REMARK Name = BDB059808 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 CA ARG A 17 1.547 3.716 -3.206 0.00 0.00 +0.159 C ENDROOT BRANCH 1 3 ATOM 2 C SER A 16 2.554 4.960 -5.092 0.00 0.00 +0.236 C ATOM 3 N ARG A 17 2.494 4.715 -3.730 0.00 0.00 -0.302 N ATOM 4 H ARG A 17 3.221 5.112 -3.130 0.00 0.00 +0.150 HD ATOM 5 O SER A 16 2.092 4.210 -5.937 0.00 0.00 -0.274 OA BRANCH 2 6 ATOM 6 CA SER A 16 3.297 6.269 -5.477 0.00 0.00 +0.184 C BRANCH 6 8 ATOM 7 C GLY A 15 2.137 7.896 -3.916 0.00 0.00 +0.231 C ATOM 8 N SER A 16 3.234 7.211 -4.349 0.00 0.00 -0.301 N ATOM 9 H SER A 16 4.123 7.537 -3.975 0.00 0.00 +0.150 HD ATOM 10 O GLY A 15 2.215 8.564 -2.882 0.00 0.00 -0.274 OA BRANCH 7 11 ATOM 11 CA GLY A 15 0.809 7.715 -4.686 0.00 0.00 +0.200 C BRANCH 11 13 ATOM 12 C GLN A 14 -0.578 9.736 -4.359 0.00 0.00 +0.234 C ATOM 13 N GLY A 15 -0.233 8.446 -3.981 0.00 0.00 -0.305 N ATOM 14 H GLY A 15 -0.325 8.227 -2.996 0.00 0.00 +0.149 HD ATOM 15 O GLN A 14 -0.247 10.212 -5.439 0.00 0.00 -0.274 OA BRANCH 12 16 ATOM 16 CA GLN A 14 -1.441 10.503 -3.333 0.00 0.00 +0.159 C BRANCH 16 18 ATOM 17 C ILE A 13 -3.870 10.693 -3.030 0.00 0.00 +0.234 C ATOM 18 N GLN A 14 -2.765 9.888 -3.241 0.00 0.00 -0.302 N ATOM 19 H GLN A 14 -2.953 9.072 -3.821 0.00 0.00 +0.150 HD ATOM 20 O ILE A 13 -3.772 11.904 -2.822 0.00 0.00 -0.274 OA BRANCH 17 21 ATOM 21 CA ILE A 13 -5.243 9.986 -2.973 0.00 0.00 +0.162 C BRANCH 21 22 ATOM 22 N ILE A 13 -5.229 8.529 -3.107 0.00 0.00 -0.302 N ATOM 23 H ILE A 13 -5.008 7.987 -2.272 0.00 0.00 +0.150 HD ATOM 24 C PRO A 12 -5.702 7.909 -4.246 0.00 0.00 +0.234 C ATOM 25 O PRO A 12 -5.514 8.417 -5.350 0.00 0.00 -0.274 OA BRANCH 24 26 ATOM 26 CA PRO A 12 -6.561 6.607 -4.020 0.00 0.00 +0.162 C ATOM 27 N PRO A 12 -6.264 5.494 -4.934 0.00 0.00 -0.288 N ATOM 28 C ALA A 11 -6.855 5.425 -6.179 0.00 0.00 +0.236 C ATOM 29 O ALA A 11 -7.450 6.399 -6.661 0.00 0.00 -0.274 OA ATOM 30 CD PRO A 12 -5.680 4.384 -4.206 0.00 0.00 +0.109 C ATOM 31 CG PRO A 12 -5.303 4.963 -2.856 0.00 0.00 +0.021 C ATOM 32 CB PRO A 12 -6.435 5.960 -2.637 0.00 0.00 +0.033 C BRANCH 28 33 ATOM 33 CA ALA A 11 -6.971 4.052 -6.899 0.00 0.00 +0.156 C ATOM 34 CB ALA A 11 -8.140 3.279 -6.278 0.00 0.00 +0.038 C BRANCH 33 35 ATOM 35 N ALA A 11 -5.701 3.295 -7.024 0.00 0.00 -0.303 N ATOM 36 H ALA A 11 -4.965 3.875 -7.421 0.00 0.00 +0.149 HD ATOM 37 C ASN A 10 -5.685 1.975 -7.444 0.00 0.00 +0.234 C ATOM 38 O ASN A 10 -6.691 1.253 -7.479 0.00 0.00 -0.274 OA BRANCH 37 39 ATOM 39 CA ASN A 10 -4.335 1.427 -7.969 0.00 0.00 +0.168 C BRANCH 39 40 ATOM 40 N ASN A 10 -4.477 -0.049 -7.899 0.00 0.00 -0.302 N ATOM 41 H ASN A 10 -5.437 -0.363 -8.022 0.00 0.00 +0.150 HD ATOM 42 C VAL A 9 -3.545 -0.878 -7.335 0.00 0.00 +0.234 C ATOM 43 O VAL A 9 -2.396 -0.481 -7.075 0.00 0.00 -0.274 OA BRANCH 42 44 ATOM 44 CA VAL A 9 -3.960 -2.372 -7.180 0.00 0.00 +0.161 C BRANCH 44 45 ATOM 45 N VAL A 9 -2.989 -3.013 -6.263 0.00 0.00 -0.302 N ATOM 46 H VAL A 9 -2.508 -2.380 -5.644 0.00 0.00 +0.150 HD ATOM 47 C GLU A 8 -2.366 -4.210 -6.553 0.00 0.00 +0.234 C ATOM 48 O GLU A 8 -2.460 -4.736 -7.663 0.00 0.00 -0.274 OA BRANCH 47 49 ATOM 49 CA GLU A 8 -1.432 -4.786 -5.454 0.00 0.00 +0.159 C BRANCH 49 50 ATOM 50 N GLU A 8 -0.051 -4.489 -5.843 0.00 0.00 -0.302 N ATOM 51 H GLU A 8 0.087 -4.251 -6.825 0.00 0.00 +0.150 HD ATOM 52 C CYS A 7 1.000 -5.170 -5.243 0.00 0.00 +0.235 C ATOM 53 O CYS A 7 0.907 -5.643 -4.100 0.00 0.00 -0.274 OA BRANCH 52 54 ATOM 54 CA CYS A 7 2.289 -5.260 -6.091 0.00 0.00 +0.168 C BRANCH 54 55 ATOM 55 N CYS A 7 3.091 -4.035 -5.971 0.00 0.00 -0.302 N ATOM 56 H CYS A 7 3.181 -3.586 -5.070 0.00 0.00 +0.150 HD ATOM 57 C ASP A 6 3.964 -3.642 -6.982 0.00 0.00 +0.235 C ATOM 58 O ASP A 6 3.788 -3.978 -8.149 0.00 0.00 -0.274 OA BRANCH 57 59 ATOM 59 CA ASP A 6 5.203 -2.817 -6.523 0.00 0.00 +0.169 C BRANCH 59 60 ATOM 60 N ASP A 6 5.129 -2.544 -5.079 0.00 0.00 -0.302 N ATOM 61 H ASP A 6 4.948 -3.348 -4.484 0.00 0.00 +0.150 HD ATOM 62 C TYR A 5 5.901 -1.604 -4.418 0.00 0.00 +0.234 C ATOM 63 O TYR A 5 6.993 -1.217 -4.832 0.00 0.00 -0.274 OA BRANCH 62 64 ATOM 64 CA TYR A 5 5.203 -0.986 -3.181 0.00 0.00 +0.163 C BRANCH 64 65 ATOM 65 N TYR A 5 4.296 -1.963 -2.583 0.00 0.00 -0.302 N ATOM 66 H TYR A 5 3.372 -2.019 -3.014 0.00 0.00 +0.150 HD ATOM 67 C SER A 4 4.690 -3.032 -1.817 0.00 0.00 +0.236 C ATOM 68 O SER A 4 5.835 -3.186 -1.394 0.00 0.00 -0.274 OA BRANCH 67 69 ATOM 69 CA SER A 4 3.603 -4.128 -1.610 0.00 0.00 +0.184 C BRANCH 69 70 ATOM 70 N SER A 4 4.016 -5.041 -0.549 0.00 0.00 -0.300 N ATOM 71 H SER A 4 5.013 -4.937 -0.350 0.00 0.00 +0.150 HD ATOM 72 C THR A 3 3.726 -6.379 -0.591 0.00 0.00 +0.237 C ATOM 73 O THR A 3 4.663 -7.185 -0.615 0.00 0.00 -0.274 OA BRANCH 72 74 ATOM 74 CA THR A 3 2.256 -6.857 -0.513 0.00 0.00 +0.187 C BRANCH 74 75 ATOM 75 N THR A 3 2.242 -8.318 -0.708 0.00 0.00 -0.300 N ATOM 76 H THR A 3 3.192 -8.643 -0.485 0.00 0.00 +0.150 HD ATOM 77 C LEU A 2 1.902 -8.799 -1.941 0.00 0.00 +0.234 C ATOM 78 O LEU A 2 2.798 -9.000 -2.756 0.00 0.00 -0.274 OA BRANCH 77 79 ATOM 79 CA LEU A 2 0.400 -8.987 -2.224 0.00 0.00 +0.159 C BRANCH 79 80 ATOM 80 N LEU A 2 0.231 -9.235 -3.669 0.00 0.00 -0.303 N ATOM 81 H LEU A 2 0.670 -8.547 -4.257 0.00 0.00 +0.149 HD ATOM 82 C GLN A 1 0.308 -10.492 -4.224 0.00 0.00 +0.230 C ATOM 83 O GLN A 1 0.058 -11.541 -3.641 0.00 0.00 -0.274 OA BRANCH 82 84 ATOM 84 CA GLN A 1 0.798 -10.507 -5.693 0.00 0.00 +0.138 C BRANCH 84 85 ATOM 85 N GLN A 1 0.222 -9.358 -6.434 0.00 0.00 -0.320 NA ATOM 86 H1 GLN A 1 -0.791 -9.398 -6.301 0.00 0.00 +0.119 HD ATOM 87 H2 GLN A 1 0.347 -9.550 -7.434 0.00 0.00 +0.119 HD ENDBRANCH 84 85 BRANCH 84 88 ATOM 88 CB GLN A 1 2.331 -10.452 -5.680 0.00 0.00 +0.037 C BRANCH 88 89 ATOM 89 CG GLN A 1 2.971 -10.532 -7.053 0.00 0.00 +0.097 C BRANCH 89 90 ATOM 90 CD GLN A 1 4.481 -10.583 -6.954 0.00 0.00 +0.211 C ATOM 91 OE1 GLN A 1 5.111 -10.689 -5.911 0.00 0.00 -0.276 OA ATOM 92 NE2 GLN A 1 5.115 -10.509 -8.169 0.00 0.00 -0.329 N ATOM 93 HE21 GLN A 1 4.665 -10.042 -8.948 0.00 0.00 +0.145 HD ATOM 94 HE22 GLN A 1 6.134 -10.411 -8.124 0.00 0.00 +0.145 HD ENDBRANCH 89 90 ENDBRANCH 88 89 ENDBRANCH 84 88 ENDBRANCH 82 84 ENDBRANCH 79 80 BRANCH 79 95 ATOM 95 CB LEU A 2 -0.373 -9.942 -1.275 0.00 0.00 +0.034 C BRANCH 95 96 ATOM 96 CG LEU A 2 0.411 -11.120 -0.627 0.00 0.00 -0.015 C ATOM 97 CD2 LEU A 2 -0.411 -12.422 -0.674 0.00 0.00 +0.007 C ATOM 98 CD1 LEU A 2 0.741 -10.856 0.844 0.00 0.00 +0.007 C ENDBRANCH 95 96 ENDBRANCH 79 95 ENDBRANCH 77 79 ENDBRANCH 74 75 BRANCH 74 99 ATOM 99 CB THR A 3 1.692 -6.516 0.886 0.00 0.00 +0.141 C ATOM 100 CG2 THR A 3 0.175 -6.709 0.960 0.00 0.00 +0.040 C BRANCH 99 101 ATOM 101 OG1 THR A 3 2.342 -7.300 1.883 0.00 0.00 -0.390 OA ATOM 102 HG1 THR A 3 1.736 -8.022 2.161 0.00 0.00 +0.210 HD ENDBRANCH 99 101 ENDBRANCH 74 99 ENDBRANCH 72 74 ENDBRANCH 69 70 BRANCH 69 103 ATOM 103 CB SER A 4 2.265 -3.470 -1.338 0.00 0.00 +0.187 C BRANCH 103 104 ATOM 104 OG SER A 4 1.784 -2.862 -2.539 0.00 0.00 -0.393 OA ATOM 105 H SER A 4 0.814 -3.079 -2.583 0.00 0.00 +0.209 HD ENDBRANCH 103 104 ENDBRANCH 69 103 ENDBRANCH 67 69 ENDBRANCH 64 65 BRANCH 64 106 ATOM 106 CB TYR A 5 6.173 -0.291 -2.209 0.00 0.00 +0.067 C BRANCH 106 107 ATOM 107 CG TYR A 5 6.275 1.210 -2.408 0.00 0.00 -0.045 A ATOM 108 CD2 TYR A 5 6.846 1.757 -3.561 0.00 0.00 +0.007 A ATOM 109 CE2 TYR A 5 6.939 3.146 -3.721 0.00 0.00 +0.045 A ATOM 110 CZ TYR A 5 6.478 3.996 -2.716 0.00 0.00 +0.117 A ATOM 111 CE1 TYR A 5 5.898 3.470 -1.571 0.00 0.00 +0.045 A ATOM 112 CD1 TYR A 5 5.803 2.093 -1.427 0.00 0.00 +0.007 A BRANCH 110 113 ATOM 113 OH TYR A 5 6.616 5.335 -2.885 0.00 0.00 -0.507 OA ATOM 114 HH TYR A 5 6.452 5.776 -2.027 0.00 0.00 +0.292 HD ENDBRANCH 110 113 ENDBRANCH 106 107 ENDBRANCH 64 106 ENDBRANCH 62 64 ENDBRANCH 59 60 BRANCH 59 115 ATOM 115 CB ASP A 6 6.455 -3.587 -6.955 0.00 0.00 +0.152 C BRANCH 115 116 ATOM 116 CG ASP A 6 7.649 -2.692 -7.058 0.00 0.00 +0.307 C ATOM 117 OD1 ASP A 6 7.680 -1.603 -7.598 0.00 0.00 -0.251 OA BRANCH 116 118 ATOM 118 OD2 ASP A 6 8.730 -3.193 -6.432 0.00 0.00 -0.481 OA ATOM 119 HD2 ASP A 6 9.251 -2.385 -6.173 0.00 0.00 +0.295 HD ENDBRANCH 116 118 ENDBRANCH 115 116 ENDBRANCH 59 115 ENDBRANCH 57 59 ENDBRANCH 54 55 BRANCH 54 120 ATOM 120 CB CYS A 7 3.060 -6.500 -5.590 0.00 0.00 +0.097 C BRANCH 120 121 ATOM 121 SG CYS A 7 4.517 -6.946 -6.598 0.00 0.00 -0.176 S ATOM 122 HG CYS A 7 4.953 -7.948 -5.804 0.00 0.00 +0.102 HD ENDBRANCH 120 121 ENDBRANCH 54 120 ENDBRANCH 52 54 ENDBRANCH 49 50 BRANCH 49 123 ATOM 123 CB GLU A 8 -1.794 -4.388 -4.013 0.00 0.00 +0.043 C BRANCH 123 124 ATOM 124 CG GLU A 8 -2.558 -5.491 -3.277 0.00 0.00 +0.123 C BRANCH 124 125 ATOM 125 CD GLU A 8 -3.239 -4.957 -2.054 0.00 0.00 +0.305 C ATOM 126 OE1 GLU A 8 -4.463 -4.886 -1.927 0.00 0.00 -0.251 OA BRANCH 125 127 ATOM 127 OE2 GLU A 8 -2.416 -4.498 -1.086 0.00 0.00 -0.481 OA ATOM 128 HE2 GLU A 8 -1.463 -4.507 -1.357 0.00 0.00 +0.295 HD ENDBRANCH 125 127 ENDBRANCH 124 125 ENDBRANCH 123 124 ENDBRANCH 49 123 ENDBRANCH 47 49 ENDBRANCH 44 45 BRANCH 44 129 ATOM 129 CB VAL A 9 -5.411 -2.579 -6.662 0.00 0.00 +0.012 C ATOM 130 CG2 VAL A 9 -5.817 -4.055 -6.661 0.00 0.00 +0.009 C ATOM 131 CG1 VAL A 9 -5.657 -1.967 -5.287 0.00 0.00 +0.009 C ENDBRANCH 44 129 ENDBRANCH 42 44 ENDBRANCH 39 40 BRANCH 39 132 ATOM 132 CB ASN A 10 -4.134 1.837 -9.442 0.00 0.00 +0.127 C BRANCH 132 133 ATOM 133 CG ASN A 10 -3.778 3.290 -9.533 0.00 0.00 +0.213 C ATOM 134 OD1 ASN A 10 -3.584 4.021 -8.566 0.00 0.00 -0.276 OA ATOM 135 ND2 ASN A 10 -3.783 3.788 -10.797 0.00 0.00 -0.329 N ATOM 136 HD21 ASN A 10 -3.606 3.182 -11.586 0.00 0.00 +0.145 HD ATOM 137 HD22 ASN A 10 -3.409 4.734 -10.924 0.00 0.00 +0.145 HD ENDBRANCH 132 133 ENDBRANCH 39 132 ENDBRANCH 37 39 ENDBRANCH 33 35 ENDBRANCH 28 33 ENDBRANCH 24 26 ENDBRANCH 21 22 BRANCH 21 138 ATOM 138 CB ILE A 13 -5.973 10.399 -1.647 0.00 0.00 +0.015 C ATOM 139 CG2 ILE A 13 -7.457 10.003 -1.685 0.00 0.00 +0.010 C BRANCH 138 141 ATOM 140 CD1 ILE A 13 -5.735 10.478 0.911 0.00 0.00 +0.004 C ATOM 141 CG1 ILE A 13 -5.264 9.837 -0.388 0.00 0.00 +0.002 C ENDBRANCH 138 141 ENDBRANCH 21 138 ENDBRANCH 17 21 ENDBRANCH 16 18 BRANCH 16 142 ATOM 142 CB GLN A 14 -0.742 10.559 -1.956 0.00 0.00 +0.041 C BRANCH 142 143 ATOM 143 CG GLN A 14 -1.294 11.644 -1.035 0.00 0.00 +0.098 C BRANCH 143 144 ATOM 144 CD GLN A 14 -0.405 11.783 0.182 0.00 0.00 +0.211 C ATOM 145 OE1 GLN A 14 0.523 12.581 0.252 0.00 0.00 -0.276 OA ATOM 146 NE2 GLN A 14 -0.682 10.929 1.216 0.00 0.00 -0.329 N ATOM 147 HE21 GLN A 14 -0.078 10.977 2.038 0.00 0.00 +0.145 HD ATOM 148 HE22 GLN A 14 -1.425 10.250 1.216 0.00 0.00 +0.145 HD ENDBRANCH 143 144 ENDBRANCH 142 143 ENDBRANCH 16 142 ENDBRANCH 12 16 ENDBRANCH 11 13 ENDBRANCH 7 11 ENDBRANCH 6 8 BRANCH 6 149 ATOM 149 CB SER A 16 4.742 5.894 -5.847 0.00 0.00 +0.187 C BRANCH 149 150 ATOM 150 OG SER A 16 5.537 7.072 -5.944 0.00 0.00 -0.393 OA ATOM 151 H SER A 16 6.396 6.783 -6.313 0.00 0.00 +0.209 HD ENDBRANCH 149 150 ENDBRANCH 6 149 ENDBRANCH 2 6 ENDBRANCH 1 3 BRANCH 1 152 ATOM 152 C ARG A 17 0.903 4.166 -1.860 0.00 0.00 +0.234 C ATOM 153 N ASN A 18 0.832 5.535 -1.722 0.00 0.00 -0.302 N ATOM 154 H ASN A 18 1.569 6.091 -2.130 0.00 0.00 +0.150 HD ATOM 155 O ARG A 17 0.332 3.397 -1.098 0.00 0.00 -0.274 OA BRANCH 153 156 ATOM 156 CA ASN A 18 -0.023 6.216 -0.749 0.00 0.00 +0.168 C BRANCH 156 157 ATOM 157 C ASN A 18 0.447 6.072 0.708 0.00 0.00 +0.234 C ATOM 158 N LEU A 19 -0.057 4.961 1.355 0.00 0.00 -0.302 N ATOM 159 H LEU A 19 -0.068 4.113 0.773 0.00 0.00 +0.150 HD ATOM 160 O ASN A 18 1.194 6.896 1.200 0.00 0.00 -0.274 OA BRANCH 158 161 ATOM 161 CA LEU A 19 -0.005 4.762 2.816 0.00 0.00 +0.159 C BRANCH 161 162 ATOM 162 C LEU A 19 -1.178 5.570 3.431 0.00 0.00 +0.234 C ATOM 163 N LEU A 20 -2.324 4.950 3.830 0.00 0.00 -0.302 N ATOM 164 H LEU A 20 -2.939 5.617 4.276 0.00 0.00 +0.150 HD ATOM 165 O LEU A 19 -1.171 6.804 3.505 0.00 0.00 -0.274 OA BRANCH 163 166 ATOM 166 CA LEU A 20 -2.555 3.524 4.133 0.00 0.00 +0.159 C BRANCH 166 167 ATOM 167 C LEU A 20 -4.070 3.162 4.245 0.00 0.00 +0.234 C ATOM 168 N GLN A 21 -4.978 4.127 3.842 0.00 0.00 -0.302 N ATOM 169 H GLN A 21 -4.628 4.910 3.252 0.00 0.00 +0.150 HD ATOM 170 O LEU A 20 -4.445 2.097 4.717 0.00 0.00 -0.274 OA BRANCH 168 171 ATOM 171 CA GLN A 21 -6.147 4.356 4.713 0.00 0.00 +0.159 C BRANCH 171 172 ATOM 172 C GLN A 21 -7.309 3.339 4.590 0.00 0.00 +0.234 C ATOM 173 N GLY A 22 -7.888 3.213 3.336 0.00 0.00 -0.305 N ATOM 174 H GLY A 22 -7.757 3.978 2.697 0.00 0.00 +0.149 HD ATOM 175 O GLN A 21 -7.808 2.839 5.603 0.00 0.00 -0.274 OA BRANCH 173 176 ATOM 176 CA GLY A 22 -9.219 2.607 3.308 0.00 0.00 +0.200 C BRANCH 176 177 ATOM 177 C GLY A 22 -9.174 1.088 3.422 0.00 0.00 +0.231 C ATOM 178 N GLU A 23 -8.556 0.443 2.357 0.00 0.00 -0.303 N ATOM 179 H GLU A 23 -8.601 0.948 1.464 0.00 0.00 +0.149 HD ATOM 180 O GLY A 22 -9.710 0.475 4.342 0.00 0.00 -0.274 OA BRANCH 178 181 ATOM 181 CA GLU A 23 -8.460 -1.011 2.363 0.00 0.00 +0.159 C BRANCH 181 182 ATOM 182 C GLU A 23 -7.304 -1.537 1.498 0.00 0.00 +0.234 C ATOM 183 N GLU A 24 -6.712 -0.603 0.674 0.00 0.00 -0.302 N ATOM 184 H GLU A 24 -6.740 0.376 0.958 0.00 0.00 +0.150 HD ATOM 185 O GLU A 23 -7.014 -2.732 1.454 0.00 0.00 -0.274 OA BRANCH 183 186 ATOM 186 CA GLU A 24 -5.769 -0.990 -0.349 0.00 0.00 +0.159 C BRANCH 186 187 ATOM 187 C GLU A 24 -4.420 -0.268 -0.158 0.00 0.00 +0.234 C ATOM 188 N LEU A 25 -3.325 -1.087 -0.406 0.00 0.00 -0.302 N ATOM 189 H LEU A 25 -3.525 -2.083 -0.434 0.00 0.00 +0.150 HD ATOM 190 O GLU A 24 -4.339 0.929 0.091 0.00 0.00 -0.274 OA BRANCH 188 191 ATOM 191 CA LEU A 25 -2.227 -0.689 -1.258 0.00 0.00 +0.159 C BRANCH 191 192 ATOM 192 C LEU A 25 -0.935 -1.456 -0.855 0.00 0.00 +0.234 C ATOM 193 N LEU A 26 -0.149 -1.094 0.187 0.00 0.00 -0.302 N ATOM 194 H LEU A 26 0.723 -1.611 0.217 0.00 0.00 +0.150 HD ATOM 195 O LEU A 25 -0.588 -2.449 -1.500 0.00 0.00 -0.274 OA BRANCH 193 196 ATOM 196 CA LEU A 26 -0.445 -0.298 1.395 0.00 0.00 +0.159 C BRANCH 196 197 ATOM 197 C LEU A 26 0.910 0.167 2.025 0.00 0.00 +0.234 C ATOM 198 N ARG A 27 1.896 -0.812 2.052 0.00 0.00 -0.302 N ATOM 199 H ARG A 27 1.544 -1.759 1.995 0.00 0.00 +0.150 HD ATOM 200 O LEU A 26 1.040 1.254 2.585 0.00 0.00 -0.274 OA BRANCH 198 201 ATOM 201 CA ARG A 27 3.183 -0.643 2.761 0.00 0.00 +0.159 C BRANCH 201 202 ATOM 202 C ARG A 27 4.064 0.398 2.012 0.00 0.00 +0.234 C ATOM 203 N ALA A 28 5.275 0.721 2.590 0.00 0.00 -0.303 N ATOM 204 H ALA A 28 5.908 0.846 1.806 0.00 0.00 +0.149 HD ATOM 205 O ARG A 27 3.784 0.833 0.897 0.00 0.00 -0.274 OA BRANCH 203 206 ATOM 206 CA ALA A 28 5.406 1.941 3.385 0.00 0.00 +0.156 C ATOM 207 CB ALA A 28 5.028 3.212 2.624 0.00 0.00 +0.038 C BRANCH 206 208 ATOM 208 C ALA A 28 4.768 1.927 4.808 0.00 0.00 +0.234 C ATOM 209 N LEU A 29 5.144 0.871 5.633 0.00 0.00 -0.302 N ATOM 210 H LEU A 29 6.006 0.410 5.378 0.00 0.00 +0.150 HD ATOM 211 O ALA A 28 4.088 2.862 5.227 0.00 0.00 -0.274 OA BRANCH 209 212 ATOM 212 CA LEU A 29 4.873 1.000 7.081 0.00 0.00 +0.159 C BRANCH 212 213 ATOM 213 C LEU A 29 5.599 -0.022 8.003 0.00 0.00 +0.234 C ATOM 214 N ASP A 30 5.592 -1.340 7.606 0.00 0.00 -0.302 N ATOM 215 H ASP A 30 5.248 -1.634 6.696 0.00 0.00 +0.150 HD ATOM 216 O LEU A 29 5.924 0.257 9.153 0.00 0.00 -0.274 OA BRANCH 214 217 ATOM 217 CA ASP A 30 5.982 -2.401 8.565 0.00 0.00 +0.169 C BRANCH 217 218 ATOM 218 C ASP A 30 5.966 -3.757 7.853 0.00 0.00 +0.234 C ATOM 219 N GLN A 31 6.088 -4.876 8.650 0.00 0.00 -0.302 N ATOM 220 H GLN A 31 6.488 -4.728 9.575 0.00 0.00 +0.150 HD ATOM 221 O ASP A 30 5.797 -3.816 6.638 0.00 0.00 -0.274 OA BRANCH 219 222 ATOM 222 CA GLN A 31 6.357 -6.200 8.070 0.00 0.00 +0.159 C BRANCH 222 223 ATOM 223 C GLN A 31 5.215 -6.870 7.259 0.00 0.00 +0.234 C ATOM 224 N VAL A 32 4.251 -6.025 6.763 0.00 0.00 -0.302 N ATOM 225 H VAL A 32 4.330 -5.035 6.992 0.00 0.00 +0.150 HD ATOM 226 O GLN A 31 5.235 -8.060 6.925 0.00 0.00 -0.274 OA BRANCH 224 227 ATOM 227 CA VAL A 32 3.391 -6.351 5.630 0.00 0.00 +0.161 C BRANCH 227 228 ATOM 228 C VAL A 32 4.321 -6.169 4.397 0.00 0.00 +0.234 C ATOM 229 N ASN A 33 5.265 -7.159 4.283 0.00 0.00 -0.300 N ATOM 230 H ASN A 33 5.302 -7.803 5.082 0.00 0.00 +0.150 HD ATOM 231 O VAL A 32 4.332 -5.146 3.700 0.00 0.00 -0.274 OA BRANCH 229 232 ATOM 232 CA ASN A 33 6.544 -6.875 3.636 0.00 0.00 +0.190 C BRANCH 232 233 ATOM 233 C ASN A 33 6.354 -6.766 2.128 0.00 0.00 +0.326 C ATOM 234 O ASN A 33 6.805 -5.870 1.416 0.00 0.00 -0.249 OA BRANCH 233 235 ATOM 235 OXT ASN A 33 5.685 -7.819 1.614 0.00 0.00 -0.479 OA ATOM 236 HXT ASN A 33 5.529 -7.609 0.659 0.00 0.00 +0.295 HD ENDBRANCH 233 235 ENDBRANCH 232 233 BRANCH 232 237 ATOM 237 CB ASN A 33 7.567 -7.970 3.898 0.00 0.00 +0.129 C BRANCH 237 238 ATOM 238 CG ASN A 33 8.865 -7.418 4.423 0.00 0.00 +0.213 C ATOM 239 OD1 ASN A 33 9.026 -7.160 5.605 0.00 0.00 -0.276 OA ATOM 240 ND2 ASN A 33 9.861 -7.314 3.499 0.00 0.00 -0.329 N ATOM 241 HD21 ASN A 33 9.657 -7.419 2.515 0.00 0.00 +0.145 HD ATOM 242 HD22 ASN A 33 10.771 -6.963 3.772 0.00 0.00 +0.145 HD ENDBRANCH 237 238 ENDBRANCH 232 237 ENDBRANCH 229 232 ENDBRANCH 227 228 BRANCH 227 243 ATOM 243 CB VAL A 32 2.164 -5.408 5.613 0.00 0.00 +0.012 C ATOM 244 CG2 VAL A 32 1.423 -5.407 6.961 0.00 0.00 +0.009 C ATOM 245 CG1 VAL A 32 1.174 -5.773 4.513 0.00 0.00 +0.009 C ENDBRANCH 227 243 ENDBRANCH 224 227 ENDBRANCH 222 223 BRANCH 222 246 ATOM 246 CB GLN A 31 6.833 -7.183 9.154 0.00 0.00 +0.041 C BRANCH 246 247 ATOM 247 CG GLN A 31 5.780 -7.523 10.234 0.00 0.00 +0.098 C BRANCH 247 248 ATOM 248 CD GLN A 31 6.294 -8.636 11.117 0.00 0.00 +0.211 C ATOM 249 OE1 GLN A 31 7.482 -8.907 11.239 0.00 0.00 -0.276 OA ATOM 250 NE2 GLN A 31 5.314 -9.388 11.713 0.00 0.00 -0.329 N ATOM 251 HE21 GLN A 31 4.323 -9.178 11.700 0.00 0.00 +0.145 HD ATOM 252 HE22 GLN A 31 5.630 -10.256 12.152 0.00 0.00 +0.145 HD ENDBRANCH 247 248 ENDBRANCH 246 247 ENDBRANCH 222 246 ENDBRANCH 219 222 ENDBRANCH 217 218 BRANCH 217 253 ATOM 253 CB ASP A 30 5.048 -2.418 9.775 0.00 0.00 +0.152 C BRANCH 253 254 ATOM 254 CG ASP A 30 5.936 -2.471 10.976 0.00 0.00 +0.307 C ATOM 255 OD1 ASP A 30 6.300 -3.531 11.475 0.00 0.00 -0.251 OA BRANCH 254 256 ATOM 256 OD2 ASP A 30 6.379 -1.258 11.368 0.00 0.00 -0.481 OA ATOM 257 HD2 ASP A 30 6.148 -0.509 10.758 0.00 0.00 +0.295 HD ENDBRANCH 254 256 ENDBRANCH 253 254 ENDBRANCH 217 253 ENDBRANCH 214 217 ENDBRANCH 212 213 BRANCH 212 258 ATOM 258 CB LEU A 29 3.353 0.921 7.366 0.00 0.00 +0.034 C BRANCH 258 259 ATOM 259 CG LEU A 29 2.860 2.042 8.305 0.00 0.00 -0.015 C ATOM 260 CD2 LEU A 29 1.340 2.093 8.294 0.00 0.00 +0.007 C ATOM 261 CD1 LEU A 29 3.375 1.892 9.740 0.00 0.00 +0.007 C ENDBRANCH 258 259 ENDBRANCH 212 258 ENDBRANCH 209 212 ENDBRANCH 206 208 ENDBRANCH 203 206 ENDBRANCH 201 202 BRANCH 201 262 ATOM 262 CB ARG A 27 3.914 -2.014 2.718 0.00 0.00 +0.033 C BRANCH 262 263 ATOM 263 CG ARG A 27 5.111 -2.145 3.665 0.00 0.00 +0.023 C BRANCH 263 264 ATOM 264 CD ARG A 27 6.346 -2.708 2.948 0.00 0.00 +0.115 C BRANCH 264 265 ATOM 265 NE ARG A 27 7.455 -2.795 3.889 0.00 0.00 -0.356 N ATOM 266 HE ARG A 27 7.557 -1.999 4.473 0.00 0.00 +0.162 HD BRANCH 265 267 ATOM 267 CZ ARG A 27 8.636 -3.345 3.573 0.00 0.00 +0.188 C ATOM 268 NH1 ARG A 27 8.949 -4.200 2.662 0.00 0.00 -0.269 NA ATOM 269 HH1 ARG A 27 8.100 -4.473 2.141 0.00 0.00 +0.190 HD BRANCH 267 270 ATOM 270 NH2 ARG A 27 9.617 -2.880 4.372 0.00 0.00 -0.370 N ATOM 271 HH21 ARG A 27 9.407 -3.036 5.353 0.00 0.00 +0.159 HD ATOM 272 HH22 ARG A 27 10.464 -3.388 4.152 0.00 0.00 +0.159 HD ENDBRANCH 267 270 ENDBRANCH 265 267 ENDBRANCH 264 265 ENDBRANCH 263 264 ENDBRANCH 262 263 ENDBRANCH 201 262 ENDBRANCH 198 201 ENDBRANCH 196 197 BRANCH 196 273 ATOM 273 CB LEU A 26 -1.224 -1.193 2.390 0.00 0.00 +0.034 C BRANCH 273 274 ATOM 274 CG LEU A 26 -1.569 -0.468 3.712 0.00 0.00 -0.015 C ATOM 275 CD2 LEU A 26 -0.565 -0.789 4.828 0.00 0.00 +0.007 C ATOM 276 CD1 LEU A 26 -2.970 -0.861 4.191 0.00 0.00 +0.007 C ENDBRANCH 273 274 ENDBRANCH 196 273 ENDBRANCH 193 196 ENDBRANCH 191 192 BRANCH 191 277 ATOM 277 CB LEU A 25 -1.976 0.790 -1.575 0.00 0.00 +0.034 C BRANCH 277 278 ATOM 278 CG LEU A 25 -2.864 1.369 -2.704 0.00 0.00 -0.015 C ATOM 279 CD2 LEU A 25 -2.507 2.832 -2.934 0.00 0.00 +0.007 C ATOM 280 CD1 LEU A 25 -2.784 0.604 -4.028 0.00 0.00 +0.007 C ENDBRANCH 277 278 ENDBRANCH 191 277 ENDBRANCH 188 191 ENDBRANCH 186 187 BRANCH 186 281 ATOM 281 CB GLU A 24 -6.335 -0.713 -1.760 0.00 0.00 +0.043 C BRANCH 281 282 ATOM 282 CG GLU A 24 -6.835 0.718 -2.004 0.00 0.00 +0.123 C BRANCH 282 283 ATOM 283 CD GLU A 24 -8.233 0.944 -1.484 0.00 0.00 +0.305 C ATOM 284 OE1 GLU A 24 -8.502 1.470 -0.397 0.00 0.00 -0.251 OA BRANCH 283 285 ATOM 285 OE2 GLU A 24 -9.167 0.417 -2.277 0.00 0.00 -0.481 OA ATOM 286 HE2 GLU A 24 -10.059 0.631 -1.938 0.00 0.00 +0.295 HD ENDBRANCH 283 285 ENDBRANCH 282 283 ENDBRANCH 281 282 ENDBRANCH 186 281 ENDBRANCH 183 186 ENDBRANCH 181 182 BRANCH 181 287 ATOM 287 CB GLU A 23 -9.776 -1.673 1.904 0.00 0.00 +0.043 C BRANCH 287 288 ATOM 288 CG GLU A 23 -10.091 -1.333 0.435 0.00 0.00 +0.123 C BRANCH 288 289 ATOM 289 CD GLU A 23 -11.297 -1.987 -0.178 0.00 0.00 +0.305 C ATOM 290 OE1 GLU A 23 -12.156 -1.344 -0.770 0.00 0.00 -0.251 OA BRANCH 289 291 ATOM 291 OE2 GLU A 23 -11.264 -3.337 -0.167 0.00 0.00 -0.481 OA ATOM 292 HE2 GLU A 23 -10.703 -3.755 0.538 0.00 0.00 +0.295 HD ENDBRANCH 289 291 ENDBRANCH 288 289 ENDBRANCH 287 288 ENDBRANCH 181 287 ENDBRANCH 178 181 ENDBRANCH 176 177 ENDBRANCH 173 176 ENDBRANCH 171 172 BRANCH 171 293 ATOM 293 CB GLN A 21 -6.736 5.755 4.535 0.00 0.00 +0.041 C BRANCH 293 294 ATOM 294 CG GLN A 21 -5.913 6.819 5.259 0.00 0.00 +0.098 C BRANCH 294 295 ATOM 295 CD GLN A 21 -6.466 8.180 4.912 0.00 0.00 +0.211 C ATOM 296 OE1 GLN A 21 -6.045 8.836 3.972 0.00 0.00 -0.276 OA ATOM 297 NE2 GLN A 21 -7.528 8.575 5.662 0.00 0.00 -0.329 N ATOM 298 HE21 GLN A 21 -7.880 8.080 6.462 0.00 0.00 +0.145 HD ATOM 299 HE22 GLN A 21 -7.939 9.487 5.462 0.00 0.00 +0.145 HD ENDBRANCH 294 295 ENDBRANCH 293 294 ENDBRANCH 171 293 ENDBRANCH 168 171 ENDBRANCH 166 167 BRANCH 166 300 ATOM 300 CB LEU A 20 -1.871 3.157 5.474 0.00 0.00 +0.034 C BRANCH 300 301 ATOM 301 CG LEU A 20 -2.522 3.808 6.724 0.00 0.00 -0.015 C ATOM 302 CD2 LEU A 20 -3.407 2.815 7.505 0.00 0.00 +0.007 C ATOM 303 CD1 LEU A 20 -1.447 4.337 7.685 0.00 0.00 +0.007 C ENDBRANCH 300 301 ENDBRANCH 166 300 ENDBRANCH 163 166 ENDBRANCH 161 162 BRANCH 161 304 ATOM 304 CB LEU A 19 1.413 4.964 3.439 0.00 0.00 +0.034 C BRANCH 304 305 ATOM 305 CG LEU A 19 1.759 6.316 4.109 0.00 0.00 -0.015 C ATOM 306 CD2 LEU A 19 3.267 6.522 4.133 0.00 0.00 +0.007 C ATOM 307 CD1 LEU A 19 1.223 6.412 5.532 0.00 0.00 +0.007 C ENDBRANCH 304 305 ENDBRANCH 161 304 ENDBRANCH 158 161 ENDBRANCH 156 157 BRANCH 156 308 ATOM 308 CB ASN A 18 -1.516 5.957 -0.934 0.00 0.00 +0.127 C BRANCH 308 309 ATOM 309 CG ASN A 18 -2.450 6.629 0.049 0.00 0.00 +0.213 C ATOM 310 OD1 ASN A 18 -3.573 6.174 0.290 0.00 0.00 -0.276 OA ATOM 311 ND2 ASN A 18 -2.052 7.769 0.651 0.00 0.00 -0.329 N ATOM 312 HD21 ASN A 18 -1.232 8.299 0.368 0.00 0.00 +0.145 HD ATOM 313 HD22 ASN A 18 -2.695 8.197 1.322 0.00 0.00 +0.145 HD ENDBRANCH 308 309 ENDBRANCH 156 308 ENDBRANCH 153 156 ENDBRANCH 1 152 BRANCH 1 314 ATOM 314 CB ARG A 17 2.130 2.296 -3.131 0.00 0.00 +0.033 C BRANCH 314 315 ATOM 315 CG ARG A 17 1.217 1.269 -3.852 0.00 0.00 +0.023 C BRANCH 315 316 ATOM 316 CD ARG A 17 1.817 0.807 -5.178 0.00 0.00 +0.115 C BRANCH 316 317 ATOM 317 NE ARG A 17 0.824 0.120 -5.997 0.00 0.00 -0.356 N ATOM 318 HE ARG A 17 -0.141 0.355 -5.887 0.00 0.00 +0.162 HD BRANCH 317 319 ATOM 319 CZ ARG A 17 1.197 -0.607 -7.071 0.00 0.00 +0.188 C ATOM 320 NH1 ARG A 17 2.407 -0.999 -7.294 0.00 0.00 -0.269 NA ATOM 321 HH1 ARG A 17 2.389 -1.518 -8.187 0.00 0.00 +0.190 HD BRANCH 319 322 ATOM 322 NH2 ARG A 17 0.208 -0.826 -7.957 0.00 0.00 -0.370 N ATOM 323 HH21 ARG A 17 0.083 -0.011 -8.544 0.00 0.00 +0.159 HD ATOM 324 HH22 ARG A 17 -0.710 -0.940 -7.517 0.00 0.00 +0.159 HD ENDBRANCH 319 322 ENDBRANCH 317 319 ENDBRANCH 316 317 ENDBRANCH 315 316 ENDBRANCH 314 315 ENDBRANCH 1 314 TORSDOF 141