Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3a6z_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 1.A N ASP 4.A OD1 no hydrogen 3.163 N/A GLY 1.A N ASP 4.A OD2 no hydrogen 2.876 N/A GLY 1.A N THR 333.A O no hydrogen 3.175 N/A VAL 2.A N THR 333.A OG1 no hydrogen 2.934 N/A TYR 3.A N TYR 330.A OH no hydrogen 2.976 N/A ASP 4.A N GLY 1.A O no hydrogen 2.996 N/A TYR 5.A N SER 13.A OG no hydrogen 2.713 N/A TYR 5.A OH LYS 245.A O no hydrogen 2.449 N/A LYS 6.A NZ SER 230.A O no hydrogen 3.162 N/A PHE 8.A N TYR 5.A O no hydrogen 3.105 N/A SER 13.A N GLY 9.A O no hydrogen 3.132 N/A SER 13.A OG TYR 5.A O no hydrogen 3.387 N/A SER 13.A OG PHE 8.A O no hydrogen 3.483 N/A SER 13.A OG GLY 9.A O no hydrogen 2.873 N/A LYS 14.A N THR 10.A O no hydrogen 3.121 N/A LYS 14.A NZ ILE 325.A O no hydrogen 3.137 N/A ALA 15.A N ALA 11.A O no hydrogen 3.104 N/A LEU 16.A N ASP 12.A O no hydrogen 2.960 N/A PHE 17.A N SER 13.A O no hydrogen 2.778 N/A SER 18.A N LYS 14.A O no hydrogen 2.870 N/A SER 18.A OG LYS 14.A O no hydrogen 3.281 N/A ASP 19.A N ALA 15.A O no hydrogen 3.138 N/A ALA 20.A N LEU 16.A O no hydrogen 2.934 N/A MET 21.A N PHE 17.A O no hydrogen 2.944 N/A ALA 22.A N SER 18.A O no hydrogen 2.977 N/A ILE 23.A N ASP 19.A O no hydrogen 2.946 N/A THR 24.A N ALA 20.A O no hydrogen 2.893 N/A THR 24.A OG1 ALA 20.A O no hydrogen 2.950 N/A THR 24.A OG1 SER 203.A OG no hydrogen 2.964 N/A LEU 25.A N MET 21.A O no hydrogen 2.767 N/A TYR 26.A N ALA 22.A O no hydrogen 2.993 N/A SER 27.A N ILE 23.A O no hydrogen 3.274 N/A SER 27.A OG THR 24.A O no hydrogen 2.783 N/A TYR 28.A N LEU 25.A O no hydrogen 3.237 N/A TYR 28.A OH HIS 205.A ND1 no hydrogen 2.790 N/A HIS 29.A N TYR 26.A O no hydrogen 2.915 N/A HIS 29.A NE2 GLU 121.A OE2 no hydrogen 2.918 N/A ASN 30.A ND2 SER 75.A O no hydrogen 2.757 N/A LEU 31.A N TYR 28.A O no hydrogen 3.318 N/A ASN 33.A N ASN 30.A O no hydrogen 3.059 N/A GLY 34.A N GLN 63.A O no hydrogen 2.879 N/A ALA 36.A N ASP 32.A O no hydrogen 2.830 N/A ALA 37.A N ASN 33.A O no hydrogen 3.013 N/A GLY 38.A N GLY 34.A O no hydrogen 3.004 N/A TYR 39.A N PHE 35.A O no hydrogen 2.834 N/A TYR 39.A OH ASN 343.A O no hydrogen 2.515 N/A GLN 40.A N ALA 36.A O no hydrogen 2.893 N/A GLN 40.A NE2 LEU 344.A O no hydrogen 3.047 N/A GLN 40.A NE2 ASP 346.A OD1 no hydrogen 2.878 N/A HIS 41.A N ALA 37.A O no hydrogen 3.149 N/A ASN 42.A N GLY 38.A O no hydrogen 2.837 N/A GLY 43.A N TYR 39.A O no hydrogen 2.803 N/A LEU 48.A N GLY 45.A O no hydrogen 3.126 N/A THR 51.A N GLY 47.A O no hydrogen 3.104 N/A THR 51.A OG1 GLY 43.A O no hydrogen 2.663 N/A LEU 52.A N LEU 48.A O no hydrogen 2.934 N/A VAL 53.A N PRO 49.A O no hydrogen 2.957 N/A THR 54.A N ALA 50.A O no hydrogen 3.282 N/A THR 54.A OG1 ALA 50.A O no hydrogen 2.984 N/A ALA 55.A N THR 51.A O no hydrogen 2.910 N/A LEU 56.A N LEU 52.A O no hydrogen 3.202 N/A LEU 56.A N VAL 53.A O no hydrogen 3.254 N/A LEU 57.A N VAL 53.A O no hydrogen 2.967 N/A GLY 58.A N THR 54.A O no hydrogen 2.789 N/A GLY 59.A N SER 62.A O no hydrogen 2.994 N/A GLN 63.A N ASN 33.A OD1 no hydrogen 2.882 N/A VAL 65.A N ALA 55.A O no hydrogen 2.897 N/A ILE 66.A N LEU 56.A O no hydrogen 2.818 N/A ASN 72.A N ILE 69.A O no hydrogen 3.221 N/A ASN 72.A ND2 LEU 57.A O no hydrogen 2.959 N/A ASN 72.A ND2 GLY 59.A O no hydrogen 2.845 N/A SER 75.A N GLN 63.A OE1 no hydrogen 3.277 N/A SER 75.A OG GLN 63.A OE1 no hydrogen 2.558 N/A LYS 77.A N ASP 74.A OD1 no hydrogen 3.371 N/A LEU 78.A N ASP 74.A O no hydrogen 3.065 N/A ALA 79.A N SER 75.A O no hydrogen 2.818 N/A LEU 80.A N GLU 76.A O no hydrogen 2.984 N/A ASP 81.A N LYS 77.A O no hydrogen 2.873 N/A ALA 82.A N LEU 78.A O no hydrogen 2.796 N/A VAL 83.A N ALA 79.A O no hydrogen 3.155 N/A LYS 84.A N LEU 80.A O no hydrogen 3.075 N/A LYS 85.A N ASP 81.A O no hydrogen 2.977 N/A ALA 86.A N ALA 82.A O no hydrogen 3.205 N/A GLY 87.A N LYS 84.A O no hydrogen 2.685 N/A TRP 88.A N VAL 83.A O no hydrogen 2.983 N/A TRP 88.A NE1 ASP 19.A OD1 no hydrogen 2.905 N/A THR 89.A N GLY 124.A O no hydrogen 2.863 N/A ILE 91.A N ILE 122.A O no hydrogen 2.828 N/A THR 92.A N GLN 95.A OE1 no hydrogen 3.244 N/A THR 92.A OG1 GLN 95.A OE1 no hydrogen 3.494 N/A GLN 95.A N THR 92.A OG1 no hydrogen 2.864 N/A GLN 95.A NE2 TYR 126.A OH no hydrogen 3.550 N/A LEU 96.A N THR 92.A O no hydrogen 3.350 N/A GLY 97.A N SER 94.A O no hydrogen 3.238 N/A TYR 98.A N ALA 93.A O no hydrogen 2.929 N/A TYR 98.A OH GLU 111.A OE2 no hydrogen 2.695 N/A ASP 99.A N ASP 99.A OD2 no hydrogen 2.441 N/A ASP 103.A N THR 107.A O no hydrogen 3.031 N/A ARG 105.A N ASP 103.A OD1 no hydrogen 3.106 N/A ARG 105.A NE GLU 76.A OE1 no hydrogen 2.919 N/A ARG 105.A NH1 GLU 76.A OE1 no hydrogen 3.026 N/A ARG 105.A NH1 GLU 147.A OE2 no hydrogen 2.584 N/A ARG 105.A NH2 ASP 103.A OD2 no hydrogen 2.994 N/A ARG 105.A NH2 GLU 147.A OE1 no hydrogen 3.019 N/A GLY 106.A N ASP 103.A O no hydrogen 2.796 N/A THR 107.A N ASP 103.A OD1 no hydrogen 3.272 N/A THR 107.A OG1 GLU 121.A OE2 no hydrogen 2.640 N/A PHE 108.A N VAL 120.A O no hydrogen 2.992 N/A PHE 109.A N LYS 101.A O no hydrogen 3.088 N/A GLY 110.A N ALA 118.A O no hydrogen 2.970 N/A GLU 111.A N ALA 178.A O no hydrogen 2.742 N/A LYS 112.A NZ GLU 177.A OE1 no hydrogen 3.047 N/A TYR 115.A N LYS 112.A O no hydrogen 2.843 N/A THR 117.A OG1 ASP 152.A O no hydrogen 3.434 N/A THR 117.A OG1 ASP 156.A OD2 no hydrogen 2.933 N/A ALA 118.A N TYR 115.A O no hydrogen 3.099 N/A GLN 119.A NE2 ASP 152.A OD1 no hydrogen 2.688 N/A VAL 120.A N PHE 108.A O no hydrogen 3.016 N/A GLU 121.A N ALA 138.A O no hydrogen 2.822 N/A LEU 123.A N GLY 136.A O no hydrogen 2.879 N/A GLY 124.A N THR 89.A O no hydrogen 2.777 N/A LYS 125.A N GLU 134.A O no hydrogen 2.966 N/A LYS 125.A NZ ASP 19.A OD2 no hydrogen 2.905 N/A LYS 125.A NZ GLU 134.A OE1 no hydrogen 2.782 N/A ASP 127.A N HIS 131.A O no hydrogen 2.865 N/A GLY 130.A N ASP 127.A O no hydrogen 2.929 N/A HIS 131.A N ASP 127.A OD1 no hydrogen 2.867 N/A THR 133.A N LYS 125.A O no hydrogen 2.751 N/A THR 133.A OG1 LYS 125.A O no hydrogen 3.295 N/A ILE 135.A N ASP 199.A O no hydrogen 2.958 N/A GLY 136.A N LEU 123.A O no hydrogen 2.696 N/A ILE 137.A N LEU 201.A O no hydrogen 2.826 N/A ALA 138.A N GLU 121.A O no hydrogen 2.989 N/A PHE 139.A N SER 203.A O no hydrogen 2.992 N/A ARG 140.A N GLN 119.A O no hydrogen 2.958 N/A ARG 140.A NE SER 143.A OG no hydrogen 3.116 N/A ARG 140.A NH2 SER 143.A OG no hydrogen 3.169 N/A THR 142.A OG1 ASP 160.A OD2 no hydrogen 2.728 N/A SER 143.A N ASP 156.A OD1 no hydrogen 2.870 N/A SER 143.A OG THR 142.A O no hydrogen 2.508 N/A ARG 146.A NE GLY 64.A O no hydrogen 2.796 N/A ARG 146.A NH1 HIS 29.A O no hydrogen 3.054 N/A ARG 146.A NH1 GLU 76.A OE2 no hydrogen 3.061 N/A ARG 146.A NH2 ASN 30.A O no hydrogen 3.024 N/A ARG 146.A NH2 GLY 64.A O no hydrogen 2.804 N/A GLU 147.A N GLU 147.A OE2 no hydrogen 2.797 N/A ASN 148.A N PRO 145.A O no hydrogen 3.023 N/A ASP 152.A N ASN 148.A O no hydrogen 2.875 N/A SER 153.A N LEU 149.A O no hydrogen 2.856 N/A SER 153.A OG LEU 149.A O no hydrogen 2.658 N/A ILE 154.A N ILE 150.A O no hydrogen 2.885 N/A GLY 155.A N LEU 151.A O no hydrogen 3.163 N/A ASP 156.A N ASP 152.A O no hydrogen 3.116 N/A VAL 157.A N SER 153.A O no hydrogen 2.956 N/A ILE 158.A N ILE 154.A O no hydrogen 3.184 N/A ASN 159.A N GLY 155.A O no hydrogen 3.212 N/A ASN 159.A ND2 GLY 114.A O no hydrogen 2.694 N/A ASP 160.A N ASP 156.A O no hydrogen 2.763 N/A LEU 161.A N VAL 157.A O no hydrogen 2.786 N/A LEU 162.A N ILE 158.A O no hydrogen 2.878 N/A ALA 163.A N ASN 159.A O no hydrogen 3.010 N/A ALA 164.A N LEU 161.A O no hydrogen 3.154 N/A PHE 165.A N LEU 161.A O no hydrogen 2.759 N/A GLY 166.A N LEU 162.A O no hydrogen 2.787 N/A TYR 170.A N PRO 167.A O no hydrogen 2.939 N/A ASN 173.A N ASP 169.A O no hydrogen 2.959 N/A TYR 174.A N ALA 171.A O no hydrogen 3.157 N/A VAL 175.A N SER 214.A OG no hydrogen 2.998 N/A GLU 177.A N ASN 173.A O no hydrogen 2.946 N/A ALA 178.A N TYR 174.A O no hydrogen 2.832 N/A PHE 179.A N VAL 175.A O no hydrogen 2.762 N/A ASN 181.A N GLU 111.A OE1 no hydrogen 3.152 N/A LEU 182.A N GLU 111.A OE2 no hydrogen 2.821 N/A LEU 183.A N PHE 179.A O no hydrogen 2.994 N/A ASN 184.A N GLY 180.A O no hydrogen 3.283 N/A ASP 185.A N ASN 181.A O no hydrogen 3.137 N/A VAL 186.A N LEU 182.A O no hydrogen 2.778 N/A VAL 187.A N LEU 183.A O no hydrogen 2.879 N/A ALA 188.A N ASN 184.A O no hydrogen 3.064 N/A PHE 189.A N ASP 185.A O no hydrogen 3.013 N/A ALA 190.A N VAL 186.A O no hydrogen 2.976 N/A LYS 191.A N VAL 187.A O no hydrogen 3.170 N/A ALA 192.A N ALA 188.A O no hydrogen 3.022 N/A ASN 193.A N ALA 190.A O no hydrogen 2.829 N/A ASN 193.A ND2 PHE 189.A O no hydrogen 2.818 N/A GLY 194.A N LYS 191.A O no hydrogen 2.757 N/A LEU 195.A N ALA 190.A O no hydrogen 2.891 N/A SER 196.A N ASP 199.A OD2 no hydrogen 2.971 N/A LYS 198.A NZ ASP 199.A OD1 no hydrogen 2.610 N/A ASP 199.A N SER 196.A O no hydrogen 3.148 N/A VAL 200.A N GLY 197.A O no hydrogen 3.215 N/A LEU 201.A N ILE 135.A O no hydrogen 2.899 N/A VAL 202.A N ASN 231.A O no hydrogen 2.578 N/A SER 203.A N ILE 137.A O no hydrogen 2.775 N/A SER 203.A OG ALA 20.A O no hydrogen 3.498 N/A SER 203.A OG THR 24.A OG1 no hydrogen 2.964 N/A SER 203.A OG ILE 233.A O no hydrogen 2.564 N/A HIS 205.A ND1 TYR 28.A OH no hydrogen 2.790 N/A SER 206.A N TYR 235.A O no hydrogen 2.831 N/A SER 206.A OG HIS 312.A NE2 no hydrogen 2.701 N/A GLY 208.A N HIS 205.A O no hydrogen 2.813 N/A LEU 210.A N SER 206.A O no hydrogen 2.870 N/A ALA 211.A N LEU 207.A O no hydrogen 3.096 N/A VAL 212.A N GLY 208.A O no hydrogen 3.030 N/A ASN 213.A N GLY 209.A O no hydrogen 3.253 N/A ASN 213.A ND2 GLY 209.A O no hydrogen 2.729 N/A SER 214.A N LEU 210.A O no hydrogen 2.824 N/A SER 214.A OG ALA 171.A O no hydrogen 3.230 N/A SER 214.A OG LYS 172.A O no hydrogen 2.524 N/A MET 215.A N ALA 211.A O no hydrogen 2.896 N/A ALA 216.A N VAL 212.A O no hydrogen 3.073 N/A ASP 217.A N ASN 213.A O no hydrogen 2.983 N/A LEU 218.A N SER 214.A O no hydrogen 2.955 N/A SER 219.A N ALA 216.A O no hydrogen 3.193 N/A SER 219.A OG ALA 216.A O no hydrogen 2.725 N/A GLY 221.A N LEU 218.A O no hydrogen 3.116 N/A LYS 222.A N LEU 218.A O no hydrogen 2.987 N/A TRP 223.A NE1 GLY 180.A O no hydrogen 2.906 N/A GLY 225.A N LYS 222.A O no hydrogen 2.921 N/A PHE 226.A N TRP 223.A O no hydrogen 3.142 N/A ALA 228.A N GLY 225.A O no hydrogen 3.193 N/A SER 230.A N PHE 227.A O no hydrogen 2.995 N/A SER 230.A OG GLY 197.A O no hydrogen 2.779 N/A SER 230.A OG PHE 227.A O no hydrogen 3.022 N/A ASN 231.A N VAL 200.A O no hydrogen 2.943 N/A ASN 231.A ND2 LYS 198.A O no hydrogen 3.323 N/A ASN 231.A ND2 VAL 200.A O no hydrogen 3.612 N/A TYR 232.A N TYR 5.A OH no hydrogen 3.067 N/A TYR 232.A OH PHE 227.A O no hydrogen 2.736 N/A ILE 233.A N VAL 202.A O no hydrogen 3.090 N/A ALA 234.A N LEU 247.A O no hydrogen 2.780 N/A TYR 235.A N GLY 204.A O no hydrogen 2.950 N/A ALA 236.A N VAL 249.A O no hydrogen 2.818 N/A SER 237.A OG THR 239.A O no hydrogen 2.670 N/A THR 239.A N SER 237.A OG no hydrogen 3.010 N/A THR 239.A OG1 SER 237.A OG no hydrogen 3.071 N/A GLN 240.A N GLY 262.A O no hydrogen 2.819 N/A GLN 240.A NE2 LEU 260.A O no hydrogen 2.951 N/A SER 241.A N ASN 213.A OD1 no hydrogen 2.928 N/A SER 241.A OG ASP 217.A OD1 no hydrogen 2.717 N/A SER 241.A OG THR 243.A OG1 no hydrogen 2.772 N/A SER 242.A N ASP 217.A OD1 no hydrogen 3.024 N/A THR 243.A N SER 241.A OG no hydrogen 2.767 N/A THR 243.A OG1 SER 241.A OG no hydrogen 2.772 N/A LYS 245.A N THR 243.A OG1 no hydrogen 3.199 N/A LYS 245.A NZ ALA 228.A O no hydrogen 2.997 N/A LEU 247.A N TYR 232.A O no hydrogen 2.926 N/A ASN 248.A N SER 279.A O no hydrogen 2.957 N/A VAL 249.A N ALA 234.A O no hydrogen 2.803 N/A GLY 250.A N THR 281.A OG1 no hydrogen 3.330 N/A TYR 251.A N TYR 317.A OH no hydrogen 3.100 N/A TYR 251.A OH ALA 316.A O no hydrogen 2.668 N/A GLU 252.A N ILE 284.A O no hydrogen 2.638 N/A ASN 253.A N ASN 253.A OD1 no hydrogen 2.701 N/A ASN 253.A ND2 SER 286.A O no hydrogen 2.996 N/A ASP 254.A N TYR 251.A O no hydrogen 2.892 N/A VAL 256.A N ASP 254.A OD1 no hydrogen 2.877 N/A PHE 257.A N ASP 254.A O no hydrogen 3.123 N/A ARG 258.A N SER 237.A O no hydrogen 2.871 N/A ARG 258.A NE PHE 257.A O no hydrogen 3.422 N/A ARG 258.A NH1 ASP 274.A OD1 no hydrogen 3.061 N/A ARG 258.A NH2 ASP 274.A OD1 no hydrogen 2.973 N/A ALA 259.A N VAL 256.A O no hydrogen 3.158 N/A LEU 260.A N PRO 238.A O no hydrogen 2.781 N/A ASP 261.A N THR 264.A O no hydrogen 3.097 N/A THR 264.A N ASP 261.A O no hydrogen 3.088 N/A THR 264.A OG1 ASP 261.A O no hydrogen 3.354 N/A THR 266.A N SER 269.A OG no hydrogen 2.925 N/A SER 269.A N THR 266.A O no hydrogen 3.067 N/A SER 269.A OG ALA 259.A O no hydrogen 2.681 N/A GLY 271.A N ALA 268.A O no hydrogen 2.733 N/A HIS 273.A ND1 HIS 273.A O no hydrogen 3.013 N/A LYS 277.A N ASP 282.A OD1 no hydrogen 3.290 N/A SER 279.A OG ASN 248.A OD1 no hydrogen 3.152 N/A ALA 280.A N LYS 277.A O no hydrogen 2.993 N/A THR 281.A N ASN 248.A O no hydrogen 3.151 N/A THR 281.A OG1 GLY 250.A O no hydrogen 3.356 N/A ASP 282.A N ASP 336.A OD1 no hydrogen 3.117 N/A ASN 283.A ND2 ASP 336.A O no hydrogen 2.857 N/A VAL 285.A N ILE 339.A O no hydrogen 2.787 N/A SER 286.A N ASN 253.A OD1 no hydrogen 2.997 N/A PHE 287.A N VAL 341.A O no hydrogen 2.833 N/A ASN 288.A ND2 SER 311.A OG no hydrogen 2.985 N/A ASP 289.A N TYR 39.A OH no hydrogen 3.105 N/A TYR 291.A N ASN 288.A OD1 no hydrogen 2.925 N/A ALA 292.A N ASN 288.A O no hydrogen 3.021 N/A SER 293.A N HIS 290.A O no hydrogen 3.037 N/A TRP 296.A N SER 293.A OG no hydrogen 3.008 N/A TRP 296.A NE1 PHE 44.A O no hydrogen 2.702 N/A ASN 297.A N SER 293.A O no hydrogen 3.390 N/A ASN 297.A N THR 294.A O no hydrogen 3.155 N/A LEU 298.A N ALA 295.A O no hydrogen 3.098 N/A LEU 299.A N TRP 296.A O no hydrogen 3.145 N/A SER 302.A OG VAL 270.A O no hydrogen 2.796 N/A LEU 304.A N SER 302.A OG no hydrogen 2.922 N/A ASN 305.A N SER 302.A O no hydrogen 2.883 N/A THR 308.A N ASN 305.A O no hydrogen 3.102 N/A THR 308.A OG1 SER 302.A O no hydrogen 2.991 N/A THR 308.A OG1 ASN 305.A O no hydrogen 2.626 N/A TRP 309.A N ILE 306.A O no hydrogen 2.803 N/A TRP 309.A NE1 ILE 303.A O no hydrogen 2.792 N/A ILE 310.A N PRO 307.A O no hydrogen 3.279 N/A HIS 312.A N TRP 309.A O no hydrogen 2.831 N/A HIS 312.A ND1 ASP 254.A OD1 no hydrogen 3.079 N/A HIS 312.A ND1 ASP 254.A OD2 no hydrogen 2.818 N/A HIS 312.A NE2 SER 206.A OG no hydrogen 2.701 N/A LEU 313.A N ILE 310.A O no hydrogen 3.250 N/A THR 315.A N ASP 32.A OD2 no hydrogen 3.007 N/A THR 315.A OG1 ASP 32.A OD1 no hydrogen 2.734 N/A THR 315.A OG1 ASP 32.A OD2 no hydrogen 3.504 N/A TYR 317.A N LEU 313.A O no hydrogen 3.409 N/A TYR 317.A OH ASP 254.A OD2 no hydrogen 2.661 N/A GLY 318.A N PRO 314.A O no hydrogen 2.943 N/A ASP 319.A N THR 315.A O no hydrogen 2.909 N/A GLY 320.A N ALA 316.A O no hydrogen 2.997 N/A MET 321.A N TYR 317.A O no hydrogen 2.845 N/A ASN 322.A N GLY 318.A O no hydrogen 3.147 N/A ASN 322.A ND2 GLU 326.A OE2 no hydrogen 2.889 N/A ARG 323.A N ASP 319.A O no hydrogen 3.334 N/A ARG 323.A NE ASP 319.A O no hydrogen 3.397 N/A ARG 323.A NE ASP 319.A OD2 no hydrogen 3.379 N/A ARG 323.A NH1 ALA 342.A O no hydrogen 2.869 N/A ARG 323.A NH1 GLY 372.A O no hydrogen 2.844 N/A ARG 323.A NH2 ASP 319.A OD2 no hydrogen 2.812 N/A ARG 323.A NH2 ALA 342.A O no hydrogen 3.004 N/A ARG 323.A NH2 ASN 343.A OD1 no hydrogen 2.943 N/A ILE 324.A N GLY 320.A O no hydrogen 3.259 N/A ILE 325.A N MET 321.A O no hydrogen 3.099 N/A GLU 326.A N ASN 322.A O no hydrogen 2.852 N/A SER 327.A N ILE 324.A O no hydrogen 3.256 N/A SER 327.A OG GLU 389.A OE1 no hydrogen 2.799 N/A LYS 328.A N GLU 389.A OE2 no hydrogen 3.010 N/A PHE 329.A N SER 327.A OG no hydrogen 2.886 N/A TYR 330.A N SER 327.A O no hydrogen 3.043 N/A LEU 332.A N PHE 329.A O no hydrogen 2.848 N/A THR 333.A N TYR 330.A O no hydrogen 2.926 N/A THR 333.A OG1 TYR 330.A O no hydrogen 2.574 N/A SER 334.A N SER 337.A OG no hydrogen 2.715 N/A LYS 335.A NZ GLU 278.A O no hydrogen 3.128 N/A LYS 335.A NZ SER 279.A O no hydrogen 3.447 N/A SER 337.A N SER 334.A O no hydrogen 2.814 N/A SER 337.A OG SER 334.A O no hydrogen 3.182 N/A THR 338.A OG1 LYS 365.A O no hydrogen 3.517 N/A ILE 339.A N ASN 283.A O no hydrogen 2.958 N/A ILE 340.A N PHE 369.A O no hydrogen 2.613 N/A VAL 341.A N VAL 285.A O no hydrogen 3.005 N/A ALA 342.A N ILE 371.A O no hydrogen 2.832 N/A ASN 343.A N PHE 287.A O no hydrogen 2.753 N/A ASN 343.A ND2 TYR 251.A OH no hydrogen 3.394 N/A ASN 343.A ND2 SER 286.A OG no hydrogen 2.693 N/A SER 345.A N ASP 289.A OD1 no hydrogen 2.828 N/A SER 345.A OG ASP 289.A OD1 no hydrogen 3.401 N/A SER 345.A OG ASP 289.A OD2 no hydrogen 2.497 N/A ASP 346.A N GLN 40.A O no hydrogen 2.791 N/A ALA 348.A N SER 345.A OG no hydrogen 3.317 N/A ARG 349.A N SER 345.A O no hydrogen 2.828 N/A ARG 349.A NH2 ASP 346.A OD1 no hydrogen 3.003 N/A ALA 350.A N ASP 346.A O no hydrogen 3.373 N/A ASN 351.A N ALA 348.A O no hydrogen 3.126 N/A THR 352.A OG1 ALA 348.A O no hydrogen 2.727 N/A THR 352.A OG1 ASN 351.A OD1 no hydrogen 2.791 N/A VAL 354.A N LEU 378.A O no hydrogen 2.791 N/A GLN 355.A NE2 TRP 353.A O no hydrogen 3.443 N/A LEU 357.A N GLN 355.A O no hydrogen 3.079 N/A ASN 358.A ND2 ASN 358.A O no hydrogen 2.806 N/A ASN 358.A ND2 GLU 362.A O no hydrogen 2.944 N/A ARG 359.A N TYR 291.A OH no hydrogen 3.215 N/A ARG 359.A NE TYR 291.A O no hydrogen 2.711 N/A ARG 359.A NH2 TYR 291.A O no hydrogen 3.478 N/A GLU 362.A N ASP 274.A OD2 no hydrogen 2.680 N/A HIS 364.A N ASN 358.A OD1 no hydrogen 3.013 N/A HIS 364.A ND1 ASP 356.A OD2 no hydrogen 2.754 N/A HIS 364.A NE2 GLU 252.A OE1 no hydrogen 2.721 N/A HIS 364.A NE2 GLU 252.A OE2 no hydrogen 3.115 N/A SER 367.A OG ALA 613.A O no hydrogen 2.573 N/A THR 368.A N ASN 385.A O no hydrogen 2.998 N/A PHE 369.A N THR 338.A O no hydrogen 2.934 N/A ILE 370.A N TYR 387.A O no hydrogen 2.784 N/A ILE 371.A N ILE 340.A O no hydrogen 2.716 N/A GLY 372.A N GLU 389.A O no hydrogen 2.697 N/A SER 373.A N ASP 377.A OD2 no hydrogen 2.791 N/A SER 373.A OG SER 375.A O no hydrogen 3.479 N/A SER 373.A OG ASP 377.A OD1 no hydrogen 2.464 N/A SER 373.A OG ASP 377.A OD2 no hydrogen 3.446 N/A SER 375.A N SER 373.A OG no hydrogen 3.173 N/A ASP 377.A N ASP 395.A OD1 no hydrogen 2.709 N/A ILE 379.A N THR 396.A O no hydrogen 2.937 N/A GLN 380.A N VAL 354.A O no hydrogen 2.770 N/A GLN 380.A NE2 GLY 381.A O no hydrogen 2.966 N/A GLY 381.A N ARG 398.A O no hydrogen 2.803 N/A GLY 382.A N ASP 386.A OD1 no hydrogen 3.038 N/A ASP 386.A N TYR 403.A O no hydrogen 3.213 N/A ASP 386.A N ASN 404.A OD1 no hydrogen 3.122 N/A TYR 387.A N THR 368.A O no hydrogen 2.788 N/A TYR 387.A OH ALA 613.A O no hydrogen 2.819 N/A LEU 388.A N VAL 405.A O no hydrogen 2.850 N/A GLU 389.A N ILE 370.A O no hydrogen 2.940 N/A GLY 390.A N LEU 407.A O no hydrogen 2.949 N/A ARG 391.A NE ASP 374.A OD1 no hydrogen 2.820 N/A ARG 391.A NH1 GLU 326.A OE1 no hydrogen 2.949 N/A ARG 391.A NH2 GLU 326.A OE1 no hydrogen 2.806 N/A ARG 391.A NH2 ASP 374.A OD2 no hydrogen 2.799 N/A ALA 392.A N ASP 374.A OD1 no hydrogen 3.290 N/A ASN 394.A N ASN 376.A OD1 no hydrogen 2.742 N/A ASP 395.A N ASN 413.A OD1 no hydrogen 3.004 N/A THR 396.A N ASP 377.A O no hydrogen 2.930 N/A PHE 397.A N THR 414.A O no hydrogen 2.703 N/A ARG 398.A N ILE 379.A O no hydrogen 2.742 N/A ARG 398.A NE ASP 416.A OD2 no hydrogen 2.933 N/A ARG 398.A NH2 ASP 416.A OD2 no hydrogen 3.183 N/A GLY 400.A N GLY 381.A O no hydrogen 3.268 N/A GLY 400.A N GLY 382.A O no hydrogen 3.173 N/A GLY 401.A N ASP 399.A OD2 no hydrogen 3.005 N/A TYR 403.A N ASN 385.A OD1 no hydrogen 2.871 N/A TYR 403.A OH GLY 441.A O no hydrogen 3.407 N/A ASN 404.A N ILE 443.A O no hydrogen 2.976 N/A ASN 404.A ND2 GLY 401.A O no hydrogen 3.264 N/A ASN 404.A ND2 SER 444.A OG no hydrogen 2.792 N/A VAL 405.A N ASP 386.A O no hydrogen 2.921 N/A ILE 406.A N ILE 445.A O no hydrogen 2.964 N/A LEU 407.A N LEU 388.A O no hydrogen 2.959 N/A GLY 408.A N ARG 447.A O no hydrogen 2.814 N/A ASN 412.A N ASN 394.A OD1 no hydrogen 2.818 N/A ASN 413.A ND2 GLY 409.A O no hydrogen 2.997 N/A ASN 413.A ND2 ALA 410.A O no hydrogen 3.176 N/A ASN 413.A ND2 ASP 448.A O no hydrogen 2.962 N/A THR 414.A N ASP 395.A O no hydrogen 2.907 N/A LEU 415.A N SER 451.A O no hydrogen 2.965 N/A ASP 416.A N PHE 397.A O no hydrogen 2.756 N/A LEU 417.A N VAL 453.A O no hydrogen 2.824 N/A GLN 418.A N ASP 416.A OD1 no hydrogen 3.061 N/A SER 420.A OG GLU 456.A OE1 no hydrogen 3.011 N/A VAL 421.A N GLU 456.A OE2 no hydrogen 2.854 N/A ASN 422.A N SER 420.A OG no hydrogen 3.061 N/A THR 423.A N SER 420.A O no hydrogen 3.037 N/A THR 423.A OG1 SER 420.A O no hydrogen 2.803 N/A PHE 424.A N VAL 421.A O no hydrogen 3.238 N/A ASP 425.A N ARG 437.A O no hydrogen 2.763 N/A ALA 427.A N TYR 435.A O no hydrogen 3.009 N/A ASN 428.A ND2 TYR 483.A OH no hydrogen 3.366 N/A ASP 429.A N ASN 433.A O no hydrogen 3.293 N/A GLY 430.A N ASN 428.A OD1 no hydrogen 2.872 N/A ALA 431.A N ASP 429.A OD1 no hydrogen 2.742 N/A ASN 433.A N ASP 429.A OD1 no hydrogen 3.215 N/A ASN 433.A ND2 ASP 429.A OD2 no hydrogen 2.741 N/A LEU 434.A N THR 446.A O no hydrogen 2.888 N/A TYR 435.A N ALA 427.A O no hydrogen 2.880 N/A TYR 435.A OH ASP 429.A OD2 no hydrogen 3.401 N/A VAL 436.A N SER 444.A O no hydrogen 2.845 N/A ARG 437.A N ASP 425.A O no hydrogen 2.797 N/A ARG 437.A NH2 ASP 425.A OD2 no hydrogen 3.290 N/A ASP 438.A N GLY 442.A O no hydrogen 2.923 N/A ASN 440.A N ASP 438.A OD1 no hydrogen 2.706 N/A GLY 441.A N ASP 438.A O no hydrogen 2.954 N/A GLY 442.A N ASP 438.A OD1 no hydrogen 3.182 N/A SER 444.A N VAL 436.A O no hydrogen 2.733 N/A ILE 445.A N ASN 404.A O no hydrogen 2.837 N/A THR 446.A N LEU 434.A O no hydrogen 2.698 N/A THR 446.A OG1 LEU 434.A O no hydrogen 3.088 N/A ARG 447.A N ILE 406.A O no hydrogen 2.973 N/A ARG 447.A NH1 ALA 431.A O no hydrogen 2.957 N/A ARG 447.A NH1 ASN 433.A OD1 no hydrogen 2.810 N/A GLY 450.A N ASN 413.A O no hydrogen 3.229 N/A ILE 452.A N HIS 467.A O no hydrogen 2.777 N/A VAL 453.A N LEU 415.A O no hydrogen 2.796 N/A THR 454.A N VAL 465.A O no hydrogen 3.130 N/A THR 454.A OG1 GLU 456.A OE2 no hydrogen 2.505 N/A LYS 455.A N LYS 419.A O no hydrogen 2.809 N/A LYS 455.A NZ ASP 464.A OD1 no hydrogen 2.966 N/A GLU 456.A N ASP 463.A O no hydrogen 3.058 N/A PHE 459.A N GLU 456.A O no hydrogen 3.294 N/A LEU 460.A N GLU 456.A O no hydrogen 2.884 N/A GLY 462.A N LEU 460.A O no hydrogen 2.196 N/A VAL 465.A N THR 454.A O no hydrogen 3.032 N/A HIS 467.A N ILE 452.A O no hydrogen 2.749 N/A HIS 467.A ND1 ILE 452.A O no hydrogen 3.211 N/A SER 468.A N LYS 475.A O no hydrogen 2.986 N/A VAL 469.A N GLY 450.A O no hydrogen 2.823 N/A THR 470.A N GLY 473.A O no hydrogen 3.178 N/A THR 470.A OG1 SER 472.A OG no hydrogen 3.357 N/A THR 470.A OG1 GLY 473.A O no hydrogen 2.791 N/A SER 472.A N THR 470.A OG1 no hydrogen 3.233 N/A SER 472.A OG THR 470.A OG1 no hydrogen 3.357 N/A GLY 473.A N THR 470.A O no hydrogen 3.346 N/A LEU 474.A N THR 481.A O no hydrogen 2.925 N/A LYS 475.A N SER 468.A O no hydrogen 3.002 N/A LYS 475.A NZ SER 472.A OG no hydrogen 2.932 N/A VAL 476.A N ASN 479.A O no hydrogen 2.735 N/A ASN 479.A N VAL 476.A O no hydrogen 2.855 N/A ASN 479.A ND2 VAL 476.A O no hydrogen 3.060 N/A THR 481.A N LEU 474.A O no hydrogen 2.757 N/A TYR 483.A OH THR 470.A O no hydrogen 2.533 N/A ASP 484.A N PHE 426.A O no hydrogen 2.779 N/A SER 486.A OG ASP 484.A O no hydrogen 3.075 N/A VAL 487.A N TRP 504.A O no hydrogen 2.890 N/A GLY 489.A N PHE 506.A O no hydrogen 2.876 N/A THR 490.A N ASP 494.A OD1 no hydrogen 3.290 N/A THR 490.A N ASP 494.A OD2 no hydrogen 2.789 N/A THR 490.A OG1 ASP 494.A OD1 no hydrogen 2.456 N/A THR 490.A OG1 ASP 494.A OD2 no hydrogen 3.540 N/A GLY 492.A N THR 490.A OG1 no hydrogen 3.048 N/A ASP 494.A N ASP 512.A OD2 no hydrogen 2.891 N/A LEU 496.A N HIS 513.A O no hydrogen 2.922 N/A ALA 498.A N ILE 515.A O no hydrogen 2.963 N/A HIS 499.A N ASP 503.A OD2 no hydrogen 2.612 N/A HIS 499.A ND1 ASP 503.A OD2 no hydrogen 2.951 N/A GLY 502.A N HIS 499.A O no hydrogen 3.044 N/A ASP 503.A N ASP 521.A OD1 no hydrogen 2.996 N/A TRP 504.A N ALA 485.A O no hydrogen 2.903 N/A LEU 505.A N VAL 522.A O no hydrogen 2.708 N/A PHE 506.A N VAL 487.A O no hydrogen 3.029 N/A GLY 507.A N VAL 524.A O no hydrogen 2.912 N/A ASP 512.A N ASP 530.A OD1 no hydrogen 2.886 N/A HIS 513.A N ASP 494.A O no hydrogen 2.888 N/A HIS 513.A NE2 GLU 533.A OE2 no hydrogen 2.456 N/A LEU 514.A N LEU 531.A O no hydrogen 2.791 N/A ILE 515.A N LEU 496.A O no hydrogen 2.738 N/A GLY 516.A N GLU 533.A O no hydrogen 2.623 N/A GLY 517.A N ASP 521.A OD2 no hydrogen 2.974 N/A ASP 521.A N ASP 539.A OD1 no hydrogen 2.808 N/A VAL 522.A N ASP 503.A O no hydrogen 3.063 N/A PHE 523.A N THR 540.A O no hydrogen 2.738 N/A VAL 524.A N LEU 505.A O no hydrogen 2.730 N/A ASN 529.A N ASN 511.A OD1 no hydrogen 2.702 N/A ASP 530.A N ASP 550.A OD1 no hydrogen 2.903 N/A LEU 531.A N ASP 512.A O no hydrogen 2.787 N/A MET 532.A N ARG 551.A O no hydrogen 2.817 N/A GLU 533.A N LEU 514.A O no hydrogen 2.938 N/A SER 534.A N VAL 553.A O no hydrogen 2.858 N/A SER 534.A OG GLY 536.A O no hydrogen 3.373 N/A SER 534.A OG ASP 539.A OD2 no hydrogen 2.626 N/A GLY 536.A N SER 534.A OG no hydrogen 2.983 N/A ALA 538.A N ASN 520.A OD1 no hydrogen 2.896 N/A ASP 539.A N ASP 559.A OD1 no hydrogen 2.712 N/A THR 540.A N ASP 521.A O no hydrogen 2.881 N/A PHE 541.A N LYS 560.A O no hydrogen 2.864 N/A LEU 542.A N PHE 523.A O no hydrogen 2.926 N/A PHE 543.A N VAL 562.A O no hydrogen 2.928 N/A ASN 544.A ND2 LEU 564.A O no hydrogen 3.342 N/A GLY 545.A N GLY 565.A O no hydrogen 2.693 N/A GLY 548.A N ASP 593.A OD1 no hydrogen 2.906 N/A GLN 549.A N ASN 529.A OD1 no hydrogen 2.969 N/A ASP 550.A N SER 594.A O no hydrogen 2.905 N/A ARG 551.A N ASP 530.A O no hydrogen 2.902 N/A VAL 552.A N THR 596.A O no hydrogen 2.695 N/A VAL 553.A N MET 532.A O no hydrogen 2.656 N/A THR 556.A N ASP 559.A OD2 no hydrogen 2.550 N/A THR 556.A OG1 ASN 558.A OD1 no hydrogen 3.097 N/A THR 556.A OG1 ASP 559.A OD2 no hydrogen 3.088 N/A ASP 559.A N THR 556.A O no hydrogen 3.120 N/A LYS 560.A N ASP 539.A O no hydrogen 2.927 N/A LYS 560.A NZ TYR 403.A OH no hydrogen 3.354 N/A LEU 561.A N GLY 609.A O no hydrogen 2.847 N/A VAL 562.A N PHE 541.A O no hydrogen 2.814 N/A PHE 563.A N VAL 611.A O no hydrogen 2.777 N/A LEU 564.A N PHE 543.A O no hydrogen 3.074 N/A GLY 565.A N TYR 387.A OH no hydrogen 2.825 N/A GLN 567.A NE2 ASP 331.A O no hydrogen 3.588 N/A ASP 573.A N LEU 570.A O no hydrogen 2.780 N/A ALA 577.A N ASP 574.A O no hydrogen 3.156 N/A HIS 578.A N PHE 575.A O no hydrogen 2.791 N/A HIS 578.A NE2 GLY 568.A O no hydrogen 2.959 N/A SER 580.A N VAL 587.A O no hydrogen 2.955 N/A VAL 582.A N ASP 585.A O no hydrogen 2.797 N/A ASP 585.A N VAL 582.A O no hydrogen 3.138 N/A THR 586.A N LEU 597.A O no hydrogen 3.427 N/A THR 586.A OG1 VAL 600.A O no hydrogen 2.701 N/A VAL 587.A N SER 580.A O no hydrogen 2.790 N/A LEU 588.A N VAL 595.A O no hydrogen 2.765 N/A LYS 589.A N HIS 578.A O no hydrogen 2.911 N/A PHE 590.A N ASP 593.A O no hydrogen 2.916 N/A ASP 593.A N PHE 590.A O no hydrogen 2.884 N/A SER 594.A N GLY 548.A O no hydrogen 2.792 N/A VAL 595.A N LEU 588.A O no hydrogen 2.829 N/A THR 596.A N ASP 550.A O no hydrogen 2.901 N/A LEU 597.A N THR 586.A O no hydrogen 2.824 N/A VAL 598.A N VAL 552.A O no hydrogen 2.960 N/A GLY 599.A N ASP 585.A OD1 no hydrogen 2.713 N/A VAL 600.A N LEU 597.A O no hydrogen 3.083 N/A SER 604.A N ALA 601.A O no hydrogen 2.990 N/A SER 604.A OG ALA 601.A O no hydrogen 2.891 N/A LEU 605.A N LEU 602.A O no hydrogen 3.314 N/A ASP 608.A N SER 606.A OG no hydrogen 3.226 N/A GLY 609.A N SER 606.A O no hydrogen 2.852 N/A ILE 610.A N ALA 607.A O no hydrogen 3.189 N/A VAL 611.A N LEU 561.A O no hydrogen 2.975 N/A ALA 613.A N PHE 563.A O no hydrogen 2.814 N/A