USER MOD reduce.3.24.130724 H: found=0, std=0, add=416, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 416 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: F 7 SER OG : rot -35:sc= -1.6! USER MOD Set 1.2: H 1 ASN : amide:sc= -12.1! C(o=-14!,f=-24!) USER MOD Set 2.1: B 1 ASN : amide:sc= -13.6! C(o=-15!,f=-26!) USER MOD Set 2.2: D 7 SER OG : rot -43:sc= -1.44! USER MOD Single : A 1 ASN :FLIP amide:sc= -0.0903 F(o=-1.3,f=-0.09) USER MOD Single : A 1 ASN N :NH3+ -137:sc= 0.706 (180deg=-1.16!) USER MOD Single : A 7 SER OG : rot -20:sc= 0.722 USER MOD Single : B 1 ASN N :NH3+ -111:sc= 1.23 (180deg=-0.69) USER MOD Single : B 7 SER OG : rot -166:sc= -1.01! USER MOD Single : C 1 ASN :FLIP amide:sc= -0.0369 F(o=-1.1,f=-0.037) USER MOD Single : C 1 ASN N :NH3+ -172:sc= 0 (180deg=-0.0436) USER MOD Single : C 7 SER OG : rot 49:sc= 0.679 USER MOD Single : D 1 ASN : amide:sc= -6.74! C(o=-6.7!,f=-18!) USER MOD Single : D 1 ASN N :NH3+ 134:sc= 0.0356 (180deg=0) USER MOD Single : E 1 ASN :FLIP amide:sc= -0.0454 F(o=-1.1,f=-0.045) USER MOD Single : E 1 ASN N :NH3+ -142:sc= 0.882 (180deg=-0.765!) USER MOD Single : E 7 SER OG : rot 55:sc= 0.468 USER MOD Single : F 1 ASN : amide:sc= -6.07! C(o=-6.1!,f=-17!) USER MOD Single : F 1 ASN N :NH3+ -124:sc= 1.1 (180deg=-1.32) USER MOD Single : G 1 ASN :FLIP amide:sc= -0.0446 F(o=-1.2!,f=-0.045) USER MOD Single : G 1 ASN N :NH3+ -172:sc= 0 (180deg=-0.0422) USER MOD Single : G 7 SER OG : rot -28:sc= 0.413 USER MOD Single : H 1 ASN N :NH3+ 137:sc= 0.0442 (180deg=0) USER MOD Single : H 7 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ASN A 1 34.109 -9.385 -2.344 1.00 1.00 N ATOM 2 CA ASN A 1 35.448 -9.516 -2.985 1.00 1.00 C ATOM 3 C ASN A 1 36.238 -8.231 -2.774 1.00 1.00 C ATOM 4 O ASN A 1 35.791 -7.147 -3.153 1.00 1.00 O ATOM 5 CB ASN A 1 35.270 -9.779 -4.483 1.00 1.00 C ATOM 6 CG ASN A 1 34.611 -11.137 -4.705 1.00 1.00 C ATOM 7 OD1 ASN A 1 34.781 -12.090 -3.829 1.00 1.00 O flip ATOM 8 ND2 ASN A 1 33.924 -11.336 -5.706 1.00 1.00 N flip ATOM 0 H1 ASN A 1 33.878 -10.264 -1.839 1.00 1.00 H new ATOM 0 H2 ASN A 1 34.122 -8.592 -1.671 1.00 1.00 H new ATOM 0 H3 ASN A 1 33.390 -9.207 -3.074 1.00 1.00 H new ATOM 0 HA ASN A 1 35.991 -10.348 -2.537 1.00 1.00 H new ATOM 0 HB2 ASN A 1 34.659 -8.993 -4.928 1.00 1.00 H new ATOM 0 HB3 ASN A 1 36.239 -9.751 -4.982 1.00 1.00 H new ATOM 0 HD21 ASN A 1 33.792 -10.591 -6.390 1.00 1.00 H new ATOM 0 HD22 ASN A 1 33.487 -12.246 -5.852 1.00 1.00 H new ATOM 17 N PHE A 2 37.417 -8.357 -2.166 1.00 1.00 N ATOM 18 CA PHE A 2 38.277 -7.200 -1.904 1.00 1.00 C ATOM 19 C PHE A 2 39.468 -7.193 -2.861 1.00 1.00 C ATOM 20 O PHE A 2 40.250 -8.143 -2.903 1.00 1.00 O ATOM 21 CB PHE A 2 38.783 -7.243 -0.444 1.00 1.00 C ATOM 22 CG PHE A 2 37.748 -6.644 0.493 1.00 1.00 C ATOM 23 CD1 PHE A 2 36.447 -7.159 0.512 1.00 1.00 C ATOM 24 CD2 PHE A 2 38.089 -5.572 1.330 1.00 1.00 C ATOM 25 CE1 PHE A 2 35.487 -6.607 1.368 1.00 1.00 C ATOM 26 CE2 PHE A 2 37.127 -5.019 2.184 1.00 1.00 C ATOM 27 CZ PHE A 2 35.827 -5.535 2.203 1.00 1.00 C ATOM 0 H PHE A 2 37.799 -9.247 -1.845 1.00 1.00 H new ATOM 0 HA PHE A 2 37.696 -6.291 -2.060 1.00 1.00 H new ATOM 0 HB2 PHE A 2 38.992 -8.273 -0.155 1.00 1.00 H new ATOM 0 HB3 PHE A 2 39.720 -6.692 -0.361 1.00 1.00 H new ATOM 0 HD1 PHE A 2 36.183 -7.983 -0.134 1.00 1.00 H new ATOM 0 HD2 PHE A 2 39.093 -5.173 1.316 1.00 1.00 H new ATOM 0 HE1 PHE A 2 34.484 -7.008 1.385 1.00 1.00 H new ATOM 0 HE2 PHE A 2 37.389 -4.193 2.829 1.00 1.00 H new ATOM 0 HZ PHE A 2 35.086 -5.107 2.861 1.00 1.00 H new ATOM 37 N GLY A 3 39.604 -6.107 -3.622 1.00 1.00 N ATOM 38 CA GLY A 3 40.710 -5.968 -4.574 1.00 1.00 C ATOM 39 C GLY A 3 41.362 -4.598 -4.432 1.00 1.00 C ATOM 40 O GLY A 3 40.673 -3.581 -4.350 1.00 1.00 O ATOM 0 H GLY A 3 38.965 -5.312 -3.599 1.00 1.00 H new ATOM 0 HA2 GLY A 3 41.449 -6.750 -4.399 1.00 1.00 H new ATOM 0 HA3 GLY A 3 40.342 -6.099 -5.591 1.00 1.00 H new ATOM 44 N ALA A 4 42.695 -4.574 -4.400 1.00 1.00 N ATOM 45 CA ALA A 4 43.426 -3.314 -4.264 1.00 1.00 C ATOM 46 C ALA A 4 44.694 -3.328 -5.101 1.00 1.00 C ATOM 47 O ALA A 4 45.415 -4.325 -5.147 1.00 1.00 O ATOM 48 CB ALA A 4 43.786 -3.076 -2.798 1.00 1.00 C ATOM 0 H ALA A 4 43.285 -5.403 -4.466 1.00 1.00 H new ATOM 0 HA ALA A 4 42.783 -2.509 -4.619 1.00 1.00 H new ATOM 0 HB1 ALA A 4 44.330 -2.136 -2.705 1.00 1.00 H new ATOM 0 HB2 ALA A 4 42.874 -3.028 -2.203 1.00 1.00 H new ATOM 0 HB3 ALA A 4 44.411 -3.894 -2.439 1.00 1.00 H new ATOM 54 N ILE A 5 44.962 -2.203 -5.764 1.00 1.00 N ATOM 55 CA ILE A 5 46.148 -2.074 -6.604 1.00 1.00 C ATOM 56 C ILE A 5 46.832 -0.738 -6.348 1.00 1.00 C ATOM 57 O ILE A 5 46.209 0.322 -6.449 1.00 1.00 O ATOM 58 CB ILE A 5 45.741 -2.171 -8.078 1.00 1.00 C ATOM 59 CG1 ILE A 5 46.996 -2.271 -8.962 1.00 1.00 C ATOM 60 CG2 ILE A 5 44.934 -0.926 -8.474 1.00 1.00 C ATOM 61 CD1 ILE A 5 47.743 -3.590 -8.699 1.00 1.00 C ATOM 0 H ILE A 5 44.374 -1.370 -5.734 1.00 1.00 H new ATOM 0 HA ILE A 5 46.844 -2.877 -6.363 1.00 1.00 H new ATOM 0 HB ILE A 5 45.129 -3.062 -8.221 1.00 1.00 H new ATOM 0 HG12 ILE A 5 46.712 -2.211 -10.013 1.00 1.00 H new ATOM 0 HG13 ILE A 5 47.656 -1.427 -8.762 1.00 1.00 H new ATOM 0 HG21 ILE A 5 44.646 -0.998 -9.523 1.00 1.00 H new ATOM 0 HG22 ILE A 5 44.039 -0.861 -7.855 1.00 1.00 H new ATOM 0 HG23 ILE A 5 45.544 -0.035 -8.325 1.00 1.00 H new ATOM 0 HD11 ILE A 5 48.627 -3.640 -9.334 1.00 1.00 H new ATOM 0 HD12 ILE A 5 48.045 -3.635 -7.653 1.00 1.00 H new ATOM 0 HD13 ILE A 5 47.087 -4.431 -8.923 1.00 1.00 H new ATOM 73 N LEU A 6 48.118 -0.796 -6.015 1.00 1.00 N ATOM 74 CA LEU A 6 48.900 0.410 -5.738 1.00 1.00 C ATOM 75 C LEU A 6 50.145 0.455 -6.621 1.00 1.00 C ATOM 76 O LEU A 6 50.904 -0.516 -6.694 1.00 1.00 O ATOM 77 CB LEU A 6 49.318 0.422 -4.266 1.00 1.00 C ATOM 78 CG LEU A 6 48.074 0.366 -3.369 1.00 1.00 C ATOM 79 CD1 LEU A 6 48.514 0.322 -1.901 1.00 1.00 C ATOM 80 CD2 LEU A 6 47.194 1.606 -3.613 1.00 1.00 C ATOM 0 H LEU A 6 48.644 -1.666 -5.930 1.00 1.00 H new ATOM 0 HA LEU A 6 48.285 1.283 -5.954 1.00 1.00 H new ATOM 0 HB2 LEU A 6 49.967 -0.428 -4.056 1.00 1.00 H new ATOM 0 HB3 LEU A 6 49.893 1.322 -4.050 1.00 1.00 H new ATOM 0 HG LEU A 6 47.496 -0.527 -3.605 1.00 1.00 H new ATOM 0 HD11 LEU A 6 47.634 0.282 -1.259 1.00 1.00 H new ATOM 0 HD12 LEU A 6 49.128 -0.563 -1.731 1.00 1.00 H new ATOM 0 HD13 LEU A 6 49.093 1.215 -1.668 1.00 1.00 H new ATOM 0 HD21 LEU A 6 46.313 1.559 -2.973 1.00 1.00 H new ATOM 0 HD22 LEU A 6 47.763 2.507 -3.382 1.00 1.00 H new ATOM 0 HD23 LEU A 6 46.882 1.631 -4.657 1.00 1.00 H new ATOM 92 N SER A 7 50.351 1.588 -7.285 1.00 1.00 N ATOM 93 CA SER A 7 51.509 1.750 -8.158 1.00 1.00 C ATOM 94 C SER A 7 51.722 3.223 -8.494 1.00 1.00 C ATOM 95 O SER A 7 52.489 3.865 -7.795 1.00 1.00 O ATOM 96 CB SER A 7 51.306 0.955 -9.447 1.00 1.00 C ATOM 97 OG SER A 7 51.190 -0.427 -9.132 1.00 1.00 O ATOM 98 OXT SER A 7 51.117 3.686 -9.447 1.00 1.00 O ATOM 0 H SER A 7 49.737 2.401 -7.237 1.00 1.00 H new ATOM 0 HA SER A 7 52.390 1.376 -7.637 1.00 1.00 H new ATOM 0 HB2 SER A 7 50.410 1.299 -9.963 1.00 1.00 H new ATOM 0 HB3 SER A 7 52.145 1.117 -10.124 1.00 1.00 H new ATOM 0 HG SER A 7 51.573 -0.594 -8.245 1.00 1.00 H new TER 104 SER A 7 ATOM 105 N ASN B 1 32.363 -5.909 7.013 1.00 1.00 N ATOM 106 CA ASN B 1 33.793 -5.993 6.603 1.00 1.00 C ATOM 107 C ASN B 1 34.419 -4.604 6.663 1.00 1.00 C ATOM 108 O ASN B 1 33.766 -3.604 6.365 1.00 1.00 O ATOM 109 CB ASN B 1 33.878 -6.544 5.177 1.00 1.00 C ATOM 110 CG ASN B 1 35.333 -6.817 4.810 1.00 1.00 C ATOM 111 OD1 ASN B 1 36.243 -6.263 5.426 1.00 1.00 O ATOM 112 ND2 ASN B 1 35.607 -7.641 3.837 1.00 1.00 N ATOM 0 H1 ASN B 1 32.237 -6.382 7.931 1.00 1.00 H new ATOM 0 H2 ASN B 1 32.084 -4.911 7.097 1.00 1.00 H new ATOM 0 H3 ASN B 1 31.769 -6.376 6.298 1.00 1.00 H new ATOM 0 HA ASN B 1 34.333 -6.657 7.278 1.00 1.00 H new ATOM 0 HB2 ASN B 1 33.296 -7.462 5.098 1.00 1.00 H new ATOM 0 HB3 ASN B 1 33.445 -5.830 4.476 1.00 1.00 H new ATOM 0 HD21 ASN B 1 36.578 -7.828 3.585 1.00 1.00 H new ATOM 0 HD22 ASN B 1 34.851 -8.099 3.328 1.00 1.00 H new ATOM 121 N PHE B 2 35.694 -4.550 7.058 1.00 1.00 N ATOM 122 CA PHE B 2 36.416 -3.279 7.163 1.00 1.00 C ATOM 123 C PHE B 2 37.751 -3.356 6.430 1.00 1.00 C ATOM 124 O PHE B 2 38.533 -4.284 6.640 1.00 1.00 O ATOM 125 CB PHE B 2 36.661 -2.947 8.636 1.00 1.00 C ATOM 126 CG PHE B 2 37.471 -1.673 8.743 1.00 1.00 C ATOM 127 CD1 PHE B 2 36.901 -0.451 8.366 1.00 1.00 C ATOM 128 CD2 PHE B 2 38.787 -1.712 9.224 1.00 1.00 C ATOM 129 CE1 PHE B 2 37.643 0.730 8.468 1.00 1.00 C ATOM 130 CE2 PHE B 2 39.529 -0.530 9.324 1.00 1.00 C ATOM 131 CZ PHE B 2 38.958 0.691 8.948 1.00 1.00 C ATOM 0 H PHE B 2 36.247 -5.370 7.310 1.00 1.00 H new ATOM 0 HA PHE B 2 35.810 -2.497 6.705 1.00 1.00 H new ATOM 0 HB2 PHE B 2 35.710 -2.830 9.155 1.00 1.00 H new ATOM 0 HB3 PHE B 2 37.190 -3.768 9.121 1.00 1.00 H new ATOM 0 HD1 PHE B 2 35.887 -0.420 7.996 1.00 1.00 H new ATOM 0 HD2 PHE B 2 39.228 -2.653 9.517 1.00 1.00 H new ATOM 0 HE1 PHE B 2 37.202 1.672 8.177 1.00 1.00 H new ATOM 0 HE2 PHE B 2 40.544 -0.560 9.692 1.00 1.00 H new ATOM 0 HZ PHE B 2 39.531 1.603 9.028 1.00 1.00 H new ATOM 141 N GLY B 3 38.009 -2.366 5.576 1.00 1.00 N ATOM 142 CA GLY B 3 39.260 -2.313 4.812 1.00 1.00 C ATOM 143 C GLY B 3 39.919 -0.948 4.971 1.00 1.00 C ATOM 144 O GLY B 3 39.247 0.081 4.913 1.00 1.00 O ATOM 0 H GLY B 3 37.372 -1.591 5.394 1.00 1.00 H new ATOM 0 HA2 GLY B 3 39.938 -3.094 5.156 1.00 1.00 H new ATOM 0 HA3 GLY B 3 39.059 -2.507 3.758 1.00 1.00 H new ATOM 148 N ALA B 4 41.238 -0.939 5.185 1.00 1.00 N ATOM 149 CA ALA B 4 41.966 0.320 5.363 1.00 1.00 C ATOM 150 C ALA B 4 43.341 0.270 4.700 1.00 1.00 C ATOM 151 O ALA B 4 44.085 -0.700 4.853 1.00 1.00 O ATOM 152 CB ALA B 4 42.131 0.608 6.856 1.00 1.00 C ATOM 0 H ALA B 4 41.817 -1.777 5.239 1.00 1.00 H new ATOM 0 HA ALA B 4 41.389 1.114 4.889 1.00 1.00 H new ATOM 0 HB1 ALA B 4 42.673 1.545 6.988 1.00 1.00 H new ATOM 0 HB2 ALA B 4 41.149 0.688 7.322 1.00 1.00 H new ATOM 0 HB3 ALA B 4 42.689 -0.203 7.323 1.00 1.00 H new ATOM 158 N ILE B 5 43.671 1.338 3.968 1.00 1.00 N ATOM 159 CA ILE B 5 44.962 1.445 3.279 1.00 1.00 C ATOM 160 C ILE B 5 45.673 2.729 3.699 1.00 1.00 C ATOM 161 O ILE B 5 45.091 3.814 3.647 1.00 1.00 O ATOM 162 CB ILE B 5 44.744 1.453 1.764 1.00 1.00 C ATOM 163 CG1 ILE B 5 44.127 0.120 1.332 1.00 1.00 C ATOM 164 CG2 ILE B 5 46.086 1.645 1.056 1.00 1.00 C ATOM 165 CD1 ILE B 5 43.659 0.220 -0.120 1.00 1.00 C ATOM 0 H ILE B 5 43.060 2.144 3.837 1.00 1.00 H new ATOM 0 HA ILE B 5 45.579 0.588 3.551 1.00 1.00 H new ATOM 0 HB ILE B 5 44.073 2.269 1.498 1.00 1.00 H new ATOM 0 HG12 ILE B 5 44.859 -0.681 1.435 1.00 1.00 H new ATOM 0 HG13 ILE B 5 43.287 -0.130 1.979 1.00 1.00 H new ATOM 0 HG21 ILE B 5 45.931 1.651 -0.023 1.00 1.00 H new ATOM 0 HG22 ILE B 5 46.528 2.593 1.364 1.00 1.00 H new ATOM 0 HG23 ILE B 5 46.758 0.829 1.322 1.00 1.00 H new ATOM 0 HD11 ILE B 5 43.220 -0.729 -0.427 1.00 1.00 H new ATOM 0 HD12 ILE B 5 42.913 1.010 -0.208 1.00 1.00 H new ATOM 0 HD13 ILE B 5 44.510 0.450 -0.761 1.00 1.00 H new ATOM 177 N LEU B 6 46.934 2.602 4.121 1.00 1.00 N ATOM 178 CA LEU B 6 47.726 3.760 4.561 1.00 1.00 C ATOM 179 C LEU B 6 48.990 3.906 3.720 1.00 1.00 C ATOM 180 O LEU B 6 49.717 2.937 3.500 1.00 1.00 O ATOM 181 CB LEU B 6 48.112 3.589 6.039 1.00 1.00 C ATOM 182 CG LEU B 6 49.036 4.730 6.500 1.00 1.00 C ATOM 183 CD1 LEU B 6 48.369 6.090 6.258 1.00 1.00 C ATOM 184 CD2 LEU B 6 49.324 4.559 7.995 1.00 1.00 C ATOM 0 H LEU B 6 47.430 1.712 4.168 1.00 1.00 H new ATOM 0 HA LEU B 6 47.121 4.658 4.437 1.00 1.00 H new ATOM 0 HB2 LEU B 6 47.213 3.573 6.655 1.00 1.00 H new ATOM 0 HB3 LEU B 6 48.612 2.631 6.180 1.00 1.00 H new ATOM 0 HG LEU B 6 49.965 4.693 5.931 1.00 1.00 H new ATOM 0 HD11 LEU B 6 49.036 6.886 6.589 1.00 1.00 H new ATOM 0 HD12 LEU B 6 48.162 6.209 5.195 1.00 1.00 H new ATOM 0 HD13 LEU B 6 47.435 6.142 6.818 1.00 1.00 H new ATOM 0 HD21 LEU B 6 49.978 5.362 8.334 1.00 1.00 H new ATOM 0 HD22 LEU B 6 48.388 4.594 8.552 1.00 1.00 H new ATOM 0 HD23 LEU B 6 49.811 3.599 8.164 1.00 1.00 H new ATOM 196 N SER B 7 49.253 5.129 3.268 1.00 1.00 N ATOM 197 CA SER B 7 50.441 5.396 2.467 1.00 1.00 C ATOM 198 C SER B 7 50.679 6.897 2.346 1.00 1.00 C ATOM 199 O SER B 7 50.241 7.619 3.227 1.00 1.00 O ATOM 200 CB SER B 7 50.280 4.792 1.075 1.00 1.00 C ATOM 201 OG SER B 7 49.501 5.669 0.274 1.00 1.00 O ATOM 202 OXT SER B 7 51.297 7.303 1.376 1.00 1.00 O ATOM 0 H SER B 7 48.664 5.944 3.441 1.00 1.00 H new ATOM 0 HA SER B 7 51.299 4.941 2.963 1.00 1.00 H new ATOM 0 HB2 SER B 7 51.257 4.634 0.618 1.00 1.00 H new ATOM 0 HB3 SER B 7 49.798 3.817 1.142 1.00 1.00 H new ATOM 0 HG SER B 7 49.203 5.198 -0.532 1.00 1.00 H new TER 208 SER B 7 ATOM 209 N ASN C 1 55.988 -1.631 -7.542 1.00 1.00 N ATOM 210 CA ASN C 1 54.513 -1.722 -7.739 1.00 1.00 C ATOM 211 C ASN C 1 53.929 -2.701 -6.726 1.00 1.00 C ATOM 212 O ASN C 1 54.335 -3.861 -6.664 1.00 1.00 O ATOM 213 CB ASN C 1 54.220 -2.206 -9.162 1.00 1.00 C ATOM 214 CG ASN C 1 54.676 -1.162 -10.177 1.00 1.00 C ATOM 215 OD1 ASN C 1 54.697 0.100 -9.843 1.00 1.00 O flip ATOM 216 ND2 ASN C 1 55.023 -1.507 -11.307 1.00 1.00 N flip ATOM 0 H1 ASN C 1 56.371 -0.868 -8.136 1.00 1.00 H new ATOM 0 H2 ASN C 1 56.193 -1.428 -6.543 1.00 1.00 H new ATOM 0 H3 ASN C 1 56.430 -2.533 -7.810 1.00 1.00 H new ATOM 0 HA ASN C 1 54.059 -0.742 -7.594 1.00 1.00 H new ATOM 0 HB2 ASN C 1 54.732 -3.151 -9.346 1.00 1.00 H new ATOM 0 HB3 ASN C 1 53.153 -2.394 -9.277 1.00 1.00 H new ATOM 0 HD21 ASN C 1 55.006 -2.493 -11.567 1.00 1.00 H new ATOM 0 HD22 ASN C 1 55.327 -0.807 -11.983 1.00 1.00 H new ATOM 225 N PHE C 2 52.968 -2.225 -5.932 1.00 1.00 N ATOM 226 CA PHE C 2 52.321 -3.061 -4.917 1.00 1.00 C ATOM 227 C PHE C 2 50.905 -3.427 -5.358 1.00 1.00 C ATOM 228 O PHE C 2 50.079 -2.552 -5.610 1.00 1.00 O ATOM 229 CB PHE C 2 52.270 -2.305 -3.574 1.00 1.00 C ATOM 230 CG PHE C 2 53.580 -2.467 -2.831 1.00 1.00 C ATOM 231 CD1 PHE C 2 54.783 -2.085 -3.438 1.00 1.00 C ATOM 232 CD2 PHE C 2 53.592 -3.003 -1.534 1.00 1.00 C ATOM 233 CE1 PHE C 2 55.993 -2.236 -2.753 1.00 1.00 C ATOM 234 CE2 PHE C 2 54.803 -3.154 -0.850 1.00 1.00 C ATOM 235 CZ PHE C 2 56.005 -2.771 -1.459 1.00 1.00 C ATOM 0 H PHE C 2 52.621 -1.267 -5.971 1.00 1.00 H new ATOM 0 HA PHE C 2 52.899 -3.977 -4.794 1.00 1.00 H new ATOM 0 HB2 PHE C 2 52.073 -1.248 -3.751 1.00 1.00 H new ATOM 0 HB3 PHE C 2 51.449 -2.685 -2.966 1.00 1.00 H new ATOM 0 HD1 PHE C 2 54.776 -1.673 -4.436 1.00 1.00 H new ATOM 0 HD2 PHE C 2 52.666 -3.299 -1.064 1.00 1.00 H new ATOM 0 HE1 PHE C 2 56.919 -1.940 -3.223 1.00 1.00 H new ATOM 0 HE2 PHE C 2 54.811 -3.566 0.148 1.00 1.00 H new ATOM 0 HZ PHE C 2 56.940 -2.888 -0.931 1.00 1.00 H new ATOM 245 N GLY C 3 50.634 -4.728 -5.441 1.00 1.00 N ATOM 246 CA GLY C 3 49.312 -5.215 -5.843 1.00 1.00 C ATOM 247 C GLY C 3 48.844 -6.317 -4.902 1.00 1.00 C ATOM 248 O GLY C 3 49.609 -7.218 -4.561 1.00 1.00 O ATOM 0 H GLY C 3 51.310 -5.464 -5.236 1.00 1.00 H new ATOM 0 HA2 GLY C 3 48.596 -4.393 -5.835 1.00 1.00 H new ATOM 0 HA3 GLY C 3 49.352 -5.593 -6.865 1.00 1.00 H new ATOM 252 N ALA C 4 47.583 -6.238 -4.479 1.00 1.00 N ATOM 253 CA ALA C 4 47.028 -7.238 -3.566 1.00 1.00 C ATOM 254 C ALA C 4 45.564 -7.521 -3.886 1.00 1.00 C ATOM 255 O ALA C 4 44.776 -6.602 -4.112 1.00 1.00 O ATOM 256 CB ALA C 4 47.141 -6.741 -2.123 1.00 1.00 C ATOM 0 H ALA C 4 46.932 -5.501 -4.750 1.00 1.00 H new ATOM 0 HA ALA C 4 47.596 -8.160 -3.688 1.00 1.00 H new ATOM 0 HB1 ALA C 4 46.726 -7.489 -1.447 1.00 1.00 H new ATOM 0 HB2 ALA C 4 48.189 -6.571 -1.878 1.00 1.00 H new ATOM 0 HB3 ALA C 4 46.588 -5.808 -2.015 1.00 1.00 H new ATOM 262 N ILE C 5 45.206 -8.807 -3.896 1.00 1.00 N ATOM 263 CA ILE C 5 43.830 -9.224 -4.175 1.00 1.00 C ATOM 264 C ILE C 5 43.359 -10.222 -3.121 1.00 1.00 C ATOM 265 O ILE C 5 43.997 -11.253 -2.902 1.00 1.00 O ATOM 266 CB ILE C 5 43.757 -9.872 -5.559 1.00 1.00 C ATOM 267 CG1 ILE C 5 44.125 -8.837 -6.625 1.00 1.00 C ATOM 268 CG2 ILE C 5 42.335 -10.378 -5.812 1.00 1.00 C ATOM 269 CD1 ILE C 5 44.313 -9.535 -7.971 1.00 1.00 C ATOM 0 H ILE C 5 45.850 -9.577 -3.714 1.00 1.00 H new ATOM 0 HA ILE C 5 43.184 -8.346 -4.149 1.00 1.00 H new ATOM 0 HB ILE C 5 44.454 -10.709 -5.606 1.00 1.00 H new ATOM 0 HG12 ILE C 5 43.341 -8.083 -6.701 1.00 1.00 H new ATOM 0 HG13 ILE C 5 45.041 -8.318 -6.342 1.00 1.00 H new ATOM 0 HG21 ILE C 5 42.283 -10.840 -6.798 1.00 1.00 H new ATOM 0 HG22 ILE C 5 42.070 -11.114 -5.053 1.00 1.00 H new ATOM 0 HG23 ILE C 5 41.638 -9.542 -5.766 1.00 1.00 H new ATOM 0 HD11 ILE C 5 44.575 -8.798 -8.730 1.00 1.00 H new ATOM 0 HD12 ILE C 5 45.112 -10.272 -7.890 1.00 1.00 H new ATOM 0 HD13 ILE C 5 43.386 -10.034 -8.255 1.00 1.00 H new ATOM 281 N LEU C 6 42.235 -9.914 -2.472 1.00 1.00 N ATOM 282 CA LEU C 6 41.675 -10.793 -1.440 1.00 1.00 C ATOM 283 C LEU C 6 40.234 -11.159 -1.782 1.00 1.00 C ATOM 284 O LEU C 6 39.424 -10.292 -2.112 1.00 1.00 O ATOM 285 CB LEU C 6 41.714 -10.093 -0.079 1.00 1.00 C ATOM 286 CG LEU C 6 43.157 -9.714 0.277 1.00 1.00 C ATOM 287 CD1 LEU C 6 43.163 -8.955 1.609 1.00 1.00 C ATOM 288 CD2 LEU C 6 44.023 -10.982 0.398 1.00 1.00 C ATOM 0 H LEU C 6 41.695 -9.065 -2.641 1.00 1.00 H new ATOM 0 HA LEU C 6 42.274 -11.703 -1.397 1.00 1.00 H new ATOM 0 HB2 LEU C 6 41.090 -9.199 -0.103 1.00 1.00 H new ATOM 0 HB3 LEU C 6 41.302 -10.749 0.688 1.00 1.00 H new ATOM 0 HG LEU C 6 43.569 -9.082 -0.509 1.00 1.00 H new ATOM 0 HD11 LEU C 6 44.186 -8.683 1.868 1.00 1.00 H new ATOM 0 HD12 LEU C 6 42.560 -8.052 1.516 1.00 1.00 H new ATOM 0 HD13 LEU C 6 42.748 -9.590 2.391 1.00 1.00 H new ATOM 0 HD21 LEU C 6 45.045 -10.702 0.651 1.00 1.00 H new ATOM 0 HD22 LEU C 6 43.619 -11.625 1.180 1.00 1.00 H new ATOM 0 HD23 LEU C 6 44.018 -11.518 -0.551 1.00 1.00 H new ATOM 300 N SER C 7 39.920 -12.448 -1.697 1.00 1.00 N ATOM 301 CA SER C 7 38.571 -12.917 -1.997 1.00 1.00 C ATOM 302 C SER C 7 38.387 -14.355 -1.525 1.00 1.00 C ATOM 303 O SER C 7 38.623 -15.253 -2.317 1.00 1.00 O ATOM 304 CB SER C 7 38.314 -12.835 -3.502 1.00 1.00 C ATOM 305 OG SER C 7 39.359 -13.506 -4.195 1.00 1.00 O ATOM 306 OXT SER C 7 38.012 -14.537 -0.378 1.00 1.00 O ATOM 0 H SER C 7 40.575 -13.181 -1.425 1.00 1.00 H new ATOM 0 HA SER C 7 37.859 -12.281 -1.471 1.00 1.00 H new ATOM 0 HB2 SER C 7 37.353 -13.288 -3.743 1.00 1.00 H new ATOM 0 HB3 SER C 7 38.263 -11.793 -3.818 1.00 1.00 H new ATOM 0 HG SER C 7 39.504 -14.388 -3.794 1.00 1.00 H new TER 312 SER C 7 ATOM 313 N ASN D 1 55.000 2.076 2.530 1.00 1.00 N ATOM 314 CA ASN D 1 53.515 2.025 2.413 1.00 1.00 C ATOM 315 C ASN D 1 52.981 0.876 3.261 1.00 1.00 C ATOM 316 O ASN D 1 53.607 -0.180 3.359 1.00 1.00 O ATOM 317 CB ASN D 1 53.128 1.820 0.947 1.00 1.00 C ATOM 318 CG ASN D 1 51.617 1.950 0.785 1.00 1.00 C ATOM 319 OD1 ASN D 1 50.873 1.816 1.757 1.00 1.00 O ATOM 320 ND2 ASN D 1 51.117 2.206 -0.393 1.00 1.00 N ATOM 0 H1 ASN D 1 55.419 2.189 1.585 1.00 1.00 H new ATOM 0 H2 ASN D 1 55.274 2.881 3.129 1.00 1.00 H new ATOM 0 H3 ASN D 1 55.345 1.193 2.958 1.00 1.00 H new ATOM 0 HA ASN D 1 53.084 2.961 2.768 1.00 1.00 H new ATOM 0 HB2 ASN D 1 53.634 2.556 0.322 1.00 1.00 H new ATOM 0 HB3 ASN D 1 53.455 0.837 0.610 1.00 1.00 H new ATOM 0 HD21 ASN D 1 50.108 2.296 -0.510 1.00 1.00 H new ATOM 0 HD22 ASN D 1 51.736 2.317 -1.197 1.00 1.00 H new ATOM 329 N PHE D 2 51.818 1.089 3.877 1.00 1.00 N ATOM 330 CA PHE D 2 51.193 0.068 4.724 1.00 1.00 C ATOM 331 C PHE D 2 49.738 -0.151 4.323 1.00 1.00 C ATOM 332 O PHE D 2 48.966 0.801 4.203 1.00 1.00 O ATOM 333 CB PHE D 2 51.261 0.504 6.190 1.00 1.00 C ATOM 334 CG PHE D 2 50.557 -0.516 7.056 1.00 1.00 C ATOM 335 CD1 PHE D 2 51.109 -1.792 7.222 1.00 1.00 C ATOM 336 CD2 PHE D 2 49.355 -0.188 7.698 1.00 1.00 C ATOM 337 CE1 PHE D 2 50.461 -2.738 8.024 1.00 1.00 C ATOM 338 CE2 PHE D 2 48.707 -1.135 8.501 1.00 1.00 C ATOM 339 CZ PHE D 2 49.260 -2.410 8.663 1.00 1.00 C ATOM 0 H PHE D 2 51.289 1.958 3.807 1.00 1.00 H new ATOM 0 HA PHE D 2 51.734 -0.869 4.593 1.00 1.00 H new ATOM 0 HB2 PHE D 2 52.301 0.605 6.502 1.00 1.00 H new ATOM 0 HB3 PHE D 2 50.795 1.482 6.311 1.00 1.00 H new ATOM 0 HD1 PHE D 2 52.036 -2.046 6.730 1.00 1.00 H new ATOM 0 HD2 PHE D 2 48.928 0.796 7.573 1.00 1.00 H new ATOM 0 HE1 PHE D 2 50.888 -3.722 8.150 1.00 1.00 H new ATOM 0 HE2 PHE D 2 47.781 -0.881 8.995 1.00 1.00 H new ATOM 0 HZ PHE D 2 48.760 -3.141 9.281 1.00 1.00 H new ATOM 349 N GLY D 3 49.369 -1.417 4.125 1.00 1.00 N ATOM 350 CA GLY D 3 48.000 -1.776 3.744 1.00 1.00 C ATOM 351 C GLY D 3 47.460 -2.856 4.676 1.00 1.00 C ATOM 352 O GLY D 3 48.161 -3.816 4.991 1.00 1.00 O ATOM 0 H GLY D 3 49.999 -2.213 4.222 1.00 1.00 H new ATOM 0 HA2 GLY D 3 47.360 -0.895 3.787 1.00 1.00 H new ATOM 0 HA3 GLY D 3 47.983 -2.132 2.714 1.00 1.00 H new ATOM 356 N ALA D 4 46.213 -2.695 5.123 1.00 1.00 N ATOM 357 CA ALA D 4 45.602 -3.671 6.030 1.00 1.00 C ATOM 358 C ALA D 4 44.125 -3.876 5.711 1.00 1.00 C ATOM 359 O ALA D 4 43.376 -2.915 5.528 1.00 1.00 O ATOM 360 CB ALA D 4 45.745 -3.191 7.475 1.00 1.00 C ATOM 0 H ALA D 4 45.612 -1.909 4.876 1.00 1.00 H new ATOM 0 HA ALA D 4 46.118 -4.622 5.898 1.00 1.00 H new ATOM 0 HB1 ALA D 4 45.290 -3.919 8.147 1.00 1.00 H new ATOM 0 HB2 ALA D 4 46.802 -3.083 7.720 1.00 1.00 H new ATOM 0 HB3 ALA D 4 45.246 -2.229 7.590 1.00 1.00 H new ATOM 366 N ILE D 5 43.713 -5.144 5.662 1.00 1.00 N ATOM 367 CA ILE D 5 42.319 -5.502 5.381 1.00 1.00 C ATOM 368 C ILE D 5 41.770 -6.384 6.500 1.00 1.00 C ATOM 369 O ILE D 5 42.381 -7.389 6.864 1.00 1.00 O ATOM 370 CB ILE D 5 42.234 -6.262 4.052 1.00 1.00 C ATOM 371 CG1 ILE D 5 42.747 -5.376 2.901 1.00 1.00 C ATOM 372 CG2 ILE D 5 40.786 -6.683 3.787 1.00 1.00 C ATOM 373 CD1 ILE D 5 41.941 -4.071 2.797 1.00 1.00 C ATOM 0 H ILE D 5 44.327 -5.944 5.814 1.00 1.00 H new ATOM 0 HA ILE D 5 41.729 -4.588 5.317 1.00 1.00 H new ATOM 0 HB ILE D 5 42.858 -7.154 4.112 1.00 1.00 H new ATOM 0 HG12 ILE D 5 43.800 -5.144 3.060 1.00 1.00 H new ATOM 0 HG13 ILE D 5 42.680 -5.923 1.961 1.00 1.00 H new ATOM 0 HG21 ILE D 5 40.731 -7.223 2.842 1.00 1.00 H new ATOM 0 HG22 ILE D 5 40.441 -7.329 4.594 1.00 1.00 H new ATOM 0 HG23 ILE D 5 40.153 -5.797 3.736 1.00 1.00 H new ATOM 0 HD11 ILE D 5 42.328 -3.469 1.975 1.00 1.00 H new ATOM 0 HD12 ILE D 5 40.892 -4.305 2.613 1.00 1.00 H new ATOM 0 HD13 ILE D 5 42.030 -3.513 3.729 1.00 1.00 H new ATOM 385 N LEU D 6 40.615 -6.000 7.044 1.00 1.00 N ATOM 386 CA LEU D 6 39.978 -6.759 8.127 1.00 1.00 C ATOM 387 C LEU D 6 38.593 -7.234 7.697 1.00 1.00 C ATOM 388 O LEU D 6 37.775 -6.447 7.223 1.00 1.00 O ATOM 389 CB LEU D 6 39.865 -5.871 9.376 1.00 1.00 C ATOM 390 CG LEU D 6 39.114 -6.603 10.501 1.00 1.00 C ATOM 391 CD1 LEU D 6 39.803 -7.938 10.823 1.00 1.00 C ATOM 392 CD2 LEU D 6 39.109 -5.715 11.750 1.00 1.00 C ATOM 0 H LEU D 6 40.100 -5.169 6.755 1.00 1.00 H new ATOM 0 HA LEU D 6 40.588 -7.633 8.357 1.00 1.00 H new ATOM 0 HB2 LEU D 6 40.861 -5.591 9.720 1.00 1.00 H new ATOM 0 HB3 LEU D 6 39.343 -4.948 9.125 1.00 1.00 H new ATOM 0 HG LEU D 6 38.092 -6.807 10.180 1.00 1.00 H new ATOM 0 HD11 LEU D 6 39.260 -8.444 11.621 1.00 1.00 H new ATOM 0 HD12 LEU D 6 39.811 -8.567 9.933 1.00 1.00 H new ATOM 0 HD13 LEU D 6 40.828 -7.751 11.144 1.00 1.00 H new ATOM 0 HD21 LEU D 6 38.579 -6.223 12.556 1.00 1.00 H new ATOM 0 HD22 LEU D 6 40.135 -5.516 12.059 1.00 1.00 H new ATOM 0 HD23 LEU D 6 38.609 -4.773 11.525 1.00 1.00 H new ATOM 404 N SER D 7 38.337 -8.527 7.866 1.00 1.00 N ATOM 405 CA SER D 7 37.047 -9.098 7.491 1.00 1.00 C ATOM 406 C SER D 7 36.806 -10.410 8.231 1.00 1.00 C ATOM 407 O SER D 7 37.522 -10.670 9.184 1.00 1.00 O ATOM 408 CB SER D 7 37.005 -9.345 5.983 1.00 1.00 C ATOM 409 OG SER D 7 37.565 -8.226 5.309 1.00 1.00 O ATOM 410 OXT SER D 7 35.910 -11.135 7.834 1.00 1.00 O ATOM 0 H SER D 7 39.000 -9.196 8.257 1.00 1.00 H new ATOM 0 HA SER D 7 36.264 -8.391 7.765 1.00 1.00 H new ATOM 0 HB2 SER D 7 37.561 -10.249 5.735 1.00 1.00 H new ATOM 0 HB3 SER D 7 35.977 -9.504 5.657 1.00 1.00 H new ATOM 0 HG SER D 7 37.231 -7.399 5.715 1.00 1.00 H new TER 416 SER D 7 ATOM 417 N ASN E 1 49.888 5.903 -8.211 1.00 1.00 N ATOM 418 CA ASN E 1 48.428 5.802 -8.493 1.00 1.00 C ATOM 419 C ASN E 1 47.796 4.803 -7.529 1.00 1.00 C ATOM 420 O ASN E 1 48.209 3.644 -7.461 1.00 1.00 O ATOM 421 CB ASN E 1 48.220 5.338 -9.938 1.00 1.00 C ATOM 422 CG ASN E 1 48.722 6.403 -10.910 1.00 1.00 C ATOM 423 OD1 ASN E 1 48.711 7.659 -10.557 1.00 1.00 O flip ATOM 424 ND2 ASN E 1 49.133 6.079 -12.025 1.00 1.00 N flip ATOM 0 H1 ASN E 1 50.195 6.890 -8.321 1.00 1.00 H new ATOM 0 H2 ASN E 1 50.076 5.589 -7.238 1.00 1.00 H new ATOM 0 H3 ASN E 1 50.413 5.301 -8.877 1.00 1.00 H new ATOM 0 HA ASN E 1 47.958 6.776 -8.359 1.00 1.00 H new ATOM 0 HB2 ASN E 1 48.751 4.401 -10.107 1.00 1.00 H new ATOM 0 HB3 ASN E 1 47.163 5.142 -10.116 1.00 1.00 H new ATOM 0 HD21 ASN E 1 49.141 5.097 -12.300 1.00 1.00 H new ATOM 0 HD22 ASN E 1 49.465 6.793 -12.673 1.00 1.00 H new ATOM 433 N PHE E 2 46.791 5.260 -6.782 1.00 1.00 N ATOM 434 CA PHE E 2 46.094 4.406 -5.815 1.00 1.00 C ATOM 435 C PHE E 2 44.712 4.029 -6.342 1.00 1.00 C ATOM 436 O PHE E 2 43.888 4.899 -6.626 1.00 1.00 O ATOM 437 CB PHE E 2 45.954 5.150 -4.472 1.00 1.00 C ATOM 438 CG PHE E 2 47.217 4.991 -3.653 1.00 1.00 C ATOM 439 CD1 PHE E 2 48.452 5.384 -4.187 1.00 1.00 C ATOM 440 CD2 PHE E 2 47.158 4.442 -2.363 1.00 1.00 C ATOM 441 CE1 PHE E 2 49.620 5.230 -3.435 1.00 1.00 C ATOM 442 CE2 PHE E 2 48.328 4.286 -1.615 1.00 1.00 C ATOM 443 CZ PHE E 2 49.560 4.681 -2.150 1.00 1.00 C ATOM 0 H PHE E 2 46.440 6.217 -6.827 1.00 1.00 H new ATOM 0 HA PHE E 2 46.674 3.495 -5.666 1.00 1.00 H new ATOM 0 HB2 PHE E 2 45.759 6.207 -4.652 1.00 1.00 H new ATOM 0 HB3 PHE E 2 45.101 4.758 -3.918 1.00 1.00 H new ATOM 0 HD1 PHE E 2 48.501 5.806 -5.180 1.00 1.00 H new ATOM 0 HD2 PHE E 2 46.208 4.140 -1.948 1.00 1.00 H new ATOM 0 HE1 PHE E 2 50.571 5.535 -3.847 1.00 1.00 H new ATOM 0 HE2 PHE E 2 48.282 3.860 -0.623 1.00 1.00 H new ATOM 0 HZ PHE E 2 50.464 4.562 -1.571 1.00 1.00 H new ATOM 453 N GLY E 3 44.460 2.725 -6.460 1.00 1.00 N ATOM 454 CA GLY E 3 43.167 2.234 -6.943 1.00 1.00 C ATOM 455 C GLY E 3 42.653 1.121 -6.041 1.00 1.00 C ATOM 456 O GLY E 3 43.403 0.221 -5.664 1.00 1.00 O ATOM 0 H GLY E 3 45.130 1.992 -6.229 1.00 1.00 H new ATOM 0 HA2 GLY E 3 42.447 3.052 -6.969 1.00 1.00 H new ATOM 0 HA3 GLY E 3 43.269 1.866 -7.964 1.00 1.00 H new ATOM 460 N ALA E 4 41.369 1.187 -5.689 1.00 1.00 N ATOM 461 CA ALA E 4 40.771 0.174 -4.819 1.00 1.00 C ATOM 462 C ALA E 4 39.334 -0.127 -5.231 1.00 1.00 C ATOM 463 O ALA E 4 38.551 0.782 -5.510 1.00 1.00 O ATOM 464 CB ALA E 4 40.792 0.659 -3.370 1.00 1.00 C ATOM 0 H ALA E 4 40.729 1.922 -5.989 1.00 1.00 H new ATOM 0 HA ALA E 4 41.356 -0.741 -4.913 1.00 1.00 H new ATOM 0 HB1 ALA E 4 40.346 -0.099 -2.726 1.00 1.00 H new ATOM 0 HB2 ALA E 4 41.822 0.837 -3.061 1.00 1.00 H new ATOM 0 HB3 ALA E 4 40.223 1.585 -3.288 1.00 1.00 H new ATOM 470 N ILE E 5 38.995 -1.416 -5.257 1.00 1.00 N ATOM 471 CA ILE E 5 37.645 -1.855 -5.623 1.00 1.00 C ATOM 472 C ILE E 5 37.128 -2.873 -4.608 1.00 1.00 C ATOM 473 O ILE E 5 37.768 -3.901 -4.364 1.00 1.00 O ATOM 474 CB ILE E 5 37.663 -2.485 -7.016 1.00 1.00 C ATOM 475 CG1 ILE E 5 38.067 -1.429 -8.047 1.00 1.00 C ATOM 476 CG2 ILE E 5 36.270 -3.020 -7.353 1.00 1.00 C ATOM 477 CD1 ILE E 5 38.343 -2.104 -9.390 1.00 1.00 C ATOM 0 H ILE E 5 39.636 -2.176 -5.029 1.00 1.00 H new ATOM 0 HA ILE E 5 36.984 -0.988 -5.626 1.00 1.00 H new ATOM 0 HB ILE E 5 38.381 -3.305 -7.035 1.00 1.00 H new ATOM 0 HG12 ILE E 5 37.273 -0.690 -8.156 1.00 1.00 H new ATOM 0 HG13 ILE E 5 38.955 -0.895 -7.707 1.00 1.00 H new ATOM 0 HG21 ILE E 5 36.283 -3.469 -8.346 1.00 1.00 H new ATOM 0 HG22 ILE E 5 35.982 -3.772 -6.619 1.00 1.00 H new ATOM 0 HG23 ILE E 5 35.551 -2.201 -7.335 1.00 1.00 H new ATOM 0 HD11 ILE E 5 38.631 -1.351 -10.123 1.00 1.00 H new ATOM 0 HD12 ILE E 5 39.152 -2.826 -9.275 1.00 1.00 H new ATOM 0 HD13 ILE E 5 37.444 -2.617 -9.731 1.00 1.00 H new ATOM 489 N LEU E 6 35.965 -2.583 -4.023 1.00 1.00 N ATOM 490 CA LEU E 6 35.354 -3.476 -3.034 1.00 1.00 C ATOM 491 C LEU E 6 33.936 -3.850 -3.458 1.00 1.00 C ATOM 492 O LEU E 6 33.133 -2.983 -3.807 1.00 1.00 O ATOM 493 CB LEU E 6 35.308 -2.787 -1.667 1.00 1.00 C ATOM 494 CG LEU E 6 36.727 -2.402 -1.223 1.00 1.00 C ATOM 495 CD1 LEU E 6 36.655 -1.668 0.122 1.00 1.00 C ATOM 496 CD2 LEU E 6 37.593 -3.666 -1.079 1.00 1.00 C ATOM 0 H LEU E 6 35.427 -1.738 -4.216 1.00 1.00 H new ATOM 0 HA LEU E 6 35.957 -4.382 -2.967 1.00 1.00 H new ATOM 0 HB2 LEU E 6 34.681 -1.897 -1.720 1.00 1.00 H new ATOM 0 HB3 LEU E 6 34.856 -3.452 -0.931 1.00 1.00 H new ATOM 0 HG LEU E 6 37.176 -1.750 -1.972 1.00 1.00 H new ATOM 0 HD11 LEU E 6 37.660 -1.393 0.441 1.00 1.00 H new ATOM 0 HD12 LEU E 6 36.050 -0.768 0.013 1.00 1.00 H new ATOM 0 HD13 LEU E 6 36.203 -2.321 0.869 1.00 1.00 H new ATOM 0 HD21 LEU E 6 38.598 -3.385 -0.764 1.00 1.00 H new ATOM 0 HD22 LEU E 6 37.151 -4.327 -0.334 1.00 1.00 H new ATOM 0 HD23 LEU E 6 37.645 -4.183 -2.037 1.00 1.00 H new ATOM 508 N SER E 7 33.637 -5.143 -3.424 1.00 1.00 N ATOM 509 CA SER E 7 32.312 -5.621 -3.805 1.00 1.00 C ATOM 510 C SER E 7 32.118 -7.070 -3.365 1.00 1.00 C ATOM 511 O SER E 7 32.451 -7.953 -4.138 1.00 1.00 O ATOM 512 CB SER E 7 32.137 -5.520 -5.320 1.00 1.00 C ATOM 513 OG SER E 7 33.270 -6.086 -5.962 1.00 1.00 O ATOM 514 OXT SER E 7 31.639 -7.273 -2.261 1.00 1.00 O ATOM 0 H SER E 7 34.288 -5.875 -3.139 1.00 1.00 H new ATOM 0 HA SER E 7 31.566 -4.999 -3.310 1.00 1.00 H new ATOM 0 HB2 SER E 7 31.231 -6.042 -5.629 1.00 1.00 H new ATOM 0 HB3 SER E 7 32.020 -4.477 -5.615 1.00 1.00 H new ATOM 0 HG SER E 7 33.403 -7.003 -5.643 1.00 1.00 H new TER 520 SER E 7 ATOM 521 N ASN F 1 48.493 9.242 1.970 1.00 1.00 N ATOM 522 CA ASN F 1 47.016 9.180 1.783 1.00 1.00 C ATOM 523 C ASN F 1 46.454 8.007 2.580 1.00 1.00 C ATOM 524 O ASN F 1 47.093 6.959 2.697 1.00 1.00 O ATOM 525 CB ASN F 1 46.701 9.004 0.295 1.00 1.00 C ATOM 526 CG ASN F 1 45.199 9.126 0.061 1.00 1.00 C ATOM 527 OD1 ASN F 1 44.409 8.955 0.989 1.00 1.00 O ATOM 528 ND2 ASN F 1 44.755 9.415 -1.132 1.00 1.00 N ATOM 0 H1 ASN F 1 48.758 10.181 2.329 1.00 1.00 H new ATOM 0 H2 ASN F 1 48.787 8.514 2.652 1.00 1.00 H new ATOM 0 H3 ASN F 1 48.966 9.074 1.059 1.00 1.00 H new ATOM 0 HA ASN F 1 46.559 10.104 2.138 1.00 1.00 H new ATOM 0 HB2 ASN F 1 47.230 9.757 -0.289 1.00 1.00 H new ATOM 0 HB3 ASN F 1 47.053 8.031 -0.047 1.00 1.00 H new ATOM 0 HD21 ASN F 1 43.752 9.499 -1.296 1.00 1.00 H new ATOM 0 HD22 ASN F 1 45.411 9.556 -1.900 1.00 1.00 H new ATOM 537 N PHE F 2 45.253 8.194 3.129 1.00 1.00 N ATOM 538 CA PHE F 2 44.595 7.151 3.924 1.00 1.00 C ATOM 539 C PHE F 2 43.160 6.939 3.449 1.00 1.00 C ATOM 540 O PHE F 2 42.392 7.889 3.319 1.00 1.00 O ATOM 541 CB PHE F 2 44.588 7.553 5.400 1.00 1.00 C ATOM 542 CG PHE F 2 43.846 6.510 6.208 1.00 1.00 C ATOM 543 CD1 PHE F 2 44.392 5.230 6.364 1.00 1.00 C ATOM 544 CD2 PHE F 2 42.617 6.821 6.805 1.00 1.00 C ATOM 545 CE1 PHE F 2 43.714 4.264 7.113 1.00 1.00 C ATOM 546 CE2 PHE F 2 41.938 5.854 7.554 1.00 1.00 C ATOM 547 CZ PHE F 2 42.488 4.576 7.709 1.00 1.00 C ATOM 0 H PHE F 2 44.715 9.056 3.039 1.00 1.00 H new ATOM 0 HA PHE F 2 45.148 6.220 3.799 1.00 1.00 H new ATOM 0 HB2 PHE F 2 45.610 7.651 5.765 1.00 1.00 H new ATOM 0 HB3 PHE F 2 44.112 8.526 5.520 1.00 1.00 H new ATOM 0 HD1 PHE F 2 45.339 4.989 5.905 1.00 1.00 H new ATOM 0 HD2 PHE F 2 42.194 7.808 6.687 1.00 1.00 H new ATOM 0 HE1 PHE F 2 44.137 3.277 7.231 1.00 1.00 H new ATOM 0 HE2 PHE F 2 40.990 6.093 8.012 1.00 1.00 H new ATOM 0 HZ PHE F 2 41.965 3.830 8.289 1.00 1.00 H new ATOM 557 N GLY F 3 42.807 5.677 3.199 1.00 1.00 N ATOM 558 CA GLY F 3 41.457 5.329 2.745 1.00 1.00 C ATOM 559 C GLY F 3 40.878 4.223 3.619 1.00 1.00 C ATOM 560 O GLY F 3 41.569 3.258 3.944 1.00 1.00 O ATOM 0 H GLY F 3 43.435 4.880 3.303 1.00 1.00 H new ATOM 0 HA2 GLY F 3 40.814 6.208 2.784 1.00 1.00 H new ATOM 0 HA3 GLY F 3 41.488 5.003 1.705 1.00 1.00 H new ATOM 564 N ALA F 4 39.610 4.367 4.010 1.00 1.00 N ATOM 565 CA ALA F 4 38.962 3.366 4.861 1.00 1.00 C ATOM 566 C ALA F 4 37.502 3.167 4.473 1.00 1.00 C ATOM 567 O ALA F 4 36.757 4.129 4.290 1.00 1.00 O ATOM 568 CB ALA F 4 39.040 3.807 6.324 1.00 1.00 C ATOM 0 H ALA F 4 39.017 5.157 3.755 1.00 1.00 H new ATOM 0 HA ALA F 4 39.485 2.419 4.725 1.00 1.00 H new ATOM 0 HB1 ALA F 4 38.557 3.061 6.955 1.00 1.00 H new ATOM 0 HB2 ALA F 4 40.085 3.910 6.618 1.00 1.00 H new ATOM 0 HB3 ALA F 4 38.534 4.765 6.443 1.00 1.00 H new ATOM 574 N ILE F 5 37.100 1.899 4.363 1.00 1.00 N ATOM 575 CA ILE F 5 35.722 1.546 4.012 1.00 1.00 C ATOM 576 C ILE F 5 35.134 0.615 5.070 1.00 1.00 C ATOM 577 O ILE F 5 35.734 -0.404 5.417 1.00 1.00 O ATOM 578 CB ILE F 5 35.690 0.852 2.647 1.00 1.00 C ATOM 579 CG1 ILE F 5 36.230 1.802 1.558 1.00 1.00 C ATOM 580 CG2 ILE F 5 34.258 0.425 2.312 1.00 1.00 C ATOM 581 CD1 ILE F 5 35.400 3.096 1.482 1.00 1.00 C ATOM 0 H ILE F 5 37.712 1.097 4.513 1.00 1.00 H new ATOM 0 HA ILE F 5 35.128 2.459 3.966 1.00 1.00 H new ATOM 0 HB ILE F 5 36.323 -0.035 2.685 1.00 1.00 H new ATOM 0 HG12 ILE F 5 37.271 2.047 1.770 1.00 1.00 H new ATOM 0 HG13 ILE F 5 36.211 1.298 0.591 1.00 1.00 H new ATOM 0 HG21 ILE F 5 34.243 -0.068 1.340 1.00 1.00 H new ATOM 0 HG22 ILE F 5 33.896 -0.265 3.074 1.00 1.00 H new ATOM 0 HG23 ILE F 5 33.614 1.304 2.283 1.00 1.00 H new ATOM 0 HD11 ILE F 5 35.806 3.744 0.705 1.00 1.00 H new ATOM 0 HD12 ILE F 5 34.365 2.851 1.245 1.00 1.00 H new ATOM 0 HD13 ILE F 5 35.440 3.611 2.442 1.00 1.00 H new ATOM 593 N LEU F 6 33.955 0.978 5.579 1.00 1.00 N ATOM 594 CA LEU F 6 33.272 0.182 6.606 1.00 1.00 C ATOM 595 C LEU F 6 31.912 -0.286 6.095 1.00 1.00 C ATOM 596 O LEU F 6 31.107 0.515 5.619 1.00 1.00 O ATOM 597 CB LEU F 6 33.092 1.032 7.871 1.00 1.00 C ATOM 598 CG LEU F 6 32.287 0.271 8.937 1.00 1.00 C ATOM 599 CD1 LEU F 6 32.963 -1.069 9.263 1.00 1.00 C ATOM 600 CD2 LEU F 6 32.215 1.126 10.207 1.00 1.00 C ATOM 0 H LEU F 6 33.451 1.819 5.298 1.00 1.00 H new ATOM 0 HA LEU F 6 33.875 -0.695 6.839 1.00 1.00 H new ATOM 0 HB2 LEU F 6 34.068 1.304 8.273 1.00 1.00 H new ATOM 0 HB3 LEU F 6 32.581 1.961 7.619 1.00 1.00 H new ATOM 0 HG LEU F 6 31.285 0.074 8.557 1.00 1.00 H new ATOM 0 HD11 LEU F 6 32.381 -1.596 10.019 1.00 1.00 H new ATOM 0 HD12 LEU F 6 33.020 -1.677 8.360 1.00 1.00 H new ATOM 0 HD13 LEU F 6 33.969 -0.887 9.641 1.00 1.00 H new ATOM 0 HD21 LEU F 6 31.646 0.596 10.971 1.00 1.00 H new ATOM 0 HD22 LEU F 6 33.223 1.318 10.574 1.00 1.00 H new ATOM 0 HD23 LEU F 6 31.725 2.073 9.981 1.00 1.00 H new ATOM 612 N SER F 7 31.663 -1.589 6.194 1.00 1.00 N ATOM 613 CA SER F 7 30.396 -2.152 5.737 1.00 1.00 C ATOM 614 C SER F 7 30.127 -3.488 6.423 1.00 1.00 C ATOM 615 O SER F 7 30.780 -3.764 7.414 1.00 1.00 O ATOM 616 CB SER F 7 30.432 -2.352 4.222 1.00 1.00 C ATOM 617 OG SER F 7 30.936 -1.176 3.605 1.00 1.00 O ATOM 618 OXT SER F 7 29.269 -4.212 5.945 1.00 1.00 O ATOM 0 H SER F 7 32.315 -2.270 6.583 1.00 1.00 H new ATOM 0 HA SER F 7 29.596 -1.457 5.993 1.00 1.00 H new ATOM 0 HB2 SER F 7 31.061 -3.206 3.971 1.00 1.00 H new ATOM 0 HB3 SER F 7 29.432 -2.572 3.849 1.00 1.00 H new ATOM 0 HG SER F 7 30.630 -0.389 4.102 1.00 1.00 H new TER 624 SER F 7 ATOM 625 N ASN G 1 27.862 -2.093 -4.201 1.00 1.00 N ATOM 626 CA ASN G 1 29.236 -2.204 -4.767 1.00 1.00 C ATOM 627 C ASN G 1 29.998 -0.911 -4.497 1.00 1.00 C ATOM 628 O ASN G 1 29.563 0.171 -4.894 1.00 1.00 O ATOM 629 CB ASN G 1 29.147 -2.450 -6.274 1.00 1.00 C ATOM 630 CG ASN G 1 28.520 -3.813 -6.550 1.00 1.00 C ATOM 631 OD1 ASN G 1 28.652 -4.775 -5.677 1.00 1.00 O flip ATOM 632 ND2 ASN G 1 27.893 -4.008 -7.591 1.00 1.00 N flip ATOM 0 H1 ASN G 1 27.386 -3.016 -4.262 1.00 1.00 H new ATOM 0 H2 ASN G 1 27.919 -1.798 -3.205 1.00 1.00 H new ATOM 0 H3 ASN G 1 27.320 -1.388 -4.740 1.00 1.00 H new ATOM 0 HA ASN G 1 29.761 -3.036 -4.299 1.00 1.00 H new ATOM 0 HB2 ASN G 1 28.552 -1.666 -6.743 1.00 1.00 H new ATOM 0 HB3 ASN G 1 30.142 -2.403 -6.717 1.00 1.00 H new ATOM 0 HD21 ASN G 1 27.790 -3.256 -8.273 1.00 1.00 H new ATOM 0 HD22 ASN G 1 27.476 -4.921 -7.772 1.00 1.00 H new ATOM 641 N PHE G 2 31.140 -1.030 -3.822 1.00 1.00 N ATOM 642 CA PHE G 2 31.970 0.136 -3.501 1.00 1.00 C ATOM 643 C PHE G 2 33.212 0.163 -4.390 1.00 1.00 C ATOM 644 O PHE G 2 33.999 -0.783 -4.407 1.00 1.00 O ATOM 645 CB PHE G 2 32.394 0.087 -2.017 1.00 1.00 C ATOM 646 CG PHE G 2 31.299 0.661 -1.134 1.00 1.00 C ATOM 647 CD1 PHE G 2 30.009 0.119 -1.183 1.00 1.00 C ATOM 648 CD2 PHE G 2 31.575 1.733 -0.274 1.00 1.00 C ATOM 649 CE1 PHE G 2 28.996 0.646 -0.373 1.00 1.00 C ATOM 650 CE2 PHE G 2 30.561 2.260 0.536 1.00 1.00 C ATOM 651 CZ PHE G 2 29.271 1.716 0.486 1.00 1.00 C ATOM 0 H PHE G 2 31.513 -1.918 -3.486 1.00 1.00 H new ATOM 0 HA PHE G 2 31.387 1.040 -3.680 1.00 1.00 H new ATOM 0 HB2 PHE G 2 32.603 -0.942 -1.726 1.00 1.00 H new ATOM 0 HB3 PHE G 2 33.316 0.651 -1.877 1.00 1.00 H new ATOM 0 HD1 PHE G 2 29.795 -0.706 -1.846 1.00 1.00 H new ATOM 0 HD2 PHE G 2 32.569 2.153 -0.236 1.00 1.00 H new ATOM 0 HE1 PHE G 2 28.002 0.226 -0.411 1.00 1.00 H new ATOM 0 HE2 PHE G 2 30.774 3.086 1.199 1.00 1.00 H new ATOM 0 HZ PHE G 2 28.489 2.122 1.110 1.00 1.00 H new ATOM 661 N GLY G 3 33.383 1.265 -5.118 1.00 1.00 N ATOM 662 CA GLY G 3 34.535 1.432 -6.007 1.00 1.00 C ATOM 663 C GLY G 3 35.155 2.810 -5.815 1.00 1.00 C ATOM 664 O GLY G 3 34.446 3.815 -5.762 1.00 1.00 O ATOM 0 H GLY G 3 32.739 2.056 -5.111 1.00 1.00 H new ATOM 0 HA2 GLY G 3 35.277 0.660 -5.801 1.00 1.00 H new ATOM 0 HA3 GLY G 3 34.224 1.307 -7.044 1.00 1.00 H new ATOM 668 N ALA G 4 36.481 2.855 -5.707 1.00 1.00 N ATOM 669 CA ALA G 4 37.187 4.124 -5.517 1.00 1.00 C ATOM 670 C ALA G 4 38.499 4.132 -6.288 1.00 1.00 C ATOM 671 O ALA G 4 39.224 3.137 -6.318 1.00 1.00 O ATOM 672 CB ALA G 4 37.468 4.344 -4.031 1.00 1.00 C ATOM 0 H ALA G 4 37.086 2.035 -5.747 1.00 1.00 H new ATOM 0 HA ALA G 4 36.555 4.928 -5.894 1.00 1.00 H new ATOM 0 HB1 ALA G 4 37.993 5.289 -3.896 1.00 1.00 H new ATOM 0 HB2 ALA G 4 36.526 4.371 -3.483 1.00 1.00 H new ATOM 0 HB3 ALA G 4 38.085 3.529 -3.653 1.00 1.00 H new ATOM 678 N ILE G 5 38.799 5.272 -6.905 1.00 1.00 N ATOM 679 CA ILE G 5 40.030 5.427 -7.678 1.00 1.00 C ATOM 680 C ILE G 5 40.685 6.765 -7.362 1.00 1.00 C ATOM 681 O ILE G 5 40.059 7.816 -7.489 1.00 1.00 O ATOM 682 CB ILE G 5 39.699 5.346 -9.175 1.00 1.00 C ATOM 683 CG1 ILE G 5 40.991 5.153 -9.986 1.00 1.00 C ATOM 684 CG2 ILE G 5 38.999 6.636 -9.627 1.00 1.00 C ATOM 685 CD1 ILE G 5 41.611 3.768 -9.718 1.00 1.00 C ATOM 0 H ILE G 5 38.207 6.102 -6.885 1.00 1.00 H new ATOM 0 HA ILE G 5 40.725 4.630 -7.414 1.00 1.00 H new ATOM 0 HB ILE G 5 39.036 4.498 -9.344 1.00 1.00 H new ATOM 0 HG12 ILE G 5 40.776 5.259 -11.049 1.00 1.00 H new ATOM 0 HG13 ILE G 5 41.707 5.932 -9.726 1.00 1.00 H new ATOM 0 HG21 ILE G 5 38.767 6.571 -10.690 1.00 1.00 H new ATOM 0 HG22 ILE G 5 38.076 6.766 -9.062 1.00 1.00 H new ATOM 0 HG23 ILE G 5 39.656 7.488 -9.450 1.00 1.00 H new ATOM 0 HD11 ILE G 5 42.523 3.658 -10.304 1.00 1.00 H new ATOM 0 HD12 ILE G 5 41.847 3.674 -8.658 1.00 1.00 H new ATOM 0 HD13 ILE G 5 40.902 2.991 -10.002 1.00 1.00 H new ATOM 697 N LEU G 6 41.950 6.719 -6.953 1.00 1.00 N ATOM 698 CA LEU G 6 42.696 7.934 -6.618 1.00 1.00 C ATOM 699 C LEU G 6 43.990 8.001 -7.422 1.00 1.00 C ATOM 700 O LEU G 6 44.753 7.035 -7.474 1.00 1.00 O ATOM 701 CB LEU G 6 43.023 7.942 -5.124 1.00 1.00 C ATOM 702 CG LEU G 6 41.728 7.859 -4.303 1.00 1.00 C ATOM 703 CD1 LEU G 6 42.081 7.796 -2.811 1.00 1.00 C ATOM 704 CD2 LEU G 6 40.848 9.093 -4.575 1.00 1.00 C ATOM 0 H LEU G 6 42.482 5.855 -6.845 1.00 1.00 H new ATOM 0 HA LEU G 6 42.082 8.801 -6.863 1.00 1.00 H new ATOM 0 HB2 LEU G 6 43.672 7.101 -4.881 1.00 1.00 H new ATOM 0 HB3 LEU G 6 43.568 8.850 -4.867 1.00 1.00 H new ATOM 0 HG LEU G 6 41.176 6.964 -4.590 1.00 1.00 H new ATOM 0 HD11 LEU G 6 41.165 7.737 -2.223 1.00 1.00 H new ATOM 0 HD12 LEU G 6 42.693 6.915 -2.619 1.00 1.00 H new ATOM 0 HD13 LEU G 6 42.636 8.691 -2.530 1.00 1.00 H new ATOM 0 HD21 LEU G 6 39.932 9.024 -3.988 1.00 1.00 H new ATOM 0 HD22 LEU G 6 41.391 9.996 -4.295 1.00 1.00 H new ATOM 0 HD23 LEU G 6 40.597 9.134 -5.635 1.00 1.00 H new ATOM 716 N SER G 7 44.234 9.149 -8.046 1.00 1.00 N ATOM 717 CA SER G 7 45.441 9.332 -8.845 1.00 1.00 C ATOM 718 C SER G 7 45.663 10.810 -9.148 1.00 1.00 C ATOM 719 O SER G 7 46.375 11.450 -8.390 1.00 1.00 O ATOM 720 CB SER G 7 45.324 8.554 -10.156 1.00 1.00 C ATOM 721 OG SER G 7 45.078 7.183 -9.867 1.00 1.00 O ATOM 722 OXT SER G 7 45.119 11.282 -10.132 1.00 1.00 O ATOM 0 H SER G 7 43.617 9.961 -8.015 1.00 1.00 H new ATOM 0 HA SER G 7 46.291 8.957 -8.275 1.00 1.00 H new ATOM 0 HB2 SER G 7 44.515 8.961 -10.763 1.00 1.00 H new ATOM 0 HB3 SER G 7 46.241 8.657 -10.737 1.00 1.00 H new ATOM 0 HG SER G 7 45.461 6.959 -8.993 1.00 1.00 H new TER 728 SER G 7 ATOM 729 N ASN H 1 25.719 1.063 5.269 1.00 1.00 N ATOM 730 CA ASN H 1 27.161 0.997 4.897 1.00 1.00 C ATOM 731 C ASN H 1 27.783 2.382 5.033 1.00 1.00 C ATOM 732 O ASN H 1 27.140 3.392 4.745 1.00 1.00 O ATOM 733 CB ASN H 1 27.291 0.504 3.456 1.00 1.00 C ATOM 734 CG ASN H 1 28.757 0.261 3.117 1.00 1.00 C ATOM 735 OD1 ASN H 1 29.645 0.802 3.778 1.00 1.00 O ATOM 736 ND2 ASN H 1 29.068 -0.527 2.125 1.00 1.00 N ATOM 0 H1 ASN H 1 25.159 0.510 4.589 1.00 1.00 H new ATOM 0 H2 ASN H 1 25.589 0.672 6.224 1.00 1.00 H new ATOM 0 H3 ASN H 1 25.402 2.053 5.254 1.00 1.00 H new ATOM 0 HA ASN H 1 27.681 0.305 5.560 1.00 1.00 H new ATOM 0 HB2 ASN H 1 26.722 -0.416 3.325 1.00 1.00 H new ATOM 0 HB3 ASN H 1 26.868 1.240 2.772 1.00 1.00 H new ATOM 0 HD21 ASN H 1 30.047 -0.696 1.896 1.00 1.00 H new ATOM 0 HD22 ASN H 1 28.332 -0.974 1.579 1.00 1.00 H new ATOM 745 N PHE H 2 29.040 2.422 5.478 1.00 1.00 N ATOM 746 CA PHE H 2 29.754 3.689 5.656 1.00 1.00 C ATOM 747 C PHE H 2 31.118 3.640 4.973 1.00 1.00 C ATOM 748 O PHE H 2 31.893 2.704 5.174 1.00 1.00 O ATOM 749 CB PHE H 2 29.942 3.970 7.148 1.00 1.00 C ATOM 750 CG PHE H 2 30.743 5.242 7.328 1.00 1.00 C ATOM 751 CD1 PHE H 2 30.181 6.475 6.982 1.00 1.00 C ATOM 752 CD2 PHE H 2 32.046 5.187 7.843 1.00 1.00 C ATOM 753 CE1 PHE H 2 30.918 7.653 7.149 1.00 1.00 C ATOM 754 CE2 PHE H 2 32.783 6.365 8.009 1.00 1.00 C ATOM 755 CZ PHE H 2 32.220 7.598 7.663 1.00 1.00 C ATOM 0 H PHE H 2 29.584 1.594 5.721 1.00 1.00 H new ATOM 0 HA PHE H 2 29.163 4.485 5.203 1.00 1.00 H new ATOM 0 HB2 PHE H 2 28.972 4.067 7.635 1.00 1.00 H new ATOM 0 HB3 PHE H 2 30.455 3.135 7.624 1.00 1.00 H new ATOM 0 HD1 PHE H 2 29.177 6.518 6.586 1.00 1.00 H new ATOM 0 HD2 PHE H 2 32.481 4.236 8.112 1.00 1.00 H new ATOM 0 HE1 PHE H 2 30.483 8.605 6.882 1.00 1.00 H new ATOM 0 HE2 PHE H 2 33.787 6.322 8.404 1.00 1.00 H new ATOM 0 HZ PHE H 2 32.789 8.507 7.792 1.00 1.00 H new ATOM 765 N GLY H 3 31.406 4.660 4.165 1.00 1.00 N ATOM 766 CA GLY H 3 32.683 4.746 3.452 1.00 1.00 C ATOM 767 C GLY H 3 33.328 6.107 3.681 1.00 1.00 C ATOM 768 O GLY H 3 32.651 7.136 3.636 1.00 1.00 O ATOM 0 H GLY H 3 30.773 5.439 3.987 1.00 1.00 H new ATOM 0 HA2 GLY H 3 33.352 3.957 3.795 1.00 1.00 H new ATOM 0 HA3 GLY H 3 32.523 4.587 2.386 1.00 1.00 H new ATOM 772 N ALA H 4 34.637 6.116 3.937 1.00 1.00 N ATOM 773 CA ALA H 4 35.354 7.371 4.181 1.00 1.00 C ATOM 774 C ALA H 4 36.747 7.342 3.562 1.00 1.00 C ATOM 775 O ALA H 4 37.484 6.365 3.702 1.00 1.00 O ATOM 776 CB ALA H 4 35.470 7.611 5.688 1.00 1.00 C ATOM 0 H ALA H 4 35.218 5.279 3.981 1.00 1.00 H new ATOM 0 HA ALA H 4 34.790 8.180 3.717 1.00 1.00 H new ATOM 0 HB1 ALA H 4 36.003 8.544 5.868 1.00 1.00 H new ATOM 0 HB2 ALA H 4 34.473 7.673 6.124 1.00 1.00 H new ATOM 0 HB3 ALA H 4 36.016 6.787 6.147 1.00 1.00 H new ATOM 782 N ILE H 5 37.103 8.435 2.884 1.00 1.00 N ATOM 783 CA ILE H 5 38.416 8.560 2.243 1.00 1.00 C ATOM 784 C ILE H 5 39.110 9.833 2.722 1.00 1.00 C ATOM 785 O ILE H 5 38.537 10.920 2.666 1.00 1.00 O ATOM 786 CB ILE H 5 38.251 8.610 0.723 1.00 1.00 C ATOM 787 CG1 ILE H 5 37.652 7.289 0.234 1.00 1.00 C ATOM 788 CG2 ILE H 5 39.616 8.824 0.068 1.00 1.00 C ATOM 789 CD1 ILE H 5 37.237 7.427 -1.232 1.00 1.00 C ATOM 0 H ILE H 5 36.500 9.249 2.764 1.00 1.00 H new ATOM 0 HA ILE H 5 39.023 7.696 2.512 1.00 1.00 H new ATOM 0 HB ILE H 5 37.588 9.433 0.455 1.00 1.00 H new ATOM 0 HG12 ILE H 5 38.380 6.485 0.342 1.00 1.00 H new ATOM 0 HG13 ILE H 5 36.789 7.021 0.843 1.00 1.00 H new ATOM 0 HG21 ILE H 5 39.498 8.860 -1.015 1.00 1.00 H new ATOM 0 HG22 ILE H 5 40.044 9.764 0.418 1.00 1.00 H new ATOM 0 HG23 ILE H 5 40.280 8.002 0.334 1.00 1.00 H new ATOM 0 HD11 ILE H 5 36.811 6.486 -1.580 1.00 1.00 H new ATOM 0 HD12 ILE H 5 36.494 8.219 -1.327 1.00 1.00 H new ATOM 0 HD13 ILE H 5 38.110 7.674 -1.836 1.00 1.00 H new ATOM 801 N LEU H 6 40.349 9.689 3.198 1.00 1.00 N ATOM 802 CA LEU H 6 41.127 10.831 3.693 1.00 1.00 C ATOM 803 C LEU H 6 42.407 10.995 2.880 1.00 1.00 C ATOM 804 O LEU H 6 43.155 10.039 2.681 1.00 1.00 O ATOM 805 CB LEU H 6 41.474 10.610 5.172 1.00 1.00 C ATOM 806 CG LEU H 6 42.370 11.743 5.698 1.00 1.00 C ATOM 807 CD1 LEU H 6 41.692 13.105 5.484 1.00 1.00 C ATOM 808 CD2 LEU H 6 42.615 11.525 7.196 1.00 1.00 C ATOM 0 H LEU H 6 40.836 8.794 3.252 1.00 1.00 H new ATOM 0 HA LEU H 6 40.531 11.738 3.589 1.00 1.00 H new ATOM 0 HB2 LEU H 6 40.558 10.561 5.762 1.00 1.00 H new ATOM 0 HB3 LEU H 6 41.982 9.653 5.292 1.00 1.00 H new ATOM 0 HG LEU H 6 43.316 11.735 5.156 1.00 1.00 H new ATOM 0 HD11 LEU H 6 42.339 13.897 5.862 1.00 1.00 H new ATOM 0 HD12 LEU H 6 41.513 13.259 4.420 1.00 1.00 H new ATOM 0 HD13 LEU H 6 40.742 13.127 6.018 1.00 1.00 H new ATOM 0 HD21 LEU H 6 43.250 12.323 7.581 1.00 1.00 H new ATOM 0 HD22 LEU H 6 41.662 11.532 7.725 1.00 1.00 H new ATOM 0 HD23 LEU H 6 43.107 10.564 7.348 1.00 1.00 H new ATOM 820 N SER H 7 42.654 12.216 2.413 1.00 1.00 N ATOM 821 CA SER H 7 43.850 12.494 1.624 1.00 1.00 C ATOM 822 C SER H 7 44.158 13.988 1.629 1.00 1.00 C ATOM 823 O SER H 7 43.606 14.684 2.466 1.00 1.00 O ATOM 824 CB SER H 7 43.650 12.018 0.186 1.00 1.00 C ATOM 825 OG SER H 7 42.726 12.878 -0.469 1.00 1.00 O ATOM 826 OXT SER H 7 44.938 14.414 0.795 1.00 1.00 O ATOM 0 H SER H 7 42.048 13.022 2.565 1.00 1.00 H new ATOM 0 HA SER H 7 44.689 11.959 2.069 1.00 1.00 H new ATOM 0 HB2 SER H 7 44.602 12.016 -0.345 1.00 1.00 H new ATOM 0 HB3 SER H 7 43.279 10.993 0.178 1.00 1.00 H new ATOM 0 HG SER H 7 42.597 12.577 -1.392 1.00 1.00 H new TER 832 SER H 7