Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3nri_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 2.A N ASP 5.A OD2 no hydrogen 3.230 N/A ASP 5.A N THR 2.A OG1 no hydrogen 3.356 N/A ASN 7.A N MET 3.A O no hydrogen 3.059 N/A PHE 8.A N MET 4.A O no hydrogen 2.821 N/A LYS 9.A N ASP 5.A O no hydrogen 2.775 N/A TYR 10.A N MET 6.A O no hydrogen 2.958 N/A TYR 10.A OH ASP 78.A OD2 no hydrogen 2.977 N/A CYS 11.A N ASN 7.A O no hydrogen 3.012 N/A CYS 11.A SG ASN 7.A O no hydrogen 3.314 N/A HIS 12.A N PHE 8.A O no hydrogen 2.758 N/A HIS 12.A NE2 ASP 27.A OD2 no hydrogen 3.163 N/A LYS 13.A N LYS 9.A O no hydrogen 2.933 N/A ILE 14.A N TYR 10.A O no hydrogen 2.935 N/A MET 15.A N CYS 11.A O no hydrogen 3.101 N/A LYS 16.A N HIS 12.A O no hydrogen 2.867 N/A LYS 17.A N LYS 13.A O no hydrogen 2.784 N/A HIS 18.A N ILE 14.A O no hydrogen 3.001 N/A HIS 18.A N MET 15.A O no hydrogen 3.294 N/A SER 19.A N MET 15.A O no hydrogen 2.770 N/A LYS 20.A NZ LYS 16.A O no hydrogen 2.844 N/A PHE 22.A N SER 19.A OG no hydrogen 3.164 N/A SER 23.A N SER 19.A O no hydrogen 3.107 N/A SER 23.A OG SER 19.A O no hydrogen 2.453 N/A TYR 24.A N LYS 20.A O no hydrogen 3.175 N/A ALA 25.A N SER 21.A O no hydrogen 3.051 N/A PHE 26.A N PHE 22.A O no hydrogen 2.575 N/A ASP 27.A N SER 23.A O no hydrogen 2.884 N/A LEU 28.A N ALA 25.A O no hydrogen 2.965 N/A LEU 29.A N PHE 26.A O no hydrogen 3.171 N/A ARG 34.A N PRO 30.A O no hydrogen 3.001 N/A ARG 34.A NE LEU 29.A O no hydrogen 3.071 N/A ARG 34.A NH2 LEU 29.A O no hydrogen 3.522 N/A LYS 35.A N GLU 31.A O no hydrogen 3.103 N/A LYS 35.A NZ ASP 5.A OD1 no hydrogen 3.310 N/A ALA 36.A N ASP 32.A O no hydrogen 3.417 N/A VAL 37.A N GLN 33.A O no hydrogen 3.091 N/A TRP 38.A N ARG 34.A O no hydrogen 3.046 N/A TRP 38.A NE1 ASP 27.A OD1 no hydrogen 3.164 N/A ALA 39.A N LYS 35.A O no hydrogen 3.024 N/A ILE 40.A N ALA 36.A O no hydrogen 3.084 N/A TYR 41.A N VAL 37.A O no hydrogen 2.880 N/A ALA 42.A N TRP 38.A O no hydrogen 2.896 N/A VAL 43.A N ALA 39.A O no hydrogen 3.071 N/A CYS 44.A N ILE 40.A O no hydrogen 2.977 N/A CYS 44.A SG ILE 40.A O no hydrogen 3.272 N/A ARG 45.A N TYR 41.A O no hydrogen 2.644 N/A ARG 45.A NE ARG 45.A O no hydrogen 3.135 N/A LYS 46.A N ALA 42.A O no hydrogen 2.722 N/A LYS 46.A NZ ASP 78.A OD2 no hydrogen 3.415 N/A ILE 47.A N VAL 43.A O no hydrogen 3.068 N/A ASP 48.A N CYS 44.A O no hydrogen 2.889 N/A ASP 49.A N ARG 45.A O no hydrogen 3.096 N/A SER 50.A N ILE 47.A O no hydrogen 3.030 N/A SER 50.A OG ILE 47.A O no hydrogen 3.109 N/A GLN 57.A N GLN 53.A O no hydrogen 3.339 N/A ILE 58.A N PHE 54.A O no hydrogen 2.883 N/A LYS 59.A N LEU 55.A O no hydrogen 2.972 N/A LYS 59.A NZ TYR 107.A OH no hydrogen 3.532 N/A GLU 60.A N ASN 56.A O no hydrogen 2.857 N/A ASP 61.A N GLN 57.A O no hydrogen 2.911 N/A ILE 62.A N ILE 58.A O no hydrogen 3.109 N/A GLN 63.A N LYS 59.A O no hydrogen 3.018 N/A SER 64.A N GLU 60.A O no hydrogen 2.942 N/A SER 64.A OG GLU 60.A O no hydrogen 3.435 N/A ILE 65.A N ASP 61.A O no hydrogen 3.054 N/A GLU 66.A N ILE 62.A O no hydrogen 3.064 N/A LYS 67.A N GLN 63.A O no hydrogen 2.882 N/A TYR 68.A N SER 64.A O no hydrogen 2.864 N/A TYR 70.A OH GLN 90.A O no hydrogen 3.006 N/A GLU 71.A N TYR 68.A O no hydrogen 3.348 N/A HIS 73.A NE2 TYR 68.A O no hydrogen 2.805 N/A GLN 76.A N ASP 61.A OD2 no hydrogen 2.903 N/A GLN 76.A NE2 GLU 60.A OE1 no hydrogen 2.798 N/A SER 77.A N ASP 61.A OD1 no hydrogen 2.865 N/A SER 77.A OG ASP 61.A OD1 no hydrogen 2.233 N/A ARG 80.A N ASP 78.A OD1 no hydrogen 2.890 N/A ILE 81.A N ASP 78.A O no hydrogen 3.258 N/A MET 82.A N ASP 78.A O no hydrogen 3.208 N/A MET 83.A N ARG 79.A O no hydrogen 3.044 N/A ALA 84.A N ARG 80.A O no hydrogen 3.434 N/A LEU 85.A N ILE 81.A O no hydrogen 2.747 N/A GLN 86.A N MET 82.A O no hydrogen 2.703 N/A HIS 87.A N MET 83.A O no hydrogen 2.770 N/A VAL 88.A N ALA 84.A O no hydrogen 3.083 N/A ALA 89.A N LEU 85.A O no hydrogen 2.796 N/A GLN 90.A N GLN 86.A O no hydrogen 3.069 N/A HIS 91.A N VAL 88.A O no hydrogen 2.745 N/A LYS 92.A N VAL 88.A O no hydrogen 2.877 N/A GLN 97.A NE2 ASN 101.A OD1 no hydrogen 3.166 N/A SER 98.A N ALA 95.A O no hydrogen 2.793 N/A SER 98.A OG ALA 95.A O no hydrogen 3.471 N/A SER 98.A OG GLU 134.A OE1 no hydrogen 2.752 N/A TYR 100.A N PHE 96.A O no hydrogen 3.151 N/A TYR 100.A OH GLU 66.A OE1 no hydrogen 2.628 N/A ASN 101.A N GLN 97.A O no hydrogen 2.895 N/A ASN 101.A ND2 TYR 126.A OH no hydrogen 3.042 N/A LEU 102.A N SER 98.A O no hydrogen 3.093 N/A ILE 103.A N PHE 99.A O no hydrogen 2.953 N/A ASP 104.A N TYR 100.A O no hydrogen 2.871 N/A THR 105.A N ASN 101.A O no hydrogen 2.665 N/A THR 105.A OG1 ASN 101.A O no hydrogen 2.939 N/A VAL 106.A N LEU 102.A O no hydrogen 2.971 N/A VAL 106.A N ILE 103.A O no hydrogen 2.945 N/A TYR 107.A N ILE 103.A O no hydrogen 3.028 N/A TYR 107.A OH ASN 56.A OD1 no hydrogen 2.616 N/A LYS 108.A N ASP 104.A O no hydrogen 3.210 N/A ASP 109.A N VAL 106.A O no hydrogen 3.139 N/A GLN 110.A N TYR 107.A O no hydrogen 2.725 N/A PHE 112.A N ASP 109.A O no hydrogen 3.064 N/A GLU 116.A N GLU 120.A OE1 no hydrogen 3.032 N/A LEU 121.A N THR 117.A O no hydrogen 3.253 N/A PHE 122.A N ASP 118.A O no hydrogen 2.793 N/A GLY 123.A N GLU 120.A O no hydrogen 3.159 N/A TYR 124.A N GLU 120.A O no hydrogen 2.900 N/A CYS 125.A N LEU 121.A O no hydrogen 2.899 N/A CYS 125.A SG LEU 121.A O no hydrogen 3.359 N/A TYR 126.A N PHE 122.A O no hydrogen 3.086 N/A TYR 126.A OH GLU 134.A OE1 no hydrogen 2.959 N/A TYR 126.A OH GLU 134.A OE2 no hydrogen 3.237 N/A GLY 127.A N GLY 123.A O no hydrogen 3.212 N/A VAL 128.A N TYR 124.A O no hydrogen 2.870 N/A ALA 129.A N CYS 125.A O no hydrogen 3.072 N/A ALA 129.A N TYR 126.A O no hydrogen 3.195 N/A GLY 130.A N CYS 125.A O no hydrogen 3.223 N/A THR 131.A N TYR 126.A O no hydrogen 2.893 N/A THR 131.A OG1 GLY 127.A O no hydrogen 2.607 N/A GLY 133.A N ALA 129.A O no hydrogen 3.022 N/A GLU 134.A N GLY 130.A O no hydrogen 3.244 N/A VAL 135.A N THR 131.A O no hydrogen 3.113 N/A LEU 136.A N VAL 132.A O no hydrogen 2.979 N/A THR 137.A N GLU 134.A O no hydrogen 3.058 N/A THR 137.A OG1 GLY 133.A O no hydrogen 2.800 N/A THR 137.A OG1 GLU 134.A O no hydrogen 3.538 N/A ILE 139.A N LEU 136.A O no hydrogen 2.991 N/A LEU 140.A N LEU 136.A O no hydrogen 3.235 N/A LEU 140.A N THR 137.A O no hydrogen 3.078 N/A SER 141.A OG THR 137.A O no hydrogen 2.571 N/A THR 145.A N THR 148.A OG1 no hydrogen 2.917 N/A THR 145.A OG1 GLN 147.A OE1 no hydrogen 3.338 N/A THR 145.A OG1 THR 148.A OG1 no hydrogen 3.094 N/A THR 148.A N THR 145.A O no hydrogen 2.902 N/A THR 148.A OG1 THR 145.A O no hydrogen 3.074 N/A THR 148.A OG1 THR 145.A OG1 no hydrogen 3.094 N/A TYR 149.A N THR 145.A O no hydrogen 3.285 N/A ASP 150.A N HIS 146.A O no hydrogen 2.864 N/A VAL 151.A N GLN 147.A O no hydrogen 3.135 N/A ALA 152.A N THR 148.A O no hydrogen 3.257 N/A ARG 153.A N TYR 149.A O no hydrogen 2.959 N/A ARG 153.A NE GLU 134.A OE2 no hydrogen 2.627 N/A ARG 153.A NH2 GLU 134.A OE2 no hydrogen 2.756 N/A ARG 154.A N ASP 150.A O no hydrogen 2.934 N/A ARG 154.A NH1 ASP 150.A OD1 no hydrogen 2.328 N/A LEU 155.A N VAL 151.A O no hydrogen 2.810 N/A GLY 156.A N ALA 152.A O no hydrogen 2.821 N/A GLU 157.A N ARG 153.A O no hydrogen 2.766 N/A SER 158.A N ARG 154.A O no hydrogen 3.089 N/A SER 158.A OG ARG 154.A O no hydrogen 3.424 N/A SER 158.A OG LEU 155.A O no hydrogen 2.735 N/A LEU 159.A N LEU 155.A O no hydrogen 2.942 N/A GLN 160.A N GLY 156.A O no hydrogen 3.131 N/A LEU 161.A N GLU 157.A O no hydrogen 3.006 N/A ILE 162.A N SER 158.A O no hydrogen 2.905 N/A ASN 163.A N LEU 159.A O no hydrogen 2.845 N/A ILE 164.A N GLN 160.A O no hydrogen 3.042 N/A LEU 165.A N LEU 161.A O no hydrogen 3.203 N/A ARG 166.A N ILE 162.A O no hydrogen 3.055 N/A ARG 166.A NE ASP 167.A OD1 no hydrogen 2.765 N/A ARG 166.A NH2 ASP 167.A OD1 no hydrogen 3.219 N/A ARG 166.A NH2 ASP 167.A OD2 no hydrogen 3.092 N/A ASP 167.A N ILE 164.A O no hydrogen 3.238 N/A ASP 171.A N ASP 167.A O no hydrogen 2.812 N/A PHE 172.A N VAL 168.A O no hydrogen 3.003 N/A GLU 173.A N GLY 169.A O no hydrogen 2.898 N/A ASN 174.A N GLU 170.A O no hydrogen 3.246 N/A GLU 175.A N PHE 172.A O no hydrogen 2.774 N/A ARG 176.A N ASP 171.A O no hydrogen 2.894 N/A SER 180.A N TYR 210.A OH no hydrogen 3.497 N/A SER 180.A OG ASP 118.A OD1 no hydrogen 2.598 N/A SER 180.A OG TYR 210.A OH no hydrogen 3.218 N/A LYS 181.A N PHE 115.A O no hydrogen 2.909 N/A LYS 181.A NZ GLU 116.A OE1 no hydrogen 3.283 N/A LYS 181.A NZ GLU 116.A OE2 no hydrogen 3.279 N/A GLN 182.A N GLU 116.A O no hydrogen 3.041 N/A ARG 183.A NE ASP 118.A OD2 no hydrogen 3.143 N/A ARG 183.A NH1 GLN 186.A OE1 no hydrogen 2.935 N/A ARG 183.A NH2 ASP 118.A OD2 no hydrogen 3.006 N/A LEU 184.A N SER 180.A O no hydrogen 2.840 N/A LYS 185.A N LYS 181.A O no hydrogen 3.000 N/A GLN 186.A N GLN 182.A O no hydrogen 2.994 N/A TYR 187.A N ARG 183.A O no hydrogen 2.997 N/A GLU 188.A N LYS 185.A O no hydrogen 3.028 N/A VAL 189.A N LEU 184.A O no hydrogen 3.014 N/A VAL 194.A N ASP 190.A O no hydrogen 3.065 N/A TYR 195.A N ILE 191.A O no hydrogen 3.025 N/A TYR 195.A OH GLU 173.A OE2 no hydrogen 3.010 N/A GLN 196.A N ALA 192.A O no hydrogen 3.401 N/A GLN 196.A N GLU 193.A O no hydrogen 2.922 N/A ASN 197.A N GLU 193.A O no hydrogen 2.921 N/A ASN 197.A ND2 GLU 193.A OE2 no hydrogen 2.508 N/A GLY 198.A N VAL 194.A O no hydrogen 2.821 N/A TYR 203.A N ASN 200.A OD1 no hydrogen 2.863 N/A ILE 204.A N ASN 200.A O no hydrogen 3.171 N/A ASP 205.A N ASN 201.A O no hydrogen 3.203 N/A LEU 206.A N HIS 202.A O no hydrogen 3.104 N/A TRP 207.A N TYR 203.A O no hydrogen 2.803 N/A TRP 207.A NE1 LEU 165.A O no hydrogen 3.214 N/A GLU 208.A N ILE 204.A O no hydrogen 2.652 N/A TYR 209.A N LEU 206.A O no hydrogen 3.026 N/A TYR 210.A N LEU 206.A O no hydrogen 3.253 N/A TYR 210.A OH ASP 118.A OD1 no hydrogen 2.587 N/A ALA 211.A N TRP 207.A O no hydrogen 3.006 N/A ALA 212.A N GLU 208.A O no hydrogen 3.120 N/A ALA 214.A N TYR 210.A O no hydrogen 3.046 N/A GLU 215.A N ALA 211.A O no hydrogen 2.973 N/A LYS 216.A N ALA 212.A O no hydrogen 3.040 N/A LYS 216.A NZ ASP 220.A OD1 no hydrogen 3.251 N/A LYS 216.A NZ ASP 220.A OD2 no hydrogen 3.143 N/A ASP 217.A N ILE 213.A O no hydrogen 2.943 N/A PHE 218.A N ALA 214.A O no hydrogen 2.737 N/A ARG 219.A N GLU 215.A O no hydrogen 2.958 N/A ASP 220.A N LYS 216.A O no hydrogen 3.063 N/A VAL 221.A N ASP 217.A O no hydrogen 3.072 N/A VAL 221.A N PHE 218.A O no hydrogen 2.977 N/A MET 222.A N PHE 218.A O no hydrogen 2.961 N/A ASP 223.A N ARG 219.A O no hydrogen 3.163 N/A GLN 224.A N VAL 221.A O no hydrogen 2.835 N/A ILE 225.A N MET 222.A O no hydrogen 3.169 N/A VAL 227.A N GLN 224.A O no hydrogen 3.141 N/A PHE 228.A N ILE 225.A O no hydrogen 3.097 N/A SER 229.A N LEU 140.A O no hydrogen 2.873 N/A SER 229.A OG GLU 231.A OE1 no hydrogen 3.308 N/A ALA 232.A N SER 229.A O no hydrogen 3.040 N/A GLN 233.A N SER 229.A O no hydrogen 3.163 N/A ILE 236.A N ALA 232.A O no hydrogen 2.802 N/A GLU 237.A N GLN 233.A O no hydrogen 2.679 N/A LEU 238.A N PRO 234.A O no hydrogen 2.776 N/A ALA 239.A N ILE 235.A O no hydrogen 2.901 N/A ALA 240.A N ILE 236.A O no hydrogen 3.008 N/A ARG 241.A N GLU 237.A O no hydrogen 2.766 N/A ARG 241.A NH1 GLU 245.A OE1 no hydrogen 2.753 N/A ARG 241.A NH2 GLU 245.A OE1 no hydrogen 3.369 N/A ILE 242.A N LEU 238.A O no hydrogen 2.794 N/A TYR 243.A N ALA 239.A O no hydrogen 3.258 N/A TYR 243.A N ALA 240.A O no hydrogen 2.869 N/A TYR 243.A OH ASN 163.A OD1 no hydrogen 3.252 N/A ILE 244.A N ALA 240.A O no hydrogen 2.869 N/A GLU 245.A N ARG 241.A O no hydrogen 3.080 N/A ILE 246.A N TYR 243.A O no hydrogen 3.086 N/A LEU 247.A N ILE 244.A O no hydrogen 2.756 N/A GLU 249.A N GLU 245.A O no hydrogen 3.149 N/A VAL 250.A N ILE 246.A O no hydrogen 3.155 N/A ARG 251.A N LEU 247.A O no hydrogen 3.127 N/A ARG 251.A NE GLU 208.A OE2 no hydrogen 2.817 N/A ARG 251.A NH1 ASP 248.A OD2 no hydrogen 3.083 N/A ARG 251.A NH2 GLU 208.A OE1 no hydrogen 3.266 N/A ARG 251.A NH2 GLU 208.A OE2 no hydrogen 3.563 N/A ARG 251.A NH2 GLU 215.A OE2 no hydrogen 3.392 N/A GLN 252.A N ASP 248.A O no hydrogen 3.041 N/A ALA 253.A N GLU 249.A O no hydrogen 3.020 N/A ASN 254.A N ARG 251.A O no hydrogen 2.911 N/A TYR 255.A N VAL 250.A O no hydrogen 2.808 N/A TYR 255.A OH GLU 208.A OE2 no hydrogen 2.898 N/A THR 256.A N ALA 253.A O no hydrogen 3.189 N/A HIS 258.A N THR 256.A OG1 no hydrogen 2.964 N/A HIS 258.A NE2 TYR 195.A O no hydrogen 2.992 N/A ARG 260.A NE GLU 170.A OE2 no hydrogen 3.214 N/A ARG 260.A NH2 GLU 170.A OE1 no hydrogen 3.394 N/A ARG 260.A NH2 GLU 170.A OE2 no hydrogen 3.097 N/A ARG 266.A NH1 ARG 266.A O no hydrogen 2.769 N/A LYS 268.A N GLU 264.A O no hydrogen 3.217 N/A LYS 268.A NZ VAL 263.A O no hydrogen 2.710 N/A ALA 269.A N LYS 265.A O no hydrogen 2.862 N/A LYS 270.A N ARG 266.A O no hydrogen 2.800 N/A LEU 271.A N LYS 267.A O no hydrogen 2.900 N/A LEU 271.A N LYS 268.A O no hydrogen 3.185 N/A PHE 272.A N LYS 268.A O no hydrogen 3.038 N/A HIS 273.A N ALA 269.A O no hydrogen 3.185 N/A HIS 273.A N LYS 270.A O no hydrogen 3.197 N/A GLU 274.A N LYS 270.A O no hydrogen 3.120 N/A ILE 275.A N LEU 271.A O no hydrogen 2.890 N/A ASN 276.A N PHE 272.A O no hydrogen 2.745 N/A SER 277.A N HIS 273.A O no hydrogen 2.829 N/A SER 277.A OG GLU 274.A O no hydrogen 2.945 N/A LYS 278.A N ILE 275.A O no hydrogen 3.251 N/A LYS 278.A NZ GLU 237.A OE2 no hydrogen 2.964 N/A TYR 279.A N ASN 276.A O no hydrogen 3.169 N/A TYR 279.A OH GLU 237.A OE1 no hydrogen 2.784 N/A