#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1dmu h TYR 2 N 0.00 0.28 0.00 2.03 0.05 -2.06 -3.04 116.97 114.23 1dmu h TYR 2 Ca 0.00 0.01 0.00 0.00 0.05 0.00 0.00 58.73 58.79 1dmu h TYR 2 Cb 0.00 -0.09 0.00 0.00 1.01 0.00 0.00 36.73 37.65 1dmu h TYR 2 CO 0.00 0.13 -1.29 0.09 -1.05 0.00 0.00 178.16 176.04 1dmu n ASN 3 N -4.45 0.80 -0.35 3.88 3.02 -1.26 -4.36 115.26 112.54 1dmu n ASN 3 Ca 0.09 -0.52 0.15 0.00 -0.03 0.00 0.00 54.58 54.27 1dmu n ASN 3 Cb 0.41 1.37 0.36 0.00 -0.61 0.00 0.00 39.78 41.31 1dmu n ASN 3 CO 0.00 0.00 0.00 0.25 -2.62 0.00 0.00 177.26 174.89 1dmu h LEU 4 N 0.00 0.72 -2.31 3.41 5.85 -2.03 -2.65 115.31 118.30 1dmu h LEU 4 Ca 0.00 0.12 0.00 0.00 0.84 0.00 0.00 57.88 58.84 1dmu h LEU 4 Cb 0.61 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.64 1dmu h LEU 4 CO 0.00 0.18 0.00 1.41 -0.34 0.00 0.00 178.44 179.69 1dmu n HIS 5 N -4.84 0.00 -0.18 1.25 8.25 -1.26 -4.85 115.22 113.59 1dmu n HIS 5 Ca 0.25 -0.33 -0.01 0.00 -0.26 0.00 0.00 57.72 57.37 1dmu n HIS 5 Cb 0.67 -0.03 0.08 0.00 1.12 0.00 0.00 29.99 31.82 1dmu n HIS 5 CO 0.00 0.00 0.00 -0.09 0.64 0.00 0.00 176.34 176.89 1dmu h ARG 6 N 0.00 0.11 -0.55 -0.41 2.43 -1.67 -1.55 114.38 112.74 1dmu h ARG 6 Ca 0.00 -0.01 -0.00 0.00 -0.81 0.00 0.00 59.98 59.16 1dmu h ARG 6 Cb 0.58 -0.03 -0.03 0.00 -0.42 0.00 0.00 29.97 30.08 1dmu h ARG 6 CO 0.00 0.07 0.34 0.93 -1.51 0.00 0.00 179.97 179.81 1dmu h GLU 7 N 0.12 0.73 -0.51 0.20 5.08 -1.89 0.14 114.58 118.46 1dmu h GLU 7 Ca 0.29 -0.06 -0.08 0.00 -1.00 0.00 0.00 59.36 58.51 1dmu h GLU 7 Cb 0.45 -0.16 -0.02 0.00 0.50 0.00 0.00 28.75 29.52 1dmu h GLU 7 CO -0.48 0.52 -0.01 -0.22 -1.00 0.00 0.00 179.01 177.82 1dmu h LYS 8 N 0.74 0.86 -0.27 2.33 3.64 -1.81 -0.49 116.57 121.56 1dmu h LYS 8 Ca 0.20 -0.24 -0.12 0.00 -1.27 0.00 0.00 60.65 59.22 1dmu h LYS 8 Cb -0.04 -0.09 -0.00 0.00 -0.41 0.00 0.00 32.23 31.68 1dmu h LYS 8 CO -0.04 0.86 -0.28 0.82 -2.27 0.00 0.00 179.45 178.54 1dmu h ILE 9 N 0.79 1.31 0.31 2.00 2.04 -0.91 -2.46 117.51 120.59 1dmu h ILE 9 Ca 0.15 -1.46 -0.00 0.00 1.00 0.00 0.00 64.86 64.55 1dmu h ILE 9 Cb 0.49 1.62 -0.01 0.00 -0.74 0.00 0.00 36.82 38.18 1dmu h ILE 9 CO 0.02 0.46 -0.24 0.15 0.00 0.00 0.00 178.15 178.54 1dmu h PHE 10 N 0.40 -0.64 0.19 1.37 3.57 -0.49 0.17 116.94 121.52 1dmu h PHE 10 Ca 0.04 -0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.54 1dmu h PHE 10 Cb 0.85 0.24 -0.00 0.00 2.79 0.00 0.00 35.95 39.83 1dmu h PHE 10 CO 0.07 -0.36 -0.12 0.52 -2.23 0.00 0.00 178.31 176.19 1dmu h MET 11 N -0.55 -0.30 -0.75 1.11 2.86 -1.15 -2.17 114.93 113.98 1dmu h MET 11 Ca -0.02 0.02 -0.03 0.00 -2.06 0.00 0.00 59.70 57.61 1dmu h MET 11 Cb 0.49 0.07 -0.03 0.00 0.06 0.00 0.00 31.60 32.18 1dmu h MET 11 CO -0.01 -0.20 0.35 1.03 1.06 0.00 0.00 176.91 179.14 1dmu h SER 12 N -0.31 0.98 0.03 1.22 0.87 -1.39 -2.37 113.55 112.58 1dmu h SER 12 Ca -0.02 -0.11 -0.00 0.00 -1.23 0.00 0.00 61.79 60.43 1dmu h SER 12 Cb 0.26 -0.25 0.00 0.00 -0.44 0.00 0.00 62.40 61.97 1dmu h SER 12 CO 0.02 0.83 -0.02 0.22 -0.53 0.00 0.00 176.83 177.35 1dmu h TYR 13 N 1.07 -0.04 -0.60 2.24 3.20 -0.52 -0.17 116.97 122.14 1dmu h TYR 13 Ca 0.26 -0.00 -0.08 0.00 3.14 0.00 0.00 58.73 62.05 1dmu h TYR 13 Cb 0.12 0.01 -0.02 0.00 1.54 0.00 0.00 36.73 38.38 1dmu h TYR 13 CO 0.01 0.11 0.06 -0.91 -1.64 0.00 0.00 178.16 175.79 1dmu h ASN 14 N -0.18 1.00 -0.35 -2.11 2.35 -1.30 0.55 115.58 115.54 1dmu h ASN 14 Ca -0.00 -0.28 -0.07 0.00 -0.55 0.00 0.00 56.30 55.40 1dmu h ASN 14 Cb 0.17 -0.27 -0.01 0.00 0.05 0.00 0.00 38.32 38.26 1dmu h ASN 14 CO 0.01 1.03 -0.04 1.56 -1.65 0.00 0.00 177.43 178.34 1dmu h GLN 15 N 0.93 0.64 -0.28 0.81 7.50 -1.41 -2.68 115.11 120.62 1dmu h GLN 15 Ca 0.18 -0.22 -0.17 0.00 0.50 0.00 0.00 58.65 58.94 1dmu h GLN 15 Cb 0.48 -0.05 -0.00 0.00 0.05 0.00 0.00 27.48 27.96 1dmu h GLN 15 CO 0.02 0.78 -0.49 -0.91 -1.50 0.00 0.00 178.83 176.73 1dmu h ASN 16 N 0.44 0.84 -0.33 1.46 2.35 -0.80 -2.83 115.58 116.71 1dmu h ASN 16 Ca 0.09 -0.43 -0.05 0.00 -0.55 0.00 0.00 56.30 55.36 1dmu h ASN 16 Cb 0.52 -0.24 -0.02 0.00 0.05 0.00 0.00 38.32 38.63 1dmu h ASN 16 CO 0.03 1.19 0.03 0.50 -1.65 0.00 0.00 177.43 177.53 1dmu h LYS 17 N 0.60 0.66 -0.38 0.81 3.64 0.10 -0.47 116.57 121.55 1dmu h LYS 17 Ca 0.03 -0.15 -0.03 0.00 -1.27 0.00 0.00 60.65 59.23 1dmu h LYS 17 Cb 1.07 -0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 32.78 1dmu h LYS 17 CO 0.11 0.66 0.13 0.37 -2.27 0.00 0.00 179.45 178.44 1dmu h GLN 18 N 0.64 0.58 -0.11 1.90 5.75 -1.40 0.35 115.11 122.82 1dmu h GLN 18 Ca 0.13 -0.12 -0.00 0.00 -0.15 0.00 0.00 58.65 58.52 1dmu h GLN 18 Cb 0.35 -0.09 -0.01 0.00 1.07 0.00 0.00 27.48 28.80 1dmu h GLN 18 CO 0.01 0.58 0.07 -0.92 -2.65 0.00 0.00 178.83 175.91 1dmu h TYR 19 N 0.46 0.14 0.05 3.99 3.20 -1.24 -0.57 116.97 123.00 1dmu h TYR 19 Ca 0.12 0.00 0.01 0.00 3.14 0.00 0.00 58.73 62.01 1dmu h TYR 19 Cb 0.23 -0.05 -0.02 0.00 1.54 0.00 0.00 36.73 38.43 1dmu h TYR 19 CO 0.01 0.12 -0.13 -0.07 -1.64 0.00 0.00 178.16 176.45 1dmu h LEU 20 N 0.12 -0.36 -0.98 2.82 3.38 -0.91 -0.89 115.31 118.50 1dmu h LEU 20 Ca 0.04 0.05 0.11 0.00 0.09 0.00 0.00 57.88 58.16 1dmu h LEU 20 Cb 0.02 0.14 -0.08 0.00 0.09 0.00 0.00 40.66 40.83 1dmu h LEU 20 CO -0.01 -0.19 0.61 -0.08 0.09 0.00 0.00 178.44 178.87 1dmu h GLU 21 N -0.24 0.96 0.00 1.13 4.81 -0.73 -1.27 114.58 119.24 1dmu h GLU 21 Ca 0.03 -0.06 0.00 0.00 -0.13 0.00 0.00 59.36 59.20 1dmu h GLU 21 Cb 0.27 -0.22 0.00 0.00 0.63 0.00 0.00 28.75 29.44 1dmu h GLU 21 CO -0.09 0.64 -0.09 -0.25 -0.73 0.00 0.00 179.01 178.48 1dmu n ASP 22 N -4.62 0.39 -3.23 1.04 8.00 -0.24 -4.09 116.55 113.80 1dmu n ASP 22 Ca 0.18 0.43 -0.25 0.00 0.71 0.00 0.00 54.79 55.86 1dmu n ASP 22 Cb 0.32 -0.49 -0.06 0.00 -0.02 0.00 0.00 41.12 40.86 1dmu n ASP 22 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1dmu n ASN 23 N -1.82 2.54 -0.02 -2.24 3.02 -0.37 -4.94 115.26 111.43 1dmu n ASN 23 Ca 0.06 -3.23 0.23 0.00 -0.03 0.00 0.00 54.58 51.61 1dmu n ASN 23 Cb 0.38 -0.63 0.72 0.00 -0.61 0.00 0.00 39.78 39.64 1dmu n ASN 23 CO 0.00 0.00 0.00 1.55 -2.62 0.00 0.00 177.26 176.19 1dmu h PRO 24 N 3.71 0.00 -0.11 3.52 0.13 -1.68 -2.57 132.00 135.00 1dmu h PRO 24 Ca 0.14 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 65.24 1dmu h PRO 24 Cb 0.73 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.85 1dmu h PRO 24 CO 0.69 0.00 -0.06 0.93 -0.23 0.00 0.00 178.00 179.32 1dmu h GLU 25 N 0.00 0.17 -0.02 0.86 5.08 -1.92 -1.82 114.58 116.92 1dmu h GLU 25 Ca 0.29 -0.03 -0.00 0.00 -1.00 0.00 0.00 59.36 58.62 1dmu h GLU 25 Cb 1.34 -0.03 -0.00 0.00 0.50 0.00 0.00 28.75 30.56 1dmu h GLU 25 CO -0.00 0.24 -0.00 0.82 -1.00 0.00 0.00 179.01 179.07 1dmu h ILE 26 N 0.16 1.26 -0.79 3.13 2.04 -1.82 -1.27 117.51 120.22 1dmu h ILE 26 Ca 0.04 -0.77 -0.00 0.00 1.00 0.00 0.00 64.86 65.12 1dmu h ILE 26 Cb 0.23 1.73 -0.04 0.00 -0.74 0.00 0.00 36.82 38.00 1dmu h ILE 26 CO 0.01 0.21 0.48 -0.61 0.00 0.00 0.00 178.15 178.24 1dmu h GLN 27 N -0.27 1.06 -0.53 2.37 5.75 -1.64 -1.99 115.11 119.85 1dmu h GLN 27 Ca 0.01 -0.09 -0.01 0.00 -0.15 0.00 0.00 58.65 58.41 1dmu h GLN 27 Cb 0.33 -0.23 -0.03 0.00 1.07 0.00 0.00 27.48 28.63 1dmu h GLN 27 CO 0.00 0.74 0.29 1.49 -2.65 0.00 0.00 178.83 178.70 1dmu h GLU 28 N 1.07 0.73 0.02 1.69 4.81 -1.21 -0.45 114.58 121.24 1dmu h GLU 28 Ca 0.28 -0.07 -0.00 0.00 -0.13 0.00 0.00 59.36 59.44 1dmu h GLU 28 Cb -0.06 -0.15 0.00 0.00 0.63 0.00 0.00 28.75 29.18 1dmu h GLU 28 CO -0.05 0.54 -0.01 0.87 -0.73 0.00 0.00 179.01 179.63 1dmu h LYS 29 N 0.74 -0.02 0.00 1.92 1.57 -0.51 -1.18 116.57 119.08 1dmu h LYS 29 Ca 0.19 0.00 -0.10 0.00 -1.87 0.00 0.00 60.65 58.87 1dmu h LYS 29 Cb 0.03 0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.33 1dmu h LYS 29 CO -0.03 0.21 -0.47 -0.84 -0.57 0.00 0.00 179.45 177.75 1dmu h ILE 30 N -0.26 1.29 -0.30 1.86 3.07 -1.24 -0.20 117.51 121.74 1dmu h ILE 30 Ca -0.00 -1.65 -0.13 0.00 1.55 0.00 0.00 64.86 64.63 1dmu h ILE 30 Cb 0.25 1.90 -0.00 0.00 -0.27 0.00 0.00 36.82 38.69 1dmu h ILE 30 CO 0.00 0.46 -0.32 -0.33 -1.05 0.00 0.00 178.15 176.92 1dmu h GLU 31 N 0.00 0.74 -0.04 0.16 5.08 -0.98 -1.25 114.58 118.28 1dmu h GLU 31 Ca -0.00 -0.40 -0.13 0.00 -1.00 0.00 0.00 59.36 57.82 1dmu h GLU 31 Cb 0.86 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 30.12 1dmu h GLU 31 CO 0.06 1.02 -0.58 -0.07 -1.00 0.00 0.00 179.01 178.44 1dmu h LEU 32 N 0.49 0.15 -0.46 1.33 3.38 -1.08 -2.11 115.31 117.01 1dmu h LEU 32 Ca 0.04 -0.08 -0.01 0.00 0.09 0.00 0.00 57.88 57.92 1dmu h LEU 32 Cb 0.90 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 41.58 1dmu h LEU 32 CO 0.08 0.70 0.24 0.22 0.09 0.00 0.00 178.44 179.77 1dmu h TYR 33 N 0.10 0.65 -0.66 1.13 3.20 -0.84 0.02 116.97 120.57 1dmu h TYR 33 Ca -0.00 -0.02 -0.04 0.00 3.14 0.00 0.00 58.73 61.81 1dmu h TYR 33 Cb 1.05 -0.20 -0.03 0.00 1.54 0.00 0.00 36.73 39.08 1dmu h TYR 33 CO 0.01 0.50 0.27 0.78 -1.64 0.00 0.00 178.16 178.08 1dmu h GLY 34 N 0.61 1.06 0.91 1.82 0.00 -1.00 -0.43 103.07 106.04 1dmu h GLY 34 Ca 0.16 -0.57 -0.00 0.00 0.00 0.00 0.00 47.33 46.91 1dmu h GLY 34 CO -0.02 0.54 -0.02 -2.00 0.00 0.00 0.00 176.54 175.04 1dmu h LEU 35 N 0.93 -0.05 -1.48 3.11 5.85 -1.08 -2.45 115.31 120.14 1dmu h LEU 35 Ca 0.22 -0.08 -0.04 0.00 0.84 0.00 0.00 57.88 58.82 1dmu h LEU 35 Cb 0.20 0.01 -0.01 0.00 0.37 0.00 0.00 40.66 41.24 1dmu h LEU 35 CO -0.02 0.05 -0.18 0.78 -0.34 0.00 0.00 178.44 178.73 1dmu h ASN 36 N -0.15 0.00 -0.32 1.25 2.35 -0.89 -1.59 115.58 116.22 1dmu h ASN 36 Ca -0.01 0.00 -0.13 0.00 -0.55 0.00 0.00 56.30 55.62 1dmu h ASN 36 Cb 0.13 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.49 1dmu h ASN 36 CO 0.01 0.18 -0.26 0.25 -1.65 0.00 0.00 177.43 175.96 1dmu h LEU 37 N 0.00 0.86 -0.28 1.61 5.85 -0.74 -0.54 115.31 122.08 1dmu h LEU 37 Ca -0.00 -0.33 -0.20 0.00 0.84 0.00 0.00 57.88 58.18 1dmu h LEU 37 Cb 0.57 -0.24 0.00 0.00 0.37 0.00 0.00 40.66 41.36 1dmu h LEU 37 CO 0.02 1.07 -0.70 -0.07 -0.34 0.00 0.00 178.44 178.43 1dmu h LEU 38 N 0.71 0.82 -0.64 2.25 3.38 -0.95 -1.64 115.31 119.25 1dmu h LEU 38 Ca 0.09 -0.51 -0.02 0.00 0.09 0.00 0.00 57.88 57.53 1dmu h LEU 38 Cb 0.80 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 41.28 1dmu h LEU 38 CO 0.07 1.29 0.33 -1.13 0.09 0.00 0.00 178.44 179.09 1dmu h ASN 39 N 0.50 0.81 0.33 -0.43 -0.73 -1.18 0.86 115.58 115.73 1dmu h ASN 39 Ca -0.03 -0.11 -0.02 0.00 1.87 0.00 0.00 56.30 58.02 1dmu h ASN 39 Cb 1.30 -0.21 0.00 0.00 0.27 0.00 0.00 38.32 39.69 1dmu h ASN 39 CO 0.14 0.69 -0.16 -0.33 -0.37 0.00 0.00 177.43 177.40 1dmu h GLU 40 N 0.87 -0.42 -0.69 6.67 5.08 -0.98 -1.51 114.58 123.60 1dmu h GLU 40 Ca 0.22 0.03 0.03 0.00 -1.00 0.00 0.00 59.36 58.64 1dmu h GLU 40 Cb 0.07 0.10 -0.04 0.00 0.50 0.00 0.00 28.75 29.38 1dmu h GLU 40 CO -0.03 -0.24 0.43 0.28 -1.00 0.00 0.00 179.01 178.45 1dmu h VAL 41 N -0.51 1.10 -0.79 3.13 2.07 -1.11 0.13 116.25 120.28 1dmu h VAL 41 Ca -0.04 -0.29 -0.04 0.00 0.82 0.00 0.00 66.70 67.14 1dmu h VAL 41 Cb 0.38 0.18 -0.04 0.00 -1.52 0.00 0.00 31.29 30.29 1dmu h VAL 41 CO 0.07 0.16 0.34 0.40 0.02 0.00 0.00 177.57 178.56 1dmu h ILE 42 N 0.85 1.26 -0.43 4.57 2.04 -0.74 -2.05 117.51 123.00 1dmu h ILE 42 Ca 0.27 -0.77 -0.07 0.00 1.00 0.00 0.00 64.86 65.29 1dmu h ILE 42 Cb 0.01 0.28 -0.02 0.00 -0.74 0.00 0.00 36.82 36.35 1dmu h ILE 42 CO -0.10 0.32 -0.00 -1.28 0.00 0.00 0.00 178.15 177.08 1dmu h SER 43 N 1.14 0.75 0.83 1.72 0.87 -0.46 -1.40 113.55 117.00 1dmu h SER 43 Ca 0.27 -0.31 0.00 0.00 -1.23 0.00 0.00 61.79 60.52 1dmu h SER 43 Cb 0.18 -0.20 0.00 0.00 -0.44 0.00 0.00 62.40 61.93 1dmu h SER 43 CO -0.03 0.88 0.00 0.47 -0.53 0.00 0.00 176.83 177.62 1dmu n ASP 44 N -4.40 0.12 -1.25 6.23 8.00 0.39 -3.43 116.55 122.21 1dmu n ASP 44 Ca -0.00 0.52 0.04 0.00 0.71 0.00 0.00 54.79 56.06 1dmu n ASP 44 Cb 0.30 -0.55 0.08 0.00 -0.02 0.00 0.00 41.12 40.93 1dmu n ASP 44 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1dmu n ASN 45 N -1.62 1.26 -0.27 -2.24 3.02 -0.79 -4.93 115.26 109.69 1dmu n ASN 45 Ca 0.05 -2.60 0.03 0.00 -0.03 0.00 0.00 54.58 52.04 1dmu n ASN 45 Cb 0.27 -0.37 0.17 0.00 -0.61 0.00 0.00 39.78 39.24 1dmu n ASN 45 CO 0.00 0.00 0.00 -0.08 -2.62 0.00 0.00 177.26 174.56 1dmu h GLU 46 N 1.04 0.65 -0.52 3.52 4.81 -1.28 -1.48 114.58 121.33 1dmu h GLU 46 Ca -0.15 -0.04 -0.07 0.00 -0.13 0.00 0.00 59.36 58.97 1dmu h GLU 46 Cb 1.61 -0.15 -0.02 0.00 0.63 0.00 0.00 28.75 30.82 1dmu h GLU 46 CO 0.08 0.43 0.05 0.93 -0.73 0.00 0.00 179.01 179.77 1dmu h GLU 47 N 0.67 0.87 -0.07 1.92 5.08 -1.90 -1.49 114.58 119.67 1dmu h GLU 47 Ca 0.39 -0.25 -0.00 0.00 -1.00 0.00 0.00 59.36 58.50 1dmu h GLU 47 Cb 0.43 -0.09 -0.00 0.00 0.50 0.00 0.00 28.75 29.59 1dmu h GLU 47 CO -0.29 0.88 0.04 1.49 -1.00 0.00 0.00 179.01 180.13 1dmu h GLU 48 N 0.75 0.10 -0.01 2.33 4.81 -1.85 0.11 114.58 120.84 1dmu h GLU 48 Ca 0.15 -0.02 0.02 0.00 -0.13 0.00 0.00 59.36 59.39 1dmu h GLU 48 Cb 0.45 -0.02 -0.03 0.00 0.63 0.00 0.00 28.75 29.78 1dmu h GLU 48 CO 0.02 0.18 -0.11 0.82 -0.73 0.00 0.00 179.01 179.19 1dmu h ILE 49 N -0.00 0.71 -0.72 2.32 2.04 -1.15 -0.49 117.51 120.22 1dmu h ILE 49 Ca 0.02 0.00 -0.06 0.00 1.00 0.00 0.00 64.86 65.83 1dmu h ILE 49 Cb 0.11 0.71 -0.03 0.00 -0.74 0.00 0.00 36.82 36.88 1dmu h ILE 49 CO -0.00 0.00 0.22 -0.09 0.00 0.00 0.00 178.15 178.28 1dmu h ARG 50 N -0.19 1.11 -0.16 2.37 2.43 -1.20 -1.42 114.38 117.31 1dmu h ARG 50 Ca 0.04 -0.23 -0.02 0.00 -0.81 0.00 0.00 59.98 58.96 1dmu h ARG 50 Cb 0.25 -0.16 -0.01 0.00 -0.42 0.00 0.00 29.97 29.63 1dmu h ARG 50 CO -0.12 0.94 0.00 0.00 -1.51 0.00 0.00 179.97 179.29 1dmu h ALA 51 N 1.17 0.22 0.00 2.80 0.00 -0.42 -1.00 119.26 122.03 1dmu h ALA 51 Ca 0.23 -0.19 -0.07 0.00 0.00 0.00 0.00 54.91 54.88 1dmu h ALA 51 Cb 0.30 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 1dmu h ALA 51 CO -0.01 -0.08 -0.34 -0.44 0.00 0.00 0.00 179.25 178.38 1dmu h ASP 52 N 0.03 0.00 0.24 0.00 3.32 -1.06 -1.62 116.42 117.33 1dmu h ASP 52 Ca 0.05 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.08 1dmu h ASP 52 Cb 0.37 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.92 1dmu h ASP 52 CO 0.01 0.34 -0.11 0.22 -1.72 0.00 0.00 179.24 177.97 1dmu h TYR 53 N 0.00 -0.30 -0.05 4.55 3.20 -1.14 -3.29 116.97 119.94 1dmu h TYR 53 Ca -0.00 -0.01 0.01 0.00 3.14 0.00 0.00 58.73 61.87 1dmu h TYR 53 Cb 0.78 0.10 -0.00 0.00 1.54 0.00 0.00 36.73 39.15 1dmu h TYR 53 CO 0.00 -0.19 0.20 -0.91 -1.64 0.00 0.00 178.16 175.63 1dmu h ASN 54 N -0.63 0.00 -0.14 -2.11 2.35 -1.22 -2.30 115.58 111.53 1dmu h ASN 54 Ca -0.03 0.00 0.04 0.00 -0.55 0.00 0.00 56.30 55.76 1dmu h ASN 54 Cb 0.25 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.61 1dmu h ASN 54 CO 0.05 0.00 0.13 -0.08 -1.65 0.00 0.00 177.43 175.88 1dmu h GLU 55 N 0.00 0.00 -0.60 0.81 4.57 -1.36 -1.91 114.58 116.10 1dmu h GLU 55 Ca 0.02 0.00 0.08 0.00 -1.18 0.00 0.00 59.36 58.29 1dmu h GLU 55 Cb 0.43 0.00 -0.04 0.00 -0.16 0.00 0.00 28.75 28.98 1dmu h GLU 55 CO -0.00 0.00 0.40 0.00 -1.18 0.00 0.00 179.01 178.23 1dmu h ALA 56 N 1.88 1.93 -0.12 2.92 0.00 -1.59 -1.48 119.26 122.80 1dmu h ALA 56 Ca 0.07 -0.01 -0.18 0.00 0.00 0.00 0.00 54.91 54.78 1dmu h ALA 56 Cb 0.32 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.00 1dmu h ALA 56 CO -0.00 -0.04 -0.68 -0.91 0.00 0.00 0.00 179.25 177.62 1dmu h ASN 57 N 0.48 0.58 0.65 0.00 2.35 -1.58 -3.08 115.58 114.99 1dmu h ASN 57 Ca 0.27 -0.36 -0.11 0.00 -0.55 0.00 0.00 56.30 55.55 1dmu h ASN 57 Cb 0.42 -0.17 -0.02 0.00 0.05 0.00 0.00 38.32 38.61 1dmu h ASN 57 CO -0.08 1.09 -0.51 -0.26 -1.65 0.00 0.00 177.43 176.03 1dmu h PHE 58 N 0.35 0.00 -0.11 1.19 0.05 -1.42 -2.48 116.94 114.52 1dmu h PHE 58 Ca -0.02 0.00 0.00 0.00 3.82 0.00 0.00 57.97 61.77 1dmu h PHE 58 Cb 1.25 0.00 0.00 0.00 2.00 0.00 0.00 35.95 39.20 1dmu h PHE 58 CO 0.05 0.51 0.00 1.28 -0.18 0.00 0.00 178.31 179.97 1dmu n LEU 59 N -3.75 0.67 -0.34 1.54 4.77 -0.64 -4.44 117.00 114.82 1dmu n LEU 59 Ca -0.01 -0.32 0.08 0.00 -0.03 0.00 0.00 56.01 55.73 1dmu n LEU 59 Cb 0.55 -0.07 0.17 0.00 -2.33 0.00 0.00 43.42 41.74 1dmu n LEU 59 CO 0.40 0.16 0.71 -0.74 -1.33 0.00 0.00 177.39 176.59 1dmu h HIS 60 N 0.77 -0.36 -0.28 -1.77 2.76 -1.39 0.31 115.15 115.19 1dmu h HIS 60 Ca 0.00 0.08 0.08 0.00 -2.20 0.00 0.00 60.37 58.33 1dmu h HIS 60 Cb 0.17 0.31 -0.01 0.00 1.55 0.00 0.00 27.41 29.43 1dmu h HIS 60 CO 0.07 -0.41 0.22 -1.00 -1.30 0.00 0.00 177.93 175.52 1dmu h PRO 61 N 0.01 0.00 0.00 5.26 0.13 -1.86 0.43 132.00 135.97 1dmu h PRO 61 Ca 0.49 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.62 1dmu h PRO 61 Cb 0.83 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.96 1dmu h PRO 61 CO -0.95 0.00 0.00 0.74 -0.23 0.00 0.00 178.00 177.56 1dmu h PHE 62 N 0.00 0.00 0.00 1.56 -1.00 -0.73 -3.35 116.94 113.42 1dmu h PHE 62 Ca 0.13 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.91 1dmu h PHE 62 Cb 0.57 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.13 1dmu h PHE 62 CO 0.00 0.00 0.00 -2.67 -1.61 0.00 0.00 178.31 174.03 1dmu n TRP 63 N -2.91 0.00 -0.33 -0.55 4.27 -0.68 -4.85 117.44 112.38 1dmu n TRP 63 Ca 0.03 0.00 0.21 0.00 -3.89 0.00 0.00 57.50 53.85 1dmu n TRP 63 Cb 0.40 0.00 0.47 0.00 -1.36 0.00 0.00 31.31 30.82 1dmu n TRP 63 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 1dmu h MET 64 N 0.00 0.44 0.00 -2.67 -0.00 -0.31 0.64 114.93 113.03 1dmu h MET 64 Ca 0.00 -0.03 0.00 0.00 -0.00 0.00 0.00 59.70 59.67 1dmu h MET 64 Cb 0.05 -0.10 0.00 0.00 -0.00 0.00 0.00 31.60 31.55 1dmu h MET 64 CO 0.00 0.29 -0.23 0.09 -0.00 0.00 0.00 176.91 177.07 1dmu n ASN 65 N -4.69 0.25 -2.99 -0.10 3.02 -1.26 -4.16 115.26 105.33 1dmu n ASN 65 Ca 0.26 0.18 -0.17 0.00 -0.03 0.00 0.00 54.58 54.82 1dmu n ASN 65 Cb 0.83 -0.18 -0.01 0.00 -0.61 0.00 0.00 39.78 39.81 1dmu n ASN 65 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 1dmu n TYR 66 N -1.54 1.01 -1.71 3.10 4.02 0.16 -5.12 117.16 117.07 1dmu n TYR 66 Ca 0.06 -3.53 -0.30 0.00 -0.01 0.00 0.00 57.90 54.12 1dmu n TYR 66 Cb 0.34 -0.40 0.07 0.00 -0.02 0.00 0.00 39.34 39.33 1dmu n TYR 66 CO 0.00 0.00 0.00 -1.25 -1.01 0.00 0.00 176.86 174.60 1dmu s PRO 67 N -2.78 2.49 0.28 -0.72 0.04 -0.86 -4.93 135.00 128.53 1dmu s PRO 67 Ca 0.38 0.56 -0.29 0.00 0.04 0.00 0.00 61.00 61.69 1dmu s PRO 67 Cb 0.37 -1.97 -0.10 0.00 0.04 0.00 0.00 34.50 32.84 1dmu s PRO 67 CO -0.06 -1.32 1.34 -2.14 0.04 0.00 0.00 177.00 174.86 1dmu s PRO 68 N -5.25 4.34 0.76 0.56 0.02 -1.26 -4.95 135.00 129.21 1dmu s PRO 68 Ca 0.59 2.21 -0.11 0.00 0.02 0.00 0.00 61.00 63.71 1dmu s PRO 68 Cb -0.13 -3.10 0.05 0.00 0.02 0.00 0.00 34.50 31.34 1dmu s PRO 68 CO 0.53 -0.26 1.09 -0.51 -0.33 0.00 0.00 177.00 177.52 1dmu s LEU 69 N -1.08 3.07 0.58 -5.54 1.43 -1.26 -4.52 118.68 111.36 1dmu s LEU 69 Ca 0.53 1.82 -0.17 0.00 -1.03 0.00 0.00 54.13 55.28 1dmu s LEU 69 Cb -0.40 -4.52 -0.04 0.00 0.03 0.00 0.00 46.19 41.26 1dmu s LEU 69 CO 0.47 -1.95 1.10 -1.81 0.23 0.00 0.00 176.35 174.40 1dmu s ASP 70 N -3.37 5.60 0.18 2.29 -0.00 -1.26 -4.83 116.67 115.29 1dmu s ASP 70 Ca 0.61 2.03 -0.09 0.00 -0.00 0.00 0.00 52.55 55.10 1dmu s ASP 70 Cb -0.17 -2.56 -0.01 0.00 -0.00 0.00 0.00 42.92 40.18 1dmu s ASP 70 CO 0.55 -1.30 0.31 0.00 -0.00 0.00 0.00 175.17 174.73 1dmu s ARG 71 N -3.68 1.24 0.00 8.23 3.03 -1.26 -5.11 118.95 121.39 1dmu s ARG 71 Ca 0.69 -1.22 0.00 0.00 2.03 0.00 0.00 55.73 57.23 1dmu s ARG 71 Cb -0.21 0.39 0.00 0.00 -1.03 0.00 0.00 34.95 34.10 1dmu s ARG 71 CO 0.33 -0.46 0.00 0.41 -1.13 0.00 0.00 175.30 174.44 1dmu n GLY 72 N -0.25 -0.14 3.70 3.88 0.00 -1.26 -4.70 105.19 106.42 1dmu n GLY 72 Ca -0.06 -1.90 -0.42 0.00 0.00 0.00 0.00 46.02 43.64 1dmu n GLY 72 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1dmu s LYS 73 N -1.12 4.49 -1.20 1.61 2.20 -1.26 -4.39 119.74 120.07 1dmu s LYS 73 Ca 0.00 1.33 -0.24 0.00 -0.36 0.00 0.00 55.97 56.70 1dmu s LYS 73 Cb 0.00 -3.49 0.01 0.00 -1.51 0.00 0.00 37.83 32.84 1dmu s LYS 73 CO 0.00 -0.14 0.70 -1.33 -0.36 0.00 0.00 175.35 174.23 1dmu n MET 74 N 4.31 -1.01 -1.74 4.03 2.81 -1.26 -4.92 117.12 119.34 1dmu n MET 74 Ca 0.06 0.30 -0.42 0.00 -1.81 0.00 0.00 57.70 55.83 1dmu n MET 74 Cb 0.50 -3.55 -0.01 0.00 -0.71 0.00 0.00 33.22 29.45 1dmu n MET 74 CO 0.00 0.00 0.00 -2.30 1.51 0.00 0.00 175.97 175.18 1dmu n PRO 75 N -4.54 2.52 0.14 0.03 -0.02 -1.26 -4.87 135.00 127.00 1dmu n PRO 75 Ca -0.12 0.89 0.01 0.00 -2.02 0.00 0.00 63.50 62.25 1dmu n PRO 75 Cb 0.59 -2.60 0.31 0.00 -0.02 0.00 0.00 33.50 31.78 1dmu n PRO 75 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 1dmu h LYS 76 N 3.47 0.13 0.00 -0.52 1.79 -1.97 -3.47 116.57 116.00 1dmu h LYS 76 Ca -0.48 -0.05 0.00 0.00 -2.18 0.00 0.00 60.65 57.94 1dmu h LYS 76 Cb 1.25 -0.01 0.00 0.00 -1.58 0.00 0.00 32.23 31.89 1dmu h LYS 76 CO 0.69 0.47 0.00 0.41 -1.08 0.00 0.00 179.45 179.93 1dmu n GLY 77 N -0.43 0.66 0.33 3.86 0.00 -1.26 -4.95 105.19 103.39 1dmu n GLY 77 Ca -0.01 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.04 1dmu n GLY 77 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1dmu n ASP 78 N 0.00 2.56 -4.41 1.61 5.75 -1.26 -5.02 116.55 115.78 1dmu n ASP 78 Ca 0.00 -2.21 -0.29 0.00 -0.01 0.00 0.00 54.79 52.28 1dmu n ASP 78 Cb 0.00 -0.18 -0.13 0.00 -1.03 0.00 0.00 41.12 39.78 1dmu n ASP 78 CO 0.00 0.00 0.00 -1.58 -0.11 0.00 0.00 177.20 175.51 1dmu s GLN 79 N -1.37 1.49 -0.20 0.11 -0.44 -1.26 -5.00 119.66 112.99 1dmu s GLN 79 Ca 0.16 -1.31 -0.05 0.00 -2.50 0.00 0.00 55.36 51.67 1dmu s GLN 79 Cb 0.11 -1.95 -0.02 0.00 -1.64 0.00 0.00 33.01 29.51 1dmu s GLN 79 CO 0.07 0.46 -0.02 0.42 0.50 0.00 0.00 175.29 176.72 1dmu s ILE 80 N -1.08 3.78 -0.40 -2.34 -1.09 -1.26 -4.97 121.20 113.84 1dmu s ILE 80 Ca 0.15 -0.37 -0.37 0.00 -2.23 0.00 0.00 60.65 57.82 1dmu s ILE 80 Cb -0.10 -2.71 -0.13 0.00 -1.58 0.00 0.00 42.46 37.94 1dmu s ILE 80 CO 0.07 0.43 2.19 -2.65 -1.23 0.00 0.00 174.94 173.75 1dmu n PRO 81 N 4.34 0.78 -0.44 2.79 -0.02 -1.26 -4.80 135.00 136.39 1dmu n PRO 81 Ca -0.17 0.21 0.11 0.00 -2.02 0.00 0.00 63.50 61.62 1dmu n PRO 81 Cb 0.52 -2.21 0.33 0.00 -0.02 0.00 0.00 33.50 32.12 1dmu n PRO 81 CO 0.00 0.00 0.00 1.87 1.98 0.00 0.00 175.50 179.35 1dmu n TRP 82 N 9.32 1.11 -0.18 6.00 -0.00 -1.26 -4.71 117.44 127.72 1dmu n TRP 82 Ca 0.45 -0.51 -0.05 0.00 -0.00 0.00 0.00 57.50 57.39 1dmu n TRP 82 Cb 0.16 -0.07 0.01 0.00 -0.00 0.00 0.00 31.31 31.40 1dmu n TRP 82 CO 0.00 0.00 0.00 0.82 -0.00 0.00 0.00 177.69 178.51 1dmu h ILE 83 N 4.15 0.20 0.00 5.87 2.04 -1.95 -2.75 117.51 125.08 1dmu h ILE 83 Ca 0.00 0.00 -0.04 0.00 1.00 0.00 0.00 64.86 65.82 1dmu h ILE 83 Cb 1.10 0.20 -0.01 0.00 -0.74 0.00 0.00 36.82 37.38 1dmu h ILE 83 CO 0.07 0.00 -0.21 -0.33 0.00 0.00 0.00 178.15 177.68 1dmu h GLU 84 N -0.17 0.00 -0.26 2.37 5.08 -1.99 -2.82 114.58 116.78 1dmu h GLU 84 Ca 0.22 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.56 1dmu h GLU 84 Cb 0.54 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.78 1dmu h GLU 84 CO -0.64 0.21 0.07 0.28 -1.00 0.00 0.00 179.01 177.93 1dmu h VAL 85 N 0.00 1.21 -0.12 3.13 2.07 -1.84 -1.86 116.25 118.84 1dmu h VAL 85 Ca -0.00 -0.67 -0.12 0.00 0.82 0.00 0.00 66.70 66.73 1dmu h VAL 85 Cb 0.82 1.15 -0.01 0.00 -1.52 0.00 0.00 31.29 31.73 1dmu h VAL 85 CO 0.03 0.22 -0.45 1.23 0.02 0.00 0.00 177.57 178.62 1dmu h GLY 86 N 0.25 0.31 1.05 2.17 0.00 -1.57 -0.95 103.07 104.33 1dmu h GLY 86 Ca 0.08 -0.31 -0.07 0.00 0.00 0.00 0.00 47.33 47.03 1dmu h GLY 86 CO -0.00 0.28 0.10 0.83 0.00 0.00 0.00 176.54 177.75 1dmu h GLU 87 N 0.23 1.03 0.00 4.80 5.08 -1.27 -1.24 114.58 123.20 1dmu h GLU 87 Ca 0.02 -0.28 -0.11 0.00 -1.00 0.00 0.00 59.36 57.99 1dmu h GLU 87 Cb 0.89 -0.12 -0.02 0.00 0.50 0.00 0.00 28.75 30.00 1dmu h GLU 87 CO 0.07 0.96 -0.92 1.63 -1.00 0.00 0.00 179.01 179.76 1dmu n LYS 88 N -4.27 0.50 0.26 2.33 4.76 -0.72 -0.52 118.16 120.51 1dmu n LYS 88 Ca 0.03 0.52 0.11 0.00 -2.87 0.00 0.00 58.31 56.10 1dmu n LYS 88 Cb 0.29 -1.69 0.71 0.00 -1.84 0.00 0.00 35.03 32.50 1dmu n LYS 88 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1dmu h ALA 89 N -0.81 1.51 0.00 7.82 0.00 -1.32 -2.49 119.26 123.96 1dmu h ALA 89 Ca -0.17 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.66 1dmu h ALA 89 Cb 0.89 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.66 1dmu h ALA 89 CO -0.10 0.12 -0.44 0.28 0.00 0.00 0.00 179.25 179.11 1dmu n VAL 90 N -3.94 1.28 0.23 0.00 0.31 -0.89 -4.51 118.33 110.81 1dmu n VAL 90 Ca -0.02 0.28 -0.15 0.00 -0.01 0.00 0.00 64.34 64.44 1dmu n VAL 90 Cb 0.19 -1.90 -0.08 0.00 -0.91 0.00 0.00 33.84 31.14 1dmu n VAL 90 CO 0.00 0.00 0.00 1.23 -1.32 0.00 0.00 176.83 176.74 1dmu h GLY 91 N -0.44 -0.63 1.56 2.92 0.00 -0.84 -1.82 103.07 103.82 1dmu h GLY 91 Ca 0.00 0.28 -0.13 0.00 0.00 0.00 0.00 47.33 47.47 1dmu h GLY 91 CO 0.00 -0.24 -0.44 1.76 0.00 0.00 0.00 176.54 177.61 1dmu h SER 92 N -0.60 0.52 -0.76 0.19 0.02 -0.67 -2.86 113.55 109.39 1dmu h SER 92 Ca -0.04 -0.24 -0.03 0.00 -0.84 0.00 0.00 61.79 60.64 1dmu h SER 92 Cb 0.51 -0.15 -0.03 0.00 0.14 0.00 0.00 62.40 62.87 1dmu h SER 92 CO 0.03 0.89 0.34 0.50 -1.14 0.00 0.00 176.83 177.45 1dmu h LYS 93 N 0.39 1.10 -0.73 3.45 3.64 -1.40 -2.75 116.57 120.28 1dmu h LYS 93 Ca 0.03 -0.18 -0.06 0.00 -1.27 0.00 0.00 60.65 59.17 1dmu h LYS 93 Cb 0.94 -0.19 -0.03 0.00 -0.41 0.00 0.00 32.23 32.53 1dmu h LYS 93 CO 0.08 0.88 0.23 -0.07 -2.27 0.00 0.00 179.45 178.30 1dmu h LEU 94 N 1.07 1.05 -0.64 5.20 3.38 -1.20 -1.26 115.31 122.91 1dmu h LEU 94 Ca 0.26 -0.21 0.04 0.00 0.09 0.00 0.00 57.88 58.06 1dmu h LEU 94 Cb 0.15 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 40.58 1dmu h LEU 94 CO -0.03 0.98 0.39 0.74 0.09 0.00 0.00 178.44 180.61 1dmu h THR 95 N 1.07 1.05 -0.32 0.22 2.02 -1.27 0.82 112.91 116.50 1dmu h THR 95 Ca 0.23 -0.26 -0.04 0.00 0.77 0.00 0.00 66.41 67.12 1dmu h THR 95 Cb 0.30 0.24 -0.01 0.00 -1.74 0.00 0.00 68.15 66.94 1dmu h THR 95 CO -0.01 0.14 0.04 -0.09 0.37 0.00 0.00 175.52 175.96 1dmu h ARG 96 N 0.75 0.54 -0.27 6.66 2.43 -1.22 -2.68 114.38 120.59 1dmu h ARG 96 Ca 0.27 -0.15 -0.06 0.00 -0.81 0.00 0.00 59.98 59.22 1dmu h ARG 96 Cb 0.07 -0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 29.54 1dmu h ARG 96 CO -0.13 0.65 -0.09 -0.07 -1.51 0.00 0.00 179.97 178.83 1dmu h LEU 97 N 0.36 0.41 -0.38 3.80 3.38 -0.79 -1.95 115.31 120.14 1dmu h LEU 97 Ca 0.10 -0.09 -0.07 0.00 0.09 0.00 0.00 57.88 57.91 1dmu h LEU 97 Cb 0.38 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.01 1dmu h LEU 97 CO 0.01 0.54 -0.02 0.58 0.09 0.00 0.00 178.44 179.64 1dmu h VAL 98 N 0.41 1.26 0.00 1.22 2.07 -0.76 -2.77 116.25 117.68 1dmu h VAL 98 Ca 0.08 -1.04 -0.02 0.00 0.82 0.00 0.00 66.70 66.53 1dmu h VAL 98 Cb 0.41 1.18 -0.00 0.00 -1.52 0.00 0.00 31.29 31.35 1dmu h VAL 98 CO 0.02 0.35 -0.11 0.77 0.02 0.00 0.00 177.57 178.62 1dmu h SER 99 N 0.51 0.00 0.72 0.57 4.64 -1.12 -1.62 113.55 117.25 1dmu h SER 99 Ca 0.11 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.43 1dmu h SER 99 Cb 0.51 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.60 1dmu h SER 99 CO 0.02 0.11 -0.06 0.00 -0.87 0.00 0.00 176.83 176.04 1dmu n GLN 100 N -3.49 0.25 -1.95 4.77 6.02 -0.77 -4.78 117.38 117.44 1dmu n GLN 100 Ca -0.01 -0.03 -0.41 0.00 -0.01 0.00 0.00 57.00 56.53 1dmu n GLN 100 Cb 0.25 -1.50 -0.02 0.00 1.02 0.00 0.00 30.24 30.00 1dmu n GLN 100 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.06 177.08 1dmu s ARG 101 N -2.78 4.23 0.19 -1.09 1.81 -0.61 -4.88 118.95 115.82 1dmu s ARG 101 Ca 0.21 2.38 -0.22 0.00 -1.72 0.00 0.00 55.73 56.38 1dmu s ARG 101 Cb 0.19 -3.08 0.11 0.00 -0.45 0.00 0.00 34.95 31.73 1dmu s ARG 101 CO 0.51 -0.47 1.57 1.05 -0.68 0.00 0.00 175.30 177.28 1dmu h GLU 102 N 4.78 -0.12 -0.11 3.54 4.11 -1.88 -2.42 114.58 122.48 1dmu h GLU 102 Ca -0.47 0.01 0.00 0.00 0.07 0.00 0.00 59.36 58.97 1dmu h GLU 102 Cb 1.22 0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.50 1dmu h GLU 102 CO 0.77 -0.08 0.00 -0.40 0.07 0.00 0.00 179.01 179.36 1dmu n ASP 103 N -5.42 1.17 -4.56 3.06 5.75 -1.26 -4.90 116.55 110.39 1dmu n ASP 103 Ca 0.05 -1.61 -0.34 0.00 -0.01 0.00 0.00 54.79 52.88 1dmu n ASP 103 Cb 0.36 -0.07 -0.11 0.00 -1.03 0.00 0.00 41.12 40.27 1dmu n ASP 103 CO 0.00 0.00 0.00 -0.63 -0.11 0.00 0.00 177.20 176.46 1dmu s ILE 104 N -1.86 3.92 -0.09 2.12 1.01 -0.91 -4.41 121.20 120.97 1dmu s ILE 104 Ca 0.32 -0.37 0.03 0.00 0.00 0.00 0.00 60.65 60.62 1dmu s ILE 104 Cb 0.16 -2.67 -0.01 0.00 0.01 0.00 0.00 42.46 39.96 1dmu s ILE 104 CO 0.25 0.55 -0.19 -0.89 0.00 0.00 0.00 174.94 174.66 1dmu s THR 105 N -0.26 2.57 -0.06 2.92 2.01 -0.51 -4.72 115.64 117.60 1dmu s THR 105 Ca 0.04 -0.86 0.02 0.00 0.31 0.00 0.00 61.69 61.21 1dmu s THR 105 Cb -0.13 -2.01 -0.03 0.00 0.01 0.00 0.00 72.50 70.35 1dmu s THR 105 CO 0.02 0.56 -0.12 -0.69 -0.69 0.00 0.00 174.62 173.70 1dmu s VAL 106 N 0.02 3.30 -0.06 3.82 1.01 -1.26 -1.23 120.40 126.00 1dmu s VAL 106 Ca -0.07 -0.63 -0.01 0.00 0.00 0.00 0.00 61.98 61.28 1dmu s VAL 106 Cb -0.15 -2.32 0.03 0.00 0.00 0.00 0.00 36.38 33.94 1dmu s VAL 106 CO 0.05 0.59 -0.01 -0.13 0.00 0.00 0.00 175.10 175.60 1dmu s ARG 107 N -0.72 0.59 -1.11 2.72 1.81 -0.43 -4.96 118.95 116.86 1dmu s ARG 107 Ca 0.11 0.06 -0.18 0.00 -1.72 0.00 0.00 55.73 54.00 1dmu s ARG 107 Cb -0.11 -0.86 0.11 0.00 -0.45 0.00 0.00 34.95 33.64 1dmu s ARG 107 CO 0.01 -0.23 1.42 -1.21 -0.68 0.00 0.00 175.30 174.61 1dmu s GLU 108 N 1.60 3.81 -0.03 3.54 8.01 -1.26 -0.43 118.70 133.94 1dmu s GLU 108 Ca -0.01 -1.88 -0.30 0.00 0.01 0.00 0.00 54.97 52.80 1dmu s GLU 108 Cb -0.13 -5.20 -0.04 0.00 -4.31 0.00 0.00 34.13 24.45 1dmu s GLU 108 CO -0.03 -1.98 1.29 0.42 0.01 0.00 0.00 175.26 174.96 1dmu s ILE 109 N 3.29 4.01 0.22 -1.63 -1.09 -1.26 -4.96 121.20 119.77 1dmu s ILE 109 Ca 0.43 1.36 -0.31 0.00 -2.23 0.00 0.00 60.65 59.90 1dmu s ILE 109 Cb -0.01 -3.87 -0.11 0.00 -1.58 0.00 0.00 42.46 36.89 1dmu s ILE 109 CO -0.03 -0.00 1.55 -0.83 -1.23 0.00 0.00 174.94 174.40 1dmu s GLY 110 N 1.65 1.85 -0.09 6.18 0.00 -1.26 -4.93 107.32 110.72 1dmu s GLY 110 Ca 0.59 1.42 -0.09 0.00 0.00 0.00 0.00 44.72 46.65 1dmu s GLY 110 CO 0.24 2.54 0.25 1.08 0.00 0.00 0.00 173.10 177.21 1dmu s LEU 111 N 0.39 1.04 0.33 0.66 1.43 -1.26 -5.07 118.68 116.19 1dmu s LEU 111 Ca 0.66 0.50 0.26 0.00 -1.03 0.00 0.00 54.13 54.52 1dmu s LEU 111 Cb -0.45 0.85 0.79 0.00 0.03 0.00 0.00 46.19 47.42 1dmu s LEU 111 CO 0.38 -0.09 1.75 1.55 0.23 0.00 0.00 176.35 180.17 1dmu h PRO 112 N 5.80 0.00 -4.37 1.29 0.13 -2.05 -3.46 132.00 129.33 1dmu h PRO 112 Ca -0.26 0.00 -0.18 0.00 -0.87 0.00 0.00 66.00 64.69 1dmu h PRO 112 Cb 1.19 0.00 -0.15 0.00 0.13 0.00 0.00 31.00 32.18 1dmu h PRO 112 CO 0.35 0.00 -0.58 0.95 -0.23 0.00 0.00 178.00 178.49 1dmu s THR 113 N -3.25 0.07 -4.49 1.56 -4.23 -1.26 -5.15 115.64 98.88 1dmu s THR 113 Ca 0.07 -1.85 0.00 0.00 -1.18 0.00 0.00 61.69 58.73 1dmu s THR 113 Cb 0.09 -2.11 0.00 0.00 1.34 0.00 0.00 72.50 71.82 1dmu s THR 113 CO 0.57 -0.34 0.00 0.61 -0.54 0.00 0.00 174.62 174.92 1dmu n GLY 114 N -0.15 0.96 3.68 3.99 0.00 -1.26 -5.11 105.19 107.29 1dmu n GLY 114 Ca -0.04 -1.96 -0.29 0.00 0.00 0.00 0.00 46.02 43.72 1dmu n GLY 114 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1dmu s PRO 115 N -1.50 -0.20 0.17 1.61 0.04 -1.25 -4.92 135.00 128.95 1dmu s PRO 115 Ca 0.00 0.11 -0.22 0.00 0.04 0.00 0.00 61.00 60.93 1dmu s PRO 115 Cb 0.00 -1.70 0.07 0.00 0.04 0.00 0.00 34.50 32.91 1dmu s PRO 115 CO 0.00 -3.07 1.59 -0.44 0.04 0.00 0.00 177.00 175.13 1dmu h ASP 116 N -2.12 -1.10 -3.81 6.66 3.32 -1.93 -3.41 116.42 114.02 1dmu h ASP 116 Ca -0.49 0.20 -0.68 0.00 0.02 0.00 0.00 57.03 56.08 1dmu h ASP 116 Cb 1.31 0.53 -0.28 0.00 0.22 0.00 0.00 39.33 41.10 1dmu h ASP 116 CO 0.46 -0.32 -0.82 -1.61 -1.72 0.00 0.00 179.24 175.23 1dmu s GLU 117 N -5.99 2.78 -0.08 3.56 0.41 0.11 -5.02 118.70 114.47 1dmu s GLU 117 Ca -0.15 -0.79 -0.04 0.00 -0.41 0.00 0.00 54.97 53.59 1dmu s GLU 117 Cb 0.14 -2.35 0.04 0.00 -1.78 0.00 0.00 34.13 30.17 1dmu s GLU 117 CO 0.68 0.40 0.18 1.03 -0.49 0.00 0.00 175.26 177.06 1dmu s ARG 118 N -0.17 0.14 -0.17 1.61 0.52 -1.26 -1.30 118.95 118.32 1dmu s ARG 118 Ca -0.02 0.39 -0.30 0.00 -0.52 0.00 0.00 55.73 55.29 1dmu s ARG 118 Cb -0.14 -0.12 0.13 0.00 0.52 0.00 0.00 34.95 35.34 1dmu s ARG 118 CO 0.04 -0.14 0.99 1.52 0.02 0.00 0.00 175.30 177.73 1dmu s TYR 119 N 1.01 -0.39 -0.23 -0.53 -0.85 -0.94 -4.62 117.35 110.80 1dmu s TYR 119 Ca -0.08 0.69 -0.29 0.00 -0.52 0.00 0.00 57.07 56.88 1dmu s TYR 119 Cb -0.09 0.44 0.00 0.00 0.38 0.00 0.00 41.96 42.69 1dmu s TYR 119 CO -0.06 -0.34 1.17 -1.17 -1.52 0.00 0.00 175.55 173.64 1dmu s LEU 120 N -0.99 4.07 -0.24 -3.49 2.96 0.43 -0.22 118.68 121.19 1dmu s LEU 120 Ca -0.02 1.41 -0.08 0.00 -0.22 0.00 0.00 54.13 55.23 1dmu s LEU 120 Cb -0.01 -3.54 -0.03 0.00 0.50 0.00 0.00 46.19 43.11 1dmu s LEU 120 CO 0.01 -0.81 0.09 -0.22 -1.32 0.00 0.00 176.35 174.10 1dmu s LEU 121 N 3.58 3.58 -0.03 -0.68 0.20 0.11 -1.32 118.68 124.13 1dmu s LEU 121 Ca 0.50 -0.13 0.07 0.00 0.69 0.00 0.00 54.13 55.26 1dmu s LEU 121 Cb -0.17 -1.96 -0.02 0.00 -0.43 0.00 0.00 46.19 43.61 1dmu s LEU 121 CO 0.13 -0.00 -0.24 -0.89 -0.29 0.00 0.00 176.35 175.06 1dmu s THR 122 N 1.45 2.17 -0.20 3.68 2.01 -0.36 -0.86 115.64 123.52 1dmu s THR 122 Ca 0.06 -1.05 -0.29 0.00 0.31 0.00 0.00 61.69 60.71 1dmu s THR 122 Cb -0.15 -1.77 0.14 0.00 0.01 0.00 0.00 72.50 70.73 1dmu s THR 122 CO 0.04 0.58 1.06 -0.55 -0.69 0.00 0.00 174.62 175.06 1dmu s SER 123 N -0.51 -0.33 0.59 3.53 0.15 -0.02 -1.43 113.70 115.68 1dmu s SER 123 Ca 0.07 0.42 0.34 0.00 0.70 0.00 0.00 55.95 57.48 1dmu s SER 123 Cb -0.11 0.35 1.86 0.00 -1.71 0.00 0.00 66.02 66.41 1dmu s SER 123 CO 0.00 -0.27 2.21 -0.65 1.20 0.00 0.00 173.24 175.74 1dmu h PRO 124 N 2.76 0.00 -0.62 5.44 0.11 -1.84 -1.79 132.00 136.05 1dmu h PRO 124 Ca -0.19 0.00 -0.07 0.00 0.11 0.00 0.00 66.00 65.86 1dmu h PRO 124 Cb 1.17 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.25 1dmu h PRO 124 CO 0.27 0.04 0.13 1.15 -0.21 0.00 0.00 178.00 179.37 1dmu h THR 125 N 0.00 1.25 -0.12 -1.15 2.02 -1.92 -1.89 112.91 111.10 1dmu h THR 125 Ca -0.00 -0.94 -0.12 0.00 0.77 0.00 0.00 66.41 66.12 1dmu h THR 125 Cb 0.16 0.64 -0.01 0.00 -1.74 0.00 0.00 68.15 67.19 1dmu h THR 125 CO 0.00 0.35 -0.46 0.40 0.37 0.00 0.00 175.52 176.19 1dmu h ILE 126 N 0.94 1.33 -0.32 3.11 2.04 -1.60 -0.89 117.51 122.12 1dmu h ILE 126 Ca 0.20 -1.65 -0.04 0.00 1.00 0.00 0.00 64.86 64.37 1dmu h ILE 126 Cb 0.37 1.75 -0.01 0.00 -0.74 0.00 0.00 36.82 38.18 1dmu h ILE 126 CO 0.00 0.49 0.04 0.22 0.00 0.00 0.00 178.15 178.91 1dmu h TYR 127 N 0.24 0.58 -0.16 1.37 3.20 -1.29 -0.39 116.97 120.51 1dmu h TYR 127 Ca 0.02 -0.09 -0.12 0.00 3.14 0.00 0.00 58.73 61.67 1dmu h TYR 127 Cb 0.90 -0.16 0.00 0.00 1.54 0.00 0.00 36.73 39.02 1dmu h TYR 127 CO 0.02 0.63 -0.39 0.66 -1.64 0.00 0.00 178.16 177.44 1dmu h SER 128 N 0.36 0.62 -0.87 -2.11 4.64 -1.30 0.66 113.55 115.54 1dmu h SER 128 Ca 0.10 -0.57 0.15 0.00 -0.47 0.00 0.00 61.79 60.99 1dmu h SER 128 Cb 0.37 -0.18 -0.09 0.00 -0.31 0.00 0.00 62.40 62.19 1dmu h SER 128 CO 0.01 1.08 0.46 -0.07 -0.87 0.00 0.00 176.83 177.44 1dmu h LEU 129 N 0.18 0.57 -2.71 5.97 3.38 -1.11 0.28 115.31 121.88 1dmu h LEU 129 Ca -0.00 0.09 0.00 0.00 0.09 0.00 0.00 57.88 58.06 1dmu h LEU 129 Cb 1.00 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.74 1dmu h LEU 129 CO 0.08 0.24 0.00 0.35 0.09 0.00 0.00 178.44 179.20 1dmu n THR 130 N -4.85 1.77 -4.20 0.22 -2.24 -0.16 -4.92 114.28 99.89 1dmu n THR 130 Ca 0.18 -0.97 -0.30 0.00 -2.27 0.00 0.00 64.05 60.68 1dmu n THR 130 Cb 0.44 -0.19 -0.07 0.00 -2.10 0.00 0.00 70.33 68.42 1dmu n THR 130 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 1dmu n ASN 131 N 0.60 0.13 0.00 3.42 5.15 0.98 -0.94 115.26 124.61 1dmu n ASN 131 Ca 0.20 -1.17 0.00 0.00 -0.60 0.00 0.00 54.58 53.01 1dmu n ASN 131 Cb 0.85 -2.16 0.00 0.00 -0.53 0.00 0.00 39.78 37.94 1dmu n ASN 131 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1dmu n GLY 132 N -2.23 1.76 0.25 8.20 0.00 0.22 -4.93 105.19 108.46 1dmu n GLY 132 Ca -0.27 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.63 1dmu n GLY 132 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1dmu h PHE 133 N 0.00 -0.55 -3.23 1.61 3.57 -1.26 -3.46 116.94 113.63 1dmu h PHE 133 Ca 0.00 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.50 1dmu h PHE 133 Cb 0.00 0.24 -0.10 0.00 2.79 0.00 0.00 35.95 38.88 1dmu h PHE 133 CO 0.00 -0.30 0.08 -0.08 -2.23 0.00 0.00 178.31 175.78 1dmu s THR 134 N -6.10 0.02 -0.61 4.41 -1.32 -1.26 -4.96 115.64 105.82 1dmu s THR 134 Ca -0.15 -0.68 0.06 0.00 -1.21 0.00 0.00 61.69 59.71 1dmu s THR 134 Cb 0.08 -1.53 0.13 0.00 -1.51 0.00 0.00 72.50 69.68 1dmu s THR 134 CO 0.66 -0.09 0.99 -0.90 -2.21 0.00 0.00 174.62 173.07 1dmu n ASP 135 N -0.36 2.18 -4.22 8.08 3.85 -1.26 -2.86 116.55 121.96 1dmu n ASP 135 Ca -0.11 -1.74 -0.15 0.00 -0.71 0.00 0.00 54.79 52.08 1dmu n ASP 135 Cb 0.62 -0.09 -0.10 0.00 -1.35 0.00 0.00 41.12 40.20 1dmu n ASP 135 CO 0.00 0.00 0.00 -0.44 -1.01 0.00 0.00 177.20 175.75 1dmu s SER 136 N -0.83 1.67 0.06 -1.12 0.01 -1.26 -0.84 113.70 111.38 1dmu s SER 136 Ca 0.11 -0.90 -0.08 0.00 1.31 0.00 0.00 55.95 56.39 1dmu s SER 136 Cb 0.06 -0.01 -0.00 0.00 0.21 0.00 0.00 66.02 66.28 1dmu s SER 136 CO 0.08 -0.28 0.16 0.27 0.41 0.00 0.00 173.24 173.88 1dmu s ILE 137 N -2.81 0.14 -0.44 1.44 -4.36 -0.04 -4.14 121.20 110.98 1dmu s ILE 137 Ca 0.11 -1.13 -0.14 0.00 -0.26 0.00 0.00 60.65 59.23 1dmu s ILE 137 Cb -0.01 -1.14 0.06 0.00 1.25 0.00 0.00 42.46 42.62 1dmu s ILE 137 CO 0.01 -0.62 0.34 -0.32 0.24 0.00 0.00 174.94 174.58 1dmu s MET 138 N -3.24 2.88 -0.00 0.37 -2.45 -0.37 0.09 119.30 116.57 1dmu s MET 138 Ca 0.00 -1.31 -0.30 0.00 -1.25 0.00 0.00 55.69 52.83 1dmu s MET 138 Cb 0.02 -4.00 -0.04 0.00 1.25 0.00 0.00 34.83 32.06 1dmu s MET 138 CO -0.08 -0.95 1.16 -1.64 1.05 0.00 0.00 175.02 174.57 1dmu s MET 139 N 1.59 4.41 -0.36 4.11 1.00 0.69 -1.17 119.30 129.57 1dmu s MET 139 Ca 0.04 1.67 0.02 0.00 0.00 0.00 0.00 55.69 57.42 1dmu s MET 139 Cb -0.23 -3.46 0.11 0.00 0.00 0.00 0.00 34.83 31.24 1dmu s MET 139 CO 0.06 -0.32 0.10 -0.06 0.00 0.00 0.00 175.02 174.81 1dmu s PHE 140 N 1.60 2.97 -0.12 -0.03 2.99 -0.15 -2.21 117.98 123.04 1dmu s PHE 140 Ca 0.56 -2.62 0.02 0.00 0.00 0.00 0.00 56.93 54.89 1dmu s PHE 140 Cb -0.26 -2.49 -0.00 0.00 0.00 0.00 0.00 43.02 40.27 1dmu s PHE 140 CO 0.25 -0.89 -0.20 0.08 -0.00 0.00 0.00 175.22 174.46 1dmu s VAL 141 N 0.92 2.40 -0.04 -0.44 1.01 -0.42 -0.51 120.40 123.32 1dmu s VAL 141 Ca 0.12 -0.89 0.04 0.00 0.00 0.00 0.00 61.98 61.25 1dmu s VAL 141 Cb -0.20 -1.96 -0.00 0.00 0.00 0.00 0.00 36.38 34.22 1dmu s VAL 141 CO -0.11 0.54 -0.15 -0.62 0.00 0.00 0.00 175.10 174.76 1dmu s ASP 142 N 0.42 1.91 -0.16 3.32 -1.08 -0.86 -0.71 116.67 119.52 1dmu s ASP 142 Ca -0.14 -0.31 -0.20 0.00 -0.52 0.00 0.00 52.55 51.38 1dmu s ASP 142 Cb -0.17 -0.55 -0.03 0.00 -1.46 0.00 0.00 42.92 40.70 1dmu s ASP 142 CO 0.06 0.12 0.57 -0.63 0.52 0.00 0.00 175.17 175.81 1dmu s ILE 143 N 0.12 5.10 -0.33 4.11 -1.09 -1.26 -1.55 121.20 126.31 1dmu s ILE 143 Ca -0.05 1.09 0.01 0.00 -2.23 0.00 0.00 60.65 59.48 1dmu s ILE 143 Cb -0.11 -3.89 0.10 0.00 -1.58 0.00 0.00 42.46 36.98 1dmu s ILE 143 CO 0.02 0.21 0.08 -0.54 -1.23 0.00 0.00 174.94 173.48 1dmu s LYS 144 N 1.30 1.04 0.14 2.79 -0.14 0.56 -4.96 119.74 120.47 1dmu s LYS 144 Ca 0.28 -1.43 -0.15 0.00 -1.36 0.00 0.00 55.97 53.31 1dmu s LYS 144 Cb -0.16 -2.49 -0.07 0.00 -1.68 0.00 0.00 37.83 33.43 1dmu s LYS 144 CO 0.11 -0.97 0.56 -1.12 -0.76 0.00 0.00 175.35 173.17 1dmu s SER 145 N 1.29 6.88 0.04 2.83 0.01 -1.26 -3.43 113.70 120.06 1dmu s SER 145 Ca 0.10 1.12 -0.01 0.00 1.31 0.00 0.00 55.95 58.48 1dmu s SER 145 Cb -0.18 -2.31 -0.03 0.00 0.21 0.00 0.00 66.02 63.71 1dmu s SER 145 CO -0.18 0.13 -0.02 0.68 0.41 0.00 0.00 173.24 174.26 1dmu s VAL 146 N -1.40 0.19 0.00 3.43 -7.23 -0.92 -4.98 120.40 109.49 1dmu s VAL 146 Ca 0.36 -1.60 0.00 0.00 -1.81 0.00 0.00 61.98 58.94 1dmu s VAL 146 Cb -0.16 -1.25 0.00 0.00 0.56 0.00 0.00 36.38 35.53 1dmu s VAL 146 CO 0.19 -0.88 0.00 0.61 -0.31 0.00 0.00 175.10 174.71 1dmu n GLY 147 N 0.42 3.16 0.00 2.32 0.00 -1.26 -2.28 105.19 107.54 1dmu n GLY 147 Ca -0.16 -2.16 0.07 0.00 0.00 0.00 0.00 46.02 43.77 1dmu n GLY 147 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1dmu n PRO 148 N -0.47 0.33 -0.22 1.61 -0.04 -1.25 -2.95 135.00 132.01 1dmu n PRO 148 Ca 0.00 0.08 0.08 0.00 -0.04 0.00 0.00 63.50 63.62 1dmu n PRO 148 Cb 0.00 -1.50 0.20 0.00 -0.04 0.00 0.00 33.50 32.16 1dmu n PRO 148 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1dmu n ARG 149 N -1.15 2.68 -4.18 0.54 1.74 -1.26 -4.95 116.66 110.08 1dmu n ARG 149 Ca 0.09 -2.18 -0.12 0.00 -0.77 0.00 0.00 57.85 54.87 1dmu n ARG 149 Cb 0.09 -1.36 -0.10 0.00 -1.02 0.00 0.00 32.46 30.06 1dmu n ARG 149 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 1dmu s ASP 150 N -1.02 1.28 0.15 0.55 2.15 -1.15 -5.12 116.67 113.51 1dmu s ASP 150 Ca 0.31 -0.94 -0.31 0.00 0.43 0.00 0.00 52.55 52.03 1dmu s ASP 150 Cb 0.16 0.06 -0.09 0.00 -0.30 0.00 0.00 42.92 42.75 1dmu s ASP 150 CO 0.21 -0.39 1.49 -0.55 -0.17 0.00 0.00 175.17 175.76 1dmu s SER 151 N -2.86 6.69 0.00 -0.34 0.15 -1.26 -4.69 113.70 111.38 1dmu s SER 151 Ca 0.10 2.50 0.18 0.00 0.70 0.00 0.00 55.95 59.43 1dmu s SER 151 Cb 0.02 -2.59 0.65 0.00 -1.71 0.00 0.00 66.02 62.39 1dmu s SER 151 CO -0.03 -0.75 1.48 -0.90 1.20 0.00 0.00 173.24 174.24 1dmu n ASP 152 N 3.86 1.63 -0.37 5.45 5.75 -1.26 -4.12 116.55 127.48 1dmu n ASP 152 Ca 0.12 -1.77 0.06 0.00 -0.01 0.00 0.00 54.79 53.19 1dmu n ASP 152 Cb 0.40 -0.13 0.13 0.00 -1.03 0.00 0.00 41.12 40.49 1dmu n ASP 152 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1dmu n TYR 153 N 0.32 0.32 -4.49 2.11 0.18 -1.26 -5.04 117.16 109.30 1dmu n TYR 153 Ca 0.15 -0.72 -0.25 0.00 1.88 0.00 0.00 57.90 58.96 1dmu n TYR 153 Cb 0.31 -0.13 -0.08 0.00 -0.38 0.00 0.00 39.34 39.06 1dmu n TYR 153 CO 0.00 0.00 0.00 0.16 -2.08 0.00 0.00 176.86 174.94 1dmu s ASP 154 N -1.71 2.72 -0.06 9.48 1.47 -1.26 -0.74 116.67 126.58 1dmu s ASP 154 Ca 0.23 -1.72 -0.04 0.00 1.18 0.00 0.00 52.55 52.20 1dmu s ASP 154 Cb 0.18 0.57 0.02 0.00 -0.34 0.00 0.00 42.92 43.36 1dmu s ASP 154 CO 0.06 -0.99 0.16 -0.76 0.68 0.00 0.00 175.17 174.32 1dmu s LEU 155 N -3.59 1.14 -0.32 2.11 1.43 -0.77 -4.86 118.68 113.82 1dmu s LEU 155 Ca 0.25 0.32 -0.03 0.00 -1.03 0.00 0.00 54.13 53.64 1dmu s LEU 155 Cb 0.02 0.49 0.06 0.00 0.03 0.00 0.00 46.19 46.78 1dmu s LEU 155 CO 0.16 -0.09 0.04 -0.69 0.23 0.00 0.00 176.35 176.01 1dmu s VAL 156 N 0.50 3.14 -0.10 -1.59 1.01 -1.26 -1.02 120.40 121.07 1dmu s VAL 156 Ca -0.03 -1.43 -0.02 0.00 0.00 0.00 0.00 61.98 60.49 1dmu s VAL 156 Cb -0.05 -2.85 -0.03 0.00 0.00 0.00 0.00 36.38 33.45 1dmu s VAL 156 CO -0.02 -0.19 -0.02 -0.76 0.00 0.00 0.00 175.10 174.11 1dmu s LEU 157 N 1.26 3.43 0.51 3.92 1.43 0.24 -4.88 118.68 124.58 1dmu s LEU 157 Ca -0.03 0.04 -0.12 0.00 -1.03 0.00 0.00 54.13 52.99 1dmu s LEU 157 Cb -0.20 -1.79 -0.06 0.00 0.03 0.00 0.00 46.19 44.17 1dmu s LEU 157 CO -0.01 0.32 0.92 -0.44 0.23 0.00 0.00 176.35 177.36 1dmu s SER 158 N -0.51 6.46 0.33 2.29 0.01 -1.26 -0.63 113.70 120.39 1dmu s SER 158 Ca 0.08 1.34 0.11 0.00 1.31 0.00 0.00 55.95 58.80 1dmu s SER 158 Cb -0.12 -2.42 0.95 0.00 0.21 0.00 0.00 66.02 64.64 1dmu s SER 158 CO 0.02 -0.60 1.71 -0.65 0.41 0.00 0.00 173.24 174.13 1dmu h PRO 159 N 0.64 0.48 0.00 12.44 0.11 -1.83 0.38 132.00 144.23 1dmu h PRO 159 Ca -0.46 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.62 1dmu h PRO 159 Cb 1.19 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.19 1dmu h PRO 159 CO 0.62 0.32 0.00 0.09 -0.21 0.00 0.00 178.00 178.82 1dmu n ASN 160 N -4.94 0.00 -0.07 -2.05 3.02 -1.26 -1.67 115.26 108.29 1dmu n ASN 160 Ca 0.28 -1.10 0.01 0.00 -0.03 0.00 0.00 54.58 53.74 1dmu n ASN 160 Cb 0.82 0.00 0.01 0.00 -0.61 0.00 0.00 39.78 40.00 1dmu n ASN 160 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1dmu n GLN 161 N -0.69 1.22 -4.30 3.52 6.02 0.13 -3.84 117.38 119.45 1dmu n GLN 161 Ca 0.06 -1.11 -0.18 0.00 -0.01 0.00 0.00 57.00 55.76 1dmu n GLN 161 Cb 0.03 -1.03 -0.14 0.00 1.02 0.00 0.00 30.24 30.12 1dmu n GLN 161 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 1dmu s VAL 162 N -0.59 0.69 0.23 5.09 1.01 -1.11 -4.94 120.40 120.78 1dmu s VAL 162 Ca 0.02 -0.50 0.05 0.00 0.00 0.00 0.00 61.98 61.56 1dmu s VAL 162 Cb 0.01 -0.60 -0.03 0.00 0.00 0.00 0.00 36.38 35.76 1dmu s VAL 162 CO 0.02 0.10 0.31 -0.94 0.00 0.00 0.00 175.10 174.59 1dmu s SER 163 N -0.45 6.12 0.00 3.32 1.04 -1.26 -2.50 113.70 119.98 1dmu s SER 163 Ca 0.02 0.00 0.00 0.00 0.48 0.00 0.00 55.95 56.45 1dmu s SER 163 Cb -0.04 -1.75 0.00 0.00 0.10 0.00 0.00 66.02 64.32 1dmu s SER 163 CO -0.00 -0.05 0.00 0.61 0.98 0.00 0.00 173.24 174.78 1dmu n GLY 164 N -1.24 5.55 0.20 7.32 0.00 -0.63 -3.20 105.19 113.19 1dmu n GLY 164 Ca -0.09 -1.88 0.08 0.00 0.00 0.00 0.00 46.02 44.13 1dmu n GLY 164 CO 0.00 0.00 0.00 3.45 0.00 0.00 0.00 173.32 176.77 1dmu h ASN 165 N 0.00 0.00 -6.17 1.61 -1.07 -1.84 -3.30 115.58 104.81 1dmu h ASN 165 Ca 0.00 0.00 -0.45 0.00 0.07 0.00 0.00 56.30 55.92 1dmu h ASN 165 Cb 0.00 0.00 0.02 0.00 -2.07 0.00 0.00 38.32 36.27 1dmu h ASN 165 CO 0.00 0.30 -0.78 0.61 0.07 0.00 0.00 177.43 177.63 1dmu n GLY 166 N 0.31 -0.43 3.77 9.14 0.00 -1.18 -4.81 105.19 112.00 1dmu n GLY 166 Ca 0.00 0.17 -0.40 0.00 0.00 0.00 0.00 46.02 45.80 1dmu n GLY 166 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1dmu s ASP 167 N -3.70 6.39 -0.42 1.61 1.01 -0.41 -4.46 116.67 116.69 1dmu s ASP 167 Ca 0.41 2.73 0.02 0.00 0.71 0.00 0.00 52.55 56.42 1dmu s ASP 167 Cb -0.20 -2.65 0.14 0.00 1.01 0.00 0.00 42.92 41.22 1dmu s ASP 167 CO 0.81 -0.80 0.26 0.86 0.21 0.00 0.00 175.17 176.51 1dmu s TRP 168 N -1.21 1.51 0.04 4.23 -0.11 -1.26 -0.46 118.94 121.68 1dmu s TRP 168 Ca 0.55 -2.18 -0.28 0.00 1.22 0.00 0.00 56.10 55.40 1dmu s TRP 168 Cb -0.40 -1.47 -0.16 0.00 -1.50 0.00 0.00 33.47 29.95 1dmu s TRP 168 CO 0.52 -0.79 1.33 0.00 -4.62 0.00 0.00 176.95 173.39 1dmu h ALA 169 N 6.61 -1.18 -3.64 5.86 0.00 -1.94 -3.46 119.26 121.52 1dmu h ALA 169 Ca 0.06 -0.22 -0.67 0.00 0.00 0.00 0.00 54.91 54.08 1dmu h ALA 169 Cb 0.93 0.39 -0.17 0.00 0.00 0.00 0.00 17.79 18.94 1dmu h ALA 169 CO 0.40 -1.11 -0.76 -0.65 0.00 0.00 0.00 179.25 177.13 1dmu s GLN 170 N -5.07 2.03 0.13 0.00 -1.52 -1.26 -5.06 119.66 108.90 1dmu s GLN 170 Ca -0.15 -1.06 -0.25 0.00 -1.95 0.00 0.00 55.36 51.95 1dmu s GLN 170 Cb 0.01 -2.24 -0.04 0.00 -0.22 0.00 0.00 33.01 30.52 1dmu s GLN 170 CO 0.44 0.50 1.64 1.25 -0.25 0.00 0.00 175.29 178.88 1dmu h LEU 171 N 3.74 -0.71 0.00 2.90 5.85 -1.99 -0.11 115.31 125.00 1dmu h LEU 171 Ca -0.49 0.10 0.00 0.00 0.84 0.00 0.00 57.88 58.33 1dmu h LEU 171 Cb 1.17 0.30 0.00 0.00 0.37 0.00 0.00 40.66 42.49 1dmu h LEU 171 CO 0.50 -0.30 0.00 -0.62 -0.34 0.00 0.00 178.44 177.68 1dmu n GLU 172 N -5.36 0.18 0.00 1.25 -0.58 -1.26 -4.64 120.64 110.23 1dmu n GLU 172 Ca -0.04 0.14 0.00 0.00 -0.42 0.00 0.00 57.16 56.84 1dmu n GLU 172 Cb 0.27 -1.50 0.00 0.00 -0.57 0.00 0.00 31.44 29.64 1dmu n GLU 172 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1dmu n GLY 173 N -0.44 1.77 0.75 0.62 0.00 -0.05 -5.16 105.19 102.67 1dmu n GLY 173 Ca 0.05 -1.99 -0.03 0.00 0.00 0.00 0.00 46.02 44.05 1dmu n GLY 173 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1dmu n GLY 174 N 5.00 2.59 3.77 -0.02 0.00 -1.26 -4.94 105.19 110.33 1dmu n GLY 174 Ca 0.00 -1.32 -0.37 0.00 0.00 0.00 0.00 46.02 44.32 1dmu n GLY 174 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1dmu s ILE 175 N -2.60 3.45 -0.00 -0.61 -5.25 -1.26 -4.35 121.20 110.58 1dmu s ILE 175 Ca 0.05 1.16 0.00 0.00 -0.99 0.00 0.00 60.65 60.88 1dmu s ILE 175 Cb -0.00 -3.62 0.00 0.00 2.95 0.00 0.00 42.46 41.79 1dmu s ILE 175 CO 0.04 0.05 -0.00 -1.10 -1.79 0.00 0.00 174.94 172.14 1dmu s GLN 176 N -2.40 0.06 0.10 0.37 -0.21 0.40 -4.94 119.66 113.04 1dmu s GLN 176 Ca 0.58 -0.01 0.05 0.00 0.02 0.00 0.00 55.36 56.00 1dmu s GLN 176 Cb -0.26 -0.08 -0.04 0.00 1.00 0.00 0.00 33.01 33.63 1dmu s GLN 176 CO 0.33 -0.00 -0.01 -0.80 -2.12 0.00 0.00 175.29 172.69 1dmu s ASN 177 N 0.09 4.96 0.34 5.90 0.01 -1.26 -1.29 114.94 123.68 1dmu s ASN 177 Ca -0.01 -0.21 -0.16 0.00 -0.71 0.00 0.00 52.86 51.77 1dmu s ASN 177 Cb -0.01 -1.15 -0.09 0.00 0.41 0.00 0.00 41.25 40.40 1dmu s ASN 177 CO -0.00 0.17 0.78 0.20 -1.51 0.00 0.00 177.10 176.74 1dmu s ASN 178 N -2.35 6.82 0.55 -1.22 0.02 -1.26 -4.96 114.94 112.54 1dmu s ASN 178 Ca 0.26 1.37 -0.19 0.00 -1.02 0.00 0.00 52.86 53.28 1dmu s ASN 178 Cb -0.11 -2.41 -0.05 0.00 0.02 0.00 0.00 41.25 38.69 1dmu s ASN 178 CO 0.18 -0.24 1.12 -1.10 0.02 0.00 0.00 177.10 177.08 1dmu s GLN 179 N -3.01 3.32 0.01 -0.60 -0.21 -1.26 -4.65 119.66 113.26 1dmu s GLN 179 Ca 0.56 1.55 0.06 0.00 0.02 0.00 0.00 55.36 57.55 1dmu s GLN 179 Cb -0.10 -2.01 -0.02 0.00 1.00 0.00 0.00 33.01 31.88 1dmu s GLN 179 CO 0.16 -0.86 -0.20 -0.65 -2.12 0.00 0.00 175.29 171.62 1dmu s GLN 180 N -3.41 1.51 -0.36 2.91 -1.52 0.00 -4.96 119.66 113.83 1dmu s GLN 180 Ca 0.71 -0.79 -0.13 0.00 -1.95 0.00 0.00 55.36 53.20 1dmu s GLN 180 Cb -0.23 -1.52 -0.00 0.00 -0.22 0.00 0.00 33.01 31.04 1dmu s GLN 180 CO 0.28 0.41 0.24 0.99 -0.25 0.00 0.00 175.29 176.96 1dmu s THR 181 N -0.59 5.13 -0.25 -0.19 2.01 -1.26 0.04 115.64 120.52 1dmu s THR 181 Ca 0.07 -0.43 -0.19 0.00 0.31 0.00 0.00 61.69 61.45 1dmu s THR 181 Cb -0.08 -3.72 -0.02 0.00 0.01 0.00 0.00 72.50 68.69 1dmu s THR 181 CO 0.00 -0.11 0.59 -0.63 -0.69 0.00 0.00 174.62 173.78 1dmu s ILE 182 N 1.68 5.02 -0.29 1.82 -1.09 0.21 -4.94 121.20 123.61 1dmu s ILE 182 Ca 0.05 1.05 -0.04 0.00 -2.23 0.00 0.00 60.65 59.48 1dmu s ILE 182 Cb -0.18 -3.90 0.03 0.00 -1.58 0.00 0.00 42.46 36.84 1dmu s ILE 182 CO 0.09 0.06 0.02 -1.58 -1.23 0.00 0.00 174.94 172.31 1dmu s GLN 183 N 2.38 2.72 0.60 2.79 2.00 -1.26 -0.48 119.66 128.41 1dmu s GLN 183 Ca 0.25 -1.08 0.10 0.00 -2.00 0.00 0.00 55.36 52.62 1dmu s GLN 183 Cb -0.16 -3.23 0.10 0.00 0.80 0.00 0.00 33.01 30.52 1dmu s GLN 183 CO 0.09 -0.53 0.81 0.20 -0.50 0.00 0.00 175.29 175.36 1dmu s GLY 184 N 1.36 1.72 0.60 2.59 0.00 0.99 -4.73 107.32 109.85 1dmu s GLY 184 Ca -0.01 -2.19 0.36 0.00 0.00 0.00 0.00 44.72 42.88 1dmu s GLY 184 CO -0.00 -1.73 2.22 -2.55 0.00 0.00 0.00 173.10 171.04 1dmu h PRO 185 N 0.12 0.00 0.00 2.90 0.11 -1.99 -3.34 132.00 129.80 1dmu h PRO 185 Ca -0.28 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.83 1dmu h PRO 185 Cb 1.29 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.40 1dmu h PRO 185 CO 0.41 0.03 -0.46 0.54 -0.21 0.00 0.00 178.00 178.30 1dmu n ARG 186 N -3.36 2.01 -4.36 1.05 3.00 -1.26 -5.11 116.66 108.63 1dmu n ARG 186 Ca -0.02 0.00 -0.18 0.00 -0.01 0.00 0.00 57.85 57.64 1dmu n ARG 186 Cb 0.15 -0.73 -0.10 0.00 0.00 0.00 0.00 32.46 31.78 1dmu n ARG 186 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.63 178.08 1dmu s SER 187 N -1.80 1.55 0.08 0.55 0.15 -1.26 -5.17 113.70 107.80 1dmu s SER 187 Ca 0.00 -1.42 -0.04 0.00 0.70 0.00 0.00 55.95 55.19 1dmu s SER 187 Cb 0.00 0.16 -0.02 0.00 -1.71 0.00 0.00 66.02 64.44 1dmu s SER 187 CO 0.00 -0.74 0.08 -0.94 1.20 0.00 0.00 173.24 172.84 1dmu s SER 188 N -3.37 0.31 0.25 5.45 1.04 -1.26 -0.01 113.70 116.12 1dmu s SER 188 Ca 0.37 -0.90 -0.21 0.00 0.48 0.00 0.00 55.95 55.68 1dmu s SER 188 Cb 0.07 0.28 0.03 0.00 0.10 0.00 0.00 66.02 66.50 1dmu s SER 188 CO 0.15 -0.68 0.69 0.00 0.98 0.00 0.00 173.24 174.38 1dmu s GLN 189 N -3.92 1.68 0.18 4.02 -2.07 0.37 -4.98 119.66 114.94 1dmu s GLN 189 Ca 0.09 -0.88 -0.06 0.00 -1.82 0.00 0.00 55.36 52.69 1dmu s GLN 189 Cb 0.07 0.60 -0.06 0.00 -1.09 0.00 0.00 33.01 32.53 1dmu s GLN 189 CO -0.08 -0.76 0.43 0.42 -1.32 0.00 0.00 175.29 173.98 1dmu s ILE 190 N -3.89 5.10 -0.03 3.63 1.01 -1.26 0.67 121.20 126.43 1dmu s ILE 190 Ca 0.09 0.11 -0.01 0.00 0.00 0.00 0.00 60.65 60.84 1dmu s ILE 190 Cb -0.05 -3.64 0.03 0.00 0.01 0.00 0.00 42.46 38.81 1dmu s ILE 190 CO 0.03 -0.04 0.04 0.12 0.00 0.00 0.00 174.94 175.09 1dmu s PHE 191 N -1.75 0.06 -0.31 3.97 5.36 0.11 -4.70 117.98 120.71 1dmu s PHE 191 Ca 0.43 0.17 0.02 0.00 -0.96 0.00 0.00 56.93 56.59 1dmu s PHE 191 Cb -0.12 -0.34 0.09 0.00 -0.34 0.00 0.00 43.02 42.32 1dmu s PHE 191 CO 0.25 -0.13 0.02 -1.17 -1.46 0.00 0.00 175.22 172.73 1dmu s LEU 192 N 1.47 3.76 0.44 6.12 2.96 -1.26 -0.82 118.68 131.35 1dmu s LEU 192 Ca -0.04 -1.81 -0.25 0.00 -0.22 0.00 0.00 54.13 51.81 1dmu s LEU 192 Cb -0.13 -1.40 -0.08 0.00 0.50 0.00 0.00 46.19 45.09 1dmu s LEU 192 CO -0.03 -0.34 1.28 -2.84 -1.32 0.00 0.00 176.35 173.10 1dmu s PRO 193 N 1.14 3.80 0.00 0.98 0.02 -1.26 -4.64 135.00 135.05 1dmu s PRO 193 Ca 0.06 2.08 0.09 0.00 0.02 0.00 0.00 61.00 63.26 1dmu s PRO 193 Cb -0.19 -2.61 -0.07 0.00 0.02 0.00 0.00 34.50 31.66 1dmu s PRO 193 CO -0.11 -0.61 0.46 0.25 -0.33 0.00 0.00 177.00 176.66 1dmu n THR 194 N -0.18 0.00 -3.58 0.99 -2.24 -0.67 -4.62 114.28 103.99 1dmu n THR 194 Ca 0.05 -0.32 -0.37 0.00 -2.27 0.00 0.00 64.05 61.14 1dmu n THR 194 Cb 0.45 1.04 -0.06 0.00 -2.10 0.00 0.00 70.33 69.65 1dmu n THR 194 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 1dmu s ILE 195 N -1.69 5.12 0.52 2.28 -1.09 -1.04 -4.98 121.20 120.32 1dmu s ILE 195 Ca 0.05 0.69 -0.18 0.00 -2.23 0.00 0.00 60.65 58.97 1dmu s ILE 195 Cb 0.07 -3.65 -0.07 0.00 -1.58 0.00 0.00 42.46 37.23 1dmu s ILE 195 CO 0.33 0.55 1.03 -2.16 -1.23 0.00 0.00 174.94 173.47 1dmu s PRO 196 N -1.17 3.69 0.34 2.79 0.04 -1.26 -1.61 135.00 137.82 1dmu s PRO 196 Ca 0.23 1.22 0.25 0.00 0.04 0.00 0.00 61.00 62.75 1dmu s PRO 196 Cb -0.16 -2.09 1.18 0.00 0.04 0.00 0.00 34.50 33.48 1dmu s PRO 196 CO 0.12 -0.51 1.76 -1.00 0.04 0.00 0.00 177.00 177.42 1dmu h PRO 197 N 1.09 0.00 -2.84 0.56 0.13 -1.88 -3.45 132.00 125.61 1dmu h PRO 197 Ca -0.48 0.00 0.01 0.00 -0.87 0.00 0.00 66.00 64.65 1dmu h PRO 197 Cb 1.21 0.00 -0.13 0.00 0.13 0.00 0.00 31.00 32.21 1dmu h PRO 197 CO 0.59 0.00 0.27 -0.48 -0.23 0.00 0.00 178.00 178.15 1dmu s LEU 198 N -4.77 -0.53 0.18 1.56 2.34 -1.26 -1.95 118.68 114.25 1dmu s LEU 198 Ca 0.01 0.01 0.11 0.00 0.06 0.00 0.00 54.13 54.32 1dmu s LEU 198 Cb 0.08 2.48 -0.04 0.00 -0.56 0.00 0.00 46.19 48.15 1dmu s LEU 198 CO 0.34 -0.89 -0.24 -0.31 -1.06 0.00 0.00 176.35 174.18 1dmu s TYR 199 N -3.59 2.28 -0.14 3.48 1.51 -0.58 -4.90 117.35 115.40 1dmu s TYR 199 Ca 0.02 -0.37 0.01 0.00 -1.01 0.00 0.00 57.07 55.72 1dmu s TYR 199 Cb -0.01 -1.15 0.02 0.00 -0.11 0.00 0.00 41.96 40.71 1dmu s TYR 199 CO -0.12 0.46 -0.15 0.42 -1.11 0.00 0.00 175.55 175.05 1dmu s ILE 200 N -1.57 1.61 0.63 2.71 -1.09 -1.26 -0.77 121.20 121.47 1dmu s ILE 200 Ca 0.19 -0.67 -0.10 0.00 -2.23 0.00 0.00 60.65 57.84 1dmu s ILE 200 Cb -0.08 -1.49 -0.02 0.00 -1.58 0.00 0.00 42.46 39.29 1dmu s ILE 200 CO 0.09 0.46 1.02 -0.76 -1.23 0.00 0.00 174.94 174.52 1dmu s LEU 201 N 1.31 3.16 0.25 2.97 1.43 -0.47 -4.91 118.68 122.42 1dmu s LEU 201 Ca 0.01 1.20 0.12 0.00 -1.03 0.00 0.00 54.13 54.43 1dmu s LEU 201 Cb -0.13 -4.13 0.66 0.00 0.03 0.00 0.00 46.19 42.61 1dmu s LEU 201 CO -0.08 -1.02 1.28 -1.54 0.23 0.00 0.00 176.35 175.22 1dmu n SER 202 N -2.77 0.31 -1.24 2.29 3.41 -1.26 -0.07 113.62 114.29 1dmu n SER 202 Ca 0.06 0.56 0.08 0.00 -0.26 0.00 0.00 58.87 59.31 1dmu n SER 202 Cb 0.56 -0.55 0.30 0.00 -0.26 0.00 0.00 64.21 64.25 1dmu n SER 202 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 1dmu n ASP 203 N -1.94 4.28 0.00 4.04 5.68 -1.26 -4.94 116.55 122.41 1dmu n ASP 203 Ca -0.01 -2.59 0.00 0.00 -0.50 0.00 0.00 54.79 51.69 1dmu n ASP 203 Cb 0.21 -0.52 0.00 0.00 -1.14 0.00 0.00 41.12 39.67 1dmu n ASP 203 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1dmu n GLY 204 N 0.47 1.18 3.72 6.12 0.00 0.89 -5.01 105.19 112.57 1dmu n GLY 204 Ca 0.22 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.82 1dmu n GLY 204 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1dmu s THR 205 N -3.29 2.01 -0.35 2.61 2.01 -1.25 -4.72 115.64 112.66 1dmu s THR 205 Ca 0.00 0.01 -0.18 0.00 0.31 0.00 0.00 61.69 61.83 1dmu s THR 205 Cb 0.00 -3.00 -0.00 0.00 0.01 0.00 0.00 72.50 69.50 1dmu s THR 205 CO 0.00 0.00 0.50 -0.63 -0.69 0.00 0.00 174.62 173.81 1dmu s ILE 206 N 1.05 5.02 -0.66 1.82 1.01 -1.26 -1.36 121.20 126.82 1dmu s ILE 206 Ca 0.74 0.31 0.05 0.00 0.00 0.00 0.00 60.65 61.75 1dmu s ILE 206 Cb -0.50 -3.96 0.16 0.00 0.01 0.00 0.00 42.46 38.18 1dmu s ILE 206 CO 0.34 -0.21 0.46 0.00 0.00 0.00 0.00 174.94 175.52 1dmu s ALA 207 N 2.37 3.61 0.48 9.38 0.00 0.05 -4.34 121.76 133.31 1dmu s ALA 207 Ca 0.18 -3.69 -0.24 0.00 0.00 0.00 0.00 51.96 48.21 1dmu s ALA 207 Cb -0.16 -2.13 -0.08 0.00 0.00 0.00 0.00 23.12 20.76 1dmu s ALA 207 CO 0.13 -2.08 1.37 -2.30 0.00 0.00 0.00 175.76 172.88 1dmu n PRO 208 N 2.17 1.99 -2.90 0.00 -0.02 -1.26 -1.53 135.00 133.45 1dmu n PRO 208 Ca 0.18 0.72 -0.41 0.00 -2.02 0.00 0.00 63.50 61.97 1dmu n PRO 208 Cb 0.35 -2.55 -0.04 0.00 -0.02 0.00 0.00 33.50 31.24 1dmu n PRO 208 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1dmu s VAL 209 N -1.23 4.96 -0.29 -1.45 1.01 -0.82 -1.24 120.40 121.34 1dmu s VAL 209 Ca 0.64 1.71 -0.00 0.00 0.00 0.00 0.00 61.98 64.33 1dmu s VAL 209 Cb -0.45 -4.16 0.05 0.00 0.00 0.00 0.00 36.38 31.82 1dmu s VAL 209 CO 0.55 0.21 -0.03 -0.69 0.00 0.00 0.00 175.10 175.14 1dmu s VAL 210 N 0.87 2.76 -0.40 2.92 1.01 -0.32 -4.68 120.40 122.56 1dmu s VAL 210 Ca 0.44 -1.44 -0.20 0.00 0.00 0.00 0.00 61.98 60.77 1dmu s VAL 210 Cb -0.19 -2.59 0.01 0.00 0.00 0.00 0.00 36.38 33.61 1dmu s VAL 210 CO 0.22 -0.08 0.60 -1.00 0.00 0.00 0.00 175.10 174.85 1dmu s HIS 211 N 1.21 3.11 0.03 5.22 3.76 -1.26 -0.97 115.29 126.39 1dmu s HIS 211 Ca -0.06 0.06 0.09 0.00 -0.15 0.00 0.00 55.06 55.00 1dmu s HIS 211 Cb -0.20 -3.19 -0.03 0.00 1.11 0.00 0.00 32.58 30.27 1dmu s HIS 211 CO -0.02 -0.74 -0.26 -0.51 -0.85 0.00 0.00 174.74 172.36 1dmu s LEU 212 N 2.67 2.16 -0.08 0.89 1.43 0.34 -1.76 118.68 124.33 1dmu s LEU 212 Ca 0.22 -0.56 0.04 0.00 -1.03 0.00 0.00 54.13 52.80 1dmu s LEU 212 Cb -0.15 -1.31 0.00 0.00 0.03 0.00 0.00 46.19 44.77 1dmu s LEU 212 CO 0.17 0.27 -0.20 -0.36 0.23 0.00 0.00 176.35 176.46 1dmu s PHE 213 N -0.77 2.15 -0.23 0.29 0.40 0.30 -2.02 117.98 118.10 1dmu s PHE 213 Ca 0.11 -0.83 -0.04 0.00 -0.60 0.00 0.00 56.93 55.57 1dmu s PHE 213 Cb -0.10 -1.46 -0.01 0.00 0.51 0.00 0.00 43.02 41.96 1dmu s PHE 213 CO 0.01 -0.35 -0.02 0.42 0.70 0.00 0.00 175.22 175.99 1dmu s ILE 214 N 0.39 3.52 -0.66 0.64 1.01 -0.59 -1.36 121.20 124.15 1dmu s ILE 214 Ca -0.16 -0.49 -0.01 0.00 0.00 0.00 0.00 60.65 59.99 1dmu s ILE 214 Cb -0.17 -2.63 0.17 0.00 0.01 0.00 0.00 42.46 39.84 1dmu s ILE 214 CO 0.07 0.37 0.47 -0.75 0.00 0.00 0.00 174.94 175.10 1dmu s LYS 215 N 1.49 2.59 0.26 2.79 2.20 0.50 -0.32 119.74 129.25 1dmu s LYS 215 Ca 0.05 -2.71 -0.30 0.00 -0.36 0.00 0.00 55.97 52.66 1dmu s LYS 215 Cb -0.15 -3.69 -0.09 0.00 -1.51 0.00 0.00 37.83 32.39 1dmu s LYS 215 CO -0.02 -1.19 1.27 -2.14 -0.36 0.00 0.00 175.35 172.91 1dmu s PRO 216 N -0.38 4.43 -0.16 4.03 0.02 -1.22 -1.15 135.00 140.57 1dmu s PRO 216 Ca 0.19 2.06 0.01 0.00 0.02 0.00 0.00 61.00 63.28 1dmu s PRO 216 Cb -0.18 -3.15 0.02 0.00 0.02 0.00 0.00 34.50 31.20 1dmu s PRO 216 CO -0.05 -0.14 -0.19 0.42 -0.33 0.00 0.00 177.00 176.72 1dmu s ILE 217 N -0.57 1.92 0.21 2.83 1.01 0.62 -2.15 121.20 125.07 1dmu s ILE 217 Ca 0.52 -0.86 0.06 0.00 0.00 0.00 0.00 60.65 60.36 1dmu s ILE 217 Cb -0.37 -1.74 -0.04 0.00 0.01 0.00 0.00 42.46 40.33 1dmu s ILE 217 CO 0.44 0.52 0.21 -0.72 0.00 0.00 0.00 174.94 175.38 1dmu s TYR 218 N 1.25 3.20 0.03 3.97 -0.85 -0.97 0.24 117.35 124.22 1dmu s TYR 218 Ca 0.02 -0.04 0.00 0.00 -0.52 0.00 0.00 57.07 56.53 1dmu s TYR 218 Cb -0.13 -1.49 -0.04 0.00 0.38 0.00 0.00 41.96 40.68 1dmu s TYR 218 CO -0.10 0.51 0.13 0.00 -1.52 0.00 0.00 175.55 174.57 1dmu s ALA 219 N -1.94 3.75 -0.54 9.51 0.00 -0.03 -3.97 121.76 128.54 1dmu s ALA 219 Ca 0.32 -0.88 -0.16 0.00 0.00 0.00 0.00 51.96 51.25 1dmu s ALA 219 Cb -0.09 -1.66 0.13 0.00 0.00 0.00 0.00 23.12 21.50 1dmu s ALA 219 CO 0.25 0.75 0.49 -1.64 0.00 0.00 0.00 175.76 175.61 1dmu s MET 220 N -2.10 2.97 0.36 0.00 -1.94 -1.26 -2.46 119.30 114.87 1dmu s MET 220 Ca 0.28 -1.71 0.03 0.00 -1.71 0.00 0.00 55.69 52.58 1dmu s MET 220 Cb -0.12 -4.28 0.67 0.00 2.01 0.00 0.00 34.83 33.11 1dmu s MET 220 CO 0.20 -1.32 2.01 0.00 -0.01 0.00 0.00 175.02 175.90 1dmu h ARG 221 N 8.87 0.79 0.00 2.03 2.47 -1.43 -1.66 114.38 125.45 1dmu h ARG 221 Ca -0.29 -0.05 0.00 0.00 -1.26 0.00 0.00 59.98 58.38 1dmu h ARG 221 Cb 1.10 -0.18 0.00 0.00 -1.65 0.00 0.00 29.97 29.24 1dmu h ARG 221 CO 1.03 0.52 0.11 0.66 0.56 0.00 0.00 179.97 182.85 1dmu h SER 222 N 0.81 0.00 0.31 7.04 4.64 -1.70 0.18 113.55 124.84 1dmu h SER 222 Ca 0.23 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.55 1dmu h SER 222 Cb -0.05 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.04 1dmu h SER 222 CO -0.05 0.00 0.00 0.18 -0.87 0.00 0.00 176.83 176.09 1dmu n LEU 223 N -2.92 0.28 -4.27 5.97 4.77 -0.62 -4.19 117.00 116.01 1dmu n LEU 223 Ca -0.03 0.60 -0.36 0.00 -0.03 0.00 0.00 56.01 56.19 1dmu n LEU 223 Cb 0.17 -0.59 -0.13 0.00 -2.33 0.00 0.00 43.42 40.53 1dmu n LEU 223 CO 0.17 -0.54 -0.34 0.42 -1.33 0.00 0.00 177.39 175.77 1dmu s THR 224 N -3.19 3.45 -0.07 -5.08 -4.23 0.64 -5.03 115.64 102.12 1dmu s THR 224 Ca 0.02 -0.86 -0.06 0.00 -1.18 0.00 0.00 61.69 59.61 1dmu s THR 224 Cb 0.06 -2.77 -0.03 0.00 1.34 0.00 0.00 72.50 71.10 1dmu s THR 224 CO 0.21 0.13 0.26 1.17 -0.54 0.00 0.00 174.62 175.85 1dmu n LYS 225 N 4.77 0.00 -0.73 3.99 3.00 -1.26 -0.90 118.16 127.03 1dmu n LYS 225 Ca -0.15 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.16 1dmu n LYS 225 Cb 0.47 -0.21 0.00 0.00 0.00 0.00 0.00 35.03 35.29 1dmu n LYS 225 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1dmu n GLY 226 N 0.81 0.43 3.91 3.14 0.00 -1.26 -5.00 105.19 107.21 1dmu n GLY 226 Ca 0.06 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.80 1dmu n GLY 226 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1dmu s ASP 227 N -2.42 6.38 0.09 1.61 2.15 -0.08 -5.05 116.67 119.36 1dmu s ASP 227 Ca 0.00 0.80 0.02 0.00 0.43 0.00 0.00 52.55 53.80 1dmu s ASP 227 Cb 0.00 -2.19 -0.04 0.00 -0.30 0.00 0.00 42.92 40.39 1dmu s ASP 227 CO 0.00 -0.36 -0.07 0.42 -0.17 0.00 0.00 175.17 174.99 1dmu s THR 228 N -2.36 0.70 0.00 1.71 -4.23 -1.26 -2.85 115.64 107.34 1dmu s THR 228 Ca 0.46 -1.84 0.00 0.00 -1.18 0.00 0.00 61.69 59.12 1dmu s THR 228 Cb -0.10 -1.57 0.00 0.00 1.34 0.00 0.00 72.50 72.17 1dmu s THR 228 CO 0.35 -0.81 0.00 0.61 -0.54 0.00 0.00 174.62 174.23 1dmu n GLY 229 N 0.12 2.42 2.91 3.99 0.00 -1.26 -4.74 105.19 108.63 1dmu n GLY 229 Ca -0.13 -1.92 -0.30 0.00 0.00 0.00 0.00 46.02 43.67 1dmu n GLY 229 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1dmu s GLN 230 N -2.97 1.51 0.24 1.61 -0.21 -1.26 -1.15 119.66 117.43 1dmu s GLN 230 Ca 0.00 -2.04 -0.04 0.00 0.02 0.00 0.00 55.36 53.30 1dmu s GLN 230 Cb 0.00 -2.94 -0.05 0.00 1.00 0.00 0.00 33.01 31.02 1dmu s GLN 230 CO 0.00 -1.04 0.49 -1.54 -2.12 0.00 0.00 175.29 171.08 1dmu s SER 231 N 0.52 6.45 -0.04 5.90 1.04 -1.03 -4.80 113.70 121.74 1dmu s SER 231 Ca 0.14 0.63 -0.30 0.00 0.48 0.00 0.00 55.95 56.90 1dmu s SER 231 Cb -0.22 -2.11 -0.07 0.00 0.10 0.00 0.00 66.02 63.72 1dmu s SER 231 CO -0.06 -0.11 1.85 -0.22 0.98 0.00 0.00 173.24 175.68 1dmu s LEU 232 N -3.30 4.26 -0.23 2.42 2.96 -1.26 -0.85 118.68 122.67 1dmu s LEU 232 Ca 0.42 2.36 -0.07 0.00 -0.22 0.00 0.00 54.13 56.61 1dmu s LEU 232 Cb -0.11 -3.53 -0.11 0.00 0.50 0.00 0.00 46.19 42.94 1dmu s LEU 232 CO 0.28 -1.11 -0.27 0.00 -1.32 0.00 0.00 176.35 173.93 1dmu n TYR 233 N 7.86 0.00 -3.94 5.38 9.36 0.14 -3.86 117.16 132.10 1dmu n TYR 233 Ca 0.20 0.00 -0.08 0.00 3.32 0.00 0.00 57.90 61.33 1dmu n TYR 233 Cb 0.42 -0.83 -0.04 0.00 -0.63 0.00 0.00 39.34 38.27 1dmu n TYR 233 CO 0.00 0.00 0.00 0.15 0.22 0.00 0.00 176.86 177.23 1dmu s LYS 234 N -2.43 1.69 -0.05 2.98 1.02 -0.80 -1.88 119.74 120.28 1dmu s LYS 234 Ca -0.31 -1.17 -0.01 0.00 0.02 0.00 0.00 55.97 54.50 1dmu s LYS 234 Cb 0.11 0.54 0.03 0.00 -0.52 0.00 0.00 37.83 37.98 1dmu s LYS 234 CO 0.44 -0.74 0.03 0.42 -0.92 0.00 0.00 175.35 174.58 1dmu s ILE 235 N -3.87 0.08 0.07 2.17 1.01 -0.11 -0.27 121.20 120.27 1dmu s ILE 235 Ca 0.18 0.28 -0.03 0.00 0.00 0.00 0.00 60.65 61.07 1dmu s ILE 235 Cb -0.03 -0.28 -0.05 0.00 0.01 0.00 0.00 42.46 42.12 1dmu s ILE 235 CO 0.09 0.19 0.26 -0.54 0.00 0.00 0.00 174.94 174.94 1dmu s LYS 236 N 1.87 3.51 -0.06 2.79 1.02 -0.30 -1.07 119.74 127.49 1dmu s LYS 236 Ca 0.02 -0.27 0.04 0.00 0.02 0.00 0.00 55.97 55.78 1dmu s LYS 236 Cb -0.12 -3.00 0.00 0.00 -0.52 0.00 0.00 37.83 34.19 1dmu s LYS 236 CO -0.03 0.58 -0.18 -0.51 -0.92 0.00 0.00 175.35 174.29 1dmu s LEU 237 N -2.36 1.89 -0.03 3.17 1.43 0.21 -0.37 118.68 122.62 1dmu s LEU 237 Ca 0.34 -0.39 -0.02 0.00 -1.03 0.00 0.00 54.13 53.04 1dmu s LEU 237 Cb -0.13 -1.04 0.02 0.00 0.03 0.00 0.00 46.19 45.07 1dmu s LEU 237 CO 0.24 0.13 0.07 0.00 0.23 0.00 0.00 176.35 177.02 1dmu s ALA 238 N 0.25 -0.11 -0.28 4.21 0.00 -0.47 -0.96 121.76 124.41 1dmu s ALA 238 Ca -0.10 0.33 -0.09 0.00 0.00 0.00 0.00 51.96 52.10 1dmu s ALA 238 Cb -0.14 -0.23 -0.03 0.00 0.00 0.00 0.00 23.12 22.72 1dmu s ALA 238 CO 0.04 -0.08 0.13 0.45 0.00 0.00 0.00 175.76 176.29 1dmu s SER 239 N 0.62 5.49 -0.24 0.00 0.15 0.63 -0.54 113.70 119.81 1dmu s SER 239 Ca -0.05 -0.26 -0.08 0.00 0.70 0.00 0.00 55.95 56.26 1dmu s SER 239 Cb -0.07 -2.00 -0.04 0.00 -1.71 0.00 0.00 66.02 62.21 1dmu s SER 239 CO -0.02 -0.09 0.09 -0.69 1.20 0.00 0.00 173.24 173.73 1dmu s VAL 240 N 1.65 4.67 0.43 4.45 1.01 -0.72 -4.85 120.40 127.04 1dmu s VAL 240 Ca 0.06 -0.06 -0.23 0.00 0.00 0.00 0.00 61.98 61.75 1dmu s VAL 240 Cb -0.16 -3.17 -0.11 0.00 0.00 0.00 0.00 36.38 32.94 1dmu s VAL 240 CO 0.06 0.35 0.79 -2.65 0.00 0.00 0.00 175.10 173.66 1dmu n PRO 241 N 4.56 0.94 -1.10 2.72 -0.02 -1.26 -4.26 135.00 136.58 1dmu n PRO 241 Ca -0.16 0.34 -0.29 0.00 -2.02 0.00 0.00 63.50 61.38 1dmu n PRO 241 Cb 0.52 -1.79 0.20 0.00 -0.02 0.00 0.00 33.50 32.40 1dmu n PRO 241 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1dmu s ASN 242 N -0.87 2.11 0.36 2.55 4.22 -1.26 -4.64 114.94 117.41 1dmu s ASN 242 Ca 0.64 1.09 0.11 0.00 -2.14 0.00 0.00 52.86 52.56 1dmu s ASN 242 Cb -0.58 -1.70 0.87 0.00 1.28 0.00 0.00 41.25 41.13 1dmu s ASN 242 CO 0.57 -3.44 1.85 1.23 -2.04 0.00 0.00 177.10 175.26 1dmu h GLY 243 N -2.10 1.23 1.02 0.45 0.00 -1.68 -1.87 103.07 100.12 1dmu h GLY 243 Ca -0.54 -0.28 -0.06 0.00 0.00 0.00 0.00 47.33 46.45 1dmu h GLY 243 CO 0.54 0.03 0.17 1.41 0.00 0.00 0.00 176.54 178.69 1dmu h LEU 244 N 0.63 0.93 -0.38 3.11 3.38 -1.87 -1.27 115.31 119.84 1dmu h LEU 244 Ca 0.48 -0.22 -0.18 0.00 0.09 0.00 0.00 57.88 58.05 1dmu h LEU 244 Cb 0.89 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 41.39 1dmu h LEU 244 CO -0.23 0.91 -0.60 1.23 0.09 0.00 0.00 178.44 179.83 1dmu h GLY 245 N 0.91 0.75 0.62 0.83 0.00 -1.50 0.16 103.07 104.83 1dmu h GLY 245 Ca 0.20 -0.92 -0.01 0.00 0.00 0.00 0.00 47.33 46.60 1dmu h GLY 245 CO -0.00 0.82 -0.02 1.41 0.00 0.00 0.00 176.54 178.75 1dmu h LEU 246 N 0.51 0.07 -1.48 3.11 3.38 -1.24 0.38 115.31 120.05 1dmu h LEU 246 Ca -0.00 -0.42 0.00 0.00 0.09 0.00 0.00 57.88 57.55 1dmu h LEU 246 Cb 1.19 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.91 1dmu h LEU 246 CO 0.12 0.48 0.00 0.49 0.09 0.00 0.00 178.44 179.62 1dmu n PHE 247 N -4.83 0.00 0.03 1.13 3.01 -0.49 -0.67 117.46 115.63 1dmu n PHE 247 Ca -0.08 -0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.38 1dmu n PHE 247 Cb 0.24 -0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.71 1dmu n PHE 247 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1dmu s ASN 249 N -5.12 0.23 0.00 0.00 3.84 0.32 -3.77 114.94 110.44 1dmu s ASN 249 Ca 0.00 0.62 0.00 0.00 0.21 0.00 0.00 52.86 53.69 1dmu s ASN 249 Cb 0.00 0.91 0.00 0.00 -0.55 0.00 0.00 41.25 41.61 1dmu s ASN 249 CO 0.00 -0.25 0.95 -0.81 -2.79 0.00 0.00 177.10 174.20 1dmu n PRO 250 N 5.36 1.00 -3.41 0.43 -0.04 -1.22 -3.91 135.00 133.21 1dmu n PRO 250 Ca -0.07 0.00 -0.17 0.00 -0.04 0.00 0.00 63.50 63.23 1dmu n PRO 250 Cb 0.50 -1.05 0.08 0.00 -0.04 0.00 0.00 33.50 32.99 1dmu n PRO 250 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1dmu n GLY 251 N 0.45 -0.56 0.37 0.55 0.00 0.07 -4.87 105.19 101.20 1dmu n GLY 251 Ca 0.00 0.22 0.12 0.00 0.00 0.00 0.00 46.02 46.37 1dmu n GLY 251 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 1dmu h TYR 252 N -1.70 0.56 0.00 1.61 -1.99 -0.84 -1.01 116.97 113.60 1dmu h TYR 252 Ca -0.60 0.02 -0.00 0.00 2.00 0.00 0.00 58.73 60.14 1dmu h TYR 252 Cb 1.33 -0.18 -0.00 0.00 2.00 0.00 0.00 36.73 39.89 1dmu h TYR 252 CO 0.41 0.24 -0.02 0.00 -0.00 0.00 0.00 178.16 178.79 1dmu h ALA 253 N 1.65 1.28 -0.25 3.88 0.00 -1.16 -2.64 119.26 122.02 1dmu h ALA 253 Ca 0.34 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.24 1dmu h ALA 253 Cb 0.64 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.43 1dmu h ALA 253 CO -0.11 0.02 0.00 1.19 0.00 0.00 0.00 179.25 180.35 1dmu n PHE 254 N -3.51 0.48 -3.12 0.00 3.01 -0.40 -4.95 117.46 108.97 1dmu n PHE 254 Ca -0.03 -0.62 -0.40 0.00 1.01 0.00 0.00 57.45 57.41 1dmu n PHE 254 Cb 0.11 -0.11 -0.06 0.00 -0.01 0.00 0.00 39.48 39.41 1dmu n PHE 254 CO 0.00 0.00 0.00 0.34 1.01 0.00 0.00 176.76 178.11 1dmu s ASP 255 N -1.34 6.67 0.64 4.37 -1.08 -1.00 -4.93 116.67 120.00 1dmu s ASP 255 Ca 0.25 0.82 0.42 0.00 -0.52 0.00 0.00 52.55 53.51 1dmu s ASP 255 Cb 0.16 -2.35 2.19 0.00 -1.46 0.00 0.00 42.92 41.47 1dmu s ASP 255 CO 0.11 -0.28 2.29 0.77 0.52 0.00 0.00 175.17 178.58 1dmu h SER 256 N 7.52 0.00 0.79 -0.34 4.64 -1.94 0.10 113.55 124.32 1dmu h SER 256 Ca -0.31 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.01 1dmu h SER 256 Cb 1.14 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.23 1dmu h SER 256 CO 0.77 0.00 -0.02 0.00 -0.87 0.00 0.00 176.83 176.72 1dmu h ALA 257 N 2.00 1.02 -1.34 5.18 0.00 -1.95 -3.19 119.26 120.97 1dmu h ALA 257 Ca -0.00 -0.02 -0.53 0.00 0.00 0.00 0.00 54.91 54.36 1dmu h ALA 257 Cb 0.11 -0.00 -0.42 0.00 0.00 0.00 0.00 17.79 17.48 1dmu h ALA 257 CO 0.00 0.02 -0.84 0.66 0.00 0.00 0.00 179.25 179.09 1dmu n TYR 258 N -3.13 2.86 -1.73 0.00 0.53 0.36 -5.07 117.16 110.97 1dmu n TYR 258 Ca -0.00 -2.98 -0.42 0.00 -1.02 0.00 0.00 57.90 53.48 1dmu n TYR 258 Cb 0.26 -0.16 -0.01 0.00 -1.03 0.00 0.00 39.34 38.40 1dmu n TYR 258 CO 0.00 0.00 0.00 1.63 -1.02 0.00 0.00 176.86 177.47 1dmu n LYS 259 N -0.41 2.40 -2.83 -0.72 4.76 -1.21 -2.72 118.16 117.45 1dmu n LYS 259 Ca 0.32 0.85 -0.16 0.00 -2.87 0.00 0.00 58.31 56.45 1dmu n LYS 259 Cb 0.72 -2.52 0.03 0.00 -1.84 0.00 0.00 35.03 31.41 1dmu n LYS 259 CO 0.00 0.00 0.00 1.19 -1.37 0.00 0.00 177.40 177.22 1dmu n PHE 260 N 0.77 -1.46 -0.21 2.13 0.99 -1.26 -4.88 117.46 113.54 1dmu n PHE 260 Ca 0.05 0.40 -0.09 0.00 -0.00 0.00 0.00 57.45 57.80 1dmu n PHE 260 Cb 0.37 -3.56 0.02 0.00 -1.00 0.00 0.00 39.48 35.31 1dmu n PHE 260 CO 0.00 0.00 0.00 1.25 -0.00 0.00 0.00 176.76 178.01 1dmu h LEU 261 N -1.05 1.05 -9.38 4.37 5.85 -1.86 -3.40 115.31 110.89 1dmu h LEU 261 Ca -0.39 -0.31 -0.66 0.00 0.84 0.00 0.00 57.88 57.37 1dmu h LEU 261 Cb 1.27 -0.28 -0.14 0.00 0.37 0.00 0.00 40.66 41.88 1dmu h LEU 261 CO 0.41 1.10 -0.67 -0.36 -0.34 0.00 0.00 178.44 178.58 1dmu s PHE 262 N -5.02 2.97 0.13 1.25 0.40 -1.26 0.36 117.98 116.81 1dmu s PHE 262 Ca -0.12 -0.01 -0.14 0.00 -0.60 0.00 0.00 56.93 56.06 1dmu s PHE 262 Cb 0.13 -1.57 0.02 0.00 0.51 0.00 0.00 43.02 42.11 1dmu s PHE 262 CO 0.86 0.45 0.35 1.03 0.70 0.00 0.00 175.22 178.61 1dmu s ARG 263 N -1.96 1.05 0.40 0.44 0.52 -0.61 -4.73 118.95 114.07 1dmu s ARG 263 Ca 0.22 -0.82 -0.25 0.00 -0.52 0.00 0.00 55.73 54.37 1dmu s ARG 263 Cb -0.11 0.44 -0.11 0.00 0.52 0.00 0.00 34.95 35.68 1dmu s ARG 263 CO 0.14 -0.40 0.96 -2.30 0.02 0.00 0.00 175.30 173.72 1dmu n PRO 264 N -0.20 1.27 0.00 3.54 -0.02 -1.26 -0.13 135.00 138.21 1dmu n PRO 264 Ca -0.15 0.45 0.00 0.00 -2.02 0.00 0.00 63.50 61.79 1dmu n PRO 264 Cb 0.63 -1.95 0.00 0.00 -0.02 0.00 0.00 33.50 32.16 1dmu n PRO 264 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1dmu n GLY 265 N 1.25 0.85 0.88 -1.23 0.00 -1.02 -4.14 105.19 101.78 1dmu n GLY 265 Ca 0.10 -1.62 0.11 0.00 0.00 0.00 0.00 46.02 44.61 1dmu n GLY 265 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1dmu n LYS 266 N 0.00 2.05 -2.37 1.61 5.02 -1.26 -4.92 118.16 118.28 1dmu n LYS 266 Ca 0.00 -1.81 -0.41 0.00 -2.02 0.00 0.00 58.31 54.07 1dmu n LYS 266 Cb 0.00 -1.42 -0.04 0.00 -0.02 0.00 0.00 35.03 33.55 1dmu n LYS 266 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1dmu s ASP 267 N -1.82 7.11 0.74 4.39 -0.00 -1.26 -5.02 116.67 120.81 1dmu s ASP 267 Ca 0.26 2.32 -0.09 0.00 -0.00 0.00 0.00 52.55 55.04 1dmu s ASP 267 Cb 0.18 -2.62 0.07 0.00 -0.00 0.00 0.00 42.92 40.55 1dmu s ASP 267 CO 0.27 -0.30 1.07 1.51 -0.00 0.00 0.00 175.17 177.73 1dmu s ASP 268 N -0.38 4.74 0.00 0.27 3.84 -1.26 -4.92 116.67 118.95 1dmu s ASP 268 Ca 0.49 0.59 0.01 0.00 -0.00 0.00 0.00 52.55 53.65 1dmu s ASP 268 Cb -0.33 -1.20 0.08 0.00 -1.38 0.00 0.00 42.92 40.09 1dmu s ASP 268 CO 0.41 -1.69 0.60 -2.11 -0.00 0.00 0.00 175.17 172.38 1dmu n ARG 269 N -3.06 0.04 0.00 2.11 1.85 -1.26 -0.95 116.66 115.39 1dmu n ARG 269 Ca 0.08 0.02 0.12 0.00 -1.00 0.00 0.00 57.85 57.07 1dmu n ARG 269 Cb 0.61 -1.50 0.14 0.00 -1.05 0.00 0.00 32.46 30.66 1dmu n ARG 269 CO 0.00 0.00 0.00 0.25 -0.01 0.00 0.00 177.63 177.87 1dmu n THR 270 N -1.02 0.00 -3.07 8.89 -2.24 -1.26 -4.94 114.28 110.64 1dmu n THR 270 Ca 0.01 -0.24 -0.35 0.00 -2.27 0.00 0.00 64.05 61.20 1dmu n THR 270 Cb 0.01 1.00 -0.06 0.00 -2.10 0.00 0.00 70.33 69.17 1dmu n THR 270 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 1dmu s LYS 271 N -2.41 4.19 0.24 -0.78 2.47 -0.13 -5.00 119.74 118.33 1dmu s LYS 271 Ca 0.22 0.85 -0.31 0.00 -1.56 0.00 0.00 55.97 55.17 1dmu s LYS 271 Cb 0.19 -2.66 -0.13 0.00 -1.46 0.00 0.00 37.83 33.76 1dmu s LYS 271 CO 0.52 0.27 1.41 0.45 0.16 0.00 0.00 175.35 178.16 1dmu n SER 272 N 0.23 2.78 0.26 1.43 2.88 -1.26 -4.80 113.62 115.13 1dmu n SER 272 Ca 0.01 1.14 0.13 0.00 -1.33 0.00 0.00 58.87 58.82 1dmu n SER 272 Cb 0.52 -1.43 0.70 0.00 -0.75 0.00 0.00 64.21 63.25 1dmu n SER 272 CO 0.00 0.00 0.00 -0.07 -1.23 0.00 0.00 175.04 173.74 1dmu h LEU 273 N 4.20 0.00 -1.14 2.46 3.38 -1.96 -1.59 115.31 120.66 1dmu h LEU 273 Ca -0.45 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.52 1dmu h LEU 273 Cb 1.27 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.02 1dmu h LEU 273 CO 0.76 0.00 -0.22 0.18 0.09 0.00 0.00 178.44 179.25 1dmu n LEU 274 N -2.56 1.88 -0.42 1.67 4.77 -1.26 -4.45 117.00 116.63 1dmu n LEU 274 Ca -0.02 -0.85 0.05 0.00 -0.03 0.00 0.00 56.01 55.17 1dmu n LEU 274 Cb 0.26 0.00 0.13 0.00 -2.33 0.00 0.00 43.42 41.47 1dmu n LEU 274 CO 0.11 0.35 0.60 0.00 -1.33 0.00 0.00 177.39 177.12 1dmu n GLN 275 N 0.24 2.69 -2.31 3.23 6.02 -0.60 -4.38 117.38 122.27 1dmu n GLN 275 Ca 0.08 -2.11 -0.41 0.00 -0.01 0.00 0.00 57.00 54.54 1dmu n GLN 275 Cb 0.36 -1.33 -0.03 0.00 1.02 0.00 0.00 30.24 30.26 1dmu n GLN 275 CO 0.00 0.00 0.00 0.15 -1.01 0.00 0.00 177.06 176.20 1dmu s LYS 276 N -1.62 4.48 0.70 -1.09 1.02 -1.22 -4.76 119.74 117.25 1dmu s LYS 276 Ca 0.21 1.97 -0.12 0.00 0.02 0.00 0.00 55.97 58.05 1dmu s LYS 276 Cb 0.15 -3.18 0.02 0.00 -0.52 0.00 0.00 37.83 34.30 1dmu s LYS 276 CO 0.08 -0.07 1.08 1.03 -0.92 0.00 0.00 175.35 176.55 1dmu s ARG 277 N -0.87 2.74 0.10 1.68 0.52 -1.26 -4.66 118.95 117.19 1dmu s ARG 277 Ca 0.51 1.15 0.08 0.00 -0.52 0.00 0.00 55.73 56.94 1dmu s ARG 277 Cb -0.35 -1.96 -0.03 0.00 0.52 0.00 0.00 34.95 33.13 1dmu s ARG 277 CO 0.42 -1.27 -0.20 0.54 0.02 0.00 0.00 175.30 174.81 1dmu s VAL 278 N -2.77 1.65 0.18 3.52 0.11 0.20 -2.44 120.40 120.84 1dmu s VAL 278 Ca 0.62 -1.51 -0.04 0.00 -2.93 0.00 0.00 61.98 58.11 1dmu s VAL 278 Cb -0.17 -1.50 -0.05 0.00 -1.53 0.00 0.00 36.38 33.13 1dmu s VAL 278 CO 0.50 -0.07 0.42 -0.13 -3.33 0.00 0.00 175.10 172.48 1dmu s ARG 279 N -1.88 3.62 -0.10 1.54 0.52 0.82 0.79 118.95 124.26 1dmu s ARG 279 Ca 0.05 -0.09 0.02 0.00 -0.52 0.00 0.00 55.73 55.20 1dmu s ARG 279 Cb -0.10 -2.80 0.01 0.00 0.52 0.00 0.00 34.95 32.58 1dmu s ARG 279 CO 0.04 0.41 -0.17 0.08 0.02 0.00 0.00 175.30 175.67 1dmu s VAL 280 N -1.77 1.62 -0.37 3.52 1.01 -0.19 -1.57 120.40 122.66 1dmu s VAL 280 Ca 0.41 -0.74 -0.22 0.00 0.00 0.00 0.00 61.98 61.44 1dmu s VAL 280 Cb -0.12 -1.45 0.01 0.00 0.00 0.00 0.00 36.38 34.82 1dmu s VAL 280 CO 0.26 0.46 0.70 -0.62 0.00 0.00 0.00 175.10 175.91 1dmu s ASP 281 N 0.77 6.48 0.54 3.32 -1.08 0.16 -1.85 116.67 125.00 1dmu s ASP 281 Ca -0.11 0.21 0.24 0.00 -0.52 0.00 0.00 52.55 52.37 1dmu s ASP 281 Cb -0.16 -2.36 1.50 0.00 -1.46 0.00 0.00 42.92 40.44 1dmu s ASP 281 CO 0.02 -0.67 2.15 -0.07 0.52 0.00 0.00 175.17 177.12 1dmu h LEU 282 N 9.57 0.00 -1.23 -1.34 3.38 -1.25 -1.10 115.31 123.33 1dmu h LEU 282 Ca -0.26 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.68 1dmu h LEU 282 Cb 1.10 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.85 1dmu h LEU 282 CO 0.87 0.06 -0.18 0.03 0.09 0.00 0.00 178.44 179.32 1dmu h ARG 283 N 0.00 0.00 0.03 1.13 3.08 -1.92 -1.78 114.38 114.92 1dmu h ARG 283 Ca -0.00 0.00 -0.35 0.00 0.07 0.00 0.00 59.98 59.70 1dmu h ARG 283 Cb 0.13 0.00 -0.05 0.00 0.08 0.00 0.00 29.97 30.13 1dmu h ARG 283 CO 0.01 0.18 -1.97 0.28 -1.07 0.00 0.00 179.97 177.39 1dmu n VAL 284 N -3.35 1.59 -0.00 2.04 0.31 -0.85 -4.10 118.33 113.97 1dmu n VAL 284 Ca 0.00 -0.36 0.20 0.00 -0.01 0.00 0.00 64.34 64.18 1dmu n VAL 284 Cb 0.39 -1.83 0.69 0.00 -0.91 0.00 0.00 33.84 32.19 1dmu n VAL 284 CO 0.00 0.00 0.00 0.25 -1.32 0.00 0.00 176.83 175.76 1dmu h LEU 285 N -0.58 0.00 -0.38 7.52 5.85 -1.23 0.60 115.31 127.08 1dmu h LEU 285 Ca -0.50 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.22 1dmu h LEU 285 Cb 1.66 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.69 1dmu h LEU 285 CO -0.18 0.00 0.00 -0.67 -0.34 0.00 0.00 178.44 177.25 1dmu n ASP 286 N -4.36 0.29 0.01 1.25 2.03 -0.67 -2.53 116.55 112.57 1dmu n ASP 286 Ca 0.10 0.58 0.11 0.00 0.52 0.00 0.00 54.79 56.10 1dmu n ASP 286 Cb 0.61 -0.64 -0.15 0.00 -0.72 0.00 0.00 41.12 40.23 1dmu n ASP 286 CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 1dmu n LYS 287 N -1.83 0.65 0.00 -0.67 5.02 0.21 -4.19 118.16 117.34 1dmu n LYS 287 Ca 0.02 -0.15 0.15 0.00 -2.02 0.00 0.00 58.31 56.31 1dmu n LYS 287 Cb 0.16 -1.56 0.86 0.00 -0.02 0.00 0.00 35.03 34.46 1dmu n LYS 287 CO 0.00 0.00 0.00 0.44 -0.52 0.00 0.00 177.40 177.32 1dmu n ILE 288 N -2.32 0.00 -2.28 -0.18 -5.35 -1.05 -4.98 119.36 103.20 1dmu n ILE 288 Ca -0.03 -0.02 0.00 0.00 -0.27 0.00 0.00 62.75 62.43 1dmu n ILE 288 Cb 0.57 -0.43 0.00 0.00 -1.74 0.00 0.00 39.64 38.04 1dmu n ILE 288 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1dmu n GLY 289 N 1.10 -0.72 2.28 3.28 0.00 -1.26 -4.94 105.19 104.93 1dmu n GLY 289 Ca 0.21 -1.47 -0.34 0.00 0.00 0.00 0.00 46.02 44.41 1dmu n GLY 289 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1dmu n PRO 290 N -0.18 3.48 0.11 1.61 -0.05 -1.26 -4.47 135.00 134.24 1dmu n PRO 290 Ca 0.00 -2.13 0.12 0.00 -0.05 0.00 0.00 63.50 61.44 1dmu n PRO 290 Cb 0.00 -2.63 0.03 0.00 -0.05 0.00 0.00 33.50 30.85 1dmu n PRO 290 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 175.50 175.45 1dmu h ARG 291 N 4.57 0.00 -6.22 0.54 2.47 -1.87 -3.47 114.38 110.39 1dmu h ARG 291 Ca 0.73 0.00 -0.61 0.00 -1.26 0.00 0.00 59.98 58.84 1dmu h ARG 291 Cb 0.50 0.00 -0.26 0.00 -1.65 0.00 0.00 29.97 28.56 1dmu h ARG 291 CO 1.47 0.00 -0.85 0.08 0.56 0.00 0.00 179.97 181.23 1dmu s VAL 292 N -3.33 1.77 0.01 2.04 1.01 -1.26 -0.27 120.40 120.37 1dmu s VAL 292 Ca 0.01 -1.21 -0.09 0.00 0.00 0.00 0.00 61.98 60.69 1dmu s VAL 292 Cb 0.10 -1.52 0.00 0.00 0.00 0.00 0.00 36.38 34.96 1dmu s VAL 292 CO 0.77 0.27 0.17 -0.04 0.00 0.00 0.00 175.10 176.28 1dmu s MET 293 N -1.11 0.56 -0.08 2.72 -1.94 -0.14 -4.99 119.30 114.32 1dmu s MET 293 Ca 0.08 -0.44 0.03 0.00 -1.71 0.00 0.00 55.69 53.65 1dmu s MET 293 Cb -0.09 0.23 0.01 0.00 2.01 0.00 0.00 34.83 36.99 1dmu s MET 293 CO 0.02 -0.14 -0.19 0.99 -0.01 0.00 0.00 175.02 175.68 1dmu s THR 294 N -1.70 1.63 -0.16 2.05 2.01 -1.26 -0.62 115.64 117.59 1dmu s THR 294 Ca -0.12 -0.77 0.00 0.00 0.31 0.00 0.00 61.69 61.11 1dmu s THR 294 Cb -0.06 -1.43 -0.00 0.00 0.01 0.00 0.00 72.50 71.02 1dmu s THR 294 CO 0.00 0.46 -0.15 -0.63 -0.69 0.00 0.00 174.62 173.62 1dmu s ILE 295 N 0.47 2.65 -0.22 1.82 1.01 -0.24 -4.98 121.20 121.72 1dmu s ILE 295 Ca -0.16 -0.77 -0.29 0.00 0.00 0.00 0.00 60.65 59.43 1dmu s ILE 295 Cb -0.17 -2.12 0.01 0.00 0.01 0.00 0.00 42.46 40.19 1dmu s ILE 295 CO 0.06 0.51 1.01 -1.81 0.00 0.00 0.00 174.94 174.72 1dmu s ASP 296 N 0.83 7.09 0.00 3.58 1.01 -1.26 -0.93 116.67 126.99 1dmu s ASP 296 Ca -0.05 1.36 0.09 0.00 0.71 0.00 0.00 52.55 54.66 1dmu s ASP 296 Cb -0.15 -2.53 0.15 0.00 1.01 0.00 0.00 42.92 41.39 1dmu s ASP 296 CO -0.00 -0.63 0.97 0.23 0.21 0.00 0.00 175.17 175.95 1dmu n MET 297 N 6.13 1.39 -3.06 8.23 2.81 -0.79 -4.82 117.12 127.00 1dmu n MET 297 Ca 0.11 -1.43 -0.44 0.00 -1.81 0.00 0.00 57.70 54.13 1dmu n MET 297 Cb 0.46 -1.19 0.00 0.00 -0.71 0.00 0.00 33.22 31.78 1dmu n MET 297 CO 0.00 0.00 0.00 -3.47 1.51 0.00 0.00 175.97 174.01 1dmu n ASP 298 N 0.43 5.40 0.00 7.83 2.03 -0.99 -4.73 116.55 126.52 1dmu n ASP 298 Ca 0.07 -3.03 0.00 0.00 0.52 0.00 0.00 54.79 52.35 1dmu n ASP 298 Cb 0.30 -1.47 0.00 0.00 -0.72 0.00 0.00 41.12 39.22 1dmu n ASP 298 CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57