Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3c2h_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 6.A N ASN 2.A O no hydrogen 2.649 N/A ALA 7.A N ILE 3.A O no hydrogen 2.968 N/A GLU 8.A N THR 4.A O no hydrogen 2.891 N/A GLN 9.A N GLN 5.A O no hydrogen 2.990 N/A ALA 10.A N ALA 6.A O no hydrogen 3.217 N/A ILE 11.A N ALA 7.A O no hydrogen 2.891 N/A ARG 12.A N GLU 8.A O no hydrogen 3.054 N/A LEU 13.A N GLN 9.A O no hydrogen 2.699 N/A TRP 14.A N ALA 10.A O no hydrogen 3.008 N/A TRP 14.A NE1 ASP 60.A OD2 no hydrogen 2.563 N/A ASN 16.A N LEU 13.A O no hydrogen 2.974 N/A THR 17.A N LEU 13.A O no hydrogen 2.960 N/A THR 17.A N TRP 14.A O no hydrogen 3.377 N/A THR 17.A OG1 LEU 13.A O no hydrogen 2.659 N/A GLN 22.A N ASP 19.A O no hydrogen 3.139 N/A ARG 23.A N ASP 19.A O no hydrogen 2.966 N/A ARG 23.A NE THR 17.A O no hydrogen 3.205 N/A LEU 24.A N PRO 20.A O no hydrogen 3.199 N/A HIS 25.A N MET 21.A O no hydrogen 3.351 N/A MET 26.A N GLN 22.A O no hydrogen 2.721 N/A ALA 27.A N ARG 23.A O no hydrogen 2.665 N/A LYS 28.A N LEU 24.A O no hydrogen 2.934 N/A THR 29.A N HIS 25.A O no hydrogen 3.257 N/A THR 29.A N MET 26.A O no hydrogen 3.198 N/A THR 29.A OG1 HIS 25.A O no hydrogen 2.511 N/A THR 29.A OG1 MET 26.A O no hydrogen 3.042 N/A ILE 30.A N MET 26.A O no hydrogen 3.223 N/A ARG 31.A N ALA 27.A O no hydrogen 3.104 N/A ARG 31.A NE ASP 83.A OD2 no hydrogen 2.848 N/A ARG 31.A NH1 ASN 80.A OD1 no hydrogen 3.190 N/A ARG 31.A NH2 ASP 83.A OD2 no hydrogen 3.543 N/A THR 32.A N LYS 28.A O no hydrogen 3.105 N/A THR 32.A OG1 LYS 28.A O no hydrogen 2.778 N/A THR 32.A OG1 THR 29.A O no hydrogen 2.957 N/A TRP 33.A N THR 29.A O no hydrogen 2.952 N/A ILE 34.A N ILE 30.A O no hydrogen 3.128 N/A ARG 35.A N ARG 31.A O no hydrogen 2.755 N/A GLN 36.A N THR 32.A O no hydrogen 3.065 N/A ASP 37.A N TRP 33.A O no hydrogen 2.907 N/A LYS 38.A N ILE 34.A O no hydrogen 3.037 N/A ALA 40.A N ASP 37.A O no hydrogen 3.481 N/A VAL 42.A N PHE 39.A O no hydrogen 3.118 N/A ASN 46.A N ASP 43.A O no hydrogen 2.962 N/A MET 47.A N GLN 44.A O no hydrogen 3.280 N/A CYS 50.A N ASN 46.A O no hydrogen 2.920 N/A VAL 51.A N MET 47.A O no hydrogen 2.883 N/A GLN 52.A N PRO 48.A O no hydrogen 3.006 N/A GLN 52.A NE2 ASN 56.A OD1 no hydrogen 2.968 N/A GLN 53.A N ASN 49.A O no hydrogen 2.970 N/A ILE 54.A N CYS 50.A O no hydrogen 3.376 N/A LEU 55.A N VAL 51.A O no hydrogen 2.977 N/A ASN 56.A N GLN 52.A O no hydrogen 3.086 N/A ILE 57.A N GLN 53.A O no hydrogen 3.037 N/A ILE 58.A N ILE 54.A O no hydrogen 2.838 N/A TYR 59.A N LEU 55.A O no hydrogen 2.856 N/A TYR 59.A OH GLN 113.A O no hydrogen 2.679 N/A ASP 60.A N ASN 56.A O no hydrogen 2.866 N/A GLY 61.A N ILE 57.A O no hydrogen 2.579 N/A LEU 62.A N ILE 58.A O no hydrogen 3.061 N/A LEU 62.A N TYR 59.A O no hydrogen 3.294 N/A LYS 63.A N ASP 60.A O no hydrogen 3.244 N/A GLN 65.A NE2 TYR 73.A OH no hydrogen 3.219 N/A TYR 73.A N PRO 70.A O no hydrogen 2.741 N/A TYR 73.A OH PRO 20.A O no hydrogen 2.785 N/A ALA 75.A N ILE 71.A O no hydrogen 3.099 N/A GLN 76.A N TYR 73.A O no hydrogen 3.048 N/A LEU 77.A N TYR 73.A O no hydrogen 3.013 N/A TRP 78.A N TYR 74.A O no hydrogen 2.691 N/A TRP 78.A NE1 GLY 61.A O no hydrogen 2.911 N/A TYR 79.A N ALA 75.A O no hydrogen 3.065 N/A ASN 80.A N GLN 76.A O no hydrogen 3.414 N/A LEU 81.A N LEU 77.A O no hydrogen 3.100 N/A LEU 82.A N TRP 78.A O no hydrogen 2.701 N/A ASP 83.A N TYR 79.A O no hydrogen 3.063 N/A ILE 84.A N ASN 80.A O no hydrogen 3.153 N/A LEU 85.A N LEU 81.A O no hydrogen 3.055 N/A ARG 86.A N LEU 82.A O no hydrogen 2.822 N/A ARG 86.A NE ASP 83.A OD1 no hydrogen 3.408 N/A ARG 86.A NH2 ASP 83.A OD1 no hydrogen 2.767 N/A ARG 87.A N ASP 83.A O no hydrogen 3.043 N/A ARG 87.A NH1 ASP 83.A OD2 no hydrogen 2.402 N/A PHE 88.A N ILE 84.A O no hydrogen 2.820 N/A THR 89.A N ARG 86.A O no hydrogen 2.904 N/A THR 89.A OG1 ARG 86.A O no hydrogen 2.537 N/A PHE 90.A N ARG 87.A O no hydrogen 3.214 N/A LEU 91.A N ARG 87.A O no hydrogen 3.040 N/A ILE 94.A N LEU 91.A O no hydrogen 2.820 N/A SER 95.A N PRO 92.A O no hydrogen 3.340 N/A SER 95.A OG PRO 92.A O no hydrogen 3.028 N/A TYR 97.A N ILE 94.A O no hydrogen 2.702 N/A ILE 98.A N SER 95.A O no hydrogen 3.212 N/A GLN 100.A N TYR 97.A O no hydrogen 2.821 N/A GLN 100.A NE2 PRO 48.A O no hydrogen 2.811 N/A GLN 100.A NE2 GLN 52.A OE1 no hydrogen 2.715 N/A VAL 102.A N ILE 98.A O no hydrogen 3.056 N/A GLN 103.A N HIS 99.A O no hydrogen 2.848 N/A MET 104.A N VAL 101.A O no hydrogen 3.121 N/A PHE 105.A N VAL 102.A O no hydrogen 2.898 N/A CYS 106.A N GLN 103.A O no hydrogen 3.129 N/A CYS 106.A SG PRO 107.A O no hydrogen 3.681 N/A ARG 108.A N ASP 114.A OD1 no hydrogen 2.633 N/A GLU 109.A N ASP 114.A OD1 no hydrogen 2.942 N/A GLY 111.A N ASP 114.A OD2 no hydrogen 2.739 N/A ASP 114.A N GLY 111.A O no hydrogen 3.200 N/A ARG 116.A NH1 HIS 163.A O no hydrogen 2.870 N/A LEU 118.A N ASP 114.A O no hydrogen 3.232 N/A LEU 118.A N PHE 115.A O no hydrogen 2.983 N/A ILE 119.A N PHE 115.A O no hydrogen 2.897 N/A CYS 120.A N ARG 116.A O no hydrogen 2.712 N/A CYS 120.A SG LYS 168.A O no hydrogen 3.513 N/A CYS 120.A SG THR 172.A OG1 no hydrogen 3.455 N/A ASN 121.A N GLU 117.A O no hydrogen 3.123 N/A LEU 122.A N ILE 119.A O no hydrogen 3.166 N/A ILE 123.A N CYS 120.A O no hydrogen 3.228 N/A SER 124.A N ASN 121.A O no hydrogen 3.266 N/A SER 124.A OG ASN 126.A OD1 no hydrogen 3.301 N/A TRP 127.A N SER 124.A O no hydrogen 3.219 N/A GLN 128.A N LEU 125.A O no hydrogen 2.768 N/A LYS 129.A N ASN 126.A O no hydrogen 3.228 N/A ASP 130.A N TRP 127.A O no hydrogen 3.242 N/A HIS 132.A N ASP 130.A OD2 no hydrogen 2.869 N/A MET 133.A N ASP 130.A OD2 no hydrogen 2.868 N/A LYS 134.A N ASP 130.A O no hydrogen 3.240 N/A LYS 134.A NZ GLN 128.A O no hydrogen 3.423 N/A CYS 136.A N MET 133.A O no hydrogen 3.094 N/A CYS 136.A SG ALA 75.A O no hydrogen 3.437 N/A ALA 137.A N MET 133.A O no hydrogen 3.321 N/A ASN 138.A N LYS 134.A O no hydrogen 3.164 N/A GLN 139.A N HIS 135.A O no hydrogen 3.305 N/A GLN 139.A N CYS 136.A O no hydrogen 3.109 N/A VAL 140.A N CYS 136.A O no hydrogen 2.946 N/A PHE 141.A N ALA 137.A O no hydrogen 3.045 N/A GLN 142.A N ASN 138.A O no hydrogen 3.252 N/A GLN 142.A NE2 ASN 138.A O no hydrogen 3.120 N/A ILE 143.A N GLN 139.A O no hydrogen 2.957 N/A PHE 144.A N VAL 140.A O no hydrogen 2.968 N/A ASN 145.A N PHE 141.A O no hydrogen 3.005 N/A CYS 146.A N ILE 143.A O no hydrogen 2.997 N/A CYS 146.A SG GLN 142.A O no hydrogen 3.225 N/A ILE 147.A N ILE 143.A O no hydrogen 2.960 N/A ILE 148.A N PHE 144.A O no hydrogen 2.827 N/A MET 149.A N ASN 145.A O no hydrogen 3.204 N/A GLY 150.A N ILE 147.A O no hydrogen 3.005 N/A VAL 151.A N ILE 147.A O no hydrogen 2.992 N/A LEU 156.A N ASN 153.A O no hydrogen 2.934 N/A LEU 156.A N ASN 153.A OD1 no hydrogen 2.910 N/A ARG 157.A N ASN 153.A O no hydrogen 3.047 N/A ARG 157.A NE VAL 151.A O no hydrogen 3.044 N/A THR 158.A N GLU 154.A O no hydrogen 3.144 N/A THR 158.A OG1 GLU 154.A O no hydrogen 3.050 N/A GLU 159.A N LYS 155.A O no hydrogen 3.277 N/A PHE 160.A N LEU 156.A O no hydrogen 2.886 N/A ALA 161.A N ARG 157.A O no hydrogen 2.949 N/A GLN 162.A N THR 158.A O no hydrogen 2.993 N/A HIS 163.A N GLU 159.A O no hydrogen 2.926 N/A LEU 164.A N PHE 160.A O no hydrogen 3.075 N/A LEU 164.A N ALA 161.A O no hydrogen 3.247 N/A LYS 165.A N GLN 162.A O no hydrogen 3.206 N/A LYS 165.A NZ ILE 197.A O no hydrogen 3.015 N/A LYS 165.A NZ ASP 201.A OD1 no hydrogen 3.241 N/A PHE 166.A N LEU 164.A O no hydrogen 2.902 N/A LEU 169.A N PHE 166.A O no hydrogen 3.162 N/A VAL 170.A N PHE 166.A O no hydrogen 3.369 N/A GLY 171.A N GLU 167.A O no hydrogen 2.908 N/A THR 172.A N LYS 168.A O no hydrogen 2.947 N/A THR 172.A OG1 LYS 168.A O no hydrogen 2.983 N/A LEU 173.A N LEU 169.A O no hydrogen 2.920 N/A SER 174.A N VAL 170.A O no hydrogen 3.106 N/A SER 174.A OG VAL 170.A O no hydrogen 2.680 N/A GLU 175.A N GLY 171.A O no hydrogen 3.188 N/A TYR 176.A N LEU 173.A O no hydrogen 3.085 N/A TYR 176.A OH ILE 123.A O no hydrogen 2.728 N/A PHE 177.A N SER 174.A O no hydrogen 2.721 N/A ASN 178.A N GLU 175.A O no hydrogen 3.443 N/A VAL 181.A N ASN 178.A O no hydrogen 3.139 N/A GLY 184.A N HIS 182.A ND1 no hydrogen 2.849 N/A MET 185.A N HIS 182.A O no hydrogen 2.945 N/A ILE 186.A N PRO 183.A O no hydrogen 3.217 N/A ALA 189.A N ASN 187.A OD1 no hydrogen 2.812 N/A ILE 190.A N ASN 187.A O no hydrogen 3.012 N/A PHE 191.A N PRO 188.A O no hydrogen 3.259 N/A ILE 193.A N ALA 189.A O no hydrogen 2.889 N/A PHE 194.A N ILE 190.A O no hydrogen 3.036 N/A ARG 195.A N PHE 191.A O no hydrogen 2.896 N/A PHE 196.A N ILE 192.A O no hydrogen 3.149 N/A ILE 197.A N ILE 193.A O no hydrogen 2.934 N/A ILE 198.A N PHE 194.A O no hydrogen 3.162 N/A SER 199.A N ARG 195.A O no hydrogen 3.125 N/A ASP 201.A N ILE 198.A O no hydrogen 2.783 N/A LEU 204.A N ASP 201.A O no hydrogen 3.229 N/A LEU 204.A N ASP 201.A OD2 no hydrogen 2.968 N/A LYS 205.A N ASP 201.A O no hydrogen 3.233 N/A LYS 205.A NZ LEU 269.A O no hydrogen 3.145 N/A ASP 206.A N THR 202.A O no hydrogen 2.978 N/A TYR 207.A N ARG 203.A O no hydrogen 2.963 N/A PHE 208.A N LEU 204.A O no hydrogen 2.863 N/A ILE 209.A N LYS 205.A O no hydrogen 3.041 N/A TRP 210.A N ASP 206.A O no hydrogen 2.951 N/A ASN 211.A N TYR 207.A O no hydrogen 2.873 N/A ASN 213.A N TRP 210.A O no hydrogen 2.982 N/A ASN 213.A ND2 TRP 210.A O no hydrogen 3.216 N/A ASN 213.A ND2 ASN 211.A O no hydrogen 3.220 N/A GLN 217.A N PRO 214.A O no hydrogen 3.216 N/A GLY 223.A N PRO 220.A O no hydrogen 2.767 N/A LEU 224.A N PHE 208.A O no hydrogen 2.818 N/A LYS 227.A N GLY 223.A O no hydrogen 3.377 N/A LYS 227.A NZ ASN 178.A OD1 no hydrogen 3.438 N/A LYS 227.A NZ THR 222.A O no hydrogen 3.276 N/A LEU 228.A N LEU 224.A O no hydrogen 2.668 N/A ASN 229.A N ILE 225.A O no hydrogen 3.278 N/A ALA 230.A N ILE 226.A O no hydrogen 3.242 N/A VAL 231.A N LYS 227.A O no hydrogen 3.067 N/A MET 232.A N LEU 228.A O no hydrogen 2.929 N/A ILE 233.A N ASN 229.A O no hydrogen 3.126 N/A GLY 234.A N ALA 230.A O no hydrogen 2.774 N/A SER 235.A N VAL 231.A O no hydrogen 2.908 N/A SER 235.A OG VAL 231.A O no hydrogen 2.757 N/A TYR 236.A N MET 232.A O no hydrogen 2.901 N/A ARG 237.A N ILE 233.A O no hydrogen 2.825 N/A LEU 238.A N SER 235.A O no hydrogen 3.046 N/A ILE 239.A N SER 235.A O no hydrogen 3.152 N/A ILE 239.A N TYR 236.A O no hydrogen 3.225 N/A GLN 242.A N ILE 239.A O no hydrogen 2.839 N/A GLU 245.A N ASN 243.A OD1 no hydrogen 3.088 N/A THR 246.A N ASN 243.A O no hydrogen 3.103 N/A THR 246.A OG1 ASN 243.A O no hydrogen 2.825 N/A LEU 247.A N PRO 244.A O no hydrogen 3.256 N/A GLN 249.A N THR 246.A O no hydrogen 2.960 N/A ASN 250.A N LEU 247.A O no hydrogen 2.883 N/A ASN 250.A ND2 THR 246.A OG1 no hydrogen 2.898 N/A LEU 253.A N ASN 250.A OD1 no hydrogen 3.187 N/A ALA 254.A N ASN 250.A O no hydrogen 2.981 N/A HIS 255.A N PRO 251.A O no hydrogen 2.828 N/A HIS 255.A NE2 ILE 186.A O no hydrogen 3.037 N/A LEU 256.A N GLU 252.A O no hydrogen 3.073 N/A ILE 257.A N LEU 253.A O no hydrogen 3.008 N/A GLN 258.A N ALA 254.A O no hydrogen 3.131 N/A VAL 259.A N HIS 255.A O no hydrogen 2.882 N/A ILE 260.A N LEU 256.A O no hydrogen 2.987 N/A ILE 261.A N ILE 257.A O no hydrogen 3.019 N/A ARG 262.A N GLN 258.A O no hydrogen 2.903 N/A THR 263.A N VAL 259.A O no hydrogen 2.862 N/A THR 263.A OG1 VAL 259.A O no hydrogen 2.791 N/A PHE 264.A N ILE 260.A O no hydrogen 2.885 N/A ASP 265.A N ILE 261.A O no hydrogen 2.966 N/A LEU 266.A N ARG 262.A O no hydrogen 2.910 N/A LEU 267.A N THR 263.A O no hydrogen 2.983 N/A GLY 268.A N PHE 264.A O no hydrogen 2.851 N/A LEU 269.A N ASP 265.A O no hydrogen 3.096 N/A LEU 270.A N LEU 266.A O no hydrogen 2.794 N/A LEU 271.A N LEU 267.A O no hydrogen 2.971 N/A HIS 272.A NE2 ASP 206.A OD1 no hydrogen 2.570 N/A ALA 276.A N ASP 273.A OD1 no hydrogen 3.105 N/A ILE 277.A N ASP 273.A O no hydrogen 2.892 N/A ASP 278.A N SER 274.A O no hydrogen 2.803 N/A GLY 279.A N ASP 275.A O no hydrogen 2.927 N/A PHE 280.A N ALA 276.A O no hydrogen 3.066 N/A VAL 281.A N ILE 277.A O no hydrogen 3.085 N/A ARG 282.A N ASP 278.A O no hydrogen 2.860 N/A ARG 282.A NH2 HIS 215.A O no hydrogen 3.530 N/A ARG 282.A NH2 GLN 217.A O no hydrogen 2.755 N/A SER 283.A N GLY 279.A O no hydrogen 2.969 N/A SER 283.A N PHE 280.A O no hydrogen 3.183 N/A SER 283.A OG GLY 279.A O no hydrogen 3.172 N/A ASP 284.A N VAL 281.A O no hydrogen 3.135 N/A GLY 285.A N PHE 280.A O no hydrogen 2.915 N/A ALA 288.A N ASP 284.A O no hydrogen 3.055 N/A ILE 289.A N GLY 285.A O no hydrogen 2.927 N/A THR 290.A N VAL 286.A O no hydrogen 3.002 N/A THR 290.A OG1 VAL 286.A O no hydrogen 2.762 N/A THR 291.A N GLY 287.A O no hydrogen 2.869 N/A THR 291.A OG1 GLY 287.A O no hydrogen 2.670 N/A VAL 292.A N ALA 288.A O no hydrogen 3.060 N/A VAL 293.A N ILE 289.A O no hydrogen 2.798 N/A GLN 294.A N THR 291.A O no hydrogen 3.237 N/A GLN 294.A NE2 THR 291.A O no hydrogen 2.742 N/A TYR 295.A N VAL 292.A O no hydrogen 3.198 N/A TYR 295.A OH GLN 242.A O no hydrogen 3.042 N/A ASN 297.A N TYR 295.A O no hydrogen 2.669 N/A LEU 300.A N ASN 297.A OD1 no hydrogen 3.085 N/A ILE 301.A N ASN 297.A O no hydrogen 2.955 N/A ARG 302.A N ASN 298.A O no hydrogen 2.934 N/A ARG 302.A NH1 ASP 338.A OD1 no hydrogen 2.813 N/A ARG 302.A NH2 ASP 299.A OD1 no hydrogen 3.086 N/A ALA 303.A N ASP 299.A O no hydrogen 3.265 N/A GLY 304.A N LEU 300.A O no hydrogen 2.945 N/A CYS 305.A N ILE 301.A O no hydrogen 2.871 N/A CYS 305.A SG ILE 301.A O no hydrogen 3.288 N/A LYS 306.A N ARG 302.A O no hydrogen 3.014 N/A LEU 307.A N ALA 303.A O no hydrogen 3.287 N/A LEU 308.A N GLY 304.A O no hydrogen 3.054 N/A LEU 309.A N CYS 305.A O no hydrogen 2.886 N/A GLN 310.A N LYS 306.A O no hydrogen 3.196 N/A GLN 310.A NE2 GLY 268.A O no hydrogen 2.789 N/A GLN 310.A NE2 LEU 271.A O no hydrogen 3.167 N/A VAL 311.A N LEU 307.A O no hydrogen 3.248 N/A VAL 311.A N LEU 308.A O no hydrogen 3.062 N/A SER 312.A N LEU 309.A O no hydrogen 3.197 N/A SER 312.A OG LEU 309.A O no hydrogen 2.539 N/A ALA 314.A N VAL 311.A O no hydrogen 3.127 N/A ALA 316.A N ASP 278.A OD2 no hydrogen 3.200 N/A LEU 317.A N ALA 314.A O no hydrogen 3.154 N/A ALA 318.A N LYS 315.A O no hydrogen 2.966 N/A LYS 319.A N ALA 316.A O no hydrogen 2.864 N/A THR 320.A OG1 ALA 316.A O no hydrogen 3.212 N/A GLU 323.A N GLU 323.A OE1 no hydrogen 3.058 N/A LEU 326.A N LEU 322.A O no hydrogen 3.141 N/A PHE 328.A N ASN 324.A O no hydrogen 3.326 N/A LEU 329.A N ILE 325.A O no hydrogen 2.907 N/A LEU 330.A N LEU 326.A O no hydrogen 2.880 N/A ARG 331.A N PRO 327.A O no hydrogen 3.036 N/A LEU 332.A N PHE 328.A O no hydrogen 2.839 N/A ILE 333.A N LEU 329.A O no hydrogen 2.939 N/A GLU 334.A N LEU 330.A O no hydrogen 2.979 N/A ILE 335.A N ARG 331.A O no hydrogen 3.225 N/A HIS 336.A N LEU 332.A O no hydrogen 2.938 N/A VAL 341.A N ASP 338.A O no hydrogen 3.248 N/A ILE 342.A N ASP 338.A O no hydrogen 3.176 N/A TYR 343.A N ASP 339.A O no hydrogen 2.912 N/A SER 344.A N GLU 340.A O no hydrogen 2.943 N/A SER 344.A OG GLU 340.A O no hydrogen 3.059 N/A GLY 345.A N VAL 341.A O no hydrogen 2.661 N/A THR 346.A N ILE 342.A O no hydrogen 3.010 N/A THR 346.A OG1 ILE 342.A O no hydrogen 2.800 N/A THR 346.A OG1 TYR 343.A O no hydrogen 3.203 N/A GLY 347.A N TYR 343.A O no hydrogen 3.015 N/A PHE 348.A N SER 344.A O no hydrogen 2.930 N/A LEU 349.A N GLY 345.A O no hydrogen 2.792 N/A SER 350.A N THR 346.A O no hydrogen 3.145 N/A SER 350.A OG THR 346.A O no hydrogen 3.119 N/A SER 350.A OG GLY 347.A O no hydrogen 3.166 N/A ASN 351.A N GLY 347.A O no hydrogen 3.408 N/A ASN 351.A ND2 SER 312.A OG no hydrogen 2.736 N/A VAL 352.A N PHE 348.A O no hydrogen 2.894 N/A VAL 353.A N LEU 349.A O no hydrogen 3.010 N/A LYS 356.A N VAL 353.A O no hydrogen 3.214 N/A LYS 356.A NZ VAL 352.A O no hydrogen 2.773 N/A LYS 356.A NZ ALA 354.A O no hydrogen 2.938 N/A GLN 357.A NE2 ASP 361.A OD1 no hydrogen 3.208 N/A GLN 357.A NE2 ASP 361.A OD2 no hydrogen 3.539 N/A LYS 360.A N LYS 356.A O no hydrogen 2.824 N/A ASP 361.A N GLN 357.A O no hydrogen 2.869 N/A ILE 362.A N HIS 358.A O no hydrogen 3.071 N/A ALA 363.A N VAL 359.A O no hydrogen 3.057 N/A ILE 364.A N LYS 360.A O no hydrogen 2.917 N/A ARG 365.A N ASP 361.A O no hydrogen 3.044 N/A SER 366.A N ILE 362.A O no hydrogen 3.010 N/A SER 366.A N ALA 363.A O no hydrogen 2.936 N/A SER 366.A OG ILE 362.A O no hydrogen 3.386 N/A ASN 367.A N ILE 364.A O no hydrogen 2.852 N/A ALA 368.A N ALA 363.A O no hydrogen 3.117 N/A PHE 370.A N GLN 428.A OE1 no hydrogen 3.407 N/A LEU 371.A N ASN 367.A O no hydrogen 3.161 N/A LEU 372.A N ALA 368.A O no hydrogen 2.916 N/A HIS 373.A N ILE 369.A O no hydrogen 3.201 N/A THR 374.A N PHE 370.A O no hydrogen 3.136 N/A THR 374.A OG1 PHE 370.A O no hydrogen 3.210 N/A ILE 375.A N LEU 371.A O no hydrogen 2.914 N/A ILE 376.A N LEU 372.A O no hydrogen 3.118 N/A SER 377.A N HIS 373.A O no hydrogen 2.860 N/A SER 377.A OG HIS 373.A O no hydrogen 3.239 N/A LYS 378.A NZ TYR 379.A OH no hydrogen 3.388 N/A TYR 379.A OH ASP 339.A OD1 no hydrogen 2.649 N/A ARG 381.A N GLU 384.A OE1 no hydrogen 3.312 N/A ARG 381.A NE ASP 383.A OD2 no hydrogen 3.460 N/A ARG 381.A NH1 ASP 383.A OD2 no hydrogen 3.176 N/A GLU 384.A N ARG 381.A O no hydrogen 3.011 N/A LEU 385.A N LEU 382.A O no hydrogen 3.017 N/A LYS 390.A N ASP 387.A OD2 no hydrogen 3.069 N/A LYS 390.A NZ ASP 339.A OD2 no hydrogen 2.982 N/A ARG 391.A N ASP 387.A O no hydrogen 3.227 N/A ARG 391.A NE THR 452.A OG1 no hydrogen 2.817 N/A ARG 391.A NH1 LEU 385.A O no hydrogen 2.773 N/A ARG 391.A NH2 ASP 451.A O no hydrogen 3.326 N/A ASN 392.A N ALA 388.A O no hydrogen 2.994 N/A ARG 393.A N PRO 389.A O no hydrogen 3.123 N/A ARG 393.A NE GLU 340.A OE1 no hydrogen 3.232 N/A ARG 393.A NH1 GLU 396.A OE1 no hydrogen 3.475 N/A ARG 393.A NH2 GLU 340.A OE1 no hydrogen 2.426 N/A VAL 394.A N LYS 390.A O no hydrogen 2.953 N/A CYS 395.A N ARG 391.A O no hydrogen 2.880 N/A GLU 396.A N ASN 392.A O no hydrogen 2.991 N/A ILE 397.A N ARG 393.A O no hydrogen 2.765 N/A ILE 398.A N VAL 394.A O no hydrogen 2.962 N/A CYS 399.A N CYS 395.A O no hydrogen 3.036 N/A CYS 399.A SG GLU 457.A O no hydrogen 3.631 N/A CYS 399.A SG GLU 457.A OE2 no hydrogen 3.321 N/A CYS 399.A SG THR 461.A OG1 no hydrogen 3.511 N/A ASN 400.A N GLU 396.A O no hydrogen 2.986 N/A ASN 400.A ND2 THR 346.A OG1 no hydrogen 3.183 N/A CYS 401.A N ILE 397.A O no hydrogen 3.182 N/A CYS 401.A SG ILE 397.A O no hydrogen 3.384 N/A LEU 402.A N ILE 398.A O no hydrogen 2.984 N/A ARG 403.A N CYS 399.A O no hydrogen 2.911 N/A ARG 403.A NH1 ASN 400.A OD1 no hydrogen 3.014 N/A THR 404.A N ASN 400.A O no hydrogen 2.953 N/A THR 404.A OG1 ASN 400.A O no hydrogen 2.838 N/A LEU 405.A N CYS 401.A O no hydrogen 2.948 N/A ASN 406.A N LEU 402.A O no hydrogen 2.917 N/A ASN 406.A ND2 THR 461.A O no hydrogen 3.577 N/A ASN 407.A N ARG 403.A O no hydrogen 3.322 N/A PHE 408.A N THR 404.A O no hydrogen 3.295 N/A LEU 409.A N LEU 405.A O no hydrogen 2.914 N/A MET 410.A N ASN 406.A O no hydrogen 3.151 N/A MET 411.A N PHE 408.A O no hydrogen 2.911 N/A TRP 412.A N LEU 409.A O no hydrogen 3.171 N/A GLY 422.A N GLU 425.A OE1 no hydrogen 3.300 N/A LYS 426.A N GLY 422.A O no hydrogen 3.035 N/A LYS 426.A NZ ALA 421.A O no hydrogen 2.806 N/A GLN 427.A N PRO 423.A O no hydrogen 3.354 N/A GLN 428.A N ASN 424.A O no hydrogen 3.064 N/A GLN 428.A NE2 ASN 367.A OD1 no hydrogen 2.886 N/A GLN 428.A NE2 ASN 424.A OD1 no hydrogen 3.659 N/A VAL 429.A N GLU 425.A O no hydrogen 3.074 N/A CYS 430.A N LYS 426.A O no hydrogen 3.007 N/A CYS 430.A SG LYS 426.A O no hydrogen 3.295 N/A CYS 430.A SG PHE 474.A O no hydrogen 3.735 N/A LYS 431.A N GLN 428.A O no hydrogen 3.128 N/A LYS 431.A NZ GLU 434.A OE2 no hydrogen 2.764 N/A PHE 432.A N VAL 429.A O no hydrogen 3.102 N/A ILE 433.A N CYS 430.A O no hydrogen 3.331 N/A GLU 434.A N LYS 431.A O no hydrogen 3.302 N/A LEU 438.A N GLU 434.A O no hydrogen 3.300 N/A LYS 439.A N ILE 435.A O no hydrogen 2.999 N/A LYS 440.A N ASP 436.A O no hydrogen 2.982 N/A LYS 440.A NZ TYR 379.A O no hydrogen 3.323 N/A LEU 441.A N ILE 437.A O no hydrogen 2.816 N/A MET 442.A N LEU 438.A O no hydrogen 2.854 N/A SER 443.A N LYS 439.A O no hydrogen 3.012 N/A SER 443.A OG LYS 439.A O no hydrogen 2.592 N/A CYS 444.A N LYS 440.A O no hydrogen 3.157 N/A CYS 444.A SG LYS 440.A O no hydrogen 3.438 N/A LEU 445.A N LEU 441.A O no hydrogen 3.246 N/A SER 446.A N SER 443.A O no hydrogen 3.114 N/A SER 446.A OG MET 442.A O no hydrogen 3.505 N/A SER 446.A OG HIS 495.A ND1 no hydrogen 2.711 N/A CYS 447.A N SER 443.A O no hydrogen 2.689 N/A CYS 447.A SG CYS 444.A O no hydrogen 3.834 N/A GLY 454.A N ASN 392.A OD1 no hydrogen 3.073 N/A LEU 455.A N THR 452.A O no hydrogen 3.047 N/A LEU 458.A N GLY 454.A O no hydrogen 3.073 N/A ARG 459.A N LEU 455.A O no hydrogen 2.983 N/A ARG 459.A NE CYS 444.A O no hydrogen 2.769 N/A ARG 459.A NH2 CYS 444.A O no hydrogen 3.023 N/A ARG 459.A NH2 CYS 447.A O no hydrogen 2.825 N/A SER 460.A N LEU 456.A O no hydrogen 3.113 N/A THR 461.A N GLU 457.A O no hydrogen 3.067 N/A THR 461.A OG1 GLU 457.A O no hydrogen 2.723 N/A ILE 462.A N LEU 458.A O no hydrogen 2.856 N/A LEU 463.A N ARG 459.A O no hydrogen 3.298 N/A ARG 464.A N SER 460.A O no hydrogen 3.342 N/A SER 465.A N THR 461.A O no hydrogen 2.909 N/A SER 465.A OG ASN 406.A OD1 no hydrogen 2.543 N/A PHE 466.A N ILE 462.A O no hydrogen 2.894 N/A ILE 467.A N LEU 463.A O no hydrogen 2.827 N/A LEU 468.A N ARG 464.A O no hydrogen 2.932 N/A LEU 469.A N SER 465.A O no hydrogen 2.903 N/A LEU 470.A N PHE 466.A O no hydrogen 3.089 N/A ARG 471.A N ILE 467.A O no hydrogen 2.994 N/A THR 472.A N LEU 469.A O no hydrogen 3.139 N/A THR 472.A OG1 LEU 468.A O no hydrogen 2.771 N/A VAL 475.A N THR 472.A O no hydrogen 2.995 N/A LYS 477.A NZ LEU 470.A O no hydrogen 2.867 N/A LYS 477.A NZ THR 472.A O no hydrogen 3.149 N/A ASN 482.A N GLY 479.A O no hydrogen 3.200 N/A VAL 483.A N VAL 480.A O no hydrogen 3.287 N/A ASP 485.A N GLU 490.A O no hydrogen 3.040 N/A ASN 487.A N ASP 485.A OD2 no hydrogen 3.246 N/A ARG 488.A N ASP 485.A OD2 no hydrogen 2.763 N/A ARG 488.A NE GLU 490.A OE1 no hydrogen 2.348 N/A ARG 488.A NH2 GLU 490.A OE2 no hydrogen 3.166 N/A GLU 490.A N ASP 485.A OD1 no hydrogen 2.943 N/A ASN 491.A ND2 LEU 481.A O no hydrogen 3.129 N/A ILE 493.A N ASN 491.A OD1 no hydrogen 3.265 N/A GLY 494.A N ASN 491.A O no hydrogen 2.966 N/A HIS 495.A N ASN 491.A O no hydrogen 3.471 N/A HIS 495.A ND1 SER 446.A OG no hydrogen 2.711 N/A HIS 495.A NE2 ASP 485.A OD1 no hydrogen 2.821 N/A ILE 496.A N LEU 492.A O no hydrogen 2.959 N/A CYS 497.A N ILE 493.A O no hydrogen 2.764 N/A CYS 497.A SG ILE 493.A O no hydrogen 3.329 N/A ALA 498.A N GLY 494.A O no hydrogen 2.748 N/A ALA 499.A N HIS 495.A O no hydrogen 3.075 N/A TYR 500.A N ILE 496.A O no hydrogen 3.143 N/A SER 501.A N CYS 497.A O no hydrogen 2.975 N/A TRP 502.A N ALA 498.A O no hydrogen 2.950 N/A VAL 503.A N ALA 499.A O no hydrogen 2.906 N/A PHE 504.A N SER 501.A O no hydrogen 3.352 N/A ARG 505.A N TRP 502.A O no hydrogen 3.038 N/A THR 512.A N ASN 509.A O no hydrogen 3.094 N/A THR 512.A OG1 ASN 509.A O no hydrogen 3.232 N/A GLN 513.A N ASN 509.A O no hydrogen 3.121 N/A LYS 516.A N THR 512.A O no hydrogen 3.127 N/A LYS 516.A NZ PRO 507.A O no hydrogen 2.879 N/A GLN 517.A N GLN 513.A O no hydrogen 3.083 N/A GLN 517.A NE2 GLU 521.A OE1 no hydrogen 2.890 N/A GLN 518.A N SER 514.A O no hydrogen 3.187 N/A LEU 519.A N THR 515.A O no hydrogen 2.811 N/A VAL 520.A N LYS 516.A O no hydrogen 2.968 N/A GLU 521.A N GLN 517.A O no hydrogen 2.950 N/A ARG 522.A N GLN 518.A O no hydrogen 2.910 N/A ARG 522.A NH1 SER 460.A O no hydrogen 2.983 N/A THR 523.A N LEU 519.A O no hydrogen 2.973 N/A THR 523.A OG1 LEU 519.A O no hydrogen 2.866 N/A ILE 524.A N VAL 520.A O no hydrogen 3.222 N/A SER 525.A N GLU 521.A O no hydrogen 2.944 N/A LEU 526.A N ARG 522.A O no hydrogen 2.659 N/A LEU 527.A N THR 523.A O no hydrogen 2.913 N/A LEU 528.A N ILE 524.A O no hydrogen 3.182 N/A VAL 529.A N SER 525.A O no hydrogen 3.073 N/A LEU 530.A N LEU 526.A O no hydrogen 2.916 N/A MET 531.A N LEU 527.A O no hydrogen 3.102 N/A GLU 532.A N LEU 528.A O no hydrogen 2.903 N/A GLN 533.A N VAL 529.A O no hydrogen 2.711 N/A CYS 534.A N LEU 530.A O no hydrogen 3.067 N/A CYS 534.A SG LYS 477.A O no hydrogen 3.772 N/A ALA 536.A N MET 531.A O no hydrogen 3.096 N/A LYS 538.A NZ HIS 577.A O no hydrogen 3.336 N/A VAL 540.A N ALA 536.A O no hydrogen 2.869 N/A ALA 541.A N GLU 537.A O no hydrogen 3.121 N/A GLN 542.A N LYS 538.A O no hydrogen 2.957 N/A TYR 543.A N GLU 539.A O no hydrogen 2.939 N/A SER 544.A N ALA 541.A O no hydrogen 3.221 N/A SER 544.A OG VAL 540.A O no hydrogen 2.991 N/A ILE 547.A N SER 544.A O no hydrogen 3.273 N/A CYS 549.A N ASP 548.A OD1 no hydrogen 2.828 N/A ASN 552.A N CYS 549.A O no hydrogen 3.195 N/A LEU 553.A N PRO 550.A O no hydrogen 2.842 N/A LEU 554.A N LEU 551.A O no hydrogen 3.034 N/A ASN 555.A N ASN 552.A O no hydrogen 3.282 N/A GLN 558.A NE2 GLN 517.A OE1 no hydrogen 3.635 N/A ILE 564.A N LYS 560.A O no hydrogen 3.305 N/A HIS 565.A N PRO 561.A O no hydrogen 3.212 N/A ASN 566.A N THR 562.A O no hydrogen 3.164 N/A VAL 567.A N PHE 563.A O no hydrogen 2.861 N/A LEU 568.A N ILE 564.A O no hydrogen 3.016 N/A VAL 569.A N HIS 565.A O no hydrogen 2.928 N/A VAL 570.A N ASN 566.A O no hydrogen 2.925 N/A CYS 571.A N VAL 567.A O no hydrogen 3.030 N/A CYS 571.A SG VAL 567.A O no hydrogen 3.354 N/A ASP 572.A N LEU 568.A O no hydrogen 3.015 N/A LYS 573.A N VAL 569.A O no hydrogen 2.912 N/A LYS 573.A NZ GLU 537.A OE1 no hydrogen 2.720 N/A ILE 574.A N VAL 570.A O no hydrogen 2.915 N/A LEU 575.A N CYS 571.A O no hydrogen 3.001 N/A GLU 576.A N ASP 572.A O no hydrogen 3.054 N/A HIS 577.A N ILE 574.A O no hydrogen 3.152 N/A HIS 577.A ND1 LYS 573.A O no hydrogen 3.192 N/A CYS 578.A N ILE 574.A O no hydrogen 2.757 N/A ARG 581.A N CYS 578.A O no hydrogen 3.298 N/A ARG 581.A NH1 ALA 541.A O no hydrogen 3.187 N/A ARG 581.A NH2 ALA 541.A O no hydrogen 2.789 N/A ALA 582.A N PRO 579.A O no hydrogen 3.025 N/A ASP 583.A N THR 580.A O no hydrogen 3.052 N/A ILE 584.A N THR 580.A O no hydrogen 3.212 N/A TRP 585.A N ARG 581.A O no hydrogen 2.637 N/A MET 591.A N ASP 588.A OD1 no hydrogen 3.055 N/A LEU 592.A N ASP 588.A O no hydrogen 3.097 N/A GLU 593.A N ARG 589.A O no hydrogen 2.776 N/A GLY 594.A N PRO 590.A O no hydrogen 2.628 N/A LEU 595.A N MET 591.A O no hydrogen 2.943 N/A THR 596.A N GLU 593.A O no hydrogen 3.356 N/A THR 596.A OG1 LEU 592.A O no hydrogen 3.225 N/A THR 596.A OG1 GLU 593.A O no hydrogen 2.703 N/A ASN 597.A N GLY 594.A O no hydrogen 3.063 N/A ASN 600.A N HIS 598.A ND1 no hydrogen 3.051 N/A ASP 602.A N ASN 600.A OD1 no hydrogen 2.736 N/A ILE 603.A N ASN 600.A OD1 no hydrogen 3.281 N/A ALA 604.A N ASN 600.A O no hydrogen 3.174 N/A LYS 605.A N SER 601.A O no hydrogen 3.074 N/A ALA 606.A N ASP 602.A O no hydrogen 3.095 N/A ALA 607.A N ILE 603.A O no hydrogen 2.926 N/A ASN 608.A N ALA 604.A O no hydrogen 3.475 N/A SER 609.A N LYS 605.A O no hydrogen 3.207 N/A SER 609.A OG LYS 605.A O no hydrogen 2.891 N/A LEU 610.A N ALA 606.A O no hydrogen 3.014 N/A LEU 611.A N ALA 607.A O no hydrogen 2.898 N/A SER 612.A N ASN 608.A O no hydrogen 3.377 N/A SER 612.A OG SER 609.A O no hydrogen 2.694 N/A ARG 613.A N LEU 610.A O no hydrogen 2.997 N/A ARG 613.A NE ASP 572.A OD1 no hydrogen 2.891 N/A ARG 613.A NH1 GLU 576.A OE2 no hydrogen 3.424 N/A ARG 613.A NH2 ASP 572.A OD1 no hydrogen 3.253 N/A ARG 613.A NH2 ASP 572.A OD2 no hydrogen 2.764 N/A ARG 613.A NH2 GLU 576.A OE1 no hydrogen 3.293 N/A PHE 614.A N LEU 611.A O no hydrogen 3.156 N/A