C ATOM 48 CA ARG 49 201.630 224.410 99.050 1.00 0.00 C ATOM 49 CA THR 50 202.480 220.760 98.280 1.00 0.00 C ATOM 50 CA ASP 51 204.060 218.160 100.700 1.00 0.00 C ATOM 51 CA GLU 52 207.470 217.230 99.340 1.00 0.00 C ATOM 52 CA ALA 53 207.040 213.580 100.330 1.00 0.00 C ATOM 53 CA ALA 54 203.520 213.460 98.920 1.00 0.00 C ATOM 54 CA PHE 55 204.840 214.710 95.460 1.00 0.00 C ATOM 55 CA GLN 56 207.750 212.120 95.810 1.00 0.00 C ATOM 56 CA LYS 57 204.880 209.520 95.340 1.00 0.00 C ATOM 57 CA LEU 58 203.480 211.450 92.160 1.00 0.00 C ATOM 58 CA MET 59 206.710 212.120 90.230 1.00 0.00 C ATOM 59 CA SER 60 206.690 208.190 89.870 1.00 0.00 C ATOM 60 CA ASN 61 203.730 208.670 87.310 1.00 0.00 C ATOM 61 CA LEU 62 205.470 211.710 85.700 1.00 0.00 C ATOM 62 CA ASP 63 208.380 209.410 84.730 1.00 0.00 C ATOM 63 CA SER 64 208.390 208.400 80.950 1.00 0.00 C ATOM 64 CA ASN 65 209.550 204.770 81.580 1.00 0.00 C ATOM 65 CA ARG 66 206.330 202.900 80.290 1.00 0.00 C ATOM 66 CA ASP 67 204.120 205.790 79.080 1.00 0.00 C ATOM 67 CA ASN 68 205.450 208.970 77.450 1.00 0.00 C ATOM 68 CA GLU 69 202.100 210.930 77.820 1.00 0.00 C ATOM 69 CA VAL 70 199.010 211.870 79.950 1.00 0.00 C ATOM 70 CA ASP 71 195.490 211.390 78.380 1.00 0.00 C ATOM 71 CA PHE 72 192.730 213.940 78.920 1.00 0.00 C ATOM 72 CA GLN 73 191.290 211.920 81.810 1.00 0.00 C ATOM 73 CA GLU 74 194.720 211.060 83.310 1.00 0.00 C ATOM 74 CA TYR 75 195.650 214.770 83.420 1.00 0.00 C ATOM 75 CA CYS 76 192.490 215.420 85.480 1.00 0.00 C ATOM 76 CA VAL 77 193.400 212.820 88.080 1.00 0.00 C ATOM 77 CA PHE 78 197.050 214.250 88.100 1.00 0.00 C ATOM 78 CA LEU 79 196.150 217.860 88.930 1.00 0.00 C ATOM 79 CA SER 80 193.380 216.600 91.200 1.00 0.00 C ATOM 80 CA CYS 81 196.000 214.690 93.260 1.00 0.00 C ATOM 81 CA ILE 82 198.160 218.010 93.430 1.00 0.00 C ATOM 82 CA ALA 83 195.160 219.670 95.090 1.00 0.00 C ATOM 83 CA MET 84 194.560 216.600 97.420 1.00 0.00 C ATOM 84 CA MET 85 198.000 216.590 98.740 1.00 0.00 C ATOM 85 CA CYS 86 197.530 220.310 99.700 1.00 0.00 C ATOM 86 CA ASN 87 194.390 219.310 101.840 1.00 0.00 C ATOM 87 CA GLU 88 194.600 215.680 103.060 1.00 0.00 C ATOM 88 CA PHE 89 197.530 213.290 103.630 1.00 0.00 C ATOM 89 CA PHE 90 198.660 211.390 100.440 1.00 0.00 C ATOM 90 CA GLU 91 200.430 208.130 99.420 1.00 0.00 C ATOM 91 CA GLY 92 199.940 207.340 95.640 1.00 0.00 C ATOM 92 CA PHE 93 197.870 207.430 92.400 1.00 0.00 C ATOM 93 CA PRO 94 194.330 205.700 92.410 1.00 0.00 C ATOM 94 CA ALA 2 198.440 233.380 92.150 1.00 0.00 C ATOM 95 CA CYS 3 197.920 231.960 88.640 1.00 0.00 C ATOM 96 CA PRO 4 194.450 230.890 87.360 1.00 0.00 C ATOM 97 CA LEU 5 195.010 227.100 87.930 1.00 0.00 C ATOM 98 CA GLU 6 196.470 227.700 91.530 1.00 0.00 C ATOM 99 CA LYS 7 193.130 229.510 92.330 1.00 0.00 C ATOM 100 CA ALA 8 191.260 226.620 90.520 1.00 0.00 C ATOM 101 CA LEU 9 192.960 224.080 92.880 1.00 0.00 C ATOM 102 CA ASP 10 192.030 226.300 95.820 1.00 0.00 C ATOM 103 CA VAL 11 188.300 225.980 94.880 1.00 0.00 C ATOM 104 CA MET 12 188.740 222.160 94.480 1.00 0.00 C ATOM 105 CA VAL 13 189.600 222.000 98.270 1.00 0.00 C ATOM 106 CA SER 14 186.990 224.650 99.210 1.00 0.00 C ATOM 107 CA THR 15 183.820 222.850 97.860 1.00 0.00 C ATOM 108 CA PHE 16 184.170 219.200 98.710 1.00 0.00 C ATOM 109 CA HIS 17 183.490 219.690 102.450 1.00 0.00 C ATOM 110 CA LYS 18 180.080 221.410 101.580 1.00 0.00 C ATOM 111 CA TYR 19 178.580 218.120 100.280 1.00 0.00 C ATOM 112 CA SER 20 180.940 215.220 101.380 1.00 0.00 C ATOM 113 CA GLY 21 178.250 213.980 103.880 1.00 0.00 C ATOM 114 CA LYS 22 176.370 214.990 106.960 1.00 0.00 C ATOM 115 CA GLU 23 172.950 213.220 107.200 1.00 0.00 C ATOM 116 CA GLY 24 173.080 209.890 105.220 1.00 0.00 C ATOM 117 CA ASP 25 175.540 208.780 107.990 1.00 0.00 C ATOM 118 CA LYS 26 176.880 210.830 110.910 1.00 0.00 C ATOM 119 CA PHE 27 180.480 209.260 111.030 1.00 0.00 C ATOM 120 CA LYS 28 180.860 208.310 107.350 1.00 0.00 C ATOM 121 CA LEU 29 181.090 210.510 104.220 1.00 0.00 C ATOM 122 CA ASN 30 178.250 209.670 101.770 1.00 0.00 C ATOM 123 CA LYS 31 177.950 209.350 97.880 1.00 0.00 C ATOM 124 CA SER 32 174.200 209.720 98.550 1.00 0.00 C ATOM 125 CA GLU 33 174.710 213.440 99.620 1.00 0.00 C ATOM 126 CA LEU 34 177.680 214.300 97.390 1.00 0.00 C ATOM 127 CA LYS 35 175.010 214.600 94.510 1.00 0.00 C ATOM 128 CA GLU 36 174.540 218.330 95.580 1.00 0.00 C ATOM 129 CA LEU 37 178.040 218.990 94.130 1.00 0.00 C ATOM 130 CA LEU 38 176.240 218.790 90.580 1.00 0.00 C ATOM 131 CA THR 39 173.440 221.340 91.480 1.00 0.00 C ATOM 132 CA ARG 40 174.610 223.650 94.350 1.00 0.00 C ATOM 133 CA GLU 41 178.310 223.960 93.040 1.00 0.00 C ATOM 134 CA LEU 42 177.970 223.270 89.210 1.00 0.00 C ATOM 135 CA PRO 43 174.480 224.950 88.400 1.00 0.00 C ATOM 136 CA SER 44 175.150 225.190 84.580 1.00 0.00 C ATOM 137 CA PHE 45 178.510 223.490 83.700 1.00 0.00 C ATOM 138 CA LEU 46 176.790 220.260 82.490 1.00 0.00 C ATOM 139 CA GLY 47 173.620 221.930 80.940 1.00 0.00 C ATOM 140 CA LYS 48 175.710 224.340 78.860 1.00 0.00 C ATOM 141 CA ARG 49 177.900 221.590 77.420 1.00 0.00 C ATOM 142 CA THR 50 176.340 218.060 77.660 1.00 0.00 C ATOM 143 CA ASP 51 173.010 216.270 77.340 1.00 0.00 C ATOM 144 CA GLU 52 170.780 215.500 80.300 1.00 0.00 C ATOM 145 CA ALA 53 171.850 211.900 79.950 1.00 0.00 C ATOM 146 CA ALA 54 175.350 213.000 81.150 1.00 0.00 C ATOM 147 CA PHE 55 173.590 214.530 84.200 1.00 0.00 C ATOM 148 CA GLN 56 171.910 211.010 84.750 1.00 0.00 C ATOM 149 CA LYS 57 175.200 209.180 84.150 1.00 0.00 C ATOM 150 CA LEU 58 177.320 211.180 86.720 1.00 0.00 C ATOM 151 CA MET 59 174.640 210.850 89.430 1.00 0.00 C ATOM 152 CA SER 60 174.560 207.050 88.660 1.00 0.00 C ATOM 153 CA ASN 61 178.240 206.930 89.750 1.00 0.00 C ATOM 154 CA LEU 62 177.050 208.380 93.240 1.00 0.00 C ATOM 155 CA ASP 63 173.780 206.210 93.500 1.00 0.00 C ATOM 156 CA SER 64 173.340 202.710 95.100 1.00 0.00 C ATOM 157 CA ASN 65 176.870 201.510 93.870 1.00 0.00 C ATOM 158 CA ARG 66 178.450 198.520 95.730 1.00 0.00 C ATOM 159 CA ASP 67 179.740 200.810 98.630 1.00 0.00 C ATOM 160 CA ASN 68 178.350 204.250 99.420 1.00 0.00 C ATOM 161 CA GLU 69 181.460 205.240 101.350 1.00 0.00 C ATOM 162 CA VAL 70 183.850 207.830 99.760 1.00 0.00 C ATOM 163 CA ASP 71 187.320 209.440 100.150 1.00 0.00 C ATOM 164 CA PHE 72 189.030 212.450 98.510 1.00 0.00 C ATOM 165 CA GLN 73 190.830 210.290 95.930 1.00 0.00 C ATOM 166 CA GLU 74 187.680 208.430 94.860 1.00 0.00 C ATOM 167 CA TYR 75 186.100 211.920 94.640 1.00 0.00 C ATOM 168 CA CYS 76 188.910 213.100 92.270 1.00 0.00 C ATOM 169 CA VAL 77 188.040 210.000 90.010 1.00 0.00 C ATOM 170 CA PHE 78 184.400 211.000 89.840 1.00 0.00 C ATOM 171 CA LEU 79 185.230 214.710 89.330 1.00 0.00 C ATOM 172 CA SER 80 187.320 213.800 86.380 1.00 0.00 C ATOM 173 CA CYS 81 184.350 212.030 84.840 1.00 0.00 C ATOM 174 CA ILE 82 182.510 215.460 84.770 1.00 0.00 C ATOM 175 CA ALA 83 185.740 216.880 83.410 1.00 0.00 C ATOM 176 CA MET 84 185.990 214.220 80.610 1.00 0.00 C ATOM 177 CA MET 85 182.330 214.500 79.620 1.00 0.00 C ATOM 178 CA CYS 86 182.680 218.410 79.330 1.00 0.00 C ATOM 179 CA ASN 87 185.630 218.300 76.930 1.00 0.00 C ATOM 180 CA GLU 88 185.400 218.090 73.120 1.00 0.00 C ATOM 181 CA PHE 89 186.930 214.660 72.540 1.00 0.00 C ATOM 182 CA PHE 90 183.900 212.750 74.130 1.00 0.00 C ATOM 183 CA GLU 91 181.690 210.900 71.480 1.00 0.00 C ATOM 184 CA GLY 92 178.350 212.460 72.900 1.00 0.00 C ATOM 185 CA PHE 93 176.760 209.270 74.150 1.00 0.00 C ATOM 186 CA PRO 94 176.660 208.930 78.000 1.00 0.00 C TER ENDMDL If you find results from this site helpful for your research, please cite one of our papers:
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