USER MOD reduce.3.24.130724 H: found=0, std=0, add=1489, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 1490 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: B 159 ASN : amide:sc= 0.622 K(o=5.2,f=-2.9) USER MOD Set 1.2: B 162 LYS NZ :NH3+ 177:sc= 2.35 (180deg=0.568) USER MOD Set 1.3: B 198 SER OG : rot -103:sc= 2.27 USER MOD Set 2.1: B 142 GLN :FLIP amide:sc= -1.82 F(o=-7!,f=-1.3) USER MOD Set 2.2: B 145 GLN : amide:sc= -0.856 K(o=-1.3,f=-6.7!) USER MOD Set 2.3: B 182 ASN : amide:sc= 1.38 K(o=-1.3,f=-11!) USER MOD Set 3.1: B 121 GLN : amide:sc= -0.167 K(o=-1.1,f=-5.7!) USER MOD Set 3.2: B 161 GLN : amide:sc= -0.888 K(o=-1.1,f=-8.4!) USER MOD Set 4.1: A 110 SER OG : rot -155:sc= 1.4 USER MOD Set 4.2: B 153 ASN : amide:sc= 0.0161 K(o=1.4,f=-0.27!) USER MOD Set 5.1: A 26 SER OG : rot 180:sc= 0.096 USER MOD Set 5.2: A 103 GLN :FLIP amide:sc= -3.08! C(o=-5!,f=-3!) USER MOD Set 6.1: A 61 GLN :FLIP amide:sc= -0.546 F(o=-9.5!,f=-7.8) USER MOD Set 6.2: A 98 ASN : amide:sc= -7.36! C(o=-7.8!,f=-14!) USER MOD Set 6.3: A 100 GLN : amide:sc= 0.124 K(o=-7.8,f=-15!) USER MOD Set 7.1: A 33 ASN : amide:sc= 1.15 K(o=2.3,f=-0.89) USER MOD Set 7.2: A 72 SER OG : rot 90:sc= 1.12 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 GLN : amide:sc=-0.00287 K(o=-0.0029,f=-0.63) USER MOD Single : A 6 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 7 THR OG1 : rot 180:sc= 0 USER MOD Single : A 8 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 9 GLN : amide:sc= 0 K(o=0,f=-0.66) USER MOD Single : A 11 ASN : amide:sc= 0 X(o=0,f=-0.034) USER MOD Single : A 12 SER OG : rot -5:sc= 0.431 USER MOD Single : A 15 MET CE :methyl -114:sc= -0.125 (180deg=-0.526) USER MOD Single : A 16 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 18 GLN : amide:sc= 0 X(o=0,f=-0.46) USER MOD Single : A 20 SER OG : rot 47:sc= 0.0453 USER MOD Single : A 22 THR OG1 : rot -140:sc= 0 USER MOD Single : A 24 LYS NZ :NH3+ 172:sc= 1.25 (180deg=1.07) USER MOD Single : A 27 GLN : amide:sc= -1.87! C(o=-1.9!,f=-3.6!) USER MOD Single : A 30 SER OG : rot 180:sc= 0 USER MOD Single : A 35 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 37 GLN : amide:sc= -1.17 K(o=-1.2,f=-8.4!) USER MOD Single : A 50 GLN : amide:sc= 0 K(o=0,f=-2.3!) USER MOD Single : A 53 SER OG : rot -170:sc= -0.0342 USER MOD Single : A 54 SER OG : rot 108:sc= 1.24 USER MOD Single : A 56 ASN : amide:sc= -0.332 K(o=-0.33,f=-1.9!) USER MOD Single : A 58 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 68 SER OG : rot 76:sc= 0.976 USER MOD Single : A 69 ASN : amide:sc= 1.02 K(o=1,f=-9.1!) USER MOD Single : A 75 ASN :FLIP amide:sc= -0.18 F(o=-0.68,f=-0.18) USER MOD Single : A 77 GLN : amide:sc= -9.46! C(o=-9.5!,f=-11!) USER MOD Single : A 79 GLN : amide:sc= -0.498 X(o=-0.5,f=0) USER MOD Single : A 92 GLN : amide:sc= 0 K(o=0,f=-0.5) USER MOD Single : A 95 SER OG : rot 90:sc= 0.205 USER MOD Single : A 96 SER OG : rot 85:sc= 1.14 USER MOD Single : A 111 ASN : amide:sc= -2.18 K(o=-2.2,f=-3.3!) USER MOD Single : A 114 SER OG : rot 69:sc= 0.603 USER MOD Single : B 117 ASN : amide:sc=-0.00114 K(o=-0.0011,f=-0.5) USER MOD Single : B 119 GLN : amide:sc= -3.87! C(o=-3.9!,f=-7.8!) USER MOD Single : B 134 GLN : amide:sc= -0.105 X(o=-0.1,f=-0.39) USER MOD Single : B 137 SER OG : rot 180:sc= -0.332 USER MOD Single : B 138 SER OG : rot -70:sc= 0.169 USER MOD Single : B 140 ASN :FLIP amide:sc= -0.404 F(o=-0.94,f=-0.4) USER MOD Single : B 152 SER OG : rot -13:sc= 0.0458 USER MOD Single : B 156 SER OG : rot -43:sc= 1.24 USER MOD Single : B 163 GLN : amide:sc= -0.167 X(o=-0.17,f=-0.66) USER MOD Single : B 166 LYS NZ :NH3+ 162:sc= -0.0333 (180deg=-0.341) USER MOD Single : B 173 LYS NZ :NH3+ -154:sc= 0.169 (180deg=-1.14!) USER MOD Single : B 176 GLN :FLIP amide:sc= -0.933 F(o=-2.1!,f=-0.93) USER MOD Single : B 178 GLN :FLIP amide:sc= -1.72! C(o=-4.3!,f=-1.7!) USER MOD Single : B 179 SER OG : rot 180:sc= 0 USER MOD Single : B 180 HIS : no HD1:sc= -0.333 K(o=-0.33,f=-1) USER MOD Single : B 184 LYS NZ :NH3+ 168:sc= -0.0341 (180deg=-0.222) USER MOD Single : B 186 GLN : amide:sc= 0.0165 X(o=0.017,f=0) USER MOD Single : B 187 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 190 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 195 LYS NZ :NH3+ 170:sc= 1.18 (180deg=0.849) USER MOD Single : B 197 GLN : amide:sc= -0.168 X(o=-0.17,f=-0.43) USER MOD Single : B 199 HIS : no HE2:sc= 1.2 K(o=1.2,f=-4!) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -40.521 -59.621 -29.700 1.00 53.44 N ATOM 2 CA GLY A 1 -40.641 -59.446 -31.149 1.00 70.12 C ATOM 3 C GLY A 1 -39.770 -58.326 -31.670 1.00 72.13 C ATOM 4 O GLY A 1 -40.180 -57.169 -31.655 1.00 34.23 O ATOM 0 H1 GLY A 1 -41.137 -60.400 -29.392 1.00 53.44 H new ATOM 0 H2 GLY A 1 -39.534 -59.843 -29.458 1.00 53.44 H new ATOM 0 H3 GLY A 1 -40.806 -58.744 -29.220 1.00 53.44 H new ATOM 0 HA2 GLY A 1 -40.369 -60.376 -31.648 1.00 70.12 H new ATOM 0 HA3 GLY A 1 -41.681 -59.241 -31.402 1.00 70.12 H new ATOM 10 N GLU A 2 -38.567 -58.686 -32.117 1.00 1.31 N ATOM 11 CA GLU A 2 -37.582 -57.779 -32.718 1.00 73.30 C ATOM 12 C GLU A 2 -37.159 -56.615 -31.825 1.00 13.02 C ATOM 13 O GLU A 2 -37.839 -55.580 -31.729 1.00 0.22 O ATOM 14 CB GLU A 2 -38.013 -57.300 -34.098 1.00 24.12 C ATOM 15 CG GLU A 2 -38.154 -58.430 -35.091 1.00 45.42 C ATOM 16 CD GLU A 2 -38.501 -57.953 -36.459 1.00 11.20 C ATOM 17 OE1 GLU A 2 -37.580 -57.680 -37.259 1.00 4.32 O1- ATOM 18 OE2 GLU A 2 -39.705 -57.854 -36.774 1.00 41.54 O ATOM 0 H GLU A 2 -38.237 -59.650 -32.070 1.00 1.31 H new ATOM 0 HA GLU A 2 -36.685 -58.387 -32.835 1.00 73.30 H new ATOM 0 HB2 GLU A 2 -38.964 -56.774 -34.015 1.00 24.12 H new ATOM 0 HB3 GLU A 2 -37.284 -56.582 -34.473 1.00 24.12 H new ATOM 0 HG2 GLU A 2 -37.220 -58.991 -35.132 1.00 45.42 H new ATOM 0 HG3 GLU A 2 -38.924 -59.119 -34.744 1.00 45.42 H new ATOM 25 N LEU A 3 -36.039 -56.785 -31.173 1.00 23.23 N ATOM 26 CA LEU A 3 -35.494 -55.758 -30.323 1.00 60.33 C ATOM 27 C LEU A 3 -34.129 -55.334 -30.837 1.00 5.32 C ATOM 28 O LEU A 3 -33.122 -55.972 -30.517 1.00 11.14 O ATOM 29 CB LEU A 3 -35.371 -56.198 -28.838 1.00 33.23 C ATOM 30 CG LEU A 3 -36.667 -56.431 -28.024 1.00 32.45 C ATOM 31 CD1 LEU A 3 -37.437 -57.652 -28.490 1.00 55.01 C ATOM 32 CD2 LEU A 3 -36.336 -56.553 -26.552 1.00 11.53 C ATOM 0 H LEU A 3 -35.480 -57.637 -31.216 1.00 23.23 H new ATOM 0 HA LEU A 3 -36.193 -54.922 -30.355 1.00 60.33 H new ATOM 0 HB2 LEU A 3 -34.794 -57.123 -28.813 1.00 33.23 H new ATOM 0 HB3 LEU A 3 -34.784 -55.442 -28.316 1.00 33.23 H new ATOM 0 HG LEU A 3 -37.311 -55.567 -28.188 1.00 32.45 H new ATOM 0 HD11 LEU A 3 -38.336 -57.768 -27.885 1.00 55.01 H new ATOM 0 HD12 LEU A 3 -37.717 -57.528 -29.536 1.00 55.01 H new ATOM 0 HD13 LEU A 3 -36.812 -58.539 -28.384 1.00 55.01 H new ATOM 0 HD21 LEU A 3 -37.253 -56.717 -25.985 1.00 11.53 H new ATOM 0 HD22 LEU A 3 -35.660 -57.394 -26.400 1.00 11.53 H new ATOM 0 HD23 LEU A 3 -35.857 -55.636 -26.210 1.00 11.53 H new ATOM 44 N PRO A 4 -34.067 -54.324 -31.710 1.00 74.40 N ATOM 45 CA PRO A 4 -32.811 -53.782 -32.179 1.00 63.51 C ATOM 46 C PRO A 4 -32.280 -52.791 -31.165 1.00 55.34 C ATOM 47 O PRO A 4 -32.814 -51.678 -31.021 1.00 21.11 O ATOM 48 CB PRO A 4 -33.170 -53.070 -33.495 1.00 42.54 C ATOM 49 CG PRO A 4 -34.644 -53.283 -33.684 1.00 52.12 C ATOM 50 CD PRO A 4 -35.196 -53.635 -32.334 1.00 14.33 C ATOM 0 HA PRO A 4 -32.042 -54.542 -32.321 1.00 63.51 H new ATOM 0 HB2 PRO A 4 -32.932 -52.008 -33.443 1.00 42.54 H new ATOM 0 HB3 PRO A 4 -32.605 -53.483 -34.330 1.00 42.54 H new ATOM 0 HG2 PRO A 4 -35.120 -52.384 -34.076 1.00 52.12 H new ATOM 0 HG3 PRO A 4 -34.832 -54.082 -34.401 1.00 52.12 H new ATOM 0 HD2 PRO A 4 -35.494 -52.750 -31.772 1.00 14.33 H new ATOM 0 HD3 PRO A 4 -36.074 -54.276 -32.408 1.00 14.33 H new ATOM 58 N GLN A 5 -31.293 -53.203 -30.425 1.00 14.12 N ATOM 59 CA GLN A 5 -30.761 -52.378 -29.385 1.00 31.54 C ATOM 60 C GLN A 5 -29.277 -52.127 -29.582 1.00 64.32 C ATOM 61 O GLN A 5 -28.479 -53.061 -29.769 1.00 62.23 O ATOM 62 CB GLN A 5 -31.100 -52.958 -28.001 1.00 4.42 C ATOM 63 CG GLN A 5 -30.633 -54.388 -27.776 1.00 21.43 C ATOM 64 CD GLN A 5 -31.113 -54.956 -26.454 1.00 0.44 C ATOM 65 OE1 GLN A 5 -32.197 -54.615 -25.955 1.00 41.05 O ATOM 66 NE2 GLN A 5 -30.315 -55.796 -25.858 1.00 45.24 N ATOM 0 H GLN A 5 -30.839 -54.111 -30.525 1.00 14.12 H new ATOM 0 HA GLN A 5 -31.239 -51.400 -29.438 1.00 31.54 H new ATOM 0 HB2 GLN A 5 -30.655 -52.321 -27.237 1.00 4.42 H new ATOM 0 HB3 GLN A 5 -32.180 -52.917 -27.860 1.00 4.42 H new ATOM 0 HG2 GLN A 5 -30.994 -55.017 -28.590 1.00 21.43 H new ATOM 0 HG3 GLN A 5 -29.544 -54.420 -27.807 1.00 21.43 H new ATOM 0 HE21 GLN A 5 -29.431 -56.056 -26.294 1.00 45.24 H new ATOM 0 HE22 GLN A 5 -30.575 -56.193 -24.955 1.00 45.24 H new ATOM 75 N MET A 6 -28.933 -50.865 -29.618 1.00 73.24 N ATOM 76 CA MET A 6 -27.580 -50.401 -29.802 1.00 14.34 C ATOM 77 C MET A 6 -27.476 -49.011 -29.206 1.00 70.50 C ATOM 78 O MET A 6 -28.406 -48.199 -29.356 1.00 25.04 O ATOM 79 CB MET A 6 -27.173 -50.386 -31.309 1.00 13.52 C ATOM 80 CG MET A 6 -28.011 -49.469 -32.228 1.00 62.33 C ATOM 81 SD MET A 6 -29.728 -50.019 -32.449 1.00 11.21 S ATOM 82 CE MET A 6 -30.381 -48.709 -33.484 1.00 21.53 C ATOM 0 H MET A 6 -29.608 -50.107 -29.517 1.00 73.24 H new ATOM 0 HA MET A 6 -26.893 -51.083 -29.301 1.00 14.34 H new ATOM 0 HB2 MET A 6 -26.129 -50.082 -31.380 1.00 13.52 H new ATOM 0 HB3 MET A 6 -27.235 -51.405 -31.692 1.00 13.52 H new ATOM 0 HG2 MET A 6 -28.013 -48.461 -31.814 1.00 62.33 H new ATOM 0 HG3 MET A 6 -27.530 -49.412 -33.204 1.00 62.33 H new ATOM 0 HE1 MET A 6 -31.430 -48.908 -33.705 1.00 21.53 H new ATOM 0 HE2 MET A 6 -30.295 -47.756 -32.962 1.00 21.53 H new ATOM 0 HE3 MET A 6 -29.816 -48.665 -34.415 1.00 21.53 H new ATOM 92 N THR A 7 -26.398 -48.743 -28.508 1.00 21.12 N ATOM 93 CA THR A 7 -26.201 -47.474 -27.861 1.00 65.42 C ATOM 94 C THR A 7 -24.719 -47.269 -27.521 1.00 35.35 C ATOM 95 O THR A 7 -24.066 -48.156 -26.961 1.00 43.14 O ATOM 96 CB THR A 7 -27.107 -47.336 -26.577 1.00 63.15 C ATOM 97 OG1 THR A 7 -26.844 -46.100 -25.882 1.00 62.01 O ATOM 98 CG2 THR A 7 -26.930 -48.513 -25.620 1.00 34.41 C ATOM 0 H THR A 7 -25.632 -49.403 -28.374 1.00 21.12 H new ATOM 0 HA THR A 7 -26.503 -46.690 -28.555 1.00 65.42 H new ATOM 0 HB THR A 7 -28.140 -47.335 -26.926 1.00 63.15 H new ATOM 0 HG1 THR A 7 -27.420 -46.040 -25.092 1.00 62.01 H new ATOM 0 HG21 THR A 7 -27.573 -48.375 -24.751 1.00 34.41 H new ATOM 0 HG22 THR A 7 -27.200 -49.439 -26.128 1.00 34.41 H new ATOM 0 HG23 THR A 7 -25.890 -48.566 -25.297 1.00 34.41 H new ATOM 106 N GLN A 8 -24.192 -46.123 -27.901 1.00 71.31 N ATOM 107 CA GLN A 8 -22.815 -45.758 -27.628 1.00 63.32 C ATOM 108 C GLN A 8 -22.723 -44.285 -27.303 1.00 5.21 C ATOM 109 O GLN A 8 -22.869 -43.436 -28.189 1.00 20.34 O ATOM 110 CB GLN A 8 -21.886 -46.084 -28.809 1.00 51.23 C ATOM 111 CG GLN A 8 -21.662 -47.565 -29.049 1.00 53.11 C ATOM 112 CD GLN A 8 -20.714 -47.827 -30.192 1.00 55.31 C ATOM 113 OE1 GLN A 8 -19.496 -47.908 -30.002 1.00 44.13 O ATOM 114 NE2 GLN A 8 -21.247 -47.970 -31.372 1.00 1.33 N ATOM 0 H GLN A 8 -24.712 -45.411 -28.413 1.00 71.31 H new ATOM 0 HA GLN A 8 -22.487 -46.348 -26.772 1.00 63.32 H new ATOM 0 HB2 GLN A 8 -22.303 -45.642 -29.714 1.00 51.23 H new ATOM 0 HB3 GLN A 8 -20.921 -45.608 -28.637 1.00 51.23 H new ATOM 0 HG2 GLN A 8 -21.267 -48.021 -28.141 1.00 53.11 H new ATOM 0 HG3 GLN A 8 -22.618 -48.045 -29.257 1.00 53.11 H new ATOM 0 HE21 GLN A 8 -22.258 -47.896 -31.487 1.00 1.33 H new ATOM 0 HE22 GLN A 8 -20.654 -48.156 -32.180 1.00 1.33 H new ATOM 123 N GLN A 9 -22.529 -43.986 -26.044 1.00 41.03 N ATOM 124 CA GLN A 9 -22.374 -42.626 -25.582 1.00 41.41 C ATOM 125 C GLN A 9 -21.667 -42.634 -24.235 1.00 23.44 C ATOM 126 O GLN A 9 -22.300 -42.740 -23.176 1.00 72.23 O ATOM 127 CB GLN A 9 -23.727 -41.894 -25.499 1.00 60.55 C ATOM 128 CG GLN A 9 -23.631 -40.440 -25.048 1.00 3.24 C ATOM 129 CD GLN A 9 -24.982 -39.754 -25.005 1.00 25.04 C ATOM 130 OE1 GLN A 9 -26.016 -40.396 -24.782 1.00 74.00 O ATOM 131 NE2 GLN A 9 -24.997 -38.467 -25.212 1.00 44.55 N ATOM 0 H GLN A 9 -22.473 -44.684 -25.302 1.00 41.03 H new ATOM 0 HA GLN A 9 -21.768 -42.077 -26.303 1.00 41.41 H new ATOM 0 HB2 GLN A 9 -24.205 -41.927 -26.478 1.00 60.55 H new ATOM 0 HB3 GLN A 9 -24.376 -42.433 -24.809 1.00 60.55 H new ATOM 0 HG2 GLN A 9 -23.175 -40.399 -24.059 1.00 3.24 H new ATOM 0 HG3 GLN A 9 -22.972 -39.896 -25.725 1.00 3.24 H new ATOM 0 HE21 GLN A 9 -24.125 -37.969 -25.393 1.00 44.55 H new ATOM 0 HE22 GLN A 9 -25.881 -37.958 -25.193 1.00 44.55 H new ATOM 140 N LEU A 10 -20.373 -42.619 -24.286 1.00 23.01 N ATOM 141 CA LEU A 10 -19.544 -42.613 -23.107 1.00 51.34 C ATOM 142 C LEU A 10 -18.348 -41.734 -23.379 1.00 41.53 C ATOM 143 O LEU A 10 -17.807 -41.751 -24.490 1.00 50.41 O ATOM 144 CB LEU A 10 -19.058 -44.036 -22.794 1.00 74.02 C ATOM 145 CG LEU A 10 -18.213 -44.198 -21.524 1.00 4.24 C ATOM 146 CD1 LEU A 10 -19.057 -44.001 -20.275 1.00 34.42 C ATOM 147 CD2 LEU A 10 -17.516 -45.544 -21.508 1.00 23.03 C ATOM 0 H LEU A 10 -19.847 -42.610 -25.160 1.00 23.01 H new ATOM 0 HA LEU A 10 -20.115 -42.240 -22.257 1.00 51.34 H new ATOM 0 HB2 LEU A 10 -19.930 -44.685 -22.711 1.00 74.02 H new ATOM 0 HB3 LEU A 10 -18.474 -44.393 -23.642 1.00 74.02 H new ATOM 0 HG LEU A 10 -17.446 -43.423 -21.529 1.00 4.24 H new ATOM 0 HD11 LEU A 10 -18.432 -44.122 -19.390 1.00 34.42 H new ATOM 0 HD12 LEU A 10 -19.488 -43.000 -20.281 1.00 34.42 H new ATOM 0 HD13 LEU A 10 -19.858 -44.740 -20.257 1.00 34.42 H new ATOM 0 HD21 LEU A 10 -16.923 -45.636 -20.598 1.00 23.03 H new ATOM 0 HD22 LEU A 10 -18.260 -46.340 -21.538 1.00 23.03 H new ATOM 0 HD23 LEU A 10 -16.863 -45.626 -22.377 1.00 23.03 H new ATOM 159 N ASN A 11 -17.945 -40.965 -22.409 1.00 75.11 N ATOM 160 CA ASN A 11 -16.779 -40.120 -22.561 1.00 51.05 C ATOM 161 C ASN A 11 -15.837 -40.352 -21.406 1.00 51.55 C ATOM 162 O ASN A 11 -16.263 -40.760 -20.316 1.00 63.25 O ATOM 163 CB ASN A 11 -17.149 -38.621 -22.656 1.00 22.43 C ATOM 164 CG ASN A 11 -17.798 -38.059 -21.394 1.00 12.34 C ATOM 165 OD1 ASN A 11 -17.113 -37.604 -20.474 1.00 10.11 O ATOM 166 ND2 ASN A 11 -19.099 -38.051 -21.352 1.00 73.33 N ATOM 0 H ASN A 11 -18.403 -40.900 -21.500 1.00 75.11 H new ATOM 0 HA ASN A 11 -16.292 -40.388 -23.499 1.00 51.05 H new ATOM 0 HB2 ASN A 11 -16.248 -38.048 -22.874 1.00 22.43 H new ATOM 0 HB3 ASN A 11 -17.829 -38.478 -23.496 1.00 22.43 H new ATOM 0 HD21 ASN A 11 -19.581 -37.661 -20.542 1.00 73.33 H new ATOM 0 HD22 ASN A 11 -19.637 -38.435 -22.129 1.00 73.33 H new ATOM 173 N SER A 12 -14.568 -40.158 -21.639 1.00 52.52 N ATOM 174 CA SER A 12 -13.568 -40.295 -20.614 1.00 54.03 C ATOM 175 C SER A 12 -12.391 -39.358 -20.896 1.00 43.22 C ATOM 176 O SER A 12 -11.470 -39.689 -21.662 1.00 64.10 O ATOM 177 CB SER A 12 -13.101 -41.753 -20.472 1.00 64.52 C ATOM 178 OG SER A 12 -14.206 -42.620 -20.167 1.00 3.11 O ATOM 0 H SER A 12 -14.195 -39.898 -22.552 1.00 52.52 H new ATOM 0 HA SER A 12 -14.015 -40.010 -19.662 1.00 54.03 H new ATOM 0 HB2 SER A 12 -12.624 -42.078 -21.397 1.00 64.52 H new ATOM 0 HB3 SER A 12 -12.351 -41.823 -19.684 1.00 64.52 H new ATOM 0 HG SER A 12 -15.016 -42.084 -20.035 1.00 3.11 H new ATOM 184 N ASP A 13 -12.485 -38.176 -20.350 1.00 5.10 N ATOM 185 CA ASP A 13 -11.461 -37.152 -20.448 1.00 75.22 C ATOM 186 C ASP A 13 -11.526 -36.293 -19.224 1.00 61.13 C ATOM 187 O ASP A 13 -12.423 -35.450 -19.086 1.00 31.22 O ATOM 188 CB ASP A 13 -11.600 -36.265 -21.705 1.00 15.15 C ATOM 189 CG ASP A 13 -10.579 -35.117 -21.725 1.00 62.04 C ATOM 190 OD1 ASP A 13 -9.382 -35.366 -21.972 1.00 1.43 O1- ATOM 191 OD2 ASP A 13 -10.955 -33.947 -21.462 1.00 53.44 O ATOM 0 H ASP A 13 -13.297 -37.883 -19.807 1.00 5.10 H new ATOM 0 HA ASP A 13 -10.500 -37.659 -20.530 1.00 75.22 H new ATOM 0 HB2 ASP A 13 -11.470 -36.879 -22.596 1.00 15.15 H new ATOM 0 HB3 ASP A 13 -12.608 -35.852 -21.746 1.00 15.15 H new ATOM 196 N ASP A 14 -10.658 -36.551 -18.312 1.00 2.14 N ATOM 197 CA ASP A 14 -10.577 -35.779 -17.104 1.00 63.53 C ATOM 198 C ASP A 14 -9.143 -35.547 -16.762 1.00 1.21 C ATOM 199 O ASP A 14 -8.438 -36.463 -16.361 1.00 73.55 O ATOM 200 CB ASP A 14 -11.294 -36.464 -15.937 1.00 63.43 C ATOM 201 CG ASP A 14 -11.179 -35.663 -14.657 1.00 74.52 C ATOM 202 OD1 ASP A 14 -11.744 -34.551 -14.595 1.00 42.51 O ATOM 203 OD2 ASP A 14 -10.544 -36.141 -13.685 1.00 1.02 O1- ATOM 0 H ASP A 14 -9.976 -37.306 -18.374 1.00 2.14 H new ATOM 0 HA ASP A 14 -11.078 -34.826 -17.276 1.00 63.53 H new ATOM 0 HB2 ASP A 14 -12.346 -36.601 -16.187 1.00 63.43 H new ATOM 0 HB3 ASP A 14 -10.871 -37.457 -15.783 1.00 63.43 H new ATOM 208 N MET A 15 -8.685 -34.363 -16.995 1.00 24.32 N ATOM 209 CA MET A 15 -7.341 -34.009 -16.658 1.00 45.10 C ATOM 210 C MET A 15 -7.380 -32.999 -15.547 1.00 23.03 C ATOM 211 O MET A 15 -8.065 -31.973 -15.651 1.00 41.32 O ATOM 212 CB MET A 15 -6.581 -33.449 -17.871 1.00 55.43 C ATOM 213 CG MET A 15 -6.524 -34.407 -19.052 1.00 54.14 C ATOM 214 SD MET A 15 -5.551 -33.786 -20.449 1.00 34.24 S ATOM 215 CE MET A 15 -3.899 -33.765 -19.742 1.00 12.51 C ATOM 0 H MET A 15 -9.227 -33.613 -17.423 1.00 24.32 H new ATOM 0 HA MET A 15 -6.807 -34.903 -16.335 1.00 45.10 H new ATOM 0 HB2 MET A 15 -7.056 -32.521 -18.190 1.00 55.43 H new ATOM 0 HB3 MET A 15 -5.564 -33.199 -17.568 1.00 55.43 H new ATOM 0 HG2 MET A 15 -6.101 -35.355 -18.719 1.00 54.14 H new ATOM 0 HG3 MET A 15 -7.539 -34.612 -19.391 1.00 54.14 H new ATOM 0 HE1 MET A 15 -3.550 -32.735 -19.664 1.00 12.51 H new ATOM 0 HE2 MET A 15 -3.922 -34.216 -18.750 1.00 12.51 H new ATOM 0 HE3 MET A 15 -3.222 -34.331 -20.382 1.00 12.51 H new ATOM 225 N GLN A 16 -6.722 -33.297 -14.477 1.00 3.53 N ATOM 226 CA GLN A 16 -6.663 -32.398 -13.360 1.00 34.12 C ATOM 227 C GLN A 16 -5.293 -31.766 -13.315 1.00 41.25 C ATOM 228 O GLN A 16 -4.280 -32.456 -13.180 1.00 50.54 O ATOM 229 CB GLN A 16 -7.025 -33.104 -12.041 1.00 24.20 C ATOM 230 CG GLN A 16 -6.185 -34.325 -11.728 1.00 42.31 C ATOM 231 CD GLN A 16 -6.611 -35.013 -10.470 1.00 21.04 C ATOM 232 OE1 GLN A 16 -7.463 -35.894 -10.499 1.00 61.43 O ATOM 233 NE2 GLN A 16 -6.029 -34.645 -9.365 1.00 43.42 N ATOM 0 H GLN A 16 -6.208 -34.168 -14.346 1.00 3.53 H new ATOM 0 HA GLN A 16 -7.407 -31.612 -13.488 1.00 34.12 H new ATOM 0 HB2 GLN A 16 -6.925 -32.391 -11.223 1.00 24.20 H new ATOM 0 HB3 GLN A 16 -8.073 -33.400 -12.079 1.00 24.20 H new ATOM 0 HG2 GLN A 16 -6.248 -35.027 -12.560 1.00 42.31 H new ATOM 0 HG3 GLN A 16 -5.140 -34.029 -11.639 1.00 42.31 H new ATOM 0 HE21 GLN A 16 -5.324 -33.908 -9.381 1.00 43.42 H new ATOM 0 HE22 GLN A 16 -6.278 -35.094 -8.484 1.00 43.42 H new ATOM 242 N GLU A 17 -5.256 -30.476 -13.484 1.00 72.01 N ATOM 243 CA GLU A 17 -4.016 -29.758 -13.526 1.00 13.34 C ATOM 244 C GLU A 17 -4.220 -28.281 -13.261 1.00 45.15 C ATOM 245 O GLU A 17 -4.612 -27.504 -14.153 1.00 70.43 O ATOM 246 CB GLU A 17 -3.272 -29.994 -14.848 1.00 51.44 C ATOM 247 CG GLU A 17 -4.118 -29.795 -16.083 1.00 75.40 C ATOM 248 CD GLU A 17 -3.321 -29.872 -17.328 1.00 23.41 C ATOM 249 OE1 GLU A 17 -2.757 -28.836 -17.743 1.00 33.15 O1- ATOM 250 OE2 GLU A 17 -3.241 -30.959 -17.930 1.00 13.20 O ATOM 0 H GLU A 17 -6.085 -29.892 -13.597 1.00 72.01 H new ATOM 0 HA GLU A 17 -3.388 -30.149 -12.725 1.00 13.34 H new ATOM 0 HB2 GLU A 17 -2.417 -29.320 -14.895 1.00 51.44 H new ATOM 0 HB3 GLU A 17 -2.877 -31.010 -14.852 1.00 51.44 H new ATOM 0 HG2 GLU A 17 -4.903 -30.551 -16.109 1.00 75.40 H new ATOM 0 HG3 GLU A 17 -4.612 -28.825 -16.030 1.00 75.40 H new ATOM 257 N GLN A 18 -4.020 -27.923 -12.037 1.00 24.24 N ATOM 258 CA GLN A 18 -4.078 -26.568 -11.589 1.00 61.43 C ATOM 259 C GLN A 18 -3.056 -26.425 -10.492 1.00 2.24 C ATOM 260 O GLN A 18 -3.274 -26.877 -9.366 1.00 54.40 O ATOM 261 CB GLN A 18 -5.476 -26.203 -11.067 1.00 2.13 C ATOM 262 CG GLN A 18 -5.582 -24.763 -10.588 1.00 23.14 C ATOM 263 CD GLN A 18 -6.945 -24.404 -10.044 1.00 13.23 C ATOM 264 OE1 GLN A 18 -7.963 -24.942 -10.467 1.00 24.44 O ATOM 265 NE2 GLN A 18 -6.980 -23.479 -9.122 1.00 23.35 N ATOM 0 H GLN A 18 -3.804 -28.587 -11.294 1.00 24.24 H new ATOM 0 HA GLN A 18 -3.868 -25.891 -12.418 1.00 61.43 H new ATOM 0 HB2 GLN A 18 -6.207 -26.370 -11.858 1.00 2.13 H new ATOM 0 HB3 GLN A 18 -5.736 -26.872 -10.246 1.00 2.13 H new ATOM 0 HG2 GLN A 18 -4.834 -24.591 -9.814 1.00 23.14 H new ATOM 0 HG3 GLN A 18 -5.343 -24.095 -11.416 1.00 23.14 H new ATOM 0 HE21 GLN A 18 -6.113 -23.053 -8.794 1.00 23.35 H new ATOM 0 HE22 GLN A 18 -7.874 -23.183 -8.730 1.00 23.35 H new ATOM 274 N LEU A 19 -1.930 -25.874 -10.824 1.00 3.10 N ATOM 275 CA LEU A 19 -0.863 -25.726 -9.871 1.00 31.34 C ATOM 276 C LEU A 19 -0.441 -24.282 -9.820 1.00 64.14 C ATOM 277 O LEU A 19 -0.269 -23.642 -10.871 1.00 4.21 O ATOM 278 CB LEU A 19 0.351 -26.602 -10.254 1.00 25.51 C ATOM 279 CG LEU A 19 0.137 -28.121 -10.359 1.00 41.23 C ATOM 280 CD1 LEU A 19 1.428 -28.803 -10.778 1.00 60.34 C ATOM 281 CD2 LEU A 19 -0.347 -28.700 -9.043 1.00 21.33 C ATOM 0 H LEU A 19 -1.721 -25.515 -11.755 1.00 3.10 H new ATOM 0 HA LEU A 19 -1.224 -26.049 -8.894 1.00 31.34 H new ATOM 0 HB2 LEU A 19 0.728 -26.250 -11.214 1.00 25.51 H new ATOM 0 HB3 LEU A 19 1.136 -26.425 -9.519 1.00 25.51 H new ATOM 0 HG LEU A 19 -0.629 -28.301 -11.113 1.00 41.23 H new ATOM 0 HD11 LEU A 19 1.265 -29.878 -10.849 1.00 60.34 H new ATOM 0 HD12 LEU A 19 1.744 -28.419 -11.748 1.00 60.34 H new ATOM 0 HD13 LEU A 19 2.203 -28.602 -10.038 1.00 60.34 H new ATOM 0 HD21 LEU A 19 -0.489 -29.775 -9.149 1.00 21.33 H new ATOM 0 HD22 LEU A 19 0.393 -28.507 -8.266 1.00 21.33 H new ATOM 0 HD23 LEU A 19 -1.293 -28.235 -8.767 1.00 21.33 H new ATOM 293 N SER A 20 -0.316 -23.760 -8.635 1.00 10.13 N ATOM 294 CA SER A 20 0.168 -22.426 -8.453 1.00 42.43 C ATOM 295 C SER A 20 1.200 -22.399 -7.335 1.00 64.34 C ATOM 296 O SER A 20 0.875 -22.166 -6.163 1.00 21.44 O ATOM 297 CB SER A 20 -0.984 -21.415 -8.246 1.00 13.25 C ATOM 298 OG SER A 20 -1.898 -21.838 -7.227 1.00 15.21 O ATOM 0 H SER A 20 -0.547 -24.248 -7.769 1.00 10.13 H new ATOM 0 HA SER A 20 0.667 -22.104 -9.367 1.00 42.43 H new ATOM 0 HB2 SER A 20 -0.569 -20.443 -7.979 1.00 13.25 H new ATOM 0 HB3 SER A 20 -1.523 -21.284 -9.184 1.00 13.25 H new ATOM 0 HG SER A 20 -1.396 -22.130 -6.438 1.00 15.21 H new ATOM 304 N ALA A 21 2.418 -22.712 -7.701 1.00 71.51 N ATOM 305 CA ALA A 21 3.512 -22.815 -6.773 1.00 33.40 C ATOM 306 C ALA A 21 4.180 -21.472 -6.552 1.00 55.14 C ATOM 307 O ALA A 21 4.386 -20.694 -7.493 1.00 13.33 O ATOM 308 CB ALA A 21 4.524 -23.826 -7.272 1.00 32.11 C ATOM 0 H ALA A 21 2.679 -22.905 -8.668 1.00 71.51 H new ATOM 0 HA ALA A 21 3.110 -23.150 -5.817 1.00 33.40 H new ATOM 0 HB1 ALA A 21 5.348 -23.896 -6.562 1.00 32.11 H new ATOM 0 HB2 ALA A 21 4.046 -24.801 -7.371 1.00 32.11 H new ATOM 0 HB3 ALA A 21 4.907 -23.509 -8.242 1.00 32.11 H new ATOM 314 N THR A 22 4.495 -21.195 -5.320 1.00 34.34 N ATOM 315 CA THR A 22 5.153 -19.980 -4.949 1.00 63.01 C ATOM 316 C THR A 22 6.296 -20.281 -3.980 1.00 53.31 C ATOM 317 O THR A 22 6.214 -21.235 -3.197 1.00 51.21 O ATOM 318 CB THR A 22 4.148 -18.997 -4.287 1.00 33.44 C ATOM 319 OG1 THR A 22 3.409 -19.668 -3.246 1.00 63.01 O ATOM 320 CG2 THR A 22 3.179 -18.413 -5.309 1.00 5.21 C ATOM 0 H THR A 22 4.299 -21.816 -4.535 1.00 34.34 H new ATOM 0 HA THR A 22 5.556 -19.515 -5.849 1.00 63.01 H new ATOM 0 HB THR A 22 4.723 -18.177 -3.857 1.00 33.44 H new ATOM 0 HG1 THR A 22 2.473 -19.378 -3.270 1.00 63.01 H new ATOM 0 HG21 THR A 22 2.491 -17.730 -4.810 1.00 5.21 H new ATOM 0 HG22 THR A 22 3.738 -17.871 -6.072 1.00 5.21 H new ATOM 0 HG23 THR A 22 2.614 -19.219 -5.777 1.00 5.21 H new ATOM 328 N ARG A 23 7.365 -19.522 -4.064 1.00 72.53 N ATOM 329 CA ARG A 23 8.454 -19.650 -3.125 1.00 54.32 C ATOM 330 C ARG A 23 8.890 -18.277 -2.679 1.00 71.14 C ATOM 331 O ARG A 23 9.040 -17.381 -3.500 1.00 41.33 O ATOM 332 CB ARG A 23 9.644 -20.437 -3.691 1.00 65.23 C ATOM 333 CG ARG A 23 10.813 -20.482 -2.715 1.00 23.23 C ATOM 334 CD ARG A 23 11.984 -21.288 -3.212 1.00 65.11 C ATOM 335 NE ARG A 23 13.110 -21.175 -2.276 1.00 41.12 N ATOM 336 CZ ARG A 23 14.267 -21.840 -2.349 1.00 33.01 C ATOM 337 NH1 ARG A 23 14.479 -22.720 -3.320 1.00 54.52 N1+ ATOM 338 NH2 ARG A 23 15.217 -21.606 -1.447 1.00 53.43 N ATOM 0 H ARG A 23 7.503 -18.806 -4.777 1.00 72.53 H new ATOM 0 HA ARG A 23 8.089 -20.223 -2.273 1.00 54.32 H new ATOM 0 HB2 ARG A 23 9.328 -21.453 -3.926 1.00 65.23 H new ATOM 0 HB3 ARG A 23 9.969 -19.980 -4.626 1.00 65.23 H new ATOM 0 HG2 ARG A 23 11.144 -19.464 -2.511 1.00 23.23 H new ATOM 0 HG3 ARG A 23 10.470 -20.901 -1.769 1.00 23.23 H new ATOM 0 HD2 ARG A 23 11.695 -22.333 -3.321 1.00 65.11 H new ATOM 0 HD3 ARG A 23 12.285 -20.936 -4.199 1.00 65.11 H new ATOM 0 HE ARG A 23 12.998 -20.527 -1.496 1.00 41.12 H new ATOM 0 HH11 ARG A 23 13.756 -22.893 -4.018 1.00 54.52 H new ATOM 0 HH12 ARG A 23 15.365 -23.223 -3.368 1.00 54.52 H new ATOM 0 HH21 ARG A 23 15.060 -20.923 -0.706 1.00 53.43 H new ATOM 0 HH22 ARG A 23 16.102 -22.110 -1.497 1.00 53.43 H new ATOM 352 N LYS A 24 9.054 -18.120 -1.390 1.00 64.02 N ATOM 353 CA LYS A 24 9.445 -16.869 -0.786 1.00 23.33 C ATOM 354 C LYS A 24 10.907 -16.556 -1.029 1.00 54.10 C ATOM 355 O LYS A 24 11.792 -17.356 -0.719 1.00 11.14 O ATOM 356 CB LYS A 24 9.123 -16.894 0.699 1.00 63.13 C ATOM 357 CG LYS A 24 7.632 -16.879 0.975 1.00 74.50 C ATOM 358 CD LYS A 24 7.311 -17.098 2.437 1.00 11.15 C ATOM 359 CE LYS A 24 7.496 -18.546 2.840 1.00 43.14 C ATOM 360 NZ LYS A 24 7.136 -18.783 4.253 1.00 32.43 N1+ ATOM 0 H LYS A 24 8.917 -18.873 -0.716 1.00 64.02 H new ATOM 0 HA LYS A 24 8.874 -16.069 -1.257 1.00 23.33 H new ATOM 0 HB2 LYS A 24 9.562 -17.785 1.147 1.00 63.13 H new ATOM 0 HB3 LYS A 24 9.586 -16.033 1.182 1.00 63.13 H new ATOM 0 HG2 LYS A 24 7.216 -15.924 0.654 1.00 74.50 H new ATOM 0 HG3 LYS A 24 7.148 -17.653 0.380 1.00 74.50 H new ATOM 0 HD2 LYS A 24 7.953 -16.465 3.049 1.00 11.15 H new ATOM 0 HD3 LYS A 24 6.283 -16.794 2.633 1.00 11.15 H new ATOM 0 HE2 LYS A 24 6.883 -19.181 2.200 1.00 43.14 H new ATOM 0 HE3 LYS A 24 8.534 -18.837 2.678 1.00 43.14 H new ATOM 0 HZ1 LYS A 24 7.148 -19.805 4.448 1.00 32.43 H new ATOM 0 HZ2 LYS A 24 7.822 -18.305 4.871 1.00 32.43 H new ATOM 0 HZ3 LYS A 24 6.184 -18.407 4.437 1.00 32.43 H new ATOM 374 N PHE A 25 11.139 -15.410 -1.609 1.00 11.41 N ATOM 375 CA PHE A 25 12.465 -14.946 -1.919 1.00 33.12 C ATOM 376 C PHE A 25 12.586 -13.452 -1.595 1.00 31.01 C ATOM 377 O PHE A 25 13.641 -12.990 -1.145 1.00 13.54 O ATOM 378 CB PHE A 25 12.754 -15.203 -3.404 1.00 35.23 C ATOM 379 CG PHE A 25 14.140 -14.832 -3.851 1.00 31.32 C ATOM 380 CD1 PHE A 25 15.207 -15.663 -3.571 1.00 52.15 C ATOM 381 CD2 PHE A 25 14.369 -13.667 -4.564 1.00 72.00 C ATOM 382 CE1 PHE A 25 16.479 -15.342 -3.988 1.00 64.34 C ATOM 383 CE2 PHE A 25 15.639 -13.339 -4.980 1.00 34.32 C ATOM 384 CZ PHE A 25 16.696 -14.179 -4.694 1.00 4.14 C ATOM 0 H PHE A 25 10.401 -14.762 -1.884 1.00 11.41 H new ATOM 0 HA PHE A 25 13.195 -15.486 -1.316 1.00 33.12 H new ATOM 0 HB2 PHE A 25 12.591 -16.260 -3.613 1.00 35.23 H new ATOM 0 HB3 PHE A 25 12.033 -14.645 -4.002 1.00 35.23 H new ATOM 0 HD1 PHE A 25 15.041 -16.576 -3.018 1.00 52.15 H new ATOM 0 HD2 PHE A 25 13.544 -13.010 -4.796 1.00 72.00 H new ATOM 0 HE1 PHE A 25 17.305 -16.000 -3.762 1.00 64.34 H new ATOM 0 HE2 PHE A 25 15.808 -12.425 -5.530 1.00 34.32 H new ATOM 0 HZ PHE A 25 17.693 -13.925 -5.023 1.00 4.14 H new ATOM 394 N SER A 26 11.483 -12.718 -1.797 1.00 53.24 N ATOM 395 CA SER A 26 11.414 -11.267 -1.592 1.00 41.14 C ATOM 396 C SER A 26 12.382 -10.540 -2.547 1.00 71.12 C ATOM 397 O SER A 26 13.462 -10.085 -2.154 1.00 52.14 O ATOM 398 CB SER A 26 11.661 -10.891 -0.121 1.00 24.05 C ATOM 399 OG SER A 26 10.786 -11.620 0.733 1.00 2.33 O ATOM 0 H SER A 26 10.601 -13.123 -2.112 1.00 53.24 H new ATOM 0 HA SER A 26 10.403 -10.936 -1.831 1.00 41.14 H new ATOM 0 HB2 SER A 26 12.697 -11.101 0.145 1.00 24.05 H new ATOM 0 HB3 SER A 26 11.507 -9.821 0.018 1.00 24.05 H new ATOM 0 HG SER A 26 10.956 -11.371 1.665 1.00 2.33 H new ATOM 405 N GLN A 27 12.002 -10.514 -3.810 1.00 22.01 N ATOM 406 CA GLN A 27 12.818 -9.949 -4.881 1.00 21.15 C ATOM 407 C GLN A 27 13.010 -8.430 -4.831 1.00 61.24 C ATOM 408 O GLN A 27 14.145 -7.970 -4.710 1.00 44.41 O ATOM 409 CB GLN A 27 12.400 -10.445 -6.303 1.00 74.41 C ATOM 410 CG GLN A 27 10.886 -10.493 -6.622 1.00 70.02 C ATOM 411 CD GLN A 27 10.167 -11.618 -5.883 1.00 73.44 C ATOM 412 OE1 GLN A 27 10.765 -12.638 -5.562 1.00 5.11 O ATOM 413 NE2 GLN A 27 8.904 -11.474 -5.636 1.00 63.44 N ATOM 0 H GLN A 27 11.109 -10.888 -4.131 1.00 22.01 H new ATOM 0 HA GLN A 27 13.809 -10.355 -4.678 1.00 21.15 H new ATOM 0 HB2 GLN A 27 12.880 -9.800 -7.039 1.00 74.41 H new ATOM 0 HB3 GLN A 27 12.806 -11.447 -6.444 1.00 74.41 H new ATOM 0 HG2 GLN A 27 10.432 -9.539 -6.355 1.00 70.02 H new ATOM 0 HG3 GLN A 27 10.748 -10.622 -7.696 1.00 70.02 H new ATOM 0 HE21 GLN A 27 8.425 -10.617 -5.912 1.00 63.44 H new ATOM 0 HE22 GLN A 27 8.388 -12.218 -5.166 1.00 63.44 H new ATOM 422 N ILE A 28 11.909 -7.659 -4.904 1.00 4.21 N ATOM 423 CA ILE A 28 11.952 -6.161 -4.946 1.00 53.33 C ATOM 424 C ILE A 28 12.448 -5.695 -6.348 1.00 64.34 C ATOM 425 O ILE A 28 13.214 -6.400 -7.003 1.00 71.25 O ATOM 426 CB ILE A 28 12.827 -5.543 -3.780 1.00 71.30 C ATOM 427 CG1 ILE A 28 12.301 -6.024 -2.413 1.00 60.30 C ATOM 428 CG2 ILE A 28 12.834 -4.009 -3.831 1.00 34.33 C ATOM 429 CD1 ILE A 28 13.107 -5.552 -1.221 1.00 32.13 C ATOM 0 H ILE A 28 10.964 -8.041 -4.936 1.00 4.21 H new ATOM 0 HA ILE A 28 10.940 -5.789 -4.784 1.00 53.33 H new ATOM 0 HB ILE A 28 13.853 -5.886 -3.915 1.00 71.30 H new ATOM 0 HG12 ILE A 28 11.272 -5.684 -2.295 1.00 60.30 H new ATOM 0 HG13 ILE A 28 12.279 -7.114 -2.411 1.00 60.30 H new ATOM 0 HG21 ILE A 28 13.444 -3.621 -3.016 1.00 34.33 H new ATOM 0 HG22 ILE A 28 13.248 -3.679 -4.784 1.00 34.33 H new ATOM 0 HG23 ILE A 28 11.814 -3.637 -3.730 1.00 34.33 H new ATOM 0 HD11 ILE A 28 12.662 -5.939 -0.304 1.00 32.13 H new ATOM 0 HD12 ILE A 28 14.131 -5.914 -1.308 1.00 32.13 H new ATOM 0 HD13 ILE A 28 13.108 -4.462 -1.191 1.00 32.13 H new ATOM 441 N LEU A 29 12.008 -4.539 -6.816 1.00 22.13 N ATOM 442 CA LEU A 29 12.337 -4.129 -8.170 1.00 1.12 C ATOM 443 C LEU A 29 12.676 -2.660 -8.290 1.00 35.21 C ATOM 444 O LEU A 29 12.070 -1.816 -7.627 1.00 12.02 O ATOM 445 CB LEU A 29 11.174 -4.416 -9.134 1.00 43.13 C ATOM 446 CG LEU A 29 9.850 -3.662 -8.893 1.00 44.43 C ATOM 447 CD1 LEU A 29 9.030 -3.680 -10.148 1.00 43.32 C ATOM 448 CD2 LEU A 29 9.038 -4.292 -7.762 1.00 55.15 C ATOM 0 H LEU A 29 11.434 -3.880 -6.291 1.00 22.13 H new ATOM 0 HA LEU A 29 13.219 -4.713 -8.433 1.00 1.12 H new ATOM 0 HB2 LEU A 29 11.511 -4.190 -10.146 1.00 43.13 H new ATOM 0 HB3 LEU A 29 10.964 -5.485 -9.100 1.00 43.13 H new ATOM 0 HG LEU A 29 10.097 -2.639 -8.609 1.00 44.43 H new ATOM 0 HD11 LEU A 29 8.094 -3.147 -9.979 1.00 43.32 H new ATOM 0 HD12 LEU A 29 9.584 -3.194 -10.951 1.00 43.32 H new ATOM 0 HD13 LEU A 29 8.815 -4.711 -10.427 1.00 43.32 H new ATOM 0 HD21 LEU A 29 8.113 -3.733 -7.623 1.00 55.15 H new ATOM 0 HD22 LEU A 29 8.802 -5.326 -8.015 1.00 55.15 H new ATOM 0 HD23 LEU A 29 9.619 -4.268 -6.840 1.00 55.15 H new ATOM 460 N SER A 30 13.700 -2.380 -9.057 1.00 31.42 N ATOM 461 CA SER A 30 13.990 -1.041 -9.508 1.00 13.10 C ATOM 462 C SER A 30 13.274 -0.848 -10.868 1.00 32.42 C ATOM 463 O SER A 30 12.618 0.164 -11.120 1.00 34.43 O ATOM 464 CB SER A 30 15.504 -0.862 -9.647 1.00 12.45 C ATOM 465 OG SER A 30 16.165 -1.203 -8.424 1.00 61.34 O ATOM 0 H SER A 30 14.362 -3.081 -9.389 1.00 31.42 H new ATOM 0 HA SER A 30 13.636 -0.295 -8.796 1.00 13.10 H new ATOM 0 HB2 SER A 30 15.877 -1.490 -10.456 1.00 12.45 H new ATOM 0 HB3 SER A 30 15.731 0.170 -9.914 1.00 12.45 H new ATOM 0 HG SER A 30 17.132 -1.085 -8.531 1.00 61.34 H new ATOM 471 N ASP A 31 13.431 -1.884 -11.705 1.00 45.51 N ATOM 472 CA ASP A 31 12.837 -2.052 -13.054 1.00 41.33 C ATOM 473 C ASP A 31 12.988 -0.837 -14.005 1.00 13.22 C ATOM 474 O ASP A 31 14.002 -0.735 -14.706 1.00 72.03 O ATOM 475 CB ASP A 31 11.402 -2.596 -13.002 1.00 62.14 C ATOM 476 CG ASP A 31 10.910 -3.072 -14.353 1.00 24.30 C ATOM 477 OD1 ASP A 31 11.333 -4.175 -14.798 1.00 22.22 O ATOM 478 OD2 ASP A 31 10.095 -2.396 -14.988 1.00 3.54 O1- ATOM 0 H ASP A 31 14.012 -2.682 -11.448 1.00 45.51 H new ATOM 0 HA ASP A 31 13.455 -2.820 -13.520 1.00 41.33 H new ATOM 0 HB2 ASP A 31 11.356 -3.421 -12.291 1.00 62.14 H new ATOM 0 HB3 ASP A 31 10.736 -1.818 -12.630 1.00 62.14 H new ATOM 483 N GLY A 32 12.036 0.079 -14.018 1.00 33.41 N ATOM 484 CA GLY A 32 12.114 1.220 -14.918 1.00 33.43 C ATOM 485 C GLY A 32 10.864 2.078 -14.864 1.00 54.02 C ATOM 486 O GLY A 32 9.887 1.821 -15.575 1.00 72.42 O ATOM 0 H GLY A 32 11.208 0.058 -13.423 1.00 33.41 H new ATOM 0 HA2 GLY A 32 12.981 1.827 -14.658 1.00 33.43 H new ATOM 0 HA3 GLY A 32 12.266 0.867 -15.938 1.00 33.43 H new ATOM 490 N ASN A 33 10.915 3.098 -14.061 1.00 22.41 N ATOM 491 CA ASN A 33 9.770 3.969 -13.774 1.00 23.20 C ATOM 492 C ASN A 33 9.388 4.863 -14.939 1.00 42.22 C ATOM 493 O ASN A 33 8.187 5.055 -15.245 1.00 12.42 O ATOM 494 CB ASN A 33 10.081 4.841 -12.554 1.00 74.04 C ATOM 495 CG ASN A 33 10.158 4.050 -11.273 1.00 4.42 C ATOM 496 OD1 ASN A 33 9.488 3.041 -11.122 1.00 62.00 O ATOM 497 ND2 ASN A 33 10.974 4.490 -10.345 1.00 54.10 N ATOM 0 H ASN A 33 11.764 3.370 -13.566 1.00 22.41 H new ATOM 0 HA ASN A 33 8.921 3.314 -13.580 1.00 23.20 H new ATOM 0 HB2 ASN A 33 11.028 5.357 -12.714 1.00 74.04 H new ATOM 0 HB3 ASN A 33 9.313 5.608 -12.456 1.00 74.04 H new ATOM 0 HD21 ASN A 33 11.064 3.985 -9.463 1.00 54.10 H new ATOM 0 HD22 ASN A 33 11.519 5.337 -10.505 1.00 54.10 H new ATOM 504 N GLU A 34 10.380 5.381 -15.615 1.00 45.21 N ATOM 505 CA GLU A 34 10.143 6.372 -16.644 1.00 64.23 C ATOM 506 C GLU A 34 9.661 5.780 -17.962 1.00 51.42 C ATOM 507 O GLU A 34 9.094 6.494 -18.768 1.00 13.21 O ATOM 508 CB GLU A 34 11.360 7.273 -16.845 1.00 3.33 C ATOM 509 CG GLU A 34 12.634 6.533 -17.175 1.00 13.31 C ATOM 510 CD GLU A 34 13.782 7.464 -17.413 1.00 13.31 C ATOM 511 OE1 GLU A 34 14.469 7.845 -16.446 1.00 12.41 O ATOM 512 OE2 GLU A 34 14.038 7.816 -18.573 1.00 23.34 O1- ATOM 0 H GLU A 34 11.360 5.137 -15.475 1.00 45.21 H new ATOM 0 HA GLU A 34 9.322 6.988 -16.279 1.00 64.23 H new ATOM 0 HB2 GLU A 34 11.146 7.979 -17.647 1.00 3.33 H new ATOM 0 HB3 GLU A 34 11.518 7.858 -15.939 1.00 3.33 H new ATOM 0 HG2 GLU A 34 12.881 5.856 -16.358 1.00 13.31 H new ATOM 0 HG3 GLU A 34 12.476 5.919 -18.062 1.00 13.31 H new ATOM 519 N GLN A 35 9.852 4.476 -18.147 1.00 55.34 N ATOM 520 CA GLN A 35 9.456 3.773 -19.381 1.00 20.41 C ATOM 521 C GLN A 35 8.007 4.084 -19.788 1.00 50.54 C ATOM 522 O GLN A 35 7.748 4.567 -20.886 1.00 40.51 O ATOM 523 CB GLN A 35 9.643 2.253 -19.215 1.00 43.34 C ATOM 524 CG GLN A 35 9.196 1.432 -20.421 1.00 31.24 C ATOM 525 CD GLN A 35 9.426 -0.052 -20.241 1.00 63.32 C ATOM 526 OE1 GLN A 35 10.483 -0.578 -20.597 1.00 52.12 O ATOM 527 NE2 GLN A 35 8.468 -0.740 -19.692 1.00 3.11 N ATOM 0 H GLN A 35 10.285 3.870 -17.450 1.00 55.34 H new ATOM 0 HA GLN A 35 10.105 4.134 -20.179 1.00 20.41 H new ATOM 0 HB2 GLN A 35 10.695 2.047 -19.019 1.00 43.34 H new ATOM 0 HB3 GLN A 35 9.085 1.923 -18.338 1.00 43.34 H new ATOM 0 HG2 GLN A 35 8.136 1.611 -20.603 1.00 31.24 H new ATOM 0 HG3 GLN A 35 9.734 1.773 -21.306 1.00 31.24 H new ATOM 0 HE21 GLN A 35 7.605 -0.276 -19.408 1.00 3.11 H new ATOM 0 HE22 GLN A 35 8.580 -1.743 -19.546 1.00 3.11 H new ATOM 536 N ILE A 36 7.084 3.855 -18.887 1.00 14.54 N ATOM 537 CA ILE A 36 5.685 4.060 -19.195 1.00 4.24 C ATOM 538 C ILE A 36 5.274 5.526 -18.927 1.00 60.05 C ATOM 539 O ILE A 36 4.281 6.019 -19.454 1.00 74.41 O ATOM 540 CB ILE A 36 4.786 3.052 -18.407 1.00 3.40 C ATOM 541 CG1 ILE A 36 5.231 1.596 -18.680 1.00 34.35 C ATOM 542 CG2 ILE A 36 3.300 3.221 -18.739 1.00 52.11 C ATOM 543 CD1 ILE A 36 5.134 1.160 -20.137 1.00 43.45 C ATOM 0 H ILE A 36 7.271 3.528 -17.939 1.00 14.54 H new ATOM 0 HA ILE A 36 5.535 3.867 -20.257 1.00 4.24 H new ATOM 0 HB ILE A 36 4.913 3.272 -17.347 1.00 3.40 H new ATOM 0 HG12 ILE A 36 6.263 1.478 -18.348 1.00 34.35 H new ATOM 0 HG13 ILE A 36 4.622 0.925 -18.074 1.00 34.35 H new ATOM 0 HG21 ILE A 36 2.715 2.500 -18.168 1.00 52.11 H new ATOM 0 HG22 ILE A 36 2.982 4.231 -18.481 1.00 52.11 H new ATOM 0 HG23 ILE A 36 3.144 3.052 -19.804 1.00 52.11 H new ATOM 0 HD11 ILE A 36 5.467 0.126 -20.230 1.00 43.45 H new ATOM 0 HD12 ILE A 36 4.100 1.240 -20.473 1.00 43.45 H new ATOM 0 HD13 ILE A 36 5.766 1.801 -20.752 1.00 43.45 H new ATOM 555 N GLN A 37 6.079 6.249 -18.174 1.00 62.12 N ATOM 556 CA GLN A 37 5.736 7.627 -17.877 1.00 62.21 C ATOM 557 C GLN A 37 6.118 8.535 -19.047 1.00 43.52 C ATOM 558 O GLN A 37 5.490 9.569 -19.270 1.00 23.45 O ATOM 559 CB GLN A 37 6.370 8.105 -16.560 1.00 43.12 C ATOM 560 CG GLN A 37 5.877 9.476 -16.089 1.00 53.33 C ATOM 561 CD GLN A 37 4.353 9.555 -15.982 1.00 24.44 C ATOM 562 OE1 GLN A 37 3.763 9.257 -14.942 1.00 72.41 O ATOM 563 NE2 GLN A 37 3.711 9.947 -17.054 1.00 53.13 N ATOM 0 H GLN A 37 6.953 5.918 -17.765 1.00 62.12 H new ATOM 0 HA GLN A 37 4.656 7.682 -17.741 1.00 62.21 H new ATOM 0 HB2 GLN A 37 6.163 7.370 -15.782 1.00 43.12 H new ATOM 0 HB3 GLN A 37 7.452 8.143 -16.683 1.00 43.12 H new ATOM 0 HG2 GLN A 37 6.317 9.701 -15.117 1.00 53.33 H new ATOM 0 HG3 GLN A 37 6.228 10.241 -16.782 1.00 53.33 H new ATOM 0 HE21 GLN A 37 4.229 10.187 -17.899 1.00 53.13 H new ATOM 0 HE22 GLN A 37 2.693 10.013 -17.043 1.00 53.13 H new ATOM 572 N ALA A 38 7.124 8.121 -19.797 1.00 61.11 N ATOM 573 CA ALA A 38 7.570 8.852 -20.966 1.00 2.44 C ATOM 574 C ALA A 38 6.569 8.715 -22.103 1.00 62.02 C ATOM 575 O ALA A 38 6.325 9.664 -22.833 1.00 11.03 O ATOM 576 CB ALA A 38 8.940 8.386 -21.399 1.00 71.34 C ATOM 0 H ALA A 38 7.653 7.269 -19.612 1.00 61.11 H new ATOM 0 HA ALA A 38 7.639 9.907 -20.700 1.00 2.44 H new ATOM 0 HB1 ALA A 38 9.255 8.948 -22.278 1.00 71.34 H new ATOM 0 HB2 ALA A 38 9.652 8.549 -20.590 1.00 71.34 H new ATOM 0 HB3 ALA A 38 8.903 7.324 -21.642 1.00 71.34 H new ATOM 582 N VAL A 39 5.967 7.534 -22.243 1.00 71.11 N ATOM 583 CA VAL A 39 4.938 7.356 -23.270 1.00 21.33 C ATOM 584 C VAL A 39 3.660 8.070 -22.829 1.00 40.43 C ATOM 585 O VAL A 39 2.818 8.451 -23.656 1.00 51.14 O ATOM 586 CB VAL A 39 4.639 5.854 -23.619 1.00 50.32 C ATOM 587 CG1 VAL A 39 5.894 5.133 -24.076 1.00 32.43 C ATOM 588 CG2 VAL A 39 3.984 5.107 -22.466 1.00 53.44 C ATOM 0 H VAL A 39 6.165 6.708 -21.678 1.00 71.11 H new ATOM 0 HA VAL A 39 5.326 7.796 -24.189 1.00 21.33 H new ATOM 0 HB VAL A 39 3.926 5.866 -24.443 1.00 50.32 H new ATOM 0 HG11 VAL A 39 5.653 4.096 -24.310 1.00 32.43 H new ATOM 0 HG12 VAL A 39 6.292 5.623 -24.965 1.00 32.43 H new ATOM 0 HG13 VAL A 39 6.640 5.162 -23.282 1.00 32.43 H new ATOM 0 HG21 VAL A 39 3.799 4.074 -22.760 1.00 53.44 H new ATOM 0 HG22 VAL A 39 4.644 5.125 -21.599 1.00 53.44 H new ATOM 0 HG23 VAL A 39 3.039 5.587 -22.212 1.00 53.44 H new ATOM 598 N ILE A 40 3.553 8.262 -21.505 1.00 33.24 N ATOM 599 CA ILE A 40 2.455 8.953 -20.828 1.00 72.32 C ATOM 600 C ILE A 40 1.167 8.130 -20.870 1.00 3.25 C ATOM 601 O ILE A 40 0.677 7.684 -19.835 1.00 21.30 O ATOM 602 CB ILE A 40 2.208 10.396 -21.383 1.00 23.14 C ATOM 603 CG1 ILE A 40 3.506 11.226 -21.319 1.00 1.42 C ATOM 604 CG2 ILE A 40 1.106 11.087 -20.578 1.00 14.21 C ATOM 605 CD1 ILE A 40 3.403 12.602 -21.949 1.00 41.53 C ATOM 0 H ILE A 40 4.261 7.924 -20.853 1.00 33.24 H new ATOM 0 HA ILE A 40 2.763 9.062 -19.788 1.00 72.32 H new ATOM 0 HB ILE A 40 1.893 10.319 -22.424 1.00 23.14 H new ATOM 0 HG12 ILE A 40 3.799 11.339 -20.275 1.00 1.42 H new ATOM 0 HG13 ILE A 40 4.302 10.671 -21.816 1.00 1.42 H new ATOM 0 HG21 ILE A 40 0.942 12.090 -20.972 1.00 14.21 H new ATOM 0 HG22 ILE A 40 0.184 10.511 -20.655 1.00 14.21 H new ATOM 0 HG23 ILE A 40 1.406 11.153 -19.532 1.00 14.21 H new ATOM 0 HD11 ILE A 40 4.360 13.116 -21.859 1.00 41.53 H new ATOM 0 HD12 ILE A 40 3.143 12.501 -23.003 1.00 41.53 H new ATOM 0 HD13 ILE A 40 2.632 13.179 -21.438 1.00 41.53 H new ATOM 617 N ASP A 41 0.657 7.914 -22.052 1.00 74.00 N ATOM 618 CA ASP A 41 -0.565 7.164 -22.246 1.00 61.11 C ATOM 619 C ASP A 41 -0.221 5.779 -22.714 1.00 54.35 C ATOM 620 O ASP A 41 0.349 5.611 -23.800 1.00 64.32 O ATOM 621 CB ASP A 41 -1.462 7.851 -23.273 1.00 50.11 C ATOM 622 CG ASP A 41 -2.765 7.116 -23.495 1.00 2.12 C ATOM 623 OD1 ASP A 41 -3.641 7.175 -22.617 1.00 34.25 O ATOM 624 OD2 ASP A 41 -2.964 6.521 -24.574 1.00 4.41 O1- ATOM 0 H ASP A 41 1.077 8.254 -22.917 1.00 74.00 H new ATOM 0 HA ASP A 41 -1.105 7.113 -21.301 1.00 61.11 H new ATOM 0 HB2 ASP A 41 -1.675 8.867 -22.941 1.00 50.11 H new ATOM 0 HB3 ASP A 41 -0.928 7.930 -24.220 1.00 50.11 H new ATOM 629 N ALA A 42 -0.517 4.802 -21.898 1.00 32.42 N ATOM 630 CA ALA A 42 -0.208 3.429 -22.216 1.00 0.51 C ATOM 631 C ALA A 42 -1.390 2.740 -22.874 1.00 35.32 C ATOM 632 O ALA A 42 -1.208 1.781 -23.642 1.00 2.53 O ATOM 633 CB ALA A 42 0.214 2.682 -20.969 1.00 4.32 C ATOM 0 H ALA A 42 -0.977 4.932 -20.997 1.00 32.42 H new ATOM 0 HA ALA A 42 0.620 3.424 -22.925 1.00 0.51 H new ATOM 0 HB1 ALA A 42 0.444 1.648 -21.225 1.00 4.32 H new ATOM 0 HB2 ALA A 42 1.098 3.156 -20.543 1.00 4.32 H new ATOM 0 HB3 ALA A 42 -0.596 2.704 -20.240 1.00 4.32 H new ATOM 639 N GLY A 43 -2.597 3.190 -22.539 1.00 25.13 N ATOM 640 CA GLY A 43 -3.815 2.658 -23.136 1.00 33.31 C ATOM 641 C GLY A 43 -4.235 1.309 -22.578 1.00 14.14 C ATOM 642 O GLY A 43 -5.291 1.184 -21.975 1.00 10.14 O ATOM 0 H GLY A 43 -2.756 3.927 -21.852 1.00 25.13 H new ATOM 0 HA2 GLY A 43 -4.625 3.372 -22.983 1.00 33.31 H new ATOM 0 HA3 GLY A 43 -3.670 2.566 -24.212 1.00 33.31 H new ATOM 646 N ALA A 44 -3.390 0.320 -22.771 1.00 3.42 N ATOM 647 CA ALA A 44 -3.625 -1.058 -22.334 1.00 32.00 C ATOM 648 C ALA A 44 -3.484 -1.206 -20.823 1.00 24.22 C ATOM 649 O ALA A 44 -3.966 -2.162 -20.238 1.00 3.14 O ATOM 650 CB ALA A 44 -2.672 -2.003 -23.048 1.00 71.24 C ATOM 0 H ALA A 44 -2.496 0.444 -23.247 1.00 3.42 H new ATOM 0 HA ALA A 44 -4.651 -1.317 -22.594 1.00 32.00 H new ATOM 0 HB1 ALA A 44 -2.856 -3.025 -22.715 1.00 71.24 H new ATOM 0 HB2 ALA A 44 -2.833 -1.937 -24.124 1.00 71.24 H new ATOM 0 HB3 ALA A 44 -1.644 -1.726 -22.817 1.00 71.24 H new ATOM 656 N LEU A 45 -2.792 -0.254 -20.217 1.00 53.13 N ATOM 657 CA LEU A 45 -2.463 -0.260 -18.781 1.00 34.44 C ATOM 658 C LEU A 45 -3.632 -0.634 -17.814 1.00 43.21 C ATOM 659 O LEU A 45 -3.419 -1.445 -16.919 1.00 65.31 O ATOM 660 CB LEU A 45 -1.865 1.054 -18.355 1.00 34.23 C ATOM 661 CG LEU A 45 -1.475 1.118 -16.898 1.00 11.33 C ATOM 662 CD1 LEU A 45 -0.265 0.257 -16.618 1.00 32.04 C ATOM 663 CD2 LEU A 45 -1.270 2.531 -16.484 1.00 54.15 C ATOM 0 H LEU A 45 -2.432 0.564 -20.709 1.00 53.13 H new ATOM 0 HA LEU A 45 -1.736 -1.067 -18.689 1.00 34.44 H new ATOM 0 HB2 LEU A 45 -0.983 1.252 -18.964 1.00 34.23 H new ATOM 0 HB3 LEU A 45 -2.581 1.849 -18.562 1.00 34.23 H new ATOM 0 HG LEU A 45 -2.290 0.713 -16.298 1.00 11.33 H new ATOM 0 HD11 LEU A 45 -0.008 0.323 -15.561 1.00 32.04 H new ATOM 0 HD12 LEU A 45 -0.489 -0.779 -16.873 1.00 32.04 H new ATOM 0 HD13 LEU A 45 0.576 0.605 -17.218 1.00 32.04 H new ATOM 0 HD21 LEU A 45 -0.989 2.565 -15.431 1.00 54.15 H new ATOM 0 HD22 LEU A 45 -0.477 2.975 -17.086 1.00 54.15 H new ATOM 0 HD23 LEU A 45 -2.194 3.091 -16.631 1.00 54.15 H new ATOM 675 N PRO A 46 -4.872 -0.049 -17.940 1.00 3.14 N ATOM 676 CA PRO A 46 -6.016 -0.417 -17.066 1.00 71.12 C ATOM 677 C PRO A 46 -6.311 -1.924 -17.093 1.00 12.01 C ATOM 678 O PRO A 46 -6.895 -2.479 -16.167 1.00 21.34 O ATOM 679 CB PRO A 46 -7.202 0.358 -17.675 1.00 12.44 C ATOM 680 CG PRO A 46 -6.734 0.786 -19.018 1.00 22.55 C ATOM 681 CD PRO A 46 -5.268 1.027 -18.868 1.00 12.24 C ATOM 0 HA PRO A 46 -5.816 -0.176 -16.022 1.00 71.12 H new ATOM 0 HB2 PRO A 46 -8.089 -0.272 -17.748 1.00 12.44 H new ATOM 0 HB3 PRO A 46 -7.471 1.216 -17.059 1.00 12.44 H new ATOM 0 HG2 PRO A 46 -6.932 0.018 -19.766 1.00 22.55 H new ATOM 0 HG3 PRO A 46 -7.249 1.689 -19.344 1.00 22.55 H new ATOM 0 HD2 PRO A 46 -4.744 0.957 -19.821 1.00 12.24 H new ATOM 0 HD3 PRO A 46 -5.057 2.015 -18.460 1.00 12.24 H new ATOM 689 N ALA A 47 -5.873 -2.569 -18.140 1.00 3.33 N ATOM 690 CA ALA A 47 -6.090 -3.992 -18.318 1.00 31.34 C ATOM 691 C ALA A 47 -4.964 -4.809 -17.682 1.00 72.03 C ATOM 692 O ALA A 47 -5.126 -5.987 -17.391 1.00 43.21 O ATOM 693 CB ALA A 47 -6.243 -4.336 -19.788 1.00 73.24 C ATOM 0 H ALA A 47 -5.354 -2.128 -18.899 1.00 3.33 H new ATOM 0 HA ALA A 47 -7.018 -4.252 -17.809 1.00 31.34 H new ATOM 0 HB1 ALA A 47 -6.405 -5.409 -19.896 1.00 73.24 H new ATOM 0 HB2 ALA A 47 -7.096 -3.797 -20.201 1.00 73.24 H new ATOM 0 HB3 ALA A 47 -5.339 -4.050 -20.325 1.00 73.24 H new ATOM 699 N LEU A 48 -3.847 -4.162 -17.406 1.00 72.51 N ATOM 700 CA LEU A 48 -2.688 -4.831 -16.869 1.00 0.43 C ATOM 701 C LEU A 48 -2.953 -5.305 -15.444 1.00 43.41 C ATOM 702 O LEU A 48 -2.420 -6.319 -15.015 1.00 51.44 O ATOM 703 CB LEU A 48 -1.457 -3.911 -16.928 1.00 43.50 C ATOM 704 CG LEU A 48 -0.156 -4.491 -16.379 1.00 5.14 C ATOM 705 CD1 LEU A 48 0.304 -5.699 -17.194 1.00 35.14 C ATOM 706 CD2 LEU A 48 0.930 -3.432 -16.309 1.00 71.01 C ATOM 0 H LEU A 48 -3.723 -3.160 -17.549 1.00 72.51 H new ATOM 0 HA LEU A 48 -2.481 -5.709 -17.481 1.00 0.43 H new ATOM 0 HB2 LEU A 48 -1.293 -3.624 -17.967 1.00 43.50 H new ATOM 0 HB3 LEU A 48 -1.685 -2.998 -16.377 1.00 43.50 H new ATOM 0 HG LEU A 48 -0.353 -4.835 -15.364 1.00 5.14 H new ATOM 0 HD11 LEU A 48 1.233 -6.087 -16.776 1.00 35.14 H new ATOM 0 HD12 LEU A 48 -0.462 -6.474 -17.159 1.00 35.14 H new ATOM 0 HD13 LEU A 48 0.469 -5.398 -18.229 1.00 35.14 H new ATOM 0 HD21 LEU A 48 1.845 -3.874 -15.914 1.00 71.01 H new ATOM 0 HD22 LEU A 48 1.119 -3.038 -17.308 1.00 71.01 H new ATOM 0 HD23 LEU A 48 0.607 -2.622 -15.655 1.00 71.01 H new ATOM 718 N VAL A 49 -3.816 -4.601 -14.732 1.00 22.01 N ATOM 719 CA VAL A 49 -4.148 -4.984 -13.385 1.00 63.03 C ATOM 720 C VAL A 49 -5.074 -6.233 -13.387 1.00 31.20 C ATOM 721 O VAL A 49 -5.057 -7.052 -12.468 1.00 33.11 O ATOM 722 CB VAL A 49 -4.801 -3.813 -12.600 1.00 64.45 C ATOM 723 CG1 VAL A 49 -6.154 -3.402 -13.174 1.00 23.42 C ATOM 724 CG2 VAL A 49 -4.909 -4.160 -11.139 1.00 53.05 C ATOM 0 H VAL A 49 -4.294 -3.765 -15.069 1.00 22.01 H new ATOM 0 HA VAL A 49 -3.220 -5.240 -12.874 1.00 63.03 H new ATOM 0 HB VAL A 49 -4.149 -2.946 -12.708 1.00 64.45 H new ATOM 0 HG11 VAL A 49 -6.564 -2.580 -12.587 1.00 23.42 H new ATOM 0 HG12 VAL A 49 -6.028 -3.081 -14.208 1.00 23.42 H new ATOM 0 HG13 VAL A 49 -6.838 -4.250 -13.138 1.00 23.42 H new ATOM 0 HG21 VAL A 49 -5.368 -3.331 -10.601 1.00 53.05 H new ATOM 0 HG22 VAL A 49 -5.523 -5.053 -11.022 1.00 53.05 H new ATOM 0 HG23 VAL A 49 -3.914 -4.348 -10.735 1.00 53.05 H new ATOM 734 N GLN A 50 -5.826 -6.400 -14.467 1.00 22.20 N ATOM 735 CA GLN A 50 -6.753 -7.527 -14.590 1.00 50.02 C ATOM 736 C GLN A 50 -5.973 -8.756 -15.052 1.00 14.12 C ATOM 737 O GLN A 50 -6.367 -9.902 -14.835 1.00 62.23 O ATOM 738 CB GLN A 50 -7.875 -7.186 -15.595 1.00 11.11 C ATOM 739 CG GLN A 50 -7.653 -7.671 -17.030 1.00 44.04 C ATOM 740 CD GLN A 50 -8.752 -7.246 -17.969 1.00 1.45 C ATOM 741 OE1 GLN A 50 -8.681 -6.197 -18.590 1.00 34.33 O ATOM 742 NE2 GLN A 50 -9.769 -8.047 -18.077 1.00 32.13 N ATOM 0 H GLN A 50 -5.815 -5.773 -15.271 1.00 22.20 H new ATOM 0 HA GLN A 50 -7.216 -7.733 -13.625 1.00 50.02 H new ATOM 0 HB2 GLN A 50 -8.808 -7.613 -15.227 1.00 11.11 H new ATOM 0 HB3 GLN A 50 -8.004 -6.104 -15.613 1.00 11.11 H new ATOM 0 HG2 GLN A 50 -6.701 -7.286 -17.395 1.00 44.04 H new ATOM 0 HG3 GLN A 50 -7.579 -8.759 -17.033 1.00 44.04 H new ATOM 0 HE21 GLN A 50 -9.793 -8.915 -17.542 1.00 32.13 H new ATOM 0 HE22 GLN A 50 -10.543 -7.808 -18.697 1.00 32.13 H new ATOM 751 N LEU A 51 -4.854 -8.482 -15.679 1.00 23.14 N ATOM 752 CA LEU A 51 -3.969 -9.488 -16.232 1.00 33.14 C ATOM 753 C LEU A 51 -3.434 -10.403 -15.104 1.00 12.50 C ATOM 754 O LEU A 51 -3.388 -11.622 -15.255 1.00 50.14 O ATOM 755 CB LEU A 51 -2.831 -8.762 -17.001 1.00 41.22 C ATOM 756 CG LEU A 51 -2.031 -9.537 -18.078 1.00 4.11 C ATOM 757 CD1 LEU A 51 -1.157 -10.619 -17.487 1.00 0.50 C ATOM 758 CD2 LEU A 51 -2.969 -10.117 -19.124 1.00 74.12 C ATOM 0 H LEU A 51 -4.522 -7.529 -15.824 1.00 23.14 H new ATOM 0 HA LEU A 51 -4.500 -10.135 -16.930 1.00 33.14 H new ATOM 0 HB2 LEU A 51 -3.267 -7.887 -17.483 1.00 41.22 H new ATOM 0 HB3 LEU A 51 -2.118 -8.396 -16.262 1.00 41.22 H new ATOM 0 HG LEU A 51 -1.364 -8.819 -18.556 1.00 4.11 H new ATOM 0 HD11 LEU A 51 -0.620 -11.130 -18.286 1.00 0.50 H new ATOM 0 HD12 LEU A 51 -0.442 -10.172 -16.796 1.00 0.50 H new ATOM 0 HD13 LEU A 51 -1.778 -11.337 -16.952 1.00 0.50 H new ATOM 0 HD21 LEU A 51 -2.390 -10.658 -19.872 1.00 74.12 H new ATOM 0 HD22 LEU A 51 -3.671 -10.800 -18.645 1.00 74.12 H new ATOM 0 HD23 LEU A 51 -3.520 -9.310 -19.606 1.00 74.12 H new ATOM 770 N LEU A 52 -3.112 -9.815 -13.954 1.00 63.40 N ATOM 771 CA LEU A 52 -2.601 -10.605 -12.819 1.00 51.05 C ATOM 772 C LEU A 52 -3.725 -11.126 -11.943 1.00 24.41 C ATOM 773 O LEU A 52 -3.485 -11.746 -10.925 1.00 13.24 O ATOM 774 CB LEU A 52 -1.564 -9.878 -11.938 1.00 74.42 C ATOM 775 CG LEU A 52 -2.019 -8.629 -11.188 1.00 53.51 C ATOM 776 CD1 LEU A 52 -1.086 -8.356 -10.041 1.00 50.20 C ATOM 777 CD2 LEU A 52 -1.993 -7.453 -12.104 1.00 43.01 C ATOM 0 H LEU A 52 -3.191 -8.814 -13.777 1.00 63.40 H new ATOM 0 HA LEU A 52 -2.081 -11.437 -13.293 1.00 51.05 H new ATOM 0 HB2 LEU A 52 -1.189 -10.591 -11.204 1.00 74.42 H new ATOM 0 HB3 LEU A 52 -0.722 -9.600 -12.572 1.00 74.42 H new ATOM 0 HG LEU A 52 -3.031 -8.793 -10.817 1.00 53.51 H new ATOM 0 HD11 LEU A 52 -1.415 -7.463 -9.509 1.00 50.20 H new ATOM 0 HD12 LEU A 52 -1.089 -9.207 -9.359 1.00 50.20 H new ATOM 0 HD13 LEU A 52 -0.077 -8.200 -10.422 1.00 50.20 H new ATOM 0 HD21 LEU A 52 -2.319 -6.564 -11.564 1.00 43.01 H new ATOM 0 HD22 LEU A 52 -0.979 -7.302 -12.474 1.00 43.01 H new ATOM 0 HD23 LEU A 52 -2.663 -7.632 -12.945 1.00 43.01 H new ATOM 789 N SER A 53 -4.960 -10.898 -12.348 1.00 11.04 N ATOM 790 CA SER A 53 -6.085 -11.433 -11.633 1.00 60.15 C ATOM 791 C SER A 53 -6.307 -12.901 -12.060 1.00 12.33 C ATOM 792 O SER A 53 -7.274 -13.566 -11.651 1.00 75.24 O ATOM 793 CB SER A 53 -7.298 -10.583 -11.929 1.00 21.13 C ATOM 794 OG SER A 53 -7.037 -9.223 -11.615 1.00 22.54 O ATOM 0 H SER A 53 -5.202 -10.344 -13.170 1.00 11.04 H new ATOM 0 HA SER A 53 -5.904 -11.416 -10.558 1.00 60.15 H new ATOM 0 HB2 SER A 53 -7.567 -10.675 -12.981 1.00 21.13 H new ATOM 0 HB3 SER A 53 -8.150 -10.940 -11.350 1.00 21.13 H new ATOM 0 HG SER A 53 -7.871 -8.711 -11.660 1.00 22.54 H new ATOM 800 N SER A 54 -5.405 -13.372 -12.893 1.00 22.15 N ATOM 801 CA SER A 54 -5.378 -14.717 -13.352 1.00 74.41 C ATOM 802 C SER A 54 -4.594 -15.552 -12.314 1.00 32.44 C ATOM 803 O SER A 54 -3.509 -15.146 -11.902 1.00 0.12 O ATOM 804 CB SER A 54 -4.653 -14.724 -14.690 1.00 43.24 C ATOM 805 OG SER A 54 -5.158 -13.689 -15.540 1.00 52.42 O ATOM 0 H SER A 54 -4.652 -12.799 -13.274 1.00 22.15 H new ATOM 0 HA SER A 54 -6.378 -15.133 -13.471 1.00 74.41 H new ATOM 0 HB2 SER A 54 -3.584 -14.583 -14.532 1.00 43.24 H new ATOM 0 HB3 SER A 54 -4.779 -15.693 -15.173 1.00 43.24 H new ATOM 0 HG SER A 54 -4.493 -12.973 -15.614 1.00 52.42 H new ATOM 811 N PRO A 55 -5.107 -16.725 -11.898 1.00 5.43 N ATOM 812 CA PRO A 55 -4.479 -17.565 -10.843 1.00 53.35 C ATOM 813 C PRO A 55 -3.230 -18.340 -11.331 1.00 34.55 C ATOM 814 O PRO A 55 -2.954 -19.461 -10.882 1.00 23.33 O ATOM 815 CB PRO A 55 -5.604 -18.542 -10.492 1.00 33.54 C ATOM 816 CG PRO A 55 -6.369 -18.692 -11.754 1.00 12.34 C ATOM 817 CD PRO A 55 -6.344 -17.342 -12.414 1.00 11.21 C ATOM 0 HA PRO A 55 -4.112 -16.964 -10.011 1.00 53.35 H new ATOM 0 HB2 PRO A 55 -5.208 -19.499 -10.151 1.00 33.54 H new ATOM 0 HB3 PRO A 55 -6.232 -18.153 -9.690 1.00 33.54 H new ATOM 0 HG2 PRO A 55 -5.919 -19.449 -12.396 1.00 12.34 H new ATOM 0 HG3 PRO A 55 -7.392 -19.011 -11.555 1.00 12.34 H new ATOM 0 HD2 PRO A 55 -6.326 -17.427 -13.500 1.00 11.21 H new ATOM 0 HD3 PRO A 55 -7.224 -16.753 -12.155 1.00 11.21 H new ATOM 825 N ASN A 56 -2.464 -17.727 -12.187 1.00 54.34 N ATOM 826 CA ASN A 56 -1.273 -18.336 -12.732 1.00 43.34 C ATOM 827 C ASN A 56 -0.088 -17.858 -11.972 1.00 70.31 C ATOM 828 O ASN A 56 0.188 -16.653 -11.925 1.00 54.10 O ATOM 829 CB ASN A 56 -1.110 -18.038 -14.230 1.00 2.25 C ATOM 830 CG ASN A 56 -2.181 -18.657 -15.120 1.00 12.32 C ATOM 831 OD1 ASN A 56 -3.340 -18.797 -14.736 1.00 54.45 O ATOM 832 ND2 ASN A 56 -1.795 -19.043 -16.303 1.00 4.20 N ATOM 0 H ASN A 56 -2.645 -16.784 -12.532 1.00 54.34 H new ATOM 0 HA ASN A 56 -1.364 -19.418 -12.632 1.00 43.34 H new ATOM 0 HB2 ASN A 56 -1.116 -16.958 -14.375 1.00 2.25 H new ATOM 0 HB3 ASN A 56 -0.134 -18.398 -14.555 1.00 2.25 H new ATOM 0 HD21 ASN A 56 -2.463 -19.476 -16.941 1.00 4.20 H new ATOM 0 HD22 ASN A 56 -0.825 -18.912 -16.591 1.00 4.20 H new ATOM 839 N GLU A 57 0.618 -18.808 -11.393 1.00 41.11 N ATOM 840 CA GLU A 57 1.776 -18.565 -10.536 1.00 55.04 C ATOM 841 C GLU A 57 2.831 -17.694 -11.211 1.00 2.21 C ATOM 842 O GLU A 57 3.400 -16.793 -10.588 1.00 20.11 O ATOM 843 CB GLU A 57 2.392 -19.904 -10.101 1.00 3.12 C ATOM 844 CG GLU A 57 2.770 -20.833 -11.261 1.00 30.40 C ATOM 845 CD GLU A 57 3.530 -22.062 -10.829 1.00 14.41 C ATOM 846 OE1 GLU A 57 2.904 -23.039 -10.382 1.00 41.14 O ATOM 847 OE2 GLU A 57 4.768 -22.082 -10.963 1.00 31.31 O1- ATOM 0 H GLU A 57 0.402 -19.799 -11.504 1.00 41.11 H new ATOM 0 HA GLU A 57 1.424 -18.018 -9.661 1.00 55.04 H new ATOM 0 HB2 GLU A 57 3.283 -19.704 -9.506 1.00 3.12 H new ATOM 0 HB3 GLU A 57 1.685 -20.422 -9.452 1.00 3.12 H new ATOM 0 HG2 GLU A 57 1.862 -21.141 -11.779 1.00 30.40 H new ATOM 0 HG3 GLU A 57 3.373 -20.277 -11.979 1.00 30.40 H new ATOM 854 N GLN A 58 3.036 -17.925 -12.482 1.00 53.30 N ATOM 855 CA GLN A 58 4.038 -17.266 -13.227 1.00 70.34 C ATOM 856 C GLN A 58 3.584 -15.854 -13.598 1.00 32.41 C ATOM 857 O GLN A 58 4.321 -14.888 -13.440 1.00 13.13 O ATOM 858 CB GLN A 58 4.302 -18.112 -14.458 1.00 54.21 C ATOM 859 CG GLN A 58 5.250 -17.521 -15.420 1.00 54.14 C ATOM 860 CD GLN A 58 5.410 -18.386 -16.647 1.00 24.14 C ATOM 861 OE1 GLN A 58 6.269 -19.280 -16.693 1.00 73.21 O ATOM 862 NE2 GLN A 58 4.594 -18.154 -17.639 1.00 15.22 N ATOM 0 H GLN A 58 2.491 -18.594 -13.025 1.00 53.30 H new ATOM 0 HA GLN A 58 4.954 -17.155 -12.647 1.00 70.34 H new ATOM 0 HB2 GLN A 58 4.685 -19.082 -14.140 1.00 54.21 H new ATOM 0 HB3 GLN A 58 3.355 -18.294 -14.967 1.00 54.21 H new ATOM 0 HG2 GLN A 58 4.900 -16.532 -15.715 1.00 54.14 H new ATOM 0 HG3 GLN A 58 6.219 -17.387 -14.940 1.00 54.14 H new ATOM 0 HE21 GLN A 58 3.900 -17.410 -17.565 1.00 15.22 H new ATOM 0 HE22 GLN A 58 4.650 -18.717 -18.488 1.00 15.22 H new ATOM 871 N ILE A 59 2.342 -15.750 -14.021 1.00 55.51 N ATOM 872 CA ILE A 59 1.770 -14.499 -14.497 1.00 62.12 C ATOM 873 C ILE A 59 1.603 -13.483 -13.371 1.00 22.34 C ATOM 874 O ILE A 59 1.926 -12.306 -13.550 1.00 2.33 O ATOM 875 CB ILE A 59 0.406 -14.750 -15.191 1.00 43.40 C ATOM 876 CG1 ILE A 59 0.603 -15.630 -16.433 1.00 73.12 C ATOM 877 CG2 ILE A 59 -0.306 -13.443 -15.542 1.00 63.24 C ATOM 878 CD1 ILE A 59 -0.671 -15.944 -17.180 1.00 61.01 C ATOM 0 H ILE A 59 1.692 -16.535 -14.046 1.00 55.51 H new ATOM 0 HA ILE A 59 2.469 -14.082 -15.222 1.00 62.12 H new ATOM 0 HB ILE A 59 -0.239 -15.277 -14.488 1.00 43.40 H new ATOM 0 HG12 ILE A 59 1.295 -15.131 -17.112 1.00 73.12 H new ATOM 0 HG13 ILE A 59 1.073 -16.566 -16.130 1.00 73.12 H new ATOM 0 HG21 ILE A 59 -1.257 -13.665 -16.026 1.00 63.24 H new ATOM 0 HG22 ILE A 59 -0.487 -12.872 -14.632 1.00 63.24 H new ATOM 0 HG23 ILE A 59 0.318 -12.859 -16.219 1.00 63.24 H new ATOM 0 HD11 ILE A 59 -0.442 -16.570 -18.043 1.00 61.01 H new ATOM 0 HD12 ILE A 59 -1.359 -16.473 -16.520 1.00 61.01 H new ATOM 0 HD13 ILE A 59 -1.133 -15.016 -17.517 1.00 61.01 H new ATOM 890 N LEU A 60 1.139 -13.953 -12.217 1.00 61.12 N ATOM 891 CA LEU A 60 0.856 -13.114 -11.067 1.00 70.34 C ATOM 892 C LEU A 60 2.027 -12.225 -10.707 1.00 52.13 C ATOM 893 O LEU A 60 1.935 -11.012 -10.842 1.00 72.12 O ATOM 894 CB LEU A 60 0.465 -14.002 -9.903 1.00 33.53 C ATOM 895 CG LEU A 60 0.112 -13.344 -8.574 1.00 75.42 C ATOM 896 CD1 LEU A 60 -0.959 -12.283 -8.754 1.00 0.45 C ATOM 897 CD2 LEU A 60 -0.380 -14.413 -7.637 1.00 44.14 C ATOM 0 H LEU A 60 0.948 -14.942 -12.057 1.00 61.12 H new ATOM 0 HA LEU A 60 0.032 -12.445 -11.315 1.00 70.34 H new ATOM 0 HB2 LEU A 60 -0.391 -14.600 -10.215 1.00 33.53 H new ATOM 0 HB3 LEU A 60 1.288 -14.694 -9.722 1.00 33.53 H new ATOM 0 HG LEU A 60 0.997 -12.854 -8.168 1.00 75.42 H new ATOM 0 HD11 LEU A 60 -1.190 -11.832 -7.789 1.00 0.45 H new ATOM 0 HD12 LEU A 60 -0.598 -11.514 -9.437 1.00 0.45 H new ATOM 0 HD13 LEU A 60 -1.859 -12.740 -9.165 1.00 0.45 H new ATOM 0 HD21 LEU A 60 -0.639 -13.965 -6.678 1.00 44.14 H new ATOM 0 HD22 LEU A 60 -1.261 -14.893 -8.063 1.00 44.14 H new ATOM 0 HD23 LEU A 60 0.403 -15.157 -7.490 1.00 44.14 H new ATOM 909 N GLN A 61 3.137 -12.819 -10.323 1.00 22.22 N ATOM 910 CA GLN A 61 4.290 -12.037 -9.950 1.00 53.31 C ATOM 911 C GLN A 61 4.891 -11.269 -11.112 1.00 75.51 C ATOM 912 O GLN A 61 5.414 -10.183 -10.927 1.00 3.43 O ATOM 913 CB GLN A 61 5.347 -12.857 -9.272 1.00 31.15 C ATOM 914 CG GLN A 61 5.000 -13.236 -7.868 1.00 53.10 C ATOM 915 CD GLN A 61 6.139 -13.917 -7.183 1.00 54.14 C ATOM 916 OE1 GLN A 61 6.314 -13.613 -5.947 1.00 4.23 O flip ATOM 917 NE2 GLN A 61 6.938 -14.639 -7.811 1.00 42.53 N flip ATOM 0 H GLN A 61 3.263 -13.829 -10.262 1.00 22.22 H new ATOM 0 HA GLN A 61 3.913 -11.308 -9.233 1.00 53.31 H new ATOM 0 HB2 GLN A 61 5.520 -13.763 -9.852 1.00 31.15 H new ATOM 0 HB3 GLN A 61 6.283 -12.298 -9.268 1.00 31.15 H new ATOM 0 HG2 GLN A 61 4.720 -12.343 -7.309 1.00 53.10 H new ATOM 0 HG3 GLN A 61 4.132 -13.895 -7.873 1.00 53.10 H new ATOM 0 HE21 GLN A 61 6.765 -14.858 -8.792 1.00 42.53 H new ATOM 0 HE22 GLN A 61 7.765 -15.011 -7.344 1.00 42.53 H new ATOM 926 N GLU A 62 4.797 -11.822 -12.306 1.00 1.23 N ATOM 927 CA GLU A 62 5.361 -11.194 -13.493 1.00 71.54 C ATOM 928 C GLU A 62 4.635 -9.872 -13.815 1.00 44.35 C ATOM 929 O GLU A 62 5.272 -8.842 -14.115 1.00 14.22 O ATOM 930 CB GLU A 62 5.265 -12.154 -14.672 1.00 71.52 C ATOM 931 CG GLU A 62 5.903 -11.649 -15.939 1.00 20.50 C ATOM 932 CD GLU A 62 5.713 -12.596 -17.080 1.00 33.12 C ATOM 933 OE1 GLU A 62 4.659 -12.534 -17.748 1.00 32.24 O ATOM 934 OE2 GLU A 62 6.604 -13.412 -17.352 1.00 72.03 O1- ATOM 0 H GLU A 62 4.332 -12.712 -12.484 1.00 1.23 H new ATOM 0 HA GLU A 62 6.409 -10.962 -13.302 1.00 71.54 H new ATOM 0 HB2 GLU A 62 5.734 -13.098 -14.395 1.00 71.52 H new ATOM 0 HB3 GLU A 62 4.214 -12.365 -14.868 1.00 71.52 H new ATOM 0 HG2 GLU A 62 5.477 -10.680 -16.198 1.00 20.50 H new ATOM 0 HG3 GLU A 62 6.969 -11.494 -15.771 1.00 20.50 H new ATOM 941 N ALA A 63 3.325 -9.897 -13.743 1.00 20.20 N ATOM 942 CA ALA A 63 2.532 -8.723 -14.029 1.00 5.02 C ATOM 943 C ALA A 63 2.467 -7.801 -12.818 1.00 74.22 C ATOM 944 O ALA A 63 2.427 -6.584 -12.967 1.00 14.43 O ATOM 945 CB ALA A 63 1.150 -9.113 -14.516 1.00 14.40 C ATOM 0 H ALA A 63 2.783 -10.722 -13.487 1.00 20.20 H new ATOM 0 HA ALA A 63 3.017 -8.168 -14.832 1.00 5.02 H new ATOM 0 HB1 ALA A 63 0.571 -8.214 -14.725 1.00 14.40 H new ATOM 0 HB2 ALA A 63 1.239 -9.707 -15.426 1.00 14.40 H new ATOM 0 HB3 ALA A 63 0.645 -9.699 -13.748 1.00 14.40 H new ATOM 951 N LEU A 64 2.486 -8.379 -11.622 1.00 42.22 N ATOM 952 CA LEU A 64 2.510 -7.596 -10.380 1.00 31.43 C ATOM 953 C LEU A 64 3.788 -6.783 -10.307 1.00 63.24 C ATOM 954 O LEU A 64 3.794 -5.645 -9.810 1.00 22.15 O ATOM 955 CB LEU A 64 2.407 -8.521 -9.184 1.00 4.55 C ATOM 956 CG LEU A 64 2.396 -7.884 -7.803 1.00 53.22 C ATOM 957 CD1 LEU A 64 1.263 -6.873 -7.653 1.00 32.54 C ATOM 958 CD2 LEU A 64 2.259 -8.971 -6.788 1.00 63.03 C ATOM 0 H LEU A 64 2.485 -9.389 -11.480 1.00 42.22 H new ATOM 0 HA LEU A 64 1.659 -6.915 -10.370 1.00 31.43 H new ATOM 0 HB2 LEU A 64 1.495 -9.109 -9.291 1.00 4.55 H new ATOM 0 HB3 LEU A 64 3.243 -9.219 -9.226 1.00 4.55 H new ATOM 0 HG LEU A 64 3.328 -7.338 -7.656 1.00 53.22 H new ATOM 0 HD11 LEU A 64 1.291 -6.441 -6.653 1.00 32.54 H new ATOM 0 HD12 LEU A 64 1.381 -6.082 -8.393 1.00 32.54 H new ATOM 0 HD13 LEU A 64 0.307 -7.373 -7.806 1.00 32.54 H new ATOM 0 HD21 LEU A 64 2.249 -8.536 -5.788 1.00 63.03 H new ATOM 0 HD22 LEU A 64 1.328 -9.512 -6.958 1.00 63.03 H new ATOM 0 HD23 LEU A 64 3.100 -9.659 -6.876 1.00 63.03 H new ATOM 970 N TRP A 65 4.860 -7.372 -10.818 1.00 63.22 N ATOM 971 CA TRP A 65 6.148 -6.725 -10.927 1.00 64.53 C ATOM 972 C TRP A 65 5.964 -5.427 -11.710 1.00 24.44 C ATOM 973 O TRP A 65 6.233 -4.335 -11.215 1.00 51.22 O ATOM 974 CB TRP A 65 7.115 -7.676 -11.672 1.00 32.23 C ATOM 975 CG TRP A 65 8.492 -7.143 -11.965 1.00 61.30 C ATOM 976 CD1 TRP A 65 8.853 -6.330 -13.002 1.00 4.41 C ATOM 977 CD2 TRP A 65 9.696 -7.429 -11.248 1.00 25.01 C ATOM 978 NE1 TRP A 65 10.194 -6.073 -12.955 1.00 21.02 N ATOM 979 CE2 TRP A 65 10.739 -6.739 -11.895 1.00 24.11 C ATOM 980 CE3 TRP A 65 9.993 -8.194 -10.118 1.00 5.42 C ATOM 981 CZ2 TRP A 65 12.055 -6.793 -11.453 1.00 32.42 C ATOM 982 CZ3 TRP A 65 11.300 -8.246 -9.681 1.00 61.13 C ATOM 983 CH2 TRP A 65 12.314 -7.550 -10.348 1.00 51.44 C ATOM 0 H TRP A 65 4.853 -8.328 -11.173 1.00 63.22 H new ATOM 0 HA TRP A 65 6.562 -6.498 -9.944 1.00 64.53 H new ATOM 0 HB2 TRP A 65 7.220 -8.586 -11.081 1.00 32.23 H new ATOM 0 HB3 TRP A 65 6.652 -7.961 -12.617 1.00 32.23 H new ATOM 0 HD1 TRP A 65 8.176 -5.946 -13.751 1.00 4.41 H new ATOM 0 HE1 TRP A 65 10.706 -5.479 -13.607 1.00 21.02 H new ATOM 0 HE3 TRP A 65 9.216 -8.733 -9.597 1.00 5.42 H new ATOM 0 HZ2 TRP A 65 12.841 -6.257 -11.964 1.00 32.42 H new ATOM 0 HZ3 TRP A 65 11.545 -8.834 -8.809 1.00 61.13 H new ATOM 0 HH2 TRP A 65 13.327 -7.614 -9.979 1.00 51.44 H new ATOM 994 N ALA A 66 5.418 -5.567 -12.905 1.00 54.23 N ATOM 995 CA ALA A 66 5.183 -4.446 -13.791 1.00 62.14 C ATOM 996 C ALA A 66 4.250 -3.431 -13.150 1.00 31.22 C ATOM 997 O ALA A 66 4.515 -2.248 -13.174 1.00 30.32 O ATOM 998 CB ALA A 66 4.603 -4.932 -15.108 1.00 23.25 C ATOM 0 H ALA A 66 5.125 -6.466 -13.288 1.00 54.23 H new ATOM 0 HA ALA A 66 6.138 -3.957 -13.982 1.00 62.14 H new ATOM 0 HB1 ALA A 66 4.431 -4.080 -15.766 1.00 23.25 H new ATOM 0 HB2 ALA A 66 5.303 -5.621 -15.582 1.00 23.25 H new ATOM 0 HB3 ALA A 66 3.659 -5.444 -14.923 1.00 23.25 H new ATOM 1004 N LEU A 67 3.198 -3.926 -12.523 1.00 42.54 N ATOM 1005 CA LEU A 67 2.167 -3.093 -11.911 1.00 5.53 C ATOM 1006 C LEU A 67 2.763 -2.206 -10.787 1.00 23.44 C ATOM 1007 O LEU A 67 2.454 -1.022 -10.689 1.00 23.32 O ATOM 1008 CB LEU A 67 1.068 -3.988 -11.341 1.00 64.01 C ATOM 1009 CG LEU A 67 -0.331 -3.389 -11.269 1.00 44.04 C ATOM 1010 CD1 LEU A 67 -0.943 -3.280 -12.652 1.00 12.03 C ATOM 1011 CD2 LEU A 67 -1.199 -4.193 -10.341 1.00 30.51 C ATOM 0 H LEU A 67 3.030 -4.927 -12.421 1.00 42.54 H new ATOM 0 HA LEU A 67 1.750 -2.436 -12.674 1.00 5.53 H new ATOM 0 HB2 LEU A 67 1.020 -4.894 -11.944 1.00 64.01 H new ATOM 0 HB3 LEU A 67 1.362 -4.290 -10.336 1.00 64.01 H new ATOM 0 HG LEU A 67 -0.257 -2.379 -10.865 1.00 44.04 H new ATOM 0 HD11 LEU A 67 -1.942 -2.850 -12.575 1.00 12.03 H new ATOM 0 HD12 LEU A 67 -0.319 -2.640 -13.276 1.00 12.03 H new ATOM 0 HD13 LEU A 67 -1.009 -4.272 -13.100 1.00 12.03 H new ATOM 0 HD21 LEU A 67 -2.195 -3.752 -10.301 1.00 30.51 H new ATOM 0 HD22 LEU A 67 -1.270 -5.218 -10.706 1.00 30.51 H new ATOM 0 HD23 LEU A 67 -0.762 -4.193 -9.343 1.00 30.51 H new ATOM 1023 N SER A 68 3.633 -2.787 -9.974 1.00 41.10 N ATOM 1024 CA SER A 68 4.307 -2.060 -8.888 1.00 63.22 C ATOM 1025 C SER A 68 5.299 -1.057 -9.458 1.00 55.14 C ATOM 1026 O SER A 68 5.535 -0.011 -8.863 1.00 23.31 O ATOM 1027 CB SER A 68 5.006 -3.057 -7.973 1.00 71.42 C ATOM 1028 OG SER A 68 4.083 -4.039 -7.530 1.00 61.15 O ATOM 0 H SER A 68 3.896 -3.770 -10.041 1.00 41.10 H new ATOM 0 HA SER A 68 3.569 -1.506 -8.308 1.00 63.22 H new ATOM 0 HB2 SER A 68 5.830 -3.534 -8.503 1.00 71.42 H new ATOM 0 HB3 SER A 68 5.436 -2.538 -7.117 1.00 71.42 H new ATOM 0 HG SER A 68 3.913 -4.678 -8.253 1.00 61.15 H new ATOM 1034 N ASN A 69 5.853 -1.370 -10.613 1.00 11.25 N ATOM 1035 CA ASN A 69 6.744 -0.449 -11.312 1.00 43.04 C ATOM 1036 C ASN A 69 5.942 0.718 -11.861 1.00 25.33 C ATOM 1037 O ASN A 69 6.376 1.852 -11.808 1.00 63.23 O ATOM 1038 CB ASN A 69 7.506 -1.148 -12.442 1.00 43.43 C ATOM 1039 CG ASN A 69 8.414 -0.190 -13.188 1.00 10.12 C ATOM 1040 OD1 ASN A 69 9.553 0.034 -12.791 1.00 51.55 O ATOM 1041 ND2 ASN A 69 7.939 0.352 -14.287 1.00 62.15 N ATOM 0 H ASN A 69 5.704 -2.258 -11.093 1.00 11.25 H new ATOM 0 HA ASN A 69 7.482 -0.082 -10.598 1.00 43.04 H new ATOM 0 HB2 ASN A 69 8.099 -1.964 -12.029 1.00 43.43 H new ATOM 0 HB3 ASN A 69 6.795 -1.592 -13.139 1.00 43.43 H new ATOM 0 HD21 ASN A 69 8.522 0.981 -14.839 1.00 62.15 H new ATOM 0 HD22 ASN A 69 6.987 0.144 -14.588 1.00 62.15 H new ATOM 1048 N ILE A 70 4.754 0.414 -12.381 1.00 24.20 N ATOM 1049 CA ILE A 70 3.800 1.431 -12.854 1.00 3.43 C ATOM 1050 C ILE A 70 3.480 2.358 -11.691 1.00 75.53 C ATOM 1051 O ILE A 70 3.459 3.588 -11.806 1.00 52.50 O ATOM 1052 CB ILE A 70 2.471 0.758 -13.328 1.00 30.25 C ATOM 1053 CG1 ILE A 70 2.713 -0.204 -14.504 1.00 5.41 C ATOM 1054 CG2 ILE A 70 1.387 1.778 -13.660 1.00 72.41 C ATOM 1055 CD1 ILE A 70 3.379 0.422 -15.708 1.00 10.41 C ATOM 0 H ILE A 70 4.420 -0.544 -12.489 1.00 24.20 H new ATOM 0 HA ILE A 70 4.240 1.977 -13.689 1.00 3.43 H new ATOM 0 HB ILE A 70 2.103 0.170 -12.487 1.00 30.25 H new ATOM 0 HG12 ILE A 70 3.329 -1.033 -14.156 1.00 5.41 H new ATOM 0 HG13 ILE A 70 1.756 -0.625 -14.813 1.00 5.41 H new ATOM 0 HG21 ILE A 70 0.485 1.258 -13.984 1.00 72.41 H new ATOM 0 HG22 ILE A 70 1.164 2.374 -12.775 1.00 72.41 H new ATOM 0 HG23 ILE A 70 1.735 2.432 -14.459 1.00 72.41 H new ATOM 0 HD11 ILE A 70 3.508 -0.331 -16.485 1.00 10.41 H new ATOM 0 HD12 ILE A 70 2.756 1.232 -16.088 1.00 10.41 H new ATOM 0 HD13 ILE A 70 4.353 0.817 -15.420 1.00 10.41 H new ATOM 1067 N ALA A 71 3.286 1.739 -10.568 1.00 34.24 N ATOM 1068 CA ALA A 71 2.987 2.393 -9.352 1.00 13.45 C ATOM 1069 C ALA A 71 4.131 3.305 -8.883 1.00 34.03 C ATOM 1070 O ALA A 71 3.899 4.293 -8.228 1.00 61.42 O ATOM 1071 CB ALA A 71 2.669 1.362 -8.321 1.00 3.02 C ATOM 0 H ALA A 71 3.336 0.724 -10.480 1.00 34.24 H new ATOM 0 HA ALA A 71 2.126 3.042 -9.509 1.00 13.45 H new ATOM 0 HB1 ALA A 71 2.436 1.852 -7.376 1.00 3.02 H new ATOM 0 HB2 ALA A 71 1.810 0.775 -8.647 1.00 3.02 H new ATOM 0 HB3 ALA A 71 3.528 0.705 -8.187 1.00 3.02 H new ATOM 1077 N SER A 72 5.351 2.976 -9.202 1.00 22.53 N ATOM 1078 CA SER A 72 6.453 3.833 -8.829 1.00 3.21 C ATOM 1079 C SER A 72 6.847 4.722 -9.994 1.00 32.41 C ATOM 1080 O SER A 72 7.736 5.570 -9.880 1.00 1.22 O ATOM 1081 CB SER A 72 7.638 2.994 -8.330 1.00 0.42 C ATOM 1082 OG SER A 72 7.957 1.943 -9.238 1.00 40.00 O ATOM 0 H SER A 72 5.611 2.132 -9.713 1.00 22.53 H new ATOM 0 HA SER A 72 6.139 4.480 -8.010 1.00 3.21 H new ATOM 0 HB2 SER A 72 8.508 3.636 -8.196 1.00 0.42 H new ATOM 0 HB3 SER A 72 7.400 2.572 -7.354 1.00 0.42 H new ATOM 0 HG SER A 72 8.610 2.264 -9.894 1.00 40.00 H new ATOM 1088 N GLY A 73 6.141 4.546 -11.092 1.00 43.02 N ATOM 1089 CA GLY A 73 6.459 5.200 -12.308 1.00 34.14 C ATOM 1090 C GLY A 73 6.189 6.675 -12.304 1.00 11.33 C ATOM 1091 O GLY A 73 7.079 7.469 -12.600 1.00 52.04 O ATOM 0 H GLY A 73 5.326 3.936 -11.148 1.00 43.02 H new ATOM 0 HA2 GLY A 73 7.513 5.036 -12.530 1.00 34.14 H new ATOM 0 HA3 GLY A 73 5.888 4.740 -13.115 1.00 34.14 H new ATOM 1095 N GLY A 74 4.982 7.058 -12.006 1.00 11.20 N ATOM 1096 CA GLY A 74 4.674 8.480 -12.014 1.00 2.05 C ATOM 1097 C GLY A 74 3.251 8.752 -11.668 1.00 44.33 C ATOM 1098 O GLY A 74 2.429 7.875 -11.778 1.00 70.30 O ATOM 0 H GLY A 74 4.210 6.439 -11.760 1.00 11.20 H new ATOM 0 HA2 GLY A 74 5.323 8.994 -11.305 1.00 2.05 H new ATOM 0 HA3 GLY A 74 4.891 8.891 -13.000 1.00 2.05 H new ATOM 1102 N ASN A 75 2.951 9.979 -11.318 1.00 30.41 N ATOM 1103 CA ASN A 75 1.623 10.380 -10.821 1.00 3.14 C ATOM 1104 C ASN A 75 0.545 10.200 -11.891 1.00 14.22 C ATOM 1105 O ASN A 75 -0.613 9.909 -11.573 1.00 32.22 O ATOM 1106 CB ASN A 75 1.667 11.833 -10.382 1.00 54.14 C ATOM 1107 CG ASN A 75 0.626 12.248 -9.340 1.00 2.02 C ATOM 1108 OD1 ASN A 75 -0.494 11.562 -9.246 1.00 53.12 O flip ATOM 1109 ND2 ASN A 75 0.861 13.181 -8.587 1.00 74.23 N flip ATOM 0 H ASN A 75 3.618 10.749 -11.364 1.00 30.41 H new ATOM 0 HA ASN A 75 1.368 9.740 -9.977 1.00 3.14 H new ATOM 0 HB2 ASN A 75 2.658 12.041 -9.980 1.00 54.14 H new ATOM 0 HB3 ASN A 75 1.542 12.463 -11.263 1.00 54.14 H new ATOM 0 HD21 ASN A 75 1.734 13.700 -8.676 1.00 74.23 H new ATOM 0 HD22 ASN A 75 0.184 13.441 -7.870 1.00 74.23 H new ATOM 1116 N GLU A 76 0.903 10.391 -13.134 1.00 11.12 N ATOM 1117 CA GLU A 76 -0.035 10.168 -14.229 1.00 45.44 C ATOM 1118 C GLU A 76 -0.184 8.673 -14.441 1.00 41.31 C ATOM 1119 O GLU A 76 -1.290 8.139 -14.547 1.00 55.21 O ATOM 1120 CB GLU A 76 0.451 10.836 -15.535 1.00 33.13 C ATOM 1121 CG GLU A 76 0.391 12.372 -15.570 1.00 33.42 C ATOM 1122 CD GLU A 76 1.162 13.041 -14.459 1.00 34.41 C ATOM 1123 OE1 GLU A 76 2.386 12.885 -14.395 1.00 1.12 O ATOM 1124 OE2 GLU A 76 0.544 13.738 -13.635 1.00 72.35 O1- ATOM 0 H GLU A 76 1.831 10.699 -13.424 1.00 11.12 H new ATOM 0 HA GLU A 76 -0.994 10.615 -13.967 1.00 45.44 H new ATOM 0 HB2 GLU A 76 1.481 10.528 -15.715 1.00 33.13 H new ATOM 0 HB3 GLU A 76 -0.146 10.450 -16.361 1.00 33.13 H new ATOM 0 HG2 GLU A 76 0.779 12.719 -16.528 1.00 33.42 H new ATOM 0 HG3 GLU A 76 -0.651 12.686 -15.516 1.00 33.42 H new ATOM 1131 N GLN A 77 0.945 8.011 -14.405 1.00 42.31 N ATOM 1132 CA GLN A 77 1.052 6.585 -14.632 1.00 14.11 C ATOM 1133 C GLN A 77 0.315 5.751 -13.550 1.00 1.42 C ATOM 1134 O GLN A 77 -0.427 4.826 -13.871 1.00 55.24 O ATOM 1135 CB GLN A 77 2.546 6.245 -14.775 1.00 50.31 C ATOM 1136 CG GLN A 77 2.931 4.799 -14.621 1.00 21.33 C ATOM 1137 CD GLN A 77 4.360 4.514 -15.050 1.00 60.33 C ATOM 1138 OE1 GLN A 77 4.688 3.420 -15.440 1.00 74.54 O ATOM 1139 NE2 GLN A 77 5.195 5.515 -15.046 1.00 3.22 N ATOM 0 H GLN A 77 1.841 8.458 -14.212 1.00 42.31 H new ATOM 0 HA GLN A 77 0.540 6.310 -15.554 1.00 14.11 H new ATOM 0 HB2 GLN A 77 2.879 6.582 -15.757 1.00 50.31 H new ATOM 0 HB3 GLN A 77 3.098 6.824 -14.035 1.00 50.31 H new ATOM 0 HG2 GLN A 77 2.805 4.505 -13.579 1.00 21.33 H new ATOM 0 HG3 GLN A 77 2.251 4.183 -15.210 1.00 21.33 H new ATOM 0 HE21 GLN A 77 4.893 6.430 -14.711 1.00 3.22 H new ATOM 0 HE22 GLN A 77 6.151 5.383 -15.378 1.00 3.22 H new ATOM 1148 N ILE A 78 0.477 6.130 -12.293 1.00 32.20 N ATOM 1149 CA ILE A 78 -0.164 5.437 -11.165 1.00 22.14 C ATOM 1150 C ILE A 78 -1.683 5.559 -11.241 1.00 74.42 C ATOM 1151 O ILE A 78 -2.414 4.633 -10.950 1.00 51.24 O ATOM 1152 CB ILE A 78 0.289 6.026 -9.784 1.00 4.45 C ATOM 1153 CG1 ILE A 78 -0.148 7.486 -9.645 1.00 2.13 C ATOM 1154 CG2 ILE A 78 1.779 5.908 -9.594 1.00 32.42 C ATOM 1155 CD1 ILE A 78 0.351 8.180 -8.418 1.00 65.33 C ATOM 0 H ILE A 78 1.054 6.924 -12.016 1.00 32.20 H new ATOM 0 HA ILE A 78 0.141 4.393 -11.237 1.00 22.14 H new ATOM 0 HB ILE A 78 -0.198 5.439 -9.005 1.00 4.45 H new ATOM 0 HG12 ILE A 78 0.194 8.037 -10.521 1.00 2.13 H new ATOM 0 HG13 ILE A 78 -1.237 7.526 -9.649 1.00 2.13 H new ATOM 0 HG21 ILE A 78 2.057 6.326 -8.626 1.00 32.42 H new ATOM 0 HG22 ILE A 78 2.069 4.858 -9.632 1.00 32.42 H new ATOM 0 HG23 ILE A 78 2.291 6.454 -10.386 1.00 32.42 H new ATOM 0 HD11 ILE A 78 -0.011 9.208 -8.409 1.00 65.33 H new ATOM 0 HD12 ILE A 78 -0.013 7.659 -7.532 1.00 65.33 H new ATOM 0 HD13 ILE A 78 1.441 8.179 -8.417 1.00 65.33 H new ATOM 1167 N GLN A 79 -2.133 6.700 -11.683 1.00 62.24 N ATOM 1168 CA GLN A 79 -3.513 7.035 -11.645 1.00 62.14 C ATOM 1169 C GLN A 79 -4.289 6.370 -12.762 1.00 13.05 C ATOM 1170 O GLN A 79 -5.448 6.013 -12.582 1.00 44.22 O ATOM 1171 CB GLN A 79 -3.658 8.562 -11.596 1.00 73.22 C ATOM 1172 CG GLN A 79 -5.077 9.099 -11.739 1.00 61.55 C ATOM 1173 CD GLN A 79 -6.058 8.545 -10.706 1.00 15.11 C ATOM 1174 OE1 GLN A 79 -7.232 8.411 -10.992 1.00 40.41 O ATOM 1175 NE2 GLN A 79 -5.598 8.240 -9.506 1.00 24.22 N ATOM 0 H GLN A 79 -1.538 7.426 -12.083 1.00 62.24 H new ATOM 0 HA GLN A 79 -3.965 6.638 -10.736 1.00 62.14 H new ATOM 0 HB2 GLN A 79 -3.249 8.917 -10.650 1.00 73.22 H new ATOM 0 HB3 GLN A 79 -3.046 8.992 -12.389 1.00 73.22 H new ATOM 0 HG2 GLN A 79 -5.053 10.186 -11.656 1.00 61.55 H new ATOM 0 HG3 GLN A 79 -5.445 8.863 -12.738 1.00 61.55 H new ATOM 0 HE21 GLN A 79 -4.608 8.362 -9.293 1.00 24.22 H new ATOM 0 HE22 GLN A 79 -6.233 7.882 -8.792 1.00 24.22 H new ATOM 1184 N ALA A 80 -3.631 6.138 -13.872 1.00 30.54 N ATOM 1185 CA ALA A 80 -4.250 5.486 -15.008 1.00 11.34 C ATOM 1186 C ALA A 80 -4.715 4.066 -14.649 1.00 10.23 C ATOM 1187 O ALA A 80 -5.770 3.619 -15.103 1.00 32.13 O ATOM 1188 CB ALA A 80 -3.295 5.469 -16.184 1.00 54.13 C ATOM 0 H ALA A 80 -2.654 6.394 -14.016 1.00 30.54 H new ATOM 0 HA ALA A 80 -5.135 6.055 -15.291 1.00 11.34 H new ATOM 0 HB1 ALA A 80 -3.771 4.977 -17.032 1.00 54.13 H new ATOM 0 HB2 ALA A 80 -3.036 6.492 -16.457 1.00 54.13 H new ATOM 0 HB3 ALA A 80 -2.390 4.926 -15.910 1.00 54.13 H new ATOM 1194 N VAL A 81 -3.951 3.372 -13.809 1.00 4.31 N ATOM 1195 CA VAL A 81 -4.318 2.051 -13.405 1.00 34.42 C ATOM 1196 C VAL A 81 -5.320 2.091 -12.214 1.00 63.43 C ATOM 1197 O VAL A 81 -6.193 1.236 -12.101 1.00 11.34 O ATOM 1198 CB VAL A 81 -3.061 1.183 -13.097 1.00 55.05 C ATOM 1199 CG1 VAL A 81 -2.309 1.627 -11.849 1.00 23.30 C ATOM 1200 CG2 VAL A 81 -3.414 -0.269 -13.037 1.00 73.22 C ATOM 0 H VAL A 81 -3.080 3.716 -13.405 1.00 4.31 H new ATOM 0 HA VAL A 81 -4.832 1.570 -14.237 1.00 34.42 H new ATOM 0 HB VAL A 81 -2.372 1.337 -13.928 1.00 55.05 H new ATOM 0 HG11 VAL A 81 -1.446 0.979 -11.695 1.00 23.30 H new ATOM 0 HG12 VAL A 81 -1.973 2.656 -11.974 1.00 23.30 H new ATOM 0 HG13 VAL A 81 -2.970 1.564 -10.984 1.00 23.30 H new ATOM 0 HG21 VAL A 81 -2.519 -0.852 -12.821 1.00 73.22 H new ATOM 0 HG22 VAL A 81 -4.152 -0.432 -12.252 1.00 73.22 H new ATOM 0 HG23 VAL A 81 -3.829 -0.583 -13.995 1.00 73.22 H new ATOM 1210 N ILE A 82 -5.214 3.125 -11.362 1.00 12.13 N ATOM 1211 CA ILE A 82 -6.150 3.318 -10.229 1.00 23.33 C ATOM 1212 C ILE A 82 -7.546 3.596 -10.747 1.00 61.42 C ATOM 1213 O ILE A 82 -8.535 3.117 -10.191 1.00 53.25 O ATOM 1214 CB ILE A 82 -5.700 4.480 -9.302 1.00 0.31 C ATOM 1215 CG1 ILE A 82 -4.366 4.144 -8.634 1.00 11.53 C ATOM 1216 CG2 ILE A 82 -6.766 4.834 -8.267 1.00 42.20 C ATOM 1217 CD1 ILE A 82 -4.313 2.790 -7.976 1.00 22.31 C ATOM 0 H ILE A 82 -4.492 3.842 -11.432 1.00 12.13 H new ATOM 0 HA ILE A 82 -6.150 2.398 -9.644 1.00 23.33 H new ATOM 0 HB ILE A 82 -5.561 5.364 -9.924 1.00 0.31 H new ATOM 0 HG12 ILE A 82 -3.576 4.200 -9.383 1.00 11.53 H new ATOM 0 HG13 ILE A 82 -4.149 4.905 -7.885 1.00 11.53 H new ATOM 0 HG21 ILE A 82 -6.408 5.651 -7.641 1.00 42.20 H new ATOM 0 HG22 ILE A 82 -7.680 5.140 -8.776 1.00 42.20 H new ATOM 0 HG23 ILE A 82 -6.972 3.963 -7.644 1.00 42.20 H new ATOM 0 HD11 ILE A 82 -3.330 2.640 -7.530 1.00 22.31 H new ATOM 0 HD12 ILE A 82 -5.076 2.733 -7.200 1.00 22.31 H new ATOM 0 HD13 ILE A 82 -4.495 2.016 -8.721 1.00 22.31 H new ATOM 1229 N ASP A 83 -7.604 4.327 -11.846 1.00 23.31 N ATOM 1230 CA ASP A 83 -8.854 4.664 -12.545 1.00 12.45 C ATOM 1231 C ASP A 83 -9.649 3.402 -12.917 1.00 20.33 C ATOM 1232 O ASP A 83 -10.870 3.435 -13.032 1.00 25.22 O ATOM 1233 CB ASP A 83 -8.529 5.486 -13.805 1.00 40.42 C ATOM 1234 CG ASP A 83 -9.741 5.837 -14.660 1.00 1.10 C ATOM 1235 OD1 ASP A 83 -10.471 6.791 -14.334 1.00 42.52 O ATOM 1236 OD2 ASP A 83 -9.939 5.194 -15.723 1.00 52.34 O1- ATOM 0 H ASP A 83 -6.774 4.715 -12.294 1.00 23.31 H new ATOM 0 HA ASP A 83 -9.477 5.255 -11.874 1.00 12.45 H new ATOM 0 HB2 ASP A 83 -8.033 6.409 -13.504 1.00 40.42 H new ATOM 0 HB3 ASP A 83 -7.819 4.927 -14.415 1.00 40.42 H new ATOM 1241 N ALA A 84 -8.958 2.284 -13.046 1.00 1.13 N ATOM 1242 CA ALA A 84 -9.590 1.028 -13.405 1.00 20.22 C ATOM 1243 C ALA A 84 -9.857 0.162 -12.165 1.00 54.33 C ATOM 1244 O ALA A 84 -10.258 -0.995 -12.284 1.00 44.15 O ATOM 1245 CB ALA A 84 -8.720 0.280 -14.389 1.00 15.32 C ATOM 0 H ALA A 84 -7.950 2.221 -12.906 1.00 1.13 H new ATOM 0 HA ALA A 84 -10.551 1.250 -13.869 1.00 20.22 H new ATOM 0 HB1 ALA A 84 -9.199 -0.662 -14.655 1.00 15.32 H new ATOM 0 HB2 ALA A 84 -8.583 0.884 -15.286 1.00 15.32 H new ATOM 0 HB3 ALA A 84 -7.749 0.078 -13.936 1.00 15.32 H new ATOM 1251 N GLY A 85 -9.653 0.731 -10.988 1.00 74.35 N ATOM 1252 CA GLY A 85 -9.866 0.003 -9.754 1.00 3.04 C ATOM 1253 C GLY A 85 -8.792 -1.028 -9.546 1.00 23.22 C ATOM 1254 O GLY A 85 -9.043 -2.232 -9.629 1.00 40.54 O ATOM 0 H GLY A 85 -9.340 1.694 -10.864 1.00 74.35 H new ATOM 0 HA2 GLY A 85 -9.876 0.698 -8.914 1.00 3.04 H new ATOM 0 HA3 GLY A 85 -10.842 -0.482 -9.777 1.00 3.04 H new ATOM 1258 N ALA A 86 -7.595 -0.563 -9.239 1.00 43.31 N ATOM 1259 CA ALA A 86 -6.449 -1.448 -9.159 1.00 62.12 C ATOM 1260 C ALA A 86 -6.356 -1.985 -7.782 1.00 54.11 C ATOM 1261 O ALA A 86 -5.836 -3.068 -7.525 1.00 52.01 O ATOM 1262 CB ALA A 86 -5.175 -0.713 -9.528 1.00 31.11 C ATOM 0 H ALA A 86 -7.392 0.417 -9.042 1.00 43.31 H new ATOM 0 HA ALA A 86 -6.575 -2.268 -9.866 1.00 62.12 H new ATOM 0 HB1 ALA A 86 -4.328 -1.396 -9.461 1.00 31.11 H new ATOM 0 HB2 ALA A 86 -5.256 -0.334 -10.547 1.00 31.11 H new ATOM 0 HB3 ALA A 86 -5.024 0.120 -8.842 1.00 31.11 H new ATOM 1268 N LEU A 87 -6.908 -1.211 -6.910 1.00 4.40 N ATOM 1269 CA LEU A 87 -6.854 -1.433 -5.522 1.00 21.04 C ATOM 1270 C LEU A 87 -7.604 -2.729 -5.129 1.00 1.41 C ATOM 1271 O LEU A 87 -7.017 -3.588 -4.463 1.00 61.43 O ATOM 1272 CB LEU A 87 -7.364 -0.202 -4.753 1.00 42.21 C ATOM 1273 CG LEU A 87 -6.738 1.161 -5.051 1.00 55.45 C ATOM 1274 CD1 LEU A 87 -5.234 1.097 -5.124 1.00 54.31 C ATOM 1275 CD2 LEU A 87 -7.364 1.819 -6.257 1.00 10.35 C ATOM 0 H LEU A 87 -7.429 -0.373 -7.166 1.00 4.40 H new ATOM 0 HA LEU A 87 -5.812 -1.580 -5.238 1.00 21.04 H new ATOM 0 HB2 LEU A 87 -8.436 -0.120 -4.934 1.00 42.21 H new ATOM 0 HB3 LEU A 87 -7.234 -0.400 -3.689 1.00 42.21 H new ATOM 0 HG LEU A 87 -6.964 1.808 -4.203 1.00 55.45 H new ATOM 0 HD11 LEU A 87 -4.838 2.090 -5.338 1.00 54.31 H new ATOM 0 HD12 LEU A 87 -4.838 0.745 -4.171 1.00 54.31 H new ATOM 0 HD13 LEU A 87 -4.937 0.410 -5.916 1.00 54.31 H new ATOM 0 HD21 LEU A 87 -6.889 2.784 -6.432 1.00 10.35 H new ATOM 0 HD22 LEU A 87 -7.226 1.183 -7.131 1.00 10.35 H new ATOM 0 HD23 LEU A 87 -8.429 1.966 -6.080 1.00 10.35 H new ATOM 1287 N PRO A 88 -8.911 -2.914 -5.559 1.00 31.11 N ATOM 1288 CA PRO A 88 -9.671 -4.166 -5.337 1.00 73.13 C ATOM 1289 C PRO A 88 -8.903 -5.424 -5.771 1.00 21.30 C ATOM 1290 O PRO A 88 -9.032 -6.491 -5.155 1.00 52.54 O ATOM 1291 CB PRO A 88 -10.861 -3.966 -6.259 1.00 34.53 C ATOM 1292 CG PRO A 88 -11.141 -2.542 -6.133 1.00 73.53 C ATOM 1293 CD PRO A 88 -9.800 -1.906 -6.219 1.00 64.43 C ATOM 0 HA PRO A 88 -9.903 -4.326 -4.284 1.00 73.13 H new ATOM 0 HB2 PRO A 88 -10.625 -4.241 -7.287 1.00 34.53 H new ATOM 0 HB3 PRO A 88 -11.714 -4.573 -5.954 1.00 34.53 H new ATOM 0 HG2 PRO A 88 -11.801 -2.193 -6.927 1.00 73.53 H new ATOM 0 HG3 PRO A 88 -11.632 -2.313 -5.187 1.00 73.53 H new ATOM 0 HD2 PRO A 88 -9.505 -1.722 -7.252 1.00 64.43 H new ATOM 0 HD3 PRO A 88 -9.774 -0.946 -5.704 1.00 64.43 H new ATOM 1301 N ALA A 89 -8.096 -5.288 -6.803 1.00 21.24 N ATOM 1302 CA ALA A 89 -7.351 -6.402 -7.329 1.00 23.23 C ATOM 1303 C ALA A 89 -6.205 -6.803 -6.408 1.00 71.13 C ATOM 1304 O ALA A 89 -5.977 -7.972 -6.185 1.00 52.43 O ATOM 1305 CB ALA A 89 -6.844 -6.103 -8.728 1.00 12.51 C ATOM 0 H ALA A 89 -7.942 -4.407 -7.294 1.00 21.24 H new ATOM 0 HA ALA A 89 -8.033 -7.251 -7.387 1.00 23.23 H new ATOM 0 HB1 ALA A 89 -6.284 -6.960 -9.103 1.00 12.51 H new ATOM 0 HB2 ALA A 89 -7.689 -5.905 -9.387 1.00 12.51 H new ATOM 0 HB3 ALA A 89 -6.193 -5.229 -8.700 1.00 12.51 H new ATOM 1311 N LEU A 90 -5.522 -5.850 -5.819 1.00 71.34 N ATOM 1312 CA LEU A 90 -4.375 -6.209 -5.000 1.00 33.35 C ATOM 1313 C LEU A 90 -4.813 -6.617 -3.614 1.00 74.44 C ATOM 1314 O LEU A 90 -4.199 -7.474 -2.991 1.00 63.40 O ATOM 1315 CB LEU A 90 -3.331 -5.097 -4.952 1.00 31.34 C ATOM 1316 CG LEU A 90 -2.947 -4.515 -6.302 1.00 3.21 C ATOM 1317 CD1 LEU A 90 -2.028 -3.338 -6.116 1.00 5.30 C ATOM 1318 CD2 LEU A 90 -2.290 -5.577 -7.169 1.00 41.25 C ATOM 0 H LEU A 90 -5.725 -4.852 -5.883 1.00 71.34 H new ATOM 0 HA LEU A 90 -3.895 -7.067 -5.470 1.00 33.35 H new ATOM 0 HB2 LEU A 90 -3.708 -4.292 -4.321 1.00 31.34 H new ATOM 0 HB3 LEU A 90 -2.432 -5.484 -4.472 1.00 31.34 H new ATOM 0 HG LEU A 90 -3.850 -4.173 -6.807 1.00 3.21 H new ATOM 0 HD11 LEU A 90 -1.759 -2.929 -7.090 1.00 5.30 H new ATOM 0 HD12 LEU A 90 -2.533 -2.572 -5.527 1.00 5.30 H new ATOM 0 HD13 LEU A 90 -1.126 -3.660 -5.596 1.00 5.30 H new ATOM 0 HD21 LEU A 90 -2.021 -5.145 -8.133 1.00 41.25 H new ATOM 0 HD22 LEU A 90 -1.392 -5.947 -6.674 1.00 41.25 H new ATOM 0 HD23 LEU A 90 -2.985 -6.402 -7.323 1.00 41.25 H new ATOM 1330 N VAL A 91 -5.923 -6.058 -3.156 1.00 10.14 N ATOM 1331 CA VAL A 91 -6.444 -6.406 -1.847 1.00 72.02 C ATOM 1332 C VAL A 91 -7.047 -7.836 -1.862 1.00 73.55 C ATOM 1333 O VAL A 91 -7.165 -8.484 -0.820 1.00 52.05 O ATOM 1334 CB VAL A 91 -7.469 -5.350 -1.307 1.00 71.12 C ATOM 1335 CG1 VAL A 91 -8.741 -5.322 -2.122 1.00 60.55 C ATOM 1336 CG2 VAL A 91 -7.765 -5.550 0.179 1.00 31.13 C ATOM 0 H VAL A 91 -6.474 -5.368 -3.667 1.00 10.14 H new ATOM 0 HA VAL A 91 -5.605 -6.396 -1.151 1.00 72.02 H new ATOM 0 HB VAL A 91 -6.995 -4.374 -1.417 1.00 71.12 H new ATOM 0 HG11 VAL A 91 -9.420 -4.576 -1.710 1.00 60.55 H new ATOM 0 HG12 VAL A 91 -8.505 -5.068 -3.155 1.00 60.55 H new ATOM 0 HG13 VAL A 91 -9.216 -6.303 -2.089 1.00 60.55 H new ATOM 0 HG21 VAL A 91 -8.480 -4.797 0.512 1.00 31.13 H new ATOM 0 HG22 VAL A 91 -8.185 -6.544 0.336 1.00 31.13 H new ATOM 0 HG23 VAL A 91 -6.842 -5.452 0.750 1.00 31.13 H new ATOM 1346 N GLN A 92 -7.389 -8.351 -3.049 1.00 51.15 N ATOM 1347 CA GLN A 92 -7.898 -9.719 -3.124 1.00 62.21 C ATOM 1348 C GLN A 92 -6.715 -10.677 -3.187 1.00 12.11 C ATOM 1349 O GLN A 92 -6.734 -11.746 -2.598 1.00 12.23 O ATOM 1350 CB GLN A 92 -8.835 -9.947 -4.330 1.00 10.41 C ATOM 1351 CG GLN A 92 -8.143 -9.943 -5.677 1.00 22.01 C ATOM 1352 CD GLN A 92 -9.077 -10.108 -6.846 1.00 32.02 C ATOM 1353 OE1 GLN A 92 -10.237 -9.699 -6.807 1.00 41.04 O ATOM 1354 NE2 GLN A 92 -8.590 -10.715 -7.890 1.00 71.22 N ATOM 0 H GLN A 92 -7.325 -7.859 -3.940 1.00 51.15 H new ATOM 0 HA GLN A 92 -8.497 -9.904 -2.232 1.00 62.21 H new ATOM 0 HB2 GLN A 92 -9.345 -10.902 -4.201 1.00 10.41 H new ATOM 0 HB3 GLN A 92 -9.602 -9.173 -4.328 1.00 10.41 H new ATOM 0 HG2 GLN A 92 -7.597 -9.006 -5.791 1.00 22.01 H new ATOM 0 HG3 GLN A 92 -7.406 -10.746 -5.698 1.00 22.01 H new ATOM 0 HE21 GLN A 92 -7.623 -11.040 -7.886 1.00 71.22 H new ATOM 0 HE22 GLN A 92 -9.175 -10.865 -8.712 1.00 71.22 H new ATOM 1363 N LEU A 93 -5.647 -10.235 -3.858 1.00 15.13 N ATOM 1364 CA LEU A 93 -4.454 -10.991 -4.023 1.00 74.13 C ATOM 1365 C LEU A 93 -3.671 -11.046 -2.723 1.00 23.13 C ATOM 1366 O LEU A 93 -2.788 -11.876 -2.547 1.00 23.34 O ATOM 1367 CB LEU A 93 -3.641 -10.351 -5.117 1.00 10.23 C ATOM 1368 CG LEU A 93 -4.229 -10.443 -6.526 1.00 51.41 C ATOM 1369 CD1 LEU A 93 -3.436 -9.588 -7.488 1.00 20.22 C ATOM 1370 CD2 LEU A 93 -4.258 -11.886 -7.004 1.00 34.22 C ATOM 0 H LEU A 93 -5.612 -9.318 -4.302 1.00 15.13 H new ATOM 0 HA LEU A 93 -4.696 -12.018 -4.297 1.00 74.13 H new ATOM 0 HB2 LEU A 93 -3.500 -9.299 -4.871 1.00 10.23 H new ATOM 0 HB3 LEU A 93 -2.653 -10.811 -5.126 1.00 10.23 H new ATOM 0 HG LEU A 93 -5.253 -10.071 -6.492 1.00 51.41 H new ATOM 0 HD11 LEU A 93 -3.869 -9.666 -8.485 1.00 20.22 H new ATOM 0 HD12 LEU A 93 -3.465 -8.549 -7.160 1.00 20.22 H new ATOM 0 HD13 LEU A 93 -2.402 -9.932 -7.513 1.00 20.22 H new ATOM 0 HD21 LEU A 93 -4.680 -11.928 -8.008 1.00 34.22 H new ATOM 0 HD22 LEU A 93 -3.244 -12.285 -7.020 1.00 34.22 H new ATOM 0 HD23 LEU A 93 -4.871 -12.481 -6.327 1.00 34.22 H new ATOM 1382 N LEU A 94 -4.039 -10.167 -1.809 1.00 12.12 N ATOM 1383 CA LEU A 94 -3.482 -10.106 -0.467 1.00 0.24 C ATOM 1384 C LEU A 94 -3.920 -11.381 0.290 1.00 1.21 C ATOM 1385 O LEU A 94 -3.316 -11.783 1.267 1.00 70.34 O ATOM 1386 CB LEU A 94 -4.017 -8.798 0.207 1.00 3.30 C ATOM 1387 CG LEU A 94 -3.340 -8.230 1.492 1.00 23.33 C ATOM 1388 CD1 LEU A 94 -3.517 -9.111 2.718 1.00 25.50 C ATOM 1389 CD2 LEU A 94 -1.874 -7.919 1.244 1.00 34.44 C ATOM 0 H LEU A 94 -4.751 -9.457 -1.982 1.00 12.12 H new ATOM 0 HA LEU A 94 -2.393 -10.072 -0.464 1.00 0.24 H new ATOM 0 HB2 LEU A 94 -3.984 -8.012 -0.547 1.00 3.30 H new ATOM 0 HB3 LEU A 94 -5.067 -8.967 0.446 1.00 3.30 H new ATOM 0 HG LEU A 94 -3.862 -7.300 1.719 1.00 23.33 H new ATOM 0 HD11 LEU A 94 -3.019 -8.651 3.572 1.00 25.50 H new ATOM 0 HD12 LEU A 94 -4.579 -9.224 2.935 1.00 25.50 H new ATOM 0 HD13 LEU A 94 -3.079 -10.091 2.528 1.00 25.50 H new ATOM 0 HD21 LEU A 94 -1.426 -7.524 2.156 1.00 34.44 H new ATOM 0 HD22 LEU A 94 -1.354 -8.830 0.949 1.00 34.44 H new ATOM 0 HD23 LEU A 94 -1.789 -7.179 0.448 1.00 34.44 H new ATOM 1401 N SER A 95 -4.938 -12.044 -0.229 1.00 52.43 N ATOM 1402 CA SER A 95 -5.447 -13.257 0.369 1.00 42.23 C ATOM 1403 C SER A 95 -4.643 -14.487 -0.110 1.00 41.23 C ATOM 1404 O SER A 95 -5.002 -15.627 0.184 1.00 33.23 O ATOM 1405 CB SER A 95 -6.912 -13.422 -0.007 1.00 64.13 C ATOM 1406 OG SER A 95 -7.626 -12.205 0.194 1.00 71.34 O ATOM 0 H SER A 95 -5.431 -11.755 -1.074 1.00 52.43 H new ATOM 0 HA SER A 95 -5.346 -13.185 1.452 1.00 42.23 H new ATOM 0 HB2 SER A 95 -6.992 -13.728 -1.050 1.00 64.13 H new ATOM 0 HB3 SER A 95 -7.359 -14.215 0.593 1.00 64.13 H new ATOM 0 HG SER A 95 -7.592 -11.667 -0.624 1.00 71.34 H new ATOM 1412 N SER A 96 -3.566 -14.260 -0.848 1.00 1.14 N ATOM 1413 CA SER A 96 -2.745 -15.352 -1.306 1.00 4.54 C ATOM 1414 C SER A 96 -1.929 -15.890 -0.134 1.00 45.21 C ATOM 1415 O SER A 96 -1.512 -15.124 0.723 1.00 52.41 O ATOM 1416 CB SER A 96 -1.827 -14.896 -2.442 1.00 73.31 C ATOM 1417 OG SER A 96 -2.589 -14.412 -3.545 1.00 12.31 O ATOM 0 H SER A 96 -3.249 -13.334 -1.136 1.00 1.14 H new ATOM 0 HA SER A 96 -3.383 -16.146 -1.694 1.00 4.54 H new ATOM 0 HB2 SER A 96 -1.159 -14.113 -2.084 1.00 73.31 H new ATOM 0 HB3 SER A 96 -1.199 -15.727 -2.764 1.00 73.31 H new ATOM 0 HG SER A 96 -2.811 -13.469 -3.400 1.00 12.31 H new ATOM 1423 N PRO A 97 -1.760 -17.209 -0.040 1.00 2.00 N ATOM 1424 CA PRO A 97 -0.972 -17.825 1.030 1.00 34.42 C ATOM 1425 C PRO A 97 0.487 -17.341 1.056 1.00 33.45 C ATOM 1426 O PRO A 97 1.122 -17.331 2.113 1.00 2.22 O ATOM 1427 CB PRO A 97 -1.042 -19.332 0.730 1.00 4.03 C ATOM 1428 CG PRO A 97 -1.534 -19.435 -0.675 1.00 21.00 C ATOM 1429 CD PRO A 97 -2.364 -18.211 -0.922 1.00 10.05 C ATOM 0 HA PRO A 97 -1.367 -17.561 2.011 1.00 34.42 H new ATOM 0 HB2 PRO A 97 -0.064 -19.800 0.839 1.00 4.03 H new ATOM 0 HB3 PRO A 97 -1.716 -19.839 1.420 1.00 4.03 H new ATOM 0 HG2 PRO A 97 -0.701 -19.487 -1.376 1.00 21.00 H new ATOM 0 HG3 PRO A 97 -2.125 -20.340 -0.814 1.00 21.00 H new ATOM 0 HD2 PRO A 97 -2.325 -17.903 -1.967 1.00 10.05 H new ATOM 0 HD3 PRO A 97 -3.413 -18.381 -0.679 1.00 10.05 H new ATOM 1437 N ASN A 98 1.022 -16.963 -0.107 1.00 14.22 N ATOM 1438 CA ASN A 98 2.311 -16.505 -0.230 1.00 44.04 C ATOM 1439 C ASN A 98 2.483 -15.109 0.348 1.00 73.32 C ATOM 1440 O ASN A 98 2.036 -14.132 -0.233 1.00 74.14 O ATOM 1441 CB ASN A 98 2.695 -16.511 -1.684 1.00 23.41 C ATOM 1442 CG ASN A 98 4.114 -16.259 -1.835 1.00 73.13 C ATOM 1443 OD1 ASN A 98 4.583 -15.789 -2.850 1.00 43.10 O ATOM 1444 ND2 ASN A 98 4.837 -16.551 -0.837 1.00 50.13 N ATOM 0 H ASN A 98 0.511 -16.987 -0.989 1.00 14.22 H new ATOM 0 HA ASN A 98 2.963 -17.169 0.338 1.00 44.04 H new ATOM 0 HB2 ASN A 98 2.441 -17.473 -2.129 1.00 23.41 H new ATOM 0 HB3 ASN A 98 2.126 -15.751 -2.220 1.00 23.41 H new ATOM 0 HD21 ASN A 98 5.844 -16.392 -0.873 1.00 50.13 H new ATOM 0 HD22 ASN A 98 4.412 -16.945 0.003 1.00 50.13 H new ATOM 1451 N GLU A 99 3.197 -15.050 1.447 1.00 41.42 N ATOM 1452 CA GLU A 99 3.453 -13.845 2.209 1.00 24.54 C ATOM 1453 C GLU A 99 4.164 -12.758 1.394 1.00 12.44 C ATOM 1454 O GLU A 99 3.953 -11.561 1.626 1.00 73.33 O ATOM 1455 CB GLU A 99 4.254 -14.160 3.485 1.00 42.13 C ATOM 1456 CG GLU A 99 3.694 -15.310 4.324 1.00 74.10 C ATOM 1457 CD GLU A 99 4.244 -16.677 3.927 1.00 31.54 C ATOM 1458 OE1 GLU A 99 4.165 -17.073 2.755 1.00 45.42 O ATOM 1459 OE2 GLU A 99 4.774 -17.382 4.805 1.00 33.31 O1- ATOM 0 H GLU A 99 3.636 -15.876 1.855 1.00 41.42 H new ATOM 0 HA GLU A 99 2.476 -13.449 2.486 1.00 24.54 H new ATOM 0 HB2 GLU A 99 5.280 -14.399 3.204 1.00 42.13 H new ATOM 0 HB3 GLU A 99 4.294 -13.263 4.103 1.00 42.13 H new ATOM 0 HG2 GLU A 99 3.921 -15.127 5.374 1.00 74.10 H new ATOM 0 HG3 GLU A 99 2.608 -15.323 4.230 1.00 74.10 H new ATOM 1466 N GLN A 100 4.998 -13.149 0.452 1.00 51.41 N ATOM 1467 CA GLN A 100 5.639 -12.173 -0.378 1.00 73.21 C ATOM 1468 C GLN A 100 4.676 -11.579 -1.370 1.00 33.22 C ATOM 1469 O GLN A 100 4.755 -10.418 -1.643 1.00 64.13 O ATOM 1470 CB GLN A 100 6.887 -12.679 -1.058 1.00 10.34 C ATOM 1471 CG GLN A 100 6.683 -13.937 -1.792 1.00 14.44 C ATOM 1472 CD GLN A 100 7.821 -14.314 -2.665 1.00 20.23 C ATOM 1473 OE1 GLN A 100 8.981 -13.980 -2.408 1.00 60.13 O ATOM 1474 NE2 GLN A 100 7.511 -15.034 -3.688 1.00 41.31 N ATOM 0 H GLN A 100 5.239 -14.119 0.251 1.00 51.41 H new ATOM 0 HA GLN A 100 5.970 -11.383 0.296 1.00 73.21 H new ATOM 0 HB2 GLN A 100 7.249 -11.918 -1.749 1.00 10.34 H new ATOM 0 HB3 GLN A 100 7.666 -12.826 -0.309 1.00 10.34 H new ATOM 0 HG2 GLN A 100 6.506 -14.739 -1.076 1.00 14.44 H new ATOM 0 HG3 GLN A 100 5.784 -13.849 -2.402 1.00 14.44 H new ATOM 0 HE21 GLN A 100 6.537 -15.285 -3.859 1.00 41.31 H new ATOM 0 HE22 GLN A 100 8.239 -15.353 -4.327 1.00 41.31 H new ATOM 1483 N ILE A 101 3.695 -12.355 -1.839 1.00 22.11 N ATOM 1484 CA ILE A 101 2.707 -11.804 -2.759 1.00 65.04 C ATOM 1485 C ILE A 101 1.898 -10.727 -2.025 1.00 1.12 C ATOM 1486 O ILE A 101 1.364 -9.781 -2.617 1.00 2.21 O ATOM 1487 CB ILE A 101 1.793 -12.896 -3.410 1.00 73.40 C ATOM 1488 CG1 ILE A 101 2.672 -13.838 -4.236 1.00 20.11 C ATOM 1489 CG2 ILE A 101 0.725 -12.261 -4.319 1.00 31.12 C ATOM 1490 CD1 ILE A 101 1.927 -14.947 -4.941 1.00 44.31 C ATOM 0 H ILE A 101 3.568 -13.339 -1.603 1.00 22.11 H new ATOM 0 HA ILE A 101 3.233 -11.352 -3.600 1.00 65.04 H new ATOM 0 HB ILE A 101 1.279 -13.443 -2.620 1.00 73.40 H new ATOM 0 HG12 ILE A 101 3.210 -13.251 -4.980 1.00 20.11 H new ATOM 0 HG13 ILE A 101 3.420 -14.282 -3.580 1.00 20.11 H new ATOM 0 HG21 ILE A 101 0.106 -13.045 -4.756 1.00 31.12 H new ATOM 0 HG22 ILE A 101 0.099 -11.590 -3.731 1.00 31.12 H new ATOM 0 HG23 ILE A 101 1.213 -11.698 -5.115 1.00 31.12 H new ATOM 0 HD11 ILE A 101 2.633 -15.562 -5.500 1.00 44.31 H new ATOM 0 HD12 ILE A 101 1.412 -15.564 -4.205 1.00 44.31 H new ATOM 0 HD13 ILE A 101 1.198 -14.516 -5.628 1.00 44.31 H new ATOM 1502 N LEU A 102 1.894 -10.849 -0.705 1.00 13.43 N ATOM 1503 CA LEU A 102 1.258 -9.840 0.157 1.00 12.53 C ATOM 1504 C LEU A 102 2.005 -8.530 0.115 1.00 10.42 C ATOM 1505 O LEU A 102 1.429 -7.487 -0.187 1.00 4.22 O ATOM 1506 CB LEU A 102 1.140 -10.283 1.611 1.00 51.02 C ATOM 1507 CG LEU A 102 -0.017 -11.183 2.011 1.00 62.10 C ATOM 1508 CD1 LEU A 102 -0.060 -12.433 1.183 1.00 62.34 C ATOM 1509 CD2 LEU A 102 0.124 -11.519 3.468 1.00 12.42 C ATOM 0 H LEU A 102 2.319 -11.628 -0.202 1.00 13.43 H new ATOM 0 HA LEU A 102 0.253 -9.712 -0.245 1.00 12.53 H new ATOM 0 HB2 LEU A 102 2.064 -10.797 1.875 1.00 51.02 H new ATOM 0 HB3 LEU A 102 1.087 -9.385 2.226 1.00 51.02 H new ATOM 0 HG LEU A 102 -0.955 -10.656 1.835 1.00 62.10 H new ATOM 0 HD11 LEU A 102 -0.901 -13.050 1.499 1.00 62.34 H new ATOM 0 HD12 LEU A 102 -0.178 -12.169 0.132 1.00 62.34 H new ATOM 0 HD13 LEU A 102 0.868 -12.989 1.315 1.00 62.34 H new ATOM 0 HD21 LEU A 102 -0.699 -12.165 3.774 1.00 12.42 H new ATOM 0 HD22 LEU A 102 1.070 -12.034 3.633 1.00 12.42 H new ATOM 0 HD23 LEU A 102 0.103 -10.602 4.057 1.00 12.42 H new ATOM 1521 N GLN A 103 3.287 -8.579 0.425 1.00 3.15 N ATOM 1522 CA GLN A 103 4.100 -7.406 0.444 1.00 14.43 C ATOM 1523 C GLN A 103 4.202 -6.813 -0.977 1.00 14.41 C ATOM 1524 O GLN A 103 4.225 -5.618 -1.135 1.00 45.30 O ATOM 1525 CB GLN A 103 5.453 -7.760 1.000 1.00 61.03 C ATOM 1526 CG GLN A 103 6.214 -8.626 0.131 1.00 15.34 C ATOM 1527 CD GLN A 103 7.203 -9.491 0.821 1.00 41.03 C ATOM 1528 OE1 GLN A 103 6.825 -10.030 1.942 1.00 3.34 O flip ATOM 1529 NE2 GLN A 103 8.266 -9.768 0.295 1.00 43.34 N flip ATOM 0 H GLN A 103 3.781 -9.438 0.668 1.00 3.15 H new ATOM 0 HA GLN A 103 3.652 -6.645 1.083 1.00 14.43 H new ATOM 0 HB2 GLN A 103 6.018 -6.844 1.176 1.00 61.03 H new ATOM 0 HB3 GLN A 103 5.326 -8.247 1.967 1.00 61.03 H new ATOM 0 HG2 GLN A 103 5.522 -9.261 -0.422 1.00 15.34 H new ATOM 0 HG3 GLN A 103 6.738 -8.012 -0.601 1.00 15.34 H new ATOM 0 HE21 GLN A 103 8.530 -9.325 -0.585 1.00 43.34 H new ATOM 0 HE22 GLN A 103 8.892 -10.443 0.735 1.00 43.34 H new ATOM 1538 N GLU A 104 4.223 -7.685 -2.000 1.00 12.01 N ATOM 1539 CA GLU A 104 4.232 -7.271 -3.386 1.00 51.02 C ATOM 1540 C GLU A 104 2.974 -6.458 -3.744 1.00 2.31 C ATOM 1541 O GLU A 104 3.055 -5.470 -4.469 1.00 63.33 O ATOM 1542 CB GLU A 104 4.379 -8.476 -4.286 1.00 1.31 C ATOM 1543 CG GLU A 104 5.707 -9.193 -4.170 1.00 23.22 C ATOM 1544 CD GLU A 104 5.833 -10.378 -5.098 1.00 53.13 C ATOM 1545 OE1 GLU A 104 5.267 -11.458 -4.794 1.00 55.32 O1- ATOM 1546 OE2 GLU A 104 6.539 -10.258 -6.132 1.00 34.13 O ATOM 0 H GLU A 104 4.234 -8.697 -1.873 1.00 12.01 H new ATOM 0 HA GLU A 104 5.089 -6.615 -3.540 1.00 51.02 H new ATOM 0 HB2 GLU A 104 3.580 -9.181 -4.060 1.00 1.31 H new ATOM 0 HB3 GLU A 104 4.241 -8.159 -5.320 1.00 1.31 H new ATOM 0 HG2 GLU A 104 6.511 -8.488 -4.381 1.00 23.22 H new ATOM 0 HG3 GLU A 104 5.841 -9.530 -3.142 1.00 23.22 H new ATOM 1553 N ALA A 105 1.816 -6.872 -3.223 1.00 13.23 N ATOM 1554 CA ALA A 105 0.574 -6.096 -3.367 1.00 64.55 C ATOM 1555 C ALA A 105 0.786 -4.720 -2.756 1.00 15.33 C ATOM 1556 O ALA A 105 0.438 -3.691 -3.352 1.00 50.34 O ATOM 1557 CB ALA A 105 -0.568 -6.813 -2.648 1.00 33.33 C ATOM 0 H ALA A 105 1.709 -7.739 -2.697 1.00 13.23 H new ATOM 0 HA ALA A 105 0.317 -5.997 -4.422 1.00 64.55 H new ATOM 0 HB1 ALA A 105 -1.486 -6.235 -2.757 1.00 33.33 H new ATOM 0 HB2 ALA A 105 -0.708 -7.802 -3.084 1.00 33.33 H new ATOM 0 HB3 ALA A 105 -0.326 -6.913 -1.590 1.00 33.33 H new ATOM 1563 N LEU A 106 1.443 -4.706 -1.598 1.00 23.50 N ATOM 1564 CA LEU A 106 1.717 -3.476 -0.874 1.00 72.35 C ATOM 1565 C LEU A 106 2.706 -2.603 -1.641 1.00 62.30 C ATOM 1566 O LEU A 106 2.645 -1.384 -1.555 1.00 55.12 O ATOM 1567 CB LEU A 106 2.264 -3.751 0.526 1.00 55.55 C ATOM 1568 CG LEU A 106 1.488 -4.747 1.384 1.00 12.14 C ATOM 1569 CD1 LEU A 106 2.117 -4.889 2.758 1.00 35.04 C ATOM 1570 CD2 LEU A 106 0.015 -4.384 1.494 1.00 4.02 C ATOM 0 H LEU A 106 1.797 -5.546 -1.140 1.00 23.50 H new ATOM 0 HA LEU A 106 0.768 -2.949 -0.776 1.00 72.35 H new ATOM 0 HB2 LEU A 106 3.287 -4.113 0.426 1.00 55.55 H new ATOM 0 HB3 LEU A 106 2.312 -2.804 1.064 1.00 55.55 H new ATOM 0 HG LEU A 106 1.543 -5.712 0.881 1.00 12.14 H new ATOM 0 HD11 LEU A 106 1.544 -5.604 3.348 1.00 35.04 H new ATOM 0 HD12 LEU A 106 3.143 -5.243 2.654 1.00 35.04 H new ATOM 0 HD13 LEU A 106 2.117 -3.922 3.260 1.00 35.04 H new ATOM 0 HD21 LEU A 106 -0.496 -5.121 2.114 1.00 4.02 H new ATOM 0 HD22 LEU A 106 -0.084 -3.398 1.947 1.00 4.02 H new ATOM 0 HD23 LEU A 106 -0.432 -4.373 0.500 1.00 4.02 H new ATOM 1582 N TRP A 107 3.605 -3.233 -2.401 1.00 61.44 N ATOM 1583 CA TRP A 107 4.580 -2.509 -3.230 1.00 22.34 C ATOM 1584 C TRP A 107 3.888 -1.634 -4.253 1.00 63.23 C ATOM 1585 O TRP A 107 4.366 -0.563 -4.579 1.00 60.44 O ATOM 1586 CB TRP A 107 5.589 -3.455 -3.947 1.00 63.43 C ATOM 1587 CG TRP A 107 6.522 -4.179 -3.026 1.00 44.13 C ATOM 1588 CD1 TRP A 107 6.800 -3.847 -1.755 1.00 54.42 C ATOM 1589 CD2 TRP A 107 7.329 -5.331 -3.320 1.00 14.51 C ATOM 1590 NE1 TRP A 107 7.669 -4.737 -1.197 1.00 3.43 N ATOM 1591 CE2 TRP A 107 8.024 -5.656 -2.137 1.00 53.13 C ATOM 1592 CE3 TRP A 107 7.518 -6.127 -4.451 1.00 43.11 C ATOM 1593 CZ2 TRP A 107 8.889 -6.740 -2.053 1.00 0.34 C ATOM 1594 CZ3 TRP A 107 8.385 -7.201 -4.368 1.00 11.00 C ATOM 1595 CH2 TRP A 107 9.057 -7.501 -3.175 1.00 64.31 C ATOM 0 H TRP A 107 3.680 -4.248 -2.461 1.00 61.44 H new ATOM 0 HA TRP A 107 5.148 -1.882 -2.542 1.00 22.34 H new ATOM 0 HB2 TRP A 107 5.030 -4.189 -4.528 1.00 63.43 H new ATOM 0 HB3 TRP A 107 6.177 -2.870 -4.654 1.00 63.43 H new ATOM 0 HD1 TRP A 107 6.390 -2.989 -1.243 1.00 54.42 H new ATOM 0 HE1 TRP A 107 8.000 -4.718 -0.232 1.00 3.43 H new ATOM 0 HE3 TRP A 107 6.998 -5.909 -5.372 1.00 43.11 H new ATOM 0 HZ2 TRP A 107 9.409 -6.972 -1.135 1.00 0.34 H new ATOM 0 HZ3 TRP A 107 8.547 -7.820 -5.238 1.00 11.00 H new ATOM 0 HH2 TRP A 107 9.722 -8.352 -3.142 1.00 64.31 H new ATOM 1606 N ALA A 108 2.743 -2.062 -4.725 1.00 44.32 N ATOM 1607 CA ALA A 108 2.054 -1.307 -5.729 1.00 31.11 C ATOM 1608 C ALA A 108 1.209 -0.290 -5.034 1.00 72.04 C ATOM 1609 O ALA A 108 1.204 0.887 -5.373 1.00 34.33 O ATOM 1610 CB ALA A 108 1.233 -2.209 -6.626 1.00 51.14 C ATOM 0 H ALA A 108 2.277 -2.920 -4.431 1.00 44.32 H new ATOM 0 HA ALA A 108 2.768 -0.804 -6.382 1.00 31.11 H new ATOM 0 HB1 ALA A 108 0.722 -1.607 -7.378 1.00 51.14 H new ATOM 0 HB2 ALA A 108 1.889 -2.926 -7.120 1.00 51.14 H new ATOM 0 HB3 ALA A 108 0.496 -2.744 -6.027 1.00 51.14 H new ATOM 1616 N LEU A 109 0.560 -0.763 -4.004 1.00 41.44 N ATOM 1617 CA LEU A 109 -0.312 0.003 -3.155 1.00 30.13 C ATOM 1618 C LEU A 109 0.374 1.227 -2.536 1.00 73.45 C ATOM 1619 O LEU A 109 -0.145 2.331 -2.594 1.00 14.34 O ATOM 1620 CB LEU A 109 -0.839 -0.914 -2.079 1.00 52.30 C ATOM 1621 CG LEU A 109 -1.948 -1.895 -2.476 1.00 14.42 C ATOM 1622 CD1 LEU A 109 -2.267 -2.824 -1.321 1.00 73.44 C ATOM 1623 CD2 LEU A 109 -3.200 -1.148 -2.906 1.00 0.24 C ATOM 0 H LEU A 109 0.629 -1.740 -3.721 1.00 41.44 H new ATOM 0 HA LEU A 109 -1.126 0.398 -3.763 1.00 30.13 H new ATOM 0 HB2 LEU A 109 -0.002 -1.491 -1.687 1.00 52.30 H new ATOM 0 HB3 LEU A 109 -1.211 -0.297 -1.261 1.00 52.30 H new ATOM 0 HG LEU A 109 -1.593 -2.488 -3.319 1.00 14.42 H new ATOM 0 HD11 LEU A 109 -3.056 -3.515 -1.617 1.00 73.44 H new ATOM 0 HD12 LEU A 109 -1.374 -3.387 -1.050 1.00 73.44 H new ATOM 0 HD13 LEU A 109 -2.600 -2.238 -0.464 1.00 73.44 H new ATOM 0 HD21 LEU A 109 -3.974 -1.864 -3.183 1.00 0.24 H new ATOM 0 HD22 LEU A 109 -3.556 -0.530 -2.082 1.00 0.24 H new ATOM 0 HD23 LEU A 109 -2.969 -0.514 -3.762 1.00 0.24 H new ATOM 1635 N SER A 110 1.530 1.036 -1.968 1.00 2.53 N ATOM 1636 CA SER A 110 2.246 2.128 -1.355 1.00 61.23 C ATOM 1637 C SER A 110 2.800 3.068 -2.431 1.00 2.42 C ATOM 1638 O SER A 110 2.892 4.292 -2.233 1.00 43.14 O ATOM 1639 CB SER A 110 3.374 1.592 -0.468 1.00 24.42 C ATOM 1640 OG SER A 110 4.022 2.642 0.211 1.00 42.20 O ATOM 0 H SER A 110 2.002 0.133 -1.914 1.00 2.53 H new ATOM 0 HA SER A 110 1.557 2.693 -0.727 1.00 61.23 H new ATOM 0 HB2 SER A 110 2.969 0.883 0.253 1.00 24.42 H new ATOM 0 HB3 SER A 110 4.095 1.049 -1.079 1.00 24.42 H new ATOM 0 HG SER A 110 4.936 2.370 0.437 1.00 42.20 H new ATOM 1646 N ASN A 111 3.083 2.509 -3.593 1.00 33.12 N ATOM 1647 CA ASN A 111 3.674 3.261 -4.663 1.00 23.52 C ATOM 1648 C ASN A 111 2.655 4.168 -5.322 1.00 31.40 C ATOM 1649 O ASN A 111 2.941 5.335 -5.589 1.00 34.41 O ATOM 1650 CB ASN A 111 4.392 2.335 -5.664 1.00 32.34 C ATOM 1651 CG ASN A 111 5.868 2.157 -5.373 1.00 22.41 C ATOM 1652 OD1 ASN A 111 6.508 3.025 -4.766 1.00 44.14 O ATOM 1653 ND2 ASN A 111 6.441 1.077 -5.857 1.00 33.34 N ATOM 0 H ASN A 111 2.908 1.528 -3.812 1.00 33.12 H new ATOM 0 HA ASN A 111 4.440 3.913 -4.243 1.00 23.52 H new ATOM 0 HB2 ASN A 111 3.908 1.358 -5.655 1.00 32.34 H new ATOM 0 HB3 ASN A 111 4.274 2.739 -6.669 1.00 32.34 H new ATOM 0 HD21 ASN A 111 7.444 0.934 -5.737 1.00 33.34 H new ATOM 0 HD22 ASN A 111 5.883 0.382 -6.352 1.00 33.34 H new ATOM 1660 N ILE A 112 1.446 3.664 -5.520 1.00 21.12 N ATOM 1661 CA ILE A 112 0.384 4.455 -6.103 1.00 15.12 C ATOM 1662 C ILE A 112 -0.056 5.584 -5.184 1.00 32.31 C ATOM 1663 O ILE A 112 -0.416 6.663 -5.640 1.00 3.24 O ATOM 1664 CB ILE A 112 -0.817 3.586 -6.594 1.00 23.43 C ATOM 1665 CG1 ILE A 112 -1.426 2.663 -5.520 1.00 22.14 C ATOM 1666 CG2 ILE A 112 -0.432 2.769 -7.794 1.00 55.30 C ATOM 1667 CD1 ILE A 112 -2.359 3.336 -4.552 1.00 52.45 C ATOM 0 H ILE A 112 1.180 2.708 -5.283 1.00 21.12 H new ATOM 0 HA ILE A 112 0.802 4.920 -6.996 1.00 15.12 H new ATOM 0 HB ILE A 112 -1.592 4.307 -6.855 1.00 23.43 H new ATOM 0 HG12 ILE A 112 -1.965 1.858 -6.019 1.00 22.14 H new ATOM 0 HG13 ILE A 112 -0.614 2.202 -4.957 1.00 22.14 H new ATOM 0 HG21 ILE A 112 -1.285 2.172 -8.117 1.00 55.30 H new ATOM 0 HG22 ILE A 112 -0.126 3.432 -8.603 1.00 55.30 H new ATOM 0 HG23 ILE A 112 0.395 2.108 -7.534 1.00 55.30 H new ATOM 0 HD11 ILE A 112 -2.733 2.603 -3.838 1.00 52.45 H new ATOM 0 HD12 ILE A 112 -1.825 4.122 -4.018 1.00 52.45 H new ATOM 0 HD13 ILE A 112 -3.196 3.772 -5.097 1.00 52.45 H new ATOM 1679 N ALA A 113 0.043 5.334 -3.892 1.00 35.11 N ATOM 1680 CA ALA A 113 -0.335 6.291 -2.851 1.00 61.13 C ATOM 1681 C ALA A 113 0.622 7.479 -2.819 1.00 22.11 C ATOM 1682 O ALA A 113 0.306 8.533 -2.279 1.00 31.24 O ATOM 1683 CB ALA A 113 -0.380 5.603 -1.494 1.00 64.34 C ATOM 0 H ALA A 113 0.393 4.450 -3.523 1.00 35.11 H new ATOM 0 HA ALA A 113 -1.329 6.671 -3.085 1.00 61.13 H new ATOM 0 HB1 ALA A 113 -0.662 6.326 -0.729 1.00 64.34 H new ATOM 0 HB2 ALA A 113 -1.113 4.796 -1.519 1.00 64.34 H new ATOM 0 HB3 ALA A 113 0.603 5.193 -1.261 1.00 64.34 H new ATOM 1689 N SER A 114 1.768 7.307 -3.437 1.00 23.52 N ATOM 1690 CA SER A 114 2.785 8.336 -3.529 1.00 11.34 C ATOM 1691 C SER A 114 2.478 9.314 -4.703 1.00 51.41 C ATOM 1692 O SER A 114 3.391 9.833 -5.355 1.00 74.14 O ATOM 1693 CB SER A 114 4.125 7.648 -3.762 1.00 14.43 C ATOM 1694 OG SER A 114 4.416 6.713 -2.723 1.00 71.11 O ATOM 0 H SER A 114 2.026 6.435 -3.898 1.00 23.52 H new ATOM 0 HA SER A 114 2.806 8.919 -2.608 1.00 11.34 H new ATOM 0 HB2 SER A 114 4.110 7.134 -4.723 1.00 14.43 H new ATOM 0 HB3 SER A 114 4.916 8.396 -3.813 1.00 14.43 H new ATOM 0 HG SER A 114 3.797 5.955 -2.782 1.00 71.11 H new ATOM 1700 N GLY A 115 1.208 9.582 -4.930 1.00 52.43 N ATOM 1701 CA GLY A 115 0.808 10.463 -5.989 1.00 52.24 C ATOM 1702 C GLY A 115 -0.137 11.524 -5.483 1.00 22.43 C ATOM 1703 O GLY A 115 -0.800 11.334 -4.455 1.00 73.41 O ATOM 0 H GLY A 115 0.436 9.195 -4.387 1.00 52.43 H new ATOM 0 HA2 GLY A 115 1.688 10.934 -6.427 1.00 52.24 H new ATOM 0 HA3 GLY A 115 0.326 9.890 -6.781 1.00 52.24 H new TER 1707 GLY A 115 ATOM 1708 N GLY B 116 -0.192 12.627 -6.186 1.00 31.23 N ATOM 1709 CA GLY B 116 -1.078 13.701 -5.855 1.00 31.33 C ATOM 1710 C GLY B 116 -2.389 13.596 -6.612 1.00 14.22 C ATOM 1711 O GLY B 116 -2.862 12.475 -6.885 1.00 1.13 O ATOM 0 HA2 GLY B 116 -1.275 13.694 -4.783 1.00 31.33 H new ATOM 0 HA3 GLY B 116 -0.599 14.653 -6.085 1.00 31.33 H new ATOM 1715 N ASN B 117 -2.946 14.756 -6.992 1.00 2.42 N ATOM 1716 CA ASN B 117 -4.286 14.885 -7.617 1.00 24.35 C ATOM 1717 C ASN B 117 -5.333 14.617 -6.557 1.00 74.14 C ATOM 1718 O ASN B 117 -5.928 15.555 -6.015 1.00 24.23 O ATOM 1719 CB ASN B 117 -4.485 13.973 -8.871 1.00 74.45 C ATOM 1720 CG ASN B 117 -5.934 13.947 -9.378 1.00 41.41 C ATOM 1721 OD1 ASN B 117 -6.744 13.127 -8.935 1.00 70.04 O ATOM 1722 ND2 ASN B 117 -6.261 14.785 -10.322 1.00 13.53 N ATOM 0 H ASN B 117 -2.474 15.653 -6.874 1.00 2.42 H new ATOM 0 HA ASN B 117 -4.387 15.901 -8.000 1.00 24.35 H new ATOM 0 HB2 ASN B 117 -3.833 14.321 -9.672 1.00 74.45 H new ATOM 0 HB3 ASN B 117 -4.175 12.957 -8.626 1.00 74.45 H new ATOM 0 HD21 ASN B 117 -7.204 14.772 -10.711 1.00 13.53 H new ATOM 0 HD22 ASN B 117 -5.574 15.453 -10.671 1.00 13.53 H new ATOM 1729 N GLU B 118 -5.497 13.349 -6.241 1.00 44.13 N ATOM 1730 CA GLU B 118 -6.314 12.841 -5.180 1.00 14.41 C ATOM 1731 C GLU B 118 -6.337 11.341 -5.300 1.00 72.03 C ATOM 1732 O GLU B 118 -7.253 10.742 -5.873 1.00 54.55 O ATOM 1733 CB GLU B 118 -7.732 13.421 -5.111 1.00 51.32 C ATOM 1734 CG GLU B 118 -8.398 13.095 -3.797 1.00 41.35 C ATOM 1735 CD GLU B 118 -7.478 13.412 -2.629 1.00 10.13 C ATOM 1736 OE1 GLU B 118 -7.351 14.588 -2.257 1.00 2.45 O1- ATOM 1737 OE2 GLU B 118 -6.808 12.485 -2.113 1.00 22.42 O ATOM 0 H GLU B 118 -5.029 12.605 -6.758 1.00 44.13 H new ATOM 0 HA GLU B 118 -5.866 13.161 -4.239 1.00 14.41 H new ATOM 0 HB2 GLU B 118 -7.691 14.502 -5.241 1.00 51.32 H new ATOM 0 HB3 GLU B 118 -8.329 13.024 -5.932 1.00 51.32 H new ATOM 0 HG2 GLU B 118 -9.322 13.665 -3.702 1.00 41.35 H new ATOM 0 HG3 GLU B 118 -8.670 12.040 -3.775 1.00 41.35 H new ATOM 1744 N GLN B 119 -5.254 10.761 -4.890 1.00 3.22 N ATOM 1745 CA GLN B 119 -5.068 9.340 -4.958 1.00 22.01 C ATOM 1746 C GLN B 119 -5.721 8.648 -3.778 1.00 54.30 C ATOM 1747 O GLN B 119 -6.493 7.691 -3.931 1.00 21.00 O ATOM 1748 CB GLN B 119 -3.573 9.018 -4.974 1.00 34.10 C ATOM 1749 CG GLN B 119 -3.287 7.541 -5.053 1.00 42.33 C ATOM 1750 CD GLN B 119 -3.700 6.956 -6.371 1.00 24.54 C ATOM 1751 OE1 GLN B 119 -4.827 6.561 -6.553 1.00 54.55 O ATOM 1752 NE2 GLN B 119 -2.773 6.858 -7.280 1.00 54.24 N ATOM 0 H GLN B 119 -4.461 11.265 -4.493 1.00 3.22 H new ATOM 0 HA GLN B 119 -5.536 8.977 -5.873 1.00 22.01 H new ATOM 0 HB2 GLN B 119 -3.109 9.518 -5.824 1.00 34.10 H new ATOM 0 HB3 GLN B 119 -3.110 9.424 -4.074 1.00 34.10 H new ATOM 0 HG2 GLN B 119 -2.222 7.370 -4.899 1.00 42.33 H new ATOM 0 HG3 GLN B 119 -3.812 7.027 -4.248 1.00 42.33 H new ATOM 0 HE21 GLN B 119 -1.833 7.203 -7.089 1.00 54.24 H new ATOM 0 HE22 GLN B 119 -2.987 6.436 -8.183 1.00 54.24 H new ATOM 1761 N ILE B 120 -5.432 9.178 -2.621 1.00 64.15 N ATOM 1762 CA ILE B 120 -5.771 8.582 -1.340 1.00 43.22 C ATOM 1763 C ILE B 120 -7.224 8.333 -1.193 1.00 23.24 C ATOM 1764 O ILE B 120 -7.612 7.274 -0.749 1.00 45.23 O ATOM 1765 CB ILE B 120 -5.269 9.459 -0.198 1.00 41.31 C ATOM 1766 CG1 ILE B 120 -3.807 9.736 -0.454 1.00 62.25 C ATOM 1767 CG2 ILE B 120 -5.455 8.734 1.134 1.00 43.35 C ATOM 1768 CD1 ILE B 120 -3.140 10.571 0.586 1.00 31.51 C ATOM 0 H ILE B 120 -4.938 10.066 -2.532 1.00 64.15 H new ATOM 0 HA ILE B 120 -5.275 7.612 -1.300 1.00 43.22 H new ATOM 0 HB ILE B 120 -5.827 10.394 -0.148 1.00 41.31 H new ATOM 0 HG12 ILE B 120 -3.279 8.785 -0.531 1.00 62.25 H new ATOM 0 HG13 ILE B 120 -3.709 10.234 -1.419 1.00 62.25 H new ATOM 0 HG21 ILE B 120 -5.094 9.366 1.946 1.00 43.35 H new ATOM 0 HG22 ILE B 120 -6.512 8.517 1.286 1.00 43.35 H new ATOM 0 HG23 ILE B 120 -4.891 7.801 1.122 1.00 43.35 H new ATOM 0 HD11 ILE B 120 -2.094 10.718 0.319 1.00 31.51 H new ATOM 0 HD12 ILE B 120 -3.637 11.539 0.650 1.00 31.51 H new ATOM 0 HD13 ILE B 120 -3.201 10.068 1.551 1.00 31.51 H new ATOM 1780 N GLN B 121 -8.010 9.273 -1.611 1.00 53.30 N ATOM 1781 CA GLN B 121 -9.481 9.151 -1.505 1.00 2.44 C ATOM 1782 C GLN B 121 -10.025 7.914 -2.213 1.00 50.12 C ATOM 1783 O GLN B 121 -10.958 7.294 -1.736 1.00 64.40 O ATOM 1784 CB GLN B 121 -10.215 10.400 -1.972 1.00 54.21 C ATOM 1785 CG GLN B 121 -10.045 11.606 -1.063 1.00 1.33 C ATOM 1786 CD GLN B 121 -10.734 11.482 0.298 1.00 60.43 C ATOM 1787 OE1 GLN B 121 -10.915 10.385 0.857 1.00 62.12 O ATOM 1788 NE2 GLN B 121 -11.108 12.609 0.842 1.00 63.24 N ATOM 0 H GLN B 121 -7.686 10.144 -2.033 1.00 53.30 H new ATOM 0 HA GLN B 121 -9.677 9.034 -0.439 1.00 2.44 H new ATOM 0 HB2 GLN B 121 -9.864 10.661 -2.970 1.00 54.21 H new ATOM 0 HB3 GLN B 121 -11.277 10.172 -2.057 1.00 54.21 H new ATOM 0 HG2 GLN B 121 -8.980 11.776 -0.902 1.00 1.33 H new ATOM 0 HG3 GLN B 121 -10.435 12.487 -1.574 1.00 1.33 H new ATOM 0 HE21 GLN B 121 -10.943 13.490 0.355 1.00 63.24 H new ATOM 0 HE22 GLN B 121 -11.565 12.608 1.754 1.00 63.24 H new ATOM 1797 N ALA B 122 -9.409 7.527 -3.316 1.00 4.24 N ATOM 1798 CA ALA B 122 -9.849 6.353 -4.044 1.00 64.24 C ATOM 1799 C ALA B 122 -9.345 5.091 -3.347 1.00 62.33 C ATOM 1800 O ALA B 122 -10.109 4.160 -3.093 1.00 32.20 O ATOM 1801 CB ALA B 122 -9.378 6.404 -5.490 1.00 53.41 C ATOM 0 H ALA B 122 -8.607 8.007 -3.725 1.00 4.24 H new ATOM 0 HA ALA B 122 -10.939 6.333 -4.054 1.00 64.24 H new ATOM 0 HB1 ALA B 122 -9.720 5.513 -6.016 1.00 53.41 H new ATOM 0 HB2 ALA B 122 -9.787 7.291 -5.975 1.00 53.41 H new ATOM 0 HB3 ALA B 122 -8.289 6.445 -5.517 1.00 53.41 H new ATOM 1807 N VAL B 123 -8.061 5.084 -3.027 1.00 12.44 N ATOM 1808 CA VAL B 123 -7.409 3.974 -2.318 1.00 50.30 C ATOM 1809 C VAL B 123 -8.072 3.692 -0.961 1.00 70.44 C ATOM 1810 O VAL B 123 -8.428 2.545 -0.656 1.00 75.13 O ATOM 1811 CB VAL B 123 -5.900 4.261 -2.092 1.00 25.14 C ATOM 1812 CG1 VAL B 123 -5.188 3.051 -1.491 1.00 23.42 C ATOM 1813 CG2 VAL B 123 -5.233 4.697 -3.388 1.00 31.30 C ATOM 0 H VAL B 123 -7.428 5.852 -3.251 1.00 12.44 H new ATOM 0 HA VAL B 123 -7.521 3.095 -2.953 1.00 50.30 H new ATOM 0 HB VAL B 123 -5.820 5.079 -1.376 1.00 25.14 H new ATOM 0 HG11 VAL B 123 -4.133 3.285 -1.345 1.00 23.42 H new ATOM 0 HG12 VAL B 123 -5.641 2.802 -0.531 1.00 23.42 H new ATOM 0 HG13 VAL B 123 -5.281 2.201 -2.167 1.00 23.42 H new ATOM 0 HG21 VAL B 123 -4.176 4.893 -3.205 1.00 31.30 H new ATOM 0 HG22 VAL B 123 -5.333 3.907 -4.132 1.00 31.30 H new ATOM 0 HG23 VAL B 123 -5.712 5.604 -3.756 1.00 31.30 H new ATOM 1823 N ILE B 124 -8.273 4.736 -0.171 1.00 40.34 N ATOM 1824 CA ILE B 124 -8.845 4.589 1.153 1.00 5.10 C ATOM 1825 C ILE B 124 -10.316 4.120 1.062 1.00 24.53 C ATOM 1826 O ILE B 124 -10.853 3.510 1.991 1.00 51.02 O ATOM 1827 CB ILE B 124 -8.724 5.910 1.997 1.00 54.14 C ATOM 1828 CG1 ILE B 124 -8.932 5.627 3.492 1.00 32.23 C ATOM 1829 CG2 ILE B 124 -9.724 6.967 1.523 1.00 75.03 C ATOM 1830 CD1 ILE B 124 -8.752 6.845 4.379 1.00 1.24 C ATOM 0 H ILE B 124 -8.046 5.697 -0.428 1.00 40.34 H new ATOM 0 HA ILE B 124 -8.270 3.824 1.675 1.00 5.10 H new ATOM 0 HB ILE B 124 -7.716 6.298 1.849 1.00 54.14 H new ATOM 0 HG12 ILE B 124 -9.935 5.227 3.640 1.00 32.23 H new ATOM 0 HG13 ILE B 124 -8.231 4.854 3.806 1.00 32.23 H new ATOM 0 HG21 ILE B 124 -9.615 7.868 2.127 1.00 75.03 H new ATOM 0 HG22 ILE B 124 -9.533 7.206 0.477 1.00 75.03 H new ATOM 0 HG23 ILE B 124 -10.738 6.581 1.627 1.00 75.03 H new ATOM 0 HD11 ILE B 124 -8.915 6.565 5.420 1.00 1.24 H new ATOM 0 HD12 ILE B 124 -7.740 7.234 4.262 1.00 1.24 H new ATOM 0 HD13 ILE B 124 -9.471 7.613 4.093 1.00 1.24 H new ATOM 1842 N ASP B 125 -10.940 4.392 -0.077 1.00 10.01 N ATOM 1843 CA ASP B 125 -12.324 4.002 -0.314 1.00 43.22 C ATOM 1844 C ASP B 125 -12.406 2.553 -0.751 1.00 14.41 C ATOM 1845 O ASP B 125 -13.324 1.834 -0.374 1.00 25.41 O ATOM 1846 CB ASP B 125 -12.986 4.898 -1.364 1.00 64.44 C ATOM 1847 CG ASP B 125 -14.458 4.586 -1.559 1.00 72.04 C ATOM 1848 OD1 ASP B 125 -15.275 4.930 -0.672 1.00 62.45 O ATOM 1849 OD2 ASP B 125 -14.839 4.020 -2.620 1.00 52.33 O1- ATOM 0 H ASP B 125 -10.505 4.885 -0.857 1.00 10.01 H new ATOM 0 HA ASP B 125 -12.861 4.122 0.627 1.00 43.22 H new ATOM 0 HB2 ASP B 125 -12.877 5.941 -1.066 1.00 64.44 H new ATOM 0 HB3 ASP B 125 -12.466 4.782 -2.315 1.00 64.44 H new ATOM 1854 N ALA B 126 -11.417 2.115 -1.513 1.00 55.23 N ATOM 1855 CA ALA B 126 -11.382 0.756 -2.021 1.00 11.34 C ATOM 1856 C ALA B 126 -11.043 -0.212 -0.904 1.00 45.13 C ATOM 1857 O ALA B 126 -11.505 -1.357 -0.890 1.00 54.13 O ATOM 1858 CB ALA B 126 -10.388 0.640 -3.155 1.00 41.13 C ATOM 0 H ALA B 126 -10.622 2.688 -1.795 1.00 55.23 H new ATOM 0 HA ALA B 126 -12.368 0.501 -2.409 1.00 11.34 H new ATOM 0 HB1 ALA B 126 -10.375 -0.386 -3.524 1.00 41.13 H new ATOM 0 HB2 ALA B 126 -10.677 1.312 -3.963 1.00 41.13 H new ATOM 0 HB3 ALA B 126 -9.394 0.910 -2.797 1.00 41.13 H new ATOM 1864 N GLY B 127 -10.236 0.248 0.024 1.00 34.53 N ATOM 1865 CA GLY B 127 -9.952 -0.537 1.179 1.00 50.04 C ATOM 1866 C GLY B 127 -8.480 -0.775 1.426 1.00 62.41 C ATOM 1867 O GLY B 127 -7.964 -1.848 1.141 1.00 13.32 O ATOM 0 H GLY B 127 -9.773 1.156 -0.007 1.00 34.53 H new ATOM 0 HA2 GLY B 127 -10.379 -0.044 2.052 1.00 50.04 H new ATOM 0 HA3 GLY B 127 -10.452 -1.501 1.080 1.00 50.04 H new ATOM 1871 N ALA B 128 -7.815 0.219 1.961 1.00 55.44 N ATOM 1872 CA ALA B 128 -6.423 0.091 2.343 1.00 54.21 C ATOM 1873 C ALA B 128 -6.336 -0.494 3.761 1.00 1.00 C ATOM 1874 O ALA B 128 -5.620 -1.479 4.014 1.00 74.12 O ATOM 1875 CB ALA B 128 -5.740 1.449 2.290 1.00 43.31 C ATOM 0 H ALA B 128 -8.218 1.138 2.145 1.00 55.44 H new ATOM 0 HA ALA B 128 -5.916 -0.578 1.647 1.00 54.21 H new ATOM 0 HB1 ALA B 128 -4.694 1.342 2.579 1.00 43.31 H new ATOM 0 HB2 ALA B 128 -5.798 1.846 1.277 1.00 43.31 H new ATOM 0 HB3 ALA B 128 -6.238 2.134 2.977 1.00 43.31 H new ATOM 1881 N LEU B 129 -7.122 0.096 4.665 1.00 44.23 N ATOM 1882 CA LEU B 129 -7.161 -0.275 6.086 1.00 11.45 C ATOM 1883 C LEU B 129 -7.338 -1.791 6.377 1.00 63.34 C ATOM 1884 O LEU B 129 -6.584 -2.313 7.191 1.00 24.34 O ATOM 1885 CB LEU B 129 -8.194 0.558 6.861 1.00 14.33 C ATOM 1886 CG LEU B 129 -7.948 2.071 6.902 1.00 21.22 C ATOM 1887 CD1 LEU B 129 -9.014 2.767 7.734 1.00 63.03 C ATOM 1888 CD2 LEU B 129 -6.563 2.370 7.446 1.00 61.01 C ATOM 0 H LEU B 129 -7.760 0.856 4.429 1.00 44.23 H new ATOM 0 HA LEU B 129 -6.161 -0.037 6.449 1.00 11.45 H new ATOM 0 HB2 LEU B 129 -9.176 0.382 6.421 1.00 14.33 H new ATOM 0 HB3 LEU B 129 -8.233 0.189 7.886 1.00 14.33 H new ATOM 0 HG LEU B 129 -8.007 2.456 5.884 1.00 21.22 H new ATOM 0 HD11 LEU B 129 -8.820 3.840 7.750 1.00 63.03 H new ATOM 0 HD12 LEU B 129 -9.995 2.582 7.297 1.00 63.03 H new ATOM 0 HD13 LEU B 129 -8.991 2.379 8.752 1.00 63.03 H new ATOM 0 HD21 LEU B 129 -6.406 3.448 7.468 1.00 61.01 H new ATOM 0 HD22 LEU B 129 -6.475 1.970 8.456 1.00 61.01 H new ATOM 0 HD23 LEU B 129 -5.813 1.907 6.805 1.00 61.01 H new ATOM 1900 N PRO B 130 -8.319 -2.530 5.720 1.00 34.22 N ATOM 1901 CA PRO B 130 -8.549 -3.986 5.960 1.00 22.30 C ATOM 1902 C PRO B 130 -7.265 -4.839 6.003 1.00 65.35 C ATOM 1903 O PRO B 130 -7.180 -5.827 6.756 1.00 42.44 O ATOM 1904 CB PRO B 130 -9.403 -4.391 4.766 1.00 33.45 C ATOM 1905 CG PRO B 130 -10.209 -3.181 4.475 1.00 25.22 C ATOM 1906 CD PRO B 130 -9.310 -2.010 4.741 1.00 21.33 C ATOM 0 HA PRO B 130 -9.003 -4.152 6.937 1.00 22.30 H new ATOM 0 HB2 PRO B 130 -8.787 -4.675 3.913 1.00 33.45 H new ATOM 0 HB3 PRO B 130 -10.037 -5.246 5.000 1.00 33.45 H new ATOM 0 HG2 PRO B 130 -10.553 -3.181 3.441 1.00 25.22 H new ATOM 0 HG3 PRO B 130 -11.097 -3.143 5.106 1.00 25.22 H new ATOM 0 HD2 PRO B 130 -8.825 -1.664 3.828 1.00 21.33 H new ATOM 0 HD3 PRO B 130 -9.866 -1.165 5.147 1.00 21.33 H new ATOM 1914 N ALA B 131 -6.283 -4.473 5.207 1.00 22.33 N ATOM 1915 CA ALA B 131 -5.022 -5.174 5.197 1.00 12.52 C ATOM 1916 C ALA B 131 -4.084 -4.564 6.231 1.00 10.43 C ATOM 1917 O ALA B 131 -3.612 -5.242 7.137 1.00 42.41 O ATOM 1918 CB ALA B 131 -4.399 -5.127 3.808 1.00 71.32 C ATOM 0 H ALA B 131 -6.337 -3.690 4.556 1.00 22.33 H new ATOM 0 HA ALA B 131 -5.194 -6.219 5.455 1.00 12.52 H new ATOM 0 HB1 ALA B 131 -3.448 -5.660 3.817 1.00 71.32 H new ATOM 0 HB2 ALA B 131 -5.072 -5.598 3.091 1.00 71.32 H new ATOM 0 HB3 ALA B 131 -4.230 -4.089 3.520 1.00 71.32 H new ATOM 1924 N LEU B 132 -3.886 -3.267 6.108 1.00 64.34 N ATOM 1925 CA LEU B 132 -2.967 -2.471 6.941 1.00 21.13 C ATOM 1926 C LEU B 132 -3.156 -2.665 8.452 1.00 23.14 C ATOM 1927 O LEU B 132 -2.171 -2.792 9.170 1.00 70.54 O ATOM 1928 CB LEU B 132 -3.035 -0.976 6.564 1.00 4.54 C ATOM 1929 CG LEU B 132 -2.190 -0.498 5.346 1.00 14.31 C ATOM 1930 CD1 LEU B 132 -2.440 -1.327 4.092 1.00 44.31 C ATOM 1931 CD2 LEU B 132 -2.484 0.962 5.055 1.00 1.45 C ATOM 0 H LEU B 132 -4.370 -2.707 5.406 1.00 64.34 H new ATOM 0 HA LEU B 132 -1.970 -2.852 6.721 1.00 21.13 H new ATOM 0 HB2 LEU B 132 -4.078 -0.727 6.367 1.00 4.54 H new ATOM 0 HB3 LEU B 132 -2.727 -0.396 7.434 1.00 4.54 H new ATOM 0 HG LEU B 132 -1.142 -0.627 5.617 1.00 14.31 H new ATOM 0 HD11 LEU B 132 -1.824 -0.948 3.276 1.00 44.31 H new ATOM 0 HD12 LEU B 132 -2.183 -2.368 4.287 1.00 44.31 H new ATOM 0 HD13 LEU B 132 -3.492 -1.259 3.814 1.00 44.31 H new ATOM 0 HD21 LEU B 132 -1.890 1.290 4.202 1.00 1.45 H new ATOM 0 HD22 LEU B 132 -3.543 1.081 4.827 1.00 1.45 H new ATOM 0 HD23 LEU B 132 -2.231 1.565 5.927 1.00 1.45 H new ATOM 1943 N VAL B 133 -4.405 -2.734 8.923 1.00 52.41 N ATOM 1944 CA VAL B 133 -4.678 -2.912 10.368 1.00 21.35 C ATOM 1945 C VAL B 133 -4.017 -4.177 10.922 1.00 44.33 C ATOM 1946 O VAL B 133 -3.483 -4.188 12.025 1.00 53.35 O ATOM 1947 CB VAL B 133 -6.202 -2.925 10.703 1.00 63.02 C ATOM 1948 CG1 VAL B 133 -6.828 -1.596 10.354 1.00 50.41 C ATOM 1949 CG2 VAL B 133 -6.927 -4.051 9.978 1.00 75.14 C ATOM 0 H VAL B 133 -5.239 -2.671 8.340 1.00 52.41 H new ATOM 0 HA VAL B 133 -4.238 -2.041 10.854 1.00 21.35 H new ATOM 0 HB VAL B 133 -6.302 -3.098 11.774 1.00 63.02 H new ATOM 0 HG11 VAL B 133 -7.891 -1.621 10.593 1.00 50.41 H new ATOM 0 HG12 VAL B 133 -6.345 -0.805 10.927 1.00 50.41 H new ATOM 0 HG13 VAL B 133 -6.700 -1.402 9.289 1.00 50.41 H new ATOM 0 HG21 VAL B 133 -7.986 -4.028 10.236 1.00 75.14 H new ATOM 0 HG22 VAL B 133 -6.813 -3.923 8.902 1.00 75.14 H new ATOM 0 HG23 VAL B 133 -6.502 -5.009 10.277 1.00 75.14 H new ATOM 1959 N GLN B 134 -4.021 -5.215 10.118 1.00 61.32 N ATOM 1960 CA GLN B 134 -3.448 -6.466 10.457 1.00 13.45 C ATOM 1961 C GLN B 134 -1.955 -6.392 10.318 1.00 61.12 C ATOM 1962 O GLN B 134 -1.196 -6.844 11.175 1.00 5.12 O ATOM 1963 CB GLN B 134 -4.012 -7.494 9.486 1.00 74.20 C ATOM 1964 CG GLN B 134 -4.121 -8.909 10.009 1.00 32.25 C ATOM 1965 CD GLN B 134 -2.801 -9.588 10.367 1.00 32.25 C ATOM 1966 OE1 GLN B 134 -2.158 -10.210 9.522 1.00 52.22 O ATOM 1967 NE2 GLN B 134 -2.415 -9.528 11.614 1.00 33.14 N ATOM 0 H GLN B 134 -4.438 -5.196 9.188 1.00 61.32 H new ATOM 0 HA GLN B 134 -3.681 -6.739 11.486 1.00 13.45 H new ATOM 0 HB2 GLN B 134 -5.004 -7.165 9.175 1.00 74.20 H new ATOM 0 HB3 GLN B 134 -3.385 -7.504 8.594 1.00 74.20 H new ATOM 0 HG2 GLN B 134 -4.756 -8.901 10.895 1.00 32.25 H new ATOM 0 HG3 GLN B 134 -4.628 -9.516 9.259 1.00 32.25 H new ATOM 0 HE21 GLN B 134 -2.967 -9.005 12.294 1.00 33.14 H new ATOM 0 HE22 GLN B 134 -1.562 -10.004 11.907 1.00 33.14 H new ATOM 1976 N LEU B 135 -1.543 -5.741 9.298 1.00 41.34 N ATOM 1977 CA LEU B 135 -0.214 -5.811 8.877 1.00 2.34 C ATOM 1978 C LEU B 135 0.721 -4.870 9.538 1.00 22.41 C ATOM 1979 O LEU B 135 1.924 -4.976 9.375 1.00 21.40 O ATOM 1980 CB LEU B 135 -0.193 -5.729 7.439 1.00 11.30 C ATOM 1981 CG LEU B 135 -1.040 -6.814 6.802 1.00 20.55 C ATOM 1982 CD1 LEU B 135 -0.710 -6.857 5.454 1.00 75.50 C ATOM 1983 CD2 LEU B 135 -0.807 -8.197 7.409 1.00 33.34 C ATOM 0 H LEU B 135 -2.136 -5.137 8.729 1.00 41.34 H new ATOM 0 HA LEU B 135 0.183 -6.773 9.202 1.00 2.34 H new ATOM 0 HB2 LEU B 135 -0.558 -4.751 7.125 1.00 11.30 H new ATOM 0 HB3 LEU B 135 0.834 -5.814 7.085 1.00 11.30 H new ATOM 0 HG LEU B 135 -2.089 -6.570 6.972 1.00 20.55 H new ATOM 0 HD11 LEU B 135 -1.300 -7.628 4.959 1.00 75.50 H new ATOM 0 HD12 LEU B 135 -0.920 -5.890 4.997 1.00 75.50 H new ATOM 0 HD13 LEU B 135 0.350 -7.087 5.346 1.00 75.50 H new ATOM 0 HD21 LEU B 135 -1.444 -8.926 6.908 1.00 33.34 H new ATOM 0 HD22 LEU B 135 0.238 -8.479 7.281 1.00 33.34 H new ATOM 0 HD23 LEU B 135 -1.049 -8.173 8.472 1.00 33.34 H new ATOM 1995 N LEU B 136 0.193 -3.963 10.309 1.00 1.51 N ATOM 1996 CA LEU B 136 1.033 -3.141 11.136 1.00 54.14 C ATOM 1997 C LEU B 136 1.507 -3.921 12.348 1.00 13.33 C ATOM 1998 O LEU B 136 2.375 -3.491 13.077 1.00 3.12 O ATOM 1999 CB LEU B 136 0.367 -1.839 11.536 1.00 42.01 C ATOM 2000 CG LEU B 136 0.783 -0.614 10.720 1.00 13.14 C ATOM 2001 CD1 LEU B 136 0.257 -0.672 9.301 1.00 24.34 C ATOM 2002 CD2 LEU B 136 0.366 0.655 11.410 1.00 4.22 C ATOM 0 H LEU B 136 -0.807 -3.774 10.383 1.00 1.51 H new ATOM 0 HA LEU B 136 1.903 -2.863 10.540 1.00 54.14 H new ATOM 0 HB2 LEU B 136 -0.713 -1.962 11.452 1.00 42.01 H new ATOM 0 HB3 LEU B 136 0.585 -1.646 12.586 1.00 42.01 H new ATOM 0 HG LEU B 136 1.871 -0.620 10.653 1.00 13.14 H new ATOM 0 HD11 LEU B 136 0.576 0.218 8.758 1.00 24.34 H new ATOM 0 HD12 LEU B 136 0.648 -1.560 8.804 1.00 24.34 H new ATOM 0 HD13 LEU B 136 -0.832 -0.715 9.318 1.00 24.34 H new ATOM 0 HD21 LEU B 136 0.673 1.513 10.811 1.00 4.22 H new ATOM 0 HD22 LEU B 136 -0.717 0.665 11.530 1.00 4.22 H new ATOM 0 HD23 LEU B 136 0.840 0.709 12.390 1.00 4.22 H new ATOM 2014 N SER B 137 0.938 -5.074 12.525 1.00 43.00 N ATOM 2015 CA SER B 137 1.301 -5.963 13.563 1.00 41.04 C ATOM 2016 C SER B 137 1.901 -7.239 12.954 1.00 44.14 C ATOM 2017 O SER B 137 1.985 -8.277 13.619 1.00 73.33 O ATOM 2018 CB SER B 137 0.068 -6.325 14.336 1.00 73.31 C ATOM 2019 OG SER B 137 -0.669 -5.173 14.716 1.00 75.40 O ATOM 0 H SER B 137 0.188 -5.424 11.929 1.00 43.00 H new ATOM 0 HA SER B 137 2.034 -5.491 14.218 1.00 41.04 H new ATOM 0 HB2 SER B 137 -0.562 -6.977 13.732 1.00 73.31 H new ATOM 0 HB3 SER B 137 0.348 -6.888 15.226 1.00 73.31 H new ATOM 0 HG SER B 137 -1.467 -5.445 15.216 1.00 75.40 H new ATOM 2025 N SER B 138 2.340 -7.155 11.701 1.00 23.01 N ATOM 2026 CA SER B 138 2.830 -8.327 11.008 1.00 12.24 C ATOM 2027 C SER B 138 4.277 -8.668 11.451 1.00 63.40 C ATOM 2028 O SER B 138 5.115 -7.765 11.637 1.00 41.14 O ATOM 2029 CB SER B 138 2.722 -8.152 9.463 1.00 22.21 C ATOM 2030 OG SER B 138 3.504 -7.084 9.009 1.00 2.32 O ATOM 0 H SER B 138 2.364 -6.294 11.155 1.00 23.01 H new ATOM 0 HA SER B 138 2.198 -9.172 11.281 1.00 12.24 H new ATOM 0 HB2 SER B 138 3.038 -9.071 8.969 1.00 22.21 H new ATOM 0 HB3 SER B 138 1.681 -7.984 9.187 1.00 22.21 H new ATOM 0 HG SER B 138 3.105 -6.238 9.302 1.00 2.32 H new ATOM 2036 N PRO B 139 4.569 -9.966 11.708 1.00 53.33 N ATOM 2037 CA PRO B 139 5.918 -10.416 12.075 1.00 5.41 C ATOM 2038 C PRO B 139 6.856 -10.476 10.866 1.00 1.24 C ATOM 2039 O PRO B 139 8.084 -10.528 11.012 1.00 61.30 O ATOM 2040 CB PRO B 139 5.688 -11.811 12.656 1.00 4.45 C ATOM 2041 CG PRO B 139 4.436 -12.294 12.014 1.00 2.24 C ATOM 2042 CD PRO B 139 3.590 -11.077 11.740 1.00 31.31 C ATOM 0 HA PRO B 139 6.401 -9.733 12.773 1.00 5.41 H new ATOM 0 HB2 PRO B 139 6.525 -12.473 12.436 1.00 4.45 H new ATOM 0 HB3 PRO B 139 5.587 -11.775 13.741 1.00 4.45 H new ATOM 0 HG2 PRO B 139 4.657 -12.828 11.090 1.00 2.24 H new ATOM 0 HG3 PRO B 139 3.911 -12.991 12.667 1.00 2.24 H new ATOM 0 HD2 PRO B 139 3.055 -11.166 10.794 1.00 31.31 H new ATOM 0 HD3 PRO B 139 2.841 -10.928 12.517 1.00 31.31 H new ATOM 2050 N ASN B 140 6.272 -10.463 9.686 1.00 23.13 N ATOM 2051 CA ASN B 140 7.020 -10.475 8.446 1.00 13.45 C ATOM 2052 C ASN B 140 7.415 -9.041 8.165 1.00 61.51 C ATOM 2053 O ASN B 140 6.571 -8.233 7.778 1.00 72.24 O ATOM 2054 CB ASN B 140 6.134 -11.007 7.316 1.00 1.22 C ATOM 2055 CG ASN B 140 6.876 -11.463 6.043 1.00 75.12 C ATOM 2056 OD1 ASN B 140 8.044 -10.953 5.767 1.00 70.20 O flip ATOM 2057 ND2 ASN B 140 6.387 -12.323 5.329 1.00 45.21 N flip ATOM 0 H ASN B 140 5.260 -10.444 9.559 1.00 23.13 H new ATOM 0 HA ASN B 140 7.899 -11.116 8.517 1.00 13.45 H new ATOM 0 HB2 ASN B 140 5.555 -11.848 7.698 1.00 1.22 H new ATOM 0 HB3 ASN B 140 5.422 -10.229 7.040 1.00 1.22 H new ATOM 0 HD21 ASN B 140 5.473 -12.714 5.555 1.00 45.21 H new ATOM 0 HD22 ASN B 140 6.893 -12.651 4.506 1.00 45.21 H new ATOM 2064 N GLU B 141 8.684 -8.730 8.381 1.00 11.21 N ATOM 2065 CA GLU B 141 9.198 -7.362 8.269 1.00 60.43 C ATOM 2066 C GLU B 141 8.869 -6.690 6.953 1.00 50.41 C ATOM 2067 O GLU B 141 8.516 -5.539 6.950 1.00 70.33 O ATOM 2068 CB GLU B 141 10.695 -7.288 8.530 1.00 62.51 C ATOM 2069 CG GLU B 141 11.100 -7.726 9.912 1.00 42.24 C ATOM 2070 CD GLU B 141 12.575 -7.600 10.130 1.00 40.14 C ATOM 2071 OE1 GLU B 141 13.028 -6.514 10.556 1.00 11.10 O1- ATOM 2072 OE2 GLU B 141 13.309 -8.575 9.887 1.00 41.12 O ATOM 0 H GLU B 141 9.393 -9.416 8.640 1.00 11.21 H new ATOM 0 HA GLU B 141 8.676 -6.808 9.049 1.00 60.43 H new ATOM 0 HB2 GLU B 141 11.212 -7.908 7.798 1.00 62.51 H new ATOM 0 HB3 GLU B 141 11.030 -6.263 8.372 1.00 62.51 H new ATOM 0 HG2 GLU B 141 10.571 -7.125 10.652 1.00 42.24 H new ATOM 0 HG3 GLU B 141 10.798 -8.762 10.067 1.00 42.24 H new ATOM 2079 N GLN B 142 8.969 -7.421 5.838 1.00 70.44 N ATOM 2080 CA GLN B 142 8.672 -6.840 4.506 1.00 53.43 C ATOM 2081 C GLN B 142 7.280 -6.318 4.453 1.00 53.32 C ATOM 2082 O GLN B 142 7.022 -5.187 4.081 1.00 62.25 O ATOM 2083 CB GLN B 142 8.883 -7.860 3.394 1.00 15.41 C ATOM 2084 CG GLN B 142 10.269 -8.526 3.312 1.00 24.14 C ATOM 2085 CD GLN B 142 11.468 -7.595 3.440 1.00 4.22 C ATOM 2086 OE1 GLN B 142 11.434 -6.725 4.403 1.00 2.32 O flip ATOM 2087 NE2 GLN B 142 12.484 -7.796 2.784 1.00 73.33 N flip ATOM 0 H GLN B 142 9.248 -8.402 5.820 1.00 70.44 H new ATOM 0 HA GLN B 142 9.366 -6.014 4.352 1.00 53.43 H new ATOM 0 HB2 GLN B 142 8.136 -8.645 3.508 1.00 15.41 H new ATOM 0 HB3 GLN B 142 8.686 -7.368 2.441 1.00 15.41 H new ATOM 0 HG2 GLN B 142 10.334 -9.280 4.097 1.00 24.14 H new ATOM 0 HG3 GLN B 142 10.342 -9.050 2.359 1.00 24.14 H new ATOM 0 HE21 GLN B 142 12.478 -8.487 2.034 1.00 73.33 H new ATOM 0 HE22 GLN B 142 13.335 -7.272 2.989 1.00 73.33 H new ATOM 2096 N ILE B 143 6.428 -7.139 4.909 1.00 20.34 N ATOM 2097 CA ILE B 143 5.015 -6.851 4.977 1.00 52.30 C ATOM 2098 C ILE B 143 4.766 -5.655 5.893 1.00 42.34 C ATOM 2099 O ILE B 143 4.102 -4.718 5.502 1.00 54.41 O ATOM 2100 CB ILE B 143 4.190 -8.082 5.449 1.00 73.41 C ATOM 2101 CG1 ILE B 143 4.357 -9.244 4.465 1.00 54.32 C ATOM 2102 CG2 ILE B 143 2.719 -7.722 5.595 1.00 72.22 C ATOM 2103 CD1 ILE B 143 3.596 -10.498 4.847 1.00 21.13 C ATOM 0 H ILE B 143 6.676 -8.063 5.262 1.00 20.34 H new ATOM 0 HA ILE B 143 4.679 -6.607 3.969 1.00 52.30 H new ATOM 0 HB ILE B 143 4.566 -8.391 6.424 1.00 73.41 H new ATOM 0 HG12 ILE B 143 4.027 -8.919 3.478 1.00 54.32 H new ATOM 0 HG13 ILE B 143 5.417 -9.487 4.383 1.00 54.32 H new ATOM 0 HG21 ILE B 143 2.161 -8.598 5.926 1.00 72.22 H new ATOM 0 HG22 ILE B 143 2.611 -6.924 6.330 1.00 72.22 H new ATOM 0 HG23 ILE B 143 2.330 -7.386 4.634 1.00 72.22 H new ATOM 0 HD11 ILE B 143 3.769 -11.271 4.098 1.00 21.13 H new ATOM 0 HD12 ILE B 143 3.941 -10.851 5.819 1.00 21.13 H new ATOM 0 HD13 ILE B 143 2.530 -10.275 4.899 1.00 21.13 H new ATOM 2115 N LEU B 144 5.346 -5.682 7.082 1.00 33.20 N ATOM 2116 CA LEU B 144 5.184 -4.597 8.039 1.00 33.31 C ATOM 2117 C LEU B 144 5.768 -3.275 7.529 1.00 64.25 C ATOM 2118 O LEU B 144 5.152 -2.214 7.714 1.00 31.43 O ATOM 2119 CB LEU B 144 5.728 -4.988 9.429 1.00 23.23 C ATOM 2120 CG LEU B 144 5.762 -3.887 10.485 1.00 24.24 C ATOM 2121 CD1 LEU B 144 4.396 -3.282 10.641 1.00 61.43 C ATOM 2122 CD2 LEU B 144 6.227 -4.441 11.814 1.00 64.33 C ATOM 0 H LEU B 144 5.936 -6.447 7.409 1.00 33.20 H new ATOM 0 HA LEU B 144 4.114 -4.425 8.152 1.00 33.31 H new ATOM 0 HB2 LEU B 144 5.123 -5.809 9.813 1.00 23.23 H new ATOM 0 HB3 LEU B 144 6.741 -5.370 9.303 1.00 23.23 H new ATOM 0 HG LEU B 144 6.463 -3.118 10.159 1.00 24.24 H new ATOM 0 HD11 LEU B 144 4.430 -2.497 11.397 1.00 61.43 H new ATOM 0 HD12 LEU B 144 4.076 -2.856 9.690 1.00 61.43 H new ATOM 0 HD13 LEU B 144 3.690 -4.053 10.950 1.00 61.43 H new ATOM 0 HD21 LEU B 144 6.245 -3.642 12.555 1.00 64.33 H new ATOM 0 HD22 LEU B 144 5.543 -5.224 12.141 1.00 64.33 H new ATOM 0 HD23 LEU B 144 7.229 -4.857 11.704 1.00 64.33 H new ATOM 2134 N GLN B 145 6.926 -3.338 6.881 1.00 2.13 N ATOM 2135 CA GLN B 145 7.545 -2.154 6.294 1.00 22.40 C ATOM 2136 C GLN B 145 6.585 -1.502 5.336 1.00 15.32 C ATOM 2137 O GLN B 145 6.213 -0.344 5.509 1.00 35.45 O ATOM 2138 CB GLN B 145 8.825 -2.512 5.546 1.00 15.11 C ATOM 2139 CG GLN B 145 9.996 -2.912 6.415 1.00 2.31 C ATOM 2140 CD GLN B 145 11.146 -3.493 5.614 1.00 3.11 C ATOM 2141 OE1 GLN B 145 11.919 -4.323 6.118 1.00 23.01 O ATOM 2142 NE2 GLN B 145 11.266 -3.097 4.371 1.00 74.12 N ATOM 0 H GLN B 145 7.457 -4.199 6.748 1.00 2.13 H new ATOM 0 HA GLN B 145 7.794 -1.469 7.104 1.00 22.40 H new ATOM 0 HB2 GLN B 145 8.608 -3.331 4.860 1.00 15.11 H new ATOM 0 HB3 GLN B 145 9.121 -1.657 4.938 1.00 15.11 H new ATOM 0 HG2 GLN B 145 10.347 -2.041 6.968 1.00 2.31 H new ATOM 0 HG3 GLN B 145 9.664 -3.645 7.151 1.00 2.31 H new ATOM 0 HE21 GLN B 145 10.613 -2.413 3.988 1.00 74.12 H new ATOM 0 HE22 GLN B 145 12.012 -3.473 3.786 1.00 74.12 H new ATOM 2151 N GLU B 146 6.148 -2.273 4.378 1.00 73.44 N ATOM 2152 CA GLU B 146 5.246 -1.814 3.360 1.00 24.24 C ATOM 2153 C GLU B 146 3.894 -1.401 3.907 1.00 31.24 C ATOM 2154 O GLU B 146 3.299 -0.445 3.424 1.00 62.21 O ATOM 2155 CB GLU B 146 5.073 -2.865 2.307 1.00 70.33 C ATOM 2156 CG GLU B 146 6.106 -2.861 1.211 1.00 50.42 C ATOM 2157 CD GLU B 146 7.554 -3.077 1.651 1.00 20.31 C ATOM 2158 OE1 GLU B 146 8.216 -2.112 2.104 1.00 63.41 O ATOM 2159 OE2 GLU B 146 8.074 -4.202 1.475 1.00 21.32 O1- ATOM 0 H GLU B 146 6.413 -3.253 4.282 1.00 73.44 H new ATOM 0 HA GLU B 146 5.697 -0.923 2.923 1.00 24.24 H new ATOM 0 HB2 GLU B 146 5.084 -3.843 2.789 1.00 70.33 H new ATOM 0 HB3 GLU B 146 4.089 -2.743 1.855 1.00 70.33 H new ATOM 0 HG2 GLU B 146 5.846 -3.638 0.492 1.00 50.42 H new ATOM 0 HG3 GLU B 146 6.046 -1.908 0.686 1.00 50.42 H new ATOM 2166 N ALA B 147 3.416 -2.118 4.901 1.00 2.20 N ATOM 2167 CA ALA B 147 2.138 -1.835 5.528 1.00 24.43 C ATOM 2168 C ALA B 147 2.137 -0.451 6.134 1.00 31.12 C ATOM 2169 O ALA B 147 1.216 0.340 5.917 1.00 23.21 O ATOM 2170 CB ALA B 147 1.859 -2.856 6.601 1.00 63.31 C ATOM 0 H ALA B 147 3.904 -2.919 5.301 1.00 2.20 H new ATOM 0 HA ALA B 147 1.360 -1.884 4.766 1.00 24.43 H new ATOM 0 HB1 ALA B 147 0.899 -2.639 7.069 1.00 63.31 H new ATOM 0 HB2 ALA B 147 1.830 -3.851 6.158 1.00 63.31 H new ATOM 0 HB3 ALA B 147 2.646 -2.817 7.354 1.00 63.31 H new ATOM 2176 N LEU B 148 3.185 -0.154 6.866 1.00 41.05 N ATOM 2177 CA LEU B 148 3.314 1.121 7.518 1.00 22.40 C ATOM 2178 C LEU B 148 3.615 2.189 6.476 1.00 32.53 C ATOM 2179 O LEU B 148 3.075 3.280 6.535 1.00 31.33 O ATOM 2180 CB LEU B 148 4.401 1.030 8.612 1.00 52.13 C ATOM 2181 CG LEU B 148 4.570 2.218 9.587 1.00 51.40 C ATOM 2182 CD1 LEU B 148 5.385 1.775 10.764 1.00 15.54 C ATOM 2183 CD2 LEU B 148 5.266 3.392 8.929 1.00 24.24 C ATOM 0 H LEU B 148 3.968 -0.789 7.024 1.00 41.05 H new ATOM 0 HA LEU B 148 2.383 1.401 8.011 1.00 22.40 H new ATOM 0 HB2 LEU B 148 4.198 0.140 9.207 1.00 52.13 H new ATOM 0 HB3 LEU B 148 5.358 0.870 8.115 1.00 52.13 H new ATOM 0 HG LEU B 148 3.576 2.540 9.898 1.00 51.40 H new ATOM 0 HD11 LEU B 148 5.508 2.608 11.456 1.00 15.54 H new ATOM 0 HD12 LEU B 148 4.876 0.955 11.271 1.00 15.54 H new ATOM 0 HD13 LEU B 148 6.364 1.439 10.423 1.00 15.54 H new ATOM 0 HD21 LEU B 148 5.365 4.206 9.648 1.00 24.24 H new ATOM 0 HD22 LEU B 148 6.255 3.085 8.590 1.00 24.24 H new ATOM 0 HD23 LEU B 148 4.679 3.731 8.076 1.00 24.24 H new ATOM 2195 N TRP B 149 4.436 1.834 5.506 1.00 23.24 N ATOM 2196 CA TRP B 149 4.843 2.736 4.432 1.00 50.43 C ATOM 2197 C TRP B 149 3.623 3.159 3.587 1.00 1.20 C ATOM 2198 O TRP B 149 3.522 4.299 3.146 1.00 33.25 O ATOM 2199 CB TRP B 149 5.915 2.028 3.588 1.00 2.20 C ATOM 2200 CG TRP B 149 6.580 2.845 2.528 1.00 43.14 C ATOM 2201 CD1 TRP B 149 6.948 4.154 2.600 1.00 32.03 C ATOM 2202 CD2 TRP B 149 7.018 2.372 1.250 1.00 64.10 C ATOM 2203 NE1 TRP B 149 7.557 4.532 1.433 1.00 74.32 N ATOM 2204 CE2 TRP B 149 7.614 3.454 0.588 1.00 61.10 C ATOM 2205 CE3 TRP B 149 6.948 1.134 0.598 1.00 30.20 C ATOM 2206 CZ2 TRP B 149 8.145 3.338 -0.694 1.00 21.14 C ATOM 2207 CZ3 TRP B 149 7.475 1.020 -0.672 1.00 73.21 C ATOM 2208 CH2 TRP B 149 8.067 2.117 -1.307 1.00 43.45 C ATOM 0 H TRP B 149 4.846 0.903 5.436 1.00 23.24 H new ATOM 0 HA TRP B 149 5.267 3.652 4.844 1.00 50.43 H new ATOM 0 HB2 TRP B 149 6.685 1.652 4.261 1.00 2.20 H new ATOM 0 HB3 TRP B 149 5.456 1.161 3.112 1.00 2.20 H new ATOM 0 HD1 TRP B 149 6.784 4.798 3.451 1.00 32.03 H new ATOM 0 HE1 TRP B 149 7.911 5.466 1.226 1.00 74.32 H new ATOM 0 HE3 TRP B 149 6.490 0.284 1.081 1.00 30.20 H new ATOM 0 HZ2 TRP B 149 8.603 4.183 -1.188 1.00 21.14 H new ATOM 0 HZ3 TRP B 149 7.430 0.070 -1.183 1.00 73.21 H new ATOM 0 HH2 TRP B 149 8.471 1.998 -2.302 1.00 43.45 H new ATOM 2219 N ALA B 150 2.690 2.245 3.393 1.00 72.15 N ATOM 2220 CA ALA B 150 1.467 2.557 2.676 1.00 12.20 C ATOM 2221 C ALA B 150 0.586 3.471 3.521 1.00 24.10 C ATOM 2222 O ALA B 150 -0.063 4.391 3.009 1.00 62.22 O ATOM 2223 CB ALA B 150 0.713 1.283 2.315 1.00 12.20 C ATOM 0 H ALA B 150 2.755 1.282 3.721 1.00 72.15 H new ATOM 0 HA ALA B 150 1.729 3.072 1.752 1.00 12.20 H new ATOM 0 HB1 ALA B 150 -0.200 1.540 1.778 1.00 12.20 H new ATOM 0 HB2 ALA B 150 1.341 0.655 1.683 1.00 12.20 H new ATOM 0 HB3 ALA B 150 0.458 0.741 3.226 1.00 12.20 H new ATOM 2229 N LEU B 151 0.604 3.236 4.820 1.00 43.42 N ATOM 2230 CA LEU B 151 -0.199 3.972 5.752 1.00 24.21 C ATOM 2231 C LEU B 151 0.331 5.392 5.918 1.00 15.43 C ATOM 2232 O LEU B 151 -0.441 6.351 5.988 1.00 31.32 O ATOM 2233 CB LEU B 151 -0.265 3.201 7.080 1.00 71.20 C ATOM 2234 CG LEU B 151 -1.159 3.768 8.182 1.00 21.01 C ATOM 2235 CD1 LEU B 151 -1.676 2.633 9.028 1.00 61.01 C ATOM 2236 CD2 LEU B 151 -0.370 4.723 9.063 1.00 61.44 C ATOM 0 H LEU B 151 1.186 2.519 5.253 1.00 43.42 H new ATOM 0 HA LEU B 151 -1.216 4.070 5.372 1.00 24.21 H new ATOM 0 HB2 LEU B 151 -0.600 2.187 6.864 1.00 71.20 H new ATOM 0 HB3 LEU B 151 0.748 3.124 7.475 1.00 71.20 H new ATOM 0 HG LEU B 151 -1.988 4.308 7.725 1.00 21.01 H new ATOM 0 HD11 LEU B 151 -2.315 3.029 9.817 1.00 61.01 H new ATOM 0 HD12 LEU B 151 -2.251 1.948 8.405 1.00 61.01 H new ATOM 0 HD13 LEU B 151 -0.836 2.100 9.474 1.00 61.01 H new ATOM 0 HD21 LEU B 151 -1.020 5.119 9.843 1.00 61.44 H new ATOM 0 HD22 LEU B 151 0.464 4.191 9.521 1.00 61.44 H new ATOM 0 HD23 LEU B 151 0.012 5.545 8.458 1.00 61.44 H new ATOM 2248 N SER B 152 1.633 5.528 5.947 1.00 40.11 N ATOM 2249 CA SER B 152 2.254 6.807 6.075 1.00 14.53 C ATOM 2250 C SER B 152 2.005 7.623 4.804 1.00 51.32 C ATOM 2251 O SER B 152 1.756 8.831 4.860 1.00 32.02 O ATOM 2252 CB SER B 152 3.740 6.616 6.360 1.00 34.43 C ATOM 2253 OG SER B 152 4.362 5.876 5.344 1.00 63.34 O ATOM 0 H SER B 152 2.287 4.748 5.882 1.00 40.11 H new ATOM 0 HA SER B 152 1.825 7.362 6.909 1.00 14.53 H new ATOM 0 HB2 SER B 152 4.223 7.589 6.452 1.00 34.43 H new ATOM 0 HB3 SER B 152 3.867 6.105 7.315 1.00 34.43 H new ATOM 0 HG SER B 152 3.679 5.469 4.771 1.00 63.34 H new ATOM 2259 N ASN B 153 2.028 6.939 3.668 1.00 31.23 N ATOM 2260 CA ASN B 153 1.736 7.562 2.380 1.00 23.52 C ATOM 2261 C ASN B 153 0.294 8.039 2.278 1.00 24.11 C ATOM 2262 O ASN B 153 0.047 9.161 1.851 1.00 30.42 O ATOM 2263 CB ASN B 153 2.133 6.683 1.177 1.00 43.14 C ATOM 2264 CG ASN B 153 3.633 6.675 0.931 1.00 25.55 C ATOM 2265 OD1 ASN B 153 4.327 7.666 1.202 1.00 63.24 O ATOM 2266 ND2 ASN B 153 4.159 5.580 0.433 1.00 52.31 N ATOM 0 H ASN B 153 2.247 5.945 3.611 1.00 31.23 H new ATOM 0 HA ASN B 153 2.370 8.447 2.335 1.00 23.52 H new ATOM 0 HB2 ASN B 153 1.791 5.662 1.348 1.00 43.14 H new ATOM 0 HB3 ASN B 153 1.624 7.044 0.284 1.00 43.14 H new ATOM 0 HD21 ASN B 153 5.163 5.530 0.260 1.00 52.31 H new ATOM 0 HD22 ASN B 153 3.564 4.780 0.220 1.00 52.31 H new ATOM 2273 N ILE B 154 -0.661 7.239 2.714 1.00 24.44 N ATOM 2274 CA ILE B 154 -2.057 7.680 2.656 1.00 34.14 C ATOM 2275 C ILE B 154 -2.359 8.761 3.685 1.00 52.23 C ATOM 2276 O ILE B 154 -3.272 9.544 3.527 1.00 33.30 O ATOM 2277 CB ILE B 154 -3.093 6.542 2.775 1.00 10.30 C ATOM 2278 CG1 ILE B 154 -2.917 5.742 4.071 1.00 74.33 C ATOM 2279 CG2 ILE B 154 -3.030 5.645 1.551 1.00 64.13 C ATOM 2280 CD1 ILE B 154 -3.948 4.645 4.279 1.00 71.41 C ATOM 0 H ILE B 154 -0.512 6.308 3.102 1.00 24.44 H new ATOM 0 HA ILE B 154 -2.162 8.095 1.654 1.00 34.14 H new ATOM 0 HB ILE B 154 -4.085 6.992 2.820 1.00 10.30 H new ATOM 0 HG12 ILE B 154 -1.923 5.295 4.075 1.00 74.33 H new ATOM 0 HG13 ILE B 154 -2.960 6.429 4.916 1.00 74.33 H new ATOM 0 HG21 ILE B 154 -3.765 4.846 1.647 1.00 64.13 H new ATOM 0 HG22 ILE B 154 -3.246 6.232 0.658 1.00 64.13 H new ATOM 0 HG23 ILE B 154 -2.033 5.212 1.468 1.00 64.13 H new ATOM 0 HD11 ILE B 154 -3.748 4.131 5.219 1.00 71.41 H new ATOM 0 HD12 ILE B 154 -4.945 5.084 4.311 1.00 71.41 H new ATOM 0 HD13 ILE B 154 -3.892 3.932 3.457 1.00 71.41 H new ATOM 2292 N ALA B 155 -1.584 8.809 4.718 1.00 24.33 N ATOM 2293 CA ALA B 155 -1.765 9.822 5.744 1.00 73.42 C ATOM 2294 C ALA B 155 -1.044 11.116 5.383 1.00 2.12 C ATOM 2295 O ALA B 155 -1.280 12.154 5.988 1.00 11.44 O ATOM 2296 CB ALA B 155 -1.268 9.312 7.073 1.00 1.12 C ATOM 0 H ALA B 155 -0.813 8.163 4.888 1.00 24.33 H new ATOM 0 HA ALA B 155 -2.831 10.037 5.815 1.00 73.42 H new ATOM 0 HB1 ALA B 155 -1.409 10.080 7.833 1.00 1.12 H new ATOM 0 HB2 ALA B 155 -1.827 8.419 7.352 1.00 1.12 H new ATOM 0 HB3 ALA B 155 -0.208 9.068 6.996 1.00 1.12 H new ATOM 2302 N SER B 156 -0.189 11.052 4.384 1.00 55.34 N ATOM 2303 CA SER B 156 0.642 12.214 4.014 1.00 43.25 C ATOM 2304 C SER B 156 -0.088 13.196 3.101 1.00 72.22 C ATOM 2305 O SER B 156 0.426 14.287 2.805 1.00 40.10 O ATOM 2306 CB SER B 156 1.968 11.766 3.364 1.00 63.53 C ATOM 2307 OG SER B 156 1.769 11.093 2.122 1.00 45.43 O ATOM 0 H SER B 156 -0.041 10.223 3.809 1.00 55.34 H new ATOM 0 HA SER B 156 0.862 12.739 4.943 1.00 43.25 H new ATOM 0 HB2 SER B 156 2.603 12.638 3.203 1.00 63.53 H new ATOM 0 HB3 SER B 156 2.500 11.106 4.050 1.00 63.53 H new ATOM 0 HG SER B 156 1.018 10.469 2.205 1.00 45.43 H new ATOM 2313 N GLY B 157 -1.275 12.821 2.686 1.00 3.25 N ATOM 2314 CA GLY B 157 -2.043 13.616 1.744 1.00 53.44 C ATOM 2315 C GLY B 157 -2.662 14.873 2.331 1.00 55.11 C ATOM 2316 O GLY B 157 -1.960 15.768 2.840 1.00 33.43 O ATOM 0 H GLY B 157 -1.737 11.963 2.987 1.00 3.25 H new ATOM 0 HA2 GLY B 157 -1.394 13.900 0.915 1.00 53.44 H new ATOM 0 HA3 GLY B 157 -2.837 12.996 1.329 1.00 53.44 H new ATOM 2320 N GLY B 158 -3.965 14.934 2.277 1.00 32.43 N ATOM 2321 CA GLY B 158 -4.655 16.100 2.716 1.00 53.51 C ATOM 2322 C GLY B 158 -5.024 16.016 4.153 1.00 63.11 C ATOM 2323 O GLY B 158 -5.070 14.906 4.735 1.00 61.25 O ATOM 0 H GLY B 158 -4.564 14.185 1.931 1.00 32.43 H new ATOM 0 HA2 GLY B 158 -4.028 16.976 2.553 1.00 53.51 H new ATOM 0 HA3 GLY B 158 -5.555 16.236 2.117 1.00 53.51 H new ATOM 2327 N ASN B 159 -5.312 17.159 4.736 1.00 22.51 N ATOM 2328 CA ASN B 159 -5.688 17.263 6.136 1.00 71.23 C ATOM 2329 C ASN B 159 -7.112 16.734 6.326 1.00 50.05 C ATOM 2330 O ASN B 159 -8.072 17.490 6.396 1.00 31.23 O ATOM 2331 CB ASN B 159 -5.564 18.719 6.624 1.00 32.13 C ATOM 2332 CG ASN B 159 -5.775 18.880 8.118 1.00 71.04 C ATOM 2333 OD1 ASN B 159 -5.465 17.992 8.904 1.00 51.34 O ATOM 2334 ND2 ASN B 159 -6.285 20.010 8.517 1.00 51.13 N ATOM 0 H ASN B 159 -5.293 18.055 4.249 1.00 22.51 H new ATOM 0 HA ASN B 159 -5.009 16.657 6.736 1.00 71.23 H new ATOM 0 HB2 ASN B 159 -4.576 19.098 6.362 1.00 32.13 H new ATOM 0 HB3 ASN B 159 -6.292 19.334 6.095 1.00 32.13 H new ATOM 0 HD21 ASN B 159 -6.438 20.178 9.511 1.00 51.13 H new ATOM 0 HD22 ASN B 159 -6.532 20.727 7.835 1.00 51.13 H new ATOM 2341 N GLU B 160 -7.210 15.422 6.293 1.00 62.53 N ATOM 2342 CA GLU B 160 -8.443 14.663 6.409 1.00 1.30 C ATOM 2343 C GLU B 160 -8.051 13.196 6.408 1.00 72.33 C ATOM 2344 O GLU B 160 -8.441 12.427 7.276 1.00 51.33 O ATOM 2345 CB GLU B 160 -9.359 14.914 5.189 1.00 31.13 C ATOM 2346 CG GLU B 160 -10.730 14.261 5.304 1.00 30.30 C ATOM 2347 CD GLU B 160 -11.538 14.323 4.027 1.00 71.21 C ATOM 2348 OE1 GLU B 160 -11.787 15.428 3.512 1.00 61.11 O1- ATOM 2349 OE2 GLU B 160 -11.936 13.258 3.507 1.00 73.24 O ATOM 0 H GLU B 160 -6.392 14.823 6.179 1.00 62.53 H new ATOM 0 HA GLU B 160 -8.978 14.955 7.313 1.00 1.30 H new ATOM 0 HB2 GLU B 160 -9.489 15.988 5.059 1.00 31.13 H new ATOM 0 HB3 GLU B 160 -8.864 14.542 4.292 1.00 31.13 H new ATOM 0 HG2 GLU B 160 -10.603 13.218 5.594 1.00 30.30 H new ATOM 0 HG3 GLU B 160 -11.290 14.748 6.102 1.00 30.30 H new ATOM 2356 N GLN B 161 -7.177 12.860 5.449 1.00 43.03 N ATOM 2357 CA GLN B 161 -6.723 11.483 5.188 1.00 13.21 C ATOM 2358 C GLN B 161 -6.085 10.866 6.374 1.00 14.43 C ATOM 2359 O GLN B 161 -6.186 9.661 6.593 1.00 52.42 O ATOM 2360 CB GLN B 161 -5.697 11.471 4.089 1.00 3.33 C ATOM 2361 CG GLN B 161 -6.149 12.102 2.793 1.00 54.33 C ATOM 2362 CD GLN B 161 -7.529 11.666 2.313 1.00 64.12 C ATOM 2363 OE1 GLN B 161 -8.219 12.447 1.706 1.00 43.13 O ATOM 2364 NE2 GLN B 161 -7.922 10.435 2.550 1.00 3.14 N ATOM 0 H GLN B 161 -6.758 13.547 4.822 1.00 43.03 H new ATOM 0 HA GLN B 161 -7.614 10.918 4.915 1.00 13.21 H new ATOM 0 HB2 GLN B 161 -4.805 11.991 4.438 1.00 3.33 H new ATOM 0 HB3 GLN B 161 -5.408 10.439 3.893 1.00 3.33 H new ATOM 0 HG2 GLN B 161 -6.148 13.185 2.914 1.00 54.33 H new ATOM 0 HG3 GLN B 161 -5.420 11.867 2.018 1.00 54.33 H new ATOM 0 HE21 GLN B 161 -7.317 9.797 3.066 1.00 3.14 H new ATOM 0 HE22 GLN B 161 -8.833 10.117 2.218 1.00 3.14 H new ATOM 2373 N LYS B 162 -5.423 11.707 7.118 1.00 0.42 N ATOM 2374 CA LYS B 162 -4.688 11.346 8.317 1.00 34.22 C ATOM 2375 C LYS B 162 -5.488 10.442 9.293 1.00 74.45 C ATOM 2376 O LYS B 162 -4.915 9.642 10.030 1.00 33.34 O ATOM 2377 CB LYS B 162 -4.205 12.605 9.026 1.00 72.40 C ATOM 2378 CG LYS B 162 -5.288 13.677 9.203 1.00 52.41 C ATOM 2379 CD LYS B 162 -4.795 14.902 9.963 1.00 41.24 C ATOM 2380 CE LYS B 162 -3.583 15.505 9.305 1.00 73.42 C ATOM 2381 NZ LYS B 162 -3.130 16.754 9.963 1.00 52.31 N1+ ATOM 0 H LYS B 162 -5.373 12.703 6.905 1.00 0.42 H new ATOM 0 HA LYS B 162 -3.835 10.750 7.992 1.00 34.22 H new ATOM 0 HB2 LYS B 162 -3.816 12.331 10.007 1.00 72.40 H new ATOM 0 HB3 LYS B 162 -3.375 13.031 8.462 1.00 72.40 H new ATOM 0 HG2 LYS B 162 -5.649 13.986 8.222 1.00 52.41 H new ATOM 0 HG3 LYS B 162 -6.136 13.244 9.733 1.00 52.41 H new ATOM 0 HD2 LYS B 162 -5.591 15.645 10.014 1.00 41.24 H new ATOM 0 HD3 LYS B 162 -4.553 14.623 10.989 1.00 41.24 H new ATOM 0 HE2 LYS B 162 -2.770 14.779 9.317 1.00 73.42 H new ATOM 0 HE3 LYS B 162 -3.809 15.713 8.259 1.00 73.42 H new ATOM 0 HZ1 LYS B 162 -2.264 17.096 9.500 1.00 52.31 H new ATOM 0 HZ2 LYS B 162 -3.873 17.477 9.885 1.00 52.31 H new ATOM 0 HZ3 LYS B 162 -2.934 16.566 10.967 1.00 52.31 H new ATOM 2395 N GLN B 163 -6.797 10.584 9.260 1.00 44.12 N ATOM 2396 CA GLN B 163 -7.738 9.799 10.047 1.00 22.12 C ATOM 2397 C GLN B 163 -7.521 8.311 9.936 1.00 51.22 C ATOM 2398 O GLN B 163 -7.704 7.580 10.898 1.00 21.12 O ATOM 2399 CB GLN B 163 -9.114 10.140 9.594 1.00 65.03 C ATOM 2400 CG GLN B 163 -9.812 11.041 10.532 1.00 10.31 C ATOM 2401 CD GLN B 163 -8.998 12.250 10.945 1.00 23.02 C ATOM 2402 OE1 GLN B 163 -8.288 12.216 11.936 1.00 51.44 O ATOM 2403 NE2 GLN B 163 -9.056 13.300 10.183 1.00 74.51 N ATOM 0 H GLN B 163 -7.256 11.273 8.664 1.00 44.12 H new ATOM 0 HA GLN B 163 -7.584 10.049 11.097 1.00 22.12 H new ATOM 0 HB2 GLN B 163 -9.063 10.611 8.613 1.00 65.03 H new ATOM 0 HB3 GLN B 163 -9.692 9.223 9.478 1.00 65.03 H new ATOM 0 HG2 GLN B 163 -10.740 11.380 10.071 1.00 10.31 H new ATOM 0 HG3 GLN B 163 -10.086 10.478 11.424 1.00 10.31 H new ATOM 0 HE21 GLN B 163 -9.659 13.300 9.360 1.00 74.51 H new ATOM 0 HE22 GLN B 163 -8.499 14.124 10.407 1.00 74.51 H new ATOM 2412 N ALA B 164 -7.120 7.897 8.777 1.00 12.31 N ATOM 2413 CA ALA B 164 -6.818 6.490 8.477 1.00 53.43 C ATOM 2414 C ALA B 164 -5.839 5.878 9.496 1.00 5.41 C ATOM 2415 O ALA B 164 -5.973 4.724 9.863 1.00 10.13 O ATOM 2416 CB ALA B 164 -6.267 6.344 7.064 1.00 42.21 C ATOM 0 H ALA B 164 -6.983 8.521 7.982 1.00 12.31 H new ATOM 0 HA ALA B 164 -7.756 5.940 8.550 1.00 53.43 H new ATOM 0 HB1 ALA B 164 -6.051 5.294 6.864 1.00 42.21 H new ATOM 0 HB2 ALA B 164 -7.004 6.705 6.347 1.00 42.21 H new ATOM 0 HB3 ALA B 164 -5.351 6.928 6.968 1.00 42.21 H new ATOM 2422 N VAL B 165 -4.891 6.678 9.982 1.00 70.30 N ATOM 2423 CA VAL B 165 -3.905 6.212 10.967 1.00 33.51 C ATOM 2424 C VAL B 165 -4.613 5.941 12.289 1.00 35.21 C ATOM 2425 O VAL B 165 -4.382 4.924 12.964 1.00 22.21 O ATOM 2426 CB VAL B 165 -2.819 7.283 11.228 1.00 21.31 C ATOM 2427 CG1 VAL B 165 -1.729 6.754 12.146 1.00 1.54 C ATOM 2428 CG2 VAL B 165 -2.240 7.808 9.935 1.00 51.12 C ATOM 0 H VAL B 165 -4.781 7.655 9.711 1.00 70.30 H new ATOM 0 HA VAL B 165 -3.435 5.312 10.571 1.00 33.51 H new ATOM 0 HB VAL B 165 -3.300 8.119 11.736 1.00 21.31 H new ATOM 0 HG11 VAL B 165 -0.982 7.531 12.309 1.00 1.54 H new ATOM 0 HG12 VAL B 165 -2.167 6.465 13.102 1.00 1.54 H new ATOM 0 HG13 VAL B 165 -1.256 5.886 11.686 1.00 1.54 H new ATOM 0 HG21 VAL B 165 -1.480 8.558 10.155 1.00 51.12 H new ATOM 0 HG22 VAL B 165 -1.789 6.987 9.379 1.00 51.12 H new ATOM 0 HG23 VAL B 165 -3.033 8.258 9.338 1.00 51.12 H new ATOM 2438 N LYS B 166 -5.495 6.848 12.623 1.00 0.12 N ATOM 2439 CA LYS B 166 -6.267 6.802 13.839 1.00 11.42 C ATOM 2440 C LYS B 166 -7.221 5.623 13.791 1.00 64.14 C ATOM 2441 O LYS B 166 -7.270 4.813 14.711 1.00 25.03 O ATOM 2442 CB LYS B 166 -7.049 8.109 13.988 1.00 43.43 C ATOM 2443 CG LYS B 166 -6.172 9.356 14.045 1.00 4.11 C ATOM 2444 CD LYS B 166 -5.362 9.413 15.337 1.00 3.34 C ATOM 2445 CE LYS B 166 -4.628 10.740 15.486 1.00 71.14 C ATOM 2446 NZ LYS B 166 -5.563 11.877 15.589 1.00 20.11 N1+ ATOM 0 H LYS B 166 -5.702 7.660 12.042 1.00 0.12 H new ATOM 0 HA LYS B 166 -5.603 6.682 14.695 1.00 11.42 H new ATOM 0 HB2 LYS B 166 -7.742 8.203 13.152 1.00 43.43 H new ATOM 0 HB3 LYS B 166 -7.650 8.059 14.896 1.00 43.43 H new ATOM 0 HG2 LYS B 166 -5.496 9.366 13.190 1.00 4.11 H new ATOM 0 HG3 LYS B 166 -6.797 10.245 13.967 1.00 4.11 H new ATOM 0 HD2 LYS B 166 -6.026 9.267 16.189 1.00 3.34 H new ATOM 0 HD3 LYS B 166 -4.641 8.595 15.351 1.00 3.34 H new ATOM 0 HE2 LYS B 166 -3.996 10.708 16.374 1.00 71.14 H new ATOM 0 HE3 LYS B 166 -3.969 10.888 14.631 1.00 71.14 H new ATOM 0 HZ1 LYS B 166 -5.067 12.700 15.987 1.00 20.11 H new ATOM 0 HZ2 LYS B 166 -5.926 12.115 14.644 1.00 20.11 H new ATOM 0 HZ3 LYS B 166 -6.357 11.619 16.209 1.00 20.11 H new ATOM 2460 N GLU B 167 -7.911 5.501 12.678 1.00 11.33 N ATOM 2461 CA GLU B 167 -8.884 4.447 12.455 1.00 35.32 C ATOM 2462 C GLU B 167 -8.228 3.080 12.334 1.00 41.44 C ATOM 2463 O GLU B 167 -8.868 2.064 12.545 1.00 2.22 O ATOM 2464 CB GLU B 167 -9.711 4.746 11.219 1.00 24.25 C ATOM 2465 CG GLU B 167 -10.547 6.007 11.342 1.00 60.12 C ATOM 2466 CD GLU B 167 -11.356 6.283 10.112 1.00 40.44 C ATOM 2467 OE1 GLU B 167 -12.457 5.687 9.961 1.00 21.04 O ATOM 2468 OE2 GLU B 167 -10.938 7.104 9.279 1.00 2.14 O1- ATOM 0 H GLU B 167 -7.812 6.140 11.889 1.00 11.33 H new ATOM 0 HA GLU B 167 -9.538 4.418 13.326 1.00 35.32 H new ATOM 0 HB2 GLU B 167 -9.046 4.842 10.361 1.00 24.25 H new ATOM 0 HB3 GLU B 167 -10.369 3.901 11.019 1.00 24.25 H new ATOM 0 HG2 GLU B 167 -11.215 5.914 12.198 1.00 60.12 H new ATOM 0 HG3 GLU B 167 -9.892 6.855 11.540 1.00 60.12 H new ATOM 2475 N ALA B 168 -6.959 3.054 11.998 1.00 2.34 N ATOM 2476 CA ALA B 168 -6.240 1.800 11.919 1.00 74.32 C ATOM 2477 C ALA B 168 -5.732 1.383 13.289 1.00 31.14 C ATOM 2478 O ALA B 168 -5.359 0.227 13.500 1.00 4.24 O ATOM 2479 CB ALA B 168 -5.070 1.899 10.953 1.00 62.35 C ATOM 0 H ALA B 168 -6.404 3.881 11.776 1.00 2.34 H new ATOM 0 HA ALA B 168 -6.936 1.047 11.551 1.00 74.32 H new ATOM 0 HB1 ALA B 168 -4.548 0.943 10.914 1.00 62.35 H new ATOM 0 HB2 ALA B 168 -5.439 2.152 9.959 1.00 62.35 H new ATOM 0 HB3 ALA B 168 -4.382 2.674 11.292 1.00 62.35 H new ATOM 2485 N GLY B 169 -5.727 2.328 14.223 1.00 31.03 N ATOM 2486 CA GLY B 169 -5.172 2.071 15.537 1.00 24.24 C ATOM 2487 C GLY B 169 -3.662 2.037 15.462 1.00 0.34 C ATOM 2488 O GLY B 169 -2.990 1.462 16.304 1.00 10.22 O ATOM 0 H GLY B 169 -6.098 3.269 14.092 1.00 31.03 H new ATOM 0 HA2 GLY B 169 -5.493 2.845 16.234 1.00 24.24 H new ATOM 0 HA3 GLY B 169 -5.547 1.122 15.920 1.00 24.24 H new ATOM 2492 N ALA B 170 -3.137 2.699 14.447 1.00 23.32 N ATOM 2493 CA ALA B 170 -1.727 2.703 14.156 1.00 3.21 C ATOM 2494 C ALA B 170 -0.955 3.533 15.150 1.00 55.44 C ATOM 2495 O ALA B 170 0.200 3.286 15.374 1.00 31.41 O ATOM 2496 CB ALA B 170 -1.501 3.218 12.759 1.00 24.01 C ATOM 0 H ALA B 170 -3.692 3.255 13.796 1.00 23.32 H new ATOM 0 HA ALA B 170 -1.362 1.679 14.232 1.00 3.21 H new ATOM 0 HB1 ALA B 170 -0.433 3.220 12.540 1.00 24.01 H new ATOM 0 HB2 ALA B 170 -2.016 2.574 12.046 1.00 24.01 H new ATOM 0 HB3 ALA B 170 -1.890 4.233 12.678 1.00 24.01 H new ATOM 2502 N LEU B 171 -1.629 4.487 15.761 1.00 40.12 N ATOM 2503 CA LEU B 171 -1.046 5.418 16.741 1.00 30.30 C ATOM 2504 C LEU B 171 -0.106 4.749 17.761 1.00 5.35 C ATOM 2505 O LEU B 171 1.059 5.146 17.912 1.00 33.54 O ATOM 2506 CB LEU B 171 -2.171 6.146 17.454 1.00 12.41 C ATOM 2507 CG LEU B 171 -3.367 5.298 17.832 1.00 74.20 C ATOM 2508 CD1 LEU B 171 -3.532 5.203 19.335 1.00 4.42 C ATOM 2509 CD2 LEU B 171 -4.581 5.867 17.170 1.00 5.42 C ATOM 0 H LEU B 171 -2.622 4.651 15.594 1.00 40.12 H new ATOM 0 HA LEU B 171 -0.419 6.116 16.186 1.00 30.30 H new ATOM 0 HB2 LEU B 171 -1.769 6.599 18.360 1.00 12.41 H new ATOM 0 HB3 LEU B 171 -2.514 6.961 16.816 1.00 12.41 H new ATOM 0 HG LEU B 171 -3.215 4.277 17.483 1.00 74.20 H new ATOM 0 HD11 LEU B 171 -4.400 4.587 19.567 1.00 4.42 H new ATOM 0 HD12 LEU B 171 -2.640 4.753 19.771 1.00 4.42 H new ATOM 0 HD13 LEU B 171 -3.674 6.201 19.749 1.00 4.42 H new ATOM 0 HD21 LEU B 171 -5.453 5.268 17.432 1.00 5.42 H new ATOM 0 HD22 LEU B 171 -4.732 6.893 17.506 1.00 5.42 H new ATOM 0 HD23 LEU B 171 -4.445 5.856 16.089 1.00 5.42 H new ATOM 2521 N GLU B 172 -0.601 3.701 18.383 1.00 30.13 N ATOM 2522 CA GLU B 172 0.090 2.970 19.415 1.00 4.13 C ATOM 2523 C GLU B 172 1.229 2.145 18.834 1.00 42.25 C ATOM 2524 O GLU B 172 2.214 1.849 19.507 1.00 3.44 O ATOM 2525 CB GLU B 172 -0.943 2.067 20.081 1.00 62.45 C ATOM 2526 CG GLU B 172 -1.596 1.057 19.144 1.00 45.44 C ATOM 2527 CD GLU B 172 -1.062 -0.354 19.299 1.00 4.34 C ATOM 2528 OE1 GLU B 172 -1.465 -1.056 20.245 1.00 70.52 O ATOM 2529 OE2 GLU B 172 -0.240 -0.797 18.477 1.00 25.23 O1- ATOM 0 H GLU B 172 -1.526 3.325 18.175 1.00 30.13 H new ATOM 0 HA GLU B 172 0.536 3.654 20.137 1.00 4.13 H new ATOM 0 HB2 GLU B 172 -0.463 1.528 20.898 1.00 62.45 H new ATOM 0 HB3 GLU B 172 -1.721 2.690 20.523 1.00 62.45 H new ATOM 0 HG2 GLU B 172 -2.671 1.051 19.324 1.00 45.44 H new ATOM 0 HG3 GLU B 172 -1.447 1.381 18.114 1.00 45.44 H new ATOM 2536 N LYS B 173 1.111 1.856 17.569 1.00 51.20 N ATOM 2537 CA LYS B 173 2.009 0.963 16.891 1.00 22.31 C ATOM 2538 C LYS B 173 3.172 1.744 16.436 1.00 74.11 C ATOM 2539 O LYS B 173 4.281 1.293 16.492 1.00 13.51 O ATOM 2540 CB LYS B 173 1.313 0.356 15.665 1.00 61.04 C ATOM 2541 CG LYS B 173 2.080 -0.767 15.031 1.00 41.21 C ATOM 2542 CD LYS B 173 2.090 -2.008 15.900 1.00 35.24 C ATOM 2543 CE LYS B 173 0.820 -2.852 15.713 1.00 33.53 C ATOM 2544 NZ LYS B 173 -0.428 -2.255 16.250 1.00 14.22 N1+ ATOM 0 H LYS B 173 0.379 2.239 16.971 1.00 51.20 H new ATOM 0 HA LYS B 173 2.315 0.162 17.564 1.00 22.31 H new ATOM 0 HB2 LYS B 173 0.329 -0.009 15.960 1.00 61.04 H new ATOM 0 HB3 LYS B 173 1.153 1.139 14.924 1.00 61.04 H new ATOM 0 HG2 LYS B 173 1.640 -1.006 14.063 1.00 41.21 H new ATOM 0 HG3 LYS B 173 3.105 -0.446 14.845 1.00 41.21 H new ATOM 0 HD2 LYS B 173 2.965 -2.612 15.660 1.00 35.24 H new ATOM 0 HD3 LYS B 173 2.181 -1.717 16.946 1.00 35.24 H new ATOM 0 HE2 LYS B 173 0.683 -3.040 14.648 1.00 33.53 H new ATOM 0 HE3 LYS B 173 0.974 -3.820 16.191 1.00 33.53 H new ATOM 0 HZ1 LYS B 173 -1.102 -3.012 16.483 1.00 14.22 H new ATOM 0 HZ2 LYS B 173 -0.210 -1.709 17.108 1.00 14.22 H new ATOM 0 HZ3 LYS B 173 -0.847 -1.626 15.536 1.00 14.22 H new ATOM 2558 N LEU B 174 2.895 2.938 16.033 1.00 64.33 N ATOM 2559 CA LEU B 174 3.863 3.808 15.494 1.00 21.44 C ATOM 2560 C LEU B 174 4.894 4.126 16.521 1.00 13.12 C ATOM 2561 O LEU B 174 6.063 3.871 16.307 1.00 41.23 O ATOM 2562 CB LEU B 174 3.201 5.069 14.977 1.00 13.32 C ATOM 2563 CG LEU B 174 2.147 4.887 13.887 1.00 43.01 C ATOM 2564 CD1 LEU B 174 1.665 6.222 13.369 1.00 32.30 C ATOM 2565 CD2 LEU B 174 2.642 3.980 12.763 1.00 73.55 C ATOM 0 H LEU B 174 1.958 3.340 16.074 1.00 64.33 H new ATOM 0 HA LEU B 174 4.358 3.317 14.656 1.00 21.44 H new ATOM 0 HB2 LEU B 174 2.736 5.580 15.820 1.00 13.32 H new ATOM 0 HB3 LEU B 174 3.978 5.730 14.593 1.00 13.32 H new ATOM 0 HG LEU B 174 1.291 4.384 14.337 1.00 43.01 H new ATOM 0 HD11 LEU B 174 0.915 6.062 12.594 1.00 32.30 H new ATOM 0 HD12 LEU B 174 1.225 6.793 14.187 1.00 32.30 H new ATOM 0 HD13 LEU B 174 2.506 6.776 12.952 1.00 32.30 H new ATOM 0 HD21 LEU B 174 1.862 3.877 12.009 1.00 73.55 H new ATOM 0 HD22 LEU B 174 3.531 4.416 12.308 1.00 73.55 H new ATOM 0 HD23 LEU B 174 2.886 2.998 13.169 1.00 73.55 H new ATOM 2577 N GLU B 175 4.433 4.610 17.660 1.00 14.43 N ATOM 2578 CA GLU B 175 5.284 4.982 18.799 1.00 71.15 C ATOM 2579 C GLU B 175 6.146 3.830 19.248 1.00 63.14 C ATOM 2580 O GLU B 175 7.280 4.001 19.685 1.00 23.23 O ATOM 2581 CB GLU B 175 4.394 5.415 19.918 1.00 33.41 C ATOM 2582 CG GLU B 175 3.689 6.711 19.623 1.00 34.40 C ATOM 2583 CD GLU B 175 4.527 7.928 19.940 1.00 5.20 C ATOM 2584 OE1 GLU B 175 5.649 8.035 19.448 1.00 51.45 O1- ATOM 2585 OE2 GLU B 175 4.065 8.795 20.718 1.00 0.14 O ATOM 0 H GLU B 175 3.439 4.762 17.833 1.00 14.43 H new ATOM 0 HA GLU B 175 5.952 5.789 18.498 1.00 71.15 H new ATOM 0 HB2 GLU B 175 3.654 4.638 20.111 1.00 33.41 H new ATOM 0 HB3 GLU B 175 4.985 5.525 20.827 1.00 33.41 H new ATOM 0 HG2 GLU B 175 3.410 6.734 18.570 1.00 34.40 H new ATOM 0 HG3 GLU B 175 2.765 6.754 20.199 1.00 34.40 H new ATOM 2592 N GLN B 176 5.613 2.672 19.099 1.00 31.22 N ATOM 2593 CA GLN B 176 6.275 1.468 19.460 1.00 22.33 C ATOM 2594 C GLN B 176 7.292 1.091 18.383 1.00 24.43 C ATOM 2595 O GLN B 176 8.437 0.728 18.673 1.00 11.14 O ATOM 2596 CB GLN B 176 5.199 0.383 19.626 1.00 71.21 C ATOM 2597 CG GLN B 176 5.469 -0.912 18.921 1.00 15.53 C ATOM 2598 CD GLN B 176 6.608 -1.735 19.504 1.00 44.42 C ATOM 2599 OE1 GLN B 176 7.274 -2.459 18.658 1.00 3.32 O flip ATOM 2600 NE2 GLN B 176 6.891 -1.692 20.703 1.00 20.41 N flip ATOM 0 H GLN B 176 4.680 2.530 18.713 1.00 31.22 H new ATOM 0 HA GLN B 176 6.825 1.583 20.394 1.00 22.33 H new ATOM 0 HB2 GLN B 176 5.077 0.178 20.690 1.00 71.21 H new ATOM 0 HB3 GLN B 176 4.250 0.780 19.267 1.00 71.21 H new ATOM 0 HG2 GLN B 176 4.560 -1.514 18.937 1.00 15.53 H new ATOM 0 HG3 GLN B 176 5.692 -0.700 17.875 1.00 15.53 H new ATOM 0 HE21 GLN B 176 6.342 -1.110 21.336 1.00 20.41 H new ATOM 0 HE22 GLN B 176 7.674 -2.238 21.062 1.00 20.41 H new ATOM 2609 N LEU B 177 6.894 1.268 17.150 1.00 2.05 N ATOM 2610 CA LEU B 177 7.641 0.772 16.024 1.00 63.52 C ATOM 2611 C LEU B 177 8.871 1.615 15.765 1.00 43.13 C ATOM 2612 O LEU B 177 9.770 1.240 15.016 1.00 5.45 O ATOM 2613 CB LEU B 177 6.774 0.633 14.765 1.00 10.21 C ATOM 2614 CG LEU B 177 6.392 -0.795 14.343 1.00 75.43 C ATOM 2615 CD1 LEU B 177 5.821 -1.565 15.468 1.00 31.02 C ATOM 2616 CD2 LEU B 177 5.412 -0.775 13.204 1.00 60.35 C ATOM 0 H LEU B 177 6.038 1.763 16.898 1.00 2.05 H new ATOM 0 HA LEU B 177 7.977 -0.232 16.283 1.00 63.52 H new ATOM 0 HB2 LEU B 177 5.855 1.199 14.920 1.00 10.21 H new ATOM 0 HB3 LEU B 177 7.302 1.103 13.935 1.00 10.21 H new ATOM 0 HG LEU B 177 7.311 -1.285 14.020 1.00 75.43 H new ATOM 0 HD11 LEU B 177 5.564 -2.568 15.129 1.00 31.02 H new ATOM 0 HD12 LEU B 177 6.553 -1.630 16.273 1.00 31.02 H new ATOM 0 HD13 LEU B 177 4.924 -1.065 15.833 1.00 31.02 H new ATOM 0 HD21 LEU B 177 5.158 -1.797 12.925 1.00 60.35 H new ATOM 0 HD22 LEU B 177 4.509 -0.248 13.510 1.00 60.35 H new ATOM 0 HD23 LEU B 177 5.857 -0.265 12.350 1.00 60.35 H new ATOM 2628 N GLN B 178 8.895 2.739 16.414 1.00 3.12 N ATOM 2629 CA GLN B 178 9.994 3.651 16.407 1.00 25.32 C ATOM 2630 C GLN B 178 11.228 3.032 17.074 1.00 3.35 C ATOM 2631 O GLN B 178 12.360 3.412 16.816 1.00 14.10 O ATOM 2632 CB GLN B 178 9.534 4.876 17.113 1.00 11.43 C ATOM 2633 CG GLN B 178 8.569 5.594 16.238 1.00 51.35 C ATOM 2634 CD GLN B 178 7.705 6.549 16.949 1.00 4.01 C ATOM 2635 OE1 GLN B 178 6.523 6.693 16.433 1.00 14.02 O flip ATOM 2636 NE2 GLN B 178 8.082 7.143 17.948 1.00 35.53 N flip ATOM 0 H GLN B 178 8.114 3.058 16.987 1.00 3.12 H new ATOM 0 HA GLN B 178 10.299 3.894 15.389 1.00 25.32 H new ATOM 0 HB2 GLN B 178 9.063 4.612 18.060 1.00 11.43 H new ATOM 0 HB3 GLN B 178 10.383 5.519 17.348 1.00 11.43 H new ATOM 0 HG2 GLN B 178 9.123 6.128 15.466 1.00 51.35 H new ATOM 0 HG3 GLN B 178 7.941 4.861 15.731 1.00 51.35 H new ATOM 0 HE21 GLN B 178 9.024 6.989 18.308 1.00 35.53 H new ATOM 0 HE22 GLN B 178 7.455 7.793 18.422 1.00 35.53 H new ATOM 2645 N SER B 179 10.977 2.061 17.922 1.00 71.35 N ATOM 2646 CA SER B 179 11.998 1.321 18.607 1.00 52.42 C ATOM 2647 C SER B 179 12.032 -0.142 18.098 1.00 42.11 C ATOM 2648 O SER B 179 12.587 -1.019 18.740 1.00 30.44 O ATOM 2649 CB SER B 179 11.721 1.369 20.108 1.00 41.34 C ATOM 2650 OG SER B 179 11.678 2.722 20.573 1.00 35.00 O ATOM 0 H SER B 179 10.031 1.761 18.157 1.00 71.35 H new ATOM 0 HA SER B 179 12.973 1.766 18.409 1.00 52.42 H new ATOM 0 HB2 SER B 179 10.774 0.875 20.324 1.00 41.34 H new ATOM 0 HB3 SER B 179 12.496 0.820 20.643 1.00 41.34 H new ATOM 0 HG SER B 179 11.498 2.731 21.536 1.00 35.00 H new ATOM 2656 N HIS B 180 11.453 -0.385 16.925 1.00 20.34 N ATOM 2657 CA HIS B 180 11.312 -1.757 16.380 1.00 63.10 C ATOM 2658 C HIS B 180 12.597 -2.244 15.652 1.00 3.13 C ATOM 2659 O HIS B 180 12.523 -3.102 14.783 1.00 63.12 O ATOM 2660 CB HIS B 180 10.108 -1.789 15.420 1.00 41.03 C ATOM 2661 CG HIS B 180 9.620 -3.158 15.022 1.00 71.12 C ATOM 2662 ND1 HIS B 180 9.924 -3.758 13.825 1.00 53.22 N ATOM 2663 CD2 HIS B 180 8.804 -4.010 15.661 1.00 4.04 C ATOM 2664 CE1 HIS B 180 9.309 -4.912 13.747 1.00 5.15 C ATOM 2665 NE2 HIS B 180 8.624 -5.092 14.848 1.00 32.31 N ATOM 0 H HIS B 180 11.069 0.344 16.323 1.00 20.34 H new ATOM 0 HA HIS B 180 11.151 -2.439 17.215 1.00 63.10 H new ATOM 0 HB2 HIS B 180 9.282 -1.251 15.886 1.00 41.03 H new ATOM 0 HB3 HIS B 180 10.375 -1.242 14.515 1.00 41.03 H new ATOM 0 HD2 HIS B 180 8.369 -3.866 16.639 1.00 4.04 H new ATOM 0 HE1 HIS B 180 9.359 -5.599 12.915 1.00 5.15 H new ATOM 0 HE2 HIS B 180 8.050 -5.907 15.063 1.00 32.31 H new ATOM 2674 N GLU B 181 13.751 -1.754 16.089 1.00 2.42 N ATOM 2675 CA GLU B 181 15.088 -2.039 15.542 1.00 24.11 C ATOM 2676 C GLU B 181 15.291 -1.828 14.007 1.00 73.22 C ATOM 2677 O GLU B 181 16.235 -1.140 13.599 1.00 23.13 O ATOM 2678 CB GLU B 181 15.531 -3.374 16.016 1.00 33.31 C ATOM 2679 CG GLU B 181 15.491 -3.459 17.534 1.00 71.21 C ATOM 2680 CD GLU B 181 16.369 -2.446 18.237 1.00 73.43 C ATOM 2681 OE1 GLU B 181 17.602 -2.567 18.197 1.00 50.12 O1- ATOM 2682 OE2 GLU B 181 15.826 -1.493 18.832 1.00 20.11 O ATOM 0 H GLU B 181 13.790 -1.110 16.879 1.00 2.42 H new ATOM 0 HA GLU B 181 15.741 -1.262 15.939 1.00 24.11 H new ATOM 0 HB2 GLU B 181 14.890 -4.146 15.589 1.00 33.31 H new ATOM 0 HB3 GLU B 181 16.544 -3.570 15.665 1.00 33.31 H new ATOM 0 HG2 GLU B 181 14.462 -3.324 17.867 1.00 71.21 H new ATOM 0 HG3 GLU B 181 15.796 -4.460 17.839 1.00 71.21 H new ATOM 2689 N ASN B 182 14.441 -2.426 13.193 1.00 73.12 N ATOM 2690 CA ASN B 182 14.458 -2.289 11.729 1.00 54.11 C ATOM 2691 C ASN B 182 14.279 -0.830 11.348 1.00 71.31 C ATOM 2692 O ASN B 182 13.224 -0.236 11.624 1.00 71.34 O ATOM 2693 CB ASN B 182 13.336 -3.166 11.118 1.00 50.34 C ATOM 2694 CG ASN B 182 13.210 -3.131 9.583 1.00 4.25 C ATOM 2695 OD1 ASN B 182 13.414 -2.112 8.937 1.00 4.24 O ATOM 2696 ND2 ASN B 182 12.902 -4.260 9.004 1.00 35.35 N ATOM 0 H ASN B 182 13.697 -3.038 13.529 1.00 73.12 H new ATOM 0 HA ASN B 182 15.416 -2.628 11.336 1.00 54.11 H new ATOM 0 HB2 ASN B 182 13.502 -4.199 11.425 1.00 50.34 H new ATOM 0 HB3 ASN B 182 12.384 -2.854 11.548 1.00 50.34 H new ATOM 0 HD21 ASN B 182 12.826 -4.308 7.988 1.00 35.35 H new ATOM 0 HD22 ASN B 182 12.737 -5.094 9.568 1.00 35.35 H new ATOM 2703 N GLU B 183 15.301 -0.274 10.703 1.00 54.32 N ATOM 2704 CA GLU B 183 15.343 1.139 10.338 1.00 1.43 C ATOM 2705 C GLU B 183 14.244 1.536 9.385 1.00 55.01 C ATOM 2706 O GLU B 183 13.716 2.639 9.486 1.00 62.22 O ATOM 2707 CB GLU B 183 16.667 1.511 9.694 1.00 25.20 C ATOM 2708 CG GLU B 183 17.882 1.363 10.570 1.00 10.53 C ATOM 2709 CD GLU B 183 19.099 1.908 9.883 1.00 73.31 C ATOM 2710 OE1 GLU B 183 19.727 1.185 9.089 1.00 14.01 O1- ATOM 2711 OE2 GLU B 183 19.425 3.102 10.084 1.00 40.35 O ATOM 0 H GLU B 183 16.130 -0.795 10.417 1.00 54.32 H new ATOM 0 HA GLU B 183 15.210 1.675 11.278 1.00 1.43 H new ATOM 0 HB2 GLU B 183 16.804 0.894 8.806 1.00 25.20 H new ATOM 0 HB3 GLU B 183 16.608 2.546 9.357 1.00 25.20 H new ATOM 0 HG2 GLU B 183 17.724 1.888 11.512 1.00 10.53 H new ATOM 0 HG3 GLU B 183 18.035 0.312 10.813 1.00 10.53 H new ATOM 2718 N LYS B 184 13.862 0.627 8.495 1.00 14.44 N ATOM 2719 CA LYS B 184 12.915 0.956 7.433 1.00 15.14 C ATOM 2720 C LYS B 184 11.579 1.218 8.025 1.00 51.03 C ATOM 2721 O LYS B 184 10.852 2.104 7.609 1.00 51.12 O ATOM 2722 CB LYS B 184 12.836 -0.165 6.412 1.00 51.14 C ATOM 2723 CG LYS B 184 14.170 -0.469 5.796 1.00 21.11 C ATOM 2724 CD LYS B 184 14.046 -1.447 4.640 1.00 61.11 C ATOM 2725 CE LYS B 184 15.393 -1.746 4.000 1.00 43.25 C ATOM 2726 NZ LYS B 184 16.367 -2.294 4.969 1.00 21.21 N1+ ATOM 0 H LYS B 184 14.191 -0.339 8.486 1.00 14.44 H new ATOM 0 HA LYS B 184 13.260 1.852 6.917 1.00 15.14 H new ATOM 0 HB2 LYS B 184 12.446 -1.063 6.891 1.00 51.14 H new ATOM 0 HB3 LYS B 184 12.130 0.110 5.628 1.00 51.14 H new ATOM 0 HG2 LYS B 184 14.627 0.456 5.443 1.00 21.11 H new ATOM 0 HG3 LYS B 184 14.835 -0.884 6.554 1.00 21.11 H new ATOM 0 HD2 LYS B 184 13.600 -2.375 4.997 1.00 61.11 H new ATOM 0 HD3 LYS B 184 13.371 -1.037 3.889 1.00 61.11 H new ATOM 0 HE2 LYS B 184 15.256 -2.457 3.185 1.00 43.25 H new ATOM 0 HE3 LYS B 184 15.795 -0.833 3.562 1.00 43.25 H new ATOM 0 HZ1 LYS B 184 17.191 -2.669 4.458 1.00 21.21 H new ATOM 0 HZ2 LYS B 184 16.674 -1.540 5.616 1.00 21.21 H new ATOM 0 HZ3 LYS B 184 15.921 -3.058 5.515 1.00 21.21 H new ATOM 2740 N ILE B 185 11.292 0.458 9.018 1.00 73.44 N ATOM 2741 CA ILE B 185 10.080 0.634 9.764 1.00 3.30 C ATOM 2742 C ILE B 185 10.228 1.840 10.659 1.00 51.25 C ATOM 2743 O ILE B 185 9.462 2.755 10.565 1.00 23.34 O ATOM 2744 CB ILE B 185 9.745 -0.594 10.627 1.00 15.31 C ATOM 2745 CG1 ILE B 185 9.619 -1.812 9.713 1.00 13.13 C ATOM 2746 CG2 ILE B 185 8.422 -0.343 11.380 1.00 73.34 C ATOM 2747 CD1 ILE B 185 9.530 -3.121 10.434 1.00 10.43 C ATOM 0 H ILE B 185 11.884 -0.306 9.344 1.00 73.44 H new ATOM 0 HA ILE B 185 9.266 0.771 9.052 1.00 3.30 H new ATOM 0 HB ILE B 185 10.533 -0.773 11.359 1.00 15.31 H new ATOM 0 HG12 ILE B 185 8.732 -1.693 9.090 1.00 13.13 H new ATOM 0 HG13 ILE B 185 10.478 -1.838 9.043 1.00 13.13 H new ATOM 0 HG21 ILE B 185 8.182 -1.212 11.993 1.00 73.34 H new ATOM 0 HG22 ILE B 185 8.528 0.534 12.019 1.00 73.34 H new ATOM 0 HG23 ILE B 185 7.621 -0.173 10.661 1.00 73.34 H new ATOM 0 HD11 ILE B 185 9.443 -3.930 9.709 1.00 10.43 H new ATOM 0 HD12 ILE B 185 10.427 -3.267 11.035 1.00 10.43 H new ATOM 0 HD13 ILE B 185 8.655 -3.120 11.083 1.00 10.43 H new ATOM 2759 N GLN B 186 11.278 1.828 11.471 1.00 71.14 N ATOM 2760 CA GLN B 186 11.577 2.857 12.477 1.00 10.32 C ATOM 2761 C GLN B 186 11.424 4.293 11.958 1.00 43.42 C ATOM 2762 O GLN B 186 10.663 5.090 12.528 1.00 3.52 O ATOM 2763 CB GLN B 186 12.992 2.645 12.974 1.00 73.43 C ATOM 2764 CG GLN B 186 13.538 3.720 13.885 1.00 21.13 C ATOM 2765 CD GLN B 186 14.949 3.417 14.280 1.00 2.13 C ATOM 2766 OE1 GLN B 186 15.891 3.789 13.585 1.00 11.23 O ATOM 2767 NE2 GLN B 186 15.121 2.778 15.394 1.00 52.24 N ATOM 0 H GLN B 186 11.971 1.080 11.452 1.00 71.14 H new ATOM 0 HA GLN B 186 10.848 2.746 13.280 1.00 10.32 H new ATOM 0 HB2 GLN B 186 13.032 1.693 13.503 1.00 73.43 H new ATOM 0 HB3 GLN B 186 13.651 2.558 12.110 1.00 73.43 H new ATOM 0 HG2 GLN B 186 13.496 4.686 13.381 1.00 21.13 H new ATOM 0 HG3 GLN B 186 12.915 3.798 14.776 1.00 21.13 H new ATOM 0 HE21 GLN B 186 14.313 2.485 15.944 1.00 52.24 H new ATOM 0 HE22 GLN B 186 16.064 2.568 15.721 1.00 52.24 H new ATOM 2776 N LYS B 187 12.124 4.605 10.874 1.00 64.14 N ATOM 2777 CA LYS B 187 12.128 5.956 10.321 1.00 10.24 C ATOM 2778 C LYS B 187 10.738 6.367 9.832 1.00 15.35 C ATOM 2779 O LYS B 187 10.285 7.483 10.085 1.00 2.40 O ATOM 2780 CB LYS B 187 13.171 6.111 9.190 1.00 50.43 C ATOM 2781 CG LYS B 187 12.910 5.251 7.967 1.00 1.44 C ATOM 2782 CD LYS B 187 13.921 5.493 6.872 1.00 11.13 C ATOM 2783 CE LYS B 187 13.538 4.721 5.625 1.00 4.53 C ATOM 2784 NZ LYS B 187 14.481 4.926 4.507 1.00 33.34 N1+ ATOM 0 H LYS B 187 12.699 3.939 10.358 1.00 64.14 H new ATOM 0 HA LYS B 187 12.414 6.627 11.131 1.00 10.24 H new ATOM 0 HB2 LYS B 187 13.202 7.156 8.883 1.00 50.43 H new ATOM 0 HB3 LYS B 187 14.156 5.866 9.586 1.00 50.43 H new ATOM 0 HG2 LYS B 187 12.932 4.199 8.253 1.00 1.44 H new ATOM 0 HG3 LYS B 187 11.909 5.457 7.587 1.00 1.44 H new ATOM 0 HD2 LYS B 187 13.976 6.558 6.647 1.00 11.13 H new ATOM 0 HD3 LYS B 187 14.912 5.187 7.208 1.00 11.13 H new ATOM 0 HE2 LYS B 187 13.490 3.658 5.863 1.00 4.53 H new ATOM 0 HE3 LYS B 187 12.539 5.022 5.310 1.00 4.53 H new ATOM 0 HZ1 LYS B 187 14.168 4.374 3.683 1.00 33.34 H new ATOM 0 HZ2 LYS B 187 14.509 5.935 4.257 1.00 33.34 H new ATOM 0 HZ3 LYS B 187 15.431 4.613 4.792 1.00 33.34 H new ATOM 2798 N GLU B 188 10.047 5.453 9.188 1.00 43.13 N ATOM 2799 CA GLU B 188 8.745 5.741 8.651 1.00 54.00 C ATOM 2800 C GLU B 188 7.703 5.709 9.773 1.00 73.03 C ATOM 2801 O GLU B 188 6.704 6.386 9.711 1.00 44.34 O ATOM 2802 CB GLU B 188 8.390 4.743 7.543 1.00 15.34 C ATOM 2803 CG GLU B 188 9.416 4.650 6.406 1.00 4.53 C ATOM 2804 CD GLU B 188 9.658 5.955 5.675 1.00 21.24 C ATOM 2805 OE1 GLU B 188 10.439 6.791 6.154 1.00 32.42 O ATOM 2806 OE2 GLU B 188 9.093 6.147 4.571 1.00 2.20 O1- ATOM 0 H GLU B 188 10.371 4.500 9.025 1.00 43.13 H new ATOM 0 HA GLU B 188 8.752 6.739 8.213 1.00 54.00 H new ATOM 0 HB2 GLU B 188 8.272 3.755 7.988 1.00 15.34 H new ATOM 0 HB3 GLU B 188 7.424 5.020 7.120 1.00 15.34 H new ATOM 0 HG2 GLU B 188 10.362 4.295 6.815 1.00 4.53 H new ATOM 0 HG3 GLU B 188 9.078 3.902 5.688 1.00 4.53 H new ATOM 2813 N ALA B 189 7.980 4.922 10.800 1.00 62.14 N ATOM 2814 CA ALA B 189 7.127 4.767 11.975 1.00 44.10 C ATOM 2815 C ALA B 189 6.958 6.087 12.699 1.00 2.32 C ATOM 2816 O ALA B 189 5.849 6.473 13.079 1.00 62.51 O ATOM 2817 CB ALA B 189 7.719 3.749 12.932 1.00 61.04 C ATOM 0 H ALA B 189 8.827 4.356 10.844 1.00 62.14 H new ATOM 0 HA ALA B 189 6.152 4.421 11.632 1.00 44.10 H new ATOM 0 HB1 ALA B 189 7.070 3.647 13.802 1.00 61.04 H new ATOM 0 HB2 ALA B 189 7.807 2.786 12.430 1.00 61.04 H new ATOM 0 HB3 ALA B 189 8.706 4.082 13.253 1.00 61.04 H new ATOM 2823 N GLN B 190 8.068 6.777 12.896 1.00 22.14 N ATOM 2824 CA GLN B 190 8.051 8.080 13.529 1.00 44.21 C ATOM 2825 C GLN B 190 7.532 9.132 12.576 1.00 2.14 C ATOM 2826 O GLN B 190 6.814 10.044 12.973 1.00 33.51 O ATOM 2827 CB GLN B 190 9.430 8.449 14.096 1.00 32.11 C ATOM 2828 CG GLN B 190 10.590 8.262 13.137 1.00 13.34 C ATOM 2829 CD GLN B 190 11.915 8.580 13.772 1.00 31.01 C ATOM 2830 OE1 GLN B 190 12.563 7.709 14.349 1.00 63.44 O ATOM 2831 NE2 GLN B 190 12.333 9.815 13.677 1.00 10.22 N ATOM 0 H GLN B 190 8.996 6.453 12.624 1.00 22.14 H new ATOM 0 HA GLN B 190 7.365 8.035 14.375 1.00 44.21 H new ATOM 0 HB2 GLN B 190 9.407 9.491 14.416 1.00 32.11 H new ATOM 0 HB3 GLN B 190 9.613 7.846 14.986 1.00 32.11 H new ATOM 0 HG2 GLN B 190 10.600 7.233 12.779 1.00 13.34 H new ATOM 0 HG3 GLN B 190 10.445 8.901 12.266 1.00 13.34 H new ATOM 0 HE21 GLN B 190 11.766 10.509 13.190 1.00 10.22 H new ATOM 0 HE22 GLN B 190 13.226 10.084 14.090 1.00 10.22 H new ATOM 2840 N GLU B 191 7.843 8.959 11.307 1.00 44.10 N ATOM 2841 CA GLU B 191 7.404 9.872 10.281 1.00 20.22 C ATOM 2842 C GLU B 191 5.890 9.765 10.084 1.00 74.33 C ATOM 2843 O GLU B 191 5.226 10.728 9.705 1.00 43.03 O ATOM 2844 CB GLU B 191 8.130 9.591 8.978 1.00 44.20 C ATOM 2845 CG GLU B 191 7.806 10.592 7.892 1.00 31.04 C ATOM 2846 CD GLU B 191 8.501 10.320 6.611 1.00 24.34 C ATOM 2847 OE1 GLU B 191 9.713 10.592 6.514 1.00 61.21 O ATOM 2848 OE2 GLU B 191 7.840 9.878 5.653 1.00 32.10 O1- ATOM 0 H GLU B 191 8.406 8.182 10.962 1.00 44.10 H new ATOM 0 HA GLU B 191 7.640 10.888 10.596 1.00 20.22 H new ATOM 0 HB2 GLU B 191 9.205 9.595 9.159 1.00 44.20 H new ATOM 0 HB3 GLU B 191 7.869 8.591 8.632 1.00 44.20 H new ATOM 0 HG2 GLU B 191 6.730 10.593 7.719 1.00 31.04 H new ATOM 0 HG3 GLU B 191 8.075 11.590 8.237 1.00 31.04 H new ATOM 2855 N ALA B 192 5.347 8.596 10.359 1.00 64.54 N ATOM 2856 CA ALA B 192 3.928 8.370 10.265 1.00 55.12 C ATOM 2857 C ALA B 192 3.191 9.224 11.277 1.00 65.14 C ATOM 2858 O ALA B 192 2.098 9.679 11.013 1.00 42.53 O ATOM 2859 CB ALA B 192 3.584 6.898 10.411 1.00 14.22 C ATOM 0 H ALA B 192 5.882 7.779 10.654 1.00 64.54 H new ATOM 0 HA ALA B 192 3.601 8.669 9.269 1.00 55.12 H new ATOM 0 HB1 ALA B 192 2.505 6.767 10.335 1.00 14.22 H new ATOM 0 HB2 ALA B 192 4.075 6.330 9.621 1.00 14.22 H new ATOM 0 HB3 ALA B 192 3.925 6.539 11.382 1.00 14.22 H new ATOM 2865 N LEU B 193 3.830 9.493 12.417 1.00 51.24 N ATOM 2866 CA LEU B 193 3.254 10.387 13.405 1.00 61.43 C ATOM 2867 C LEU B 193 3.206 11.804 12.871 1.00 22.13 C ATOM 2868 O LEU B 193 2.259 12.555 13.124 1.00 2.22 O ATOM 2869 CB LEU B 193 4.039 10.389 14.700 1.00 12.23 C ATOM 2870 CG LEU B 193 3.880 9.184 15.603 1.00 65.50 C ATOM 2871 CD1 LEU B 193 4.701 9.408 16.831 1.00 33.02 C ATOM 2872 CD2 LEU B 193 2.414 8.974 15.983 1.00 43.33 C ATOM 0 H LEU B 193 4.738 9.105 12.671 1.00 51.24 H new ATOM 0 HA LEU B 193 2.247 10.022 13.608 1.00 61.43 H new ATOM 0 HB2 LEU B 193 5.096 10.491 14.455 1.00 12.23 H new ATOM 0 HB3 LEU B 193 3.756 11.276 15.266 1.00 12.23 H new ATOM 0 HG LEU B 193 4.217 8.290 15.079 1.00 65.50 H new ATOM 0 HD11 LEU B 193 4.601 8.551 17.497 1.00 33.02 H new ATOM 0 HD12 LEU B 193 5.747 9.531 16.552 1.00 33.02 H new ATOM 0 HD13 LEU B 193 4.354 10.306 17.342 1.00 33.02 H new ATOM 0 HD21 LEU B 193 2.328 8.102 16.632 1.00 43.33 H new ATOM 0 HD22 LEU B 193 2.044 9.855 16.508 1.00 43.33 H new ATOM 0 HD23 LEU B 193 1.823 8.815 15.081 1.00 43.33 H new ATOM 2884 N GLU B 194 4.209 12.142 12.078 1.00 23.31 N ATOM 2885 CA GLU B 194 4.357 13.473 11.517 1.00 74.40 C ATOM 2886 C GLU B 194 3.261 13.769 10.503 1.00 4.10 C ATOM 2887 O GLU B 194 2.973 14.930 10.213 1.00 14.22 O ATOM 2888 CB GLU B 194 5.731 13.651 10.868 1.00 22.14 C ATOM 2889 CG GLU B 194 6.896 13.385 11.800 1.00 52.34 C ATOM 2890 CD GLU B 194 8.226 13.734 11.179 1.00 63.15 C ATOM 2891 OE1 GLU B 194 8.731 12.982 10.318 1.00 62.11 O1- ATOM 2892 OE2 GLU B 194 8.794 14.780 11.534 1.00 31.45 O ATOM 0 H GLU B 194 4.948 11.495 11.804 1.00 23.31 H new ATOM 0 HA GLU B 194 4.268 14.182 12.340 1.00 74.40 H new ATOM 0 HB2 GLU B 194 5.805 12.982 10.011 1.00 22.14 H new ATOM 0 HB3 GLU B 194 5.811 14.669 10.485 1.00 22.14 H new ATOM 0 HG2 GLU B 194 6.764 13.962 12.715 1.00 52.34 H new ATOM 0 HG3 GLU B 194 6.897 12.333 12.084 1.00 52.34 H new ATOM 2899 N LYS B 195 2.634 12.717 9.988 1.00 30.15 N ATOM 2900 CA LYS B 195 1.560 12.867 9.017 1.00 43.22 C ATOM 2901 C LYS B 195 0.324 13.435 9.722 1.00 34.34 C ATOM 2902 O LYS B 195 -0.455 14.174 9.137 1.00 53.51 O ATOM 2903 CB LYS B 195 1.196 11.522 8.381 1.00 71.55 C ATOM 2904 CG LYS B 195 2.373 10.673 7.905 1.00 11.51 C ATOM 2905 CD LYS B 195 3.245 11.346 6.862 1.00 4.51 C ATOM 2906 CE LYS B 195 4.369 10.404 6.452 1.00 12.42 C ATOM 2907 NZ LYS B 195 5.313 11.001 5.484 1.00 5.34 N1+ ATOM 0 H LYS B 195 2.853 11.750 10.228 1.00 30.15 H new ATOM 0 HA LYS B 195 1.899 13.541 8.230 1.00 43.22 H new ATOM 0 HB2 LYS B 195 0.623 10.942 9.105 1.00 71.55 H new ATOM 0 HB3 LYS B 195 0.540 11.709 7.531 1.00 71.55 H new ATOM 0 HG2 LYS B 195 2.990 10.413 8.765 1.00 11.51 H new ATOM 0 HG3 LYS B 195 1.990 9.739 7.494 1.00 11.51 H new ATOM 0 HD2 LYS B 195 2.647 11.615 5.992 1.00 4.51 H new ATOM 0 HD3 LYS B 195 3.660 12.271 7.262 1.00 4.51 H new ATOM 0 HE2 LYS B 195 4.919 10.097 7.342 1.00 12.42 H new ATOM 0 HE3 LYS B 195 3.937 9.502 6.018 1.00 12.42 H new ATOM 0 HZ1 LYS B 195 6.139 10.379 5.376 1.00 5.34 H new ATOM 0 HZ2 LYS B 195 4.842 11.113 4.564 1.00 5.34 H new ATOM 0 HZ3 LYS B 195 5.623 11.931 5.830 1.00 5.34 H new ATOM 2921 N LEU B 196 0.175 13.094 10.997 1.00 15.24 N ATOM 2922 CA LEU B 196 -0.934 13.592 11.806 1.00 71.10 C ATOM 2923 C LEU B 196 -0.635 15.007 12.223 1.00 52.31 C ATOM 2924 O LEU B 196 -1.510 15.878 12.211 1.00 3.43 O ATOM 2925 CB LEU B 196 -1.155 12.753 13.095 1.00 3.45 C ATOM 2926 CG LEU B 196 -1.618 11.289 12.966 1.00 74.14 C ATOM 2927 CD1 LEU B 196 -2.850 11.177 12.123 1.00 44.23 C ATOM 2928 CD2 LEU B 196 -0.532 10.398 12.434 1.00 54.35 C ATOM 0 H LEU B 196 0.811 12.472 11.496 1.00 15.24 H new ATOM 0 HA LEU B 196 -1.835 13.527 11.196 1.00 71.10 H new ATOM 0 HB2 LEU B 196 -0.218 12.753 13.652 1.00 3.45 H new ATOM 0 HB3 LEU B 196 -1.889 13.277 13.706 1.00 3.45 H new ATOM 0 HG LEU B 196 -1.860 10.948 13.973 1.00 74.14 H new ATOM 0 HD11 LEU B 196 -3.149 10.131 12.053 1.00 44.23 H new ATOM 0 HD12 LEU B 196 -3.655 11.755 12.577 1.00 44.23 H new ATOM 0 HD13 LEU B 196 -2.644 11.563 11.125 1.00 44.23 H new ATOM 0 HD21 LEU B 196 -0.904 9.376 12.360 1.00 54.35 H new ATOM 0 HD22 LEU B 196 -0.227 10.746 11.447 1.00 54.35 H new ATOM 0 HD23 LEU B 196 0.324 10.425 13.109 1.00 54.35 H new ATOM 2940 N GLN B 197 0.623 15.231 12.528 1.00 43.43 N ATOM 2941 CA GLN B 197 1.122 16.493 13.060 1.00 23.35 C ATOM 2942 C GLN B 197 1.242 17.583 11.997 1.00 60.40 C ATOM 2943 O GLN B 197 1.698 18.693 12.297 1.00 2.32 O ATOM 2944 CB GLN B 197 2.466 16.261 13.721 1.00 73.13 C ATOM 2945 CG GLN B 197 2.403 15.303 14.892 1.00 20.51 C ATOM 2946 CD GLN B 197 3.762 14.944 15.426 1.00 55.14 C ATOM 2947 OE1 GLN B 197 4.703 15.725 15.349 1.00 30.02 O ATOM 2948 NE2 GLN B 197 3.876 13.768 15.971 1.00 13.31 N ATOM 0 H GLN B 197 1.352 14.527 12.412 1.00 43.43 H new ATOM 0 HA GLN B 197 0.395 16.849 13.790 1.00 23.35 H new ATOM 0 HB2 GLN B 197 3.165 15.872 12.980 1.00 73.13 H new ATOM 0 HB3 GLN B 197 2.864 17.216 14.064 1.00 73.13 H new ATOM 0 HG2 GLN B 197 1.811 15.751 15.690 1.00 20.51 H new ATOM 0 HG3 GLN B 197 1.887 14.394 14.584 1.00 20.51 H new ATOM 0 HE21 GLN B 197 3.069 13.146 16.016 1.00 13.31 H new ATOM 0 HE22 GLN B 197 4.773 13.468 16.353 1.00 13.31 H new ATOM 2957 N SER B 198 0.846 17.268 10.783 1.00 51.32 N ATOM 2958 CA SER B 198 0.855 18.214 9.703 1.00 61.12 C ATOM 2959 C SER B 198 -0.077 19.385 10.032 1.00 60.14 C ATOM 2960 O SER B 198 -1.262 19.186 10.376 1.00 33.24 O ATOM 2961 CB SER B 198 0.451 17.509 8.407 1.00 54.42 C ATOM 2962 OG SER B 198 -0.745 16.761 8.592 1.00 42.43 O ATOM 0 H SER B 198 0.508 16.342 10.522 1.00 51.32 H new ATOM 0 HA SER B 198 1.857 18.620 9.566 1.00 61.12 H new ATOM 0 HB2 SER B 198 0.306 18.246 7.617 1.00 54.42 H new ATOM 0 HB3 SER B 198 1.253 16.847 8.082 1.00 54.42 H new ATOM 0 HG SER B 198 -0.526 15.809 8.674 1.00 42.43 H new ATOM 2968 N HIS B 199 0.462 20.575 9.984 1.00 44.12 N ATOM 2969 CA HIS B 199 -0.281 21.755 10.318 1.00 24.11 C ATOM 2970 C HIS B 199 0.006 22.850 9.315 1.00 24.42 C ATOM 2971 O HIS B 199 -0.468 22.732 8.180 1.00 2.31 O ATOM 2972 CB HIS B 199 -0.030 22.203 11.793 1.00 13.33 C ATOM 2973 CG HIS B 199 1.418 22.378 12.206 1.00 72.30 C ATOM 2974 ND1 HIS B 199 2.201 21.343 12.668 1.00 3.00 N ATOM 2975 CD2 HIS B 199 2.205 23.476 12.254 1.00 25.42 C ATOM 2976 CE1 HIS B 199 3.392 21.799 12.986 1.00 51.21 C ATOM 2977 NE2 HIS B 199 3.420 23.086 12.741 1.00 50.53 N ATOM 0 H HIS B 199 1.429 20.750 9.712 1.00 44.12 H new ATOM 0 HA HIS B 199 -1.345 21.525 10.259 1.00 24.11 H new ATOM 0 HB2 HIS B 199 -0.549 23.148 11.956 1.00 13.33 H new ATOM 0 HB3 HIS B 199 -0.488 21.469 12.456 1.00 13.33 H new ATOM 0 HD1 HIS B 199 1.902 20.371 12.751 1.00 3.00 H new ATOM 0 HD2 HIS B 199 1.925 24.477 11.961 1.00 25.42 H new ATOM 0 HE1 HIS B 199 4.208 21.213 13.382 1.00 51.21 H new TER 2986 HIS B 199