Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1iwa_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 8.A N SER 6.A OG no hydrogen 3.408 N/A TYR 15.A N GLU 48.A OE2 no hydrogen 2.714 N/A TYR 15.A OH GLU 56.A OE2 no hydrogen 2.925 N/A ALA 16.A N GLU 48.A OE1 no hydrogen 2.680 N/A LYS 17.A N PRO 14.A O no hydrogen 3.161 N/A TYR 20.A OH THR 59.A OG1 no hydrogen 2.838 N/A ASN 22.A N ALA 80.A O no hydrogen 3.468 N/A ASP 24.A N ASN 22.A OD1 no hydrogen 2.930 N/A TYR 25.A N ASN 22.A O no hydrogen 3.022 N/A TYR 25.A OH ASP 31.A OD2 no hydrogen 2.495 N/A GLN 26.A NE2 ASP 24.A O no hydrogen 2.868 N/A LYS 28.A N ASP 31.A OD2 no hydrogen 2.730 N/A ASP 31.A N LYS 28.A O no hydrogen 3.104 N/A VAL 32.A N TYR 99.A O no hydrogen 2.852 N/A LEU 33.A N ARG 135.A O no hydrogen 2.849 N/A ALA 34.A N ILE 97.A O no hydrogen 2.875 N/A LEU 35.A N ASP 133.A O no hydrogen 2.959 N/A PHE 36.A N ALA 95.A O no hydrogen 2.923 N/A ARG 37.A N ARG 130.A O no hydrogen 2.816 N/A ARG 37.A NE GLU 132.A OE2 no hydrogen 2.968 N/A ARG 37.A NH1 GLN 92.A OE1 no hydrogen 3.108 N/A ARG 37.A NH1 ASP 471.A OD2 no hydrogen 3.142 N/A ARG 37.A NH2 GLU 132.A OE2 no hydrogen 2.951 N/A ARG 37.A NH2 ASP 471.A OD2 no hydrogen 2.971 N/A VAL 38.A N TYR 93.A O no hydrogen 2.598 N/A THR 39.A N ALA 128.A O no hydrogen 3.133 N/A GLN 41.A N ALA 125.A O no hydrogen 2.862 N/A GLN 41.A NE2 LYS 124.A O no hydrogen 3.037 N/A VAL 44.A N GLN 41.A O no hydrogen 2.785 N/A ILE 47.A N ASP 45.A OD2 no hydrogen 3.316 N/A ALA 49.A N ASP 45.A O no hydrogen 2.815 N/A ALA 50.A N PRO 46.A O no hydrogen 2.936 N/A ALA 51.A N ILE 47.A O no hydrogen 2.947 N/A ALA 52.A N GLU 48.A O no hydrogen 2.601 N/A VAL 53.A N ALA 49.A O no hydrogen 2.886 N/A ALA 54.A N ALA 50.A O no hydrogen 2.879 N/A GLY 55.A N ALA 51.A O no hydrogen 2.815 N/A GLU 56.A N ALA 52.A O no hydrogen 3.033 N/A SER 57.A N VAL 53.A O no hydrogen 3.206 N/A SER 57.A OG VAL 53.A O no hydrogen 2.812 N/A SER 57.A OG ALA 54.A O no hydrogen 3.163 N/A SER 57.A OG TYR 99.A OH no hydrogen 2.610 N/A SER 58.A N GLY 55.A O no hydrogen 3.085 N/A SER 58.A OG ALA 54.A O no hydrogen 2.967 N/A SER 58.A OG GLY 55.A O no hydrogen 3.216 N/A THR 59.A N SER 58.A OG no hydrogen 2.607 N/A THR 59.A OG1 TYR 20.A OH no hydrogen 2.838 N/A ALA 60.A N GLY 55.A O no hydrogen 2.935 N/A VAL 64.A N GLY 11.A O no hydrogen 3.219 N/A ASP 68.A N VAL 65.A O no hydrogen 3.349 N/A LEU 69.A N TRP 66.A O no hydrogen 2.941 N/A LEU 70.A N THR 67.A O no hydrogen 3.212 N/A THR 71.A N ASP 68.A O no hydrogen 2.683 N/A THR 71.A OG1 ASP 68.A O no hydrogen 2.891 N/A LEU 75.A N ALA 72.A O no hydrogen 2.857 N/A TYR 76.A N ALA 72.A O no hydrogen 3.109 N/A ARG 77.A N ALA 73.A O no hydrogen 2.881 N/A ARG 77.A NH1 TYR 20.A OH no hydrogen 3.520 N/A ARG 77.A NH1 ASP 68.A OD2 no hydrogen 3.181 N/A ARG 77.A NH2 ASP 68.A OD2 no hydrogen 3.429 N/A ALA 78.A N SER 58.A OG no hydrogen 3.403 N/A LYS 79.A N ALA 98.A O no hydrogen 3.159 N/A LYS 79.A NZ ASP 74.A O no hydrogen 2.616 N/A LYS 79.A NZ ARG 77.A O no hydrogen 2.557 N/A ALA 80.A N TYR 20.A O no hydrogen 2.802 N/A ASP 84.A N PHE 94.A O no hydrogen 3.054 N/A VAL 86.A N GLN 92.A O no hydrogen 2.897 N/A ASN 88.A ND2 PRO 87.A O no hydrogen 2.659 N/A ASN 89.A N VAL 86.A O no hydrogen 2.798 N/A GLU 91.A N ASN 89.A OD1 no hydrogen 2.781 N/A GLN 92.A N ASN 89.A O no hydrogen 3.086 N/A TYR 93.A N VAL 38.A O no hydrogen 2.642 N/A TYR 93.A OH PRO 90.A O no hydrogen 3.326 N/A PHE 94.A N ASP 84.A O no hydrogen 2.785 N/A ALA 95.A N PHE 36.A O no hydrogen 2.745 N/A TYR 96.A N LYS 82.A O no hydrogen 2.703 N/A ILE 97.A N ALA 34.A O no hydrogen 2.842 N/A ALA 98.A N LYS 79.A O no hydrogen 3.012 N/A TYR 99.A N VAL 32.A O no hydrogen 2.844 N/A TYR 99.A OH SER 57.A OG no hydrogen 2.610 N/A ASP 102.A N GLU 100.A OE2 no hydrogen 3.238 N/A LEU 103.A N GLU 100.A O no hydrogen 3.112 N/A PHE 104.A N LEU 101.A O no hydrogen 2.946 N/A GLU 105.A N ASN 111.A OD1 no hydrogen 2.939 N/A GLU 106.A N GLU 106.A OE1 no hydrogen 2.355 N/A GLY 107.A N THR 143.A OG1 no hydrogen 3.053 N/A SER 108.A N GLU 105.A O no hydrogen 3.308 N/A ILE 109.A N GLN 273.A OE1 no hydrogen 3.028 N/A ASN 111.A N SER 108.A OG no hydrogen 3.098 N/A LEU 112.A N SER 108.A O no hydrogen 3.165 N/A THR 113.A N ILE 109.A O no hydrogen 3.098 N/A THR 113.A OG1 ILE 109.A O no hydrogen 2.828 N/A THR 113.A OG1 ALA 110.A O no hydrogen 2.870 N/A ALA 114.A N ALA 110.A O no hydrogen 2.799 N/A SER 115.A N ASN 111.A O no hydrogen 3.395 N/A SER 115.A OG ASN 111.A O no hydrogen 3.493 N/A ILE 116.A N LEU 112.A O no hydrogen 3.062 N/A ILE 117.A N THR 113.A O no hydrogen 2.814 N/A GLY 118.A N SER 115.A O no hydrogen 3.202 N/A GLY 122.A N ASN 119.A O no hydrogen 2.700 N/A VAL 126.A N PHE 123.A O no hydrogen 3.246 N/A ALA 128.A N THR 39.A O no hydrogen 3.189 N/A LEU 129.A N HIS 302.A ND1 no hydrogen 2.922 N/A ARG 130.A NH1 GLU 132.A OE2 no hydrogen 2.514 N/A ARG 130.A NH1 ASP 468.A OD1 no hydrogen 3.043 N/A ARG 130.A NH2 SER 297.A O no hydrogen 3.365 N/A ARG 130.A NH2 ASP 468.A OD1 no hydrogen 3.168 N/A LEU 131.A N GLY 303.A O no hydrogen 3.032 N/A GLU 132.A N LEU 35.A O no hydrogen 2.927 N/A ARG 135.A N LEU 33.A O no hydrogen 2.798 N/A ARG 135.A NE ARG 135.A O no hydrogen 3.196 N/A ARG 135.A NH2 LYS 28.A O no hydrogen 3.006 N/A ARG 135.A NH2 ASP 31.A O no hydrogen 2.841 N/A TYR 140.A N PRO 137.A O no hydrogen 2.972 N/A LEU 141.A N PRO 137.A O no hydrogen 2.927 N/A LYS 142.A N LEU 138.A O no hydrogen 2.946 N/A THR 143.A N TYR 140.A O no hydrogen 2.919 N/A THR 143.A OG1 TYR 140.A O no hydrogen 2.525 N/A PHE 144.A N LEU 141.A O no hydrogen 3.020 N/A GLN 145.A NE2 GLY 146.A O no hydrogen 3.272 N/A GLN 145.A NE2 ALA 276.A O no hydrogen 3.286 N/A GLY 146.A N MET 315.A O no hydrogen 3.112 N/A ALA 148.A N GLY 317.A O no hydrogen 2.832 N/A THR 149.A N ASP 319.A OD1 no hydrogen 2.709 N/A THR 149.A OG1 ASP 319.A OD2 no hydrogen 2.815 N/A GLY 150.A N ASP 319.A OD1 no hydrogen 2.911 N/A VAL 151.A N LYS 368.A O no hydrogen 2.978 N/A GLU 154.A N GLY 150.A O no hydrogen 2.805 N/A ARG 155.A N VAL 151.A O no hydrogen 2.999 N/A ARG 155.A NE LYS 160.A O no hydrogen 3.114 N/A GLU 156.A N ILE 152.A O no hydrogen 3.145 N/A ARG 157.A N LEU 153.A O no hydrogen 2.981 N/A LEU 158.A N GLU 154.A O no hydrogen 3.004 N/A ASP 159.A N ARG 155.A O no hydrogen 2.640 N/A LYS 160.A N ARG 155.A O no hydrogen 3.150 N/A LYS 160.A NZ ASP 194.A OD1 no hydrogen 2.547 N/A LYS 160.A NZ GLU 230.A OE2 no hydrogen 3.106 N/A LYS 160.A NZ VAL 231.A O no hydrogen 3.297 N/A ARG 163.A NH1 ASP 194.A OD2 no hydrogen 3.009 N/A ARG 163.A NH2 ASP 194.A OD1 no hydrogen 2.743 N/A ARG 163.A NH2 ASP 194.A OD2 no hydrogen 3.497 N/A LEU 165.A N VAL 393.A O no hydrogen 2.912 N/A LEU 166.A N ASP 194.A OD2 no hydrogen 2.682 N/A GLY 167.A N LEU 395.A O no hydrogen 2.775 N/A CYS 168.A SG GLY 398.A O no hydrogen 3.849 N/A THR 170.A N LYS 197.A O no hydrogen 3.301 N/A THR 170.A OG1 LYS 197.A O no hydrogen 3.388 N/A LYS 171.A NZ ASP 199.A OD1 no hydrogen 3.284 N/A LYS 173.A NZ ASP 199.A OD1 no hydrogen 2.963 N/A LYS 173.A NZ ASP 199.A OD2 no hydrogen 3.218 N/A LYS 173.A NZ GLU 200.A OE2 no hydrogen 2.807 N/A ASN 180.A N SER 177.A OG no hydrogen 3.147 N/A TYR 181.A N SER 177.A O no hydrogen 2.764 N/A TYR 181.A OH ASP 198.A OD1 no hydrogen 3.240 N/A GLY 182.A N GLY 178.A O no hydrogen 3.078 N/A ARG 183.A N LYS 179.A O no hydrogen 3.246 N/A ARG 183.A NE GLU 187.A OE2 no hydrogen 3.218 N/A VAL 184.A N ASN 180.A O no hydrogen 3.375 N/A VAL 185.A N TYR 181.A O no hydrogen 3.147 N/A TYR 186.A N GLY 182.A O no hydrogen 2.765 N/A GLU 187.A N ARG 183.A O no hydrogen 2.955 N/A ALA 188.A N VAL 184.A O no hydrogen 3.053 N/A LEU 189.A N VAL 185.A O no hydrogen 3.081 N/A LYS 190.A N TYR 186.A O no hydrogen 2.932 N/A LYS 190.A NZ GLN 409.A OE1 no hydrogen 3.559 N/A GLY 191.A N GLU 187.A O no hydrogen 2.814 N/A GLY 192.A N LEU 189.A O no hydrogen 3.236 N/A LEU 193.A N ALA 188.A O no hydrogen 3.177 N/A ASP 194.A N LEU 166.A O no hydrogen 2.906 N/A PHE 195.A N LEU 166.A O no hydrogen 2.801 N/A VAL 196.A N GLY 233.A O no hydrogen 3.156 N/A LYS 197.A N CYS 168.A O no hydrogen 2.991 N/A LYS 197.A NZ THR 169.A OG1 no hydrogen 2.683 N/A LYS 197.A NZ ASP 198.A O no hydrogen 3.087 N/A ASP 198.A N TYR 235.A O no hydrogen 3.170 N/A GLU 200.A N ASP 199.A OD2 no hydrogen 2.935 N/A ASN 201.A N GLU 200.A OE2 no hydrogen 3.236 N/A ILE 202.A N ASP 199.A O no hydrogen 2.962 N/A ASN 203.A N GLN 205.A OE1 no hydrogen 3.029 N/A ASN 203.A ND2 GLU 200.A O no hydrogen 3.362 N/A GLN 205.A N MET 208.A O no hydrogen 2.995 N/A GLN 205.A NE2 ASN 201.A O no hydrogen 2.954 N/A MET 208.A N GLN 205.A O no hydrogen 3.048 N/A ARG 209.A N GLU 212.A OE1 no hydrogen 3.104 N/A TRP 210.A N SER 204.A OG no hydrogen 3.360 N/A ARG 213.A NE ASP 198.A OD2 no hydrogen 3.327 N/A ARG 213.A NH1 ASP 198.A OD2 no hydrogen 3.547 N/A ARG 213.A NH1 ASN 203.A O no hydrogen 2.891 N/A ARG 213.A NH2 ASN 203.A O no hydrogen 3.064 N/A TYR 214.A N TRP 210.A O no hydrogen 2.946 N/A TYR 214.A OH ASN 237.A O no hydrogen 2.732 N/A LEU 215.A N ARG 211.A O no hydrogen 3.052 N/A PHE 216.A N GLU 212.A O no hydrogen 2.821 N/A THR 217.A N ARG 213.A O no hydrogen 2.826 N/A THR 217.A OG1 ARG 213.A O no hydrogen 3.017 N/A MET 218.A N TYR 214.A O no hydrogen 3.071 N/A ALA 220.A N PHE 216.A O no hydrogen 3.044 N/A VAL 221.A N THR 217.A O no hydrogen 2.733 N/A ASN 222.A N MET 218.A O no hydrogen 2.977 N/A ASN 222.A ND2 MET 218.A O no hydrogen 2.535 N/A LYS 223.A N GLU 219.A O no hydrogen 3.087 N/A ALA 224.A N ALA 220.A O no hydrogen 3.021 N/A SER 225.A N VAL 221.A O no hydrogen 3.000 N/A SER 225.A OG GLU 230.A O no hydrogen 2.867 N/A ALA 226.A N ASN 222.A O no hydrogen 2.995 N/A ALA 227.A N LYS 223.A O no hydrogen 2.840 N/A THR 228.A N SER 225.A O no hydrogen 3.168 N/A THR 228.A OG1 ALA 224.A O no hydrogen 2.644 N/A GLY 229.A N SER 225.A O no hydrogen 2.772 N/A LYS 232.A NZ LEU 189.A O no hydrogen 2.730 N/A LYS 232.A NZ LEU 193.A O no hydrogen 2.719 N/A LYS 232.A NZ GLU 230.A OE2 no hydrogen 2.784 N/A HIS 234.A NE2 ASP 198.A OD1 no hydrogen 2.949 N/A TYR 235.A N VAL 196.A O no hydrogen 2.788 N/A TYR 235.A OH GLN 396.A OE1 no hydrogen 3.224 N/A ASN 237.A N ASP 198.A OD2 no hydrogen 2.639 N/A ASN 237.A ND2 THR 239.A OG1 no hydrogen 2.759 N/A ASN 237.A ND2 MET 262.A O no hydrogen 3.138 N/A VAL 238.A N MET 262.A O no hydrogen 3.205 N/A GLU 244.A N GLU 244.A OE1 no hydrogen 2.700 N/A GLU 245.A N THR 242.A OG1 no hydrogen 3.245 N/A MET 246.A N THR 242.A O no hydrogen 3.008 N/A TYR 247.A N MET 243.A O no hydrogen 2.850 N/A ALA 248.A N GLU 244.A O no hydrogen 3.005 N/A ARG 249.A N GLU 245.A O no hydrogen 3.221 N/A ARG 249.A NE GLU 245.A OE2 no hydrogen 2.843 N/A ARG 249.A NH2 GLU 245.A OE2 no hydrogen 3.205 N/A ALA 250.A N MET 246.A O no hydrogen 2.891 N/A ASN 251.A N TYR 247.A O no hydrogen 2.737 N/A PHE 252.A N ALA 248.A O no hydrogen 3.078 N/A ALA 253.A N ARG 249.A O no hydrogen 3.027 N/A LYS 254.A N ALA 250.A O no hydrogen 2.959 N/A GLU 255.A N ASN 251.A O no hydrogen 2.881 N/A LEU 256.A N PHE 252.A O no hydrogen 3.032 N/A GLY 257.A N LYS 254.A O no hydrogen 3.260 N/A SER 258.A N ALA 253.A O no hydrogen 3.175 N/A SER 258.A OG ILE 260.A O no hydrogen 2.738 N/A ILE 260.A N SER 258.A OG no hydrogen 3.243 N/A ILE 261.A N ILE 285.A O no hydrogen 3.071 N/A MET 262.A N LEU 236.A O no hydrogen 3.077 N/A ILE 263.A N HIS 287.A O no hydrogen 2.841 N/A ASP 264.A N THR 239.A OG1 no hydrogen 3.023 N/A LEU 265.A N HIS 289.A O no hydrogen 2.818 N/A ILE 267.A N ASP 264.A O no hydrogen 3.056 N/A GLY 268.A N LEU 265.A O no hydrogen 3.044 N/A ILE 272.A N GLY 268.A O no hydrogen 2.975 N/A GLN 273.A N TYR 269.A O no hydrogen 2.867 N/A GLN 273.A NE2 GLY 107.A O no hydrogen 2.988 N/A THR 274.A N THR 270.A O no hydrogen 2.925 N/A THR 274.A OG1 THR 270.A O no hydrogen 2.527 N/A MET 275.A N ALA 271.A O no hydrogen 2.827 N/A ALA 276.A N ILE 272.A O no hydrogen 2.737 N/A LYS 277.A N GLN 273.A O no hydrogen 3.234 N/A LYS 277.A NZ ASP 281.A OD1 no hydrogen 2.880 N/A TRP 278.A N THR 274.A O no hydrogen 3.184 N/A ALA 279.A N MET 275.A O no hydrogen 2.867 N/A ARG 280.A N ALA 276.A O no hydrogen 3.094 N/A ARG 280.A NE ALA 148.A O no hydrogen 2.768 N/A ARG 280.A NH2 PRO 147.A O no hydrogen 3.161 N/A ASP 281.A N LYS 277.A O no hydrogen 2.980 N/A ASN 282.A N ALA 279.A O no hydrogen 3.307 N/A ASN 282.A ND2 TRP 278.A O no hydrogen 2.793 N/A MET 284.A N ALA 279.A O no hydrogen 3.164 N/A ILE 285.A N VAL 259.A O no hydrogen 3.270 N/A LEU 286.A N ASP 319.A OD2 no hydrogen 2.763 N/A HIS 287.A N ILE 261.A O no hydrogen 2.880 N/A HIS 287.A ND1 HIS 320.A ND1 no hydrogen 3.353 N/A HIS 287.A NE2 HIS 322.A NE2 no hydrogen 3.078 N/A LEU 288.A N HIS 320.A O no hydrogen 3.061 N/A HIS 289.A N ILE 263.A O no hydrogen 2.769 N/A ALA 291.A N HIS 289.A ND1 no hydrogen 2.837 N/A ASN 293.A N ARG 290.A O no hydrogen 2.964 N/A TYR 296.A N ASN 293.A O no hydrogen 2.971 N/A TYR 296.A OH ASN 293.A OD1 no hydrogen 2.634 N/A SER 297.A N ASN 293.A O no hydrogen 3.166 N/A SER 297.A OG ASN 293.A O no hydrogen 3.261 N/A ARG 298.A N SER 294.A O no hydrogen 3.376 N/A ARG 298.A NE GLU 331.A OE2 no hydrogen 3.320 N/A ARG 298.A NE THR 467.A OG1 no hydrogen 3.243 N/A LYS 300.A NZ THR 469.A O no hydrogen 3.433 N/A LYS 300.A NZ ASP 471.A OD1 no hydrogen 2.810 N/A GLY 303.A N LEU 129.A O no hydrogen 2.851 N/A MET 304.A N TYR 296.A O no hydrogen 2.837 N/A ASN 305.A N LEU 131.A O no hydrogen 2.906 N/A ASN 305.A ND2 GLU 132.A OE1 no hydrogen 3.228 N/A ARG 307.A N ASN 305.A OD1 no hydrogen 3.029 N/A ARG 307.A NE GLU 132.A O no hydrogen 2.854 N/A VAL 308.A N ASN 305.A O no hydrogen 2.846 N/A CYS 310.A N PHE 306.A O no hydrogen 2.774 N/A CYS 310.A SG PHE 306.A O no hydrogen 3.354 N/A LYS 311.A N ARG 307.A O no hydrogen 3.098 N/A LYS 311.A NZ ASP 133.A OD1 no hydrogen 3.046 N/A LYS 311.A NZ MET 134.A O no hydrogen 2.673 N/A TRP 312.A N VAL 308.A O no hydrogen 2.956 N/A MET 313.A N ILE 309.A O no hydrogen 2.885 N/A ARG 314.A N CYS 310.A O no hydrogen 3.020 N/A ARG 314.A NE THR 343.A O no hydrogen 3.142 N/A ARG 314.A NH1 LEU 346.A O no hydrogen 3.486 N/A ARG 314.A NH1 LEU 366.A O no hydrogen 3.461 N/A ARG 314.A NH1 ARG 367.A O no hydrogen 3.107 N/A ARG 314.A NH2 THR 343.A O no hydrogen 2.775 N/A ARG 314.A NH2 LEU 346.A O no hydrogen 2.770 N/A MET 315.A N LYS 311.A O no hydrogen 2.983 N/A ALA 316.A N TRP 312.A O no hydrogen 2.732 N/A GLY 317.A N MET 313.A O no hydrogen 3.119 N/A VAL 318.A N MET 313.A O no hydrogen 3.368 N/A ASP 319.A N LEU 286.A O no hydrogen 2.837 N/A HIS 320.A N LEU 286.A O no hydrogen 3.261 N/A HIS 320.A NE2 GLU 154.A OE1 no hydrogen 2.465 N/A HIS 320.A NE2 GLU 154.A OE2 no hydrogen 2.898 N/A ILE 321.A N MET 370.A O no hydrogen 3.115 N/A HIS 322.A NE2 HIS 287.A NE2 no hydrogen 3.078 N/A ALA 323.A N VAL 372.A O no hydrogen 2.712 N/A THR 325.A OG1 THR 325.A O no hydrogen 2.308 N/A GLY 328.A N THR 325.A O no hydrogen 2.421 N/A LYS 329.A N GLY 375.A O no hydrogen 2.716 N/A ILE 336.A N ASP 333.A OD2 no hydrogen 3.428 N/A THR 337.A N ASP 333.A O no hydrogen 2.669 N/A THR 337.A OG1 ASP 333.A O no hydrogen 2.532 N/A ARG 338.A N PRO 334.A O no hydrogen 2.942 N/A ARG 338.A NH1 GLU 355.A OE1 no hydrogen 2.865 N/A GLY 339.A N ILE 335.A O no hydrogen 3.249 N/A PHE 340.A N ILE 336.A O no hydrogen 3.341 N/A TYR 341.A N THR 337.A O no hydrogen 3.049 N/A TYR 341.A OH GLY 324.A O no hydrogen 2.852 N/A LYS 342.A N ARG 338.A O no hydrogen 2.843 N/A LYS 342.A NZ GLU 355.A OE1 no hydrogen 2.695 N/A THR 343.A N GLY 339.A O no hydrogen 2.934 N/A THR 343.A OG1 GLY 339.A O no hydrogen 2.928 N/A LEU 344.A N PHE 340.A O no hydrogen 3.088 N/A LEU 345.A N TYR 341.A O no hydrogen 3.083 N/A LEU 345.A N LYS 342.A O no hydrogen 3.312 N/A LEU 346.A N LYS 342.A O no hydrogen 3.006 N/A LYS 348.A NZ GLU 362.A OE1 no hydrogen 2.598 N/A LEU 349.A N MET 361.A O no hydrogen 2.709 N/A ARG 351.A N ASP 360.A OD2 no hydrogen 2.682 N/A ARG 351.A NE PHE 358.A O no hydrogen 3.065 N/A ARG 351.A NH2 TYR 96.A OH no hydrogen 3.433 N/A ASN 352.A N LEU 357.A O no hydrogen 2.809 N/A GLU 355.A N ASN 352.A O no hydrogen 2.993 N/A GLU 355.A N ASN 352.A OD1 no hydrogen 2.950 N/A GLY 356.A N ASN 352.A O no hydrogen 2.924 N/A LEU 357.A N ASN 352.A O no hydrogen 3.275 N/A PHE 358.A N ASP 133.A OD2 no hydrogen 3.099 N/A MET 361.A N LEU 349.A O no hydrogen 2.841 N/A TRP 363.A N PRO 347.A O no hydrogen 2.921 N/A LEU 366.A N TRP 363.A O no hydrogen 3.116 N/A VAL 369.A N LEU 344.A O no hydrogen 2.922 N/A MET 370.A N ASP 319.A O no hydrogen 2.604 N/A VAL 372.A N ILE 321.A O no hydrogen 2.901 N/A ALA 373.A N VAL 394.A O no hydrogen 2.880 N/A HIS 378.A N GLN 381.A OE1 no hydrogen 2.947 N/A HIS 378.A ND1 ALA 379.A O no hydrogen 2.748 N/A GLN 381.A N HIS 378.A O no hydrogen 3.015 N/A GLN 381.A NE2 VAL 327.A O no hydrogen 2.963 N/A HIS 383.A ND1 LEU 433.A O no hydrogen 3.127 N/A LEU 385.A N GLN 381.A O no hydrogen 2.781 N/A ILE 386.A N MET 382.A O no hydrogen 2.962 N/A HIS 387.A N HIS 383.A O no hydrogen 3.080 N/A TYR 388.A N GLN 384.A O no hydrogen 2.978 N/A LEU 389.A N LEU 385.A O no hydrogen 2.867 N/A GLY 390.A N ILE 386.A O no hydrogen 2.895 N/A VAL 394.A N PRO 371.A O no hydrogen 3.026 N/A LEU 395.A N LEU 165.A O no hydrogen 2.715 N/A GLN 396.A N ALA 373.A O no hydrogen 2.850 N/A PHE 397.A N GLY 167.A O no hydrogen 2.997 N/A THR 401.A N GLY 398.A O no hydrogen 3.068 N/A THR 401.A OG1 PHE 397.A O no hydrogen 2.734 N/A ILE 402.A N GLY 398.A O no hydrogen 3.238 N/A GLY 403.A N GLY 399.A O no hydrogen 3.110 N/A HIS 404.A N THR 401.A O no hydrogen 3.178 N/A HIS 404.A NE2 ALA 449.A O no hydrogen 3.151 N/A ASP 406.A N HIS 404.A ND1 no hydrogen 2.958 N/A GLN 409.A NE2 GLU 187.A OE1 no hydrogen 2.958 N/A GLY 411.A N GLY 407.A O no hydrogen 3.194 N/A ALA 412.A N ILE 408.A O no hydrogen 2.901 N/A THR 413.A N GLN 409.A O no hydrogen 2.896 N/A THR 413.A OG1 GLY 191.A O no hydrogen 2.960 N/A THR 413.A OG1 GLN 409.A O no hydrogen 3.227 N/A ALA 414.A N ALA 410.A O no hydrogen 2.938 N/A ASN 415.A ND2 GLY 400.A O no hydrogen 3.344 N/A ARG 416.A N ALA 412.A O no hydrogen 2.976 N/A ARG 416.A NE GLU 420.A OE2 no hydrogen 2.714 N/A ARG 416.A NH1 GLY 192.A O no hydrogen 2.539 N/A ARG 416.A NH1 GLU 230.A OE1 no hydrogen 3.215 N/A ARG 416.A NH2 GLU 230.A OE1 no hydrogen 2.871 N/A VAL 417.A N THR 413.A O no hydrogen 2.890 N/A ALA 418.A N ALA 414.A O no hydrogen 3.095 N/A LEU 419.A N ASN 415.A O no hydrogen 2.904 N/A GLU 420.A N ARG 416.A O no hydrogen 3.299 N/A ALA 421.A N VAL 417.A O no hydrogen 2.855 N/A MET 422.A N ALA 418.A O no hydrogen 3.094 N/A ILE 423.A N LEU 419.A O no hydrogen 3.190 N/A LEU 424.A N GLU 420.A O no hydrogen 2.871 N/A ALA 425.A N ALA 421.A O no hydrogen 3.052 N/A ARG 426.A N MET 422.A O no hydrogen 2.810 N/A ARG 426.A NE ASN 427.A OD1 no hydrogen 2.975 N/A ARG 426.A NH1 GLU 391.A OE1 no hydrogen 2.857 N/A ARG 426.A NH2 GLU 391.A OE1 no hydrogen 2.826 N/A ARG 426.A NH2 ASN 427.A OD1 no hydrogen 2.870 N/A ASN 427.A N ILE 423.A O no hydrogen 2.674 N/A GLU 428.A N LEU 424.A O no hydrogen 2.946 N/A ASN 429.A N ARG 426.A O no hydrogen 2.889 N/A ARG 430.A N ALA 425.A O no hydrogen 3.247 N/A ARG 430.A NE GLU 435.A OE1 no hydrogen 2.898 N/A ARG 430.A NH2 GLU 435.A OE1 no hydrogen 2.630 N/A THR 434.A N ASP 431.A O no hydrogen 3.169 N/A THR 434.A N ASP 431.A OD2 no hydrogen 3.371 N/A THR 434.A OG1 ASP 431.A OD1 no hydrogen 3.023 N/A GLU 435.A N ASP 431.A O no hydrogen 2.958 N/A ILE 439.A N GLU 435.A O no hydrogen 2.833 N/A LEU 440.A N GLY 436.A O no hydrogen 3.121 N/A ARG 441.A N PRO 437.A O no hydrogen 3.019 N/A ARG 441.A NE GLU 438.A OE2 no hydrogen 2.995 N/A ARG 441.A NH2 GLU 438.A OE2 no hydrogen 2.755 N/A GLU 442.A N GLU 438.A O no hydrogen 2.720 N/A ALA 443.A N ILE 439.A O no hydrogen 3.120 N/A ALA 444.A N LEU 440.A O no hydrogen 2.730 N/A LYS 445.A N GLU 442.A O no hydrogen 2.904 N/A LYS 445.A NZ GLU 442.A OE2 no hydrogen 2.632 N/A THR 446.A N ALA 443.A O no hydrogen 3.160 N/A ARG 451.A N CYS 447.A O no hydrogen 2.971 N/A ARG 451.A NE ALA 444.A O no hydrogen 3.296 N/A ARG 451.A NH2 ALA 444.A O no hydrogen 3.455 N/A ARG 451.A NH2 LYS 445.A O no hydrogen 3.212 N/A THR 452.A N GLY 448.A O no hydrogen 3.050 N/A THR 452.A OG1 GLY 448.A O no hydrogen 3.298 N/A ALA 453.A N ALA 449.A O no hydrogen 3.199 N/A LEU 454.A N LEU 450.A O no hydrogen 3.088 N/A LEU 456.A N THR 452.A O no hydrogen 3.084 N/A TRP 457.A N ALA 453.A O no hydrogen 3.497 N/A LYS 458.A NZ ASP 459.A OD2 no hydrogen 3.469 N/A THR 461.A OG1 ASN 463.A OD1 no hydrogen 2.603 N/A THR 467.A N GLU 331.A OE1 no hydrogen 2.721 N/A THR 467.A OG1 ARG 298.A O no hydrogen 2.744 N/A ASP 468.A N GLU 331.A OE1 no hydrogen 3.354 N/A SER 470.A OG LEU 353.A O no hydrogen 2.917 N/A SER 470.A OG GLN 354.A O no hydrogen 3.148 N/A PHE 472.A N SER 470.A OG no hydrogen 3.266 N/A MET 18A.A N TYR 15.A O no hydrogen 3.137 N/A