Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1peo_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 7.A N ASP 4.A OD1 no hydrogen 3.242 N/A LEU 8.A N ASP 4.A O no hydrogen 2.932 N/A ASN 9.A N TYR 5.A O no hydrogen 2.638 N/A ALA 10.A N HIS 6.A O no hydrogen 2.708 N/A MET 11.A N ALA 7.A O no hydrogen 3.151 N/A MET 11.A N LEU 8.A O no hydrogen 3.025 N/A LEU 12.A N ASN 9.A O no hydrogen 2.762 N/A ASN 13.A N ALA 10.A O no hydrogen 2.754 N/A LEU 14.A N MET 11.A O no hydrogen 3.174 N/A ASP 16.A N HIS 20.A O no hydrogen 3.193 N/A ALA 18.A N ASP 16.A OD2 no hydrogen 2.986 N/A GLY 19.A N ASP 16.A O no hydrogen 2.564 N/A HIS 20.A N ASP 16.A OD2 no hydrogen 2.733 N/A ILE 21.A N ASN 611.A OD1 no hydrogen 2.713 N/A PHE 23.A N ILE 21.A O no hydrogen 2.828 N/A LYS 25.A N GLN 22.A O no hydrogen 2.837 N/A ASP 26.A N PHE 23.A O no hydrogen 3.006 N/A GLN 28.A N ASP 24.A O no hydrogen 2.988 N/A ALA 29.A N LYS 25.A O no hydrogen 3.067 N/A ILE 30.A N ASP 26.A O no hydrogen 3.105 N/A ASP 31.A N GLN 27.A O no hydrogen 3.084 N/A ALA 32.A N GLN 28.A O no hydrogen 2.988 N/A PHE 33.A N ALA 29.A O no hydrogen 2.800 N/A PHE 34.A N ILE 30.A O no hydrogen 2.924 N/A ALA 35.A N ASP 31.A O no hydrogen 3.043 N/A THR 36.A N ALA 32.A O no hydrogen 2.758 N/A HIS 37.A N PHE 33.A O no hydrogen 2.809 N/A HIS 37.A NE2 TYR 111.A OH no hydrogen 2.639 N/A VAL 38.A N PHE 33.A O no hydrogen 3.047 N/A ARG 39.A N PHE 34.A O no hydrogen 2.778 N/A HIS 41.A N VAL 38.A O no hydrogen 2.509 N/A SER 42.A N ARG 39.A O no hydrogen 3.245 N/A SER 42.A OG VAL 38.A O no hydrogen 2.268 N/A SER 42.A OG ARG 39.A O no hydrogen 3.246 N/A VAL 43.A N TYR 111.A O no hydrogen 3.071 N/A GLU 50.A N SER 47.A OG no hydrogen 3.005 N/A ARG 51.A N SER 47.A O no hydrogen 3.042 N/A ARG 51.A NH1 GLN 48.A OE1 no hydrogen 3.384 N/A ARG 51.A NH2 TYR 61.A OH no hydrogen 3.054 N/A ARG 51.A NH2 LEU 112.A O no hydrogen 2.897 N/A LEU 52.A N GLN 48.A O no hydrogen 2.850 N/A GLY 53.A N HIS 49.A O no hydrogen 3.119 N/A THR 54.A N GLU 50.A O no hydrogen 2.788 N/A THR 54.A OG1 GLU 50.A O no hydrogen 3.228 N/A LEU 55.A N ARG 51.A O no hydrogen 2.666 N/A VAL 56.A N LEU 52.A O no hydrogen 2.737 N/A ARG 57.A N GLY 53.A O no hydrogen 2.769 N/A GLU 58.A N THR 54.A O no hydrogen 2.855 N/A GLY 59.A N VAL 56.A O no hydrogen 3.007 N/A TYR 60.A N LEU 55.A O no hydrogen 3.096 N/A TYR 61.A N LEU 55.A O no hydrogen 3.271 N/A TYR 61.A OH GLU 113.A OE1 no hydrogen 2.611 N/A ASP 62.A N GLY 157.A O no hydrogen 2.889 N/A ALA 64.A N ASP 62.A OD2 no hydrogen 2.856 N/A VAL 65.A N ASP 62.A O no hydrogen 3.044 N/A ALA 67.A N ASP 63.A O no hydrogen 3.052 N/A ARG 68.A N VAL 65.A O no hydrogen 3.253 N/A ARG 68.A NE GLN 128.A O no hydrogen 3.439 N/A ARG 68.A NH2 GLN 128.A O no hydrogen 3.336 N/A TYR 69.A N LEU 66.A O no hydrogen 3.043 N/A TYR 69.A OH LEU 124.A O no hydrogen 2.649 N/A VAL 74.A N ASP 70.A O no hydrogen 3.198 N/A ARG 76.A N ALA 72.A O no hydrogen 2.781 N/A LEU 77.A N PHE 73.A O no hydrogen 3.111 N/A GLU 79.A N LEU 75.A O no hydrogen 3.137 N/A GLU 79.A N ARG 76.A O no hydrogen 2.948 N/A HIS 80.A N ARG 76.A O no hydrogen 2.945 N/A HIS 80.A NE2 ASP 139.A OD2 no hydrogen 2.951 N/A ALA 81.A N LEU 77.A O no hydrogen 2.862 N/A HIS 82.A N PHE 78.A O no hydrogen 2.943 N/A HIS 82.A NE2 ASP 117.A OD1 no hydrogen 2.970 N/A ALA 83.A N HIS 80.A O no hydrogen 2.800 N/A SER 84.A N ALA 81.A O no hydrogen 3.087 N/A SER 84.A OG ALA 81.A O no hydrogen 2.753 N/A PHE 91.A N ASP 26.A OD1 no hydrogen 3.208 N/A GLY 93.A N THR 90.A OG1 no hydrogen 3.105 N/A ALA 94.A N THR 90.A O no hydrogen 3.184 N/A TRP 95.A N PHE 91.A O no hydrogen 3.080 N/A LYS 96.A N LEU 92.A O no hydrogen 2.736 N/A LYS 96.A NZ GLU 596.A OE1 no hydrogen 2.793 N/A LYS 96.A NZ GLU 596.A OE2 no hydrogen 3.544 N/A PHE 97.A N GLY 93.A O no hydrogen 3.105 N/A TYR 98.A N ALA 94.A O no hydrogen 3.218 N/A TYR 98.A OH HIS 114.A ND1 no hydrogen 2.556 N/A THR 99.A N TRP 95.A O no hydrogen 2.963 N/A THR 99.A OG1 TRP 95.A O no hydrogen 2.418 N/A THR 99.A OG1 LYS 96.A O no hydrogen 2.926 N/A SER 100.A N LYS 96.A O no hydrogen 2.904 N/A TYR 101.A N PHE 97.A O no hydrogen 2.847 N/A TYR 101.A OH THR 150.A OG1 no hydrogen 2.977 N/A THR 102.A N PHE 97.A O no hydrogen 2.620 N/A LEU 103.A N GLU 113.A OE2 no hydrogen 3.201 N/A LYS 104.A NZ GLY 108.A O no hydrogen 3.566 N/A THR 105.A N ARG 110.A O no hydrogen 2.832 N/A THR 105.A OG1 ASP 107.A OD1 no hydrogen 2.275 N/A THR 105.A OG1 ARG 110.A O no hydrogen 3.509 N/A PHE 106.A N TYR 60.A OH no hydrogen 3.088 N/A GLY 108.A N THR 105.A O no hydrogen 2.801 N/A LYS 109.A N ASP 107.A OD1 no hydrogen 3.048 N/A TYR 111.A N HIS 41.A O no hydrogen 2.754 N/A TYR 111.A OH HIS 37.A NE2 no hydrogen 2.639 N/A LEU 112.A N LEU 103.A O no hydrogen 2.858 N/A HIS 114.A N ASP 117.A OD2 no hydrogen 2.703 N/A GLU 116.A N GLU 116.A OE1 no hydrogen 2.358 N/A ASP 117.A N HIS 114.A O no hydrogen 3.008 N/A ARG 118.A N HIS 114.A O no hydrogen 3.187 N/A ARG 118.A NE GLU 113.A OE1 no hydrogen 3.400 N/A ARG 118.A NE GLU 113.A OE2 no hydrogen 2.726 N/A ARG 118.A NH1 PHE 153.A O no hydrogen 2.902 N/A ARG 118.A NH1 CYS 156.A O no hydrogen 3.004 N/A ARG 118.A NH2 GLU 113.A OE1 no hydrogen 2.846 N/A ARG 118.A NH2 GLU 113.A OE2 no hydrogen 3.452 N/A ARG 118.A NH2 CYS 156.A O no hydrogen 3.099 N/A VAL 119.A N PHE 115.A O no hydrogen 2.888 N/A THR 120.A N GLU 116.A O no hydrogen 2.772 N/A THR 120.A OG1 GLU 116.A O no hydrogen 2.862 N/A MET 121.A N ASP 117.A O no hydrogen 2.814 N/A VAL 122.A N ARG 118.A O no hydrogen 2.981 N/A ALA 123.A N VAL 119.A O no hydrogen 2.853 N/A LEU 124.A N THR 120.A O no hydrogen 2.608 N/A THR 125.A N MET 121.A O no hydrogen 2.850 N/A THR 125.A OG1 MET 121.A O no hydrogen 2.947 N/A LEU 126.A N VAL 122.A O no hydrogen 2.932 N/A ALA 127.A N ALA 123.A O no hydrogen 3.084 N/A ALA 127.A N LEU 124.A O no hydrogen 3.186 N/A GLN 128.A N LEU 124.A O no hydrogen 3.258 N/A GLN 128.A N THR 125.A O no hydrogen 3.244 N/A GLY 129.A N TYR 69.A OH no hydrogen 2.761 N/A ASP 130.A N ALA 127.A O no hydrogen 2.676 N/A THR 132.A OG1 ASP 130.A OD2 no hydrogen 3.315 N/A LEU 133.A N ASP 130.A OD2 no hydrogen 2.790 N/A ALA 134.A N ASP 130.A O no hydrogen 2.785 N/A THR 135.A N GLU 131.A O no hydrogen 2.759 N/A THR 135.A N THR 132.A O no hydrogen 2.827 N/A THR 135.A OG1 GLU 131.A O no hydrogen 2.987 N/A GLN 136.A N THR 132.A O no hydrogen 2.937 N/A LEU 137.A N LEU 133.A O no hydrogen 3.024 N/A THR 138.A N ALA 134.A O no hydrogen 3.154 N/A THR 138.A OG1 ALA 134.A O no hydrogen 2.618 N/A ASP 139.A N THR 135.A O no hydrogen 2.894 N/A GLU 140.A N GLN 136.A O no hydrogen 2.603 N/A MET 141.A N LEU 137.A O no hydrogen 2.971 N/A LEU 142.A N THR 138.A O no hydrogen 2.993 N/A LEU 142.A N ASP 139.A O no hydrogen 3.040 N/A SER 143.A N ASP 139.A O no hydrogen 2.927 N/A SER 143.A OG ASP 139.A O no hydrogen 2.925 N/A SER 143.A OG GLU 140.A O no hydrogen 2.907 N/A GLY 144.A N MET 141.A O no hydrogen 3.200 N/A ARG 145.A N SER 143.A OG no hydrogen 3.286 N/A ARG 145.A NE GLU 140.A OE1 no hydrogen 2.814 N/A ARG 145.A NE GLU 140.A OE2 no hydrogen 3.171 N/A ARG 145.A NH2 GLU 140.A OE2 no hydrogen 2.732 N/A PHE 146.A N GLU 140.A O no hydrogen 3.051 N/A GLN 147.A N SER 401.A O no hydrogen 2.913 N/A ALA 149.A N LEU 399.A O no hydrogen 2.942 N/A THR 150.A OG1 TYR 101.A OH no hydrogen 2.977 N/A THR 152.A OG1 LEU 164.A O no hydrogen 2.830 N/A PHE 153.A N ALA 149.A O no hydrogen 2.926 N/A LEU 154.A N THR 150.A O no hydrogen 2.904 N/A ASN 155.A N PRO 151.A O no hydrogen 3.370 N/A ASN 155.A N THR 152.A O no hydrogen 3.149 N/A ASN 155.A ND2 GLU 163.A O no hydrogen 2.894 N/A CYS 156.A N THR 152.A O no hydrogen 3.111 N/A CYS 156.A SG THR 152.A O no hydrogen 3.546 N/A LYS 158.A N ASN 155.A O no hydrogen 2.960 N/A LYS 158.A NZ TYR 101.A O no hydrogen 3.036 N/A LYS 158.A NZ LEU 154.A O no hydrogen 2.621 N/A GLN 159.A N TYR 60.A O no hydrogen 2.872 N/A ARG 161.A NH1 GLY 162.A O no hydrogen 2.960 N/A PHE 168.A N GLY 195.A O no hydrogen 2.724 N/A LEU 169.A N ILE 395.A O no hydrogen 2.688 N/A LEU 170.A N ALA 197.A O no hydrogen 2.840 N/A ARG 171.A N ASP 394.A OD1 no hydrogen 2.839 N/A ARG 171.A NH1 GLU 173.A OE1 no hydrogen 2.917 N/A ARG 171.A NH2 ASP 306.A OD1 no hydrogen 3.001 N/A GLU 173.A N SER 178.A OG no hydrogen 2.727 N/A ASN 175.A N GLU 173.A O no hydrogen 2.641 N/A SER 178.A N ASN 175.A OD1 no hydrogen 2.956 N/A ILE 179.A N ASN 175.A O no hydrogen 3.151 N/A GLY 180.A N MET 176.A O no hydrogen 2.692 N/A ARG 181.A N GLU 177.A O no hydrogen 2.887 N/A ARG 181.A NE LEU 386.A O no hydrogen 3.185 N/A ARG 181.A NH2 LEU 386.A O no hydrogen 2.438 N/A ALA 182.A N SER 178.A O no hydrogen 2.699 N/A VAL 183.A N ILE 179.A O no hydrogen 3.015 N/A ASN 184.A N GLY 180.A O no hydrogen 2.835 N/A ASN 184.A ND2 GLN 188.A OE1 no hydrogen 3.147 N/A SER 185.A N ARG 181.A O no hydrogen 2.776 N/A SER 185.A OG ARG 181.A O no hydrogen 3.120 N/A ALA 186.A N ALA 182.A O no hydrogen 2.944 N/A LEU 187.A N VAL 183.A O no hydrogen 3.055 N/A GLN 188.A N ASN 184.A O no hydrogen 3.003 N/A LEU 189.A N SER 185.A O no hydrogen 2.736 N/A SER 190.A N ALA 186.A O no hydrogen 2.946 N/A SER 190.A OG ALA 234.A O no hydrogen 2.253 N/A LYS 191.A N LEU 187.A O no hydrogen 2.858 N/A ARG 192.A N LEU 189.A O no hydrogen 3.005 N/A GLY 193.A N SER 190.A O no hydrogen 2.950 N/A GLY 194.A N LEU 189.A O no hydrogen 3.165 N/A GLY 195.A N SER 166.A O no hydrogen 2.836 N/A VAL 196.A N ALA 243.A O no hydrogen 3.206 N/A ALA 197.A N PHE 168.A O no hydrogen 2.856 N/A PHE 198.A N ALA 245.A O no hydrogen 2.716 N/A LEU 199.A N LEU 170.A O no hydrogen 3.132 N/A LEU 200.A N TYR 247.A O no hydrogen 2.981 N/A ASN 202.A ND2 ILE 172.A O no hydrogen 3.027 N/A LEU 203.A N LEU 200.A O no hydrogen 3.173 N/A ARG 204.A N ASP 174.A OD2 no hydrogen 2.675 N/A ARG 204.A NE ASP 174.A OD1 no hydrogen 2.722 N/A ARG 204.A NH1 PRO 209.A O no hydrogen 3.028 N/A ARG 204.A NH2 ASP 174.A OD1 no hydrogen 2.622 N/A GLU 205.A N GLU 205.A OE2 no hydrogen 2.890 N/A ALA 206.A N ASP 254.A OD1 no hydrogen 2.945 N/A ALA 206.A N ASP 254.A OD2 no hydrogen 3.170 N/A GLY 207.A N SER 217.A O no hydrogen 3.067 N/A ALA 208.A N GLU 205.A O no hydrogen 3.152 N/A ILE 210.A N ILE 213.A O no hydrogen 3.427 N/A ILE 213.A N ILE 210.A O no hydrogen 3.242 N/A GLN 216.A N ALA 208.A O no hydrogen 2.833 N/A SER 217.A N ALA 208.A O no hydrogen 2.545 N/A SER 217.A OG ARG 204.A O no hydrogen 3.386 N/A SER 217.A OG GLU 205.A O no hydrogen 3.094 N/A GLY 219.A N SER 217.A OG no hydrogen 3.160 N/A VAL 220.A N ASP 254.A OD2 no hydrogen 3.337 N/A MET 224.A N VAL 220.A O no hydrogen 2.686 N/A LYS 225.A N ILE 221.A O no hydrogen 2.587 N/A LYS 225.A NZ ASP 229.A OD2 no hydrogen 3.066 N/A MET 226.A N PRO 222.A O no hydrogen 3.284 N/A MET 226.A N VAL 223.A O no hydrogen 2.985 N/A LEU 227.A N VAL 223.A O no hydrogen 3.138 N/A GLU 228.A N MET 224.A O no hydrogen 2.933 N/A ASP 229.A N LYS 225.A O no hydrogen 3.171 N/A ALA 230.A N MET 226.A O no hydrogen 2.870 N/A PHE 231.A N LEU 227.A O no hydrogen 2.970 N/A SER 232.A N GLU 228.A O no hydrogen 2.899 N/A TYR 233.A N ASP 229.A O no hydrogen 2.724 N/A ALA 234.A N ALA 230.A O no hydrogen 2.848 N/A ASN 235.A N TYR 233.A O no hydrogen 3.083 N/A ALA 245.A N VAL 196.A O no hydrogen 3.152 N/A VAL 246.A N SER 269.A O no hydrogen 3.022 N/A TYR 247.A N PHE 198.A O no hydrogen 2.705 N/A TYR 247.A OH ASN 368.A O no hydrogen 2.531 N/A LEU 248.A N GLY 271.A O no hydrogen 3.026 N/A HIS 249.A N SER 201.A OG no hydrogen 2.650 N/A HIS 249.A NE2 GLU 351.A OE1 no hydrogen 2.596 N/A ALA 250.A N VAL 273.A O no hydrogen 2.912 N/A HIS 251.A N HIS 249.A ND1 no hydrogen 2.969 N/A HIS 251.A ND1 ALA 289.A O no hydrogen 3.032 N/A HIS 252.A N HIS 249.A O no hydrogen 2.980 N/A HIS 252.A NE2 LEU 203.A O no hydrogen 3.042 N/A ASP 254.A N HIS 252.A ND1 no hydrogen 3.006 N/A ILE 255.A N HIS 252.A O no hydrogen 2.749 N/A PHE 258.A N ASP 254.A O no hydrogen 2.866 N/A LEU 259.A N ILE 255.A O no hydrogen 3.018 N/A ASP 260.A N LEU 256.A O no hydrogen 3.073 N/A THR 261.A N PHE 258.A O no hydrogen 3.099 N/A THR 261.A OG1 PHE 258.A O no hydrogen 2.624 N/A LYS 262.A N LEU 259.A O no hydrogen 3.131 N/A LYS 262.A NZ ILE 265.A O no hydrogen 2.234 N/A LYS 262.A NZ LEU 268.A O no hydrogen 3.026 N/A ARG 263.A N ASP 260.A O no hydrogen 3.448 N/A ARG 263.A NH1 GLU 338.A OE2 no hydrogen 3.511 N/A ARG 263.A NH2 GLU 338.A OE2 no hydrogen 2.671 N/A ILE 265.A N THR 261.A O no hydrogen 3.434 N/A THR 267.A N GLU 228.A OE2 no hydrogen 3.138 N/A THR 267.A OG1 GLU 228.A OE1 no hydrogen 2.833 N/A LEU 268.A N GLU 228.A OE2 no hydrogen 3.001 N/A SER 269.A N GLY 244.A O no hydrogen 2.997 N/A SER 269.A OG GLY 244.A O no hydrogen 3.424 N/A SER 269.A OG TYR 345.A OH no hydrogen 2.845 N/A SER 269.A OG TYR 347.A OH no hydrogen 3.250 N/A GLY 271.A N VAL 246.A O no hydrogen 3.081 N/A VAL 272.A N TYR 347.A O no hydrogen 2.848 N/A VAL 273.A N LEU 248.A O no hydrogen 3.014 N/A ILE 274.A N MET 349.A O no hydrogen 3.058 N/A ASP 276.A N ASP 352.A OD1 no hydrogen 2.591 N/A THR 278.A OG1 HIS 251.A NE2 no hydrogen 2.933 N/A THR 278.A OG1 PRO 275.A O no hydrogen 3.392 N/A PHE 279.A N ASP 276.A O no hydrogen 2.675 N/A ARG 280.A N ASP 276.A O no hydrogen 2.957 N/A ARG 280.A NE GLU 284.A OE2 no hydrogen 3.504 N/A LEU 281.A N ILE 277.A O no hydrogen 2.674 N/A ALA 282.A N THR 278.A O no hydrogen 3.172 N/A LYS 283.A N PHE 279.A O no hydrogen 3.058 N/A GLU 284.A N ARG 280.A O no hydrogen 3.230 N/A ASN 285.A N LYS 283.A O no hydrogen 2.677 N/A ALA 286.A N LEU 281.A O no hydrogen 2.803 N/A MET 288.A N ILE 327.A O no hydrogen 2.609 N/A ALA 289.A N TYR 313.A OH no hydrogen 2.588 N/A LEU 290.A N THR 325.A O no hydrogen 2.662 N/A SER 292.A N ARG 323.A O no hydrogen 3.159 N/A SER 292.A OG GLU 205.A OE1 no hydrogen 3.138 N/A SER 292.A OG GLU 205.A OE2 no hydrogen 2.879 N/A ASP 295.A N SER 292.A OG no hydrogen 2.909 N/A ILE 296.A N SER 292.A O no hydrogen 2.757 N/A GLN 297.A N PRO 293.A O no hydrogen 3.134 N/A GLN 297.A N TYR 294.A O no hydrogen 3.139 N/A ARG 298.A N TYR 294.A O no hydrogen 3.452 N/A ARG 299.A N ASP 295.A O no hydrogen 2.858 N/A ARG 299.A NE HIS 321.A ND1 no hydrogen 2.911 N/A ARG 299.A NH1 ARG 299.A O no hydrogen 3.421 N/A TYR 300.A N ILE 296.A O no hydrogen 2.877 N/A GLY 301.A N GLN 297.A O no hydrogen 2.464 N/A GLY 305.A N ASN 202.A OD1 no hydrogen 2.694 N/A ASP 306.A N PRO 303.A O no hydrogen 2.462 N/A ILE 307.A N PHE 304.A O no hydrogen 3.264 N/A SER 310.A OG ASP 352.A OD1 no hydrogen 2.528 N/A ARG 312.A N ILE 309.A O no hydrogen 2.755 N/A TYR 313.A N SER 310.A O no hydrogen 3.296 N/A LEU 316.A N ARG 312.A O no hydrogen 2.759 N/A ILE 317.A N TYR 313.A O no hydrogen 2.636 N/A ALA 318.A N ASP 314.A O no hydrogen 2.768 N/A ASP 319.A N GLU 315.A O no hydrogen 2.922 N/A ASP 319.A N LEU 316.A O no hydrogen 3.121 N/A HIS 321.A N ASP 319.A OD1 no hydrogen 2.551 N/A VAL 322.A N ASP 319.A O no hydrogen 3.020 N/A ARG 323.A N ASP 295.A OD2 no hydrogen 2.911 N/A LYS 324.A NZ LEU 316.A O no hydrogen 2.431 N/A LYS 324.A NZ ILE 317.A O no hydrogen 2.786 N/A LYS 324.A NZ ASP 319.A O no hydrogen 2.490 N/A LYS 324.A NZ VAL 322.A O no hydrogen 3.113 N/A THR 325.A N LEU 290.A O no hydrogen 2.865 N/A ILE 327.A N MET 288.A O no hydrogen 3.155 N/A ALA 329.A N ALA 286.A O no hydrogen 3.435 N/A ARG 330.A N ASN 328.A OD1 no hydrogen 3.182 N/A ARG 330.A NE ALA 282.A O no hydrogen 2.922 N/A ARG 330.A NH2 ALA 282.A O no hydrogen 2.886 N/A ARG 330.A NH2 LYS 283.A O no hydrogen 2.513 N/A PHE 332.A N ASN 328.A O no hydrogen 3.055 N/A PHE 332.A N ALA 329.A O no hydrogen 2.911 N/A PHE 333.A N ALA 329.A O no hydrogen 3.275 N/A GLN 334.A N ARG 330.A O no hydrogen 3.245 N/A THR 335.A N ASP 331.A O no hydrogen 2.738 N/A THR 335.A OG1 ASP 331.A O no hydrogen 2.794 N/A LEU 336.A N PHE 332.A O no hydrogen 2.721 N/A ALA 337.A N PHE 333.A O no hydrogen 3.045 N/A GLU 338.A N GLN 334.A O no hydrogen 3.015 N/A ILE 339.A N THR 335.A O no hydrogen 3.088 N/A GLN 340.A N LEU 336.A O no hydrogen 3.012 N/A GLN 340.A NE2 PRO 346.A O no hydrogen 3.283 N/A PHE 341.A N ALA 337.A O no hydrogen 2.687 N/A GLU 342.A N GLU 338.A O no hydrogen 2.983 N/A SER 343.A N ILE 339.A O no hydrogen 2.705 N/A SER 343.A N GLN 340.A O no hydrogen 3.127 N/A SER 343.A OG ILE 339.A O no hydrogen 3.060 N/A GLY 344.A N GLN 340.A O no hydrogen 2.709 N/A TYR 347.A N LEU 270.A O no hydrogen 3.059 N/A ILE 348.A N LEU 673.A O no hydrogen 2.738 N/A MET 349.A N VAL 272.A O no hydrogen 3.147 N/A PHE 350.A N LYS 671.A O no hydrogen 3.058 N/A GLU 351.A N MET 349.A O no hydrogen 2.626 N/A VAL 354.A N PHE 350.A O no hydrogen 3.109 N/A ASN 355.A N GLU 351.A O no hydrogen 2.919 N/A ASN 355.A ND2 ILE 364.A O no hydrogen 3.680 N/A ARG 356.A N ASP 352.A O no hydrogen 3.042 N/A ARG 356.A NH2 ASP 276.A OD2 no hydrogen 3.288 N/A ALA 357.A N THR 353.A O no hydrogen 2.950 N/A ALA 357.A N VAL 354.A O no hydrogen 2.947 N/A ASN 358.A N ASN 355.A O no hydrogen 3.188 N/A ILE 360.A N ASN 358.A OD1 no hydrogen 2.482 N/A ILE 364.A N ASN 355.A OD1 no hydrogen 2.669 N/A ASN 365.A ND2 GLY 305.A O no hydrogen 3.243 N/A SER 367.A OG ASN 368.A OD1 no hydrogen 3.385 N/A SER 367.A OG ILE 373.A O no hydrogen 2.815 N/A ASN 368.A N SER 367.A OG no hydrogen 2.500 N/A ASN 368.A ND2 GLU 372.A OE1 no hydrogen 2.903 N/A SER 371.A N ASN 368.A O no hydrogen 2.981 N/A SER 371.A OG CYS 370.A O no hydrogen 2.561 N/A ILE 373.A N ASN 368.A OD1 no hydrogen 3.133 N/A GLN 375.A NE2 GLN 641.A OE1 no hydrogen 2.758 N/A SER 378.A N HIS 393.A O no hydrogen 2.716 N/A ARG 381.A N HIS 390.A O no hydrogen 2.744 N/A ASP 383.A N ASP 387.A O no hydrogen 2.663 N/A ASN 385.A N ASP 383.A OD1 no hydrogen 2.793 N/A LEU 386.A N ASP 383.A O no hydrogen 2.647 N/A ASP 387.A N ASN 385.A OD1 no hydrogen 2.769 N/A THR 389.A N ARG 381.A O no hydrogen 2.815 N/A THR 389.A OG1 ARG 381.A O no hydrogen 3.038 N/A HIS 390.A N ARG 381.A O no hydrogen 3.053 N/A GLY 392.A N SER 380.A OG no hydrogen 2.747 N/A HIS 393.A N SER 378.A O no hydrogen 3.169 N/A HIS 393.A N SER 378.A OG no hydrogen 2.964 N/A ASP 394.A N SER 438.A O no hydrogen 2.856 N/A ILE 395.A N LEU 169.A O no hydrogen 3.152 N/A CYS 397.A N CYS 167.A O no hydrogen 2.995 N/A CYS 397.A SG CYS 167.A O no hydrogen 2.824 N/A ASN 398.A ND2 ASN 443.A OD1 no hydrogen 3.433 N/A ASN 398.A ND2 ALA 448.A O no hydrogen 2.975 N/A SER 401.A N GLN 147.A O no hydrogen 2.970 N/A LEU 402.A N GLY 452.A O no hydrogen 3.043 N/A ASN 403.A N ARG 145.A O no hydrogen 3.363 N/A ASN 403.A ND2 ASN 578.A OD1 no hydrogen 3.124 N/A ILE 404.A N MET 454.A O no hydrogen 2.949 N/A ALA 405.A N ASN 403.A OD1 no hydrogen 2.630 N/A HIS 406.A N ASN 403.A OD1 no hydrogen 3.287 N/A VAL 407.A N ASN 403.A O no hydrogen 2.831 N/A MET 408.A N ILE 404.A O no hydrogen 2.887 N/A ASP 409.A N ALA 405.A O no hydrogen 2.827 N/A SER 410.A N VAL 407.A O no hydrogen 2.843 N/A ILE 413.A N PRO 411.A O no hydrogen 2.831 N/A ARG 415.A N ASP 412.A O no hydrogen 2.888 N/A ARG 415.A N ASP 412.A OD2 no hydrogen 3.011 N/A THR 416.A N ASP 412.A O no hydrogen 3.088 N/A THR 416.A OG1 GLU 140.A OE1 no hydrogen 2.999 N/A THR 416.A OG1 ASP 412.A O no hydrogen 3.367 N/A VAL 417.A N ILE 413.A O no hydrogen 3.025 N/A GLU 418.A N GLY 414.A O no hydrogen 3.111 N/A THR 419.A N ARG 415.A O no hydrogen 2.988 N/A THR 419.A OG1 ARG 415.A O no hydrogen 3.128 N/A ILE 421.A N VAL 417.A O no hydrogen 3.072 N/A ARG 422.A N GLU 418.A O no hydrogen 2.702 N/A ARG 422.A NE GLU 418.A OE1 no hydrogen 2.386 N/A ARG 422.A NH1 GLU 497.A OE1 no hydrogen 3.181 N/A ARG 422.A NH2 GLU 418.A OE1 no hydrogen 2.999 N/A ARG 422.A NH2 GLU 497.A OE2 no hydrogen 2.508 N/A GLY 423.A N THR 419.A O no hydrogen 2.536 N/A LEU 424.A N ALA 420.A O no hydrogen 2.672 N/A THR 425.A N ILE 421.A O no hydrogen 3.002 N/A THR 425.A OG1 ILE 421.A O no hydrogen 2.623 N/A THR 425.A OG1 ASN 562.A OD1 no hydrogen 2.929 N/A ALA 426.A N ARG 422.A O no hydrogen 3.118 N/A VAL 427.A N GLY 423.A O no hydrogen 3.002 N/A SER 428.A N LEU 424.A O no hydrogen 2.951 N/A ASP 429.A N THR 425.A O no hydrogen 2.812 N/A MET 430.A N ALA 426.A O no hydrogen 2.847 N/A SER 431.A N SER 428.A O no hydrogen 2.951 N/A SER 438.A OG ASP 394.A OD2 no hydrogen 2.833 N/A ILE 439.A N VAL 436.A O no hydrogen 2.772 N/A ALA 440.A N VAL 436.A O no hydrogen 3.307 N/A ALA 441.A N PRO 437.A O no hydrogen 2.818 N/A GLY 442.A N SER 438.A O no hydrogen 3.216 N/A ASN 443.A N ILE 439.A O no hydrogen 3.016 N/A ASN 443.A ND2 SER 428.A O no hydrogen 2.797 N/A ASN 443.A ND2 SER 428.A OG no hydrogen 2.715 N/A ALA 444.A N ALA 440.A O no hydrogen 3.035 N/A ALA 445.A N ALA 441.A O no hydrogen 2.920 N/A ALA 445.A N GLY 442.A O no hydrogen 3.159 N/A SER 446.A N GLY 442.A O no hydrogen 3.041 N/A SER 446.A N ASN 443.A O no hydrogen 3.050 N/A SER 446.A OG GLY 442.A O no hydrogen 2.931 N/A SER 446.A OG ASN 443.A O no hydrogen 3.522 N/A HIS 447.A N ASN 443.A O no hydrogen 2.826 N/A ALA 448.A N SER 446.A OG no hydrogen 3.137 N/A ILE 449.A N ASN 564.A O no hydrogen 2.871 N/A GLY 450.A N ASN 398.A O no hydrogen 2.999 N/A LEU 451.A N LEU 565.A O no hydrogen 2.708 N/A GLY 452.A N GLY 400.A O no hydrogen 2.802 N/A ASN 455.A ND2 ASN 403.A OD1 no hydrogen 3.164 N/A TYR 459.A N ASN 455.A O no hydrogen 2.563 N/A LEU 460.A N LEU 456.A O no hydrogen 2.907 N/A ALA 461.A N HIS 457.A O no hydrogen 3.038 N/A ARG 462.A N GLY 458.A O no hydrogen 3.241 N/A ARG 462.A NE GLU 463.A OE1 no hydrogen 2.931 N/A ARG 462.A NH1 ASP 409.A OD1 no hydrogen 3.286 N/A ARG 462.A NH1 ASP 409.A OD2 no hydrogen 3.441 N/A ARG 462.A NH2 ASP 409.A OD2 no hydrogen 3.246 N/A ARG 462.A NH2 GLU 463.A OE1 no hydrogen 2.855 N/A GLU 463.A N TYR 459.A O no hydrogen 2.967 N/A GLY 464.A N ALA 461.A O no hydrogen 2.438 N/A ILE 465.A N LEU 460.A O no hydrogen 2.958 N/A TYR 467.A OH ILE 584.A O no hydrogen 2.911 N/A TYR 467.A OH THR 631.A OG1 no hydrogen 3.393 N/A SER 469.A N ALA 466.A O no hydrogen 2.966 N/A ALA 472.A N SER 469.A OG no hydrogen 2.707 N/A LEU 473.A N SER 469.A O no hydrogen 2.638 N/A ASP 474.A N PRO 470.A O no hydrogen 2.852 N/A PHE 475.A N GLU 471.A O no hydrogen 2.833 N/A THR 476.A N ALA 472.A O no hydrogen 2.880 N/A ASN 477.A N LEU 473.A O no hydrogen 3.032 N/A LEU 478.A N ASP 474.A O no hydrogen 3.316 N/A LEU 478.A N PHE 475.A O no hydrogen 2.910 N/A TYR 479.A N PHE 475.A O no hydrogen 2.889 N/A TYR 479.A OH GLN 453.A OE1 no hydrogen 2.680 N/A PHE 480.A N THR 476.A O no hydrogen 3.356 N/A TYR 481.A N ASN 477.A O no hydrogen 3.144 N/A TYR 481.A OH PRO 543.A O no hydrogen 2.658 N/A THR 482.A N LEU 478.A O no hydrogen 2.691 N/A ILE 483.A N TYR 479.A O no hydrogen 2.701 N/A THR 484.A N PHE 480.A O no hydrogen 2.851 N/A THR 484.A OG1 PHE 480.A O no hydrogen 3.391 N/A TRP 485.A N TYR 481.A O no hydrogen 3.144 N/A HIS 486.A N THR 482.A O no hydrogen 3.283 N/A ALA 487.A N ILE 483.A O no hydrogen 3.091 N/A VAL 488.A N THR 484.A O no hydrogen 3.315 N/A HIS 489.A N TRP 485.A O no hydrogen 3.108 N/A THR 490.A N HIS 486.A O no hydrogen 2.864 N/A THR 490.A OG1 HIS 486.A O no hydrogen 2.752 N/A SER 491.A N ALA 487.A O no hydrogen 2.887 N/A MET 492.A N VAL 488.A O no hydrogen 3.124 N/A ARG 493.A N HIS 489.A O no hydrogen 2.924 N/A LEU 494.A N THR 490.A O no hydrogen 2.854 N/A ALA 495.A N SER 491.A O no hydrogen 3.083 N/A ARG 496.A N MET 492.A O no hydrogen 3.204 N/A ARG 496.A NH2 TYR 558.A OH no hydrogen 3.496 N/A GLU 497.A N ARG 493.A O no hydrogen 2.982 N/A ARG 498.A N LEU 494.A O no hydrogen 2.686 N/A ARG 498.A NH1 ASP 429.A OD2 no hydrogen 2.545 N/A THR 501.A OG1 PHE 502.A O no hydrogen 3.091 N/A PHE 502.A N ILE 560.A O no hydrogen 3.416 N/A ALA 503.A N ALA 445.A O no hydrogen 2.974 N/A PHE 505.A N PHE 502.A O no hydrogen 3.046 N/A GLN 507.A N GLY 504.A O no hydrogen 2.408 N/A SER 508.A N PHE 505.A O no hydrogen 2.483 N/A SER 508.A OG PHE 505.A O no hydrogen 2.743 N/A ARG 509.A N PRO 359.A O no hydrogen 3.002 N/A ARG 509.A NH2 ARG 356.A O no hydrogen 2.975 N/A TYR 510.A N SER 508.A OG no hydrogen 2.845 N/A ALA 511.A N SER 508.A OG no hydrogen 2.981 N/A GLY 513.A N ARG 509.A O no hydrogen 2.986 N/A GLY 513.A N TYR 510.A O no hydrogen 3.231 N/A ASP 514.A N SER 512.A OG no hydrogen 3.061 N/A TYR 515.A N ARG 509.A O no hydrogen 2.960 N/A PHE 516.A N GLY 513.A O no hydrogen 2.693 N/A THR 517.A N ASP 514.A O no hydrogen 3.317 N/A THR 517.A OG1 ASP 514.A O no hydrogen 3.281 N/A TYR 519.A N PHE 516.A O no hydrogen 2.257 N/A TYR 519.A OH HIS 638.A ND1 no hydrogen 2.554 N/A LEU 520.A N PHE 516.A O no hydrogen 3.118 N/A LEU 520.A N THR 517.A O no hydrogen 3.221 N/A GLN 525.A N ASP 523.A O no hydrogen 2.361 N/A LYS 527.A N ASP 474.A OD1 no hydrogen 3.068 N/A LYS 527.A NZ ASP 474.A OD1 no hydrogen 2.922 N/A LYS 530.A NZ GLU 463.A O no hydrogen 3.352 N/A ARG 532.A N THR 528.A O no hydrogen 2.974 N/A ARG 532.A NH2 GLN 525.A OE1 no hydrogen 3.105 N/A ALA 533.A N ALA 529.A O no hydrogen 2.832 N/A LEU 534.A N LYS 530.A O no hydrogen 2.920 N/A PHE 535.A N VAL 531.A O no hydrogen 3.290 N/A ALA 536.A N ARG 532.A O no hydrogen 3.189 N/A ARG 537.A N ALA 533.A O no hydrogen 2.799 N/A ARG 537.A NH1 GLU 463.A OE2 no hydrogen 3.275 N/A ARG 537.A NH2 GLU 463.A OE2 no hydrogen 3.353 N/A SER 538.A N LEU 534.A O no hydrogen 2.875 N/A SER 538.A OG MET 408.A O no hydrogen 3.225 N/A SER 538.A OG LEU 534.A O no hydrogen 3.120 N/A GLY 539.A N ALA 536.A O no hydrogen 2.903 N/A ILE 540.A N PHE 535.A O no hydrogen 2.969 N/A ARG 545.A NH1 LEU 520.A O no hydrogen 2.781 N/A MET 547.A N THR 544.A OG1 no hydrogen 3.162 N/A TRP 548.A N THR 544.A O no hydrogen 2.988 N/A TRP 548.A NE1 TYR 481.A OH no hydrogen 2.943 N/A LEU 549.A N ARG 545.A O no hydrogen 2.822 N/A LYS 550.A N GLU 546.A O no hydrogen 2.846 N/A LEU 551.A N MET 547.A O no hydrogen 2.830 N/A ARG 552.A N TRP 548.A O no hydrogen 2.811 N/A ASP 553.A N LEU 549.A O no hydrogen 3.412 N/A ASP 554.A N LYS 550.A O no hydrogen 3.042 N/A VAL 555.A N LEU 551.A O no hydrogen 2.864 N/A MET 556.A N ARG 552.A O no hydrogen 2.975 N/A ARG 557.A N ASP 553.A O no hydrogen 2.912 N/A ARG 557.A N ASP 554.A O no hydrogen 3.250 N/A TYR 558.A N ASP 554.A O no hydrogen 2.612 N/A GLY 559.A N VAL 555.A O no hydrogen 2.739 N/A TYR 561.A N SER 491.A O no hydrogen 2.807 N/A TYR 561.A OH ASP 429.A OD1 no hydrogen 2.935 N/A ASN 562.A N SER 491.A OG no hydrogen 2.721 N/A ASN 562.A ND2 SER 491.A OG no hydrogen 2.319 N/A GLN 563.A N SER 446.A O no hydrogen 3.003 N/A LEU 565.A N ASP 640.A OD1 no hydrogen 3.217 N/A LEU 565.A N ASP 640.A OD2 no hydrogen 2.910 N/A GLN 566.A N ASP 640.A OD1 no hydrogen 2.847 N/A GLN 566.A NE2 THR 484.A OG1 no hydrogen 2.599 N/A ALA 567.A N LEU 451.A O no hydrogen 2.851 N/A VAL 568.A N GLY 642.A O no hydrogen 3.024 N/A THR 571.A N SER 582.A O no hydrogen 2.715 N/A THR 571.A OG1 THR 571.A O no hydrogen 2.353 N/A THR 571.A OG1 SER 582.A O no hydrogen 2.766 N/A SER 575.A OG THR 571.A O no hydrogen 2.871 N/A SER 575.A OG GLY 572.A O no hydrogen 2.498 N/A TYR 576.A N SER 573.A O no hydrogen 2.616 N/A TYR 576.A OH GLU 592.A OE2 no hydrogen 2.280 N/A ILE 577.A N SER 573.A O no hydrogen 3.335 N/A ASN 578.A N ILE 574.A O no hydrogen 2.737 N/A ASN 578.A ND2 GLY 144.A O no hydrogen 3.195 N/A HIS 579.A ND1 TYR 604.A OH no hydrogen 2.799 N/A ALA 580.A N SER 575.A O no hydrogen 3.201 N/A THR 581.A N ASN 455.A OD1 no hydrogen 3.170 N/A HIS 585.A ND1 PRO 586.A O no hydrogen 2.595 N/A VAL 588.A N PRO 586.A O no hydrogen 3.223 N/A LYS 590.A NZ TYR 617.A O no hydrogen 1.980 N/A GLU 592.A N TYR 604.A O no hydrogen 3.322 N/A ARG 594.A N VAL 602.A O no hydrogen 2.813 N/A ARG 594.A NE GLU 596.A OE2 no hydrogen 2.893 N/A ARG 594.A NH2 GLU 596.A OE2 no hydrogen 2.831 N/A GLY 600.A N GLY 597.A O no hydrogen 3.383 N/A VAL 602.A N ARG 594.A O no hydrogen 2.873 N/A TYR 604.A N GLU 592.A O no hydrogen 2.877 N/A TYR 604.A OH HIS 579.A ND1 no hydrogen 2.799 N/A TYR 604.A OH ALA 580.A O no hydrogen 3.423 N/A MET 609.A N ALA 606.A O no hydrogen 3.357 N/A ASN 611.A ND2 ILE 21.A O no hydrogen 2.905 N/A GLU 612.A N THR 610.A OG1 no hydrogen 2.724 N/A ASN 613.A N THR 610.A O no hydrogen 2.658 N/A ASN 613.A ND2 THR 610.A O no hydrogen 2.394 N/A MET 616.A N ASN 613.A O no hydrogen 2.690 N/A TYR 617.A N LEU 614.A O no hydrogen 2.751 N/A TYR 617.A OH PRO 607.A O no hydrogen 2.673 N/A GLN 618.A NE2 ASP 622.A OD2 no hydrogen 3.190 N/A ASP 622.A N ASP 619.A OD1 no hydrogen 3.050 N/A ILE 623.A N ASP 619.A O no hydrogen 2.712 N/A GLY 624.A N ALA 620.A O no hydrogen 2.806 N/A ILE 628.A N GLY 624.A O no hydrogen 3.440 N/A ILE 629.A N PRO 625.A O no hydrogen 2.526 N/A ASP 630.A N GLU 626.A O no hydrogen 2.589 N/A THR 631.A N LYS 627.A O no hydrogen 2.858 N/A THR 631.A OG1 TYR 467.A OH no hydrogen 3.393 N/A THR 631.A OG1 LYS 627.A O no hydrogen 3.015 N/A TYR 632.A N ILE 628.A O no hydrogen 2.999 N/A TYR 632.A OH SER 644.A O no hydrogen 3.121 N/A ALA 633.A N ILE 629.A O no hydrogen 3.093 N/A ALA 633.A N ASP 630.A O no hydrogen 3.108 N/A GLU 634.A N ASP 630.A O no hydrogen 3.295 N/A ALA 635.A N THR 631.A O no hydrogen 3.194 N/A THR 636.A N TYR 632.A O no hydrogen 2.546 N/A THR 636.A OG1 TYR 632.A O no hydrogen 2.616 N/A ARG 637.A N ALA 633.A O no hydrogen 3.161 N/A ARG 637.A N GLU 634.A O no hydrogen 3.191 N/A ARG 637.A NE GLU 634.A OE2 no hydrogen 3.111 N/A ARG 637.A NH2 GLU 634.A OE2 no hydrogen 2.995 N/A HIS 638.A N ALA 635.A O no hydrogen 3.024 N/A HIS 638.A ND1 TYR 519.A OH no hydrogen 2.554 N/A HIS 638.A NE2 ASN 477.A OD1 no hydrogen 2.716 N/A VAL 639.A N ALA 635.A O no hydrogen 3.291 N/A GLN 641.A N GLN 566.A O no hydrogen 3.311 N/A GLN 641.A NE2 GLN 566.A O no hydrogen 3.489 N/A SER 644.A N VAL 568.A O no hydrogen 2.976 N/A SER 644.A OG CYS 370.A O no hydrogen 2.527 N/A THR 646.A OG1 TYR 675.A O no hydrogen 3.478 N/A PHE 649.A N ARG 677.A O no hydrogen 2.866 N/A ALA 653.A N PRO 650.A O no hydrogen 2.999 N/A THR 654.A N ASP 657.A OD2 no hydrogen 3.037 N/A ASP 657.A N THR 654.A OG1 no hydrogen 3.180 N/A ILE 658.A N THR 654.A O no hydrogen 2.950 N/A ASN 659.A N THR 655.A O no hydrogen 2.770 N/A ASN 659.A ND2 PHE 333.A O no hydrogen 3.395 N/A LYS 660.A N ARG 656.A O no hydrogen 2.729 N/A ALA 661.A N ASP 657.A O no hydrogen 3.006 N/A GLN 662.A N ILE 658.A O no hydrogen 2.962 N/A GLN 662.A NE2 GLN 340.A OE1 no hydrogen 2.466 N/A ILE 663.A N ASN 659.A O no hydrogen 3.004 N/A TYR 664.A N LYS 660.A O no hydrogen 2.897 N/A TYR 664.A OH ASP 630.A OD2 no hydrogen 2.702 N/A ALA 665.A N ALA 661.A O no hydrogen 2.828 N/A TRP 666.A N GLN 662.A O no hydrogen 2.864 N/A TRP 666.A NE1 ASP 276.A OD1 no hydrogen 2.793 N/A ARG 667.A N ILE 663.A O no hydrogen 2.643 N/A LYS 668.A N ALA 665.A O no hydrogen 2.671 N/A LYS 668.A NZ ASP 630.A OD2 no hydrogen 2.926 N/A GLY 669.A N TRP 666.A O no hydrogen 3.141 N/A LYS 671.A NZ VAL 639.A O no hydrogen 2.913 N/A LYS 671.A NZ GLN 641.A O no hydrogen 2.582 N/A SER 672.A OG SER 371.A O no hydrogen 2.970 N/A LEU 673.A N ILE 348.A O no hydrogen 2.668 N/A TYR 674.A N LEU 645.A O no hydrogen 3.140 N/A ILE 676.A N GLY 344.A O no hydrogen 3.033 N/A ARG 677.A N LEU 647.A O no hydrogen 2.985 N/A ARG 679.A N PHE 649.A O no hydrogen 2.916 N/A