Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4cmg_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 4.A N ASP 87.A OD1 no hydrogen 2.862 N/A ALA 5.A N ARG 28.A O no hydrogen 2.887 N/A VAL 6.A N VAL 88.A O no hydrogen 2.812 N/A VAL 7.A N VAL 30.A O no hydrogen 3.078 N/A THR 8.A N VAL 90.A O no hydrogen 3.092 N/A THR 8.A OG1 VAL 90.A O no hydrogen 3.299 N/A GLY 9.A N HIS 32.A ND1 no hydrogen 3.044 N/A ALA 10.A N HIS 32.A O no hydrogen 2.881 N/A LYS 12.A NZ SER 36.A OG no hydrogen 2.709 N/A ARG 13.A NH1 LEU 190.A O no hydrogen 2.903 N/A ARG 13.A NH2 LEU 190.A O no hydrogen 3.239 N/A ARG 16.A N LYS 12.A O no hydrogen 3.101 N/A ALA 17.A N ARG 13.A O no hydrogen 3.260 N/A ILE 18.A N ILE 14.A O no hydrogen 3.020 N/A ALA 19.A N GLY 15.A O no hydrogen 2.914 N/A VAL 20.A N ARG 16.A O no hydrogen 2.827 N/A LYS 21.A N ALA 17.A O no hydrogen 2.845 N/A LYS 21.A NZ GLU 217.A OE2 no hydrogen 2.980 N/A LYS 21.A NZ ASP 221.A OD1 no hydrogen 3.248 N/A LEU 22.A N ILE 18.A O no hydrogen 2.868 N/A HIS 23.A N ALA 19.A O no hydrogen 2.902 N/A HIS 23.A NE2 THR 54.A OG1 no hydrogen 2.724 N/A GLN 24.A N VAL 20.A O no hydrogen 2.938 N/A THR 25.A N LYS 21.A O no hydrogen 3.079 N/A THR 25.A OG1 LYS 21.A O no hydrogen 2.645 N/A GLY 26.A N HIS 23.A O no hydrogen 2.924 N/A TYR 27.A N LEU 22.A O no hydrogen 2.898 N/A ARG 28.A N PRO 3.A O no hydrogen 2.824 N/A ARG 28.A NE ALA 2.A O no hydrogen 3.235 N/A ARG 28.A NH2 ALA 2.A O no hydrogen 2.885 N/A VAL 29.A N THR 54.A O no hydrogen 2.836 N/A VAL 30.A N ALA 5.A O no hydrogen 2.794 N/A ILE 31.A N VAL 56.A O no hydrogen 2.850 N/A HIS 32.A N VAL 7.A O no hydrogen 3.030 N/A HIS 32.A NE2 ALA 60.A O no hydrogen 2.808 N/A TYR 33.A N CYS 58.A O no hydrogen 3.230 N/A ALA 40.A N SER 36.A O no hydrogen 3.024 N/A VAL 41.A N ALA 37.A O no hydrogen 2.894 N/A SER 42.A N GLU 38.A O no hydrogen 2.876 N/A LEU 43.A N ALA 39.A O no hydrogen 2.921 N/A ALA 44.A N ALA 40.A O no hydrogen 2.920 N/A ASP 45.A N VAL 41.A O no hydrogen 2.948 N/A GLU 46.A N SER 42.A O no hydrogen 3.079 N/A LEU 47.A N LEU 43.A O no hydrogen 2.960 N/A ASN 48.A N ALA 44.A O no hydrogen 2.946 N/A ASN 48.A ND2 ALA 55.A O no hydrogen 2.861 N/A LYS 49.A N ASP 45.A O no hydrogen 2.823 N/A GLU 50.A N GLU 46.A O no hydrogen 3.296 N/A GLU 50.A N LEU 47.A O no hydrogen 3.191 N/A ARG 51.A N LEU 47.A O no hydrogen 2.916 N/A ARG 51.A NH1 HIS 23.A O no hydrogen 3.097 N/A ARG 51.A NH2 HIS 23.A O no hydrogen 2.927 N/A THR 54.A N ASN 48.A OD1 no hydrogen 3.024 N/A THR 54.A OG1 HIS 23.A NE2 no hydrogen 2.724 N/A THR 54.A OG1 ARG 51.A O no hydrogen 2.613 N/A ALA 55.A N ASN 48.A OD1 no hydrogen 3.136 N/A VAL 56.A N VAL 29.A O no hydrogen 3.089 N/A CYS 58.A N ILE 31.A O no hydrogen 2.917 N/A CYS 58.A SG GLN 59.A O no hydrogen 4.022 N/A CYS 58.A SG SER 78.A OG no hydrogen 3.292 N/A GLN 59.A NE2 HIS 34.A O no hydrogen 2.796 N/A ALA 60.A N TYR 33.A O no hydrogen 3.025 N/A THR 63.A N ASP 61.A OD1 no hydrogen 3.058 N/A THR 63.A OG1 ASP 61.A OD1 no hydrogen 2.728 N/A THR 63.A OG1 ASP 61.A OD2 no hydrogen 3.400 N/A ASN 64.A N ALA 111.A O no hydrogen 2.888 N/A VAL 67.A N SER 65.A OG no hydrogen 3.109 N/A LEU 68.A N SER 65.A O no hydrogen 3.087 N/A SER 71.A N VAL 67.A O no hydrogen 3.187 N/A SER 71.A OG VAL 67.A O no hydrogen 3.000 N/A CYS 72.A N LEU 68.A O no hydrogen 2.948 N/A CYS 72.A SG LEU 68.A O no hydrogen 3.406 N/A CYS 72.A SG ALA 120.A O no hydrogen 4.010 N/A GLU 73.A N PRO 69.A O no hydrogen 2.963 N/A GLU 74.A N ALA 70.A O no hydrogen 2.793 N/A ILE 75.A N SER 71.A O no hydrogen 2.996 N/A ILE 76.A N CYS 72.A O no hydrogen 3.201 N/A ASN 77.A N GLU 73.A O no hydrogen 2.864 N/A ASN 77.A ND2 GLU 73.A O no hydrogen 3.464 N/A SER 78.A N GLU 74.A O no hydrogen 2.886 N/A SER 78.A OG GLU 74.A O no hydrogen 2.967 N/A CYS 79.A N ILE 76.A O no hydrogen 2.991 N/A CYS 79.A SG ARG 85.A O no hydrogen 3.247 N/A PHE 80.A N ILE 76.A O no hydrogen 3.333 N/A ARG 81.A N ASN 77.A O no hydrogen 2.853 N/A ARG 81.A NE ASN 77.A OD1 no hydrogen 3.394 N/A ALA 82.A N SER 78.A O no hydrogen 3.067 N/A PHE 83.A N CYS 79.A O no hydrogen 2.913 N/A GLY 84.A N PHE 80.A O no hydrogen 2.734 N/A ARG 85.A NE ASP 87.A OD1 no hydrogen 3.046 N/A ARG 85.A NH1 GLU 1.A OE1 no hydrogen 3.327 N/A ARG 85.A NH2 ASP 87.A OD2 no hydrogen 2.967 N/A CYS 86.A SG VAL 88.A O no hydrogen 3.903 N/A ASP 87.A N ALA 4.A O no hydrogen 2.692 N/A VAL 88.A N ALA 4.A O no hydrogen 3.148 N/A LEU 89.A N SER 137.A O no hydrogen 3.132 N/A VAL 90.A N VAL 6.A O no hydrogen 2.726 N/A ASN 91.A N VAL 139.A O no hydrogen 2.852 N/A ASN 91.A ND2 ASN 140.A OD1 no hydrogen 2.829 N/A ASN 92.A N THR 8.A OG1 no hydrogen 2.834 N/A ASN 92.A ND2 THR 8.A O no hydrogen 2.983 N/A ALA 93.A N THR 8.A OG1 no hydrogen 2.969 N/A SER 94.A OG ALA 95.A O no hydrogen 3.222 N/A SER 94.A OG ASN 117.A OD1 no hydrogen 2.608 N/A ALA 95.A N THR 116.A OG1 no hydrogen 2.889 N/A TYR 97.A OH GLU 112.A OE1 no hydrogen 2.524 N/A THR 99.A N ALA 152.A O no hydrogen 2.766 N/A LYS 104.A NZ GLU 112.A OE1 no hydrogen 2.765 N/A LYS 104.A NZ GLU 112.A OE2 no hydrogen 3.319 N/A GLU 107.A N GLU 107.A OE2 no hydrogen 2.970 N/A THR 108.A N THR 105.A OG1 no hydrogen 3.255 N/A THR 108.A OG1 THR 105.A OG1 no hydrogen 2.754 N/A GLN 109.A N THR 105.A O no hydrogen 2.982 N/A GLN 109.A NE2 LYS 104.A O no hydrogen 2.766 N/A VAL 110.A N VAL 106.A O no hydrogen 2.884 N/A ALA 111.A N GLU 107.A O no hydrogen 2.849 N/A GLU 112.A N THR 108.A O no hydrogen 2.772 N/A LEU 113.A N GLN 109.A O no hydrogen 2.869 N/A ILE 114.A N VAL 110.A O no hydrogen 2.873 N/A GLY 115.A N ALA 111.A O no hydrogen 2.987 N/A THR 116.A N GLU 112.A O no hydrogen 3.155 N/A THR 116.A OG1 GLU 112.A O no hydrogen 2.938 N/A ASN 117.A N LEU 113.A O no hydrogen 3.414 N/A ASN 117.A ND2 ALA 95.A O no hydrogen 3.062 N/A ASN 117.A ND2 LEU 113.A O no hydrogen 2.911 N/A ALA 118.A N ILE 114.A O no hydrogen 3.106 N/A ILE 119.A N ILE 114.A O no hydrogen 3.042 N/A ALA 120.A N GLY 115.A O no hydrogen 2.954 N/A PHE 122.A N ALA 118.A O no hydrogen 2.995 N/A LEU 123.A N ILE 119.A O no hydrogen 2.861 N/A LEU 124.A N ALA 120.A O no hydrogen 2.815 N/A THR 125.A N PRO 121.A O no hydrogen 3.060 N/A THR 125.A OG1 PRO 121.A O no hydrogen 2.775 N/A MET 126.A N PHE 122.A O no hydrogen 2.893 N/A SER 127.A N LEU 123.A O no hydrogen 2.947 N/A SER 127.A OG LEU 123.A O no hydrogen 3.440 N/A PHE 128.A N LEU 124.A O no hydrogen 2.814 N/A ALA 129.A N THR 125.A O no hydrogen 2.901 N/A GLN 130.A N MET 126.A O no hydrogen 2.921 N/A ARG 131.A N SER 127.A O no hydrogen 3.194 N/A GLN 132.A N ALA 129.A O no hydrogen 3.247 N/A GLN 132.A NE2 CYS 86.A O no hydrogen 3.129 N/A GLN 132.A NE2 PHE 128.A O no hydrogen 3.046 N/A ASN 135.A ND2 VAL 227.A O no hydrogen 2.625 N/A SER 137.A N ASP 87.A O no hydrogen 3.067 N/A ILE 138.A N ARG 180.A O no hydrogen 2.788 N/A VAL 139.A N LEU 89.A O no hydrogen 2.864 N/A ASN 140.A N ASN 182.A O no hydrogen 2.926 N/A ASN 140.A ND2 THR 167.A OG1 no hydrogen 2.896 N/A LEU 141.A N ASN 91.A O no hydrogen 2.903 N/A CYS 142.A N VAL 184.A O no hydrogen 2.761 N/A CYS 142.A SG ASN 140.A O no hydrogen 3.538 N/A ALA 144.A N PRO 186.A O no hydrogen 3.000 N/A MET 145.A N ASP 143.A OD1 no hydrogen 2.677 N/A VAL 146.A N ASP 143.A O no hydrogen 3.355 N/A GLN 148.A N MET 145.A O no hydrogen 2.842 N/A GLN 148.A NE2 SER 246.A O no hydrogen 2.772 N/A PHE 153.A N CYS 150.A O no hydrogen 3.291 N/A TYR 156.A OH ASP 143.A OD2 no hydrogen 2.481 N/A ASN 157.A N PHE 153.A O no hydrogen 2.915 N/A ASN 157.A ND2 VAL 146.A O no hydrogen 3.182 N/A MET 158.A N SER 154.A O no hydrogen 2.836 N/A GLY 159.A N LEU 155.A O no hydrogen 2.876 N/A LYS 160.A N TYR 156.A O no hydrogen 2.957 N/A LYS 160.A NZ ASN 117.A OD1 no hydrogen 3.019 N/A LYS 160.A NZ LEU 141.A O no hydrogen 2.876 N/A HIS 161.A N ASN 157.A O no hydrogen 2.892 N/A HIS 161.A NE2 VAL 146.A O no hydrogen 3.065 N/A ALA 162.A N MET 158.A O no hydrogen 2.843 N/A LEU 163.A N GLY 159.A O no hydrogen 2.845 N/A VAL 164.A N LYS 160.A O no hydrogen 3.093 N/A GLY 165.A N HIS 161.A O no hydrogen 3.092 N/A LEU 166.A N ALA 162.A O no hydrogen 2.900 N/A THR 167.A N LEU 163.A O no hydrogen 2.972 N/A THR 167.A OG1 LEU 163.A O no hydrogen 2.700 N/A GLN 168.A N VAL 164.A O no hydrogen 3.128 N/A SER 169.A N GLY 165.A O no hydrogen 2.875 N/A SER 169.A OG GLY 165.A O no hydrogen 3.150 N/A ALA 170.A N LEU 166.A O no hydrogen 2.763 N/A ALA 171.A N THR 167.A O no hydrogen 2.877 N/A LEU 172.A N GLN 168.A O no hydrogen 3.006 N/A GLU 173.A N SER 169.A O no hydrogen 3.009 N/A LEU 174.A N ALA 170.A O no hydrogen 2.764 N/A ALA 175.A N ALA 171.A O no hydrogen 3.149 N/A TYR 177.A N LEU 174.A O no hydrogen 3.005 N/A GLY 178.A N ALA 175.A O no hydrogen 2.868 N/A ILE 179.A N LEU 174.A O no hydrogen 3.243 N/A ARG 180.A N LEU 136.A O no hydrogen 3.305 N/A ARG 180.A NH1 LEU 226.A O no hydrogen 2.835 N/A ARG 180.A NH1 ILE 234.A O no hydrogen 3.106 N/A ARG 180.A NH2 ASN 135.A OD1 no hydrogen 3.324 N/A ARG 180.A NH2 LEU 226.A O no hydrogen 2.881 N/A VAL 181.A N THR 235.A OG1 no hydrogen 3.028 N/A ASN 182.A N ILE 138.A O no hydrogen 3.016 N/A ASN 182.A ND2 ILE 234.A O no hydrogen 3.017 N/A GLY 183.A N SER 237.A O no hydrogen 2.785 N/A VAL 184.A N ASN 140.A O no hydrogen 2.944 N/A ALA 185.A N ILE 239.A O no hydrogen 2.867 N/A GLY 187.A N VAL 241.A O no hydrogen 3.363 N/A SER 189.A OG ALA 214.A O no hydrogen 2.806 N/A MET 195.A N PRO 192.A O no hydrogen 3.213 N/A LYS 200.A N GLY 196.A O no hydrogen 2.852 N/A LYS 200.A NZ GLU 197.A OE2 no hydrogen 2.745 N/A ASP 201.A N GLU 197.A O no hydrogen 3.073 N/A LYS 202.A N GLU 198.A O no hydrogen 3.001 N/A TRP 203.A N GLU 199.A O no hydrogen 3.009 N/A ARG 204.A N LYS 200.A O no hydrogen 2.748 N/A ARG 204.A NE GLU 213.A OE1 no hydrogen 2.708 N/A ARG 204.A NH1 ASP 201.A OD1 no hydrogen 2.924 N/A ARG 204.A NH2 GLU 213.A OE1 no hydrogen 3.521 N/A ARG 204.A NH2 GLU 213.A OE2 no hydrogen 2.956 N/A ARG 205.A N ASP 201.A O no hydrogen 2.648 N/A LYS 206.A N TRP 203.A O no hydrogen 3.229 N/A VAL 207.A N ARG 204.A O no hydrogen 3.246 N/A LEU 209.A N GLY 243.A O no hydrogen 2.934 N/A GLY 210.A N PRO 208.A O no hydrogen 3.085 N/A ARG 211.A N VAL 207.A O no hydrogen 3.283 N/A ARG 212.A NH1 GLN 218.A OE1 no hydrogen 3.412 N/A ARG 212.A NH2 GLN 218.A OE1 no hydrogen 2.490 N/A GLU 213.A N GLU 213.A OE1 no hydrogen 2.813 N/A ALA 214.A N VAL 188.A O no hydrogen 2.892 N/A SER 215.A N GLN 218.A OE1 no hydrogen 3.055 N/A GLN 218.A N SER 215.A O no hydrogen 2.951 N/A GLN 218.A N SER 215.A OG no hydrogen 3.095 N/A ILE 219.A N SER 215.A O no hydrogen 3.383 N/A ALA 220.A N ALA 216.A O no hydrogen 3.002 N/A ASP 221.A N GLU 217.A O no hydrogen 2.899 N/A ALA 222.A N ILE 219.A O no hydrogen 3.038 N/A VAL 223.A N ILE 219.A O no hydrogen 3.348 N/A ILE 224.A N ALA 220.A O no hydrogen 2.932 N/A PHE 225.A N ASP 221.A O no hydrogen 3.087 N/A LEU 226.A N ALA 222.A O no hydrogen 3.088 N/A VAL 227.A N VAL 223.A O no hydrogen 3.107 N/A SER 228.A N ILE 224.A O no hydrogen 2.965 N/A SER 228.A N PHE 225.A O no hydrogen 2.995 N/A SER 228.A OG PHE 225.A O no hydrogen 2.765 N/A SER 230.A N SER 228.A OG no hydrogen 2.967 N/A ALA 231.A N SER 228.A O no hydrogen 3.225 N/A GLN 232.A NE2 ASN 135.A OD1 no hydrogen 2.760 N/A ILE 234.A N ALA 231.A O no hydrogen 3.037 N/A GLY 236.A N VAL 181.A O no hydrogen 2.697 N/A SER 237.A N ASN 182.A OD1 no hydrogen 2.948 N/A ILE 239.A N GLY 183.A O no hydrogen 2.946 N/A LYS 240.A NZ SER 246.A OG no hydrogen 3.211 N/A VAL 241.A N ALA 185.A O no hydrogen 2.808 N/A GLY 244.A N ASP 242.A OD1 no hydrogen 2.974 N/A LEU 245.A N ASP 242.A O no hydrogen 2.951 N/A SER 246.A N ASP 242.A OD2 no hydrogen 2.936 N/A SER 246.A OG ASP 242.A OD2 no hydrogen 2.685 N/A LEU 247.A N GLY 244.A O no hydrogen 3.049 N/A VAL 248.A N LEU 245.A O no hydrogen 3.219 N/A HIS 249.A ND1 ALA 250.A OXT no hydrogen 2.849 N/A