Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6mr3_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 4.A N THR 49.A O no hydrogen 2.710 N/A ARG 6.A N LEU 47.A O no hydrogen 2.855 N/A ARG 6.A NH1 ASP 62.A OD1 no hydrogen 2.515 N/A ARG 6.A NH1 GLU 65.A OE1 no hydrogen 2.715 N/A ARG 6.A NH2 ASP 58.A O no hydrogen 3.429 N/A ARG 6.A NH2 ASP 58.A OD2 no hydrogen 3.346 N/A ARG 6.A NH2 ASP 62.A OD1 no hydrogen 2.888 N/A LEU 8.A N ILE 45.A O no hydrogen 2.823 N/A ARG 9.A N GLY 80.A O no hydrogen 2.986 N/A ARG 9.A NE TYR 79.A OH no hydrogen 2.720 N/A ARG 9.A NH1 GLY 82.A O no hydrogen 2.861 N/A ARG 9.A NH2 GLU 42.A OE1 no hydrogen 3.185 N/A PHE 10.A N VAL 43.A O no hydrogen 2.899 N/A PHE 11.A N TYR 77.A O no hydrogen 2.837 N/A LEU 18.A N GLY 14.A O no hydrogen 2.878 N/A THR 20.A OG1 SER 16.A O no hydrogen 3.149 N/A LEU 21.A N HIS 17.A O no hydrogen 3.501 N/A LEU 22.A N LEU 18.A O no hydrogen 3.181 N/A HIS 23.A N VAL 19.A O no hydrogen 2.772 N/A LEU 25.A N LEU 22.A O no hydrogen 2.685 N/A ILE 26.A N LEU 22.A O no hydrogen 2.881 N/A ALA 27.A N HIS 23.A O no hydrogen 2.700 N/A GLN 29.A N ILE 26.A O no hydrogen 3.409 N/A GLN 29.A NE2 ILE 26.A O no hydrogen 2.977 N/A THR 33.A N SER 48.A O no hydrogen 2.802 N/A THR 33.A OG1 SER 48.A O no hydrogen 3.419 N/A ILE 34.A N GLN 29.A OE1 no hydrogen 2.850 N/A ALA 35.A N ARG 46.A O no hydrogen 2.891 N/A TYR 37.A N THR 44.A O no hydrogen 2.853 N/A LYS 39.A N GLU 42.A O no hydrogen 3.054 N/A GLU 42.A N LYS 39.A O no hydrogen 3.097 N/A VAL 43.A N PHE 10.A O no hydrogen 3.217 N/A THR 44.A N TYR 37.A O no hydrogen 2.736 N/A THR 44.A OG1 TYR 37.A O no hydrogen 3.095 N/A ILE 45.A N LEU 8.A O no hydrogen 2.821 N/A ARG 46.A N ALA 35.A O no hydrogen 2.728 N/A ARG 46.A NE TYR 37.A OH no hydrogen 3.363 N/A LEU 47.A N ARG 6.A O no hydrogen 2.810 N/A SER 48.A N THR 33.A O no hydrogen 3.090 N/A THR 49.A N TYR 4.A O no hydrogen 2.792 N/A THR 49.A OG1 ASP 31.A OD1 no hydrogen 3.408 N/A THR 49.A OG1 ASP 31.A OD2 no hydrogen 2.707 N/A THR 49.A OG1 LYS 50.A O no hydrogen 3.560 N/A ALA 51.A N LYS 2.A O no hydrogen 3.397 N/A ALA 57.A N ARG 53.A O no hydrogen 3.201 N/A ASP 58.A N GLN 54.A O no hydrogen 2.903 N/A SER 59.A N LYS 55.A O no hydrogen 3.116 N/A LYS 60.A N GLU 56.A O no hydrogen 3.360 N/A LYS 60.A NZ ASP 31.A OD2 no hydrogen 3.143 N/A LYS 60.A NZ THR 49.A OG1 no hydrogen 2.699 N/A LYS 60.A NZ LYS 50.A O no hydrogen 2.770 N/A LEU 61.A N ALA 57.A O no hydrogen 2.809 N/A ASP 62.A N ASP 58.A O no hydrogen 2.786 N/A LEU 64.A N LYS 60.A O no hydrogen 3.486 N/A GLU 65.A N LEU 61.A O no hydrogen 3.060 N/A LYS 66.A N ASP 62.A O no hydrogen 3.018 N/A LYS 67.A N LYS 63.A O no hydrogen 3.271 N/A ILE 68.A N LEU 64.A O no hydrogen 3.069 N/A ILE 69.A N GLU 65.A O no hydrogen 2.919 N/A THR 70.A N LYS 66.A O no hydrogen 3.386 N/A THR 70.A OG1 LYS 66.A O no hydrogen 2.783 N/A ILE 71.A N ILE 68.A O no hydrogen 3.178 N/A LEU 74.A N ILE 71.A O no hydrogen 3.100 N/A ASP 76.A N ASN 73.A O no hydrogen 2.759 N/A TYR 77.A N LEU 74.A O no hydrogen 2.959 N/A PHE 78.A N LEU 74.A O no hydrogen 2.851 N/A TYR 79.A N ARG 9.A O no hydrogen 2.922 N/A TYR 79.A OH GLU 42.A OE1 no hydrogen 2.475 N/A TYR 81.A OH GLU 65.A OE2 no hydrogen 2.474 N/A GLY 82.A N VAL 7.A O no hydrogen 3.129 N/A ASN 85.A ND2 TYR 81.A O no hydrogen 2.979 N/A SER 86.A N ASN 85.A OD1 no hydrogen 2.958 N/A VAL 90.A N SER 86.A O no hydrogen 2.929 N/A VAL 91.A N LEU 87.A O no hydrogen 2.908 N/A PHE 92.A N PRO 88.A O no hydrogen 2.831 N/A ASP 93.A N GLN 89.A O no hydrogen 2.986 N/A LEU 94.A N VAL 90.A O no hydrogen 2.915 N/A LEU 95.A N VAL 91.A O no hydrogen 2.755 N/A LYS 96.A N PHE 92.A O no hydrogen 3.043 N/A LYS 96.A NZ GLY 122.A O no hydrogen 3.157 N/A LYS 96.A NZ ASP 125.A OD2 no hydrogen 3.113 N/A GLU 97.A N ASP 93.A O no hydrogen 2.825 N/A LYS 98.A N LEU 94.A O no hydrogen 3.109 N/A GLY 99.A N LYS 96.A O no hydrogen 3.347 N/A LYS 100.A N LEU 95.A O no hydrogen 3.099 N/A THR 101.A N ASP 173.A OD2 no hydrogen 2.849 N/A THR 101.A OG1 ASP 173.A OD2 no hydrogen 3.367 N/A ILE 102.A N ILE 126.A O no hydrogen 2.884 N/A THR 103.A N LEU 174.A O no hydrogen 2.903 N/A THR 103.A OG1 GLY 129.A O no hydrogen 2.679 N/A ALA 105.A N ILE 176.A O no hydrogen 2.955 N/A GLU 106.A N PHE 131.A O no hydrogen 2.969 N/A SER 107.A N LEU 178.A O no hydrogen 2.974 N/A SER 107.A OG THR 133.A O no hydrogen 2.939 N/A SER 107.A OG TYR 134.A O no hydrogen 3.531 N/A THR 109.A OG1 GLU 106.A OE1 no hydrogen 2.732 N/A GLY 111.A N GLU 106.A OE1 no hydrogen 3.031 N/A LEU 112.A N THR 109.A O no hydrogen 3.227 N/A PHE 113.A N GLU 106.A OE1 no hydrogen 2.912 N/A GLN 114.A N GLU 106.A OE2 no hydrogen 3.015 N/A GLN 114.A NE2 GLU 106.A OE2 no hydrogen 2.699 N/A GLN 114.A NE2 PHE 131.A O no hydrogen 3.448 N/A ALA 115.A N GLY 111.A O no hydrogen 2.869 N/A ARG 116.A N LEU 112.A O no hydrogen 3.060 N/A ARG 116.A NH1 ASP 119.A OD2 no hydrogen 2.676 N/A LEU 117.A N PHE 113.A O no hydrogen 3.267 N/A ALA 118.A N GLN 114.A O no hydrogen 3.182 N/A ASP 119.A N ARG 116.A O no hydrogen 3.140 N/A PHE 120.A N LEU 117.A O no hydrogen 3.448 N/A ALA 123.A N PHE 120.A O no hydrogen 3.135 N/A ASP 125.A N GLY 122.A O no hydrogen 3.022 N/A ILE 126.A N ALA 123.A O no hydrogen 2.920 N/A LYS 128.A NZ SER 124.A O no hydrogen 2.806 N/A PHE 131.A N ALA 104.A O no hydrogen 2.866 N/A THR 133.A N GLU 106.A O no hydrogen 2.788 N/A GLU 138.A N SER 135.A OG no hydrogen 3.119 N/A LYS 139.A N SER 135.A O no hydrogen 3.115 N/A LYS 139.A NZ SER 107.A OG no hydrogen 2.696 N/A LYS 139.A NZ THR 133.A O no hydrogen 2.766 N/A LYS 139.A NZ SER 135.A O no hydrogen 3.308 N/A ALA 140.A N ILE 136.A O no hydrogen 3.116 N/A ARG 141.A N GLU 137.A O no hydrogen 2.811 N/A ARG 141.A NE GLU 138.A OE1 no hydrogen 3.489 N/A ARG 141.A NE GLU 138.A OE2 no hydrogen 3.095 N/A ARG 141.A NH2 GLU 138.A OE2 no hydrogen 2.738 N/A GLY 143.A N ALA 140.A O no hydrogen 2.851 N/A LEU 149.A N PRO 145.A O no hydrogen 3.175 N/A GLN 150.A N PHE 146.A O no hydrogen 2.938 N/A GLN 150.A NE2 GLU 147.A OE1 no hydrogen 3.005 N/A LEU 151.A N GLU 147.A O no hydrogen 2.658 N/A HIS 152.A N ASP 148.A O no hydrogen 2.927 N/A GLY 153.A N LEU 149.A O no hydrogen 2.759 N/A VAL 154.A N GLU 188.A OE2 no hydrogen 2.911 N/A VAL 155.A N GLU 188.A OE1 no hydrogen 3.028 N/A SER 156.A OG GLY 153.A O no hydrogen 2.837 N/A SER 156.A OG THR 159.A OG1 no hydrogen 3.314 N/A THR 159.A N SER 156.A OG no hydrogen 3.096 N/A THR 159.A OG1 GLY 153.A O no hydrogen 2.706 N/A THR 159.A OG1 SER 156.A OG no hydrogen 3.314 N/A ALA 160.A N SER 156.A O no hydrogen 3.080 N/A GLU 161.A N ALA 157.A O no hydrogen 2.854 N/A LYS 162.A N PHE 158.A O no hydrogen 2.993 N/A GLU 164.A N GLU 161.A O no hydrogen 2.930 N/A ARG 165.A N LYS 162.A O no hydrogen 2.903 N/A ARG 165.A NE LEU 142.A O no hydrogen 2.655 N/A ARG 165.A NH1 GLN 168.A OE1 no hydrogen 2.762 N/A ARG 165.A NH2 LEU 142.A O no hydrogen 3.567 N/A SER 166.A OG ALA 163.A O no hydrogen 3.143 N/A ARG 167.A N ALA 163.A O no hydrogen 2.990 N/A ARG 167.A NE SER 200.A OG no hydrogen 2.918 N/A GLN 168.A N GLU 164.A O no hydrogen 2.980 N/A LEU 169.A N ARG 165.A O no hydrogen 2.827 N/A THR 170.A N SER 166.A O no hydrogen 3.173 N/A THR 170.A OG1 SER 166.A O no hydrogen 2.880 N/A THR 170.A OG1 ARG 167.A O no hydrogen 3.528 N/A GLN 171.A N ARG 167.A O no hydrogen 2.596 N/A GLN 171.A NE2 GLN 168.A O no hydrogen 3.068 N/A ALA 172.A N THR 170.A OG1 no hydrogen 3.233 N/A ASP 173.A N THR 101.A OG1 no hydrogen 3.172 N/A LEU 174.A N THR 101.A O no hydrogen 2.997 N/A ALA 175.A N SER 200.A O no hydrogen 2.973 N/A ILE 176.A N THR 103.A O no hydrogen 3.027 N/A SER 177.A N GLY 198.A O no hydrogen 2.955 N/A SER 177.A OG ALA 160.A O no hydrogen 2.541 N/A LEU 178.A N ALA 105.A O no hydrogen 3.216 N/A THR 179.A N PHE 196.A O no hydrogen 3.071 N/A THR 179.A OG1 VAL 154.A O no hydrogen 2.643 N/A VAL 181.A N THR 194.A O no hydrogen 2.816 N/A LEU 187.A N GLN 190.A O no hydrogen 2.926 N/A GLN 190.A N LEU 187.A O no hydrogen 2.803 N/A GLN 190.A NE2 VAL 155.A O no hydrogen 3.173 N/A GLY 193.A N VAL 181.A O no hydrogen 2.843 N/A THR 194.A N PRO 191.A O no hydrogen 3.090 N/A THR 194.A OG1 PRO 191.A O no hydrogen 2.873 N/A VAL 195.A N VAL 209.A O no hydrogen 2.882 N/A PHE 196.A N THR 179.A O no hydrogen 2.784 N/A ILE 197.A N ILE 207.A O no hydrogen 2.956 N/A GLY 198.A N SER 177.A O no hydrogen 3.069 N/A GLY 198.A N SER 177.A OG no hydrogen 2.993 N/A SER 200.A N ALA 175.A O no hydrogen 2.943 N/A SER 200.A OG SER 201.A O no hydrogen 3.565 N/A SER 200.A OG THR 205.A OG1 no hydrogen 2.758 N/A SER 201.A N ARG 204.A O no hydrogen 2.825 N/A SER 201.A OG ARG 204.A O no hydrogen 3.488 N/A SER 201.A OG LEU 241.A O no hydrogen 2.637 N/A SER 202.A OG VAL 242.A OXT no hydrogen 3.528 N/A LYS 203.A N SER 201.A OG no hydrogen 3.302 N/A ARG 204.A N SER 201.A OG no hydrogen 3.387 N/A THR 205.A OG1 SER 200.A OG no hydrogen 2.758 N/A ILE 207.A N ILE 197.A O no hydrogen 2.912 N/A VAL 209.A N VAL 195.A O no hydrogen 2.863 N/A ILE 211.A N GLY 193.A O no hydrogen 2.681 N/A ARG 214.A NH2 ASP 218.A OD2 no hydrogen 2.961 N/A SER 215.A OG SER 217.A OG no hydrogen 3.388 N/A SER 217.A OG SER 215.A OG no hydrogen 3.388 N/A ASP 218.A N SER 215.A OG no hydrogen 3.118 N/A VAL 219.A N SER 215.A O no hydrogen 2.923 N/A ARG 220.A N ARG 216.A O no hydrogen 3.160 N/A ARG 220.A NE LEU 108.A O no hydrogen 2.953 N/A ARG 220.A NH2 THR 109.A O no hydrogen 3.063 N/A TYR 221.A N SER 217.A O no hydrogen 2.976 N/A ILE 222.A N ASP 218.A O no hydrogen 2.829 N/A ALA 223.A N VAL 219.A O no hydrogen 2.818 N/A VAL 224.A N ARG 220.A O no hydrogen 3.166 N/A LEU 225.A N TYR 221.A O no hydrogen 3.403 N/A HIS 226.A N ILE 222.A O no hydrogen 3.026 N/A ALA 227.A N ALA 223.A O no hydrogen 3.002 N/A PHE 228.A N VAL 224.A O no hydrogen 2.940 N/A ASN 229.A N LEU 225.A O no hydrogen 2.815 N/A LEU 230.A N HIS 226.A O no hydrogen 3.013 N/A VAL 231.A N ALA 227.A O no hydrogen 3.128 N/A ARG 232.A N PHE 228.A O no hydrogen 2.906 N/A ARG 232.A NE ASN 229.A OD1 no hydrogen 2.932 N/A ARG 232.A NH2 ASN 229.A OD1 no hydrogen 2.844 N/A GLN 233.A N ASN 229.A O no hydrogen 2.935 N/A THR 234.A N LEU 230.A O no hydrogen 3.138 N/A THR 234.A OG1 LEU 230.A O no hydrogen 2.775 N/A LEU 235.A N VAL 231.A O no hydrogen 2.945 N/A LEU 236.A N ARG 232.A O no hydrogen 2.921 N/A SER 237.A N GLN 233.A O no hydrogen 2.943 N/A LYS 239.A N SER 237.A OG no hydrogen 3.135 N/A