Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4nrw_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 3.A N GLY 169.A O no hydrogen 2.819 N/A VAL 6.A N GLU 2.A O no hydrogen 2.727 N/A ALA 7.A N GLY 3.A O no hydrogen 2.967 N/A LEU 8.A N PRO 4.A O no hydrogen 3.171 N/A THR 9.A N GLU 5.A O no hydrogen 3.021 N/A THR 9.A OG1 GLU 5.A O no hydrogen 2.899 N/A ALA 10.A N VAL 6.A O no hydrogen 3.046 N/A ASP 11.A N ALA 7.A O no hydrogen 3.222 N/A ILE 12.A N LEU 8.A O no hydrogen 3.149 N/A LEU 13.A N THR 9.A O no hydrogen 2.925 N/A GLU 14.A N ALA 10.A O no hydrogen 2.764 N/A LYS 15.A N ASP 11.A O no hydrogen 3.108 N/A LYS 15.A N ILE 12.A O no hydrogen 3.029 N/A LYS 15.A NZ TYR 16.A OH no hydrogen 3.489 N/A LYS 15.A NZ LYS 230.A O no hydrogen 2.774 N/A TYR 16.A N ILE 12.A O no hydrogen 3.250 N/A PHE 17.A N LEU 13.A O no hydrogen 2.881 N/A GLY 19.A N VAL 51.A O no hydrogen 2.916 N/A LYS 20.A N PHE 17.A O no hydrogen 3.347 N/A LEU 22.A N LEU 49.A O no hydrogen 2.660 N/A GLU 23.A N SER 100.A O no hydrogen 2.859 N/A TYR 24.A N SER 100.A O no hydrogen 3.166 N/A ASP 26.A N VAL 98.A O no hydrogen 2.680 N/A SER 29.A OG THR 95.A O no hydrogen 2.635 N/A ARG 31.A NH2 GLY 116.A O no hydrogen 2.683 N/A SER 33.A N GLY 30.A O no hydrogen 3.278 N/A SER 33.A OG GLY 30.A O no hydrogen 2.458 N/A LYS 34.A N ARG 31.A O no hydrogen 3.187 N/A SER 35.A N ARG 31.A O no hydrogen 3.082 N/A SER 35.A OG ARG 31.A O no hydrogen 3.508 N/A TYR 40.A N PRO 37.A O no hydrogen 3.276 N/A TYR 40.A OH ILE 25.A O no hydrogen 2.972 N/A PHE 43.A N GLY 39.A O no hydrogen 3.230 N/A ILE 44.A N TYR 40.A O no hydrogen 2.976 N/A ALA 45.A N ASP 41.A O no hydrogen 3.194 N/A ASN 46.A N PHE 43.A O no hydrogen 3.148 N/A ASN 46.A ND2 ASP 42.A O no hydrogen 2.382 N/A LEU 47.A N ILE 44.A O no hydrogen 3.188 N/A LEU 49.A N LEU 22.A O no hydrogen 2.965 N/A LYS 50.A N PHE 66.A O no hydrogen 2.612 N/A VAL 51.A N LYS 20.A O no hydrogen 3.027 N/A SER 52.A N GLU 64.A O no hydrogen 2.608 N/A SER 52.A OG GLU 64.A O no hydrogen 2.398 N/A ASN 53.A N GLU 64.A O no hydrogen 3.393 N/A VAL 54.A N GLU 14.A OE2 no hydrogen 2.388 N/A LYS 57.A N PHE 60.A O no hydrogen 3.126 N/A LYS 57.A NZ LEU 131.A O no hydrogen 2.784 N/A LYS 57.A NZ LEU 134.A O no hydrogen 3.383 N/A GLY 58.A N ASP 137.A OD2 no hydrogen 2.856 N/A LYS 59.A NZ LEU 170.A O no hydrogen 3.125 N/A LEU 61.A N ASN 79.A O no hydrogen 3.200 N/A TRP 62.A N ASP 55.A O no hydrogen 3.313 N/A PHE 63.A N ILE 77.A O no hydrogen 3.093 N/A GLU 64.A N ASN 53.A O no hydrogen 2.897 N/A LEU 65.A N TRP 75.A O no hydrogen 3.022 N/A PHE 66.A N LYS 50.A O no hydrogen 2.756 N/A SER 72.A N ASP 70.A OD1 no hydrogen 2.947 N/A TRP 75.A N LEU 65.A O no hydrogen 3.011 N/A TYR 76.A N SER 121.A O no hydrogen 2.726 N/A ILE 77.A N PHE 63.A O no hydrogen 3.186 N/A TRP 78.A N LYS 119.A O no hydrogen 2.597 N/A ASN 79.A N LEU 61.A O no hydrogen 2.836 N/A ASN 79.A ND2 THR 117.A O no hydrogen 3.013 N/A THR 80.A N THR 117.A O no hydrogen 3.169 N/A THR 80.A OG1 THR 117.A OG1 no hydrogen 2.252 N/A GLY 82.A N ASP 85.A OD1 no hydrogen 3.081 N/A THR 84.A OG1 ASP 111.A OD1 no hydrogen 3.496 N/A MET 86.A N SER 110.A O no hydrogen 2.893 N/A SER 88.A N TYR 108.A O no hydrogen 2.782 N/A SER 88.A OG PHE 90.A O no hydrogen 2.711 N/A SER 88.A OG TYR 108.A O no hydrogen 3.442 N/A THR 95.A OG1 ALA 92.A O no hydrogen 2.302 N/A ARG 96.A N PHE 109.A O no hydrogen 2.671 N/A ARG 96.A NE ASN 114.A OD1 no hydrogen 2.479 N/A ARG 96.A NH1 SER 29.A OG no hydrogen 3.355 N/A ALA 97.A N PHE 109.A O no hydrogen 3.061 N/A VAL 98.A N ASP 26.A O no hydrogen 2.659 N/A LEU 99.A N ALA 107.A O no hydrogen 2.665 N/A SER 100.A N TYR 24.A O no hydrogen 2.592 N/A PHE 101.A N LEU 105.A O no hydrogen 2.806 N/A ASP 102.A N THR 21.A O no hydrogen 3.045 N/A LEU 105.A N ASP 102.A O no hydrogen 3.163 N/A ALA 107.A N LEU 99.A O no hydrogen 2.942 N/A TYR 108.A N SER 88.A O no hydrogen 2.880 N/A PHE 109.A N ALA 97.A O no hydrogen 2.934 N/A SER 110.A N MET 86.A O no hydrogen 2.652 N/A SER 110.A OG MET 86.A O no hydrogen 2.886 N/A ASP 111.A N TYR 94.A O no hydrogen 2.902 N/A ARG 113.A N THR 84.A OG1 no hydrogen 3.058 N/A ASN 114.A N ASP 111.A OD1 no hydrogen 2.885 N/A GLY 116.A N ASP 111.A OD2 no hydrogen 2.931 N/A THR 117.A N THR 80.A O no hydrogen 3.188 N/A THR 117.A OG1 THR 80.A OG1 no hydrogen 2.252 N/A PHE 118.A N TYR 32.A OH no hydrogen 2.807 N/A LYS 119.A N TRP 78.A O no hydrogen 3.066 N/A LYS 119.A NZ GLU 38.A OE1 no hydrogen 2.815 N/A PHE 120.A N GLU 38.A O no hydrogen 2.985 N/A SER 121.A N TYR 76.A O no hydrogen 3.015 N/A SER 121.A OG GLU 126.A OE1 no hydrogen 3.007 N/A SER 123.A N SER 121.A OG no hydrogen 3.200 N/A GLU 126.A N SER 123.A OG no hydrogen 3.387 N/A LYS 128.A N GLU 124.A O no hydrogen 3.097 N/A LYS 128.A NZ ASN 132.A OD1 no hydrogen 3.199 N/A LYS 130.A N GLU 126.A O no hydrogen 3.255 N/A LEU 131.A N LEU 127.A O no hydrogen 3.076 N/A ASN 132.A N LYS 128.A O no hydrogen 3.160 N/A GLU 133.A N LYS 130.A O no hydrogen 3.258 N/A LEU 134.A N LEU 131.A O no hydrogen 3.182 N/A GLY 135.A N GLN 163.A O no hydrogen 2.406 N/A PHE 138.A N SER 168.A O no hydrogen 3.120 N/A LEU 139.A N ASP 137.A OD1 no hydrogen 3.198 N/A LYS 140.A NZ THR 56.A O no hydrogen 3.065 N/A ASN 141.A N ASP 137.A O no hydrogen 2.920 N/A SER 147.A N ASP 145.A OD2 no hydrogen 3.300 N/A SER 147.A OG ASP 145.A OD1 no hydrogen 3.353 N/A ILE 149.A N ILE 146.A O no hydrogen 3.386 N/A LYS 150.A N SER 147.A O no hydrogen 3.424 N/A LYS 150.A NZ ASP 195.A OD1 no hydrogen 3.481 N/A LYS 151.A N LYS 148.A O no hydrogen 3.154 N/A TYR 152.A N ILE 149.A O no hydrogen 3.141 N/A ILE 156.A N LYS 188.A O no hydrogen 3.055 N/A ALA 158.A N PRO 155.A O no hydrogen 3.000 N/A LEU 159.A N PRO 155.A O no hydrogen 3.260 N/A LEU 160.A N ILE 156.A O no hydrogen 3.181 N/A MET 161.A N VAL 157.A O no hydrogen 3.278 N/A ASP 162.A N ALA 158.A O no hydrogen 3.191 N/A GLN 163.A NE2 MET 161.A O no hydrogen 2.838 N/A GLN 163.A NE2 LEU 170.A O no hydrogen 3.124 N/A LYS 164.A N ASP 162.A OD1 no hydrogen 2.657 N/A LYS 165.A N ASP 162.A OD1 no hydrogen 2.703 N/A LYS 165.A NZ GLN 154.A OE1 no hydrogen 2.955 N/A SER 168.A N PRO 136.A O no hydrogen 2.639 N/A SER 168.A OG GLY 135.A O no hydrogen 2.768 N/A SER 168.A OG PRO 136.A O no hydrogen 3.380 N/A GLY 169.A N GLN 163.A OE1 no hydrogen 3.046 N/A ASN 172.A ND2 THR 277.A O no hydrogen 3.574 N/A TYR 173.A OH GLU 5.A OE2 no hydrogen 3.005 N/A VAL 175.A N GLY 171.A O no hydrogen 3.487 N/A GLU 177.A N TYR 173.A O no hydrogen 3.065 N/A ILE 178.A N LEU 174.A O no hydrogen 2.800 N/A LEU 179.A N VAL 175.A O no hydrogen 3.149 N/A TYR 180.A OH ASP 257.A OD2 no hydrogen 2.762 N/A ARG 181.A N GLU 177.A O no hydrogen 3.014 N/A ARG 181.A NH2 GLU 244.A OE2 no hydrogen 3.133 N/A ALA 182.A N ILE 178.A O no hydrogen 2.965 N/A LYS 183.A N TYR 180.A O no hydrogen 3.203 N/A ILE 184.A N LEU 179.A O no hydrogen 2.795 N/A HIS 187.A N ASP 185.A OD1 no hydrogen 2.885 N/A HIS 187.A ND1 ASP 185.A OD1 no hydrogen 2.942 N/A LYS 188.A N ASP 185.A O no hydrogen 2.992 N/A LYS 188.A NZ GLU 197.A OE1 no hydrogen 2.851 N/A LYS 188.A NZ GLU 197.A OE2 no hydrogen 2.837 N/A GLY 190.A N GLN 154.A O no hydrogen 2.960 N/A SER 191.A OG TYR 152.A O no hydrogen 3.473 N/A ASN 192.A N LEU 189.A O no hydrogen 3.185 N/A LEU 193.A N GLY 190.A O no hydrogen 3.500 N/A THR 194.A N GLU 197.A OE1 no hydrogen 2.761 N/A THR 194.A OG1 GLU 197.A OE1 no hydrogen 2.945 N/A ILE 198.A N THR 194.A O no hydrogen 2.926 N/A GLU 199.A N ASP 195.A O no hydrogen 3.239 N/A ASN 200.A N GLN 196.A O no hydrogen 2.874 N/A LEU 201.A N GLU 197.A O no hydrogen 2.786 N/A TRP 202.A N ILE 198.A O no hydrogen 3.031 N/A TRP 204.A N ASN 200.A O no hydrogen 3.467 N/A ILE 205.A N LEU 201.A O no hydrogen 2.981 N/A LYS 206.A N TRP 202.A O no hydrogen 3.212 N/A TYR 207.A N TYR 203.A O no hydrogen 2.855 N/A TYR 207.A OH GLU 244.A OE1 no hydrogen 2.660 N/A GLU 208.A N TRP 204.A O no hydrogen 2.877 N/A THR 209.A N ILE 205.A O no hydrogen 3.200 N/A THR 209.A OG1 ILE 205.A O no hydrogen 2.560 N/A THR 209.A OG1 LYS 206.A O no hydrogen 3.278 N/A LYS 210.A N LYS 206.A O no hydrogen 3.258 N/A LYS 210.A NZ HIS 237.A O no hydrogen 2.835 N/A LYS 210.A NZ ILE 240.A O no hydrogen 2.424 N/A LEU 211.A N TYR 207.A O no hydrogen 3.092 N/A ALA 212.A N GLU 208.A O no hydrogen 3.036 N/A TYR 213.A N LYS 210.A O no hydrogen 3.147 N/A TYR 213.A OH ASP 11.A OD2 no hydrogen 2.414 N/A ASP 214.A N LYS 210.A O no hydrogen 2.926 N/A SER 215.A OG LEU 211.A O no hydrogen 2.605 N/A ASN 216.A N GLU 246.A OE1 no hydrogen 3.413 N/A ASN 216.A N GLU 246.A OE2 no hydrogen 3.204 N/A HIS 217.A N GLU 246.A OE2 no hydrogen 2.926 N/A LEU 224.A N MET 221.A O no hydrogen 2.953 N/A SER 228.A N LEU 224.A O no hydrogen 2.889 N/A SER 228.A OG LEU 224.A O no hydrogen 2.625 N/A SER 229.A OG ASN 226.A O no hydrogen 3.141 N/A LYS 230.A NZ ASN 226.A O no hydrogen 3.318 N/A ARG 233.A NE TYR 213.A O no hydrogen 2.856 N/A ARG 233.A NH1 SER 228.A O no hydrogen 2.736 N/A ARG 233.A NH1 GLY 232.A O no hydrogen 3.431 N/A ARG 233.A NH2 SER 215.A O no hydrogen 3.066 N/A ARG 233.A NH2 SER 228.A O no hydrogen 2.789 N/A LYS 234.A N TYR 213.A OH no hydrogen 2.944 N/A TYR 236.A N LYS 234.A O no hydrogen 2.834 N/A HIS 237.A ND1 ASP 142.A OD1 no hydrogen 2.978 N/A HIS 237.A NE2 PHE 138.A O no hydrogen 2.806 N/A ILE 240.A N HIS 237.A O no hydrogen 3.172 N/A THR 243.A N TYR 207.A OH no hydrogen 3.340 N/A THR 243.A OG1 GLU 244.A OE1 no hydrogen 3.240 N/A GLU 244.A N GLU 244.A OE1 no hydrogen 2.718 N/A PHE 247.A N SER 215.A OG no hydrogen 2.981 N/A LEU 250.A N GLU 177.A OE1 no hydrogen 3.056 N/A VAL 251.A N GLU 177.A OE2 no hydrogen 2.876 N/A TYR 252.A N GLU 177.A OE2 no hydrogen 3.259 N/A ASP 257.A N ASN 261.A O no hydrogen 3.239 N/A GLY 260.A N ASP 257.A O no hydrogen 2.805 N/A VAL 263.A N LYS 255.A O no hydrogen 3.095 N/A ILE 264.A N TRP 280.A O no hydrogen 3.030 N/A ASP 266.A N THR 278.A O no hydrogen 3.393 N/A ASN 274.A N SER 271.A O no hydrogen 2.990 N/A ASN 274.A ND2 ASN 274.A O no hydrogen 2.733 N/A ARG 276.A N ILE 269.A O no hydrogen 2.928 N/A THR 278.A N ASP 266.A O no hydrogen 2.773 N/A ALA 281.A N GLN 285.A OE1 no hydrogen 3.194 N/A ILE 284.A N ALA 281.A O no hydrogen 3.138 N/A GLN 285.A N ALA 281.A O no hydrogen 2.734 N/A GLN 285.A NE2 ILE 184.A O no hydrogen 2.787 N/A