Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4g7r_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 1.A OH LEU 397.A O no hydrogen 2.908 N/A GLU 6.A N GLU 6.A OE1 no hydrogen 2.768 N/A LYS 7.A NZ TYR 80.A OH no hydrogen 2.893 N/A LYS 7.A NZ ASN 396.A O no hydrogen 3.070 N/A LYS 7.A NZ ASN 396.A OD1 no hydrogen 3.449 N/A LYS 7.A NZ ALA 491.A O no hydrogen 2.853 N/A ALA 9.A N PRO 5.A O no hydrogen 3.420 N/A THR 10.A N GLU 6.A O no hydrogen 2.949 N/A THR 10.A OG1 GLU 6.A O no hydrogen 2.717 N/A LEU 11.A N LYS 7.A O no hydrogen 2.806 N/A TYR 12.A N LYS 8.A O no hydrogen 3.004 N/A PHE 13.A N ALA 9.A O no hydrogen 3.170 N/A LEU 14.A N THR 10.A O no hydrogen 2.985 N/A VAL 15.A N LEU 11.A O no hydrogen 2.923 N/A LEU 16.A N TYR 12.A O no hydrogen 3.252 N/A GLY 17.A N PHE 13.A O no hydrogen 3.154 N/A PHE 18.A N LEU 14.A O no hydrogen 2.805 N/A LEU 19.A N VAL 15.A O no hydrogen 2.859 N/A ALA 20.A N LEU 16.A O no hydrogen 2.986 N/A LEU 21.A N GLY 17.A O no hydrogen 3.011 N/A ILE 22.A N PHE 18.A O no hydrogen 2.831 N/A VAL 23.A N LEU 19.A O no hydrogen 3.116 N/A GLY 24.A N ALA 20.A O no hydrogen 2.792 N/A SER 25.A N LEU 21.A O no hydrogen 2.748 N/A SER 25.A OG LEU 21.A O no hydrogen 3.031 N/A LEU 26.A N ILE 22.A O no hydrogen 3.005 N/A LEU 26.A N VAL 23.A O no hydrogen 3.305 N/A GLY 28.A N SER 25.A O no hydrogen 2.736 N/A GLN 31.A N PHE 27.A O no hydrogen 3.085 N/A ALA 32.A N GLY 28.A O no hydrogen 2.839 N/A LEU 33.A N PRO 29.A O no hydrogen 2.906 N/A ASN 34.A N PHE 30.A O no hydrogen 3.072 N/A ASN 34.A ND2 ALA 440.A O no hydrogen 2.772 N/A TYR 35.A N GLN 31.A O no hydrogen 3.090 N/A TYR 35.A OH PRO 437.A O no hydrogen 2.694 N/A GLY 36.A N LEU 33.A O no hydrogen 2.892 N/A ASN 37.A N ASN 34.A O no hydrogen 2.993 N/A ASN 37.A ND2 PRO 446.A O no hydrogen 3.321 N/A VAL 38.A N LEU 33.A O no hydrogen 2.707 N/A TYR 41.A N ASP 39.A OD2 no hydrogen 3.154 N/A LEU 44.A N ALA 40.A O no hydrogen 3.378 N/A LYS 45.A N TYR 41.A O no hydrogen 2.744 N/A LYS 45.A NZ GLN 52.A O no hydrogen 3.423 N/A ARG 46.A N PRO 42.A O no hydrogen 3.213 N/A LEU 47.A N LEU 43.A O no hydrogen 3.095 N/A LEU 48.A N LEU 44.A O no hydrogen 2.677 N/A GLN 52.A N GLN 56.A OE1 no hydrogen 2.730 N/A GLN 52.A NE2 PHE 50.A O no hydrogen 3.373 N/A GLN 56.A N SER 53.A OG no hydrogen 2.990 N/A GLN 56.A NE2 PHE 50.A O no hydrogen 3.672 N/A GLN 56.A NE2 LEU 113.A O no hydrogen 3.027 N/A GLN 56.A NE2 LEU 114.A O no hydrogen 3.022 N/A GLY 57.A N SER 53.A O no hydrogen 3.203 N/A LEU 58.A N TYR 54.A O no hydrogen 2.949 N/A THR 59.A N TYR 55.A O no hydrogen 3.170 N/A THR 59.A OG1 TYR 55.A O no hydrogen 2.868 N/A LEU 60.A N GLN 56.A O no hydrogen 3.119 N/A HIS 61.A N GLY 57.A O no hydrogen 2.900 N/A HIS 61.A ND1 GLY 24.A O no hydrogen 2.872 N/A GLY 62.A N LEU 58.A O no hydrogen 3.090 N/A VAL 63.A N THR 59.A O no hydrogen 2.865 N/A LEU 64.A N LEU 60.A O no hydrogen 2.859 N/A ASN 65.A N HIS 61.A O no hydrogen 2.854 N/A ASN 65.A ND2 SER 25.A OG no hydrogen 3.069 N/A ALA 66.A N GLY 62.A O no hydrogen 2.755 N/A ILE 67.A N GLY 62.A O no hydrogen 3.319 N/A ILE 67.A N VAL 63.A O no hydrogen 3.090 N/A VAL 68.A N VAL 63.A O no hydrogen 2.827 N/A PHE 69.A N LEU 64.A O no hydrogen 3.059 N/A THR 70.A OG1 ALA 66.A O no hydrogen 2.494 N/A THR 70.A OG1 ILE 67.A O no hydrogen 3.430 N/A GLN 71.A N ILE 67.A O no hydrogen 3.316 N/A GLN 71.A NE2 GLN 75.A OE1 no hydrogen 2.999 N/A GLN 71.A NE2 PHE 141.A O no hydrogen 3.400 N/A LEU 72.A N VAL 68.A O no hydrogen 3.033 N/A PHE 73.A N PHE 69.A O no hydrogen 2.912 N/A ALA 74.A N THR 70.A O no hydrogen 2.857 N/A GLN 75.A N GLN 71.A O no hydrogen 2.755 N/A GLN 75.A NE2 SER 144.A OG no hydrogen 3.206 N/A GLN 75.A NE2 SER 148.A OG no hydrogen 3.110 N/A ALA 76.A N LEU 72.A O no hydrogen 2.927 N/A ILE 77.A N PHE 73.A O no hydrogen 2.849 N/A MET 78.A N ALA 74.A O no hydrogen 2.839 N/A TYR 80.A N ALA 76.A O no hydrogen 3.120 N/A TYR 80.A OH ASN 396.A OD1 no hydrogen 2.657 N/A LEU 81.A N ILE 77.A O no hydrogen 3.089 N/A ALA 83.A N VAL 79.A O no hydrogen 3.200 N/A ARG 84.A N TYR 80.A O no hydrogen 2.768 N/A ARG 84.A NH1 ASN 87.A OD1 no hydrogen 3.494 N/A GLU 85.A N LEU 81.A O no hydrogen 2.963 N/A LEU 86.A N PRO 82.A O no hydrogen 3.000 N/A ASN 87.A N ARG 84.A O no hydrogen 3.353 N/A MET 88.A N ALA 83.A O no hydrogen 3.183 N/A ARG 89.A NH1 GLU 2.A O no hydrogen 3.217 N/A ARG 89.A NH1 ALA 3.A O no hydrogen 2.785 N/A LEU 94.A N ASN 91.A OD1 no hydrogen 3.346 N/A MET 95.A N ASN 91.A O no hydrogen 3.019 N/A TRP 96.A N MET 92.A O no hydrogen 3.038 N/A LEU 97.A N GLY 93.A O no hydrogen 3.072 N/A SER 98.A N LEU 94.A O no hydrogen 2.883 N/A SER 98.A OG MET 95.A O no hydrogen 3.130 N/A TRP 99.A N MET 95.A O no hydrogen 3.213 N/A TRP 99.A NE1 TYR 12.A O no hydrogen 2.944 N/A TRP 100.A N TRP 96.A O no hydrogen 2.947 N/A MET 101.A N LEU 97.A O no hydrogen 2.848 N/A ALA 102.A N SER 98.A O no hydrogen 3.058 N/A PHE 103.A N TRP 99.A O no hydrogen 2.876 N/A ILE 104.A N TRP 100.A O no hydrogen 2.858 N/A GLY 105.A N MET 101.A O no hydrogen 2.832 N/A LEU 106.A N ALA 102.A O no hydrogen 2.860 N/A VAL 107.A N PHE 103.A O no hydrogen 2.788 N/A VAL 108.A N ILE 104.A O no hydrogen 2.839 N/A PHE 109.A N GLY 105.A O no hydrogen 2.945 N/A ALA 110.A N LEU 106.A O no hydrogen 2.751 N/A LEU 111.A N VAL 107.A O no hydrogen 3.190 N/A LEU 114.A N ALA 110.A O no hydrogen 2.943 N/A ALA 115.A N LEU 111.A O no hydrogen 3.191 N/A ASN 116.A N LEU 113.A O no hydrogen 3.385 N/A GLU 117.A N PRO 112.A O no hydrogen 2.689 N/A THR 119.A OG1 ASN 116.A OD1 no hydrogen 2.669 N/A VAL 120.A N ALA 118.A O no hydrogen 2.706 N/A LEU 121.A N THR 59.A OG1 no hydrogen 3.021 N/A PHE 124.A N LEU 121.A O no hydrogen 3.061 N/A LEU 128.A N TYR 125.A O no hydrogen 3.088 N/A LYS 129.A N TRP 548.A O no hydrogen 2.919 N/A GLY 130.A N TYR 135.A OH no hydrogen 3.075 N/A HIS 131.A N GLU 117.A O no hydrogen 3.145 N/A ALA 133.A N HIS 131.A ND1 no hydrogen 2.896 N/A PHE 134.A N HIS 131.A O no hydrogen 2.822 N/A LEU 136.A N TRP 132.A O no hydrogen 2.894 N/A GLY 137.A N ALA 133.A O no hydrogen 3.066 N/A ALA 138.A N PHE 134.A O no hydrogen 2.862 N/A SER 139.A N TYR 135.A O no hydrogen 2.998 N/A SER 139.A OG TYR 135.A O no hydrogen 2.903 N/A VAL 140.A N LEU 136.A O no hydrogen 2.934 N/A PHE 141.A N GLY 137.A O no hydrogen 3.177 N/A VAL 142.A N ALA 138.A O no hydrogen 2.880 N/A LEU 143.A N SER 139.A O no hydrogen 2.931 N/A SER 144.A N VAL 140.A O no hydrogen 3.359 N/A SER 144.A N PHE 141.A O no hydrogen 3.234 N/A SER 144.A OG SER 98.A O no hydrogen 2.526 N/A THR 145.A N VAL 142.A O no hydrogen 3.062 N/A THR 145.A OG1 VAL 142.A O no hydrogen 2.512 N/A TRP 146.A N LEU 143.A O no hydrogen 2.666 N/A TRP 146.A NE1 SER 186.A OG no hydrogen 2.995 N/A SER 148.A N SER 144.A O no hydrogen 3.344 N/A SER 148.A OG SER 144.A O no hydrogen 3.553 N/A ILE 149.A N THR 145.A O no hydrogen 2.688 N/A TYR 150.A N TRP 146.A O no hydrogen 2.938 N/A ILE 151.A N VAL 147.A O no hydrogen 3.131 N/A VAL 152.A N SER 148.A O no hydrogen 3.179 N/A LEU 153.A N ILE 149.A O no hydrogen 3.146 N/A ASP 154.A N TYR 150.A O no hydrogen 2.755 N/A LEU 155.A N ILE 151.A O no hydrogen 3.042 N/A TRP 156.A N VAL 152.A O no hydrogen 2.817 N/A TRP 156.A NE1 THR 168.A OG1 no hydrogen 3.175 N/A ARG 157.A N LEU 153.A O no hydrogen 2.898 N/A ARG 158.A N ASP 154.A O no hydrogen 2.922 N/A ARG 158.A NH1 ARG 89.A O no hydrogen 3.220 N/A ARG 158.A NH2 ARG 89.A O no hydrogen 3.193 N/A ARG 158.A NH2 ASP 154.A OD1 no hydrogen 3.277 N/A TRP 159.A N LEU 155.A O no hydrogen 3.050 N/A LYS 160.A N TRP 156.A O no hydrogen 2.978 N/A LYS 160.A NZ LYS 166.A O no hydrogen 2.878 N/A LYS 160.A NZ THR 168.A OG1 no hydrogen 3.319 N/A LYS 160.A NZ ASP 514.A OD1 no hydrogen 2.809 N/A ALA 161.A N ARG 157.A O no hydrogen 2.729 N/A ALA 162.A N ARG 158.A O no hydrogen 3.059 N/A ASN 163.A N LYS 160.A O no hydrogen 3.084 N/A ASN 163.A ND2 TRP 159.A O no hydrogen 3.206 N/A LYS 166.A N ASN 163.A O no hydrogen 3.149 N/A LYS 166.A NZ ASN 163.A OD1 no hydrogen 2.666 N/A THR 168.A N ASP 514.A OD1 no hydrogen 2.895 N/A THR 168.A N ASP 514.A OD2 no hydrogen 3.318 N/A THR 168.A OG1 ASP 514.A OD1 no hydrogen 3.210 N/A THR 168.A OG1 ASP 514.A OD2 no hydrogen 2.612 N/A VAL 171.A N GLU 85.A OE1 no hydrogen 3.339 N/A THR 172.A N GLU 85.A OE2 no hydrogen 2.737 N/A THR 172.A OG1 PRO 82.A O no hydrogen 3.421 N/A THR 172.A OG1 GLU 85.A OE2 no hydrogen 2.808 N/A TYR 173.A N PRO 169.A O no hydrogen 2.786 N/A TYR 173.A OH MET 513.A O no hydrogen 3.186 N/A MET 174.A N LEU 170.A O no hydrogen 3.003 N/A ALA 175.A N VAL 171.A O no hydrogen 2.883 N/A VAL 176.A N THR 172.A O no hydrogen 2.857 N/A VAL 177.A N TYR 173.A O no hydrogen 3.053 N/A PHE 178.A N MET 174.A O no hydrogen 2.882 N/A TRP 179.A N ALA 175.A O no hydrogen 2.993 N/A TRP 179.A NE1 MET 78.A O no hydrogen 2.946 N/A LEU 180.A N VAL 176.A O no hydrogen 2.888 N/A MET 181.A N VAL 177.A O no hydrogen 3.077 N/A TRP 182.A N PHE 178.A O no hydrogen 2.941 N/A TRP 182.A NE1 THR 145.A OG1 no hydrogen 2.689 N/A PHE 183.A N TRP 179.A O no hydrogen 2.819 N/A LEU 184.A N LEU 180.A O no hydrogen 3.357 N/A ALA 185.A N MET 181.A O no hydrogen 2.828 N/A SER 186.A N TRP 182.A O no hydrogen 2.715 N/A SER 186.A OG TRP 182.A O no hydrogen 3.000 N/A SER 186.A OG PHE 183.A O no hydrogen 2.620 N/A LEU 187.A N LEU 184.A O no hydrogen 3.020 N/A LEU 189.A N THR 220.A OG1 no hydrogen 2.605 N/A VAL 190.A N SER 186.A O no hydrogen 3.098 N/A LEU 191.A N LEU 187.A O no hydrogen 2.931 N/A GLU 192.A N GLY 188.A O no hydrogen 2.884 N/A ALA 193.A N LEU 189.A O no hydrogen 2.666 N/A VAL 194.A N VAL 190.A O no hydrogen 2.869 N/A LEU 195.A N LEU 191.A O no hydrogen 2.851 N/A PHE 196.A N GLU 192.A O no hydrogen 3.295 N/A LEU 197.A N GLU 192.A O no hydrogen 2.907 N/A LEU 198.A N ALA 193.A O no hydrogen 2.739 N/A TRP 200.A N PHE 196.A O no hydrogen 3.016 N/A SER 201.A N LEU 197.A O no hydrogen 2.952 N/A SER 201.A OG LEU 197.A O no hydrogen 3.140 N/A SER 201.A OG LEU 198.A O no hydrogen 3.301 N/A PHE 202.A N LEU 198.A O no hydrogen 3.079 N/A GLY 203.A N TRP 200.A O no hydrogen 3.153 N/A VAL 205.A N PRO 199.A O no hydrogen 3.425 N/A VAL 208.A N VAL 545.A O no hydrogen 3.201 N/A LEU 211.A N ASP 209.A OD1 no hydrogen 2.838 N/A VAL 212.A N ASP 209.A OD1 no hydrogen 3.161 N/A ALA 213.A N ASP 209.A O no hydrogen 3.078 N/A ARG 214.A N PRO 210.A O no hydrogen 2.984 N/A ARG 214.A NE ASP 276.A OD1 no hydrogen 2.666 N/A ARG 214.A NH2 ASP 276.A OD1 no hydrogen 3.318 N/A ARG 214.A NH2 ASP 276.A OD2 no hydrogen 2.607 N/A THR 215.A N LEU 211.A O no hydrogen 2.908 N/A THR 215.A OG1 LEU 211.A O no hydrogen 2.556 N/A LEU 216.A N VAL 212.A O no hydrogen 2.943 N/A PHE 217.A N ALA 213.A O no hydrogen 2.717 N/A TRP 218.A N ARG 214.A O no hydrogen 2.959 N/A TRP 218.A NE1 TYR 125.A OH no hydrogen 3.110 N/A TRP 219.A N THR 215.A O no hydrogen 3.143 N/A TRP 219.A NE1 LEU 184.A O no hydrogen 3.001 N/A THR 220.A OG1 ALA 185.A O no hydrogen 2.726 N/A GLY 221.A N PHE 217.A O no hydrogen 2.654 N/A HIS 222.A N TRP 218.A O no hydrogen 3.438 N/A ILE 224.A N THR 220.A O no hydrogen 3.051 N/A ALA 225.A N HIS 222.A O no hydrogen 2.751 N/A PHE 227.A N PRO 223.A O no hydrogen 2.787 N/A TRP 228.A N ILE 224.A O no hydrogen 2.988 N/A LEU 229.A N ALA 225.A O no hydrogen 2.940 N/A LEU 230.A N TYR 226.A O no hydrogen 2.926 N/A TYR 233.A N LEU 229.A O no hydrogen 3.100 N/A TYR 233.A OH SER 298.A OG no hydrogen 2.533 N/A ALA 234.A N LEU 230.A O no hydrogen 2.752 N/A ILE 235.A N PRO 231.A O no hydrogen 3.213 N/A ILE 236.A N ALA 232.A O no hydrogen 2.797 N/A TYR 237.A N TYR 233.A O no hydrogen 2.621 N/A TYR 237.A OH THR 301.A OG1 no hydrogen 2.664 N/A THR 238.A N ALA 234.A O no hydrogen 3.032 N/A THR 238.A OG1 ALA 234.A O no hydrogen 2.724 N/A ILE 239.A N ILE 235.A O no hydrogen 2.903 N/A LEU 240.A N ILE 235.A O no hydrogen 2.814 N/A LYS 242.A N ILE 239.A O no hydrogen 2.953 N/A GLN 243.A N ILE 239.A O no hydrogen 3.313 N/A ALA 244.A N LEU 240.A O no hydrogen 2.805 N/A GLY 245.A N PRO 241.A O no hydrogen 3.123 N/A GLY 245.A N LYS 242.A O no hydrogen 2.750 N/A GLY 246.A N PRO 241.A O no hydrogen 2.733 N/A LEU 248.A N GLU 499.A O no hydrogen 2.927 N/A VAL 249.A N SER 308.A OG no hydrogen 3.022 N/A ARG 255.A N ASP 251.A O no hydrogen 3.117 N/A ARG 255.A NE ASP 251.A OD2 no hydrogen 2.520 N/A ARG 255.A NH1 THR 168.A O no hydrogen 2.910 N/A ARG 255.A NH2 THR 168.A O no hydrogen 2.826 N/A ARG 255.A NH2 ASP 251.A OD1 no hydrogen 3.485 N/A LEU 256.A N PRO 252.A O no hydrogen 2.912 N/A ALA 257.A N MET 253.A O no hydrogen 3.128 N/A PHE 258.A N ALA 254.A O no hydrogen 3.045 N/A LEU 259.A N ARG 255.A O no hydrogen 2.751 N/A LEU 260.A N LEU 256.A O no hydrogen 2.862 N/A PHE 261.A N ALA 257.A O no hydrogen 3.055 N/A LEU 262.A N PHE 258.A O no hydrogen 3.086 N/A LEU 263.A N LEU 259.A O no hydrogen 3.024 N/A LEU 264.A N LEU 260.A O no hydrogen 2.862 N/A SER 265.A N PHE 261.A O no hydrogen 3.181 N/A SER 265.A OG PHE 261.A O no hydrogen 2.708 N/A PHE 270.A N HIS 287.A ND1 no hydrogen 3.096 N/A HIS 271.A N VAL 268.A O no hydrogen 3.135 N/A HIS 271.A ND1 THR 291.A OG1 no hydrogen 2.911 N/A HIS 271.A NE2 HIS 222.A ND1 no hydrogen 2.857 N/A HIS 272.A N GLY 269.A O no hydrogen 3.198 N/A GLN 273.A N PHE 270.A O no hydrogen 2.568 N/A GLN 273.A NE2 THR 215.A OG1 no hydrogen 2.944 N/A ASP 276.A N GLN 273.A O no hydrogen 3.025 N/A THR 282.A N ASP 280.A OD2 no hydrogen 2.762 N/A THR 282.A OG1 ASP 280.A OD2 no hydrogen 3.177 N/A LYS 284.A N ASP 280.A O no hydrogen 3.176 N/A LYS 284.A NZ ASP 276.A O no hydrogen 3.064 N/A LYS 284.A NZ ILE 279.A O no hydrogen 3.179 N/A MET 285.A N PRO 281.A O no hydrogen 2.818 N/A ILE 286.A N THR 282.A O no hydrogen 3.080 N/A HIS 287.A N TRP 283.A O no hydrogen 3.107 N/A HIS 287.A NE2 ALA 530.A O no hydrogen 3.080 N/A SER 288.A N LYS 284.A O no hydrogen 3.065 N/A SER 288.A OG ALA 356.A O no hydrogen 2.941 N/A VAL 289.A N MET 285.A O no hydrogen 2.959 N/A LEU 290.A N ILE 286.A O no hydrogen 2.895 N/A THR 291.A N HIS 287.A O no hydrogen 2.716 N/A THR 291.A OG1 HIS 271.A ND1 no hydrogen 2.911 N/A THR 291.A OG1 HIS 287.A O no hydrogen 2.626 N/A LEU 292.A N SER 288.A O no hydrogen 2.872 N/A PHE 293.A N VAL 289.A O no hydrogen 2.987 N/A VAL 294.A N LEU 290.A O no hydrogen 3.045 N/A ALA 295.A N THR 291.A O no hydrogen 3.315 N/A ALA 295.A N LEU 292.A O no hydrogen 3.376 N/A VAL 296.A N PHE 293.A O no hydrogen 2.739 N/A SER 298.A OG TYR 233.A OH no hydrogen 2.533 N/A LEU 299.A N ALA 295.A O no hydrogen 3.040 N/A MET 300.A N VAL 296.A O no hydrogen 2.655 N/A THR 301.A N PRO 297.A O no hydrogen 2.804 N/A THR 301.A OG1 TYR 237.A OH no hydrogen 2.664 N/A THR 301.A OG1 PRO 297.A O no hydrogen 2.691 N/A ALA 302.A N SER 298.A O no hydrogen 2.744 N/A THR 304.A N MET 300.A O no hydrogen 3.128 N/A THR 304.A OG1 MET 300.A O no hydrogen 3.441 N/A VAL 305.A N THR 301.A O no hydrogen 2.896 N/A ALA 306.A N ALA 302.A O no hydrogen 2.989 N/A ALA 307.A N PHE 303.A O no hydrogen 2.736 N/A SER 308.A N THR 304.A O no hydrogen 2.900 N/A SER 308.A OG LYS 247.A O no hydrogen 3.235 N/A SER 308.A OG THR 304.A O no hydrogen 3.209 N/A LEU 309.A N VAL 305.A O no hydrogen 2.922 N/A LEU 309.A N ALA 306.A O no hydrogen 3.127 N/A GLU 310.A N ALA 306.A O no hydrogen 2.916 N/A PHE 311.A N ALA 307.A O no hydrogen 2.842 N/A ALA 312.A N SER 308.A O no hydrogen 3.032 N/A GLY 313.A N LEU 309.A O no hydrogen 2.860 N/A ARG 314.A N GLU 310.A O no hydrogen 2.838 N/A ARG 314.A NE GLU 310.A OE1 no hydrogen 3.321 N/A ARG 314.A NH1 GLU 310.A OE1 no hydrogen 2.903 N/A ARG 314.A NH1 GLY 320.A O no hydrogen 2.709 N/A ARG 314.A NH2 GLY 318.A O no hydrogen 3.343 N/A ARG 314.A NH2 GLY 320.A O no hydrogen 3.187 N/A LEU 315.A N PHE 311.A O no hydrogen 2.971 N/A ARG 316.A N ALA 312.A O no hydrogen 3.027 N/A ARG 316.A NE ALA 327.A O no hydrogen 2.518 N/A ARG 316.A NH1 ALA 327.A O no hydrogen 3.219 N/A GLY 317.A N ARG 314.A O no hydrogen 3.022 N/A GLY 318.A N GLY 313.A O no hydrogen 2.921 N/A TRP 324.A NE1 LEU 321.A O no hydrogen 2.725 N/A ILE 325.A N PHE 322.A O no hydrogen 3.273 N/A LEU 328.A N ILE 325.A O no hydrogen 3.265 N/A TRP 330.A N LEU 328.A O no hydrogen 2.770 N/A TRP 330.A NE1 ILE 325.A O no hydrogen 2.766 N/A ASN 332.A N PRO 329.A O no hydrogen 2.907 N/A ALA 334.A N ASN 332.A OD1 no hydrogen 3.002 N/A PHE 335.A N ASN 332.A O no hydrogen 3.000 N/A VAL 336.A N ASN 332.A O no hydrogen 2.956 N/A ALA 337.A N PRO 333.A O no hydrogen 3.011 N/A VAL 339.A N PHE 335.A O no hydrogen 3.440 N/A LEU 340.A N VAL 336.A O no hydrogen 2.950 N/A GLY 341.A N ALA 337.A O no hydrogen 3.106 N/A LEU 342.A N PRO 338.A O no hydrogen 2.799 N/A LEU 343.A N VAL 339.A O no hydrogen 3.029 N/A GLY 344.A N LEU 340.A O no hydrogen 3.265 N/A PHE 345.A N GLY 341.A O no hydrogen 3.187 N/A PHE 345.A N LEU 342.A O no hydrogen 3.221 N/A ILE 346.A N LEU 343.A O no hydrogen 3.274 N/A GLY 348.A N GLY 344.A O no hydrogen 3.144 N/A GLY 349.A N PHE 345.A O no hydrogen 2.721 N/A ALA 350.A N ILE 346.A O no hydrogen 3.044 N/A GLY 351.A N PRO 347.A O no hydrogen 2.948 N/A GLY 352.A N GLY 348.A O no hydrogen 3.075 N/A ILE 353.A N GLY 349.A O no hydrogen 2.809 N/A VAL 354.A N ALA 350.A O no hydrogen 3.298 N/A ASN 355.A N GLY 351.A O no hydrogen 2.953 N/A ALA 356.A N GLY 352.A O no hydrogen 3.069 N/A SER 357.A N VAL 354.A O no hydrogen 2.903 N/A SER 357.A OG ILE 353.A O no hydrogen 3.036 N/A SER 357.A OG VAL 354.A O no hydrogen 3.546 N/A PHE 358.A N ALA 356.A O no hydrogen 2.755 N/A LEU 360.A N SER 357.A O no hydrogen 3.153 N/A ASP 361.A N PHE 358.A O no hydrogen 2.966 N/A TYR 362.A N THR 359.A O no hydrogen 3.149 N/A TYR 362.A OH PHE 274.A O no hydrogen 2.612 N/A VAL 363.A N LEU 360.A O no hydrogen 3.249 N/A VAL 364.A N ASP 361.A O no hydrogen 3.103 N/A HIS 365.A N ASP 361.A O no hydrogen 2.575 N/A THR 367.A N VAL 364.A O no hydrogen 3.079 N/A THR 367.A OG1 VAL 364.A O no hydrogen 2.644 N/A ALA 368.A N VAL 436.A O no hydrogen 2.759 N/A TRP 369.A N THR 367.A OG1 no hydrogen 3.378 N/A TRP 369.A NE1 ASN 355.A OD1 no hydrogen 2.997 N/A VAL 370.A N THR 367.A O no hydrogen 3.198 N/A GLY 372.A N ALA 368.A O no hydrogen 3.051 N/A HIS 373.A N TRP 369.A O no hydrogen 2.769 N/A HIS 373.A ND1 GLY 348.A O no hydrogen 2.916 N/A PHE 374.A N VAL 370.A O no hydrogen 2.941 N/A HIS 375.A N PRO 371.A O no hydrogen 3.064 N/A HIS 375.A ND1 PRO 371.A O no hydrogen 2.640 N/A VAL 378.A N PHE 374.A O no hydrogen 2.792 N/A LEU 381.A N LEU 376.A O no hydrogen 3.398 N/A VAL 382.A N GLN 377.A O no hydrogen 3.375 N/A THR 383.A N VAL 378.A O no hydrogen 3.084 N/A THR 383.A OG1 VAL 378.A O no hydrogen 2.860 N/A LEU 384.A N SER 380.A O no hydrogen 2.798 N/A THR 385.A N LEU 381.A O no hydrogen 3.035 N/A THR 385.A OG1 LEU 381.A O no hydrogen 2.691 N/A ALA 386.A N VAL 382.A O no hydrogen 2.939 N/A MET 387.A N THR 383.A O no hydrogen 2.778 N/A GLY 388.A N LEU 384.A O no hydrogen 2.802 N/A SER 389.A N THR 385.A O no hydrogen 3.205 N/A SER 389.A N ALA 386.A O no hydrogen 3.226 N/A SER 389.A OG ALA 386.A O no hydrogen 2.641 N/A TYR 391.A N GLY 388.A O no hydrogen 3.343 N/A TRP 392.A N SER 389.A O no hydrogen 2.819 N/A LEU 393.A N SER 389.A O no hydrogen 2.598 N/A LEU 394.A N LEU 390.A O no hydrogen 3.346 N/A ASN 396.A N TRP 392.A O no hydrogen 3.402 N/A ASN 396.A ND2 ALA 493.A O no hydrogen 3.149 N/A LEU 397.A N LEU 393.A O no hydrogen 2.822 N/A LEU 397.A N LEU 394.A O no hydrogen 3.137 N/A THR 398.A N LEU 394.A O no hydrogen 2.789 N/A THR 398.A OG1 LEU 394.A O no hydrogen 2.992 N/A GLY 399.A N PRO 395.A O no hydrogen 2.808 N/A LYS 400.A N THR 398.A OG1 no hydrogen 3.022 N/A LYS 400.A NZ LEU 481.A O no hydrogen 3.074 N/A SER 403.A N GLN 406.A OE1 no hydrogen 3.000 N/A GLN 406.A N SER 403.A OG no hydrogen 3.047 N/A GLN 406.A NE2 SER 479.A OG no hydrogen 3.168 N/A ARG 407.A N SER 403.A O no hydrogen 3.051 N/A ARG 407.A NE ASP 404.A OD2 no hydrogen 3.387 N/A ARG 407.A NH1 ASP 404.A OD2 no hydrogen 2.673 N/A ARG 407.A NH2 ASP 331.A O no hydrogen 2.828 N/A ARG 408.A N ASP 404.A O no hydrogen 3.078 N/A ARG 408.A NE ASP 404.A OD1 no hydrogen 2.773 N/A ARG 408.A NE ASP 404.A OD2 no hydrogen 3.252 N/A ARG 408.A NH2 ASP 404.A OD1 no hydrogen 3.176 N/A ARG 408.A NH2 ASP 404.A OD2 no hydrogen 3.158 N/A LEU 409.A N ALA 405.A O no hydrogen 3.011 N/A GLY 410.A N GLN 406.A O no hydrogen 3.040 N/A LEU 411.A N ARG 407.A O no hydrogen 2.966 N/A ALA 412.A N ARG 408.A O no hydrogen 3.174 N/A VAL 413.A N LEU 409.A O no hydrogen 2.921 N/A VAL 414.A N GLY 410.A O no hydrogen 3.108 N/A TRP 415.A N LEU 411.A O no hydrogen 2.867 N/A LEU 416.A N ALA 412.A O no hydrogen 2.851 N/A TRP 417.A N VAL 413.A O no hydrogen 2.886 N/A TRP 417.A NE1 ALA 379.A O no hydrogen 2.907 N/A PHE 418.A N VAL 414.A O no hydrogen 2.936 N/A LEU 419.A N TRP 415.A O no hydrogen 2.901 N/A GLY 420.A N LEU 416.A O no hydrogen 2.844 N/A MET 421.A N TRP 417.A O no hydrogen 2.907 N/A MET 422.A N PHE 418.A O no hydrogen 2.905 N/A ILE 423.A N LEU 419.A O no hydrogen 2.800 N/A MET 424.A N GLY 420.A O no hydrogen 2.742 N/A ALA 425.A N MET 421.A O no hydrogen 2.772 N/A VAL 426.A N MET 422.A O no hydrogen 3.028 N/A GLY 427.A N ILE 423.A O no hydrogen 3.144 N/A LEU 428.A N MET 424.A O no hydrogen 2.825 N/A HIS 429.A N ALA 425.A O no hydrogen 3.104 N/A HIS 429.A ND1 ALA 425.A O no hydrogen 2.582 N/A TRP 430.A N VAL 426.A O no hydrogen 3.141 N/A ALA 431.A N GLY 427.A O no hydrogen 3.067 N/A GLY 432.A N LEU 428.A O no hydrogen 2.683 N/A LEU 433.A N HIS 429.A O no hydrogen 2.843 N/A LEU 434.A N ALA 431.A O no hydrogen 2.833 N/A ASN 435.A N GLY 432.A O no hydrogen 3.075 N/A VAL 436.A N ALA 431.A O no hydrogen 3.062 N/A ARG 438.A N ASN 366.A O no hydrogen 2.972 N/A ARG 439.A NH1 THR 123.A OG1 no hydrogen 2.815 N/A ARG 439.A NH2 THR 123.A OG1 no hydrogen 3.124 N/A ALA 440.A N TYR 35.A OH no hydrogen 2.946 N/A TYR 441.A N TYR 55.A OH no hydrogen 3.054 N/A TYR 441.A OH ASP 39.A OD1 no hydrogen 3.017 N/A TYR 441.A OH ASP 39.A OD2 no hydrogen 2.538 N/A ILE 442.A N ALA 440.A O no hydrogen 2.772 N/A ALA 443.A N ASN 34.A OD1 no hydrogen 2.805 N/A GLN 444.A N TYR 441.A O no hydrogen 3.119 N/A VAL 445.A N ILE 442.A O no hydrogen 3.165 N/A ALA 448.A N VAL 445.A O no hydrogen 2.931 N/A ALA 452.A N TYR 449.A O no hydrogen 3.314 N/A ALA 453.A N PRO 450.A O no hydrogen 3.248 N/A MET 456.A N ALA 452.A O no hydrogen 3.006 N/A VAL 457.A N VAL 454.A O no hydrogen 2.950 N/A ASN 459.A N PRO 455.A O no hydrogen 2.993 N/A ASN 459.A ND2 TYR 35.A O no hydrogen 2.478 N/A VAL 460.A N MET 456.A O no hydrogen 2.989 N/A LEU 461.A N VAL 457.A O no hydrogen 3.002 N/A ALA 462.A N PHE 458.A O no hydrogen 2.739 N/A GLY 463.A N ASN 459.A O no hydrogen 2.855 N/A ILE 464.A N VAL 460.A O no hydrogen 3.050 N/A VAL 465.A N LEU 461.A O no hydrogen 2.866 N/A LEU 466.A N ALA 462.A O no hydrogen 2.834 N/A LEU 467.A N GLY 463.A O no hydrogen 2.973 N/A VAL 468.A N ILE 464.A O no hydrogen 3.012 N/A ALA 469.A N VAL 465.A O no hydrogen 3.073 N/A LEU 470.A N LEU 466.A O no hydrogen 2.914 N/A LEU 471.A N LEU 467.A O no hydrogen 2.862 N/A LEU 472.A N VAL 468.A O no hydrogen 2.851 N/A PHE 473.A N ALA 469.A O no hydrogen 2.769 N/A ILE 474.A N LEU 470.A O no hydrogen 2.882 N/A TYR 475.A N LEU 471.A O no hydrogen 3.048 N/A GLY 476.A N LEU 472.A O no hydrogen 2.827 N/A LEU 477.A N PHE 473.A O no hydrogen 2.829 N/A PHE 478.A N ILE 474.A O no hydrogen 3.185 N/A SER 479.A N TYR 475.A O no hydrogen 2.987 N/A VAL 480.A N GLY 476.A O no hydrogen 3.387 N/A LEU 481.A N LEU 477.A O no hydrogen 2.841 N/A LEU 482.A N PHE 478.A O no hydrogen 2.827 N/A ARG 486.A NH1 THR 398.A O no hydrogen 3.218 N/A LYS 487.A N GLY 399.A O no hydrogen 2.791 N/A LEU 490.A N LYS 487.A O no hydrogen 3.131 N/A GLU 492.A N PRO 488.A O no hydrogen 3.221 N/A PHE 497.A N LEU 495.A O no hydrogen 2.549 N/A ALA 498.A N THR 238.A O no hydrogen 2.824 N/A ILE 501.A N LEU 248.A O no hydrogen 2.925 N/A LEU 509.A N ASP 506.A OD1 no hydrogen 2.729 N/A LEU 511.A N ARG 507.A O no hydrogen 3.055 N/A ALA 512.A N ARG 508.A O no hydrogen 2.992 N/A MET 513.A N LEU 509.A O no hydrogen 2.689 N/A ASP 514.A N VAL 510.A O no hydrogen 2.910 N/A ARG 515.A N ALA 512.A O no hydrogen 2.924 N/A ILE 516.A N ASP 514.A O no hydrogen 2.722 N/A TRP 519.A N ARG 515.A O no hydrogen 3.381 N/A TRP 519.A NE1 ALA 512.A O no hydrogen 3.200 N/A PHE 520.A N ILE 516.A O no hydrogen 2.738 N/A ALA 521.A N GLY 517.A O no hydrogen 2.956 N/A VAL 522.A N PHE 518.A O no hydrogen 3.049 N/A ALA 523.A N TRP 519.A O no hydrogen 2.981 N/A ALA 524.A N PHE 520.A O no hydrogen 3.017 N/A ILE 525.A N ALA 521.A O no hydrogen 2.841 N/A LEU 526.A N VAL 522.A O no hydrogen 2.942 N/A VAL 527.A N ALA 523.A O no hydrogen 3.200 N/A VAL 528.A N ALA 524.A O no hydrogen 2.991 N/A LEU 529.A N ILE 525.A O no hydrogen 2.683 N/A ALA 530.A N LEU 526.A O no hydrogen 2.893 N/A TYR 531.A N VAL 527.A O no hydrogen 2.869 N/A GLY 532.A N VAL 528.A O no hydrogen 2.734 N/A LEU 535.A N TYR 531.A O no hydrogen 2.988 N/A VAL 536.A N GLY 532.A O no hydrogen 2.915 N/A GLN 537.A N PRO 533.A O no hydrogen 3.042 N/A LEU 538.A N THR 534.A O no hydrogen 3.088 N/A PHE 539.A N LEU 535.A O no hydrogen 2.978 N/A GLY 540.A N VAL 536.A O no hydrogen 3.100 N/A HIS 541.A N LEU 538.A O no hydrogen 3.389 N/A HIS 541.A ND1 GLN 537.A O no hydrogen 3.195 N/A ASN 543.A N ASP 209.A OD2 no hydrogen 2.788 N/A VAL 545.A N VAL 208.A O no hydrogen 3.252 N/A TRP 548.A N PRO 127.A O no hydrogen 2.621 N/A ARG 549.A NE TRP 551.A OXT no hydrogen 3.084 N/A ARG 549.A NH1 ASN 116.A O no hydrogen 3.120 N/A ARG 549.A NH2 GLU 117.A OE2 no hydrogen 3.448 N/A TRP 551.A NE1 ASN 116.A O no hydrogen 3.056 N/A