Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2is9_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 6.A OH GLU 63.A OE2 no hydrogen 2.562 N/A LEU 10.A N PRO 7.A O no hydrogen 3.018 N/A THR 11.A N PRO 7.A O no hydrogen 3.153 N/A THR 11.A OG1 PRO 7.A O no hydrogen 3.318 N/A THR 11.A OG1 LYS 8.A O no hydrogen 2.952 N/A GLN 12.A N LYS 8.A O no hydrogen 2.894 N/A VAL 13.A N GLU 9.A O no hydrogen 3.231 N/A PHE 14.A N LEU 10.A O no hydrogen 3.227 N/A GLU 15.A N THR 11.A O no hydrogen 2.908 N/A HIS 16.A N GLN 12.A O no hydrogen 2.957 N/A TYR 17.A N VAL 13.A O no hydrogen 3.346 N/A TYR 17.A N PHE 14.A O no hydrogen 3.237 N/A ILE 18.A N PHE 14.A O no hydrogen 2.982 N/A ASN 19.A N LEU 22.A O no hydrogen 2.824 N/A LEU 22.A N ASN 19.A O no hydrogen 3.048 N/A ASP 24.A N SER 27.A OG no hydrogen 3.183 N/A SER 27.A N ASP 24.A OD1 no hydrogen 3.020 N/A SER 27.A OG TYR 17.A O no hydrogen 2.655 N/A SER 27.A OG ASN 19.A OD1 no hydrogen 3.182 N/A SER 27.A OG LEU 22.A O no hydrogen 3.455 N/A SER 27.A OG ASP 24.A OD1 no hydrogen 3.353 N/A LEU 28.A N ASP 24.A O no hydrogen 2.923 N/A VAL 29.A N ILE 25.A O no hydrogen 2.873 N/A LYS 30.A N ASP 26.A O no hydrogen 3.115 N/A LYS 30.A NZ GLU 33.A OE1 no hydrogen 2.825 N/A PHE 31.A N SER 27.A O no hydrogen 2.883 N/A ILE 32.A N LEU 28.A O no hydrogen 2.804 N/A GLU 33.A N VAL 29.A O no hydrogen 3.065 N/A GLU 34.A N LYS 30.A O no hydrogen 3.042 N/A LEU 35.A N PHE 31.A O no hydrogen 2.955 N/A GLY 36.A N ILE 32.A O no hydrogen 3.190 N/A GLY 36.A N GLU 33.A O no hydrogen 3.125 N/A TYR 37.A N ILE 32.A O no hydrogen 3.015 N/A ASN 38.A N ASP 41.A OD2 no hydrogen 2.887 N/A GLU 40.A N GLU 40.A OE1 no hydrogen 2.788 N/A ASP 41.A N ASN 38.A O no hydrogen 3.077 N/A THR 44.A N ASP 41.A O no hydrogen 3.108 N/A THR 44.A OG1 ASN 38.A O no hydrogen 2.742 N/A CYS 46.A N LEU 42.A O no hydrogen 3.301 N/A CYS 46.A SG LEU 42.A O no hydrogen 3.768 N/A CYS 46.A SG TYR 97.A OH no hydrogen 3.418 N/A LEU 47.A N ALA 43.A O no hydrogen 2.999 N/A ALA 48.A N THR 44.A O no hydrogen 2.894 N/A HIS 49.A N LEU 45.A O no hydrogen 2.917 N/A LEU 50.A N CYS 46.A O no hydrogen 2.961 N/A LEU 51.A N LEU 47.A O no hydrogen 3.002 N/A GLY 52.A N HIS 49.A O no hydrogen 3.168 N/A TYR 53.A N ALA 48.A O no hydrogen 2.961 N/A LYS 55.A NZ ASN 107.A O no hydrogen 3.064 N/A LYS 55.A NZ ASN 107.A OD1 no hydrogen 2.754 N/A LYS 55.A NZ LEU 110.A O no hydrogen 3.514 N/A LEU 56.A N LEU 108.A O no hydrogen 2.990 N/A GLU 58.A N LYS 55.A O no hydrogen 3.081 N/A LEU 60.A N PHE 23.A O no hydrogen 2.979 N/A PHE 65.A N LYS 61.A O no hydrogen 3.091 N/A LEU 66.A N ARG 62.A O no hydrogen 2.954 N/A SER 67.A N GLU 63.A O no hydrogen 2.864 N/A SER 67.A OG GLU 63.A O no hydrogen 2.803 N/A SER 67.A OG ASP 64.A O no hydrogen 3.569 N/A THR 68.A N ASP 64.A O no hydrogen 3.209 N/A THR 68.A OG1 ASP 64.A O no hydrogen 2.701 N/A TRP 69.A N PHE 65.A O no hydrogen 3.225 N/A PHE 70.A N LEU 66.A O no hydrogen 2.877 N/A MET 71.A N SER 67.A O no hydrogen 2.908 N/A GLN 72.A N THR 68.A O no hydrogen 3.171 N/A GLY 73.A N PHE 70.A O no hydrogen 2.992 N/A CYS 74.A N TRP 69.A O no hydrogen 2.870 N/A CYS 74.A SG GLN 72.A O no hydrogen 3.613 N/A CYS 74.A SG ASP 79.A O no hydrogen 3.567 N/A SER 75.A N ASP 79.A OD2 no hydrogen 2.964 N/A SER 75.A OG ASP 79.A OD2 no hydrogen 3.506 N/A THR 76.A N ASP 79.A OD2 no hydrogen 3.337 N/A THR 76.A OG1 SER 78.A OG no hydrogen 3.066 N/A SER 78.A OG THR 76.A OG1 no hydrogen 3.066 N/A ASP 79.A N THR 76.A OG1 no hydrogen 3.173 N/A MET 80.A N THR 76.A O no hydrogen 3.019 N/A GLN 81.A N ILE 77.A O no hydrogen 2.795 N/A GLN 81.A NE2 GLU 34.A O no hydrogen 3.002 N/A GLU 82.A N SER 78.A O no hydrogen 3.028 N/A CYS 83.A N ASP 79.A O no hydrogen 2.958 N/A ILE 84.A N MET 80.A O no hydrogen 2.994 N/A LYS 85.A N GLN 81.A O no hydrogen 3.000 N/A THR 86.A N GLU 82.A O no hydrogen 3.031 N/A THR 86.A OG1 GLU 82.A O no hydrogen 3.154 N/A LEU 87.A N CYS 83.A O no hydrogen 2.954 N/A ASP 88.A N ILE 84.A O no hydrogen 2.834 N/A VAL 89.A N LYS 85.A O no hydrogen 3.039 N/A LYS 90.A N THR 86.A O no hydrogen 3.081 N/A LEU 91.A N LEU 87.A O no hydrogen 2.872 N/A HIS 92.A N ASP 88.A O no hydrogen 3.212 N/A HIS 92.A ND1 ASP 88.A O no hydrogen 2.615 N/A HIS 92.A NE2 GLU 133.A OE2 no hydrogen 2.738 N/A GLU 93.A N VAL 89.A O no hydrogen 3.040 N/A GLU 93.A N LYS 90.A O no hydrogen 3.183 N/A ASP 94.A N LYS 90.A O no hydrogen 2.744 N/A TYR 97.A N ASP 94.A OD1 no hydrogen 2.956 N/A PHE 98.A N ASP 94.A O no hydrogen 2.843 N/A THR 99.A N LEU 95.A O no hydrogen 2.932 N/A THR 99.A OG1 LEU 95.A O no hydrogen 3.111 N/A GLN 100.A N GLN 96.A O no hydrogen 2.939 N/A ILE 101.A N TYR 97.A O no hydrogen 2.842 N/A TYR 102.A N PHE 98.A O no hydrogen 2.842 N/A TYR 102.A OH TRP 163.A O no hydrogen 2.575 N/A ASN 103.A N THR 99.A O no hydrogen 2.967 N/A TYR 104.A N GLN 100.A O no hydrogen 2.910 N/A TYR 104.A OH TYR 53.A O no hydrogen 2.599 N/A ALA 105.A N ILE 101.A O no hydrogen 2.985 N/A LEU 108.A N TYR 104.A O no hydrogen 3.116 N/A ILE 109.A N ALA 105.A O no hydrogen 3.171 N/A LEU 110.A N ASN 107.A O no hydrogen 3.394 N/A ARG 114.A N ASP 111.A O no hydrogen 3.367 N/A ARG 114.A NH1 ASP 118.A OD1 no hydrogen 3.051 N/A ARG 114.A NH2 ASP 118.A OD1 no hydrogen 2.616 N/A ILE 117.A N ILE 158.A O no hydrogen 3.062 N/A THR 119.A N THR 156.A O no hydrogen 3.028 N/A THR 119.A OG1 LYS 155.A O no hydrogen 2.632 N/A GLY 122.A N ASP 118.A O no hydrogen 3.066 N/A ILE 123.A N THR 119.A O no hydrogen 2.890 N/A GLN 124.A N ASP 120.A O no hydrogen 3.051 N/A TYR 125.A N GLU 121.A O no hydrogen 3.193 N/A TRP 126.A N GLY 122.A O no hydrogen 2.825 N/A TRP 126.A NE1 TYR 102.A OH no hydrogen 3.002 N/A LYS 127.A N ILE 123.A O no hydrogen 2.884 N/A LEU 128.A N TYR 125.A O no hydrogen 2.989 N/A PHE 129.A N TYR 125.A O no hydrogen 2.885 N/A PHE 130.A N TRP 126.A O no hydrogen 3.084 N/A GLN 131.A N LEU 128.A O no hydrogen 3.316 N/A TYR 134.A N GLN 131.A O no hydrogen 3.123 N/A GLU 139.A N PRO 174.A O no hydrogen 2.938 N/A LEU 142.A N GLU 139.A O no hydrogen 3.102 N/A LEU 143.A N GLU 139.A O no hydrogen 3.417 N/A GLU 144.A N PRO 140.A O no hydrogen 2.941 N/A ALA 145.A N ASP 141.A O no hydrogen 2.923 N/A TRP 146.A N LEU 142.A O no hydrogen 2.996 N/A PHE 147.A N LEU 143.A O no hydrogen 3.123 N/A ARG 148.A N GLU 144.A O no hydrogen 2.934 N/A ARG 148.A NH2 GLN 203.A OE1 no hydrogen 3.176 N/A PHE 149.A N ALA 145.A O no hydrogen 2.773 N/A LEU 150.A N TRP 146.A O no hydrogen 3.044 N/A ARG 151.A N PHE 147.A O no hydrogen 3.033 N/A ASP 152.A N ARG 148.A O no hydrogen 2.740 N/A GLU 153.A N PHE 149.A O no hydrogen 2.905 N/A GLY 154.A N ARG 151.A O no hydrogen 3.209 N/A LYS 155.A N LEU 150.A O no hydrogen 2.753 N/A THR 157.A OG1 ASP 116.A OD1 no hydrogen 3.201 N/A ILE 158.A N ILE 117.A O no hydrogen 2.777 N/A SER 159.A OG THR 162.A OG1 no hydrogen 3.247 N/A THR 162.A N SER 159.A OG no hydrogen 3.153 N/A THR 162.A OG1 SER 159.A OG no hydrogen 3.247 N/A TRP 163.A N SER 159.A O no hydrogen 2.990 N/A TRP 163.A NE1 TYR 102.A O no hydrogen 2.883 N/A ARG 164.A N LYS 160.A O no hydrogen 2.935 N/A MET 165.A N ASP 161.A O no hydrogen 2.978 N/A LEU 166.A N THR 162.A O no hydrogen 3.022 N/A PHE 169.A N MET 165.A O no hydrogen 2.930 N/A PHE 170.A N LEU 166.A O no hydrogen 2.909 N/A LYS 171.A N LEU 167.A O no hydrogen 3.132 N/A ARG 172.A N LEU 168.A O no hydrogen 2.858 N/A ARG 172.A NH1 ARG 172.A O no hydrogen 3.104 N/A TYR 173.A N PHE 169.A O no hydrogen 2.817 N/A ILE 176.A N GLU 139.A OE1 no hydrogen 2.675 N/A GLN 177.A NE2 SER 181.A OG no hydrogen 2.904 N/A LYS 178.A N THR 175.A OG1 no hydrogen 3.021 N/A ILE 179.A N THR 175.A O no hydrogen 3.196 N/A ILE 180.A N ILE 176.A O no hydrogen 2.867 N/A SER 181.A N GLN 177.A O no hydrogen 2.840 N/A SER 181.A OG GLN 177.A O no hydrogen 3.257 N/A ASP 182.A N LYS 178.A O no hydrogen 2.831 N/A TYR 183.A N ILE 179.A O no hydrogen 3.011 N/A TYR 183.A OH ASP 194.A OD1 no hydrogen 2.583 N/A THR 186.A N ASP 184.A OD1 no hydrogen 2.890 N/A THR 186.A OG1 ASP 184.A OD1 no hydrogen 2.698 N/A THR 186.A OG1 ASP 184.A OD2 no hydrogen 3.265 N/A ALA 187.A N ASP 184.A O no hydrogen 2.980 N/A ILE 193.A N PRO 190.A O no hydrogen 3.029 N/A ASP 194.A N PRO 190.A O no hydrogen 3.175 N/A GLU 195.A N PHE 191.A O no hydrogen 2.943 N/A PHE 196.A N ILE 192.A O no hydrogen 3.001 N/A TYR 197.A N ILE 193.A O no hydrogen 2.870 N/A GLU 198.A N ASP 194.A O no hydrogen 3.029 N/A CYS 199.A N GLU 195.A O no hydrogen 2.947 N/A LEU 200.A N PHE 196.A O no hydrogen 2.849 N/A GLN 201.A N TYR 197.A O no hydrogen 2.862 N/A ASP 202.A N GLU 198.A O no hydrogen 2.986 N/A GLN 203.A N CYS 199.A O no hydrogen 3.172 N/A GLN 203.A N LEU 200.A O no hydrogen 3.259 N/A GLN 203.A NE2 CYS 199.A O no hydrogen 3.348 N/A GLN 204.A N GLN 201.A O no hydrogen 3.233 N/A GLN 204.A NE2 LEU 200.A O no hydrogen 3.688 N/A