#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1u15 s ASP 18 N 0.00 6.58 0.17 8.00 -1.08 -1.26 -4.93 116.67 124.15 1u15 s ASP 18 Ca 0.00 2.62 -0.14 0.00 -0.52 0.00 0.00 52.55 54.50 1u15 s ASP 18 Cb 0.00 -2.59 0.14 0.00 -1.46 0.00 0.00 42.92 39.01 1u15 s ASP 18 CO 0.00 -0.83 1.71 1.55 0.52 0.00 0.00 175.17 178.12 1u15 h PRO 19 N 6.88 0.18 -0.33 4.34 0.13 -2.07 -1.86 132.00 139.27 1u15 h PRO 19 Ca -0.43 -0.01 -0.01 0.00 -0.87 0.00 0.00 66.00 64.69 1u15 h PRO 19 Cb 1.20 -0.04 -0.02 0.00 0.13 0.00 0.00 31.00 32.28 1u15 h PRO 19 CO 0.92 0.12 0.17 0.82 -0.23 0.00 0.00 178.00 179.80 1u15 h ILE 20 N 0.18 1.14 -1.01 -3.56 5.03 -2.01 -1.87 117.51 115.42 1u15 h ILE 20 Ca 0.22 -0.38 0.23 0.00 -0.12 0.00 0.00 64.86 64.80 1u15 h ILE 20 Cb 0.29 0.80 -0.10 0.00 -3.03 0.00 0.00 36.82 34.78 1u15 h ILE 20 CO -0.31 0.15 0.62 0.24 -0.68 0.00 0.00 178.15 178.17 1u15 h MET 21 N 0.40 0.55 0.00 2.37 2.86 -1.86 -0.61 114.93 118.64 1u15 h MET 21 Ca 0.11 -0.03 -0.06 0.00 -2.06 0.00 0.00 59.70 57.66 1u15 h MET 21 Cb 0.08 -0.12 -0.01 0.00 0.06 0.00 0.00 31.60 31.61 1u15 h MET 21 CO -0.02 0.36 -0.29 0.93 1.06 0.00 0.00 176.91 178.95 1u15 h GLU 22 N 0.57 0.00 0.00 1.72 5.08 -0.52 -2.87 114.58 118.56 1u15 h GLU 22 Ca 0.59 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.91 1u15 h GLU 22 Cb 1.21 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.45 1u15 h GLU 22 CO -0.36 0.29 -0.21 0.87 -1.00 0.00 0.00 179.01 178.60 1u15 h LYS 23 N 0.00 0.00 -0.00 2.33 1.79 -0.91 -2.73 116.57 117.06 1u15 h LYS 23 Ca -0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 1u15 h LYS 23 Cb 0.91 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.56 1u15 h LYS 23 CO 0.04 0.21 -0.04 1.28 -1.08 0.00 0.00 179.45 179.86 1u15 n LEU 24 N -3.26 0.25 -0.03 2.94 4.77 -1.08 -3.54 117.00 117.04 1u15 n LEU 24 Ca 0.01 0.07 -0.02 0.00 -0.03 0.00 0.00 56.01 56.05 1u15 n LEU 24 Cb 0.49 -0.16 -0.07 0.00 -2.33 0.00 0.00 43.42 41.35 1u15 n LEU 24 CO 0.34 0.04 -0.74 0.59 -1.33 0.00 0.00 177.39 176.30 1u15 n ASN 25 N -1.01 2.80 -4.52 -1.43 3.02 -1.09 -4.91 115.26 108.11 1u15 n ASN 25 Ca 0.17 0.00 -0.13 0.00 -0.03 0.00 0.00 54.58 54.59 1u15 n ASN 25 Cb 0.22 0.95 -0.10 0.00 -0.61 0.00 0.00 39.78 40.24 1u15 n ASN 25 CO 0.00 0.00 0.00 -0.24 -2.62 0.00 0.00 177.26 174.40 1u15 n SER 26 N -2.18 1.05 -0.28 6.41 2.88 -1.05 -4.66 113.62 115.81 1u15 n SER 26 Ca -0.11 -1.77 0.12 0.00 -1.33 0.00 0.00 58.87 55.78 1u15 n SER 26 Cb 0.62 -1.51 0.23 0.00 -0.75 0.00 0.00 64.21 62.80 1u15 n SER 26 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 1u15 n SER 27 N 17.04 1.25 -0.35 -3.46 7.64 -0.84 -4.32 113.62 130.58 1u15 n SER 27 Ca 0.43 -1.01 0.13 0.00 1.01 0.00 0.00 58.87 59.44 1u15 n SER 27 Cb 0.42 0.29 0.33 0.00 -1.01 0.00 0.00 64.21 64.24 1u15 n SER 27 CO 0.00 0.00 0.00 -0.29 -3.01 0.00 0.00 175.04 171.74 1u15 h ILE 28 N 1.36 0.69 -1.22 0.44 -0.00 -1.29 0.34 117.51 117.82 1u15 h ILE 28 Ca 0.00 -0.26 0.35 0.00 -0.00 0.00 0.00 64.86 64.96 1u15 h ILE 28 Cb 0.57 -0.12 -0.08 0.00 -0.00 0.00 0.00 36.82 37.19 1u15 h ILE 28 CO 0.00 0.14 0.84 0.00 -0.00 0.00 0.00 178.15 179.12 1u15 h ALA 29 N 1.65 2.81 0.00 0.18 0.00 -1.85 -3.23 119.26 118.83 1u15 h ALA 29 Ca 0.58 0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.51 1u15 h ALA 29 Cb 0.93 0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.81 1u15 h ALA 29 CO -0.39 -1.25 -0.74 2.48 0.00 0.00 0.00 179.25 179.36 1u15 n TYR 30 N -4.40 0.00 0.98 0.00 0.18 -0.64 -4.76 117.16 108.51 1u15 n TYR 30 Ca 0.29 0.00 0.05 0.00 1.88 0.00 0.00 57.90 60.12 1u15 n TYR 30 Cb 1.22 0.00 0.29 0.00 -0.38 0.00 0.00 39.34 40.46 1u15 n TYR 30 CO 0.00 0.00 0.00 -0.40 -2.08 0.00 0.00 176.86 174.38 1u15 n ASP 31 N -1.76 0.00 0.31 9.48 3.85 0.02 -2.71 116.55 125.74 1u15 n ASP 31 Ca 0.00 -0.67 0.19 0.00 -0.71 0.00 0.00 54.79 53.59 1u15 n ASP 31 Cb 0.37 0.00 1.02 0.00 -1.35 0.00 0.00 41.12 41.16 1u15 n ASP 31 CO 0.00 0.00 0.00 1.56 -1.01 0.00 0.00 177.20 177.75 1u15 h GLN 32 N 0.00 0.00 0.00 0.11 4.20 -1.79 0.30 115.11 117.93 1u15 h GLN 32 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1u15 h GLN 32 Cb 0.00 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.78 1u15 h GLN 32 CO 0.00 0.02 0.00 0.54 -0.67 0.00 0.00 178.83 178.72 1u15 n ARG 33 N -3.38 0.05 -0.11 1.46 5.12 -1.10 -0.35 116.66 118.35 1u15 n ARG 33 Ca -0.03 0.48 0.11 0.00 -1.93 0.00 0.00 57.85 56.48 1u15 n ARG 33 Cb 0.12 -1.64 0.16 0.00 -1.16 0.00 0.00 32.46 29.93 1u15 n ARG 33 CO 0.00 0.00 0.00 1.28 -1.93 0.00 0.00 177.63 176.98 1u15 n LEU 34 N -1.74 3.16 0.01 0.55 4.77 0.10 -4.63 117.00 119.21 1u15 n LEU 34 Ca 0.01 -1.30 -0.06 0.00 -0.03 0.00 0.00 56.01 54.63 1u15 n LEU 34 Cb 0.06 -0.14 -0.04 0.00 -2.33 0.00 0.00 43.42 40.97 1u15 n LEU 34 CO 0.07 0.63 0.50 0.77 -1.33 0.00 0.00 177.39 178.03 1u15 h SER 35 N 4.30 -0.68 -0.75 -1.43 4.64 -0.81 0.59 113.55 119.40 1u15 h SER 35 Ca 0.00 0.08 0.04 0.00 -0.47 0.00 0.00 61.79 61.43 1u15 h SER 35 Cb 0.94 0.26 -0.05 0.00 -0.31 0.00 0.00 62.40 63.24 1u15 h SER 35 CO 0.00 -0.20 0.47 -0.08 -0.87 0.00 0.00 176.83 176.14 1u15 h GLU 36 N -0.26 0.88 -0.20 4.77 4.57 -1.82 -1.80 114.58 120.72 1u15 h GLU 36 Ca 0.01 -0.05 -0.15 0.00 -1.18 0.00 0.00 59.36 57.99 1u15 h GLU 36 Cb 0.28 -0.20 -0.01 0.00 -0.16 0.00 0.00 28.75 28.67 1u15 h GLU 36 CO -0.16 0.58 -0.49 -0.39 -1.18 0.00 0.00 179.01 177.37 1u15 h VAL 37 N 0.91 1.32 -0.50 0.32 -1.51 -1.80 -2.41 116.25 112.57 1u15 h VAL 37 Ca 0.30 -1.71 0.02 0.00 -1.23 0.00 0.00 66.70 64.08 1u15 h VAL 37 Cb 0.04 1.70 -0.03 0.00 -2.13 0.00 0.00 31.29 30.87 1u15 h VAL 37 CO -0.12 0.53 0.31 -0.78 -1.23 0.00 0.00 177.57 176.28 1u15 h ASP 38 N 0.42 0.51 -0.72 4.19 1.82 0.60 0.52 116.42 123.76 1u15 h ASP 38 Ca 0.02 -0.00 0.02 0.00 -0.39 0.00 0.00 57.03 56.67 1u15 h ASP 38 Cb 1.01 -0.11 -0.04 0.00 0.68 0.00 0.00 39.33 40.87 1u15 h ASP 38 CO 0.09 0.36 0.47 0.40 -1.61 0.00 0.00 179.24 178.95 1u15 h ILE 39 N 0.62 1.16 -0.55 2.25 1.08 -1.20 -1.42 117.51 119.44 1u15 h ILE 39 Ca 0.20 -0.32 -0.05 0.00 -0.39 0.00 0.00 64.86 64.29 1u15 h ILE 39 Cb -0.01 0.13 -0.03 0.00 -3.07 0.00 0.00 36.82 33.85 1u15 h ILE 39 CO -0.08 0.17 0.14 1.56 -0.69 0.00 0.00 178.15 179.26 1u15 h GLN 40 N 0.94 0.84 -0.78 2.37 1.08 -0.82 0.17 115.11 118.92 1u15 h GLN 40 Ca 0.27 -0.17 -0.04 0.00 -1.45 0.00 0.00 58.65 57.27 1u15 h GLN 40 Cb -0.07 -0.13 -0.04 0.00 -0.05 0.00 0.00 27.48 27.20 1u15 h GLN 40 CO -0.07 0.75 0.35 0.00 -0.95 0.00 0.00 178.83 178.90 1u15 h ALA 41 N 1.34 1.14 -0.05 3.87 0.00 -0.20 -2.25 119.26 123.12 1u15 h ALA 41 Ca 0.18 -0.17 -0.11 0.00 0.00 0.00 0.00 54.91 54.82 1u15 h ALA 41 Cb 0.28 -0.31 0.01 0.00 0.00 0.00 0.00 17.79 17.77 1u15 h ALA 41 CO -0.00 0.63 -0.38 0.77 0.00 0.00 0.00 179.25 180.27 1u15 h SER 42 N 1.12 0.42 -0.84 0.00 0.02 -0.57 -2.15 113.55 111.54 1u15 h SER 42 Ca 0.27 -0.69 0.22 0.00 -0.84 0.00 0.00 61.79 60.74 1u15 h SER 42 Cb 0.15 -0.12 -0.05 0.00 0.14 0.00 0.00 62.40 62.52 1u15 h SER 42 CO -0.03 1.05 0.58 0.40 -1.14 0.00 0.00 176.83 177.69 1u15 h ILE 43 N -0.18 0.64 0.05 3.27 2.04 -0.59 0.15 117.51 122.89 1u15 h ILE 43 Ca -0.04 -0.06 -0.24 0.00 1.00 0.00 0.00 64.86 65.52 1u15 h ILE 43 Cb 1.07 0.43 -0.02 0.00 -0.74 0.00 0.00 36.82 37.56 1u15 h ILE 43 CO 0.08 0.03 -1.15 0.00 0.00 0.00 0.00 178.15 177.11 1u15 h ALA 44 N 1.61 0.27 0.03 1.87 0.00 -1.33 -2.84 119.26 118.87 1u15 h ALA 44 Ca 0.42 -0.93 -0.23 0.00 0.00 0.00 0.00 54.91 54.16 1u15 h ALA 44 Cb 1.35 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.10 1u15 h ALA 44 CO -0.08 1.16 -1.01 -0.92 0.00 0.00 0.00 179.25 178.40 1u15 h TYR 45 N 0.03 0.56 0.91 0.00 3.20 -0.27 -2.37 116.97 119.03 1u15 h TYR 45 Ca -0.08 -0.33 -0.04 0.00 3.14 0.00 0.00 58.73 61.42 1u15 h TYR 45 Cb 1.87 -0.05 0.01 0.00 1.54 0.00 0.00 36.73 40.09 1u15 h TYR 45 CO 0.03 1.17 -0.44 0.00 -1.64 0.00 0.00 178.16 177.28 1u15 h ALA 46 N 0.72 -1.33 -1.02 1.82 0.00 -0.90 1.11 119.26 119.66 1u15 h ALA 46 Ca -0.09 -0.27 0.27 0.00 0.00 0.00 0.00 54.91 54.82 1u15 h ALA 46 Cb 1.66 0.47 -0.12 0.00 0.00 0.00 0.00 17.79 19.80 1u15 h ALA 46 CO 0.17 -1.24 0.62 0.87 0.00 0.00 0.00 179.25 179.67 1u15 h LYS 47 N -1.23 0.47 -0.06 0.00 1.57 -1.56 1.26 116.57 117.03 1u15 h LYS 47 Ca -0.13 -0.03 -0.18 0.00 -1.87 0.00 0.00 60.65 58.45 1u15 h LYS 47 Cb 0.94 -0.11 -0.01 0.00 0.08 0.00 0.00 32.23 33.13 1u15 h LYS 47 CO 0.21 0.31 -0.73 0.00 -0.57 0.00 0.00 179.45 178.67 1u15 h ALA 48 N 1.72 0.64 -0.76 3.86 0.00 -0.92 -3.06 119.26 120.75 1u15 h ALA 48 Ca 0.66 -0.61 -0.05 0.00 0.00 0.00 0.00 54.91 54.90 1u15 h ALA 48 Cb 1.41 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 19.10 1u15 h ALA 48 CO -0.46 0.78 0.28 -0.07 0.00 0.00 0.00 179.25 179.78 1u15 h LEU 49 N 0.22 1.06 0.15 0.00 3.38 1.03 -2.16 115.31 119.00 1u15 h LEU 49 Ca -0.03 -0.18 -0.01 0.00 0.09 0.00 0.00 57.88 57.76 1u15 h LEU 49 Cb 1.30 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 41.77 1u15 h LEU 49 CO 0.12 0.96 -0.08 -0.08 0.09 0.00 0.00 178.44 179.45 1u15 h GLU 50 N 1.11 -0.20 -0.89 1.13 4.22 -0.48 -2.60 114.58 116.86 1u15 h GLU 50 Ca 0.25 0.01 0.11 0.00 0.08 0.00 0.00 59.36 59.82 1u15 h GLU 50 Cb 0.25 0.05 -0.08 0.00 0.50 0.00 0.00 28.75 29.46 1u15 h GLU 50 CO -0.02 -0.14 0.52 -0.22 -2.18 0.00 0.00 179.01 176.98 1u15 h LYS 51 N -0.21 0.81 0.00 1.92 3.64 -1.41 0.54 116.57 121.85 1u15 h LYS 51 Ca -0.02 -0.05 -0.01 0.00 -1.27 0.00 0.00 60.65 59.30 1u15 h LYS 51 Cb 0.17 -0.18 -0.00 0.00 -0.41 0.00 0.00 32.23 31.80 1u15 h LYS 51 CO 0.03 0.54 -0.06 0.00 -2.27 0.00 0.00 179.45 177.69 1u15 h ALA 52 N 1.50 1.64 0.00 5.00 0.00 -1.03 -3.46 119.26 122.90 1u15 h ALA 52 Ca 0.44 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.30 1u15 h ALA 52 Cb 0.45 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.23 1u15 h ALA 52 CO -0.27 0.07 0.00 0.41 0.00 0.00 0.00 179.25 179.46 1u15 n GLY 53 N -1.21 2.49 0.32 0.00 0.00 0.18 -4.96 105.19 102.02 1u15 n GLY 53 Ca -0.03 0.00 0.17 0.00 0.00 0.00 0.00 46.02 46.16 1u15 n GLY 53 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1u15 h ILE 54 N 0.00 0.48 -2.97 -0.61 1.08 -1.70 -3.43 117.51 110.36 1u15 h ILE 54 Ca 0.00 0.00 -0.55 0.00 -0.39 0.00 0.00 64.86 63.92 1u15 h ILE 54 Cb 0.00 0.88 -0.17 0.00 -3.07 0.00 0.00 36.82 34.47 1u15 h ILE 54 CO 0.00 0.00 -0.78 -0.76 -0.69 0.00 0.00 178.15 175.92 1u15 s LEU 55 N -7.61 2.49 0.23 1.44 1.43 -1.21 -4.97 118.68 110.48 1u15 s LEU 55 Ca -0.05 -0.93 0.05 0.00 -1.03 0.00 0.00 54.13 52.18 1u15 s LEU 55 Cb 0.15 -0.92 -0.03 0.00 0.03 0.00 0.00 46.19 45.42 1u15 s LEU 55 CO 0.54 -0.01 0.33 0.42 0.23 0.00 0.00 176.35 177.86 1u15 s THR 56 N -2.24 5.14 0.54 5.49 -4.23 -1.26 -4.62 115.64 114.45 1u15 s THR 56 Ca 0.21 -1.03 0.20 0.00 -1.18 0.00 0.00 61.69 59.90 1u15 s THR 56 Cb -0.05 -3.78 0.31 0.00 1.34 0.00 0.00 72.50 70.33 1u15 s THR 56 CO 0.09 -0.31 2.13 0.11 -0.54 0.00 0.00 174.62 176.10 1u15 h LYS 57 N 1.32 0.00 0.10 3.99 1.57 -1.99 0.38 116.57 121.93 1u15 h LYS 57 Ca -0.51 0.00 -0.26 0.00 -1.87 0.00 0.00 60.65 58.01 1u15 h LYS 57 Cb 1.23 0.00 0.03 0.00 0.08 0.00 0.00 32.23 33.56 1u15 h LYS 57 CO 0.62 0.00 -1.07 1.15 -0.57 0.00 0.00 179.45 179.57 1u15 h THR 58 N 0.00 1.34 -0.14 -0.16 2.02 -2.00 -2.82 112.91 111.15 1u15 h THR 58 Ca 0.06 -2.39 -0.00 0.00 0.77 0.00 0.00 66.41 64.84 1u15 h THR 58 Cb 0.24 2.73 -0.01 0.00 -1.74 0.00 0.00 68.15 69.38 1u15 h THR 58 CO -0.00 0.72 0.08 -0.33 0.37 0.00 0.00 175.52 176.36 1u15 h GLU 59 N 0.13 0.20 -0.06 6.66 5.08 -1.61 -1.52 114.58 123.46 1u15 h GLU 59 Ca -0.16 -0.02 0.04 0.00 -1.00 0.00 0.00 59.36 58.21 1u15 h GLU 59 Cb 1.77 -0.04 -0.05 0.00 0.50 0.00 0.00 28.75 30.93 1u15 h GLU 59 CO 0.21 0.20 -0.27 1.25 -1.00 0.00 0.00 179.01 179.40 1u15 h LEU 60 N 0.14 -0.81 -0.85 1.33 5.85 -0.37 0.11 115.31 120.71 1u15 h LEU 60 Ca 0.05 0.12 0.12 0.00 0.84 0.00 0.00 57.88 59.01 1u15 h LEU 60 Cb 0.06 0.34 -0.08 0.00 0.37 0.00 0.00 40.66 41.35 1u15 h LEU 60 CO -0.01 -0.33 0.47 -0.33 -0.34 0.00 0.00 178.44 177.91 1u15 h GLU 61 N -0.38 0.72 0.47 1.25 5.08 -1.36 0.38 114.58 120.74 1u15 h GLU 61 Ca 0.08 -0.04 -0.02 0.00 -1.00 0.00 0.00 59.36 58.37 1u15 h GLU 61 Cb 0.49 -0.16 0.00 0.00 0.50 0.00 0.00 28.75 29.59 1u15 h GLU 61 CO -0.27 0.48 -0.22 -0.22 -1.00 0.00 0.00 179.01 177.77 1u15 h LYS 62 N 0.74 -0.61 -0.10 2.33 3.64 -0.13 -1.03 116.57 121.42 1u15 h LYS 62 Ca 0.43 0.04 0.04 0.00 -1.27 0.00 0.00 60.65 59.89 1u15 h LYS 62 Cb 0.49 0.14 -0.04 0.00 -0.41 0.00 0.00 32.23 32.41 1u15 h LYS 62 CO -0.29 -0.38 -0.14 0.82 -2.27 0.00 0.00 179.45 177.18 1u15 h ILE 63 N -0.67 0.63 -0.46 2.00 2.04 -0.22 -1.76 117.51 119.06 1u15 h ILE 63 Ca -0.06 0.00 0.07 0.00 1.00 0.00 0.00 64.86 65.86 1u15 h ILE 63 Cb 0.50 0.63 -0.03 0.00 -0.74 0.00 0.00 36.82 37.18 1u15 h ILE 63 CO 0.11 0.00 0.31 -0.07 0.00 0.00 0.00 178.15 178.50 1u15 h LEU 64 N -0.19 0.30 -0.74 1.44 3.38 -0.89 -0.65 115.31 117.95 1u15 h LEU 64 Ca 0.08 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.02 1u15 h LEU 64 Cb 0.30 -0.06 -0.03 0.00 0.09 0.00 0.00 40.66 40.96 1u15 h LEU 64 CO -0.21 0.19 0.35 0.28 0.09 0.00 0.00 178.44 179.14 1u15 h SER 65 N 0.34 0.97 0.65 -0.43 0.02 -0.28 -0.65 113.55 114.17 1u15 h SER 65 Ca 0.21 -0.14 -0.03 0.00 -0.84 0.00 0.00 61.79 60.99 1u15 h SER 65 Cb 0.38 -0.25 0.01 0.00 0.14 0.00 0.00 62.40 62.68 1u15 h SER 65 CO -0.05 0.84 -0.31 1.23 -1.14 0.00 0.00 176.83 177.40 1u15 h GLY 66 N 1.04 -0.91 -0.30 -3.77 0.00 -0.83 -2.93 103.07 95.37 1u15 h GLY 66 Ca 0.25 0.34 0.07 0.00 0.00 0.00 0.00 47.33 47.99 1u15 h GLY 66 CO -0.03 -0.33 -0.44 1.41 0.00 0.00 0.00 176.54 177.15 1u15 h LEU 67 N -1.17 -1.45 -0.58 3.11 3.38 -1.36 0.62 115.31 117.86 1u15 h LEU 67 Ca -0.09 0.22 0.00 0.00 0.09 0.00 0.00 57.88 58.10 1u15 h LEU 67 Cb 0.70 0.63 0.00 0.00 0.09 0.00 0.00 40.66 42.08 1u15 h LEU 67 CO 0.15 -0.37 0.23 1.21 0.09 0.00 0.00 178.44 179.75 1u15 n GLU 68 N -5.41 0.06 -0.10 1.13 4.07 -0.26 -0.31 120.64 119.82 1u15 n GLU 68 Ca -0.01 0.48 -0.23 0.00 -0.06 0.00 0.00 57.16 57.35 1u15 n GLU 68 Cb 0.35 -1.93 -0.12 0.00 -0.06 0.00 0.00 31.44 29.69 1u15 n GLU 68 CO 0.00 0.00 0.00 1.17 -0.06 0.00 0.00 177.13 178.24 1u15 n LYS 69 N -1.79 0.64 -0.30 5.31 4.81 0.19 -4.05 118.16 122.97 1u15 n LYS 69 Ca -0.01 0.26 -0.01 0.00 -0.87 0.00 0.00 58.31 57.68 1u15 n LYS 69 Cb 0.24 -1.58 0.12 0.00 0.02 0.00 0.00 35.03 33.84 1u15 n LYS 69 CO 0.00 0.00 0.00 0.82 1.17 0.00 0.00 177.40 179.39 1u15 h ILE 70 N -0.42 1.09 -0.79 3.15 2.04 0.17 -0.63 117.51 122.12 1u15 h ILE 70 Ca -0.56 -0.34 0.10 0.00 1.00 0.00 0.00 64.86 65.05 1u15 h ILE 70 Cb 1.76 0.01 -0.05 0.00 -0.74 0.00 0.00 36.82 37.80 1u15 h ILE 70 CO -0.18 0.18 0.51 -1.28 0.00 0.00 0.00 178.15 177.39 1u15 h SER 71 N 1.00 0.65 -0.12 1.72 0.87 -0.91 -2.55 113.55 114.20 1u15 h SER 71 Ca 0.34 0.02 -0.11 0.00 -1.23 0.00 0.00 61.79 60.81 1u15 h SER 71 Cb 0.07 -0.12 0.00 0.00 -0.44 0.00 0.00 62.40 61.92 1u15 h SER 71 CO -0.14 0.39 -0.34 -0.33 -0.53 0.00 0.00 176.83 175.87 1u15 h GLU 72 N 0.72 0.44 -0.11 2.24 4.39 -1.28 -2.56 114.58 118.41 1u15 h GLU 72 Ca 0.36 -0.32 0.03 0.00 0.34 0.00 0.00 59.36 59.78 1u15 h GLU 72 Cb 0.45 0.05 -0.00 0.00 -0.10 0.00 0.00 28.75 29.15 1u15 h GLU 72 CO -0.14 0.94 0.22 0.93 -1.16 0.00 0.00 179.01 179.80 1u15 h GLU 73 N 0.03 0.00 0.06 2.33 5.08 -0.96 -1.12 114.58 119.99 1u15 h GLU 73 Ca -0.01 0.00 -0.28 0.00 -1.00 0.00 0.00 59.36 58.07 1u15 h GLU 73 Cb 0.96 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 30.19 1u15 h GLU 73 CO 0.07 0.00 -1.53 -1.49 -1.00 0.00 0.00 179.01 175.06 1u15 h TRP 74 N 0.00 0.21 0.00 4.33 4.06 -1.52 2.06 115.95 125.09 1u15 h TRP 74 Ca 0.05 -0.16 0.00 0.00 2.06 0.00 0.00 58.89 60.85 1u15 h TRP 74 Cb 0.49 -0.01 0.00 0.00 -1.00 0.00 0.00 29.16 28.64 1u15 h TRP 74 CO 0.00 1.60 0.00 -1.13 -3.56 0.00 0.00 178.44 175.35 1u15 n SER 75 N -4.05 1.31 0.00 -3.49 3.41 -0.50 -1.20 113.62 109.11 1u15 n SER 75 Ca -0.31 -1.51 0.00 0.00 -0.26 0.00 0.00 58.87 56.78 1u15 n SER 75 Cb 0.83 -0.38 0.00 0.00 -0.26 0.00 0.00 64.21 64.40 1u15 n SER 75 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1u15 n LYS 76 N 0.31 0.00 -0.91 4.33 5.02 -0.77 -4.99 118.16 121.14 1u15 n LYS 76 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 1u15 n LYS 76 Cb 0.26 -0.24 0.00 0.00 -0.02 0.00 0.00 35.03 35.03 1u15 n LYS 76 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1u15 n GLY 77 N 0.00 0.53 0.15 0.72 0.00 -0.34 -4.90 105.19 101.35 1u15 n GLY 77 Ca 0.00 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.07 1u15 n GLY 77 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1u15 h VAL 78 N 0.00 0.55 -0.53 1.61 2.07 -0.59 -3.45 116.25 115.91 1u15 h VAL 78 Ca 0.00 -1.81 -0.41 0.00 0.82 0.00 0.00 66.70 65.30 1u15 h VAL 78 Cb 0.14 2.21 -0.05 0.00 -1.52 0.00 0.00 31.29 32.07 1u15 h VAL 78 CO 0.00 0.32 1.56 0.33 0.02 0.00 0.00 177.57 179.80 1u15 n PHE 79 N -3.12 0.81 -2.13 1.57 7.35 0.66 -4.84 117.46 117.75 1u15 n PHE 79 Ca 0.01 0.19 -0.41 0.00 -0.76 0.00 0.00 57.45 56.48 1u15 n PHE 79 Cb 0.68 -2.19 -0.03 0.00 0.35 0.00 0.00 39.48 38.30 1u15 n PHE 79 CO 0.00 0.00 0.00 0.08 -0.76 0.00 0.00 176.76 176.08 1u15 s VAL 80 N 9.26 2.92 0.73 -2.13 1.01 -1.26 -4.97 120.40 125.97 1u15 s VAL 80 Ca 1.19 0.80 -0.00 0.00 0.00 0.00 0.00 61.98 63.97 1u15 s VAL 80 Cb -0.73 -3.51 0.14 0.00 0.00 0.00 0.00 36.38 32.28 1u15 s VAL 80 CO 0.38 0.14 1.01 -0.69 0.00 0.00 0.00 175.10 175.94 1u15 s VAL 81 N -0.25 2.06 -0.20 2.92 1.01 -1.26 -5.07 120.40 119.61 1u15 s VAL 81 Ca 0.55 -0.62 -0.13 0.00 0.00 0.00 0.00 61.98 61.78 1u15 s VAL 81 Cb -0.39 -2.43 0.06 0.00 0.00 0.00 0.00 36.38 33.62 1u15 s VAL 81 CO 0.43 0.00 0.49 -0.54 0.00 0.00 0.00 175.10 175.49 1u15 s LYS 82 N -5.15 0.51 0.00 2.72 -0.14 -1.26 -5.01 119.74 111.41 1u15 s LYS 82 Ca 0.67 0.86 0.00 0.00 -1.36 0.00 0.00 55.97 56.14 1u15 s LYS 82 Cb -0.04 0.09 0.00 0.00 -1.68 0.00 0.00 37.83 36.20 1u15 s LYS 82 CO 0.45 -0.13 0.80 1.04 -0.76 0.00 0.00 175.35 176.75 1u15 n GLN 83 N 3.88 0.54 0.00 1.68 1.13 -1.26 0.11 117.38 123.46 1u15 n GLN 83 Ca -0.20 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 54.86 1u15 n GLN 83 Cb 0.56 -1.23 0.00 0.00 0.11 0.00 0.00 30.24 29.68 1u15 n GLN 83 CO 0.00 0.00 0.00 0.43 -1.44 0.00 0.00 177.06 176.05 1u15 n SER 84 N 1.22 3.24 -4.57 1.08 7.64 -1.26 -4.98 113.62 115.99 1u15 n SER 84 Ca 0.00 0.00 -0.41 0.00 1.01 0.00 0.00 58.87 59.47 1u15 n SER 84 Cb 0.27 0.37 -0.03 0.00 -1.01 0.00 0.00 64.21 63.82 1u15 n SER 84 CO 0.00 0.00 0.00 -1.81 -3.01 0.00 0.00 175.04 170.22 1u15 s ASP 85 N -2.14 6.08 -0.05 6.43 1.01 0.31 -4.89 116.67 123.42 1u15 s ASP 85 Ca 0.00 0.20 -0.23 0.00 0.71 0.00 0.00 52.55 53.22 1u15 s ASP 85 Cb 0.00 -2.55 -0.18 0.00 1.01 0.00 0.00 42.92 41.21 1u15 s ASP 85 CO 0.00 -1.76 0.99 -0.33 0.21 0.00 0.00 175.17 174.28 1u15 h GLU 86 N 11.15 -0.15 -6.05 8.23 3.07 -1.93 -3.44 114.58 125.45 1u15 h GLU 86 Ca -0.27 0.01 -0.58 0.00 -0.50 0.00 0.00 59.36 58.02 1u15 h GLU 86 Cb 1.09 0.03 -0.14 0.00 -0.84 0.00 0.00 28.75 28.90 1u15 h GLU 86 CO 1.19 0.33 -0.74 0.16 -1.40 0.00 0.00 179.01 178.55 1u15 s ASP 87 N -5.56 3.44 0.49 1.42 -4.77 -1.26 -0.92 116.67 109.51 1u15 s ASP 87 Ca -0.14 -1.06 0.26 0.00 -3.30 0.00 0.00 52.55 48.31 1u15 s ASP 87 Cb 0.01 -0.28 1.33 0.00 -1.09 0.00 0.00 42.92 42.89 1u15 s ASP 87 CO 0.55 -0.04 1.87 -0.29 0.70 0.00 0.00 175.17 177.96 1u15 h ILE 88 N 2.27 0.59 0.24 2.11 6.09 -1.87 -0.82 117.51 126.13 1u15 h ILE 88 Ca -0.40 -0.05 -0.01 0.00 -1.37 0.00 0.00 64.86 63.03 1u15 h ILE 88 Cb 1.25 0.43 0.00 0.00 0.47 0.00 0.00 36.82 38.97 1u15 h ILE 88 CO 0.62 0.03 -0.12 0.45 -3.07 0.00 0.00 178.15 176.06 1u15 h HIS 89 N 0.15 -0.30 -0.91 2.19 3.86 -1.96 -0.06 115.15 118.12 1u15 h HIS 89 Ca 0.45 -0.01 0.15 0.00 -1.16 0.00 0.00 60.37 59.80 1u15 h HIS 89 Cb 1.52 0.10 -0.07 0.00 1.06 0.00 0.00 27.41 30.01 1u15 h HIS 89 CO -0.00 0.07 0.58 1.15 0.86 0.00 0.00 177.93 180.59 1u15 h THR 90 N -0.78 0.82 0.16 2.45 2.02 -1.75 0.15 112.91 115.98 1u15 h THR 90 Ca -0.03 -0.24 -0.01 0.00 0.77 0.00 0.00 66.41 66.90 1u15 h THR 90 Cb 0.51 0.06 0.00 0.00 -1.74 0.00 0.00 68.15 66.98 1u15 h THR 90 CO 0.05 0.13 -0.08 0.00 0.37 0.00 0.00 175.52 175.99 1u15 h ALA 91 N 1.60 -0.22 -0.72 6.16 0.00 -1.04 -1.53 119.26 123.51 1u15 h ALA 91 Ca 0.46 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 55.23 1u15 h ALA 91 Cb 0.74 0.08 -0.04 0.00 0.00 0.00 0.00 17.79 18.58 1u15 h ALA 91 CO -0.22 -0.51 0.42 -0.91 0.00 0.00 0.00 179.25 178.02 1u15 h ASN 92 N -0.43 0.88 0.10 0.00 2.35 0.32 -2.60 115.58 116.20 1u15 h ASN 92 Ca -0.02 -0.06 -0.01 0.00 -0.55 0.00 0.00 56.30 55.67 1u15 h ASN 92 Cb 0.34 -0.22 0.00 0.00 0.05 0.00 0.00 38.32 38.49 1u15 h ASN 92 CO 0.04 0.69 -0.05 -0.33 -1.65 0.00 0.00 177.43 176.12 1u15 h GLU 93 N 1.00 -0.13 -0.71 0.81 5.08 -0.69 -2.74 114.58 117.19 1u15 h GLU 93 Ca 0.26 0.01 0.13 0.00 -1.00 0.00 0.00 59.36 58.76 1u15 h GLU 93 Cb -0.01 0.03 -0.13 0.00 0.50 0.00 0.00 28.75 29.13 1u15 h GLU 93 CO -0.05 0.16 -0.27 -0.09 -1.00 0.00 0.00 179.01 177.76 1u15 h ARG 94 N -0.43 -0.07 0.00 2.33 2.43 -1.07 0.31 114.38 117.88 1u15 h ARG 94 Ca -0.01 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.16 1u15 h ARG 94 Cb 0.36 0.02 0.00 0.00 -0.42 0.00 0.00 29.97 29.92 1u15 h ARG 94 CO 0.02 -0.05 0.00 -0.09 -1.51 0.00 0.00 179.97 178.35 1u15 h ARG 95 N -0.07 0.00 0.18 0.20 9.65 -1.44 -2.33 114.38 120.57 1u15 h ARG 95 Ca 0.31 0.00 -0.24 0.00 -1.10 0.00 0.00 59.98 58.94 1u15 h ARG 95 Cb 0.56 0.00 0.02 0.00 -1.39 0.00 0.00 29.97 29.16 1u15 h ARG 95 CO -0.76 0.00 -1.10 1.25 2.80 0.00 0.00 179.97 182.16 1u15 h LEU 96 N 0.00 0.58 -0.63 3.80 5.85 -0.12 -2.86 115.31 121.92 1u15 h LEU 96 Ca 0.00 -0.94 0.04 0.00 0.84 0.00 0.00 57.88 57.82 1u15 h LEU 96 Cb 0.36 -0.19 -0.05 0.00 0.37 0.00 0.00 40.66 41.15 1u15 h LEU 96 CO 0.00 1.52 0.37 0.50 -0.34 0.00 0.00 178.44 180.50 1u15 h LYS 97 N -0.20 0.70 0.00 1.25 3.64 -0.94 -0.13 116.57 120.88 1u15 h LYS 97 Ca -0.20 -0.04 -0.07 0.00 -1.27 0.00 0.00 60.65 59.07 1u15 h LYS 97 Cb 1.83 -0.16 -0.01 0.00 -0.41 0.00 0.00 32.23 33.48 1u15 h LYS 97 CO 0.18 0.46 -0.31 0.93 -2.27 0.00 0.00 179.45 178.44 1u15 h GLU 98 N 0.72 0.00 0.05 1.90 5.08 -1.50 0.18 114.58 121.00 1u15 h GLU 98 Ca 0.27 0.00 -0.27 0.00 -1.00 0.00 0.00 59.36 58.36 1u15 h GLU 98 Cb 0.08 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.31 1u15 h GLU 98 CO -0.13 0.31 -1.39 -0.07 -1.00 0.00 0.00 179.01 176.73 1u15 h LEU 99 N 0.00 0.16 -0.08 1.33 3.38 -1.02 -3.42 115.31 115.66 1u15 h LEU 99 Ca -0.00 -0.23 0.00 0.00 0.09 0.00 0.00 57.88 57.74 1u15 h LEU 99 Cb 0.61 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.31 1u15 h LEU 99 CO 0.04 1.19 0.00 2.30 0.09 0.00 0.00 178.44 182.06 1u15 n ILE 100 N -3.32 0.00 -0.48 1.22 -5.35 -0.17 -5.00 119.36 106.26 1u15 n ILE 100 Ca -0.11 -0.27 0.00 0.00 -0.27 0.00 0.00 62.75 62.11 1u15 n ILE 100 Cb 1.01 1.07 0.00 0.00 -1.74 0.00 0.00 39.64 39.98 1u15 n ILE 100 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1u15 n GLY 101 N 0.46 -1.82 0.00 3.28 0.00 0.62 -4.43 105.19 103.31 1u15 n GLY 101 Ca 0.00 -1.95 0.03 0.00 0.00 0.00 0.00 46.02 44.11 1u15 n GLY 101 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1u15 n ASP 102 N 0.04 0.00 0.17 1.61 8.00 -1.26 -2.08 116.55 123.03 1u15 n ASP 102 Ca 0.00 0.18 0.03 0.00 0.71 0.00 0.00 54.79 55.71 1u15 n ASP 102 Cb 0.00 -0.28 0.30 0.00 -0.02 0.00 0.00 41.12 41.12 1u15 n ASP 102 CO 0.00 0.00 0.00 -0.29 -0.39 0.00 0.00 177.20 176.52 1u15 h ILE 103 N 0.00 1.13 -0.40 0.53 6.09 -1.95 -3.12 117.51 119.79 1u15 h ILE 103 Ca 0.00 -1.65 0.08 0.00 -1.37 0.00 0.00 64.86 61.91 1u15 h ILE 103 Cb 0.06 1.94 -0.07 0.00 0.47 0.00 0.00 36.82 39.22 1u15 h ILE 103 CO 0.00 0.44 -0.04 0.00 -3.07 0.00 0.00 178.15 175.48 1u15 h ALA 104 N 1.55 0.33 -0.84 0.18 0.00 -1.72 -2.39 119.26 116.37 1u15 h ALA 104 Ca -0.00 0.13 0.21 0.00 0.00 0.00 0.00 54.91 55.25 1u15 h ALA 104 Cb 0.91 0.24 -0.16 0.00 0.00 0.00 0.00 17.79 18.78 1u15 h ALA 104 CO 0.06 -0.42 -0.06 0.41 0.00 0.00 0.00 179.25 179.24 1u15 n GLY 105 N -1.29 -1.24 0.39 0.00 0.00 -1.18 0.11 105.19 101.98 1u15 n GLY 105 Ca 0.03 0.85 0.20 0.00 0.00 0.00 0.00 46.02 47.10 1u15 n GLY 105 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1u15 h LYS 106 N 0.00 0.00 0.00 1.61 1.57 -1.62 0.13 116.57 118.26 1u15 h LYS 106 Ca 0.47 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 59.25 1u15 h LYS 106 Cb 0.90 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.21 1u15 h LYS 106 CO -0.82 0.00 -0.00 1.25 -0.57 0.00 0.00 179.45 179.31 1u15 h LEU 107 N 0.00 0.00 -1.85 2.94 5.85 0.65 -1.96 115.31 120.93 1u15 h LEU 107 Ca 0.19 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.91 1u15 h LEU 107 Cb 1.12 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.15 1u15 h LEU 107 CO -0.00 0.00 0.00 1.57 -0.34 0.00 0.00 178.44 179.67 1u15 n HIS 108 N -3.09 0.42 -1.68 1.25 -0.00 0.45 -4.84 115.22 107.74 1u15 n HIS 108 Ca -0.02 -0.21 -0.46 0.00 0.46 0.00 0.00 57.72 57.49 1u15 n HIS 108 Cb 0.14 0.00 -0.04 0.00 -0.12 0.00 0.00 29.99 29.96 1u15 n HIS 108 CO 0.00 0.00 0.00 2.41 0.46 0.00 0.00 176.34 179.21 1u15 n THR 109 N 1.03 0.60 -0.16 3.57 -1.04 -0.74 -1.84 114.28 115.70 1u15 n THR 109 Ca 0.18 -0.11 0.00 0.00 -2.04 0.00 0.00 64.05 62.08 1u15 n THR 109 Cb 0.49 -1.99 0.00 0.00 -1.82 0.00 0.00 70.33 67.01 1u15 n THR 109 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1u15 n GLY 110 N 4.40 1.34 3.83 3.41 0.00 -1.26 -4.97 105.19 111.94 1u15 n GLY 110 Ca 0.22 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.88 1u15 n GLY 110 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1u15 s ARG 111 N -0.10 4.14 -0.08 1.61 3.52 -0.77 -4.65 118.95 122.63 1u15 s ARG 111 Ca 0.00 0.72 0.04 0.00 -0.13 0.00 0.00 55.73 56.36 1u15 s ARG 111 Cb 0.00 -2.87 -0.00 0.00 -1.56 0.00 0.00 34.95 30.52 1u15 s ARG 111 CO 0.00 0.41 -0.21 0.45 -0.81 0.00 0.00 175.30 175.14 1u15 s SER 112 N -1.71 2.71 0.60 -2.12 0.15 -1.26 -4.98 113.70 107.09 1u15 s SER 112 Ca 0.42 -0.47 0.34 0.00 0.70 0.00 0.00 55.95 56.93 1u15 s SER 112 Cb -0.16 -1.05 1.83 0.00 -1.71 0.00 0.00 66.02 64.94 1u15 s SER 112 CO 0.20 0.16 2.02 -0.09 1.20 0.00 0.00 173.24 176.73 1u15 h ARG 113 N 6.53 0.00 -0.44 5.44 2.43 -1.98 0.24 114.38 126.60 1u15 h ARG 113 Ca -0.26 0.00 -0.08 0.00 -0.81 0.00 0.00 59.98 58.83 1u15 h ARG 113 Cb 1.21 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 30.74 1u15 h ARG 113 CO 0.47 0.00 -0.05 -0.91 -1.51 0.00 0.00 179.97 177.97 1u15 h ASN 114 N 0.00 0.73 1.24 -3.80 -0.26 -1.94 -2.48 115.58 109.07 1u15 h ASN 114 Ca 0.00 -0.19 -0.11 0.00 -0.56 0.00 0.00 56.30 55.44 1u15 h ASN 114 Cb 0.33 -0.19 -0.02 0.00 -1.06 0.00 0.00 38.32 37.37 1u15 h ASN 114 CO 0.00 0.83 -0.79 1.05 -1.06 0.00 0.00 177.43 177.46 1u15 h GLU 115 N 0.69 0.00 -0.35 0.81 4.11 -0.67 -3.29 114.58 115.89 1u15 h GLU 115 Ca 0.13 0.00 -0.06 0.00 0.07 0.00 0.00 59.36 59.50 1u15 h GLU 115 Cb 0.50 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.74 1u15 h GLU 115 CO 0.03 0.36 -0.02 1.96 0.07 0.00 0.00 179.01 181.41 1u15 h GLN 116 N 0.00 0.63 -0.68 1.06 4.20 -1.21 -1.24 115.11 117.86 1u15 h GLN 116 Ca -0.05 -0.21 -0.05 0.00 0.06 0.00 0.00 58.65 58.40 1u15 h GLN 116 Cb 1.39 -0.05 -0.03 0.00 0.30 0.00 0.00 27.48 29.09 1u15 h GLN 116 CO 0.05 0.76 0.23 -0.39 -0.67 0.00 0.00 178.83 178.81 1u15 h VAL 117 N 0.43 1.24 -0.08 -0.54 -1.51 -1.55 0.38 116.25 114.63 1u15 h VAL 117 Ca 0.10 -0.82 -0.23 0.00 -1.23 0.00 0.00 66.70 64.52 1u15 h VAL 117 Cb 0.49 0.47 0.01 0.00 -2.13 0.00 0.00 31.29 30.13 1u15 h VAL 117 CO 0.02 0.32 -0.87 -0.37 -1.23 0.00 0.00 177.57 175.45 1u15 h VAL 118 N 1.00 1.30 -0.29 7.19 -1.51 -1.61 -1.86 116.25 120.47 1u15 h VAL 118 Ca 0.23 -2.12 0.00 0.00 -1.23 0.00 0.00 66.70 63.57 1u15 h VAL 118 Cb 0.25 2.16 -0.01 0.00 -2.13 0.00 0.00 31.29 31.55 1u15 h VAL 118 CO -0.01 0.66 0.19 0.74 -1.23 0.00 0.00 177.57 177.91 1u15 h THR 119 N 0.44 1.08 -0.46 7.19 2.02 -0.95 -1.37 112.91 120.85 1u15 h THR 119 Ca -0.08 -0.17 -0.10 0.00 0.77 0.00 0.00 66.41 66.83 1u15 h THR 119 Cb 1.50 0.68 -0.01 0.00 -1.74 0.00 0.00 68.15 68.57 1u15 h THR 119 CO 0.17 0.08 -0.12 0.44 0.37 0.00 0.00 175.52 176.46 1u15 h ASP 120 N 0.39 0.90 -0.09 4.18 5.19 -0.96 -2.38 116.42 123.64 1u15 h ASP 120 Ca 0.11 -0.37 -0.01 0.00 -0.62 0.00 0.00 57.03 56.14 1u15 h ASP 120 Cb -0.03 -0.25 -0.00 0.00 0.18 0.00 0.00 39.33 39.23 1u15 h ASP 120 CO -0.02 1.06 0.02 0.25 -3.12 0.00 0.00 179.24 177.43 1u15 h LEU 121 N 0.73 0.13 -0.75 1.55 5.85 -1.14 -1.46 115.31 120.22 1u15 h LEU 121 Ca 0.11 -0.23 0.03 0.00 0.84 0.00 0.00 57.88 58.63 1u15 h LEU 121 Cb 0.67 -0.04 -0.04 0.00 0.37 0.00 0.00 40.66 41.62 1u15 h LEU 121 CO 0.05 0.33 0.48 0.11 -0.34 0.00 0.00 178.44 179.07 1u15 h LYS 122 N -0.06 0.92 -0.75 1.25 1.57 -1.25 0.32 116.57 118.56 1u15 h LYS 122 Ca 0.03 -0.06 -0.01 0.00 -1.87 0.00 0.00 60.65 58.74 1u15 h LYS 122 Cb 0.24 -0.21 -0.04 0.00 0.08 0.00 0.00 32.23 32.31 1u15 h LYS 122 CO 0.00 0.61 0.41 -0.07 -0.57 0.00 0.00 179.45 179.83 1u15 h LEU 123 N 0.95 0.93 -1.03 2.94 3.38 -1.32 0.39 115.31 121.56 1u15 h LEU 123 Ca 0.30 -0.09 -0.09 0.00 0.09 0.00 0.00 57.88 58.08 1u15 h LEU 123 Cb -0.01 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.49 1u15 h LEU 123 CO -0.10 0.76 -0.27 0.15 0.09 0.00 0.00 178.44 179.07 1u15 h PHE 124 N 1.03 0.41 -0.03 1.13 3.57 -0.71 -1.87 116.94 120.47 1u15 h PHE 124 Ca 0.26 -0.09 -0.21 0.00 3.53 0.00 0.00 57.97 61.47 1u15 h PHE 124 Cb 0.03 -0.10 -0.00 0.00 2.79 0.00 0.00 35.95 38.67 1u15 h PHE 124 CO -0.00 0.61 -0.86 0.52 -2.23 0.00 0.00 178.31 176.35 1u15 h MET 125 N 0.33 0.40 -0.44 1.11 2.86 0.04 -0.76 114.93 118.47 1u15 h MET 125 Ca 0.05 -0.39 -0.02 0.00 -2.06 0.00 0.00 59.70 57.28 1u15 h MET 125 Cb 0.65 0.10 -0.02 0.00 0.06 0.00 0.00 31.60 32.39 1u15 h MET 125 CO 0.05 1.05 0.19 -0.22 1.06 0.00 0.00 176.91 179.03 1u15 h LYS 126 N 0.25 0.65 0.07 1.72 3.64 0.00 0.20 116.57 123.10 1u15 h LYS 126 Ca -0.06 -0.11 -0.00 0.00 -1.27 0.00 0.00 60.65 59.21 1u15 h LYS 126 Cb 1.47 -0.11 0.00 0.00 -0.41 0.00 0.00 32.23 33.18 1u15 h LYS 126 CO 0.15 0.59 -0.03 -0.91 -2.27 0.00 0.00 179.45 176.98 1u15 h ASN 127 N 0.57 -0.07 -0.58 4.20 -0.26 -1.30 -2.84 115.58 115.29 1u15 h ASN 127 Ca 0.15 -0.25 0.02 0.00 -0.56 0.00 0.00 56.30 55.66 1u15 h ASN 127 Cb 0.17 0.02 -0.04 0.00 -1.06 0.00 0.00 38.32 37.42 1u15 h ASN 127 CO -0.01 0.21 0.36 0.28 -1.06 0.00 0.00 177.43 177.21 1u15 h SER 128 N -0.36 0.60 -0.70 5.81 0.02 -1.02 -2.14 113.55 115.76 1u15 h SER 128 Ca -0.01 -0.00 0.09 0.00 -0.84 0.00 0.00 61.79 61.03 1u15 h SER 128 Cb 0.32 -0.13 -0.04 0.00 0.14 0.00 0.00 62.40 62.68 1u15 h SER 128 CO 0.01 0.42 0.46 -0.07 -1.14 0.00 0.00 176.83 176.51 1u15 h LEU 129 N 0.72 0.54 -0.51 5.07 4.07 -0.57 0.12 115.31 124.75 1u15 h LEU 129 Ca 0.23 0.01 -0.13 0.00 0.08 0.00 0.00 57.88 58.06 1u15 h LEU 129 Cb -0.00 -0.10 -0.01 0.00 1.08 0.00 0.00 40.66 41.62 1u15 h LEU 129 CO -0.09 0.33 -0.24 -1.28 -1.08 0.00 0.00 178.44 176.08 1u15 h SER 130 N 0.60 0.99 -0.08 -0.43 0.87 -1.15 0.11 113.55 114.46 1u15 h SER 130 Ca 0.32 -0.39 -0.04 0.00 -1.23 0.00 0.00 61.79 60.45 1u15 h SER 130 Cb 0.44 -0.27 -0.00 0.00 -0.44 0.00 0.00 62.40 62.13 1u15 h SER 130 CO -0.11 1.18 -0.10 0.40 -0.53 0.00 0.00 176.83 177.67 1u15 h ILE 131 N 0.83 1.38 -0.32 2.23 2.04 -0.89 -2.77 117.51 120.00 1u15 h ILE 131 Ca 0.10 -1.30 0.06 0.00 1.00 0.00 0.00 64.86 64.72 1u15 h ILE 131 Cb 0.82 2.05 -0.05 0.00 -0.74 0.00 0.00 36.82 38.89 1u15 h ILE 131 CO 0.07 0.36 -0.03 0.40 0.00 0.00 0.00 178.15 178.96 1u15 h ILE 132 N -0.22 0.74 -0.66 -0.67 2.04 -0.77 -0.97 117.51 117.00 1u15 h ILE 132 Ca 0.01 -0.02 0.14 0.00 1.00 0.00 0.00 64.86 65.99 1u15 h ILE 132 Cb 0.63 0.67 -0.04 0.00 -0.74 0.00 0.00 36.82 37.35 1u15 h ILE 132 CO 0.02 0.01 0.45 -1.28 0.00 0.00 0.00 178.15 177.36 1u15 h SER 133 N 0.06 0.27 -0.33 1.72 0.87 -0.79 0.88 113.55 116.24 1u15 h SER 133 Ca 0.15 0.01 -0.14 0.00 -1.23 0.00 0.00 61.79 60.58 1u15 h SER 133 Cb 0.22 -0.04 -0.00 0.00 -0.44 0.00 0.00 62.40 62.13 1u15 h SER 133 CO -0.28 0.15 -0.36 0.74 -0.53 0.00 0.00 176.83 176.55 1u15 h THR 134 N 0.29 1.29 -0.39 2.23 2.02 -0.89 -2.22 112.91 115.23 1u15 h THR 134 Ca 0.32 -1.54 -0.15 0.00 0.77 0.00 0.00 66.41 65.81 1u15 h THR 134 Cb 0.84 1.51 -0.01 0.00 -1.74 0.00 0.00 68.15 68.75 1u15 h THR 134 CO -0.08 0.50 -0.34 0.45 0.37 0.00 0.00 175.52 176.43 1u15 h HIS 135 N 0.60 1.07 -0.49 3.16 -0.00 -0.68 -1.52 115.15 117.29 1u15 h HIS 135 Ca 0.05 -0.30 0.01 0.00 -0.00 0.00 0.00 60.37 60.13 1u15 h HIS 135 Cb 0.95 -0.23 -0.03 0.00 -0.00 0.00 0.00 27.41 28.10 1u15 h HIS 135 CO 0.07 1.11 0.31 1.25 -0.00 0.00 0.00 177.93 180.67 1u15 h LEU 136 N 0.75 0.52 -0.98 2.43 6.46 -0.82 -0.72 115.31 122.94 1u15 h LEU 136 Ca 0.07 -0.01 -0.10 0.00 -0.12 0.00 0.00 57.88 57.72 1u15 h LEU 136 Cb 0.91 -0.12 -0.01 0.00 -0.73 0.00 0.00 40.66 40.71 1u15 h LEU 136 CO 0.08 0.37 -0.43 -0.07 -0.62 0.00 0.00 178.44 177.77 1u15 h LEU 137 N 0.62 0.16 -0.53 2.25 4.07 -1.30 -1.67 115.31 118.92 1u15 h LEU 137 Ca 0.19 -0.07 -0.07 0.00 0.08 0.00 0.00 57.88 58.01 1u15 h LEU 137 Cb -0.03 -0.05 -0.02 0.00 1.08 0.00 0.00 40.66 41.64 1u15 h LEU 137 CO -0.06 0.58 0.05 -0.61 -1.08 0.00 0.00 178.44 177.32 1u15 h GLN 138 N 0.13 0.90 0.22 1.13 5.75 -0.53 0.84 115.11 123.54 1u15 h GLN 138 Ca 0.01 -0.26 -0.01 0.00 -0.15 0.00 0.00 58.65 58.24 1u15 h GLN 138 Cb 0.82 -0.09 0.00 0.00 1.07 0.00 0.00 27.48 29.28 1u15 h GLN 138 CO 0.06 0.89 -0.11 1.25 -2.65 0.00 0.00 178.83 178.28 1u15 h LEU 139 N 0.77 -0.25 -0.34 -2.39 6.46 -0.76 -0.11 115.31 118.69 1u15 h LEU 139 Ca 0.16 0.01 0.03 0.00 -0.12 0.00 0.00 57.88 57.96 1u15 h LEU 139 Cb 0.46 0.07 -0.03 0.00 -0.73 0.00 0.00 40.66 40.42 1u15 h LEU 139 CO 0.02 -0.18 0.14 0.40 -0.62 0.00 0.00 178.44 178.20 1u15 h ILE 140 N -0.29 0.95 -0.74 4.05 2.04 -1.19 -1.44 117.51 120.88 1u15 h ILE 140 Ca -0.03 -0.10 0.00 0.00 1.00 0.00 0.00 64.86 65.73 1u15 h ILE 140 Cb 0.23 0.62 -0.04 0.00 -0.74 0.00 0.00 36.82 36.89 1u15 h ILE 140 CO 0.05 0.06 0.47 0.50 0.00 0.00 0.00 178.15 179.22 1u15 h LYS 141 N 0.30 0.99 -0.40 2.37 3.64 -0.63 -0.43 116.57 122.42 1u15 h LYS 141 Ca 0.15 -0.07 -0.05 0.00 -1.27 0.00 0.00 60.65 59.40 1u15 h LYS 141 Cb 0.09 -0.22 -0.02 0.00 -0.41 0.00 0.00 32.23 31.67 1u15 h LYS 141 CO -0.12 0.68 0.03 1.15 -2.27 0.00 0.00 179.45 178.91 1u15 h THR 142 N 1.01 1.21 0.16 1.00 2.02 -0.09 -0.44 112.91 117.78 1u15 h THR 142 Ca 0.27 -0.81 -0.31 0.00 0.77 0.00 0.00 66.41 66.33 1u15 h THR 142 Cb -0.08 0.87 0.03 0.00 -1.74 0.00 0.00 68.15 67.24 1u15 h THR 142 CO -0.05 0.29 -1.29 -0.07 0.37 0.00 0.00 175.52 174.76 1u15 h LEU 143 N 0.60 0.87 -0.45 2.58 3.38 -0.41 -2.62 115.31 119.26 1u15 h LEU 143 Ca 0.13 -0.85 -0.14 0.00 0.09 0.00 0.00 57.88 57.11 1u15 h LEU 143 Cb 0.33 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.80 1u15 h LEU 143 CO 0.01 1.64 -0.26 0.58 0.09 0.00 0.00 178.44 180.49 1u15 h VAL 144 N 0.22 1.27 -0.33 1.22 2.07 -1.02 -1.09 116.25 118.59 1u15 h VAL 144 Ca -0.21 -1.43 -0.10 0.00 0.82 0.00 0.00 66.70 65.79 1u15 h VAL 144 Cb 1.98 1.22 -0.01 0.00 -1.52 0.00 0.00 31.29 32.95 1u15 h VAL 144 CO 0.25 0.49 -0.18 -0.33 0.02 0.00 0.00 177.57 177.82 1u15 h GLU 145 N 0.81 0.70 -0.58 1.57 4.39 -1.18 -2.46 114.58 117.83 1u15 h GLU 145 Ca 0.09 -0.32 -0.07 0.00 0.34 0.00 0.00 59.36 59.41 1u15 h GLU 145 Cb 0.85 -0.02 -0.03 0.00 -0.10 0.00 0.00 28.75 29.45 1u15 h GLU 145 CO 0.07 0.92 0.10 -0.09 -1.16 0.00 0.00 179.01 178.85 1u15 h ARG 146 N 0.48 0.93 -0.84 2.33 2.43 -1.44 -2.00 114.38 116.26 1u15 h ARG 146 Ca 0.07 -0.22 0.06 0.00 -0.81 0.00 0.00 59.98 59.08 1u15 h ARG 146 Cb 0.72 -0.12 -0.05 0.00 -0.42 0.00 0.00 29.97 30.09 1u15 h ARG 146 CO 0.05 0.86 0.55 0.00 -1.51 0.00 0.00 179.97 179.92 1u15 h ALA 147 N 1.22 1.57 0.05 2.80 0.00 -1.03 -1.14 119.26 122.73 1u15 h ALA 147 Ca 0.18 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.07 1u15 h ALA 147 Cb 0.38 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.92 1u15 h ALA 147 CO 0.01 0.30 -0.02 0.00 0.00 0.00 0.00 179.25 179.54 1u15 h ALA 148 N 1.54 -0.07 -0.59 0.00 0.00 -0.89 -2.05 119.26 117.20 1u15 h ALA 148 Ca 0.36 -0.15 0.02 0.00 0.00 0.00 0.00 54.91 55.14 1u15 h ALA 148 Cb 0.20 0.03 -0.03 0.00 0.00 0.00 0.00 17.79 17.98 1u15 h ALA 148 CO -0.13 -0.40 0.37 0.82 0.00 0.00 0.00 179.25 179.92 1u15 h ILE 149 N -0.35 1.10 -0.73 0.00 1.08 -1.08 -2.92 117.51 114.60 1u15 h ILE 149 Ca -0.01 -0.26 -0.23 0.00 -0.39 0.00 0.00 64.86 63.98 1u15 h ILE 149 Cb 0.31 0.29 -0.14 0.00 -3.07 0.00 0.00 36.82 34.22 1u15 h ILE 149 CO 0.01 0.14 0.29 -0.62 -0.69 0.00 0.00 178.15 177.28 1u15 n GLU 150 N -4.72 3.54 0.13 2.37 1.02 -0.47 -4.66 120.64 117.87 1u15 n GLU 150 Ca 0.05 -2.93 0.09 0.00 -0.02 0.00 0.00 57.16 54.35 1u15 n GLU 150 Cb 0.06 -2.18 0.47 0.00 -0.02 0.00 0.00 31.44 29.76 1u15 n GLU 150 CO 0.00 0.00 0.00 1.51 1.18 0.00 0.00 177.13 179.82 1u15 n ILE 151 N -0.17 1.16 0.14 -3.67 3.06 -0.77 -2.01 119.36 117.08 1u15 n ILE 151 Ca 0.40 0.70 0.11 0.00 -2.50 0.00 0.00 62.75 61.47 1u15 n ILE 151 Cb 1.37 -1.70 -0.02 0.00 0.54 0.00 0.00 39.64 39.83 1u15 n ILE 151 CO 0.00 0.00 0.00 0.47 -2.50 0.00 0.00 176.55 174.52 1u15 n ASP 152 N -2.10 0.67 -4.72 9.51 10.43 -1.26 -4.82 116.55 124.25 1u15 n ASP 152 Ca -0.01 0.22 -0.42 0.00 2.57 0.00 0.00 54.79 57.15 1u15 n ASP 152 Cb 0.06 0.74 -0.03 0.00 1.84 0.00 0.00 41.12 43.73 1u15 n ASP 152 CO 0.00 0.00 0.00 -0.69 -1.07 0.00 0.00 177.20 175.44 1u15 s VAL 153 N -3.37 2.28 -0.08 2.53 1.01 -0.85 -4.95 120.40 116.97 1u15 s VAL 153 Ca -0.01 0.21 0.04 0.00 0.00 0.00 0.00 61.98 62.21 1u15 s VAL 153 Cb 0.11 -3.13 0.00 0.00 0.00 0.00 0.00 36.38 33.36 1u15 s VAL 153 CO 0.81 0.02 -0.21 -0.63 0.00 0.00 0.00 175.10 175.09 1u15 s ILE 154 N 0.97 1.79 0.28 2.22 1.01 -1.26 -0.93 121.20 125.27 1u15 s ILE 154 Ca 0.71 -0.88 -0.01 0.00 0.00 0.00 0.00 60.65 60.47 1u15 s ILE 154 Cb -0.47 -1.55 -0.02 0.00 0.01 0.00 0.00 42.46 40.43 1u15 s ILE 154 CO 0.34 0.50 0.31 -1.48 0.00 0.00 0.00 174.94 174.62 1u15 s LEU 155 N 0.26 1.12 0.30 2.97 2.34 -0.32 -3.94 118.68 121.41 1u15 s LEU 155 Ca -0.13 -1.43 -0.28 0.00 0.06 0.00 0.00 54.13 52.35 1u15 s LEU 155 Cb -0.16 0.94 -0.09 0.00 -0.56 0.00 0.00 46.19 46.32 1u15 s LEU 155 CO 0.06 -1.07 1.01 -2.16 -1.06 0.00 0.00 176.35 173.14 1u15 s PRO 156 N -3.67 4.62 0.07 1.48 0.04 -1.26 -0.60 135.00 135.67 1u15 s PRO 156 Ca 0.34 1.57 -0.07 0.00 0.04 0.00 0.00 61.00 62.89 1u15 s PRO 156 Cb 0.03 -3.04 -0.05 0.00 0.04 0.00 0.00 34.50 31.48 1u15 s PRO 156 CO 0.18 0.26 0.34 0.20 0.04 0.00 0.00 177.00 178.01 1u15 s GLY 157 N -1.22 2.28 0.06 0.56 0.00 -0.64 -4.81 107.32 103.55 1u15 s GLY 157 Ca 0.47 -0.50 0.07 0.00 0.00 0.00 0.00 44.72 44.76 1u15 s GLY 157 CO 0.33 -0.33 -0.17 -0.19 0.00 0.00 0.00 173.10 172.73 1u15 s TYR 158 N -1.42 2.57 -0.02 1.90 1.51 -1.26 -2.37 117.35 118.26 1u15 s TYR 158 Ca 0.33 -0.24 0.02 0.00 -1.01 0.00 0.00 57.07 56.16 1u15 s TYR 158 Cb -0.13 -1.44 0.00 0.00 -0.11 0.00 0.00 41.96 40.28 1u15 s TYR 158 CO 0.19 0.30 -0.06 0.95 -1.11 0.00 0.00 175.55 175.82 1u15 s THR 159 N -1.00 0.56 -2.09 -0.71 -4.23 -0.79 -4.71 115.64 102.68 1u15 s THR 159 Ca 0.16 -0.25 0.00 0.00 -1.18 0.00 0.00 61.69 60.42 1u15 s THR 159 Cb -0.11 -0.51 0.00 0.00 1.34 0.00 0.00 72.50 73.22 1u15 s THR 159 CO 0.07 0.18 0.00 1.41 -0.54 0.00 0.00 174.62 175.74 1u15 n HIS 160 N 3.28 -0.22 -2.19 3.99 8.25 -1.26 -0.67 115.22 126.41 1u15 n HIS 160 Ca -0.17 0.00 -0.21 0.00 -0.26 0.00 0.00 57.72 57.08 1u15 n HIS 160 Cb 0.55 -3.55 -0.03 0.00 1.12 0.00 0.00 29.99 28.08 1u15 n HIS 160 CO 0.00 0.00 0.00 -0.11 0.64 0.00 0.00 176.34 176.87 1u15 n LEU 161 N -2.48 -1.84 -4.48 2.41 7.94 -1.26 -4.99 117.00 112.30 1u15 n LEU 161 Ca -0.21 0.13 -0.24 0.00 -1.11 0.00 0.00 56.01 54.57 1u15 n LEU 161 Cb 0.68 -2.93 -0.10 0.00 0.53 0.00 0.00 43.42 41.60 1u15 n LEU 161 CO 0.31 -0.45 -0.47 -1.10 -1.11 0.00 0.00 177.39 174.56 1u15 s GLN 162 N -4.71 1.72 0.02 1.96 -1.52 0.16 -5.06 119.66 112.23 1u15 s GLN 162 Ca 0.00 -1.68 -0.30 0.00 -1.95 0.00 0.00 55.36 51.43 1u15 s GLN 162 Cb 0.00 -1.83 -0.05 0.00 -0.22 0.00 0.00 33.01 30.91 1u15 s GLN 162 CO 0.00 0.35 1.19 0.15 -0.25 0.00 0.00 175.29 176.73 1u15 s LYS 163 N -3.36 4.41 -0.09 2.91 1.02 -1.26 -1.88 119.74 121.49 1u15 s LYS 163 Ca 0.28 1.72 -0.04 0.00 0.02 0.00 0.00 55.97 57.95 1u15 s LYS 163 Cb -0.06 -3.43 -0.04 0.00 -0.52 0.00 0.00 37.83 33.78 1u15 s LYS 163 CO 0.15 -0.31 -0.12 0.00 -0.92 0.00 0.00 175.35 174.15 1u15 n ALA 164 N 4.39 2.35 -3.61 5.17 0.00 -1.00 -4.91 120.51 122.90 1u15 n ALA 164 Ca 0.09 -0.37 -0.06 0.00 0.00 0.00 0.00 53.44 53.11 1u15 n ALA 164 Cb 0.47 0.37 -0.05 0.00 0.00 0.00 0.00 19.45 20.24 1u15 n ALA 164 CO 0.00 0.00 0.00 1.14 0.00 0.00 0.00 177.50 178.64 1u15 s GLN 165 N -2.17 0.31 0.43 0.00 -2.07 -1.24 -4.91 119.66 110.01 1u15 s GLN 165 Ca -0.13 0.10 -0.25 0.00 -1.82 0.00 0.00 55.36 53.27 1u15 s GLN 165 Cb 0.05 0.15 -0.09 0.00 -1.09 0.00 0.00 33.01 32.02 1u15 s GLN 165 CO 0.17 -0.09 1.26 -0.35 -1.32 0.00 0.00 175.29 174.95 1u15 n PRO 166 N 0.76 1.87 -4.04 9.60 -0.04 -1.26 -1.62 135.00 140.27 1u15 n PRO 166 Ca -0.06 0.67 -0.10 0.00 -0.04 0.00 0.00 63.50 63.97 1u15 n PRO 166 Cb 0.58 -2.37 -0.07 0.00 -0.04 0.00 0.00 33.50 31.60 1u15 n PRO 166 CO 0.00 0.00 0.00 0.96 -0.04 0.00 0.00 175.50 176.42 1u15 s ILE 167 N -1.21 0.03 -0.07 0.52 -4.36 0.23 -4.62 121.20 111.70 1u15 s ILE 167 Ca 0.62 -1.58 -0.19 0.00 -0.26 0.00 0.00 60.65 59.24 1u15 s ILE 167 Cb -0.50 -2.15 -0.04 0.00 1.25 0.00 0.00 42.46 41.01 1u15 s ILE 167 CO 0.57 -0.12 0.53 -0.13 0.24 0.00 0.00 174.94 176.04 1u15 s ARG 168 N -4.04 4.32 0.30 0.37 0.52 -1.26 -1.18 118.95 117.99 1u15 s ARG 168 Ca 0.25 0.58 0.04 0.00 -0.52 0.00 0.00 55.73 56.08 1u15 s ARG 168 Cb 0.03 -3.40 0.81 0.00 0.52 0.00 0.00 34.95 32.90 1u15 s ARG 168 CO 0.06 0.23 1.50 1.87 0.02 0.00 0.00 175.30 178.99 1u15 n TRP 169 N 3.34 0.68 0.26 -0.53 -0.00 -0.10 0.12 117.44 121.21 1u15 n TRP 169 Ca -0.07 1.15 0.09 0.00 -0.00 0.00 0.00 57.50 58.68 1u15 n TRP 169 Cb 0.51 -1.26 0.68 0.00 -0.00 0.00 0.00 31.31 31.25 1u15 n TRP 169 CO 0.00 0.00 0.00 0.77 -0.00 0.00 0.00 177.69 178.46 1u15 h SER 170 N 0.00 0.00 0.10 5.87 0.02 -1.79 -0.85 113.55 116.91 1u15 h SER 170 Ca 0.61 0.00 -0.09 0.00 -0.84 0.00 0.00 61.79 61.47 1u15 h SER 170 Cb 1.32 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.85 1u15 h SER 170 CO -0.88 0.00 -0.31 -0.61 -1.14 0.00 0.00 176.83 173.90 1u15 h GLN 171 N 0.00 0.31 0.23 3.45 5.75 0.57 -0.17 115.11 125.24 1u15 h GLN 171 Ca 0.00 -0.12 -0.01 0.00 -0.15 0.00 0.00 58.65 58.37 1u15 h GLN 171 Cb 0.01 -0.02 0.00 0.00 1.07 0.00 0.00 27.48 28.54 1u15 h GLN 171 CO -0.00 0.59 -0.11 0.35 -2.65 0.00 0.00 178.83 177.01 1u15 h PHE 172 N 0.27 -0.29 -0.73 3.99 3.57 -1.08 -2.76 116.94 119.92 1u15 h PHE 172 Ca 0.04 -0.01 0.09 0.00 3.53 0.00 0.00 57.97 61.62 1u15 h PHE 172 Cb 0.68 0.09 -0.07 0.00 2.79 0.00 0.00 35.95 39.45 1u15 h PHE 172 CO 0.01 0.09 0.38 -0.07 -2.23 0.00 0.00 178.31 176.50 1u15 h LEU 173 N -0.88 0.52 -1.47 0.59 3.38 -1.25 -1.91 115.31 114.29 1u15 h LEU 173 Ca -0.03 0.05 -0.05 0.00 0.09 0.00 0.00 57.88 57.94 1u15 h LEU 173 Cb 0.51 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.21 1u15 h LEU 173 CO 0.05 0.30 -0.19 -0.07 0.09 0.00 0.00 178.44 178.63 1u15 h LEU 174 N 0.65 0.10 -0.97 1.67 3.38 -1.08 -1.83 115.31 117.24 1u15 h LEU 174 Ca 0.35 -0.02 -0.06 0.00 0.09 0.00 0.00 57.88 58.24 1u15 h LEU 174 Cb 0.34 -0.03 -0.02 0.00 0.09 0.00 0.00 40.66 41.04 1u15 h LEU 174 CO -0.25 0.30 0.10 0.77 0.09 0.00 0.00 178.44 179.45 1u15 h SER 175 N 0.10 0.81 -0.15 -0.43 4.64 -1.04 0.19 113.55 117.67 1u15 h SER 175 Ca 0.02 -0.16 -0.20 0.00 -0.47 0.00 0.00 61.79 60.98 1u15 h SER 175 Cb 0.39 -0.21 0.01 0.00 -0.31 0.00 0.00 62.40 62.28 1u15 h SER 175 CO 0.03 0.81 -0.69 0.45 -0.87 0.00 0.00 176.83 176.55 1u15 h HIS 176 N 0.82 0.99 -0.80 4.77 3.86 -1.36 -2.72 115.15 120.72 1u15 h HIS 176 Ca 0.17 -0.43 0.00 0.00 -1.16 0.00 0.00 60.37 58.96 1u15 h HIS 176 Cb 0.34 -0.16 -0.04 0.00 1.06 0.00 0.00 27.41 28.62 1u15 h HIS 176 CO 0.02 1.25 0.51 0.00 0.86 0.00 0.00 177.93 180.57 1u15 h ALA 177 N 0.54 1.40 -0.54 2.45 0.00 -0.86 -1.20 119.26 121.05 1u15 h ALA 177 Ca -0.04 -0.07 -0.10 0.00 0.00 0.00 0.00 54.91 54.70 1u15 h ALA 177 Cb 1.33 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 18.77 1u15 h ALA 177 CO 0.14 0.54 -0.06 0.28 0.00 0.00 0.00 179.25 180.16 1u15 h VAL 178 N 1.09 1.26 -0.36 0.00 2.07 -0.58 -0.73 116.25 119.00 1u15 h VAL 178 Ca 0.29 -1.18 -0.09 0.00 0.82 0.00 0.00 66.70 66.54 1u15 h VAL 178 Cb -0.10 0.90 -0.01 0.00 -1.52 0.00 0.00 31.29 30.57 1u15 h VAL 178 CO -0.06 0.42 -0.14 0.00 0.02 0.00 0.00 177.57 177.82 1u15 h ALA 179 N 1.04 0.50 0.00 1.67 0.00 -1.11 -2.59 119.26 118.77 1u15 h ALA 179 Ca 0.15 -0.33 -0.05 0.00 0.00 0.00 0.00 54.91 54.68 1u15 h ALA 179 Cb 0.59 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 1u15 h ALA 179 CO 0.04 0.39 -0.24 -0.07 0.00 0.00 0.00 179.25 179.37 1u15 h LEU 180 N 0.51 0.00 -0.53 0.00 3.38 -1.09 -2.51 115.31 115.07 1u15 h LEU 180 Ca 0.08 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 58.02 1u15 h LEU 180 Cb 0.66 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.39 1u15 h LEU 180 CO 0.04 0.24 0.19 0.74 0.09 0.00 0.00 178.44 179.74 1u15 h THR 181 N 0.00 1.23 0.00 0.22 2.02 -0.75 -1.12 112.91 114.50 1u15 h THR 181 Ca -0.00 -0.75 -0.04 0.00 0.77 0.00 0.00 66.41 66.39 1u15 h THR 181 Cb 0.49 0.71 -0.01 0.00 -1.74 0.00 0.00 68.15 67.61 1u15 h THR 181 CO 0.03 0.28 -0.18 0.03 0.37 0.00 0.00 175.52 176.05 1u15 h ARG 182 N 0.73 0.00 -0.19 6.66 3.08 -1.18 -1.60 114.38 121.88 1u15 h ARG 182 Ca 0.17 0.00 -0.08 0.00 0.07 0.00 0.00 59.98 60.15 1u15 h ARG 182 Cb 0.25 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.29 1u15 h ARG 182 CO -0.01 0.18 -0.18 -0.44 -1.07 0.00 0.00 179.97 178.45 1u15 h ASP 183 N 0.00 0.49 -0.77 7.04 3.45 -1.15 0.06 116.42 125.53 1u15 h ASP 183 Ca -0.00 -0.47 0.10 0.00 0.43 0.00 0.00 57.03 57.09 1u15 h ASP 183 Cb 0.41 -0.14 -0.08 0.00 -0.56 0.00 0.00 39.33 38.97 1u15 h ASP 183 CO 0.02 0.86 0.41 -1.28 -1.57 0.00 0.00 179.24 177.68 1u15 h SER 184 N 0.12 0.54 -0.43 6.45 0.87 -0.57 0.31 113.55 120.84 1u15 h SER 184 Ca 0.03 0.06 -0.11 0.00 -1.23 0.00 0.00 61.79 60.54 1u15 h SER 184 Cb 0.72 -0.04 -0.01 0.00 -0.44 0.00 0.00 62.40 62.63 1u15 h SER 184 CO 0.05 0.30 -0.17 -0.08 -0.53 0.00 0.00 176.83 176.40 1u15 h GLU 185 N 0.67 0.87 -0.17 2.24 4.81 -1.08 -2.24 114.58 119.67 1u15 h GLU 185 Ca 0.38 -0.36 -0.02 0.00 -0.13 0.00 0.00 59.36 59.23 1u15 h GLU 185 Cb 0.41 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.75 1u15 h GLU 185 CO -0.28 1.00 0.03 0.00 -0.73 0.00 0.00 179.01 179.04 1u15 h ARG 186 N 0.69 0.27 -0.95 1.92 3.08 0.07 -1.81 114.38 117.66 1u15 h ARG 186 Ca 0.10 -0.07 0.14 0.00 0.07 0.00 0.00 59.98 60.22 1u15 h ARG 186 Cb 0.72 -0.03 -0.09 0.00 0.08 0.00 0.00 29.97 30.65 1u15 h ARG 186 CO 0.06 0.44 0.56 -0.07 -1.07 0.00 0.00 179.97 179.89 1u15 h LEU 187 N 0.07 0.77 -0.94 3.04 3.38 -0.42 0.64 115.31 121.84 1u15 h LEU 187 Ca 0.05 0.07 -0.02 0.00 0.09 0.00 0.00 57.88 58.08 1u15 h LEU 187 Cb 0.29 -0.07 -0.04 0.00 0.09 0.00 0.00 40.66 40.93 1u15 h LEU 187 CO 0.00 0.36 0.50 1.23 0.09 0.00 0.00 178.44 180.62 1u15 h GLY 188 N 0.83 1.32 1.01 0.83 0.00 -0.95 -0.75 103.07 105.37 1u15 h GLY 188 Ca 0.50 -0.59 -0.09 0.00 0.00 0.00 0.00 47.33 47.15 1u15 h GLY 188 CO -0.31 0.57 -0.06 0.83 0.00 0.00 0.00 176.54 177.57 1u15 h GLU 189 N 1.24 0.84 -0.75 4.80 5.08 -0.11 -2.98 114.58 122.72 1u15 h GLU 189 Ca 0.31 -0.30 -0.03 0.00 -1.00 0.00 0.00 59.36 58.35 1u15 h GLU 189 Cb 0.01 -0.06 -0.03 0.00 0.50 0.00 0.00 28.75 29.17 1u15 h GLU 189 CO -0.05 0.92 0.35 0.28 -1.00 0.00 0.00 179.01 179.51 1u15 h VAL 190 N 0.68 1.24 -0.02 3.13 2.07 -0.68 -2.48 116.25 120.19 1u15 h VAL 190 Ca 0.12 -0.68 -0.03 0.00 0.82 0.00 0.00 66.70 66.94 1u15 h VAL 190 Cb 0.58 0.29 -0.00 0.00 -1.52 0.00 0.00 31.29 30.64 1u15 h VAL 190 CO 0.03 0.29 -0.11 0.50 0.02 0.00 0.00 177.57 178.30 1u15 h LYS 191 N 1.06 0.03 0.00 1.57 3.64 -1.00 -2.27 116.57 119.61 1u15 h LYS 191 Ca 0.26 -0.01 -0.06 0.00 -1.27 0.00 0.00 60.65 59.57 1u15 h LYS 191 Cb 0.12 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 31.93 1u15 h LYS 191 CO -0.03 0.14 -0.28 0.87 -2.27 0.00 0.00 179.45 177.88 1u15 h LYS 192 N 0.03 0.00 0.00 1.90 1.57 -1.34 -1.83 116.57 116.90 1u15 h LYS 192 Ca 0.01 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.79 1u15 h LYS 192 Cb 0.21 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.52 1u15 h LYS 192 CO 0.01 0.28 -0.92 0.54 -0.57 0.00 0.00 179.45 178.79 1u15 n ARG 193 N -3.41 0.50 0.14 3.15 1.74 -0.90 -3.52 116.66 114.37 1u15 n ARG 193 Ca 0.00 0.10 0.07 0.00 -0.77 0.00 0.00 57.85 57.26 1u15 n ARG 193 Cb 0.48 -1.77 0.05 0.00 -1.02 0.00 0.00 32.46 30.19 1u15 n ARG 193 CO 0.00 0.00 0.00 0.82 -1.52 0.00 0.00 177.63 176.93 1u15 h ILE 194 N 0.00 0.31 -0.25 0.55 2.04 -1.26 -3.33 117.51 115.57 1u15 h ILE 194 Ca 0.00 -1.49 -0.16 0.00 1.00 0.00 0.00 64.86 64.21 1u15 h ILE 194 Cb 0.91 1.99 -0.07 0.00 -0.74 0.00 0.00 36.82 38.91 1u15 h ILE 194 CO 0.00 0.18 0.21 -3.20 0.00 0.00 0.00 178.15 175.34 1u15 n ASN 195 N -2.99 5.78 -4.06 1.72 5.15 -0.71 -4.77 115.26 115.38 1u15 n ASN 195 Ca 0.00 -2.73 -0.30 0.00 -0.60 0.00 0.00 54.58 50.95 1u15 n ASN 195 Cb 0.64 -1.06 -0.16 0.00 -0.53 0.00 0.00 39.78 38.66 1u15 n ASN 195 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 1u15 s VAL 196 N -1.16 1.65 -0.07 3.44 1.01 -1.25 -1.18 120.40 122.84 1u15 s VAL 196 Ca 0.16 -0.70 -0.30 0.00 0.00 0.00 0.00 61.98 61.14 1u15 s VAL 196 Cb 0.12 -1.52 -0.04 0.00 0.00 0.00 0.00 36.38 34.95 1u15 s VAL 196 CO -0.00 0.47 1.29 -0.22 0.00 0.00 0.00 175.10 176.64 1u15 s LEU 197 N 1.24 4.27 0.00 3.92 2.96 0.74 -4.71 118.68 127.10 1u15 s LEU 197 Ca 0.00 1.88 0.19 0.00 -0.22 0.00 0.00 54.13 55.98 1u15 s LEU 197 Cb -0.14 -3.55 -0.11 0.00 0.50 0.00 0.00 46.19 42.89 1u15 s LEU 197 CO -0.07 -0.68 0.88 -0.81 -1.32 0.00 0.00 176.35 174.35 1u15 n PRO 198 N 5.65 1.17 -1.89 0.98 -0.04 -1.26 0.10 135.00 139.71 1u15 n PRO 198 Ca 0.12 -0.45 -0.42 0.00 -0.04 0.00 0.00 63.50 62.72 1u15 n PRO 198 Cb 0.45 -1.38 -0.03 0.00 -0.04 0.00 0.00 33.50 32.51 1u15 n PRO 198 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 1u15 s LEU 199 N -2.58 4.37 0.00 1.53 0.20 -1.26 -2.78 118.68 118.16 1u15 s LEU 199 Ca 0.11 2.71 0.00 0.00 0.69 0.00 0.00 54.13 57.65 1u15 s LEU 199 Cb 0.15 -3.61 0.00 0.00 -0.43 0.00 0.00 46.19 42.30 1u15 s LEU 199 CO 0.63 -0.84 0.00 0.61 -0.29 0.00 0.00 176.35 176.46 1u15 n GLY 200 N 3.27 1.57 0.00 7.98 0.00 -1.26 -4.96 105.19 111.80 1u15 n GLY 200 Ca 0.12 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.21 1u15 n GLY 200 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1u15 n SER 201 N 0.00 0.95 0.00 1.61 7.64 -1.12 -2.92 113.62 119.77 1u15 n SER 201 Ca 0.00 -0.60 0.00 0.00 1.01 0.00 0.00 58.87 59.28 1u15 n SER 201 Cb 0.00 1.20 0.00 0.00 -1.01 0.00 0.00 64.21 64.40 1u15 n SER 201 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1u15 n GLY 202 N 1.43 1.47 0.07 0.23 0.00 -1.21 0.51 105.19 107.68 1u15 n GLY 202 Ca 0.01 -0.69 0.11 0.00 0.00 0.00 0.00 46.02 45.46 1u15 n GLY 202 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1u15 n ALA 203 N 8.11 2.89 0.00 4.61 0.00 -1.26 -4.04 120.51 130.82 1u15 n ALA 203 Ca 0.00 -0.33 0.00 0.00 0.00 0.00 0.00 53.44 53.11 1u15 n ALA 203 Cb 0.00 -1.03 0.00 0.00 0.00 0.00 0.00 19.45 18.42 1u15 n ALA 203 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 177.50 178.97 1u15 n LEU 204 N -2.32 0.00 -0.30 0.00 -0.00 -1.21 -4.84 117.00 108.33 1u15 n LEU 204 Ca 0.01 0.00 0.11 0.00 -0.00 0.00 0.00 56.01 56.12 1u15 n LEU 204 Cb 0.50 0.00 -0.04 0.00 -0.00 0.00 0.00 43.42 43.88 1u15 n LEU 204 CO 0.40 0.00 0.18 0.00 -0.00 0.00 0.00 177.39 177.97 1u15 n ALA 205 N 0.00 4.01 0.00 1.47 0.00 -1.24 -2.68 120.51 122.07 1u15 n ALA 205 Ca 0.00 -0.62 0.00 0.00 0.00 0.00 0.00 53.44 52.82 1u15 n ALA 205 Cb 0.00 -0.79 0.00 0.00 0.00 0.00 0.00 19.45 18.66 1u15 n ALA 205 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1u15 n GLY 206 N 1.45 -0.18 3.72 0.00 0.00 0.18 -4.91 105.19 105.45 1u15 n GLY 206 Ca 0.07 -2.28 -0.41 0.00 0.00 0.00 0.00 46.02 43.40 1u15 n GLY 206 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1u15 s ASN 207 N -0.89 7.36 0.00 1.61 2.47 -1.15 -3.32 114.94 121.02 1u15 s ASN 207 Ca 0.00 1.64 0.27 0.00 0.42 0.00 0.00 52.86 55.19 1u15 s ASN 207 Cb 0.00 -2.56 0.84 0.00 -1.45 0.00 0.00 41.25 38.09 1u15 s ASN 207 CO 0.00 -0.19 1.65 -0.81 -3.72 0.00 0.00 177.10 174.03 1u15 n PRO 208 N 3.56 0.05 -0.79 0.43 -0.04 -1.26 -4.10 135.00 132.85 1u15 n PRO 208 Ca 0.04 -0.02 0.01 0.00 -0.04 0.00 0.00 63.50 63.49 1u15 n PRO 208 Cb 0.51 -1.50 0.29 0.00 -0.04 0.00 0.00 33.50 32.76 1u15 n PRO 208 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1u15 n LEU 209 N -1.45 5.08 -1.59 1.53 4.77 -1.26 -4.94 117.00 119.13 1u15 n LEU 209 Ca 0.07 -3.19 -0.20 0.00 -0.03 0.00 0.00 56.01 52.65 1u15 n LEU 209 Cb 0.33 -0.66 -0.09 0.00 -2.33 0.00 0.00 43.42 40.68 1u15 n LEU 209 CO 0.31 0.80 -0.19 -0.67 -1.33 0.00 0.00 177.39 176.30 1u15 n ASP 210 N -0.29 -5.41 -4.40 -1.43 4.64 -1.26 -4.91 116.55 103.49 1u15 n ASP 210 Ca 0.32 0.51 -0.41 0.00 -1.38 0.00 0.00 54.79 53.83 1u15 n ASP 210 Cb 1.16 -4.78 0.01 0.00 -1.04 0.00 0.00 41.12 36.47 1u15 n ASP 210 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 1u15 n ILE 211 N -2.36 1.45 -2.73 5.18 0.13 -1.26 -4.83 119.36 114.94 1u15 n ILE 211 Ca -0.20 -0.50 -0.42 0.00 -1.10 0.00 0.00 62.75 60.52 1u15 n ILE 211 Cb 0.67 -0.40 -0.03 0.00 -0.84 0.00 0.00 39.64 39.03 1u15 n ILE 211 CO 0.00 0.00 0.00 -0.62 2.80 0.00 0.00 176.55 178.73 1u15 s ASP 212 N -1.01 6.20 0.43 9.51 2.15 -1.26 -4.88 116.67 127.81 1u15 s ASP 212 Ca 0.63 -0.67 0.21 0.00 0.43 0.00 0.00 52.55 53.15 1u15 s ASP 212 Cb -0.57 -2.48 0.98 0.00 -0.30 0.00 0.00 42.92 40.55 1u15 s ASP 212 CO 0.59 -1.57 1.88 0.03 -0.17 0.00 0.00 175.17 175.93 1u15 h ARG 213 N 9.71 0.00 -0.13 4.34 3.08 -1.93 -2.30 114.38 127.15 1u15 h ARG 213 Ca -0.28 0.00 -0.12 0.00 0.07 0.00 0.00 59.98 59.65 1u15 h ARG 213 Cb 1.06 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.10 1u15 h ARG 213 CO 1.21 0.27 -0.43 1.49 -1.07 0.00 0.00 179.97 181.43 1u15 h GLU 214 N 0.00 0.29 -0.48 0.04 4.57 -1.98 -1.01 114.58 116.01 1u15 h GLU 214 Ca -0.00 -0.15 -0.11 0.00 -1.18 0.00 0.00 59.36 57.92 1u15 h GLU 214 Cb 0.63 0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 29.21 1u15 h GLU 214 CO 0.03 0.68 -0.13 1.98 -1.18 0.00 0.00 179.01 180.39 1u15 h MET 215 N 0.24 0.91 0.25 1.92 4.05 -1.83 -2.30 114.93 118.17 1u15 h MET 215 Ca 0.02 -0.33 -0.01 0.00 -0.28 0.00 0.00 59.70 59.10 1u15 h MET 215 Cb 0.86 -0.06 0.00 0.00 -0.80 0.00 0.00 31.60 31.60 1u15 h MET 215 CO 0.07 0.98 -0.12 -0.07 0.23 0.00 0.00 176.91 177.99 1u15 h LEU 216 N 0.81 -0.29 -0.44 3.39 3.38 -1.21 -1.48 115.31 119.48 1u15 h LEU 216 Ca 0.13 -0.14 0.06 0.00 0.09 0.00 0.00 57.88 58.02 1u15 h LEU 216 Cb 0.66 0.07 -0.09 0.00 0.09 0.00 0.00 40.66 41.39 1u15 h LEU 216 CO 0.05 -0.03 -0.53 -0.09 0.09 0.00 0.00 178.44 177.93 1u15 h ARG 217 N -0.55 -0.35 -0.63 1.13 2.43 -1.08 -0.09 114.38 115.23 1u15 h ARG 217 Ca -0.03 0.02 0.10 0.00 -0.81 0.00 0.00 59.98 59.26 1u15 h ARG 217 Cb 0.41 0.08 -0.07 0.00 -0.42 0.00 0.00 29.97 29.96 1u15 h ARG 217 CO 0.06 -0.24 0.24 1.03 -1.51 0.00 0.00 179.97 179.55 1u15 h SER 218 N -0.37 0.23 -0.40 -3.80 0.87 -1.41 0.74 113.55 109.41 1u15 h SER 218 Ca 0.09 0.08 -0.01 0.00 -1.23 0.00 0.00 61.79 60.72 1u15 h SER 218 Cb 0.59 0.06 -0.02 0.00 -0.44 0.00 0.00 62.40 62.59 1u15 h SER 218 CO -0.61 0.13 0.19 -0.33 -0.53 0.00 0.00 176.83 175.69 1u15 h GLU 219 N 0.42 0.57 0.00 2.24 4.39 -0.16 -2.92 114.58 119.12 1u15 h GLU 219 Ca 0.32 -0.08 0.00 0.00 0.34 0.00 0.00 59.36 59.94 1u15 h GLU 219 Cb 0.41 -0.10 0.00 0.00 -0.10 0.00 0.00 28.75 28.95 1u15 h GLU 219 CO -0.32 0.50 -0.31 -0.07 -1.16 0.00 0.00 179.01 177.65 1u15 h LEU 220 N 0.51 0.00 -0.29 1.33 3.38 -0.65 -3.48 115.31 116.11 1u15 h LEU 220 Ca 0.14 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 58.04 1u15 h LEU 220 Cb 0.12 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.87 1u15 h LEU 220 CO -0.02 0.03 0.00 -0.62 0.09 0.00 0.00 178.44 177.93 1u15 n GLU 221 N -2.43 0.00 -2.26 1.13 1.02 0.25 -5.07 120.64 113.28 1u15 n GLU 221 Ca 0.04 0.00 -0.28 0.00 -0.02 0.00 0.00 57.16 56.90 1u15 n GLU 221 Cb 0.47 -3.16 0.03 0.00 -0.02 0.00 0.00 31.44 28.76 1u15 n GLU 221 CO 0.00 0.00 0.00 -0.06 1.18 0.00 0.00 177.13 178.25 1u15 s PHE 222 N -2.29 3.33 0.03 -0.32 0.40 -0.83 -5.01 117.98 113.30 1u15 s PHE 222 Ca 0.00 0.80 -0.11 0.00 -0.60 0.00 0.00 56.93 57.03 1u15 s PHE 222 Cb 0.00 -2.77 -0.32 0.00 0.51 0.00 0.00 43.02 40.44 1u15 s PHE 222 CO 0.00 -0.84 1.00 0.00 0.70 0.00 0.00 175.22 176.08 1u15 h ALA 223 N -0.26 -0.02 -2.93 5.36 0.00 -1.49 -3.43 119.26 116.50 1u15 h ALA 223 Ca -0.45 -0.92 -0.22 0.00 0.00 0.00 0.00 54.91 53.32 1u15 h ALA 223 Cb 1.25 0.16 -0.07 0.00 0.00 0.00 0.00 17.79 19.13 1u15 h ALA 223 CO 0.62 0.85 -0.12 -1.54 0.00 0.00 0.00 179.25 179.06 1u15 s SER 224 N -7.37 0.69 0.18 0.00 1.04 -1.21 -5.06 113.70 101.98 1u15 s SER 224 Ca -0.08 -1.39 0.07 0.00 0.48 0.00 0.00 55.95 55.03 1u15 s SER 224 Cb 0.05 0.69 -0.04 0.00 0.10 0.00 0.00 66.02 66.82 1u15 s SER 224 CO 0.91 -1.34 0.03 0.27 0.98 0.00 0.00 173.24 174.09 1u15 s ILE 225 N -3.02 3.88 0.55 -1.02 -4.36 -1.26 -0.19 121.20 115.77 1u15 s ILE 225 Ca 0.28 -1.40 -0.21 0.00 -0.26 0.00 0.00 60.65 59.05 1u15 s ILE 225 Cb -0.01 -2.97 -0.05 0.00 1.25 0.00 0.00 42.46 40.67 1u15 s ILE 225 CO 0.18 -0.15 1.20 -1.54 0.24 0.00 0.00 174.94 174.88 1u15 n SER 226 N -0.29 1.95 0.05 4.36 3.41 0.29 -4.76 113.62 118.63 1u15 n SER 226 Ca -0.09 0.93 -0.17 0.00 -0.26 0.00 0.00 58.87 59.28 1u15 n SER 226 Cb 0.56 -1.50 -0.14 0.00 -0.26 0.00 0.00 64.21 62.87 1u15 n SER 226 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 1u15 h LEU 227 N 1.14 0.38 -7.54 1.04 3.38 -1.98 -3.46 115.31 108.27 1u15 h LEU 227 Ca -0.49 -0.59 -0.43 0.00 0.09 0.00 0.00 57.88 56.46 1u15 h LEU 227 Cb 1.33 -0.12 -0.37 0.00 0.09 0.00 0.00 40.66 41.58 1u15 h LEU 227 CO 0.55 1.50 -0.77 0.21 0.09 0.00 0.00 178.44 180.02 1u15 s ASN 228 N -6.93 1.46 0.28 -0.43 2.47 -1.26 -5.06 114.94 105.47 1u15 s ASN 228 Ca -0.11 -0.10 -0.01 0.00 0.42 0.00 0.00 52.86 53.06 1u15 s ASN 228 Cb 0.07 -0.45 0.46 0.00 -1.45 0.00 0.00 41.25 39.88 1u15 s ASN 228 CO 0.84 -0.16 1.90 0.77 -3.72 0.00 0.00 177.10 176.72 1u15 h SER 229 N 8.09 0.98 -0.12 -4.21 4.64 -1.90 0.14 113.55 121.17 1u15 h SER 229 Ca -0.24 0.01 -0.00 0.00 -0.47 0.00 0.00 61.79 61.08 1u15 h SER 229 Cb 1.13 -0.21 -0.01 0.00 -0.31 0.00 0.00 62.40 63.01 1u15 h SER 229 CO 0.31 0.63 0.06 0.24 -0.87 0.00 0.00 176.83 177.20 1u15 h MET 230 N 1.12 0.17 -0.02 4.77 2.86 -1.85 -1.07 114.93 120.90 1u15 h MET 230 Ca 0.41 -0.03 -0.00 0.00 -2.06 0.00 0.00 59.70 58.02 1u15 h MET 230 Cb 0.16 -0.03 -0.00 0.00 0.06 0.00 0.00 31.60 31.79 1u15 h MET 230 CO -0.15 0.24 0.01 0.22 1.06 0.00 0.00 176.91 178.28 1u15 h ASP 231 N 0.07 0.03 -0.39 1.22 3.58 -1.82 -1.55 116.42 117.55 1u15 h ASP 231 Ca 0.04 -0.15 0.11 0.00 0.42 0.00 0.00 57.03 57.46 1u15 h ASP 231 Cb 0.12 -0.01 -0.02 0.00 1.72 0.00 0.00 39.33 41.15 1u15 h ASP 231 CO -0.01 0.17 0.32 0.00 -2.88 0.00 0.00 179.24 176.85 1u15 h ALA 232 N 0.86 2.23 0.20 -0.78 0.00 -0.57 0.33 119.26 121.54 1u15 h ALA 232 Ca 0.01 -0.01 -0.34 0.00 0.00 0.00 0.00 54.91 54.56 1u15 h ALA 232 Cb 0.15 0.03 0.02 0.00 0.00 0.00 0.00 17.79 17.98 1u15 h ALA 232 CO -0.00 -0.53 -1.65 0.82 0.00 0.00 0.00 179.25 177.90 1u15 h ILE 233 N 0.00 1.03 0.00 0.00 1.08 -0.80 -3.40 117.51 115.42 1u15 h ILE 233 Ca 0.19 -2.55 -0.09 0.00 -0.39 0.00 0.00 64.86 62.02 1u15 h ILE 233 Cb 0.83 2.84 -0.02 0.00 -3.07 0.00 0.00 36.82 37.40 1u15 h ILE 233 CO -0.00 0.83 -1.76 -1.54 -0.69 0.00 0.00 178.15 174.99 1u15 n SER 234 N -3.66 0.32 -4.77 1.72 3.41 -0.62 -4.82 113.62 105.20 1u15 n SER 234 Ca -0.23 0.13 -0.38 0.00 -0.26 0.00 0.00 58.87 58.13 1u15 n SER 234 Cb 1.06 1.22 -0.04 0.00 -0.26 0.00 0.00 64.21 66.20 1u15 n SER 234 CO 0.00 0.00 0.00 -1.83 -0.16 0.00 0.00 175.04 173.05 1u15 s GLU 235 N -3.22 4.32 -0.11 4.33 4.04 0.11 -4.93 118.70 123.24 1u15 s GLU 235 Ca -0.06 1.72 0.14 0.00 0.04 0.00 0.00 54.97 56.81 1u15 s GLU 235 Cb 0.11 -2.84 0.28 0.00 0.02 0.00 0.00 34.13 31.70 1u15 s GLU 235 CO 0.86 -0.05 1.14 0.54 -1.84 0.00 0.00 175.26 175.90 1u15 n ARG 236 N 0.47 0.93 -0.29 -4.83 5.12 -1.26 -4.84 116.66 111.96 1u15 n ARG 236 Ca 0.02 -2.35 0.11 0.00 -1.93 0.00 0.00 57.85 53.69 1u15 n ARG 236 Cb 0.47 -1.14 0.25 0.00 -1.16 0.00 0.00 32.46 30.88 1u15 n ARG 236 CO 0.00 0.00 0.00 -0.44 -1.93 0.00 0.00 177.63 175.26 1u15 h ASP 237 N 0.37 -0.07 0.09 0.55 5.19 -1.98 0.15 116.42 120.72 1u15 h ASP 237 Ca -0.03 0.19 -0.01 0.00 -0.62 0.00 0.00 57.03 56.56 1u15 h ASP 237 Cb 1.19 0.28 -0.00 0.00 0.18 0.00 0.00 39.33 40.98 1u15 h ASP 237 CO 0.01 -0.15 -0.05 2.19 -3.12 0.00 0.00 179.24 178.12 1u15 h PHE 238 N 0.20 0.00 0.15 4.55 -5.15 -1.93 0.26 116.94 115.02 1u15 h PHE 238 Ca 0.51 0.00 -0.21 0.00 -0.20 0.00 0.00 57.97 58.07 1u15 h PHE 238 Cb 0.99 0.00 0.02 0.00 0.22 0.00 0.00 35.95 37.19 1u15 h PHE 238 CO -0.30 0.05 -0.91 0.28 -2.00 0.00 0.00 178.31 175.43 1u15 h VAL 239 N 0.00 1.47 0.31 0.88 2.07 -1.12 -3.04 116.25 116.83 1u15 h VAL 239 Ca -0.00 -2.54 -0.02 0.00 0.82 0.00 0.00 66.70 64.96 1u15 h VAL 239 Cb 0.11 3.15 0.00 0.00 -1.52 0.00 0.00 31.29 33.04 1u15 h VAL 239 CO 0.01 0.73 -0.15 0.58 0.02 0.00 0.00 177.57 178.75 1u15 h VAL 240 N -0.28 0.71 -0.25 2.57 2.07 -0.56 -1.57 116.25 118.95 1u15 h VAL 240 Ca -0.16 -0.18 0.06 0.00 0.82 0.00 0.00 66.70 67.24 1u15 h VAL 240 Cb 1.71 0.81 -0.07 0.00 -1.52 0.00 0.00 31.29 32.23 1u15 h VAL 240 CO 0.17 0.04 -0.20 -0.33 0.02 0.00 0.00 177.57 177.27 1u15 h GLU 241 N -0.52 -0.19 -0.84 1.57 5.08 -0.67 0.14 114.58 119.15 1u15 h GLU 241 Ca -0.04 0.01 0.03 0.00 -1.00 0.00 0.00 59.36 58.36 1u15 h GLU 241 Cb 0.39 0.04 -0.05 0.00 0.50 0.00 0.00 28.75 29.63 1u15 h GLU 241 CO 0.07 -0.13 0.54 0.35 -1.00 0.00 0.00 179.01 178.84 1u15 h PHE 242 N -0.20 1.02 -0.53 4.33 3.57 -1.53 0.02 116.94 123.61 1u15 h PHE 242 Ca 0.14 0.03 -0.10 0.00 3.53 0.00 0.00 57.97 61.57 1u15 h PHE 242 Cb 0.41 -0.34 -0.02 0.00 2.79 0.00 0.00 35.95 38.79 1u15 h PHE 242 CO -0.37 0.60 -0.05 -0.07 -2.23 0.00 0.00 178.31 176.20 1u15 h LEU 243 N 1.07 0.97 0.06 0.59 3.38 -0.61 -0.10 115.31 120.66 1u15 h LEU 243 Ca 0.33 -0.33 -0.00 0.00 0.09 0.00 0.00 57.88 57.97 1u15 h LEU 243 Cb -0.03 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 40.46 1u15 h LEU 243 CO -0.10 1.06 -0.03 0.28 0.09 0.00 0.00 178.44 179.74 1u15 h SER 244 N 0.85 -0.07 -0.53 -0.43 0.02 -0.22 -0.76 113.55 112.42 1u15 h SER 244 Ca 0.15 -0.14 0.02 0.00 -0.84 0.00 0.00 61.79 60.97 1u15 h SER 244 Cb 0.60 0.02 -0.03 0.00 0.14 0.00 0.00 62.40 63.12 1u15 h SER 244 CO 0.04 0.10 0.33 0.58 -1.14 0.00 0.00 176.83 176.74 1u15 h VAL 245 N -0.23 1.09 0.00 2.27 2.07 -0.97 -1.56 116.25 118.91 1u15 h VAL 245 Ca -0.01 -0.23 -0.04 0.00 0.82 0.00 0.00 66.70 67.24 1u15 h VAL 245 Cb 0.20 0.37 -0.01 0.00 -1.52 0.00 0.00 31.29 30.33 1u15 h VAL 245 CO 0.01 0.12 -0.20 0.00 0.02 0.00 0.00 177.57 177.53 1u15 h ALA 246 N 1.22 1.39 -0.05 1.67 0.00 -0.84 -2.18 119.26 120.47 1u15 h ALA 246 Ca 0.20 -0.18 -0.10 0.00 0.00 0.00 0.00 54.91 54.84 1u15 h ALA 246 Cb -0.02 -0.03 0.01 0.00 0.00 0.00 0.00 17.79 17.75 1u15 h ALA 246 CO -0.07 0.24 -0.36 1.15 0.00 0.00 0.00 179.25 180.21 1u15 h THR 247 N 0.00 1.44 -0.63 0.00 2.02 -0.19 -2.23 112.91 113.31 1u15 h THR 247 Ca -0.00 -1.82 0.04 0.00 0.77 0.00 0.00 66.41 65.40 1u15 h THR 247 Cb 0.42 2.43 -0.04 0.00 -1.74 0.00 0.00 68.15 69.22 1u15 h THR 247 CO 0.03 0.52 0.38 0.25 0.37 0.00 0.00 175.52 177.06 1u15 h LEU 248 N -0.19 0.60 -0.17 2.58 6.46 -1.18 -0.50 115.31 122.92 1u15 h LEU 248 Ca -0.03 0.01 0.04 0.00 -0.12 0.00 0.00 57.88 57.78 1u15 h LEU 248 Cb 1.03 -0.12 -0.04 0.00 -0.73 0.00 0.00 40.66 40.80 1u15 h LEU 248 CO 0.07 0.41 -0.10 0.25 -0.62 0.00 0.00 178.44 178.46 1u15 h LEU 249 N 0.74 -0.33 -1.71 2.25 5.85 -1.40 -0.80 115.31 119.91 1u15 h LEU 249 Ca 0.26 0.08 -0.01 0.00 0.84 0.00 0.00 57.88 59.04 1u15 h LEU 249 Cb 0.06 0.18 -0.01 0.00 0.37 0.00 0.00 40.66 41.26 1u15 h LEU 249 CO -0.12 -0.13 0.03 -0.07 -0.34 0.00 0.00 178.44 177.81 1u15 h LEU 250 N -0.09 0.19 -0.02 2.25 -0.00 -0.81 -1.65 115.31 115.19 1u15 h LEU 250 Ca 0.10 -0.02 -0.00 0.00 -0.00 0.00 0.00 57.88 57.96 1u15 h LEU 250 Cb 0.24 -0.05 -0.00 0.00 -0.00 0.00 0.00 40.66 40.85 1u15 h LEU 250 CO -0.23 0.21 0.01 0.40 -0.00 0.00 0.00 178.44 178.83 1u15 h ILE 251 N 0.22 1.13 -0.65 1.22 1.08 0.20 0.31 117.51 121.01 1u15 h ILE 251 Ca 0.05 -0.39 0.14 0.00 -0.39 0.00 0.00 64.86 64.27 1u15 h ILE 251 Cb 0.10 1.37 -0.10 0.00 -3.07 0.00 0.00 36.82 35.11 1u15 h ILE 251 CO -0.00 0.11 0.09 0.45 -0.69 0.00 0.00 178.15 178.11 1u15 h HIS 252 N -0.13 0.13 -0.53 1.37 3.86 -0.32 0.14 115.15 119.66 1u15 h HIS 252 Ca 0.01 0.04 -0.07 0.00 -1.16 0.00 0.00 60.37 59.19 1u15 h HIS 252 Cb 0.16 0.04 -0.02 0.00 1.06 0.00 0.00 27.41 28.66 1u15 h HIS 252 CO -0.02 -0.10 0.04 -0.07 0.86 0.00 0.00 177.93 178.63 1u15 h LEU 253 N 0.21 0.83 -1.52 2.43 3.38 -0.70 -1.45 115.31 118.49 1u15 h LEU 253 Ca 0.35 -0.19 -0.02 0.00 0.09 0.00 0.00 57.88 58.11 1u15 h LEU 253 Cb 0.57 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 41.09 1u15 h LEU 253 CO -0.49 0.87 0.08 0.77 0.09 0.00 0.00 178.44 179.76 1u15 h SER 254 N 0.82 0.35 -0.12 -0.43 4.64 0.22 0.45 113.55 119.48 1u15 h SER 254 Ca 0.16 -0.04 -0.18 0.00 -0.47 0.00 0.00 61.79 61.27 1u15 h SER 254 Cb 0.43 -0.09 0.01 0.00 -0.31 0.00 0.00 62.40 62.44 1u15 h SER 254 CO 0.02 0.35 -0.62 0.50 -0.87 0.00 0.00 176.83 176.21 1u15 h LYS 255 N 0.39 0.63 -0.36 4.77 3.64 -0.62 -1.72 116.57 123.30 1u15 h LYS 255 Ca 0.10 -0.52 -0.04 0.00 -1.27 0.00 0.00 60.65 58.92 1u15 h LYS 255 Cb 0.14 0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 32.05 1u15 h LYS 255 CO -0.01 1.14 0.07 1.98 -2.27 0.00 0.00 179.45 180.37 1u15 h MET 256 N 0.28 0.59 -1.01 1.90 4.05 -0.66 -1.52 114.93 118.56 1u15 h MET 256 Ca -0.04 -0.15 0.06 0.00 -0.28 0.00 0.00 59.70 59.29 1u15 h MET 256 Cb 1.26 -0.07 -0.07 0.00 -0.80 0.00 0.00 31.60 31.92 1u15 h MET 256 CO 0.13 0.64 0.65 0.00 0.23 0.00 0.00 176.91 178.56 1u15 h ALA 257 N 0.92 1.39 0.16 0.39 0.00 -0.08 -1.18 119.26 120.86 1u15 h ALA 257 Ca 0.11 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 1u15 h ALA 257 Cb 0.33 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 17.80 1u15 h ALA 257 CO 0.00 0.47 -0.08 1.49 0.00 0.00 0.00 179.25 181.14 1u15 h GLU 258 N 1.20 -0.20 0.16 0.00 4.57 -0.92 -0.02 114.58 119.37 1u15 h GLU 258 Ca 0.43 0.01 0.02 0.00 -1.18 0.00 0.00 59.36 58.64 1u15 h GLU 258 Cb 0.14 0.05 -0.03 0.00 -0.16 0.00 0.00 28.75 28.74 1u15 h GLU 258 CO -0.16 -0.01 -0.30 -0.44 -1.18 0.00 0.00 179.01 176.91 1u15 h ASP 259 N -0.37 -0.86 -0.81 1.04 3.32 -0.79 -0.28 116.42 117.67 1u15 h ASP 259 Ca -0.02 0.09 0.01 0.00 0.02 0.00 0.00 57.03 57.13 1u15 h ASP 259 Cb 0.29 0.32 -0.04 0.00 0.22 0.00 0.00 39.33 40.12 1u15 h ASP 259 CO 0.04 -0.40 0.53 -0.07 -1.72 0.00 0.00 179.24 177.62 1u15 h LEU 260 N -0.55 0.94 0.08 1.55 4.07 -1.23 0.46 115.31 120.63 1u15 h LEU 260 Ca 0.02 -0.03 -0.00 0.00 0.08 0.00 0.00 57.88 57.95 1u15 h LEU 260 Cb 0.56 -0.24 0.00 0.00 1.08 0.00 0.00 40.66 42.06 1u15 h LEU 260 CO -0.15 0.69 -0.04 0.40 -1.08 0.00 0.00 178.44 178.25 1u15 h ILE 261 N 1.11 1.00 -0.51 1.22 2.04 -0.64 0.08 117.51 121.81 1u15 h ILE 261 Ca 0.30 -0.29 -0.01 0.00 1.00 0.00 0.00 64.86 65.86 1u15 h ILE 261 Cb -0.12 1.19 -0.02 0.00 -0.74 0.00 0.00 36.82 37.13 1u15 h ILE 261 CO -0.06 0.07 0.28 0.40 0.00 0.00 0.00 178.15 178.84 1u15 h ILE 262 N -0.24 1.17 0.00 -0.67 2.04 -0.55 -1.95 117.51 117.31 1u15 h ILE 262 Ca -0.01 -0.43 0.00 0.00 1.00 0.00 0.00 64.86 65.41 1u15 h ILE 262 Cb 0.20 0.54 0.00 0.00 -0.74 0.00 0.00 36.82 36.82 1u15 h ILE 262 CO 0.02 0.18 0.00 1.88 0.00 0.00 0.00 178.15 180.23 1u15 h TYR 263 N 0.67 0.00 -0.01 1.37 0.05 0.09 -2.23 116.97 116.92 1u15 h TYR 263 Ca 0.18 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.96 1u15 h TYR 263 Cb 0.04 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.78 1u15 h TYR 263 CO -0.02 0.00 -0.23 -1.13 -1.05 0.00 0.00 178.16 175.74 1u15 n SER 264 N -3.02 0.78 -4.70 3.88 3.41 -0.00 -1.65 113.62 112.32 1u15 n SER 264 Ca -0.01 -0.70 -0.33 0.00 -0.26 0.00 0.00 58.87 57.58 1u15 n SER 264 Cb 0.22 0.06 0.12 0.00 -0.26 0.00 0.00 64.21 64.35 1u15 n SER 264 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 1u15 s THR 265 N -2.55 2.23 0.31 6.66 -4.23 -0.84 -4.72 115.64 112.50 1u15 s THR 265 Ca 0.24 0.10 0.12 0.00 -1.18 0.00 0.00 61.69 60.97 1u15 s THR 265 Cb 0.19 -2.47 0.04 0.00 1.34 0.00 0.00 72.50 71.60 1u15 s THR 265 CO 0.52 -0.08 1.72 0.77 -0.54 0.00 0.00 174.62 177.01 1u15 h SER 266 N -0.95 0.00 -0.16 3.99 4.64 -1.91 0.35 113.55 119.52 1u15 h SER 266 Ca -0.46 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.87 1u15 h SER 266 Cb 1.28 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.36 1u15 h SER 266 CO 0.47 0.49 0.09 -0.33 -0.87 0.00 0.00 176.83 176.68 1u15 h GLU 267 N 0.00 0.19 0.02 4.77 3.07 -1.92 -3.15 114.58 117.56 1u15 h GLU 267 Ca -0.00 -0.01 -0.04 0.00 -0.50 0.00 0.00 59.36 58.80 1u15 h GLU 267 Cb 0.89 -0.04 0.00 0.00 -0.84 0.00 0.00 28.75 28.76 1u15 h GLU 267 CO 0.06 0.13 -0.18 0.74 -1.40 0.00 0.00 179.01 178.36 1u15 h PHE 268 N 0.19 0.15 -2.32 4.33 -1.00 -1.77 -3.48 116.94 113.06 1u15 h PHE 268 Ca 0.06 -0.09 -0.38 0.00 2.81 0.00 0.00 57.97 60.37 1u15 h PHE 268 Cb -0.01 -0.01 -0.05 0.00 3.61 0.00 0.00 35.95 39.49 1u15 h PHE 268 CO -0.08 0.98 -0.46 0.41 -1.61 0.00 0.00 178.31 177.55 1u15 n GLY 269 N 1.32 0.06 0.14 -1.45 0.00 0.12 -4.92 105.19 100.46 1u15 n GLY 269 Ca -0.10 -0.09 -0.15 0.00 0.00 0.00 0.00 46.02 45.68 1u15 n GLY 269 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 1u15 h PHE 270 N 0.00 0.58 -3.68 1.61 0.04 -1.54 -3.44 116.94 110.51 1u15 h PHE 270 Ca -0.44 -0.35 -0.11 0.00 2.80 0.00 0.00 57.97 59.87 1u15 h PHE 270 Cb 1.31 -0.05 -0.07 0.00 2.20 0.00 0.00 35.95 39.34 1u15 h PHE 270 CO 0.51 1.21 -0.08 -0.48 -0.60 0.00 0.00 178.31 178.87 1u15 s LEU 271 N -7.51 0.46 -0.04 1.54 0.05 -1.14 -0.88 118.68 111.15 1u15 s LEU 271 Ca -0.05 -1.11 -0.03 0.00 0.05 0.00 0.00 54.13 52.99 1u15 s LEU 271 Cb 0.08 1.86 0.02 0.00 -2.05 0.00 0.00 46.19 46.10 1u15 s LEU 271 CO 0.88 -1.27 0.10 -0.89 -0.55 0.00 0.00 176.35 174.62 1u15 s THR 272 N -3.50 -0.03 0.56 5.48 2.01 0.79 -4.37 115.64 116.58 1u15 s THR 272 Ca 0.23 0.11 -0.09 0.00 0.31 0.00 0.00 61.69 62.26 1u15 s THR 272 Cb -0.01 -0.17 -0.04 0.00 0.01 0.00 0.00 72.50 72.29 1u15 s THR 272 CO 0.13 0.04 0.93 -0.76 -0.69 0.00 0.00 174.62 174.26 1u15 s LEU 273 N 0.65 3.40 0.80 4.42 1.43 -1.26 -0.26 118.68 127.85 1u15 s LEU 273 Ca -0.05 1.21 -0.12 0.00 -1.03 0.00 0.00 54.13 54.14 1u15 s LEU 273 Cb -0.07 -4.22 0.07 0.00 0.03 0.00 0.00 46.19 42.00 1u15 s LEU 273 CO -0.03 -0.75 1.11 -0.94 0.23 0.00 0.00 176.35 175.98 1u15 s SER 274 N -4.15 4.56 0.29 2.29 1.04 -1.26 -4.85 113.70 111.62 1u15 s SER 274 Ca 0.52 1.16 0.01 0.00 0.48 0.00 0.00 55.95 58.12 1u15 s SER 274 Cb -0.11 -1.86 0.43 0.00 0.10 0.00 0.00 66.02 64.59 1u15 s SER 274 CO 0.50 -1.91 1.78 0.44 0.98 0.00 0.00 173.24 175.03 1u15 h ASP 275 N -1.05 0.60 -0.69 7.02 3.32 -1.94 -2.38 116.42 121.29 1u15 h ASP 275 Ca -0.47 -0.15 0.18 0.00 0.02 0.00 0.00 57.03 56.60 1u15 h ASP 275 Cb 1.28 -0.16 -0.04 0.00 0.22 0.00 0.00 39.33 40.64 1u15 h ASP 275 CO 0.61 0.72 0.48 0.00 -1.72 0.00 0.00 179.24 179.34 1u15 h ALA 276 N 1.34 2.44 -0.13 3.45 0.00 -2.00 -1.67 119.26 122.69 1u15 h ALA 276 Ca 0.11 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.97 1u15 h ALA 276 Cb 0.49 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.27 1u15 h ALA 276 CO 0.03 -0.64 -0.13 1.19 0.00 0.00 0.00 179.25 179.70 1u15 n PHE 277 N -4.40 0.42 -4.34 0.00 3.01 -0.92 -5.03 117.46 106.21 1u15 n PHE 277 Ca 0.13 -1.22 -0.21 0.00 1.01 0.00 0.00 57.45 57.16 1u15 n PHE 277 Cb 0.66 -0.28 -0.08 0.00 -0.01 0.00 0.00 39.48 39.77 1u15 n PHE 277 CO 0.00 0.00 0.00 -1.13 1.01 0.00 0.00 176.76 176.64 1u15 n SER 278 N -1.11 -0.23 -4.13 4.37 3.41 -0.63 -3.23 113.62 112.08 1u15 n SER 278 Ca 0.21 -3.21 -0.09 0.00 -0.26 0.00 0.00 58.87 55.52 1u15 n SER 278 Cb 0.79 1.53 -0.10 0.00 -0.26 0.00 0.00 64.21 66.17 1u15 n SER 278 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 1u15 s THR 279 N -3.31 0.34 -0.62 6.66 2.01 -0.01 -4.86 115.64 115.84 1u15 s THR 279 Ca 0.36 -1.86 0.00 0.00 0.31 0.00 0.00 61.69 60.49 1u15 s THR 279 Cb 0.02 -1.67 0.00 0.00 0.01 0.00 0.00 72.50 70.86 1u15 s THR 279 CO 0.25 -0.86 0.00 0.61 -0.69 0.00 0.00 174.62 173.93 1u15 n GLY 280 N 0.02 -1.29 3.09 4.40 0.00 -1.26 0.11 105.19 110.27 1u15 n GLY 280 Ca -0.12 -0.95 -0.12 0.00 0.00 0.00 0.00 46.02 44.83 1u15 n GLY 280 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1u15 s SER 281 N -1.95 0.91 0.63 1.61 1.04 -1.26 -5.01 113.70 109.66 1u15 s SER 281 Ca 0.00 -0.70 0.34 0.00 0.48 0.00 0.00 55.95 56.07 1u15 s SER 281 Cb 0.00 0.06 1.95 0.00 0.10 0.00 0.00 66.02 68.13 1u15 s SER 281 CO 0.00 -0.30 2.20 0.77 0.98 0.00 0.00 173.24 176.89 1u15 h SER 282 N 3.99 0.00 0.47 7.02 4.64 -1.99 -0.28 113.55 127.40 1u15 h SER 282 Ca -0.35 0.00 -0.08 0.00 -0.47 0.00 0.00 61.79 60.89 1u15 h SER 282 Cb 1.19 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.27 1u15 h SER 282 CO 0.49 0.00 -0.36 -0.07 -0.87 0.00 0.00 176.83 176.02 1u15 h LEU 283 N 0.00 0.00 -5.90 5.97 4.07 -2.02 -3.32 115.31 114.11 1u15 h LEU 283 Ca 0.03 0.00 -0.51 0.00 0.08 0.00 0.00 57.88 57.48 1u15 h LEU 283 Cb 0.24 0.00 -0.40 0.00 1.08 0.00 0.00 40.66 41.58 1u15 h LEU 283 CO -0.00 0.36 -1.10 0.23 -1.08 0.00 0.00 178.44 176.86 1u15 n MET 284 N -3.93 1.30 -0.38 1.13 2.81 -0.14 -5.01 117.12 112.91 1u15 n MET 284 Ca -0.02 -3.61 0.35 0.00 -1.81 0.00 0.00 57.70 52.62 1u15 n MET 284 Cb 0.42 -1.74 0.61 0.00 -0.71 0.00 0.00 33.22 31.80 1u15 n MET 284 CO 0.00 0.00 0.00 -0.35 1.51 0.00 0.00 175.97 177.13 1u15 n PRO 285 N 0.34 -0.05 0.10 0.03 -0.04 -1.05 -0.74 135.00 133.59 1u15 n PRO 285 Ca 0.26 1.29 -0.03 0.00 -0.04 0.00 0.00 63.50 64.98 1u15 n PRO 285 Cb 0.60 -2.41 0.03 0.00 -0.04 0.00 0.00 33.50 31.68 1u15 n PRO 285 CO 0.00 0.00 0.00 1.96 -0.04 0.00 0.00 175.50 177.42 1u15 h GLN 286 N 0.00 0.00 -6.47 0.54 7.50 -1.95 -3.44 115.11 111.29 1u15 h GLN 286 Ca 0.84 0.00 -0.53 0.00 0.50 0.00 0.00 58.65 59.46 1u15 h GLN 286 Cb 2.44 0.00 0.02 0.00 0.05 0.00 0.00 27.48 29.99 1u15 h GLN 286 CO -0.62 0.77 0.93 0.21 -1.50 0.00 0.00 178.83 178.61 1u15 s LYS 287 N -3.11 4.23 -0.13 1.46 2.20 0.08 -4.99 119.74 119.48 1u15 s LYS 287 Ca 0.00 2.25 0.01 0.00 -0.36 0.00 0.00 55.97 57.87 1u15 s LYS 287 Cb 0.11 -3.50 0.02 0.00 -1.51 0.00 0.00 37.83 32.95 1u15 s LYS 287 CO 0.78 -0.66 -0.16 0.15 -0.36 0.00 0.00 175.35 175.10 1u15 s LYS 288 N 2.24 2.36 -0.32 4.03 1.02 -1.26 -4.56 119.74 123.25 1u15 s LYS 288 Ca 0.71 -0.60 -0.19 0.00 0.02 0.00 0.00 55.97 55.91 1u15 s LYS 288 Cb -0.39 -2.05 -0.01 0.00 -0.52 0.00 0.00 37.83 34.87 1u15 s LYS 288 CO 0.31 -0.12 0.56 -0.80 -0.92 0.00 0.00 175.35 174.37 1u15 s ASN 289 N 1.16 6.39 -0.51 2.83 0.01 0.30 -4.85 114.94 120.27 1u15 s ASN 289 Ca -0.02 0.20 -0.04 0.00 -0.71 0.00 0.00 52.86 52.29 1u15 s ASN 289 Cb -0.14 -2.29 -0.06 0.00 0.41 0.00 0.00 41.25 39.17 1u15 s ASN 289 CO -0.05 -0.46 1.83 -0.81 -1.51 0.00 0.00 177.10 176.09 1u15 n PRO 290 N 5.79 1.38 -0.23 -0.60 -0.04 -1.26 -0.83 135.00 139.20 1u15 n PRO 290 Ca -0.03 -1.01 -0.00 0.00 -0.04 0.00 0.00 63.50 62.42 1u15 n PRO 290 Cb 0.49 -2.17 0.11 0.00 -0.04 0.00 0.00 33.50 31.89 1u15 n PRO 290 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 1u15 h ASP 291 N 6.21 0.48 -0.26 3.54 5.19 -1.90 -1.71 116.42 127.97 1u15 h ASP 291 Ca 0.30 0.05 0.06 0.00 -0.62 0.00 0.00 57.03 56.81 1u15 h ASP 291 Cb 0.25 -0.04 -0.06 0.00 0.18 0.00 0.00 39.33 39.66 1u15 h ASP 291 CO 1.09 0.29 -0.16 0.77 -3.12 0.00 0.00 179.24 178.11 1u15 h SER 292 N 0.62 -0.52 -0.14 6.45 4.64 -1.80 0.24 113.55 123.03 1u15 h SER 292 Ca 0.32 0.11 -0.09 0.00 -0.47 0.00 0.00 61.79 61.66 1u15 h SER 292 Cb 0.28 0.27 -0.01 0.00 -0.31 0.00 0.00 62.40 62.63 1u15 h SER 292 CO -0.23 -0.19 -0.20 -0.07 -0.87 0.00 0.00 176.83 175.26 1u15 h LEU 293 N -0.14 0.56 -0.43 5.97 3.38 -1.71 -2.58 115.31 120.36 1u15 h LEU 293 Ca 0.14 -0.18 -0.08 0.00 0.09 0.00 0.00 57.88 57.86 1u15 h LEU 293 Cb 0.35 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 40.93 1u15 h LEU 293 CO -0.34 0.77 -0.02 -0.33 0.09 0.00 0.00 178.44 178.61 1u15 h GLU 294 N 0.51 0.78 -0.53 1.13 5.08 -0.54 -0.87 114.58 120.14 1u15 h GLU 294 Ca 0.08 -0.26 0.01 0.00 -1.00 0.00 0.00 59.36 58.19 1u15 h GLU 294 Cb 0.63 -0.06 -0.03 0.00 0.50 0.00 0.00 28.75 29.79 1u15 h GLU 294 CO 0.04 0.86 0.34 -0.07 -1.00 0.00 0.00 179.01 179.19 1u15 h LEU 295 N 0.62 0.58 0.35 1.33 3.38 -0.50 -2.10 115.31 118.96 1u15 h LEU 295 Ca 0.12 -0.01 -0.02 0.00 0.09 0.00 0.00 57.88 58.06 1u15 h LEU 295 Cb 0.52 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.14 1u15 h LEU 295 CO 0.03 0.42 -0.17 0.40 0.09 0.00 0.00 178.44 179.20 1u15 h ILE 296 N 0.69 0.65 -0.96 1.22 2.04 -1.23 -2.63 117.51 117.29 1u15 h ILE 296 Ca 0.20 0.00 0.13 0.00 1.00 0.00 0.00 64.86 66.19 1u15 h ILE 296 Cb -0.05 0.65 -0.09 0.00 -0.74 0.00 0.00 36.82 36.59 1u15 h ILE 296 CO -0.06 0.00 0.59 -0.09 0.00 0.00 0.00 178.15 178.59 1u15 h ARG 297 N -0.47 0.88 -0.16 2.37 2.43 -1.03 -1.45 114.38 116.94 1u15 h ARG 297 Ca -0.05 -0.05 -0.05 0.00 -0.81 0.00 0.00 59.98 59.02 1u15 h ARG 297 Cb 0.36 -0.20 -0.01 0.00 -0.42 0.00 0.00 29.97 29.70 1u15 h ARG 297 CO 0.08 0.58 -0.14 0.66 -1.51 0.00 0.00 179.97 179.64 1u15 h SER 298 N 0.90 0.24 0.36 -3.80 4.64 -1.18 -2.57 113.55 112.14 1u15 h SER 298 Ca 0.49 -0.05 0.00 0.00 -0.47 0.00 0.00 61.79 61.76 1u15 h SER 298 Cb 0.54 -0.06 0.00 0.00 -0.31 0.00 0.00 62.40 62.56 1u15 h SER 298 CO -0.29 0.41 0.00 0.11 -0.87 0.00 0.00 176.83 176.19 1u15 h LYS 299 N 0.24 0.00 -0.73 4.77 1.79 -0.89 -1.66 116.57 120.09 1u15 h LYS 299 Ca 0.05 0.00 0.03 0.00 -2.18 0.00 0.00 60.65 58.55 1u15 h LYS 299 Cb 0.40 0.00 -0.05 0.00 -1.58 0.00 0.00 32.23 31.00 1u15 h LYS 299 CO 0.02 0.00 0.46 0.00 -1.08 0.00 0.00 179.45 178.85 1u15 h ALA 300 N 2.02 0.96 0.17 3.86 0.00 -1.51 0.18 119.26 124.94 1u15 h ALA 300 Ca 0.00 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 1u15 h ALA 300 Cb 0.18 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.74 1u15 h ALA 300 CO 0.00 0.23 -0.08 0.78 0.00 0.00 0.00 179.25 180.18 1u15 h GLY 301 N 0.88 -0.24 0.22 0.00 0.00 -1.48 -0.96 103.07 101.49 1u15 h GLY 301 Ca 0.30 0.09 0.06 0.00 0.00 0.00 0.00 47.33 47.78 1u15 h GLY 301 CO -0.12 -0.09 -0.18 -0.09 0.00 0.00 0.00 176.54 176.06 1u15 h ARG 302 N -0.52 -0.16 -0.67 4.80 2.43 -1.40 0.37 114.38 119.24 1u15 h ARG 302 Ca -0.02 0.01 -0.05 0.00 -0.81 0.00 0.00 59.98 59.11 1u15 h ARG 302 Cb 0.40 0.04 -0.03 0.00 -0.42 0.00 0.00 29.97 29.95 1u15 h ARG 302 CO 0.04 -0.11 0.23 0.28 -1.51 0.00 0.00 179.97 178.91 1u15 h VAL 303 N -0.17 1.24 -0.19 0.20 2.07 -0.66 -1.94 116.25 116.81 1u15 h VAL 303 Ca 0.15 -0.79 -0.06 0.00 0.82 0.00 0.00 66.70 66.81 1u15 h VAL 303 Cb 0.39 0.48 -0.01 0.00 -1.52 0.00 0.00 31.29 30.62 1u15 h VAL 303 CO -0.37 0.31 -0.16 0.15 0.02 0.00 0.00 177.57 177.53 1u15 h PHE 304 N 0.98 0.33 -0.59 1.57 3.57 0.11 -2.34 116.94 120.56 1u15 h PHE 304 Ca 0.22 -0.05 0.01 0.00 3.53 0.00 0.00 57.97 61.68 1u15 h PHE 304 Cb 0.24 -0.09 -0.03 0.00 2.79 0.00 0.00 35.95 38.86 1u15 h PHE 304 CO 0.02 0.46 0.39 0.78 -2.23 0.00 0.00 178.31 177.73 1u15 h GLY 305 N 0.85 0.83 0.95 2.40 0.00 0.48 -0.73 103.07 107.84 1u15 h GLY 305 Ca 0.05 -0.31 0.01 0.00 0.00 0.00 0.00 47.33 47.09 1u15 h GLY 305 CO 0.03 0.30 0.35 3.21 0.00 0.00 0.00 176.54 180.44 1u15 h ARG 306 N 0.80 0.69 -0.47 4.80 2.47 -1.14 0.33 114.38 121.86 1u15 h ARG 306 Ca 0.22 -0.04 -0.01 0.00 -1.26 0.00 0.00 59.98 58.89 1u15 h ARG 306 Cb -0.09 -0.16 -0.02 0.00 -1.65 0.00 0.00 29.97 28.05 1u15 h ARG 306 CO -0.05 0.46 0.26 1.25 0.56 0.00 0.00 179.97 182.45 1u15 h LEU 307 N 0.71 0.58 -0.02 3.04 5.85 -1.14 -1.84 115.31 122.49 1u15 h LEU 307 Ca 0.21 -0.08 0.00 0.00 0.84 0.00 0.00 57.88 58.85 1u15 h LEU 307 Cb -0.04 -0.15 -0.00 0.00 0.37 0.00 0.00 40.66 40.84 1u15 h LEU 307 CO -0.07 0.50 0.01 0.00 -0.34 0.00 0.00 178.44 178.54 1u15 h ALA 308 N 1.11 0.03 -0.41 1.25 0.00 -0.53 -1.92 119.26 118.79 1u15 h ALA 308 Ca 0.17 -0.01 0.08 0.00 0.00 0.00 0.00 54.91 55.15 1u15 h ALA 308 Cb 0.04 -0.01 -0.08 0.00 0.00 0.00 0.00 17.79 17.75 1u15 h ALA 308 CO -0.03 -0.47 -0.08 1.03 0.00 0.00 0.00 179.25 179.70 1u15 h SER 309 N 0.02 -0.34 0.07 0.00 0.87 -0.78 -1.17 113.55 112.22 1u15 h SER 309 Ca 0.01 0.12 -0.13 0.00 -1.23 0.00 0.00 61.79 60.56 1u15 h SER 309 Cb 0.01 0.24 -0.01 0.00 -0.44 0.00 0.00 62.40 62.20 1u15 h SER 309 CO -0.00 -0.12 -0.42 0.40 -0.53 0.00 0.00 176.83 176.15 1u15 h ILE 310 N 0.02 1.31 -0.64 2.23 1.08 -1.21 -1.29 117.51 119.01 1u15 h ILE 310 Ca 0.20 -1.59 -0.03 0.00 -0.39 0.00 0.00 64.86 63.04 1u15 h ILE 310 Cb 0.30 1.63 -0.03 0.00 -3.07 0.00 0.00 36.82 35.65 1u15 h ILE 310 CO -0.41 0.49 0.27 -0.07 -0.69 0.00 0.00 178.15 177.75 1u15 h LEU 311 N 0.36 0.87 -0.55 1.44 3.38 -0.76 -1.97 115.31 118.07 1u15 h LEU 311 Ca 0.03 -0.16 -0.07 0.00 0.09 0.00 0.00 57.88 57.77 1u15 h LEU 311 Cb 0.90 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 41.40 1u15 h LEU 311 CO 0.08 0.78 0.08 -0.03 0.09 0.00 0.00 178.44 179.44 1u15 h MET 312 N 0.89 0.92 -0.91 1.13 4.05 -0.94 -1.98 114.93 118.09 1u15 h MET 312 Ca 0.21 -0.25 0.06 0.00 -0.28 0.00 0.00 59.70 59.44 1u15 h MET 312 Cb 0.18 -0.10 -0.06 0.00 -0.80 0.00 0.00 31.60 30.81 1u15 h MET 312 CO -0.02 0.90 0.58 0.28 0.23 0.00 0.00 176.91 178.87 1u15 h VAL 313 N 0.81 1.08 0.00 -5.77 2.07 -0.91 -2.95 116.25 110.59 1u15 h VAL 313 Ca 0.17 -0.37 -0.18 0.00 0.82 0.00 0.00 66.70 67.14 1u15 h VAL 313 Cb 0.43 -0.08 -0.03 0.00 -1.52 0.00 0.00 31.29 30.09 1u15 h VAL 313 CO 0.01 0.19 -0.97 -0.07 0.02 0.00 0.00 177.57 176.76 1u15 h LEU 314 N 1.07 0.00 -9.41 2.57 3.38 -1.23 -3.44 115.31 108.26 1u15 h LEU 314 Ca 0.39 0.00 -0.56 0.00 0.09 0.00 0.00 57.88 57.80 1u15 h LEU 314 Cb 0.13 0.00 0.03 0.00 0.09 0.00 0.00 40.66 40.92 1u15 h LEU 314 CO -0.16 0.78 1.12 1.17 0.09 0.00 0.00 178.44 181.44 1u15 n LYS 315 N -3.22 2.61 -0.97 1.13 0.00 -0.76 -2.10 118.16 114.86 1u15 n LYS 315 Ca -0.03 0.95 0.00 0.00 0.00 0.00 0.00 58.31 59.24 1u15 n LYS 315 Cb 0.87 -2.84 0.00 0.00 0.00 0.00 0.00 35.03 33.06 1u15 n LYS 315 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1u15 n GLY 316 N 4.30 0.81 3.78 3.14 0.00 -1.26 -5.00 105.19 110.96 1u15 n GLY 316 Ca 0.20 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.85 1u15 n GLY 316 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1u15 s LEU 317 N 0.00 4.07 0.45 0.99 1.43 -0.89 -5.04 118.68 119.70 1u15 s LEU 317 Ca 0.00 2.18 -0.03 0.00 -1.03 0.00 0.00 54.13 55.25 1u15 s LEU 317 Cb 0.00 -4.22 -0.03 0.00 0.03 0.00 0.00 46.19 41.98 1u15 s LEU 317 CO 0.00 -0.72 0.72 -2.16 0.23 0.00 0.00 176.35 174.43 1u15 s PRO 318 N -2.61 3.41 0.42 1.29 0.04 -1.26 -5.06 135.00 131.23 1u15 s PRO 318 Ca 0.61 -0.04 -0.23 0.00 0.04 0.00 0.00 61.00 61.38 1u15 s PRO 318 Cb -0.25 -2.46 -0.09 0.00 0.04 0.00 0.00 34.50 31.74 1u15 s PRO 318 CO 0.31 -0.17 1.04 -1.12 0.04 0.00 0.00 177.00 177.10 1u15 s SER 319 N -4.12 6.67 0.00 6.66 0.01 -1.26 -4.71 113.70 116.95 1u15 s SER 319 Ca 0.46 1.99 0.00 0.00 1.31 0.00 0.00 55.95 59.71 1u15 s SER 319 Cb -0.10 -2.58 0.00 0.00 0.21 0.00 0.00 66.02 63.55 1u15 s SER 319 CO 0.42 -0.56 0.00 0.35 0.41 0.00 0.00 173.24 173.86 1u15 n THR 320 N -0.32 0.00 -2.43 1.44 -2.24 -1.26 -5.05 114.28 104.42 1u15 n THR 320 Ca 0.06 0.00 -0.41 0.00 -2.27 0.00 0.00 64.05 61.44 1u15 n THR 320 Cb 0.51 -0.34 -0.04 0.00 -2.10 0.00 0.00 70.33 68.36 1u15 n THR 320 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 1u15 s TYR 321 N 0.00 3.51 -0.03 4.78 5.04 -1.26 -4.69 117.35 124.71 1u15 s TYR 321 Ca 0.00 1.63 -0.04 0.00 -2.44 0.00 0.00 57.07 56.22 1u15 s TYR 321 Cb 0.00 -3.34 0.01 0.00 0.35 0.00 0.00 41.96 38.98 1u15 s TYR 321 CO 0.00 -0.76 0.09 -0.80 -1.34 0.00 0.00 175.55 172.74 1u15 s ASN 322 N -0.63 -0.05 0.59 4.32 0.01 -1.26 -5.04 114.94 112.89 1u15 s ASN 322 Ca 0.46 0.07 0.29 0.00 -0.71 0.00 0.00 52.86 52.97 1u15 s ASN 322 Cb -0.33 0.19 1.51 0.00 0.41 0.00 0.00 41.25 43.04 1u15 s ASN 322 CO 0.41 -0.12 1.93 0.50 -1.51 0.00 0.00 177.10 178.31 1u15 h LYS 323 N 5.58 0.00 -0.93 -0.60 1.63 -2.02 -1.76 116.57 118.48 1u15 h LYS 323 Ca -0.26 0.00 0.14 0.00 -0.85 0.00 0.00 60.65 59.68 1u15 h LYS 323 Cb 1.20 0.00 -0.08 0.00 -0.60 0.00 0.00 32.23 32.76 1u15 h LYS 323 CO 0.44 0.00 0.59 -0.44 -3.45 0.00 0.00 179.45 176.59 1u15 h ASP 324 N 0.00 0.73 0.00 4.20 5.19 -1.96 -1.27 116.42 123.31 1u15 h ASP 324 Ca 0.18 0.05 0.00 0.00 -0.62 0.00 0.00 57.03 56.63 1u15 h ASP 324 Cb 1.03 -0.10 0.00 0.00 0.18 0.00 0.00 39.33 40.44 1u15 h ASP 324 CO -0.00 0.37 0.17 -0.07 -3.12 0.00 0.00 179.24 176.58 1u15 h LEU 325 N 0.77 0.00 0.00 1.55 3.38 -1.67 -2.45 115.31 116.89 1u15 h LEU 325 Ca 0.47 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.44 1u15 h LEU 325 Cb 0.67 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.42 1u15 h LEU 325 CO -0.23 0.00 0.00 1.67 0.09 0.00 0.00 178.44 179.97 1u15 n GLN 326 N -2.18 0.05 0.00 1.13 7.27 -0.48 -2.51 117.38 120.67 1u15 n GLN 326 Ca -0.01 0.27 0.14 0.00 0.07 0.00 0.00 57.00 57.48 1u15 n GLN 326 Cb 0.19 -1.50 0.67 0.00 2.41 0.00 0.00 30.24 32.02 1u15 n GLN 326 CO 0.00 0.00 0.00 0.39 0.07 0.00 0.00 177.06 177.52 1u15 n GLU 327 N -1.42 0.24 0.14 3.69 -0.58 -0.92 -4.04 120.64 117.74 1u15 n GLU 327 Ca 0.03 -0.01 -0.14 0.00 -0.42 0.00 0.00 57.16 56.63 1u15 n GLU 327 Cb 0.11 -1.50 -0.08 0.00 -0.57 0.00 0.00 31.44 29.40 1u15 n GLU 327 CO 0.00 0.00 0.00 0.38 -0.48 0.00 0.00 177.13 177.03 1u15 h ASP 328 N 0.03 -0.29 -0.99 1.62 2.03 -1.76 -3.32 116.42 113.75 1u15 h ASP 328 Ca 0.00 -0.15 0.10 0.00 -0.73 0.00 0.00 57.03 56.24 1u15 h ASP 328 Cb 0.39 0.07 -0.12 0.00 -0.83 0.00 0.00 39.33 38.84 1u15 h ASP 328 CO 0.00 -0.00 -0.55 0.29 -1.03 0.00 0.00 179.24 177.95 1u15 n LYS 329 N -5.13 -0.40 -0.24 4.15 5.02 -1.26 -1.70 118.16 118.60 1u15 n LYS 329 Ca -0.09 1.49 -0.06 0.00 -2.02 0.00 0.00 58.31 57.63 1u15 n LYS 329 Cb 0.23 -2.20 0.04 0.00 -0.02 0.00 0.00 35.03 33.08 1u15 n LYS 329 CO 0.00 0.00 0.00 1.49 -0.52 0.00 0.00 177.40 178.37 1u15 h GLU 330 N 0.00 0.95 -0.32 1.97 4.81 -1.84 -1.66 114.58 118.49 1u15 h GLU 330 Ca 0.19 -0.13 0.00 0.00 -0.13 0.00 0.00 59.36 59.29 1u15 h GLU 330 Cb 0.43 -0.18 -0.02 0.00 0.63 0.00 0.00 28.75 29.62 1u15 h GLU 330 CO -0.93 0.73 0.21 0.00 -0.73 0.00 0.00 179.01 178.29 1u15 h ALA 331 N 1.16 0.41 0.31 2.92 0.00 -1.45 0.08 119.26 122.69 1u15 h ALA 331 Ca 0.23 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 55.10 1u15 h ALA 331 Cb 0.08 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.74 1u15 h ALA 331 CO -0.03 -0.13 -0.15 0.28 0.00 0.00 0.00 179.25 179.22 1u15 h VAL 332 N 0.44 0.69 -1.00 0.00 2.07 -1.11 -1.01 116.25 116.34 1u15 h VAL 332 Ca 0.12 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.69 1u15 h VAL 332 Cb -0.05 0.69 -0.06 0.00 -1.52 0.00 0.00 31.29 30.35 1u15 h VAL 332 CO -0.03 0.00 0.65 0.40 0.02 0.00 0.00 177.57 178.61 1u15 h ILE 333 N -0.42 1.12 -0.57 4.57 2.04 -1.17 0.46 117.51 123.55 1u15 h ILE 333 Ca -0.04 -0.42 -0.06 0.00 1.00 0.00 0.00 64.86 65.34 1u15 h ILE 333 Cb 0.32 -0.19 -0.02 0.00 -0.74 0.00 0.00 36.82 36.19 1u15 h ILE 333 CO 0.07 0.22 0.11 -0.78 0.00 0.00 0.00 178.15 177.77 1u15 h ASP 334 N 1.21 0.89 -0.01 1.72 -0.00 -0.64 -2.32 116.42 117.27 1u15 h ASP 334 Ca 0.42 -0.25 -0.17 0.00 -0.00 0.00 0.00 57.03 57.03 1u15 h ASP 334 Cb 0.09 -0.24 -0.00 0.00 -0.00 0.00 0.00 39.33 39.18 1u15 h ASP 334 CO -0.15 0.91 -0.56 0.58 -0.00 0.00 0.00 179.24 180.02 1u15 h VAL 335 N 0.84 1.32 0.00 2.25 2.07 -0.51 -1.42 116.25 120.79 1u15 h VAL 335 Ca 0.18 -1.81 0.02 0.00 0.82 0.00 0.00 66.70 65.91 1u15 h VAL 335 Cb 0.39 1.77 -0.02 0.00 -1.52 0.00 0.00 31.29 31.91 1u15 h VAL 335 CO 0.01 0.56 -0.11 0.58 0.02 0.00 0.00 177.57 178.63 1u15 h VAL 336 N 0.45 0.72 -0.12 2.57 2.07 -0.81 0.26 116.25 121.40 1u15 h VAL 336 Ca 0.01 0.00 -0.11 0.00 0.82 0.00 0.00 66.70 67.42 1u15 h VAL 336 Cb 1.11 0.72 -0.01 0.00 -1.52 0.00 0.00 31.29 31.60 1u15 h VAL 336 CO 0.11 0.00 -0.42 0.44 0.02 0.00 0.00 177.57 177.72 1u15 h ASP 337 N -0.19 0.28 -0.16 0.57 3.32 -1.38 -1.66 116.42 117.21 1u15 h ASP 337 Ca 0.04 -0.12 -0.04 0.00 0.02 0.00 0.00 57.03 56.93 1u15 h ASP 337 Cb 0.24 -0.08 -0.00 0.00 0.22 0.00 0.00 39.33 39.70 1u15 h ASP 337 CO -0.11 0.67 -0.07 0.74 -1.72 0.00 0.00 179.24 178.76 1u15 h THR 338 N 0.23 1.31 -0.66 0.35 2.02 -0.95 -2.73 112.91 112.47 1u15 h THR 338 Ca 0.02 -1.09 0.00 0.00 0.77 0.00 0.00 66.41 66.11 1u15 h THR 338 Cb 0.84 1.70 -0.03 0.00 -1.74 0.00 0.00 68.15 68.91 1u15 h THR 338 CO 0.07 0.32 0.42 -0.07 0.37 0.00 0.00 175.52 176.63 1u15 h LEU 339 N -0.00 0.77 -0.51 2.58 3.38 -0.36 -2.02 115.31 119.15 1u15 h LEU 339 Ca 0.04 -0.03 0.01 0.00 0.09 0.00 0.00 57.88 57.98 1u15 h LEU 339 Cb 0.53 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 41.06 1u15 h LEU 339 CO 0.02 0.57 0.32 0.74 0.09 0.00 0.00 178.44 180.19 1u15 h THR 340 N 0.90 1.10 0.22 0.22 2.02 -1.24 -2.00 112.91 114.12 1u15 h THR 340 Ca 0.24 -0.23 -0.01 0.00 0.77 0.00 0.00 66.41 67.18 1u15 h THR 340 Cb -0.08 0.39 0.00 0.00 -1.74 0.00 0.00 68.15 66.72 1u15 h THR 340 CO -0.05 0.12 -0.10 0.00 0.37 0.00 0.00 175.52 175.86 1u15 h ALA 341 N 1.20 -0.29 -0.79 6.16 0.00 -1.42 -3.12 119.26 121.01 1u15 h ALA 341 Ca 0.19 -0.20 0.18 0.00 0.00 0.00 0.00 54.91 55.09 1u15 h ALA 341 Cb -0.04 0.11 -0.14 0.00 0.00 0.00 0.00 17.79 17.72 1u15 h ALA 341 CO -0.06 -0.35 0.02 0.28 0.00 0.00 0.00 179.25 179.14 1u15 h VAL 342 N -0.91 0.31 -0.63 0.00 2.07 -1.37 0.72 116.25 116.43 1u15 h VAL 342 Ca -0.03 -0.04 -0.02 0.00 0.82 0.00 0.00 66.70 67.44 1u15 h VAL 342 Cb 0.50 0.20 -0.03 0.00 -1.52 0.00 0.00 31.29 30.43 1u15 h VAL 342 CO 0.05 0.02 0.33 -0.07 0.02 0.00 0.00 177.57 177.91 1u15 h LEU 343 N 0.10 0.80 -0.38 2.57 3.38 -1.45 -0.07 115.31 120.27 1u15 h LEU 343 Ca 0.44 -0.11 -0.08 0.00 0.09 0.00 0.00 57.88 58.21 1u15 h LEU 343 Cb 0.79 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.32 1u15 h LEU 343 CO -0.69 0.69 -0.09 1.56 0.09 0.00 0.00 178.44 180.00 1u15 h GLN 344 N 0.86 0.73 -0.76 1.13 4.20 -1.10 -1.87 115.11 118.31 1u15 h GLN 344 Ca 0.22 -0.28 -0.02 0.00 0.06 0.00 0.00 58.65 58.63 1u15 h GLN 344 Cb 0.08 -0.04 -0.04 0.00 0.30 0.00 0.00 27.48 27.78 1u15 h GLN 344 CO -0.03 0.88 0.41 0.28 -0.67 0.00 0.00 178.83 179.69 1u15 h VAL 345 N 0.54 1.23 0.27 -0.54 2.07 -0.70 -0.87 116.25 118.24 1u15 h VAL 345 Ca 0.10 -0.57 -0.01 0.00 0.82 0.00 0.00 66.70 67.03 1u15 h VAL 345 Cb 0.60 0.21 0.00 0.00 -1.52 0.00 0.00 31.29 30.58 1u15 h VAL 345 CO 0.04 0.26 -0.13 0.00 0.02 0.00 0.00 177.57 177.75 1u15 h ALA 346 N 1.39 -0.36 -0.80 1.67 0.00 -0.83 -1.09 119.26 119.23 1u15 h ALA 346 Ca 0.27 -0.13 0.15 0.00 0.00 0.00 0.00 54.91 55.20 1u15 h ALA 346 Cb 0.04 0.14 -0.10 0.00 0.00 0.00 0.00 17.79 17.87 1u15 h ALA 346 CO -0.04 -0.63 0.36 1.15 0.00 0.00 0.00 179.25 180.09 1u15 h THR 347 N -0.51 0.67 -0.39 0.00 2.02 -1.01 0.11 112.91 113.81 1u15 h THR 347 Ca -0.04 -0.18 -0.07 0.00 0.77 0.00 0.00 66.41 66.90 1u15 h THR 347 Cb 0.38 0.11 -0.02 0.00 -1.74 0.00 0.00 68.15 66.88 1u15 h THR 347 CO 0.06 0.09 -0.06 1.23 0.37 0.00 0.00 175.52 177.22 1u15 h GLY 348 N 0.51 0.69 0.72 2.16 0.00 -0.97 -2.24 103.07 103.94 1u15 h GLY 348 Ca 0.45 -0.47 -0.03 0.00 0.00 0.00 0.00 47.33 47.27 1u15 h GLY 348 CO -0.40 0.43 -0.05 -2.08 0.00 0.00 0.00 176.54 174.45 1u15 h VAL 349 N 0.60 1.31 0.56 4.60 2.07 0.50 -1.95 116.25 123.95 1u15 h VAL 349 Ca 0.11 -1.06 -0.03 0.00 0.82 0.00 0.00 66.70 66.55 1u15 h VAL 349 Cb 0.47 1.76 0.01 0.00 -1.52 0.00 0.00 31.29 32.00 1u15 h VAL 349 CO 0.02 0.30 -0.27 0.40 0.02 0.00 0.00 177.57 178.05 1u15 h ILE 350 N -0.09 0.40 -0.72 4.57 1.08 -1.21 -2.15 117.51 119.39 1u15 h ILE 350 Ca 0.03 -0.19 0.05 0.00 -0.39 0.00 0.00 64.86 64.36 1u15 h ILE 350 Cb 0.50 0.48 -0.04 0.00 -3.07 0.00 0.00 36.82 34.69 1u15 h ILE 350 CO 0.02 0.03 0.48 0.77 -0.69 0.00 0.00 178.15 178.75 1u15 h SER 351 N -0.89 0.70 -0.01 1.72 4.64 -1.48 -2.86 113.55 115.37 1u15 h SER 351 Ca -0.08 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.24 1u15 h SER 351 Cb 0.63 -0.15 0.00 0.00 -0.31 0.00 0.00 62.40 62.56 1u15 h SER 351 CO 0.13 0.47 -0.08 0.35 -0.87 0.00 0.00 176.83 176.82 1u15 n THR 352 N -4.47 0.00 -2.56 2.95 -2.24 -0.73 -4.95 114.28 102.27 1u15 n THR 352 Ca 0.10 -0.39 -0.36 0.00 -2.27 0.00 0.00 64.05 61.13 1u15 n THR 352 Cb 0.18 1.19 -0.04 0.00 -2.10 0.00 0.00 70.33 69.56 1u15 n THR 352 CO 0.00 0.00 0.00 -1.48 -0.57 0.00 0.00 175.07 173.02 1u15 s LEU 353 N -2.09 4.08 -0.11 3.22 0.05 -0.81 -4.15 118.68 118.87 1u15 s LEU 353 Ca 0.29 2.00 -0.03 0.00 0.05 0.00 0.00 54.13 56.43 1u15 s LEU 353 Cb 0.20 -4.27 -0.03 0.00 -2.05 0.00 0.00 46.19 40.04 1u15 s LEU 353 CO 0.36 -0.53 0.02 -1.10 -0.55 0.00 0.00 176.35 174.55 1u15 s GLN 354 N -2.65 3.25 0.31 1.48 -0.21 0.64 -4.97 119.66 117.50 1u15 s GLN 354 Ca 0.60 -0.37 0.08 0.00 0.02 0.00 0.00 55.36 55.68 1u15 s GLN 354 Cb -0.20 -2.91 -0.03 0.00 1.00 0.00 0.00 33.01 30.86 1u15 s GLN 354 CO 0.25 0.61 0.23 0.96 -2.12 0.00 0.00 175.29 175.22 1u15 s ILE 355 N -0.61 3.77 -0.46 1.08 -4.36 -1.26 -0.15 121.20 119.21 1u15 s ILE 355 Ca 0.10 -1.45 0.01 0.00 -0.26 0.00 0.00 60.65 59.06 1u15 s ILE 355 Cb -0.12 -3.21 0.12 0.00 1.25 0.00 0.00 42.46 40.50 1u15 s ILE 355 CO 0.02 -0.24 0.21 -0.55 0.24 0.00 0.00 174.94 174.62 1u15 s SER 356 N -3.91 4.85 0.15 4.36 0.15 -0.06 -4.93 113.70 114.30 1u15 s SER 356 Ca 0.37 -2.49 -0.17 0.00 0.70 0.00 0.00 55.95 54.37 1u15 s SER 356 Cb -0.06 -1.72 0.05 0.00 -1.71 0.00 0.00 66.02 62.58 1u15 s SER 356 CO 0.25 -0.38 1.73 0.11 1.20 0.00 0.00 173.24 176.16 1u15 h LYS 357 N 7.30 0.18 -0.38 5.44 1.57 -1.96 -1.69 116.57 127.04 1u15 h LYS 357 Ca -0.07 -0.01 0.08 0.00 -1.87 0.00 0.00 60.65 58.78 1u15 h LYS 357 Cb 0.98 -0.04 -0.09 0.00 0.08 0.00 0.00 32.23 33.16 1u15 h LYS 357 CO 0.64 0.12 -0.34 1.49 -0.57 0.00 0.00 179.45 180.79 1u15 h GLU 358 N 0.19 -0.26 -0.28 3.15 4.81 -1.97 -0.48 114.58 119.74 1u15 h GLU 358 Ca 0.15 0.02 -0.10 0.00 -0.13 0.00 0.00 59.36 59.30 1u15 h GLU 358 Cb 0.17 0.06 -0.01 0.00 0.63 0.00 0.00 28.75 29.59 1u15 h GLU 358 CO -0.20 -0.17 -0.27 -0.91 -0.73 0.00 0.00 179.01 176.73 1u15 h ASN 359 N -0.27 0.55 -0.13 1.04 2.35 -1.80 0.13 115.58 117.45 1u15 h ASN 359 Ca 0.16 -0.20 -0.05 0.00 -0.55 0.00 0.00 56.30 55.67 1u15 h ASN 359 Cb 0.55 -0.15 -0.02 0.00 0.05 0.00 0.00 38.32 38.75 1u15 h ASN 359 CO -0.53 0.80 -0.06 0.24 -1.65 0.00 0.00 177.43 176.24 1u15 h MET 360 N 0.48 0.41 0.06 0.81 2.86 -0.64 -2.47 114.93 116.43 1u15 h MET 360 Ca 0.07 -0.09 -0.18 0.00 -2.06 0.00 0.00 59.70 57.44 1u15 h MET 360 Cb 0.71 -0.06 0.02 0.00 0.06 0.00 0.00 31.60 32.33 1u15 h MET 360 CO 0.05 0.49 -0.73 1.49 1.06 0.00 0.00 176.91 179.27 1u15 h GLU 361 N 0.39 0.38 -0.06 1.72 4.22 -0.61 -3.21 114.58 117.41 1u15 h GLU 361 Ca 0.08 -0.49 0.02 0.00 0.08 0.00 0.00 59.36 59.05 1u15 h GLU 361 Cb 0.35 0.16 -0.00 0.00 0.50 0.00 0.00 28.75 29.76 1u15 h GLU 361 CO 0.02 1.18 0.11 0.87 -2.18 0.00 0.00 179.01 179.01 1u15 h LYS 362 N -0.19 0.00 0.00 1.92 1.57 -0.57 -1.32 116.57 117.98 1u15 h LYS 362 Ca -0.11 0.00 -0.07 0.00 -1.87 0.00 0.00 60.65 58.60 1u15 h LYS 362 Cb 1.48 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.78 1u15 h LYS 362 CO 0.14 0.00 -0.32 0.00 -0.57 0.00 0.00 179.45 178.70 1u15 h ALA 363 N 1.82 0.90 -2.31 3.86 0.00 -1.44 -3.44 119.26 118.66 1u15 h ALA 363 Ca 0.03 -0.29 -0.55 0.00 0.00 0.00 0.00 54.91 54.10 1u15 h ALA 363 Cb 0.26 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 1u15 h ALA 363 CO -0.00 0.40 0.92 -0.51 0.00 0.00 0.00 179.25 180.06 1u15 s LEU 364 N -6.67 4.30 0.25 0.00 1.43 -0.50 -4.87 118.68 112.62 1u15 s LEU 364 Ca 0.02 2.09 0.11 0.00 -1.03 0.00 0.00 54.13 55.32 1u15 s LEU 364 Cb 0.09 -3.55 -0.05 0.00 0.03 0.00 0.00 46.19 42.71 1u15 s LEU 364 CO 0.68 -0.79 -0.16 0.42 0.23 0.00 0.00 176.35 176.73 1u15 s THR 365 N 3.05 2.71 0.33 5.49 -4.23 -1.26 -5.03 115.64 116.69 1u15 s THR 365 Ca 0.65 -2.18 0.04 0.00 -1.18 0.00 0.00 61.69 59.02 1u15 s THR 365 Cb -0.31 -2.40 0.13 0.00 1.34 0.00 0.00 72.50 71.27 1u15 s THR 365 CO 0.25 -0.32 1.84 1.55 -0.54 0.00 0.00 174.62 177.40 1u15 h PRO 366 N 2.42 0.49 -0.67 3.99 0.13 -2.00 -2.14 132.00 134.22 1u15 h PRO 366 Ca -0.43 -0.12 0.19 0.00 -0.87 0.00 0.00 66.00 64.77 1u15 h PRO 366 Cb 1.24 -0.06 -0.03 0.00 0.13 0.00 0.00 31.00 32.29 1u15 h PRO 366 CO 0.57 0.58 0.49 0.93 -0.23 0.00 0.00 178.00 180.34 1u15 h GLU 367 N 0.46 0.00 0.00 0.86 3.07 -2.00 0.38 114.58 117.34 1u15 h GLU 367 Ca 0.09 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.95 1u15 h GLU 367 Cb 0.42 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.33 1u15 h GLU 367 CO 0.02 0.00 0.00 -1.33 -1.40 0.00 0.00 179.01 176.30 1u15 n MET 368 N -4.29 0.37 -0.28 2.33 2.81 -0.80 -3.27 117.12 113.98 1u15 n MET 368 Ca 0.13 0.07 0.09 0.00 -1.81 0.00 0.00 57.70 56.17 1u15 n MET 368 Cb 0.75 -1.50 0.24 0.00 -0.71 0.00 0.00 33.22 32.00 1u15 n MET 368 CO 0.00 0.00 0.00 1.28 1.51 0.00 0.00 175.97 178.76 1u15 n LEU 369 N -1.25 3.47 -0.08 4.03 4.77 0.13 -4.35 117.00 123.72 1u15 n LEU 369 Ca 0.11 -2.03 -0.04 0.00 -0.03 0.00 0.00 56.01 54.02 1u15 n LEU 369 Cb 0.16 -0.37 0.18 0.00 -2.33 0.00 0.00 43.42 41.07 1u15 n LEU 369 CO 0.16 0.85 0.88 0.00 -1.33 0.00 0.00 177.39 177.95 1u15 h ALA 370 N 3.11 1.14 -0.26 -1.18 0.00 -1.67 -0.35 119.26 120.05 1u15 h ALA 370 Ca 0.00 -0.26 -0.00 0.00 0.00 0.00 0.00 54.91 54.65 1u15 h ALA 370 Cb 0.89 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.48 1u15 h ALA 370 CO 0.01 0.55 0.15 1.15 0.00 0.00 0.00 179.25 181.11 1u15 h THR 371 N 0.69 1.12 -0.76 0.00 2.02 -1.85 -1.49 112.91 112.63 1u15 h THR 371 Ca 0.13 -0.30 -0.02 0.00 0.77 0.00 0.00 66.41 66.99 1u15 h THR 371 Cb 0.44 0.84 -0.04 0.00 -1.74 0.00 0.00 68.15 67.66 1u15 h THR 371 CO 0.02 0.11 0.39 0.44 0.37 0.00 0.00 175.52 176.85 1u15 h ASP 372 N 0.31 0.98 -0.02 4.18 3.45 -1.70 -1.32 116.42 122.30 1u15 h ASP 372 Ca 0.09 -0.12 0.01 0.00 0.43 0.00 0.00 57.03 57.44 1u15 h ASP 372 Cb 0.05 -0.25 -0.00 0.00 -0.56 0.00 0.00 39.33 38.57 1u15 h ASP 372 CO -0.02 0.82 0.02 0.25 -1.57 0.00 0.00 179.24 178.74 1u15 h LEU 373 N 1.06 0.00 0.12 1.55 5.85 -0.57 0.30 115.31 123.63 1u15 h LEU 373 Ca 0.26 0.00 -0.30 0.00 0.84 0.00 0.00 57.88 58.68 1u15 h LEU 373 Cb 0.08 0.00 0.03 0.00 0.37 0.00 0.00 40.66 41.14 1u15 h LEU 373 CO -0.04 0.00 -1.26 0.00 -0.34 0.00 0.00 178.44 176.80 1u15 h ALA 374 N 1.98 -0.01 0.00 1.25 0.00 -0.25 -3.06 119.26 119.17 1u15 h ALA 374 Ca 0.01 -0.78 -0.05 0.00 0.00 0.00 0.00 54.91 54.09 1u15 h ALA 374 Cb 0.05 0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 1u15 h ALA 374 CO -0.00 0.70 -0.26 -0.07 0.00 0.00 0.00 179.25 179.62 1u15 h LEU 375 N 0.27 0.00 -0.16 0.00 3.38 -0.20 -2.10 115.31 116.49 1u15 h LEU 375 Ca -0.19 0.00 0.02 0.00 0.09 0.00 0.00 57.88 57.80 1u15 h LEU 375 Cb 1.93 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 42.66 1u15 h LEU 375 CO 0.24 0.26 0.01 0.22 0.09 0.00 0.00 178.44 179.26 1u15 h TYR 376 N 0.00 0.02 -0.56 1.13 3.20 -0.36 -0.91 116.97 119.49 1u15 h TYR 376 Ca -0.00 0.01 -0.07 0.00 3.14 0.00 0.00 58.73 61.81 1u15 h TYR 376 Cb 0.57 0.02 -0.02 0.00 1.54 0.00 0.00 36.73 38.84 1u15 h TYR 376 CO 0.00 -0.01 0.08 -0.07 -1.64 0.00 0.00 178.16 176.52 1u15 h LEU 377 N 0.07 0.89 -0.11 2.82 3.38 -1.43 -3.15 115.31 117.78 1u15 h LEU 377 Ca 0.07 -0.27 0.03 0.00 0.09 0.00 0.00 57.88 57.81 1u15 h LEU 377 Cb 0.08 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.56 1u15 h LEU 377 CO -0.11 0.94 -0.09 0.58 0.09 0.00 0.00 178.44 179.85 1u15 h VAL 378 N 0.82 0.74 0.00 1.22 2.07 -1.00 -0.75 116.25 119.36 1u15 h VAL 378 Ca 0.17 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.69 1u15 h VAL 378 Cb 0.43 0.74 0.00 0.00 -1.52 0.00 0.00 31.29 30.95 1u15 h VAL 378 CO 0.01 0.00 0.00 0.54 0.02 0.00 0.00 177.57 178.14 1u15 n ARG 379 N -5.23 0.05 -0.63 1.57 1.74 -0.38 -0.34 116.66 113.45 1u15 n ARG 379 Ca -0.04 0.51 0.08 0.00 -0.77 0.00 0.00 57.85 57.64 1u15 n ARG 379 Cb 0.15 -1.66 0.34 0.00 -1.02 0.00 0.00 32.46 30.26 1u15 n ARG 379 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 1u15 n LYS 380 N -1.78 3.86 -0.23 5.56 5.02 -0.33 -4.94 118.16 125.31 1u15 n LYS 380 Ca 0.00 -2.90 0.00 0.00 -2.02 0.00 0.00 58.31 53.39 1u15 n LYS 380 Cb 0.04 -1.94 0.00 0.00 -0.02 0.00 0.00 35.03 33.11 1u15 n LYS 380 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1u15 n GLY 381 N 0.62 0.62 3.79 0.72 0.00 0.54 -5.07 105.19 106.42 1u15 n GLY 381 Ca 0.24 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.88 1u15 n GLY 381 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1u15 s MET 382 N -0.77 4.47 0.42 1.61 0.00 -0.92 -5.00 119.30 119.12 1u15 s MET 382 Ca 0.00 1.08 -0.25 0.00 0.00 0.00 0.00 55.69 56.52 1u15 s MET 382 Cb 0.00 -3.11 -0.08 0.00 0.00 0.00 0.00 34.83 31.64 1u15 s MET 382 CO 0.00 0.50 1.20 -2.14 0.00 0.00 0.00 175.02 174.57 1u15 s PRO 383 N -1.47 3.92 0.13 4.11 0.02 -1.26 -4.11 135.00 136.35 1u15 s PRO 383 Ca 0.39 1.89 -0.26 0.00 0.02 0.00 0.00 61.00 63.03 1u15 s PRO 383 Cb -0.21 -2.59 -0.06 0.00 0.02 0.00 0.00 34.50 31.66 1u15 s PRO 383 CO 0.24 -0.45 1.46 0.35 -0.33 0.00 0.00 177.00 178.27 1u15 h PHE 384 N 2.42 -1.59 -0.30 6.54 3.57 -1.96 0.96 116.94 126.58 1u15 h PHE 384 Ca -0.49 0.11 0.07 0.00 3.53 0.00 0.00 57.97 61.18 1u15 h PHE 384 Cb 1.24 0.80 -0.07 0.00 2.79 0.00 0.00 35.95 40.71 1u15 h PHE 384 CO 0.54 -0.32 -0.15 0.00 -2.23 0.00 0.00 178.31 176.14 1u15 h ARG 385 N -0.03 -0.11 -0.72 1.11 2.47 -1.98 0.70 114.38 115.82 1u15 h ARG 385 Ca 0.13 0.01 -0.03 0.00 -1.26 0.00 0.00 59.98 58.82 1u15 h ARG 385 Cb 0.36 0.02 -0.03 0.00 -1.65 0.00 0.00 29.97 28.67 1u15 h ARG 385 CO -0.77 -0.07 0.33 0.37 0.56 0.00 0.00 179.97 180.39 1u15 h GLN 386 N -0.11 1.05 -0.22 0.04 4.15 -1.81 0.20 115.11 118.40 1u15 h GLN 386 Ca 0.16 -0.16 -0.17 0.00 0.77 0.00 0.00 58.65 59.25 1u15 h GLN 386 Cb 0.35 -0.19 -0.00 0.00 0.21 0.00 0.00 27.48 27.85 1u15 h GLN 386 CO -0.37 0.82 -0.56 0.00 -1.93 0.00 0.00 178.83 176.79 1u15 h ALA 387 N 1.32 0.61 -0.01 3.38 0.00 0.19 1.00 119.26 125.75 1u15 h ALA 387 Ca 0.25 -0.52 -0.00 0.00 0.00 0.00 0.00 54.91 54.64 1u15 h ALA 387 Cb 0.14 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 17.85 1u15 h ALA 387 CO -0.03 0.69 -0.00 1.25 0.00 0.00 0.00 179.25 181.16 1u15 h HIS 388 N 0.51 0.02 -0.56 0.00 -0.00 0.81 -1.18 115.15 114.75 1u15 h HIS 388 Ca 0.01 -0.00 0.09 0.00 -0.00 0.00 0.00 60.37 60.46 1u15 h HIS 388 Cb 1.13 -0.01 -0.07 0.00 -0.00 0.00 0.00 27.41 28.46 1u15 h HIS 388 CO 0.06 0.35 0.17 1.15 -0.00 0.00 0.00 177.93 179.66 1u15 h THR 389 N -0.32 0.75 -0.71 6.26 2.02 -0.56 -0.17 112.91 120.19 1u15 h THR 389 Ca 0.00 -0.11 0.04 0.00 0.77 0.00 0.00 66.41 67.11 1u15 h THR 389 Cb 0.34 0.39 -0.05 0.00 -1.74 0.00 0.00 68.15 67.10 1u15 h THR 389 CO 0.00 0.06 0.43 0.00 0.37 0.00 0.00 175.52 176.38 1u15 h ALA 390 N 1.40 0.94 0.00 6.16 0.00 -0.61 -0.27 119.26 126.87 1u15 h ALA 390 Ca 0.28 -0.01 -0.06 0.00 0.00 0.00 0.00 54.91 55.12 1u15 h ALA 390 Cb 0.35 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 1u15 h ALA 390 CO -0.31 0.17 -0.29 1.03 0.00 0.00 0.00 179.25 179.84 1u15 h SER 391 N 0.81 0.00 -0.63 0.00 0.87 -0.17 -2.21 113.55 112.22 1u15 h SER 391 Ca 0.30 0.00 -0.08 0.00 -1.23 0.00 0.00 61.79 60.77 1u15 h SER 391 Cb 0.09 0.00 -0.03 0.00 -0.44 0.00 0.00 62.40 62.02 1u15 h SER 391 CO -0.14 0.29 0.08 1.23 -0.53 0.00 0.00 176.83 177.76 1u15 h GLY 392 N 1.08 1.16 1.30 5.77 0.00 0.69 -2.22 103.07 110.85 1u15 h GLY 392 Ca -0.00 -0.78 -0.09 0.00 0.00 0.00 0.00 47.33 46.45 1u15 h GLY 392 CO 0.04 0.73 -0.06 0.50 0.00 0.00 0.00 176.54 177.75 1u15 h LYS 393 N 1.00 0.83 -0.72 4.80 1.57 -0.76 -0.94 116.57 122.36 1u15 h LYS 393 Ca 0.19 -0.26 -0.05 0.00 -1.87 0.00 0.00 60.65 58.66 1u15 h LYS 393 Cb 0.47 -0.08 -0.03 0.00 0.08 0.00 0.00 32.23 32.67 1u15 h LYS 393 CO 0.02 0.87 0.24 0.00 -0.57 0.00 0.00 179.45 180.01 1u15 h ALA 394 N 1.17 1.07 -0.03 3.86 0.00 -1.21 0.11 119.26 124.23 1u15 h ALA 394 Ca 0.14 -0.21 -0.00 0.00 0.00 0.00 0.00 54.91 54.83 1u15 h ALA 394 Cb 0.54 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 18.05 1u15 h ALA 394 CO 0.03 0.64 0.00 0.28 0.00 0.00 0.00 179.25 180.21 1u15 h VAL 395 N 1.06 1.21 -0.72 0.00 2.07 -0.90 -1.29 116.25 117.68 1u15 h VAL 395 Ca 0.24 -0.63 0.00 0.00 0.82 0.00 0.00 66.70 67.13 1u15 h VAL 395 Cb 0.27 1.58 -0.04 0.00 -1.52 0.00 0.00 31.29 31.59 1u15 h VAL 395 CO -0.01 0.17 0.46 -0.74 0.02 0.00 0.00 177.57 177.47 1u15 h HIS 396 N -0.20 0.92 -0.36 1.57 6.17 -0.93 -1.44 115.15 120.88 1u15 h HIS 396 Ca 0.01 0.01 0.05 0.00 0.71 0.00 0.00 60.37 61.15 1u15 h HIS 396 Cb 0.27 -0.31 -0.05 0.00 2.52 0.00 0.00 27.41 29.84 1u15 h HIS 396 CO 0.01 0.59 0.08 1.25 0.71 0.00 0.00 177.93 180.58 1u15 h LEU 397 N 0.98 0.04 -0.68 0.26 6.46 -0.65 0.12 115.31 121.84 1u15 h LEU 397 Ca 0.26 0.05 0.05 0.00 -0.12 0.00 0.00 57.88 58.13 1u15 h LEU 397 Cb -0.09 0.07 -0.05 0.00 -0.73 0.00 0.00 40.66 39.86 1u15 h LEU 397 CO -0.05 0.06 0.39 0.00 -0.62 0.00 0.00 178.44 178.22 1u15 h ALA 398 N 1.26 0.91 -0.49 1.25 0.00 -0.72 0.33 119.26 121.80 1u15 h ALA 398 Ca 0.17 0.01 0.01 0.00 0.00 0.00 0.00 54.91 55.10 1u15 h ALA 398 Cb 0.18 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.80 1u15 h ALA 398 CO -0.21 0.09 0.31 0.93 0.00 0.00 0.00 179.25 180.37 1u15 h GLU 399 N 0.73 0.62 0.19 0.00 5.08 -0.12 0.63 114.58 121.71 1u15 h GLU 399 Ca 0.30 -0.04 0.01 0.00 -1.00 0.00 0.00 59.36 58.64 1u15 h GLU 399 Cb 0.16 -0.14 -0.04 0.00 0.50 0.00 0.00 28.75 29.23 1u15 h GLU 399 CO -0.17 0.41 -0.38 1.15 -1.00 0.00 0.00 179.01 179.01 1u15 h THR 400 N 0.63 0.22 0.00 1.13 2.02 0.12 0.21 112.91 117.24 1u15 h THR 400 Ca 0.19 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.37 1u15 h THR 400 Cb -0.04 0.22 0.00 0.00 -1.74 0.00 0.00 68.15 66.59 1u15 h THR 400 CO -0.06 0.00 0.00 0.29 0.37 0.00 0.00 175.52 176.12 1u15 n LYS 401 N -5.46 0.71 -3.37 6.66 5.02 0.97 -4.89 118.16 117.79 1u15 n LYS 401 Ca -0.08 0.01 -0.22 0.00 -2.02 0.00 0.00 58.31 56.01 1u15 n LYS 401 Cb 0.37 -1.50 0.06 0.00 -0.02 0.00 0.00 35.03 33.94 1u15 n LYS 401 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1u15 n GLY 402 N 0.65 -0.43 3.09 0.72 0.00 0.20 -5.01 105.19 104.41 1u15 n GLY 402 Ca 0.18 0.15 -0.22 0.00 0.00 0.00 0.00 46.02 46.13 1u15 n GLY 402 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1u15 n ILE 403 N -4.72 0.00 -2.90 -0.61 -5.35 0.15 -4.99 119.36 100.94 1u15 n ILE 403 Ca -0.02 -2.24 -0.28 0.00 -0.27 0.00 0.00 62.75 59.94 1u15 n ILE 403 Cb 0.57 0.90 -0.02 0.00 -1.74 0.00 0.00 39.64 39.36 1u15 n ILE 403 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1u15 s ALA 404 N -3.11 3.46 0.60 -1.28 0.00 -1.26 -4.33 121.76 115.84 1u15 s ALA 404 Ca 0.25 -0.49 0.39 0.00 0.00 0.00 0.00 51.96 52.11 1u15 s ALA 404 Cb 0.01 -2.51 2.14 0.00 0.00 0.00 0.00 23.12 22.76 1u15 s ALA 404 CO 0.18 -0.12 2.30 -0.84 0.00 0.00 0.00 175.76 177.28 1u15 h ILE 405 N 0.70 0.19 0.00 0.00 3.07 -1.90 -0.30 117.51 119.28 1u15 h ILE 405 Ca -0.47 -0.07 0.00 0.00 1.55 0.00 0.00 64.86 65.87 1u15 h ILE 405 Cb 1.20 1.05 0.00 0.00 -0.27 0.00 0.00 36.82 38.80 1u15 h ILE 405 CO 0.63 0.01 0.00 -0.46 -1.05 0.00 0.00 178.15 177.28 1u15 n ASN 406 N -3.34 0.20 0.02 2.16 6.94 -1.26 -2.63 115.26 117.35 1u15 n ASN 406 Ca -0.03 0.53 0.11 0.00 -0.02 0.00 0.00 54.58 55.17 1u15 n ASN 406 Cb 0.10 -0.58 -0.04 0.00 -2.36 0.00 0.00 39.78 36.90 1u15 n ASN 406 CO 0.00 0.00 0.00 0.59 -1.03 0.00 0.00 177.26 176.82 1u15 n ASN 407 N -1.70 0.58 -4.51 0.53 5.03 -0.13 -4.93 115.26 110.12 1u15 n ASN 407 Ca 0.05 -0.32 -0.36 0.00 0.87 0.00 0.00 54.58 54.82 1u15 n ASN 407 Cb 0.29 1.04 0.07 0.00 -1.02 0.00 0.00 39.78 40.17 1u15 n ASN 407 CO 0.00 0.00 0.00 0.18 -1.83 0.00 0.00 177.26 175.61 1u15 n LEU 408 N -1.94 1.72 -4.91 3.41 4.77 -1.08 -4.95 117.00 114.03 1u15 n LEU 408 Ca 0.01 0.63 -0.28 0.00 -0.03 0.00 0.00 56.01 56.35 1u15 n LEU 408 Cb 0.44 -1.27 -0.02 0.00 -2.33 0.00 0.00 43.42 40.24 1u15 n LEU 408 CO 0.42 -2.75 0.31 -0.89 -1.33 0.00 0.00 177.39 173.16 1u15 s THR 409 N -1.85 4.96 0.17 -5.08 2.01 -1.26 -4.89 115.64 109.70 1u15 s THR 409 Ca 0.68 0.10 -0.13 0.00 0.31 0.00 0.00 61.69 62.66 1u15 s THR 409 Cb -0.36 -3.80 0.07 0.00 0.01 0.00 0.00 72.50 68.43 1u15 s THR 409 CO 0.55 -0.57 1.76 0.25 -0.69 0.00 0.00 174.62 175.93 1u15 h LEU 410 N 0.98 0.75 -0.97 4.42 5.85 -1.98 0.73 115.31 125.08 1u15 h LEU 410 Ca -0.48 -0.12 -0.01 0.00 0.84 0.00 0.00 57.88 58.11 1u15 h LEU 410 Cb 1.20 -0.19 -0.04 0.00 0.37 0.00 0.00 40.66 42.00 1u15 h LEU 410 CO 0.63 0.66 0.51 -0.08 -0.34 0.00 0.00 178.44 179.82 1u15 h GLU 411 N 0.78 1.22 0.46 1.25 4.81 -1.98 0.29 114.58 121.42 1u15 h GLU 411 Ca 0.20 -0.13 -0.01 0.00 -0.13 0.00 0.00 59.36 59.29 1u15 h GLU 411 Cb 0.10 -0.25 -0.02 0.00 0.63 0.00 0.00 28.75 29.21 1u15 h GLU 411 CO -0.03 0.88 -0.44 -0.44 -0.73 0.00 0.00 179.01 178.25 1u15 h ASP 412 N 1.24 -1.20 -0.75 1.04 3.32 -1.26 -0.84 116.42 117.97 1u15 h ASP 412 Ca 0.32 0.10 -0.02 0.00 0.02 0.00 0.00 57.03 57.45 1u15 h ASP 412 Cb -0.01 0.40 -0.04 0.00 0.22 0.00 0.00 39.33 39.90 1u15 h ASP 412 CO -0.05 -0.61 0.41 -0.07 -1.72 0.00 0.00 179.24 177.20 1u15 h LEU 413 N -0.91 0.94 -0.50 1.55 3.38 0.73 -1.96 115.31 118.54 1u15 h LEU 413 Ca -0.05 -0.08 0.05 0.00 0.09 0.00 0.00 57.88 57.90 1u15 h LEU 413 Cb 0.80 -0.24 -0.05 0.00 0.09 0.00 0.00 40.66 41.26 1u15 h LEU 413 CO -0.05 0.76 0.22 0.11 0.09 0.00 0.00 178.44 179.57 1u15 h LYS 414 N 1.06 0.42 0.00 1.13 1.79 -0.14 0.19 116.57 121.03 1u15 h LYS 414 Ca 0.27 -0.03 0.00 0.00 -2.18 0.00 0.00 60.65 58.71 1u15 h LYS 414 Cb 0.03 -0.09 0.00 0.00 -1.58 0.00 0.00 32.23 30.58 1u15 h LYS 414 CO -0.04 0.28 0.22 -1.13 -1.08 0.00 0.00 179.45 177.69 1u15 n SER 415 N -4.94 0.25 -0.13 0.86 3.41 -0.35 -1.37 113.62 111.35 1u15 n SER 415 Ca 0.05 0.50 -0.27 0.00 -0.26 0.00 0.00 58.87 58.89 1u15 n SER 415 Cb 0.16 -0.48 -0.10 0.00 -0.26 0.00 0.00 64.21 63.53 1u15 n SER 415 CO 0.00 0.00 0.00 -0.38 -0.16 0.00 0.00 175.04 174.50 1u15 n ILE 416 N -1.83 1.48 -3.73 -1.33 5.41 0.59 -5.01 119.36 114.93 1u15 n ILE 416 Ca -0.01 -0.41 -0.12 0.00 1.00 0.00 0.00 62.75 63.22 1u15 n ILE 416 Cb 0.24 -1.80 -0.12 0.00 -0.71 0.00 0.00 39.64 37.25 1u15 n ILE 416 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 176.55 176.00 1u15 s SER 417 N -7.29 -0.31 0.11 4.38 0.15 -0.47 -5.01 113.70 105.25 1u15 s SER 417 Ca -0.37 0.60 0.16 0.00 0.70 0.00 0.00 55.95 57.03 1u15 s SER 417 Cb 0.14 0.51 0.68 0.00 -1.71 0.00 0.00 66.02 65.64 1u15 s SER 417 CO 0.49 -0.15 1.49 -0.81 1.20 0.00 0.00 173.24 175.45 1u15 n PRO 418 N 3.92 0.07 0.26 5.44 -0.04 -1.25 -2.39 135.00 141.01 1u15 n PRO 418 Ca -0.22 0.38 0.14 0.00 -0.04 0.00 0.00 63.50 63.76 1u15 n PRO 418 Cb 0.55 -1.65 0.65 0.00 -0.04 0.00 0.00 33.50 33.00 1u15 n PRO 418 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 1u15 h LEU 419 N 0.00 0.00 -9.54 1.53 3.38 -1.93 -3.43 115.31 105.32 1u15 h LEU 419 Ca 0.00 0.00 -0.53 0.00 0.09 0.00 0.00 57.88 57.44 1u15 h LEU 419 Cb 0.22 0.00 0.02 0.00 0.09 0.00 0.00 40.66 40.99 1u15 h LEU 419 CO 0.00 0.11 0.74 -0.36 0.09 0.00 0.00 178.44 179.02 1u15 s PHE 420 N -3.82 3.21 0.32 1.13 2.99 -1.01 -5.01 117.98 115.80 1u15 s PHE 420 Ca -0.00 0.93 0.09 0.00 0.00 0.00 0.00 56.93 57.94 1u15 s PHE 420 Cb 0.11 -3.69 -0.06 0.00 0.00 0.00 0.00 43.02 39.37 1u15 s PHE 420 CO 0.58 -2.44 -0.09 0.45 -0.00 0.00 0.00 175.22 173.72 1u15 s SER 421 N 1.16 3.45 0.57 1.36 0.15 -1.26 -4.79 113.70 114.34 1u15 s SER 421 Ca 0.65 -1.19 0.28 0.00 0.70 0.00 0.00 55.95 56.40 1u15 s SER 421 Cb -0.37 -0.30 1.48 0.00 -1.71 0.00 0.00 66.02 65.13 1u15 s SER 421 CO 0.30 -0.23 1.94 0.77 1.20 0.00 0.00 173.24 177.22 1u15 h SER 422 N 2.11 0.00 0.18 5.45 4.64 -1.96 0.18 113.55 124.14 1u15 h SER 422 Ca -0.41 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.91 1u15 h SER 422 Cb 1.25 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.34 1u15 h SER 422 CO 0.69 0.00 0.00 -0.90 -0.87 0.00 0.00 176.83 175.75 1u15 n ASP 423 N -3.97 0.00 0.23 4.97 5.75 -1.26 -2.38 116.55 119.90 1u15 n ASP 423 Ca 0.10 -0.10 0.16 0.00 -0.01 0.00 0.00 54.79 54.94 1u15 n ASP 423 Cb 0.67 -0.19 0.69 0.00 -1.03 0.00 0.00 41.12 41.25 1u15 n ASP 423 CO 0.00 0.00 0.00 1.62 -0.11 0.00 0.00 177.20 178.71 1u15 h VAL 424 N 0.00 0.00 0.00 2.12 3.04 -1.05 -2.48 116.25 117.88 1u15 h VAL 424 Ca 0.00 -0.34 0.00 0.00 -1.01 0.00 0.00 66.70 65.35 1u15 h VAL 424 Cb 0.09 1.23 0.00 0.00 -2.01 0.00 0.00 31.29 30.60 1u15 h VAL 424 CO 0.00 0.00 0.01 0.77 -1.01 0.00 0.00 177.57 177.34 1u15 h SER 425 N 0.00 0.00 -0.01 3.17 4.64 -1.69 -0.89 113.55 118.77 1u15 h SER 425 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1u15 h SER 425 Cb 0.38 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.47 1u15 h SER 425 CO 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.96 1u15 n GLN 426 N -2.85 1.22 0.09 4.77 6.02 -0.93 -3.12 117.38 122.57 1u15 n GLN 426 Ca -0.03 -0.32 -0.18 0.00 -0.01 0.00 0.00 57.00 56.47 1u15 n GLN 426 Cb 0.07 -1.47 -0.10 0.00 1.02 0.00 0.00 30.24 29.76 1u15 n GLN 426 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 177.06 176.33 1u15 h VAL 427 N 0.76 1.37 -0.28 5.09 2.07 -1.38 -3.36 116.25 120.52 1u15 h VAL 427 Ca 0.00 -2.58 -0.69 0.00 0.82 0.00 0.00 66.70 64.25 1u15 h VAL 427 Cb 0.16 2.65 -0.01 0.00 -1.52 0.00 0.00 31.29 32.57 1u15 h VAL 427 CO 0.00 0.77 3.50 0.49 0.02 0.00 0.00 177.57 182.35 1u15 n PHE 428 N -3.72 2.49 -3.68 1.57 3.01 -1.18 -4.70 117.46 111.25 1u15 n PHE 428 Ca -0.10 -3.03 -0.10 0.00 1.01 0.00 0.00 57.45 55.23 1u15 n PHE 428 Cb 0.94 -2.34 -0.11 0.00 -0.01 0.00 0.00 39.48 37.97 1u15 n PHE 428 CO 0.00 0.00 0.00 1.21 1.01 0.00 0.00 176.76 178.98 1u15 s ASN 429 N 1.76 -0.35 0.33 4.37 3.84 -1.26 -5.07 114.94 118.57 1u15 s ASN 429 Ca 0.66 0.90 0.11 0.00 0.21 0.00 0.00 52.86 54.74 1u15 s ASN 429 Cb 0.18 0.98 0.58 0.00 -0.55 0.00 0.00 41.25 42.45 1u15 s ASN 429 CO -0.07 -0.21 1.75 -0.26 -2.79 0.00 0.00 177.10 175.52 1u15 h PHE 430 N 7.62 0.06 -0.47 0.43 -1.00 -1.94 -1.96 116.94 119.69 1u15 h PHE 430 Ca -0.27 -0.02 -0.09 0.00 2.81 0.00 0.00 57.97 60.40 1u15 h PHE 430 Cb 1.15 -0.01 -0.02 0.00 3.61 0.00 0.00 35.95 40.68 1u15 h PHE 430 CO 0.27 0.48 -0.06 0.28 -1.61 0.00 0.00 178.31 177.68 1u15 h VAL 431 N 0.05 1.27 -0.63 -0.55 2.07 -1.97 -2.27 116.25 114.21 1u15 h VAL 431 Ca 0.00 -1.15 -0.01 0.00 0.82 0.00 0.00 66.70 66.36 1u15 h VAL 431 Cb 0.79 1.06 -0.03 0.00 -1.52 0.00 0.00 31.29 31.59 1u15 h VAL 431 CO 0.06 0.40 0.35 0.78 0.02 0.00 0.00 177.57 179.18 1u15 h ASN 432 N 0.71 0.76 0.91 0.57 2.35 -1.80 -1.24 115.58 117.85 1u15 h ASN 432 Ca 0.13 -0.05 -0.04 0.00 -0.55 0.00 0.00 56.30 55.78 1u15 h ASN 432 Cb 0.59 -0.19 0.01 0.00 0.05 0.00 0.00 38.32 38.77 1u15 h ASN 432 CO 0.04 0.61 -0.45 -1.28 -1.65 0.00 0.00 177.43 174.69 1u15 h SER 433 N 0.87 -1.07 -0.39 5.81 0.87 -0.81 -2.60 113.55 116.23 1u15 h SER 433 Ca 0.22 0.04 0.03 0.00 -1.23 0.00 0.00 61.79 60.85 1u15 h SER 433 Cb 0.01 0.28 -0.02 0.00 -0.44 0.00 0.00 62.40 62.23 1u15 h SER 433 CO -0.04 -0.75 0.26 -0.37 -0.53 0.00 0.00 176.83 175.39 1u15 h VAL 434 N -1.24 1.03 0.00 2.23 -1.51 -1.24 -2.02 116.25 113.49 1u15 h VAL 434 Ca -0.12 -0.14 0.00 0.00 -1.23 0.00 0.00 66.70 65.20 1u15 h VAL 434 Cb 0.96 0.58 0.00 0.00 -2.13 0.00 0.00 31.29 30.70 1u15 h VAL 434 CO 0.20 0.08 0.00 -0.62 -1.23 0.00 0.00 177.57 175.99 1u15 n GLU 435 N -4.48 0.14 0.19 5.19 -0.58 -0.49 -1.80 120.64 118.80 1u15 n GLU 435 Ca 0.04 0.53 0.03 0.00 -0.42 0.00 0.00 57.16 57.34 1u15 n GLU 435 Cb 0.15 -1.86 0.37 0.00 -0.57 0.00 0.00 31.44 29.53 1u15 n GLU 435 CO 0.00 0.00 0.00 1.96 -0.48 0.00 0.00 177.13 178.61 1u15 h GLN 436 N 0.00 0.00 -4.13 3.49 4.20 -1.18 -3.36 115.11 114.12 1u15 h GLN 436 Ca 0.00 0.00 -0.74 0.00 0.06 0.00 0.00 58.65 57.97 1u15 h GLN 436 Cb 0.14 0.00 -0.14 0.00 0.30 0.00 0.00 27.48 27.78 1u15 h GLN 436 CO 0.00 0.36 2.01 0.66 -0.67 0.00 0.00 178.83 181.19 1u15 n TYR 437 N -4.08 3.75 0.22 2.96 4.02 -0.75 -4.62 117.16 118.67 1u15 n TYR 437 Ca -0.02 -2.98 0.11 0.00 -0.01 0.00 0.00 57.90 55.00 1u15 n TYR 437 Cb 0.40 -2.16 0.00 0.00 -0.02 0.00 0.00 39.34 37.56 1u15 n TYR 437 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 176.86 176.10 1u15 n THR 438 N 4.20 0.44 -1.76 -0.72 -2.24 -1.26 -0.54 114.28 112.40 1u15 n THR 438 Ca 0.41 -0.46 -0.40 0.00 -2.27 0.00 0.00 64.05 61.33 1u15 n THR 438 Cb 0.39 -0.18 0.01 0.00 -2.10 0.00 0.00 70.33 68.45 1u15 n THR 438 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1u15 n ALA 439 N -2.09 2.01 -1.68 6.98 0.00 -1.26 -4.75 120.51 119.72 1u15 n ALA 439 Ca 0.00 0.28 -0.61 0.00 0.00 0.00 0.00 53.44 53.11 1u15 n ALA 439 Cb 0.52 -2.38 -0.08 0.00 0.00 0.00 0.00 19.45 17.51 1u15 n ALA 439 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1u15 n LEU 440 N 0.04 1.48 0.00 0.00 4.32 -1.26 -1.04 117.00 120.55 1u15 n LEU 440 Ca 0.04 1.14 0.00 0.00 -0.02 0.00 0.00 56.01 57.17 1u15 n LEU 440 Cb 0.40 -1.01 0.00 0.00 -1.62 0.00 0.00 43.42 41.19 1u15 n LEU 440 CO 0.60 -0.89 0.00 0.61 -1.22 0.00 0.00 177.39 176.50 1u15 n GLY 441 N 3.50 2.83 3.70 -0.72 0.00 -1.26 -5.08 105.19 108.17 1u15 n GLY 441 Ca 0.26 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.99 1u15 n GLY 441 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1u15 s GLY 442 N -2.73 1.62 0.00 -0.02 0.00 -0.20 -4.99 107.32 101.00 1u15 s GLY 442 Ca 0.00 -0.85 0.27 0.00 0.00 0.00 0.00 44.72 44.13 1u15 s GLY 442 CO 0.00 -0.08 1.94 -0.37 0.00 0.00 0.00 173.10 174.59 1u15 n THR 443 N -4.32 0.02 -1.22 0.90 5.66 -1.22 -4.18 114.28 109.92 1u15 n THR 443 Ca 0.11 -0.07 -0.33 0.00 -3.05 0.00 0.00 64.05 60.71 1u15 n THR 443 Cb 0.59 -0.20 0.11 0.00 -1.55 0.00 0.00 70.33 69.28 1u15 n THR 443 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1u15 s ALA 444 N -1.98 1.97 0.26 1.79 0.00 0.29 -4.57 121.76 119.52 1u15 s ALA 444 Ca 0.39 0.72 -0.04 0.00 0.00 0.00 0.00 51.96 53.02 1u15 s ALA 444 Cb 0.19 -3.44 0.32 0.00 0.00 0.00 0.00 23.12 20.20 1u15 s ALA 444 CO 0.31 -2.08 1.92 -0.22 0.00 0.00 0.00 175.76 175.68 1u15 h LYS 445 N -0.81 1.25 -0.15 0.00 3.64 -1.87 -0.28 116.57 118.34 1u15 h LYS 445 Ca -0.46 -0.08 -0.07 0.00 -1.27 0.00 0.00 60.65 58.78 1u15 h LYS 445 Cb 1.28 -0.28 -0.01 0.00 -0.41 0.00 0.00 32.23 32.80 1u15 h LYS 445 CO 0.48 0.83 -0.22 0.66 -2.27 0.00 0.00 179.45 178.93 1u15 h SER 446 N 1.29 0.26 -0.08 4.20 4.64 -1.93 -0.47 113.55 121.45 1u15 h SER 446 Ca 0.39 -0.07 -0.13 0.00 -0.47 0.00 0.00 61.79 61.51 1u15 h SER 446 Cb -0.05 -0.07 0.01 0.00 -0.31 0.00 0.00 62.40 61.98 1u15 h SER 446 CO -0.11 0.49 -0.45 0.28 -0.87 0.00 0.00 176.83 176.17 1u15 h SER 447 N 0.24 0.54 -0.76 4.97 0.02 -1.61 -1.42 113.55 115.53 1u15 h SER 447 Ca 0.04 -0.66 0.04 0.00 -0.84 0.00 0.00 61.79 60.37 1u15 h SER 447 Cb 0.53 -0.16 -0.04 0.00 0.14 0.00 0.00 62.40 62.86 1u15 h SER 447 CO 0.04 1.11 0.50 0.58 -1.14 0.00 0.00 176.83 177.91 1u15 h VAL 448 N 0.00 1.10 -0.27 2.27 2.07 -0.84 0.02 116.25 120.59 1u15 h VAL 448 Ca -0.03 -0.31 -0.10 0.00 0.82 0.00 0.00 66.70 67.07 1u15 h VAL 448 Cb 1.11 0.12 -0.01 0.00 -1.52 0.00 0.00 31.29 30.99 1u15 h VAL 448 CO 0.09 0.17 -0.23 0.74 0.02 0.00 0.00 177.57 178.36 1u15 h THR 449 N 0.91 1.31 -0.89 2.57 2.02 -0.97 -2.11 112.91 115.75 1u15 h THR 449 Ca 0.31 -1.38 0.04 0.00 0.77 0.00 0.00 66.41 66.15 1u15 h THR 449 Cb 0.08 1.59 -0.06 0.00 -1.74 0.00 0.00 68.15 68.03 1u15 h THR 449 CO -0.09 0.44 0.58 0.74 0.37 0.00 0.00 175.52 177.55 1u15 h THR 450 N 0.36 1.13 -0.28 3.16 2.02 -0.51 -2.21 112.91 116.59 1u15 h THR 450 Ca 0.05 -0.38 -0.01 0.00 0.77 0.00 0.00 66.41 66.84 1u15 h THR 450 Cb 0.78 -0.07 -0.01 0.00 -1.74 0.00 0.00 68.15 67.11 1u15 h THR 450 CO 0.06 0.20 0.14 1.56 0.37 0.00 0.00 175.52 177.85 1u15 h GLN 451 N 1.10 0.40 -0.88 6.66 4.20 -0.91 -0.26 115.11 125.41 1u15 h GLN 451 Ca 0.36 -0.06 0.06 0.00 0.06 0.00 0.00 58.65 59.08 1u15 h GLN 451 Cb 0.04 -0.07 -0.06 0.00 0.30 0.00 0.00 27.48 27.69 1u15 h GLN 451 CO -0.13 0.38 0.55 0.82 -0.67 0.00 0.00 178.83 179.78 1u15 h ILE 452 N 0.32 1.05 -0.36 2.54 2.04 -0.93 0.67 117.51 122.84 1u15 h ILE 452 Ca 0.10 -0.35 -0.13 0.00 1.00 0.00 0.00 64.86 65.48 1u15 h ILE 452 Cb 0.11 -0.05 -0.01 0.00 -0.74 0.00 0.00 36.82 36.13 1u15 h ILE 452 CO -0.01 0.18 -0.28 -0.33 0.00 0.00 0.00 178.15 177.71 1u15 h GLU 453 N 1.01 0.82 -0.70 2.37 5.08 -1.17 -1.04 114.58 120.95 1u15 h GLU 453 Ca 0.39 -0.41 0.02 0.00 -1.00 0.00 0.00 59.36 58.36 1u15 h GLU 453 Cb 0.17 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.38 1u15 h GLU 453 CO -0.17 1.04 0.45 1.96 -1.00 0.00 0.00 179.01 181.29 1u15 h GLN 454 N 0.61 0.88 -0.14 2.33 4.20 -0.23 -1.19 115.11 121.58 1u15 h GLN 454 Ca 0.07 -0.05 -0.03 0.00 0.06 0.00 0.00 58.65 58.69 1u15 h GLN 454 Cb 0.86 -0.20 -0.00 0.00 0.30 0.00 0.00 27.48 28.44 1u15 h GLN 454 CO 0.07 0.58 -0.05 -0.07 -0.67 0.00 0.00 178.83 178.70 1u15 h LEU 455 N 0.90 0.28 -1.34 1.46 -0.00 -0.80 -1.44 115.31 114.37 1u15 h LEU 455 Ca 0.27 -0.39 0.15 0.00 -0.00 0.00 0.00 57.88 57.91 1u15 h LEU 455 Cb -0.04 -0.08 -0.07 0.00 -0.00 0.00 0.00 40.66 40.48 1u15 h LEU 455 CO -0.09 0.60 0.56 0.03 -0.00 0.00 0.00 178.44 179.55 1u15 h ARG 456 N -0.05 0.62 0.01 1.13 3.08 -0.93 0.12 114.38 118.36 1u15 h ARG 456 Ca 0.03 -0.04 -0.00 0.00 0.07 0.00 0.00 59.98 60.05 1u15 h ARG 456 Cb 0.49 -0.14 0.00 0.00 0.08 0.00 0.00 29.97 30.40 1u15 h ARG 456 CO 0.02 0.41 -0.00 1.49 -1.07 0.00 0.00 179.97 180.81 1u15 h GLU 457 N 0.64 -0.01 0.07 0.04 4.57 -1.06 -2.69 114.58 116.15 1u15 h GLU 457 Ca 0.44 0.00 0.01 0.00 -1.18 0.00 0.00 59.36 58.63 1u15 h GLU 457 Cb 0.75 0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 29.32 1u15 h GLU 457 CO -0.19 0.40 -0.15 -0.07 -1.18 0.00 0.00 179.01 177.82 1u15 h LEU 458 N -0.42 -0.41 -0.85 1.64 3.38 -0.08 -1.83 115.31 116.73 1u15 h LEU 458 Ca -0.00 0.05 0.16 0.00 0.09 0.00 0.00 57.88 58.19 1u15 h LEU 458 Cb 0.42 0.16 -0.10 0.00 0.09 0.00 0.00 40.66 41.23 1u15 h LEU 458 CO 0.00 -0.22 0.41 0.24 0.09 0.00 0.00 178.44 178.97 1u15 h MET 459 N -0.28 0.53 0.27 1.13 2.86 -1.09 0.10 114.93 118.45 1u15 h MET 459 Ca 0.03 -0.03 -0.00 0.00 -2.06 0.00 0.00 59.70 57.63 1u15 h MET 459 Cb 0.31 -0.12 -0.03 0.00 0.06 0.00 0.00 31.60 31.82 1u15 h MET 459 CO -0.09 0.35 -0.44 -0.22 1.06 0.00 0.00 176.91 177.57 1u15 h LYS 460 N 0.55 -0.72 0.01 1.72 3.64 -1.00 0.41 116.57 121.17 1u15 h LYS 460 Ca 0.48 0.05 0.02 0.00 -1.27 0.00 0.00 60.65 59.93 1u15 h LYS 460 Cb 0.76 0.16 -0.05 0.00 -0.41 0.00 0.00 32.23 32.69 1u15 h LYS 460 CO -0.41 -0.48 -0.51 0.87 -2.27 0.00 0.00 179.45 176.65 1u15 h LYS 461 N -0.75 -0.62 -0.01 1.90 1.57 -0.47 0.29 116.57 118.47 1u15 h LYS 461 Ca -0.03 0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.79 1u15 h LYS 461 Cb 0.69 0.14 -0.00 0.00 0.08 0.00 0.00 32.23 33.14 1u15 h LYS 461 CO -0.14 -0.42 0.02 1.96 -0.57 0.00 0.00 179.45 180.30 1u15 h GLN 462 N -0.65 0.00 0.13 3.15 4.20 -0.92 -1.23 115.11 119.79 1u15 h GLN 462 Ca 0.01 0.00 -0.30 0.00 0.06 0.00 0.00 58.65 58.42 1u15 h GLN 462 Cb 0.69 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.47 1u15 h GLN 462 CO -0.34 0.00 -1.48 -0.22 -0.67 0.00 0.00 178.83 176.13 1u15 h LYS 463 N 0.00 0.28 -0.12 1.46 3.64 0.98 -3.27 116.57 119.53 1u15 h LYS 463 Ca 0.00 -0.48 -0.02 0.00 -1.27 0.00 0.00 60.65 58.89 1u15 h LYS 463 Cb 0.03 0.18 -0.00 0.00 -0.41 0.00 0.00 32.23 32.03 1u15 h LYS 463 CO -0.00 1.17 -0.00 0.93 -2.27 0.00 0.00 179.45 179.27 1u15 h GLU 464 N 0.08 0.22 0.00 1.90 5.08 0.15 -2.88 114.58 119.13 1u15 h GLU 464 Ca -0.22 -0.07 0.00 0.00 -1.00 0.00 0.00 59.36 58.07 1u15 h GLU 464 Cb 2.02 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 31.25 1u15 h GLU 464 CO 0.18 0.46 0.00 0.00 -1.00 0.00 0.00 179.01 178.65 1u15 n GLN 465 N -4.79 0.70 0.00 2.33 10.64 -0.73 -5.12 117.38 120.41 1u15 n GLN 465 Ca -0.06 0.00 0.10 0.00 -1.83 0.00 0.00 57.00 55.21 1u15 n GLN 465 Cb 0.21 -1.04 0.08 0.00 -0.86 0.00 0.00 30.24 28.63 1u15 n GLN 465 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23