Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1mhc_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 3.A N VAL 103.A O no hydrogen 3.280 N/A HIS 3.A ND1 ASP 29.A OD2 no hydrogen 2.703 N/A SER 4.A N ASP 29.A OD1 no hydrogen 2.838 N/A SER 4.A OG GLU 102.A OE2 no hydrogen 3.279 N/A LEU 5.A N CYS 101.A O no hydrogen 2.777 N/A ARG 6.A N TYR 27.A O no hydrogen 2.906 N/A ARG 6.A NH1 ASP 29.A O no hydrogen 2.629 N/A ARG 6.A NH2 ASP 29.A O no hydrogen 2.998 N/A TYR 7.A N VAL 99.A O no hydrogen 2.865 N/A PHE 8.A N VAL 25.A O no hydrogen 2.919 N/A HIS 9.A N TRP 97.A O no hydrogen 2.842 N/A HIS 9.A ND1 TYR 22.A OH no hydrogen 2.927 N/A THR 10.A N ILE 23.A O no hydrogen 2.884 N/A ALA 11.A N LEU 95.A O no hydrogen 2.982 N/A VAL 12.A N GLN 21.A O no hydrogen 3.013 N/A SER 13.A N HIS 93.A O no hydrogen 3.025 N/A SER 13.A OG GLY 91.A O no hydrogen 3.492 N/A SER 13.A OG HIS 93.A O no hydrogen 3.516 N/A GLN 21.A N SER 38.A O no hydrogen 3.121 N/A TYR 22.A OH HIS 9.A ND1 no hydrogen 2.927 N/A TYR 22.A OH SER 24.A OG no hydrogen 2.799 N/A ILE 23.A N THR 10.A O no hydrogen 2.927 N/A SER 24.A N CYS 36.A O no hydrogen 2.855 N/A SER 24.A OG TYR 22.A OH no hydrogen 2.799 N/A VAL 25.A N PHE 8.A O no hydrogen 3.083 N/A GLY 26.A N GLN 34.A O no hydrogen 3.407 N/A TYR 27.A N ARG 6.A O no hydrogen 2.856 N/A VAL 28.A N VAL 31.A O no hydrogen 2.800 N/A ASP 29.A N SER 4.A O no hydrogen 2.944 N/A VAL 31.A N VAL 28.A O no hydrogen 3.049 N/A GLN 32.A NE2 GLN 34.A O no hydrogen 3.272 N/A PHE 33.A N GLY 26.A O no hydrogen 2.897 N/A ARG 35.A N GLU 46.A O no hydrogen 2.891 N/A ARG 35.A NE ASP 37.A OD1 no hydrogen 3.296 N/A ARG 35.A NE ASP 37.A OD2 no hydrogen 3.316 N/A ARG 35.A NH2 ASP 37.A OD1 no hydrogen 3.151 N/A ARG 35.A NH2 ASP 37.A OD2 no hydrogen 3.025 N/A CYS 36.A N SER 24.A O no hydrogen 2.862 N/A ASP 37.A N ARG 44.A O no hydrogen 3.127 N/A ILE 42.A N ILE 39.A O no hydrogen 3.300 N/A GLU 46.A N ARG 35.A O no hydrogen 2.999 N/A ARG 48.A N PHE 33.A O no hydrogen 2.829 N/A ARG 48.A NH1 PRO 47.A O no hydrogen 3.203 N/A MET 52.A N ALA 49.A O no hydrogen 3.112 N/A GLU 53.A N PRO 50.A O no hydrogen 2.975 N/A GLU 55.A N MET 52.A O no hydrogen 3.187 N/A TYR 59.A N ARG 56.A O no hydrogen 2.752 N/A TYR 59.A OH GLN 34.A OE1 no hydrogen 2.632 N/A LYS 61.A N PRO 57.A O no hydrogen 3.270 N/A GLU 62.A N GLU 58.A O no hydrogen 3.460 N/A LEU 63.A N TYR 59.A O no hydrogen 3.027 N/A LYS 64.A N TRP 60.A O no hydrogen 3.168 N/A LYS 66.A N GLU 62.A O no hydrogen 3.021 N/A LYS 66.A NZ GLU 163.A OE1 no hydrogen 3.000 N/A LYS 66.A NZ GLU 163.A OE2 no hydrogen 2.978 N/A VAL 67.A N LEU 63.A O no hydrogen 2.760 N/A LYS 68.A N LYS 64.A O no hydrogen 3.130 N/A ASN 69.A N LEU 65.A O no hydrogen 3.078 N/A ILE 70.A N LYS 66.A O no hydrogen 2.848 N/A ALA 71.A N VAL 67.A O no hydrogen 2.864 N/A GLN 72.A N LYS 68.A O no hydrogen 3.101 N/A GLN 72.A N ASN 69.A O no hydrogen 2.960 N/A SER 73.A N ASN 69.A O no hydrogen 3.020 N/A SER 73.A OG ASN 69.A O no hydrogen 2.958 N/A ALA 74.A N ILE 70.A O no hydrogen 2.967 N/A ALA 76.A N SER 73.A O no hydrogen 2.760 N/A ASN 77.A N SER 73.A O no hydrogen 2.852 N/A ASN 77.A ND2 SER 73.A O no hydrogen 2.896 N/A LEU 78.A N ALA 74.A O no hydrogen 3.025 N/A ARG 79.A N ARG 75.A O no hydrogen 3.463 N/A THR 80.A N ALA 76.A O no hydrogen 3.025 N/A THR 80.A OG1 ALA 76.A O no hydrogen 3.029 N/A LEU 81.A N ASN 77.A O no hydrogen 2.768 N/A LEU 82.A N LEU 78.A O no hydrogen 2.975 N/A ARG 83.A N ARG 79.A O no hydrogen 3.075 N/A TYR 84.A N THR 80.A O no hydrogen 2.839 N/A TYR 85.A N LEU 81.A O no hydrogen 2.967 N/A TYR 85.A OH ASP 137.A OD2 no hydrogen 2.799 N/A ASN 86.A N ARG 83.A O no hydrogen 3.150 N/A GLN 87.A N LEU 82.A O no hydrogen 2.979 N/A HIS 93.A N SER 13.A OG no hydrogen 3.105 N/A HIS 93.A ND1 ASP 119.A OD2 no hydrogen 2.793 N/A ILE 94.A N ASP 119.A OD1 no hydrogen 2.988 N/A LEU 95.A N ALA 11.A O no hydrogen 3.044 N/A GLN 96.A N ALA 117.A O no hydrogen 2.870 N/A TRP 97.A N HIS 9.A O no hydrogen 3.022 N/A MET 98.A N GLN 115.A O no hydrogen 3.014 N/A VAL 99.A N TYR 7.A O no hydrogen 3.112 N/A SER 100.A N HIS 113.A O no hydrogen 3.022 N/A SER 100.A OG GLU 102.A OE2 no hydrogen 3.556 N/A CYS 101.A N LEU 5.A O no hydrogen 3.091 N/A GLU 102.A N GLY 111.A O no hydrogen 3.297 N/A VAL 103.A N HIS 3.A O no hydrogen 2.974 N/A GLY 104.A N ARG 108.A O no hydrogen 2.865 N/A MET 107.A N GLY 104.A O no hydrogen 2.887 N/A LEU 110.A N GLU 102.A O no hydrogen 3.186 N/A HIS 113.A N SER 100.A O no hydrogen 2.967 N/A GLN 115.A N MET 98.A O no hydrogen 3.192 N/A ALA 116.A N ILE 124.A O no hydrogen 2.926 N/A ALA 117.A N GLN 96.A O no hydrogen 2.840 N/A TYR 118.A N SER 121.A O no hydrogen 3.039 N/A ASP 119.A N ILE 94.A O no hydrogen 2.710 N/A TYR 123.A N ALA 116.A O no hydrogen 2.801 N/A TYR 123.A OH THR 143.A OG1 no hydrogen 2.748 N/A ILE 124.A N ALA 116.A O no hydrogen 3.279 N/A THR 125.A N THR 134.A O no hydrogen 3.058 N/A LEU 126.A N TYR 114.A O no hydrogen 2.995 N/A ASN 127.A N SER 132.A O no hydrogen 2.802 N/A ASN 127.A ND2 SER 132.A OG no hydrogen 2.707 N/A LEU 130.A N ASN 127.A O no hydrogen 2.657 N/A SER 131.A N ASP 129.A OD1 no hydrogen 3.191 N/A SER 131.A OG ASP 129.A O no hydrogen 3.437 N/A SER 131.A OG ASP 129.A OD2 no hydrogen 2.722 N/A SER 132.A N ASP 129.A OD1 no hydrogen 3.309 N/A SER 132.A OG ASP 129.A OD1 no hydrogen 2.950 N/A SER 132.A OG ASP 129.A OD2 no hydrogen 2.991 N/A THR 134.A N THR 125.A O no hydrogen 2.773 N/A VAL 136.A N SER 140.A OG no hydrogen 2.897 N/A SER 140.A N ASP 137.A OD1 no hydrogen 2.876 N/A SER 140.A OG TYR 123.A O no hydrogen 3.385 N/A SER 140.A OG ASP 137.A O no hydrogen 3.486 N/A SER 140.A OG ASP 137.A OD1 no hydrogen 2.928 N/A GLN 141.A N ASP 137.A O no hydrogen 2.989 N/A ILE 142.A N MET 138.A O no hydrogen 3.075 N/A ILE 142.A N VAL 139.A O no hydrogen 2.817 N/A THR 143.A N VAL 139.A O no hydrogen 3.213 N/A THR 143.A OG1 TYR 123.A OH no hydrogen 2.748 N/A LYS 144.A N SER 140.A O no hydrogen 2.786 N/A LYS 144.A NZ TRP 133.A O no hydrogen 2.738 N/A LYS 144.A NZ GLU 148.A OE2 no hydrogen 2.877 N/A SER 145.A N GLN 141.A O no hydrogen 3.063 N/A ARG 146.A N ILE 142.A O no hydrogen 3.194 N/A ARG 146.A NH2 TYR 84.A OH no hydrogen 3.033 N/A LEU 147.A N THR 143.A O no hydrogen 2.918 N/A GLU 148.A N LYS 144.A O no hydrogen 3.019 N/A SER 149.A N SER 145.A O no hydrogen 3.025 N/A SER 149.A OG SER 145.A O no hydrogen 2.716 N/A ALA 150.A N ARG 146.A O no hydrogen 2.897 N/A GLY 151.A N LEU 147.A O no hydrogen 3.308 N/A GLU 154.A N GLY 151.A O no hydrogen 3.101 N/A TYR 155.A N THR 152.A O no hydrogen 3.036 N/A PHE 156.A N THR 152.A O no hydrogen 3.378 N/A ARG 157.A N ALA 153.A O no hydrogen 2.916 N/A ALA 158.A N GLU 154.A O no hydrogen 2.950 N/A TYR 159.A N TYR 155.A O no hydrogen 3.162 N/A VAL 160.A N PHE 156.A O no hydrogen 2.843 N/A GLU 161.A N ARG 157.A O no hydrogen 3.087 N/A GLY 162.A N ALA 158.A O no hydrogen 2.855 N/A GLY 162.A N TYR 159.A O no hydrogen 3.096 N/A CYS 164.A N TYR 159.A O no hydrogen 3.196 N/A LEU 165.A N VAL 160.A O no hydrogen 3.090 N/A GLU 166.A N GLY 162.A O no hydrogen 3.106 N/A LEU 167.A N GLU 163.A O no hydrogen 2.863 N/A LEU 168.A N CYS 164.A O no hydrogen 2.913 N/A HIS 169.A N LEU 165.A O no hydrogen 3.047 N/A ARG 170.A N GLU 166.A O no hydrogen 3.113 N/A ARG 170.A NE GLU 55.A OE1 no hydrogen 2.809 N/A ARG 170.A NH1 GLU 166.A OE1 no hydrogen 2.817 N/A ARG 170.A NH2 GLU 55.A OE1 no hydrogen 3.030 N/A ARG 170.A NH2 GLU 166.A OE1 no hydrogen 3.526 N/A PHE 171.A N LEU 167.A O no hydrogen 2.751 N/A LEU 172.A N LEU 168.A O no hydrogen 2.804 N/A ARG 173.A N HIS 169.A O no hydrogen 3.019 N/A ASN 174.A N ARG 170.A O no hydrogen 2.860 N/A GLY 175.A N PHE 171.A O no hydrogen 2.618 N/A ILE 178.A N GLY 175.A O no hydrogen 2.705 N/A LEU 179.A N GLY 175.A O no hydrogen 3.167 N/A GLN 180.A N LYS 176.A O no hydrogen 3.002 N/A ARG 181.A NE ASP 183.A OD1 no hydrogen 3.238 N/A ARG 181.A NE ASP 183.A OD2 no hydrogen 2.953 N/A ARG 181.A NH1 ILE 178.A O no hydrogen 2.597 N/A LYS 186.A N LEU 206.A O no hydrogen 2.827 N/A HIS 188.A N TRP 204.A O no hydrogen 3.139 N/A ALA 190.A N ARG 202.A O no hydrogen 2.660 N/A HIS 191.A NE2 GLU 254.A OE1 no hydrogen 3.060 N/A HIS 192.A N THR 200.A O no hydrogen 2.922 N/A ARG 194.A N ASP 198.A O no hydrogen 2.583 N/A LYS 196.A NZ ASP 198.A OD1 no hydrogen 3.360 N/A LYS 196.A NZ ASP 198.A OD2 no hydrogen 2.960 N/A VAL 199.A N VAL 249.A O no hydrogen 2.847 N/A THR 200.A N HIS 192.A O no hydrogen 2.774 N/A LEU 201.A N VAL 247.A O no hydrogen 2.991 N/A ARG 202.A N ALA 190.A O no hydrogen 3.010 N/A CYS 203.A N ALA 245.A O no hydrogen 2.722 N/A TRP 204.A N HIS 188.A O no hydrogen 2.752 N/A ALA 205.A N LYS 243.A O no hydrogen 2.918 N/A LEU 206.A N LYS 186.A O no hydrogen 2.674 N/A PHE 208.A N PHE 241.A O no hydrogen 3.273 N/A TYR 209.A N ASP 183.A O no hydrogen 3.208 N/A ALA 211.A N ASP 30.A OD2 no hydrogen 2.964 N/A THR 214.A N HIS 262.A O no hydrogen 3.128 N/A THR 216.A N TYR 260.A O no hydrogen 2.962 N/A TRP 217.A NE1 ALA 245.A O no hydrogen 2.742 N/A GLN 218.A N THR 258.A O no hydrogen 2.885 N/A GLN 218.A NE2 ASP 223.A OD1 no hydrogen 3.161 N/A LYS 219.A N GLU 222.A O no hydrogen 2.831 N/A ASP 220.A N ARG 256.A O no hydrogen 3.231 N/A GLU 222.A N LYS 219.A O no hydrogen 2.611 N/A LEU 224.A N TRP 217.A O no hydrogen 3.074 N/A THR 225.A OG1 ASP 223.A OD2 no hydrogen 2.966 N/A ASP 227.A N LEU 224.A O no hydrogen 3.076 N/A GLU 229.A N ALA 246.A O no hydrogen 2.837 N/A VAL 231.A N TRP 244.A O no hydrogen 3.476 N/A ARG 234.A N GLN 242.A O no hydrogen 3.032 N/A ARG 234.A NE GLN 242.A OE1 no hydrogen 2.872 N/A ARG 234.A NH2 GLN 242.A OE1 no hydrogen 3.103 N/A SER 236.A N THR 240.A O no hydrogen 2.842 N/A THR 240.A N ASP 238.A OD1 no hydrogen 3.242 N/A THR 240.A OG1 ASP 238.A OD1 no hydrogen 2.592 N/A PHE 241.A N PHE 208.A O no hydrogen 2.836 N/A GLN 242.A N ARG 234.A O no hydrogen 3.027 N/A GLN 242.A NE2 SER 236.A OG no hydrogen 3.036 N/A LYS 243.A N ALA 205.A O no hydrogen 2.977 N/A LYS 243.A NZ VAL 231.A O no hydrogen 2.694 N/A LYS 243.A NZ THR 233.A OG1 no hydrogen 3.172 N/A ALA 245.A N CYS 203.A O no hydrogen 2.916 N/A ALA 246.A N GLU 229.A O no hydrogen 2.887 N/A VAL 247.A N LEU 201.A O no hydrogen 3.071 N/A VAL 249.A N VAL 199.A O no hydrogen 2.750 N/A GLY 252.A N GLU 254.A OE2 no hydrogen 2.964 N/A GLU 253.A N PRO 250.A O no hydrogen 3.307 N/A GLU 254.A N GLU 254.A OE2 no hydrogen 3.174 N/A GLN 255.A NE2 TRP 274.A O no hydrogen 2.668 N/A ARG 256.A N GLU 253.A O no hydrogen 3.151 N/A TYR 257.A N GLU 254.A O no hydrogen 3.280 N/A THR 258.A N GLN 218.A O no hydrogen 2.868 N/A CYS 259.A N LEU 272.A O no hydrogen 2.702 N/A TYR 260.A N THR 216.A O no hydrogen 2.862 N/A VAL 261.A N LEU 270.A O no hydrogen 3.039 N/A HIS 262.A N THR 214.A O no hydrogen 2.945 N/A HIS 263.A NE2 PRO 210.A O no hydrogen 2.830 N/A GLY 265.A N HIS 263.A ND1 no hydrogen 3.120 N/A LEU 266.A N HIS 263.A O no hydrogen 2.925 N/A LEU 270.A N VAL 261.A O no hydrogen 3.145 N/A LEU 272.A N CYS 259.A O no hydrogen 2.818 N/A LYS 273.A NZ GLN 255.A O no hydrogen 2.952 N/A LYS 273.A NZ THR 258.A OG1 no hydrogen 2.584 N/A SER 276.A OG ARG 275.A O no hydrogen 2.586 N/A