Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5kra_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A OG ASP 60.A OD2 no hydrogen 2.766 N/A SER 5.A N LEU 2.A O no hydrogen 3.099 N/A THR 7.A N GLN 10.A OE1 no hydrogen 3.371 N/A GLN 10.A N THR 7.A OG1 no hydrogen 3.331 N/A MET 11.A N THR 7.A O no hydrogen 2.915 N/A VAL 12.A N ALA 8.A O no hydrogen 3.040 N/A SER 13.A N ASP 9.A O no hydrogen 3.035 N/A SER 13.A OG ASP 9.A O no hydrogen 2.927 N/A ALA 14.A N GLN 10.A O no hydrogen 3.076 N/A LEU 15.A N MET 11.A O no hydrogen 3.119 N/A LEU 16.A N VAL 12.A O no hydrogen 2.863 N/A ASP 17.A N SER 13.A O no hydrogen 3.039 N/A ALA 18.A N LEU 15.A O no hydrogen 3.165 N/A GLU 19.A N LEU 16.A O no hydrogen 3.271 N/A SER 25.A N ASN 98.A OD1 no hydrogen 3.033 N/A TYR 27.A N SER 25.A O no hydrogen 2.743 N/A SER 29.A OG SER 32.A OG no hydrogen 3.172 N/A SER 32.A N SER 29.A OG no hydrogen 3.308 N/A SER 32.A OG SER 29.A O no hydrogen 3.356 N/A SER 32.A OG SER 29.A OG no hydrogen 3.172 N/A MET 33.A N SER 29.A O no hydrogen 3.209 N/A GLY 35.A N ALA 31.A O no hydrogen 3.194 N/A LEU 36.A N SER 32.A O no hydrogen 2.998 N/A LEU 37.A N MET 33.A O no hydrogen 3.102 N/A THR 38.A N MET 34.A O no hydrogen 2.935 N/A THR 38.A OG1 MET 34.A O no hydrogen 2.839 N/A THR 38.A OG1 GLY 35.A O no hydrogen 3.286 N/A ASN 39.A N GLY 35.A O no hydrogen 3.151 N/A LEU 40.A N LEU 36.A O no hydrogen 2.986 N/A ALA 41.A N LEU 37.A O no hydrogen 2.933 N/A ASP 42.A N THR 38.A O no hydrogen 2.909 N/A ARG 43.A N ASN 39.A O no hydrogen 3.279 N/A ARG 43.A NH1 ASN 39.A OD1 no hydrogen 2.731 N/A ARG 43.A NH2 TYR 24.A O no hydrogen 2.350 N/A GLU 44.A N LEU 40.A O no hydrogen 2.948 N/A LEU 45.A N ALA 41.A O no hydrogen 2.910 N/A MET 48.A N GLU 44.A O no hydrogen 2.924 N/A ILE 49.A N LEU 45.A O no hydrogen 3.075 N/A ASN 50.A N VAL 46.A O no hydrogen 3.479 N/A ASN 50.A ND2 VAL 46.A O no hydrogen 2.654 N/A TRP 51.A N HIS 47.A O no hydrogen 2.877 N/A ALA 52.A N MET 48.A O no hydrogen 2.739 N/A ARG 54.A N TRP 51.A O no hydrogen 3.076 N/A ARG 54.A NH2 ASP 17.A OD2 no hydrogen 2.488 N/A VAL 55.A N ALA 52.A O no hydrogen 3.183 N/A PHE 58.A N VAL 55.A O no hydrogen 2.979 N/A ASP 60.A N GLY 57.A O no hydrogen 3.378 N/A LEU 61.A N PHE 58.A O no hydrogen 3.436 N/A ASP 65.A N THR 62.A OG1 no hydrogen 3.259 N/A GLN 66.A N THR 62.A O no hydrogen 3.057 N/A GLN 66.A NE2 PHE 58.A O no hydrogen 2.961 N/A GLN 66.A NE2 LEU 61.A O no hydrogen 3.302 N/A VAL 67.A N LEU 63.A O no hydrogen 2.957 N/A HIS 68.A N HIS 64.A O no hydrogen 3.022 N/A HIS 68.A NE2 THR 148.A OG1 no hydrogen 2.420 N/A LEU 69.A N ASP 65.A O no hydrogen 3.001 N/A LEU 70.A N GLN 66.A O no hydrogen 3.025 N/A GLU 71.A N VAL 67.A O no hydrogen 2.918 N/A CYS 72.A N HIS 68.A O no hydrogen 3.064 N/A CYS 72.A N LEU 69.A O no hydrogen 3.248 N/A CYS 72.A SG SER 144.A O no hydrogen 3.202 N/A ALA 73.A N LEU 69.A O no hydrogen 3.054 N/A ILE 77.A N ALA 73.A O no hydrogen 2.912 N/A LEU 78.A N TRP 74.A O no hydrogen 3.007 N/A MET 79.A N LEU 75.A O no hydrogen 2.905 N/A ILE 80.A N GLU 76.A O no hydrogen 2.834 N/A GLY 81.A N ILE 77.A O no hydrogen 3.158 N/A LEU 82.A N LEU 78.A O no hydrogen 2.907 N/A VAL 83.A N MET 79.A O no hydrogen 2.787 N/A TRP 84.A N ILE 80.A O no hydrogen 3.002 N/A ARG 85.A N GLY 81.A O no hydrogen 3.217 N/A ARG 85.A NE LEU 94.A O no hydrogen 2.788 N/A ARG 85.A NH2 PHE 95.A O no hydrogen 3.019 N/A SER 86.A N VAL 83.A O no hydrogen 3.230 N/A SER 86.A OG LEU 82.A O no hydrogen 2.680 N/A MET 87.A N TRP 84.A O no hydrogen 3.343 N/A HIS 89.A N SER 86.A O no hydrogen 3.112 N/A LYS 92.A N HIS 89.A O no hydrogen 3.018 N/A LEU 93.A N LEU 101.A O no hydrogen 3.143 N/A LEU 94.A N SER 86.A OG no hydrogen 2.645 N/A PHE 95.A N LEU 93.A O no hydrogen 3.172 N/A PHE 95.A N LEU 99.A O no hydrogen 3.252 N/A ALA 96.A N LEU 99.A O no hydrogen 3.487 N/A ASN 98.A ND2 SER 25.A O no hydrogen 3.028 N/A LEU 99.A N ALA 96.A O no hydrogen 2.789 N/A LEU 101.A N LEU 93.A O no hydrogen 3.011 N/A ASP 102.A N GLN 105.A OE1 no hydrogen 3.403 N/A GLN 105.A N ASP 102.A O no hydrogen 3.414 N/A PHE 113.A N MET 109.A O no hydrogen 2.563 N/A ASP 114.A N VAL 110.A O no hydrogen 2.964 N/A MET 115.A N GLU 111.A O no hydrogen 3.109 N/A LEU 116.A N ILE 112.A O no hydrogen 2.837 N/A LEU 117.A N PHE 113.A O no hydrogen 2.871 N/A ALA 118.A N ASP 114.A O no hydrogen 2.794 N/A THR 119.A N MET 115.A O no hydrogen 2.932 N/A THR 119.A OG1 MET 115.A O no hydrogen 2.712 N/A SER 120.A N LEU 116.A O no hydrogen 2.978 N/A SER 120.A OG SER 86.A O no hydrogen 3.106 N/A SER 121.A N LEU 117.A O no hydrogen 2.873 N/A ARG 122.A N ALA 118.A O no hydrogen 2.931 N/A PHE 123.A N THR 119.A O no hydrogen 2.919 N/A ARG 124.A N SER 120.A O no hydrogen 3.065 N/A ARG 124.A NH1 MET 87.A O no hydrogen 2.457 N/A MET 125.A N SER 121.A O no hydrogen 2.900 N/A MET 126.A N ARG 122.A O no hydrogen 2.985 N/A ASN 127.A N ARG 124.A O no hydrogen 3.169 N/A LEU 128.A N PHE 123.A O no hydrogen 3.044 N/A GLN 129.A N GLU 132.A OE1 no hydrogen 3.030 N/A GLN 129.A NE2 ASN 127.A O no hydrogen 2.959 N/A GLU 131.A N GLU 131.A OE1 no hydrogen 2.678 N/A GLU 132.A N GLN 129.A O no hydrogen 3.057 N/A PHE 133.A N GLN 129.A O no hydrogen 2.946 N/A VAL 134.A N GLY 130.A O no hydrogen 3.166 N/A CYS 135.A SG GLU 131.A O no hydrogen 3.362 N/A LEU 136.A N GLU 132.A O no hydrogen 3.100 N/A LYS 137.A N PHE 133.A O no hydrogen 2.932 N/A LYS 137.A NZ GLU 19.A OE1 no hydrogen 3.413 N/A LYS 137.A NZ GLU 19.A OE2 no hydrogen 2.560 N/A SER 138.A N VAL 134.A O no hydrogen 3.212 N/A SER 138.A OG VAL 134.A O no hydrogen 3.231 N/A ILE 139.A N CYS 135.A O no hydrogen 2.966 N/A ILE 140.A N LEU 136.A O no hydrogen 3.002 N/A LEU 141.A N LYS 137.A O no hydrogen 3.212 N/A LEU 142.A N SER 138.A O no hydrogen 3.108 N/A ASN 143.A N ILE 139.A O no hydrogen 2.742 N/A SER 144.A N ILE 140.A O no hydrogen 3.119 N/A SER 144.A OG GLU 76.A OE1 no hydrogen 3.561 N/A SER 144.A OG GLU 76.A OE2 no hydrogen 2.824 N/A SER 144.A OG ILE 140.A O no hydrogen 2.957 N/A VAL 146.A N ASN 143.A O no hydrogen 3.216 N/A TYR 147.A OH ASN 143.A OD1 no hydrogen 2.326 N/A THR 148.A OG1 HIS 68.A NE2 no hydrogen 2.420 N/A THR 148.A OG1 GLY 145.A O no hydrogen 2.961 N/A HIS 152.A NE2 GLY 57.A O no hydrogen 2.925 N/A HIS 154.A N LYS 150.A O no hydrogen 3.153 N/A ARG 155.A N ASP 151.A O no hydrogen 3.070 N/A ARG 155.A NE ASP 151.A O no hydrogen 3.311 N/A VAL 156.A N HIS 152.A O no hydrogen 3.005 N/A LEU 157.A N ILE 153.A O no hydrogen 2.884 N/A ASP 158.A N HIS 154.A O no hydrogen 2.992 N/A LYS 159.A N ARG 155.A O no hydrogen 3.048 N/A LYS 159.A NZ LEU 6.A O no hydrogen 2.699 N/A ILE 160.A N VAL 156.A O no hydrogen 3.004 N/A THR 161.A N LEU 157.A O no hydrogen 2.952 N/A THR 161.A OG1 LEU 157.A O no hydrogen 3.028 N/A ASP 162.A N ASP 158.A O no hydrogen 2.989 N/A THR 163.A N LYS 159.A O no hydrogen 2.972 N/A THR 163.A OG1 LYS 159.A O no hydrogen 2.942 N/A LEU 164.A N ILE 160.A O no hydrogen 2.803 N/A ILE 165.A N THR 161.A O no hydrogen 3.101 N/A HIS 166.A N ASP 162.A O no hydrogen 2.849 N/A HIS 166.A NE2 ASP 9.A OD1 no hydrogen 2.754 N/A LEU 167.A N THR 163.A O no hydrogen 2.964 N/A MET 168.A N LEU 164.A O no hydrogen 3.081 N/A ALA 169.A N ILE 165.A O no hydrogen 2.842 N/A LYS 170.A N HIS 166.A O no hydrogen 3.039 N/A LYS 170.A NZ ASP 9.A OD1 no hydrogen 2.707 N/A LYS 170.A NZ HIS 166.A NE2 no hydrogen 3.557 N/A ALA 171.A N LEU 167.A O no hydrogen 2.935 N/A GLY 172.A N ALA 169.A O no hydrogen 3.161 N/A LEU 173.A N MET 168.A O no hydrogen 3.093 N/A THR 174.A N GLN 177.A OE1 no hydrogen 2.910 N/A GLN 177.A N THR 174.A OG1 no hydrogen 3.256 N/A GLN 178.A N THR 174.A O no hydrogen 2.972 N/A GLN 178.A NE2 LEU 173.A O no hydrogen 3.143 N/A GLN 180.A N GLN 176.A O no hydrogen 3.183 N/A ARG 181.A N GLN 177.A O no hydrogen 2.909 N/A ARG 181.A NE GLU 132.A OE2 no hydrogen 2.764 N/A ARG 181.A NH1 MET 126.A O no hydrogen 2.895 N/A ARG 181.A NH2 MET 126.A O no hydrogen 2.942 N/A ARG 181.A NH2 GLU 132.A OE1 no hydrogen 2.783 N/A ARG 181.A NH2 GLU 132.A OE2 no hydrogen 3.486 N/A LEU 182.A N GLN 178.A O no hydrogen 2.866 N/A ALA 183.A N HIS 179.A O no hydrogen 3.081 N/A GLN 184.A N GLN 180.A O no hydrogen 2.972 N/A LEU 185.A N ARG 181.A O no hydrogen 2.978 N/A LEU 186.A N LEU 182.A O no hydrogen 3.200 N/A LEU 187.A N ALA 183.A O no hydrogen 3.001 N/A ILE 188.A N LEU 185.A O no hydrogen 3.120 N/A LEU 189.A N LEU 186.A O no hydrogen 3.254 N/A SER 190.A N LEU 187.A O no hydrogen 3.262 N/A ILE 192.A N ILE 188.A O no hydrogen 2.978 N/A ARG 193.A N LEU 189.A O no hydrogen 2.863 N/A ARG 193.A NH1 SER 144.A O no hydrogen 3.297 N/A ARG 193.A NH2 SER 144.A O no hydrogen 2.952 N/A HIS 194.A N SER 190.A O no hydrogen 3.153 N/A MET 195.A N HIS 191.A O no hydrogen 2.860 N/A SER 196.A N ILE 192.A O no hydrogen 3.038 N/A ASN 197.A N ARG 193.A O no hydrogen 3.124 N/A LYS 198.A N HIS 194.A O no hydrogen 3.133 N/A GLY 199.A N MET 195.A O no hydrogen 2.815 N/A MET 200.A N SER 196.A O no hydrogen 2.693 N/A GLU 201.A N ASN 197.A O no hydrogen 3.179 N/A HIS 202.A N LYS 198.A O no hydrogen 3.286 N/A LEU 203.A N GLY 199.A O no hydrogen 3.056 N/A TYR 204.A N MET 200.A O no hydrogen 3.070 N/A TYR 204.A N GLU 201.A O no hydrogen 3.196 N/A SER 205.A N GLU 201.A O no hydrogen 3.337 N/A SER 205.A OG HIS 202.A O no hydrogen 2.590 N/A MET 206.A N HIS 202.A O no hydrogen 3.112 N/A LYS 207.A N LEU 203.A O no hydrogen 3.207 N/A CYS 208.A N TYR 204.A O no hydrogen 3.054 N/A CYS 208.A SG TYR 204.A O no hydrogen 3.198 N/A LYS 209.A N SER 205.A O no hydrogen 2.794 N/A ASN 210.A N MET 206.A O no hydrogen 3.201 N/A ASN 210.A N LYS 207.A O no hydrogen 3.077 N/A ASN 210.A ND2 LYS 207.A O no hydrogen 3.652 N/A SER 215.A OG ASP 42.A OD1 no hydrogen 2.564 N/A LEU 218.A N SER 215.A OG no hydrogen 3.324 N/A LEU 219.A N SER 215.A O no hydrogen 2.837 N/A GLU 220.A N ASP 216.A O no hydrogen 2.809 N/A MET 221.A N LEU 217.A O no hydrogen 2.972 N/A LEU 222.A N LEU 218.A O no hydrogen 3.268 N/A ASP 223.A N LEU 219.A O no hydrogen 2.902 N/A ALA 224.A N GLU 220.A O no hydrogen 3.344 N/A HIS 225.A N LEU 222.A O no hydrogen 3.386 N/A HIS 225.A NE2 GLU 71.A O no hydrogen 2.690 N/A ARG 226.A N ASP 223.A O no hydrogen 2.945 N/A