USER MOD reduce.3.24.130724 H: found=0, std=0, add=701, rem=0, adj=10 USER MOD reduce.3.24.130724 removed 700 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: A 52 GLN : amide:sc= -14! C(o=-18!,f=-23!) USER MOD Set 1.2: A 80 ASN : amide:sc= -3.94! C(o=-18!,f=-19!) USER MOD Single : A 22 MET CE :methyl -120:sc= -2.44 (180deg=-3.59) USER MOD Single : A 24 LYS NZ :NH3+ -118:sc= -1.77! (180deg=-4.05!) USER MOD Single : A 26 ASN : amide:sc= -4.37! C(o=-4.4!,f=-15!) USER MOD Single : A 27 GLN : amide:sc= -0.231 K(o=-0.23,f=-2!) USER MOD Single : A 31 LYS NZ :NH3+ -153:sc= -0.416 (180deg=-1.58!) USER MOD Single : A 33 GLN : amide:sc= -0.85 K(o=-0.85,f=-0.0077) USER MOD Single : A 36 HIS : no HD1:sc= -1.66 K(o=-1.7,f=-0.38) USER MOD Single : A 46 HIS : no HD1:sc= -4.95 K(o=-5,f=-1.1) USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 LYS NZ :NH3+ -143:sc= -0.568 (180deg=-2.36!) USER MOD Single : A 63 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.00129) USER MOD Single : A 73 LYS NZ :NH3+ 144:sc= -0.476 (180deg=-1.78!) USER MOD Single : A 82 ASN : amide:sc= -0.451 X(o=-0.45,f=0) USER MOD Single : A 87 LYS NZ :NH3+ 164:sc=-0.00609 (180deg=-0.327) USER MOD Single : A 88 TYR OH : rot 167:sc= -8.97! USER MOD Single : A 93 LYS NZ :NH3+ 148:sc= -2.04! (180deg=-3.75!) USER MOD Single : A 94 LYS NZ :NH3+ -174:sc= -2.07 (180deg=-2.25) USER MOD Single : A 98 GLN : amide:sc= 0 K(o=0,f=-1.1) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 17 63.577 55.959-124.687 1.00 3.57 N ATOM 2 CA GLY A 17 63.379 55.291-123.326 1.00 2.94 C ATOM 3 C GLY A 17 62.721 53.955-123.256 1.00 2.17 C ATOM 4 O GLY A 17 62.344 53.492-122.198 1.00 2.41 O ATOM 0 HA2 GLY A 17 64.361 55.197-122.862 1.00 2.94 H new ATOM 0 HA3 GLY A 17 62.798 55.975-122.707 1.00 2.94 H new ATOM 8 N GLU A 18 62.565 53.301-124.375 1.00 1.64 N ATOM 9 CA GLU A 18 61.914 51.960-124.368 1.00 0.99 C ATOM 10 C GLU A 18 62.949 50.889-124.720 1.00 0.98 C ATOM 11 O GLU A 18 63.206 50.624-125.874 1.00 1.60 O ATOM 12 CB GLU A 18 60.783 51.938-125.398 1.00 1.22 C ATOM 13 CG GLU A 18 59.577 52.700-124.848 1.00 1.64 C ATOM 14 CD GLU A 18 58.362 52.450-125.742 1.00 2.48 C ATOM 15 OE1 GLU A 18 58.495 51.695-126.692 1.00 3.09 O ATOM 16 OE2 GLU A 18 57.318 53.016-125.463 1.00 3.13 O ATOM 0 H GLU A 18 62.860 53.637-125.292 1.00 1.64 H new ATOM 0 HA GLU A 18 61.506 51.758-123.378 1.00 0.99 H new ATOM 0 HB2 GLU A 18 61.118 52.391-126.331 1.00 1.22 H new ATOM 0 HB3 GLU A 18 60.504 50.909-125.625 1.00 1.22 H new ATOM 0 HG2 GLU A 18 59.364 52.377-123.829 1.00 1.64 H new ATOM 0 HG3 GLU A 18 59.797 53.767-124.805 1.00 1.64 H new ATOM 23 N GLU A 19 63.554 50.293-123.726 1.00 0.57 N ATOM 24 CA GLU A 19 64.589 49.246-123.991 1.00 0.55 C ATOM 25 C GLU A 19 64.574 48.895-125.482 1.00 0.56 C ATOM 26 O GLU A 19 65.562 49.036-126.175 1.00 0.63 O ATOM 27 CB GLU A 19 64.309 47.993-123.147 1.00 0.45 C ATOM 28 CG GLU A 19 62.827 47.619-123.218 1.00 0.38 C ATOM 29 CD GLU A 19 61.976 48.763-122.664 1.00 1.26 C ATOM 30 OE1 GLU A 19 62.388 49.363-121.686 1.00 1.96 O ATOM 31 OE2 GLU A 19 60.925 49.021-123.229 1.00 2.06 O ATOM 0 H GLU A 19 63.377 50.485-122.740 1.00 0.57 H new ATOM 0 HA GLU A 19 65.572 49.629-123.717 1.00 0.55 H new ATOM 0 HB2 GLU A 19 64.917 47.163-123.505 1.00 0.45 H new ATOM 0 HB3 GLU A 19 64.595 48.174-122.111 1.00 0.45 H new ATOM 0 HG2 GLU A 19 62.544 47.410-124.250 1.00 0.38 H new ATOM 0 HG3 GLU A 19 62.645 46.709-122.647 1.00 0.38 H new ATOM 38 N PHE A 20 63.449 48.468-125.985 1.00 0.51 N ATOM 39 CA PHE A 20 63.344 48.138-127.436 1.00 0.54 C ATOM 40 C PHE A 20 62.311 49.070-128.064 1.00 0.55 C ATOM 41 O PHE A 20 61.955 50.079-127.490 1.00 0.57 O ATOM 42 CB PHE A 20 62.883 46.690-127.604 1.00 0.52 C ATOM 43 CG PHE A 20 63.708 45.801-126.713 1.00 0.52 C ATOM 44 CD1 PHE A 20 65.040 45.525-127.036 1.00 0.80 C ATOM 45 CD2 PHE A 20 63.140 45.259-125.558 1.00 0.49 C ATOM 46 CE1 PHE A 20 65.806 44.702-126.202 1.00 0.82 C ATOM 47 CE2 PHE A 20 63.903 44.436-124.721 1.00 0.51 C ATOM 48 CZ PHE A 20 65.236 44.157-125.043 1.00 0.56 C ATOM 0 H PHE A 20 62.591 48.332-125.450 1.00 0.51 H new ATOM 0 HA PHE A 20 64.314 48.261-127.918 1.00 0.54 H new ATOM 0 HB2 PHE A 20 61.827 46.600-127.350 1.00 0.52 H new ATOM 0 HB3 PHE A 20 62.988 46.381-128.644 1.00 0.52 H new ATOM 0 HD1 PHE A 20 65.478 45.947-127.929 1.00 0.80 H new ATOM 0 HD2 PHE A 20 62.111 45.475-125.310 1.00 0.49 H new ATOM 0 HE1 PHE A 20 66.835 44.487-126.451 1.00 0.82 H new ATOM 0 HE2 PHE A 20 63.463 44.017-123.828 1.00 0.51 H new ATOM 0 HZ PHE A 20 65.826 43.522-124.399 1.00 0.56 H new ATOM 58 N ARG A 21 61.803 48.752-129.222 1.00 0.57 N ATOM 59 CA ARG A 21 60.780 49.637-129.844 1.00 0.60 C ATOM 60 C ARG A 21 59.588 48.769-130.238 1.00 0.57 C ATOM 61 O ARG A 21 58.637 49.222-130.843 1.00 0.59 O ATOM 62 CB ARG A 21 61.364 50.295-131.092 1.00 0.69 C ATOM 63 CG ARG A 21 62.690 50.972-130.742 1.00 0.74 C ATOM 64 CD ARG A 21 63.779 49.910-130.573 1.00 0.82 C ATOM 65 NE ARG A 21 64.932 50.237-131.458 1.00 1.35 N ATOM 66 CZ ARG A 21 66.085 49.652-131.271 1.00 1.78 C ATOM 67 NH1 ARG A 21 66.226 48.782-130.309 1.00 2.06 N ATOM 68 NH2 ARG A 21 67.094 49.939-132.046 1.00 2.72 N ATOM 0 H ARG A 21 62.050 47.923-129.762 1.00 0.57 H new ATOM 0 HA ARG A 21 60.473 50.415-129.145 1.00 0.60 H new ATOM 0 HB2 ARG A 21 61.520 49.548-131.870 1.00 0.69 H new ATOM 0 HB3 ARG A 21 60.663 51.029-131.490 1.00 0.69 H new ATOM 0 HG2 ARG A 21 62.971 51.673-131.528 1.00 0.74 H new ATOM 0 HG3 ARG A 21 62.584 51.549-129.823 1.00 0.74 H new ATOM 0 HD2 ARG A 21 64.104 49.870-129.534 1.00 0.82 H new ATOM 0 HD3 ARG A 21 63.384 48.925-130.822 1.00 0.82 H new ATOM 0 HE ARG A 21 64.821 50.917-132.210 1.00 1.35 H new ATOM 0 HH11 ARG A 21 65.436 48.559-129.703 1.00 2.06 H new ATOM 0 HH12 ARG A 21 67.126 48.325-130.163 1.00 2.06 H new ATOM 0 HH21 ARG A 21 66.982 50.620-132.797 1.00 2.72 H new ATOM 0 HH22 ARG A 21 67.995 49.483-131.901 1.00 2.72 H new ATOM 82 N MET A 22 59.646 47.519-129.881 1.00 0.54 N ATOM 83 CA MET A 22 58.534 46.586-130.205 1.00 0.55 C ATOM 84 C MET A 22 57.706 46.351-128.943 1.00 0.49 C ATOM 85 O MET A 22 58.239 46.156-127.867 1.00 0.63 O ATOM 86 CB MET A 22 59.107 45.258-130.699 1.00 0.61 C ATOM 87 CG MET A 22 59.727 45.452-132.085 1.00 0.71 C ATOM 88 SD MET A 22 58.427 45.367-133.342 1.00 1.14 S ATOM 89 CE MET A 22 58.120 43.587-133.233 1.00 1.25 C ATOM 0 H MET A 22 60.425 47.099-129.373 1.00 0.54 H new ATOM 0 HA MET A 22 57.905 47.014-130.986 1.00 0.55 H new ATOM 0 HB2 MET A 22 59.860 44.892-130.000 1.00 0.61 H new ATOM 0 HB3 MET A 22 58.321 44.505-130.743 1.00 0.61 H new ATOM 0 HG2 MET A 22 60.236 46.415-132.137 1.00 0.71 H new ATOM 0 HG3 MET A 22 60.478 44.684-132.270 1.00 0.71 H new ATOM 0 HE1 MET A 22 58.313 43.125-134.201 1.00 1.25 H new ATOM 0 HE2 MET A 22 58.780 43.149-132.484 1.00 1.25 H new ATOM 0 HE3 MET A 22 57.082 43.414-132.948 1.00 1.25 H new ATOM 99 N GLU A 23 56.410 46.379-129.057 1.00 0.47 N ATOM 100 CA GLU A 23 55.557 46.174-127.856 1.00 0.46 C ATOM 101 C GLU A 23 55.769 44.770-127.290 1.00 0.50 C ATOM 102 O GLU A 23 55.886 44.592-126.095 1.00 0.50 O ATOM 103 CB GLU A 23 54.087 46.359-128.234 1.00 0.50 C ATOM 104 CG GLU A 23 53.805 47.842-128.480 1.00 1.45 C ATOM 105 CD GLU A 23 52.305 48.047-128.701 1.00 2.02 C ATOM 106 OE1 GLU A 23 51.821 47.650-129.749 1.00 2.68 O ATOM 107 OE2 GLU A 23 51.666 48.598-127.820 1.00 2.48 O ATOM 0 H GLU A 23 55.904 46.535-129.929 1.00 0.47 H new ATOM 0 HA GLU A 23 55.833 46.906-127.097 1.00 0.46 H new ATOM 0 HB2 GLU A 23 53.855 45.781-129.128 1.00 0.50 H new ATOM 0 HB3 GLU A 23 53.446 45.984-127.437 1.00 0.50 H new ATOM 0 HG2 GLU A 23 54.142 48.433-127.628 1.00 1.45 H new ATOM 0 HG3 GLU A 23 54.362 48.190-129.350 1.00 1.45 H new ATOM 114 N LYS A 24 55.817 43.765-128.122 1.00 0.54 N ATOM 115 CA LYS A 24 56.018 42.387-127.595 1.00 0.59 C ATOM 116 C LYS A 24 57.242 42.361-126.685 1.00 0.53 C ATOM 117 O LYS A 24 57.176 41.927-125.551 1.00 0.55 O ATOM 118 CB LYS A 24 56.232 41.422-128.762 1.00 0.67 C ATOM 119 CG LYS A 24 57.287 41.997-129.707 1.00 0.64 C ATOM 120 CD LYS A 24 57.292 41.200-131.013 1.00 0.77 C ATOM 121 CE LYS A 24 55.974 41.427-131.755 1.00 1.46 C ATOM 122 NZ LYS A 24 54.990 40.384-131.350 1.00 2.09 N ATOM 0 H LYS A 24 55.726 43.838-129.135 1.00 0.54 H new ATOM 0 HA LYS A 24 55.138 42.085-127.028 1.00 0.59 H new ATOM 0 HB2 LYS A 24 56.552 40.449-128.390 1.00 0.67 H new ATOM 0 HB3 LYS A 24 55.295 41.266-129.296 1.00 0.67 H new ATOM 0 HG2 LYS A 24 57.075 43.047-129.910 1.00 0.64 H new ATOM 0 HG3 LYS A 24 58.271 41.955-129.239 1.00 0.64 H new ATOM 0 HD2 LYS A 24 58.131 41.509-131.637 1.00 0.77 H new ATOM 0 HD3 LYS A 24 57.425 40.139-130.803 1.00 0.77 H new ATOM 0 HE2 LYS A 24 55.583 42.419-131.528 1.00 1.46 H new ATOM 0 HE3 LYS A 24 56.139 41.388-132.832 1.00 1.46 H new ATOM 0 HZ1 LYS A 24 54.722 39.818-132.180 1.00 2.09 H new ATOM 0 HZ2 LYS A 24 55.417 39.765-130.632 1.00 2.09 H new ATOM 0 HZ3 LYS A 24 54.143 40.840-130.955 1.00 2.09 H new ATOM 136 N LEU A 25 58.360 42.817-127.170 1.00 0.47 N ATOM 137 CA LEU A 25 59.596 42.817-126.340 1.00 0.42 C ATOM 138 C LEU A 25 59.389 43.669-125.090 1.00 0.39 C ATOM 139 O LEU A 25 59.587 43.221-123.987 1.00 0.55 O ATOM 140 CB LEU A 25 60.746 43.410-127.154 1.00 0.43 C ATOM 141 CG LEU A 25 61.392 42.327-128.015 1.00 0.57 C ATOM 142 CD1 LEU A 25 61.379 42.769-129.481 1.00 0.92 C ATOM 143 CD2 LEU A 25 62.837 42.119-127.559 1.00 1.03 C ATOM 0 H LEU A 25 58.473 43.192-128.112 1.00 0.47 H new ATOM 0 HA LEU A 25 59.827 41.793-126.046 1.00 0.42 H new ATOM 0 HB2 LEU A 25 60.376 44.216-127.787 1.00 0.43 H new ATOM 0 HB3 LEU A 25 61.489 43.845-126.485 1.00 0.43 H new ATOM 0 HG LEU A 25 60.837 41.395-127.912 1.00 0.57 H new ATOM 0 HD11 LEU A 25 61.840 41.997-130.098 1.00 0.92 H new ATOM 0 HD12 LEU A 25 60.350 42.926-129.805 1.00 0.92 H new ATOM 0 HD13 LEU A 25 61.938 43.699-129.586 1.00 0.92 H new ATOM 0 HD21 LEU A 25 63.304 41.347-128.170 1.00 1.03 H new ATOM 0 HD22 LEU A 25 63.391 43.052-127.668 1.00 1.03 H new ATOM 0 HD23 LEU A 25 62.848 41.810-126.514 1.00 1.03 H new ATOM 155 N ASN A 26 58.997 44.898-125.258 1.00 0.39 N ATOM 156 CA ASN A 26 58.791 45.756-124.057 1.00 0.37 C ATOM 157 C ASN A 26 57.900 44.988-123.083 1.00 0.40 C ATOM 158 O ASN A 26 58.258 44.733-121.949 1.00 0.40 O ATOM 159 CB ASN A 26 58.110 47.068-124.440 1.00 0.41 C ATOM 160 CG ASN A 26 58.796 47.659-125.673 1.00 0.55 C ATOM 161 OD1 ASN A 26 59.569 46.992-126.331 1.00 1.21 O ATOM 162 ND2 ASN A 26 58.547 48.894-126.013 1.00 0.45 N ATOM 0 H ASN A 26 58.812 45.342-126.157 1.00 0.39 H new ATOM 0 HA ASN A 26 59.754 45.993-123.604 1.00 0.37 H new ATOM 0 HB2 ASN A 26 57.054 46.895-124.646 1.00 0.41 H new ATOM 0 HB3 ASN A 26 58.161 47.772-123.610 1.00 0.41 H new ATOM 0 HD21 ASN A 26 59.001 49.299-126.831 1.00 0.45 H new ATOM 0 HD22 ASN A 26 57.898 49.454-125.460 1.00 0.45 H new ATOM 169 N GLN A 27 56.739 44.624-123.535 1.00 0.44 N ATOM 170 CA GLN A 27 55.793 43.872-122.671 1.00 0.50 C ATOM 171 C GLN A 27 56.538 42.728-121.984 1.00 0.47 C ATOM 172 O GLN A 27 56.508 42.590-120.774 1.00 0.48 O ATOM 173 CB GLN A 27 54.660 43.303-123.528 1.00 0.59 C ATOM 174 CG GLN A 27 53.584 44.373-123.727 1.00 0.58 C ATOM 175 CD GLN A 27 52.761 44.515-122.445 1.00 1.39 C ATOM 176 OE1 GLN A 27 52.630 43.574-121.686 1.00 2.21 O ATOM 177 NE2 GLN A 27 52.197 45.658-122.169 1.00 2.02 N ATOM 0 H GLN A 27 56.400 44.817-124.477 1.00 0.44 H new ATOM 0 HA GLN A 27 55.375 44.540-121.918 1.00 0.50 H new ATOM 0 HB2 GLN A 27 55.048 42.978-124.493 1.00 0.59 H new ATOM 0 HB3 GLN A 27 54.230 42.425-123.045 1.00 0.59 H new ATOM 0 HG2 GLN A 27 54.047 45.326-123.982 1.00 0.58 H new ATOM 0 HG3 GLN A 27 52.935 44.101-124.560 1.00 0.58 H new ATOM 0 HE21 GLN A 27 52.307 46.448-122.805 1.00 2.02 H new ATOM 0 HE22 GLN A 27 51.646 45.762-121.317 1.00 2.02 H new ATOM 186 N LEU A 28 57.195 41.894-122.743 1.00 0.47 N ATOM 187 CA LEU A 28 57.926 40.743-122.133 1.00 0.47 C ATOM 188 C LEU A 28 58.984 41.242-121.152 1.00 0.39 C ATOM 189 O LEU A 28 59.085 40.759-120.041 1.00 0.50 O ATOM 190 CB LEU A 28 58.603 39.929-123.239 1.00 0.50 C ATOM 191 CG LEU A 28 57.553 39.091-123.971 1.00 0.62 C ATOM 192 CD1 LEU A 28 58.092 38.682-125.343 1.00 1.41 C ATOM 193 CD2 LEU A 28 57.243 37.836-123.152 1.00 1.21 C ATOM 0 H LEU A 28 57.258 41.958-123.759 1.00 0.47 H new ATOM 0 HA LEU A 28 57.213 40.119-121.594 1.00 0.47 H new ATOM 0 HB2 LEU A 28 59.105 40.595-123.940 1.00 0.50 H new ATOM 0 HB3 LEU A 28 59.368 39.281-122.812 1.00 0.50 H new ATOM 0 HG LEU A 28 56.643 39.678-124.098 1.00 0.62 H new ATOM 0 HD11 LEU A 28 57.344 38.085-125.865 1.00 1.41 H new ATOM 0 HD12 LEU A 28 58.315 39.575-125.927 1.00 1.41 H new ATOM 0 HD13 LEU A 28 59.001 38.094-125.216 1.00 1.41 H new ATOM 0 HD21 LEU A 28 56.495 37.238-123.672 1.00 1.21 H new ATOM 0 HD22 LEU A 28 58.153 37.250-123.026 1.00 1.21 H new ATOM 0 HD23 LEU A 28 56.860 38.126-122.174 1.00 1.21 H new ATOM 205 N TRP A 29 59.772 42.205-121.540 1.00 0.37 N ATOM 206 CA TRP A 29 60.819 42.745-120.636 1.00 0.30 C ATOM 207 C TRP A 29 60.168 43.146-119.318 1.00 0.36 C ATOM 208 O TRP A 29 60.486 42.623-118.261 1.00 0.39 O ATOM 209 CB TRP A 29 61.406 43.973-121.337 1.00 0.32 C ATOM 210 CG TRP A 29 62.539 44.561-120.572 1.00 0.29 C ATOM 211 CD1 TRP A 29 62.682 45.881-120.342 1.00 0.32 C ATOM 212 CD2 TRP A 29 63.692 43.910-119.961 1.00 0.29 C ATOM 213 NE1 TRP A 29 63.842 46.091-119.631 1.00 0.34 N ATOM 214 CE2 TRP A 29 64.501 44.909-119.366 1.00 0.33 C ATOM 215 CE3 TRP A 29 64.113 42.571-119.861 1.00 0.31 C ATOM 216 CZ2 TRP A 29 65.682 44.591-118.699 1.00 0.38 C ATOM 217 CZ3 TRP A 29 65.302 42.249-119.189 1.00 0.37 C ATOM 218 CH2 TRP A 29 66.083 43.258-118.608 1.00 0.41 C ATOM 0 H TRP A 29 59.732 42.646-122.459 1.00 0.37 H new ATOM 0 HA TRP A 29 61.600 42.014-120.426 1.00 0.30 H new ATOM 0 HB2 TRP A 29 61.747 43.693-122.334 1.00 0.32 H new ATOM 0 HB3 TRP A 29 60.627 44.724-121.466 1.00 0.32 H new ATOM 0 HD1 TRP A 29 61.996 46.651-120.664 1.00 0.32 H new ATOM 0 HE1 TRP A 29 64.174 47.009-119.336 1.00 0.34 H new ATOM 0 HE3 TRP A 29 63.517 41.787-120.304 1.00 0.31 H new ATOM 0 HZ2 TRP A 29 66.283 45.371-118.255 1.00 0.38 H new ATOM 0 HZ3 TRP A 29 65.617 41.218-119.119 1.00 0.37 H new ATOM 0 HH2 TRP A 29 66.996 43.003-118.090 1.00 0.41 H new ATOM 229 N GLU A 30 59.262 44.076-119.375 1.00 0.45 N ATOM 230 CA GLU A 30 58.586 44.518-118.134 1.00 0.56 C ATOM 231 C GLU A 30 58.206 43.269-117.340 1.00 0.50 C ATOM 232 O GLU A 30 58.423 43.181-116.148 1.00 0.52 O ATOM 233 CB GLU A 30 57.323 45.307-118.488 1.00 0.68 C ATOM 234 CG GLU A 30 57.687 46.774-118.726 1.00 0.86 C ATOM 235 CD GLU A 30 58.182 47.396-117.419 1.00 1.53 C ATOM 236 OE1 GLU A 30 57.928 46.815-116.376 1.00 2.33 O ATOM 237 OE2 GLU A 30 58.807 48.442-117.482 1.00 2.06 O ATOM 0 H GLU A 30 58.962 44.548-120.228 1.00 0.45 H new ATOM 0 HA GLU A 30 59.245 45.159-117.547 1.00 0.56 H new ATOM 0 HB2 GLU A 30 56.858 44.888-119.380 1.00 0.68 H new ATOM 0 HB3 GLU A 30 56.594 45.228-117.681 1.00 0.68 H new ATOM 0 HG2 GLU A 30 58.459 46.848-119.492 1.00 0.86 H new ATOM 0 HG3 GLU A 30 56.819 47.320-119.095 1.00 0.86 H new ATOM 244 N LYS A 31 57.640 42.298-118.004 1.00 0.46 N ATOM 245 CA LYS A 31 57.242 41.043-117.308 1.00 0.45 C ATOM 246 C LYS A 31 58.454 40.432-116.596 1.00 0.43 C ATOM 247 O LYS A 31 58.407 40.135-115.415 1.00 0.46 O ATOM 248 CB LYS A 31 56.697 40.044-118.333 1.00 0.44 C ATOM 249 CG LYS A 31 55.278 39.629-117.942 1.00 0.91 C ATOM 250 CD LYS A 31 54.789 38.529-118.886 1.00 0.99 C ATOM 251 CE LYS A 31 54.420 39.142-120.238 1.00 1.36 C ATOM 252 NZ LYS A 31 53.464 40.265-120.028 1.00 2.08 N ATOM 0 H LYS A 31 57.436 42.321-119.003 1.00 0.46 H new ATOM 0 HA LYS A 31 56.472 41.271-116.571 1.00 0.45 H new ATOM 0 HB2 LYS A 31 56.695 40.492-119.327 1.00 0.44 H new ATOM 0 HB3 LYS A 31 57.343 39.167-118.380 1.00 0.44 H new ATOM 0 HG2 LYS A 31 55.263 39.272-116.912 1.00 0.91 H new ATOM 0 HG3 LYS A 31 54.610 40.489-117.991 1.00 0.91 H new ATOM 0 HD2 LYS A 31 55.566 37.776-119.016 1.00 0.99 H new ATOM 0 HD3 LYS A 31 53.924 38.024-118.456 1.00 0.99 H new ATOM 0 HE2 LYS A 31 55.316 39.502-120.743 1.00 1.36 H new ATOM 0 HE3 LYS A 31 53.973 38.385-120.883 1.00 1.36 H new ATOM 0 HZ1 LYS A 31 52.874 40.382-120.877 1.00 2.08 H new ATOM 0 HZ2 LYS A 31 52.857 40.055-119.210 1.00 2.08 H new ATOM 0 HZ3 LYS A 31 53.993 41.143-119.850 1.00 2.08 H new ATOM 266 N ALA A 32 59.543 40.232-117.293 1.00 0.41 N ATOM 267 CA ALA A 32 60.731 39.630-116.622 1.00 0.41 C ATOM 268 C ALA A 32 61.081 40.460-115.392 1.00 0.41 C ATOM 269 O ALA A 32 61.034 39.977-114.275 1.00 0.42 O ATOM 270 CB ALA A 32 61.932 39.605-117.569 1.00 0.42 C ATOM 0 H ALA A 32 59.660 40.456-118.281 1.00 0.41 H new ATOM 0 HA ALA A 32 60.491 38.606-116.334 1.00 0.41 H new ATOM 0 HB1 ALA A 32 62.788 39.162-117.060 1.00 0.42 H new ATOM 0 HB2 ALA A 32 61.688 39.012-118.451 1.00 0.42 H new ATOM 0 HB3 ALA A 32 62.177 40.623-117.872 1.00 0.42 H new ATOM 276 N GLN A 33 61.427 41.710-115.563 1.00 0.43 N ATOM 277 CA GLN A 33 61.763 42.522-114.369 1.00 0.47 C ATOM 278 C GLN A 33 60.714 42.247-113.301 1.00 0.49 C ATOM 279 O GLN A 33 61.016 42.140-112.128 1.00 0.53 O ATOM 280 CB GLN A 33 61.762 44.007-114.739 1.00 0.51 C ATOM 281 CG GLN A 33 62.939 44.300-115.676 1.00 0.53 C ATOM 282 CD GLN A 33 62.849 45.744-116.173 1.00 0.75 C ATOM 283 OE1 GLN A 33 63.837 46.449-116.209 1.00 1.17 O ATOM 284 NE2 GLN A 33 61.696 46.216-116.560 1.00 1.23 N ATOM 0 H GLN A 33 61.489 42.191-116.460 1.00 0.43 H new ATOM 0 HA GLN A 33 62.753 42.261-113.996 1.00 0.47 H new ATOM 0 HB2 GLN A 33 60.822 44.271-115.224 1.00 0.51 H new ATOM 0 HB3 GLN A 33 61.839 44.617-113.839 1.00 0.51 H new ATOM 0 HG2 GLN A 33 63.882 44.143-115.153 1.00 0.53 H new ATOM 0 HG3 GLN A 33 62.925 43.612-116.521 1.00 0.53 H new ATOM 0 HE21 GLN A 33 60.866 45.624-116.530 1.00 1.23 H new ATOM 0 HE22 GLN A 33 61.624 47.177-116.893 1.00 1.23 H new ATOM 293 N ARG A 34 59.480 42.113-113.700 1.00 0.49 N ATOM 294 CA ARG A 34 58.412 41.822-112.712 1.00 0.52 C ATOM 295 C ARG A 34 58.749 40.520-112.002 1.00 0.52 C ATOM 296 O ARG A 34 58.568 40.387-110.808 1.00 0.55 O ATOM 297 CB ARG A 34 57.073 41.682-113.430 1.00 0.56 C ATOM 298 CG ARG A 34 56.136 42.809-112.994 1.00 0.67 C ATOM 299 CD ARG A 34 54.937 42.871-113.942 1.00 1.59 C ATOM 300 NE ARG A 34 53.875 41.945-113.458 1.00 1.96 N ATOM 301 CZ ARG A 34 52.660 42.042-113.927 1.00 2.81 C ATOM 302 NH1 ARG A 34 52.378 42.950-114.821 1.00 3.42 N ATOM 303 NH2 ARG A 34 51.730 41.232-113.503 1.00 3.58 N ATOM 0 H ARG A 34 59.168 42.193-114.668 1.00 0.49 H new ATOM 0 HA ARG A 34 58.343 42.634-111.988 1.00 0.52 H new ATOM 0 HB2 ARG A 34 57.222 41.717-114.509 1.00 0.56 H new ATOM 0 HB3 ARG A 34 56.626 40.715-113.201 1.00 0.56 H new ATOM 0 HG2 ARG A 34 55.797 42.639-111.972 1.00 0.67 H new ATOM 0 HG3 ARG A 34 56.667 43.761-113.000 1.00 0.67 H new ATOM 0 HD2 ARG A 34 54.552 43.889-113.992 1.00 1.59 H new ATOM 0 HD3 ARG A 34 55.243 42.596-114.951 1.00 1.59 H new ATOM 0 HE ARG A 34 54.097 41.235-112.760 1.00 1.96 H new ATOM 0 HH11 ARG A 34 53.106 43.583-115.153 1.00 3.42 H new ATOM 0 HH12 ARG A 34 51.430 43.027-115.188 1.00 3.42 H new ATOM 0 HH21 ARG A 34 51.951 40.522-112.805 1.00 3.58 H new ATOM 0 HH22 ARG A 34 50.781 41.308-113.870 1.00 3.58 H new ATOM 317 N LEU A 35 59.278 39.568-112.717 1.00 0.50 N ATOM 318 CA LEU A 35 59.667 38.296-112.059 1.00 0.54 C ATOM 319 C LEU A 35 60.921 38.587-111.248 1.00 0.55 C ATOM 320 O LEU A 35 61.339 37.819-110.404 1.00 0.61 O ATOM 321 CB LEU A 35 59.962 37.228-113.114 1.00 0.57 C ATOM 322 CG LEU A 35 58.664 36.518-113.496 1.00 0.68 C ATOM 323 CD1 LEU A 35 57.809 37.446-114.362 1.00 1.20 C ATOM 324 CD2 LEU A 35 58.993 35.247-114.282 1.00 0.84 C ATOM 0 H LEU A 35 59.456 39.616-113.720 1.00 0.50 H new ATOM 0 HA LEU A 35 58.865 37.924-111.422 1.00 0.54 H new ATOM 0 HB2 LEU A 35 60.411 37.686-113.995 1.00 0.57 H new ATOM 0 HB3 LEU A 35 60.683 36.508-112.726 1.00 0.57 H new ATOM 0 HG LEU A 35 58.113 36.256-112.593 1.00 0.68 H new ATOM 0 HD11 LEU A 35 56.883 36.939-114.634 1.00 1.20 H new ATOM 0 HD12 LEU A 35 57.576 38.352-113.803 1.00 1.20 H new ATOM 0 HD13 LEU A 35 58.358 37.708-115.266 1.00 1.20 H new ATOM 0 HD21 LEU A 35 58.068 34.739-114.556 1.00 0.84 H new ATOM 0 HD22 LEU A 35 59.543 35.510-115.185 1.00 0.84 H new ATOM 0 HD23 LEU A 35 59.602 34.586-113.666 1.00 0.84 H new ATOM 336 N HIS A 36 61.511 39.721-111.508 1.00 0.53 N ATOM 337 CA HIS A 36 62.743 40.130-110.767 1.00 0.58 C ATOM 338 C HIS A 36 63.870 39.115-110.986 1.00 0.49 C ATOM 339 O HIS A 36 64.330 38.470-110.064 1.00 1.37 O ATOM 340 CB HIS A 36 62.430 40.229-109.273 1.00 0.98 C ATOM 341 CG HIS A 36 61.906 41.603-108.960 1.00 1.43 C ATOM 342 ND1 HIS A 36 62.556 42.460-108.086 1.00 1.89 N ATOM 343 CD2 HIS A 36 60.795 42.282-109.395 1.00 1.60 C ATOM 344 CE1 HIS A 36 61.838 43.597-108.025 1.00 2.32 C ATOM 345 NE2 HIS A 36 60.754 43.542-108.803 1.00 2.17 N ATOM 0 H HIS A 36 61.191 40.390-112.209 1.00 0.53 H new ATOM 0 HA HIS A 36 63.070 41.100-111.143 1.00 0.58 H new ATOM 0 HB2 HIS A 36 61.694 39.475-108.994 1.00 0.98 H new ATOM 0 HB3 HIS A 36 63.328 40.029-108.688 1.00 0.98 H new ATOM 0 HD2 HIS A 36 60.064 41.898-110.091 1.00 1.60 H new ATOM 0 HE1 HIS A 36 62.106 44.451-107.420 1.00 2.32 H new ATOM 0 HE2 HIS A 36 60.048 44.266-108.935 1.00 2.17 H new ATOM 353 N LEU A 37 64.296 38.959-112.204 1.00 0.59 N ATOM 354 CA LEU A 37 65.373 37.965-112.476 1.00 0.43 C ATOM 355 C LEU A 37 66.723 38.653-112.243 1.00 0.44 C ATOM 356 O LEU A 37 66.964 39.733-112.744 1.00 0.42 O ATOM 357 CB LEU A 37 65.318 37.494-113.932 1.00 0.53 C ATOM 358 CG LEU A 37 63.882 37.166-114.332 1.00 0.49 C ATOM 359 CD1 LEU A 37 63.066 38.459-114.401 1.00 0.66 C ATOM 360 CD2 LEU A 37 63.888 36.502-115.712 1.00 0.82 C ATOM 0 H LEU A 37 63.952 39.469-113.017 1.00 0.59 H new ATOM 0 HA LEU A 37 65.243 37.105-111.820 1.00 0.43 H new ATOM 0 HB2 LEU A 37 65.716 38.269-114.587 1.00 0.53 H new ATOM 0 HB3 LEU A 37 65.948 36.614-114.060 1.00 0.53 H new ATOM 0 HG LEU A 37 63.440 36.493-113.597 1.00 0.49 H new ATOM 0 HD11 LEU A 37 62.040 38.227-114.687 1.00 0.66 H new ATOM 0 HD12 LEU A 37 63.070 38.944-113.425 1.00 0.66 H new ATOM 0 HD13 LEU A 37 63.506 39.128-115.141 1.00 0.66 H new ATOM 0 HD21 LEU A 37 62.866 36.264-116.006 1.00 0.82 H new ATOM 0 HD22 LEU A 37 64.326 37.183-116.442 1.00 0.82 H new ATOM 0 HD23 LEU A 37 64.477 35.585-115.672 1.00 0.82 H new ATOM 372 N PRO A 38 67.598 38.041-111.477 1.00 0.57 N ATOM 373 CA PRO A 38 68.923 38.647-111.188 1.00 0.66 C ATOM 374 C PRO A 38 69.564 39.202-112.449 1.00 0.58 C ATOM 375 O PRO A 38 69.266 38.762-113.530 1.00 0.52 O ATOM 376 CB PRO A 38 69.716 37.453-110.657 1.00 0.81 C ATOM 377 CG PRO A 38 68.721 36.338-110.298 1.00 0.82 C ATOM 378 CD PRO A 38 67.342 36.713-110.862 1.00 0.69 C ATOM 0 HA PRO A 38 68.873 39.488-110.497 1.00 0.66 H new ATOM 0 HB2 PRO A 38 70.425 37.103-111.408 1.00 0.81 H new ATOM 0 HB3 PRO A 38 70.296 37.741-109.781 1.00 0.81 H new ATOM 0 HG2 PRO A 38 69.053 35.386-110.712 1.00 0.82 H new ATOM 0 HG3 PRO A 38 68.666 36.213-109.217 1.00 0.82 H new ATOM 0 HD2 PRO A 38 66.992 35.987-111.595 1.00 0.69 H new ATOM 0 HD3 PRO A 38 66.584 36.767-110.080 1.00 0.69 H new ATOM 386 N PRO A 39 70.438 40.153-112.319 1.00 0.62 N ATOM 387 CA PRO A 39 71.102 40.732-113.507 1.00 0.60 C ATOM 388 C PRO A 39 71.644 39.636-114.423 1.00 0.53 C ATOM 389 O PRO A 39 71.379 39.608-115.598 1.00 0.51 O ATOM 390 CB PRO A 39 72.233 41.552-112.884 1.00 0.74 C ATOM 391 CG PRO A 39 72.027 41.596-111.361 1.00 0.81 C ATOM 392 CD PRO A 39 70.831 40.706-111.000 1.00 0.74 C ATOM 0 HA PRO A 39 70.437 41.323-114.137 1.00 0.60 H new ATOM 0 HB2 PRO A 39 73.199 41.106-113.122 1.00 0.74 H new ATOM 0 HB3 PRO A 39 72.238 42.562-113.294 1.00 0.74 H new ATOM 0 HG2 PRO A 39 72.924 41.249-110.848 1.00 0.81 H new ATOM 0 HG3 PRO A 39 71.848 42.620-111.033 1.00 0.81 H new ATOM 0 HD2 PRO A 39 71.106 39.921-110.296 1.00 0.74 H new ATOM 0 HD3 PRO A 39 70.023 41.277-110.541 1.00 0.74 H new ATOM 400 N VAL A 40 72.430 38.759-113.883 1.00 0.52 N ATOM 401 CA VAL A 40 73.042 37.669-114.691 1.00 0.47 C ATOM 402 C VAL A 40 71.965 36.946-115.497 1.00 0.41 C ATOM 403 O VAL A 40 72.027 36.852-116.717 1.00 0.37 O ATOM 404 CB VAL A 40 73.723 36.678-113.740 1.00 0.50 C ATOM 405 CG1 VAL A 40 72.707 35.659-113.221 1.00 0.50 C ATOM 406 CG2 VAL A 40 74.850 35.951-114.477 1.00 0.50 C ATOM 0 H VAL A 40 72.682 38.748-112.895 1.00 0.52 H new ATOM 0 HA VAL A 40 73.773 38.090-115.382 1.00 0.47 H new ATOM 0 HB VAL A 40 74.136 37.227-112.894 1.00 0.50 H new ATOM 0 HG11 VAL A 40 73.204 34.961-112.547 1.00 0.50 H new ATOM 0 HG12 VAL A 40 71.912 36.178-112.685 1.00 0.50 H new ATOM 0 HG13 VAL A 40 72.280 35.111-114.061 1.00 0.50 H new ATOM 0 HG21 VAL A 40 75.333 35.247-113.799 1.00 0.50 H new ATOM 0 HG22 VAL A 40 74.438 35.410-115.329 1.00 0.50 H new ATOM 0 HG23 VAL A 40 75.583 36.677-114.828 1.00 0.50 H new ATOM 416 N ARG A 41 70.968 36.452-114.835 1.00 0.42 N ATOM 417 CA ARG A 41 69.881 35.746-115.557 1.00 0.40 C ATOM 418 C ARG A 41 69.087 36.773-116.344 1.00 0.34 C ATOM 419 O ARG A 41 68.418 36.457-117.310 1.00 0.30 O ATOM 420 CB ARG A 41 68.963 35.046-114.552 1.00 0.46 C ATOM 421 CG ARG A 41 67.923 34.215-115.303 1.00 0.87 C ATOM 422 CD ARG A 41 66.978 33.550-114.301 1.00 1.00 C ATOM 423 NE ARG A 41 67.775 32.818-113.277 1.00 1.53 N ATOM 424 CZ ARG A 41 67.211 32.429-112.167 1.00 2.18 C ATOM 425 NH1 ARG A 41 65.948 32.683-111.954 1.00 2.54 N ATOM 426 NH2 ARG A 41 67.908 31.787-111.269 1.00 3.12 N ATOM 0 H ARG A 41 70.856 36.505-113.823 1.00 0.42 H new ATOM 0 HA ARG A 41 70.301 34.998-116.229 1.00 0.40 H new ATOM 0 HB2 ARG A 41 69.549 34.405-113.893 1.00 0.46 H new ATOM 0 HB3 ARG A 41 68.468 35.784-113.921 1.00 0.46 H new ATOM 0 HG2 ARG A 41 67.358 34.851-115.985 1.00 0.87 H new ATOM 0 HG3 ARG A 41 68.418 33.457-115.910 1.00 0.87 H new ATOM 0 HD2 ARG A 41 66.352 34.302-113.821 1.00 1.00 H new ATOM 0 HD3 ARG A 41 66.309 32.861-114.817 1.00 1.00 H new ATOM 0 HE ARG A 41 68.762 32.621-113.444 1.00 1.53 H new ATOM 0 HH11 ARG A 41 65.403 33.185-112.655 1.00 2.54 H new ATOM 0 HH12 ARG A 41 65.506 32.379-111.086 1.00 2.54 H new ATOM 0 HH21 ARG A 41 68.895 31.589-111.435 1.00 3.12 H new ATOM 0 HH22 ARG A 41 67.466 31.483-110.401 1.00 3.12 H new ATOM 440 N LEU A 42 69.167 38.012-115.947 1.00 0.35 N ATOM 441 CA LEU A 42 68.422 39.054-116.686 1.00 0.30 C ATOM 442 C LEU A 42 69.235 39.437-117.911 1.00 0.31 C ATOM 443 O LEU A 42 68.704 39.910-118.886 1.00 0.49 O ATOM 444 CB LEU A 42 68.165 40.276-115.804 1.00 0.32 C ATOM 445 CG LEU A 42 66.918 41.004-116.317 1.00 0.29 C ATOM 446 CD1 LEU A 42 65.658 40.280-115.849 1.00 0.43 C ATOM 447 CD2 LEU A 42 66.894 42.430-115.765 1.00 0.60 C ATOM 0 H LEU A 42 69.712 38.341-115.150 1.00 0.35 H new ATOM 0 HA LEU A 42 67.449 38.667-116.988 1.00 0.30 H new ATOM 0 HB2 LEU A 42 68.023 39.970-114.768 1.00 0.32 H new ATOM 0 HB3 LEU A 42 69.026 40.944-115.824 1.00 0.32 H new ATOM 0 HG LEU A 42 66.948 41.022-117.406 1.00 0.29 H new ATOM 0 HD11 LEU A 42 64.778 40.806-116.219 1.00 0.43 H new ATOM 0 HD12 LEU A 42 65.660 39.260-116.234 1.00 0.43 H new ATOM 0 HD13 LEU A 42 65.635 40.257-114.759 1.00 0.43 H new ATOM 0 HD21 LEU A 42 66.007 42.947-116.131 1.00 0.60 H new ATOM 0 HD22 LEU A 42 66.872 42.398-114.676 1.00 0.60 H new ATOM 0 HD23 LEU A 42 67.786 42.963-116.095 1.00 0.60 H new ATOM 459 N ALA A 43 70.516 39.189-117.896 1.00 0.30 N ATOM 460 CA ALA A 43 71.335 39.482-119.092 1.00 0.30 C ATOM 461 C ALA A 43 71.042 38.343-120.049 1.00 0.29 C ATOM 462 O ALA A 43 71.020 38.489-121.245 1.00 0.28 O ATOM 463 CB ALA A 43 72.820 39.493-118.719 1.00 0.36 C ATOM 0 H ALA A 43 71.025 38.796-117.104 1.00 0.30 H new ATOM 0 HA ALA A 43 71.105 40.455-119.527 1.00 0.30 H new ATOM 0 HB1 ALA A 43 73.416 39.709-119.605 1.00 0.36 H new ATOM 0 HB2 ALA A 43 73.000 40.259-117.965 1.00 0.36 H new ATOM 0 HB3 ALA A 43 73.102 38.518-118.321 1.00 0.36 H new ATOM 469 N GLU A 44 70.797 37.196-119.491 1.00 0.30 N ATOM 470 CA GLU A 44 70.463 36.040-120.357 1.00 0.32 C ATOM 471 C GLU A 44 69.139 36.374-121.056 1.00 0.30 C ATOM 472 O GLU A 44 69.075 36.496-122.263 1.00 0.34 O ATOM 473 CB GLU A 44 70.308 34.774-119.509 1.00 0.37 C ATOM 474 CG GLU A 44 70.699 33.552-120.342 1.00 1.15 C ATOM 475 CD GLU A 44 72.184 33.630-120.698 1.00 2.05 C ATOM 476 OE1 GLU A 44 72.919 34.260-119.957 1.00 2.92 O ATOM 477 OE2 GLU A 44 72.562 33.058-121.708 1.00 2.80 O ATOM 0 H GLU A 44 70.813 37.010-118.488 1.00 0.30 H new ATOM 0 HA GLU A 44 71.253 35.857-121.086 1.00 0.32 H new ATOM 0 HB2 GLU A 44 70.937 34.839-118.621 1.00 0.37 H new ATOM 0 HB3 GLU A 44 69.278 34.678-119.164 1.00 0.37 H new ATOM 0 HG2 GLU A 44 70.496 32.638-119.784 1.00 1.15 H new ATOM 0 HG3 GLU A 44 70.098 33.511-121.251 1.00 1.15 H new ATOM 484 N LEU A 45 68.080 36.511-120.302 1.00 0.28 N ATOM 485 CA LEU A 45 66.746 36.826-120.911 1.00 0.29 C ATOM 486 C LEU A 45 66.752 38.219-121.562 1.00 0.24 C ATOM 487 O LEU A 45 66.112 38.442-122.570 1.00 0.25 O ATOM 488 CB LEU A 45 65.673 36.788-119.821 1.00 0.34 C ATOM 489 CG LEU A 45 64.348 37.300-120.389 1.00 0.41 C ATOM 490 CD1 LEU A 45 63.222 36.338-120.007 1.00 0.83 C ATOM 491 CD2 LEU A 45 64.048 38.686-119.815 1.00 0.77 C ATOM 0 H LEU A 45 68.078 36.419-119.286 1.00 0.28 H new ATOM 0 HA LEU A 45 66.534 36.083-121.680 1.00 0.29 H new ATOM 0 HB2 LEU A 45 65.552 35.770-119.450 1.00 0.34 H new ATOM 0 HB3 LEU A 45 65.979 37.402-118.974 1.00 0.34 H new ATOM 0 HG LEU A 45 64.420 37.363-121.475 1.00 0.41 H new ATOM 0 HD11 LEU A 45 62.278 36.703-120.412 1.00 0.83 H new ATOM 0 HD12 LEU A 45 63.434 35.350-120.415 1.00 0.83 H new ATOM 0 HD13 LEU A 45 63.150 36.274-118.921 1.00 0.83 H new ATOM 0 HD21 LEU A 45 63.104 39.051-120.220 1.00 0.77 H new ATOM 0 HD22 LEU A 45 63.977 38.623-118.729 1.00 0.77 H new ATOM 0 HD23 LEU A 45 64.849 39.373-120.087 1.00 0.77 H new ATOM 503 N HIS A 46 67.487 39.148-121.013 1.00 0.21 N ATOM 504 CA HIS A 46 67.542 40.508-121.630 1.00 0.20 C ATOM 505 C HIS A 46 68.376 40.427-122.910 1.00 0.19 C ATOM 506 O HIS A 46 67.966 40.862-123.968 1.00 0.21 O ATOM 507 CB HIS A 46 68.191 41.502-120.663 1.00 0.23 C ATOM 508 CG HIS A 46 68.163 42.881-121.265 1.00 0.24 C ATOM 509 ND1 HIS A 46 69.293 43.474-121.807 1.00 0.34 N ATOM 510 CD2 HIS A 46 67.151 43.798-121.413 1.00 0.27 C ATOM 511 CE1 HIS A 46 68.937 44.693-122.251 1.00 0.35 C ATOM 512 NE2 HIS A 46 67.643 44.940-122.037 1.00 0.31 N ATOM 0 H HIS A 46 68.049 39.028-120.170 1.00 0.21 H new ATOM 0 HA HIS A 46 66.531 40.848-121.855 1.00 0.20 H new ATOM 0 HB2 HIS A 46 67.660 41.499-119.711 1.00 0.23 H new ATOM 0 HB3 HIS A 46 69.219 41.205-120.456 1.00 0.23 H new ATOM 0 HD2 HIS A 46 66.129 43.654-121.094 1.00 0.27 H new ATOM 0 HE1 HIS A 46 69.616 45.387-122.723 1.00 0.35 H new ATOM 0 HE2 HIS A 46 67.126 45.785-122.279 1.00 0.31 H new ATOM 520 N ALA A 47 69.544 39.861-122.809 1.00 0.19 N ATOM 521 CA ALA A 47 70.435 39.721-123.995 1.00 0.22 C ATOM 522 C ALA A 47 69.698 38.956-125.087 1.00 0.21 C ATOM 523 O ALA A 47 69.504 39.446-126.181 1.00 0.22 O ATOM 524 CB ALA A 47 71.688 38.939-123.592 1.00 0.27 C ATOM 0 H ALA A 47 69.926 39.483-121.942 1.00 0.19 H new ATOM 0 HA ALA A 47 70.718 40.707-124.363 1.00 0.22 H new ATOM 0 HB1 ALA A 47 72.344 38.833-124.456 1.00 0.27 H new ATOM 0 HB2 ALA A 47 72.213 39.475-122.801 1.00 0.27 H new ATOM 0 HB3 ALA A 47 71.400 37.951-123.232 1.00 0.27 H new ATOM 530 N ASP A 48 69.275 37.761-124.794 1.00 0.22 N ATOM 531 CA ASP A 48 68.537 36.971-125.814 1.00 0.25 C ATOM 532 C ASP A 48 67.370 37.816-126.311 1.00 0.22 C ATOM 533 O ASP A 48 67.188 38.016-127.494 1.00 0.25 O ATOM 534 CB ASP A 48 68.009 35.679-125.187 1.00 0.28 C ATOM 535 CG ASP A 48 69.185 34.834-124.693 1.00 0.31 C ATOM 536 OD1 ASP A 48 70.312 35.272-124.851 1.00 0.94 O ATOM 537 OD2 ASP A 48 68.937 33.762-124.165 1.00 0.84 O ATOM 0 H ASP A 48 69.408 37.298-123.895 1.00 0.22 H new ATOM 0 HA ASP A 48 69.197 36.711-126.642 1.00 0.25 H new ATOM 0 HB2 ASP A 48 67.341 35.911-124.358 1.00 0.28 H new ATOM 0 HB3 ASP A 48 67.427 35.119-125.918 1.00 0.28 H new ATOM 542 N LEU A 49 66.588 38.329-125.405 1.00 0.19 N ATOM 543 CA LEU A 49 65.445 39.179-125.826 1.00 0.19 C ATOM 544 C LEU A 49 65.974 40.234-126.801 1.00 0.18 C ATOM 545 O LEU A 49 65.346 40.544-127.794 1.00 0.19 O ATOM 546 CB LEU A 49 64.807 39.848-124.609 1.00 0.18 C ATOM 547 CG LEU A 49 63.791 38.888-123.983 1.00 0.35 C ATOM 548 CD1 LEU A 49 63.115 39.562-122.790 1.00 1.06 C ATOM 549 CD2 LEU A 49 62.730 38.515-125.023 1.00 0.89 C ATOM 0 H LEU A 49 66.690 38.197-124.399 1.00 0.19 H new ATOM 0 HA LEU A 49 64.681 38.572-126.311 1.00 0.19 H new ATOM 0 HB2 LEU A 49 65.573 40.112-123.880 1.00 0.18 H new ATOM 0 HB3 LEU A 49 64.316 40.775-124.904 1.00 0.18 H new ATOM 0 HG LEU A 49 64.306 37.988-123.648 1.00 0.35 H new ATOM 0 HD11 LEU A 49 62.393 38.877-122.346 1.00 1.06 H new ATOM 0 HD12 LEU A 49 63.868 39.827-122.047 1.00 1.06 H new ATOM 0 HD13 LEU A 49 62.602 40.464-123.124 1.00 1.06 H new ATOM 0 HD21 LEU A 49 62.007 37.832-124.577 1.00 0.89 H new ATOM 0 HD22 LEU A 49 62.217 39.416-125.359 1.00 0.89 H new ATOM 0 HD23 LEU A 49 63.209 38.031-125.874 1.00 0.89 H new ATOM 561 N LYS A 50 67.145 40.762-126.548 1.00 0.20 N ATOM 562 CA LYS A 50 67.718 41.761-127.493 1.00 0.21 C ATOM 563 C LYS A 50 67.985 41.041-128.812 1.00 0.23 C ATOM 564 O LYS A 50 67.489 41.411-129.854 1.00 0.24 O ATOM 565 CB LYS A 50 69.030 42.317-126.932 1.00 0.24 C ATOM 566 CG LYS A 50 68.786 42.911-125.542 1.00 0.36 C ATOM 567 CD LYS A 50 69.256 44.368-125.516 1.00 0.84 C ATOM 568 CE LYS A 50 70.775 44.411-125.348 1.00 1.09 C ATOM 569 NZ LYS A 50 71.231 45.829-125.306 1.00 1.84 N ATOM 0 H LYS A 50 67.722 40.546-125.735 1.00 0.20 H new ATOM 0 HA LYS A 50 67.028 42.592-127.639 1.00 0.21 H new ATOM 0 HB2 LYS A 50 69.776 41.525-126.874 1.00 0.24 H new ATOM 0 HB3 LYS A 50 69.428 43.081-127.600 1.00 0.24 H new ATOM 0 HG2 LYS A 50 67.726 42.856-125.293 1.00 0.36 H new ATOM 0 HG3 LYS A 50 69.321 42.332-124.789 1.00 0.36 H new ATOM 0 HD2 LYS A 50 68.967 44.871-126.439 1.00 0.84 H new ATOM 0 HD3 LYS A 50 68.774 44.902-124.697 1.00 0.84 H new ATOM 0 HE2 LYS A 50 71.065 43.898-124.431 1.00 1.09 H new ATOM 0 HE3 LYS A 50 71.258 43.887-126.173 1.00 1.09 H new ATOM 0 HZ1 LYS A 50 72.264 45.858-125.192 1.00 1.84 H new ATOM 0 HZ2 LYS A 50 70.967 46.305-126.192 1.00 1.84 H new ATOM 0 HZ3 LYS A 50 70.780 46.315-124.505 1.00 1.84 H new ATOM 583 N ILE A 51 68.762 39.999-128.768 1.00 0.25 N ATOM 584 CA ILE A 51 69.038 39.257-130.023 1.00 0.27 C ATOM 585 C ILE A 51 67.698 39.138-130.746 1.00 0.26 C ATOM 586 O ILE A 51 67.518 39.634-131.852 1.00 0.25 O ATOM 587 CB ILE A 51 69.586 37.866-129.701 1.00 0.33 C ATOM 588 CG1 ILE A 51 71.105 37.943-129.536 1.00 0.36 C ATOM 589 CG2 ILE A 51 69.248 36.904-130.842 1.00 0.42 C ATOM 590 CD1 ILE A 51 71.450 38.938-128.426 1.00 0.30 C ATOM 0 H ILE A 51 69.212 39.633-127.929 1.00 0.25 H new ATOM 0 HA ILE A 51 69.779 39.770-130.636 1.00 0.27 H new ATOM 0 HB ILE A 51 69.135 37.505-128.777 1.00 0.33 H new ATOM 0 HG12 ILE A 51 71.505 36.959-129.293 1.00 0.36 H new ATOM 0 HG13 ILE A 51 71.568 38.253-130.473 1.00 0.36 H new ATOM 0 HG21 ILE A 51 69.639 35.913-130.611 1.00 0.42 H new ATOM 0 HG22 ILE A 51 68.166 36.848-130.962 1.00 0.42 H new ATOM 0 HG23 ILE A 51 69.697 37.265-131.767 1.00 0.42 H new ATOM 0 HD11 ILE A 51 72.532 38.992-128.309 1.00 0.30 H new ATOM 0 HD12 ILE A 51 71.064 39.923-128.687 1.00 0.30 H new ATOM 0 HD13 ILE A 51 71.000 38.609-127.489 1.00 0.30 H new ATOM 602 N GLN A 52 66.730 38.527-130.117 1.00 0.26 N ATOM 603 CA GLN A 52 65.396 38.428-130.748 1.00 0.27 C ATOM 604 C GLN A 52 64.946 39.839-131.121 1.00 0.24 C ATOM 605 O GLN A 52 64.152 40.023-132.009 1.00 0.26 O ATOM 606 CB GLN A 52 64.403 37.814-129.761 1.00 0.32 C ATOM 607 CG GLN A 52 63.249 37.169-130.530 1.00 0.45 C ATOM 608 CD GLN A 52 63.753 35.917-131.249 1.00 0.62 C ATOM 609 OE1 GLN A 52 63.823 34.853-130.665 1.00 1.00 O ATOM 610 NE2 GLN A 52 64.110 35.997-132.502 1.00 0.48 N ATOM 0 H GLN A 52 66.811 38.095-129.196 1.00 0.26 H new ATOM 0 HA GLN A 52 65.441 37.797-131.635 1.00 0.27 H new ATOM 0 HB2 GLN A 52 64.903 37.069-129.143 1.00 0.32 H new ATOM 0 HB3 GLN A 52 64.021 38.582-129.088 1.00 0.32 H new ATOM 0 HG2 GLN A 52 62.442 36.908-129.845 1.00 0.45 H new ATOM 0 HG3 GLN A 52 62.839 37.876-131.252 1.00 0.45 H new ATOM 0 HE21 GLN A 52 64.052 36.889-132.993 1.00 0.48 H new ATOM 0 HE22 GLN A 52 64.447 35.167-132.990 1.00 0.48 H new ATOM 619 N GLU A 53 65.446 40.841-130.438 1.00 0.23 N ATOM 620 CA GLU A 53 65.041 42.239-130.772 1.00 0.23 C ATOM 621 C GLU A 53 65.685 42.641-132.095 1.00 0.20 C ATOM 622 O GLU A 53 65.101 43.343-132.889 1.00 0.21 O ATOM 623 CB GLU A 53 65.504 43.213-129.692 1.00 0.25 C ATOM 624 CG GLU A 53 65.200 44.644-130.147 1.00 0.28 C ATOM 625 CD GLU A 53 66.457 45.507-129.990 1.00 0.33 C ATOM 626 OE1 GLU A 53 67.336 45.109-129.245 1.00 1.09 O ATOM 627 OE2 GLU A 53 66.517 46.552-130.615 1.00 1.04 O ATOM 0 H GLU A 53 66.111 40.751-129.670 1.00 0.23 H new ATOM 0 HA GLU A 53 63.954 42.277-130.842 1.00 0.23 H new ATOM 0 HB2 GLU A 53 64.996 43.001-128.751 1.00 0.25 H new ATOM 0 HB3 GLU A 53 66.572 43.094-129.511 1.00 0.25 H new ATOM 0 HG2 GLU A 53 64.873 44.645-131.187 1.00 0.28 H new ATOM 0 HG3 GLU A 53 64.384 45.060-129.556 1.00 0.28 H new ATOM 634 N ARG A 54 66.886 42.206-132.346 1.00 0.22 N ATOM 635 CA ARG A 54 67.550 42.571-133.625 1.00 0.22 C ATOM 636 C ARG A 54 66.827 41.863-134.761 1.00 0.20 C ATOM 637 O ARG A 54 66.678 42.381-135.853 1.00 0.21 O ATOM 638 CB ARG A 54 68.998 42.094-133.589 1.00 0.24 C ATOM 639 CG ARG A 54 69.809 42.999-132.666 1.00 0.27 C ATOM 640 CD ARG A 54 70.152 44.303-133.391 1.00 0.85 C ATOM 641 NE ARG A 54 71.604 44.608-133.221 1.00 1.55 N ATOM 642 CZ ARG A 54 72.192 44.423-132.067 1.00 2.09 C ATOM 643 NH1 ARG A 54 71.502 44.026-131.032 1.00 2.40 N ATOM 644 NH2 ARG A 54 73.471 44.654-131.946 1.00 3.03 N ATOM 0 H ARG A 54 67.435 41.615-131.722 1.00 0.22 H new ATOM 0 HA ARG A 54 67.521 43.651-133.770 1.00 0.22 H new ATOM 0 HB2 ARG A 54 69.044 41.063-133.237 1.00 0.24 H new ATOM 0 HB3 ARG A 54 69.422 42.107-134.593 1.00 0.24 H new ATOM 0 HG2 ARG A 54 69.241 43.214-131.761 1.00 0.27 H new ATOM 0 HG3 ARG A 54 70.723 42.493-132.356 1.00 0.27 H new ATOM 0 HD2 ARG A 54 69.911 44.215-134.450 1.00 0.85 H new ATOM 0 HD3 ARG A 54 69.550 45.120-132.994 1.00 0.85 H new ATOM 0 HE ARG A 54 72.142 44.964-134.011 1.00 1.55 H new ATOM 0 HH11 ARG A 54 70.500 43.859-131.121 1.00 2.40 H new ATOM 0 HH12 ARG A 54 71.965 43.883-130.135 1.00 2.40 H new ATOM 0 HH21 ARG A 54 74.009 44.978-132.750 1.00 3.03 H new ATOM 0 HH22 ARG A 54 73.932 44.511-131.048 1.00 3.03 H new ATOM 658 N ASP A 55 66.350 40.687-134.489 1.00 0.20 N ATOM 659 CA ASP A 55 65.603 39.927-135.533 1.00 0.21 C ATOM 660 C ASP A 55 64.144 40.396-135.552 1.00 0.21 C ATOM 661 O ASP A 55 63.520 40.497-136.593 1.00 0.20 O ATOM 662 CB ASP A 55 65.656 38.431-135.212 1.00 0.25 C ATOM 663 CG ASP A 55 67.105 37.945-135.280 1.00 0.29 C ATOM 664 OD1 ASP A 55 67.971 38.763-135.540 1.00 0.94 O ATOM 665 OD2 ASP A 55 67.322 36.762-135.073 1.00 0.84 O ATOM 0 H ASP A 55 66.442 40.214-133.590 1.00 0.20 H new ATOM 0 HA ASP A 55 66.056 40.103-136.509 1.00 0.21 H new ATOM 0 HB2 ASP A 55 65.246 38.247-134.219 1.00 0.25 H new ATOM 0 HB3 ASP A 55 65.041 37.875-135.919 1.00 0.25 H new ATOM 670 N GLU A 56 63.609 40.716-134.408 1.00 0.27 N ATOM 671 CA GLU A 56 62.204 41.200-134.344 1.00 0.32 C ATOM 672 C GLU A 56 62.157 42.585-134.959 1.00 0.30 C ATOM 673 O GLU A 56 61.355 42.865-135.824 1.00 0.31 O ATOM 674 CB GLU A 56 61.739 41.264-132.889 1.00 0.39 C ATOM 675 CG GLU A 56 61.190 39.900-132.467 1.00 0.44 C ATOM 676 CD GLU A 56 59.785 39.714-133.046 1.00 0.89 C ATOM 677 OE1 GLU A 56 59.322 40.617-133.721 1.00 1.39 O ATOM 678 OE2 GLU A 56 59.198 38.673-132.802 1.00 1.72 O ATOM 0 H GLU A 56 64.088 40.663-133.509 1.00 0.27 H new ATOM 0 HA GLU A 56 61.547 40.521-134.887 1.00 0.32 H new ATOM 0 HB2 GLU A 56 62.570 41.549-132.243 1.00 0.39 H new ATOM 0 HB3 GLU A 56 60.970 42.028-132.775 1.00 0.39 H new ATOM 0 HG2 GLU A 56 61.848 39.106-132.820 1.00 0.44 H new ATOM 0 HG3 GLU A 56 61.159 39.829-131.380 1.00 0.44 H new ATOM 685 N LEU A 57 63.037 43.450-134.552 1.00 0.30 N ATOM 686 CA LEU A 57 63.055 44.796-135.160 1.00 0.32 C ATOM 687 C LEU A 57 63.352 44.602-136.643 1.00 0.28 C ATOM 688 O LEU A 57 62.656 45.102-137.501 1.00 0.29 O ATOM 689 CB LEU A 57 64.151 45.649-134.520 1.00 0.36 C ATOM 690 CG LEU A 57 63.608 46.320-133.258 1.00 0.50 C ATOM 691 CD1 LEU A 57 64.773 46.815-132.400 1.00 1.08 C ATOM 692 CD2 LEU A 57 62.728 47.508-133.650 1.00 1.22 C ATOM 0 H LEU A 57 63.738 43.282-133.830 1.00 0.30 H new ATOM 0 HA LEU A 57 62.103 45.305-135.009 1.00 0.32 H new ATOM 0 HB2 LEU A 57 65.011 45.027-134.272 1.00 0.36 H new ATOM 0 HB3 LEU A 57 64.496 46.404-135.226 1.00 0.36 H new ATOM 0 HG LEU A 57 63.018 45.600-132.691 1.00 0.50 H new ATOM 0 HD11 LEU A 57 64.385 47.293-131.501 1.00 1.08 H new ATOM 0 HD12 LEU A 57 65.403 45.971-132.119 1.00 1.08 H new ATOM 0 HD13 LEU A 57 65.363 47.535-132.968 1.00 1.08 H new ATOM 0 HD21 LEU A 57 62.341 47.986-132.750 1.00 1.22 H new ATOM 0 HD22 LEU A 57 63.319 48.227-134.218 1.00 1.22 H new ATOM 0 HD23 LEU A 57 61.896 47.159-134.262 1.00 1.22 H new ATOM 704 N ALA A 58 64.363 43.831-136.954 1.00 0.25 N ATOM 705 CA ALA A 58 64.656 43.571-138.384 1.00 0.24 C ATOM 706 C ALA A 58 63.359 43.070-139.012 1.00 0.21 C ATOM 707 O ALA A 58 63.095 43.260-140.186 1.00 0.21 O ATOM 708 CB ALA A 58 65.743 42.500-138.507 1.00 0.24 C ATOM 0 H ALA A 58 64.987 43.379-136.286 1.00 0.25 H new ATOM 0 HA ALA A 58 65.013 44.472-138.883 1.00 0.24 H new ATOM 0 HB1 ALA A 58 65.953 42.314-139.560 1.00 0.24 H new ATOM 0 HB2 ALA A 58 66.651 42.844-138.011 1.00 0.24 H new ATOM 0 HB3 ALA A 58 65.400 41.578-138.037 1.00 0.24 H new ATOM 714 N TRP A 59 62.521 42.466-138.211 1.00 0.19 N ATOM 715 CA TRP A 59 61.225 41.996-138.751 1.00 0.18 C ATOM 716 C TRP A 59 60.311 43.202-138.953 1.00 0.20 C ATOM 717 O TRP A 59 59.891 43.490-140.058 1.00 0.30 O ATOM 718 CB TRP A 59 60.545 40.995-137.823 1.00 0.19 C ATOM 719 CG TRP A 59 59.316 40.516-138.521 1.00 0.23 C ATOM 720 CD1 TRP A 59 59.290 39.553-139.470 1.00 0.26 C ATOM 721 CD2 TRP A 59 57.948 40.982-138.368 1.00 0.27 C ATOM 722 NE1 TRP A 59 57.995 39.409-139.924 1.00 0.30 N ATOM 723 CE2 TRP A 59 57.127 40.262-139.267 1.00 0.31 C ATOM 724 CE3 TRP A 59 57.346 41.949-137.544 1.00 0.30 C ATOM 725 CZ2 TRP A 59 55.753 40.498-139.346 1.00 0.37 C ATOM 726 CZ3 TRP A 59 55.965 42.185-137.620 1.00 0.36 C ATOM 727 CH2 TRP A 59 55.171 41.461-138.519 1.00 0.39 C ATOM 0 H TRP A 59 62.680 42.282-137.220 1.00 0.19 H new ATOM 0 HA TRP A 59 61.415 41.489-139.697 1.00 0.18 H new ATOM 0 HB2 TRP A 59 61.211 40.162-137.600 1.00 0.19 H new ATOM 0 HB3 TRP A 59 60.291 41.463-136.872 1.00 0.19 H new ATOM 0 HD1 TRP A 59 60.143 38.989-139.816 1.00 0.26 H new ATOM 0 HE1 TRP A 59 57.713 38.755-140.654 1.00 0.30 H new ATOM 0 HE3 TRP A 59 57.950 42.513-136.849 1.00 0.30 H new ATOM 0 HZ2 TRP A 59 55.145 39.940-140.042 1.00 0.37 H new ATOM 0 HZ3 TRP A 59 55.511 42.929-136.982 1.00 0.36 H new ATOM 0 HH2 TRP A 59 54.109 41.648-138.572 1.00 0.39 H new ATOM 738 N LYS A 60 59.979 43.912-137.902 1.00 0.27 N ATOM 739 CA LYS A 60 59.081 45.080-138.093 1.00 0.30 C ATOM 740 C LYS A 60 59.551 45.811-139.347 1.00 0.29 C ATOM 741 O LYS A 60 58.762 46.319-140.125 1.00 0.31 O ATOM 742 CB LYS A 60 59.137 46.011-136.874 1.00 0.38 C ATOM 743 CG LYS A 60 60.321 46.977-136.992 1.00 0.42 C ATOM 744 CD LYS A 60 60.233 48.024-135.881 1.00 1.08 C ATOM 745 CE LYS A 60 59.187 49.079-136.253 1.00 1.53 C ATOM 746 NZ LYS A 60 59.334 50.260-135.357 1.00 2.27 N ATOM 0 H LYS A 60 60.285 43.736-136.945 1.00 0.27 H new ATOM 0 HA LYS A 60 58.047 44.754-138.203 1.00 0.30 H new ATOM 0 HB2 LYS A 60 58.207 46.574-136.796 1.00 0.38 H new ATOM 0 HB3 LYS A 60 59.230 45.421-135.962 1.00 0.38 H new ATOM 0 HG2 LYS A 60 61.261 46.429-136.918 1.00 0.42 H new ATOM 0 HG3 LYS A 60 60.312 47.464-137.967 1.00 0.42 H new ATOM 0 HD2 LYS A 60 59.964 47.547-134.938 1.00 1.08 H new ATOM 0 HD3 LYS A 60 61.204 48.496-135.734 1.00 1.08 H new ATOM 0 HE2 LYS A 60 59.312 49.380-137.293 1.00 1.53 H new ATOM 0 HE3 LYS A 60 58.184 48.661-136.161 1.00 1.53 H new ATOM 0 HZ1 LYS A 60 58.624 50.977-135.609 1.00 2.27 H new ATOM 0 HZ2 LYS A 60 59.194 49.966-134.369 1.00 2.27 H new ATOM 0 HZ3 LYS A 60 60.287 50.662-135.467 1.00 2.27 H new ATOM 760 N LYS A 61 60.838 45.831-139.576 1.00 0.28 N ATOM 761 CA LYS A 61 61.360 46.491-140.796 1.00 0.30 C ATOM 762 C LYS A 61 61.113 45.568-141.987 1.00 0.27 C ATOM 763 O LYS A 61 60.917 46.020-143.097 1.00 0.35 O ATOM 764 CB LYS A 61 62.859 46.756-140.652 1.00 0.35 C ATOM 765 CG LYS A 61 63.123 47.501-139.342 1.00 0.40 C ATOM 766 CD LYS A 61 64.618 47.455-139.019 1.00 0.77 C ATOM 767 CE LYS A 61 65.030 48.753-138.323 1.00 1.42 C ATOM 768 NZ LYS A 61 64.568 49.919-139.128 1.00 2.43 N ATOM 0 H LYS A 61 61.545 45.418-138.968 1.00 0.28 H new ATOM 0 HA LYS A 61 60.853 47.444-140.945 1.00 0.30 H new ATOM 0 HB2 LYS A 61 63.408 45.815-140.664 1.00 0.35 H new ATOM 0 HB3 LYS A 61 63.218 47.345-141.496 1.00 0.35 H new ATOM 0 HG2 LYS A 61 62.790 48.536-139.427 1.00 0.40 H new ATOM 0 HG3 LYS A 61 62.551 47.048-138.532 1.00 0.40 H new ATOM 0 HD2 LYS A 61 64.836 46.601-138.378 1.00 0.77 H new ATOM 0 HD3 LYS A 61 65.195 47.322-139.934 1.00 0.77 H new ATOM 0 HE2 LYS A 61 64.598 48.794-137.323 1.00 1.42 H new ATOM 0 HE3 LYS A 61 66.113 48.786-138.204 1.00 1.42 H new ATOM 0 HZ1 LYS A 61 65.280 50.675-139.084 1.00 2.43 H new ATOM 0 HZ2 LYS A 61 64.434 49.627-140.117 1.00 2.43 H new ATOM 0 HZ3 LYS A 61 63.667 50.270-138.745 1.00 2.43 H new ATOM 782 N LEU A 62 61.077 44.273-141.769 1.00 0.24 N ATOM 783 CA LEU A 62 60.791 43.348-142.901 1.00 0.24 C ATOM 784 C LEU A 62 59.375 43.620-143.385 1.00 0.24 C ATOM 785 O LEU A 62 59.148 44.015-144.511 1.00 0.26 O ATOM 786 CB LEU A 62 60.846 41.894-142.421 1.00 0.24 C ATOM 787 CG LEU A 62 62.272 41.350-142.504 1.00 0.28 C ATOM 788 CD1 LEU A 62 62.455 40.246-141.460 1.00 0.24 C ATOM 789 CD2 LEU A 62 62.508 40.759-143.893 1.00 0.41 C ATOM 0 H LEU A 62 61.232 43.826-140.865 1.00 0.24 H new ATOM 0 HA LEU A 62 61.526 43.504-143.690 1.00 0.24 H new ATOM 0 HB2 LEU A 62 60.487 41.831-141.394 1.00 0.24 H new ATOM 0 HB3 LEU A 62 60.181 41.280-143.029 1.00 0.24 H new ATOM 0 HG LEU A 62 62.980 42.158-142.319 1.00 0.28 H new ATOM 0 HD11 LEU A 62 63.471 39.856-141.517 1.00 0.24 H new ATOM 0 HD12 LEU A 62 62.278 40.654-140.465 1.00 0.24 H new ATOM 0 HD13 LEU A 62 61.746 39.441-141.654 1.00 0.24 H new ATOM 0 HD21 LEU A 62 63.524 40.370-143.955 1.00 0.41 H new ATOM 0 HD22 LEU A 62 61.799 39.950-144.070 1.00 0.41 H new ATOM 0 HD23 LEU A 62 62.369 41.534-144.647 1.00 0.41 H new ATOM 801 N LYS A 63 58.416 43.395-142.528 1.00 0.24 N ATOM 802 CA LYS A 63 57.006 43.626-142.926 1.00 0.26 C ATOM 803 C LYS A 63 56.841 45.080-143.373 1.00 0.29 C ATOM 804 O LYS A 63 56.051 45.372-144.248 1.00 0.30 O ATOM 805 CB LYS A 63 56.065 43.314-141.758 1.00 0.34 C ATOM 806 CG LYS A 63 56.586 43.958-140.475 1.00 0.46 C ATOM 807 CD LYS A 63 55.401 44.401-139.612 1.00 0.41 C ATOM 808 CE LYS A 63 54.619 45.507-140.325 1.00 0.58 C ATOM 809 NZ LYS A 63 53.204 45.075-140.506 1.00 1.20 N ATOM 0 H LYS A 63 58.551 43.062-141.573 1.00 0.24 H new ATOM 0 HA LYS A 63 56.750 42.964-143.753 1.00 0.26 H new ATOM 0 HB2 LYS A 63 55.064 43.684-141.979 1.00 0.34 H new ATOM 0 HB3 LYS A 63 55.984 42.235-141.625 1.00 0.34 H new ATOM 0 HG2 LYS A 63 57.206 43.250-139.925 1.00 0.46 H new ATOM 0 HG3 LYS A 63 57.216 44.815-140.715 1.00 0.46 H new ATOM 0 HD2 LYS A 63 54.747 43.552-139.414 1.00 0.41 H new ATOM 0 HD3 LYS A 63 55.758 44.761-138.647 1.00 0.41 H new ATOM 0 HE2 LYS A 63 54.658 46.428-139.743 1.00 0.58 H new ATOM 0 HE3 LYS A 63 55.072 45.722-141.293 1.00 0.58 H new ATOM 0 HZ1 LYS A 63 52.684 45.804-141.035 1.00 1.20 H new ATOM 0 HZ2 LYS A 63 53.179 44.179-141.034 1.00 1.20 H new ATOM 0 HZ3 LYS A 63 52.760 44.940-139.575 1.00 1.20 H new ATOM 823 N LEU A 64 57.590 46.001-142.813 1.00 0.33 N ATOM 824 CA LEU A 64 57.472 47.420-143.256 1.00 0.43 C ATOM 825 C LEU A 64 57.983 47.557-144.689 1.00 0.52 C ATOM 826 O LEU A 64 57.331 48.130-145.539 1.00 0.75 O ATOM 827 CB LEU A 64 58.321 48.311-142.336 1.00 0.38 C ATOM 828 CG LEU A 64 57.501 48.790-141.131 1.00 0.50 C ATOM 829 CD1 LEU A 64 56.780 50.089-141.492 1.00 1.10 C ATOM 830 CD2 LEU A 64 56.469 47.734-140.739 1.00 1.23 C ATOM 0 H LEU A 64 58.272 45.830-142.074 1.00 0.33 H new ATOM 0 HA LEU A 64 56.427 47.725-143.210 1.00 0.43 H new ATOM 0 HB2 LEU A 64 59.194 47.757-141.990 1.00 0.38 H new ATOM 0 HB3 LEU A 64 58.690 49.171-142.895 1.00 0.38 H new ATOM 0 HG LEU A 64 58.174 48.959-140.291 1.00 0.50 H new ATOM 0 HD11 LEU A 64 56.197 50.431-140.637 1.00 1.10 H new ATOM 0 HD12 LEU A 64 57.513 50.850-141.759 1.00 1.10 H new ATOM 0 HD13 LEU A 64 56.115 49.913-142.338 1.00 1.10 H new ATOM 0 HD21 LEU A 64 55.894 48.087-139.883 1.00 1.23 H new ATOM 0 HD22 LEU A 64 55.797 47.553-141.578 1.00 1.23 H new ATOM 0 HD23 LEU A 64 56.979 46.807-140.477 1.00 1.23 H new ATOM 842 N ASP A 65 59.152 47.048-144.960 1.00 0.45 N ATOM 843 CA ASP A 65 59.718 47.160-146.335 1.00 0.60 C ATOM 844 C ASP A 65 59.032 46.164-147.272 1.00 0.96 C ATOM 845 O ASP A 65 59.208 46.215-148.473 1.00 0.98 O ATOM 846 CB ASP A 65 61.219 46.863-146.290 1.00 0.53 C ATOM 847 CG ASP A 65 61.937 47.980-145.530 1.00 0.53 C ATOM 848 OD1 ASP A 65 61.315 49.002-145.292 1.00 1.31 O ATOM 849 OD2 ASP A 65 63.096 47.794-145.199 1.00 1.14 O ATOM 0 H ASP A 65 59.742 46.558-144.288 1.00 0.45 H new ATOM 0 HA ASP A 65 59.550 48.171-146.707 1.00 0.60 H new ATOM 0 HB2 ASP A 65 61.396 45.904-145.802 1.00 0.53 H new ATOM 0 HB3 ASP A 65 61.616 46.784-147.302 1.00 0.53 H new ATOM 854 N GLY A 66 58.246 45.265-146.746 1.00 1.30 N ATOM 855 CA GLY A 66 57.553 44.284-147.627 1.00 1.72 C ATOM 856 C GLY A 66 58.506 43.148-148.012 1.00 0.91 C ATOM 857 O GLY A 66 58.737 42.892-149.176 1.00 1.14 O ATOM 0 H GLY A 66 58.054 45.168-145.749 1.00 1.30 H new ATOM 0 HA2 GLY A 66 56.681 43.878-147.115 1.00 1.72 H new ATOM 0 HA3 GLY A 66 57.191 44.784-148.525 1.00 1.72 H new ATOM 861 N LEU A 67 59.051 42.454-147.047 1.00 0.37 N ATOM 862 CA LEU A 67 59.972 41.331-147.375 1.00 1.03 C ATOM 863 C LEU A 67 59.279 40.005-147.052 1.00 0.91 C ATOM 864 O LEU A 67 59.323 39.068-147.824 1.00 1.09 O ATOM 865 CB LEU A 67 61.266 41.471-146.576 1.00 1.69 C ATOM 866 CG LEU A 67 62.243 42.354-147.362 1.00 1.79 C ATOM 867 CD1 LEU A 67 63.130 43.147-146.400 1.00 2.52 C ATOM 868 CD2 LEU A 67 63.121 41.469-148.248 1.00 2.68 C ATOM 0 H LEU A 67 58.898 42.617-146.052 1.00 0.37 H new ATOM 0 HA LEU A 67 60.221 41.354-148.436 1.00 1.03 H new ATOM 0 HB2 LEU A 67 61.061 41.912-145.601 1.00 1.69 H new ATOM 0 HB3 LEU A 67 61.706 40.490-146.396 1.00 1.69 H new ATOM 0 HG LEU A 67 61.676 43.052-147.978 1.00 1.79 H new ATOM 0 HD11 LEU A 67 63.819 43.770-146.970 1.00 2.52 H new ATOM 0 HD12 LEU A 67 62.507 43.780-145.768 1.00 2.52 H new ATOM 0 HD13 LEU A 67 63.697 42.457-145.775 1.00 2.52 H new ATOM 0 HD21 LEU A 67 63.817 42.092-148.809 1.00 2.68 H new ATOM 0 HD22 LEU A 67 63.680 40.771-147.625 1.00 2.68 H new ATOM 0 HD23 LEU A 67 62.492 40.912-148.943 1.00 2.68 H new ATOM 880 N ASP A 68 58.576 39.942-145.955 1.00 0.69 N ATOM 881 CA ASP A 68 57.803 38.715-145.613 1.00 0.59 C ATOM 882 C ASP A 68 56.333 39.096-145.777 1.00 0.59 C ATOM 883 O ASP A 68 55.834 39.909-145.024 1.00 0.59 O ATOM 884 CB ASP A 68 58.089 38.305-144.158 1.00 0.53 C ATOM 885 CG ASP A 68 57.818 36.809-143.990 1.00 0.64 C ATOM 886 OD1 ASP A 68 57.783 36.116-144.994 1.00 1.19 O ATOM 887 OD2 ASP A 68 57.651 36.381-142.860 1.00 0.97 O ATOM 0 H ASP A 68 58.504 40.697-145.273 1.00 0.69 H new ATOM 0 HA ASP A 68 58.072 37.872-146.249 1.00 0.59 H new ATOM 0 HB2 ASP A 68 59.124 38.529-143.902 1.00 0.53 H new ATOM 0 HB3 ASP A 68 57.461 38.879-143.477 1.00 0.53 H new ATOM 892 N GLU A 69 55.611 38.565-146.731 1.00 0.63 N ATOM 893 CA GLU A 69 54.187 38.976-146.868 1.00 0.69 C ATOM 894 C GLU A 69 53.283 38.075-146.029 1.00 0.71 C ATOM 895 O GLU A 69 52.089 38.285-145.960 1.00 0.77 O ATOM 896 CB GLU A 69 53.773 38.880-148.338 1.00 0.73 C ATOM 897 CG GLU A 69 53.876 37.427-148.804 1.00 0.75 C ATOM 898 CD GLU A 69 53.579 37.349-150.303 1.00 1.36 C ATOM 899 OE1 GLU A 69 52.411 37.313-150.654 1.00 2.06 O ATOM 900 OE2 GLU A 69 54.524 37.329-151.074 1.00 1.82 O ATOM 0 H GLU A 69 55.941 37.877-147.408 1.00 0.63 H new ATOM 0 HA GLU A 69 54.083 40.002-146.515 1.00 0.69 H new ATOM 0 HB2 GLU A 69 52.752 39.242-148.464 1.00 0.73 H new ATOM 0 HB3 GLU A 69 54.414 39.515-148.949 1.00 0.73 H new ATOM 0 HG2 GLU A 69 54.874 37.038-148.600 1.00 0.75 H new ATOM 0 HG3 GLU A 69 53.172 36.806-148.250 1.00 0.75 H new ATOM 907 N ASP A 70 53.824 37.077-145.386 1.00 0.72 N ATOM 908 CA ASP A 70 52.964 36.186-144.559 1.00 0.78 C ATOM 909 C ASP A 70 53.435 36.276-143.112 1.00 0.69 C ATOM 910 O ASP A 70 52.874 35.672-142.220 1.00 0.84 O ATOM 911 CB ASP A 70 53.092 34.743-145.053 1.00 0.83 C ATOM 912 CG ASP A 70 52.836 34.695-146.561 1.00 0.95 C ATOM 913 OD1 ASP A 70 51.880 35.313-147.000 1.00 1.43 O ATOM 914 OD2 ASP A 70 53.601 34.041-147.250 1.00 1.34 O ATOM 0 H ASP A 70 54.816 36.841-145.397 1.00 0.72 H new ATOM 0 HA ASP A 70 51.921 36.493-144.635 1.00 0.78 H new ATOM 0 HB2 ASP A 70 54.087 34.358-144.830 1.00 0.83 H new ATOM 0 HB3 ASP A 70 52.379 34.104-144.532 1.00 0.83 H new ATOM 919 N GLY A 71 54.457 37.049-142.878 1.00 0.50 N ATOM 920 CA GLY A 71 54.972 37.215-141.496 1.00 0.43 C ATOM 921 C GLY A 71 55.651 35.934-141.005 1.00 0.34 C ATOM 922 O GLY A 71 55.855 35.764-139.821 1.00 0.31 O ATOM 0 H GLY A 71 54.960 37.576-143.592 1.00 0.50 H new ATOM 0 HA2 GLY A 71 55.682 38.042-141.466 1.00 0.43 H new ATOM 0 HA3 GLY A 71 54.151 37.475-140.827 1.00 0.43 H new ATOM 926 N GLU A 72 56.018 35.026-141.875 1.00 0.36 N ATOM 927 CA GLU A 72 56.687 33.797-141.363 1.00 0.34 C ATOM 928 C GLU A 72 57.918 34.242-140.577 1.00 0.30 C ATOM 929 O GLU A 72 58.112 33.875-139.438 1.00 0.30 O ATOM 930 CB GLU A 72 57.113 32.910-142.536 1.00 0.40 C ATOM 931 CG GLU A 72 57.856 31.682-142.005 1.00 1.23 C ATOM 932 CD GLU A 72 58.495 30.927-143.172 1.00 1.97 C ATOM 933 OE1 GLU A 72 57.756 30.388-143.978 1.00 2.68 O ATOM 934 OE2 GLU A 72 59.714 30.903-143.240 1.00 2.64 O ATOM 0 H GLU A 72 55.888 35.080-142.885 1.00 0.36 H new ATOM 0 HA GLU A 72 56.010 33.225-140.729 1.00 0.34 H new ATOM 0 HB2 GLU A 72 56.238 32.600-143.107 1.00 0.40 H new ATOM 0 HB3 GLU A 72 57.755 33.471-143.215 1.00 0.40 H new ATOM 0 HG2 GLU A 72 58.622 31.988-141.293 1.00 1.23 H new ATOM 0 HG3 GLU A 72 57.166 31.029-141.470 1.00 1.23 H new ATOM 941 N LYS A 73 58.749 35.045-141.181 1.00 0.31 N ATOM 942 CA LYS A 73 59.955 35.524-140.457 1.00 0.33 C ATOM 943 C LYS A 73 59.499 35.968-139.068 1.00 0.29 C ATOM 944 O LYS A 73 60.217 35.862-138.084 1.00 0.29 O ATOM 945 CB LYS A 73 60.573 36.700-141.216 1.00 0.38 C ATOM 946 CG LYS A 73 60.913 36.264-142.643 1.00 0.55 C ATOM 947 CD LYS A 73 61.726 37.361-143.335 1.00 1.07 C ATOM 948 CE LYS A 73 63.212 37.158-143.038 1.00 1.38 C ATOM 949 NZ LYS A 73 63.627 35.797-143.483 1.00 2.36 N ATOM 0 H LYS A 73 58.645 35.387-142.136 1.00 0.31 H new ATOM 0 HA LYS A 73 60.707 34.739-140.378 1.00 0.33 H new ATOM 0 HB2 LYS A 73 59.878 37.539-141.237 1.00 0.38 H new ATOM 0 HB3 LYS A 73 61.472 37.044-140.705 1.00 0.38 H new ATOM 0 HG2 LYS A 73 61.481 35.334-142.624 1.00 0.55 H new ATOM 0 HG3 LYS A 73 59.998 36.068-143.202 1.00 0.55 H new ATOM 0 HD2 LYS A 73 61.552 37.334-144.411 1.00 1.07 H new ATOM 0 HD3 LYS A 73 61.405 38.342-142.985 1.00 1.07 H new ATOM 0 HE2 LYS A 73 63.803 37.916-143.552 1.00 1.38 H new ATOM 0 HE3 LYS A 73 63.400 37.276-141.971 1.00 1.38 H new ATOM 0 HZ1 LYS A 73 64.596 35.835-143.859 1.00 2.36 H new ATOM 0 HZ2 LYS A 73 63.595 35.143-142.675 1.00 2.36 H new ATOM 0 HZ3 LYS A 73 62.980 35.462-144.226 1.00 2.36 H new ATOM 963 N GLU A 74 58.264 36.376-138.978 1.00 0.28 N ATOM 964 CA GLU A 74 57.691 36.750-137.661 1.00 0.28 C ATOM 965 C GLU A 74 57.371 35.434-136.967 1.00 0.26 C ATOM 966 O GLU A 74 57.501 35.280-135.784 1.00 0.27 O ATOM 967 CB GLU A 74 56.405 37.546-137.866 1.00 0.31 C ATOM 968 CG GLU A 74 56.167 38.434-136.648 1.00 0.37 C ATOM 969 CD GLU A 74 54.672 38.479-136.322 1.00 0.47 C ATOM 970 OE1 GLU A 74 53.909 37.842-137.030 1.00 1.14 O ATOM 971 OE2 GLU A 74 54.315 39.150-135.368 1.00 1.11 O ATOM 0 H GLU A 74 57.625 36.466-139.768 1.00 0.28 H new ATOM 0 HA GLU A 74 58.378 37.363-137.078 1.00 0.28 H new ATOM 0 HB2 GLU A 74 56.480 38.155-138.767 1.00 0.31 H new ATOM 0 HB3 GLU A 74 55.563 36.869-138.008 1.00 0.31 H new ATOM 0 HG2 GLU A 74 56.723 38.050-135.793 1.00 0.37 H new ATOM 0 HG3 GLU A 74 56.536 39.441-136.843 1.00 0.37 H new ATOM 978 N ALA A 75 56.959 34.489-137.751 1.00 0.25 N ATOM 979 CA ALA A 75 56.642 33.150-137.196 1.00 0.27 C ATOM 980 C ALA A 75 57.915 32.642-136.545 1.00 0.26 C ATOM 981 O ALA A 75 57.982 32.492-135.345 1.00 0.27 O ATOM 982 CB ALA A 75 56.188 32.197-138.305 1.00 0.30 C ATOM 0 H ALA A 75 56.827 34.584-138.758 1.00 0.25 H new ATOM 0 HA ALA A 75 55.827 33.209-136.475 1.00 0.27 H new ATOM 0 HB1 ALA A 75 55.961 31.221-137.876 1.00 0.30 H new ATOM 0 HB2 ALA A 75 55.296 32.598-138.787 1.00 0.30 H new ATOM 0 HB3 ALA A 75 56.983 32.092-139.043 1.00 0.30 H new ATOM 988 N ARG A 76 58.931 32.380-137.310 1.00 0.28 N ATOM 989 CA ARG A 76 60.187 31.888-136.691 1.00 0.31 C ATOM 990 C ARG A 76 60.494 32.749-135.470 1.00 0.28 C ATOM 991 O ARG A 76 60.756 32.249-134.395 1.00 0.30 O ATOM 992 CB ARG A 76 61.335 31.989-137.699 1.00 0.35 C ATOM 993 CG ARG A 76 62.659 31.678-136.999 1.00 0.66 C ATOM 994 CD ARG A 76 63.783 31.615-138.035 1.00 1.00 C ATOM 995 NE ARG A 76 64.376 32.971-138.208 1.00 1.51 N ATOM 996 CZ ARG A 76 65.528 33.108-138.806 1.00 2.03 C ATOM 997 NH1 ARG A 76 66.160 32.057-139.251 1.00 2.34 N ATOM 998 NH2 ARG A 76 66.048 34.295-138.957 1.00 3.14 N ATOM 0 H ARG A 76 58.948 32.483-138.325 1.00 0.28 H new ATOM 0 HA ARG A 76 60.073 30.846-136.393 1.00 0.31 H new ATOM 0 HB2 ARG A 76 61.174 31.291-138.521 1.00 0.35 H new ATOM 0 HB3 ARG A 76 61.366 32.989-138.131 1.00 0.35 H new ATOM 0 HG2 ARG A 76 62.878 32.444-136.256 1.00 0.66 H new ATOM 0 HG3 ARG A 76 62.587 30.729-136.467 1.00 0.66 H new ATOM 0 HD2 ARG A 76 64.549 30.910-137.713 1.00 1.00 H new ATOM 0 HD3 ARG A 76 63.395 31.252-138.987 1.00 1.00 H new ATOM 0 HE ARG A 76 63.882 33.792-137.859 1.00 1.51 H new ATOM 0 HH11 ARG A 76 65.754 31.129-139.131 1.00 2.34 H new ATOM 0 HH12 ARG A 76 67.060 32.163-139.718 1.00 2.34 H new ATOM 0 HH21 ARG A 76 65.554 35.116-138.608 1.00 3.14 H new ATOM 0 HH22 ARG A 76 66.948 34.402-139.424 1.00 3.14 H new ATOM 1012 N LEU A 77 60.460 34.041-135.626 1.00 0.30 N ATOM 1013 CA LEU A 77 60.748 34.927-134.462 1.00 0.31 C ATOM 1014 C LEU A 77 59.816 34.561-133.304 1.00 0.29 C ATOM 1015 O LEU A 77 60.251 34.202-132.228 1.00 0.30 O ATOM 1016 CB LEU A 77 60.533 36.384-134.866 1.00 0.35 C ATOM 1017 CG LEU A 77 61.799 36.905-135.546 1.00 0.41 C ATOM 1018 CD1 LEU A 77 61.455 38.114-136.411 1.00 0.51 C ATOM 1019 CD2 LEU A 77 62.822 37.312-134.481 1.00 0.38 C ATOM 0 H LEU A 77 60.247 34.521-136.501 1.00 0.30 H new ATOM 0 HA LEU A 77 61.782 34.795-134.145 1.00 0.31 H new ATOM 0 HB2 LEU A 77 59.682 36.465-135.542 1.00 0.35 H new ATOM 0 HB3 LEU A 77 60.302 36.988-133.988 1.00 0.35 H new ATOM 0 HG LEU A 77 62.221 36.120-136.173 1.00 0.41 H new ATOM 0 HD11 LEU A 77 62.359 38.484-136.895 1.00 0.51 H new ATOM 0 HD12 LEU A 77 60.730 37.823-137.171 1.00 0.51 H new ATOM 0 HD13 LEU A 77 61.030 38.900-135.786 1.00 0.51 H new ATOM 0 HD21 LEU A 77 63.724 37.683-134.966 1.00 0.38 H new ATOM 0 HD22 LEU A 77 62.400 38.095-133.852 1.00 0.38 H new ATOM 0 HD23 LEU A 77 63.071 36.447-133.866 1.00 0.38 H new ATOM 1031 N ILE A 78 58.537 34.646-133.524 1.00 0.29 N ATOM 1032 CA ILE A 78 57.548 34.305-132.461 1.00 0.32 C ATOM 1033 C ILE A 78 57.888 32.946-131.866 1.00 0.30 C ATOM 1034 O ILE A 78 57.902 32.768-130.671 1.00 0.32 O ATOM 1035 CB ILE A 78 56.155 34.248-133.073 1.00 0.37 C ATOM 1036 CG1 ILE A 78 55.757 35.653-133.505 1.00 0.38 C ATOM 1037 CG2 ILE A 78 55.158 33.728-132.035 1.00 0.45 C ATOM 1038 CD1 ILE A 78 54.779 35.563-134.667 1.00 0.37 C ATOM 0 H ILE A 78 58.126 34.942-134.409 1.00 0.29 H new ATOM 0 HA ILE A 78 57.579 35.063-131.679 1.00 0.32 H new ATOM 0 HB ILE A 78 56.153 33.578-133.933 1.00 0.37 H new ATOM 0 HG12 ILE A 78 55.301 36.187-132.671 1.00 0.38 H new ATOM 0 HG13 ILE A 78 56.640 36.219-133.801 1.00 0.38 H new ATOM 0 HG21 ILE A 78 54.162 33.688-132.475 1.00 0.45 H new ATOM 0 HG22 ILE A 78 55.454 32.729-131.715 1.00 0.45 H new ATOM 0 HG23 ILE A 78 55.148 34.396-131.174 1.00 0.45 H new ATOM 0 HD11 ILE A 78 54.492 36.567-134.979 1.00 0.37 H new ATOM 0 HD12 ILE A 78 55.252 35.045-135.501 1.00 0.37 H new ATOM 0 HD13 ILE A 78 53.892 35.012-134.354 1.00 0.37 H new ATOM 1050 N ARG A 79 58.187 31.994-132.698 1.00 0.29 N ATOM 1051 CA ARG A 79 58.561 30.647-132.167 1.00 0.32 C ATOM 1052 C ARG A 79 59.845 30.799-131.351 1.00 0.26 C ATOM 1053 O ARG A 79 60.029 30.156-130.338 1.00 0.26 O ATOM 1054 CB ARG A 79 58.798 29.672-133.321 1.00 0.38 C ATOM 1055 CG ARG A 79 57.777 29.933-134.425 1.00 0.39 C ATOM 1056 CD ARG A 79 57.093 28.621-134.816 1.00 0.39 C ATOM 1057 NE ARG A 79 56.661 27.901-133.585 1.00 1.50 N ATOM 1058 CZ ARG A 79 55.807 26.917-133.671 1.00 2.14 C ATOM 1059 NH1 ARG A 79 55.332 26.564-134.834 1.00 2.28 N ATOM 1060 NH2 ARG A 79 55.429 26.285-132.593 1.00 3.27 N ATOM 0 H ARG A 79 58.191 32.082-133.714 1.00 0.29 H new ATOM 0 HA ARG A 79 57.756 30.255-131.545 1.00 0.32 H new ATOM 0 HB2 ARG A 79 59.809 29.791-133.710 1.00 0.38 H new ATOM 0 HB3 ARG A 79 58.712 28.645-132.967 1.00 0.38 H new ATOM 0 HG2 ARG A 79 57.034 30.654-134.084 1.00 0.39 H new ATOM 0 HG3 ARG A 79 58.270 30.370-135.293 1.00 0.39 H new ATOM 0 HD2 ARG A 79 56.232 28.823-135.453 1.00 0.39 H new ATOM 0 HD3 ARG A 79 57.778 27.999-135.393 1.00 0.39 H new ATOM 0 HE ARG A 79 57.032 28.177-132.676 1.00 1.50 H new ATOM 0 HH11 ARG A 79 55.628 27.057-135.677 1.00 2.28 H new ATOM 0 HH12 ARG A 79 54.665 25.795-134.900 1.00 2.28 H new ATOM 0 HH21 ARG A 79 55.801 26.560-131.684 1.00 3.27 H new ATOM 0 HH22 ARG A 79 54.762 25.516-132.660 1.00 3.27 H new ATOM 1074 N ASN A 80 60.729 31.661-131.779 1.00 0.23 N ATOM 1075 CA ASN A 80 61.995 31.874-131.020 1.00 0.21 C ATOM 1076 C ASN A 80 61.672 32.631-129.734 1.00 0.21 C ATOM 1077 O ASN A 80 62.373 32.530-128.746 1.00 0.22 O ATOM 1078 CB ASN A 80 62.978 32.685-131.867 1.00 0.23 C ATOM 1079 CG ASN A 80 63.198 31.979-133.207 1.00 0.30 C ATOM 1080 OD1 ASN A 80 62.717 30.884-133.416 1.00 1.06 O ATOM 1081 ND2 ASN A 80 63.912 32.565-134.129 1.00 1.15 N ATOM 0 H ASN A 80 60.629 32.227-132.622 1.00 0.23 H new ATOM 0 HA ASN A 80 62.450 30.913-130.780 1.00 0.21 H new ATOM 0 HB2 ASN A 80 62.589 33.690-132.032 1.00 0.23 H new ATOM 0 HB3 ASN A 80 63.926 32.793-131.340 1.00 0.23 H new ATOM 0 HD21 ASN A 80 64.066 32.103-135.025 1.00 1.15 H new ATOM 0 HD22 ASN A 80 64.316 33.485-133.953 1.00 1.15 H new ATOM 1088 N LEU A 81 60.572 33.330-129.717 1.00 0.23 N ATOM 1089 CA LEU A 81 60.163 34.027-128.473 1.00 0.28 C ATOM 1090 C LEU A 81 59.545 32.954-127.597 1.00 0.30 C ATOM 1091 O LEU A 81 59.932 32.732-126.470 1.00 0.31 O ATOM 1092 CB LEU A 81 59.127 35.109-128.790 1.00 0.35 C ATOM 1093 CG LEU A 81 59.802 36.262-129.534 1.00 0.44 C ATOM 1094 CD1 LEU A 81 58.761 37.012-130.367 1.00 1.28 C ATOM 1095 CD2 LEU A 81 60.430 37.222-128.522 1.00 1.26 C ATOM 0 H LEU A 81 59.942 33.447-130.510 1.00 0.23 H new ATOM 0 HA LEU A 81 61.005 34.517-127.985 1.00 0.28 H new ATOM 0 HB2 LEU A 81 58.324 34.691-129.397 1.00 0.35 H new ATOM 0 HB3 LEU A 81 58.673 35.473-127.868 1.00 0.35 H new ATOM 0 HG LEU A 81 60.576 35.866-130.191 1.00 0.44 H new ATOM 0 HD11 LEU A 81 59.243 37.834-130.897 1.00 1.28 H new ATOM 0 HD12 LEU A 81 58.311 36.329-131.088 1.00 1.28 H new ATOM 0 HD13 LEU A 81 57.986 37.408-129.710 1.00 1.28 H new ATOM 0 HD21 LEU A 81 60.912 38.044-129.051 1.00 1.26 H new ATOM 0 HD22 LEU A 81 59.655 37.617-127.866 1.00 1.26 H new ATOM 0 HD23 LEU A 81 61.172 36.689-127.927 1.00 1.26 H new ATOM 1107 N ASN A 82 58.606 32.253-128.158 1.00 0.35 N ATOM 1108 CA ASN A 82 57.954 31.138-127.445 1.00 0.42 C ATOM 1109 C ASN A 82 59.037 30.267-126.824 1.00 0.37 C ATOM 1110 O ASN A 82 59.091 30.089-125.626 1.00 0.38 O ATOM 1111 CB ASN A 82 57.140 30.339-128.470 1.00 0.51 C ATOM 1112 CG ASN A 82 55.738 30.938-128.591 1.00 0.62 C ATOM 1113 OD1 ASN A 82 54.756 30.223-128.567 1.00 1.27 O ATOM 1114 ND2 ASN A 82 55.602 32.230-128.720 1.00 0.98 N ATOM 0 H ASN A 82 58.258 32.414-129.103 1.00 0.35 H new ATOM 0 HA ASN A 82 57.293 31.496-126.656 1.00 0.42 H new ATOM 0 HB2 ASN A 82 57.639 30.357-129.439 1.00 0.51 H new ATOM 0 HB3 ASN A 82 57.075 29.295-128.164 1.00 0.51 H new ATOM 0 HD21 ASN A 82 54.671 32.639-128.801 1.00 0.98 H new ATOM 0 HD22 ASN A 82 56.427 32.830-128.740 1.00 0.98 H new ATOM 1121 N VAL A 83 59.916 29.740-127.624 1.00 0.35 N ATOM 1122 CA VAL A 83 61.011 28.902-127.069 1.00 0.36 C ATOM 1123 C VAL A 83 61.723 29.704-125.979 1.00 0.32 C ATOM 1124 O VAL A 83 61.875 29.254-124.864 1.00 0.35 O ATOM 1125 CB VAL A 83 62.000 28.548-128.181 1.00 0.38 C ATOM 1126 CG1 VAL A 83 62.932 27.435-127.700 1.00 0.42 C ATOM 1127 CG2 VAL A 83 61.232 28.069-129.416 1.00 0.44 C ATOM 0 H VAL A 83 59.924 29.853-128.638 1.00 0.35 H new ATOM 0 HA VAL A 83 60.607 27.980-126.652 1.00 0.36 H new ATOM 0 HB VAL A 83 62.587 29.430-128.437 1.00 0.38 H new ATOM 0 HG11 VAL A 83 63.637 27.183-128.492 1.00 0.42 H new ATOM 0 HG12 VAL A 83 63.480 27.774-126.821 1.00 0.42 H new ATOM 0 HG13 VAL A 83 62.344 26.554-127.443 1.00 0.42 H new ATOM 0 HG21 VAL A 83 61.937 27.817-130.208 1.00 0.44 H new ATOM 0 HG22 VAL A 83 60.644 27.188-129.160 1.00 0.44 H new ATOM 0 HG23 VAL A 83 60.567 28.861-129.761 1.00 0.44 H new ATOM 1137 N ILE A 84 62.154 30.895-126.294 1.00 0.27 N ATOM 1138 CA ILE A 84 62.847 31.714-125.264 1.00 0.30 C ATOM 1139 C ILE A 84 62.061 31.612-123.958 1.00 0.31 C ATOM 1140 O ILE A 84 62.598 31.294-122.909 1.00 0.37 O ATOM 1141 CB ILE A 84 62.899 33.169-125.701 1.00 0.34 C ATOM 1142 CG1 ILE A 84 64.028 33.347-126.709 1.00 0.37 C ATOM 1143 CG2 ILE A 84 63.163 34.057-124.483 1.00 0.44 C ATOM 1144 CD1 ILE A 84 63.754 34.590-127.544 1.00 0.37 C ATOM 0 H ILE A 84 62.057 31.331-127.211 1.00 0.27 H new ATOM 0 HA ILE A 84 63.865 31.349-125.129 1.00 0.30 H new ATOM 0 HB ILE A 84 61.950 33.450-126.157 1.00 0.34 H new ATOM 0 HG12 ILE A 84 64.983 33.443-126.192 1.00 0.37 H new ATOM 0 HG13 ILE A 84 64.101 32.470-127.352 1.00 0.37 H new ATOM 0 HG21 ILE A 84 63.201 35.101-124.795 1.00 0.44 H new ATOM 0 HG22 ILE A 84 62.362 33.924-123.756 1.00 0.44 H new ATOM 0 HG23 ILE A 84 64.115 33.779-124.030 1.00 0.44 H new ATOM 0 HD11 ILE A 84 64.557 34.726-128.269 1.00 0.37 H new ATOM 0 HD12 ILE A 84 62.806 34.473-128.070 1.00 0.37 H new ATOM 0 HD13 ILE A 84 63.702 35.462-126.892 1.00 0.37 H new ATOM 1156 N LEU A 85 60.784 31.878-124.013 1.00 0.35 N ATOM 1157 CA LEU A 85 59.959 31.799-122.779 1.00 0.42 C ATOM 1158 C LEU A 85 59.989 30.367-122.251 1.00 0.42 C ATOM 1159 O LEU A 85 60.400 30.117-121.143 1.00 0.47 O ATOM 1160 CB LEU A 85 58.516 32.194-123.094 1.00 0.54 C ATOM 1161 CG LEU A 85 58.365 33.717-123.038 1.00 0.61 C ATOM 1162 CD1 LEU A 85 58.251 34.165-121.581 1.00 0.69 C ATOM 1163 CD2 LEU A 85 59.586 34.380-123.680 1.00 0.61 C ATOM 0 H LEU A 85 60.279 32.146-124.858 1.00 0.35 H new ATOM 0 HA LEU A 85 60.360 32.480-122.029 1.00 0.42 H new ATOM 0 HB2 LEU A 85 58.238 31.829-124.083 1.00 0.54 H new ATOM 0 HB3 LEU A 85 57.838 31.727-122.380 1.00 0.54 H new ATOM 0 HG LEU A 85 57.467 34.010-123.581 1.00 0.61 H new ATOM 0 HD11 LEU A 85 58.144 35.249-121.541 1.00 0.69 H new ATOM 0 HD12 LEU A 85 57.379 33.697-121.124 1.00 0.69 H new ATOM 0 HD13 LEU A 85 59.149 33.869-121.038 1.00 0.69 H new ATOM 0 HD21 LEU A 85 59.475 35.464-123.639 1.00 0.61 H new ATOM 0 HD22 LEU A 85 60.486 34.086-123.140 1.00 0.61 H new ATOM 0 HD23 LEU A 85 59.667 34.063-124.720 1.00 0.61 H new ATOM 1175 N ALA A 86 59.566 29.424-123.043 1.00 0.47 N ATOM 1176 CA ALA A 86 59.579 28.007-122.590 1.00 0.58 C ATOM 1177 C ALA A 86 60.967 27.672-122.036 1.00 0.59 C ATOM 1178 O ALA A 86 61.153 26.695-121.338 1.00 0.73 O ATOM 1179 CB ALA A 86 59.276 27.097-123.782 1.00 0.64 C ATOM 0 H ALA A 86 59.211 29.574-123.987 1.00 0.47 H new ATOM 0 HA ALA A 86 58.828 27.858-121.815 1.00 0.58 H new ATOM 0 HB1 ALA A 86 59.284 26.057-123.457 1.00 0.64 H new ATOM 0 HB2 ALA A 86 58.294 27.343-124.187 1.00 0.64 H new ATOM 0 HB3 ALA A 86 60.033 27.242-124.552 1.00 0.64 H new ATOM 1185 N LYS A 87 61.941 28.476-122.357 1.00 0.50 N ATOM 1186 CA LYS A 87 63.327 28.221-121.874 1.00 0.60 C ATOM 1187 C LYS A 87 63.485 28.772-120.464 1.00 0.58 C ATOM 1188 O LYS A 87 64.007 28.119-119.582 1.00 0.71 O ATOM 1189 CB LYS A 87 64.309 28.931-122.799 1.00 0.61 C ATOM 1190 CG LYS A 87 65.672 28.237-122.736 1.00 0.82 C ATOM 1191 CD LYS A 87 66.739 29.152-123.339 1.00 0.99 C ATOM 1192 CE LYS A 87 68.126 28.665-122.918 1.00 1.63 C ATOM 1193 NZ LYS A 87 68.297 27.241-123.323 1.00 2.02 N ATOM 0 H LYS A 87 61.835 29.307-122.939 1.00 0.50 H new ATOM 0 HA LYS A 87 63.523 27.149-121.869 1.00 0.60 H new ATOM 0 HB2 LYS A 87 63.932 28.921-123.822 1.00 0.61 H new ATOM 0 HB3 LYS A 87 64.409 29.976-122.506 1.00 0.61 H new ATOM 0 HG2 LYS A 87 65.924 27.999-121.702 1.00 0.82 H new ATOM 0 HG3 LYS A 87 65.637 27.293-123.281 1.00 0.82 H new ATOM 0 HD2 LYS A 87 66.658 29.156-124.426 1.00 0.99 H new ATOM 0 HD3 LYS A 87 66.585 30.178-123.004 1.00 0.99 H new ATOM 0 HE2 LYS A 87 68.896 29.281-123.382 1.00 1.63 H new ATOM 0 HE3 LYS A 87 68.246 28.764-121.839 1.00 1.63 H new ATOM 0 HZ1 LYS A 87 69.306 26.989-123.289 1.00 2.02 H new ATOM 0 HZ2 LYS A 87 67.765 26.629-122.672 1.00 2.02 H new ATOM 0 HZ3 LYS A 87 67.940 27.110-124.291 1.00 2.02 H new ATOM 1207 N TYR A 88 63.021 29.965-120.240 1.00 0.45 N ATOM 1208 CA TYR A 88 63.126 30.549-118.877 1.00 0.47 C ATOM 1209 C TYR A 88 62.031 29.933-118.013 1.00 0.54 C ATOM 1210 O TYR A 88 62.109 29.898-116.801 1.00 0.58 O ATOM 1211 CB TYR A 88 62.949 32.067-118.949 1.00 0.44 C ATOM 1212 CG TYR A 88 64.213 32.685-119.494 1.00 0.45 C ATOM 1213 CD1 TYR A 88 65.299 32.925-118.643 1.00 0.58 C ATOM 1214 CD2 TYR A 88 64.304 33.012-120.853 1.00 0.53 C ATOM 1215 CE1 TYR A 88 66.474 33.493-119.149 1.00 0.64 C ATOM 1216 CE2 TYR A 88 65.480 33.579-121.359 1.00 0.62 C ATOM 1217 CZ TYR A 88 66.565 33.819-120.507 1.00 0.61 C ATOM 1218 OH TYR A 88 67.724 34.377-121.007 1.00 0.73 O ATOM 0 H TYR A 88 62.575 30.560-120.938 1.00 0.45 H new ATOM 0 HA TYR A 88 64.105 30.338-118.447 1.00 0.47 H new ATOM 0 HB2 TYR A 88 62.102 32.317-119.588 1.00 0.44 H new ATOM 0 HB3 TYR A 88 62.731 32.468-117.959 1.00 0.44 H new ATOM 0 HD1 TYR A 88 65.230 32.672-117.595 1.00 0.58 H new ATOM 0 HD2 TYR A 88 63.467 32.827-121.510 1.00 0.53 H new ATOM 0 HE1 TYR A 88 67.310 33.680-118.492 1.00 0.64 H new ATOM 0 HE2 TYR A 88 65.550 33.831-122.407 1.00 0.62 H new ATOM 0 HH TYR A 88 67.704 34.350-121.986 1.00 0.73 H new ATOM 1228 N GLY A 89 61.001 29.466-118.650 1.00 0.59 N ATOM 1229 CA GLY A 89 59.866 28.863-117.902 1.00 0.69 C ATOM 1230 C GLY A 89 58.942 29.989-117.442 1.00 0.77 C ATOM 1231 O GLY A 89 58.474 30.010-116.321 1.00 1.09 O ATOM 0 H GLY A 89 60.894 29.475-119.664 1.00 0.59 H new ATOM 0 HA2 GLY A 89 59.323 28.162-118.536 1.00 0.69 H new ATOM 0 HA3 GLY A 89 60.233 28.299-117.045 1.00 0.69 H new ATOM 1235 N LEU A 90 58.682 30.927-118.309 1.00 0.65 N ATOM 1236 CA LEU A 90 57.791 32.062-117.946 1.00 0.75 C ATOM 1237 C LEU A 90 56.425 31.879-118.612 1.00 0.80 C ATOM 1238 O LEU A 90 55.397 31.914-117.966 1.00 1.31 O ATOM 1239 CB LEU A 90 58.420 33.369-118.428 1.00 0.82 C ATOM 1240 CG LEU A 90 58.637 34.303-117.240 1.00 1.03 C ATOM 1241 CD1 LEU A 90 59.622 35.405-117.634 1.00 1.50 C ATOM 1242 CD2 LEU A 90 57.301 34.930-116.838 1.00 1.68 C ATOM 0 H LEU A 90 59.051 30.956-119.259 1.00 0.65 H new ATOM 0 HA LEU A 90 57.663 32.092-116.864 1.00 0.75 H new ATOM 0 HB2 LEU A 90 59.370 33.166-118.922 1.00 0.82 H new ATOM 0 HB3 LEU A 90 57.773 33.846-119.164 1.00 0.82 H new ATOM 0 HG LEU A 90 59.041 33.739-116.399 1.00 1.03 H new ATOM 0 HD11 LEU A 90 59.778 36.073-116.787 1.00 1.50 H new ATOM 0 HD12 LEU A 90 60.573 34.957-117.923 1.00 1.50 H new ATOM 0 HD13 LEU A 90 59.218 35.971-118.473 1.00 1.50 H new ATOM 0 HD21 LEU A 90 57.453 35.597-115.990 1.00 1.68 H new ATOM 0 HD22 LEU A 90 56.897 35.496-117.678 1.00 1.68 H new ATOM 0 HD23 LEU A 90 56.599 34.144-116.560 1.00 1.68 H new ATOM 1254 N ASP A 91 56.411 31.691-119.901 1.00 0.77 N ATOM 1255 CA ASP A 91 55.116 31.512-120.619 1.00 0.87 C ATOM 1256 C ASP A 91 54.216 30.544-119.850 1.00 1.30 C ATOM 1257 O ASP A 91 53.048 30.398-120.155 1.00 1.70 O ATOM 1258 CB ASP A 91 55.378 30.957-122.020 1.00 1.04 C ATOM 1259 CG ASP A 91 55.626 32.114-122.991 1.00 0.99 C ATOM 1260 OD1 ASP A 91 55.563 33.250-122.553 1.00 0.84 O ATOM 1261 OD2 ASP A 91 55.873 31.842-124.155 1.00 1.42 O ATOM 0 H ASP A 91 57.242 31.653-120.491 1.00 0.77 H new ATOM 0 HA ASP A 91 54.618 32.479-120.694 1.00 0.87 H new ATOM 0 HB2 ASP A 91 56.241 30.291-122.003 1.00 1.04 H new ATOM 0 HB3 ASP A 91 54.525 30.365-122.353 1.00 1.04 H new ATOM 1266 N GLY A 92 54.739 29.876-118.858 1.00 1.77 N ATOM 1267 CA GLY A 92 53.895 28.922-118.085 1.00 2.22 C ATOM 1268 C GLY A 92 52.786 29.686-117.360 1.00 2.72 C ATOM 1269 O GLY A 92 51.735 29.148-117.081 1.00 3.30 O ATOM 0 H GLY A 92 55.709 29.949-118.551 1.00 1.77 H new ATOM 0 HA2 GLY A 92 53.461 28.180-118.755 1.00 2.22 H new ATOM 0 HA3 GLY A 92 54.508 28.381-117.364 1.00 2.22 H new ATOM 1273 N LYS A 93 53.025 30.930-117.037 1.00 3.13 N ATOM 1274 CA LYS A 93 51.997 31.737-116.314 1.00 3.96 C ATOM 1275 C LYS A 93 50.634 31.623-117.007 1.00 4.22 C ATOM 1276 O LYS A 93 50.022 32.614-117.354 1.00 4.63 O ATOM 1277 CB LYS A 93 52.432 33.203-116.292 1.00 4.60 C ATOM 1278 CG LYS A 93 52.687 33.680-117.723 1.00 4.79 C ATOM 1279 CD LYS A 93 53.076 35.160-117.708 1.00 5.91 C ATOM 1280 CE LYS A 93 51.952 35.978-117.070 1.00 6.60 C ATOM 1281 NZ LYS A 93 51.902 37.328-117.698 1.00 6.86 N ATOM 0 H LYS A 93 53.893 31.425-117.244 1.00 3.13 H new ATOM 0 HA LYS A 93 51.904 31.357-115.296 1.00 3.96 H new ATOM 0 HB2 LYS A 93 51.661 33.815-115.825 1.00 4.60 H new ATOM 0 HB3 LYS A 93 53.335 33.317-115.693 1.00 4.60 H new ATOM 0 HG2 LYS A 93 53.482 33.089-118.178 1.00 4.79 H new ATOM 0 HG3 LYS A 93 51.794 33.534-118.330 1.00 4.79 H new ATOM 0 HD2 LYS A 93 54.002 35.298-117.150 1.00 5.91 H new ATOM 0 HD3 LYS A 93 53.262 35.508-118.724 1.00 5.91 H new ATOM 0 HE2 LYS A 93 50.997 35.469-117.201 1.00 6.60 H new ATOM 0 HE3 LYS A 93 52.119 36.070-115.997 1.00 6.60 H new ATOM 0 HZ1 LYS A 93 50.920 37.669-117.710 1.00 6.86 H new ATOM 0 HZ2 LYS A 93 52.491 37.987-117.151 1.00 6.86 H new ATOM 0 HZ3 LYS A 93 52.260 37.271-118.673 1.00 6.86 H new ATOM 1295 N LYS A 94 50.150 30.428-117.199 1.00 4.52 N ATOM 1296 CA LYS A 94 48.823 30.255-117.855 1.00 5.25 C ATOM 1297 C LYS A 94 47.836 29.697-116.828 1.00 5.64 C ATOM 1298 O LYS A 94 46.679 29.463-117.118 1.00 6.30 O ATOM 1299 CB LYS A 94 48.952 29.276-119.025 1.00 6.00 C ATOM 1300 CG LYS A 94 47.894 29.599-120.080 1.00 6.18 C ATOM 1301 CD LYS A 94 48.498 30.517-121.146 1.00 7.02 C ATOM 1302 CE LYS A 94 49.096 29.669-122.270 1.00 7.55 C ATOM 1303 NZ LYS A 94 49.989 28.629-121.686 1.00 7.75 N ATOM 0 H LYS A 94 50.616 29.562-116.930 1.00 4.52 H new ATOM 0 HA LYS A 94 48.467 31.214-118.230 1.00 5.25 H new ATOM 0 HB2 LYS A 94 49.948 29.344-119.461 1.00 6.00 H new ATOM 0 HB3 LYS A 94 48.828 28.252-118.672 1.00 6.00 H new ATOM 0 HG2 LYS A 94 47.531 28.680-120.540 1.00 6.18 H new ATOM 0 HG3 LYS A 94 47.036 30.082-119.613 1.00 6.18 H new ATOM 0 HD2 LYS A 94 47.732 31.181-121.546 1.00 7.02 H new ATOM 0 HD3 LYS A 94 49.268 31.149-120.703 1.00 7.02 H new ATOM 0 HE2 LYS A 94 48.300 29.198-122.847 1.00 7.55 H new ATOM 0 HE3 LYS A 94 49.658 30.301-122.958 1.00 7.55 H new ATOM 0 HZ1 LYS A 94 50.474 28.119-122.451 1.00 7.75 H new ATOM 0 HZ2 LYS A 94 50.694 29.083-121.071 1.00 7.75 H new ATOM 0 HZ3 LYS A 94 49.423 27.959-121.128 1.00 7.75 H new ATOM 1317 N ASP A 95 48.294 29.484-115.624 1.00 5.55 N ATOM 1318 CA ASP A 95 47.398 28.942-114.565 1.00 6.18 C ATOM 1319 C ASP A 95 46.715 30.099-113.832 1.00 6.72 C ATOM 1320 O ASP A 95 46.496 30.046-112.638 1.00 7.02 O ATOM 1321 CB ASP A 95 48.223 28.125-113.568 1.00 6.12 C ATOM 1322 CG ASP A 95 48.936 26.989-114.306 1.00 6.05 C ATOM 1323 OD1 ASP A 95 48.314 26.384-115.164 1.00 6.23 O ATOM 1324 OD2 ASP A 95 50.092 26.745-114.001 1.00 6.22 O ATOM 0 H ASP A 95 49.254 29.663-115.328 1.00 5.55 H new ATOM 0 HA ASP A 95 46.642 28.304-115.022 1.00 6.18 H new ATOM 0 HB2 ASP A 95 48.953 28.765-113.072 1.00 6.12 H new ATOM 0 HB3 ASP A 95 47.576 27.718-112.791 1.00 6.12 H new ATOM 1329 N ALA A 96 46.376 31.144-114.537 1.00 7.12 N ATOM 1330 CA ALA A 96 45.708 32.301-113.878 1.00 7.86 C ATOM 1331 C ALA A 96 44.711 31.790-112.837 1.00 8.30 C ATOM 1332 O ALA A 96 43.554 31.558-113.130 1.00 8.93 O ATOM 1333 CB ALA A 96 44.966 33.128-114.930 1.00 8.22 C ATOM 0 H ALA A 96 46.533 31.246-115.540 1.00 7.12 H new ATOM 0 HA ALA A 96 46.458 32.922-113.389 1.00 7.86 H new ATOM 0 HB1 ALA A 96 44.477 33.975-114.449 1.00 8.22 H new ATOM 0 HB2 ALA A 96 45.675 33.493-115.673 1.00 8.22 H new ATOM 0 HB3 ALA A 96 44.216 32.506-115.419 1.00 8.22 H new ATOM 1339 N ARG A 97 45.149 31.612-111.620 1.00 8.23 N ATOM 1340 CA ARG A 97 44.226 31.116-110.562 1.00 8.95 C ATOM 1341 C ARG A 97 43.621 29.779-110.998 1.00 9.53 C ATOM 1342 O ARG A 97 43.468 29.511-112.174 1.00 9.76 O ATOM 1343 CB ARG A 97 43.105 32.135-110.344 1.00 8.85 C ATOM 1344 CG ARG A 97 42.283 31.737-109.117 1.00 8.58 C ATOM 1345 CD ARG A 97 41.090 32.684-108.972 1.00 8.65 C ATOM 1346 NE ARG A 97 40.105 32.412-110.055 1.00 9.34 N ATOM 1347 CZ ARG A 97 38.891 32.883-109.968 1.00 9.46 C ATOM 1348 NH1 ARG A 97 38.541 33.592-108.930 1.00 9.01 N ATOM 1349 NH2 ARG A 97 38.028 32.642-110.917 1.00 10.30 N ATOM 0 H ARG A 97 46.106 31.789-111.314 1.00 8.23 H new ATOM 0 HA ARG A 97 44.779 30.979-109.633 1.00 8.95 H new ATOM 0 HB2 ARG A 97 43.526 33.131-110.205 1.00 8.85 H new ATOM 0 HB3 ARG A 97 42.464 32.180-111.225 1.00 8.85 H new ATOM 0 HG2 ARG A 97 41.935 30.709-109.217 1.00 8.58 H new ATOM 0 HG3 ARG A 97 42.904 31.777-108.222 1.00 8.58 H new ATOM 0 HD2 ARG A 97 40.621 32.549-107.997 1.00 8.65 H new ATOM 0 HD3 ARG A 97 41.426 33.720-109.023 1.00 8.65 H new ATOM 0 HE ARG A 97 40.379 31.857-110.866 1.00 9.34 H new ATOM 0 HH11 ARG A 97 39.216 33.777-108.188 1.00 9.01 H new ATOM 0 HH12 ARG A 97 37.593 33.961-108.861 1.00 9.01 H new ATOM 0 HH21 ARG A 97 38.302 32.086-111.727 1.00 10.30 H new ATOM 0 HH22 ARG A 97 37.079 33.010-110.849 1.00 10.30 H new ATOM 1363 N GLN A 98 43.278 28.938-110.062 1.00 9.97 N ATOM 1364 CA GLN A 98 42.685 27.620-110.424 1.00 10.76 C ATOM 1365 C GLN A 98 41.501 27.836-111.369 1.00 10.99 C ATOM 1366 O GLN A 98 41.045 28.964-111.468 1.00 11.00 O ATOM 1367 CB GLN A 98 42.203 26.911-109.157 1.00 11.07 C ATOM 1368 CG GLN A 98 43.409 26.514-108.304 1.00 11.38 C ATOM 1369 CD GLN A 98 42.926 25.835-107.021 1.00 11.58 C ATOM 1370 OE1 GLN A 98 41.847 26.117-106.540 1.00 11.67 O ATOM 1371 NE2 GLN A 98 43.686 24.946-106.442 1.00 11.85 N ATOM 0 H GLN A 98 43.383 29.107-109.061 1.00 9.97 H new ATOM 0 HA GLN A 98 43.438 27.007-110.919 1.00 10.76 H new ATOM 0 HB2 GLN A 98 41.543 27.567-108.589 1.00 11.07 H new ATOM 0 HB3 GLN A 98 41.624 26.026-109.421 1.00 11.07 H new ATOM 0 HG2 GLN A 98 44.057 25.839-108.863 1.00 11.38 H new ATOM 0 HG3 GLN A 98 44.002 27.396-108.060 1.00 11.38 H new ATOM 0 HE21 GLN A 98 44.592 24.709-106.846 1.00 11.85 H new ATOM 0 HE22 GLN A 98 43.374 24.488-105.586 1.00 11.85 H new TER 1380 GLN A 98