Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3pye_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 4.A N PRO 2.A O no hydrogen 3.230 N/A VAL 6.A N VAL 46.A O no hydrogen 2.974 N/A THR 7.A N SER 301.A OG no hydrogen 2.841 N/A VAL 8.A N VAL 44.A O no hydrogen 2.745 N/A ARG 9.A N ARG 298.A O no hydrogen 2.997 N/A ARG 9.A NH1 GLU 43.A OE2 no hydrogen 3.010 N/A VAL 10.A N ASP 42.A O no hydrogen 2.984 N/A GLY 12.A N LEU 40.A O no hydrogen 2.794 N/A LYS 13.A N MET 103.A O no hydrogen 3.108 N/A LYS 13.A NZ ASN 15.A OD1 no hydrogen 2.706 N/A VAL 14.A N HIS 36.A O no hydrogen 2.806 N/A ASN 15.A N SER 255.A OG no hydrogen 2.817 N/A LEU 16.A N VAL 34.A O no hydrogen 2.865 N/A TYR 17.A OH GLY 201.A O no hydrogen 2.556 N/A LEU 18.A N GLY 223.A O no hydrogen 3.095 N/A ALA 19.A N THR 32.A O no hydrogen 2.914 N/A VAL 20.A N GLU 225.A OE1 no hydrogen 2.815 N/A GLY 21.A N GLU 30.A O no hydrogen 2.938 N/A ARG 23.A NH1 GLU 25.A OE2 no hydrogen 3.245 N/A ARG 24.A N TYR 28.A O no hydrogen 2.832 N/A GLY 27.A N ARG 24.A O no hydrogen 2.869 N/A HIS 29.A NE2 ASP 189.A OD1 no hydrogen 2.741 N/A THR 32.A N ALA 19.A O no hydrogen 3.033 N/A THR 33.A N GLY 152.A O no hydrogen 2.800 N/A THR 33.A OG1 ASN 15.A OD1 no hydrogen 3.507 N/A THR 33.A OG1 TYR 17.A O no hydrogen 3.445 N/A VAL 34.A N TYR 17.A O no hydrogen 2.884 N/A PHE 35.A N ALA 150.A O no hydrogen 2.843 N/A HIS 36.A N VAL 14.A O no hydrogen 2.886 N/A ALA 37.A N GLY 148.A O no hydrogen 2.951 N/A VAL 38.A N GLY 12.A O no hydrogen 3.113 N/A SER 39.A N THR 291.A O no hydrogen 2.909 N/A ASP 42.A N VAL 10.A O no hydrogen 2.795 N/A GLU 43.A N ASP 94.A O no hydrogen 2.959 N/A VAL 44.A N VAL 8.A O no hydrogen 2.860 N/A THR 45.A N MET 92.A O no hydrogen 2.858 N/A VAL 46.A N VAL 6.A O no hydrogen 2.911 N/A ARG 47.A N SER 90.A O no hydrogen 3.197 N/A ARG 47.A NH1.B ASN 48.A O no hydrogen 2.897 N/A ALA 49.A N ASP 88.A O no hydrogen 3.043 N/A SER 53.A N VAL 89.A O no hydrogen 3.138 N/A GLU 55.A N ILE 91.A O no hydrogen 2.863 N/A VAL 57.A N ILE 93.A O no hydrogen 2.842 N/A ALA 61.A N GLY 58.A O no hydrogen 2.852 N/A GLN 63.A N GLY 60.A O no hydrogen 2.961 N/A LEU 64.A N ALA 61.A O no hydrogen 3.019 N/A ARG 69.A N ASP 67.A OD2 no hydrogen 2.913 N/A ARG 69.A NE ASP 67.A OD1 no hydrogen 3.163 N/A ARG 69.A NE ASP 67.A OD2 no hydrogen 2.994 N/A ARG 69.A NH2 ASP 67.A OD1 no hydrogen 3.406 N/A ASN 70.A N ASP 67.A O no hydrogen 2.871 N/A TRP 73.A NE1 GLU 77.A OE1 no hydrogen 3.150 N/A GLN 74.A N ASN 70.A O no hydrogen 3.111 N/A GLN 74.A NE2 GLU 68.A O no hydrogen 3.095 N/A GLN 74.A NE2 ARG 69.A O no hydrogen 3.663 N/A ALA 75.A N LEU 71.A O no hydrogen 2.979 N/A ALA 76.A N ALA 72.A O no hydrogen 3.137 N/A GLU 77.A N TRP 73.A O no hydrogen 3.209 N/A LEU 78.A N GLN 74.A O no hydrogen 2.897 N/A MET 79.A N ALA 75.A O no hydrogen 2.810 N/A ALA 80.A N ALA 76.A O no hydrogen 2.922 N/A GLU 81.A N GLU 77.A O no hydrogen 2.913 N/A HIS 82.A N LEU 78.A O no hydrogen 2.910 N/A HIS 82.A NE2 ASP 129.A OD2 no hydrogen 2.869 N/A VAL 83.A N MET 79.A O no hydrogen 3.226 N/A VAL 83.A N ALA 80.A O no hydrogen 3.042 N/A GLY 84.A N GLU 81.A O no hydrogen 3.033 N/A ARG 85.A N ALA 80.A O no hydrogen 2.765 N/A ASP 88.A N ALA 86.A O no hydrogen 2.655 N/A VAL 89.A N PRO 87.A O no hydrogen 2.786 N/A SER 90.A N ARG 47.A O no hydrogen 3.013 N/A ILE 91.A N SER 53.A O no hydrogen 2.827 N/A MET 92.A N THR 45.A O no hydrogen 2.807 N/A ILE 93.A N GLU 55.A O no hydrogen 2.861 N/A ASP 94.A N GLU 43.A O no hydrogen 2.761 N/A LYS 95.A N VAL 57.A O no hydrogen 2.732 N/A LYS 95.A NZ ASP 42.A OD2 no hydrogen 2.566 N/A LYS 95.A NZ ASP 109.A OD1 no hydrogen 3.048 N/A SER 96.A N ASP 42.A OD1 no hydrogen 2.871 N/A ILE 97.A N ASP 42.A OD1 no hydrogen 2.829 N/A GLY 101.A N PRO 98.A O no hydrogen 3.105 N/A ALA 108.A N ALA 104.A O no hydrogen 3.019 N/A ASP 109.A N GLY 105.A O no hydrogen 2.978 N/A ALA 110.A N GLY 106.A O no hydrogen 3.060 N/A ALA 111.A N SER 107.A O no hydrogen 2.975 N/A ALA 112.A N ALA 108.A O no hydrogen 2.876 N/A VAL 113.A N ASP 109.A O no hydrogen 2.883 N/A LEU 114.A N ALA 110.A O no hydrogen 3.188 N/A VAL 115.A N ALA 111.A O no hydrogen 3.193 N/A ALA 116.A N ALA 112.A O no hydrogen 2.871 N/A MET 117.A N VAL 113.A O no hydrogen 2.933 N/A ASN 118.A N LEU 114.A O no hydrogen 3.101 N/A ASN 118.A ND2 VAL 125.A O no hydrogen 3.049 N/A SER 119.A N VAL 115.A O no hydrogen 3.168 N/A LEU 120.A N ALA 116.A O no hydrogen 2.786 N/A TRP 121.A N MET 117.A O no hydrogen 2.910 N/A TRP 121.A NE1 ASN 48.A OD1 no hydrogen 3.130 N/A GLU 122.A N SER 119.A O no hydrogen 2.883 N/A LEU 123.A N ASN 118.A O no hydrogen 2.874 N/A VAL 125.A N ASN 118.A OD1 no hydrogen 2.728 N/A ARG 127.A NH2 ARG 127.A O no hydrogen 3.214 N/A ASP 129.A N PRO 126.A O no hydrogen 2.935 N/A LEU 130.A N PRO 126.A O no hydrogen 3.294 N/A ARG 131.A N ARG 127.A O no hydrogen 2.958 N/A MET 132.A N ARG 128.A O no hydrogen 3.155 N/A LEU 133.A N ASP 129.A O no hydrogen 2.913 N/A ALA 134.A N LEU 130.A O no hydrogen 2.725 N/A ALA 135.A N ARG 131.A O no hydrogen 2.973 N/A ARG 136.A N MET 132.A O no hydrogen 3.238 N/A LEU 137.A N LEU 133.A O no hydrogen 3.130 N/A LEU 137.A N ALA 134.A O no hydrogen 2.981 N/A GLY 138.A N ALA 134.A O no hydrogen 3.078 N/A VAL 141.A N GLY 138.A O no hydrogen 3.161 N/A ALA 144.A N ASP 140.A O no hydrogen 3.328 N/A LEU 145.A N VAL 141.A O no hydrogen 3.239 N/A HIS 146.A N PRO 142.A O no hydrogen 3.036 N/A HIS 146.A ND1 GLY 147.A O no hydrogen 2.751 N/A HIS 146.A NE2 THR 161.A OG1 no hydrogen 2.651 N/A GLY 147.A N PHE 143.A O no hydrogen 2.779 N/A GLY 148.A N VAL 294.A O no hydrogen 2.873 N/A ALA 150.A N PHE 35.A O no hydrogen 3.027 N/A LEU 151.A N ALA 160.A O no hydrogen 2.778 N/A GLY 152.A N THR 33.A O no hydrogen 2.758 N/A ARG 155.A NE ARG 155.A O no hydrogen 3.038 N/A ALA 160.A N LEU 151.A O no hydrogen 2.838 N/A THR 161.A OG1 HIS 146.A NE2 no hydrogen 2.651 N/A VAL 162.A N THR 149.A O no hydrogen 2.861 N/A SER 164.A OG LEU 210.A O no hydrogen 3.167 N/A ASN 166.A ND2 GLY 213.A O no hydrogen 3.304 N/A PHE 168.A N GLY 292.A O no hydrogen 2.639 N/A TRP 170.A N ALA 290.A O no hydrogen 3.022 N/A VAL 171.A N PHE 263.A O no hydrogen 2.889 N/A LEU 172.A N ARG 288.A O.A no hydrogen 2.857 N/A LEU 172.A N ARG 288.A O.B no hydrogen 2.864 N/A ALA 173.A N CYS 261.A O no hydrogen 2.931 N/A PHE 174.A N THR 286.A O no hydrogen 2.836 N/A VAL 184.A N LEU 180.A O no hydrogen 3.073 N/A TYR 185.A N THR 181.A O no hydrogen 2.967 N/A ASN 186.A N SER 182.A O no hydrogen 2.921 N/A GLU 187.A N ALA 183.A O no hydrogen 2.978 N/A LEU 188.A N VAL 184.A O no hydrogen 2.748 N/A ASP 189.A N TYR 185.A O no hydrogen 2.768 N/A ARG 190.A N ASN 186.A O no hydrogen 2.963 N/A ARG 190.A NH1 GLU 187.A OE1 no hydrogen 2.642 N/A ARG 190.A NH1 GLU 187.A OE2 no hydrogen 3.391 N/A LEU 191.A N GLU 187.A O no hydrogen 2.979 N/A ARG 192.A N LEU 188.A O no hydrogen 3.125 N/A ARG 192.A NH1 VAL 20.A O no hydrogen 2.912 N/A ARG 192.A NH2 VAL 20.A O no hydrogen 2.878 N/A GLU 193.A N ASP 189.A O no hydrogen 3.205 N/A GLU 193.A N ARG 190.A O no hydrogen 2.953 N/A VAL 194.A N ARG 190.A O no hydrogen 3.092 N/A GLY 195.A N LEU 191.A O no hydrogen 3.006 N/A ARG 199.A NH2 ASP 22.A OD1 no hydrogen 3.013 N/A LEU 200.A N GLU 225.A OE2 no hydrogen 2.680 N/A LEU 207.A N PRO 203.A O no hydrogen 3.129 N/A ALA 208.A N GLY 204.A O no hydrogen 2.920 N/A ALA 209.A N PRO 205.A O no hydrogen 2.962 N/A LEU 210.A N VAL 206.A O no hydrogen 2.955 N/A ALA 211.A N LEU 207.A O no hydrogen 2.876 N/A ALA 212.A N ALA 208.A O no hydrogen 2.961 N/A GLY 213.A N LEU 210.A O no hydrogen 2.974 N/A ASP 214.A N ALA 209.A O no hydrogen 3.269 N/A GLN 217.A N ASP 214.A OD1 no hydrogen 3.274 N/A LEU 218.A N ASP 214.A O no hydrogen 2.916 N/A ALA 219.A N PRO 215.A O no hydrogen 2.915 N/A LEU 221.A N LEU 218.A O no hydrogen 2.954 N/A LEU 222.A N LEU 218.A O no hydrogen 3.304 N/A LEU 222.A N ALA 219.A O no hydrogen 3.363 N/A GLY 223.A N LEU 16.A O no hydrogen 2.925 N/A ASN 224.A ND2 VAL 254.A O no hydrogen 2.667 N/A ASN 224.A ND2 GLY 256.A O no hydrogen 2.844 N/A GLU 225.A N LEU 18.A O no hydrogen 2.945 N/A MET 226.A N ASN 224.A OD1 no hydrogen 2.780 N/A GLN 227.A N ASN 224.A O no hydrogen 3.030 N/A ALA 230.A N MET 226.A O no hydrogen 2.889 N/A VAL 231.A N GLN 227.A O no hydrogen 2.817 N/A SER 232.A N ALA 228.A O no hydrogen 2.962 N/A SER 232.A N ALA 229.A O no hydrogen 3.123 N/A SER 232.A OG GLU 187.A OE1 no hydrogen 2.430 N/A LEU 233.A N ALA 229.A O no hydrogen 2.980 N/A LEU 237.A N ASP 234.A O no hydrogen 2.951 N/A ALA 238.A N PRO 235.A O no hydrogen 3.169 N/A ALA 240.A N ALA 236.A O no hydrogen 3.076 N/A LEU 241.A N LEU 237.A O no hydrogen 2.964 N/A ARG 242.A N ALA 238.A O no hydrogen 3.113 N/A ALA 243.A N ARG 239.A O no hydrogen 2.815 N/A GLY 244.A N ALA 240.A O no hydrogen 3.024 N/A VAL 245.A N LEU 241.A O no hydrogen 3.484 N/A GLU 246.A N ARG 242.A O no hydrogen 2.842 N/A ALA 247.A N ALA 243.A O no hydrogen 2.758 N/A GLY 248.A N VAL 245.A O no hydrogen 2.780 N/A ALA 249.A N GLY 244.A O no hydrogen 3.058 N/A LEU 250.A N LEU 264.A O no hydrogen 2.862 N/A ILE 253.A N ALA 262.A O no hydrogen 3.098 N/A SER 255.A N THR 260.A O no hydrogen 2.907 N/A GLY 258.A N SER 255.A O no hydrogen 3.040 N/A THR 260.A N GLY 101.A O no hydrogen 3.264 N/A THR 260.A OG1 GLY 101.A O no hydrogen 2.692 N/A CYS 261.A N ALA 173.A O no hydrogen 2.899 N/A ALA 262.A N ILE 253.A O no hydrogen 2.888 N/A PHE 263.A N VAL 171.A O no hydrogen 2.719 N/A LEU 264.A N ALA 251.A O no hydrogen 3.063 N/A CYS 265.A N HIS 169.A O no hydrogen 2.831 N/A CYS 265.A SG PHE 263.A O no hydrogen 3.902 N/A SER 270.A N SER 267.A OG no hydrogen 2.926 N/A ALA 271.A N SER 267.A O no hydrogen 2.972 N/A ILE 272.A N ALA 268.A O no hydrogen 2.966 N/A ASP 273.A N SER 269.A O no hydrogen 3.219 N/A VAL 274.A N SER 270.A O no hydrogen 2.838 N/A GLY 275.A N ALA 271.A O no hydrogen 2.874 N/A ALA 276.A N ILE 272.A O no hydrogen 2.928 N/A GLN 277.A N ASP 273.A O no hydrogen 2.920 N/A LEU 278.A N VAL 274.A O no hydrogen 2.838 N/A SER 279.A N GLY 275.A O no hydrogen 2.936 N/A GLY 280.A N ALA 276.A O no hydrogen 2.975 N/A ALA 281.A N GLN 277.A O no hydrogen 2.904 N/A ALA 281.A N LEU 278.A O no hydrogen 3.128 N/A ARG 285.A NH1 THR 286.A OG1 no hydrogen 2.572 N/A THR 286.A N PHE 174.A O no hydrogen 3.374 N/A ARG 288.A N.A LEU 172.A O no hydrogen 2.912 N/A ARG 288.A N.B LEU 172.A O no hydrogen 2.913 N/A ALA 290.A N TRP 170.A O no hydrogen 3.053 N/A THR 291.A N SER 39.A OG no hydrogen 2.851 N/A GLY 292.A N PHE 168.A O no hydrogen 2.958 N/A VAL 294.A N ALA 37.A O no hydrogen 3.230 N/A ALA 297.A N ALA 144.A O no hydrogen 3.023 N/A ARG 298.A N ARG 9.A O no hydrogen 3.015 N/A ARG 298.A NH1.A GLY 296.A O no hydrogen 3.103 N/A VAL 300.A N THR 7.A O no hydrogen 2.800 N/A SER 301.A N THR 7.A O no hydrogen 3.476 N/A SER 301.A OG THR 7.A O no hydrogen 3.515 N/A