#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2p0j s ARG 2 N 0.00 1.66 -0.30 0.03 1.70 0.06 -3.48 118.95 118.63 2p0j s ARG 2 Ca 0.00 -1.22 -0.22 0.00 -0.47 0.00 0.00 55.73 53.82 2p0j s ARG 2 Cb 0.00 -2.02 -0.01 0.00 -0.57 0.00 0.00 34.95 32.36 2p0j s ARG 2 CO 0.00 0.48 0.72 0.42 -1.08 0.00 0.00 175.30 175.83 2p0j s ILE 3 N -1.04 4.87 -0.21 4.99 1.01 -1.26 -1.57 121.20 127.98 2p0j s ILE 3 Ca 0.15 1.07 -0.01 0.00 0.00 0.00 0.00 60.65 61.86 2p0j s ILE 3 Cb -0.10 -4.07 -0.20 0.00 0.01 0.00 0.00 42.46 38.10 2p0j s ILE 3 CO 0.07 -0.17 -0.02 0.52 0.00 0.00 0.00 174.94 175.33 2p0j n VAL 4 N 5.44 1.59 -3.95 2.92 0.31 0.09 -5.00 118.33 119.73 2p0j n VAL 4 Ca 0.02 -0.60 -0.10 0.00 -0.01 0.00 0.00 64.34 63.65 2p0j n VAL 4 Cb 0.48 -1.54 -0.12 0.00 -0.91 0.00 0.00 33.84 31.76 2p0j n VAL 4 CO 0.00 0.00 0.00 -1.61 -1.32 0.00 0.00 176.83 173.90 2p0j s GLU 5 N -2.53 0.22 -0.03 5.55 0.41 -1.11 -5.01 118.70 116.20 2p0j s GLU 5 Ca -0.31 -0.41 0.01 0.00 -0.41 0.00 0.00 54.97 53.85 2p0j s GLU 5 Cb 0.08 0.06 0.01 0.00 -1.78 0.00 0.00 34.13 32.50 2p0j s GLU 5 CO 0.66 -0.03 -0.04 0.08 -0.49 0.00 0.00 175.26 175.44 2p0j s VAL 6 N -0.97 0.43 -0.14 2.63 1.01 -1.26 -1.07 120.40 121.03 2p0j s VAL 6 Ca -0.11 -0.12 0.00 0.00 0.00 0.00 0.00 61.98 61.76 2p0j s VAL 6 Cb -0.07 -0.44 0.02 0.00 0.00 0.00 0.00 36.38 35.90 2p0j s VAL 6 CO -0.01 0.17 -0.14 -0.47 0.00 0.00 0.00 175.10 174.66 2p0j s TYR 7 N 0.58 2.06 -0.38 5.22 5.04 -0.19 -4.99 117.35 124.70 2p0j s TYR 7 Ca -0.07 -1.12 -0.18 0.00 -2.44 0.00 0.00 57.07 53.26 2p0j s TYR 7 Cb -0.10 -1.53 0.01 0.00 0.35 0.00 0.00 41.96 40.68 2p0j s TYR 7 CO -0.00 -0.62 0.52 0.45 -1.34 0.00 0.00 175.55 174.55 2p0j s SER 8 N 1.44 6.29 -0.27 4.32 0.15 -1.26 -1.11 113.70 123.26 2p0j s SER 8 Ca 0.03 -0.21 -0.11 0.00 0.70 0.00 0.00 55.95 56.37 2p0j s SER 8 Cb -0.13 -2.27 -0.05 0.00 -1.71 0.00 0.00 66.02 61.86 2p0j s SER 8 CO -0.09 -0.54 0.18 -2.28 1.20 0.00 0.00 173.24 171.70 2p0j s HIS 9 N 2.41 3.24 -1.47 3.44 2.46 0.24 -4.13 115.29 121.47 2p0j s HIS 9 Ca 0.18 0.14 -0.03 0.00 0.47 0.00 0.00 55.06 55.82 2p0j s HIS 9 Cb -0.16 -2.35 0.00 0.00 -0.13 0.00 0.00 32.58 29.95 2p0j s HIS 9 CO 0.14 -0.10 0.34 1.28 -2.47 0.00 0.00 174.74 173.93 2p0j n LEU 10 N 4.84 -2.30 -3.49 8.88 4.77 -1.26 -1.13 117.00 127.31 2p0j n LEU 10 Ca -0.14 -0.17 -0.25 0.00 -0.03 0.00 0.00 56.01 55.42 2p0j n LEU 10 Cb 0.52 -2.71 0.03 0.00 -2.33 0.00 0.00 43.42 38.93 2p0j n LEU 10 CO 0.34 0.06 0.08 0.59 -1.33 0.00 0.00 177.39 177.12 2p0j n ASN 11 N -1.88 -5.29 -0.01 -1.43 3.02 -1.26 -4.86 115.26 103.56 2p0j n ASN 11 Ca -0.15 -0.51 -0.03 0.00 -0.03 0.00 0.00 54.58 53.85 2p0j n ASN 11 Cb 0.63 -4.24 0.20 0.00 -0.61 0.00 0.00 39.78 35.76 2p0j n ASN 11 CO 0.00 0.00 0.00 1.23 -2.62 0.00 0.00 177.26 175.87 2p0j h GLY 12 N -1.78 0.58 0.83 7.41 0.00 -1.59 -1.63 103.07 106.89 2p0j h GLY 12 Ca -0.53 -0.45 -0.05 0.00 0.00 0.00 0.00 47.33 46.30 2p0j h GLY 12 CO 0.59 0.41 -0.05 -2.00 0.00 0.00 0.00 176.54 175.50 2p0j h LEU 13 N 0.48 0.44 -1.30 3.11 5.85 -1.86 -2.24 115.31 119.80 2p0j h LEU 13 Ca 0.08 -0.36 0.01 0.00 0.84 0.00 0.00 57.88 58.44 2p0j h LEU 13 Cb 0.61 -0.12 -0.04 0.00 0.37 0.00 0.00 40.66 41.49 2p0j h LEU 13 CO 0.04 0.70 0.47 -0.33 -0.34 0.00 0.00 178.44 178.98 2p0j h GLU 14 N 0.17 0.94 -0.64 1.25 3.07 -1.92 0.81 114.58 118.27 2p0j h GLU 14 Ca 0.06 -0.06 0.01 0.00 -0.50 0.00 0.00 59.36 58.87 2p0j h GLU 14 Cb 0.51 -0.21 -0.03 0.00 -0.84 0.00 0.00 28.75 28.17 2p0j h GLU 14 CO 0.02 0.62 0.42 -0.92 -1.40 0.00 0.00 179.01 177.75 2p0j h TYR 15 N 0.96 0.79 -0.43 4.33 3.20 -1.01 -1.04 116.97 123.77 2p0j h TYR 15 Ca 0.26 0.02 -0.12 0.00 3.14 0.00 0.00 58.73 62.03 2p0j h TYR 15 Cb -0.11 -0.26 -0.01 0.00 1.54 0.00 0.00 36.73 37.88 2p0j h TYR 15 CO -0.00 0.49 -0.18 0.82 -1.64 0.00 0.00 178.16 177.64 2p0j h ILE 16 N 0.84 1.28 -0.10 1.81 2.04 -0.69 -1.15 117.51 121.54 2p0j h ILE 16 Ca 0.24 -1.33 -0.01 0.00 1.00 0.00 0.00 64.86 64.76 2p0j h ILE 16 Cb -0.08 1.22 -0.01 0.00 -0.74 0.00 0.00 36.82 37.21 2p0j h ILE 16 CO -0.06 0.45 0.02 1.56 0.00 0.00 0.00 178.15 180.12 2p0j h GLN 17 N 0.71 0.13 0.00 2.37 4.20 -0.36 0.28 115.11 122.44 2p0j h GLN 17 Ca 0.10 -0.01 -0.13 0.00 0.06 0.00 0.00 58.65 58.66 2p0j h GLN 17 Cb 0.75 -0.03 -0.02 0.00 0.30 0.00 0.00 27.48 28.48 2p0j h GLN 17 CO 0.06 0.12 -0.75 0.28 -0.67 0.00 0.00 178.83 177.87 2p0j h VAL 18 N 0.13 1.20 0.00 -0.54 2.07 -1.06 -3.36 116.25 114.70 2p0j h VAL 18 Ca 0.03 -2.19 -0.28 0.00 0.82 0.00 0.00 66.70 65.09 2p0j h VAL 18 Cb 0.05 2.56 -0.05 0.00 -1.52 0.00 0.00 31.29 32.33 2p0j h VAL 18 CO -0.00 0.41 -1.81 1.41 0.02 0.00 0.00 177.57 177.59 2p0j n HIS 19 N -4.51 0.75 -2.82 1.57 8.25 -0.45 -4.62 115.22 113.38 2p0j n HIS 19 Ca -0.23 0.26 -0.15 0.00 -0.26 0.00 0.00 57.72 57.35 2p0j n HIS 19 Cb 0.58 -1.11 0.00 0.00 1.12 0.00 0.00 29.99 30.59 2p0j n HIS 19 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 2p0j n LEU 20 N -2.92 1.88 -0.31 2.41 4.77 0.86 -4.96 117.00 118.72 2p0j n LEU 20 Ca -0.19 -4.44 0.24 0.00 -0.03 0.00 0.00 56.01 51.59 2p0j n LEU 20 Cb 1.02 0.34 0.53 0.00 -2.33 0.00 0.00 43.42 42.98 2p0j n LEU 20 CO 0.44 1.93 1.23 1.55 -1.33 0.00 0.00 177.39 181.21 2p0j h PRO 21 N 2.95 0.35 0.00 3.23 0.13 -1.34 0.58 132.00 137.89 2p0j h PRO 21 Ca 0.03 -0.02 -0.02 0.00 -0.87 0.00 0.00 66.00 65.12 2p0j h PRO 21 Cb 1.03 -0.08 -0.00 0.00 0.13 0.00 0.00 31.00 32.08 2p0j h PRO 21 CO 0.57 0.23 -0.09 1.12 -0.23 0.00 0.00 178.00 179.59 2p0j h HIS 22 N 0.36 0.00 -0.31 1.56 2.07 -1.93 -2.57 115.15 114.34 2p0j h HIS 22 Ca 0.58 0.00 -0.14 0.00 -2.85 0.00 0.00 60.37 57.96 2p0j h HIS 22 Cb 1.55 0.00 -0.00 0.00 2.57 0.00 0.00 27.41 31.52 2p0j h HIS 22 CO -0.00 0.09 -0.35 0.82 -3.07 0.00 0.00 177.93 175.42 2p0j h ILE 23 N 0.00 1.29 -0.30 6.12 1.08 -1.22 -1.62 117.51 122.87 2p0j h ILE 23 Ca -0.00 -1.53 -0.12 0.00 -0.39 0.00 0.00 64.86 62.82 2p0j h ILE 23 Cb 0.20 1.56 -0.01 0.00 -3.07 0.00 0.00 36.82 35.50 2p0j h ILE 23 CO 0.01 0.50 -0.30 -0.25 -0.69 0.00 0.00 178.15 177.42 2p0j h TRP 24 N 0.54 0.72 -0.21 1.37 -0.00 -1.53 -0.62 115.95 116.23 2p0j h TRP 24 Ca 0.04 -0.18 -0.03 0.00 -0.00 0.00 0.00 58.89 58.72 2p0j h TRP 24 Cb 0.94 -0.17 -0.01 0.00 -0.00 0.00 0.00 29.16 29.92 2p0j h TRP 24 CO 0.07 0.86 -0.00 0.93 -0.00 0.00 0.00 178.44 180.29 2p0j h GLU 25 N 0.54 0.37 -0.85 2.65 4.39 -1.45 -2.49 114.58 117.74 2p0j h GLU 25 Ca 0.07 -0.12 -0.02 0.00 0.34 0.00 0.00 59.36 59.63 2p0j h GLU 25 Cb 0.78 -0.03 -0.04 0.00 -0.10 0.00 0.00 28.75 29.36 2p0j h GLU 25 CO 0.06 0.57 0.47 1.49 -1.16 0.00 0.00 179.01 180.44 2p0j h GLU 26 N 0.13 1.19 -0.52 2.33 4.81 -1.14 -0.90 114.58 120.48 2p0j h GLU 26 Ca 0.06 -0.14 -0.02 0.00 -0.13 0.00 0.00 59.36 59.13 2p0j h GLU 26 Cb 0.40 -0.23 -0.02 0.00 0.63 0.00 0.00 28.75 29.53 2p0j h GLU 26 CO 0.01 0.87 0.24 0.82 -0.73 0.00 0.00 179.01 180.22 2p0j h ILE 27 N 1.19 1.20 -0.38 2.32 2.04 -1.05 -0.98 117.51 121.85 2p0j h ILE 27 Ca 0.30 -0.58 -0.03 0.00 1.00 0.00 0.00 64.86 65.54 2p0j h ILE 27 Cb 0.03 0.62 -0.02 0.00 -0.74 0.00 0.00 36.82 36.72 2p0j h ILE 27 CO -0.05 0.23 0.11 1.56 0.00 0.00 0.00 178.15 180.00 2p0j h GLN 28 N 0.70 0.60 -0.42 2.37 4.20 -1.12 -2.31 115.11 119.13 2p0j h GLN 28 Ca 0.18 -0.13 0.02 0.00 0.06 0.00 0.00 58.65 58.78 2p0j h GLN 28 Cb 0.14 -0.08 -0.03 0.00 0.30 0.00 0.00 27.48 27.80 2p0j h GLN 28 CO -0.02 0.62 0.23 0.93 -0.67 0.00 0.00 178.83 179.92 2p0j h GLU 29 N 0.47 0.46 -0.39 1.46 5.08 -0.95 -1.52 114.58 119.19 2p0j h GLU 29 Ca 0.12 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.46 2p0j h GLU 29 Cb 0.27 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.40 2p0j h GLU 29 CO -0.00 0.30 0.26 0.82 -1.00 0.00 0.00 179.01 179.39 2p0j h ILE 30 N 0.47 1.10 -0.49 3.13 2.04 -1.04 0.00 117.51 122.72 2p0j h ILE 30 Ca 0.17 -0.19 0.00 0.00 1.00 0.00 0.00 64.86 65.84 2p0j h ILE 30 Cb 0.03 0.54 -0.02 0.00 -0.74 0.00 0.00 36.82 36.62 2p0j h ILE 30 CO -0.09 0.10 0.31 0.40 0.00 0.00 0.00 178.15 178.87 2p0j h ILE 31 N 0.53 1.14 -0.68 -0.67 2.04 -1.13 -2.40 117.51 116.34 2p0j h ILE 31 Ca 0.14 -0.30 -0.03 0.00 1.00 0.00 0.00 64.86 65.67 2p0j h ILE 31 Cb -0.06 0.46 -0.03 0.00 -0.74 0.00 0.00 36.82 36.45 2p0j h ILE 31 CO -0.03 0.14 0.31 0.58 0.00 0.00 0.00 178.15 179.15 2p0j h VAL 32 N 0.66 1.22 0.00 1.67 2.07 -0.95 0.39 116.25 121.32 2p0j h VAL 32 Ca 0.18 -0.66 0.00 0.00 0.82 0.00 0.00 66.70 67.04 2p0j h VAL 32 Cb -0.03 0.38 0.00 0.00 -1.52 0.00 0.00 31.29 30.11 2p0j h VAL 32 CO -0.04 0.27 0.00 -1.54 0.02 0.00 0.00 177.57 176.29 2p0j n SER 33 N -4.32 0.00 -4.72 0.57 3.41 -0.04 -2.71 113.62 105.80 2p0j n SER 33 Ca 0.06 0.26 -0.39 0.00 -0.26 0.00 0.00 58.87 58.54 2p0j n SER 33 Cb 0.15 -0.40 -0.05 0.00 -0.26 0.00 0.00 64.21 63.65 2p0j n SER 33 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 2p0j s ILE 34 N -2.80 5.09 -0.53 -1.33 1.01 -1.03 -4.85 121.20 116.76 2p0j s ILE 34 Ca 0.14 1.25 -0.16 0.00 0.00 0.00 0.00 60.65 61.88 2p0j s ILE 34 Cb 0.13 -3.95 0.12 0.00 0.01 0.00 0.00 42.46 38.77 2p0j s ILE 34 CO 0.34 0.29 0.50 -0.62 0.00 0.00 0.00 174.94 175.45 2p0j s ASP 35 N 0.66 6.18 0.51 3.58 2.15 -1.26 0.11 116.67 128.60 2p0j s ASP 35 Ca 0.33 -1.65 0.19 0.00 0.43 0.00 0.00 52.55 51.85 2p0j s ASP 35 Cb -0.17 -2.21 1.28 0.00 -0.30 0.00 0.00 42.92 41.52 2p0j s ASP 35 CO 0.15 -0.84 2.06 0.00 -0.17 0.00 0.00 175.17 176.38 2p0j h ALA 36 N 8.89 2.20 -0.01 3.66 0.00 -1.96 -1.71 119.26 130.34 2p0j h ALA 36 Ca -0.30 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.61 2p0j h ALA 36 Cb 1.10 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.89 2p0j h ALA 36 CO 1.01 -0.29 0.00 0.93 0.00 0.00 0.00 179.25 180.91 2p0j h GLU 37 N 0.07 0.00 -0.15 0.00 4.39 -2.00 -0.21 114.58 116.69 2p0j h GLU 37 Ca 0.15 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.85 2p0j h GLU 37 Cb 0.50 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.15 2p0j h GLU 37 CO -0.01 0.00 0.00 0.00 -1.16 0.00 0.00 179.01 177.84 2p0j n ALA 38 N -2.54 2.52 -1.34 3.43 0.00 -0.64 -3.48 120.51 118.45 2p0j n ALA 38 Ca -0.03 -0.35 0.08 0.00 0.00 0.00 0.00 53.44 53.14 2p0j n ALA 38 Cb 0.10 -1.09 0.17 0.00 0.00 0.00 0.00 19.45 18.63 2p0j n ALA 38 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2p0j s ARG 40 N -2.98 3.36 0.03 0.00 0.52 -1.23 -0.35 118.95 118.30 2p0j s ARG 40 Ca 0.34 0.06 -0.06 0.00 -0.52 0.00 0.00 55.73 55.56 2p0j s ARG 40 Cb 0.32 -2.39 -0.01 0.00 0.52 0.00 0.00 34.95 33.40 2p0j s ARG 40 CO -0.02 -0.30 0.11 -0.08 0.02 0.00 0.00 175.30 175.03 2p0j s THR 41 N -2.76 0.12 -0.83 0.02 -1.32 -0.79 -4.69 115.64 105.39 2p0j s THR 41 Ca 0.48 -0.96 -0.18 0.00 -1.21 0.00 0.00 61.69 59.83 2p0j s THR 41 Cb -0.10 -0.72 0.15 0.00 -1.51 0.00 0.00 72.50 70.31 2p0j s THR 41 CO 0.44 -0.53 0.95 -1.59 -2.21 0.00 0.00 174.62 171.68 2p0j s LYS 42 N -2.18 3.48 -0.18 7.08 0.00 -1.26 -4.21 119.74 122.46 2p0j s LYS 42 Ca -0.09 -1.83 -0.27 0.00 0.00 0.00 0.00 55.97 53.78 2p0j s LYS 42 Cb -0.04 -4.63 0.07 0.00 0.00 0.00 0.00 37.83 33.23 2p0j s LYS 42 CO -0.03 -1.60 0.71 -1.21 0.00 0.00 0.00 175.35 173.23 2p0j s GLU 43 N 2.06 0.92 0.37 1.78 8.01 -1.26 -5.17 118.70 125.41 2p0j s GLU 43 Ca 0.24 0.69 0.07 0.00 0.01 0.00 0.00 54.97 55.99 2p0j s GLU 43 Cb -0.10 0.44 -0.02 0.00 -4.31 0.00 0.00 34.13 30.14 2p0j s GLU 43 CO -0.06 -0.19 0.35 0.45 0.01 0.00 0.00 175.26 175.82 2p0j s SER 44 N -0.27 5.29 0.46 -0.19 0.15 -1.26 -4.76 113.70 113.12 2p0j s SER 44 Ca -0.04 -0.55 0.05 0.00 0.70 0.00 0.00 55.95 56.11 2p0j s SER 44 Cb -0.03 -0.84 -0.03 0.00 -1.71 0.00 0.00 66.02 63.41 2p0j s SER 44 CO 0.04 -0.48 0.12 -1.59 1.20 0.00 0.00 173.24 172.53 2p0j s LYS 45 N -4.08 2.16 0.00 5.44 -2.85 -1.26 -5.03 119.74 114.12 2p0j s LYS 45 Ca 0.45 -2.10 0.00 0.00 -1.00 0.00 0.00 55.97 53.31 2p0j s LYS 45 Cb -0.05 -1.78 0.00 0.00 -2.06 0.00 0.00 37.83 33.93 2p0j s LYS 45 CO 0.28 -0.26 0.35 0.39 0.10 0.00 0.00 175.35 176.22 2p0j n GLU 46 N -1.27 0.41 0.00 1.78 4.71 -1.26 -5.17 120.64 119.84 2p0j n GLU 46 Ca -0.08 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.07 2p0j n GLU 46 Cb 0.66 -1.05 0.00 0.00 -1.01 0.00 0.00 31.44 30.03 2p0j n GLU 46 CO 0.00 0.00 0.00 1.28 0.09 0.00 0.00 177.13 178.50 2p0j n LEU 54 N -0.29 0.00 -4.39 -4.62 4.32 -1.26 -5.27 117.00 105.50 2p0j n LEU 54 Ca 0.00 0.00 -0.31 0.00 -0.02 0.00 0.00 56.01 55.68 2p0j n LEU 54 Cb 0.03 0.00 -0.14 0.00 -1.62 0.00 0.00 43.42 41.68 2p0j n LEU 54 CO 0.00 0.00 -0.52 -0.31 -1.22 0.00 0.00 177.39 175.34 2p0j s TYR 55 N -2.00 2.47 -0.13 -1.77 1.51 -0.31 -1.89 117.35 115.23 2p0j s TYR 55 Ca 0.00 -0.32 -0.17 0.00 -1.01 0.00 0.00 57.07 55.57 2p0j s TYR 55 Cb 0.00 -1.51 -0.04 0.00 -0.11 0.00 0.00 41.96 40.30 2p0j s TYR 55 CO 0.00 0.11 0.44 0.45 -1.11 0.00 0.00 175.55 175.44 2p0j s SER 56 N -0.92 6.63 0.16 2.29 0.15 0.53 -4.48 113.70 118.06 2p0j s SER 56 Ca 0.12 0.75 -0.14 0.00 0.70 0.00 0.00 55.95 57.37 2p0j s SER 56 Cb -0.10 -2.26 0.05 0.00 -1.71 0.00 0.00 66.02 62.00 2p0j s SER 56 CO 0.01 0.02 1.76 -0.65 1.20 0.00 0.00 173.24 175.58 2p0j h PRO 57 N 6.72 0.74 -0.27 5.44 0.11 -1.88 -0.85 132.00 142.01 2p0j h PRO 57 Ca -0.41 -0.10 0.00 0.00 0.11 0.00 0.00 66.00 65.61 2p0j h PRO 57 Cb 1.18 -0.14 -0.01 0.00 0.11 0.00 0.00 31.00 32.13 2p0j h PRO 57 CO 0.76 0.60 0.17 0.28 -0.21 0.00 0.00 178.00 179.59 2p0j h VAL 58 N 0.70 1.06 -0.58 3.15 2.07 -1.94 0.05 116.25 120.77 2p0j h VAL 58 Ca 0.18 -0.12 -0.03 0.00 0.82 0.00 0.00 66.70 67.55 2p0j h VAL 58 Cb 0.09 0.68 -0.03 0.00 -1.52 0.00 0.00 31.29 30.51 2p0j h VAL 58 CO -0.03 0.06 0.23 0.00 0.02 0.00 0.00 177.57 177.85 2p0j h ALA 59 N 1.10 0.75 -0.66 1.67 0.00 -1.82 -0.11 119.26 120.19 2p0j h ALA 59 Ca 0.10 -0.17 -0.06 0.00 0.00 0.00 0.00 54.91 54.78 2p0j h ALA 59 Cb -0.03 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.50 2p0j h ALA 59 CO -0.03 0.37 0.18 -0.07 0.00 0.00 0.00 179.25 179.70 2p0j h LEU 60 N 0.80 0.98 -0.12 0.00 3.38 -0.95 -0.12 115.31 119.28 2p0j h LEU 60 Ca 0.19 -0.22 -0.00 0.00 0.09 0.00 0.00 57.88 57.94 2p0j h LEU 60 Cb 0.21 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.70 2p0j h LEU 60 CO -0.01 0.95 0.06 0.78 0.09 0.00 0.00 178.44 180.30 2p0j h ASN 61 N 0.97 0.15 -0.43 -0.43 2.35 -0.69 -1.87 115.58 115.64 2p0j h ASN 61 Ca 0.21 -0.10 -0.03 0.00 -0.55 0.00 0.00 56.30 55.82 2p0j h ASN 61 Cb 0.33 -0.04 -0.02 0.00 0.05 0.00 0.00 38.32 38.64 2p0j h ASN 61 CO -0.00 0.21 0.16 -0.33 -1.65 0.00 0.00 177.43 175.82 2p0j h GLU 62 N 0.08 0.71 0.32 0.81 5.08 -0.84 0.21 114.58 120.96 2p0j h GLU 62 Ca 0.04 -0.11 -0.02 0.00 -1.00 0.00 0.00 59.36 58.27 2p0j h GLU 62 Cb 0.10 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.23 2p0j h GLU 62 CO -0.01 0.61 -0.16 0.00 -1.00 0.00 0.00 179.01 178.46 2p0j h ALA 63 N 1.49 -0.43 -0.61 3.43 0.00 -0.68 -1.48 119.26 120.98 2p0j h ALA 63 Ca 0.16 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 54.96 2p0j h ALA 63 Cb 0.19 0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.12 2p0j h ALA 63 CO -0.01 -0.73 0.31 0.74 0.00 0.00 0.00 179.25 179.56 2p0j h PHE 64 N -0.45 0.86 -0.55 0.00 -1.00 -1.07 -2.78 116.94 111.93 2p0j h PHE 64 Ca -0.04 -0.03 0.09 0.00 2.81 0.00 0.00 57.97 60.79 2p0j h PHE 64 Cb 0.35 -0.27 -0.07 0.00 3.61 0.00 0.00 35.95 39.57 2p0j h PHE 64 CO -0.05 0.64 0.17 -0.22 -1.61 0.00 0.00 178.31 177.24 2p0j h LYS 65 N 0.83 0.33 0.15 1.51 3.64 -0.78 0.89 116.57 123.13 2p0j h LYS 65 Ca 0.21 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.57 2p0j h LYS 65 Cb 0.08 -0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 31.82 2p0j h LYS 65 CO -0.03 0.22 -0.12 1.49 -2.27 0.00 0.00 179.45 178.74 2p0j h GLU 66 N 0.33 -0.27 0.05 1.90 4.81 -1.08 -1.47 114.58 118.86 2p0j h GLU 66 Ca 0.28 0.02 -0.00 0.00 -0.13 0.00 0.00 59.36 59.52 2p0j h GLU 66 Cb 0.34 0.06 0.00 0.00 0.63 0.00 0.00 28.75 29.79 2p0j h GLU 66 CO -0.30 -0.18 -0.02 0.87 -0.73 0.00 0.00 179.01 178.65 2p0j h LYS 67 N -0.28 -0.06 -0.09 1.92 6.56 -1.18 -2.13 116.57 121.31 2p0j h LYS 67 Ca -0.00 0.00 -0.00 0.00 -1.06 0.00 0.00 60.65 59.59 2p0j h LYS 67 Cb 0.25 0.01 -0.00 0.00 -0.57 0.00 0.00 32.23 31.92 2p0j h LYS 67 CO -0.01 -0.04 0.05 -0.07 -2.06 0.00 0.00 179.45 177.32 2p0j h LEU 68 N -0.07 0.10 -1.28 2.94 3.38 -0.79 -2.39 115.31 117.22 2p0j h LEU 68 Ca -0.01 -0.05 -0.04 0.00 0.09 0.00 0.00 57.88 57.88 2p0j h LEU 68 Cb 0.05 -0.03 -0.02 0.00 0.09 0.00 0.00 40.66 40.76 2p0j h LEU 68 CO 0.01 0.12 0.03 -0.33 0.09 0.00 0.00 178.44 178.36 2p0j h GLU 69 N 0.08 0.52 0.00 1.13 5.08 -1.29 -0.81 114.58 119.29 2p0j h GLU 69 Ca 0.03 -0.10 -0.05 0.00 -1.00 0.00 0.00 59.36 58.24 2p0j h GLU 69 Cb 0.03 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.20 2p0j h GLU 69 CO -0.01 0.52 -0.23 0.00 -1.00 0.00 0.00 179.01 178.30 2p0j h ALA 70 N 1.54 1.38 -0.48 3.43 0.00 -1.12 -2.24 119.26 121.77 2p0j h ALA 70 Ca 0.11 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.81 2p0j h ALA 70 Cb 0.28 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.04 2p0j h ALA 70 CO 0.01 0.28 0.00 1.63 0.00 0.00 0.00 179.25 181.17 2p0j n LYS 71 N -3.92 2.18 -0.05 0.00 4.76 -0.41 -4.92 118.16 115.80 2p0j n LYS 71 Ca -0.02 -1.76 0.00 0.00 -2.87 0.00 0.00 58.31 53.67 2p0j n LYS 71 Cb 0.31 -1.40 0.00 0.00 -1.84 0.00 0.00 35.03 32.10 2p0j n LYS 71 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2p0j n GLY 72 N 1.23 0.44 3.70 0.72 0.00 -0.84 -5.06 105.19 105.38 2p0j n GLY 72 Ca 0.16 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.76 2p0j n GLY 72 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2p0j s TRP 73 N -2.13 3.12 0.14 1.61 0.52 -0.61 -4.86 118.94 116.74 2p0j s TRP 73 Ca 0.00 1.04 0.06 0.00 0.02 0.00 0.00 56.10 57.22 2p0j s TRP 73 Cb 0.00 -3.56 -0.04 0.00 -1.15 0.00 0.00 33.47 28.72 2p0j s TRP 73 CO 0.00 -1.91 -0.13 0.15 0.02 0.00 0.00 176.95 175.08 2p0j s LYS 74 N 1.85 1.07 0.49 4.98 1.02 -0.98 -4.02 119.74 124.16 2p0j s LYS 74 Ca 0.61 -1.34 -0.22 0.00 0.02 0.00 0.00 55.97 55.04 2p0j s LYS 74 Cb -0.30 -0.85 -0.07 0.00 -0.52 0.00 0.00 37.83 36.09 2p0j s LYS 74 CO 0.27 0.15 1.18 -1.83 -0.92 0.00 0.00 175.35 174.20 2p0j s GLU 75 N -3.08 3.59 0.09 1.68 -1.05 -0.54 -0.93 118.70 118.46 2p0j s GLU 75 Ca 0.13 1.80 0.01 0.00 -0.15 0.00 0.00 54.97 56.76 2p0j s GLU 75 Cb -0.02 -2.30 -0.04 0.00 -0.44 0.00 0.00 34.13 31.32 2p0j s GLU 75 CO 0.03 -0.70 -0.05 0.45 0.95 0.00 0.00 175.26 175.93 2p0j s SER 76 N -1.39 0.93 -0.08 0.83 0.15 -0.34 -4.90 113.70 108.91 2p0j s SER 76 Ca 0.67 -1.01 -0.05 0.00 0.70 0.00 0.00 55.95 56.25 2p0j s SER 76 Cb -0.29 0.13 0.03 0.00 -1.71 0.00 0.00 66.02 64.18 2p0j s SER 76 CO 0.35 -0.51 0.19 -0.60 1.20 0.00 0.00 173.24 173.87 2p0j s ARG 77 N -3.87 0.18 -0.14 5.44 3.52 -1.26 -1.85 118.95 120.98 2p0j s ARG 77 Ca 0.11 0.38 0.01 0.00 -0.13 0.00 0.00 55.73 56.10 2p0j s ARG 77 Cb 0.06 -0.05 -0.00 0.00 -1.56 0.00 0.00 34.95 33.40 2p0j s ARG 77 CO -0.06 -0.11 -0.17 0.95 -0.81 0.00 0.00 175.30 175.10 2p0j s THR 78 N 0.78 2.56 0.12 4.11 -4.23 -0.64 -5.00 115.64 113.34 2p0j s THR 78 Ca -0.06 -0.82 0.02 0.00 -1.18 0.00 0.00 61.69 59.65 2p0j s THR 78 Cb -0.07 -2.05 -0.04 0.00 1.34 0.00 0.00 72.50 71.68 2p0j s THR 78 CO -0.04 0.53 0.25 0.20 -0.54 0.00 0.00 174.62 175.01 2p0j s ASN 79 N 0.63 6.29 -0.06 3.99 0.01 -1.26 -1.61 114.94 122.94 2p0j s ASN 79 Ca -0.09 0.19 -0.29 0.00 -0.71 0.00 0.00 52.86 51.95 2p0j s ASN 79 Cb -0.16 -1.90 0.10 0.00 0.41 0.00 0.00 41.25 39.71 2p0j s ASN 79 CO 0.03 0.10 0.88 -0.72 -1.51 0.00 0.00 177.10 175.87 2p0j s TYR 80 N -1.65 -0.41 -0.20 2.20 -0.85 -0.82 -4.52 117.35 111.10 2p0j s TYR 80 Ca 0.34 0.51 -0.07 0.00 -0.52 0.00 0.00 57.07 57.33 2p0j s TYR 80 Cb -0.12 0.49 -0.03 0.00 0.38 0.00 0.00 41.96 42.68 2p0j s TYR 80 CO 0.28 -0.50 0.05 0.71 -1.52 0.00 0.00 175.55 174.57 2p0j s TYR 81 N -2.14 3.15 0.43 -3.49 1.51 -1.26 -1.39 117.35 114.16 2p0j s TYR 81 Ca -0.00 -0.15 0.07 0.00 -1.01 0.00 0.00 57.07 55.98 2p0j s TYR 81 Cb -0.01 -2.11 0.01 0.00 -0.11 0.00 0.00 41.96 39.75 2p0j s TYR 81 CO -0.03 -0.04 0.59 0.14 -1.11 0.00 0.00 175.55 175.10 2p0j s VAL 82 N 0.76 3.10 0.17 0.71 -7.23 0.58 -4.84 120.40 113.65 2p0j s VAL 82 Ca 0.02 -0.94 -0.24 0.00 -1.81 0.00 0.00 61.98 59.01 2p0j s VAL 82 Cb -0.14 -3.06 0.06 0.00 0.56 0.00 0.00 36.38 33.80 2p0j s VAL 82 CO 0.02 -0.02 0.82 0.28 -0.31 0.00 0.00 175.10 175.88 2p0j s THR 83 N -2.39 0.00 -0.05 5.32 -1.32 -1.26 -0.60 115.64 115.33 2p0j s THR 83 Ca 0.54 -0.55 0.14 0.00 -1.21 0.00 0.00 61.69 60.61 2p0j s THR 83 Cb -0.10 -1.67 0.02 0.00 -1.51 0.00 0.00 72.50 69.24 2p0j s THR 83 CO 0.34 0.00 1.46 0.00 -2.21 0.00 0.00 174.62 174.20 2p0j h ALA 84 N 2.00 0.66 -1.84 11.08 0.00 -2.01 -3.45 119.26 125.71 2p0j h ALA 84 Ca -0.24 -0.53 -0.57 0.00 0.00 0.00 0.00 54.91 53.58 2p0j h ALA 84 Cb 1.25 -0.09 -0.07 0.00 0.00 0.00 0.00 17.79 18.88 2p0j h ALA 84 CO 0.28 0.73 0.87 0.34 0.00 0.00 0.00 179.25 181.46 2p0j s ASP 85 N -6.51 6.75 0.22 0.00 -1.08 -1.26 -4.94 116.67 109.85 2p0j s ASP 85 Ca 0.03 0.70 -0.08 0.00 -0.52 0.00 0.00 52.55 52.68 2p0j s ASP 85 Cb 0.09 -2.54 0.32 0.00 -1.46 0.00 0.00 42.92 39.33 2p0j s ASP 85 CO 0.75 -1.07 1.76 -0.65 0.52 0.00 0.00 175.17 176.48 2p0j h PRO 86 N 8.72 0.50 -0.59 4.34 0.11 -2.00 -2.29 132.00 140.79 2p0j h PRO 86 Ca -0.22 -0.03 0.05 0.00 0.11 0.00 0.00 66.00 65.91 2p0j h PRO 86 Cb 1.06 -0.11 -0.05 0.00 0.11 0.00 0.00 31.00 32.01 2p0j h PRO 86 CO 1.08 0.33 0.32 -0.22 -0.21 0.00 0.00 178.00 179.30 2p0j h LYS 87 N 0.52 0.60 -0.00 1.05 1.63 -2.00 -2.00 116.57 116.36 2p0j h LYS 87 Ca 0.34 -0.04 -0.08 0.00 -0.85 0.00 0.00 60.65 60.02 2p0j h LYS 87 Cb 0.39 -0.14 -0.01 0.00 -0.60 0.00 0.00 32.23 31.87 2p0j h LYS 87 CO -0.29 0.40 -0.39 -0.07 -3.45 0.00 0.00 179.45 175.64 2p0j h LEU 88 N 0.62 0.00 0.01 5.20 3.38 -1.85 -2.47 115.31 120.20 2p0j h LEU 88 Ca 0.25 -0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.22 2p0j h LEU 88 Cb 0.13 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.87 2p0j h LEU 88 CO -0.15 0.40 -0.00 0.40 0.09 0.00 0.00 178.44 179.17 2p0j h ILE 89 N 0.00 1.21 0.00 1.22 2.04 -0.87 -1.79 117.51 119.32 2p0j h ILE 89 Ca -0.00 -0.66 -0.02 0.00 1.00 0.00 0.00 64.86 65.18 2p0j h ILE 89 Cb 0.70 1.66 -0.00 0.00 -0.74 0.00 0.00 36.82 38.43 2p0j h ILE 89 CO 0.05 0.17 -0.07 0.03 0.00 0.00 0.00 178.15 178.33 2p0j h ARG 90 N -0.29 0.00 0.00 2.37 3.08 -1.24 -0.29 114.38 118.00 2p0j h ARG 90 Ca -0.00 0.00 -0.16 0.00 0.07 0.00 0.00 59.98 59.89 2p0j h ARG 90 Cb 0.29 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.31 2p0j h ARG 90 CO 0.00 0.07 -0.79 0.93 -1.07 0.00 0.00 179.97 179.12 2p0j h GLU 91 N 0.00 0.00 -0.01 0.04 4.39 -1.19 -3.36 114.58 114.45 2p0j h GLU 91 Ca -0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 2p0j h GLU 91 Cb 0.17 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.82 2p0j h GLU 91 CO 0.01 0.72 -0.07 0.25 -1.16 0.00 0.00 179.01 178.76 2p0j n THR 92 N -3.26 0.00 -0.23 1.13 -2.24 -0.70 -4.70 114.28 104.27 2p0j n THR 92 Ca 0.00 -0.46 0.04 0.00 -2.27 0.00 0.00 64.05 61.35 2p0j n THR 92 Cb 0.84 1.25 0.16 0.00 -2.10 0.00 0.00 70.33 70.47 2p0j n THR 92 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 2p0j h LEU 93 N 2.34 0.11 -0.51 3.22 3.38 -1.22 -2.41 115.31 120.22 2p0j h LEU 93 Ca 0.00 0.12 0.00 0.00 0.09 0.00 0.00 57.88 58.09 2p0j h LEU 93 Cb 0.53 0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.42 2p0j h LEU 93 CO 0.00 0.03 -0.20 -1.20 0.09 0.00 0.00 178.44 177.16 2p0j n SER 94 N -5.09 1.00 -4.91 -0.43 7.64 -1.26 -4.76 113.62 105.81 2p0j n SER 94 Ca 0.12 -0.92 -0.28 0.00 1.01 0.00 0.00 58.87 58.80 2p0j n SER 94 Cb 0.39 0.08 0.07 0.00 -1.01 0.00 0.00 64.21 63.75 2p0j n SER 94 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 2p0j s LEU 95 N -2.43 2.75 0.49 -3.43 1.43 -0.91 -4.99 118.68 111.59 2p0j s LEU 95 Ca 0.27 0.75 -0.14 0.00 -1.03 0.00 0.00 54.13 53.99 2p0j s LEU 95 Cb 0.20 -3.39 -0.07 0.00 0.03 0.00 0.00 46.19 42.96 2p0j s LEU 95 CO 0.49 -1.61 0.91 -1.61 0.23 0.00 0.00 176.35 174.76 2p0j s GLU 96 N -5.37 3.84 0.06 1.70 2.02 -1.26 -4.82 118.70 114.87 2p0j s GLU 96 Ca 0.60 0.74 -0.12 0.00 0.02 0.00 0.00 54.97 56.21 2p0j s GLU 96 Cb -0.11 -2.23 -0.03 0.00 0.10 0.00 0.00 34.13 31.87 2p0j s GLU 96 CO 0.48 -0.22 1.00 -2.30 0.02 0.00 0.00 175.26 174.24 2p0j n PRO 97 N -1.62 -0.17 0.10 0.39 -0.02 -1.26 -1.17 135.00 131.25 2p0j n PRO 97 Ca 0.05 0.99 0.07 0.00 -2.02 0.00 0.00 63.50 62.58 2p0j n PRO 97 Cb 0.54 -1.47 0.52 0.00 -0.02 0.00 0.00 33.50 33.08 2p0j n PRO 97 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 2p0j h GLU 98 N 0.00 0.30 -0.05 -0.52 4.39 -1.96 -2.03 114.58 114.70 2p0j h GLU 98 Ca 0.06 -0.02 -0.17 0.00 0.34 0.00 0.00 59.36 59.57 2p0j h GLU 98 Cb 0.16 -0.07 -0.01 0.00 -0.10 0.00 0.00 28.75 28.73 2p0j h GLU 98 CO -0.37 0.20 -0.72 1.49 -1.16 0.00 0.00 179.01 178.45 2p0j h GLU 99 N 0.30 0.30 -0.11 2.33 4.57 -1.52 -1.92 114.58 118.53 2p0j h GLU 99 Ca 0.10 -0.24 -0.02 0.00 -1.18 0.00 0.00 59.36 58.02 2p0j h GLU 99 Cb 0.03 0.05 -0.00 0.00 -0.16 0.00 0.00 28.75 28.67 2p0j h GLU 99 CO -0.02 0.90 0.01 1.96 -1.18 0.00 0.00 179.01 180.67 2p0j h GLN 100 N 0.20 0.18 -0.03 1.92 4.20 -0.46 -1.35 115.11 119.77 2p0j h GLN 100 Ca -0.03 -0.05 0.03 0.00 0.06 0.00 0.00 58.65 58.66 2p0j h GLN 100 Cb 1.28 -0.02 -0.04 0.00 0.30 0.00 0.00 27.48 29.00 2p0j h GLN 100 CO 0.12 0.41 -0.19 -0.22 -0.67 0.00 0.00 178.83 178.28 2p0j h LYS 101 N -0.07 -0.28 -0.30 1.46 3.64 -1.41 -0.76 116.57 118.86 2p0j h LYS 101 Ca 0.03 0.02 0.07 0.00 -1.27 0.00 0.00 60.65 59.50 2p0j h LYS 101 Cb 0.32 0.06 -0.08 0.00 -0.41 0.00 0.00 32.23 32.13 2p0j h LYS 101 CO 0.00 -0.19 -0.28 -0.22 -2.27 0.00 0.00 179.45 176.50 2p0j h LYS 102 N -0.29 -0.25 -0.44 1.90 1.63 -1.23 -0.58 116.57 117.31 2p0j h LYS 102 Ca 0.07 0.02 -0.01 0.00 -0.85 0.00 0.00 60.65 59.87 2p0j h LYS 102 Cb 0.38 0.06 -0.02 0.00 -0.60 0.00 0.00 32.23 32.05 2p0j h LYS 102 CO -0.20 -0.17 0.22 0.28 -3.45 0.00 0.00 179.45 176.13 2p0j h VAL 103 N -0.26 1.18 -0.14 2.00 2.07 -0.94 -1.65 116.25 118.52 2p0j h VAL 103 Ca 0.15 -0.49 -0.01 0.00 0.82 0.00 0.00 66.70 67.17 2p0j h VAL 103 Cb 0.50 0.69 -0.01 0.00 -1.52 0.00 0.00 31.29 30.96 2p0j h VAL 103 CO -0.45 0.19 0.04 0.40 0.02 0.00 0.00 177.57 177.77 2p0j h ILE 104 N 0.57 1.19 0.00 4.57 2.04 -0.83 -2.83 117.51 122.22 2p0j h ILE 104 Ca 0.15 -0.59 -0.05 0.00 1.00 0.00 0.00 64.86 65.37 2p0j h ILE 104 Cb 0.11 1.33 -0.01 0.00 -0.74 0.00 0.00 36.82 37.51 2p0j h ILE 104 CO -0.02 0.18 -0.24 -0.33 0.00 0.00 0.00 178.15 177.74 2p0j h GLU 105 N 0.03 0.00 0.00 2.37 5.08 -1.11 -2.30 114.58 118.65 2p0j h GLU 105 Ca 0.04 0.00 -0.08 0.00 -1.00 0.00 0.00 59.36 58.32 2p0j h GLU 105 Cb 0.24 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.48 2p0j h GLU 105 CO -0.00 0.24 -0.40 0.00 -1.00 0.00 0.00 179.01 177.85 2p0j h ALA 106 N 1.76 0.98 -0.20 3.43 0.00 -1.16 -2.19 119.26 121.90 2p0j h ALA 106 Ca -0.00 -0.36 0.00 0.00 0.00 0.00 0.00 54.91 54.55 2p0j h ALA 106 Cb 0.69 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.41 2p0j h ALA 106 CO 0.03 0.49 0.00 0.00 0.00 0.00 0.00 179.25 179.78 2p0j n ALA 107 N -2.30 2.48 -1.15 0.00 0.00 -0.90 -4.87 120.51 113.76 2p0j n ALA 107 Ca -0.00 -0.36 -0.05 0.00 0.00 0.00 0.00 53.44 53.02 2p0j n ALA 107 Cb 0.52 -1.01 -0.02 0.00 0.00 0.00 0.00 19.45 18.94 2p0j n ALA 107 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2p0j n GLY 108 N 0.85 0.78 3.76 0.00 0.00 -0.82 -5.03 105.19 104.73 2p0j n GLY 108 Ca 0.08 -0.79 -0.25 0.00 0.00 0.00 0.00 46.02 45.07 2p0j n GLY 108 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2p0j s LYS 109 N -2.37 2.75 0.10 1.61 -0.14 -0.99 -5.02 119.74 115.67 2p0j s LYS 109 Ca 0.00 -1.03 -0.30 0.00 -1.36 0.00 0.00 55.97 53.28 2p0j s LYS 109 Cb 0.00 -2.51 -0.06 0.00 -1.68 0.00 0.00 37.83 33.58 2p0j s LYS 109 CO 0.00 0.44 0.95 -2.00 -0.76 0.00 0.00 175.35 173.98 2p0j s GLU 110 N -3.37 4.68 -0.20 1.68 2.12 -1.26 -3.73 118.70 118.62 2p0j s GLU 110 Ca 0.31 1.43 -0.06 0.00 0.36 0.00 0.00 54.97 57.02 2p0j s GLU 110 Cb -0.09 -3.38 -0.03 0.00 0.26 0.00 0.00 34.13 30.89 2p0j s GLU 110 CO 0.23 0.20 0.02 0.00 -0.54 0.00 0.00 175.26 175.16 2p0j s ALA 111 N 0.06 3.13 -0.22 6.30 0.00 -1.26 -4.59 121.76 125.18 2p0j s ALA 111 Ca 0.47 -0.93 -0.05 0.00 0.00 0.00 0.00 51.96 51.45 2p0j s ALA 111 Cb -0.23 -1.82 -0.02 0.00 0.00 0.00 0.00 23.12 21.06 2p0j s ALA 111 CO 0.29 -0.07 -0.01 -0.51 0.00 0.00 0.00 175.76 175.47 2p0j s LEU 112 N 0.85 3.09 0.13 0.00 1.02 0.23 -4.93 118.68 119.07 2p0j s LEU 112 Ca 0.02 -0.31 -0.31 0.00 0.02 0.00 0.00 54.13 53.55 2p0j s LEU 112 Cb -0.14 -1.80 -0.08 0.00 0.02 0.00 0.00 46.19 44.19 2p0j s LEU 112 CO 0.02 -0.00 1.35 -0.75 0.02 0.00 0.00 176.35 176.99 2p0j s LYS 113 N 1.38 4.35 0.35 1.70 2.36 -1.26 -0.31 119.74 128.31 2p0j s LYS 113 Ca 0.05 2.04 -0.01 0.00 -2.55 0.00 0.00 55.97 55.49 2p0j s LYS 113 Cb -0.15 -3.24 0.00 0.00 -1.05 0.00 0.00 37.83 33.39 2p0j s LYS 113 CO -0.00 -0.37 0.46 0.45 1.55 0.00 0.00 175.35 177.44 2p0j s SER 114 N 0.89 1.05 -0.03 1.43 0.15 -0.48 -4.91 113.70 111.79 2p0j s SER 114 Ca 0.62 -1.54 -0.31 0.00 0.70 0.00 0.00 55.95 55.42 2p0j s SER 114 Cb -0.36 0.66 0.12 0.00 -1.71 0.00 0.00 66.02 64.74 2p0j s SER 114 CO 0.32 -1.29 1.32 -0.72 1.20 0.00 0.00 173.24 174.07 2p0j s TYR 115 N -3.02 -0.03 0.04 3.44 -0.85 -1.26 -1.94 117.35 113.73 2p0j s TYR 115 Ca 0.32 -0.06 0.04 0.00 -0.52 0.00 0.00 57.07 56.85 2p0j s TYR 115 Cb -0.00 0.54 -0.02 0.00 0.38 0.00 0.00 41.96 42.85 2p0j s TYR 115 CO 0.22 -0.21 -0.13 -0.80 -1.52 0.00 0.00 175.55 173.11 2p0j s ASN 116 N -3.08 1.47 -0.01 -0.18 -0.87 -0.63 -5.00 114.94 106.64 2p0j s ASN 116 Ca 0.16 -0.45 0.02 0.00 -1.57 0.00 0.00 52.86 51.02 2p0j s ASN 116 Cb 0.05 -0.08 0.00 0.00 -0.02 0.00 0.00 41.25 41.20 2p0j s ASN 116 CO -0.04 -0.00 -0.05 -1.58 -2.57 0.00 0.00 177.10 172.85 2p0j s GLN 117 N -1.15 0.53 0.02 -0.60 0.74 -1.26 -1.62 119.66 116.32 2p0j s GLN 117 Ca -0.00 -0.17 0.02 0.00 0.05 0.00 0.00 55.36 55.25 2p0j s GLN 117 Cb -0.08 -0.53 -0.02 0.00 1.10 0.00 0.00 33.01 33.48 2p0j s GLN 117 CO 0.01 0.07 -0.06 -0.08 -0.55 0.00 0.00 175.29 174.68 2p0j s THR 118 N 0.13 0.44 0.27 -0.34 -1.32 -0.77 -5.01 115.64 109.03 2p0j s THR 118 Ca -0.01 -0.70 0.04 0.00 -1.21 0.00 0.00 61.69 59.80 2p0j s THR 118 Cb -0.05 -0.46 0.02 0.00 -1.51 0.00 0.00 72.50 70.50 2p0j s THR 118 CO -0.00 -0.19 1.66 0.44 -2.21 0.00 0.00 174.62 174.32 2p0j h ASP 119 N 5.14 0.38 -3.53 8.08 3.32 -1.87 -0.88 116.42 127.06 2p0j h ASP 119 Ca -0.32 -0.16 -0.61 0.00 0.02 0.00 0.00 57.03 55.96 2p0j h ASP 119 Cb 1.20 -0.11 -0.39 0.00 0.22 0.00 0.00 39.33 40.26 2p0j h ASP 119 CO 0.45 0.75 -0.77 -0.36 -1.72 0.00 0.00 179.24 177.58 2p0j s PHE 120 N -4.18 2.36 -0.01 4.55 0.40 -1.26 -1.46 117.98 118.38 2p0j s PHE 120 Ca -0.06 -1.86 0.02 0.00 -0.60 0.00 0.00 56.93 54.44 2p0j s PHE 120 Cb 0.13 -1.75 -0.00 0.00 0.51 0.00 0.00 43.02 41.91 2p0j s PHE 120 CO 0.79 -0.80 -0.08 0.08 0.70 0.00 0.00 175.22 175.91 2p0j s VAL 121 N 1.40 0.66 -0.28 -0.44 1.01 -0.11 -0.84 120.40 121.81 2p0j s VAL 121 Ca -0.00 -0.34 -0.21 0.00 0.00 0.00 0.00 61.98 61.43 2p0j s VAL 121 Cb -0.18 -0.57 0.09 0.00 0.00 0.00 0.00 36.38 35.72 2p0j s VAL 121 CO -0.10 0.19 0.81 -0.75 0.00 0.00 0.00 175.10 175.25 2p0j s LYS 122 N -0.07 0.68 -1.53 2.72 2.20 -0.34 -2.31 119.74 121.09 2p0j s LYS 122 Ca 0.01 0.94 -0.08 0.00 -0.36 0.00 0.00 55.97 56.49 2p0j s LYS 122 Cb -0.05 0.26 0.06 0.00 -1.51 0.00 0.00 37.83 36.59 2p0j s LYS 122 CO -0.00 -0.10 0.58 -0.25 -0.36 0.00 0.00 175.35 175.21 2p0j n ASP 123 N 3.18 -1.66 -2.19 1.43 8.00 -1.26 -1.09 116.55 122.96 2p0j n ASP 123 Ca -0.16 -1.00 -0.19 0.00 0.71 0.00 0.00 54.79 54.15 2p0j n ASP 123 Cb 0.57 -2.96 -0.00 0.00 -0.02 0.00 0.00 41.12 38.70 2p0j n ASP 123 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 2p0j n ARG 124 N -4.42 -1.77 -4.65 -1.24 1.74 -1.26 -4.93 116.66 100.12 2p0j n ARG 124 Ca -0.15 0.90 -0.24 0.00 -0.77 0.00 0.00 57.85 57.59 2p0j n ARG 124 Cb 0.61 -5.45 -0.16 0.00 -1.02 0.00 0.00 32.46 26.44 2p0j n ARG 124 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2p0j s VAL 125 N -2.95 1.17 -0.09 1.55 1.01 -0.25 -0.71 120.40 120.12 2p0j s VAL 125 Ca 0.03 -0.57 0.01 0.00 0.00 0.00 0.00 61.98 61.45 2p0j s VAL 125 Cb -0.01 -1.02 -0.02 0.00 0.00 0.00 0.00 36.38 35.33 2p0j s VAL 125 CO 0.03 0.35 -0.12 0.00 0.00 0.00 0.00 175.10 175.35 2p0j s ALA 126 N 0.14 2.69 -0.19 5.51 0.00 -1.13 -1.20 121.76 127.59 2p0j s ALA 126 Ca -0.04 -0.92 0.01 0.00 0.00 0.00 0.00 51.96 51.01 2p0j s ALA 126 Cb -0.11 -1.14 0.02 0.00 0.00 0.00 0.00 23.12 21.90 2p0j s ALA 126 CO 0.02 0.40 -0.18 0.42 0.00 0.00 0.00 175.76 176.41 2p0j s ILE 127 N -0.18 2.01 -0.28 0.00 1.01 -0.02 0.31 121.20 124.05 2p0j s ILE 127 Ca 0.00 -0.98 -0.08 0.00 0.00 0.00 0.00 60.65 59.59 2p0j s ILE 127 Cb -0.13 -1.86 -0.02 0.00 0.01 0.00 0.00 42.46 40.46 2p0j s ILE 127 CO 0.03 0.47 0.11 -1.61 0.00 0.00 0.00 174.94 173.94 2p0j s GLU 128 N 1.29 3.45 -0.16 2.79 0.41 0.44 -4.08 118.70 122.85 2p0j s GLU 128 Ca 0.03 -0.63 -0.19 0.00 -0.41 0.00 0.00 54.97 53.78 2p0j s GLU 128 Cb -0.14 -3.44 -0.03 0.00 -1.78 0.00 0.00 34.13 28.73 2p0j s GLU 128 CO -0.12 -0.32 0.54 0.08 -0.49 0.00 0.00 175.26 174.96 2p0j s VAL 129 N 1.60 5.11 -0.26 2.63 1.01 -1.26 -1.16 120.40 128.07 2p0j s VAL 129 Ca 0.05 1.05 -0.02 0.00 0.00 0.00 0.00 61.98 63.06 2p0j s VAL 129 Cb -0.16 -3.87 0.08 0.00 0.00 0.00 0.00 36.38 32.43 2p0j s VAL 129 CO 0.05 0.22 0.06 -1.58 0.00 0.00 0.00 175.10 173.85 2p0j s GLN 130 N 1.27 0.71 -0.43 2.72 2.00 -0.34 -4.94 119.66 120.64 2p0j s GLN 130 Ca 0.27 -0.76 0.07 0.00 -2.00 0.00 0.00 55.36 52.94 2p0j s GLN 130 Cb -0.16 -2.01 0.42 0.00 0.80 0.00 0.00 33.01 32.06 2p0j s GLN 130 CO 0.11 -0.82 1.05 1.19 -0.50 0.00 0.00 175.29 176.32 2p0j n PHE 131 N 4.95 3.03 -3.71 1.67 3.01 -1.26 -4.45 117.46 120.70 2p0j n PHE 131 Ca -0.06 -3.19 0.00 0.00 1.01 0.00 0.00 57.45 55.21 2p0j n PHE 131 Cb 0.44 -0.19 0.00 0.00 -0.01 0.00 0.00 39.48 39.73 2p0j n PHE 131 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2p0j n GLY 132 N -0.36 4.90 3.59 1.37 0.00 -1.26 -4.78 105.19 108.64 2p0j n GLY 132 Ca 0.33 -2.16 -0.30 0.00 0.00 0.00 0.00 46.02 43.89 2p0j n GLY 132 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2p0j s LYS 133 N -1.26 0.06 0.58 1.61 -0.14 -1.26 -2.79 119.74 116.54 2p0j s LYS 133 Ca 0.00 1.13 0.29 0.00 -1.36 0.00 0.00 55.97 56.02 2p0j s LYS 133 Cb 0.00 -1.65 1.47 0.00 -1.68 0.00 0.00 37.83 35.98 2p0j s LYS 133 CO 0.00 -3.15 1.91 0.10 -0.76 0.00 0.00 175.35 173.45 2p0j h TYR 134 N -2.22 0.00 0.00 3.18 -0.00 -1.65 -2.82 116.97 113.45 2p0j h TYR 134 Ca -0.53 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.20 2p0j h TYR 134 Cb 1.30 0.00 0.00 0.00 0.00 0.00 0.00 36.73 38.03 2p0j h TYR 134 CO 0.38 0.00 -0.61 -1.13 -0.00 0.00 0.00 178.16 176.80 2p0j n SER 135 N -3.85 0.57 -0.08 0.10 3.41 -1.26 -4.38 113.62 108.13 2p0j n SER 135 Ca 0.10 -0.18 -0.05 0.00 -0.26 0.00 0.00 58.87 58.48 2p0j n SER 135 Cb 0.70 0.31 0.15 0.00 -0.26 0.00 0.00 64.21 65.11 2p0j n SER 135 CO 0.00 0.00 0.00 -0.26 -0.16 0.00 0.00 175.04 174.62 2p0j h PHE 136 N 0.00 0.80 -0.29 7.33 0.05 -1.85 -2.91 116.94 120.08 2p0j h PHE 136 Ca 0.00 -0.14 -0.05 0.00 3.82 0.00 0.00 57.97 61.61 2p0j h PHE 136 Cb 0.58 -0.21 -0.01 0.00 2.00 0.00 0.00 35.95 38.31 2p0j h PHE 136 CO 0.00 0.80 0.00 0.28 -0.18 0.00 0.00 178.31 179.21 2p0j h VAL 137 N 0.67 1.26 -0.70 -0.55 2.07 -1.79 -0.31 116.25 116.90 2p0j h VAL 137 Ca 0.12 -0.92 0.06 0.00 0.82 0.00 0.00 66.70 66.78 2p0j h VAL 137 Cb 0.56 1.30 -0.06 0.00 -1.52 0.00 0.00 31.29 31.57 2p0j h VAL 137 CO 0.03 0.30 0.39 0.00 0.02 0.00 0.00 177.57 178.31 2p0j h ALA 138 N 0.83 0.94 -0.53 1.67 0.00 -1.81 -0.33 119.26 120.04 2p0j h ALA 138 Ca 0.08 0.02 -0.05 0.00 0.00 0.00 0.00 54.91 54.96 2p0j h ALA 138 Cb 0.43 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.06 2p0j h ALA 138 CO 0.01 0.07 0.15 -0.92 0.00 0.00 0.00 179.25 178.56 2p0j h TYR 139 N 0.71 0.87 0.06 0.00 3.20 -1.32 -0.39 116.97 120.10 2p0j h TYR 139 Ca 0.31 -0.10 0.02 0.00 3.14 0.00 0.00 58.73 62.11 2p0j h TYR 139 Cb 0.20 -0.25 -0.03 0.00 1.54 0.00 0.00 36.73 38.20 2p0j h TYR 139 CO -0.07 0.75 -0.17 -0.44 -1.64 0.00 0.00 178.16 176.59 2p0j h ASP 140 N 0.73 -0.49 0.13 -2.11 3.32 -0.08 -0.04 116.42 117.89 2p0j h ASP 140 Ca 0.17 0.06 -0.01 0.00 0.02 0.00 0.00 57.03 57.27 2p0j h ASP 140 Cb 0.31 0.19 0.00 0.00 0.22 0.00 0.00 39.33 40.05 2p0j h ASP 140 CO -0.00 -0.24 -0.06 -0.07 -1.72 0.00 0.00 179.24 177.14 2p0j h LEU 141 N -0.31 -0.15 0.00 1.55 3.38 -1.00 0.18 115.31 118.96 2p0j h LEU 141 Ca 0.04 -0.37 0.00 0.00 0.09 0.00 0.00 57.88 57.63 2p0j h LEU 141 Cb 0.35 0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.14 2p0j h LEU 141 CO -0.12 0.34 -0.35 0.49 0.09 0.00 0.00 178.44 178.89 2p0j n PHE 142 N -4.94 0.63 0.03 1.13 3.01 -0.17 -3.85 117.46 113.30 2p0j n PHE 142 Ca -0.08 0.18 -0.00 0.00 1.01 0.00 0.00 57.45 58.56 2p0j n PHE 142 Cb 0.26 -0.73 -0.00 0.00 -0.01 0.00 0.00 39.48 39.00 2p0j n PHE 142 CO 0.00 0.00 0.00 0.28 1.01 0.00 0.00 176.76 178.05 2p0j n VAL 143 N -2.10 0.85 0.48 -4.37 0.31 -0.14 -4.61 118.33 108.74 2p0j n VAL 143 Ca 0.04 0.28 -0.20 0.00 -0.01 0.00 0.00 64.34 64.45 2p0j n VAL 143 Cb 0.42 -1.43 -0.10 0.00 -0.91 0.00 0.00 33.84 31.82 2p0j n VAL 143 CO 0.00 0.00 0.00 0.11 -1.32 0.00 0.00 176.83 175.62 2p0j h LYS 144 N -0.04 -1.23 -0.97 5.55 1.57 -1.10 -0.47 116.57 119.88 2p0j h LYS 144 Ca 0.00 0.08 0.05 0.00 -1.87 0.00 0.00 60.65 58.92 2p0j h LYS 144 Cb 0.04 0.28 -0.06 0.00 0.08 0.00 0.00 32.23 32.56 2p0j h LYS 144 CO 0.00 -0.82 0.63 0.45 -0.57 0.00 0.00 179.45 179.14 2p0j h HIS 145 N -1.28 1.17 -0.44 -1.35 3.86 -0.82 -2.16 115.15 114.13 2p0j h HIS 145 Ca -0.12 0.03 -0.05 0.00 -1.16 0.00 0.00 60.37 59.07 2p0j h HIS 145 Cb 1.00 -0.38 -0.02 0.00 1.06 0.00 0.00 27.41 29.07 2p0j h HIS 145 CO -0.06 0.63 0.04 0.52 0.86 0.00 0.00 177.93 179.92 2p0j h MET 146 N 1.17 0.68 -0.25 2.45 2.86 -1.64 -1.24 114.93 118.95 2p0j h MET 146 Ca 0.41 -0.15 -0.02 0.00 -2.06 0.00 0.00 59.70 57.87 2p0j h MET 146 Cb 0.10 -0.10 -0.01 0.00 0.06 0.00 0.00 31.60 31.66 2p0j h MET 146 CO -0.15 0.67 0.07 0.00 1.06 0.00 0.00 176.91 178.56 2p0j h ALA 147 N 1.40 0.33 -0.25 6.32 0.00 -0.43 0.14 119.26 126.78 2p0j h ALA 147 Ca 0.14 -0.15 -0.13 0.00 0.00 0.00 0.00 54.91 54.76 2p0j h ALA 147 Cb 0.34 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 2p0j h ALA 147 CO 0.01 -0.02 -0.40 0.74 0.00 0.00 0.00 179.25 179.57 2p0j h PHE 148 N 0.24 0.69 -0.12 0.00 -1.00 -1.37 -1.67 116.94 113.71 2p0j h PHE 148 Ca 0.08 -0.20 -0.02 0.00 2.81 0.00 0.00 57.97 60.64 2p0j h PHE 148 Cb 0.26 -0.15 -0.00 0.00 3.61 0.00 0.00 35.95 39.67 2p0j h PHE 148 CO 0.01 0.89 -0.01 -0.92 -1.61 0.00 0.00 178.31 176.66 2p0j h TYR 149 N 0.48 0.25 -0.15 -0.55 3.20 -1.02 0.23 116.97 119.40 2p0j h TYR 149 Ca 0.04 -0.05 -0.08 0.00 3.14 0.00 0.00 58.73 61.78 2p0j h TYR 149 Cb 0.90 -0.06 -0.01 0.00 1.54 0.00 0.00 36.73 39.10 2p0j h TYR 149 CO 0.04 0.49 -0.26 0.28 -1.64 0.00 0.00 178.16 177.06 2p0j h VAL 150 N -0.07 1.25 -0.11 1.81 2.07 -0.71 -1.67 116.25 118.82 2p0j h VAL 150 Ca 0.03 -1.18 0.00 0.00 0.82 0.00 0.00 66.70 66.37 2p0j h VAL 150 Cb 0.40 1.43 0.00 0.00 -1.52 0.00 0.00 31.29 31.60 2p0j h VAL 150 CO 0.01 0.36 0.00 -1.20 0.02 0.00 0.00 177.57 176.76 2p0j n SER 151 N -4.14 0.64 -3.64 0.57 7.64 -0.63 -4.74 113.62 109.31 2p0j n SER 151 Ca -0.01 -2.00 -0.24 0.00 1.01 0.00 0.00 58.87 57.63 2p0j n SER 151 Cb 0.38 -0.09 0.07 0.00 -1.01 0.00 0.00 64.21 63.56 2p0j n SER 151 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 2p0j n ASP 152 N -0.16 -4.97 -0.06 6.43 2.03 -0.63 -4.91 116.55 114.28 2p0j n ASP 152 Ca 0.04 -0.62 -0.04 0.00 0.52 0.00 0.00 54.79 54.69 2p0j n ASP 152 Cb 0.10 -4.75 -0.12 0.00 -0.72 0.00 0.00 41.12 35.63 2p0j n ASP 152 CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 2p0j n LYS 153 N -4.75 1.24 -4.14 -0.67 4.76 0.77 -5.01 118.16 110.36 2p0j n LYS 153 Ca -0.06 -0.04 -0.11 0.00 -2.87 0.00 0.00 58.31 55.23 2p0j n LYS 153 Cb 0.58 -1.40 -0.10 0.00 -1.84 0.00 0.00 35.03 32.27 2p0j n LYS 153 CO 0.00 0.00 0.00 0.96 -1.37 0.00 0.00 177.40 176.99 2p0j s ILE 154 N -2.57 0.60 -0.11 -0.18 -4.36 -1.17 -4.42 121.20 108.99 2p0j s ILE 154 Ca -0.07 -1.73 0.12 0.00 -0.26 0.00 0.00 60.65 58.71 2p0j s ILE 154 Cb 0.06 -1.42 -0.18 0.00 1.25 0.00 0.00 42.46 42.16 2p0j s ILE 154 CO 0.65 -0.78 0.32 0.47 0.24 0.00 0.00 174.94 175.83 2p0j n ASP 155 N 0.31 1.87 -3.67 4.36 10.43 0.11 -4.39 116.55 125.57 2p0j n ASP 155 Ca -0.15 -0.13 -0.14 0.00 2.57 0.00 0.00 54.79 56.93 2p0j n ASP 155 Cb 0.59 1.47 -0.08 0.00 1.84 0.00 0.00 41.12 44.95 2p0j n ASP 155 CO 0.00 0.00 0.00 0.54 -1.07 0.00 0.00 177.20 176.67 2p0j s VAL 156 N -2.75 0.01 0.09 2.53 0.11 -1.25 -4.39 120.40 114.75 2p0j s VAL 156 Ca -0.03 -0.07 0.06 0.00 -2.93 0.00 0.00 61.98 59.01 2p0j s VAL 156 Cb 0.08 -0.79 -0.04 0.00 -1.53 0.00 0.00 36.38 34.10 2p0j s VAL 156 CO 0.52 -0.04 -0.05 -0.83 -3.33 0.00 0.00 175.10 171.36 2p0j s GLY 157 N -0.23 1.84 -0.04 6.54 0.00 -0.18 -2.82 107.32 112.44 2p0j s GLY 157 Ca -0.04 -1.17 0.06 0.00 0.00 0.00 0.00 44.72 43.57 2p0j s GLY 157 CO 0.03 -1.13 -0.21 0.14 0.00 0.00 0.00 173.10 171.93 2p0j s VAL 158 N -1.23 1.72 -0.16 1.40 1.01 0.15 -0.93 120.40 122.35 2p0j s VAL 158 Ca 0.23 -0.89 0.00 0.00 0.00 0.00 0.00 61.98 61.32 2p0j s VAL 158 Cb -0.11 -1.45 0.03 0.00 0.00 0.00 0.00 36.38 34.85 2p0j s VAL 158 CO 0.15 0.49 -0.10 -0.70 0.00 0.00 0.00 175.10 174.93 2p0j s GLU 159 N -0.19 1.94 -0.26 2.72 2.56 -0.29 -0.42 118.70 124.76 2p0j s GLU 159 Ca -0.00 -0.61 -0.12 0.00 0.00 0.00 0.00 54.97 54.24 2p0j s GLU 159 Cb -0.11 -2.13 -0.05 0.00 2.00 0.00 0.00 34.13 33.84 2p0j s GLU 159 CO 0.02 -0.34 0.22 0.42 -0.56 0.00 0.00 175.26 175.02 2p0j s ILE 160 N 1.51 5.29 0.09 -3.70 -1.09 -0.31 -0.52 121.20 122.47 2p0j s ILE 160 Ca 0.02 0.27 0.03 0.00 -2.23 0.00 0.00 60.65 58.73 2p0j s ILE 160 Cb -0.14 -3.56 -0.04 0.00 -1.58 0.00 0.00 42.46 37.14 2p0j s ILE 160 CO -0.09 0.26 -0.08 -0.22 -1.23 0.00 0.00 174.94 173.57 2p0j s LEU 161 N 1.63 2.41 0.28 2.97 2.96 0.59 -1.20 118.68 128.31 2p0j s LEU 161 Ca 0.09 -0.83 -0.21 0.00 -0.22 0.00 0.00 54.13 52.96 2p0j s LEU 161 Cb -0.15 -0.18 -0.09 0.00 0.50 0.00 0.00 46.19 46.26 2p0j s LEU 161 CO 0.09 -0.33 0.80 -2.16 -1.32 0.00 0.00 176.35 173.43 2p0j s PRO 162 N -2.92 4.30 0.84 0.98 0.04 -1.26 -0.26 135.00 136.71 2p0j s PRO 162 Ca 0.04 0.98 -0.11 0.00 0.04 0.00 0.00 61.00 61.95 2p0j s PRO 162 Cb -0.01 -2.75 0.09 0.00 0.04 0.00 0.00 34.50 31.87 2p0j s PRO 162 CO -0.02 0.30 1.09 -1.64 0.04 0.00 0.00 177.00 176.78 2p0j s MET 163 N -2.21 1.76 0.40 4.56 -1.94 0.47 -0.57 119.30 121.76 2p0j s MET 163 Ca 0.48 0.87 0.10 0.00 -1.71 0.00 0.00 55.69 55.42 2p0j s MET 163 Cb -0.16 -1.86 0.89 0.00 2.01 0.00 0.00 34.83 35.71 2p0j s MET 163 CO 0.21 -1.91 1.97 -0.22 -0.01 0.00 0.00 175.02 175.06 2p0j h LYS 164 N -1.31 0.56 0.00 2.03 1.63 -1.91 -0.40 116.57 117.17 2p0j h LYS 164 Ca -0.47 -0.03 0.00 0.00 -0.85 0.00 0.00 60.65 59.29 2p0j h LYS 164 Cb 1.26 -0.13 0.00 0.00 -0.60 0.00 0.00 32.23 32.77 2p0j h LYS 164 CO 0.55 0.37 0.00 1.05 -3.45 0.00 0.00 179.45 177.97 2p0j h GLU 165 N 0.57 0.00 0.03 1.90 4.11 -1.93 -1.34 114.58 117.93 2p0j h GLU 165 Ca 0.29 0.00 -0.39 0.00 0.07 0.00 0.00 59.36 59.33 2p0j h GLU 165 Cb 0.38 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 29.58 2p0j h GLU 165 CO -0.09 0.00 -2.34 -0.11 0.07 0.00 0.00 179.01 176.54 2p0j n LEU 166 N -2.73 2.75 0.15 3.06 7.94 -0.23 -4.34 117.00 123.61 2p0j n LEU 166 Ca -0.01 0.01 0.04 0.00 -1.11 0.00 0.00 56.01 54.94 2p0j n LEU 166 Cb 0.12 -0.95 0.48 0.00 0.53 0.00 0.00 43.42 43.60 2p0j n LEU 166 CO 0.18 0.86 0.98 0.77 -1.11 0.00 0.00 177.39 179.07 2p0j h SER 167 N -0.13 0.17 0.56 1.96 4.64 -1.05 -0.22 113.55 119.48 2p0j h SER 167 Ca -0.55 -0.02 0.00 0.00 -0.47 0.00 0.00 61.79 60.75 2p0j h SER 167 Cb 1.88 -0.04 0.00 0.00 -0.31 0.00 0.00 62.40 63.92 2p0j h SER 167 CO -0.09 0.25 0.00 0.07 -0.87 0.00 0.00 176.83 176.19 2p0j h LYS 168 N 0.19 0.00 -0.66 4.77 2.10 -1.45 -1.27 116.57 120.25 2p0j h LYS 168 Ca 0.04 0.00 -0.23 0.00 -2.00 0.00 0.00 60.65 58.46 2p0j h LYS 168 Cb 0.20 0.00 -0.14 0.00 -0.90 0.00 0.00 32.23 31.39 2p0j h LYS 168 CO 0.01 0.00 0.25 0.39 -2.00 0.00 0.00 179.45 178.09 2p0j n GLU 169 N -2.86 3.10 -4.31 0.07 -0.58 -0.10 -4.95 120.64 111.01 2p0j n GLU 169 Ca -0.00 -3.07 -0.16 0.00 -0.42 0.00 0.00 57.16 53.51 2p0j n GLU 169 Cb 0.19 -2.10 -0.10 0.00 -0.57 0.00 0.00 31.44 28.86 2p0j n GLU 169 CO 0.00 0.00 0.00 -1.64 -0.48 0.00 0.00 177.13 175.01 2p0j s MET 170 N -3.07 1.37 0.56 3.49 -1.94 -0.48 -1.17 119.30 118.06 2p0j s MET 170 Ca 0.52 -1.73 -0.20 0.00 -1.71 0.00 0.00 55.69 52.57 2p0j s MET 170 Cb 0.43 -0.26 -0.06 0.00 2.01 0.00 0.00 34.83 36.95 2p0j s MET 170 CO 0.10 -0.27 1.06 -1.13 -0.01 0.00 0.00 175.02 174.77 2p0j n SER 171 N -0.43 1.26 -4.56 3.03 3.41 -1.26 -4.91 113.62 110.16 2p0j n SER 171 Ca -0.01 0.88 -0.36 0.00 -0.26 0.00 0.00 58.87 59.12 2p0j n SER 171 Cb 0.66 -1.42 0.08 0.00 -0.26 0.00 0.00 64.21 63.26 2p0j n SER 171 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 2p0j n SER 172 N -0.60 -0.09 0.00 4.04 2.88 -1.26 -3.67 113.62 114.92 2p0j n SER 172 Ca 0.12 0.65 0.00 0.00 -1.33 0.00 0.00 58.87 58.31 2p0j n SER 172 Cb 0.45 -1.34 0.00 0.00 -0.75 0.00 0.00 64.21 62.58 2p0j n SER 172 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2p0j n GLY 173 N 1.30 0.85 3.68 0.46 0.00 -1.26 -5.01 105.19 105.22 2p0j n GLY 173 Ca 0.12 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.72 2p0j n GLY 173 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2p0j s ILE 174 N -3.39 4.85 0.60 -0.61 1.01 -1.24 -1.61 121.20 120.81 2p0j s ILE 174 Ca 0.00 1.78 -0.18 0.00 0.00 0.00 0.00 60.65 62.25 2p0j s ILE 174 Cb 0.00 -4.20 -0.03 0.00 0.01 0.00 0.00 42.46 38.24 2p0j s ILE 174 CO 0.00 0.03 1.17 -0.94 0.00 0.00 0.00 174.94 175.20 2p0j s SER 175 N 1.11 5.21 0.13 3.58 1.04 -1.12 -4.91 113.70 118.74 2p0j s SER 175 Ca 0.42 2.27 0.06 0.00 0.48 0.00 0.00 55.95 59.18 2p0j s SER 175 Cb -0.17 -2.59 -0.04 0.00 0.10 0.00 0.00 66.02 63.32 2p0j s SER 175 CO 0.15 -1.57 -0.14 -0.72 0.98 0.00 0.00 173.24 171.93 2p0j s TYR 176 N -1.80 1.42 0.18 5.02 -0.85 -1.26 -4.53 117.35 115.53 2p0j s TYR 176 Ca 0.74 -0.56 -0.26 0.00 -0.52 0.00 0.00 57.07 56.48 2p0j s TYR 176 Cb -0.27 -0.74 0.05 0.00 0.38 0.00 0.00 41.96 41.38 2p0j s TYR 176 CO 0.34 0.16 1.56 -0.92 -1.52 0.00 0.00 175.55 175.16 2p0j h TYR 177 N 3.46 -1.41 -0.92 -3.49 3.20 -1.13 -1.00 116.97 115.69 2p0j h TYR 177 Ca -0.40 0.10 0.14 0.00 3.14 0.00 0.00 58.73 61.71 2p0j h TYR 177 Cb 1.20 0.72 -0.07 0.00 1.54 0.00 0.00 36.73 40.12 2p0j h TYR 177 CO 0.65 -0.41 0.59 0.93 -1.64 0.00 0.00 178.16 178.28 2p0j h GLU 178 N -0.14 0.75 -0.10 1.82 3.07 -1.95 0.58 114.58 118.61 2p0j h GLU 178 Ca 0.20 -0.04 -0.24 0.00 -0.50 0.00 0.00 59.36 58.78 2p0j h GLU 178 Cb 0.54 -0.17 0.01 0.00 -0.84 0.00 0.00 28.75 28.29 2p0j h GLU 178 CO -0.81 0.49 -0.87 0.78 -1.40 0.00 0.00 179.01 177.21 2p0j h GLY 179 N 0.77 0.81 1.94 -3.84 0.00 -1.63 -2.81 103.07 98.31 2p0j h GLY 179 Ca 0.46 -1.23 -0.18 0.00 0.00 0.00 0.00 47.33 46.38 2p0j h GLY 179 CO -0.22 1.09 -0.83 0.83 0.00 0.00 0.00 176.54 177.41 2p0j h GLU 180 N 0.47 0.05 -0.35 4.80 4.39 -0.78 -1.99 114.58 121.17 2p0j h GLU 180 Ca -0.08 -0.06 -0.01 0.00 0.34 0.00 0.00 59.36 59.55 2p0j h GLU 180 Cb 1.50 0.02 -0.02 0.00 -0.10 0.00 0.00 28.75 30.15 2p0j h GLU 180 CO 0.17 0.85 0.17 1.25 -1.16 0.00 0.00 179.01 180.29 2p0j h LEU 181 N 0.03 0.46 -0.53 1.33 5.85 -0.97 -1.85 115.31 119.63 2p0j h LEU 181 Ca -0.02 -0.13 0.06 0.00 0.84 0.00 0.00 57.88 58.63 2p0j h LEU 181 Cb 1.46 -0.12 -0.05 0.00 0.37 0.00 0.00 40.66 42.32 2p0j h LEU 181 CO 0.11 0.46 0.24 0.22 -0.34 0.00 0.00 178.44 179.14 2p0j h TYR 182 N 0.43 0.44 -0.40 1.25 3.20 -1.33 -0.55 116.97 120.00 2p0j h TYR 182 Ca 0.12 0.02 -0.00 0.00 3.14 0.00 0.00 58.73 62.01 2p0j h TYR 182 Cb 0.12 -0.12 -0.02 0.00 1.54 0.00 0.00 36.73 38.25 2p0j h TYR 182 CO -0.02 0.19 0.24 -0.91 -1.64 0.00 0.00 178.16 176.02 2p0j h ASN 183 N 0.47 0.48 0.09 -2.11 2.35 -0.90 0.29 115.58 116.24 2p0j h ASN 183 Ca 0.25 -0.02 -0.00 0.00 -0.55 0.00 0.00 56.30 55.97 2p0j h ASN 183 Cb 0.20 -0.12 0.00 0.00 0.05 0.00 0.00 38.32 38.45 2p0j h ASN 183 CO -0.20 0.38 -0.04 0.58 -1.65 0.00 0.00 177.43 176.49 2p0j h VAL 184 N 0.56 1.07 -0.33 2.81 2.07 -0.49 -3.28 116.25 118.65 2p0j h VAL 184 Ca 0.15 -1.40 0.02 0.00 0.82 0.00 0.00 66.70 66.28 2p0j h VAL 184 Cb -0.01 1.86 -0.02 0.00 -1.52 0.00 0.00 31.29 31.60 2p0j h VAL 184 CO -0.03 0.30 0.22 0.40 0.02 0.00 0.00 177.57 178.49 2p0j h ILE 185 N -0.85 1.04 0.00 4.57 2.04 -1.02 -0.73 117.51 122.55 2p0j h ILE 185 Ca -0.01 -0.13 -0.01 0.00 1.00 0.00 0.00 64.86 65.71 2p0j h ILE 185 Cb 0.59 0.63 -0.00 0.00 -0.74 0.00 0.00 36.82 37.30 2p0j h ILE 185 CO 0.02 0.07 -0.03 -0.09 0.00 0.00 0.00 178.15 178.11 2p0j h ARG 186 N 0.37 0.00 -0.20 2.37 2.43 -1.01 -1.62 114.38 116.72 2p0j h ARG 186 Ca 0.13 0.00 -0.08 0.00 -0.81 0.00 0.00 59.98 59.22 2p0j h ARG 186 Cb 0.06 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.60 2p0j h ARG 186 CO -0.03 0.03 -0.23 1.96 -1.51 0.00 0.00 179.97 180.19 2p0j h GLN 187 N 0.00 0.36 0.00 0.20 1.08 -1.19 -3.49 115.11 112.08 2p0j h GLN 187 Ca -0.00 -0.12 0.00 0.00 -1.45 0.00 0.00 58.65 57.08 2p0j h GLN 187 Cb 0.15 -0.03 0.00 0.00 -0.05 0.00 0.00 27.48 27.55 2p0j h GLN 187 CO 0.00 0.58 0.00 0.41 -0.95 0.00 0.00 178.83 178.88 2p0j n GLY 188 N -0.50 2.53 3.73 3.46 0.00 -0.61 -4.91 105.19 108.88 2p0j n GLY 188 Ca -0.01 -2.02 -0.42 0.00 0.00 0.00 0.00 46.02 43.57 2p0j n GLY 188 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2p0j n ARG 189 N 0.04 2.37 -1.03 1.61 5.12 -1.26 -3.10 116.66 120.42 2p0j n ARG 189 Ca 0.00 0.83 -0.01 0.00 -1.93 0.00 0.00 57.85 56.74 2p0j n ARG 189 Cb 0.00 -2.49 -0.00 0.00 -1.16 0.00 0.00 32.46 28.80 2p0j n ARG 189 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2p0j n GLY 190 N 0.87 0.49 2.94 -0.13 0.00 -1.26 -5.04 105.19 103.06 2p0j n GLY 190 Ca 0.04 -0.38 -0.20 0.00 0.00 0.00 0.00 46.02 45.48 2p0j n GLY 190 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2p0j s VAL 191 N -1.96 0.66 0.95 1.61 1.01 -1.18 -3.93 120.40 117.56 2p0j s VAL 191 Ca 0.00 -0.22 -0.12 0.00 0.00 0.00 0.00 61.98 61.64 2p0j s VAL 191 Cb 0.00 -0.65 0.16 0.00 0.00 0.00 0.00 36.38 35.89 2p0j s VAL 191 CO 0.00 0.24 1.10 -2.16 0.00 0.00 0.00 175.10 174.28 2p0j s PRO 192 N 0.69 0.84 0.34 2.72 0.04 -1.26 -4.70 135.00 133.66 2p0j s PRO 192 Ca -0.10 0.58 0.26 0.00 0.04 0.00 0.00 61.00 61.78 2p0j s PRO 192 Cb -0.13 -1.78 1.14 0.00 0.04 0.00 0.00 34.50 33.77 2p0j s PRO 192 CO 0.01 -2.47 1.78 0.00 0.04 0.00 0.00 177.00 176.36 2p0j h ALA 193 N -1.71 1.00 -2.76 8.56 0.00 -1.96 -3.44 119.26 118.96 2p0j h ALA 193 Ca -0.52 0.00 -0.57 0.00 0.00 0.00 0.00 54.91 53.82 2p0j h ALA 193 Cb 1.31 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 19.05 2p0j h ALA 193 CO 0.57 0.00 0.00 0.54 0.00 0.00 0.00 179.25 180.37 2p0j s VAL 194 N -3.45 5.01 0.36 0.00 0.11 -1.26 -5.03 120.40 116.15 2p0j s VAL 194 Ca 0.02 1.27 -0.28 0.00 -2.93 0.00 0.00 61.98 60.06 2p0j s VAL 194 Cb 0.09 -3.95 -0.11 0.00 -1.53 0.00 0.00 36.38 30.88 2p0j s VAL 194 CO 0.39 0.34 1.41 -2.84 -3.33 0.00 0.00 175.10 171.07 2p0j s PRO 195 N 0.35 4.19 0.05 1.54 0.02 -1.26 -4.88 135.00 135.01 2p0j s PRO 195 Ca 0.33 2.42 -0.01 0.00 0.02 0.00 0.00 61.00 63.76 2p0j s PRO 195 Cb -0.17 -3.00 -0.04 0.00 0.02 0.00 0.00 34.50 31.31 2p0j s PRO 195 CO 0.16 -0.40 -0.02 -0.51 -0.33 0.00 0.00 177.00 175.90 2p0j s LEU 196 N -2.00 2.41 -0.20 -5.54 1.43 -0.28 -1.01 118.68 113.49 2p0j s LEU 196 Ca 0.51 -0.91 -0.00 0.00 -1.03 0.00 0.00 54.13 52.70 2p0j s LEU 196 Cb -0.44 0.22 0.05 0.00 0.03 0.00 0.00 46.19 46.06 2p0j s LEU 196 CO 0.59 -0.56 -0.05 -0.69 0.23 0.00 0.00 176.35 175.87 2p0j s VAL 197 N -3.56 1.28 -0.17 -1.59 1.01 -0.11 0.80 120.40 118.07 2p0j s VAL 197 Ca 0.04 -0.92 -0.13 0.00 0.00 0.00 0.00 61.98 60.96 2p0j s VAL 197 Cb 0.05 -1.53 -0.05 0.00 0.00 0.00 0.00 36.38 34.86 2p0j s VAL 197 CO -0.09 -0.01 0.28 -0.76 0.00 0.00 0.00 175.10 174.52 2p0j s LEU 198 N 1.53 4.24 -0.13 3.92 1.43 -0.27 -1.14 118.68 128.26 2p0j s LEU 198 Ca -0.03 0.47 0.01 0.00 -1.03 0.00 0.00 54.13 53.55 2p0j s LEU 198 Cb -0.17 -2.34 0.02 0.00 0.03 0.00 0.00 46.19 43.72 2p0j s LEU 198 CO -0.07 0.10 -0.14 -0.63 0.23 0.00 0.00 176.35 175.84 2p0j s ILE 199 N 0.48 1.50 -0.19 -0.59 1.01 0.33 -1.02 121.20 122.72 2p0j s ILE 199 Ca 0.15 -0.61 -0.09 0.00 0.00 0.00 0.00 60.65 60.10 2p0j s ILE 199 Cb -0.13 -1.40 -0.05 0.00 0.01 0.00 0.00 42.46 40.89 2p0j s ILE 199 CO 0.03 0.45 0.11 -0.83 0.00 0.00 0.00 174.94 174.70 2p0j s GLY 200 N 1.30 2.00 0.31 6.18 0.00 -0.23 -0.30 107.32 116.59 2p0j s GLY 200 Ca 0.00 -0.70 0.08 0.00 0.00 0.00 0.00 44.72 44.10 2p0j s GLY 200 CO -0.07 0.11 -0.07 -0.26 0.00 0.00 0.00 173.10 172.82 2p0j s ILE 201 N 0.35 1.89 0.13 0.90 -4.36 0.64 -0.73 121.20 120.01 2p0j s ILE 201 Ca 0.07 -2.15 -0.09 0.00 -0.26 0.00 0.00 60.65 58.22 2p0j s ILE 201 Cb -0.11 -2.57 -0.00 0.00 1.25 0.00 0.00 42.46 41.03 2p0j s ILE 201 CO -0.01 -0.23 0.25 0.00 0.24 0.00 0.00 174.94 175.18 2p0j s ALA 202 N -2.85 -0.17 -2.00 2.27 0.00 -0.61 -0.40 121.76 118.00 2p0j s ALA 202 Ca 0.31 -0.70 0.04 0.00 0.00 0.00 0.00 51.96 51.62 2p0j s ALA 202 Cb 0.04 0.67 0.26 0.00 0.00 0.00 0.00 23.12 24.08 2p0j s ALA 202 CO 0.14 -0.58 0.73 -2.30 0.00 0.00 0.00 175.76 173.75