Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4rr5_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 2.A N THR 257.A OG1 no hydrogen 3.306 N/A LYS 2.A NZ MET 1.A O no hydrogen 3.348 N/A THR 3.A N ASP 82.A OD2 no hydrogen 2.538 N/A ALA 4.A N ASP 258.A O no hydrogen 2.861 N/A TRP 5.A N TYR 83.A O no hydrogen 2.858 N/A VAL 6.A N TRP 260.A O no hydrogen 2.850 N/A PHE 7.A N ALA 85.A O no hydrogen 2.980 N/A GLN 10.A NE2 ALA 54.A O no hydrogen 2.983 N/A GLN 10.A NE2 THR 59.A OG1 no hydrogen 3.342 N/A GLY 11.A N GLN 13.A OE1 no hydrogen 2.855 N/A SER 12.A N GLY 9.A O no hydrogen 3.141 N/A GLN 13.A N GLN 13.A OE1 no hydrogen 2.751 N/A GLY 16.A N CYS 46.A O no hydrogen 2.737 N/A MET 17.A N ALA 14.A O no hydrogen 3.210 N/A VAL 19.A N GLY 16.A O no hydrogen 3.169 N/A LEU 21.A N GLY 18.A O no hydrogen 3.028 N/A LEU 22.A N VAL 19.A O no hydrogen 3.312 N/A THR 24.A N LEU 21.A O no hydrogen 2.959 N/A THR 24.A OG1 LEU 21.A O no hydrogen 2.813 N/A ALA 27.A N THR 24.A OG1 no hydrogen 3.120 N/A LYS 28.A N THR 24.A O no hydrogen 3.034 N/A GLU 29.A N ALA 25.A O no hydrogen 3.020 N/A LYS 30.A N ILE 26.A O no hydrogen 3.129 N/A LYS 30.A NZ ASP 72.A OD2 no hydrogen 2.760 N/A TYR 31.A N ALA 27.A O no hydrogen 2.886 N/A TYR 31.A OH GLY 18.A O no hydrogen 2.785 N/A GLN 32.A N LYS 28.A O no hydrogen 3.100 N/A GLN 33.A N GLU 29.A O no hydrogen 2.942 N/A ALA 34.A N LYS 30.A O no hydrogen 2.747 N/A GLU 35.A N TYR 31.A O no hydrogen 2.910 N/A GLU 36.A N GLN 32.A O no hydrogen 3.070 N/A ILE 37.A N GLN 33.A O no hydrogen 3.087 N/A LEU 38.A N ALA 34.A O no hydrogen 2.824 N/A GLY 39.A N GLU 35.A O no hydrogen 2.825 N/A GLU 44.A N SER 41.A OG no hydrogen 3.123 N/A LYS 45.A N SER 41.A O no hydrogen 3.104 N/A LYS 45.A NZ ASN 58.A OD1 no hydrogen 3.246 N/A CYS 46.A N VAL 42.A O no hydrogen 2.955 N/A CYS 46.A SG VAL 42.A O no hydrogen 3.368 N/A GLN 47.A N GLU 44.A O no hydrogen 3.100 N/A GLY 48.A N LYS 45.A O no hydrogen 3.280 N/A LEU 53.A N ASP 49.A O no hydrogen 3.005 N/A ALA 54.A N GLU 50.A O no hydrogen 3.065 N/A ALA 54.A N ALA 51.A O no hydrogen 3.019 N/A LEU 55.A N SER 52.A O no hydrogen 3.379 N/A THR 56.A OG1 GLN 10.A OE1 no hydrogen 2.578 N/A GLN 57.A N GLN 57.A OE1 no hydrogen 2.995 N/A ASN 58.A N LEU 55.A O no hydrogen 2.718 N/A ASN 58.A ND2 SER 52.A O no hydrogen 2.702 N/A THR 59.A N LEU 55.A O no hydrogen 2.963 N/A THR 59.A OG1 LEU 53.A O no hydrogen 2.332 N/A THR 59.A OG1 LEU 55.A O no hydrogen 3.117 N/A GLN 60.A N THR 56.A O no hydrogen 3.055 N/A GLN 60.A NE2 THR 56.A OG1 no hydrogen 2.855 N/A CYS 62.A N ASN 58.A O no hydrogen 3.058 N/A CYS 62.A SG ASN 58.A O no hydrogen 3.367 N/A LEU 63.A N THR 59.A O no hydrogen 2.776 N/A TYR 64.A N GLN 60.A O no hydrogen 2.936 N/A TYR 64.A OH PHE 103.A O no hydrogen 2.874 N/A VAL 65.A N PRO 61.A O no hydrogen 2.946 N/A ILE 66.A N CYS 62.A O no hydrogen 3.109 N/A GLU 67.A N LEU 63.A O no hydrogen 2.895 N/A ALA 68.A N TYR 64.A O no hydrogen 2.881 N/A ILE 69.A N VAL 65.A O no hydrogen 2.959 N/A LEU 70.A N ILE 66.A O no hydrogen 2.785 N/A ALA 71.A N GLU 67.A O no hydrogen 2.870 N/A ASP 72.A N ALA 68.A O no hydrogen 3.112 N/A LEU 73.A N ILE 69.A O no hydrogen 2.883 N/A LEU 74.A N LEU 70.A O no hydrogen 2.903 N/A ARG 75.A N ALA 71.A O no hydrogen 3.007 N/A ARG 75.A NH2 ALA 97.A O no hydrogen 3.178 N/A ASP 76.A N ASP 72.A O no hydrogen 2.891 N/A LYS 77.A N LEU 73.A O no hydrogen 3.099 N/A LYS 77.A NZ LEU 290.A O no hydrogen 3.153 N/A GLY 78.A N ARG 75.A O no hydrogen 2.694 N/A PHE 79.A N LEU 74.A O no hydrogen 3.124 N/A ASP 82.A N THR 3.A O no hydrogen 2.681 N/A TYR 83.A N THR 3.A O no hydrogen 3.214 N/A VAL 84.A N PRO 214.A O no hydrogen 2.965 N/A ALA 85.A N TRP 5.A O no hydrogen 3.194 N/A HIS 87.A N PHE 7.A O no hydrogen 2.779 N/A HIS 87.A NE2 ASN 152.A OD1 no hydrogen 2.874 N/A SER 88.A N ASN 218.A OD1 no hydrogen 2.732 N/A SER 88.A OG HIS 188.A NE2 no hydrogen 2.572 N/A GLY 90.A N HIS 87.A O no hydrogen 2.960 N/A GLU 91.A N SER 88.A O no hydrogen 2.990 N/A TYR 92.A N LEU 89.A O no hydrogen 2.920 N/A SER 93.A OG GLU 67.A OE1 no hydrogen 2.553 N/A ALA 94.A N GLY 90.A O no hydrogen 2.794 N/A LEU 95.A N GLU 91.A O no hydrogen 2.711 N/A TYR 96.A N TYR 92.A O no hydrogen 2.934 N/A TYR 96.A OH ASP 72.A OD1 no hydrogen 3.041 N/A TYR 96.A OH ASP 72.A OD2 no hydrogen 2.575 N/A ALA 97.A N SER 93.A O no hydrogen 2.908 N/A ALA 98.A N LEU 95.A O no hydrogen 3.183 N/A GLY 99.A N TYR 96.A O no hydrogen 3.209 N/A VAL 100.A N LEU 95.A O no hydrogen 3.076 N/A THR 105.A N ASP 102.A OD1 no hydrogen 2.861 N/A THR 105.A OG1 ASP 102.A OD1 no hydrogen 2.554 N/A GLY 106.A N ASP 102.A O no hydrogen 3.138 N/A LEU 107.A N PHE 103.A O no hydrogen 3.046 N/A GLN 108.A N ALA 104.A O no hydrogen 3.029 N/A LEU 109.A N THR 105.A O no hydrogen 3.072 N/A VAL 110.A N GLY 106.A O no hydrogen 2.896 N/A LYS 111.A N LEU 107.A O no hydrogen 2.812 N/A LYS 111.A NZ GLU 115.A OE2 no hydrogen 3.399 N/A GLN 112.A N GLN 108.A O no hydrogen 3.058 N/A GLN 112.A NE2 THR 202.A OG1 no hydrogen 2.976 N/A ARG 113.A N LEU 109.A O no hydrogen 2.776 N/A ARG 113.A NH1 GLN 60.A OE1 no hydrogen 2.902 N/A ARG 113.A NH2 SER 88.A OG no hydrogen 3.131 N/A ARG 113.A NH2 GLN 237.A OE1 no hydrogen 2.730 N/A SER 114.A N VAL 110.A O no hydrogen 2.849 N/A SER 114.A OG VAL 110.A O no hydrogen 3.026 N/A SER 114.A OG LYS 111.A O no hydrogen 3.027 N/A GLU 115.A N LYS 111.A O no hydrogen 3.147 N/A VAL 116.A N GLN 112.A O no hydrogen 3.000 N/A MET 117.A N ARG 113.A O no hydrogen 3.133 N/A ALA 118.A N SER 114.A O no hydrogen 3.048 N/A SER 119.A N GLU 115.A O no hydrogen 2.956 N/A SER 119.A OG GLU 115.A O no hydrogen 3.116 N/A ALA 120.A N MET 117.A O no hydrogen 3.238 N/A SER 121.A OG SER 184.A O no hydrogen 2.255 N/A MET 124.A N GLY 161.A O no hydrogen 2.803 N/A ALA 126.A N ILE 159.A O no hydrogen 3.097 N/A ALA 127.A N VAL 179.A O no hydrogen 2.889 N/A LEU 128.A N VAL 157.A O no hydrogen 2.875 N/A MET 129.A N ARG 177.A O no hydrogen 3.085 N/A LYS 130.A N GLU 155.A O no hydrogen 2.586 N/A ASP 132.A N LYS 174.A O no hydrogen 2.773 N/A GLN 135.A N ASP 132.A OD2 no hydrogen 2.945 N/A LEU 136.A N ASP 132.A O no hydrogen 2.793 N/A GLN 137.A N GLN 133.A O no hydrogen 3.268 N/A GLN 138.A N THR 134.A O no hydrogen 3.271 N/A ALA 139.A N GLN 135.A O no hydrogen 3.361 N/A LEU 140.A N GLN 137.A O no hydrogen 3.164 N/A THR 141.A N GLN 137.A O no hydrogen 2.609 N/A THR 141.A OG1 GLN 137.A O no hydrogen 3.251 N/A ASN 143.A N LEU 140.A O no hydrogen 2.952 N/A ASN 143.A ND2 ALA 139.A O no hydrogen 2.541 N/A THR 144.A OG1 GLU 145.A OE2 no hydrogen 2.200 N/A VAL 147.A N SER 160.A O no hydrogen 2.825 N/A ALA 149.A N VAL 158.A O no hydrogen 2.795 N/A ASN 150.A N VAL 158.A O no hydrogen 3.093 N/A ASP 151.A N VAL 242.A O no hydrogen 2.673 N/A ASN 152.A N GLN 156.A O no hydrogen 3.158 N/A SER 153.A N GLN 156.A O no hydrogen 3.044 N/A GLN 156.A N SER 153.A O no hydrogen 2.686 N/A VAL 157.A N LEU 128.A O no hydrogen 3.201 N/A VAL 158.A N ASN 150.A O no hydrogen 3.009 N/A ILE 159.A N ALA 126.A O no hydrogen 2.860 N/A SER 160.A N VAL 147.A O no hydrogen 2.771 N/A SER 160.A OG PHE 187.A O no hydrogen 2.690 N/A GLY 161.A N MET 124.A O no hydrogen 2.933 N/A THR 162.A N GLU 145.A O no hydrogen 2.984 N/A GLY 165.A N THR 162.A OG1 no hydrogen 3.053 N/A VAL 166.A N THR 162.A O no hydrogen 3.008 N/A GLU 167.A N VAL 163.A O no hydrogen 3.075 N/A ALA 168.A N ALA 164.A O no hydrogen 3.151 N/A ILE 169.A N GLY 165.A O no hydrogen 3.379 N/A LEU 170.A N VAL 166.A O no hydrogen 3.186 N/A ALA 171.A N GLU 167.A O no hydrogen 3.308 N/A ALA 171.A N ALA 168.A O no hydrogen 2.804 N/A ASN 172.A N ALA 168.A O no hydrogen 3.092 N/A ASN 172.A N ILE 169.A O no hydrogen 3.220 N/A LYS 174.A N GLN 135.A OE1 no hydrogen 2.717 N/A VAL 179.A N ALA 127.A O no hydrogen 2.951 N/A LEU 181.A N MET 125.A O no hydrogen 2.862 N/A HIS 188.A ND1 GLN 237.A O no hydrogen 2.932 N/A HIS 188.A ND1 GLY 240.A O no hydrogen 2.779 N/A HIS 188.A NE2 SER 88.A OG no hydrogen 2.572 N/A SER 189.A OG ALA 186.A O no hydrogen 2.701 N/A PHE 191.A N SER 189.A OG no hydrogen 3.145 N/A MET 192.A N SER 189.A O no hydrogen 3.009 N/A ALA 193.A N SER 190.A O no hydrogen 2.990 N/A SER 196.A N MET 192.A O no hydrogen 2.411 N/A GLN 197.A N GLN 194.A O no hydrogen 3.203 N/A ALA 200.A N SER 196.A O no hydrogen 3.257 N/A GLN 201.A N GLN 197.A O no hydrogen 3.443 N/A THR 202.A N SER 198.A O no hydrogen 3.392 N/A LEU 203.A N PHE 199.A O no hydrogen 2.848 N/A THR 204.A N ALA 200.A O no hydrogen 2.905 N/A THR 204.A OG1 ALA 200.A O no hydrogen 2.674 N/A THR 204.A OG1 GLN 201.A O no hydrogen 3.131 N/A CYS 206.A N LEU 203.A O no hydrogen 3.026 N/A CYS 206.A SG HIS 207.A O no hydrogen 3.962 N/A ASN 209.A N VAL 100.A O no hydrogen 2.871 N/A ASN 209.A ND2 GLY 99.A O no hydrogen 2.965 N/A ALA 211.A N GLN 225.A O no hydrogen 2.787 N/A THR 212.A N ALA 98.A O no hydrogen 2.946 N/A THR 212.A OG1 ALA 98.A O no hydrogen 3.318 N/A VAL 215.A N THR 224.A O no hydrogen 2.947 N/A LEU 216.A N VAL 84.A O no hydrogen 2.945 N/A ASN 218.A N GLU 91.A OE2 no hydrogen 2.682 N/A ASN 218.A ND2 GLY 86.A O no hydrogen 2.790 N/A ASP 220.A N SER 217.A O no hydrogen 3.028 N/A SER 222.A OG ASP 220.A OD1 no hydrogen 3.130 N/A SER 222.A OG ASP 220.A OD2 no hydrogen 3.506 N/A THR 224.A N VAL 215.A O no hydrogen 3.214 N/A GLN 225.A NE2 ALA 211.A O no hydrogen 2.467 N/A ASN 226.A N THR 224.A OG1 no hydrogen 3.170 N/A GLY 227.A N ASP 210.A OD1 no hydrogen 2.659 N/A ARG 229.A N ASN 226.A OD1 no hydrogen 2.850 N/A LEU 230.A N ASN 226.A O no hydrogen 3.030 N/A LYS 231.A N GLY 227.A O no hydrogen 3.091 N/A LYS 231.A NZ THR 204.A O no hydrogen 2.918 N/A LYS 231.A NZ CYS 206.A O no hydrogen 2.339 N/A GLU 232.A N ASP 228.A O no hydrogen 3.053 N/A LYS 233.A N ARG 229.A O no hydrogen 2.808 N/A LYS 233.A NZ ASP 220.A O no hydrogen 2.540 N/A LYS 233.A NZ ASP 220.A OD2 no hydrogen 3.224 N/A LYS 233.A NZ SER 222.A O no hydrogen 3.218 N/A LEU 234.A N LEU 230.A O no hydrogen 2.822 N/A ILE 235.A N LYS 231.A O no hydrogen 2.721 N/A GLN 236.A N GLU 232.A O no hydrogen 3.099 N/A GLN 236.A NE2 GLU 232.A OE2 no hydrogen 3.288 N/A GLN 237.A N LEU 234.A O no hydrogen 2.845 N/A GLN 237.A NE2 SER 88.A O no hydrogen 2.852 N/A GLN 237.A NE2 ASN 218.A OD1 no hydrogen 2.826 N/A GLY 240.A N GLN 237.A O no hydrogen 3.239 N/A SER 241.A OG LEU 148.A O no hydrogen 3.178 N/A VAL 242.A N ALA 149.A O no hydrogen 2.701 N/A ARG 243.A N ASN 218.A O no hydrogen 3.076 N/A ARG 243.A NE GLU 246.A OE1 no hydrogen 2.700 N/A ARG 243.A NH1 VAL 219.A O no hydrogen 2.973 N/A ARG 243.A NH2 GLU 246.A OE1 no hydrogen 3.131 N/A ARG 243.A NH2 GLU 246.A OE2 no hydrogen 2.505 N/A ARG 245.A N ASP 151.A O no hydrogen 2.758 N/A ARG 245.A NE ASP 151.A OD1 no hydrogen 3.330 N/A ARG 245.A NE ASP 151.A OD2 no hydrogen 2.736 N/A THR 247.A N ARG 243.A O no hydrogen 3.103 N/A THR 247.A OG1 ARG 243.A O no hydrogen 2.809 N/A MET 248.A N TRP 244.A O no hydrogen 3.037 N/A VAL 249.A N ARG 245.A O no hydrogen 3.179 N/A ASN 250.A N GLU 246.A O no hydrogen 3.027 N/A ASN 250.A ND2 PRO 221.A O no hydrogen 2.506 N/A LEU 251.A N THR 247.A O no hydrogen 3.054 N/A GLY 252.A N MET 248.A O no hydrogen 3.020 N/A GLU 253.A N VAL 249.A O no hydrogen 3.131 N/A ILE 254.A N ASN 250.A O no hydrogen 2.903 N/A ILE 254.A N LEU 251.A O no hydrogen 3.191 N/A ALA 256.A N LEU 251.A O no hydrogen 3.141 N/A THR 257.A N LYS 2.A O no hydrogen 2.844 N/A THR 257.A OG1 LYS 2.A O no hydrogen 3.246 N/A THR 257.A OG1 ASP 258.A OD1 no hydrogen 2.431 N/A ASP 258.A N LYS 2.A O no hydrogen 3.025 N/A TYR 259.A N ASN 280.A O no hydrogen 2.766 N/A TYR 259.A OH LEU 268.A O no hydrogen 2.707 N/A TRP 260.A N ALA 4.A O no hydrogen 2.791 N/A GLU 261.A N LYS 282.A O no hydrogen 2.842 N/A VAL 262.A N VAL 6.A O no hydrogen 2.907 N/A GLY 263.A N ILE 284.A O no hydrogen 2.970 N/A LEU 268.A N GLU 261.A OE1 no hydrogen 3.242 N/A LEU 268.A N GLU 261.A OE2 no hydrogen 3.048 N/A THR 269.A N GLU 261.A OE1 no hydrogen 3.027 N/A THR 269.A OG1 GLU 261.A OE1 no hydrogen 3.176 N/A THR 269.A OG1 LYS 266.A O no hydrogen 3.221 N/A GLY 270.A N LYS 266.A O no hydrogen 2.850 N/A LEU 271.A N VAL 267.A O no hydrogen 2.943 N/A CYS 272.A N LEU 268.A O no hydrogen 3.150 N/A CYS 272.A SG CYS 276.A O no hydrogen 3.890 N/A LYS 273.A N THR 269.A O no hydrogen 2.908 N/A ARG 274.A NH1 GLU 155.A OE2 no hydrogen 3.068 N/A THR 275.A N CYS 272.A O no hydrogen 3.200 N/A THR 275.A OG1 LEU 271.A O no hydrogen 3.330 N/A CYS 276.A N CYS 272.A O no hydrogen 2.903 N/A CYS 276.A SG MET 248.A O no hydrogen 3.562 N/A ASP 278.A N ASP 278.A OD1 no hydrogen 2.650 N/A LEU 279.A N CYS 276.A O no hydrogen 3.167 N/A ASN 280.A N THR 257.A O no hydrogen 3.273 N/A ASN 280.A ND2 THR 257.A O no hydrogen 2.835 N/A LYS 282.A N TYR 259.A O no hydrogen 3.149 N/A ASN 283.A ND2 THR 269.A OG1 no hydrogen 2.915 N/A ILE 284.A N GLU 261.A O no hydrogen 2.807 N/A GLY 285.A N ASP 289.A OD2 no hydrogen 2.939 N/A GLN 286.A N ASP 289.A OD2 no hydrogen 2.863 N/A LEU 287.A N ASP 20.A OD2 no hydrogen 2.650 N/A LEU 290.A N GLN 286.A O no hydrogen 3.177 N/A ASN 291.A N LEU 287.A O no hydrogen 2.989 N/A SER 292.A N ASP 289.A O no hydrogen 3.317 N/A SER 292.A OG ASP 288.A O no hydrogen 3.052 N/A LEU 293.A N LEU 290.A O no hydrogen 3.124 N/A