Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3m46_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 4.A N VAL 135.A O no hydrogen 3.064 N/A ARG 4.A NH1 GLU 26.A OE1 no hydrogen 3.297 N/A LYS 5.A NZ ILE 21.A O no hydrogen 2.988 N/A TYR 6.A N ILE 133.A O no hydrogen 2.699 N/A TYR 6.A OH ALA 27.A O no hydrogen 3.153 N/A ARG 7.A NE ASP 132.A OD1 no hydrogen 2.881 N/A ARG 7.A NH1 ASP 132.A OD2 no hydrogen 3.314 N/A TYR 8.A N LEU 131.A O no hydrogen 3.078 N/A ALA 10.A N ASP 130.A OD1 no hydrogen 2.997 N/A THR 14.A OG1 ASP 105.A OD1 no hydrogen 2.698 N/A THR 14.A OG1 ASP 105.A OD2 no hydrogen 3.092 N/A GLU 15.A N.A ASP 13.A OD2 no hydrogen 2.977 N/A GLU 15.A N.B ASP 13.A OD2 no hydrogen 2.960 N/A THR 18.A N VAL 151.A O no hydrogen 2.651 N/A GLU 19.A N VAL 151.A O no hydrogen 3.177 N/A ALA 24.A N LYS 5.A O no hydrogen 2.780 N/A TYR 30.A OH GLU 137.A OE1 no hydrogen 2.650 N/A GLU 32.A N THR 42.A O no hydrogen 2.817 N/A SER 34.A N ALA 40.A O no hydrogen 2.854 N/A PHE 39.A N CYS 126.A O no hydrogen 2.983 N/A ALA 40.A N SER 34.A O no hydrogen 3.023 N/A PHE 41.A N VAL 124.A O no hydrogen 2.699 N/A THR 42.A N GLU 32.A O no hydrogen 2.951 N/A TYR 43.A N LEU 122.A O no hydrogen 2.829 N/A MET 45.A N ASP 120.A O no hydrogen 2.560 N/A ASP 46.A N ASP 49.A OD2 no hydrogen 2.935 N/A ASP 48.A N ASP 46.A OD2 no hydrogen 3.036 N/A ILE 50.A N SER 95.A O no hydrogen 2.808 N/A VAL 51.A N ASN 62.A OD1 no hydrogen 3.198 N/A TYR 52.A N ILE 93.A O no hydrogen 2.939 N/A LEU 54.A N PHE 91.A O no hydrogen 2.786 N/A GLU 56.A N HIS 89.A ND1 no hydrogen 2.747 N/A SER 57.A N GLY 55.A O no hydrogen 2.853 N/A SER 57.A OG LEU 54.A O no hydrogen 3.343 N/A ASN 58.A ND2 THR 79.A O no hydrogen 2.886 N/A ASN 58.A ND2 LYS 82.A O no hydrogen 3.049 N/A ARG 59.A N ASN 58.A OD1 no hydrogen 2.818 N/A ARG 59.A NE GLU 80.A O no hydrogen 3.032 N/A ARG 59.A NH1 GLU 80.A O no hydrogen 3.173 N/A ILE 61.A N GLU 532.A OE1 no hydrogen 2.692 N/A ASN 62.A N GLU 532.A OE2 no hydrogen 3.069 N/A LYS 63.A N VAL 51.A O no hydrogen 2.823 N/A LYS 63.A NZ SER 57.A OG no hydrogen 2.772 N/A LYS 63.A NZ ASN 58.A O no hydrogen 2.681 N/A LYS 63.A NZ GLY 60.A O no hydrogen 2.961 N/A ARG 64.A N ASN 62.A OD1 no hydrogen 3.062 N/A ARG 64.A NH1 ASP 46.A O no hydrogen 2.658 N/A ARG 64.A NH1 ASP 49.A O no hydrogen 2.960 N/A ARG 64.A NH2 MET 119.A O no hydrogen 3.146 N/A GLY 65.A N ILE 114.A O no hydrogen 2.594 N/A TYR 66.A N ILE 114.A O no hydrogen 3.262 N/A TYR 66.A OH ASP 81.A O no hydrogen 3.282 N/A CYS 67.A SG PHE 112.A O no hydrogen 3.963 N/A TYR 68.A N PHE 112.A O no hydrogen 2.953 N/A TYR 68.A OH LYS 63.A O no hydrogen 2.573 N/A ILE 69.A N ARG 83.A O no hydrogen 2.995 N/A SER 70.A N LEU 110.A O no hydrogen 2.647 N/A CYS 72.A N ASN 377.A OD1 no hydrogen 3.004 N/A CYS 72.A SG TYR 86.A O no hydrogen 3.212 N/A CYS 72.A SG ASN 377.A O no hydrogen 3.915 N/A CYS 72.A SG ASN 377.A OD1 no hydrogen 3.606 N/A CYS 72.A SG SER 406.A OG no hydrogen 3.509 N/A CYS 72.A SG SER 407.A O no hydrogen 3.518 N/A THR 73.A N LEU 85.A O no hydrogen 2.758 N/A THR 79.A OG1 ASP 81.A OD1 no hydrogen 2.817 N/A THR 79.A OG1 ASP 81.A OD2 no hydrogen 3.317 N/A LYS 82.A N THR 79.A O no hydrogen 3.103 N/A LYS 82.A NZ ASP 75.A OD1 no hydrogen 3.394 N/A LYS 82.A NZ ASP 75.A OD2 no hydrogen 3.203 N/A SER 84.A OG ILE 69.A O no hydrogen 2.719 N/A TYR 86.A N GLU 56.A OE1 no hydrogen 3.146 N/A TYR 86.A OH HIS 78.A NE2 no hydrogen 3.362 N/A ALA 88.A N SER 407.A O no hydrogen 3.076 N/A HIS 89.A NE2 SER 407.A OG no hydrogen 2.862 N/A PHE 91.A N HIS 89.A O no hydrogen 2.866 N/A ILE 92.A N LEU 102.A O no hydrogen 3.009 N/A ILE 93.A N TYR 52.A O no hydrogen 2.905 N/A VAL 94.A N PHE 100.A O no hydrogen 2.759 N/A SER 95.A N ILE 50.A O no hydrogen 2.662 N/A GLY 96.A N THR 99.A OG1 no hydrogen 3.175 N/A LYS 97.A NZ ASP 46.A OD1 no hydrogen 3.250 N/A THR 99.A OG1 GLY 96.A O no hydrogen 3.045 N/A PHE 100.A N VAL 94.A O no hydrogen 3.100 N/A GLY 101.A N ILE 136.A O no hydrogen 2.773 N/A LEU 102.A N ILE 92.A O no hydrogen 2.800 N/A PHE 103.A N TYR 134.A O no hydrogen 3.008 N/A PHE 104.A N ASN 90.A O no hydrogen 3.048 N/A ASP 105.A N ASP 132.A O no hydrogen 2.737 N/A TYR 106.A N TYR 408.A OH no hydrogen 2.886 N/A TYR 106.A OH ASN 128.A OD1 no hydrogen 2.799 N/A SER 108.A OG ASP 373.A O no hydrogen 3.106 N/A LEU 110.A N SER 70.A O no hydrogen 3.233 N/A THR 111.A N SER 125.A O no hydrogen 2.926 N/A PHE 112.A N TYR 68.A O no hydrogen 2.717 N/A ASP 113.A N LYS 123.A O no hydrogen 2.717 N/A ILE 114.A N TYR 66.A O no hydrogen 3.191 N/A GLY 115.A N THR 121.A O no hydrogen 3.088 N/A THR 117.A N ASP 113.A OD1 no hydrogen 3.180 N/A THR 117.A OG1 ASP 113.A OD2 no hydrogen 2.623 N/A THR 121.A N ARG 118.A O no hydrogen 2.809 N/A THR 121.A OG1 ASP 120.A OD1 no hydrogen 3.157 N/A LEU 122.A N TYR 43.A O no hydrogen 2.714 N/A LYS 123.A N ASP 113.A O no hydrogen 2.748 N/A LYS 123.A NZ GLU 37.A OE2 no hydrogen 2.543 N/A VAL 124.A N PHE 41.A O no hydrogen 2.825 N/A SER 125.A N THR 111.A O no hydrogen 3.023 N/A CYS 126.A N PHE 39.A O no hydrogen 2.998 N/A CYS 126.A SG ASN 128.A O no hydrogen 3.418 N/A LEU 131.A N TYR 8.A O no hydrogen 3.025 N/A ASP 132.A N ASP 105.A O no hydrogen 3.346 N/A ILE 133.A N TYR 6.A O no hydrogen 2.761 N/A TYR 134.A N PHE 103.A O no hydrogen 2.965 N/A VAL 135.A N ARG 4.A O no hydrogen 2.760 N/A ILE 136.A N GLY 101.A O no hydrogen 2.855 N/A GLU 137.A N MET 2.A O no hydrogen 2.961 N/A TYR 142.A OH ASP 512.A OD1 no hydrogen 2.434 N/A ASP 143.A N ASN 140.A OD1 no hydrogen 2.881 N/A ILE 144.A N ASN 140.A O no hydrogen 2.952 N/A VAL 145.A N ALA 141.A O no hydrogen 2.738 N/A LYS 146.A N TYR 142.A O no hydrogen 2.839 N/A GLN 147.A N ASP 143.A O no hydrogen 3.148 N/A GLN 147.A NE2 GLU 137.A O no hydrogen 2.941 N/A GLN 147.A NE2 ASP 143.A O no hydrogen 2.873 N/A PHE 148.A N ILE 144.A O no hydrogen 3.094 N/A ARG 149.A N VAL 145.A O no hydrogen 2.727 N/A ARG 149.A NH1 ASN 440.A O no hydrogen 3.107 N/A ARG 149.A NH1 ASP 512.A O no hydrogen 2.747 N/A ARG 150.A N LYS 146.A O no hydrogen 3.251 N/A ARG 150.A N GLN 147.A O no hydrogen 3.071 N/A ARG 150.A NE GLU 19.A OE1 no hydrogen 2.817 N/A ARG 150.A NE GLU 19.A OE2 no hydrogen 3.404 N/A ARG 150.A NH2 GLU 19.A OE1 no hydrogen 3.349 N/A ARG 150.A NH2 GLU 19.A OE2 no hydrogen 2.678 N/A VAL 151.A N PHE 148.A O no hydrogen 3.055 N/A ILE 152.A N PHE 148.A O no hydrogen 3.181 N/A SER 155.A OG GLY 443.A O no hydrogen 2.747 N/A TYR 156.A N HIS 412.A O no hydrogen 2.751 N/A TYR 156.A OH PHE 400.A O no hydrogen 2.641 N/A LYS 160.A N GLY 636.A O no hydrogen 2.892 N/A ALA 162.A N PRO 159.A O no hydrogen 3.133 N/A PHE 163.A N LYS 160.A O no hydrogen 2.656 N/A GLY 164.A N PHE 161.A O no hydrogen 2.881 N/A PHE 165.A N TYR 494.A OH no hydrogen 2.962 N/A GLY 166.A N MET 474.A O no hydrogen 3.137 N/A GLN 167.A N MET 194.A O no hydrogen 3.200 N/A GLN 167.A NE2 TYR 185.A OH no hydrogen 2.456 N/A SER 168.A N ASP 476.A O no hydrogen 2.874 N/A ARG 169.A NE SER 168.A O no hydrogen 2.802 N/A ARG 169.A NH1 SER 168.A O no hydrogen 3.382 N/A ARG 169.A NH1 ASP 476.A O no hydrogen 3.281 N/A ARG 169.A NH1 ASP 476.A OD2 no hydrogen 2.926 N/A TRP 170.A N ALA 478.A O no hydrogen 3.013 N/A TYR 172.A N ARG 169.A O no hydrogen 3.136 N/A TYR 172.A OH GLN 167.A OE1 no hydrogen 3.115 N/A THR 173.A N ASP 177.A OD2 no hydrogen 2.971 N/A THR 173.A OG1 GLY 171.A O no hydrogen 3.200 N/A THR 174.A N ASP 177.A OD2 no hydrogen 2.900 N/A THR 174.A OG1 ASP 177.A OD2 no hydrogen 3.063 N/A ARG 179.A N LYS 175.A O no hydrogen 2.735 N/A ARG 179.A NE GLU 224.A OE2 no hydrogen 2.714 N/A ARG 179.A NH1 GLU 224.A OE1 no hydrogen 2.777 N/A ARG 179.A NH1 GLU 224.A OE2 no hydrogen 3.129 N/A ALA 180.A N GLU 176.A O no hydrogen 2.782 N/A VAL 181.A N PHE 178.A O no hydrogen 3.348 N/A ALA 182.A N PHE 178.A O no hydrogen 3.416 N/A LYS 183.A N ARG 179.A O no hydrogen 3.271 N/A GLY 184.A N ALA 180.A O no hydrogen 3.144 N/A TYR 185.A N VAL 181.A O no hydrogen 2.874 N/A ARG 186.A N ALA 182.A O no hydrogen 2.981 N/A ARG 186.A NE GLN 228.A O no hydrogen 3.063 N/A ARG 186.A NH1 ILE 192.A O no hydrogen 3.138 N/A ARG 186.A NH2 ILE 192.A O no hydrogen 3.227 N/A ARG 186.A NH2 GLN 228.A O no hydrogen 2.735 N/A GLU 187.A N LYS 183.A O no hydrogen 2.997 N/A ASN 188.A N GLY 184.A O no hydrogen 3.193 N/A ILE 190.A N TYR 185.A O no hydrogen 2.879 N/A ILE 192.A N GLU 609.A O no hydrogen 2.994 N/A ASP 193.A N PHE 165.A O no hydrogen 2.953 N/A MET 194.A N PHE 165.A O no hydrogen 3.167 N/A ILE 195.A N ARG 231.A O no hydrogen 2.982 N/A TYR 196.A N GLN 167.A O no hydrogen 2.969 N/A MET 197.A N ILE 233.A O no hydrogen 2.801 N/A ILE 199.A N ASP 198.A OD2 no hydrogen 2.679 N/A TYR 201.A N ASP 198.A O no hydrogen 3.325 N/A TYR 201.A OH ILE 235.A O no hydrogen 2.686 N/A MET 202.A N ILE 199.A O no hydrogen 3.169 N/A GLN 203.A N THR 209.A OG1 no hydrogen 2.721 N/A GLN 203.A NE2 ASP 204.A OD2 no hydrogen 3.140 N/A LYS 206.A N GLN 203.A O no hydrogen 2.964 N/A LYS 206.A NZ GLU 243.A OE1 no hydrogen 2.730 N/A LYS 206.A NZ GLU 243.A OE2 no hydrogen 2.928 N/A THR 209.A OG1 LYS 206.A O no hydrogen 2.750 N/A ASN 211.A N TYR 201.A O no hydrogen 2.839 N/A ASN 211.A ND2 MET 202.A O no hydrogen 3.557 N/A GLU 212.A N GLN 203.A OE1 no hydrogen 3.133 N/A ASN 214.A N ASN 211.A OD1 no hydrogen 2.976 N/A PHE 215.A N ASN 211.A O no hydrogen 2.808 N/A GLU 220.A N ASP 217.A OD2 no hydrogen 3.300 N/A PHE 221.A N ASP 217.A O no hydrogen 2.998 N/A VAL 222.A N PHE 218.A O no hydrogen 2.633 N/A LYS 223.A N PRO 219.A O no hydrogen 2.876 N/A LYS 223.A NZ ASP 227.A OD1 no hydrogen 3.422 N/A LYS 223.A NZ ASP 227.A OD2 no hydrogen 2.890 N/A GLU 224.A N GLU 220.A O no hydrogen 2.853 N/A MET 225.A N PHE 221.A O no hydrogen 3.084 N/A LYS 226.A N VAL 222.A O no hydrogen 2.883 N/A LYS 226.A NZ GLY 301.A O no hydrogen 2.742 N/A LYS 226.A NZ GLU 303.A OE2 no hydrogen 3.215 N/A ASP 227.A N LYS 223.A O no hydrogen 2.904 N/A GLN 228.A N MET 225.A O no hydrogen 2.969 N/A GLU 229.A N LYS 226.A O no hydrogen 3.095 N/A LEU 230.A N MET 225.A O no hydrogen 2.943 N/A ARG 231.A N ASP 193.A O no hydrogen 2.863 N/A ARG 231.A NH1 GLU 229.A OE1 no hydrogen 3.519 N/A ILE 233.A N ILE 195.A O no hydrogen 2.764 N/A ILE 236.A N TRP 306.A O no hydrogen 2.873 N/A ASP 237.A N ASP 207.A OD1 no hydrogen 3.320 N/A ALA 238.A N ASP 308.A O no hydrogen 3.375 N/A VAL 240.A N HIS 277.A O no hydrogen 3.056 N/A LYS 241.A NZ PRO 273.A O no hydrogen 2.756 N/A VAL 242.A N ASP 275.A O no hydrogen 2.697 N/A LYS 244.A NZ GLU 250.A OE2 no hydrogen 3.093 N/A GLY 245.A N GLU 250.A OE2 no hydrogen 3.014 N/A TYR 246.A N GLU 243.A O no hydrogen 3.122 N/A TYR 246.A OH ASP 207.A O no hydrogen 2.332 N/A GLU 250.A N TYR 246.A O no hydrogen 2.932 N/A GLU 251.A N GLU 247.A O no hydrogen 2.917 N/A GLY 252.A N VAL 248.A O no hydrogen 2.803 N/A VAL 253.A N TYR 249.A O no hydrogen 2.840 N/A LYS 254.A N GLU 250.A O no hydrogen 2.877 N/A LYS 254.A NZ LYS 254.A O no hydrogen 3.309 N/A ASN 255.A N GLU 251.A O no hydrogen 2.871 N/A ASN 255.A ND2 GLU 251.A O no hydrogen 2.943 N/A ASN 256.A N VAL 253.A O no hydrogen 3.438 N/A TYR 257.A N GLY 252.A O no hydrogen 2.978 N/A TYR 257.A OH GLU 285.A OE1 no hydrogen 2.530 N/A CYS 259.A N PHE 278.A O no hydrogen 2.620 N/A CYS 259.A SG PHE 278.A O no hydrogen 3.511 N/A CYS 259.A SG PRO 279.A O no hydrogen 3.695 N/A LYS 260.A N TYR 362.A O no hydrogen 3.470 N/A LYS 260.A NZ ASN 256.A OD1 no hydrogen 2.984 N/A LYS 260.A NZ ASP 266.A OD1 no hydrogen 2.586 N/A ARG 261.A N SER 265.A O no hydrogen 2.757 N/A ARG 261.A NE GLU 319.A OE2 no hydrogen 3.443 N/A ARG 261.A NH1 SER 265.A OG no hydrogen 2.924 N/A GLY 264.A N ARG 261.A O no hydrogen 3.028 N/A SER 265.A N ASP 263.A OD1 no hydrogen 2.925 N/A SER 265.A OG ASP 263.A OD1 no hydrogen 2.620 N/A SER 265.A OG ASP 263.A OD2 no hydrogen 3.534 N/A PHE 267.A N CYS 259.A O no hydrogen 3.187 N/A ALA 269.A N THR 276.A O no hydrogen 3.117 N/A ALA 270.A N TYR 316.A O no hydrogen 2.884 N/A VAL 271.A N GLY 274.A O no hydrogen 2.886 N/A GLY 274.A N VAL 271.A O no hydrogen 3.194 N/A THR 276.A N ALA 269.A O no hydrogen 2.891 N/A THR 276.A OG1 ALA 269.A O no hydrogen 2.809 N/A HIS 277.A N VAL 240.A O no hydrogen 2.986 N/A HIS 277.A ND1 PHE 267.A O no hydrogen 2.674 N/A ASP 280.A N TYR 257.A O no hydrogen 2.771 N/A LEU 282.A N ASP 280.A OD1 no hydrogen 3.017 N/A ASN 283.A N ASP 280.A O no hydrogen 3.325 N/A ASN 283.A N ASP 280.A OD1 no hydrogen 3.062 N/A ASN 283.A ND2 ASN 364.A O no hydrogen 2.974 N/A ALA 286.A N ASN 283.A OD1 no hydrogen 2.832 N/A ARG 287.A N ASN 283.A O no hydrogen 2.877 N/A ARG 287.A NH1 MET 281.A O no hydrogen 2.985 N/A LYS 288.A N PRO 284.A O no hydrogen 3.307 N/A LYS 288.A NZ ASP 292.A OD2 no hydrogen 2.792 N/A TRP 289.A N GLU 285.A O no hydrogen 3.234 N/A TRP 289.A NE1 GLU 251.A OE2 no hydrogen 2.876 N/A PHE 290.A N ALA 286.A O no hydrogen 3.052 N/A GLY 291.A N ARG 287.A O no hydrogen 2.911 N/A ASP 292.A N LYS 288.A O no hydrogen 2.856 N/A LYS 293.A N TRP 289.A O no hydrogen 3.326 N/A LYS 293.A NZ GLU 251.A OE2 no hydrogen 2.752 N/A TYR 294.A N GLY 291.A O no hydrogen 3.057 N/A ARG 295.A N ASP 292.A O no hydrogen 2.780 N/A PHE 296.A N LYS 293.A O no hydrogen 2.804 N/A LEU 297.A N TYR 294.A O no hydrogen 3.136 N/A ILE 298.A N TYR 294.A O no hydrogen 2.938 N/A ASP 299.A N ARG 295.A O no hydrogen 2.614 N/A GLN 300.A N LEU 297.A O no hydrogen 2.870 N/A GLN 300.A NE2 PHE 296.A O no hydrogen 2.871 N/A GLY 301.A N ILE 298.A O no hydrogen 3.174 N/A ILE 302.A N LEU 297.A O no hydrogen 3.260 N/A PHE 305.A N LEU 401.A O no hydrogen 2.774 N/A TRP 306.A N PRO 234.A O no hydrogen 3.221 N/A TRP 306.A NE1 ILE 233.A O no hydrogen 3.052 N/A ASN 307.A N PHE 403.A O no hydrogen 2.911 N/A ASN 307.A ND2 TYR 294.A OH no hydrogen 2.763 N/A ASP 308.A N ILE 236.A O no hydrogen 3.169 N/A MET 309.A N ASP 308.A OD1 no hydrogen 2.666 N/A ASN 310.A ND2 SER 404.A OG no hydrogen 2.691 N/A GLU 311.A N GLU 311.A OE1 no hydrogen 2.777 N/A ALA 313.A N MET 309.A O no hydrogen 2.928 N/A ILE 314.A N ASN 353.A OD1 no hydrogen 2.850 N/A PHE 315.A N ALA 270.A O no hydrogen 3.100 N/A SER 317.A OG GLU 319.A OE1 no hydrogen 3.476 N/A SER 317.A OG ASP 357.A OD1 no hydrogen 2.580 N/A SER 317.A OG ASP 357.A OD2 no hydrogen 2.897 N/A GLU 319.A N GLU 319.A OE1 no hydrogen 2.508 N/A GLY 320.A N SER 317.A OG no hydrogen 3.096 N/A LEU 321.A N SER 317.A O no hydrogen 2.802 N/A ALA 322.A N SER 318.A O no hydrogen 3.167 N/A GLU 323.A N GLU 319.A O no hydrogen 2.806 N/A ALA 324.A N GLY 320.A O no hydrogen 2.980 N/A LYS 325.A N LEU 321.A O no hydrogen 3.118 N/A GLU 326.A N ALA 322.A O no hydrogen 3.194 N/A PHE 327.A N GLU 323.A O no hydrogen 3.360 N/A ALA 328.A N ALA 324.A O no hydrogen 3.030 N/A GLY 329.A N LYS 325.A O no hydrogen 2.880 N/A GLU 330.A N GLU 326.A O no hydrogen 3.046 N/A PHE 331.A N PHE 327.A O no hydrogen 2.691 N/A ALA 332.A N ALA 328.A O no hydrogen 2.633 N/A LYS 333.A N GLY 329.A O no hydrogen 3.282 N/A LYS 333.A N GLU 330.A O no hydrogen 3.324 N/A ASP 334.A N GLU 330.A O no hydrogen 2.952 N/A ASP 334.A N PHE 331.A O no hydrogen 3.325 N/A GLY 337.A N ASP 334.A OD2 no hydrogen 2.821 N/A LYS 338.A N ASP 334.A OD1 no hydrogen 2.729 N/A ILE 339.A N ASP 334.A OD1 no hydrogen 3.012 N/A ALA 343.A N HIS 340.A O no hydrogen 3.070 N/A MET 344.A N HIS 340.A O no hydrogen 3.073 N/A GLN 345.A N PRO 341.A O no hydrogen 2.844 N/A ALA 346.A N TRP 342.A O no hydrogen 2.916 N/A LYS 347.A N ALA 343.A O no hydrogen 2.818 N/A LYS 347.A NZ GLU 323.A OE1 no hydrogen 3.448 N/A MET 348.A N MET 344.A O no hydrogen 3.303 N/A LYS 349.A N GLN 345.A O no hydrogen 3.127 N/A LYS 349.A NZ GLN 345.A OE1 no hydrogen 3.458 N/A ASP 350.A N ALA 346.A O no hydrogen 3.021 N/A VAL 352.A N LYS 349.A O no hydrogen 2.969 N/A ASN 353.A N ILE 314.A O no hydrogen 2.876 N/A SER 354.A OG ASP 350.A O no hydrogen 3.169 N/A SER 354.A OG GLU 356.A OE2 no hydrogen 3.497 N/A GLU 356.A N GLU 356.A OE2 no hydrogen 3.234 N/A ASP 357.A N SER 354.A O no hydrogen 2.705 N/A TYR 358.A N SER 354.A O no hydrogen 3.208 N/A TYR 358.A OH PRO 312.A O no hydrogen 2.713 N/A LYS 359.A N GLU 356.A O no hydrogen 3.298 N/A ARG 360.A N ASP 357.A O no hydrogen 3.040 N/A ARG 360.A NH1 ASP 357.A OD1 no hydrogen 2.556 N/A ARG 360.A NH2 GLU 323.A OE1 no hydrogen 3.247 N/A TYR 362.A OH GLU 262.A OE2 no hydrogen 3.157 N/A HIS 363.A N ILE 370.A O no hydrogen 2.612 N/A HIS 363.A ND1 ASP 280.A OD1 no hydrogen 2.925 N/A ASN 364.A N ASP 280.A OD2 no hydrogen 2.793 N/A VAL 365.A N LYS 368.A O no hydrogen 2.801 N/A LYS 368.A N VAL 365.A O no hydrogen 3.043 N/A ILE 370.A N HIS 363.A O no hydrogen 2.772 N/A ARG 371.A NE ASP 373.A OD1 no hydrogen 2.430 N/A ARG 371.A NH2 ASP 373.A OD2 no hydrogen 2.666 N/A HIS 372.A N PHE 361.A O no hydrogen 2.924 N/A ASP 373.A N TYR 358.A O no hydrogen 2.924 N/A LYS 374.A N ARG 371.A O no hydrogen 2.930 N/A VAL 375.A N HIS 372.A O no hydrogen 2.908 N/A HIS 376.A NE2 CYS 72.A O no hydrogen 2.706 N/A ASN 377.A N PRO 107.A O no hydrogen 3.180 N/A ASN 377.A ND2 SER 70.A O no hydrogen 3.209 N/A LEU 378.A N VAL 375.A O no hydrogen 3.155 N/A PHE 379.A N HIS 376.A O no hydrogen 3.356 N/A TYR 381.A OH THR 14.A O no hydrogen 2.992 N/A ASN 382.A N LEU 378.A O no hydrogen 2.830 N/A ASN 382.A ND2 LEU 378.A O no hydrogen 2.971 N/A MET 383.A N PHE 379.A O no hydrogen 2.875 N/A THR 384.A N GLY 380.A O no hydrogen 3.042 N/A THR 384.A OG1 ASN 307.A OD1 no hydrogen 3.413 N/A THR 384.A OG1 GLY 380.A O no hydrogen 3.290 N/A THR 384.A OG1 SER 404.A OG no hydrogen 2.897 N/A ARG 385.A N TYR 381.A O no hydrogen 2.821 N/A ARG 385.A NH1 GLU 15.A OE2.A no hydrogen 2.737 N/A ARG 385.A NH2 GLU 15.A OE1.A no hydrogen 2.675 N/A ARG 385.A NH2 GLU 15.A OE2.A no hydrogen 3.348 N/A ALA 386.A N ASN 382.A O no hydrogen 2.830 N/A GLY 388.A N THR 384.A O no hydrogen 2.907 N/A GLU 389.A N ARG 385.A O no hydrogen 3.052 N/A ALA 390.A N ALA 386.A O no hydrogen 3.126 N/A PHE 391.A N ALA 387.A O no hydrogen 3.084 N/A ARG 393.A N GLU 389.A O no hydrogen 3.186 N/A ARG 393.A N ALA 390.A O no hydrogen 3.312 N/A ARG 393.A NE ASP 292.A OD1 no hydrogen 3.060 N/A ARG 393.A NH2 ASP 292.A OD1 no hydrogen 2.612 N/A ILE 394.A N ALA 390.A O no hydrogen 3.206 N/A ASP 395.A N PHE 391.A O no hydrogen 2.947 N/A GLU 397.A N ASP 395.A OD1 no hydrogen 3.077 N/A LYS 398.A N ASP 395.A O no hydrogen 3.050 N/A LYS 398.A NZ GLU 303.A OE1 no hydrogen 2.925 N/A ARG 399.A N ILE 637.A O no hydrogen 2.989 N/A ARG 399.A NE HIS 638.A O no hydrogen 3.102 N/A ARG 399.A NH1 ASP 634.A OD1 no hydrogen 3.395 N/A ARG 399.A NH1 HIS 638.A O no hydrogen 3.181 N/A ARG 399.A NH2 PRO 158.A O no hydrogen 2.984 N/A ARG 399.A NH2 TYR 501.A OH no hydrogen 2.862 N/A LEU 401.A N GLU 303.A O no hydrogen 3.153 N/A MET 402.A N TYR 156.A OH no hydrogen 3.205 N/A SER 404.A N GLY 416.A O no hydrogen 2.953 N/A SER 404.A OG THR 384.A OG1 no hydrogen 2.897 N/A SER 404.A OG SER 406.A O no hydrogen 3.155 N/A ARG 405.A N ASN 307.A O no hydrogen 2.979 N/A ARG 405.A NH1 GLU 311.A OE1 no hydrogen 2.978 N/A SER 406.A N ASN 310.A OD1 no hydrogen 2.893 N/A SER 406.A OG TYR 86.A O no hydrogen 3.461 N/A SER 407.A OG HIS 89.A NE2 no hydrogen 2.862 N/A TYR 408.A OH ASP 105.A OD1 no hydrogen 2.848 N/A TYR 408.A OH TYR 106.A O no hydrogen 3.419 N/A GLY 410.A N HIS 412.A ND1 no hydrogen 2.960 N/A MET 411.A N TYR 408.A O no hydrogen 3.101 N/A HIS 412.A NE2 GLY 153.A O no hydrogen 2.969 N/A ARG 413.A NH1 ALA 16.A O no hydrogen 2.708 N/A ARG 413.A NH1 ILE 152.A O no hydrogen 2.797 N/A ARG 413.A NH2 GLU 15.A O.A no hydrogen 2.863 N/A ARG 413.A NH2 GLU 15.A O.B no hydrogen 2.873 N/A ARG 413.A NH2 TYR 414.A OH no hydrogen 3.358 N/A TYR 414.A N MET 411.A O no hydrogen 2.686 N/A GLY 415.A N MET 411.A O no hydrogen 3.374 N/A GLY 416.A N MET 402.A O no hydrogen 3.131 N/A ILE 417.A N TYR 446.A O no hydrogen 3.110 N/A TRP 418.A N SER 404.A O no hydrogen 3.465 N/A MET 419.A N GLY 448.A O no hydrogen 2.842 N/A ASN 422.A N ASP 421.A OD1 no hydrogen 2.541 N/A LYS 423.A NZ ASN 422.A O no hydrogen 3.259 N/A SER 424.A OG THR 456.A OG1 no hydrogen 3.106 N/A HIS 428.A N TRP 425.A O no hydrogen 2.823 N/A HIS 428.A NE2 ASP 421.A OD2 no hydrogen 2.636 N/A ILE 429.A N TRP 426.A O no hydrogen 3.252 N/A LEU 431.A N SER 427.A O no hydrogen 3.052 N/A ASN 432.A N HIS 428.A O no hydrogen 2.861 N/A LEU 433.A N ILE 429.A O no hydrogen 2.786 N/A LYS 434.A N LEU 430.A O no hydrogen 2.842 N/A LYS 434.A NZ GLU 532.A OE1 no hydrogen 2.931 N/A MET 435.A N LEU 431.A O no hydrogen 2.900 N/A LEU 436.A N LEU 433.A O no hydrogen 3.300 N/A LEU 439.A N MET 435.A O no hydrogen 2.987 N/A LEU 439.A N LEU 436.A O no hydrogen 3.194 N/A ASN 440.A N LEU 436.A O no hydrogen 3.174 N/A ASN 440.A ND2 LEU 436.A O no hydrogen 3.055 N/A MET 441.A N PRO 437.A O no hydrogen 2.894 N/A CYS 442.A N LEU 439.A O no hydrogen 3.008 N/A CYS 442.A SG SER 438.A O no hydrogen 3.493 N/A GLY 443.A N ASN 440.A O no hydrogen 3.110 N/A PHE 444.A N LEU 439.A O no hydrogen 2.863 N/A TYR 446.A OH ALA 162.A O no hydrogen 2.646 N/A ASP 450.A N MET 419.A O no hydrogen 2.465 N/A THR 456.A OG1 SER 424.A OG no hydrogen 3.106 N/A THR 457.A OG1 ASP 459.A OD1 no hydrogen 2.659 N/A LEU 460.A N ASP 459.A OD1 no hydrogen 2.977 N/A LEU 461.A N THR 457.A O no hydrogen 3.208 N/A LEU 462.A N ARG 458.A O no hydrogen 3.028 N/A ARG 463.A N ASP 459.A O no hydrogen 2.955 N/A ARG 463.A NH1 VAL 587.A O no hydrogen 3.061 N/A ARG 463.A NH2 VAL 587.A O no hydrogen 3.100 N/A PHE 464.A N LEU 460.A O no hydrogen 2.783 N/A LEU 465.A N LEU 461.A O no hydrogen 2.873 N/A ALA 466.A N LEU 462.A O no hydrogen 3.100 N/A LEU 467.A N ARG 463.A O no hydrogen 3.312 N/A LEU 467.A N PHE 464.A O no hydrogen 3.199 N/A GLY 468.A N PHE 464.A O no hydrogen 3.143 N/A VAL 469.A N LEU 465.A O no hydrogen 2.747 N/A PHE 470.A N LEU 467.A O no hydrogen 2.902 N/A THR 471.A N GLY 468.A O no hydrogen 2.936 N/A THR 471.A OG1 GLY 468.A O no hydrogen 2.804 N/A THR 471.A OG1 LEU 473.A O no hydrogen 2.778 N/A LEU 473.A N THR 447.A O no hydrogen 3.198 N/A ARG 475.A NE ASP 450.A OD1 no hydrogen 3.203 N/A ASP 476.A N GLY 166.A O no hydrogen 2.809 N/A HIS 477.A NE2 ASP 198.A OD1 no hydrogen 2.825 N/A GLU 484.A N GLU 484.A OE1 no hydrogen 2.971 N/A ASP 485.A N ASN 482.A O no hydrogen 3.251 N/A ARG 487.A N ILE 483.A O no hydrogen 3.414 N/A ARG 487.A NE ASN 188.A O no hydrogen 3.147 N/A ARG 487.A NH2 ASN 188.A O no hydrogen 2.864 N/A SER 488.A N GLU 484.A O no hydrogen 3.306 N/A SER 488.A OG GLU 484.A O no hydrogen 2.576 N/A VAL 489.A N ASP 485.A O no hydrogen 3.428 N/A ILE 490.A N PHE 486.A O no hydrogen 3.272 N/A ASN 491.A N ARG 487.A O no hydrogen 2.786 N/A ALA 492.A N SER 488.A O no hydrogen 3.072 N/A ARG 493.A N VAL 489.A O no hydrogen 3.239 N/A ARG 493.A NE PHE 163.A O no hydrogen 3.170 N/A ARG 493.A NH1 PHE 163.A O no hydrogen 3.221 N/A ARG 493.A NH1 GLY 164.A O no hydrogen 3.389 N/A ARG 493.A NH1 THR 471.A O no hydrogen 3.561 N/A ARG 493.A NH1 PRO 472.A O no hydrogen 2.852 N/A ARG 493.A NH2 VAL 469.A O no hydrogen 2.602 N/A ARG 493.A NH2 THR 471.A O no hydrogen 2.863 N/A TYR 494.A N ILE 490.A O no hydrogen 3.059 N/A TYR 494.A OH ASP 193.A OD2 no hydrogen 2.752 N/A ARG 495.A N ASN 491.A O no hydrogen 2.818 N/A ARG 495.A NE ALA 605.A O no hydrogen 3.054 N/A ARG 495.A NH1 GLY 571.A O no hydrogen 2.897 N/A LEU 496.A N ARG 493.A O no hydrogen 2.838 N/A VAL 497.A N TYR 494.A O no hydrogen 3.451 N/A TYR 499.A N LEU 496.A O no hydrogen 3.119 N/A TYR 499.A OH GLU 540.A OE1 no hydrogen 2.717 N/A LEU 500.A N LEU 496.A O no hydrogen 2.905 N/A TYR 501.A N VAL 497.A O no hydrogen 2.602 N/A TYR 501.A OH ASP 634.A OD1 no hydrogen 2.855 N/A SER 502.A N PRO 498.A O no hydrogen 3.081 N/A SER 502.A OG TYR 629.A OH no hydrogen 2.837 N/A GLU 503.A N TYR 499.A O no hydrogen 2.818 N/A TYR 504.A N LEU 500.A O no hydrogen 2.977 N/A TYR 504.A N TYR 501.A O no hydrogen 2.990 N/A TYR 504.A OH TYR 156.A O no hydrogen 2.758 N/A MET 505.A N TYR 501.A O no hydrogen 2.868 N/A LYS 506.A N SER 502.A O no hydrogen 2.862 N/A LYS 506.A NZ GLU 503.A OE2 no hydrogen 3.317 N/A LYS 506.A NZ THR 630.A O no hydrogen 2.959 N/A ALA 507.A N GLU 503.A O no hydrogen 3.127 N/A ALA 508.A N TYR 504.A O no hydrogen 2.722 N/A LEU 509.A N MET 505.A O no hydrogen 2.935 N/A ASN 510.A N ALA 507.A O no hydrogen 3.104 N/A ASN 510.A ND2 LYS 506.A O no hydrogen 3.147 N/A ASP 511.A N ALA 508.A O no hydrogen 3.474 N/A ASP 512.A N ALA 507.A O no hydrogen 2.841 N/A MET 513.A N ASP 512.A OD1 no hydrogen 2.573 N/A TYR 514.A N ASN 440.A OD1 no hydrogen 2.590 N/A TYR 514.A OH PHE 470.A O no hydrogen 3.251 N/A PHE 515.A N ASN 440.A OD1 no hydrogen 3.322 N/A LYS 516.A N MET 536.A O no hydrogen 2.791 N/A LYS 516.A NZ GLY 538.A O no hydrogen 2.999 N/A PHE 520.A N PRO 517.A O no hydrogen 2.714 N/A VAL 521.A N LEU 518.A O no hydrogen 3.116 N/A TYR 522.A N LEU 518.A O no hydrogen 2.702 N/A TYR 522.A OH GLU 560.A OE2 no hydrogen 2.531 N/A ASP 525.A N TYR 522.A O no hydrogen 2.924 N/A MET 527.A N ASP 525.A OD1 no hydrogen 3.063 N/A ALA 528.A N ASP 525.A OD1 no hydrogen 2.985 N/A ILE 529.A N ASP 525.A O no hydrogen 3.120 N/A ARG 530.A N MET 527.A O no hydrogen 3.005 N/A VAL 531.A N ALA 528.A O no hydrogen 3.198 N/A GLN 534.A NE2 TYR 557.A O no hydrogen 3.041 N/A LEU 535.A N ILE 543.A O no hydrogen 3.036 N/A MET 536.A N LYS 516.A O no hydrogen 2.818 N/A LEU 537.A N ILE 541.A O no hydrogen 2.998 N/A GLY 538.A N TYR 514.A O no hydrogen 3.237 N/A ASN 539.A N GLU 540.A OE1 no hydrogen 3.137 N/A ASN 539.A N GLU 540.A OE2 no hydrogen 3.210 N/A GLU 540.A N LEU 537.A O no hydrogen 3.475 N/A ILE 541.A N LEU 537.A O no hydrogen 3.296 N/A MET 542.A N PHE 595.A O no hydrogen 2.866 N/A ILE 543.A N LEU 535.A O no hydrogen 2.878 N/A TYR 547.A OH ASP 533.A OD2 no hydrogen 2.433 N/A GLN 549.A NE2 ASP 459.A OD2 no hydrogen 2.966 N/A ALA 551.A N GLU 548.A O no hydrogen 3.294 N/A ARG 554.A N VAL 585.A O no hydrogen 3.214 N/A ARG 554.A NE TYR 555.A O no hydrogen 2.762 N/A ARG 554.A NH1 ASP 533.A O no hydrogen 3.041 N/A ARG 554.A NH1 PRO 545.A O no hydrogen 2.671 N/A ARG 554.A NH2 ASP 533.A O no hydrogen 3.440 N/A ARG 554.A NH2 ASP 533.A OD1 no hydrogen 3.280 N/A ARG 554.A NH2 TYR 555.A O no hydrogen 2.901 N/A VAL 556.A N HIS 583.A O no hydrogen 2.837 N/A TYR 557.A N GLN 534.A OE1 no hydrogen 3.125 N/A TYR 557.A OH ASP 525.A OD1 no hydrogen 3.172 N/A TYR 557.A OH ASP 525.A OD2 no hydrogen 2.681 N/A LEU 558.A N GLY 581.A O no hydrogen 2.881 N/A MET 562.A N LEU 578.A O no hydrogen 2.934 N/A LYS 563.A N ILE 596.A O no hydrogen 2.926 N/A LYS 563.A NZ GLU 575.A OE2 no hydrogen 3.169 N/A LYS 563.A NZ GLY 623.A O no hydrogen 2.550 N/A PHE 564.A N GLU 576.A O no hydrogen 2.588 N/A ILE 565.A N LEU 594.A O no hydrogen 2.878 N/A LYS 566.A N SER 574.A O no hydrogen 2.991 N/A LYS 566.A NZ ASP 586.A O no hydrogen 2.940 N/A LYS 566.A NZ GLU 591.A OE1 no hydrogen 3.432 N/A PHE 567.A N VAL 592.A O no hydrogen 2.599 N/A MET 568.A N SER 572.A O no hydrogen 3.027 N/A GLY 571.A N MET 568.A O no hydrogen 2.960 N/A SER 572.A N ASP 570.A OD1 no hydrogen 2.777 N/A SER 572.A OG ASP 570.A OD1 no hydrogen 2.845 N/A SER 574.A N LYS 566.A O no hydrogen 3.040 N/A GLU 576.A N PHE 564.A O no hydrogen 2.972 N/A LEU 578.A N MET 562.A O no hydrogen 2.735 N/A GLY 581.A N LEU 558.A O no hydrogen 3.103 N/A HIS 583.A N VAL 556.A O no hydrogen 2.829 N/A HIS 583.A NE2 GLU 579.A O no hydrogen 2.783 N/A VAL 585.A N ARG 554.A O no hydrogen 3.155 N/A VAL 587.A N ARG 552.A O no hydrogen 3.063 N/A ALA 588.A N GLU 591.A OE1 no hydrogen 3.138 N/A ASN 590.A ND2 ASP 485.A OD1 no hydrogen 2.995 N/A GLU 591.A N ALA 588.A O no hydrogen 2.934 N/A VAL 592.A N PHE 567.A O no hydrogen 3.158 N/A LEU 594.A N ILE 565.A O no hydrogen 2.960 N/A PHE 595.A N MET 542.A O no hydrogen 2.974 N/A ILE 596.A N LYS 563.A O no hydrogen 3.037 N/A ARG 597.A N GLU 540.A O no hydrogen 2.947 N/A ARG 597.A NE GLU 560.A OE2 no hydrogen 3.089 N/A ARG 597.A NH2 GLU 560.A OE2 no hydrogen 3.415 N/A SER 598.A N GLU 561.A O no hydrogen 3.075 N/A LYS 600.A N ARG 597.A O no hydrogen 2.659 N/A LYS 600.A NZ ASN 539.A O no hydrogen 2.841 N/A CYS 601.A SG SER 627.A O no hydrogen 3.595 N/A ILE 602.A N ILE 622.A O no hydrogen 2.946 N/A VAL 604.A N GLN 620.A O no hydrogen 2.861 N/A ALA 605.A N ARG 495.A O no hydrogen 3.011 N/A VAL 611.A N ASP 193.A OD1 no hydrogen 3.310 N/A VAL 611.A N ASP 193.A OD2 no hydrogen 2.829 N/A ASP 613.A N CYS 610.A O no hydrogen 3.282 N/A ILE 614.A N VAL 611.A O no hydrogen 3.155 N/A THR 616.A OG1 GLU 633.A OE1 no hydrogen 3.107 N/A GLU 617.A N ASP 615.A OD1 no hydrogen 3.286 N/A GLN 620.A N VAL 604.A O no hydrogen 3.180 N/A ILE 622.A N ILE 602.A O no hydrogen 2.981 N/A TYR 624.A N LYS 600.A O no hydrogen 3.022 N/A TYR 624.A OH GLU 561.A OE2 no hydrogen 3.088 N/A GLY 626.A N LYS 652.A O no hydrogen 3.065 N/A SER 627.A N TYR 624.A O no hydrogen 3.056 N/A SER 627.A OG TYR 624.A O no hydrogen 2.899 N/A TYR 629.A N LEU 650.A O no hydrogen 2.959 N/A TYR 629.A OH SER 502.A OG no hydrogen 2.837 N/A TYR 629.A OH GLU 503.A OE2 no hydrogen 2.660 N/A LEU 631.A N ARG 648.A O no hydrogen 2.671 N/A TYR 632.A N SER 502.A OG no hydrogen 2.890 N/A TYR 632.A OH ASP 634.A OD2 no hydrogen 2.593 N/A GLU 633.A N ASN 646.A O no hydrogen 2.872 N/A GLY 636.A N ASP 634.A OD1 no hydrogen 2.993 N/A ILE 637.A N ASP 635.A OD1 no hydrogen 2.806 N/A HIS 638.A N ASP 635.A OD1 no hydrogen 2.882 N/A HIS 638.A ND1 ASP 635.A OD2 no hydrogen 2.754 N/A LYS 639.A NZ PRO 396.A O no hydrogen 3.248 N/A TYR 641.A N LYS 639.A O no hydrogen 2.954 N/A LYS 643.A NZ ASP 640.A OD2 no hydrogen 3.027 N/A ASN 646.A N LYS 643.A O no hydrogen 3.023 N/A ASN 646.A ND2 ASP 640.A O no hydrogen 2.957 N/A ASN 646.A ND2 TYR 641.A O no hydrogen 3.159 N/A TYR 647.A N LYS 644.A O no hydrogen 3.173 N/A ARG 648.A N LEU 631.A O no hydrogen 2.862 N/A ARG 648.A NH1 GLU 633.A OE2 no hydrogen 2.708 N/A ARG 648.A NH2 GLU 633.A OE2 no hydrogen 3.130 N/A LEU 650.A N TYR 629.A O no hydrogen 2.889 N/A LYS 652.A N SER 627.A O no hydrogen 3.044 N/A LYS 652.A NZ LEU 621.A O no hydrogen 2.847 N/A