Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3zpr_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 5.A N GLY 1.A O no hydrogen 3.064 N/A SER 6.A N ALA 2.A O no hydrogen 2.994 N/A GLN 7.A N GLU 3.A O no hydrogen 2.924 N/A GLN 8.A N LEU 4.A O no hydrogen 2.977 N/A TRP 9.A N LEU 5.A O no hydrogen 3.178 N/A GLU 10.A N SER 6.A O no hydrogen 2.748 N/A ALA 11.A N GLN 7.A O no hydrogen 3.227 N/A GLY 12.A N GLN 8.A O no hydrogen 3.112 N/A MET 13.A N TRP 9.A O no hydrogen 2.827 N/A SER 14.A N GLU 10.A O no hydrogen 3.003 N/A SER 14.A OG GLU 10.A O no hydrogen 2.592 N/A LEU 15.A N ALA 11.A O no hydrogen 3.334 N/A LEU 16.A N GLY 12.A O no hydrogen 3.228 N/A MET 17.A N MET 13.A O no hydrogen 2.753 N/A ALA 18.A N SER 14.A O no hydrogen 2.974 N/A LEU 19.A N LEU 15.A O no hydrogen 2.823 N/A VAL 20.A N LEU 16.A O no hydrogen 3.035 N/A VAL 21.A N MET 17.A O no hydrogen 2.943 N/A LEU 22.A N ALA 18.A O no hydrogen 2.881 N/A LEU 23.A N LEU 19.A O no hydrogen 2.869 N/A ILE 24.A N VAL 20.A O no hydrogen 2.953 N/A VAL 25.A N VAL 21.A O no hydrogen 2.770 N/A ALA 26.A N LEU 22.A O no hydrogen 2.844 N/A GLY 27.A N LEU 23.A O no hydrogen 3.006 N/A ASN 28.A N ILE 24.A O no hydrogen 3.349 N/A ASN 28.A ND2 ILE 24.A O no hydrogen 2.797 N/A ASN 28.A ND2 SER 262.A O no hydrogen 2.801 N/A VAL 29.A N VAL 25.A O no hydrogen 2.985 N/A LEU 30.A N ALA 26.A O no hydrogen 2.937 N/A VAL 31.A N GLY 27.A O no hydrogen 3.131 N/A ILE 32.A N ASN 28.A O no hydrogen 2.947 N/A ALA 33.A N VAL 29.A O no hydrogen 2.761 N/A ALA 34.A N LEU 30.A O no hydrogen 2.841 N/A ILE 35.A N VAL 31.A O no hydrogen 3.185 N/A GLY 36.A N ILE 32.A O no hydrogen 2.948 N/A SER 37.A N ALA 34.A O no hydrogen 3.302 N/A SER 37.A OG ALA 33.A O no hydrogen 2.967 N/A SER 37.A OG ALA 34.A O no hydrogen 3.504 N/A THR 38.A OG1 ALA 34.A O no hydrogen 2.902 N/A LEU 41.A N THR 38.A O no hydrogen 2.790 N/A GLN 42.A N GLN 39.A O no hydrogen 3.247 N/A THR 45.A OG1 ASP 107.A OD2 no hydrogen 2.848 N/A ASN 46.A N THR 43.A O no hydrogen 3.115 N/A ASN 46.A N THR 43.A OG1 no hydrogen 3.281 N/A ASN 46.A ND2 LEU 41.A O no hydrogen 2.537 N/A LEU 47.A N THR 43.A O no hydrogen 3.349 N/A LEU 47.A N LEU 44.A O no hydrogen 2.912 N/A ILE 49.A N THR 45.A O no hydrogen 3.156 N/A THR 50.A N ASN 46.A O no hydrogen 2.949 N/A THR 50.A OG1 ASN 46.A O no hydrogen 2.909 N/A SER 51.A N LEU 47.A O no hydrogen 3.231 N/A LEU 52.A N PHE 48.A O no hydrogen 3.196 N/A ALA 53.A N ILE 49.A O no hydrogen 2.910 N/A CYS 54.A N THR 50.A O no hydrogen 2.864 N/A CYS 54.A SG THR 50.A O no hydrogen 3.351 N/A ALA 55.A N SER 51.A O no hydrogen 3.071 N/A ASP 56.A N LEU 52.A O no hydrogen 3.083 N/A LEU 57.A N ALA 53.A O no hydrogen 2.717 N/A VAL 58.A N CYS 54.A O no hydrogen 2.908 N/A VAL 59.A N ALA 55.A O no hydrogen 3.153 N/A GLY 60.A N ASP 56.A O no hydrogen 2.991 N/A LEU 61.A N LEU 57.A O no hydrogen 2.877 N/A LEU 62.A N VAL 58.A O no hydrogen 3.020 N/A VAL 63.A N VAL 58.A O no hydrogen 3.287 N/A VAL 64.A N VAL 59.A O no hydrogen 2.698 N/A GLY 67.A N VAL 63.A O no hydrogen 3.136 N/A ALA 68.A N VAL 64.A O no hydrogen 2.694 N/A THR 69.A N PRO 65.A O no hydrogen 2.999 N/A THR 69.A OG1 PHE 66.A O no hydrogen 2.607 N/A LEU 70.A N PHE 66.A O no hydrogen 3.268 N/A VAL 71.A N GLY 67.A O no hydrogen 3.008 N/A VAL 72.A N ALA 68.A O no hydrogen 2.787 N/A ARG 73.A N THR 69.A O no hydrogen 3.030 N/A GLY 74.A N LEU 70.A O no hydrogen 3.057 N/A TRP 76.A N GLY 166.A O no hydrogen 2.811 N/A TRP 76.A NE1 GLY 79.A O no hydrogen 2.655 N/A TRP 78.A NE1 THR 69.A OG1 no hydrogen 3.070 N/A CYS 83.A N GLY 79.A O no hydrogen 3.160 N/A GLU 84.A N SER 80.A O no hydrogen 3.190 N/A LEU 85.A N PHE 81.A O no hydrogen 2.826 N/A TRP 86.A N LEU 82.A O no hydrogen 2.822 N/A TRP 86.A NE1 VAL 63.A O no hydrogen 2.805 N/A THR 87.A N CYS 83.A O no hydrogen 3.012 N/A THR 87.A OG1 CYS 83.A O no hydrogen 2.819 N/A SER 88.A N GLU 84.A O no hydrogen 2.950 N/A SER 88.A OG GLU 84.A O no hydrogen 3.037 N/A LEU 89.A N LEU 85.A O no hydrogen 2.922 N/A ASP 90.A N TRP 86.A O no hydrogen 2.945 N/A VAL 91.A N THR 87.A O no hydrogen 2.921 N/A LEU 92.A N SER 88.A O no hydrogen 2.792 N/A CYS 93.A N LEU 89.A O no hydrogen 3.080 N/A CYS 93.A SG ALA 55.A O no hydrogen 3.528 N/A CYS 93.A SG LEU 89.A O no hydrogen 3.326 N/A VAL 94.A N ASP 90.A O no hydrogen 3.401 N/A THR 95.A N VAL 91.A O no hydrogen 3.138 N/A THR 95.A OG1 VAL 91.A O no hydrogen 3.031 N/A THR 95.A OG1 SER 184.A OG no hydrogen 2.801 N/A ALA 96.A N LEU 92.A O no hydrogen 2.782 N/A SER 97.A N CYS 93.A O no hydrogen 2.915 N/A SER 97.A OG CYS 93.A O no hydrogen 2.820 N/A ILE 98.A N VAL 94.A O no hydrogen 3.144 N/A GLU 99.A N THR 95.A O no hydrogen 2.946 N/A THR 100.A N ALA 96.A O no hydrogen 2.962 N/A THR 100.A OG1 ALA 96.A O no hydrogen 2.742 N/A LEU 101.A N SER 97.A O no hydrogen 2.947 N/A CYS 102.A N ILE 98.A O no hydrogen 3.078 N/A CYS 102.A SG PRO 188.A O no hydrogen 3.690 N/A VAL 103.A N GLU 99.A O no hydrogen 2.994 N/A ILE 104.A N THR 100.A O no hydrogen 2.942 N/A ALA 105.A N LEU 101.A O no hydrogen 2.998 N/A ILE 106.A N CYS 102.A O no hydrogen 3.050 N/A ASP 107.A N VAL 103.A O no hydrogen 2.715 N/A ARG 108.A N ILE 104.A O no hydrogen 2.969 N/A ARG 108.A NE ASP 107.A OD2 no hydrogen 3.082 N/A ARG 108.A NH2 ASP 107.A OD2 no hydrogen 2.928 N/A TYR 109.A N ALA 105.A O no hydrogen 3.013 N/A LEU 110.A N ILE 106.A O no hydrogen 2.923 N/A ALA 111.A N ASP 107.A O no hydrogen 2.953 N/A ILE 112.A N ARG 108.A O no hydrogen 2.848 N/A THR 113.A N TYR 109.A O no hydrogen 3.074 N/A THR 113.A OG1 TYR 109.A O no hydrogen 3.057 N/A SER 114.A N LEU 110.A O no hydrogen 2.946 N/A TYR 118.A N SER 114.A O no hydrogen 2.821 N/A TYR 118.A OH ASP 107.A OD1 no hydrogen 2.614 N/A GLN 119.A N PRO 115.A O no hydrogen 2.930 N/A SER 120.A N PHE 116.A O no hydrogen 3.280 N/A SER 120.A OG PHE 116.A O no hydrogen 3.549 N/A SER 120.A OG ARG 117.A O no hydrogen 3.374 N/A LEU 121.A N ARG 117.A O no hydrogen 2.939 N/A MET 122.A N TYR 118.A O no hydrogen 2.872 N/A ARG 124.A NH1 GLN 42.A O no hydrogen 3.235 N/A ARG 124.A NH2 GLN 42.A O no hydrogen 2.374 N/A ARG 126.A N THR 123.A OG1 no hydrogen 3.414 N/A ARG 126.A NH1 LEU 121.A O no hydrogen 2.509 N/A ALA 127.A N THR 123.A O no hydrogen 2.877 N/A LYS 128.A N ARG 124.A O no hydrogen 2.962 N/A VAL 129.A N ALA 125.A O no hydrogen 3.109 N/A ILE 130.A N ARG 126.A O no hydrogen 2.731 N/A ILE 131.A N ALA 127.A O no hydrogen 2.940 N/A CYS 132.A N LYS 128.A O no hydrogen 3.027 N/A CYS 132.A SG LYS 128.A O no hydrogen 3.451 N/A THR 133.A N VAL 129.A O no hydrogen 2.864 N/A THR 133.A OG1 VAL 129.A O no hydrogen 2.821 N/A VAL 134.A N ILE 130.A O no hydrogen 3.024 N/A TRP 135.A N ILE 131.A O no hydrogen 3.138 N/A TRP 135.A NE1 SER 51.A OG no hydrogen 2.974 N/A ALA 136.A N CYS 132.A O no hydrogen 2.779 N/A ILE 137.A N THR 133.A O no hydrogen 2.905 N/A SER 138.A N VAL 134.A O no hydrogen 2.951 N/A SER 138.A OG GLU 99.A OE1 no hydrogen 3.049 N/A SER 138.A OG VAL 134.A O no hydrogen 2.770 N/A ALA 139.A N TRP 135.A O no hydrogen 2.771 N/A LEU 140.A N ALA 136.A O no hydrogen 2.820 N/A VAL 141.A N ILE 137.A O no hydrogen 3.090 N/A SER 142.A N ALA 139.A O no hydrogen 3.185 N/A SER 142.A OG SER 138.A O no hydrogen 2.795 N/A PHE 143.A N ALA 139.A O no hydrogen 2.982 N/A MET 147.A N PHE 143.A O no hydrogen 2.839 N/A MET 148.A N LEU 144.A O no hydrogen 2.826 N/A HIS 149.A N ILE 146.A O no hydrogen 3.200 N/A TRP 150.A N PRO 145.A O no hydrogen 3.123 N/A TRP 151.A NE1 ILE 146.A O no hydrogen 3.113 N/A ARG 152.A N HIS 149.A O no hydrogen 3.270 N/A ASP 153.A N TYR 162.A OH no hydrogen 2.916 N/A ASP 155.A N ASP 153.A OD2 no hydrogen 3.375 N/A GLN 157.A N ASP 155.A OD1 no hydrogen 2.582 N/A LEU 159.A N ASP 155.A O no hydrogen 2.768 N/A LYS 160.A N PRO 156.A O no hydrogen 2.651 N/A CYS 161.A N GLN 157.A O no hydrogen 3.038 N/A CYS 161.A SG ASP 169.A O no hydrogen 4.038 N/A TYR 162.A N ALA 158.A O no hydrogen 3.001 N/A TYR 162.A OH VAL 171.A O no hydrogen 2.675 N/A GLN 163.A N LEU 159.A O no hydrogen 3.288 N/A ASP 164.A N LYS 160.A O no hydrogen 3.291 N/A GLY 166.A N ASP 164.A OD1 no hydrogen 3.089 N/A CYS 167.A N ASP 164.A O no hydrogen 3.090 N/A CYS 168.A SG CYS 83.A O no hydrogen 3.577 N/A THR 172.A OG1 ASN 173.A O no hydrogen 3.031 N/A ASN 173.A N TRP 151.A O no hydrogen 2.797 N/A ASN 173.A ND2 TRP 150.A O no hydrogen 2.871 N/A ASN 173.A ND2 ARG 152.A O no hydrogen 3.065 N/A TYR 176.A N ASN 173.A OD1 no hydrogen 2.776 N/A ALA 177.A N ASN 173.A O no hydrogen 3.135 N/A ILE 178.A N ARG 174.A O no hydrogen 3.066 N/A ALA 179.A N ALA 175.A O no hydrogen 2.802 N/A SER 180.A N TYR 176.A O no hydrogen 2.755 N/A SER 181.A N ALA 177.A O no hydrogen 3.288 N/A SER 181.A OG ALA 177.A O no hydrogen 2.797 N/A ILE 182.A N ILE 178.A O no hydrogen 3.019 N/A ILE 183.A N ALA 179.A O no hydrogen 2.829 N/A SER 184.A N SER 180.A O no hydrogen 2.839 N/A SER 184.A OG THR 95.A OG1 no hydrogen 2.801 N/A PHE 185.A N SER 181.A O no hydrogen 2.776 N/A TYR 186.A N SER 181.A O no hydrogen 2.962 N/A TYR 186.A OH PHE 233.A O no hydrogen 2.599 N/A ILE 187.A N ILE 182.A O no hydrogen 2.967 N/A LEU 189.A N PHE 185.A O no hydrogen 2.966 N/A LEU 190.A N TYR 186.A O no hydrogen 2.991 N/A ILE 191.A N ILE 187.A O no hydrogen 3.061 N/A MET 192.A N PRO 188.A O no hydrogen 2.978 N/A ILE 193.A N LEU 189.A O no hydrogen 2.872 N/A PHE 194.A N LEU 190.A O no hydrogen 2.944 N/A VAL 195.A N ILE 191.A O no hydrogen 2.954 N/A ALA 196.A N MET 192.A O no hydrogen 2.787 N/A LEU 197.A N ILE 193.A O no hydrogen 3.004 N/A ARG 198.A N PHE 194.A O no hydrogen 3.232 N/A VAL 199.A N VAL 195.A O no hydrogen 3.052 N/A TYR 200.A N ALA 196.A O no hydrogen 3.066 N/A ARG 201.A N LEU 197.A O no hydrogen 3.011 N/A GLU 202.A N ARG 198.A O no hydrogen 3.041 N/A ALA 203.A N VAL 199.A O no hydrogen 2.949 N/A LYS 204.A N TYR 200.A O no hydrogen 2.985 N/A GLU 205.A N ARG 201.A O no hydrogen 3.141 N/A GLN 206.A N GLU 202.A O no hydrogen 3.265 N/A GLN 206.A N ALA 203.A O no hydrogen 3.293 N/A GLU 211.A N MET 207.A O no hydrogen 3.141 N/A HIS 212.A N LEU 208.A O no hydrogen 2.956 N/A LYS 213.A N MET 209.A O no hydrogen 2.931 N/A ALA 214.A N ARG 210.A O no hydrogen 3.199 N/A LEU 215.A N GLU 211.A O no hydrogen 2.952 N/A LYS 216.A N HIS 212.A O no hydrogen 2.839 N/A THR 217.A N LYS 213.A O no hydrogen 3.110 N/A THR 217.A OG1 LYS 213.A O no hydrogen 3.024 N/A LEU 218.A N ALA 214.A O no hydrogen 3.095 N/A GLY 219.A N LEU 215.A O no hydrogen 2.756 N/A ILE 220.A N LYS 216.A O no hydrogen 2.885 N/A ILE 221.A N THR 217.A O no hydrogen 3.042 N/A MET 222.A N LEU 218.A O no hydrogen 3.016 N/A GLY 223.A N GLY 219.A O no hydrogen 2.989 N/A VAL 224.A N ILE 220.A O no hydrogen 2.905 N/A PHE 225.A N ILE 221.A O no hydrogen 3.044 N/A THR 226.A N MET 222.A O no hydrogen 3.080 N/A THR 226.A OG1 MET 222.A O no hydrogen 2.962 N/A LEU 227.A N GLY 223.A O no hydrogen 2.861 N/A CYS 228.A N VAL 224.A O no hydrogen 2.867 N/A CYS 228.A SG VAL 224.A O no hydrogen 3.059 N/A TRP 229.A N PHE 225.A O no hydrogen 2.974 N/A LEU 230.A N THR 226.A O no hydrogen 2.783 N/A PHE 233.A N TRP 229.A O no hydrogen 3.134 N/A LEU 234.A N LEU 230.A O no hydrogen 2.803 N/A VAL 235.A N PRO 231.A O no hydrogen 2.994 N/A ASN 236.A N PHE 232.A O no hydrogen 2.887 N/A ASN 236.A ND2 SER 181.A OG no hydrogen 3.095 N/A ILE 237.A N PHE 233.A O no hydrogen 3.429 N/A VAL 238.A N LEU 234.A O no hydrogen 2.948 N/A ASN 239.A N VAL 235.A O no hydrogen 2.903 N/A VAL 240.A N ILE 237.A O no hydrogen 2.831 N/A PHE 241.A N VAL 238.A O no hydrogen 2.963 N/A ASN 242.A N VAL 238.A O no hydrogen 2.943 N/A ARG 243.A NH1 ASN 239.A O no hydrogen 3.522 N/A ASP 244.A N ASN 242.A OD1 no hydrogen 2.996 N/A LEU 245.A N ASN 242.A OD1 no hydrogen 2.851 N/A LEU 250.A N PRO 247.A O no hydrogen 3.108 N/A PHE 251.A N PRO 247.A O no hydrogen 3.367 N/A VAL 252.A N ASP 248.A O no hydrogen 3.028 N/A ALA 253.A N TRP 249.A O no hydrogen 2.908 N/A PHE 254.A N LEU 250.A O no hydrogen 3.097 N/A ASN 255.A N PHE 251.A O no hydrogen 3.282 N/A TRP 256.A N VAL 252.A O no hydrogen 3.059 N/A LEU 257.A N ALA 253.A O no hydrogen 2.738 N/A GLY 258.A N PHE 254.A O no hydrogen 3.130 N/A TYR 259.A N ASN 255.A O no hydrogen 2.957 N/A TYR 259.A OH ASP 90.A OD2 no hydrogen 2.655 N/A ALA 260.A N TRP 256.A O no hydrogen 2.894 N/A ASN 261.A N LEU 257.A O no hydrogen 3.282 N/A ASN 261.A N GLY 258.A O no hydrogen 3.094 N/A SER 262.A N TYR 259.A O no hydrogen 3.008 N/A SER 262.A OG ASP 56.A OD1 no hydrogen 2.696 N/A ALA 263.A N ALA 260.A O no hydrogen 3.134 N/A MET 264.A N ASN 261.A O no hydrogen 3.073 N/A ILE 268.A N MET 264.A O no hydrogen 3.033 N/A TYR 269.A N ASN 265.A O no hydrogen 2.867 N/A CYS 270.A N ILE 267.A O no hydrogen 2.871 N/A CYS 270.A SG PRO 266.A O no hydrogen 3.601 N/A ARG 271.A N ILE 268.A O no hydrogen 3.143 N/A ARG 271.A NE THR 217.A OG1 no hydrogen 3.047 N/A ARG 271.A NH2 LYS 213.A O no hydrogen 3.094 N/A SER 272.A N TYR 269.A O no hydrogen 3.059 N/A PHE 275.A N SER 272.A OG no hydrogen 3.339 N/A ARG 276.A N SER 272.A O no hydrogen 2.967 N/A ARG 276.A NH1 CYS 270.A O no hydrogen 2.816 N/A LYS 277.A N PRO 273.A O no hydrogen 2.774 N/A ALA 278.A N ASP 274.A O no hydrogen 3.180 N/A PHE 279.A N PHE 275.A O no hydrogen 2.838 N/A LYS 280.A N ARG 276.A O no hydrogen 3.054 N/A ARG 281.A N LYS 277.A O no hydrogen 2.895 N/A ARG 281.A NH2 SER 37.A OG no hydrogen 2.890 N/A LEU 282.A N ALA 278.A O no hydrogen 2.974 N/A LEU 283.A N PHE 279.A O no hydrogen 3.029 N/A