Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4pep_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 2.A N LEU 166.A O no hydrogen 2.718 N/A ASP 3.A N GLY 91.A O no hydrogen 3.117 N/A GLU 4.A N VAL 164.A O no hydrogen 2.787 N/A LEU 6.A N SER 162.A O no hydrogen 2.853 N/A GLU 7.A N PHE 15.A O no hydrogen 2.688 N/A ASN 8.A ND2 ASP 11.A OD1 no hydrogen 2.835 N/A ASN 8.A ND2 SER 155.A OG no hydrogen 3.185 N/A TYR 9.A N GLU 13.A O no hydrogen 2.823 N/A ASP 11.A N ASN 8.A OD1 no hydrogen 2.952 N/A THR 12.A N TYR 9.A O no hydrogen 2.694 N/A THR 12.A OG1 LEU 10.A O no hydrogen 2.778 N/A GLU 13.A N TYR 9.A O no hydrogen 3.069 N/A TYR 14.A OH SER 155.A O no hydrogen 2.662 N/A PHE 15.A N GLU 7.A O no hydrogen 3.249 N/A GLY 16.A N VAL 29.A O no hydrogen 2.956 N/A ILE 18.A N PHE 27.A O no hydrogen 2.916 N/A GLY 19.A N GLN 89.A O no hydrogen 3.148 N/A ILE 20.A N GLN 25.A O no hydrogen 2.817 N/A GLY 21.A N THR 87.A O no hydrogen 2.797 N/A THR 22.A N SER 61.A OG no hydrogen 3.084 N/A THR 22.A OG1 THR 63.A OG1 no hydrogen 2.745 N/A GLN 25.A N ILE 20.A O no hydrogen 2.971 N/A GLN 25.A NE2 ASN 57.A O no hydrogen 2.697 N/A PHE 27.A N ILE 18.A O no hydrogen 2.937 N/A THR 28.A N ASP 117.A OD2 no hydrogen 2.977 N/A THR 28.A OG1 ASP 117.A OD2 no hydrogen 3.511 N/A VAL 29.A N GLY 16.A O no hydrogen 2.853 N/A ILE 30.A N GLY 118.A O no hydrogen 3.149 N/A ASP 32.A N LEU 120.A O no hydrogen 2.927 N/A THR 33.A N THR 215.A OG1 no hydrogen 3.047 N/A THR 33.A OG1 VAL 213.A O no hydrogen 2.852 N/A THR 33.A OG1 THR 215.A OG1 no hydrogen 3.395 N/A GLY 34.A N ASP 32.A OD1 no hydrogen 3.073 N/A SER 35.A N ASP 32.A O no hydrogen 3.433 N/A SER 35.A OG ASP 32.A OD2 no hydrogen 2.777 N/A SER 36.A OG TYR 124.A O no hydrogen 2.562 N/A ASN 37.A ND2 ALA 129.A O no hydrogen 3.033 N/A TRP 39.A N ILE 119.A O no hydrogen 3.027 N/A TRP 39.A NE1 TYR 74.A OH no hydrogen 2.770 N/A VAL 40.A N GLY 101.A O no hydrogen 3.174 N/A SER 42.A OG SER 103.A O no hydrogen 2.732 N/A VAL 43.A N PHE 56.A O no hydrogen 3.166 N/A TYR 44.A N SER 42.A OG no hydrogen 3.142 N/A CYS 45.A N SER 42.A O no hydrogen 2.858 N/A CYS 45.A SG SER 47.A OG no hydrogen 3.690 N/A CYS 45.A SG GLU 104.A O no hydrogen 3.454 N/A CYS 50.A N SER 47.A O no hydrogen 3.114 N/A CYS 50.A SG GLU 106.A OE2 no hydrogen 3.427 N/A SER 51.A N LEU 48.A O no hydrogen 2.981 N/A SER 51.A OG LEU 48.A O no hydrogen 2.475 N/A ASP 52.A N ALA 49.A O no hydrogen 3.506 N/A HIS 53.A ND1 ALA 49.A O no hydrogen 2.546 N/A HIS 53.A NE2 ALA 114.A O no hydrogen 2.848 N/A ASN 54.A ND2 ASP 117.A OD2 no hydrogen 2.652 N/A GLN 55.A NE2 SER 42.A O no hydrogen 2.828 N/A GLN 55.A NE2 CYS 45.A O no hydrogen 3.248 N/A PHE 56.A N PRO 41.A O no hydrogen 2.900 N/A ASN 57.A N GLN 25.A OE1 no hydrogen 3.136 N/A ASN 57.A ND2 ASP 59.A OD1 no hydrogen 3.564 N/A ASP 59.A N ASN 57.A OD1 no hydrogen 3.175 N/A ASP 60.A N ASN 57.A O no hydrogen 3.120 N/A SER 61.A OG ASP 86.A OD1 no hydrogen 3.353 N/A SER 61.A OG ASP 86.A OD2 no hydrogen 2.628 N/A SER 62.A N THR 22.A O no hydrogen 3.178 N/A THR 63.A OG1 THR 22.A OG1 no hydrogen 2.745 N/A THR 63.A OG1 ASP 86.A OD1 no hydrogen 2.640 N/A GLU 65.A N TYR 85.A O no hydrogen 2.901 N/A THR 67.A OG1 LEU 83.A O no hydrogen 3.001 N/A LEU 70.A N GLY 81.A O no hydrogen 2.779 N/A ILE 72.A N MET 79.A O no hydrogen 3.085 N/A TYR 74.A N GLY 77.A O no hydrogen 2.469 N/A GLY 77.A N TYR 74.A O no hydrogen 3.255 N/A MET 79.A N ILE 72.A O no hydrogen 2.961 N/A THR 80.A N THR 105.A O no hydrogen 2.972 N/A GLY 81.A N LEU 70.A O no hydrogen 2.875 N/A ILE 82.A N LEU 102.A O no hydrogen 2.972 N/A LEU 83.A N GLN 68.A O no hydrogen 2.977 N/A GLY 84.A N PHE 100.A O no hydrogen 2.899 N/A TYR 85.A N GLU 65.A O no hydrogen 2.936 N/A ASP 86.A N GLN 98.A O no hydrogen 3.014 N/A THR 87.A N ASP 86.A OD1 no hydrogen 2.713 N/A VAL 88.A N ASP 95.A O no hydrogen 2.883 N/A GLN 89.A N GLY 19.A O no hydrogen 2.717 N/A VAL 90.A N ILE 93.A O no hydrogen 2.934 N/A GLY 91.A N GLU 4.A OE1 no hydrogen 3.065 N/A ILE 93.A N VAL 90.A O no hydrogen 2.990 N/A ASP 95.A N VAL 88.A O no hydrogen 2.784 N/A GLN 98.A N ASP 86.A O no hydrogen 2.997 N/A GLN 98.A NE2 ILE 99.A O no hydrogen 2.638 N/A GLN 98.A NE2 THR 133.A O no hydrogen 3.230 N/A PHE 100.A N GLY 84.A O no hydrogen 2.934 N/A GLY 101.A N LEU 38.A O no hydrogen 3.050 N/A LEU 102.A N ILE 82.A O no hydrogen 2.858 N/A SER 103.A N VAL 40.A O no hydrogen 2.885 N/A SER 103.A OG GLU 106.A OE2 no hydrogen 2.773 N/A GLU 104.A N THR 80.A O no hydrogen 2.787 N/A THR 105.A N THR 80.A O no hydrogen 3.174 N/A GLU 106.A N SER 47.A OG no hydrogen 2.970 N/A TYR 113.A N SER 109.A O no hydrogen 3.061 N/A ALA 114.A N PHE 110.A O no hydrogen 3.175 N/A ASP 117.A N THR 28.A O no hydrogen 2.903 N/A ASP 117.A N THR 28.A OG1 no hydrogen 3.228 N/A GLY 118.A N THR 28.A O no hydrogen 2.986 N/A ILE 119.A N TRP 39.A O no hydrogen 3.190 N/A LEU 120.A N ILE 30.A O no hydrogen 2.951 N/A GLY 121.A N ASN 37.A O no hydrogen 2.834 N/A LEU 122.A N ASP 32.A O no hydrogen 2.896 N/A ALA 123.A N SER 35.A O no hydrogen 2.822 N/A TYR 124.A N GLY 187.A O no hydrogen 2.823 N/A TYR 124.A OH ASN 317.A OD1 no hydrogen 2.636 N/A SER 126.A OG GLU 186.A O no hydrogen 3.450 N/A ILE 127.A N TYR 124.A O no hydrogen 3.181 N/A SER 128.A N PRO 125.A O no hydrogen 2.936 N/A SER 128.A OG ALA 132.A O no hydrogen 2.557 N/A ALA 129.A N ASN 37.A OD1 no hydrogen 2.981 N/A SER 130.A OG GLU 69.A O no hydrogen 2.731 N/A GLY 131.A N SER 128.A O no hydrogen 3.007 N/A ALA 132.A N ALA 129.A O no hydrogen 3.246 N/A ASN 138.A N PRO 134.A O no hydrogen 3.109 N/A ASN 138.A ND2 ASP 95.A OD1 no hydrogen 2.868 N/A ASN 138.A ND2 THR 96.A O no hydrogen 3.171 N/A ASN 138.A ND2 ASN 97.A O no hydrogen 3.102 N/A ASN 138.A ND2 GLN 98.A OE1 no hydrogen 3.195 N/A LEU 139.A N VAL 135.A O no hydrogen 3.039 N/A TRP 140.A N PHE 136.A O no hydrogen 3.086 N/A ASP 141.A N ASP 137.A O no hydrogen 2.715 N/A GLN 142.A NE2 THR 96.A O no hydrogen 3.235 N/A GLN 142.A NE2 THR 96.A OG1 no hydrogen 2.975 N/A GLY 143.A N TRP 140.A O no hydrogen 3.096 N/A LEU 144.A N LEU 139.A O no hydrogen 2.863 N/A GLN 147.A NE2 GLY 167.A O no hydrogen 2.627 N/A PHE 150.A N PHE 312.A O no hydrogen 2.833 N/A SER 151.A N LEU 165.A O no hydrogen 2.901 N/A SER 151.A OG GLY 168.A O no hydrogen 3.049 N/A SER 151.A OG TYR 309.A OH no hydrogen 2.420 N/A VAL 152.A N THR 310.A O no hydrogen 2.657 N/A TYR 153.A N VAL 163.A O no hydrogen 2.904 N/A SER 155.A N SER 162.A OG no hydrogen 2.969 N/A SER 155.A OG ASP 159.A O no hydrogen 2.876 N/A SER 155.A OG SER 162.A OG no hydrogen 2.873 N/A ASP 158.A N ASP 11.A OD1 no hydrogen 3.215 N/A ASP 159.A N SER 156.A O no hydrogen 2.998 N/A SER 162.A OG SER 155.A OG no hydrogen 2.873 N/A VAL 163.A N TYR 153.A O no hydrogen 2.749 N/A VAL 164.A N GLU 4.A O no hydrogen 2.920 N/A LEU 165.A N SER 151.A O no hydrogen 2.904 N/A LEU 166.A N GLY 2.A O no hydrogen 2.876 N/A GLY 167.A N LEU 149.A O no hydrogen 2.814 N/A ASP 170.A N TYR 309.A OH no hydrogen 2.967 N/A SER 172.A N ASP 170.A OD2 no hydrogen 3.248 N/A TYR 173.A N ASP 170.A O no hydrogen 3.033 N/A THR 175.A N PRO 323.A O no hydrogen 2.978 N/A ASN 179.A N LEU 321.A O no hydrogen 3.059 N/A ASN 179.A ND2 LEU 321.A O no hydrogen 3.425 N/A VAL 181.A N VAL 319.A O no hydrogen 2.717 N/A VAL 183.A N ASN 317.A O no hydrogen 2.926 N/A SER 184.A N GLN 190.A O no hydrogen 2.706 N/A SER 184.A OG GLN 190.A O no hydrogen 3.381 N/A SER 184.A OG GLN 210.A OE1 no hydrogen 2.894 N/A GLY 187.A N TYR 188.A O no hydrogen 3.226 N/A TRP 189.A NE1 LEU 122.A O no hydrogen 2.774 N/A GLN 190.A NE2 GLN 210.A OE1 no hydrogen 2.700 N/A GLN 190.A NE2 SER 294.A OG no hydrogen 3.426 N/A ILE 191.A N ALA 211.A O no hydrogen 2.828 N/A LEU 193.A N CYS 209.A O no hydrogen 2.744 N/A ASP 194.A N THR 260.A O no hydrogen 2.884 N/A ILE 196.A N ALA 204.A O no hydrogen 3.263 N/A THR 197.A N VAL 258.A O no hydrogen 3.018 N/A THR 197.A OG1 GLU 201.A O no hydrogen 3.500 N/A MET 198.A N GLU 201.A O no hydrogen 2.827 N/A GLU 201.A N MET 198.A O no hydrogen 2.926 N/A ILE 203.A N GLU 201.A O no hydrogen 3.191 N/A CYS 205.A SG LEU 193.A O no hydrogen 3.349 N/A CYS 209.A N LEU 193.A O no hydrogen 2.542 N/A CYS 209.A SG LEU 193.A O no hydrogen 3.807 N/A GLN 210.A NE2 THR 192.A OG1 no hydrogen 2.790 N/A ALA 211.A N ILE 191.A O no hydrogen 2.970 N/A ILE 212.A N TRP 298.A O no hydrogen 2.968 N/A VAL 213.A N TRP 189.A O no hydrogen 2.914 N/A ASP 214.A N LEU 300.A O no hydrogen 2.945 N/A THR 215.A N THR 33.A OG1 no hydrogen 3.035 N/A THR 215.A OG1 PHE 31.A O no hydrogen 2.629 N/A THR 215.A OG1 THR 33.A OG1 no hydrogen 3.395 N/A GLY 216.A N ASP 214.A OD2 no hydrogen 2.969 N/A THR 217.A N ASP 214.A O no hydrogen 3.315 N/A THR 217.A OG1 ASP 214.A OD1 no hydrogen 3.010 N/A SER 218.A OG THR 12.A O no hydrogen 2.992 N/A LEU 220.A N GLY 284.A O no hydrogen 3.121 N/A THR 221.A N ILE 299.A O no hydrogen 3.066 N/A GLY 222.A N GLU 286.A O no hydrogen 3.071 N/A THR 224.A N ASP 289.A OD1 no hydrogen 2.925 N/A THR 224.A OG1 ASP 289.A OD1 no hydrogen 3.518 N/A ALA 226.A N PRO 223.A O no hydrogen 2.892 N/A ILE 227.A N PRO 223.A O no hydrogen 3.002 N/A ALA 228.A N THR 224.A O no hydrogen 3.046 N/A ILE 230.A N ALA 226.A O no hydrogen 3.330 N/A GLN 231.A N ILE 227.A O no hydrogen 2.873 N/A GLN 231.A NE2 PHE 285.A O no hydrogen 2.873 N/A SER 232.A N ALA 228.A O no hydrogen 3.049 N/A ASP 233.A N ASN 229.A O no hydrogen 2.982 N/A ILE 234.A N ILE 230.A O no hydrogen 2.985 N/A GLY 235.A N SER 232.A O no hydrogen 3.378 N/A ALA 236.A N GLN 231.A O no hydrogen 2.772 N/A SER 237.A N VAL 245.A O no hydrogen 3.175 N/A ASN 239.A N GLU 243.A O no hydrogen 3.063 N/A ILE 246.A N CYS 281.A O no hydrogen 2.733 N/A CYS 248.A SG ASP 279.A O no hydrogen 3.871 N/A SER 249.A N SER 247.A OG no hydrogen 3.204 N/A SER 250.A N SER 247.A O no hydrogen 2.685 N/A SER 250.A OG SER 247.A O no hydrogen 2.958 N/A ILE 251.A N CYS 248.A O no hydrogen 3.109 N/A SER 253.A N SER 249.A O no hydrogen 3.397 N/A SER 253.A OG SER 249.A O no hydrogen 2.716 N/A LEU 254.A N SER 250.A O no hydrogen 2.428 N/A ILE 257.A N LEU 268.A O no hydrogen 2.919 N/A VAL 258.A N THR 197.A O no hydrogen 3.028 N/A PHE 259.A N TYR 266.A O no hydrogen 3.187 N/A THR 260.A N SER 195.A O no hydrogen 3.164 N/A ILE 261.A N VAL 264.A O no hydrogen 2.874 N/A GLY 263.A N ASP 194.A OD1 no hydrogen 2.897 N/A VAL 264.A N ILE 261.A O no hydrogen 2.730 N/A TYR 266.A N PHE 259.A O no hydrogen 2.720 N/A LEU 268.A N ILE 257.A O no hydrogen 2.889 N/A SER 271.A N SER 269.A OG no hydrogen 3.100 N/A ALA 272.A N SER 269.A O no hydrogen 2.627 N/A TYR 273.A N SER 269.A O no hydrogen 3.124 N/A TYR 273.A OH PRO 255.A O no hydrogen 2.490 N/A ILE 274.A N PRO 270.A O no hydrogen 3.043 N/A LEU 275.A N THR 282.A O no hydrogen 2.852 N/A ASP 277.A N SER 280.A O no hydrogen 2.844 N/A SER 280.A N ASP 277.A O no hydrogen 3.021 N/A THR 282.A N LEU 275.A O no hydrogen 2.948 N/A SER 283.A N MET 244.A O no hydrogen 3.366 N/A SER 283.A OG GLN 231.A OE1 no hydrogen 2.687 N/A PHE 285.A N SER 283.A OG no hydrogen 2.882 N/A GLU 286.A N LEU 220.A O no hydrogen 2.751 N/A MET 288.A N GLY 222.A O no hydrogen 2.790 N/A THR 292.A N GLY 295.A O no hydrogen 2.495 N/A THR 292.A OG1 GLY 295.A O no hydrogen 2.825 N/A LEU 297.A N VAL 290.A O no hydrogen 2.973 N/A TRP 298.A N GLN 210.A O no hydrogen 3.289 N/A ILE 299.A N THR 221.A O no hydrogen 2.824 N/A LEU 300.A N ILE 212.A O no hydrogen 2.790 N/A ASP 302.A N THR 217.A O no hydrogen 2.701 N/A VAL 303.A N SER 218.A O no hydrogen 3.004 N/A PHE 304.A N GLY 301.A O no hydrogen 2.984 N/A ILE 305.A N GLY 301.A O no hydrogen 3.008 N/A ARG 306.A N ASP 302.A O no hydrogen 2.875 N/A ARG 306.A NH2 ASP 11.A O no hydrogen 2.671 N/A ARG 306.A NH2 TYR 14.A OH no hydrogen 3.389 N/A GLN 307.A N PHE 304.A O no hydrogen 2.998 N/A TYR 308.A N ILE 305.A O no hydrogen 3.092 N/A TYR 308.A OH PRO 267.A O no hydrogen 2.712 N/A TYR 309.A N ALA 322.A O no hydrogen 2.518 N/A THR 310.A N VAL 152.A O no hydrogen 3.094 N/A THR 310.A OG1 TYR 308.A O no hydrogen 3.086 N/A VAL 311.A N GLY 320.A O no hydrogen 2.977 N/A PHE 312.A N PHE 150.A O no hydrogen 2.750 N/A ASP 313.A N LYS 318.A O no hydrogen 3.136 N/A ARG 314.A N ASP 148.A O no hydrogen 2.822 N/A ARG 314.A NH1 ASP 137.A OD1 no hydrogen 2.992 N/A ARG 314.A NH1 ASP 137.A OD2 no hydrogen 3.327 N/A ARG 314.A NH2 ASP 137.A OD2 no hydrogen 2.830 N/A ALA 315.A N ASP 313.A OD2 no hydrogen 2.888 N/A ASN 316.A N ASP 313.A OD2 no hydrogen 3.146 N/A ASN 316.A ND2 ASP 313.A OD1 no hydrogen 3.344 N/A LYS 318.A N ASP 313.A O no hydrogen 3.133 N/A VAL 319.A N VAL 181.A O no hydrogen 2.706 N/A GLY 320.A N VAL 311.A O no hydrogen 2.882 N/A LEU 321.A N ASN 179.A O no hydrogen 2.868 N/A ALA 322.A N TYR 309.A O no hydrogen 3.285 N/A VAL 324.A N GLN 307.A O no hydrogen 3.147 N/A ALA 325.A N TYR 173.A O no hydrogen 3.132 N/A