Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2ddh_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 2.A N ASP 592.A O no hydrogen 2.777 N/A ASN 2.A ND2 GLY 593.A O no hydrogen 3.132 N/A ASP 4.A N ASN 2.A OD1 no hydrogen 2.709 N/A LEU 5.A N ASN 2.A O no hydrogen 2.945 N/A ARG 6.A N ASN 2.A O no hydrogen 2.903 N/A LYS 7.A N PRO 3.A O no hydrogen 2.996 N/A LYS 7.A NZ GLU 8.A OE1 no hydrogen 3.183 N/A LYS 7.A NZ GLN 311.A OE1 no hydrogen 2.717 N/A ARG 9.A N LEU 5.A O no hydrogen 3.230 N/A ARG 9.A NE ASP 575.A OD1 no hydrogen 2.704 N/A ARG 9.A NH1 TYR 591.A O no hydrogen 2.879 N/A ARG 9.A NH2 ASP 575.A OD1 no hydrogen 3.531 N/A ARG 9.A NH2 ASP 575.A OD2 no hydrogen 2.954 N/A ARG 9.A NH2 TYR 591.A O no hydrogen 2.951 N/A ALA 10.A N ARG 6.A O no hydrogen 2.948 N/A SER 11.A N LYS 7.A O no hydrogen 3.145 N/A SER 11.A OG GLU 8.A O no hydrogen 2.797 N/A SER 11.A OG PRO 568.A O no hydrogen 2.782 N/A THR 13.A N ASN 569.A OD1 no hydrogen 2.665 N/A THR 13.A OG1 ASN 569.A OD1 no hydrogen 3.204 N/A GLU 17.A N ASN 15.A OD1 no hydrogen 3.022 N/A LEU 18.A N ASN 15.A O no hydrogen 2.915 N/A ILE 19.A N PRO 16.A O no hydrogen 2.868 N/A THR 20.A N PRO 16.A O no hydrogen 2.977 N/A THR 20.A OG1 PRO 16.A O no hydrogen 3.266 N/A THR 20.A OG1 ALA 576.A O no hydrogen 2.710 N/A HIS 21.A N GLU 17.A O no hydrogen 3.033 N/A HIS 21.A ND1 THR 30.A OG1 no hydrogen 3.324 N/A ILE 22.A N LEU 18.A O no hydrogen 3.262 N/A LEU 23.A N ILE 19.A O no hydrogen 2.899 N/A ASP 24.A N THR 20.A O no hydrogen 2.966 N/A GLY 25.A N ILE 22.A O no hydrogen 2.989 N/A ASN 29.A N SER 26.A OG no hydrogen 3.207 N/A THR 30.A N SER 26.A O no hydrogen 3.108 N/A THR 30.A OG1 THR 20.A O no hydrogen 3.503 N/A THR 30.A OG1 HIS 21.A ND1 no hydrogen 3.324 N/A THR 30.A OG1 ASP 24.A OD2 no hydrogen 2.652 N/A THR 30.A OG1 SER 26.A O no hydrogen 3.367 N/A ARG 31.A N PRO 27.A O no hydrogen 3.041 N/A ARG 32.A N GLU 28.A O no hydrogen 2.858 N/A ARG 32.A NE GLU 84.A OE2 no hydrogen 2.853 N/A ARG 33.A N ASN 29.A O no hydrogen 2.778 N/A ARG 33.A NE ASP 24.A OD1 no hydrogen 2.768 N/A ARG 33.A NE ASP 24.A OD2 no hydrogen 3.386 N/A ARG 33.A NH1 GLU 37.A OE2 no hydrogen 2.844 N/A ARG 33.A NH1 ASP 578.A OD1 no hydrogen 3.247 N/A ARG 33.A NH2 ASP 24.A OD2 no hydrogen 2.865 N/A ARG 33.A NH2 ASP 578.A OD1 no hydrogen 2.821 N/A ARG 34.A N THR 30.A O no hydrogen 2.914 N/A ARG 34.A NE ASP 578.A OD1 no hydrogen 2.751 N/A ARG 34.A NH1 GLU 17.A OE1 no hydrogen 2.587 N/A ARG 34.A NH2 GLU 17.A OE2 no hydrogen 2.919 N/A ARG 34.A NH2 ASP 578.A OD1 no hydrogen 3.430 N/A ARG 34.A NH2 ASP 578.A OD2 no hydrogen 3.535 N/A GLU 35.A N ARG 31.A O no hydrogen 3.017 N/A ILE 36.A N ARG 32.A O no hydrogen 2.989 N/A GLU 37.A N ARG 33.A O no hydrogen 2.858 N/A ASN 38.A N ARG 34.A O no hydrogen 2.944 N/A LEU 39.A N GLU 35.A O no hydrogen 2.928 N/A ILE 40.A N ILE 36.A O no hydrogen 3.150 N/A LEU 41.A N GLU 37.A O no hydrogen 2.893 N/A ASN 42.A N ASN 38.A O no hydrogen 3.186 N/A ASN 42.A ND2 ASN 38.A O no hydrogen 3.396 N/A ASP 43.A N ILE 40.A O no hydrogen 3.003 N/A ASP 45.A N ASP 43.A OD1 no hydrogen 2.846 N/A PHE 46.A N ASP 43.A O no hydrogen 3.111 N/A GLN 47.A N PRO 44.A O no hydrogen 3.140 N/A GLN 47.A NE2 ASP 43.A O no hydrogen 2.966 N/A ASP 50.A N GLU 49.A OE1 no hydrogen 3.156 N/A ASN 52.A N ASP 50.A OD1 no hydrogen 2.858 N/A PHE 53.A N ASP 50.A O no hydrogen 2.805 N/A LEU 54.A N TYR 51.A O no hydrogen 2.978 N/A THR 55.A N GLN 58.A OE1 no hydrogen 3.050 N/A ARG 56.A NE GLU 232.A O no hydrogen 3.008 N/A ARG 56.A NH1 ASP 224.A OD2 no hydrogen 2.645 N/A ARG 56.A NH2 ASP 224.A OD1 no hydrogen 2.931 N/A ARG 56.A NH2 ASP 224.A OD2 no hydrogen 3.390 N/A ARG 56.A NH2 MET 234.A O no hydrogen 2.962 N/A GLN 58.A N THR 55.A OG1 no hydrogen 3.285 N/A ARG 59.A N THR 55.A O no hydrogen 2.945 N/A ARG 59.A NH1 GLU 233.A OE1 no hydrogen 3.409 N/A TYR 60.A N ARG 56.A O no hydrogen 2.941 N/A TYR 60.A OH THR 182.A OG1 no hydrogen 2.535 N/A GLU 61.A N SER 57.A O no hydrogen 3.057 N/A VAL 62.A N GLN 58.A O no hydrogen 2.938 N/A ALA 63.A N ARG 59.A O no hydrogen 2.981 N/A VAL 64.A N TYR 60.A O no hydrogen 2.832 N/A LYS 65.A N GLU 61.A O no hydrogen 2.862 N/A LYS 66.A N VAL 62.A O no hydrogen 2.855 N/A LYS 66.A NZ TYR 51.A OH no hydrogen 2.714 N/A LYS 66.A NZ VAL 92.A O no hydrogen 2.776 N/A SER 67.A N ALA 63.A O no hydrogen 2.851 N/A SER 67.A OG ALA 63.A O no hydrogen 3.218 N/A SER 67.A OG HIS 93.A NE2 no hydrogen 3.166 N/A SER 67.A OG GLU 98.A OE1 no hydrogen 2.654 N/A ALA 68.A N VAL 64.A O no hydrogen 2.960 N/A THR 69.A N LYS 65.A O no hydrogen 3.138 N/A THR 69.A OG1 LYS 65.A O no hydrogen 2.922 N/A MET 70.A N LYS 66.A O no hydrogen 2.726 N/A VAL 71.A N SER 67.A O no hydrogen 3.111 N/A LYS 72.A N ALA 68.A O no hydrogen 3.279 N/A LYS 73.A N THR 69.A O no hydrogen 2.912 N/A LYS 73.A NZ ASP 43.A OD1 no hydrogen 3.400 N/A LYS 73.A NZ ASP 43.A OD2 no hydrogen 2.647 N/A LYS 73.A NZ ASP 45.A OD2 no hydrogen 2.763 N/A MET 74.A N MET 70.A O no hydrogen 3.095 N/A ARG 75.A N VAL 71.A O no hydrogen 3.203 N/A GLU 76.A N LYS 72.A O no hydrogen 2.883 N/A TYR 77.A N LYS 73.A O no hydrogen 2.605 N/A GLY 78.A N ARG 75.A O no hydrogen 3.330 N/A ILE 79.A N MET 74.A O no hydrogen 2.757 N/A GLU 84.A N ASP 81.A OD2 no hydrogen 2.975 N/A ILE 85.A N ASP 81.A O no hydrogen 2.820 N/A MET 86.A N PRO 82.A O no hydrogen 3.078 N/A TRP 87.A N GLU 83.A O no hydrogen 3.088 N/A PHE 88.A N GLU 84.A O no hydrogen 2.790 N/A LYS 89.A N ILE 85.A O no hydrogen 2.915 N/A ASN 90.A N MET 86.A O no hydrogen 2.847 N/A SER 91.A N TRP 87.A O no hydrogen 2.944 N/A SER 91.A OG TRP 87.A O no hydrogen 3.150 N/A VAL 92.A N PHE 88.A O no hydrogen 2.959 N/A HIS 93.A N LYS 89.A O no hydrogen 3.017 N/A ARG 94.A N SER 91.A O no hydrogen 3.395 N/A ARG 94.A NH2 GLN 47.A OE1 no hydrogen 3.422 N/A HIS 96.A N HIS 93.A O no hydrogen 2.813 N/A HIS 96.A ND1 ARG 94.A O no hydrogen 3.330 N/A LEU 100.A N GLU 98.A OE1 no hydrogen 2.700 N/A ASP 101.A N GLU 98.A O no hydrogen 3.057 N/A LEU 104.A N LEU 100.A O no hydrogen 2.901 N/A GLY 105.A N ASP 101.A O no hydrogen 2.793 N/A MET 106.A N LEU 102.A O no hydrogen 2.818 N/A PHE 107.A N LEU 102.A O no hydrogen 2.712 N/A LEU 108.A N HIS 103.A O no hydrogen 3.048 N/A THR 110.A N MET 106.A O no hydrogen 2.798 N/A THR 110.A OG1 MET 106.A O no hydrogen 2.818 N/A LEU 111.A N PHE 107.A O no hydrogen 3.164 N/A LEU 112.A N PRO 109.A O no hydrogen 2.806 N/A GLN 118.A N THR 115.A OG1 no hydrogen 3.204 N/A GLN 119.A N THR 115.A O no hydrogen 3.080 N/A GLU 120.A N ALA 116.A O no hydrogen 2.930 N/A ARG 121.A N GLN 118.A O no hydrogen 2.710 N/A ARG 121.A NH1 GLU 249.A O no hydrogen 3.422 N/A ARG 121.A NH2 ASN 250.A OD1 no hydrogen 2.611 N/A PHE 122.A N GLN 118.A O no hydrogen 2.887 N/A PHE 123.A N GLN 119.A O no hydrogen 2.969 N/A ALA 126.A N PHE 122.A O no hydrogen 3.089 N/A TRP 127.A N PHE 123.A O no hydrogen 2.547 N/A ASN 128.A N MET 124.A O no hydrogen 3.012 N/A LEU 129.A N ALA 126.A O no hydrogen 3.064 N/A GLU 130.A N PRO 125.A O no hydrogen 2.706 N/A ILE 131.A N PRO 125.A O no hydrogen 3.186 N/A THR 132.A N ASN 184.A OD1 no hydrogen 3.145 N/A THR 132.A OG1 THR 182.A O no hydrogen 2.861 N/A THR 134.A N HIS 185.A O no hydrogen 3.171 N/A THR 134.A OG1 GLY 177.A O no hydrogen 2.838 N/A ALA 136.A N ILE 187.A O no hydrogen 2.854 N/A GLU 139.A N HIS 142.A O no hydrogen 2.934 N/A MET 140.A N ILE 172.A O no hydrogen 2.845 N/A GLY 141.A N THR 170.A O no hydrogen 2.881 N/A HIS 142.A N GLU 139.A O no hydrogen 3.015 N/A GLY 148.A N HIS 145.A O no hydrogen 3.124 N/A LEU 149.A N LEU 146.A O no hydrogen 3.017 N/A GLU 150.A N GLU 139.A OE1 no hydrogen 2.740 N/A THR 151.A N GLU 139.A OE2 no hydrogen 2.972 N/A THR 151.A OG1 GLU 139.A OE2 no hydrogen 2.679 N/A THR 151.A OG1 SER 171.A O no hydrogen 3.270 N/A THR 152.A N ASN 165.A O no hydrogen 3.088 N/A ALA 153.A N GLN 191.A O no hydrogen 2.881 N/A THR 154.A N ILE 163.A O no hydrogen 2.933 N/A TYR 155.A N ILE 193.A O no hydrogen 2.864 N/A TYR 155.A OH PRO 260.A O no hydrogen 2.636 N/A ASP 156.A N GLU 161.A O no hydrogen 2.741 N/A LYS 158.A N ASP 156.A OD2 no hydrogen 2.969 N/A THR 159.A OG1 GLU 161.A OE1 no hydrogen 2.636 N/A GLU 161.A N ASP 156.A O no hydrogen 3.314 N/A PHE 162.A N ILE 246.A O no hydrogen 2.769 N/A ILE 163.A N THR 154.A O no hydrogen 2.718 N/A LEU 164.A N TYR 244.A O no hydrogen 2.756 N/A ASN 165.A N THR 152.A O no hydrogen 2.930 N/A SER 166.A N MET 241.A O no hydrogen 2.854 N/A THR 168.A N SER 171.A OG no hydrogen 3.076 N/A THR 168.A OG1 GLU 150.A OE1 no hydrogen 2.683 N/A THR 168.A OG1 THR 170.A OG1 no hydrogen 2.870 N/A THR 170.A OG1 GLU 150.A OE1 no hydrogen 3.445 N/A THR 170.A OG1 GLU 150.A OE2 no hydrogen 2.467 N/A THR 170.A OG1 THR 168.A OG1 no hydrogen 2.870 N/A SER 171.A N THR 168.A O no hydrogen 3.180 N/A SER 171.A N THR 168.A OG1 no hydrogen 3.113 N/A SER 171.A OG THR 168.A O no hydrogen 2.540 N/A ILE 172.A N VAL 169.A O no hydrogen 3.383 N/A LYS 173.A N LEU 239.A O no hydrogen 3.098 N/A LYS 173.A NZ GLN 137.A O no hydrogen 3.010 N/A LYS 173.A NZ GLU 139.A OE2 no hydrogen 2.955 N/A LYS 173.A NZ LEU 189.A O no hydrogen 2.750 N/A TRP 174.A N THR 138.A O no hydrogen 2.869 N/A TRP 175.A N GLY 237.A O no hydrogen 2.866 N/A LEU 179.A N PRO 176.A O no hydrogen 3.190 N/A GLY 180.A N ASP 235.A O no hydrogen 2.899 N/A LYS 181.A N ASP 235.A OD2 no hydrogen 2.686 N/A THR 182.A N ASP 235.A OD2 no hydrogen 2.888 N/A THR 182.A OG1 TYR 60.A OH no hydrogen 2.535 N/A THR 182.A OG1 ASP 235.A OD1 no hydrogen 3.196 N/A THR 182.A OG1 ASP 235.A OD2 no hydrogen 2.987 N/A SER 183.A N GLY 178.A O no hydrogen 2.982 N/A SER 183.A OG GLY 178.A O no hydrogen 2.658 N/A ASN 184.A N THR 132.A O no hydrogen 2.832 N/A ASN 184.A N THR 132.A OG1 no hydrogen 3.156 N/A HIS 185.A N THR 132.A O no hydrogen 3.035 N/A HIS 185.A ND1 ASN 184.A OD1 no hydrogen 2.630 N/A ALA 186.A N VAL 206.A O no hydrogen 2.937 N/A ILE 187.A N THR 134.A O no hydrogen 2.912 N/A VAL 188.A N PHE 204.A O no hydrogen 2.766 N/A LEU 189.A N ALA 136.A O no hydrogen 3.147 N/A ALA 190.A N HIS 202.A O no hydrogen 2.990 N/A GLN 191.A N THR 151.A O no hydrogen 2.763 N/A GLN 191.A NE2 ARG 147.A O no hydrogen 3.063 N/A GLN 191.A NE2 LEU 149.A O no hydrogen 3.027 N/A LEU 192.A N GLY 200.A O no hydrogen 2.962 N/A ILE 193.A N ALA 153.A O no hydrogen 2.832 N/A THR 194.A N GLU 197.A O no hydrogen 2.963 N/A THR 194.A OG1 GLY 262.A O no hydrogen 2.565 N/A GLN 195.A NE2 ASP 261.A O no hydrogen 3.670 N/A GLU 197.A N THR 194.A O no hydrogen 3.065 N/A CYS 198.A SG GLN 191.A OE1 no hydrogen 4.043 N/A CYS 198.A SG LEU 192.A O no hydrogen 3.872 N/A TYR 199.A N LEU 192.A O no hydrogen 2.834 N/A HIS 202.A N ALA 190.A O no hydrogen 2.925 N/A PHE 204.A N VAL 188.A O no hydrogen 3.010 N/A VAL 205.A N ASN 250.A O no hydrogen 2.781 N/A VAL 206.A N ALA 186.A O no hydrogen 2.704 N/A ILE 208.A N ASN 184.A O no hydrogen 2.678 N/A ARG 209.A N ASN 184.A O no hydrogen 3.167 N/A ARG 209.A NH1 HIS 214.A O no hydrogen 2.811 N/A ARG 209.A NH2 GLY 180.A O no hydrogen 2.973 N/A GLU 210.A N LYS 215.A O no hydrogen 2.657 N/A THR 213.A OG1 GLU 210.A OE2 no hydrogen 2.563 N/A HIS 214.A N GLU 210.A O no hydrogen 2.687 N/A LYS 215.A N THR 213.A OG1 no hydrogen 3.272 N/A LEU 217.A N ILE 208.A O no hydrogen 2.998 N/A ILE 220.A N LEU 217.A O no hydrogen 2.884 N/A THR 221.A N LYS 240.A O no hydrogen 3.005 N/A GLY 223.A N TYR 238.A O no hydrogen 3.372 N/A ILE 225.A N ASN 236.A O no hydrogen 2.929 N/A GLY 226.A N ASP 224.A OD2 no hydrogen 2.798 N/A LYS 228.A NZ TYR 231.A O no hydrogen 2.862 N/A LYS 228.A NZ ASN 236.A OD1 no hydrogen 2.788 N/A GLU 232.A N GLU 232.A OE2 no hydrogen 2.728 N/A MET 234.A N TYR 231.A O no hydrogen 3.193 N/A ASP 235.A N ASP 235.A OD1 no hydrogen 2.641 N/A ASN 236.A ND2 TRP 175.A O no hydrogen 2.763 N/A GLY 237.A N PRO 176.A O no hydrogen 3.013 N/A TYR 238.A N GLY 223.A O no hydrogen 2.932 N/A LEU 239.A N LYS 173.A O no hydrogen 3.144 N/A LYS 240.A N THR 221.A O no hydrogen 2.807 N/A LYS 240.A NZ SER 166.A O no hydrogen 3.252 N/A MET 241.A N SER 166.A OG no hydrogen 2.952 N/A ASP 242.A N GLY 219.A O no hydrogen 2.913 N/A ASN 243.A N ASN 165.A OD1 no hydrogen 2.952 N/A TYR 244.A N LEU 164.A O no hydrogen 2.733 N/A TYR 244.A OH PRO 207.A O no hydrogen 2.632 N/A ARG 245.A NH1 ASP 156.A OD1 no hydrogen 2.821 N/A ARG 245.A NH1 GLU 161.A OE1 no hydrogen 2.956 N/A ARG 245.A NH2 ASP 156.A OD1 no hydrogen 3.067 N/A ILE 246.A N PHE 162.A O no hydrogen 2.994 N/A ARG 248.A N GLN 160.A O no hydrogen 3.205 N/A ARG 248.A NE VAL 258.A O no hydrogen 3.157 N/A ARG 248.A NH1 GLU 249.A OE2 no hydrogen 2.743 N/A GLU 249.A N GLU 249.A OE1 no hydrogen 2.629 N/A ASN 250.A N PRO 247.A O no hydrogen 3.056 N/A ASN 250.A ND2 VAL 205.A O no hydrogen 2.708 N/A MET 251.A N ARG 248.A O no hydrogen 3.136 N/A LEU 252.A N ALA 203.A O no hydrogen 2.868 N/A LYS 254.A N GLN 113.A O no hydrogen 3.278 N/A GLN 257.A N VAL 265.A O no hydrogen 3.178 N/A GLN 257.A NE2 MET 253.A O no hydrogen 3.094 N/A LYS 259.A N THR 263.A O no hydrogen 2.786 N/A GLY 262.A N LYS 259.A O no hydrogen 2.632 N/A THR 263.A N ASP 261.A OD1 no hydrogen 2.918 N/A THR 263.A OG1 ASP 261.A OD1 no hydrogen 2.793 N/A THR 263.A OG1 ASP 261.A OD2 no hydrogen 3.087 N/A VAL 265.A N GLN 257.A O no hydrogen 2.812 N/A ARG 273.A N MET 269.A O no hydrogen 3.166 N/A SER 274.A N VAL 270.A O no hydrogen 2.934 N/A SER 274.A OG VAL 270.A O no hydrogen 2.782 N/A PHE 275.A N PHE 271.A O no hydrogen 3.110 N/A LEU 276.A N VAL 272.A O no hydrogen 3.041 N/A VAL 277.A N ARG 273.A O no hydrogen 2.915 N/A GLY 278.A N SER 274.A O no hydrogen 3.116 N/A ASN 279.A N PHE 275.A O no hydrogen 2.763 N/A ALA 280.A N LEU 276.A O no hydrogen 2.859 N/A ALA 281.A N VAL 277.A O no hydrogen 3.044 N/A GLN 282.A N GLY 278.A O no hydrogen 2.792 N/A GLN 282.A NE2 HIS 333.A NE2 no hydrogen 2.914 N/A SER 283.A N ASN 279.A O no hydrogen 2.889 N/A SER 283.A OG ASN 279.A O no hydrogen 3.053 N/A LEU 284.A N ALA 280.A O no hydrogen 3.053 N/A SER 285.A N ALA 281.A O no hydrogen 2.930 N/A SER 285.A OG ALA 281.A O no hydrogen 3.395 N/A SER 285.A OG GLN 282.A O no hydrogen 2.616 N/A LYS 286.A N GLN 282.A O no hydrogen 2.911 N/A ALA 287.A N SER 283.A O no hydrogen 3.020 N/A CYS 288.A N LEU 284.A O no hydrogen 2.877 N/A THR 289.A N SER 285.A O no hydrogen 2.812 N/A THR 289.A OG1 SER 285.A O no hydrogen 2.757 N/A ILE 290.A N LYS 286.A O no hydrogen 3.081 N/A ALA 291.A N ALA 287.A O no hydrogen 3.071 N/A ILE 292.A N CYS 288.A O no hydrogen 2.954 N/A ARG 293.A N THR 289.A O no hydrogen 3.111 N/A ARG 293.A NE ASP 575.A OD2 no hydrogen 3.104 N/A ARG 293.A NH1 GLY 589.A O no hydrogen 2.998 N/A ARG 293.A NH2 ASP 575.A OD2 no hydrogen 2.680 N/A TYR 294.A N ILE 290.A O no hydrogen 2.967 N/A SER 295.A N ALA 291.A O no hydrogen 2.894 N/A SER 295.A OG ALA 291.A O no hydrogen 2.523 N/A ALA 296.A N ILE 292.A O no hydrogen 3.110 N/A ALA 296.A N ARG 293.A O no hydrogen 2.952 N/A VAL 297.A N ARG 293.A O no hydrogen 3.098 N/A VAL 297.A N TYR 294.A O no hydrogen 3.010 N/A ARG 298.A N TYR 294.A O no hydrogen 2.676 N/A ARG 298.A NH1 TYR 596.A OH no hydrogen 3.007 N/A ARG 299.A NE ASP 4.A OD1 no hydrogen 2.871 N/A ARG 299.A NH1 GLU 309.A O no hydrogen 2.900 N/A ARG 299.A NH2 ASP 4.A OD2 no hydrogen 3.037 N/A GLN 300.A N PRO 310.A O no hydrogen 3.060 N/A GLU 307.A N LYS 304.A O no hydrogen 2.734 N/A GLN 311.A NE2 GLU 8.A OE1 no hydrogen 2.913 N/A GLN 311.A NE2 ALA 296.A O no hydrogen 2.835 N/A ILE 312.A N ARG 298.A O no hydrogen 2.675 N/A LEU 313.A N SER 295.A O no hydrogen 3.099 N/A ASP 314.A N GLN 311.A O no hydrogen 2.817 N/A PHE 315.A N ILE 312.A O no hydrogen 2.958 N/A GLN 318.A NE2 SER 295.A OG no hydrogen 2.999 N/A GLN 318.A NE2 ALA 376.A O no hydrogen 2.841 N/A GLN 319.A N PHE 315.A O no hydrogen 2.976 N/A TYR 320.A N GLN 316.A O no hydrogen 2.817 N/A LYS 321.A N THR 317.A O no hydrogen 2.987 N/A LEU 322.A N GLN 318.A O no hydrogen 3.159 N/A PHE 323.A N GLN 319.A O no hydrogen 2.923 N/A LEU 326.A N LEU 322.A O no hydrogen 2.836 N/A ALA 327.A N PHE 323.A O no hydrogen 2.868 N/A THR 328.A N PRO 324.A O no hydrogen 2.985 N/A THR 328.A OG1 PRO 324.A O no hydrogen 2.791 N/A ALA 329.A N LEU 325.A O no hydrogen 2.887 N/A TYR 330.A N LEU 326.A O no hydrogen 3.183 N/A TYR 330.A OH LEU 573.A O no hydrogen 2.711 N/A ALA 331.A N ALA 327.A O no hydrogen 2.925 N/A PHE 332.A N THR 328.A O no hydrogen 2.958 N/A HIS 333.A N ALA 329.A O no hydrogen 3.061 N/A PHE 334.A N TYR 330.A O no hydrogen 3.162 N/A VAL 335.A N ALA 331.A O no hydrogen 2.986 N/A GLY 336.A N PHE 332.A O no hydrogen 2.787 N/A ARG 337.A N HIS 333.A O no hydrogen 3.114 N/A TYR 338.A N PHE 334.A O no hydrogen 2.857 N/A MET 339.A N VAL 335.A O no hydrogen 3.053 N/A LYS 340.A N GLY 336.A O no hydrogen 3.021 N/A GLU 341.A N ARG 337.A O no hydrogen 2.832 N/A THR 342.A N TYR 338.A O no hydrogen 2.770 N/A THR 342.A OG1 TYR 338.A O no hydrogen 2.877 N/A TYR 343.A N MET 339.A O no hydrogen 2.859 N/A LEU 344.A N LYS 340.A O no hydrogen 2.939 N/A ARG 345.A N THR 342.A O no hydrogen 3.094 N/A LEU 351.A N GLU 347.A O no hydrogen 3.001 N/A HIS 352.A N LEU 348.A O no hydrogen 2.834 N/A HIS 352.A ND1 LEU 348.A O no hydrogen 2.734 N/A ALA 353.A N PRO 349.A O no hydrogen 2.932 N/A LEU 354.A N GLU 350.A O no hydrogen 2.977 N/A THR 355.A N LEU 351.A O no hydrogen 2.925 N/A ALA 356.A N HIS 352.A O no hydrogen 3.012 N/A GLY 357.A N ALA 353.A O no hydrogen 3.111 N/A LEU 358.A N LEU 354.A O no hydrogen 2.812 N/A LYS 359.A N THR 355.A O no hydrogen 3.148 N/A LYS 359.A NZ ALA 398.A O no hydrogen 2.616 N/A LYS 359.A NZ PHE 401.A O no hydrogen 3.083 N/A LYS 359.A NZ GLY 403.A O no hydrogen 2.908 N/A LYS 359.A NZ ASN 405.A OD1 no hydrogen 2.873 N/A ALA 360.A N ALA 356.A O no hydrogen 3.352 N/A PHE 361.A N GLY 357.A O no hydrogen 2.832 N/A THR 362.A N LEU 358.A O no hydrogen 2.857 N/A THR 362.A OG1 LEU 358.A O no hydrogen 2.770 N/A THR 362.A OG1 LYS 359.A O no hydrogen 3.465 N/A THR 363.A N LYS 359.A O no hydrogen 3.168 N/A THR 363.A OG1 LYS 359.A O no hydrogen 2.712 N/A THR 363.A OG1 ALA 360.A O no hydrogen 3.373 N/A TRP 364.A N ALA 360.A O no hydrogen 3.073 N/A THR 365.A N PHE 361.A O no hydrogen 3.219 N/A THR 365.A OG1 PHE 361.A O no hydrogen 3.184 N/A THR 365.A OG1 THR 362.A O no hydrogen 2.763 N/A ALA 366.A N THR 362.A O no hydrogen 2.837 N/A ASN 367.A N THR 363.A O no hydrogen 2.926 N/A ASN 367.A ND2 TYR 392.A OH no hydrogen 3.296 N/A ALA 368.A N TRP 364.A O no hydrogen 3.173 N/A GLY 369.A N THR 365.A O no hydrogen 2.915 N/A ILE 370.A N ALA 366.A O no hydrogen 2.828 N/A GLU 372.A N ALA 368.A O no hydrogen 3.080 N/A CYS 373.A N GLY 369.A O no hydrogen 3.060 N/A CYS 373.A SG GLY 369.A O no hydrogen 3.509 N/A ARG 374.A N ILE 370.A O no hydrogen 3.093 N/A ARG 374.A NE GLU 371.A OE2 no hydrogen 3.299 N/A ARG 374.A NH2 GLU 371.A OE1 no hydrogen 2.806 N/A MET 375.A N GLU 371.A O no hydrogen 3.051 N/A ALA 376.A N GLU 372.A O no hydrogen 2.994 N/A CYS 377.A N ARG 374.A O no hydrogen 3.145 N/A CYS 377.A SG CYS 373.A O no hydrogen 3.501 N/A GLY 378.A N MET 375.A O no hydrogen 3.007 N/A HIS 380.A ND1 TYR 294.A OH no hydrogen 3.006 N/A GLY 381.A N GLY 378.A O no hydrogen 3.085 N/A TYR 382.A N GLY 379.A O no hydrogen 2.856 N/A SER 383.A N HIS 380.A O no hydrogen 3.310 N/A SER 383.A OG SER 385.A OG no hydrogen 2.745 N/A SER 385.A N SER 383.A OG no hydrogen 3.033 N/A SER 385.A OG SER 383.A OG no hydrogen 2.745 N/A SER 386.A N SER 383.A O no hydrogen 3.052 N/A SER 386.A OG GLY 381.A O no hydrogen 2.811 N/A SER 386.A OG SER 383.A O no hydrogen 3.149 N/A GLY 387.A N HIS 384.A O no hydrogen 2.866 N/A ILE 388.A N SER 386.A OG no hydrogen 3.129 N/A ILE 391.A N GLY 387.A O no hydrogen 3.435 N/A TYR 392.A N ILE 388.A O no hydrogen 2.898 N/A VAL 393.A N PRO 389.A O no hydrogen 2.974 N/A THR 394.A N ASN 390.A O no hydrogen 2.893 N/A THR 394.A OG1 ASN 390.A O no hydrogen 2.636 N/A PHE 395.A N ILE 391.A O no hydrogen 2.897 N/A THR 396.A N TYR 392.A O no hydrogen 2.763 N/A THR 396.A OG1 ASN 367.A OD1 no hydrogen 2.868 N/A ALA 398.A N PHE 395.A O no hydrogen 2.855 N/A CYS 399.A N THR 396.A O no hydrogen 3.109 N/A CYS 399.A SG THR 363.A O no hydrogen 3.374 N/A THR 400.A N PRO 397.A O no hydrogen 2.890 N/A PHE 401.A N PRO 397.A O no hydrogen 2.860 N/A ASN 405.A N CYS 399.A O no hydrogen 3.142 N/A ASN 405.A ND2 THR 363.A OG1 no hydrogen 2.899 N/A THR 406.A N GLU 404.A OE2 no hydrogen 3.027 N/A THR 406.A OG1 GLU 404.A OE2 no hydrogen 3.368 N/A VAL 407.A N GLU 404.A OE1 no hydrogen 3.033 N/A MET 408.A N GLU 404.A O no hydrogen 2.895 N/A MET 409.A N ASN 405.A O no hydrogen 2.864 N/A LEU 410.A N THR 406.A O no hydrogen 3.012 N/A GLN 411.A N VAL 407.A O no hydrogen 3.026 N/A THR 412.A N MET 408.A O no hydrogen 3.041 N/A THR 412.A OG1 ALA 353.A O no hydrogen 2.757 N/A THR 412.A OG1 MET 408.A O no hydrogen 3.287 N/A ALA 413.A N MET 409.A O no hydrogen 2.915 N/A ARG 414.A N LEU 410.A O no hydrogen 2.960 N/A PHE 415.A N GLN 411.A O no hydrogen 3.346 N/A LEU 416.A N THR 412.A O no hydrogen 3.085 N/A MET 417.A N ALA 413.A O no hydrogen 2.959 N/A LYS 418.A N ARG 414.A O no hydrogen 3.075 N/A ILE 419.A N PHE 415.A O no hydrogen 2.975 N/A TYR 420.A N LEU 416.A O no hydrogen 2.852 N/A ASP 421.A N MET 417.A O no hydrogen 2.875 N/A GLN 422.A N LYS 418.A O no hydrogen 2.936 N/A VAL 423.A N ILE 419.A O no hydrogen 2.981 N/A ARG 424.A N TYR 420.A O no hydrogen 2.934 N/A ARG 424.A NE TYR 420.A OH no hydrogen 3.508 N/A SER 425.A N ASP 421.A O no hydrogen 2.993 N/A SER 425.A N GLN 422.A O no hydrogen 3.028 N/A SER 425.A OG ASP 421.A O no hydrogen 2.817 N/A GLY 426.A N VAL 423.A O no hydrogen 3.026 N/A LYS 427.A N GLN 422.A O no hydrogen 2.973 N/A VAL 429.A N ASN 437.A OD1 no hydrogen 3.155 N/A MET 432.A N GLU 350.A OE2 no hydrogen 3.052 N/A SER 434.A N GLY 431.A O no hydrogen 3.186 N/A SER 434.A OG GLY 431.A O no hydrogen 2.609 N/A TYR 435.A OH HIS 497.A ND1 no hydrogen 2.797 N/A LEU 436.A N VAL 433.A O no hydrogen 2.806 N/A ASN 437.A N SER 434.A O no hydrogen 2.858 N/A ASN 437.A ND2 VAL 429.A O no hydrogen 2.900 N/A ASN 437.A ND2 SER 434.A O no hydrogen 2.972 N/A ASP 438.A N TYR 435.A O no hydrogen 2.997 N/A LEU 439.A N LEU 436.A O no hydrogen 3.291 N/A SER 441.A OG GLU 463.A OE2 no hydrogen 3.282 N/A ASN 445.A N ASP 443.A OD2 no hydrogen 2.752 N/A ASN 445.A ND2 ASP 443.A OD2 no hydrogen 2.797 N/A SER 446.A N ASP 443.A O no hydrogen 3.443 N/A SER 446.A OG ASP 443.A OD1 no hydrogen 3.409 N/A GLY 449.A N SER 446.A OG no hydrogen 3.088 N/A LEU 450.A N SER 446.A O no hydrogen 2.898 N/A THR 451.A N LEU 447.A O no hydrogen 2.910 N/A THR 451.A OG1 LEU 447.A O no hydrogen 2.895 N/A GLU 452.A N GLU 448.A O no hydrogen 3.098 N/A ALA 453.A N GLY 449.A O no hydrogen 2.996 N/A TYR 454.A N LEU 450.A O no hydrogen 3.089 N/A TYR 454.A OH SER 530.A O no hydrogen 2.608 N/A LYS 455.A N THR 451.A O no hydrogen 2.910 N/A LYS 455.A NZ GLU 452.A OE1 no hydrogen 3.067 N/A LYS 455.A NZ GLU 452.A OE2 no hydrogen 2.936 N/A LEU 456.A N GLU 452.A O no hydrogen 2.984 N/A ARG 457.A N ALA 453.A O no hydrogen 2.936 N/A ARG 457.A NH1 ASP 540.A OD2 no hydrogen 2.889 N/A ALA 458.A N TYR 454.A O no hydrogen 3.091 N/A ALA 459.A N LYS 455.A O no hydrogen 2.988 N/A ARG 460.A N LEU 456.A O no hydrogen 2.890 N/A ARG 460.A NE GLU 543.A OE2 no hydrogen 3.168 N/A ARG 460.A NH1 GLU 463.A OE2 no hydrogen 2.645 N/A ARG 460.A NH2 GLU 543.A OE1 no hydrogen 2.855 N/A LEU 461.A N ARG 457.A O no hydrogen 2.990 N/A VAL 462.A N ALA 458.A O no hydrogen 2.971 N/A GLU 463.A N ALA 459.A O no hydrogen 3.011 N/A ILE 464.A N ARG 460.A O no hydrogen 3.029 N/A ALA 465.A N LEU 461.A O no hydrogen 3.076 N/A ALA 466.A N VAL 462.A O no hydrogen 2.950 N/A LYS 467.A N GLU 463.A O no hydrogen 2.892 N/A ASN 468.A N ILE 464.A O no hydrogen 2.976 N/A ASN 468.A ND2 ASP 489.A OD1 no hydrogen 2.731 N/A LEU 469.A N ALA 465.A O no hydrogen 2.929 N/A GLN 470.A N ALA 466.A O no hydrogen 2.900 N/A THR 471.A N LYS 467.A O no hydrogen 2.949 N/A THR 471.A OG1 LYS 467.A O no hydrogen 3.122 N/A HIS 472.A N ASN 468.A O no hydrogen 3.090 N/A VAL 473.A N LEU 469.A O no hydrogen 3.011 N/A SER 474.A N GLN 470.A O no hydrogen 2.898 N/A HIS 475.A N THR 471.A O no hydrogen 3.098 N/A HIS 475.A ND1 THR 471.A O no hydrogen 3.143 N/A ARG 476.A N HIS 472.A O no hydrogen 2.838 N/A LYS 477.A N VAL 473.A O no hydrogen 2.766 N/A SER 478.A N ARG 476.A O no hydrogen 2.736 N/A VAL 481.A N SER 478.A OG no hydrogen 3.216 N/A ALA 482.A N SER 478.A O no hydrogen 2.940 N/A TRP 483.A N LYS 479.A O no hydrogen 2.793 N/A ASN 484.A N GLU 480.A O no hydrogen 3.319 N/A LEU 485.A N VAL 481.A O no hydrogen 3.024 N/A THR 486.A N TRP 483.A O no hydrogen 3.218 N/A THR 486.A OG1 ALA 482.A O no hydrogen 2.820 N/A THR 486.A OG1 TRP 483.A O no hydrogen 3.387 N/A SER 487.A N ASN 484.A O no hydrogen 3.115 N/A SER 487.A OG ASN 484.A O no hydrogen 2.552 N/A LEU 490.A N THR 486.A O no hydrogen 2.836 N/A VAL 491.A N SER 487.A O no hydrogen 2.970 N/A ARG 492.A N VAL 488.A O no hydrogen 3.240 N/A ALA 493.A N ASP 489.A O no hydrogen 3.014 N/A SER 494.A N LEU 490.A O no hydrogen 2.982 N/A SER 494.A OG MET 409.A O no hydrogen 2.740 N/A SER 494.A OG LEU 490.A O no hydrogen 3.404 N/A GLU 495.A N VAL 491.A O no hydrogen 2.853 N/A ALA 496.A N ARG 492.A O no hydrogen 2.984 N/A HIS 497.A N ALA 493.A O no hydrogen 2.961 N/A HIS 497.A ND1 TYR 435.A OH no hydrogen 2.797 N/A CYS 498.A N SER 494.A O no hydrogen 2.994 N/A CYS 498.A SG SER 494.A O no hydrogen 3.271 N/A HIS 499.A N GLU 495.A O no hydrogen 2.929 N/A TYR 500.A N ALA 496.A O no hydrogen 3.074 N/A VAL 501.A N HIS 497.A O no hydrogen 3.033 N/A VAL 502.A N CYS 498.A O no hydrogen 2.928 N/A VAL 503.A N HIS 499.A O no hydrogen 3.014 N/A LYS 504.A N TYR 500.A O no hydrogen 2.845 N/A LYS 504.A NZ ASP 508.A OD1 no hydrogen 3.189 N/A VAL 505.A N VAL 501.A O no hydrogen 2.836 N/A PHE 506.A N VAL 502.A O no hydrogen 2.914 N/A SER 507.A N VAL 503.A O no hydrogen 2.878 N/A SER 507.A OG VAL 503.A O no hydrogen 2.837 N/A ASP 508.A N LYS 504.A O no hydrogen 2.782 N/A LYS 509.A N VAL 505.A O no hydrogen 3.148 N/A LYS 509.A N PHE 506.A O no hydrogen 3.184 N/A LEU 510.A N SER 507.A O no hydrogen 3.349 N/A LYS 512.A N LYS 509.A O no hydrogen 3.015 N/A ILE 513.A N LEU 510.A O no hydrogen 2.961 N/A LYS 516.A NZ GLN 514.A O no hydrogen 3.171 N/A VAL 518.A N ASP 515.A OD1 no hydrogen 3.020 N/A GLN 519.A N ASP 515.A O no hydrogen 2.977 N/A ALA 520.A N LYS 516.A O no hydrogen 2.910 N/A VAL 521.A N ALA 517.A O no hydrogen 3.242 N/A LEU 522.A N VAL 518.A O no hydrogen 3.068 N/A ARG 523.A N GLN 519.A O no hydrogen 2.838 N/A ARG 523.A N ALA 520.A O no hydrogen 3.204 N/A ASN 524.A N ALA 520.A O no hydrogen 3.187 N/A LEU 525.A N VAL 521.A O no hydrogen 3.173 N/A CYS 526.A N LEU 522.A O no hydrogen 3.000 N/A CYS 526.A SG SER 507.A OG no hydrogen 3.548 N/A LEU 527.A N ARG 523.A O no hydrogen 2.835 N/A LEU 528.A N ASN 524.A O no hydrogen 2.885 N/A TYR 529.A N LEU 525.A O no hydrogen 2.799 N/A SER 530.A N CYS 526.A O no hydrogen 2.996 N/A SER 530.A OG CYS 526.A O no hydrogen 2.786 N/A LEU 531.A N LEU 527.A O no hydrogen 2.895 N/A TYR 532.A N LEU 528.A O no hydrogen 2.762 N/A GLY 533.A N TYR 529.A O no hydrogen 3.048 N/A ILE 534.A N SER 530.A O no hydrogen 3.201 N/A SER 535.A N LEU 531.A O no hydrogen 2.938 N/A SER 535.A OG ASN 556.A OD1 no hydrogen 2.499 N/A GLN 536.A N TYR 532.A O no hydrogen 2.921 N/A LYS 537.A N GLY 533.A O no hydrogen 3.246 N/A GLY 538.A N SER 535.A O no hydrogen 3.425 N/A ASP 540.A N LYS 537.A O no hydrogen 2.899 N/A LEU 542.A N GLY 538.A O no hydrogen 2.990 N/A GLU 543.A N GLY 539.A O no hydrogen 2.909 N/A GLY 544.A N ASP 540.A O no hydrogen 3.426 N/A SER 545.A N LEU 542.A O no hydrogen 2.924 N/A ILE 546.A N PHE 541.A O no hydrogen 2.819 N/A ILE 547.A N PHE 541.A O no hydrogen 3.428 N/A THR 548.A N GLN 551.A OE1 no hydrogen 2.853 N/A GLN 551.A N THR 548.A OG1 no hydrogen 3.164 N/A GLN 551.A NE2 VAL 442.A O no hydrogen 3.651 N/A LEU 552.A N THR 548.A O no hydrogen 3.099 N/A SER 553.A N GLY 549.A O no hydrogen 3.170 N/A SER 553.A OG ALA 550.A O no hydrogen 2.623 N/A GLN 554.A N ALA 550.A O no hydrogen 3.100 N/A VAL 555.A N GLN 551.A O no hydrogen 2.746 N/A ASN 556.A N LEU 552.A O no hydrogen 2.967 N/A ALA 557.A N SER 553.A O no hydrogen 2.938 N/A ARG 558.A N GLN 554.A O no hydrogen 2.761 N/A ARG 558.A NH1 GLU 561.A OE1 no hydrogen 2.835 N/A ILE 559.A N VAL 555.A O no hydrogen 2.949 N/A LEU 560.A N ASN 556.A O no hydrogen 3.437 N/A GLU 561.A N ALA 557.A O no hydrogen 3.183 N/A LEU 562.A N ARG 558.A O no hydrogen 2.976 N/A LEU 563.A N ILE 559.A O no hydrogen 3.168 N/A LEU 563.A N LEU 560.A O no hydrogen 3.191 N/A THR 564.A OG1 GLU 561.A O no hydrogen 3.207 N/A LEU 565.A N GLU 561.A O no hydrogen 3.214 N/A ILE 566.A N LEU 562.A O no hydrogen 2.833 N/A ILE 566.A N LEU 563.A O no hydrogen 3.166 N/A ARG 567.A N LEU 563.A O no hydrogen 2.820 N/A ARG 567.A NE GLU 8.A OE2 no hydrogen 3.273 N/A ARG 567.A NH1 ASP 314.A OD1 no hydrogen 2.616 N/A ARG 567.A NH2 GLU 8.A OE1 no hydrogen 2.769 N/A ARG 567.A NH2 ASP 314.A OD1 no hydrogen 2.982 N/A ASN 569.A N ILE 566.A O no hydrogen 2.802 N/A ASN 569.A ND2 THR 13.A OG1 no hydrogen 2.973 N/A ALA 570.A N ARG 567.A O no hydrogen 3.063 N/A LEU 573.A N ASN 569.A O no hydrogen 2.819 N/A VAL 574.A N ALA 570.A O no hydrogen 3.328 N/A VAL 574.A N VAL 571.A O no hydrogen 3.212 N/A ASP 575.A N VAL 571.A O no hydrogen 2.964 N/A ALA 576.A N ALA 572.A O no hydrogen 2.986 N/A PHE 577.A N VAL 574.A O no hydrogen 3.034 N/A ASP 578.A N ASP 575.A O no hydrogen 2.770 N/A THR 583.A N LYS 580.A O no hydrogen 2.997 N/A LEU 584.A N LYS 580.A O no hydrogen 3.118 N/A GLY 585.A N ASP 581.A O no hydrogen 2.831 N/A SER 586.A OG SER 386.A O no hydrogen 2.628 N/A VAL 587.A N SER 385.A O no hydrogen 2.692 N/A GLY 589.A N SER 586.A OG no hydrogen 2.742 N/A ARG 590.A N VAL 587.A O no hydrogen 3.497 N/A ARG 590.A NE ASP 592.A OD1 no hydrogen 2.990 N/A ARG 590.A NH2 ASP 592.A OD2 no hydrogen 2.702 N/A TYR 591.A N ASP 581.A OD2 no hydrogen 2.979 N/A GLY 593.A N ARG 590.A O no hydrogen 3.245 N/A ASN 594.A N ASP 592.A OD1 no hydrogen 2.845 N/A VAL 595.A N GLY 593.A O no hydrogen 2.774 N/A ASN 598.A ND2 ASN 594.A O no hydrogen 2.463 N/A LEU 599.A N VAL 595.A O no hydrogen 2.766 N/A PHE 600.A N TYR 596.A O no hydrogen 3.035 N/A GLU 601.A N GLU 597.A O no hydrogen 3.186 N/A TRP 602.A N ASN 598.A O no hydrogen 2.964 N/A TRP 602.A NE1 ASP 50.A OD2 no hydrogen 3.344 N/A ALA 603.A N LEU 599.A O no hydrogen 3.031 N/A LYS 604.A N PHE 600.A O no hydrogen 3.080 N/A LYS 604.A NZ GLU 601.A OE2 no hydrogen 2.869 N/A LYS 605.A N GLU 601.A O no hydrogen 2.923 N/A LYS 605.A N TRP 602.A O no hydrogen 3.081 N/A SER 606.A N ALA 603.A O no hydrogen 3.086 N/A SER 606.A OG ALA 603.A O no hydrogen 2.532 N/A ASN 609.A N SER 606.A O no hydrogen 3.028 N/A ASN 609.A ND2 ALA 603.A O no hydrogen 2.691 N/A LYS 610.A N PRO 607.A O no hydrogen 3.035 N/A THR 611.A OG1 VAL 613.A O no hydrogen 2.800 N/A TYR 617.A N HIS 614.A O no hydrogen 2.835 N/A LYS 619.A N GLU 615.A O no hydrogen 3.308 N/A HIS 620.A N SER 616.A O no hydrogen 2.946 N/A LEU 621.A N TYR 617.A O no hydrogen 2.851 N/A LYS 622.A N TYR 617.A O no hydrogen 2.835 N/A