Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3r75_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 2.A N ASP 5.A OD2 no hydrogen 3.307 N/A LEU 3.A N GLU 88.A OE1 no hydrogen 2.936 N/A ASP 5.A N ASN 2.A OD1 no hydrogen 2.718 N/A ARG 6.A N ASN 2.A O no hydrogen 3.198 N/A ARG 6.A NH1 GLU 86.A OE2 no hydrogen 3.083 N/A ARG 6.A NH2 GLU 86.A OE1 no hydrogen 2.657 N/A ARG 6.A NH2 GLU 86.A OE2 no hydrogen 3.306 N/A VAL 7.A N LEU 3.A O no hydrogen 2.884 N/A LEU 8.A N PHE 4.A O no hydrogen 2.804 N/A HIS 9.A N ASP 5.A O no hydrogen 2.936 N/A HIS 9.A N ARG 6.A O no hydrogen 3.239 N/A GLY 10.A N VAL 7.A O no hydrogen 3.097 N/A GLN 11.A N ARG 6.A O no hydrogen 2.789 N/A CYS 14.A SG GLY 30.A O no hydrogen 3.753 N/A CYS 14.A SG HIS 177.A O no hydrogen 3.532 N/A PHE 15.A N HIS 177.A O no hydrogen 3.005 N/A ALA 16.A N PHE 28.A O no hydrogen 2.974 N/A LEU 17.A N VAL 175.A O no hydrogen 2.814 N/A ILE 18.A N ASP 26.A O no hydrogen 2.895 N/A ALA 19.A N ILE 173.A O no hydrogen 2.800 N/A ARG 20.A NE ASP 26.A OD2 no hydrogen 2.971 N/A ARG 20.A NH1 ASP 334.A OD2 no hydrogen 3.117 N/A ARG 20.A NH2 ASP 26.A OD2 no hydrogen 3.265 N/A ILE 25.A N VAL 90.A O no hydrogen 2.852 N/A ASP 26.A N ILE 18.A O no hydrogen 2.860 N/A VAL 27.A N GLU 88.A O no hydrogen 2.739 N/A PHE 28.A N ALA 16.A O no hydrogen 2.889 N/A ALA 29.A N GLU 86.A O no hydrogen 3.026 N/A ALA 31.A N THR 83.A OG1 no hydrogen 3.290 N/A SER 33.A N ALA 81.A O no hydrogen 2.903 N/A TYR 34.A OH GLU 180.A OE2 no hydrogen 2.709 N/A SER 36.A OG GLU 40.A OE2 no hydrogen 2.438 N/A SER 37.A OG GLU 40.A OE2 no hydrogen 3.199 N/A LEU 38.A N GLU 67.A OE2 no hydrogen 2.846 N/A GLU 40.A N SER 37.A O no hydrogen 2.965 N/A LEU 41.A N LEU 38.A O no hydrogen 3.075 N/A GLY 50.A N ALA 327.A O no hydrogen 3.137 N/A ALA 51.A N THR 49.A OG1 no hydrogen 3.241 N/A ARG 53.A N ARG 325.A O no hydrogen 2.878 N/A ARG 53.A NH2 THR 47.A O no hydrogen 3.364 N/A GLU 55.A N ILE 323.A O no hydrogen 2.745 N/A LEU 56.A N ILE 323.A O no hydrogen 3.092 N/A LEU 57.A N ILE 82.A O no hydrogen 2.839 N/A VAL 58.A N ALA 321.A O no hydrogen 2.802 N/A MET 59.A N VAL 80.A O no hydrogen 2.818 N/A VAL 60.A N ILE 319.A O no hydrogen 2.870 N/A TYR 62.A N GLY 314.A O no hydrogen 2.949 N/A ARG 63.A NE ASP 74.A OD1 no hydrogen 3.500 N/A ARG 63.A NE ASP 74.A OD2 no hydrogen 3.129 N/A ARG 63.A NH2 ASP 74.A OD2 no hydrogen 2.966 N/A GLN 64.A N PRO 61.A O no hydrogen 3.082 N/A GLN 64.A NE2 GLU 67.A OE2 no hydrogen 2.756 N/A LEU 65.A N TYR 62.A O no hydrogen 3.124 N/A HIS 66.A N ARG 63.A O no hydrogen 3.218 N/A HIS 66.A ND1 ARG 63.A O no hydrogen 3.341 N/A GLU 67.A N GLN 64.A O no hydrogen 2.976 N/A ARG 68.A N LEU 65.A O no hydrogen 2.934 N/A ARG 68.A NH1 MET 288.A O no hydrogen 2.614 N/A GLY 69.A N HIS 66.A O no hydrogen 2.883 N/A PHE 70.A N LEU 65.A O no hydrogen 3.237 N/A HIS 73.A NE2 ALA 306.A O no hydrogen 3.026 N/A GLY 76.A N ASP 74.A OD1 no hydrogen 2.773 N/A ALA 77.A N ASP 75.A OD2 no hydrogen 3.131 N/A VAL 80.A N MET 59.A O no hydrogen 2.975 N/A ALA 81.A N SER 33.A O no hydrogen 2.895 N/A ILE 82.A N LEU 57.A O no hydrogen 2.731 N/A THR 83.A N ALA 31.A O no hydrogen 2.857 N/A THR 83.A OG1 ASP 85.A OD1 no hydrogen 2.582 N/A THR 83.A OG1 ASP 85.A OD2 no hydrogen 3.290 N/A CYS 84.A N GLU 55.A O no hydrogen 2.923 N/A GLU 86.A N ALA 29.A O no hydrogen 2.982 N/A HIS 87.A NE2 ASP 26.A OD1 no hydrogen 2.922 N/A GLU 88.A N VAL 27.A O no hydrogen 2.814 N/A VAL 90.A N ILE 25.A O no hydrogen 3.015 N/A ALA 92.A N ALA 23.A O no hydrogen 2.901 N/A LEU 94.A N SER 91.A OG no hydrogen 3.387 N/A ALA 95.A N SER 91.A O no hydrogen 3.012 N/A LEU 96.A N ALA 92.A O no hydrogen 2.906 N/A ALA 97.A N GLN 93.A O no hydrogen 2.972 N/A ALA 98.A N LEU 94.A O no hydrogen 3.141 N/A ALA 98.A N ALA 95.A O no hydrogen 3.116 N/A ILE 99.A N ALA 95.A O no hydrogen 3.260 N/A ILE 99.A N LEU 96.A O no hydrogen 3.240 N/A THR 104.A OG1 PHE 382.A O no hydrogen 2.556 N/A ALA 105.A N ASP 103.A OD1 no hydrogen 3.370 N/A LEU 106.A N ASP 383.A OD1 no hydrogen 3.346 N/A LEU 106.A N ASP 383.A OD2 no hydrogen 3.127 N/A GLY 107.A N ASP 147.A O no hydrogen 2.848 N/A ARG 109.A NE SER 379.A OG no hydrogen 3.386 N/A ARG 109.A NH2 SER 379.A OG no hydrogen 2.854 N/A HIS 110.A N GLU 145.A O no hydrogen 2.898 N/A HIS 110.A ND1 GLU 108.A O no hydrogen 2.923 N/A ASP 112.A N THR 143.A O no hydrogen 2.859 N/A ILE 113.A N ASP 112.A OD1 no hydrogen 2.639 N/A ALA 117.A N ASP 114.A OD2 no hydrogen 2.890 N/A TYR 118.A N ASP 114.A O no hydrogen 2.831 N/A TYR 118.A OH ILE 140.A O no hydrogen 2.628 N/A ALA 119.A N ASP 115.A O no hydrogen 2.847 N/A GLU 120.A N GLU 116.A O no hydrogen 3.064 N/A ILE 121.A N ALA 117.A O no hydrogen 3.125 N/A VAL 122.A N TYR 118.A O no hydrogen 2.996 N/A GLU 123.A N ALA 119.A O no hydrogen 3.095 N/A ARG 124.A N GLU 120.A O no hydrogen 3.106 N/A ARG 124.A NH2.B ASP 128.A OD2 no hydrogen 3.135 N/A VAL 125.A N ILE 121.A O no hydrogen 2.905 N/A ILE 126.A N VAL 122.A O no hydrogen 3.048 N/A THR 127.A N GLU 123.A O no hydrogen 2.937 N/A THR 127.A OG1 GLU 123.A O no hydrogen 3.072 N/A ASP 128.A N ARG 124.A O no hydrogen 2.711 N/A GLU 129.A N VAL 125.A O no hydrogen 2.992 N/A ILE 130.A N VAL 125.A O no hydrogen 3.028 N/A GLY 131.A N ILE 126.A O no hydrogen 2.885 N/A THR 132.A N GLU 129.A O no hydrogen 3.089 N/A THR 132.A OG1 ASP 128.A O no hydrogen 2.540 N/A THR 132.A OG1 GLU 129.A O no hydrogen 3.497 N/A GLY 133.A N ILE 130.A O no hydrogen 3.250 N/A ALA 134.A N GLU 129.A O no hydrogen 2.990 N/A SER 136.A N SER 296.A O no hydrogen 3.231 N/A SER 136.A OG ASN 137.A OD1 no hydrogen 2.626 N/A ASN 137.A ND2 GLU 239.A OE2 no hydrogen 2.785 N/A PHE 138.A N LEU 358.A O no hydrogen 3.213 N/A VAL 139.A N THR 294.A O no hydrogen 2.948 N/A LYS 141.A N GLU 309.A OE2 no hydrogen 2.882 N/A LYS 141.A NZ ARG 313.A O no hydrogen 2.856 N/A ARG 142.A N VAL 354.A O no hydrogen 2.859 N/A ARG 142.A NH1 ILE 113.A O no hydrogen 2.800 N/A ARG 142.A NH1 ASP 115.A OD2 no hydrogen 2.823 N/A ARG 142.A NH2 ASP 115.A OD2 no hydrogen 2.875 N/A ARG 142.A NH2 THR 371.A OG1 no hydrogen 2.914 N/A THR 143.A N ASP 112.A OD1 no hydrogen 2.967 N/A LEU 144.A N ILE 352.A O no hydrogen 2.863 N/A GLU 145.A N HIS 110.A O no hydrogen 2.762 N/A GLY 146.A N VAL 350.A O no hydrogen 3.191 N/A ASP 147.A N GLY 107.A O no hydrogen 2.841 N/A LEU 148.A N GLY 348.A O no hydrogen 2.813 N/A TYR 151.A OH THR 182.A OG1 no hydrogen 2.648 N/A LYS 155.A N SER 152.A O no hydrogen 2.977 N/A LYS 155.A NZ ASP 103.A O no hydrogen 3.101 N/A LYS 155.A NZ ASP 149.A O no hydrogen 2.539 N/A LEU 157.A N PRO 153.A O no hydrogen 2.926 N/A ALA 158.A N ALA 154.A O no hydrogen 3.070 N/A VAL 159.A N LYS 155.A O no hydrogen 3.039 N/A PHE 160.A N ALA 156.A O no hydrogen 2.935 N/A LYS 161.A N LEU 157.A O no hydrogen 2.943 N/A LYS 161.A NZ LEU 96.A O no hydrogen 2.887 N/A LYS 161.A NZ ILE 99.A O no hydrogen 2.831 N/A ARG 162.A N ALA 158.A O no hydrogen 3.203 N/A ARG 162.A NH1 THR 104.A OG1 no hydrogen 2.673 N/A ARG 162.A NH1 ALA 381.A O no hydrogen 2.795 N/A ARG 162.A NH2 ALA 102.A O no hydrogen 2.915 N/A LEU 163.A N VAL 159.A O no hydrogen 2.898 N/A MET 164.A N PHE 160.A O no hydrogen 2.801 N/A ARG 165.A N LYS 161.A O no hydrogen 2.970 N/A ARG 166.A N ARG 162.A O no hydrogen 2.948 N/A ARG 166.A N LEU 163.A O no hydrogen 3.274 N/A GLU 167.A N LEU 163.A O no hydrogen 2.821 N/A VAL 168.A N GLU 167.A OE2 no hydrogen 2.910 N/A TYR 171.A N THR 187.A O no hydrogen 2.802 N/A TYR 171.A OH ASP 334.A OD1 no hydrogen 2.364 N/A TRP 172.A N THR 187.A O no hydrogen 3.438 N/A TRP 172.A NE1 ASP 334.A OD2 no hydrogen 3.034 N/A ILE 173.A N ALA 19.A O no hydrogen 3.040 N/A PHE 174.A N GLY 185.A O no hydrogen 3.001 N/A VAL 175.A N LEU 17.A O no hydrogen 2.954 N/A ILE 176.A N PHE 183.A O no hydrogen 2.787 N/A HIS 177.A N PHE 15.A O no hydrogen 2.826 N/A THR 178.A N ARG 181.A O no hydrogen 2.884 N/A THR 178.A OG1 ARG 181.A O no hydrogen 3.171 N/A ARG 181.A N THR 178.A OG1 no hydrogen 3.130 N/A ARG 181.A NH1 GLU 343.A OE2 no hydrogen 2.999 N/A THR 182.A N ILE 344.A O no hydrogen 3.000 N/A THR 182.A OG1 TYR 151.A OH no hydrogen 2.648 N/A PHE 183.A N ILE 176.A O no hydrogen 2.800 N/A VAL 184.A N ALA 342.A O no hydrogen 2.976 N/A GLY 185.A N PHE 174.A O no hydrogen 3.052 N/A ALA 186.A N ARG 340.A O no hydrogen 3.079 N/A THR 187.A N TRP 172.A O no hydrogen 3.024 N/A THR 187.A OG1 ILE 337.A O no hydrogen 2.859 N/A GLU 189.A N THR 187.A OG1 no hydrogen 3.338 N/A ARG 190.A NH1 THR 193.A OG1 no hydrogen 3.060 N/A HIS 191.A N SER 335.A O no hydrogen 2.797 N/A HIS 191.A NE2 THR 287.A OG1 no hydrogen 2.823 N/A LEU 192.A N SER 335.A OG no hydrogen 2.928 N/A THR 193.A N THR 200.A O no hydrogen 3.056 N/A LEU 194.A N LEU 333.A O no hydrogen 2.938 N/A HIS 195.A N CYS 198.A O no hydrogen 3.043 N/A CYS 198.A N HIS 195.A O no hydrogen 2.960 N/A CYS 198.A SG.A GLU 196.A O no hydrogen 3.791 N/A ALA 199.A N GLY 274.A O no hydrogen 2.790 N/A THR 200.A N THR 193.A O no hydrogen 2.921 N/A MET 201.A N ILE 272.A O no hydrogen 2.937 N/A ASN 202.A ND2 GLU 269.A OE2 no hydrogen 2.903 N/A ASN 202.A ND2 TYR 270.A O no hydrogen 2.972 N/A ILE 204.A N GLU 189.A OE1 no hydrogen 3.341 N/A SER 205.A N THR 268.A O no hydrogen 3.243 N/A SER 205.A OG GLU 232.A OE1 no hydrogen 2.901 N/A SER 205.A OG THR 357.A OG1 no hydrogen 3.147 N/A THR 207.A N GLU 229.A OE1 no hydrogen 3.256 N/A THR 207.A OG1 HIS 267.A ND1 no hydrogen 2.902 N/A TYR 208.A N ALA 266.A O no hydrogen 2.845 N/A TYR 210.A N ARG 264.A O no hydrogen 3.029 N/A TYR 210.A OH MET 262.A O no hydrogen 2.807 N/A GLY 214.A N PRO 211.A O no hydrogen 2.847 N/A THR 216.A N TYR 208.A OH no hydrogen 3.076 N/A GLY 219.A N THR 216.A OG1 no hydrogen 2.938 N/A ILE 220.A N THR 216.A O no hydrogen 2.877 N/A ASN 221.A N ILE 217.A O no hydrogen 3.024 N/A ALA 222.A N ASP 218.A O no hydrogen 3.061 N/A PHE 223.A N GLY 219.A O no hydrogen 2.976 N/A LEU 224.A N ILE 220.A O no hydrogen 2.829 N/A GLY 225.A N ASN 221.A O no hydrogen 3.075 N/A GLY 225.A N ALA 222.A O no hydrogen 3.304 N/A ASP 226.A N PHE 223.A O no hydrogen 3.138 N/A ARG 227.A NE ASP 231.A OD1 no hydrogen 3.187 N/A ARG 227.A NE ASP 231.A OD2 no hydrogen 3.251 N/A LYS 228.A N ASP 226.A OD2 no hydrogen 3.051 N/A LYS 228.A NZ GLU 229.A OE2 no hydrogen 3.147 N/A LYS 228.A NZ GLU 232.A OE2 no hydrogen 2.581 N/A LYS 228.A NZ GLU 367.A OE2 no hydrogen 2.702 N/A GLU 229.A N ASP 226.A OD2 no hydrogen 3.491 N/A SER 230.A N ASP 226.A O no hydrogen 2.994 N/A SER 230.A OG.B ASP 226.A O no hydrogen 3.083 N/A ASP 231.A N ARG 227.A O no hydrogen 2.836 N/A GLU 232.A N LYS 228.A O no hydrogen 2.956 N/A LEU 233.A N GLU 229.A O no hydrogen 3.261 N/A TYR 234.A N SER 230.A O no hydrogen 3.156 N/A MET 235.A N ASP 231.A O no hydrogen 2.936 N/A VAL 236.A N GLU 232.A O no hydrogen 3.227 N/A LEU 237.A N LEU 233.A O no hydrogen 3.026 N/A ASP 238.A N TYR 234.A O no hydrogen 2.976 N/A GLU 239.A N MET 235.A O no hydrogen 2.990 N/A GLU 240.A N VAL 236.A O no hydrogen 2.898 N/A LEU 241.A N LEU 237.A O no hydrogen 2.839 N/A LYS 242.A N ASP 238.A O no hydrogen 3.004 N/A LYS 242.A NZ SER 296.A OG no hydrogen 3.305 N/A MET 243.A N GLU 239.A O no hydrogen 3.436 N/A MET 244.A N GLU 240.A O no hydrogen 2.892 N/A ALA 245.A N LEU 241.A O no hydrogen 2.898 N/A ARG 246.A N LYS 242.A O no hydrogen 3.189 N/A ARG 246.A N MET 243.A O no hydrogen 3.121 N/A ARG 246.A NH1 GLU 286.A O no hydrogen 3.128 N/A ILE 247.A N MET 243.A O no hydrogen 3.041 N/A CYS 248.A N MET 244.A O no hydrogen 2.922 N/A CYS 248.A SG HIS 275.A O no hydrogen 3.275 N/A GLY 251.A N CYS 248.A O no hydrogen 2.896 N/A GLN 253.A N VAL 273.A O no hydrogen 2.838 N/A THR 255.A N PHE 271.A O no hydrogen 2.827 N/A HIS 258.A N GLU 269.A O no hydrogen 2.794 N/A HIS 258.A ND1.A GLU 269.A OE1 no hydrogen 2.743 N/A ARG 260.A N HIS 267.A O no hydrogen 2.667 N/A ARG 260.A NE GLU 269.A OE1 no hydrogen 3.052 N/A ARG 260.A NE GLU 269.A OE2 no hydrogen 3.195 N/A ARG 260.A NH1 GLY 169.A O no hydrogen 2.884 N/A ARG 260.A NH2 GLU 269.A OE2 no hydrogen 2.719 N/A MET 262.A N LEU 265.A O no hydrogen 2.808 N/A ALA 263.A N GLU 167.A OE2 no hydrogen 2.700 N/A ALA 266.A N TYR 208.A O no hydrogen 2.948 N/A HIS 267.A N ARG 260.A O no hydrogen 2.832 N/A THR 268.A N GLY 206.A O no hydrogen 3.214 N/A THR 268.A OG1 SER 205.A O no hydrogen 2.689 N/A GLU 269.A N HIS 258.A O no hydrogen 2.977 N/A TYR 270.A N PRO 203.A O no hydrogen 3.047 N/A PHE 271.A N THR 255.A O no hydrogen 2.797 N/A ILE 272.A N MET 201.A O no hydrogen 2.880 N/A VAL 273.A N GLN 253.A O no hydrogen 2.911 N/A GLY 274.A N ALA 199.A O no hydrogen 2.961 N/A THR 276.A N GLY 197.A O no hydrogen 2.888 N/A THR 276.A OG1 ILE 247.A O no hydrogen 2.621 N/A ALA 278.A N THR 276.A OG1 no hydrogen 3.247 N/A ARG 281.A N ASP 279.A OD1 no hydrogen 2.715 N/A ARG 281.A NH1 ASP 279.A OD1 no hydrogen 3.386 N/A LEU 283.A N ASP 279.A O no hydrogen 2.929 N/A LEU 284.A N VAL 280.A O no hydrogen 2.949 N/A ARG 285.A N ARG 281.A O no hydrogen 3.076 N/A ARG 285.A NH2 ASP 282.A OD1 no hydrogen 2.499 N/A GLU 286.A N ASP 282.A O no hydrogen 2.925 N/A THR 287.A N LEU 283.A O no hydrogen 3.163 N/A THR 287.A N LEU 284.A O no hydrogen 3.318 N/A THR 287.A OG1 HIS 191.A NE2 no hydrogen 2.823 N/A THR 287.A OG1 LEU 283.A O no hydrogen 2.781 N/A THR 287.A OG1 LEU 284.A O no hydrogen 3.379 N/A MET 288.A N ARG 285.A O no hydrogen 3.401 N/A THR 292.A OG1 GLU 189.A OE1 no hydrogen 2.949 N/A THR 292.A OG1 GLU 189.A OE2 no hydrogen 3.517 N/A VAL 293.A N ALA 290.A O no hydrogen 3.050 N/A THR 294.A N PRO 291.A O no hydrogen 3.426 N/A THR 294.A OG1 ALA 290.A O no hydrogen 2.862 N/A GLY 295.A N THR 294.A OG1 no hydrogen 2.734 N/A SER 296.A N ASN 137.A O no hydrogen 2.948 N/A SER 300.A OG ALA 134.A O no hydrogen 2.541 N/A ALA 301.A N PRO 297.A O no hydrogen 2.880 N/A THR 302.A N ILE 298.A O no hydrogen 3.092 N/A THR 302.A OG1 GLU 299.A O no hydrogen 2.654 N/A ARG 303.A N GLU 299.A O no hydrogen 3.333 N/A VAL 304.A N SER 300.A O no hydrogen 2.910 N/A ILE 305.A N ALA 301.A O no hydrogen 2.818 N/A ALA 306.A N THR 302.A O no hydrogen 3.051 N/A ARG 307.A N ARG 303.A O no hydrogen 3.036 N/A ARG 307.A NE GLU 129.A OE2 no hydrogen 2.852 N/A ARG 307.A NH2 GLU 129.A OE1 no hydrogen 2.927 N/A HIS 308.A N VAL 304.A O no hydrogen 3.084 N/A HIS 308.A N ILE 305.A O no hydrogen 3.200 N/A HIS 308.A NE2 GLU 129.A OE2 no hydrogen 2.927 N/A GLU 309.A N ILE 305.A O no hydrogen 2.763 N/A ARG 313.A NE GLU 309.A OE1 no hydrogen 2.896 N/A ARG 313.A NE GLU 309.A OE2 no hydrogen 3.391 N/A ARG 313.A NH1 VAL 293.A O no hydrogen 2.971 N/A ARG 313.A NH1 SER 317.A OG no hydrogen 3.010 N/A ARG 313.A NH2 VAL 139.A O no hydrogen 2.898 N/A ARG 313.A NH2 GLU 309.A OE2 no hydrogen 2.810 N/A GLY 314.A N ASP 75.A OD1 no hydrogen 2.757 N/A TYR 315.A N GLU 343.A OE1 no hydrogen 2.840 N/A TYR 315.A OH PRO 78.A O no hydrogen 2.526 N/A TYR 316.A N ARG 313.A O no hydrogen 3.021 N/A SER 317.A N LEU 338.A O no hydrogen 3.086 N/A SER 317.A OG TYR 316.A O no hydrogen 2.424 N/A GLY 318.A N TYR 315.A O no hydrogen 2.856 N/A ILE 319.A N VAL 60.A O no hydrogen 3.294 N/A ALA 320.A N ALA 336.A O no hydrogen 2.905 N/A ALA 321.A N VAL 58.A O no hydrogen 2.832 N/A LEU 322.A N ASP 334.A O no hydrogen 2.721 N/A ILE 323.A N LEU 56.A O no hydrogen 2.848 N/A GLY 324.A N THR 332.A O no hydrogen 2.868 N/A ARG 325.A N ARG 53.A O no hydrogen 2.849 N/A ARG 325.A NH1 GLY 329.A O no hydrogen 2.894 N/A ASP 326.A N GLY 330.A O no hydrogen 2.754 N/A ALA 327.A N ASP 52.A OD1 no hydrogen 3.243 N/A GLY 329.A N ASP 326.A O no hydrogen 2.799 N/A GLY 330.A N ASP 326.A OD1 no hydrogen 2.972 N/A ARG 331.A NH1 GLU 55.A OE2 no hydrogen 2.793 N/A ARG 331.A NH1 GLY 324.A O no hydrogen 2.835 N/A THR 332.A N GLY 324.A O no hydrogen 2.921 N/A LEU 333.A N LEU 194.A O no hydrogen 2.972 N/A ASP 334.A N LEU 322.A O no hydrogen 3.039 N/A SER 335.A OG LEU 192.A O no hydrogen 2.640 N/A ALA 336.A N ALA 320.A O no hydrogen 2.870 N/A ILE 337.A N GLU 189.A O no hydrogen 3.003 N/A LEU 338.A N GLY 318.A O no hydrogen 2.881 N/A ILE 339.A N ILE 337.A O no hydrogen 2.970 N/A ARG 340.A NH1 HIS 267.A NE2 no hydrogen 3.106 N/A ARG 340.A NH2 HIS 267.A NE2 no hydrogen 3.204 N/A THR 341.A OG1 ILE 339.A O no hydrogen 2.777 N/A ALA 342.A N VAL 184.A O no hydrogen 2.795 N/A GLU 343.A N ARG 351.A O no hydrogen 2.919 N/A ILE 344.A N THR 182.A O no hydrogen 2.749 N/A ASP 345.A N HIS 349.A O no hydrogen 3.066 N/A GLY 348.A N ASP 345.A O no hydrogen 2.901 N/A HIS 349.A N ASP 345.A OD1 no hydrogen 2.871 N/A HIS 349.A ND1.B ASP 345.A OD2 no hydrogen 2.655 N/A VAL 350.A N GLY 146.A O no hydrogen 2.799 N/A ARG 351.A N GLU 343.A O no hydrogen 2.907 N/A ILE 352.A N LEU 144.A O no hydrogen 2.782 N/A VAL 354.A N ARG 142.A O no hydrogen 2.772 N/A SER 356.A OG GLU 367.A OE1 no hydrogen 2.803 N/A THR 357.A OG1 SER 205.A OG no hydrogen 3.147 N/A LEU 358.A N PHE 138.A O no hydrogen 2.781 N/A VAL 359.A N SER 362.A OG no hydrogen 2.912 N/A ARG 360.A NH2 ASP 231.A OD2 no hydrogen 2.908 N/A HIS 361.A N HIS 361.A ND1 no hydrogen 2.690 N/A HIS 361.A NE2 ASP 231.A OD2 no hydrogen 2.838 N/A SER 362.A N VAL 359.A O no hydrogen 2.968 N/A SER 362.A OG VAL 359.A O no hydrogen 3.219 N/A SER 362.A OG GLU 367.A OE2 no hydrogen 2.902 N/A SER 366.A N ASP 363.A OD2 no hydrogen 3.005 N/A SER 366.A OG ASP 363.A OD2 no hydrogen 2.626 N/A GLU 367.A N ASP 363.A O no hydrogen 2.904 N/A VAL 368.A N ALA 364.A O no hydrogen 2.988 N/A MET 369.A N VAL 365.A O no hydrogen 3.059 N/A GLU 370.A N SER 366.A O no hydrogen 2.847 N/A THR 371.A N GLU 367.A O no hydrogen 3.094 N/A THR 371.A OG1 VAL 368.A O no hydrogen 2.560 N/A HIS 372.A N VAL 368.A O no hydrogen 3.152 N/A HIS 372.A NE2 ASP 115.A OD1 no hydrogen 2.917 N/A HIS 372.A NE2 ASP 115.A OD2 no hydrogen 2.943 N/A ALA 373.A N MET 369.A O no hydrogen 3.000 N/A LYS 374.A N GLU 370.A O no hydrogen 3.036 N/A LYS 374.A NZ GLY 355.A O no hydrogen 2.859 N/A LYS 374.A NZ GLU 370.A OE2 no hydrogen 3.193 N/A VAL 375.A N THR 371.A O no hydrogen 3.190 N/A ALA 376.A N ALA 373.A O no hydrogen 3.204 N/A SER 379.A N VAL 375.A O no hydrogen 2.816 N/A ASN 380.A N ALA 376.A O no hydrogen 2.875 N/A ALA 381.A N ALA 377.A O no hydrogen 2.955 N/A PHE 382.A N LEU 378.A O no hydrogen 3.242 N/A PHE 382.A N SER 379.A O no hydrogen 3.223 N/A ASP 383.A N SER 379.A O no hydrogen 3.044 N/A GLN 393.A N ALA 390.A O no hydrogen 2.906 N/A HIS 394.A N LEU 391.A O no hydrogen 3.038 N/A SER 396.A N HIS 394.A ND1 no hydrogen 3.074 N/A GLN 398.A N HIS 394.A O no hydrogen 2.969 N/A ALA 399.A N PRO 395.A O no hydrogen 3.008 N/A ALA 400.A N SER 396.A O no hydrogen 3.044 N/A LEU 401.A N VAL 397.A O no hydrogen 2.854 N/A ARG 402.A N GLN 398.A O no hydrogen 3.035 N/A GLU 403.A N ALA 399.A O no hydrogen 3.012 N/A ARG 404.A N LEU 401.A O no hydrogen 3.014 N/A ASN 405.A N ARG 402.A O no hydrogen 3.091 N/A GLU 406.A N GLU 403.A O no hydrogen 3.179 N/A ALA 409.A N VAL 594.A O no hydrogen 2.899 N/A TRP 412.A NE1 GLU 592.A O no hydrogen 2.924 N/A PHE 413.A N ASP 410.A O no hydrogen 3.048 N/A ARG 414.A N PHE 411.A O no hydrogen 3.217 N/A ARG 414.A NE ASP 410.A OD1.B no hydrogen 2.598 N/A ARG 414.A NH2 ASP 410.A OD1.B no hydrogen 2.747 N/A ARG 419.A NH1 PHE 411.A O no hydrogen 3.265 N/A LEU 422.A N ALA 420.A O no hydrogen 2.522 N/A GLY 424.A N GLY 448.A O no hydrogen 2.781 N/A CYS 425.A N LEU 422.A O no hydrogen 2.893 N/A ARG 426.A N ASP 466.A OD1 no hydrogen 2.740 N/A ARG 426.A NH1 ASP 466.A OD2 no hydrogen 3.160 N/A ALA 427.A N ALA 450.A O no hydrogen 2.904 N/A LEU 428.A N VAL 467.A O no hydrogen 3.000 N/A ILE 429.A N GLU 452.A O no hydrogen 2.671 N/A VAL 430.A N VAL 469.A O no hydrogen 2.792 N/A ASP 431.A N CYS 454.A O no hydrogen 2.774 N/A GLU 433.A N ASP 431.A OD1 no hydrogen 2.704 N/A ASP 434.A N ASP 431.A OD1 no hydrogen 3.229 N/A PHE 436.A N ASP 434.A OD1 no hydrogen 2.973 N/A THR 437.A N ASP 434.A O no hydrogen 3.417 N/A THR 437.A OG1 ASP 431.A OD2 no hydrogen 2.358 N/A THR 437.A OG1 ASP 434.A O no hydrogen 3.358 N/A ALA 438.A N HIS 435.A O no hydrogen 2.849 N/A ILE 440.A N PHE 436.A O no hydrogen 2.878 N/A ALA 441.A N THR 437.A O no hydrogen 2.945 N/A GLN 442.A N ALA 438.A O no hydrogen 3.239 N/A GLN 443.A N MET 439.A O no hydrogen 3.150 N/A LEU 444.A N ILE 440.A O no hydrogen 2.818 N/A SER 445.A N ALA 441.A O no hydrogen 2.932 N/A SER 445.A OG ALA 441.A O no hydrogen 3.036 N/A SER 446.A N GLN 442.A O no hydrogen 3.112 N/A SER 446.A OG GLN 443.A O no hydrogen 2.546 N/A LEU 447.A N GLN 443.A O no hydrogen 3.221 N/A LEU 447.A N LEU 444.A O no hydrogen 3.039 N/A GLY 448.A N SER 445.A O no hydrogen 2.804 N/A LEU 449.A N LEU 444.A O no hydrogen 3.177 N/A ALA 450.A N CYS 425.A O no hydrogen 2.934 N/A GLU 452.A N ALA 427.A O no hydrogen 2.949 N/A CYS 454.A N ILE 429.A O no hydrogen 2.839 N/A CYS 454.A SG GLY 455.A O no hydrogen 3.535 N/A GLY 455.A N ASP 458.A OD2 no hydrogen 3.010 N/A VAL 456.A N ASP 431.A O no hydrogen 3.196 N/A ASP 458.A N GLY 455.A O no hydrogen 3.043 N/A ALA 463.A N ASP 461.A OD1 no hydrogen 2.946 N/A ARG 464.A N ASP 461.A O no hydrogen 3.284 N/A TYR 465.A N LEU 462.A O no hydrogen 3.154 N/A TYR 465.A OH GLU 452.A OE1 no hydrogen 2.481 N/A ASP 466.A N ARG 426.A O no hydrogen 2.860 N/A VAL 467.A N ARG 426.A O no hydrogen 3.215 N/A VAL 468.A N PRO 501.A O no hydrogen 3.072 N/A VAL 469.A N LEU 428.A O no hydrogen 2.692 N/A MET 470.A N MET 503.A O no hydrogen 2.947 N/A GLY 471.A N VAL 430.A O no hydrogen 2.994 N/A SER 478.A N ASP 476.A OD2 no hydrogen 2.905 N/A ASP 479.A N ASP 476.A O no hydrogen 2.879 N/A ASP 482.A N ASP 479.A O no hydrogen 3.107 N/A ARG 484.A N ASP 482.A OD1 no hydrogen 2.910 N/A ARG 484.A NE ALA 432.A O no hydrogen 2.966 N/A ARG 484.A NH1 PRO 474.A O no hydrogen 3.179 N/A ARG 484.A NH2 ALA 432.A O no hydrogen 3.042 N/A ARG 484.A NH2 PRO 474.A O no hydrogen 2.646 N/A ILE 485.A N ASP 482.A OD1 no hydrogen 3.147 N/A ALA 486.A N ASP 482.A O no hydrogen 2.832 N/A ARG 487.A N PRO 483.A O no hydrogen 2.922 N/A ARG 487.A NE VAL 456.A O no hydrogen 3.084 N/A ARG 487.A NH2 ASP 458.A O no hydrogen 3.314 N/A LEU 488.A N ARG 484.A O no hydrogen 3.018 N/A TYR 489.A N ILE 485.A O no hydrogen 3.022 N/A TYR 489.A OH PRO 477.A O no hydrogen 2.747 N/A ALA 490.A N ALA 486.A O no hydrogen 3.054 N/A TRP 491.A N ARG 487.A O no hydrogen 2.973 N/A TRP 491.A NE1 VAL 456.A O no hydrogen 2.767 N/A LEU 492.A N LEU 488.A O no hydrogen 2.997 N/A ARG 493.A N TYR 489.A O no hydrogen 2.953 N/A HIS 494.A N ALA 490.A O no hydrogen 3.067 N/A LEU 495.A N TRP 491.A O no hydrogen 2.881 N/A ILE 496.A N LEU 492.A O no hydrogen 2.853 N/A ASP 497.A N ARG 493.A O no hydrogen 3.010 N/A GLU 498.A N HIS 494.A O no hydrogen 2.936 N/A GLY 499.A N ILE 496.A O no hydrogen 3.088 N/A LYS 500.A N LEU 495.A O no hydrogen 3.022 N/A LYS 500.A NZ LEU 462.A O no hydrogen 2.884 N/A LYS 500.A NZ TYR 465.A O no hydrogen 2.655 N/A PHE 502.A N THR 583.A O no hydrogen 3.372 N/A MET 503.A N VAL 468.A O no hydrogen 2.852 N/A ALA 504.A N SER 585.A O no hydrogen 2.866 N/A VAL 505.A N MET 470.A O no hydrogen 2.834 N/A SER 507.A N VAL 505.A O no hydrogen 3.065 N/A SER 507.A OG GLY 471.A O no hydrogen 2.712 N/A HIS 508.A ND1 SER 586.A OG no hydrogen 2.787 N/A GLN 509.A NE2 TYR 548.A O no hydrogen 2.780 N/A GLN 509.A NE2 GLN 588.A OE1 no hydrogen 3.493 N/A ILE 510.A N LEU 506.A O no hydrogen 2.986 N/A LEU 511.A N SER 507.A O no hydrogen 2.899 N/A ASN 512.A N HIS 508.A O no hydrogen 2.913 N/A ASN 512.A ND2 HIS 508.A O no hydrogen 2.736 N/A ALA 513.A N GLN 509.A O no hydrogen 2.971 N/A ILE 514.A N ILE 510.A O no hydrogen 2.864 N/A LEU 515.A N LEU 511.A O no hydrogen 2.914 N/A GLY 516.A N ALA 513.A O no hydrogen 2.948 N/A ILE 517.A N ASN 512.A O no hydrogen 2.787 N/A VAL 520.A N VAL 549.A O no hydrogen 2.846 N/A ARG 522.A N THR 547.A O no hydrogen 2.900 N/A ARG 522.A NE VAL 524.A O no hydrogen 2.821 N/A ARG 522.A NH1 GLU 575.A OE1 no hydrogen 3.220 N/A ARG 522.A NH2 VAL 524.A O no hydrogen 2.907 N/A GLN 527.A NE2 THR 547.A OG1 no hydrogen 2.937 N/A GLY 528.A N PHE 544.A O no hydrogen 2.784 N/A ILE 529.A N PHE 544.A O no hydrogen 3.089 N/A GLN 530.A NE2 GLY 407.A O no hydrogen 2.857 N/A GLN 530.A NE2 LEU 595.A O no hydrogen 2.652 N/A VAL 531.A N VAL 542.A O no hydrogen 2.878 N/A ILE 533.A N GLU 540.A O no hydrogen 2.774 N/A LEU 535.A N GLN 538.A O no hydrogen 2.643 N/A GLY 537.A N ASP 534.A OD2 no hydrogen 3.054 N/A GLN 538.A N LEU 535.A O no hydrogen 2.982 N/A ARG 539.A NH1 GLU 532.A OE1 no hydrogen 3.212 N/A GLU 540.A N ILE 533.A O no hydrogen 2.766 N/A ARG 541.A NE GLN 530.A OE1 no hydrogen 3.014 N/A ARG 541.A NH1 GLU 532.A OE2 no hydrogen 3.055 N/A ARG 541.A NH2 GLN 530.A OE1 no hydrogen 2.922 N/A VAL 542.A N VAL 531.A O no hydrogen 3.000 N/A GLY 543.A N THR 596.A OG1 no hydrogen 2.864 N/A PHE 544.A N ILE 529.A O no hydrogen 2.837 N/A ASN 546.A N ASN 526.A O no hydrogen 2.830 N/A ASN 546.A ND2 TYR 548.A O no hydrogen 2.827 N/A VAL 549.A N VAL 520.A O no hydrogen 2.919 N/A GLN 551.A N PRO 518.A O no hydrogen 2.922 N/A GLN 551.A NE2 THR 573.A O no hydrogen 2.967 N/A THR 552.A N GLY 574.A O no hydrogen 2.858 N/A ARG 554.A N THR 552.A OG1 no hydrogen 3.143 N/A ARG 554.A NE GLU 556.A O no hydrogen 3.131 N/A ARG 554.A NH2 GLU 556.A O no hydrogen 3.244 N/A MET 557.A N VAL 565.A O no hydrogen 2.923 N/A VAL 559.A N GLY 563.A O no hydrogen 2.841 N/A VAL 562.A N VAL 559.A O no hydrogen 3.000 N/A GLY 563.A N VAL 559.A O no hydrogen 2.831 N/A THR 564.A OG1 ASP 558.A OD1 no hydrogen 2.691 N/A VAL 565.A N MET 557.A O no hydrogen 2.728 N/A ALA 566.A N ARG 580.A O no hydrogen 2.913 N/A ILE 567.A N ASP 555.A O no hydrogen 2.976 N/A SER 568.A N ALA 578.A O no hydrogen 2.879 N/A ARG 569.A NE THR 552.A O no hydrogen 2.711 N/A ARG 569.A NH1 ASP 555.A OD2 no hydrogen 3.042 N/A ARG 569.A NH2 THR 552.A O no hydrogen 3.021 N/A ASP 570.A N GLU 575.A O no hydrogen 2.892 N/A ARG 572.A N ASP 570.A OD2 no hydrogen 2.719 N/A GLY 574.A N ASP 570.A O no hydrogen 2.800 N/A GLU 575.A N THR 573.A OG1 no hydrogen 3.120 N/A VAL 576.A N ALA 550.A O no hydrogen 2.775 N/A HIS 577.A N SER 568.A O no hydrogen 2.785 N/A ALA 578.A N SER 568.A O no hydrogen 3.352 N/A LEU 579.A N SER 586.A O no hydrogen 2.962 N/A ARG 580.A N ALA 566.A O no hydrogen 2.796 N/A GLY 581.A N PHE 584.A O no hydrogen 2.910 N/A SER 585.A N PHE 502.A O no hydrogen 3.062 N/A SER 585.A OG ALA 606.A O no hydrogen 2.672 N/A SER 586.A N LEU 579.A O no hydrogen 2.968 N/A SER 586.A OG HIS 508.A ND1 no hydrogen 2.787 N/A MET 587.A N ALA 504.A O no hydrogen 2.888 N/A GLN 588.A N HIS 577.A O no hydrogen 2.849 N/A GLN 588.A NE2 GLN 588.A O no hydrogen 2.887 N/A HIS 590.A N GLY 543.A O no hydrogen 2.809 N/A HIS 590.A ND1 GLU 592.A OE2 no hydrogen 2.684 N/A GLU 592.A N GLU 592.A OE1 no hydrogen 2.753 N/A SER 593.A N HIS 590.A O no hydrogen 3.091 N/A LEU 595.A N SER 593.A OG no hydrogen 2.899 N/A THR 596.A N SER 593.A O no hydrogen 3.121 N/A THR 596.A OG1 HIS 590.A O no hydrogen 2.694 N/A VAL 597.A N ARG 541.A O no hydrogen 2.881 N/A ARG 601.A NE.A GLU 605.A OE2 no hydrogen 3.106 N/A ARG 601.A NE.B ASP 598.A OD2 no hydrogen 3.338 N/A ARG 601.A NH1.B GLU 540.A OE2 no hydrogen 3.036 N/A ARG 601.A NH1.B GLU 605.A OE2 no hydrogen 3.187 N/A ARG 601.A NH2.A GLU 540.A OE1 no hydrogen 2.982 N/A ARG 601.A NH2.B GLU 540.A OE1 no hydrogen 2.894 N/A ARG 601.A NH2.B GLU 540.A OE2 no hydrogen 3.426 N/A ARG 601.A NH2.B ASP 598.A OD2 no hydrogen 2.869 N/A ILE 602.A N ASP 598.A O no hydrogen 3.154 N/A LEU 603.A N GLY 599.A O no hydrogen 2.858 N/A GLY 604.A N PRO 600.A O no hydrogen 2.891 N/A GLU 605.A N ARG 601.A O no hydrogen 2.899 N/A ALA 606.A N ILE 602.A O no hydrogen 2.973 N/A ILE 607.A N LEU 603.A O no hydrogen 2.940 N/A THR 608.A N GLY 604.A O no hydrogen 2.920 N/A THR 608.A OG1 GLY 604.A O no hydrogen 2.913 N/A HIS 609.A N GLU 605.A O no hydrogen 2.986 N/A HIS 609.A NE2 GLY 581.A O no hydrogen 2.653 N/A ALA 610.A N ALA 606.A O no hydrogen 3.027 N/A ILE 611.A N ILE 607.A O no hydrogen 3.161 N/A ARG 612.A N HIS 609.A O no hydrogen 3.071 N/A ARG 612.A NH1 GLY 581.A O no hydrogen 3.386 N/A GLU 614.A N ILE 611.A O no hydrogen 2.988 N/A