Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3hys_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 5.A N LEU 18.A O no hydrogen 3.030 N/A GLY 7.A N ILE 16.A O no hydrogen 2.767 N/A ALA 8.A N ASP 82.A OD1 no hydrogen 2.735 N/A ASP 10.A N ARG 14.A O no hydrogen 2.826 N/A GLU 12.A N ASP 10.A OD1 no hydrogen 2.737 N/A PHE 13.A N ASP 10.A O no hydrogen 2.916 N/A ARG 14.A N ASP 10.A OD1 no hydrogen 3.069 N/A ARG 14.A NE ASP 10.A OD2 no hydrogen 3.046 N/A ARG 14.A NH2 ASP 10.A OD2 no hydrogen 3.132 N/A LEU 18.A N PHE 5.A O no hydrogen 2.951 N/A TYR 20.A N LEU 3.A O no hydrogen 2.957 N/A ASP 21.A N THR 59.A O no hydrogen 2.700 N/A ASN 23.A N CYS 57.A O no hydrogen 3.002 N/A ASN 23.A ND2 ASP 21.A OD1 no hydrogen 3.436 N/A ASP 27.A N GLY 54.A O no hydrogen 3.223 N/A VAL 29.A N ARG 56.A O no hydrogen 2.711 N/A VAL 30.A N ARG 96.A O no hydrogen 2.838 N/A PHE 31.A N ILE 58.A O no hydrogen 2.960 N/A ILE 32.A N VAL 98.A O no hydrogen 2.763 N/A ARG 35.A NE LEU 194.A O no hydrogen 2.988 N/A ARG 35.A NH1 GLU 141.A OE2 no hydrogen 3.559 N/A ARG 35.A NH2 GLU 141.A OE2 no hydrogen 3.443 N/A ARG 35.A NH2 LEU 194.A O no hydrogen 3.547 N/A GLY 36.A N GLN 197.A OE1 no hydrogen 2.884 N/A GLY 37.A N GLY 34.A O no hydrogen 2.866 N/A GLY 39.A N ASP 61.A OD1 no hydrogen 3.009 N/A THR 41.A N ALA 38.A O no hydrogen 3.003 N/A THR 41.A OG1 ALA 38.A O no hydrogen 2.756 N/A TRP 42.A N GLY 39.A O no hydrogen 3.088 N/A HIS 43.A N ARG 40.A O no hydrogen 3.124 N/A HIS 43.A NE2 THR 59.A OG1 no hydrogen 3.006 N/A GLN 46.A N TRP 42.A O no hydrogen 2.972 N/A GLN 46.A NE2 PHE 256.A O no hydrogen 3.116 N/A GLN 46.A NE2 ASN 264.A OD1 no hydrogen 2.828 N/A VAL 47.A N TRP 42.A O no hydrogen 2.920 N/A PHE 50.A N GLN 46.A O no hydrogen 3.110 N/A LEU 51.A N VAL 47.A O no hydrogen 3.033 N/A ALA 52.A N PRO 48.A O no hydrogen 3.003 N/A ALA 53.A N ALA 49.A O no hydrogen 3.107 N/A GLY 54.A N LEU 51.A O no hydrogen 3.012 N/A TYR 55.A N PHE 50.A O no hydrogen 2.932 N/A ARG 56.A N ASP 27.A O no hydrogen 2.887 N/A ARG 56.A NE ASP 22.A OD1 no hydrogen 2.904 N/A ARG 56.A NE ASP 22.A OD2 no hydrogen 3.421 N/A ARG 56.A NH2 ASP 22.A OD2 no hydrogen 2.822 N/A CYS 57.A N ASN 23.A O no hydrogen 2.768 N/A ILE 58.A N VAL 29.A O no hydrogen 2.821 N/A THR 59.A N ASP 21.A O no hydrogen 3.145 N/A THR 59.A OG1 HIS 43.A NE2 no hydrogen 3.006 N/A ASP 61.A N ALA 19.A O no hydrogen 2.977 N/A ASN 62.A ND2 ALA 33.A O no hydrogen 2.948 N/A ARG 63.A NE ASP 82.A OD2 no hydrogen 2.822 N/A ARG 63.A NH2 ALA 8.A O no hydrogen 2.994 N/A ARG 63.A NH2 ASP 82.A OD1 no hydrogen 2.873 N/A ARG 63.A NH2 ASP 82.A OD2 no hydrogen 3.367 N/A GLY 64.A N THR 68.A OG1 no hydrogen 2.981 N/A ILE 65.A N ASN 62.A O no hydrogen 3.058 N/A THR 68.A N ILE 65.A O no hydrogen 3.055 N/A THR 68.A OG1 ILE 65.A O no hydrogen 3.545 N/A GLU 69.A N GLY 66.A O no hydrogen 3.065 N/A ALA 71.A N THR 68.A O no hydrogen 2.773 N/A THR 75.A N THR 78.A OG1 no hydrogen 2.932 N/A THR 75.A OG1 THR 78.A OG1 no hydrogen 3.220 N/A THR 78.A N THR 75.A OG1 no hydrogen 3.245 N/A THR 78.A OG1 THR 75.A O no hydrogen 3.448 N/A THR 78.A OG1 THR 75.A OG1 no hydrogen 3.220 N/A MET 79.A N THR 75.A O no hydrogen 3.251 N/A VAL 80.A N THR 76.A O no hydrogen 2.841 N/A ALA 81.A N GLN 77.A O no hydrogen 3.035 N/A ASP 82.A N THR 78.A O no hydrogen 2.896 N/A THR 83.A N MET 79.A O no hydrogen 3.055 N/A THR 83.A N VAL 80.A O no hydrogen 3.032 N/A THR 83.A OG1 MET 79.A O no hydrogen 2.747 N/A ALA 84.A N VAL 80.A O no hydrogen 2.961 N/A ALA 85.A N ALA 81.A O no hydrogen 2.764 N/A LEU 86.A N ASP 82.A O no hydrogen 2.935 N/A ILE 87.A N THR 83.A O no hydrogen 3.035 N/A GLU 88.A N ALA 84.A O no hydrogen 2.801 N/A THR 89.A N ALA 85.A O no hydrogen 2.834 N/A THR 89.A OG1 ALA 85.A O no hydrogen 2.623 N/A LEU 90.A N LEU 86.A O no hydrogen 3.144 N/A LEU 90.A N ILE 87.A O no hydrogen 3.249 N/A ASP 91.A N GLU 88.A O no hydrogen 3.213 N/A ILE 92.A N ILE 87.A O no hydrogen 3.328 N/A ALA 95.A N LEU 117.A O no hydrogen 2.753 N/A ARG 96.A NH2 PHE 271.A O no hydrogen 3.076 N/A VAL 97.A N SER 120.A O no hydrogen 2.929 N/A VAL 98.A N VAL 30.A O no hydrogen 2.851 N/A GLY 99.A N VAL 122.A O no hydrogen 2.974 N/A VAL 100.A N ILE 32.A O no hydrogen 3.198 N/A SER 101.A N MET 124.A O no hydrogen 2.821 N/A SER 101.A OG ALA 125.A O no hydrogen 3.138 N/A GLY 103.A N VAL 100.A O no hydrogen 2.958 N/A PHE 105.A N SER 101.A O no hydrogen 2.945 N/A ILE 106.A N MET 102.A O no hydrogen 2.885 N/A ALA 107.A N GLY 103.A O no hydrogen 2.992 N/A GLN 108.A N ALA 104.A O no hydrogen 2.973 N/A GLN 108.A NE2 ARG 127.A O no hydrogen 3.229 N/A GLN 108.A NE2 TYR 210.A OH no hydrogen 2.870 N/A GLU 109.A N PHE 105.A O no hydrogen 2.988 N/A LEU 110.A N ILE 106.A O no hydrogen 2.713 N/A MET 111.A N ALA 107.A O no hydrogen 2.849 N/A VAL 112.A N GLN 108.A O no hydrogen 3.057 N/A VAL 112.A N GLU 109.A O no hydrogen 3.170 N/A VAL 113.A N GLU 109.A O no hydrogen 3.241 N/A ALA 114.A N LEU 110.A O no hydrogen 2.858 N/A GLU 116.A N GLU 116.A OE1 no hydrogen 2.773 N/A LEU 117.A N ALA 114.A O no hydrogen 2.906 N/A VAL 118.A N PRO 115.A O no hydrogen 3.242 N/A SER 119.A N ALA 95.A O no hydrogen 2.876 N/A ALA 121.A N PRO 216.A O no hydrogen 3.112 N/A VAL 122.A N VAL 97.A O no hydrogen 2.914 N/A LEU 123.A N LEU 218.A O no hydrogen 2.823 N/A MET 124.A N GLY 99.A O no hydrogen 2.843 N/A ALA 125.A N ILE 220.A O no hydrogen 2.938 N/A THR 126.A OG1 GLN 108.A OE1 no hydrogen 2.698 N/A THR 126.A OG1 ARG 127.A O no hydrogen 3.393 N/A ARG 127.A N THR 126.A OG1 no hydrogen 2.711 N/A ARG 129.A NE GLU 235.A OE1 no hydrogen 2.794 N/A ARG 129.A NH2 GLU 235.A OE1 no hydrogen 3.563 N/A ARG 129.A NH2 GLU 235.A OE2 no hydrogen 2.895 N/A ARG 134.A N ASP 131.A OD1 no hydrogen 2.864 N/A ARG 134.A NE ASP 131.A OD1 no hydrogen 2.844 N/A ARG 134.A NH1 VAL 226.A O no hydrogen 2.805 N/A ARG 134.A NH2 ASP 131.A OD2 no hydrogen 2.976 N/A GLN 135.A N ASP 131.A O no hydrogen 2.952 N/A GLN 135.A NE2 GLN 135.A O no hydrogen 3.678 N/A PHE 136.A N ARG 132.A O no hydrogen 3.084 N/A PHE 137.A N ALA 133.A O no hydrogen 2.997 N/A ASN 138.A N ARG 134.A O no hydrogen 3.041 N/A ASN 138.A ND2 LEU 198.A O no hydrogen 3.159 N/A LYS 139.A N GLN 135.A O no hydrogen 2.971 N/A ALA 140.A N PHE 136.A O no hydrogen 2.768 N/A GLU 141.A N PHE 137.A O no hydrogen 2.901 N/A ALA 142.A N ASN 138.A O no hydrogen 3.053 N/A GLU 143.A N LYS 139.A O no hydrogen 2.910 N/A LEU 144.A N ALA 140.A O no hydrogen 2.978 N/A TYR 145.A N GLU 141.A O no hydrogen 3.127 N/A ASP 146.A N ALA 142.A O no hydrogen 2.767 N/A SER 147.A N GLU 143.A O no hydrogen 2.887 N/A SER 147.A OG LEU 144.A O no hydrogen 2.647 N/A GLY 148.A N TYR 145.A O no hydrogen 3.162 N/A VAL 149.A N SER 147.A OG no hydrogen 2.948 N/A ASP 156.A N PRO 152.A O no hydrogen 2.952 N/A ALA 157.A N PRO 153.A O no hydrogen 2.984 N/A ARG 158.A N THR 154.A O no hydrogen 2.921 N/A ALA 159.A N TYR 155.A O no hydrogen 2.963 N/A ARG 160.A N ASP 156.A O no hydrogen 2.965 N/A ARG 160.A NH1 PHE 183.A O no hydrogen 3.560 N/A ARG 160.A NH1 TRP 186.A O no hydrogen 3.079 N/A ARG 160.A NH2 TRP 186.A O no hydrogen 2.849 N/A LEU 161.A N ALA 157.A O no hydrogen 2.942 N/A LEU 162.A N ARG 158.A O no hydrogen 2.982 N/A GLU 163.A N ALA 159.A O no hydrogen 3.038 N/A ASN 164.A N LEU 161.A O no hydrogen 3.302 N/A ASN 164.A ND2 ARG 160.A O no hydrogen 2.889 N/A SER 166.A N GLU 258.A OE1 no hydrogen 2.859 N/A SER 166.A OG ASP 250.A O no hydrogen 3.164 N/A SER 166.A OG GLU 258.A OE1 no hydrogen 2.741 N/A ARG 167.A N ASP 224.A OD2 no hydrogen 2.830 N/A THR 169.A N SER 166.A OG no hydrogen 3.313 N/A THR 169.A OG1 GLU 258.A OE1 no hydrogen 2.565 N/A LEU 170.A N SER 166.A O no hydrogen 2.860 N/A ASN 171.A N ARG 167.A O no hydrogen 2.959 N/A ASP 172.A N THR 169.A O no hydrogen 2.946 N/A ALA 175.A N ASP 172.A OD1 no hydrogen 3.051 N/A VAL 176.A N ASP 172.A O no hydrogen 2.935 N/A GLY 177.A N ASP 173.A O no hydrogen 3.121 N/A ASP 178.A N VAL 174.A O no hydrogen 3.129 N/A TRP 179.A N ALA 175.A O no hydrogen 2.935 N/A ILE 180.A N VAL 176.A O no hydrogen 2.995 N/A ALA 181.A N GLY 177.A O no hydrogen 3.064 N/A MET 182.A N ASP 178.A O no hydrogen 2.976 N/A PHE 183.A N TRP 179.A O no hydrogen 2.900 N/A PHE 183.A N ILE 180.A O no hydrogen 3.171 N/A SER 184.A N ALA 181.A O no hydrogen 3.194 N/A SER 184.A OG ALA 181.A O no hydrogen 3.053 N/A MET 185.A N MET 182.A O no hydrogen 2.916 N/A TRP 186.A N PHE 183.A O no hydrogen 3.070 N/A LYS 189.A NZ GLU 69.A OE2 no hydrogen 3.193 N/A THR 191.A OG1 GLU 69.A O no hydrogen 3.320 N/A GLY 193.A N GLU 69.A O no hydrogen 2.758 N/A LEU 194.A N THR 191.A OG1 no hydrogen 2.883 N/A ARG 195.A N THR 191.A O no hydrogen 3.112 N/A ARG 195.A NE ASP 146.A OD1 no hydrogen 3.062 N/A ARG 195.A NH1 ARG 195.A O no hydrogen 2.993 N/A ARG 195.A NH1 ASP 199.A OD2 no hydrogen 2.981 N/A ARG 195.A NH2 ASP 146.A OD2 no hydrogen 3.302 N/A CYS 196.A N PRO 192.A O no hydrogen 2.851 N/A CYS 196.A SG PHE 74.A O no hydrogen 3.249 N/A GLN 197.A N GLY 193.A O no hydrogen 2.843 N/A GLN 197.A NE2 ARG 63.A O no hydrogen 2.886 N/A LEU 198.A N ARG 195.A O no hydrogen 3.144 N/A ASP 199.A N CYS 196.A O no hydrogen 3.012 N/A CYS 200.A N GLN 197.A O no hydrogen 3.032 N/A CYS 200.A SG CYS 196.A O no hydrogen 3.715 N/A ARG 206.A N GLY 128.A O no hydrogen 2.821 N/A ARG 206.A NE GLU 109.A OE1 no hydrogen 3.398 N/A ARG 206.A NE GLU 109.A OE2 no hydrogen 2.882 N/A ARG 206.A NH2 GLU 109.A OE1 no hydrogen 2.751 N/A ARG 206.A NH2 GLU 109.A OE2 no hydrogen 3.506 N/A LEU 207.A N ASN 205.A OD1 no hydrogen 3.018 N/A TYR 210.A N LEU 207.A O no hydrogen 3.093 N/A TYR 210.A OH GLU 109.A OE2 no hydrogen 2.763 N/A ARG 211.A N PRO 208.A O no hydrogen 3.184 N/A ASN 212.A N ALA 209.A O no hydrogen 3.357 N/A ILE 213.A N TYR 210.A O no hydrogen 3.104 N/A VAL 217.A N ASN 242.A O no hydrogen 3.101 N/A LEU 218.A N ALA 121.A O no hydrogen 2.865 N/A VAL 219.A N ARG 244.A O no hydrogen 2.873 N/A ILE 220.A N LEU 123.A O no hydrogen 2.794 N/A GLY 221.A N LEU 246.A O no hydrogen 2.824 N/A ALA 223.A N ILE 248.A O no hydrogen 2.993 N/A ASP 224.A N ALA 251.A O no hydrogen 2.841 N/A ASP 225.A N PHE 222.A O no hydrogen 3.006 N/A THR 228.A N ASP 225.A OD1 no hydrogen 2.759 N/A THR 228.A OG1 ASP 225.A OD2 no hydrogen 2.956 N/A TYR 231.A OH ASP 131.A OD2 no hydrogen 2.437 N/A LEU 232.A N PRO 229.A O no hydrogen 3.047 N/A GLY 233.A N PRO 230.A O no hydrogen 3.084 N/A ARG 234.A N PRO 230.A O no hydrogen 3.109 N/A GLU 235.A N TYR 231.A O no hydrogen 3.070 N/A VAL 236.A N LEU 232.A O no hydrogen 3.378 N/A ALA 237.A N GLY 233.A O no hydrogen 3.003 N/A ASP 238.A N ARG 234.A O no hydrogen 2.918 N/A ALA 239.A N GLU 235.A O no hydrogen 3.013 N/A LEU 240.A N VAL 236.A O no hydrogen 3.050 N/A ASN 242.A ND2 ALA 214.A O no hydrogen 2.709 N/A GLY 243.A N LEU 240.A O no hydrogen 3.073 N/A ARG 244.A N VAL 217.A O no hydrogen 3.075 N/A TYR 245.A OH GLN 247.A OE1 no hydrogen 2.820 N/A LEU 246.A N VAL 219.A O no hydrogen 2.833 N/A ILE 248.A N GLY 221.A O no hydrogen 2.833 N/A GLY 252.A N GLU 258.A OE2 no hydrogen 2.790 N/A HIS 253.A ND1 ASP 225.A OD2 no hydrogen 2.864 N/A LEU 254.A N ASN 164.A O no hydrogen 3.111 N/A PHE 257.A N LEU 254.A O no hydrogen 2.999 N/A GLU 258.A N LEU 254.A O no hydrogen 2.903 N/A ARG 259.A N GLY 255.A O no hydrogen 2.735 N/A ARG 259.A NE ASP 250.A O no hydrogen 2.671 N/A ARG 259.A NH1 SER 166.A OG no hydrogen 3.224 N/A ARG 259.A NH1 ASP 250.A O no hydrogen 3.220 N/A VAL 263.A N ARG 259.A O no hydrogen 3.182 N/A ASN 264.A N PRO 260.A O no hydrogen 2.654 N/A ASN 264.A ND2 HIS 45.A O no hydrogen 2.764 N/A THR 265.A N GLU 261.A O no hydrogen 2.873 N/A THR 265.A OG1 GLU 261.A O no hydrogen 2.968 N/A ALA 266.A N ALA 262.A O no hydrogen 3.149 N/A MET 267.A N VAL 263.A O no hydrogen 2.971 N/A LEU 268.A N ASN 264.A O no hydrogen 2.850 N/A LYS 269.A N THR 265.A O no hydrogen 3.040 N/A PHE 270.A N ALA 266.A O no hydrogen 3.003 N/A PHE 271.A N MET 267.A O no hydrogen 2.958 N/A ALA 272.A N LEU 268.A O no hydrogen 3.044 N/A SER 273.A N PHE 270.A O no hydrogen 3.191 N/A LYS 275.A NZ SER 119.A O no hydrogen 2.597 N/A