Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4at9_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 3.A N GLY 1.A O no hydrogen 2.438 N/A TYR 9.A N ASP 7.A OD1 no hydrogen 3.396 N/A LEU 10.A N ASP 7.A O no hydrogen 3.015 N/A CYS 11.A SG ASP 7.A O no hydrogen 3.686 N/A ALA 14.A N CYS 11.A O no hydrogen 3.184 N/A PHE 15.A N GLU 12.A O no hydrogen 3.042 N/A SER 28.A N GLU 24.A O no hydrogen 3.208 N/A GLU 29.A N THR 25.A O no hydrogen 2.906 N/A ALA 30.A N SER 26.A O no hydrogen 2.897 N/A LEU 31.A N PHE 27.A O no hydrogen 2.950 N/A LEU 32.A N SER 28.A O no hydrogen 3.167 N/A LYS 33.A N GLU 29.A O no hydrogen 2.911 N/A ARG 34.A N ALA 30.A O no hydrogen 2.979 N/A ARG 34.A NE LEU 301.A O no hydrogen 2.671 N/A ASN 35.A N LEU 31.A O no hydrogen 3.219 N/A GLN 36.A N LEU 32.A O no hydrogen 3.039 N/A GLN 36.A N LYS 33.A O no hydrogen 3.132 N/A ASP 37.A N LYS 33.A O no hydrogen 2.993 N/A LEU 38.A N ARG 34.A O no hydrogen 3.027 N/A ALA 39.A N ASN 35.A O no hydrogen 2.961 N/A ASN 41.A N GLU 44.A OE1 no hydrogen 3.092 N/A GLU 44.A N ASN 41.A OD1 no hydrogen 2.687 N/A SER 47.A N ALA 43.A O no hydrogen 3.390 N/A SER 47.A OG ALA 43.A O no hydrogen 2.710 N/A SER 47.A OG GLU 44.A O no hydrogen 2.823 N/A ILE 48.A N GLU 44.A O no hydrogen 3.193 N/A LEU 49.A N GLN 45.A O no hydrogen 3.086 N/A SER 50.A N ALA 46.A O no hydrogen 2.884 N/A LEU 51.A N SER 47.A O no hydrogen 3.106 N/A VAL 52.A N ILE 48.A O no hydrogen 2.734 N/A THR 53.A N LEU 49.A O no hydrogen 3.038 N/A THR 53.A OG1 LEU 49.A O no hydrogen 3.074 N/A LYS 54.A N SER 50.A O no hydrogen 3.108 N/A LYS 54.A NZ GLU 127.A OE1 no hydrogen 2.321 N/A LYS 54.A NZ GLU 127.A OE2 no hydrogen 3.167 N/A ILE 55.A N LEU 51.A O no hydrogen 3.102 N/A ASN 56.A N VAL 52.A O no hydrogen 3.054 N/A ASN 57.A N THR 53.A O no hydrogen 2.884 N/A VAL 58.A N LYS 54.A O no hydrogen 3.147 N/A ILE 59.A N ILE 55.A O no hydrogen 3.021 N/A ASP 60.A N ASN 56.A O no hydrogen 2.791 N/A ASN 61.A N ASN 57.A O no hydrogen 2.873 N/A LEU 62.A N VAL 58.A O no hydrogen 3.051 N/A ILE 63.A N ASP 60.A O no hydrogen 2.994 N/A VAL 64.A N ASP 60.A O no hydrogen 3.239 N/A ALA 65.A N ASN 61.A O no hydrogen 2.681 N/A PHE 69.A N PRO 66.A O no hydrogen 3.194 N/A GLU 74.A N ILE 99.A O no hydrogen 2.892 N/A GLU 75.A N ILE 99.A O no hydrogen 3.474 N/A ARG 77.A N VAL 97.A O no hydrogen 3.007 N/A ARG 77.A NE GLU 75.A OE2 no hydrogen 2.604 N/A VAL 79.A N ASP 95.A O no hydrogen 3.172 N/A LYS 84.A N GLY 80.A O no hydrogen 3.063 N/A GLY 85.A N SER 81.A O no hydrogen 2.868 N/A THR 86.A N SER 81.A O no hydrogen 3.115 N/A THR 89.A N LEU 38.A O no hydrogen 2.780 N/A THR 89.A OG1 GLU 44.A OE1 no hydrogen 2.845 N/A THR 89.A OG1 GLU 44.A OE2 no hydrogen 3.548 N/A GLY 90.A N GLU 44.A OE2 no hydrogen 3.014 N/A HIS 91.A N THR 88.A O no hydrogen 3.361 N/A ASN 92.A ND2 GLU 44.A O no hydrogen 3.214 N/A ASN 92.A ND2 ASP 144.A O no hydrogen 2.794 N/A VAL 93.A N HIS 91.A O no hydrogen 2.989 N/A ALA 94.A N THR 146.A O no hydrogen 2.914 N/A LEU 96.A N LYS 148.A O no hydrogen 2.611 N/A VAL 97.A N ARG 77.A O no hydrogen 2.917 N/A VAL 98.A N LEU 150.A O no hydrogen 2.784 N/A ILE 99.A N GLU 75.A O no hydrogen 2.991 N/A LEU 100.A N THR 152.A O no hydrogen 2.916 N/A LYS 101.A N GLN 72.A O no hydrogen 2.693 N/A ALA 108.A N THR 105.A OG1 no hydrogen 3.245 N/A VAL 109.A N THR 105.A O no hydrogen 3.197 N/A ALA 111.A N GLU 107.A O no hydrogen 2.956 N/A LEU 112.A N ALA 108.A O no hydrogen 2.832 N/A GLY 113.A N VAL 109.A O no hydrogen 3.418 N/A ASN 114.A N ALA 110.A O no hydrogen 2.995 N/A LYS 115.A N ALA 111.A O no hydrogen 2.949 N/A VAL 116.A N LEU 112.A O no hydrogen 2.841 N/A VAL 117.A N GLY 113.A O no hydrogen 3.117 N/A GLU 118.A N ASN 114.A O no hydrogen 3.157 N/A SER 119.A N LYS 115.A O no hydrogen 3.264 N/A SER 119.A N VAL 116.A O no hydrogen 3.068 N/A SER 119.A OG LYS 115.A O no hydrogen 3.043 N/A LEU 120.A N VAL 116.A O no hydrogen 3.197 N/A ARG 121.A N VAL 117.A O no hydrogen 2.998 N/A ARG 121.A NH2 LEU 129.A O no hydrogen 2.842 N/A ALA 122.A N GLU 118.A O no hydrogen 3.043 N/A GLN 123.A N SER 119.A O no hydrogen 3.192 N/A ASP 124.A N LEU 120.A O no hydrogen 2.867 N/A SER 126.A OG ASP 124.A OD1 no hydrogen 2.515 N/A THR 130.A N SER 141.A O no hydrogen 3.057 N/A LEU 132.A N GLU 139.A O no hydrogen 3.024 N/A ASN 134.A N GLY 137.A O no hydrogen 2.888 N/A THR 136.A N ASN 134.A OD1 no hydrogen 2.682 N/A THR 136.A OG1 ASN 134.A OD1 no hydrogen 2.354 N/A PHE 138.A N ILE 149.A O no hydrogen 3.320 N/A GLU 139.A N LEU 132.A O no hydrogen 2.561 N/A ILE 140.A N VAL 147.A O no hydrogen 3.085 N/A SER 141.A N THR 130.A O no hydrogen 3.066 N/A SER 142.A N ALA 145.A O no hydrogen 2.748 N/A SER 142.A OG ALA 145.A O no hydrogen 3.235 N/A THR 146.A N ASN 92.A O no hydrogen 3.056 N/A VAL 147.A N ILE 140.A O no hydrogen 2.796 N/A LYS 148.A N ALA 94.A O no hydrogen 2.650 N/A ILE 149.A N PHE 138.A O no hydrogen 2.965 N/A LEU 150.A N LEU 96.A O no hydrogen 2.497 N/A ILE 151.A N THR 136.A O no hydrogen 3.079 N/A THR 152.A N VAL 98.A O no hydrogen 3.097 N/A THR 152.A OG1 LEU 172.A O no hydrogen 2.453 N/A THR 153.A OG1 LEU 100.A O no hydrogen 2.770 N/A THR 153.A OG1 ILE 102.A O no hydrogen 3.061 N/A VAL 154.A N LEU 100.A O no hydrogen 3.390 N/A ASN 157.A N VAL 154.A O no hydrogen 2.710 N/A LEU 158.A N PRO 155.A O no hydrogen 2.444 N/A LYS 160.A N ASN 157.A O no hydrogen 3.314 N/A ASP 162.A N HIS 166.A ND1 no hydrogen 2.760 N/A GLU 164.A N ASP 162.A OD2 no hydrogen 3.284 N/A LEU 165.A N ASP 162.A O no hydrogen 3.106 N/A HIS 166.A N ASP 162.A O no hydrogen 3.121 N/A LEU 167.A N PRO 104.A O no hydrogen 3.243 N/A LEU 172.A N ASP 168.A O no hydrogen 3.242 N/A GLN 173.A N ILE 169.A O no hydrogen 2.956 N/A SER 174.A N LYS 170.A O no hydrogen 2.955 N/A SER 174.A OG LYS 170.A O no hydrogen 2.771 N/A ALA 175.A N VAL 171.A O no hydrogen 3.316 N/A LEU 176.A N LEU 172.A O no hydrogen 3.347 N/A ALA 177.A N GLN 173.A O no hydrogen 3.074 N/A ALA 178.A N SER 174.A O no hydrogen 3.020 N/A ILE 179.A N ALA 175.A O no hydrogen 3.301 N/A ILE 179.A N LEU 176.A O no hydrogen 2.957 N/A ARG 180.A N LEU 176.A O no hydrogen 3.275 N/A ARG 180.A NE CYS 262.A O no hydrogen 2.800 N/A ARG 180.A NH2 CYS 262.A O no hydrogen 3.341 N/A ARG 180.A NH2 GLU 263.A OE2 no hydrogen 2.812 N/A HIS 181.A N ALA 177.A O no hydrogen 2.952 N/A ALA 182.A N ALA 178.A O no hydrogen 3.146 N/A ARG 183.A N ILE 179.A O no hydrogen 3.048 N/A TRP 184.A N ARG 180.A O no hydrogen 2.891 N/A PHE 185.A N HIS 181.A O no hydrogen 2.667 N/A GLU 186.A N ALA 182.A O no hydrogen 2.781 N/A GLU 187.A N ARG 183.A O no hydrogen 3.050 N/A ASN 188.A N TRP 184.A O no hydrogen 2.574 N/A ASN 188.A ND2 TRP 184.A O no hydrogen 2.728 N/A ALA 189.A N PHE 185.A O no hydrogen 2.744 N/A SER 190.A OG PHE 185.A O no hydrogen 3.567 N/A SER 190.A OG GLU 186.A O no hydrogen 2.271 N/A GLN 191.A N ALA 189.A O no hydrogen 2.736 N/A LYS 195.A N GLN 191.A O no hydrogen 3.142 N/A VAL 196.A N SER 192.A O no hydrogen 3.312 N/A LEU 197.A N THR 193.A O no hydrogen 2.873 N/A ILE 198.A N VAL 194.A O no hydrogen 2.980 N/A ARG 199.A N LYS 195.A O no hydrogen 3.350 N/A ARG 199.A NE MET 87.A O no hydrogen 2.877 N/A ARG 199.A NH1 ASN 35.A OD1 no hydrogen 2.720 N/A ARG 199.A NH2 MET 87.A O no hydrogen 2.948 N/A LEU 200.A N VAL 196.A O no hydrogen 3.272 N/A LEU 201.A N LEU 197.A O no hydrogen 2.706 N/A LYS 202.A N ILE 198.A O no hydrogen 3.073 N/A ASP 203.A N ARG 199.A O no hydrogen 3.367 N/A LEU 204.A N LEU 200.A O no hydrogen 2.879 N/A ARG 205.A N LEU 201.A O no hydrogen 2.988 N/A ARG 205.A NE GLU 212.A O no hydrogen 2.943 N/A ARG 205.A NE LEU 214.A O no hydrogen 2.872 N/A ARG 205.A NH2 GLU 212.A O no hydrogen 2.947 N/A ILE 206.A N ASP 203.A O no hydrogen 3.102 N/A ARG 207.A N ASP 203.A O no hydrogen 3.165 N/A ARG 207.A NE ASP 203.A OD2 no hydrogen 3.209 N/A ARG 207.A NH2 ILE 300.A O no hydrogen 2.721 N/A PHE 208.A N LEU 204.A O no hydrogen 2.929 N/A PHE 211.A N PHE 208.A O no hydrogen 2.853 N/A GLU 212.A N PRO 209.A O no hydrogen 3.160 N/A LEU 214.A N PHE 211.A O no hydrogen 2.947 N/A ILE 218.A N THR 215.A OG1 no hydrogen 3.283 N/A LEU 219.A N THR 215.A O no hydrogen 2.933 N/A ASP 220.A N PRO 216.A O no hydrogen 2.984 N/A LEU 221.A N TRP 217.A O no hydrogen 3.097 N/A LEU 222.A N ILE 218.A O no hydrogen 2.782 N/A GLY 223.A N LEU 219.A O no hydrogen 2.861 N/A HIS 224.A N ASP 220.A O no hydrogen 3.130 N/A TYR 225.A N LEU 221.A O no hydrogen 3.071 N/A TYR 225.A OH ASP 7.A OD2 no hydrogen 2.797 N/A ALA 226.A N LEU 222.A O no hydrogen 2.873 N/A VAL 227.A N GLY 223.A O no hydrogen 3.026 N/A VAL 227.A N HIS 224.A O no hydrogen 3.220 N/A MET 228.A N HIS 224.A O no hydrogen 2.779 N/A ASN 229.A N TYR 225.A O no hydrogen 3.177 N/A ASN 230.A ND2 GLN 232.A O no hydrogen 3.332 N/A LEU 234.A N VAL 227.A O no hydrogen 2.864 N/A VAL 238.A N ALA 235.A O no hydrogen 2.850 N/A ARG 240.A N ASN 237.A O no hydrogen 3.344 N/A ARG 241.A N VAL 238.A O no hydrogen 2.926 N/A ARG 241.A NE ASP 7.A OD1 no hydrogen 3.489 N/A ARG 241.A NE ASP 7.A OD2 no hydrogen 3.415 N/A ARG 241.A NH1 ALA 226.A O no hydrogen 3.008 N/A ARG 241.A NH1 ASN 229.A O no hydrogen 3.126 N/A ARG 241.A NH2 ASP 7.A OD2 no hydrogen 3.139 N/A ARG 241.A NH2 ASN 229.A O no hydrogen 2.614 N/A CYS 242.A N TYR 239.A O no hydrogen 3.252 N/A CYS 242.A SG LEU 222.A O no hydrogen 4.026 N/A LEU 243.A N TYR 239.A O no hydrogen 3.459 N/A GLN 244.A N ARG 240.A O no hydrogen 3.005 N/A ILE 245.A N ARG 241.A O no hydrogen 3.008 N/A LEU 246.A N CYS 242.A O no hydrogen 3.383 N/A ALA 247.A N LEU 243.A O no hydrogen 2.986 N/A ALA 248.A N GLN 244.A O no hydrogen 3.055 N/A GLY 249.A N LEU 246.A O no hydrogen 3.265 N/A LEU 250.A N ILE 245.A O no hydrogen 3.073 N/A SER 255.A N LEU 252.A O no hydrogen 3.188 N/A SER 255.A OG LEU 250.A O no hydrogen 2.654 N/A VAL 256.A N HIS 3.A O no hydrogen 2.648 N/A GLY 257.A N SER 255.A OG no hydrogen 2.909 N/A ASP 260.A N PHE 267.A O no hydrogen 2.765 N/A CYS 262.A N ASP 260.A OD1 no hydrogen 2.811 N/A CYS 262.A SG ARG 180.A O no hydrogen 3.480 N/A CYS 262.A SG HIS 181.A ND1 no hydrogen 3.588 N/A GLU 263.A N ASP 260.A O no hydrogen 3.442 N/A ARG 268.A NH1 SER 255.A O no hydrogen 2.669 N/A VAL 269.A N ILE 258.A O no hydrogen 3.024 N/A THR 271.A N ARG 268.A O no hydrogen 2.759 N/A THR 271.A OG1 ARG 268.A O no hydrogen 2.705 N/A MET 273.A N HIS 270.A O no hydrogen 3.407 N/A THR 274.A N GLN 277.A OE1 no hydrogen 2.784 N/A GLN 277.A N THR 274.A OG1 no hydrogen 3.192 N/A GLN 278.A N THR 274.A O no hydrogen 2.837 N/A GLN 278.A NE2 HIS 270.A O no hydrogen 3.388 N/A GLN 278.A NE2 MET 273.A O no hydrogen 3.216 N/A ASP 279.A N LEU 275.A O no hydrogen 3.113 N/A MET 280.A N GLU 276.A O no hydrogen 3.012 N/A VAL 281.A N GLN 277.A O no hydrogen 2.812 N/A CYS 282.A N GLN 278.A O no hydrogen 2.962 N/A CYS 282.A SG LEU 246.A O no hydrogen 3.432 N/A CYS 282.A SG ALA 247.A O no hydrogen 3.861 N/A TYR 283.A N ASP 279.A O no hydrogen 2.913 N/A THR 284.A N MET 280.A O no hydrogen 2.950 N/A THR 284.A N VAL 281.A O no hydrogen 3.240 N/A THR 284.A OG1 MET 280.A O no hydrogen 2.412 N/A ALA 285.A N VAL 281.A O no hydrogen 3.028 N/A GLN 286.A N CYS 282.A O no hydrogen 2.823 N/A GLN 286.A NE2 ALA 247.A O no hydrogen 2.564 N/A THR 287.A N TYR 283.A O no hydrogen 3.310 N/A THR 287.A N THR 284.A O no hydrogen 3.195 N/A THR 287.A OG1 TYR 283.A O no hydrogen 3.194 N/A LEU 288.A N THR 284.A O no hydrogen 3.115 N/A VAL 289.A N ALA 285.A O no hydrogen 2.857 N/A ARG 290.A N GLN 286.A O no hydrogen 3.433 N/A ARG 290.A NH2 SER 325.A OG no hydrogen 3.111 N/A ILE 291.A N THR 287.A O no hydrogen 2.874 N/A LEU 292.A N LEU 288.A O no hydrogen 3.001 N/A SER 293.A N VAL 289.A O no hydrogen 3.378 N/A SER 293.A N ARG 290.A O no hydrogen 3.265 N/A SER 293.A OG VAL 289.A O no hydrogen 3.329 N/A HIS 294.A N ARG 290.A O no hydrogen 3.377 N/A GLY 295.A N LEU 292.A O no hydrogen 3.068 N/A GLY 296.A N ILE 291.A O no hydrogen 3.012 N/A LYS 299.A NZ GLU 304.A O no hydrogen 3.105 N/A LYS 299.A NZ ASP 306.A O no hydrogen 3.039 N/A ILE 300.A N GLY 296.A O no hydrogen 3.108 N/A LEU 301.A N PHE 297.A O no hydrogen 2.966 N/A GLY 302.A N LYS 299.A O no hydrogen 2.961 N/A GLN 303.A N ARG 298.A O no hydrogen 2.842 N/A GLN 303.A NE2 ALA 30.A O no hydrogen 3.501 N/A ALA 307.A N ASP 306.A OD1 no hydrogen 3.211 N/A SER 308.A OG ASP 306.A OD2 no hydrogen 3.090 N/A LEU 310.A N ALA 307.A O no hydrogen 2.825 N/A SER 312.A N TYR 309.A O no hydrogen 2.938 N/A GLU 313.A N TYR 309.A O no hydrogen 2.735 N/A SER 315.A N VAL 322.A O no hydrogen 3.045 N/A SER 315.A OG GLU 313.A O no hydrogen 3.434 N/A TRP 317.A N VAL 320.A O no hydrogen 2.543 N/A VAL 320.A N TRP 317.A O no hydrogen 3.116 N/A VAL 322.A N SER 315.A O no hydrogen 2.568 N/A SER 325.A N THR 287.A OG1 no hydrogen 2.960 N/A ALA 328.A N ASP 279.A OD2 no hydrogen 2.943 N/A TYR 329.A N ASP 279.A OD2 no hydrogen 3.078 N/A