Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3m49_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A OG SER 3.A OG no hydrogen 3.306 N/A SER 3.A N SER 1.A OG no hydrogen 3.072 N/A SER 3.A OG SER 1.A OG no hydrogen 3.306 N/A GLU 5.A N GLU 5.A OE1 no hydrogen 2.880 N/A GLN 6.A N SER 3.A OG no hydrogen 3.029 N/A GLN 6.A NE2 ASN 10.A OD1 no hydrogen 3.224 N/A LEU 7.A N SER 3.A O no hydrogen 3.065 N/A SER 8.A N ILE 4.A O no hydrogen 2.865 N/A SER 8.A OG ILE 4.A O no hydrogen 3.244 N/A ILE 9.A N GLU 5.A O no hydrogen 2.987 N/A ASN 10.A N GLN 6.A O no hydrogen 2.879 N/A THR 11.A N LEU 7.A O no hydrogen 2.833 N/A THR 11.A OG1 LEU 7.A O no hydrogen 2.794 N/A ILE 12.A N SER 8.A O no hydrogen 2.977 N/A ARG 13.A N ILE 9.A O no hydrogen 3.098 N/A ARG 13.A NH1 ASN 10.A OD1 no hydrogen 2.973 N/A ARG 13.A NH2 ASN 211.A OD1 no hydrogen 3.051 N/A THR 14.A N ASN 10.A O no hydrogen 2.892 N/A THR 14.A OG1 ASN 10.A O no hydrogen 2.944 N/A THR 14.A OG1 THR 11.A O no hydrogen 3.452 N/A LEU 15.A N.A THR 11.A O no hydrogen 2.840 N/A LEU 15.A N.B THR 11.A O no hydrogen 2.854 N/A SER 16.A N ILE 12.A O no hydrogen 3.041 N/A SER 16.A OG ILE 12.A O no hydrogen 2.829 N/A SER 16.A OG SER 69.A OG no hydrogen 3.184 N/A ILE 17.A N ARG 13.A O no hydrogen 2.896 N/A ASP 18.A N THR 14.A O no hydrogen 2.875 N/A ALA 19.A N LEU 15.A O.A no hydrogen 3.057 N/A ALA 19.A N LEU 15.A O.B no hydrogen 2.958 N/A ILE 20.A N SER 16.A O no hydrogen 3.135 N/A GLU 21.A N ILE 17.A O no hydrogen 2.893 N/A LYS 22.A N ASP 18.A O no hydrogen 3.002 N/A LYS 22.A NZ LYS 83.A O no hydrogen 2.820 N/A ALA 23.A N ALA 19.A O no hydrogen 2.982 N/A ASN 24.A N GLU 21.A O no hydrogen 3.120 N/A SER 25.A N ILE 20.A O no hydrogen 3.301 N/A ALA 33.A N PRO 30.A O no hydrogen 3.027 N/A TYR 36.A N ALA 33.A O no hydrogen 2.849 N/A THR 37.A N PRO 34.A O no hydrogen 3.029 N/A THR 37.A OG1 PRO 34.A O no hydrogen 2.813 N/A TRP 39.A N ALA 35.A O no hydrogen 2.825 N/A TRP 39.A NE1 SER 74.A OG.A no hydrogen 3.204 N/A TRP 39.A NE1 SER 74.A OG.B no hydrogen 2.591 N/A THR 40.A N TYR 36.A O no hydrogen 2.955 N/A THR 40.A OG1 TYR 36.A O no hydrogen 2.784 N/A GLN 41.A N THR 37.A O no hydrogen 2.900 N/A PHE 42.A N LEU 38.A O no hydrogen 3.178 N/A LYS 43.A NZ ASN 53.A O no hydrogen 2.886 N/A LYS 43.A NZ ASP 139.A O no hydrogen 3.136 N/A HIS 44.A ND1 TYR 76.A OH no hydrogen 2.774 N/A HIS 44.A NE2 TRP 39.A O no hydrogen 3.004 N/A ASN 47.A ND2 GLU 296.A OE2 no hydrogen 3.029 N/A ASN 48.A N ASN 45.A O no hydrogen 2.763 N/A ASN 48.A ND2 GLN 299.A OE1 no hydrogen 2.346 N/A TRP 51.A N ASN 48.A O no hydrogen 3.045 N/A ASN 53.A ND2 ASP 139.A O no hydrogen 3.207 N/A ARG 54.A N TRP 51.A O no hydrogen 3.066 N/A ARG 54.A NE ASP 105.A OD1 no hydrogen 3.245 N/A ARG 54.A NH1 ASP 105.A OD1 no hydrogen 2.883 N/A ARG 54.A NH2 TRP 51.A O no hydrogen 2.949 N/A ASP 55.A N LYS 43.A O no hydrogen 2.845 N/A ARG 56.A N TYR 141.A O no hydrogen 3.005 N/A ARG 56.A NH1 PHE 52.A O no hydrogen 2.858 N/A ARG 56.A NH1 ARG 54.A O no hydrogen 2.811 N/A ARG 56.A NH2 PHE 52.A O no hydrogen 3.009 N/A ARG 56.A NH2 HIS 410.A O no hydrogen 3.057 N/A PHE 57.A N ASP 105.A OD2 no hydrogen 2.924 N/A VAL 58.A N TYR 143.A O no hydrogen 2.849 N/A SER 60.A OG ASP 150.A OD1 no hydrogen 2.780 N/A ALA 61.A N ILE 145.A O no hydrogen 3.277 N/A GLY 64.A N ALA 61.A O no hydrogen 3.011 N/A SER 65.A OG GLY 94.A O no hydrogen 2.724 N/A TYR 68.A N SER 65.A O no hydrogen 2.899 N/A TYR 68.A OH PRO 93.A O no hydrogen 2.699 N/A SER 69.A OG SER 16.A OG no hydrogen 3.184 N/A LEU 70.A N LEU 66.A O no hydrogen 3.155 N/A LEU 71.A N LEU 67.A O no hydrogen 2.880 N/A HIS 72.A N TYR 68.A O no hydrogen 2.965 N/A HIS 72.A ND1 VAL 78.A O no hydrogen 2.767 N/A HIS 72.A NE2 TYR 284.A OH no hydrogen 2.682 N/A LEU 73.A N SER 69.A O no hydrogen 2.848 N/A SER 74.A N.A LEU 70.A O no hydrogen 2.996 N/A SER 74.A N.B LEU 70.A O no hydrogen 2.982 N/A SER 74.A OG.A LEU 70.A O no hydrogen 2.709 N/A SER 74.A OG.A LEU 71.A O no hydrogen 3.432 N/A SER 74.A OG.B LEU 70.A O no hydrogen 2.722 N/A GLY 75.A N HIS 72.A O no hydrogen 3.185 N/A TYR 76.A N LEU 71.A O no hydrogen 2.931 N/A TYR 76.A OH HIS 44.A ND1 no hydrogen 2.774 N/A VAL 78.A N TYR 76.A O no hydrogen 2.780 N/A THR 79.A N ASP 81.A OD2 no hydrogen 2.846 N/A ASP 81.A N THR 79.A OG1 no hydrogen 2.978 N/A LEU 82.A N THR 79.A O no hydrogen 3.105 N/A ASN 84.A N ASP 81.A O no hydrogen 2.899 N/A PHE 85.A N LEU 82.A O no hydrogen 3.328 N/A ARG 86.A N THR 92.A O no hydrogen 2.888 N/A ARG 86.A NH1 GLY 94.A O no hydrogen 3.412 N/A ARG 86.A NH2 SER 25.A OG no hydrogen 2.863 N/A GLN 87.A N ASN 84.A O no hydrogen 3.109 N/A GLN 87.A NE2 PHE 85.A O no hydrogen 3.091 N/A SER 90.A N GLN 87.A O no hydrogen 2.978 N/A SER 90.A OG ASN 84.A O no hydrogen 2.923 N/A SER 90.A OG GLN 87.A O no hydrogen 3.445 N/A SER 90.A OG THR 92.A OG1 no hydrogen 3.115 N/A THR 92.A N SER 90.A OG no hydrogen 2.987 N/A THR 92.A OG1 ASP 81.A O no hydrogen 2.751 N/A THR 92.A OG1 SER 90.A OG no hydrogen 3.115 N/A TYR 98.A N THR 107.A OG1 no hydrogen 2.748 N/A HIS 100.A N GLU 97.A O no hydrogen 3.104 N/A THR 101.A OG1 LYS 91.A O no hydrogen 2.594 N/A VAL 104.A N THR 101.A O no hydrogen 3.266 N/A THR 108.A N PRO 96.A O no hydrogen 3.265 N/A THR 108.A OG1 LEU 59.A O no hydrogen 2.768 N/A GLY 112.A N ASP 150.A OD1 no hydrogen 2.798 N/A ALA 116.A N GLY 112.A O no hydrogen 3.478 N/A THR 117.A N GLN 113.A O no hydrogen 2.708 N/A THR 117.A OG1 GLN 113.A O no hydrogen 2.728 N/A ALA 118.A N GLY 114.A O no hydrogen 2.999 N/A VAL 119.A N ILE 115.A O no hydrogen 2.976 N/A GLY 120.A N ALA 116.A O no hydrogen 3.230 N/A ARG 124.A N ALA 121.A O no hydrogen 3.156 N/A ARG 124.A NE GLU 123.A OE1 no hydrogen 2.699 N/A ARG 124.A NH2 GLU 123.A OE1 no hydrogen 3.362 N/A ARG 124.A NH2 GLU 123.A OE2 no hydrogen 2.709 N/A HIS 125.A ND1 TYR 388.A O no hydrogen 2.832 N/A LEU 126.A N ALA 122.A O no hydrogen 2.880 N/A ALA 127.A N GLU 123.A O no hydrogen 2.969 N/A ALA 128.A N ARG 124.A O no hydrogen 2.965 N/A LYS 129.A N HIS 125.A O no hydrogen 2.966 N/A LYS 129.A NZ PRO 361.A O no hydrogen 2.825 N/A TYR 130.A N LEU 126.A O no hydrogen 2.854 N/A TYR 130.A OH GLU 318.A OE2 no hydrogen 2.834 N/A ASN 131.A N ALA 127.A O no hydrogen 2.938 N/A ASN 131.A ND2 VAL 138.A O no hydrogen 2.889 N/A ARG 132.A N TYR 135.A O no hydrogen 3.192 N/A ARG 132.A NH1 LYS 129.A O no hydrogen 2.939 N/A ARG 132.A NH1 ASN 131.A O no hydrogen 3.020 N/A TYR 135.A N ARG 132.A O no hydrogen 2.539 N/A ASN 136.A N ALA 134.A O no hydrogen 3.255 N/A ASN 136.A N ASN 136.A OD1 no hydrogen 2.698 N/A ASN 136.A ND2 ASP 139.A OD2 no hydrogen 2.818 N/A VAL 138.A N ASN 131.A OD1 no hydrogen 2.948 N/A ASP 139.A N ASN 53.A OD1 no hydrogen 2.831 N/A HIS 140.A N GLU 123.A OE2 no hydrogen 2.981 N/A HIS 140.A ND1 TYR 141.A O no hydrogen 2.959 N/A HIS 140.A NE2 HIS 410.A NE2 no hydrogen 2.809 N/A TYR 141.A N ASP 55.A OD1 no hydrogen 2.852 N/A TYR 141.A OH LYS 224.A O no hydrogen 3.220 N/A THR 142.A N ARG 169.A O no hydrogen 2.852 N/A TYR 143.A N ARG 56.A O no hydrogen 2.859 N/A ALA 144.A N VAL 171.A O no hydrogen 3.109 N/A ILE 145.A N VAL 58.A O no hydrogen 3.038 N/A CYS 146.A N LEU 173.A O no hydrogen 3.008 N/A CYS 146.A SG GLY 147.A O no hydrogen 3.995 N/A GLY 147.A N ASP 150.A OD2 no hydrogen 3.031 N/A LEU 151.A N ASP 148.A O no hydrogen 2.991 N/A SER 155.A N GLU 152.A O no hydrogen 3.202 N/A SER 155.A OG ASP 150.A O no hydrogen 2.698 N/A SER 155.A OG GLU 152.A O no hydrogen 2.940 N/A GLU 157.A N GLY 153.A O no hydrogen 3.015 N/A ALA 158.A N VAL 154.A O no hydrogen 3.013 N/A SER 159.A N SER 155.A O no hydrogen 2.910 N/A SER 159.A OG SER 155.A O no hydrogen 2.670 N/A SER 159.A OG TYR 197.A OH no hydrogen 2.681 N/A SER 160.A N ALA 156.A O no hydrogen 2.966 N/A LEU 161.A N GLU 157.A O no hydrogen 3.008 N/A ALA 162.A N ALA 158.A O no hydrogen 2.817 N/A ALA 163.A N SER 159.A O no hydrogen 3.112 N/A HIS 164.A N SER 160.A O no hydrogen 3.022 N/A LEU 165.A N LEU 161.A O no hydrogen 2.981 N/A GLN 166.A N ALA 163.A O no hydrogen 2.960 N/A LEU 167.A N ALA 162.A O no hydrogen 3.170 N/A GLY 168.A N GLN 166.A O no hydrogen 2.938 N/A ARG 169.A NH1 ASP 139.A OD1 no hydrogen 2.707 N/A ARG 169.A NH1 HIS 140.A O no hydrogen 3.205 N/A ARG 169.A NH2 ASP 139.A OD1 no hydrogen 3.001 N/A LEU 170.A N LEU 167.A O no hydrogen 3.156 N/A VAL 171.A N THR 142.A O no hydrogen 2.922 N/A VAL 172.A N THR 231.A O no hydrogen 2.889 N/A LEU 173.A N ALA 144.A O no hydrogen 2.765 N/A TYR 174.A N ILE 233.A O no hydrogen 2.800 N/A TYR 174.A OH ASP 148.A OD1 no hydrogen 2.435 N/A ASP 175.A N CYS 146.A O no hydrogen 2.855 N/A SER 176.A N VAL 235.A O no hydrogen 2.935 N/A SER 176.A OG GLU 234.A OE2 no hydrogen 2.627 N/A ILE 179.A N ASN 177.A OD1 no hydrogen 3.166 N/A SER 180.A N.A GLY 183.A O no hydrogen 2.832 N/A SER 180.A N.B GLY 183.A O no hydrogen 2.853 N/A SER 180.A OG.B GLY 183.A O no hydrogen 3.402 N/A GLY 183.A N SER 180.A O.B no hydrogen 3.231 N/A LEU 185.A N ASP 178.A O no hydrogen 2.890 N/A ARG 187.A N ASP 184.A O no hydrogen 3.007 N/A SER 188.A N LEU 185.A O no hydrogen 2.951 N/A SER 188.A OG LEU 185.A O no hydrogen 3.544 N/A ASP 195.A N SER 192.A OG no hydrogen 3.032 N/A ARG 196.A N SER 192.A O no hydrogen 3.052 N/A ARG 196.A NE GLU 191.A OE1 no hydrogen 2.810 N/A ARG 196.A NH1 TYR 200.A OH no hydrogen 2.994 N/A ARG 196.A NH2 GLU 191.A OE1 no hydrogen 2.999 N/A TYR 197.A N VAL 193.A O no hydrogen 2.982 N/A TYR 197.A OH SER 159.A OG no hydrogen 2.681 N/A LYS 198.A N GLU 194.A O no hydrogen 2.980 N/A LYS 198.A NZ GLU 194.A OE2 no hydrogen 2.892 N/A ALA 199.A N ASP 195.A O no hydrogen 2.926 N/A TYR 200.A N ARG 196.A O no hydrogen 2.997 N/A GLY 201.A N TYR 197.A O no hydrogen 3.150 N/A TRP 202.A N TYR 197.A O no hydrogen 2.967 N/A TRP 202.A NE1 SER 159.A O no hydrogen 2.769 N/A GLN 203.A N PRO 230.A O no hydrogen 2.844 N/A ILE 205.A N LEU 232.A O no hydrogen 2.960 N/A ARG 206.A NE GLU 208.A OE1 no hydrogen 2.873 N/A ARG 206.A NE GLU 208.A OE2 no hydrogen 2.965 N/A VAL 207.A N GLU 234.A O no hydrogen 2.834 N/A GLY 210.A N ARG 236.A O no hydrogen 2.913 N/A ASN 211.A N ASP 209.A OD2 no hydrogen 2.938 N/A ASP 212.A N ASP 209.A O no hydrogen 2.868 N/A ALA 215.A N ASP 212.A OD2 no hydrogen 3.163 N/A ILE 216.A N ASP 212.A O no hydrogen 3.225 N/A ALA 217.A N ILE 213.A O no hydrogen 2.871 N/A LYS 218.A N GLU 214.A O no hydrogen 2.947 N/A ALA 219.A N ALA 215.A O no hydrogen 3.059 N/A ILE 220.A N ILE 216.A O no hydrogen 2.926 N/A GLU 221.A N ALA 217.A O no hydrogen 2.923 N/A GLU 222.A N LYS 218.A O no hydrogen 2.897 N/A ALA 223.A N ALA 219.A O no hydrogen 2.818 N/A LYS 224.A N ILE 220.A O no hydrogen 2.902 N/A ALA 225.A N GLU 221.A O no hydrogen 3.075 N/A ALA 225.A N GLU 222.A O no hydrogen 3.258 N/A ASP 226.A N ALA 223.A O no hydrogen 3.212 N/A LYS 228.A N ASP 226.A OD2 no hydrogen 2.975 N/A ARG 229.A N ASP 226.A OD2 no hydrogen 3.115 N/A ARG 229.A NE ASP 226.A OD1 no hydrogen 2.697 N/A ARG 229.A NH2 ASP 226.A OD1 no hydrogen 2.720 N/A THR 231.A N LEU 170.A O no hydrogen 3.038 N/A THR 231.A OG1 GLN 203.A OE1 no hydrogen 2.635 N/A LEU 232.A N GLN 203.A O no hydrogen 2.819 N/A ILE 233.A N VAL 172.A O no hydrogen 2.780 N/A GLU 234.A N ILE 205.A O no hydrogen 2.828 N/A VAL 235.A N TYR 174.A O no hydrogen 2.806 N/A ARG 236.A N VAL 207.A O no hydrogen 2.951 N/A ARG 236.A NH1 SER 176.A OG no hydrogen 2.956 N/A ARG 236.A NH1 ASP 178.A OD1 no hydrogen 2.961 N/A ARG 236.A NH2 ASP 178.A OD1 no hydrogen 3.416 N/A ARG 236.A NH2 ASP 178.A OD2 no hydrogen 2.865 N/A THR 237.A N SER 176.A O no hydrogen 3.105 N/A THR 237.A OG1 ASP 175.A OD1 no hydrogen 2.498 N/A GLY 240.A N GLY 29.A O no hydrogen 2.964 N/A PHE 241.A N THR 238.A O no hydrogen 3.060 N/A SER 243.A N GLY 240.A O no hydrogen 3.089 N/A SER 243.A OG GLU 261.A OE2 no hydrogen 2.543 N/A ASN 245.A N GLU 261.A OE2 no hydrogen 2.853 N/A ASN 245.A ND2 GLU 261.A OE1 no hydrogen 2.788 N/A LYS 246.A N SER 243.A OG no hydrogen 2.875 N/A LYS 246.A NZ PRO 256.A O no hydrogen 3.312 N/A LYS 246.A NZ LEU 257.A O no hydrogen 3.092 N/A SER 247.A N SER 243.A O no hydrogen 3.002 N/A SER 247.A OG SER 243.A O no hydrogen 2.792 N/A GLY 248.A N ILE 239.A O no hydrogen 2.828 N/A LYS 249.A N LYS 246.A O no hydrogen 3.113 N/A LYS 249.A NZ ASN 245.A O no hydrogen 2.971 N/A SER 252.A N LYS 249.A O no hydrogen 3.027 N/A SER 252.A OG LYS 246.A O no hydrogen 3.441 N/A SER 252.A OG LYS 249.A O no hydrogen 2.871 N/A HIS 253.A N SER 250.A O no hydrogen 2.910 N/A GLY 258.A N GLU 21.A OE2 no hydrogen 2.781 N/A THR 262.A N GLY 258.A O no hydrogen 2.870 N/A THR 262.A OG1 GLY 258.A O no hydrogen 2.761 N/A LYS 263.A N VAL 259.A O no hydrogen 3.192 N/A LYS 263.A NZ GLU 260.A OE2 no hydrogen 3.360 N/A LEU 264.A N GLU 260.A O no hydrogen 3.029 N/A THR 265.A N GLU 261.A O no hydrogen 2.867 N/A THR 265.A OG1 GLU 261.A O no hydrogen 2.772 N/A LYS 266.A N THR 262.A O no hydrogen 2.942 N/A LYS 266.A NZ ASP 18.A OD1 no hydrogen 2.783 N/A LYS 266.A NZ ASP 18.A OD2 no hydrogen 3.271 N/A GLU 267.A N LYS 263.A O no hydrogen 3.015 N/A ALA 268.A N LEU 264.A O no hydrogen 2.994 N/A TYR 269.A N THR 265.A O no hydrogen 2.964 N/A TYR 269.A OH PHE 241.A O no hydrogen 2.623 N/A ALA 270.A N GLU 267.A O no hydrogen 2.977 N/A TRP 271.A N LYS 266.A O no hydrogen 2.803 N/A PHE 277.A N ASP 18.A OD2 no hydrogen 2.858 N/A VAL 283.A N ALA 280.A O no hydrogen 2.971 N/A TYR 284.A N ALA 280.A O no hydrogen 3.443 N/A TYR 284.A OH HIS 72.A NE2 no hydrogen 2.682 N/A GLU 285.A N GLU 281.A O no hydrogen 2.927 N/A ASN 286.A N GLU 282.A O no hydrogen 2.933 N/A ASN 286.A ND2 SER 8.A OG no hydrogen 2.877 N/A ASN 286.A ND2 TYR 36.A OH no hydrogen 2.656 N/A PHE 287.A N VAL 283.A O no hydrogen 3.085 N/A ARG 288.A N TYR 284.A O no hydrogen 2.807 N/A ARG 288.A NH2 GLU 281.A OE1 no hydrogen 2.954 N/A ARG 288.A NH2 GLU 285.A OE1 no hydrogen 2.907 N/A LYS 289.A N GLU 285.A O no hydrogen 2.926 N/A THR 290.A N ASN 286.A O no hydrogen 3.047 N/A THR 290.A OG1 ASN 286.A O no hydrogen 2.850 N/A VAL 291.A N PHE 287.A O no hydrogen 2.783 N/A GLN 292.A N PHE 287.A O no hydrogen 3.314 N/A ASP 293.A N ARG 288.A O no hydrogen 2.891 N/A GLY 295.A N VAL 291.A O no hydrogen 2.814 N/A GLU 296.A N GLN 292.A O no hydrogen 2.903 N/A THR 297.A N ASP 293.A O no hydrogen 3.095 N/A THR 297.A OG1 ASP 293.A O no hydrogen 3.040 N/A ALA 298.A N VAL 294.A O no hydrogen 2.941 N/A GLN 299.A N GLY 295.A O no hydrogen 2.880 N/A ALA 300.A N GLU 296.A O no hydrogen 2.949 N/A GLU 301.A N THR 297.A O no hydrogen 2.982 N/A TRP 302.A N ALA 298.A O no hydrogen 2.931 N/A TRP 302.A NE1 ILE 137.A O no hydrogen 2.742 N/A ASN 303.A N GLN 299.A O no hydrogen 2.800 N/A THR 304.A N ALA 300.A O no hydrogen 2.944 N/A THR 304.A OG1 ALA 300.A O no hydrogen 3.062 N/A GLY 306.A N ASN 303.A O no hydrogen 3.063 N/A GLU 307.A N THR 304.A O no hydrogen 3.171 N/A TYR 308.A OH TYR 130.A O no hydrogen 2.560 N/A ALA 309.A N LEU 305.A O no hydrogen 2.940 N/A GLN 310.A N GLY 306.A O no hydrogen 3.208 N/A ALA 311.A N GLU 307.A O no hydrogen 3.002 N/A TYR 312.A N TYR 308.A O no hydrogen 2.766 N/A TYR 312.A OH ASP 133.A OD1 no hydrogen 2.524 N/A ALA 316.A N TYR 312.A O no hydrogen 2.839 N/A ASN 317.A N PRO 313.A O no hydrogen 2.951 N/A GLU 318.A N GLU 314.A O no hydrogen 2.944 N/A LEU 319.A N LEU 315.A O no hydrogen 2.915 N/A GLN 320.A N ALA 316.A O no hydrogen 2.989 N/A ALA 321.A N ASN 317.A O no hydrogen 3.101 N/A ALA 322.A N GLU 318.A O no hydrogen 2.865 N/A GLY 324.A N ALA 322.A O no hydrogen 2.933 N/A LEU 325.A N ALA 321.A O no hydrogen 2.992 N/A TRP 330.A N PRO 327.A O no hydrogen 3.047 N/A GLU 331.A N GLU 331.A OE1 no hydrogen 2.791 N/A GLN 332.A N GLY 329.A O no hydrogen 3.059 N/A GLN 332.A NE2 GLU 331.A OE2 no hydrogen 3.254 N/A ASN 333.A N TRP 330.A O no hydrogen 3.368 N/A ASN 333.A ND2 ALA 355.A O no hydrogen 2.818 N/A ASN 333.A ND2 GLU 358.A OE1 no hydrogen 3.282 N/A LEU 334.A N GLU 331.A O no hydrogen 3.026 N/A TYR 337.A N ASN 481.A OD1 no hydrogen 2.799 N/A SER 341.A OG GLU 338.A O no hydrogen 2.536 N/A SER 341.A OG THR 509.A OG1 no hydrogen 2.973 N/A ALA 343.A N LEU 507.A O no hydrogen 2.941 N/A THR 345.A N THR 503.A OG1 no hydrogen 3.012 N/A THR 345.A OG1 THR 503.A OG1 no hydrogen 3.346 N/A ARG 346.A N THR 503.A O no hydrogen 3.149 N/A ARG 346.A NH1 SER 373.A O no hydrogen 2.804 N/A ASN 347.A N ALA 344.A O no hydrogen 2.952 N/A SER 348.A N ALA 344.A O no hydrogen 3.121 N/A SER 348.A OG THR 345.A O no hydrogen 3.194 N/A SER 348.A OG SER 483.A OG no hydrogen 2.484 N/A SER 349.A N THR 345.A O no hydrogen 2.945 N/A GLY 350.A N ARG 346.A O no hydrogen 2.929 N/A ALA 351.A N ASN 347.A O no hydrogen 2.921 N/A VAL 352.A N SER 348.A O no hydrogen 2.910 N/A ILE 353.A N SER 349.A O no hydrogen 2.864 N/A ASN 354.A N GLY 350.A O no hydrogen 3.056 N/A ASN 354.A ND2 GLY 350.A O no hydrogen 2.965 N/A ASN 354.A ND2 TYR 377.A O no hydrogen 3.167 N/A ALA 355.A N ALA 351.A O no hydrogen 2.998 N/A ILE 356.A N VAL 352.A O no hydrogen 2.780 N/A ALA 357.A N ILE 353.A O no hydrogen 2.896 N/A SER 359.A N ALA 355.A O no hydrogen 3.225 N/A SER 359.A N ILE 356.A O no hydrogen 3.000 N/A SER 359.A OG TRP 330.A O no hydrogen 3.248 N/A SER 359.A OG ALA 355.A O no hydrogen 3.234 N/A VAL 360.A N ILE 356.A O no hydrogen 2.752 N/A PHE 363.A N VAL 360.A O no hydrogen 3.314 N/A PHE 364.A N LYS 414.A O no hydrogen 2.963 N/A GLY 365.A N LYS 391.A O no hydrogen 3.338 N/A GLY 366.A N TYR 416.A O no hydrogen 3.271 N/A SER 367.A N ILE 393.A O no hydrogen 3.451 N/A SER 367.A OG GLY 418.A O no hydrogen 3.376 N/A ALA 368.A N GLY 418.A O no hydrogen 2.983 N/A LEU 370.A N SER 367.A OG no hydrogen 3.042 N/A ASN 374.A N LEU 370.A O no hydrogen 2.664 N/A ASN 374.A ND2 SER 367.A OG no hydrogen 2.747 N/A LYS 375.A NZ GLY 372.A O no hydrogen 3.315 N/A THR 376.A N ALA 371.A O no hydrogen 3.439 N/A TYR 377.A OH ASP 382.A OD1 no hydrogen 2.555 N/A PHE 383.A N ASN 392.A O no hydrogen 2.778 N/A THR 384.A N ASP 387.A O no hydrogen 3.204 N/A ARG 385.A NE.A HIS 164.A O no hydrogen 3.030 N/A ARG 385.A NH2.A HIS 164.A O no hydrogen 2.952 N/A ASP 386.A N THR 384.A OG1 no hydrogen 3.006 N/A ASP 387.A N THR 384.A O no hydrogen 2.958 N/A ASP 387.A N THR 384.A OG1 no hydrogen 3.140 N/A TYR 388.A OH LEU 165.A O no hydrogen 2.680 N/A SER 389.A N ASP 387.A OD1 no hydrogen 3.060 N/A SER 389.A OG ASP 387.A OD1 no hydrogen 2.693 N/A GLY 390.A N ASP 387.A O no hydrogen 3.281 N/A ASN 392.A N LYS 381.A O no hydrogen 3.044 N/A ASN 392.A ND2 LYS 381.A O no hydrogen 3.355 N/A ILE 393.A N GLY 365.A O no hydrogen 2.948 N/A TRP 394.A NE1 ASP 382.A OD1 no hydrogen 2.995 N/A TYR 395.A N SER 367.A O no hydrogen 3.201 N/A ARG 398.A N GLY 396.A O no hydrogen 2.840 N/A ARG 398.A NH1 TYR 395.A O no hydrogen 2.814 N/A ARG 398.A NH2 SER 160.A OG no hydrogen 2.962 N/A GLU 399.A N GLU 399.A OE1 no hydrogen 2.841 N/A ALA 401.A N GLU 157.A OE1 no hydrogen 2.891 N/A ALA 403.A N PHE 400.A O no hydrogen 2.972 N/A ALA 404.A N ALA 401.A O no hydrogen 2.758 N/A ASN 405.A ND2 ALA 430.A O no hydrogen 3.012 N/A GLY 406.A N ALA 403.A O no hydrogen 3.119 N/A ILE 407.A N ALA 404.A O no hydrogen 2.816 N/A LEU 409.A N ASN 405.A O no hydrogen 2.793 N/A HIS 410.A N GLY 406.A O no hydrogen 2.950 N/A HIS 410.A ND1 GLY 411.A O no hydrogen 2.941 N/A HIS 410.A NE2 HIS 140.A NE2 no hydrogen 2.809 N/A LYS 414.A N SER 362.A O no hydrogen 2.801 N/A LYS 414.A NZ LEU 491.A O no hydrogen 2.832 N/A THR 415.A OG1 PHE 364.A O no hydrogen 2.683 N/A TYR 416.A N PHE 364.A O no hydrogen 3.363 N/A TYR 416.A OH THR 376.A O no hydrogen 2.826 N/A GLY 417.A N THR 441.A O no hydrogen 3.097 N/A GLY 418.A N GLY 366.A O no hydrogen 2.884 N/A THR 419.A N VAL 443.A O no hydrogen 3.124 N/A PHE 421.A N THR 445.A O no hydrogen 2.886 N/A PHE 423.A N PHE 420.A O no hydrogen 2.891 N/A SER 424.A N PHE 421.A O no hydrogen 2.907 N/A SER 424.A OG PHE 421.A O no hydrogen 2.689 N/A TYR 426.A N PHE 423.A O no hydrogen 2.962 N/A LEU 427.A N SER 424.A O no hydrogen 3.105 N/A ARG 428.A N ASP 425.A O no hydrogen 3.337 N/A ARG 428.A NH1 ALA 466.A O no hydrogen 3.204 N/A ARG 428.A NH2 ALA 466.A O no hydrogen 2.790 N/A ALA 430.A N LEU 427.A O no hydrogen 2.939 N/A ILE 431.A N LEU 427.A O no hydrogen 3.166 N/A ARG 432.A N ARG 428.A O no hydrogen 3.025 N/A LEU 433.A N PRO 429.A O no hydrogen 3.169 N/A ALA 434.A N ALA 430.A O no hydrogen 2.917 N/A ALA 435.A N ILE 431.A O no hydrogen 2.930 N/A LEU 436.A N ARG 432.A O no hydrogen 2.974 N/A LEU 438.A N ALA 434.A O no hydrogen 2.866 N/A VAL 440.A N LEU 438.A O no hydrogen 2.816 N/A THR 441.A N THR 415.A O no hydrogen 3.170 N/A TYR 442.A N THR 498.A O no hydrogen 2.844 N/A VAL 443.A N GLY 417.A O no hydrogen 2.803 N/A PHE 444.A N LEU 500.A O no hydrogen 2.940 N/A THR 445.A N THR 419.A O no hydrogen 3.257 N/A THR 445.A OG1 ASN 374.A OD1 no hydrogen 2.948 N/A THR 445.A OG1 HIS 446.A ND1 no hydrogen 2.823 N/A HIS 446.A ND1 THR 445.A OG1 no hydrogen 2.823 N/A ASP 447.A N LEU 502.A O no hydrogen 3.145 N/A ALA 450.A N SER 448.A OG no hydrogen 3.026 N/A VAL 451.A N SER 448.A O no hydrogen 3.013 N/A GLY 452.A N ILE 449.A O no hydrogen 3.009 N/A GLU 453.A N GLU 453.A OE1 no hydrogen 2.821 N/A GLY 455.A N GLY 452.A O no hydrogen 3.174 N/A THR 457.A OG1 HIS 458.A ND1 no hydrogen 2.853 N/A HIS 458.A N GLY 455.A O no hydrogen 2.918 N/A HIS 458.A ND1 THR 457.A OG1 no hydrogen 2.853 N/A GLU 459.A N PRO 456.A O no hydrogen 3.348 N/A ILE 461.A N GLN 463.A OE1 no hydrogen 2.926 N/A GLU 462.A N GLU 462.A OE1 no hydrogen 2.561 N/A GLN 463.A N GLN 463.A OE1 no hydrogen 2.734 N/A GLN 463.A NE2 VAL 422.A O no hydrogen 3.416 N/A GLN 463.A NE2 ASP 425.A OD2 no hydrogen 3.103 N/A ALA 466.A N GLU 462.A O no hydrogen 2.989 N/A LEU 467.A N GLN 463.A O no hydrogen 3.216 N/A ARG 468.A N LEU 464.A O no hydrogen 2.853 N/A ARG 468.A NH1 GLU 596.A OE1 no hydrogen 2.774 N/A ARG 468.A NH1 GLU 596.A OE2 no hydrogen 3.397 N/A ARG 468.A NH2 GLU 596.A OE2 no hydrogen 2.825 N/A ALA 469.A N ALA 465.A O no hydrogen 3.030 N/A ASN 471.A ND2 ALA 435.A O no hydrogen 2.785 N/A ASN 471.A ND2 ASN 495.A O no hydrogen 3.101 N/A SER 473.A N PRO 497.A O no hydrogen 2.992 N/A SER 473.A OG ASP 571.A OD1 no hydrogen 2.767 N/A SER 473.A OG ASP 571.A OD2 no hydrogen 3.558 N/A VAL 474.A N ASP 571.A OD2 no hydrogen 2.874 N/A ILE 475.A N ALA 499.A O no hydrogen 2.971 N/A ARG 476.A N PRO 569.A O no hydrogen 2.878 N/A ARG 476.A NE ASP 447.A OD2 no hydrogen 2.795 N/A ARG 476.A NH1 THR 543.A OG1 no hydrogen 2.769 N/A ARG 476.A NH1 GLU 546.A OE1 no hydrogen 2.880 N/A ARG 476.A NH2 ASP 447.A OD2 no hydrogen 3.008 N/A ARG 476.A NH2 GLU 546.A OE1 no hydrogen 2.987 N/A ALA 478.A N GLU 482.A OE1 no hydrogen 2.765 N/A ASN 481.A ND2 TYR 337.A O no hydrogen 2.941 N/A GLU 482.A N ASP 479.A OD1 no hydrogen 2.889 N/A SER 483.A N ASP 479.A O no hydrogen 3.025 N/A SER 483.A OG SER 348.A OG no hydrogen 2.484 N/A SER 483.A OG GLY 480.A O no hydrogen 2.784 N/A VAL 484.A N GLY 480.A O no hydrogen 3.135 N/A ALA 485.A N ASN 481.A O no hydrogen 3.177 N/A ALA 486.A N GLU 482.A O no hydrogen 2.857 N/A TRP 487.A N SER 483.A O no hydrogen 3.018 N/A TRP 487.A NE1 SER 349.A OG no hydrogen 2.923 N/A ARG 488.A N VAL 484.A O no hydrogen 2.969 N/A ARG 488.A NE GLU 492.A OE2 no hydrogen 2.958 N/A LEU 489.A N ALA 485.A O no hydrogen 2.957 N/A ALA 490.A N ALA 486.A O no hydrogen 2.902 N/A LEU 491.A N TRP 487.A O no hydrogen 2.831 N/A GLU 492.A N ARG 488.A O no hydrogen 3.048 N/A SER 493.A N ALA 490.A O no hydrogen 3.306 N/A SER 493.A OG LYS 496.A O no hydrogen 2.737 N/A LYS 496.A N SER 493.A OG no hydrogen 3.405 N/A LYS 496.A NZ ASN 495.A OD1 no hydrogen 3.047 N/A THR 498.A N VAL 440.A O no hydrogen 2.894 N/A ALA 499.A N SER 473.A O no hydrogen 2.741 N/A LEU 500.A N TYR 442.A O no hydrogen 2.847 N/A VAL 501.A N ILE 475.A O no hydrogen 2.885 N/A LEU 502.A N PHE 444.A O no hydrogen 2.866 N/A THR 503.A N THR 345.A OG1 no hydrogen 2.746 N/A THR 503.A OG1 THR 345.A OG1 no hydrogen 3.346 N/A THR 503.A OG1 GLN 505.A O no hydrogen 2.706 N/A GLN 505.A N GLN 505.A OE1 no hydrogen 2.587 N/A LEU 507.A N ALA 343.A O no hydrogen 2.911 N/A THR 509.A N SER 341.A O no hydrogen 3.038 N/A THR 509.A OG1 GLU 338.A O no hydrogen 3.361 N/A THR 509.A OG1 SER 341.A O no hydrogen 3.129 N/A THR 509.A OG1 SER 341.A OG no hydrogen 2.973 N/A LEU 510.A N ASP 479.A OD2 no hydrogen 2.755 N/A ALA 513.A N LEU 510.A O no hydrogen 3.147 N/A LYS 514.A N GLU 511.A O no hydrogen 3.334 N/A THR 517.A OG1 ALA 513.A O no hydrogen 2.739 N/A TYR 518.A OH GLU 492.A OE1 no hydrogen 2.668 N/A LYS 520.A N ASP 516.A O.A no hydrogen 3.058 N/A LYS 520.A N ASP 516.A O.B no hydrogen 3.069 N/A LYS 520.A NZ GLY 512.A O no hydrogen 2.855 N/A LYS 520.A NZ ASP 515.A O no hydrogen 2.756 N/A VAL 521.A N THR 517.A O no hydrogen 2.863 N/A ALA 522.A N TYR 518.A O no hydrogen 2.891 N/A LYS 523.A N LYS 520.A O no hydrogen 3.082 N/A GLY 524.A N VAL 521.A O no hydrogen 2.846 N/A TYR 526.A N SER 568.A O no hydrogen 2.987 N/A TYR 526.A OH GLU 482.A OE2 no hydrogen 2.575 N/A VAL 528.A N VAL 566.A O no hydrogen 2.837 N/A SER 529.A N VAL 566.A O no hydrogen 3.182 N/A SER 529.A OG GLN 554.A OE1 no hydrogen 2.577 N/A SER 531.A OG LYS 533.A O no hydrogen 2.889 N/A LYS 532.A N ASP 563.A OD1 no hydrogen 2.840 N/A LYS 533.A N ASP 563.A OD2 no hydrogen 2.726 N/A LYS 533.A NZ ASP 537.A OD1 no hydrogen 2.877 N/A ASP 537.A N ASP 563.A O no hydrogen 2.750 N/A ILE 539.A N LYS 591.A O no hydrogen 2.940 N/A LEU 540.A N SER 565.A O no hydrogen 2.740 N/A LEU 541.A N PHE 593.A O no hydrogen 2.803 N/A ALA 542.A N VAL 567.A O no hydrogen 3.013 N/A THR 543.A OG1 GLU 596.A OE2 no hydrogen 2.528 N/A SER 545.A OG GLU 546.A OE1 no hydrogen 3.369 N/A SER 545.A OG GLU 546.A OE2 no hydrogen 2.661 N/A GLU 546.A N THR 543.A O no hydrogen 2.948 N/A VAL 547.A N GLY 544.A O no hydrogen 3.160 N/A SER 548.A OG SER 545.A O no hydrogen 3.491 N/A ALA 550.A N GLU 546.A O no hydrogen 2.928 N/A VAL 551.A N VAL 547.A O no hydrogen 2.932 N/A GLU 552.A N SER 548.A O no hydrogen 3.032 N/A ALA 553.A N LEU 549.A O no hydrogen 2.881 N/A GLN 554.A N ALA 550.A O no hydrogen 2.845 N/A GLN 554.A NE2 SER 529.A O no hydrogen 3.126 N/A GLN 554.A NE2 ALA 530.A O no hydrogen 3.195 N/A GLN 554.A NE2 ALA 564.A O no hydrogen 2.745 N/A LYS 555.A N VAL 551.A O no hydrogen 3.145 N/A ALA 556.A N GLU 552.A O no hydrogen 3.119 N/A LEU 557.A N ALA 553.A O no hydrogen 2.800 N/A ALA 558.A N GLN 554.A O no hydrogen 2.995 N/A VAL 559.A N LYS 555.A O no hydrogen 3.364 N/A ASP 560.A N LEU 557.A O no hydrogen 2.935 N/A GLY 561.A N ALA 558.A O no hydrogen 3.065 N/A VAL 562.A N LEU 557.A O no hydrogen 2.976 N/A ASP 563.A N ASP 537.A OD2 no hydrogen 2.684 N/A SER 565.A N VAL 538.A O no hydrogen 2.949 N/A VAL 566.A N SER 529.A O no hydrogen 2.834 N/A VAL 567.A N LEU 540.A O no hydrogen 2.780 N/A SER 568.A N TYR 526.A O no hydrogen 3.002 N/A SER 568.A OG GLU 482.A OE2 no hydrogen 2.783 N/A SER 570.A N GLY 524.A O no hydrogen 2.953 N/A SER 570.A OG VAL 474.A O no hydrogen 3.195 N/A SER 570.A OG ASP 571.A OD2 no hydrogen 2.793 N/A ARG 572.A N SER 570.A OG no hydrogen 3.190 N/A ARG 572.A NE ALA 522.A O no hydrogen 2.763 N/A ARG 572.A NH2 ALA 522.A O no hydrogen 3.336 N/A PHE 573.A N SER 570.A O no hydrogen 3.083 N/A ALA 575.A N ARG 572.A O no hydrogen 3.255 N/A GLN 576.A N PHE 573.A O no hydrogen 2.900 N/A GLN 576.A NE2 ARG 572.A O no hydrogen 2.925 N/A TYR 580.A N THR 577.A OG1 no hydrogen 3.031 N/A TYR 580.A OH ALA 525.A O no hydrogen 2.720 N/A LYS 581.A N THR 577.A O no hydrogen 3.007 N/A LYS 581.A NZ GLU 574.A O no hydrogen 3.209 N/A LYS 581.A NZ GLU 574.A OE1 no hydrogen 3.561 N/A GLU 582.A N ALA 578.A O no hydrogen 2.907 N/A SER 583.A N GLU 579.A O no hydrogen 3.173 N/A SER 583.A N TYR 580.A O no hydrogen 2.977 N/A SER 583.A OG TYR 580.A O no hydrogen 2.669 N/A VAL 584.A N TYR 580.A O no hydrogen 3.287 N/A VAL 584.A N LYS 581.A O no hydrogen 3.139 N/A LEU 585.A N LYS 581.A O no hydrogen 2.832 N/A LYS 587.A N GLU 582.A OE1 no hydrogen 2.933 N/A VAL 589.A N PRO 586.A O no hydrogen 2.961 N/A THR 590.A OG1 GLU 609.A OE1 no hydrogen 3.277 N/A ARG 592.A NE VAL 589.A O no hydrogen 2.813 N/A ARG 592.A NH1 TYR 605.A O no hydrogen 2.924 N/A ARG 592.A NH2 PRO 586.A O no hydrogen 2.921 N/A ARG 592.A NH2 VAL 589.A O no hydrogen 3.380 N/A PHE 593.A N ILE 539.A O no hydrogen 2.866 N/A ALA 594.A N ASP 611.A O no hydrogen 3.012 N/A ILE 595.A N LEU 541.A O no hydrogen 2.747 N/A GLU 596.A N LEU 613.A O no hydrogen 3.158 N/A ALA 598.A N ILE 461.A O no hydrogen 2.885 N/A THR 599.A N ASP 616.A OD1 no hydrogen 3.025 N/A THR 599.A OG1 ASP 616.A OD1 no hydrogen 3.512 N/A THR 599.A OG1 ASP 616.A OD2 no hydrogen 2.639 N/A TRP 602.A N THR 599.A O no hydrogen 3.069 N/A TRP 602.A NE1 GLU 596.A OE1 no hydrogen 2.895 N/A ARG 604.A NE GLU 574.A OE2 no hydrogen 3.426 N/A ARG 604.A NH2 GLU 574.A OE1 no hydrogen 2.897 N/A TYR 605.A N TRP 602.A O no hydrogen 2.901 N/A TYR 605.A OH GLU 574.A OE2 no hydrogen 2.579 N/A VAL 606.A N TRP 602.A O no hydrogen 3.047 N/A GLY 607.A N HIS 603.A O.A no hydrogen 2.981 N/A GLY 607.A N HIS 603.A O.B no hydrogen 2.982 N/A ASP 611.A N ARG 592.A O no hydrogen 2.958 N/A LEU 613.A N ALA 594.A O no hydrogen 2.784 N/A ILE 615.A N GLY 597.A O no hydrogen 2.922 N/A THR 617.A OG1 PHE 618.A O no hydrogen 2.988 N/A ALA 620.A N GLU 459.A OE1 no hydrogen 2.844 N/A SER 621.A OG GLU 453.A O no hydrogen 2.657 N/A ALA 622.A N GLY 452.A O no hydrogen 3.378 N/A LYS 626.A NZ GLU 629.A OE2 no hydrogen 2.586 N/A ILE 627.A N PRO 623.A O no hydrogen 3.298 N/A GLU 629.A N LYS 626.A O no hydrogen 2.890 N/A TYR 630.A N ILE 627.A O no hydrogen 2.788 N/A TYR 630.A OH PHE 618.A O no hydrogen 2.741 N/A GLY 631.A N GLU 628.A O no hydrogen 3.059 N/A ASN 636.A N THR 633.A OG1 no hydrogen 3.084 N/A ASN 636.A ND2 GLY 631.A O no hydrogen 2.750 N/A VAL 637.A N THR 633.A O no hydrogen 2.996 N/A VAL 638.A N VAL 634.A O no hydrogen 2.913 N/A ARG 639.A N GLU 635.A O no hydrogen 3.046 N/A ARG 639.A NE ASN 636.A OD1 no hydrogen 3.193 N/A ARG 639.A NH1 GLU 643.A OE1 no hydrogen 2.876 N/A ARG 639.A NH2 ASN 636.A OD1 no hydrogen 2.740 N/A LYS 640.A N ASN 636.A O no hydrogen 3.007 N/A VAL 641.A N VAL 637.A O no hydrogen 2.947 N/A LYS 642.A N VAL 638.A O no hydrogen 3.065 N/A LYS 642.A NZ ASP 560.A OD1 no hydrogen 2.616 N/A GLU 643.A N ARG 639.A O no hydrogen 3.042 N/A