Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1nec_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 4.A N ASP 1.A OD2 no hydrogen 3.144 N/A SER 4.A OG ASP 1.A OD2 no hydrogen 3.057 N/A VAL 5.A N ASP 1.A O no hydrogen 3.417 N/A ALA 6.A N ILE 2.A O no hydrogen 2.984 N/A LEU 7.A N ILE 3.A O no hydrogen 3.089 N/A LYS 8.A N VAL 5.A O no hydrogen 3.059 N/A ARG 9.A N VAL 5.A O no hydrogen 2.892 N/A HIS 10.A NE2 ASP 197.A OD2 no hydrogen 2.660 N/A THR 12.A N ALA 160.A O no hydrogen 2.996 N/A THR 12.A OG1 ALA 160.A O no hydrogen 3.223 N/A LYS 13.A N ASP 197.A OD1 no hydrogen 3.005 N/A ASP 16.A N HIS 192.A O no hydrogen 2.850 N/A SER 18.A N ASP 16.A OD1 no hydrogen 3.018 N/A SER 18.A OG ASP 16.A OD1 no hydrogen 2.699 N/A LYS 19.A N ASP 16.A O no hydrogen 3.128 N/A LYS 20.A NZ ALA 17.A O no hydrogen 2.796 N/A LEU 21.A N SER 78.A OG no hydrogen 3.024 N/A THR 22.A N GLU 25.A OE1 no hydrogen 2.872 N/A GLU 25.A N THR 22.A OG1 no hydrogen 3.148 N/A ALA 26.A N THR 22.A O no hydrogen 2.954 N/A GLU 27.A N ALA 23.A O no hydrogen 3.042 N/A LYS 28.A N GLU 24.A O no hydrogen 3.000 N/A ILE 29.A N GLU 25.A O no hydrogen 3.020 N/A LYS 30.A N ALA 26.A O no hydrogen 3.482 N/A LYS 30.A NZ GLU 27.A OE1 no hydrogen 3.381 N/A LYS 30.A NZ GLU 27.A OE2 no hydrogen 2.824 N/A THR 31.A N GLU 27.A O no hydrogen 3.198 N/A THR 31.A OG1 GLU 27.A O no hydrogen 3.444 N/A LEU 32.A N LYS 28.A O no hydrogen 3.061 N/A LEU 33.A N ILE 29.A O no hydrogen 3.055 N/A GLN 34.A N LYS 30.A O no hydrogen 3.101 N/A TYR 35.A N THR 31.A O no hydrogen 3.095 N/A SER 36.A OG PRO 37.A O no hydrogen 3.078 N/A SER 39.A N GLN 141.A OE1 no hydrogen 2.849 N/A THR 40.A OG1 SER 39.A O no hydrogen 2.925 N/A ASN 41.A N SER 38.A O no hydrogen 3.013 N/A ASN 41.A ND2 GLU 101.A OE2 no hydrogen 2.909 N/A SER 42.A N SER 39.A O no hydrogen 3.120 N/A SER 42.A OG SER 39.A O no hydrogen 2.934 N/A GLN 43.A N SER 38.A OG no hydrogen 3.108 N/A GLN 43.A NE2 ASN 41.A O no hydrogen 3.013 N/A TRP 45.A N GLN 43.A O no hydrogen 2.879 N/A HIS 46.A N CYS 84.A O no hydrogen 3.141 N/A ILE 48.A N VAL 82.A O no hydrogen 3.071 N/A ALA 50.A N VAL 80.A O no hydrogen 3.023 N/A GLY 55.A N THR 52.A OG1 no hydrogen 3.012 N/A LYS 56.A N THR 52.A O no hydrogen 2.979 N/A LYS 56.A NZ GLU 53.A OE2 no hydrogen 3.049 N/A LYS 56.A NZ LEU 75.A O no hydrogen 2.891 N/A LYS 56.A NZ ALA 77.A O no hydrogen 2.668 N/A ALA 57.A N GLU 53.A O no hydrogen 3.094 N/A ARG 58.A N GLU 54.A O no hydrogen 3.225 N/A ARG 58.A NE GLU 174.A OE2 no hydrogen 2.850 N/A ARG 58.A NH2 GLU 174.A O no hydrogen 2.858 N/A ARG 58.A NH2 GLU 174.A OE2 no hydrogen 3.380 N/A VAL 59.A N GLY 55.A O no hydrogen 3.129 N/A ALA 60.A N LYS 56.A O no hydrogen 2.796 N/A LYS 61.A N ALA 57.A O no hydrogen 3.234 N/A LYS 61.A NZ GLU 174.A OE1 no hydrogen 3.107 N/A SER 62.A N VAL 59.A O no hydrogen 3.281 N/A SER 62.A OG VAL 59.A O no hydrogen 2.847 N/A ALA 63.A N ALA 60.A O no hydrogen 2.956 N/A TYR 67.A N ALA 64.A O no hydrogen 2.978 N/A VAL 68.A N GLY 65.A O no hydrogen 3.328 N/A ASN 70.A N TYR 67.A O no hydrogen 2.919 N/A ASN 70.A ND2 GLY 165.A O no hydrogen 2.870 N/A GLU 71.A N VAL 68.A O no hydrogen 2.912 N/A LYS 73.A NZ PHE 69.A O no hydrogen 3.413 N/A LYS 73.A NZ ASN 70.A OD1 no hydrogen 2.808 N/A MET 74.A N GLU 71.A O no hydrogen 3.092 N/A LEU 75.A N GLU 71.A O no hydrogen 3.018 N/A ASP 76.A N ARG 72.A O no hydrogen 3.169 N/A SER 78.A OG HIS 79.A ND1 no hydrogen 2.704 N/A HIS 79.A N VAL 190.A O no hydrogen 3.013 N/A HIS 79.A ND1 SER 78.A OG no hydrogen 2.704 N/A VAL 80.A N ALA 50.A O no hydrogen 2.762 N/A VAL 81.A N VAL 188.A O no hydrogen 3.124 N/A VAL 82.A N ILE 48.A O no hydrogen 2.748 N/A PHE 83.A N VAL 186.A O no hydrogen 2.822 N/A CYS 84.A N HIS 46.A O no hydrogen 2.945 N/A CYS 84.A SG VAL 82.A O no hydrogen 3.851 N/A ALA 85.A N THR 183.A O no hydrogen 2.847 N/A LYS 86.A N PRO 44.A O no hydrogen 2.953 N/A LYS 86.A NZ ALA 88.A O no hydrogen 3.079 N/A LYS 86.A NZ ASP 90.A OD1 no hydrogen 2.827 N/A THR 87.A N GLY 181.A O no hydrogen 3.123 N/A MET 89.A N ASP 134.A OD2 no hydrogen 2.990 N/A TRP 93.A N ASP 90.A OD2 no hydrogen 3.313 N/A TRP 93.A NE1 SER 42.A O no hydrogen 2.756 N/A LEU 94.A N ASP 90.A O no hydrogen 3.371 N/A GLU 95.A N ASP 91.A O no hydrogen 2.970 N/A ARG 96.A N ALA 92.A O no hydrogen 3.222 N/A VAL 97.A N TRP 93.A O no hydrogen 3.165 N/A VAL 98.A N LEU 94.A O no hydrogen 2.987 N/A ASP 99.A N GLU 95.A O no hydrogen 2.810 N/A GLN 100.A N ARG 96.A O no hydrogen 2.997 N/A GLN 100.A NE2 ASP 104.A OD2 no hydrogen 2.864 N/A GLU 101.A N VAL 97.A O no hydrogen 2.908 N/A GLU 102.A N VAL 98.A O no hydrogen 2.853 N/A ALA 103.A N ASP 99.A O no hydrogen 2.823 N/A ASP 104.A N GLN 100.A O no hydrogen 2.889 N/A GLY 105.A N GLU 102.A O no hydrogen 3.080 N/A ARG 106.A N GLU 101.A O no hydrogen 3.073 N/A ALA 112.A N THR 109.A O no hydrogen 2.871 N/A LYS 113.A NZ ASP 99.A OD1 no hydrogen 3.305 N/A ALA 115.A N GLU 111.A O no hydrogen 3.172 N/A ASN 116.A N ALA 112.A O no hydrogen 2.888 N/A HIS 117.A N LYS 113.A O no hydrogen 2.985 N/A LYS 118.A N ALA 114.A O no hydrogen 3.403 N/A GLY 119.A N ALA 115.A O no hydrogen 3.337 N/A ARG 120.A N ASN 116.A O no hydrogen 2.991 N/A ARG 120.A NH2 GLU 101.A OE1 no hydrogen 2.560 N/A THR 121.A N HIS 117.A O no hydrogen 2.713 N/A THR 121.A OG1 HIS 117.A O no hydrogen 2.820 N/A TYR 122.A N LYS 118.A O no hydrogen 2.754 N/A PHE 123.A N GLY 119.A O no hydrogen 2.917 N/A ALA 124.A N ARG 120.A O no hydrogen 2.927 N/A ASP 125.A N THR 121.A O no hydrogen 2.983 N/A HIS 127.A ND1 ASP 133.A OD1 no hydrogen 3.025 N/A ARG 128.A N ALA 124.A O no hydrogen 2.965 N/A ARG 128.A NH1 MET 89.A O no hydrogen 3.104 N/A ARG 128.A NH1 ASP 91.A OD1 no hydrogen 3.258 N/A ARG 128.A NH2 ASP 91.A OD1 no hydrogen 3.123 N/A VAL 129.A N ASP 125.A O no hydrogen 3.094 N/A ASP 130.A N ASP 125.A O no hydrogen 3.021 N/A LEU 131.A N MET 126.A O no hydrogen 2.932 N/A GLN 136.A NE2 ASP 135.A OD1 no hydrogen 3.299 N/A TRP 137.A N ASP 133.A O no hydrogen 2.875 N/A MET 138.A N ASP 134.A O no hydrogen 2.905 N/A ALA 139.A N ASP 135.A O no hydrogen 3.030 N/A LYS 140.A N GLN 136.A O no hydrogen 2.965 N/A GLN 141.A N TRP 137.A O no hydrogen 3.295 N/A GLN 141.A NE2 TRP 137.A O no hydrogen 3.086 N/A VAL 142.A N MET 138.A O no hydrogen 3.339 N/A TYR 143.A N ALA 139.A O no hydrogen 3.055 N/A TYR 143.A OH GLU 164.A OE2 no hydrogen 2.606 N/A LEU 144.A N LYS 140.A O no hydrogen 3.142 N/A ASN 145.A N GLN 141.A O no hydrogen 3.132 N/A ASN 145.A ND2 LEU 33.A O no hydrogen 3.059 N/A VAL 146.A N VAL 142.A O no hydrogen 3.018 N/A GLY 147.A N TYR 143.A O no hydrogen 3.022 N/A ASN 148.A N LEU 144.A O no hydrogen 3.083 N/A PHE 149.A N ASN 145.A O no hydrogen 2.728 N/A LEU 150.A N VAL 146.A O no hydrogen 2.931 N/A LEU 151.A N GLY 147.A O no hydrogen 3.394 N/A GLY 152.A N ASN 148.A O no hydrogen 3.041 N/A VAL 153.A N PHE 149.A O no hydrogen 2.965 N/A GLY 154.A N LEU 150.A O no hydrogen 3.169 N/A ALA 155.A N LEU 151.A O no hydrogen 2.967 N/A MET 156.A N GLY 152.A O no hydrogen 2.934 N/A GLY 157.A N GLY 154.A O no hydrogen 3.002 N/A LEU 158.A N VAL 153.A O no hydrogen 3.074 N/A ASP 159.A N GLY 191.A O no hydrogen 2.824 N/A VAL 161.A N PRO 189.A O no hydrogen 3.322 N/A ILE 163.A N VAL 187.A O no hydrogen 2.781 N/A PHE 166.A N GLU 164.A O no hydrogen 3.026 N/A ASP 167.A N SER 62.A O no hydrogen 2.760 N/A ILE 170.A N ASP 167.A OD1 no hydrogen 3.203 N/A LEU 171.A N ASP 167.A O no hydrogen 3.018 N/A ASP 172.A N ALA 168.A O no hydrogen 2.708 N/A GLU 173.A N ALA 169.A O no hydrogen 3.017 N/A GLU 174.A N ILE 170.A O no hydrogen 2.961 N/A PHE 175.A N LEU 171.A O no hydrogen 3.280 N/A GLY 176.A N GLU 173.A O no hydrogen 3.429 N/A LEU 177.A N ASP 172.A O no hydrogen 2.993 N/A LYS 180.A N LEU 177.A O no hydrogen 2.917 N/A GLY 181.A N LYS 178.A O no hydrogen 3.229 N/A PHE 182.A N LEU 177.A O no hydrogen 3.053 N/A THR 183.A N ALA 85.A O no hydrogen 2.902 N/A THR 183.A OG1 ASP 172.A OD2 no hydrogen 2.766 N/A SER 184.A N ASP 172.A OD1 no hydrogen 2.828 N/A SER 184.A OG ASP 172.A OD1 no hydrogen 2.862 N/A LEU 185.A N PHE 83.A O no hydrogen 2.792 N/A VAL 186.A N PHE 83.A O no hydrogen 3.451 N/A VAL 187.A N ILE 163.A O no hydrogen 2.981 N/A VAL 188.A N VAL 81.A O no hydrogen 2.804 N/A VAL 190.A N HIS 79.A O no hydrogen 2.717 N/A GLY 191.A N ASP 159.A O no hydrogen 2.869 N/A HIS 193.A N ASP 159.A OD2 no hydrogen 2.731 N/A HIS 193.A ND1 ASP 159.A OD2 no hydrogen 2.811 N/A SER 194.A N ALA 14.A O no hydrogen 2.797 N/A GLU 196.A N SER 194.A OG no hydrogen 2.841 N/A ASP 197.A N SER 194.A O no hydrogen 2.844 N/A ASN 199.A ND2 SER 11.A O no hydrogen 2.794 N/A ALA 200.A N ASP 197.A O no hydrogen 3.065 N/A THR 201.A N PHE 198.A O no hydrogen 3.463 N/A LEU 202.A N ASN 199.A O no hydrogen 3.428 N/A LYS 204.A NZ ARG 9.A O no hydrogen 2.557 N/A ARG 206.A NH1 SER 205.A O no hydrogen 2.849 N/A THR 211.A N PRO 208.A O no hydrogen 3.068 N/A ILE 212.A N PRO 208.A O no hydrogen 3.189 N/A VAL 213.A N LEU 209.A O no hydrogen 2.760 N/A CYS 216.A SG GLU 215.A O no hydrogen 3.635 N/A