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*** ca_my_mu_3 ***elNémo ID: 21011507581093769Job options:ID = 21011507581093769 JOBID = ca_my_mu_3 USERID = unknown PRIVAT = 0 NMODES = 5 DQMIN = -100 DQMAX = 100 DQSTEP = 20 DOGRAPHS = on DOPROJMODS = 0 DORMSD = 0 NRBL = 0 CUTOFF = 12 CAONLY = 0 Input data for this run:HEADER ca_my_mu_3 REMARK GENERATED BY TRJCONV TITLE Protein in water t= 700000.00000 step= 350000000 REMARK THIS IS A SIMULATION BOX CRYST1 83.539 83.539 83.539 60.00 60.00 90.00 P 1 1 MODEL 1 ATOM 1 CA ALA 2 42.710 174.500-151.070 1.00 0.00 C ATOM 2 CA SER 3 42.810 178.020-149.300 1.00 0.00 C ATOM 3 CA PRO 4 45.120 180.810-150.480 1.00 0.00 C ATOM 4 CA LEU 5 47.980 179.490-148.260 1.00 0.00 C ATOM 5 CA GLU 6 47.500 175.750-149.180 1.00 0.00 C ATOM 6 CA LYS 7 47.680 176.920-152.990 1.00 0.00 C ATOM 7 CA ALA 8 50.860 178.890-151.950 1.00 0.00 C ATOM 8 CA LEU 9 52.800 175.730-150.730 1.00 0.00 C ATOM 9 CA ASP 10 52.680 174.780-154.520 1.00 0.00 C ATOM 10 CA VAL 11 53.970 178.010-155.830 1.00 0.00 C ATOM 11 CA MET 12 56.970 177.720-153.370 1.00 0.00 C ATOM 12 CA VAL 13 57.520 173.940-154.340 1.00 0.00 C ATOM 13 CA SER 14 57.360 174.370-158.110 1.00 0.00 C ATOM 14 CA THR 15 59.710 177.280-157.910 1.00 0.00 C ATOM 15 CA PHE 16 62.540 174.840-157.010 1.00 0.00 C ATOM 16 CA HIS 17 61.530 172.260-159.890 1.00 0.00 C ATOM 17 CA LYS 18 61.430 175.260-162.300 1.00 0.00 C ATOM 18 CA TYR 19 65.310 175.570-162.270 1.00 0.00 C ATOM 19 CA SER 20 66.640 172.400-160.330 1.00 0.00 C ATOM 20 CA GLY 21 66.620 169.960-163.260 1.00 0.00 C ATOM 21 CA LYS 22 68.230 172.400-165.790 1.00 0.00 C ATOM 22 CA GLU 23 71.710 170.840-165.320 1.00 0.00 C ATOM 23 CA GLY 24 70.440 167.370-164.580 1.00 0.00 C ATOM 24 CA ASP 25 69.090 166.100-161.230 1.00 0.00 C ATOM 25 CA LYS 26 65.700 167.810-160.310 1.00 0.00 C ATOM 26 CA PHE 27 66.010 166.840-156.690 1.00 0.00 C ATOM 27 CA LYS 28 68.880 169.300-155.930 1.00 0.00 C ATOM 28 CA LEU 29 69.550 172.840-156.890 1.00 0.00 C ATOM 29 CA ASN 30 73.120 173.470-158.090 1.00 0.00 C ATOM 30 CA LYS 31 75.230 176.700-158.530 1.00 0.00 C ATOM 31 CA SER 32 74.000 177.050-162.100 1.00 0.00 C ATOM 32 CA GLU 33 70.230 176.930-161.060 1.00 0.00 C ATOM 33 CA LEU 34 70.350 179.230-157.970 1.00 0.00 C ATOM 34 CA LYS 35 71.440 181.760-160.770 1.00 0.00 C ATOM 35 CA GLU 36 68.040 181.550-162.560 1.00 0.00 C ATOM 36 CA LEU 37 65.970 181.790-159.390 1.00 0.00 C ATOM 37 CA LEU 38 67.960 184.870-158.180 1.00 0.00 C ATOM 38 CA THR 39 67.690 186.690-161.630 1.00 0.00 C ATOM 39 CA ARG 40 64.110 185.580-162.740 1.00 0.00 C ATOM 40 CA GLU 41 62.130 185.420-159.410 1.00 0.00 C ATOM 41 CA LEU 42 64.500 187.140-156.880 1.00 0.00 C ATOM 42 CA PRO 43 66.450 189.870-158.930 1.00 0.00 C ATOM 43 CA SER 44 64.680 191.920-156.180 1.00 0.00 C ATOM 44 CA TRP 45 67.050 190.390-153.620 1.00 0.00 C ATOM 45 CA LEU 46 70.210 189.680-155.690 1.00 0.00 C ATOM 46 CA GLY 47 72.710 192.560-155.530 1.00 0.00 C ATOM 47 CA LYS 48 74.040 194.480-158.720 1.00 0.00 C ATOM 48 CA ARG 49 77.700 194.240-157.480 1.00 0.00 C ATOM 49 CA THR 50 77.770 190.460-156.890 1.00 0.00 C ATOM 50 CA ASP 51 81.150 189.010-158.010 1.00 0.00 C ATOM 51 CA GLU 52 81.380 185.250-158.830 1.00 0.00 C ATOM 52 CA ALA 53 83.490 184.590-155.490 1.00 0.00 C ATOM 53 CA ALA 54 80.650 186.370-153.590 1.00 0.00 C ATOM 54 CA PHE 55 78.410 183.900-155.540 1.00 0.00 C ATOM 55 CA GLN 56 80.490 181.000-154.380 1.00 0.00 C ATOM 56 CA LYS 57 80.340 182.170-150.790 1.00 0.00 C ATOM 57 CA LEU 58 76.560 182.760-150.970 1.00 0.00 C ATOM 58 CA MET 59 76.120 179.170-152.170 1.00 0.00 C ATOM 59 CA SER 60 78.530 177.900-149.360 1.00 0.00 C ATOM 60 CA ASN 61 76.270 179.420-146.720 1.00 0.00 C ATOM 61 CA LEU 62 73.010 178.030-148.300 1.00 0.00 C ATOM 62 CA ASP 63 73.860 174.630-146.760 1.00 0.00 C ATOM 63 CA SER 64 73.290 172.500-143.500 1.00 0.00 C ATOM 64 CA ASN 65 75.590 169.520-144.240 1.00 0.00 C ATOM 65 CA ARG 66 78.710 170.700-146.170 1.00 0.00 C ATOM 66 CA ASP 67 77.950 169.530-149.800 1.00 0.00 C ATOM 67 CA ASN 68 77.370 173.090-151.130 1.00 0.00 C ATOM 68 CA GLU 69 74.380 171.590-152.990 1.00 0.00 C ATOM 69 CA VAL 70 70.860 172.990-152.080 1.00 0.00 C ATOM 70 CA ASP 71 68.290 170.780-150.510 1.00 0.00 C ATOM 71 CA PHE 72 64.650 171.890-150.560 1.00 0.00 C ATOM 72 CA GLN 73 64.370 172.400-146.750 1.00 0.00 C ATOM 73 CA GLU 74 67.460 174.750-146.910 1.00 0.00 C ATOM 74 CA TYR 75 65.780 176.630-149.730 1.00 0.00 C ATOM 75 CA CYS 76 62.580 176.740-147.310 1.00 0.00 C ATOM 76 CA VAL 77 64.240 178.390-144.290 1.00 0.00 C ATOM 77 CA PHE 78 65.920 180.710-146.950 1.00 0.00 C ATOM 78 CA LEU 79 62.430 181.510-148.460 1.00 0.00 C ATOM 79 CA SER 80 61.180 182.050-144.900 1.00 0.00 C ATOM 80 CA SER 81 63.990 184.570-144.110 1.00 0.00 C ATOM 81 CA ILE 82 62.980 186.400-147.370 1.00 0.00 C ATOM 82 CA ALA 83 59.490 186.560-145.790 1.00 0.00 C ATOM 83 CA MET 84 61.040 187.830-142.460 1.00 0.00 C ATOM 84 CA MET 85 62.740 190.740-144.460 1.00 0.00 C ATOM 85 CA SER 86 59.280 191.390-146.050 1.00 0.00 C ATOM 86 CA ASN 87 57.600 191.220-142.490 1.00 0.00 C ATOM 87 CA GLU 88 59.820 192.930-139.820 1.00 0.00 C ATOM 88 CA PHE 89 63.390 193.020-140.960 1.00 0.00 C ATOM 89 CA PHE 90 62.950 195.520-143.740 1.00 0.00 C ATOM 90 CA GLU 91 66.110 197.630-143.200 1.00 0.00 C ATOM 91 CA GLY 92 68.310 194.650-142.310 1.00 0.00 C ATOM 92 CA PHE 93 68.220 190.980-141.050 1.00 0.00 C ATOM 93 CA PRO 94 69.290 190.680-137.330 1.00 0.00 C ATOM 94 CA ALA 2 56.840 191.190-158.980 1.00 0.00 C ATOM 95 CA SER 3 57.340 187.380-158.940 1.00 0.00 C ATOM 96 CA PRO 4 54.490 184.830-158.120 1.00 0.00 C ATOM 97 CA LEU 5 57.120 183.790-155.500 1.00 0.00 C ATOM 98 CA GLU 6 56.960 187.180-153.840 1.00 0.00 C ATOM 99 CA LYS 7 53.070 187.160-153.940 1.00 0.00 C ATOM 100 CA ALA 8 52.970 183.620-152.330 1.00 0.00 C ATOM 101 CA LEU 9 55.300 184.900-149.480 1.00 0.00 C ATOM 102 CA ASP 10 52.820 187.900-149.160 1.00 0.00 C ATOM 103 CA VAL 11 50.130 185.330-148.360 1.00 0.00 C ATOM 104 CA MET 12 52.500 183.830-145.710 1.00 0.00 C ATOM 105 CA VAL 13 52.970 187.190-143.860 1.00 0.00 C ATOM 106 CA SER 14 49.300 188.310-144.360 1.00 0.00 C ATOM 107 CA THR 15 48.010 184.940-142.940 1.00 0.00 C ATOM 108 CA PHE 16 50.160 185.490-139.710 1.00 0.00 C ATOM 109 CA HIS 17 48.620 189.000-139.200 1.00 0.00 C ATOM 110 CA LYS 18 45.140 187.680-140.190 1.00 0.00 C ATOM 111 CA TYR 19 44.850 185.980-136.820 1.00 0.00 C ATOM 112 CA SER 20 47.900 187.060-134.720 1.00 0.00 C ATOM 113 CA GLY 21 46.250 190.320-133.710 1.00 0.00 C ATOM 114 CA LYS 22 42.670 188.680-133.620 1.00 0.00 C ATOM 115 CA GLU 23 42.550 188.280-129.760 1.00 0.00 C ATOM 116 CA GLY 24 44.840 191.400-129.440 1.00 0.00 C ATOM 117 CA ASP 25 48.500 191.850-129.950 1.00 0.00 C ATOM 118 CA LYS 26 49.850 191.000-133.470 1.00 0.00 C ATOM 119 CA PHE 27 53.400 190.580-132.300 1.00 0.00 C ATOM 120 CA LYS 28 52.640 186.900-131.290 1.00 0.00 C ATOM 121 CA LEU 29 50.030 184.300-132.300 1.00 0.00 C ATOM 122 CA ASN 30 48.060 182.500-129.440 1.00 0.00 C ATOM 123 CA LYS 31 46.350 179.060-129.100 1.00 0.00 C ATOM 124 CA SER 32 42.780 180.570-129.700 1.00 0.00 C ATOM 125 CA GLU 33 44.110 182.530-132.720 1.00 0.00 C ATOM 126 CA LEU 34 46.010 179.460-134.060 1.00 0.00 C ATOM 127 CA LYS 35 43.100 176.940-133.790 1.00 0.00 C ATOM 128 CA GLU 36 41.190 179.550-135.960 1.00 0.00 C ATOM 129 CA LEU 37 44.220 179.930-138.440 1.00 0.00 C ATOM 130 CA LEU 38 44.580 176.090-138.740 1.00 0.00 C ATOM 131 CA THR 39 40.870 175.200-139.060 1.00 0.00 C ATOM 132 CA ARG 40 40.090 178.220-141.410 1.00 0.00 C ATOM 133 CA GLU 41 43.230 178.390-143.630 1.00 0.00 C ATOM 134 CA LEU 42 44.930 174.980-143.350 1.00 0.00 C ATOM 135 CA PRO 43 41.900 172.460-142.930 1.00 0.00 C ATOM 136 CA SER 44 43.370 169.700-145.130 1.00 0.00 C ATOM 137 CA TRP 45 46.220 169.470-142.510 1.00 0.00 C ATOM 138 CA LEU 46 44.020 168.350-139.630 1.00 0.00 C ATOM 139 CA GLY 47 45.010 164.830-138.190 1.00 0.00 C ATOM 140 CA LYS 48 43.440 161.780-136.500 1.00 0.00 C ATOM 141 CA ARG 49 42.470 163.700-133.170 1.00 0.00 C ATOM 142 CA THR 50 40.070 166.770-132.690 1.00 0.00 C ATOM 143 CA ASP 51 40.080 167.530-128.930 1.00 0.00 C ATOM 144 CA GLU 52 41.470 170.600-126.980 1.00 0.00 C ATOM 145 CA ALA 53 44.260 168.670-125.130 1.00 0.00 C ATOM 146 CA ALA 54 45.820 167.540-128.390 1.00 0.00 C ATOM 147 CA PHE 55 45.640 171.230-129.500 1.00 0.00 C ATOM 148 CA GLN 56 47.530 172.290-126.260 1.00 0.00 C ATOM 149 CA LYS 57 50.150 169.620-127.260 1.00 0.00 C ATOM 150 CA LEU 58 50.510 171.300-130.770 1.00 0.00 C ATOM 151 CA MET 59 51.030 174.710-129.060 1.00 0.00 C ATOM 152 CA SER 60 53.630 173.290-126.570 1.00 0.00 C ATOM 153 CA ASN 61 55.630 171.940-129.660 1.00 0.00 C ATOM 154 CA LEU 62 55.500 175.040-131.810 1.00 0.00 C ATOM 155 CA ASP 63 56.780 177.230-128.940 1.00 0.00 C ATOM 156 CA SER 64 60.510 176.890-128.210 1.00 0.00 C ATOM 157 CA ASN 65 60.780 179.390-125.130 1.00 0.00 C ATOM 158 CA ARG 66 57.890 178.120-122.820 1.00 0.00 C ATOM 159 CA ASP 67 55.760 181.190-123.110 1.00 0.00 C ATOM 160 CA ASN 68 53.180 179.110-125.000 1.00 0.00 C ATOM 161 CA GLU 69 52.990 181.840-127.760 1.00 0.00 C ATOM 162 CA VAL 70 54.210 181.600-131.440 1.00 0.00 C ATOM 163 CA ASP 71 56.420 184.270-133.180 1.00 0.00 C ATOM 164 CA PHE 72 56.540 184.790-137.030 1.00 0.00 C ATOM 165 CA GLN 73 60.150 183.160-136.530 1.00 0.00 C ATOM 166 CA GLU 74 58.360 180.160-134.830 1.00 0.00 C ATOM 167 CA TYR 75 55.560 179.990-137.410 1.00 0.00 C ATOM 168 CA CYS 76 58.250 179.800-140.200 1.00 0.00 C ATOM 169 CA VAL 77 59.250 176.420-138.600 1.00 0.00 C ATOM 170 CA PHE 78 55.660 174.970-138.930 1.00 0.00 C ATOM 171 CA LEU 79 55.210 176.720-142.380 1.00 0.00 C ATOM 172 CA SER 80 58.380 175.180-143.930 1.00 0.00 C ATOM 173 CA SER 81 57.610 171.760-142.470 1.00 0.00 C ATOM 174 CA ILE 82 54.270 171.760-144.450 1.00 0.00 C ATOM 175 CA ALA 83 56.030 173.130-147.530 1.00 0.00 C ATOM 176 CA MET 84 58.720 170.270-147.230 1.00 0.00 C ATOM 177 CA MET 85 55.720 167.730-147.030 1.00 0.00 C ATOM 178 CA SER 86 54.650 169.370-150.250 1.00 0.00 C ATOM 179 CA ASN 87 57.990 168.860-152.200 1.00 0.00 C ATOM 180 CA GLU 88 57.790 165.070-151.390 1.00 0.00 C ATOM 181 CA PHE 89 54.080 164.940-152.540 1.00 0.00 C ATOM 182 CA PHE 90 55.230 166.750-155.820 1.00 0.00 C ATOM 183 CA GLU 91 56.860 163.440-156.980 1.00 0.00 C ATOM 184 CA GLY 92 54.940 160.890-154.740 1.00 0.00 C ATOM 185 CA PHE 93 52.290 160.170-152.010 1.00 0.00 C ATOM 186 CA PRO 94 50.230 156.920-151.400 1.00 0.00 C ATOM 187 CA TYR 1893 69.010 194.110-158.510 1.00 0.00 C ATOM 188 CA ARG 1894 69.680 195.580-155.080 1.00 0.00 C ATOM 189 CA LYS 1895 72.120 198.610-154.720 1.00 0.00 C ATOM 190 CA LEU 1896 73.710 197.130-151.460 1.00 0.00 C ATOM 191 CA GLN 1897 75.980 193.970-151.340 1.00 0.00 C ATOM 192 CA ARG 1898 75.740 190.730-149.100 1.00 0.00 C ATOM 193 CA GLU 1899 71.950 190.900-148.560 1.00 0.00 C ATOM 194 CA LEU 1900 71.400 187.120-148.750 1.00 0.00 C ATOM 195 CA GLU 1901 74.890 186.110-147.170 1.00 0.00 C ATOM 196 CA ASP 1902 73.380 185.950-143.630 1.00 0.00 C ATOM 197 CA ALA 1903 69.780 184.920-144.550 1.00 0.00 C ATOM 198 CA THR 1904 71.180 181.810-146.440 1.00 0.00 C ATOM 199 CA GLU 1905 73.310 180.950-143.370 1.00 0.00 C ATOM 200 CA THR 1906 69.910 180.340-141.670 1.00 0.00 C ATOM 201 CA ALA 1907 70.320 176.840-143.180 1.00 0.00 C ATOM 202 CA ASP 1908 73.130 176.330-140.500 1.00 0.00 C ATOM 203 CA ALA 1909 70.940 177.140-137.430 1.00 0.00 C ATOM 204 CA MET 1910 67.170 176.760-138.320 1.00 0.00 C ATOM 205 CA ASN 1911 67.140 173.780-140.880 1.00 0.00 C ATOM 206 CA ARG 1912 67.450 171.160-138.010 1.00 0.00 C ATOM 207 CA GLU 1913 64.540 172.950-136.050 1.00 0.00 C ATOM 208 CA VAL 1914 62.410 172.410-139.150 1.00 0.00 C ATOM 209 CA SER 1915 63.530 168.780-139.400 1.00 0.00 C ATOM 210 CA SER 1916 62.610 168.310-135.580 1.00 0.00 C ATOM 211 CA LEU 1917 59.210 169.760-135.930 1.00 0.00 C ATOM 212 CA LYS 1918 58.710 167.880-139.230 1.00 0.00 C ATOM 213 CA ASN 1919 59.890 164.670-137.370 1.00 0.00 C ATOM 214 CA LYS 1920 57.620 165.120-134.250 1.00 0.00 C ATOM 215 CA LEU 1921 54.890 165.650-136.950 1.00 0.00 C ATOM 216 CA ARG 1922 55.920 162.470-139.080 1.00 0.00 C ATOM 217 CA ARG 1923 56.570 160.110-136.100 1.00 0.00 C ATOM 218 CA GLY 1924 53.180 161.500-135.050 1.00 0.00 C ATOM 219 CA ASP 1925 53.620 162.960-131.560 1.00 0.00 C ATOM 220 CA LEU 1926 51.290 165.670-132.840 1.00 0.00 C ATOM 221 CA PRO 1927 48.010 163.820-133.870 1.00 0.00 C ATOM 222 CA PHE 1928 46.000 167.110-134.050 1.00 0.00 C ATOM 223 CA VAL 1929 47.700 167.500-137.560 1.00 0.00 C ATOM 224 CA VAL 1930 48.580 165.130-140.470 1.00 0.00 C ATOM 225 CA PRO 1931 52.010 163.140-140.490 1.00 0.00 C ATOM 226 CA ARG 1932 52.130 163.480-144.400 1.00 0.00 C ATOM 227 CA ARG 1933 50.170 165.730-146.920 1.00 0.00 C ATOM 228 CA MET 1934 46.780 164.170-147.620 1.00 0.00 C ATOM 229 CA ALA 1935 44.560 164.210-150.870 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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