#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x51 s SER 2 N 0.00 0.02 -0.03 1.61 0.01 -1.26 -5.16 113.70 108.89 1x51 s SER 2 Ca 0.00 0.04 -0.09 0.00 1.31 0.00 0.00 55.95 57.22 1x51 s SER 2 Cb 0.00 -0.01 0.01 0.00 0.21 0.00 0.00 66.02 66.24 1x51 s SER 2 CO 0.00 -0.06 0.19 -0.44 0.41 0.00 0.00 173.24 173.34 1x51 s SER 3 N 0.47 -0.10 0.00 2.44 0.01 -1.26 -5.14 113.70 110.13 1x51 s SER 3 Ca -0.04 0.07 0.00 0.00 1.31 0.00 0.00 55.95 57.30 1x51 s SER 3 Cb -0.06 0.31 0.00 0.00 0.21 0.00 0.00 66.02 66.48 1x51 s SER 3 CO -0.01 -0.27 0.00 0.61 0.41 0.00 0.00 173.24 173.97 1x51 n GLY 4 N 1.98 1.44 3.60 3.44 0.00 -1.26 -5.17 105.19 109.22 1x51 n GLY 4 Ca -0.19 0.08 -0.24 0.00 0.00 0.00 0.00 46.02 45.67 1x51 n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1x51 s SER 5 N 2.00 4.10 -0.25 1.61 1.04 -1.26 -5.02 113.70 115.92 1x51 s SER 5 Ca 0.00 -0.95 -0.02 0.00 0.48 0.00 0.00 55.95 55.46 1x51 s SER 5 Cb 0.00 -0.53 0.12 0.00 0.10 0.00 0.00 66.02 65.70 1x51 s SER 5 CO 0.00 -0.14 2.24 -1.20 0.98 0.00 0.00 173.24 175.12 1x51 n SER 6 N -0.87 6.17 -3.99 7.02 7.64 -1.26 -4.73 113.62 123.60 1x51 n SER 6 Ca -0.05 -2.92 -0.32 0.00 1.01 0.00 0.00 58.87 56.60 1x51 n SER 6 Cb 0.61 -1.12 -0.12 0.00 -1.01 0.00 0.00 64.21 62.57 1x51 n SER 6 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 1x51 s GLY 7 N 0.69 2.61 0.00 0.23 0.00 -1.26 -4.91 107.32 104.68 1x51 s GLY 7 Ca 0.32 -3.43 0.15 0.00 0.00 0.00 0.00 44.72 41.75 1x51 s GLY 7 CO -0.04 1.06 1.29 -1.55 0.00 0.00 0.00 173.10 173.87 1x51 n PRO 8 N 2.91 0.48 -0.06 2.90 -0.04 -1.26 -3.09 135.00 136.85 1x51 n PRO 8 Ca 0.10 0.00 -0.14 0.00 -0.04 0.00 0.00 63.50 63.42 1x51 n PRO 8 Cb 0.34 -1.47 -0.12 0.00 -0.04 0.00 0.00 33.50 32.21 1x51 n PRO 8 CO 0.00 0.00 0.00 -0.09 -0.04 0.00 0.00 175.50 175.37 1x51 h ARG 9 N 0.00 0.01 0.00 0.54 9.65 -1.91 -3.29 114.38 119.39 1x51 h ARG 9 Ca 0.00 -0.02 0.00 0.00 -1.10 0.00 0.00 59.98 58.86 1x51 h ARG 9 Cb 0.00 0.01 0.00 0.00 -1.39 0.00 0.00 29.97 28.59 1x51 h ARG 9 CO 0.00 0.91 0.00 1.57 2.80 0.00 0.00 179.97 185.25 1x51 h LYS 10 N -0.87 0.00 -6.25 0.20 2.10 -1.89 -3.43 116.57 106.42 1x51 h LYS 10 Ca -0.00 0.00 -0.56 0.00 -2.00 0.00 0.00 60.65 58.09 1x51 h LYS 10 Cb 0.92 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 32.23 1x51 h LYS 10 CO 0.00 0.00 1.09 0.00 -2.00 0.00 0.00 179.45 178.54 1x51 s ALA 11 N -3.48 3.44 -0.23 0.07 0.00 -1.23 -4.87 121.76 115.47 1x51 s ALA 11 Ca 0.03 0.65 0.09 0.00 0.00 0.00 0.00 51.96 52.73 1x51 s ALA 11 Cb 0.08 -3.79 -0.20 0.00 0.00 0.00 0.00 23.12 19.21 1x51 s ALA 11 CO 0.57 -1.66 -0.09 0.43 0.00 0.00 0.00 175.76 175.01 1x51 n SER 12 N 7.76 1.18 -0.60 0.00 7.64 -1.26 -4.38 113.62 123.95 1x51 n SER 12 Ca 0.18 -0.08 0.48 0.00 1.01 0.00 0.00 58.87 60.46 1x51 n SER 12 Cb 0.44 0.22 0.77 0.00 -1.01 0.00 0.00 64.21 64.63 1x51 n SER 12 CO 0.00 0.00 0.00 0.08 -3.01 0.00 0.00 175.04 172.11 1x51 h ARG 13 N 0.00 0.01 -4.07 1.43 -0.00 -1.99 -3.38 114.38 106.38 1x51 h ARG 13 Ca -0.55 -0.00 -0.23 0.00 -0.00 0.00 0.00 59.98 59.20 1x51 h ARG 13 Cb 2.03 -0.00 -0.24 0.00 -0.00 0.00 0.00 29.97 31.76 1x51 h ARG 13 CO -0.04 0.01 -0.72 0.15 -0.00 0.00 0.00 179.97 179.37 1x51 s LYS 14 N -5.01 0.29 0.46 0.08 -0.14 -1.26 -5.15 119.74 109.00 1x51 s LYS 14 Ca -0.06 -0.43 -0.23 0.00 -1.36 0.00 0.00 55.97 53.89 1x51 s LYS 14 Cb 0.28 -0.07 -0.07 0.00 -1.68 0.00 0.00 37.83 36.29 1x51 s LYS 14 CO 0.87 0.00 1.17 -1.25 -0.76 0.00 0.00 175.35 175.38 1x51 s PRO 15 N -0.93 3.77 0.31 -1.68 0.04 -1.26 -4.87 135.00 130.38 1x51 s PRO 15 Ca -0.08 1.78 0.10 0.00 0.04 0.00 0.00 61.00 62.84 1x51 s PRO 15 Cb -0.06 -2.42 0.50 0.00 0.04 0.00 0.00 34.50 32.56 1x51 s PRO 15 CO -0.00 -0.54 1.71 -1.00 0.04 0.00 0.00 177.00 177.20 1x51 h PRO 16 N 2.08 0.07 -0.44 0.56 0.13 -1.86 -3.32 132.00 129.23 1x51 h PRO 16 Ca -0.49 -0.04 0.04 0.00 -0.87 0.00 0.00 66.00 64.64 1x51 h PRO 16 Cb 1.25 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.33 1x51 h PRO 16 CO 0.60 0.54 -0.26 0.54 -0.23 0.00 0.00 178.00 179.20 1x51 n ARG 17 N -3.97 -0.19 -2.77 0.86 1.74 -1.26 -3.48 116.66 107.58 1x51 n ARG 17 Ca -0.02 1.16 -0.42 0.00 -0.77 0.00 0.00 57.85 57.80 1x51 n ARG 17 Cb 0.51 -1.72 -0.04 0.00 -1.02 0.00 0.00 32.46 30.19 1x51 n ARG 17 CO 0.00 0.00 0.00 -1.83 -1.52 0.00 0.00 177.63 174.28 1x51 s GLU 18 N -4.15 3.14 -0.16 5.56 -1.05 -1.25 -1.98 118.70 118.82 1x51 s GLU 18 Ca -0.05 -0.64 -0.04 0.00 -0.15 0.00 0.00 54.97 54.08 1x51 s GLU 18 Cb 0.05 -4.21 0.07 0.00 -0.44 0.00 0.00 34.13 29.60 1x51 s GLU 18 CO 0.27 -1.89 0.17 -1.21 0.95 0.00 0.00 175.26 173.56 1x51 s GLU 19 N 4.50 0.11 0.05 -4.83 0.41 -1.21 -4.90 118.70 112.83 1x51 s GLU 19 Ca 0.26 0.27 0.09 0.00 -0.41 0.00 0.00 54.97 55.17 1x51 s GLU 19 Cb -0.14 -1.02 -0.03 0.00 -1.78 0.00 0.00 34.13 31.16 1x51 s GLU 19 CO 0.12 -0.54 -0.24 -1.12 -0.49 0.00 0.00 175.26 172.99 1x51 s SER 20 N 2.28 2.89 0.08 -0.19 0.01 -1.26 -2.34 113.70 115.16 1x51 s SER 20 Ca 0.05 -0.57 -0.11 0.00 1.31 0.00 0.00 55.95 56.62 1x51 s SER 20 Cb -0.15 -0.25 0.01 0.00 0.21 0.00 0.00 66.02 65.85 1x51 s SER 20 CO -0.09 0.22 0.26 -0.44 0.41 0.00 0.00 173.24 173.59 1x51 s SER 21 N -1.25 -0.02 -0.28 2.44 0.01 -0.49 -3.11 113.70 111.01 1x51 s SER 21 Ca 0.10 -0.44 -0.03 0.00 1.31 0.00 0.00 55.95 56.89 1x51 s SER 21 Cb -0.10 0.36 0.03 0.00 0.21 0.00 0.00 66.02 66.53 1x51 s SER 21 CO 0.02 -0.71 -0.00 0.00 0.41 0.00 0.00 173.24 172.96 1x51 s ALA 22 N -3.40 2.83 0.03 1.44 0.00 0.15 -2.22 121.76 120.59 1x51 s ALA 22 Ca 0.01 -1.58 0.03 0.00 0.00 0.00 0.00 51.96 50.42 1x51 s ALA 22 Cb 0.02 -1.91 -0.04 0.00 0.00 0.00 0.00 23.12 21.20 1x51 s ALA 22 CO -0.09 -1.02 -0.02 -0.08 0.00 0.00 0.00 175.76 174.55 1x51 s THR 23 N 1.34 3.97 0.12 0.00 -1.32 -0.98 -0.31 115.64 118.47 1x51 s THR 23 Ca -0.01 -0.78 0.04 0.00 -1.21 0.00 0.00 61.69 59.74 1x51 s THR 23 Cb -0.18 -2.80 -0.04 0.00 -1.51 0.00 0.00 72.50 67.97 1x51 s THR 23 CO -0.01 0.30 -0.11 0.00 -2.21 0.00 0.00 174.62 172.59 1x51 s VAL 25 N -2.69 4.07 -0.45 0.00 1.01 0.12 -4.40 120.40 118.05 1x51 s VAL 25 Ca 0.10 -1.87 -0.24 0.00 0.00 0.00 0.00 61.98 59.96 1x51 s VAL 25 Cb -0.01 -3.69 0.03 0.00 0.00 0.00 0.00 36.38 32.70 1x51 s VAL 25 CO 0.01 -0.77 0.87 -0.22 0.00 0.00 0.00 175.10 174.98 1x51 s LEU 26 N 1.28 4.10 0.13 3.92 2.96 -1.25 -1.97 118.68 127.86 1x51 s LEU 26 Ca 0.07 0.05 0.10 0.00 -0.22 0.00 0.00 54.13 54.12 1x51 s LEU 26 Cb -0.25 -3.10 -0.04 0.00 0.50 0.00 0.00 46.19 43.29 1x51 s LEU 26 CO -0.01 -0.99 -0.23 -0.70 -1.32 0.00 0.00 176.35 173.10 1x51 s GLU 27 N 3.56 1.30 -0.01 1.98 2.12 -0.65 -1.56 118.70 125.44 1x51 s GLU 27 Ca 0.34 -1.32 -0.00 0.00 0.36 0.00 0.00 54.97 54.35 1x51 s GLU 27 Cb -0.11 -1.63 0.01 0.00 0.26 0.00 0.00 34.13 32.66 1x51 s GLU 27 CO 0.25 0.37 0.02 -1.14 -0.54 0.00 0.00 175.26 174.21 1x51 s GLN 28 N -2.20 0.00 0.02 4.30 0.74 -0.08 -1.78 119.66 120.65 1x51 s GLN 28 Ca 0.12 0.05 -0.30 0.00 0.05 0.00 0.00 55.36 55.28 1x51 s GLN 28 Cb -0.09 -0.04 -0.06 0.00 1.10 0.00 0.00 33.01 33.92 1x51 s GLN 28 CO 0.06 -0.03 1.44 -1.25 -0.55 0.00 0.00 175.29 174.96 1x51 s PRO 29 N 0.20 4.27 0.00 1.67 0.04 -1.26 -1.21 135.00 138.71 1x51 s PRO 29 Ca -0.02 2.02 0.00 0.00 0.04 0.00 0.00 61.00 63.05 1x51 s PRO 29 Cb -0.02 -3.56 0.00 0.00 0.04 0.00 0.00 34.50 30.96 1x51 s PRO 29 CO -0.01 -0.59 0.00 0.41 0.04 0.00 0.00 177.00 176.85 1x51 n GLY 30 N 3.69 0.60 0.95 0.56 0.00 -1.20 -4.95 105.19 104.83 1x51 n GLY 30 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.15 1x51 n GLY 30 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1x51 n ALA 31 N -3.00 2.68 -0.36 4.61 0.00 -1.26 -4.87 120.51 118.31 1x51 n ALA 31 Ca 0.00 0.00 0.03 0.00 0.00 0.00 0.00 53.44 53.47 1x51 n ALA 31 Cb 0.00 0.00 0.19 0.00 0.00 0.00 0.00 19.45 19.64 1x51 n ALA 31 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 1x51 h LEU 32 N 0.00 1.01 0.00 0.00 3.38 -2.01 -3.46 115.31 114.23 1x51 h LEU 32 Ca 0.00 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.98 1x51 h LEU 32 Cb 0.00 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 40.54 1x51 h LEU 32 CO 0.00 0.64 0.00 0.61 0.09 0.00 0.00 178.44 179.78 1x51 n GLY 33 N -1.37 -2.04 3.66 0.83 0.00 -1.26 -5.18 105.19 99.83 1x51 n GLY 33 Ca 0.15 0.65 -0.05 0.00 0.00 0.00 0.00 46.02 46.77 1x51 n GLY 33 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1x51 s ALA 34 N -1.00 -1.72 -0.01 4.61 0.00 -1.26 -3.27 121.76 119.10 1x51 s ALA 34 Ca 0.00 0.45 0.01 0.00 0.00 0.00 0.00 51.96 52.42 1x51 s ALA 34 Cb 0.00 0.56 0.00 0.00 0.00 0.00 0.00 23.12 23.68 1x51 s ALA 34 CO 0.00 -0.92 -0.04 -0.65 0.00 0.00 0.00 175.76 174.15 1x51 s GLN 35 N -3.22 0.42 0.47 0.00 -0.21 -0.35 -4.30 119.66 112.47 1x51 s GLN 35 Ca 0.10 -0.14 0.08 0.00 0.02 0.00 0.00 55.36 55.41 1x51 s GLN 35 Cb -0.01 -0.43 0.02 0.00 1.00 0.00 0.00 33.01 33.59 1x51 s GLN 35 CO -0.02 0.06 0.52 0.96 -2.12 0.00 0.00 175.29 174.69 1x51 s ILE 36 N 0.10 2.53 -0.08 1.08 -4.36 0.77 -0.91 121.20 120.34 1x51 s ILE 36 Ca -0.01 -1.19 -0.01 0.00 -0.26 0.00 0.00 60.65 59.18 1x51 s ILE 36 Cb -0.04 -2.72 -0.03 0.00 1.25 0.00 0.00 42.46 40.92 1x51 s ILE 36 CO -0.00 0.00 -0.03 -0.22 0.24 0.00 0.00 174.94 174.93 1x51 s LEU 37 N -4.32 3.42 -0.04 0.37 2.96 -0.60 -2.12 118.68 118.34 1x51 s LEU 37 Ca 0.51 0.08 -0.00 0.00 -0.22 0.00 0.00 54.13 54.49 1x51 s LEU 37 Cb -0.06 -1.77 0.03 0.00 0.50 0.00 0.00 46.19 44.89 1x51 s LEU 37 CO 0.31 0.37 0.01 -0.22 -1.32 0.00 0.00 176.35 175.50 1x51 s LEU 38 N -0.88 0.85 -0.13 -0.68 2.96 0.65 -4.65 118.68 116.81 1x51 s LEU 38 Ca 0.13 -0.03 -0.01 0.00 -0.22 0.00 0.00 54.13 54.00 1x51 s LEU 38 Cb -0.11 -0.28 -0.02 0.00 0.50 0.00 0.00 46.19 46.28 1x51 s LEU 38 CO 0.02 -0.15 -0.08 0.68 -1.32 0.00 0.00 176.35 175.50 1x51 s VAL 39 N 1.45 3.51 0.75 1.68 -7.23 -0.93 -0.14 120.40 119.50 1x51 s VAL 39 Ca -0.04 -0.51 -0.11 0.00 -1.81 0.00 0.00 61.98 59.52 1x51 s VAL 39 Cb -0.13 -2.49 0.04 0.00 0.56 0.00 0.00 36.38 34.36 1x51 s VAL 39 CO -0.03 0.52 1.08 -1.58 -0.31 0.00 0.00 175.10 174.79 1x51 s GLN 40 N 0.15 2.43 0.12 4.82 0.74 -1.13 -2.24 119.66 124.55 1x51 s GLN 40 Ca -0.04 1.11 0.04 0.00 0.05 0.00 0.00 55.36 56.51 1x51 s GLN 40 Cb -0.14 -1.92 -0.04 0.00 1.10 0.00 0.00 33.01 32.01 1x51 s GLN 40 CO 0.04 -1.50 0.14 1.03 -0.55 0.00 0.00 175.29 174.45 1x51 s ARG 41 N -4.94 3.02 0.77 1.67 1.81 0.00 -4.90 118.95 116.37 1x51 s ARG 41 Ca 0.60 -0.73 -0.11 0.00 -1.72 0.00 0.00 55.73 53.77 1x51 s ARG 41 Cb -0.16 -2.75 0.05 0.00 -0.45 0.00 0.00 34.95 31.64 1x51 s ARG 41 CO 0.56 0.53 1.09 -1.25 -0.68 0.00 0.00 175.30 175.55 1x51 s PRO 42 N -2.83 2.29 -0.94 3.54 0.04 -1.26 -3.63 135.00 132.20 1x51 s PRO 42 Ca 0.31 1.18 -0.24 0.00 0.04 0.00 0.00 61.00 62.30 1x51 s PRO 42 Cb -0.11 -1.90 0.02 0.00 0.04 0.00 0.00 34.50 32.55 1x51 s PRO 42 CO 0.24 -1.62 1.55 -0.80 0.04 0.00 0.00 177.00 176.41 1x51 s ASN 43 N -3.34 6.12 -0.53 6.66 -0.87 -1.26 -3.85 114.94 117.88 1x51 s ASN 43 Ca 0.62 -1.08 0.04 0.00 -1.57 0.00 0.00 52.86 50.86 1x51 s ASN 43 Cb -0.17 -2.56 0.16 0.00 -0.02 0.00 0.00 41.25 38.65 1x51 s ASN 43 CO 0.55 -1.84 0.36 -0.55 -2.57 0.00 0.00 177.10 173.05 1x51 s SER 44 N 5.58 3.34 0.86 -1.22 0.15 -1.26 -5.02 113.70 116.13 1x51 s SER 44 Ca 0.50 -3.21 0.00 0.00 0.70 0.00 0.00 55.95 53.94 1x51 s SER 44 Cb -0.03 -1.05 0.00 0.00 -1.71 0.00 0.00 66.02 63.23 1x51 s SER 44 CO -0.04 -0.17 0.00 0.61 1.20 0.00 0.00 173.24 174.85 1x51 n GLY 45 N 2.75 1.51 2.94 9.45 0.00 -1.26 -4.67 105.19 115.91 1x51 n GLY 45 Ca 0.20 -0.53 -0.35 0.00 0.00 0.00 0.00 46.02 45.33 1x51 n GLY 45 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1x51 n LEU 46 N 0.00 -5.66 -4.27 0.99 4.77 -1.26 -2.10 117.00 109.47 1x51 n LEU 46 Ca 0.00 0.22 -0.33 0.00 -0.03 0.00 0.00 56.01 55.87 1x51 n LEU 46 Cb 0.00 -0.75 -0.07 0.00 -2.33 0.00 0.00 43.42 40.27 1x51 n LEU 46 CO 0.00 -5.77 -0.30 0.18 -1.33 0.00 0.00 177.39 170.17 1x51 n LEU 47 N 3.31 -1.33 -4.59 2.23 4.32 -1.26 -4.87 117.00 114.80 1x51 n LEU 47 Ca -0.01 -1.17 -0.42 0.00 -0.02 0.00 0.00 56.01 54.39 1x51 n LEU 47 Cb 0.54 -1.81 -0.06 0.00 -1.62 0.00 0.00 43.42 40.47 1x51 n LEU 47 CO 0.52 0.36 0.48 0.00 -1.22 0.00 0.00 177.39 177.53 1x51 s ALA 48 N -3.91 3.49 0.00 -1.18 0.00 -0.89 -4.19 121.76 115.07 1x51 s ALA 48 Ca 0.27 -0.65 0.00 0.00 0.00 0.00 0.00 51.96 51.58 1x51 s ALA 48 Cb -0.15 -3.23 0.00 0.00 0.00 0.00 0.00 23.12 19.74 1x51 s ALA 48 CO 0.97 -1.27 0.00 0.41 0.00 0.00 0.00 175.76 175.88 1x51 n GLY 49 N 4.46 0.57 3.40 0.00 0.00 -1.24 -4.93 105.19 107.45 1x51 n GLY 49 Ca 0.01 -0.33 -0.32 0.00 0.00 0.00 0.00 46.02 45.38 1x51 n GLY 49 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1x51 s LEU 50 N -1.28 2.43 -0.03 0.99 2.01 -1.26 -4.86 118.68 116.68 1x51 s LEU 50 Ca 0.00 -0.32 -0.21 0.00 0.01 0.00 0.00 54.13 53.61 1x51 s LEU 50 Cb 0.00 -1.46 -0.05 0.00 0.01 0.00 0.00 46.19 44.69 1x51 s LEU 50 CO 0.00 0.33 0.60 0.26 1.01 0.00 0.00 176.35 178.55 1x51 s TRP 51 N -0.69 3.64 0.10 0.29 0.52 -0.50 -0.82 118.94 121.49 1x51 s TRP 51 Ca 0.11 1.16 -0.25 0.00 0.02 0.00 0.00 56.10 57.14 1x51 s TRP 51 Cb -0.10 -2.64 0.07 0.00 -1.15 0.00 0.00 33.47 29.65 1x51 s TRP 51 CO -0.00 0.27 0.65 -1.83 0.02 0.00 0.00 176.95 176.06 1x51 s GLU 52 N 0.13 1.19 0.52 4.98 -1.05 -0.95 -3.90 118.70 119.62 1x51 s GLU 52 Ca 0.32 -0.29 -0.22 0.00 -0.15 0.00 0.00 54.97 54.63 1x51 s GLU 52 Cb -0.18 0.55 -0.07 0.00 -0.44 0.00 0.00 34.13 34.00 1x51 s GLU 52 CO 0.16 -0.49 1.14 1.19 0.95 0.00 0.00 175.26 178.21 1x51 n PHE 53 N -0.08 1.54 -2.26 4.83 3.72 -1.26 -2.19 117.46 121.76 1x51 n PHE 53 Ca -0.17 0.47 -0.38 0.00 -0.05 0.00 0.00 57.45 57.32 1x51 n PHE 53 Cb 0.63 -2.26 -0.02 0.00 -0.94 0.00 0.00 39.48 36.89 1x51 n PHE 53 CO 0.00 0.00 0.00 -1.25 -0.05 0.00 0.00 176.76 175.46 1x51 s PRO 54 N -2.56 4.03 0.09 -1.08 0.04 -1.26 -4.84 135.00 129.42 1x51 s PRO 54 Ca 0.70 1.88 -0.07 0.00 0.04 0.00 0.00 61.00 63.54 1x51 s PRO 54 Cb -0.46 -2.67 -0.01 0.00 0.04 0.00 0.00 34.50 31.40 1x51 s PRO 54 CO 0.51 -0.35 0.16 -1.54 0.04 0.00 0.00 177.00 175.82 1x51 s SER 55 N -1.09 0.18 0.44 6.66 1.04 -1.26 -2.64 113.70 117.03 1x51 s SER 55 Ca 0.57 -0.75 0.03 0.00 0.48 0.00 0.00 55.95 56.28 1x51 s SER 55 Cb -0.32 0.33 -0.03 0.00 0.10 0.00 0.00 66.02 66.10 1x51 s SER 55 CO 0.40 -0.73 0.05 0.68 0.98 0.00 0.00 173.24 174.62 1x51 s VAL 56 N -3.89 1.10 0.29 5.02 -7.23 0.58 -4.89 120.40 111.38 1x51 s VAL 56 Ca 0.07 -2.00 -0.30 0.00 -1.81 0.00 0.00 61.98 57.94 1x51 s VAL 56 Cb 0.05 -2.42 -0.12 0.00 0.56 0.00 0.00 36.38 34.45 1x51 s VAL 56 CO -0.09 0.00 1.56 0.35 -0.31 0.00 0.00 175.10 176.61 1x51 n THR 57 N -1.03 1.10 -0.58 5.32 -2.24 -1.26 -0.68 114.28 114.91 1x51 n THR 57 Ca -0.11 -0.28 -0.29 0.00 -2.27 0.00 0.00 64.05 61.11 1x51 n THR 57 Cb 0.66 -1.89 0.22 0.00 -2.10 0.00 0.00 70.33 67.23 1x51 n THR 57 CO 0.00 0.00 0.00 0.86 -0.57 0.00 0.00 175.07 175.36 1x51 s TRP 58 N -0.11 1.42 -0.12 4.78 -0.00 -1.18 -4.55 118.94 119.19 1x51 s TRP 58 Ca 0.64 1.43 -0.11 0.00 -0.00 0.00 0.00 56.10 58.06 1x51 s TRP 58 Cb -0.52 -3.19 0.03 0.00 -0.00 0.00 0.00 33.47 29.79 1x51 s TRP 58 CO 0.50 -3.50 0.31 -1.21 -0.00 0.00 0.00 176.95 173.05 1x51 s GLU 59 N -4.52 0.36 0.42 5.86 0.41 -1.26 -4.97 118.70 115.00 1x51 s GLU 59 Ca 0.68 0.44 0.29 0.00 -0.41 0.00 0.00 54.97 55.97 1x51 s GLU 59 Cb -0.24 0.17 1.22 0.00 -1.78 0.00 0.00 34.13 33.49 1x51 s GLU 59 CO 0.62 -0.05 1.87 -1.00 -0.49 0.00 0.00 175.26 176.21 1x51 h PRO 60 N 5.70 0.00 -6.15 0.39 0.13 -1.97 -3.44 132.00 126.65 1x51 h PRO 60 Ca -0.27 0.00 -0.55 0.00 -0.87 0.00 0.00 66.00 64.31 1x51 h PRO 60 Cb 1.19 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.26 1x51 h PRO 60 CO 0.31 0.00 -0.53 0.45 -0.23 0.00 0.00 178.00 178.00 1x51 s SER 61 N -4.99 5.77 0.34 1.44 0.15 -1.26 -5.02 113.70 110.14 1x51 s SER 61 Ca 0.02 -0.05 0.18 0.00 0.70 0.00 0.00 55.95 56.81 1x51 s SER 61 Cb 0.09 -1.58 0.27 0.00 -1.71 0.00 0.00 66.02 63.09 1x51 s SER 61 CO 0.47 0.05 1.54 -0.08 1.20 0.00 0.00 173.24 176.42 1x51 h GLU 62 N 2.22 0.00 0.02 5.44 4.81 -2.01 -3.06 114.58 122.01 1x51 h GLU 62 Ca -0.48 0.00 -0.19 0.00 -0.13 0.00 0.00 59.36 58.56 1x51 h GLU 62 Cb 1.20 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 30.56 1x51 h GLU 62 CO 0.64 0.35 -0.99 0.37 -0.73 0.00 0.00 179.01 178.65 1x51 h GLN 63 N 0.00 0.05 -0.66 1.92 4.15 -1.96 -3.32 115.11 115.29 1x51 h GLN 63 Ca -0.00 -0.09 0.11 0.00 0.77 0.00 0.00 58.65 59.43 1x51 h GLN 63 Cb 1.20 0.03 -0.04 0.00 0.21 0.00 0.00 27.48 28.88 1x51 h GLN 63 CO 0.05 1.04 0.44 -0.07 -1.93 0.00 0.00 178.83 178.36 1x51 h LEU 64 N -0.84 0.42 0.44 -2.39 4.07 -1.96 -0.51 115.31 114.53 1x51 h LEU 64 Ca -0.26 0.01 -0.02 0.00 0.08 0.00 0.00 57.88 57.69 1x51 h LEU 64 Cb 1.33 -0.07 0.00 0.00 1.08 0.00 0.00 40.66 43.00 1x51 h LEU 64 CO -0.10 0.25 -0.21 -0.61 -1.08 0.00 0.00 178.44 176.68 1x51 h GLN 65 N 0.46 -0.57 -0.70 1.13 5.75 -1.68 -2.64 115.11 116.86 1x51 h GLN 65 Ca 0.31 0.04 -0.05 0.00 -0.15 0.00 0.00 58.65 58.80 1x51 h GLN 65 Cb 0.58 0.13 -0.03 0.00 1.07 0.00 0.00 27.48 29.23 1x51 h GLN 65 CO -0.09 -0.35 0.25 0.00 -2.65 0.00 0.00 178.83 175.98 1x51 h ARG 66 N -0.64 1.04 -0.00 1.69 3.08 -1.52 -0.71 114.38 117.32 1x51 h ARG 66 Ca -0.06 -0.19 0.01 0.00 0.07 0.00 0.00 59.98 59.80 1x51 h ARG 66 Cb 0.48 -0.17 -0.03 0.00 0.08 0.00 0.00 29.97 30.34 1x51 h ARG 66 CO 0.10 0.87 -0.26 0.87 -1.07 0.00 0.00 179.97 180.48 1x51 h LYS 67 N 1.02 -0.31 -0.56 0.04 1.57 -0.95 -2.05 116.57 115.33 1x51 h LYS 67 Ca 0.23 0.02 -0.05 0.00 -1.87 0.00 0.00 60.65 58.98 1x51 h LYS 67 Cb 0.24 0.07 -0.03 0.00 0.08 0.00 0.00 32.23 32.59 1x51 h LYS 67 CO -0.01 -0.20 0.14 0.00 -0.57 0.00 0.00 179.45 178.80 1x51 h ALA 68 N -0.99 1.20 -0.53 3.86 0.00 -1.47 -2.77 119.26 118.56 1x51 h ALA 68 Ca 0.01 -0.21 0.06 0.00 0.00 0.00 0.00 54.91 54.77 1x51 h ALA 68 Cb 0.34 -0.22 -0.08 0.00 0.00 0.00 0.00 17.79 17.82 1x51 h ALA 68 CO -0.17 0.55 -0.52 1.25 0.00 0.00 0.00 179.25 180.37 1x51 h LEU 69 N 0.83 -1.78 -0.13 0.00 5.85 -0.61 -1.69 115.31 117.78 1x51 h LEU 69 Ca 0.18 0.24 -0.01 0.00 0.84 0.00 0.00 57.88 59.14 1x51 h LEU 69 Cb 0.30 0.75 -0.01 0.00 0.37 0.00 0.00 40.66 42.07 1x51 h LEU 69 CO -0.00 -0.32 0.06 -0.07 -0.34 0.00 0.00 178.44 177.77 1x51 h LEU 70 N -0.26 0.18 -0.85 2.25 3.38 -1.36 -2.80 115.31 115.85 1x51 h LEU 70 Ca 0.09 -0.14 0.33 0.00 0.09 0.00 0.00 57.88 58.25 1x51 h LEU 70 Cb 0.49 -0.05 -0.13 0.00 0.09 0.00 0.00 40.66 41.07 1x51 h LEU 70 CO -0.63 0.27 0.49 0.00 0.09 0.00 0.00 178.44 178.66 1x51 n GLN 71 N -4.90 -0.04 -0.05 1.13 1.13 -0.68 0.40 117.38 114.36 1x51 n GLN 71 Ca -0.05 1.02 -0.08 0.00 -1.94 0.00 0.00 57.00 55.95 1x51 n GLN 71 Cb 0.11 -1.89 -0.08 0.00 0.11 0.00 0.00 30.24 28.49 1x51 n GLN 71 CO 0.00 0.00 0.00 1.49 -1.44 0.00 0.00 177.06 177.11 1x51 h GLU 72 N 0.00 -0.01 -0.87 -1.09 4.57 -1.19 -3.32 114.58 112.66 1x51 h GLU 72 Ca 0.65 0.00 0.18 0.00 -1.18 0.00 0.00 59.36 59.02 1x51 h GLU 72 Cb 1.85 0.00 -0.16 0.00 -0.16 0.00 0.00 28.75 30.28 1x51 h GLU 72 CO -0.52 0.57 -0.18 -0.07 -1.18 0.00 0.00 179.01 177.63 1x51 h LEU 73 N -0.99 -0.75 -0.76 1.64 3.38 0.11 0.46 115.31 118.40 1x51 h LEU 73 Ca -0.00 0.26 0.15 0.00 0.09 0.00 0.00 57.88 58.38 1x51 h LEU 73 Cb 0.59 0.52 -0.10 0.00 0.09 0.00 0.00 40.66 41.75 1x51 h LEU 73 CO 0.00 -0.28 0.26 1.56 0.09 0.00 0.00 178.44 180.07 1x51 h GLN 74 N 0.01 0.37 -0.87 1.13 4.20 -1.27 0.27 115.11 118.94 1x51 h GLN 74 Ca 0.43 -0.02 0.22 0.00 0.06 0.00 0.00 58.65 59.34 1x51 h GLN 74 Cb 0.69 -0.08 -0.05 0.00 0.30 0.00 0.00 27.48 28.34 1x51 h GLN 74 CO -0.88 0.24 0.60 0.00 -0.67 0.00 0.00 178.83 178.12 1x51 h ARG 75 N 0.38 0.22 0.00 1.46 3.08 -0.17 -0.80 114.38 118.54 1x51 h ARG 75 Ca 0.42 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.46 1x51 h ARG 75 Cb 0.69 -0.05 0.00 0.00 0.08 0.00 0.00 29.97 30.69 1x51 h ARG 75 CO -0.45 0.14 0.00 0.91 -1.07 0.00 0.00 179.97 179.50 1x51 n TRP 76 N -4.41 0.00 0.00 3.04 7.02 0.83 -4.65 117.44 119.27 1x51 n TRP 76 Ca 0.18 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.66 1x51 n TRP 76 Cb 0.79 -0.33 0.00 0.00 -2.42 0.00 0.00 31.31 29.35 1x51 n TRP 76 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 1x51 n ALA 77 N -1.93 0.00 0.00 6.99 0.00 -0.53 -4.03 120.51 121.00 1x51 n ALA 77 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 53.44 53.43 1x51 n ALA 77 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1x51 n ALA 77 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1x51 n GLY 78 N 1.99 -0.14 3.61 0.00 0.00 -0.31 -4.79 105.19 105.55 1x51 n GLY 78 Ca 0.00 0.06 -0.43 0.00 0.00 0.00 0.00 46.02 45.65 1x51 n GLY 78 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1x51 s PRO 79 N 0.00 3.52 -0.05 1.61 0.04 -1.26 -4.10 135.00 134.76 1x51 s PRO 79 Ca 0.00 1.41 0.04 0.00 0.04 0.00 0.00 61.00 62.49 1x51 s PRO 79 Cb 0.00 -4.12 -0.00 0.00 0.04 0.00 0.00 34.50 30.42 1x51 s PRO 79 CO 0.00 -1.63 -0.18 -0.51 0.04 0.00 0.00 177.00 174.72 1x51 s LEU 80 N 6.10 1.92 0.00 -3.56 2.01 -1.26 -5.02 118.68 118.87 1x51 s LEU 80 Ca 0.74 -0.38 -0.08 0.00 0.01 0.00 0.00 54.13 54.41 1x51 s LEU 80 Cb -0.22 -1.04 0.12 0.00 0.01 0.00 0.00 46.19 45.06 1x51 s LEU 80 CO 0.32 0.15 0.44 -0.81 1.01 0.00 0.00 176.35 177.47 1x51 n PRO 81 N 3.21 -1.87 0.01 1.29 -0.04 -1.26 -5.07 135.00 131.27 1x51 n PRO 81 Ca -0.19 -0.70 0.00 0.00 -0.04 0.00 0.00 63.50 62.57 1x51 n PRO 81 Cb 0.53 -0.66 0.00 0.00 -0.04 0.00 0.00 33.50 33.33 1x51 n PRO 81 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1x51 n ALA 82 N -3.75 3.00 -0.16 0.55 0.00 -1.26 -4.82 120.51 114.08 1x51 n ALA 82 Ca -0.08 0.00 0.11 0.00 0.00 0.00 0.00 53.44 53.47 1x51 n ALA 82 Cb 0.24 0.01 0.45 0.00 0.00 0.00 0.00 19.45 20.14 1x51 n ALA 82 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 1x51 h THR 83 N 0.00 0.89 -0.89 0.00 2.02 -2.04 -0.79 112.91 112.11 1x51 h THR 83 Ca 0.00 -0.18 0.14 0.00 0.77 0.00 0.00 66.41 67.14 1x51 h THR 83 Cb 0.00 0.30 -0.07 0.00 -1.74 0.00 0.00 68.15 66.64 1x51 h THR 83 CO 0.00 0.10 0.58 0.45 0.37 0.00 0.00 175.52 177.01 1x51 h HIS 84 N 0.54 0.83 -2.40 3.16 -0.00 -1.97 -3.40 115.15 111.90 1x51 h HIS 84 Ca 0.34 0.02 -0.53 0.00 -0.00 0.00 0.00 60.37 60.20 1x51 h HIS 84 Cb 0.58 -0.26 0.01 0.00 -0.00 0.00 0.00 27.41 27.75 1x51 h HIS 84 CO -0.00 0.30 1.21 -1.17 -0.00 0.00 0.00 177.93 178.28 1x51 s LEU 85 N -9.82 4.40 -0.02 2.43 2.96 -0.30 -4.84 118.68 113.50 1x51 s LEU 85 Ca -0.10 2.59 0.05 0.00 -0.22 0.00 0.00 54.13 56.45 1x51 s LEU 85 Cb 0.22 -3.53 -0.01 0.00 0.50 0.00 0.00 46.19 43.37 1x51 s LEU 85 CO 0.79 -1.05 -0.16 -0.60 -1.32 0.00 0.00 176.35 174.01 1x51 s ARG 86 N 4.42 1.39 -0.05 1.98 6.06 -1.10 -5.02 118.95 126.63 1x51 s ARG 86 Ca 0.86 -0.57 -0.30 0.00 -2.50 0.00 0.00 55.73 53.22 1x51 s ARG 86 Cb -0.41 -1.31 -0.04 0.00 0.06 0.00 0.00 34.95 33.24 1x51 s ARG 86 CO 0.40 0.32 1.42 -1.58 -2.50 0.00 0.00 175.30 173.35 1x51 s HIS 87 N -0.27 2.67 -0.41 5.12 5.65 -1.26 -2.69 115.29 124.10 1x51 s HIS 87 Ca 0.04 0.74 0.02 0.00 0.25 0.00 0.00 55.06 56.11 1x51 s HIS 87 Cb -0.07 -3.67 0.12 0.00 -1.18 0.00 0.00 32.58 27.78 1x51 s HIS 87 CO -0.00 -2.53 0.19 -0.51 -0.65 0.00 0.00 174.74 171.23 1x51 s LEU 88 N 3.00 3.09 0.00 8.88 1.43 -1.17 -4.97 118.68 128.94 1x51 s LEU 88 Ca 0.63 -2.42 0.00 0.00 -1.03 0.00 0.00 54.13 51.32 1x51 s LEU 88 Cb -0.29 -1.16 0.00 0.00 0.03 0.00 0.00 46.19 44.77 1x51 s LEU 88 CO 0.24 -0.31 0.00 0.61 0.23 0.00 0.00 176.35 177.13 1x51 n GLY 89 N 3.84 -1.27 3.29 -3.19 0.00 -1.26 -4.57 105.19 102.02 1x51 n GLY 89 Ca 0.05 -1.00 -0.12 0.00 0.00 0.00 0.00 46.02 44.95 1x51 n GLY 89 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1x51 s GLU 90 N -0.94 1.31 -0.23 1.61 -1.05 -1.26 -3.37 118.70 114.76 1x51 s GLU 90 Ca 0.00 -1.57 -0.04 0.00 -0.15 0.00 0.00 54.97 53.21 1x51 s GLU 90 Cb 0.00 0.32 0.08 0.00 -0.44 0.00 0.00 34.13 34.09 1x51 s GLU 90 CO 0.00 -0.46 0.10 0.08 0.95 0.00 0.00 175.26 175.93 1x51 s VAL 91 N -4.08 0.01 -0.26 1.83 1.01 0.03 -4.84 120.40 114.11 1x51 s VAL 91 Ca 0.36 -0.52 -0.01 0.00 0.00 0.00 0.00 61.98 61.80 1x51 s VAL 91 Cb 0.05 -0.84 0.04 0.00 0.00 0.00 0.00 36.38 35.62 1x51 s VAL 91 CO 0.12 -0.50 -0.05 -0.69 0.00 0.00 0.00 175.10 173.98 1x51 s VAL 92 N 2.07 2.81 0.19 2.92 1.01 -1.26 0.13 120.40 128.27 1x51 s VAL 92 Ca 0.05 -1.18 0.06 0.00 0.00 0.00 0.00 61.98 60.91 1x51 s VAL 92 Cb -0.16 -2.49 -0.04 0.00 0.00 0.00 0.00 36.38 33.69 1x51 s VAL 92 CO -0.22 0.10 0.12 -2.28 0.00 0.00 0.00 175.10 172.82 1x51 s HIS 93 N 1.28 3.08 -0.12 5.22 2.46 -0.82 -4.99 115.29 121.39 1x51 s HIS 93 Ca -0.02 -0.06 0.01 0.00 0.47 0.00 0.00 55.06 55.46 1x51 s HIS 93 Cb -0.18 -1.46 0.02 0.00 -0.13 0.00 0.00 32.58 30.83 1x51 s HIS 93 CO -0.04 0.52 -0.14 0.99 -2.47 0.00 0.00 174.74 173.61 1x51 s THR 94 N -1.84 1.45 0.47 0.89 2.01 -1.26 -0.72 115.64 116.64 1x51 s THR 94 Ca 0.31 -0.59 0.05 0.00 0.31 0.00 0.00 61.69 61.76 1x51 s THR 94 Cb -0.09 -1.35 0.05 0.00 0.01 0.00 0.00 72.50 71.11 1x51 s THR 94 CO 0.23 0.44 0.38 0.49 -0.69 0.00 0.00 174.62 175.46 1x51 n PHE 95 N 4.46 -0.83 -1.66 4.92 3.72 -0.44 -4.99 117.46 122.65 1x51 n PHE 95 Ca -0.18 -1.99 -0.48 0.00 -0.05 0.00 0.00 57.45 54.75 1x51 n PHE 95 Cb 0.51 -0.39 -0.05 0.00 -0.94 0.00 0.00 39.48 38.61 1x51 n PHE 95 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14 1x51 n SER 96 N -1.89 2.82 -2.04 4.37 7.64 -1.26 -1.50 113.62 121.76 1x51 n SER 96 Ca -0.01 1.07 -0.02 0.00 1.01 0.00 0.00 58.87 60.93 1x51 n SER 96 Cb 0.54 -1.35 -0.00 0.00 -1.01 0.00 0.00 64.21 62.38 1x51 n SER 96 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1x51 n HIS 97 N 3.95 -1.41 -3.91 1.43 1.44 -1.26 -4.79 115.22 110.67 1x51 n HIS 97 Ca 0.19 0.03 -0.08 0.00 -2.01 0.00 0.00 57.72 55.84 1x51 n HIS 97 Cb 0.26 -0.75 -0.08 0.00 0.12 0.00 0.00 29.99 29.54 1x51 n HIS 97 CO 0.00 0.00 0.00 0.42 -2.81 0.00 0.00 176.34 173.95 1x51 s ILE 98 N -1.50 0.16 -0.05 0.61 1.01 -0.56 -4.57 121.20 116.30 1x51 s ILE 98 Ca 0.03 -1.32 -0.02 0.00 0.00 0.00 0.00 60.65 59.35 1x51 s ILE 98 Cb -0.02 -1.37 0.03 0.00 0.01 0.00 0.00 42.46 41.11 1x51 s ILE 98 CO 0.04 -0.73 0.10 -0.75 0.00 0.00 0.00 174.94 173.60 1x51 s LYS 99 N -3.85 0.05 0.12 2.79 2.36 -0.84 -1.33 119.74 119.05 1x51 s LYS 99 Ca 0.05 0.28 0.11 0.00 -2.55 0.00 0.00 55.97 53.86 1x51 s LYS 99 Cb 0.05 -0.18 -0.04 0.00 -1.05 0.00 0.00 37.83 36.61 1x51 s LYS 99 CO -0.11 -0.15 -0.26 -0.51 1.55 0.00 0.00 175.35 175.87 1x51 s LEU 100 N 1.03 2.37 -0.11 5.43 2.01 0.10 -3.36 118.68 126.14 1x51 s LEU 100 Ca -0.08 -0.72 -0.03 0.00 0.01 0.00 0.00 54.13 53.31 1x51 s LEU 100 Cb -0.11 -1.27 0.04 0.00 0.01 0.00 0.00 46.19 44.87 1x51 s LEU 100 CO -0.04 0.18 0.06 -0.89 1.01 0.00 0.00 176.35 176.67 1x51 s THR 101 N -1.06 0.08 -0.06 5.49 2.01 -0.99 -1.95 115.64 119.16 1x51 s THR 101 Ca 0.14 0.02 0.03 0.00 0.31 0.00 0.00 61.69 62.20 1x51 s THR 101 Cb -0.10 -0.50 -0.02 0.00 0.01 0.00 0.00 72.50 71.89 1x51 s THR 101 CO 0.06 -0.02 -0.14 -0.31 -0.69 0.00 0.00 174.62 173.52 1x51 s TYR 102 N 2.08 2.72 -0.32 4.92 1.51 0.12 -1.39 117.35 126.98 1x51 s TYR 102 Ca 0.03 -0.21 -0.11 0.00 -1.01 0.00 0.00 57.07 55.77 1x51 s TYR 102 Cb -0.14 -1.66 -0.02 0.00 -0.11 0.00 0.00 41.96 40.04 1x51 s TYR 102 CO -0.06 0.14 0.20 -0.65 -1.11 0.00 0.00 175.55 174.07 1x51 s GLN 103 N -0.61 3.48 0.04 -0.62 -1.52 -0.94 -0.79 119.66 118.70 1x51 s GLN 103 Ca 0.09 -0.64 -0.31 0.00 -1.95 0.00 0.00 55.36 52.55 1x51 s GLN 103 Cb -0.11 -3.69 -0.06 0.00 -0.22 0.00 0.00 33.01 28.92 1x51 s GLN 103 CO 0.01 -0.40 1.37 0.08 -0.25 0.00 0.00 175.29 176.10 1x51 s VAL 104 N 1.68 3.63 -0.20 1.09 1.01 -1.22 -2.31 120.40 124.08 1x51 s VAL 104 Ca 0.06 1.09 -0.03 0.00 0.00 0.00 0.00 61.98 63.09 1x51 s VAL 104 Cb -0.17 -3.70 0.07 0.00 0.00 0.00 0.00 36.38 32.58 1x51 s VAL 104 CO 0.09 0.03 0.06 -0.31 0.00 0.00 0.00 175.10 174.97 1x51 s TYR 105 N 1.86 0.83 0.03 5.22 2.02 -0.75 -3.03 117.35 123.54 1x51 s TYR 105 Ca 0.63 -0.79 -0.25 0.00 -0.37 0.00 0.00 57.07 56.30 1x51 s TYR 105 Cb -0.33 -0.98 -0.05 0.00 -0.40 0.00 0.00 41.96 40.20 1x51 s TYR 105 CO 0.28 -0.62 0.76 0.20 -1.57 0.00 0.00 175.55 174.60 1x51 s GLY 106 N 1.92 2.77 -0.23 0.71 0.00 -1.09 0.11 107.32 111.51 1x51 s GLY 106 Ca 0.01 0.27 -0.04 0.00 0.00 0.00 0.00 44.72 44.97 1x51 s GLY 106 CO -0.11 1.12 0.36 -2.27 0.00 0.00 0.00 173.10 172.19 1x51 s LEU 107 N 0.07 -0.57 -0.02 0.66 1.98 -0.83 -2.70 118.68 117.27 1x51 s LEU 107 Ca 0.39 0.33 0.04 0.00 -2.89 0.00 0.00 54.13 51.99 1x51 s LEU 107 Cb -0.20 1.06 -0.01 0.00 0.66 0.00 0.00 46.19 47.70 1x51 s LEU 107 CO 0.23 -0.29 -0.13 0.00 -1.89 0.00 0.00 176.35 174.27 1x51 s ALA 108 N 2.53 1.12 -0.27 5.97 0.00 -1.26 -1.64 121.76 128.20 1x51 s ALA 108 Ca 0.09 -0.53 -0.29 0.00 0.00 0.00 0.00 51.96 51.23 1x51 s ALA 108 Cb -0.15 -0.33 -0.01 0.00 0.00 0.00 0.00 23.12 22.63 1x51 s ALA 108 CO -0.14 0.24 1.40 -0.51 0.00 0.00 0.00 175.76 176.74 1x51 s LEU 109 N -0.11 3.89 0.54 0.00 1.43 -0.74 -4.85 118.68 118.84 1x51 s LEU 109 Ca 0.01 1.34 0.19 0.00 -1.03 0.00 0.00 54.13 54.64 1x51 s LEU 109 Cb -0.07 -3.54 1.03 0.00 0.03 0.00 0.00 46.19 43.64 1x51 s LEU 109 CO 0.00 -1.14 1.53 -0.08 0.23 0.00 0.00 176.35 176.90 1x51 h GLU 110 N 9.75 0.00 0.00 1.70 4.81 -1.99 -3.39 114.58 125.46 1x51 h GLU 110 Ca -0.29 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.94 1x51 h GLU 110 Cb 1.12 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.50 1x51 h GLU 110 CO 1.02 0.00 0.00 0.41 -0.73 0.00 0.00 179.01 179.71 1x51 n GLY 111 N -1.28 0.89 0.04 1.92 0.00 -1.26 -5.00 105.19 100.50 1x51 n GLY 111 Ca -0.01 -0.08 -0.03 0.00 0.00 0.00 0.00 46.02 45.90 1x51 n GLY 111 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1x51 n GLN 112 N 0.00 0.26 -3.69 1.61 6.02 -1.26 -5.05 117.38 115.27 1x51 n GLN 112 Ca 0.00 0.36 -0.14 0.00 -0.01 0.00 0.00 57.00 57.21 1x51 n GLN 112 Cb 0.00 -1.24 -0.09 0.00 1.02 0.00 0.00 30.24 29.93 1x51 n GLN 112 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 177.06 177.00 1x51 s THR 113 N -1.76 0.00 0.63 5.09 -4.23 -1.26 -5.18 115.64 108.94 1x51 s THR 113 Ca -0.10 -0.04 -0.11 0.00 -1.18 0.00 0.00 61.69 60.27 1x51 s THR 113 Cb 0.01 -0.73 0.16 0.00 1.34 0.00 0.00 72.50 73.28 1x51 s THR 113 CO 0.14 -0.02 0.56 -0.81 -0.54 0.00 0.00 174.62 173.95 1x51 n PRO 114 N 2.56 -2.12 -0.00 3.99 -0.04 -1.26 -5.04 135.00 133.08 1x51 n PRO 114 Ca -0.14 -0.90 -0.00 0.00 -0.04 0.00 0.00 63.50 62.42 1x51 n PRO 114 Cb 0.56 -0.84 -0.00 0.00 -0.04 0.00 0.00 33.50 33.18 1x51 n PRO 114 CO 0.00 0.00 0.00 1.55 -0.04 0.00 0.00 175.50 177.01 1x51 n VAL 115 N -3.72 0.00 -3.64 0.52 3.14 -1.26 -4.99 118.33 108.37 1x51 n VAL 115 Ca 0.08 -0.00 -0.27 0.00 -2.96 0.00 0.00 64.34 61.19 1x51 n VAL 115 Cb 0.30 -0.54 -0.06 0.00 -1.06 0.00 0.00 33.84 32.48 1x51 n VAL 115 CO 0.00 0.00 0.00 0.35 -6.46 0.00 0.00 176.83 170.72 1x51 n THR 116 N -2.52 -0.20 -3.59 1.55 -2.24 -1.26 -4.84 114.28 101.18 1x51 n THR 116 Ca -0.00 -0.10 -0.00 0.00 -2.27 0.00 0.00 64.05 61.68 1x51 n THR 116 Cb 0.50 -0.44 -0.04 0.00 -2.10 0.00 0.00 70.33 68.25 1x51 n THR 116 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1x51 s THR 117 N -2.96 -0.90 -0.04 4.28 2.01 -1.26 -5.16 115.64 111.61 1x51 s THR 117 Ca 0.41 0.00 -0.03 0.00 0.31 0.00 0.00 61.69 62.38 1x51 s THR 117 Cb -0.24 -1.00 0.02 0.00 0.01 0.00 0.00 72.50 71.29 1x51 s THR 117 CO 0.70 0.00 0.11 0.54 -0.69 0.00 0.00 174.62 175.28 1x51 s VAL 118 N 2.81 -0.01 0.93 3.82 0.11 -1.26 -4.40 120.40 122.39 1x51 s VAL 118 Ca -0.05 0.05 -0.12 0.00 -2.93 0.00 0.00 61.98 58.93 1x51 s VAL 118 Cb -0.11 -0.17 0.15 0.00 -1.53 0.00 0.00 36.38 34.72 1x51 s VAL 118 CO -0.19 0.02 1.09 -2.16 -3.33 0.00 0.00 175.10 170.54 1x51 s PRO 119 N 0.37 0.98 -0.73 1.54 0.04 -1.26 -4.91 135.00 131.02 1x51 s PRO 119 Ca -0.03 0.72 -0.26 0.00 0.04 0.00 0.00 61.00 61.48 1x51 s PRO 119 Cb -0.04 -1.78 -0.03 0.00 0.04 0.00 0.00 34.50 32.69 1x51 s PRO 119 CO -0.01 -2.41 1.90 -1.25 0.04 0.00 0.00 177.00 175.26 1x51 s PRO 120 N -4.94 2.60 0.00 0.56 0.04 -1.26 -2.70 135.00 129.29 1x51 s PRO 120 Ca 0.64 0.23 0.00 0.00 0.04 0.00 0.00 61.00 61.91 1x51 s PRO 120 Cb -0.18 -4.67 0.00 0.00 0.04 0.00 0.00 34.50 29.69 1x51 s PRO 120 CO 0.57 -3.00 0.00 0.41 0.04 0.00 0.00 177.00 175.02 1x51 n GLY 121 N 6.18 0.09 3.72 0.56 0.00 -1.26 -5.15 105.19 109.33 1x51 n GLY 121 Ca 0.29 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 46.08 1x51 n GLY 121 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1x51 s ALA 122 N 0.00 3.44 -0.09 4.61 0.00 -1.10 -2.84 121.76 125.78 1x51 s ALA 122 Ca 0.00 -1.77 -0.07 0.00 0.00 0.00 0.00 51.96 50.11 1x51 s ALA 122 Cb 0.00 -0.77 0.02 0.00 0.00 0.00 0.00 23.12 22.38 1x51 s ALA 122 CO 0.00 0.09 0.22 0.50 0.00 0.00 0.00 175.76 176.58 1x51 s ARG 123 N -3.81 0.25 -0.46 0.00 3.52 0.81 -4.92 118.95 114.34 1x51 s ARG 123 Ca 0.36 0.33 -0.09 0.00 -0.13 0.00 0.00 55.73 56.21 1x51 s ARG 123 Cb -0.04 0.10 0.11 0.00 -1.56 0.00 0.00 34.95 33.56 1x51 s ARG 123 CO 0.22 -0.05 0.32 -1.58 -0.81 0.00 0.00 175.30 173.40 1x51 s TRP 124 N 0.25 3.42 0.41 5.12 0.52 -1.26 -0.25 118.94 127.14 1x51 s TRP 124 Ca -0.01 -1.83 0.07 0.00 0.02 0.00 0.00 56.10 54.35 1x51 s TRP 124 Cb -0.03 -3.36 -0.07 0.00 -1.15 0.00 0.00 33.47 28.86 1x51 s TRP 124 CO -0.01 -0.96 0.04 -0.48 0.02 0.00 0.00 176.95 175.56 1x51 s LEU 125 N 1.36 2.93 0.65 2.99 0.05 -0.90 -4.95 118.68 120.81 1x51 s LEU 125 Ca 0.05 -1.31 -0.07 0.00 0.05 0.00 0.00 54.13 52.85 1x51 s LEU 125 Cb -0.25 -1.01 0.03 0.00 -2.05 0.00 0.00 46.19 42.90 1x51 s LEU 125 CO -0.00 -0.46 0.98 0.42 -0.55 0.00 0.00 176.35 176.74 1x51 s THR 126 N -2.68 3.13 0.14 5.48 -4.23 -1.26 -0.16 115.64 116.05 1x51 s THR 126 Ca 0.36 -0.00 -0.24 0.00 -1.18 0.00 0.00 61.69 60.63 1x51 s THR 126 Cb 0.09 -3.30 0.01 0.00 1.34 0.00 0.00 72.50 70.63 1x51 s THR 126 CO 0.19 -0.33 1.62 1.56 -0.54 0.00 0.00 174.62 177.12 1x51 h GLN 127 N -0.42 -0.30 -0.22 3.99 4.20 -1.93 -1.82 115.11 118.60 1x51 h GLN 127 Ca -0.45 0.02 0.05 0.00 0.06 0.00 0.00 58.65 58.33 1x51 h GLN 127 Cb 1.28 0.07 -0.05 0.00 0.30 0.00 0.00 27.48 29.08 1x51 h GLN 127 CO 0.61 -0.20 -0.08 0.93 -0.67 0.00 0.00 178.83 179.42 1x51 h GLU 128 N -0.31 -0.04 -0.35 1.46 3.07 -1.94 -2.73 114.58 113.73 1x51 h GLU 128 Ca 0.12 0.00 0.06 0.00 -0.50 0.00 0.00 59.36 59.04 1x51 h GLU 128 Cb 0.50 0.01 -0.08 0.00 -0.84 0.00 0.00 28.75 28.33 1x51 h GLU 128 CO -0.37 -0.03 -0.43 0.93 -1.40 0.00 0.00 179.01 177.71 1x51 h GLU 129 N -0.05 -0.35 -0.82 2.33 4.39 -1.78 -2.28 114.58 116.02 1x51 h GLU 129 Ca 0.12 0.02 0.07 0.00 0.34 0.00 0.00 59.36 59.91 1x51 h GLU 129 Cb 0.22 0.08 -0.10 0.00 -0.10 0.00 0.00 28.75 28.85 1x51 h GLU 129 CO -0.26 -0.23 -0.49 0.34 -1.16 0.00 0.00 179.01 177.21 1x51 n PHE 130 N -5.42 -0.36 -0.28 4.33 -0.00 -0.74 -0.90 117.46 114.09 1x51 n PHE 130 Ca -0.01 1.03 -0.07 0.00 -0.00 0.00 0.00 57.45 58.39 1x51 n PHE 130 Cb 0.35 -0.56 -0.07 0.00 -0.00 0.00 0.00 39.48 39.20 1x51 n PHE 130 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 176.76 177.48 1x51 n HIS 131 N -4.90 -0.29 -0.30 -5.13 8.25 -0.86 0.11 115.22 112.10 1x51 n HIS 131 Ca 0.02 0.83 0.05 0.00 -0.26 0.00 0.00 57.72 58.35 1x51 n HIS 131 Cb 0.21 -0.54 0.25 0.00 1.12 0.00 0.00 29.99 31.04 1x51 n HIS 131 CO 0.00 0.00 0.00 1.79 0.64 0.00 0.00 176.34 178.77 1x51 h THR 132 N 0.00 1.05 -3.06 1.59 1.35 -1.06 -3.44 112.91 109.34 1x51 h THR 132 Ca 0.11 -0.34 -0.55 0.00 -0.55 0.00 0.00 66.41 65.08 1x51 h THR 132 Cb 0.27 -0.04 0.21 0.00 -1.73 0.00 0.00 68.15 66.86 1x51 h THR 132 CO -0.63 0.18 -0.73 0.00 -0.25 0.00 0.00 175.52 174.10 1x51 n ALA 133 N -2.40 -2.64 -2.39 6.62 0.00 0.31 -4.82 120.51 115.19 1x51 n ALA 133 Ca 0.14 -0.45 -0.40 0.00 0.00 0.00 0.00 53.44 52.73 1x51 n ALA 133 Cb 0.22 -1.70 -0.03 0.00 0.00 0.00 0.00 19.45 17.93 1x51 n ALA 133 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1x51 s ALA 134 N -2.13 2.54 0.04 0.00 0.00 -1.26 -4.97 121.76 115.98 1x51 s ALA 134 Ca 0.58 -1.27 0.05 0.00 0.00 0.00 0.00 51.96 51.32 1x51 s ALA 134 Cb -0.27 -4.31 -0.02 0.00 0.00 0.00 0.00 23.12 18.51 1x51 s ALA 134 CO 0.66 -3.56 -0.15 0.08 0.00 0.00 0.00 175.76 172.80 1x51 s VAL 135 N 6.76 1.19 0.59 0.00 1.01 -1.25 -1.40 120.40 127.30 1x51 s VAL 135 Ca 0.46 -1.05 -0.16 0.00 0.00 0.00 0.00 61.98 61.24 1x51 s VAL 135 Cb -0.08 -1.08 -0.04 0.00 0.00 0.00 0.00 36.38 35.18 1x51 s VAL 135 CO 0.13 0.02 1.06 -0.55 0.00 0.00 0.00 175.10 175.76 1x51 s SER 136 N -1.19 5.77 0.05 3.32 0.15 -1.26 -4.75 113.70 115.79 1x51 s SER 136 Ca 0.02 1.82 -0.10 0.00 0.70 0.00 0.00 55.95 58.39 1x51 s SER 136 Cb -0.08 -2.53 -0.03 0.00 -1.71 0.00 0.00 66.02 61.67 1x51 s SER 136 CO 0.01 -1.18 1.18 0.74 1.20 0.00 0.00 173.24 175.20 1x51 h THR 137 N 0.43 0.00 -0.68 6.45 2.02 -2.01 0.14 112.91 119.26 1x51 h THR 137 Ca -0.47 0.00 0.06 0.00 0.77 0.00 0.00 66.41 66.77 1x51 h THR 137 Cb 1.22 0.00 -0.08 0.00 -1.74 0.00 0.00 68.15 67.55 1x51 h THR 137 CO 0.57 0.00 -0.40 0.00 0.37 0.00 0.00 175.52 176.06 1x51 n ALA 138 N -3.00 -0.44 -0.09 6.16 0.00 -1.26 -0.47 120.51 121.43 1x51 n ALA 138 Ca 0.00 0.58 -0.07 0.00 0.00 0.00 0.00 53.44 53.95 1x51 n ALA 138 Cb 0.09 0.02 -0.01 0.00 0.00 0.00 0.00 19.45 19.56 1x51 n ALA 138 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 177.50 178.02 1x51 h MET 139 N 0.00 -0.20 -0.83 0.00 2.07 -1.73 0.24 114.93 114.48 1x51 h MET 139 Ca 0.11 0.01 0.24 0.00 -2.07 0.00 0.00 59.70 57.99 1x51 h MET 139 Cb 0.28 0.04 -0.03 0.00 -1.87 0.00 0.00 31.60 30.02 1x51 h MET 139 CO -0.64 -0.13 0.70 0.87 1.07 0.00 0.00 176.91 178.78 1x51 h LYS 140 N -0.20 0.00 0.00 1.72 1.57 0.20 0.98 116.57 120.84 1x51 h LYS 140 Ca 0.17 0.00 -0.13 0.00 -1.87 0.00 0.00 60.65 58.82 1x51 h LYS 140 Cb 0.46 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.75 1x51 h LYS 140 CO -0.45 0.00 -0.63 0.87 -0.57 0.00 0.00 179.45 178.68 1x51 h LYS 141 N 0.00 0.00 0.00 3.15 1.57 0.94 -3.22 116.57 119.01 1x51 h LYS 141 Ca 0.40 0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 59.14 1x51 h LYS 141 Cb 1.79 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 34.09 1x51 h LYS 141 CO -0.00 0.57 -0.18 0.28 -0.57 0.00 0.00 179.45 179.54 1x51 h VAL 142 N 0.00 0.77 0.04 0.50 2.07 0.16 -2.30 116.25 117.49 1x51 h VAL 142 Ca -0.01 -0.72 -0.00 0.00 0.82 0.00 0.00 66.70 66.79 1x51 h VAL 142 Cb 1.46 1.43 0.00 0.00 -1.52 0.00 0.00 31.29 32.66 1x51 h VAL 142 CO 0.07 0.18 -0.02 0.15 0.02 0.00 0.00 177.57 177.97 1x51 h PHE 143 N 0.00 -0.06 -1.04 1.57 3.57 -1.54 -3.06 116.94 116.38 1x51 h PHE 143 Ca -0.00 -0.00 0.27 0.00 3.53 0.00 0.00 57.97 61.76 1x51 h PHE 143 Cb 0.42 0.02 -0.10 0.00 2.79 0.00 0.00 35.95 39.08 1x51 h PHE 143 CO 0.00 -0.03 0.66 0.07 -2.23 0.00 0.00 178.31 176.78 1x51 h ARG 144 N -0.91 0.41 -0.46 1.11 0.11 -1.60 0.43 114.38 113.47 1x51 h ARG 144 Ca -0.01 -0.02 -0.09 0.00 0.10 0.00 0.00 59.98 59.96 1x51 h ARG 144 Cb 0.05 -0.09 -0.02 0.00 1.11 0.00 0.00 29.97 31.02 1x51 h ARG 144 CO 0.01 0.27 -0.09 0.28 0.10 0.00 0.00 179.97 180.54 1x51 h VAL 145 N 0.42 1.26 -0.04 0.08 2.07 -1.53 -2.52 116.25 115.99 1x51 h VAL 145 Ca 0.61 -1.15 -0.17 0.00 0.82 0.00 0.00 66.70 66.81 1x51 h VAL 145 Cb 1.48 1.00 -0.01 0.00 -1.52 0.00 0.00 31.29 32.24 1x51 h VAL 145 CO -0.33 0.40 -0.71 0.22 0.02 0.00 0.00 177.57 177.16 1x51 h TYR 146 N 0.74 0.30 0.00 1.57 3.20 -0.14 -2.89 116.97 119.75 1x51 h TYR 146 Ca 0.13 -0.13 0.00 0.00 3.14 0.00 0.00 58.73 61.86 1x51 h TYR 146 Cb 0.58 -0.05 0.00 0.00 1.54 0.00 0.00 36.73 38.80 1x51 h TYR 146 CO 0.03 0.86 0.00 1.04 -1.64 0.00 0.00 178.16 178.45 1x51 n GLN 147 N -3.79 0.05 0.00 1.82 6.02 -0.12 -4.03 117.38 117.34 1x51 n GLN 147 Ca -0.03 0.18 0.00 0.00 -0.01 0.00 0.00 57.00 57.14 1x51 n GLN 147 Cb 0.69 -1.58 0.00 0.00 1.02 0.00 0.00 30.24 30.37 1x51 n GLN 147 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1x51 n GLY 148 N 0.67 -3.26 0.27 1.08 0.00 -0.97 -2.73 105.19 100.24 1x51 n GLY 148 Ca 0.05 0.45 0.00 0.00 0.00 0.00 0.00 46.02 46.52 1x51 n GLY 148 CO 0.00 0.00 0.00 0.06 0.00 0.00 0.00 173.32 173.38 1x51 h GLN 149 N 0.00 0.63 -6.01 1.61 -0.00 -1.79 -3.43 115.11 106.11 1x51 h GLN 149 Ca 0.00 -0.04 -0.74 0.00 -0.00 0.00 0.00 58.65 57.87 1x51 h GLN 149 Cb 0.00 -0.14 0.07 0.00 -0.00 0.00 0.00 27.48 27.41 1x51 h GLN 149 CO 0.00 0.41 -0.14 0.43 -0.00 0.00 0.00 178.83 179.54 1x51 n SER 150 N -4.83 -0.39 -3.10 0.06 7.64 -1.10 -4.94 113.62 106.96 1x51 n SER 150 Ca 0.10 1.15 -0.11 0.00 1.01 0.00 0.00 58.87 61.02 1x51 n SER 150 Cb 0.24 -0.94 -0.04 0.00 -1.01 0.00 0.00 64.21 62.46 1x51 n SER 150 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 1x51 s GLY 151 N -0.34 -0.47 0.47 0.23 0.00 -1.26 -4.97 107.32 100.98 1x51 s GLY 151 Ca 0.81 -0.88 -0.22 0.00 0.00 0.00 0.00 44.72 44.43 1x51 s GLY 151 CO 0.56 3.13 1.16 2.56 0.00 0.00 0.00 173.10 180.52 1x51 s PRO 152 N 0.97 3.70 -0.12 2.90 0.04 -1.26 -5.04 135.00 136.20 1x51 s PRO 152 Ca 0.26 1.75 -0.08 0.00 0.04 0.00 0.00 61.00 62.97 1x51 s PRO 152 Cb -0.03 -2.35 -0.04 0.00 0.04 0.00 0.00 34.50 32.12 1x51 s PRO 152 CO -0.08 -0.59 0.15 -1.54 0.04 0.00 0.00 177.00 174.98 1x51 s SER 153 N -1.42 6.40 -1.10 6.66 1.04 -1.26 -5.04 113.70 118.98 1x51 s SER 153 Ca 0.65 0.48 -0.14 0.00 0.48 0.00 0.00 55.95 57.42 1x51 s SER 153 Cb -0.28 -2.08 0.19 0.00 0.10 0.00 0.00 66.02 63.95 1x51 s SER 153 CO 0.33 0.39 1.26 -0.55 0.98 0.00 0.00 173.24 175.65 1x51 s SER 154 N -0.92 7.01 0.00 7.02 0.15 -1.26 -5.26 113.70 120.43 1x51 s SER 154 Ca 0.15 -2.89 0.22 0.00 0.70 0.00 0.00 55.95 54.13 1x51 s SER 154 Cb -0.12 -2.35 1.33 0.00 -1.71 0.00 0.00 66.02 63.17 1x51 s SER 154 CO 0.04 -0.71 1.71 0.61 1.20 0.00 0.00 173.24 176.09