#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 0.84 -0.09 1.61 1.04 -1.26 -5.15 113.70 110.69 1x51 s SER 2 Ca 0.00 -1.30 0.05 0.00 0.48 0.00 0.00 55.95 55.17 1x51 s SER 2 Cb 0.00 0.22 -0.00 0.00 0.10 0.00 0.00 66.02 66.33 1x51 s SER 2 CO 0.00 -0.71 -0.24 -0.55 0.98 0.00 0.00 173.24 172.72 1x51 s SER 3 N -3.20 3.08 0.05 7.02 0.15 -1.26 -4.97 113.70 114.57 1x51 s SER 3 Ca 0.32 -0.55 0.00 0.00 0.70 0.00 0.00 55.95 56.43 1x51 s SER 3 Cb 0.07 -1.27 0.00 0.00 -1.71 0.00 0.00 66.02 63.11 1x51 s SER 3 CO 0.09 0.18 0.00 0.61 1.20 0.00 0.00 173.24 175.32 1x51 n GLY 4 N 3.38 -4.90 3.44 9.45 0.00 -1.26 -5.04 105.19 110.26 1x51 n GLY 4 Ca -0.19 -0.20 0.01 0.00 0.00 0.00 0.00 46.02 45.65 1x51 n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1x51 s SER 5 N -0.40 -0.62 -0.91 1.61 0.15 -1.26 -4.82 113.70 107.45 1x51 s SER 5 Ca 0.00 0.86 -0.05 0.00 0.70 0.00 0.00 55.95 57.47 1x51 s SER 5 Cb 0.00 1.68 0.23 0.00 -1.71 0.00 0.00 66.02 66.21 1x51 s SER 5 CO 0.00 -0.12 0.82 -0.94 1.20 0.00 0.00 173.24 174.20 1x51 s SER 6 N 2.40 6.31 0.00 5.45 1.04 -1.26 -4.85 113.70 122.79 1x51 s SER 6 Ca -0.03 -3.51 0.00 0.00 0.48 0.00 0.00 55.95 52.89 1x51 s SER 6 Cb -0.06 -2.00 0.00 0.00 0.10 0.00 0.00 66.02 64.05 1x51 s SER 6 CO -0.17 -0.26 0.00 0.61 0.98 0.00 0.00 173.24 174.39 1x51 n GLY 7 N 2.70 1.15 2.11 7.32 0.00 -1.26 -5.01 105.19 112.19 1x51 n GLY 7 Ca 0.20 -0.84 -0.18 0.00 0.00 0.00 0.00 46.02 45.20 1x51 n GLY 7 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1x51 n PRO 8 N 0.00 -2.31 -2.83 1.61 -0.04 -1.26 -4.78 135.00 125.39 1x51 n PRO 8 Ca 0.00 -1.05 -0.31 0.00 -0.04 0.00 0.00 63.50 62.09 1x51 n PRO 8 Cb 0.00 -0.99 -0.04 0.00 -0.04 0.00 0.00 33.50 32.43 1x51 n PRO 8 CO 0.00 0.00 0.00 0.50 -0.04 0.00 0.00 175.50 175.96 1x51 s ARG 9 N -4.50 3.90 -0.19 0.54 6.06 -1.26 -4.90 118.95 118.59 1x51 s ARG 9 Ca 0.43 0.66 -0.18 0.00 -2.50 0.00 0.00 55.73 54.14 1x51 s ARG 9 Cb -0.04 -2.33 -0.20 0.00 0.06 0.00 0.00 34.95 32.43 1x51 s ARG 9 CO 0.33 -0.04 0.22 1.17 -2.50 0.00 0.00 175.30 174.48 1x51 n LYS 10 N -1.09 0.61 -0.32 5.12 0.00 -1.26 -3.81 118.16 117.41 1x51 n LYS 10 Ca 0.04 0.49 0.17 0.00 0.00 0.00 0.00 58.31 59.01 1x51 n LYS 10 Cb 0.54 -1.73 0.36 0.00 0.00 0.00 0.00 35.03 34.21 1x51 n LYS 10 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1x51 h ALA 11 N -0.39 1.58 -0.55 3.14 0.00 -1.96 0.32 119.26 121.40 1x51 h ALA 11 Ca -0.39 0.19 -0.10 0.00 0.00 0.00 0.00 54.91 54.62 1x51 h ALA 11 Cb 1.48 0.21 -0.02 0.00 0.00 0.00 0.00 17.79 19.46 1x51 h ALA 11 CO -0.16 -0.46 -0.03 0.66 0.00 0.00 0.00 179.25 179.26 1x51 h SER 12 N 0.31 0.98 -4.81 0.00 4.64 -2.00 -3.47 113.55 109.20 1x51 h SER 12 Ca 0.62 -0.32 -0.36 0.00 -0.47 0.00 0.00 61.79 61.26 1x51 h SER 12 Cb 1.31 -0.26 0.10 0.00 -0.31 0.00 0.00 62.40 63.23 1x51 h SER 12 CO -0.60 1.06 -0.58 0.54 -0.87 0.00 0.00 176.83 176.38 1x51 n ARG 13 N -4.22 -6.05 -4.31 4.77 1.74 0.11 -5.01 116.66 103.69 1x51 n ARG 13 Ca 0.02 0.77 -0.19 0.00 -0.77 0.00 0.00 57.85 57.68 1x51 n ARG 13 Cb 0.35 -5.51 -0.11 0.00 -1.02 0.00 0.00 32.46 26.17 1x51 n ARG 13 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 1x51 s LYS 14 N -5.94 1.21 0.85 5.56 -0.14 -1.26 -5.13 119.74 114.89 1x51 s LYS 14 Ca 0.42 -1.42 -0.11 0.00 -1.36 0.00 0.00 55.97 53.50 1x51 s LYS 14 Cb -0.19 -1.10 0.10 0.00 -1.68 0.00 0.00 37.83 34.97 1x51 s LYS 14 CO 0.52 0.20 1.09 -1.25 -0.76 0.00 0.00 175.35 175.16 1x51 s PRO 15 N -3.10 1.66 0.09 -1.68 0.04 -1.26 -4.82 135.00 125.93 1x51 s PRO 15 Ca 0.16 0.96 -0.16 0.00 0.04 0.00 0.00 61.00 62.00 1x51 s PRO 15 Cb -0.03 -1.84 -0.09 0.00 0.04 0.00 0.00 34.50 32.57 1x51 s PRO 15 CO 0.05 -2.00 1.41 -1.00 0.04 0.00 0.00 177.00 175.50 1x51 h PRO 16 N -1.38 0.65 -0.14 0.56 0.13 -2.00 -3.34 132.00 126.49 1x51 h PRO 16 Ca -0.47 -0.35 0.01 0.00 -0.87 0.00 0.00 66.00 64.33 1x51 h PRO 16 Cb 1.26 0.01 -0.02 0.00 0.13 0.00 0.00 31.00 32.39 1x51 h PRO 16 CO 0.53 0.95 -0.08 0.54 -0.23 0.00 0.00 178.00 179.71 1x51 n ARG 17 N -4.30 -0.06 -2.57 0.86 5.12 -1.26 -3.33 116.66 111.11 1x51 n ARG 17 Ca -0.04 0.79 -0.41 0.00 -1.93 0.00 0.00 57.85 56.25 1x51 n ARG 17 Cb 0.46 -1.17 -0.03 0.00 -1.16 0.00 0.00 32.46 30.55 1x51 n ARG 17 CO 0.00 0.00 0.00 -1.83 -1.93 0.00 0.00 177.63 173.87 1x51 s GLU 18 N -3.46 3.20 -0.15 5.56 -1.05 -1.25 -2.29 118.70 119.26 1x51 s GLU 18 Ca -0.02 -0.26 -0.04 0.00 -0.15 0.00 0.00 54.97 54.51 1x51 s GLU 18 Cb 0.02 -4.17 0.07 0.00 -0.44 0.00 0.00 34.13 29.60 1x51 s GLU 18 CO 0.09 -2.10 0.17 -1.21 0.95 0.00 0.00 175.26 173.16 1x51 s GLU 19 N 5.58 0.11 0.06 -4.83 0.41 -1.21 -4.80 118.70 114.01 1x51 s GLU 19 Ca 0.34 0.27 0.07 0.00 -0.41 0.00 0.00 54.97 55.25 1x51 s GLU 19 Cb -0.09 -1.00 -0.03 0.00 -1.78 0.00 0.00 34.13 31.23 1x51 s GLU 19 CO 0.15 -0.54 -0.20 -1.12 -0.49 0.00 0.00 175.26 173.07 1x51 s SER 20 N 2.28 2.36 0.08 -0.19 0.01 -1.26 -1.94 113.70 115.04 1x51 s SER 20 Ca 0.05 -0.55 -0.17 0.00 1.31 0.00 0.00 55.95 56.58 1x51 s SER 20 Cb -0.14 -0.17 0.04 0.00 0.21 0.00 0.00 66.02 65.95 1x51 s SER 20 CO -0.09 0.11 0.41 -0.44 0.41 0.00 0.00 173.24 173.64 1x51 s SER 21 N -1.35 -0.26 -0.26 2.44 0.01 -0.86 -3.23 113.70 110.18 1x51 s SER 21 Ca 0.06 -0.16 -0.03 0.00 1.31 0.00 0.00 55.95 57.13 1x51 s SER 21 Cb -0.09 0.45 0.02 0.00 0.21 0.00 0.00 66.02 66.61 1x51 s SER 21 CO 0.02 -0.76 -0.01 0.00 0.41 0.00 0.00 173.24 172.90 1x51 s ALA 22 N -3.15 2.83 0.03 1.44 0.00 -0.94 -2.12 121.76 119.84 1x51 s ALA 22 Ca -0.01 -1.46 0.04 0.00 0.00 0.00 0.00 51.96 50.53 1x51 s ALA 22 Cb 0.01 -1.85 -0.04 0.00 0.00 0.00 0.00 23.12 21.24 1x51 s ALA 22 CO -0.07 -0.85 -0.06 -0.08 0.00 0.00 0.00 175.76 174.69 1x51 s THR 23 N 1.38 3.67 0.15 0.00 -1.32 -0.92 -1.60 115.64 117.00 1x51 s THR 23 Ca 0.01 -0.85 0.05 0.00 -1.21 0.00 0.00 61.69 59.69 1x51 s THR 23 Cb -0.17 -2.63 -0.04 0.00 -1.51 0.00 0.00 72.50 68.15 1x51 s THR 23 CO -0.02 0.33 -0.12 0.00 -2.21 0.00 0.00 174.62 172.60 1x51 s VAL 25 N -2.85 4.00 -0.29 0.00 1.01 0.15 -4.43 120.40 117.98 1x51 s VAL 25 Ca 0.14 -0.29 -0.08 0.00 0.00 0.00 0.00 61.98 61.76 1x51 s VAL 25 Cb -0.01 -2.83 -0.01 0.00 0.00 0.00 0.00 36.38 33.54 1x51 s VAL 25 CO 0.02 0.40 0.10 -0.22 0.00 0.00 0.00 175.10 175.41 1x51 s LEU 26 N 1.26 3.83 -0.02 3.92 2.96 -1.24 -0.77 118.68 128.62 1x51 s LEU 26 Ca 0.04 -0.50 0.06 0.00 -0.22 0.00 0.00 54.13 53.51 1x51 s LEU 26 Cb -0.15 -1.94 -0.01 0.00 0.50 0.00 0.00 46.19 44.59 1x51 s LEU 26 CO 0.02 -0.15 -0.19 -0.70 -1.32 0.00 0.00 176.35 174.01 1x51 s GLU 27 N 1.57 1.59 -0.10 1.98 2.12 -0.65 -0.95 118.70 124.27 1x51 s GLU 27 Ca 0.04 -0.67 -0.00 0.00 0.36 0.00 0.00 54.97 54.70 1x51 s GLU 27 Cb -0.17 -1.51 0.02 0.00 0.26 0.00 0.00 34.13 32.74 1x51 s GLU 27 CO 0.04 0.39 -0.07 -1.14 -0.54 0.00 0.00 175.26 173.94 1x51 s GLN 28 N -0.38 1.44 0.05 4.30 0.74 -0.13 -1.54 119.66 124.14 1x51 s GLN 28 Ca 0.06 -0.24 -0.31 0.00 0.05 0.00 0.00 55.36 54.92 1x51 s GLN 28 Cb -0.08 -1.47 -0.07 0.00 1.10 0.00 0.00 33.01 32.49 1x51 s GLN 28 CO -0.00 -0.22 1.41 -1.25 -0.55 0.00 0.00 175.29 174.68 1x51 s PRO 29 N 1.54 4.30 0.00 1.67 0.04 -1.26 -2.54 135.00 138.74 1x51 s PRO 29 Ca 0.01 2.03 0.00 0.00 0.04 0.00 0.00 61.00 63.08 1x51 s PRO 29 Cb -0.13 -3.44 0.00 0.00 0.04 0.00 0.00 34.50 30.97 1x51 s PRO 29 CO -0.06 -0.52 0.00 0.41 0.04 0.00 0.00 177.00 176.87 1x51 n GLY 30 N 3.59 5.24 0.23 0.56 0.00 0.18 -4.91 105.19 110.09 1x51 n GLY 30 Ca 0.12 -2.09 -0.07 0.00 0.00 0.00 0.00 46.02 43.98 1x51 n GLY 30 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1x51 h ALA 31 N 1.00 0.69 -0.26 4.61 0.00 -2.04 -2.95 119.26 120.31 1x51 h ALA 31 Ca 0.00 -0.08 -0.13 0.00 0.00 0.00 0.00 54.91 54.70 1x51 h ALA 31 Cb 0.00 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 17.57 1x51 h ALA 31 CO 0.00 0.19 -0.35 -0.07 0.00 0.00 0.00 179.25 179.02 1x51 h LEU 32 N 0.72 0.76 0.00 0.00 3.38 -2.00 -3.49 115.31 114.69 1x51 h LEU 32 Ca 0.19 -0.50 0.00 0.00 0.09 0.00 0.00 57.88 57.66 1x51 h LEU 32 Cb 0.01 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 40.55 1x51 h LEU 32 CO -0.03 1.12 0.00 0.61 0.09 0.00 0.00 178.44 180.22 1x51 n GLY 33 N 0.27 -1.71 3.52 0.83 0.00 -1.11 -5.13 105.19 101.85 1x51 n GLY 33 Ca -0.05 0.72 0.00 0.00 0.00 0.00 0.00 46.02 46.70 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 -2.37 0.33 4.61 0.00 -1.26 0.51 121.76 122.58 1x51 s ALA 34 Ca 0.00 2.19 0.08 0.00 0.00 0.00 0.00 51.96 54.23 1x51 s ALA 34 Cb 0.00 -1.92 -0.04 0.00 0.00 0.00 0.00 23.12 21.15 1x51 s ALA 34 CO 0.00 -0.96 0.11 1.14 0.00 0.00 0.00 175.76 176.05 1x51 s GLN 35 N 2.70 2.35 0.51 0.00 -2.07 -1.05 -4.55 119.66 117.55 1x51 s GLN 35 Ca -0.04 -1.54 0.06 0.00 -1.82 0.00 0.00 55.36 52.03 1x51 s GLN 35 Cb -0.09 -2.16 0.02 0.00 -1.09 0.00 0.00 33.01 29.69 1x51 s GLN 35 CO -0.18 0.16 0.38 0.96 -1.32 0.00 0.00 175.29 175.29 1x51 s ILE 36 N -2.41 1.86 -0.02 3.63 -4.36 -0.55 -0.95 121.20 118.40 1x51 s ILE 36 Ca 0.36 -1.48 0.02 0.00 -0.26 0.00 0.00 60.65 59.29 1x51 s ILE 36 Cb -0.03 -2.35 -0.03 0.00 1.25 0.00 0.00 42.46 41.30 1x51 s ILE 36 CO 0.22 0.00 -0.04 -0.22 0.24 0.00 0.00 174.94 175.14 1x51 s LEU 37 N -4.23 3.32 -0.03 0.37 2.96 -0.12 -2.59 118.68 118.35 1x51 s LEU 37 Ca 0.37 -0.04 0.00 0.00 -0.22 0.00 0.00 54.13 54.24 1x51 s LEU 37 Cb -0.02 -1.85 0.03 0.00 0.50 0.00 0.00 46.19 44.85 1x51 s LEU 37 CO 0.22 0.31 -0.00 -0.22 -1.32 0.00 0.00 176.35 175.34 1x51 s LEU 38 N -1.26 1.16 0.07 -0.68 2.96 0.13 -4.71 118.68 116.35 1x51 s LEU 38 Ca 0.16 -0.04 0.07 0.00 -0.22 0.00 0.00 54.13 54.10 1x51 s LEU 38 Cb -0.11 -0.25 -0.04 0.00 0.50 0.00 0.00 46.19 46.29 1x51 s LEU 38 CO 0.06 -0.10 -0.14 0.68 -1.32 0.00 0.00 176.35 175.54 1x51 s VAL 39 N 1.04 3.11 0.48 1.68 -7.23 0.18 0.07 120.40 119.73 1x51 s VAL 39 Ca -0.10 -1.19 0.08 0.00 -1.81 0.00 0.00 61.98 58.96 1x51 s VAL 39 Cb -0.14 -2.38 0.03 0.00 0.56 0.00 0.00 36.38 34.45 1x51 s VAL 39 CO -0.02 0.24 0.56 0.00 -0.31 0.00 0.00 175.10 175.57 1x51 s GLN 40 N -1.78 2.53 0.20 4.82 -2.07 -1.19 -0.22 119.66 121.96 1x51 s GLN 40 Ca 0.18 -1.53 0.06 0.00 -1.82 0.00 0.00 55.36 52.25 1x51 s GLN 40 Cb -0.11 -2.54 -0.04 0.00 -1.09 0.00 0.00 33.01 29.23 1x51 s GLN 40 CO 0.09 -0.46 0.11 1.03 -1.32 0.00 0.00 175.29 174.75 1x51 s ARG 41 N -4.37 2.76 0.79 9.60 1.81 -1.13 -4.91 118.95 123.50 1x51 s ARG 41 Ca 0.52 -1.01 -0.13 0.00 -1.72 0.00 0.00 55.73 53.39 1x51 s ARG 41 Cb -0.06 -2.52 0.20 0.00 -0.45 0.00 0.00 34.95 32.11 1x51 s ARG 41 CO 0.32 0.45 0.70 -0.35 -0.68 0.00 0.00 175.30 175.74 1x51 n PRO 42 N -0.58 -2.40 -2.80 3.54 -0.04 -1.26 -4.04 135.00 127.42 1x51 n PRO 42 Ca -0.08 -1.13 -0.43 0.00 -0.04 0.00 0.00 63.50 61.82 1x51 n PRO 42 Cb 0.56 -1.06 -0.01 0.00 -0.04 0.00 0.00 33.50 32.95 1x51 n PRO 42 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 1x51 s ASN 43 N -3.40 6.85 -0.23 3.54 0.01 -1.26 -4.19 114.94 116.25 1x51 s ASN 43 Ca 0.46 -2.47 -0.29 0.00 -0.71 0.00 0.00 52.86 49.85 1x51 s ASN 43 Cb -0.05 -2.47 0.16 0.00 0.41 0.00 0.00 41.25 39.31 1x51 s ASN 43 CO 0.35 -1.01 1.19 -0.44 -1.51 0.00 0.00 177.10 175.68 1x51 s SER 44 N 3.62 -0.20 0.00 -1.22 0.01 -1.26 -5.14 113.70 109.51 1x51 s SER 44 Ca 0.44 0.23 0.00 0.00 1.31 0.00 0.00 55.95 57.92 1x51 s SER 44 Cb -0.01 0.18 0.00 0.00 0.21 0.00 0.00 66.02 66.39 1x51 s SER 44 CO -0.01 -0.18 0.00 0.61 0.41 0.00 0.00 173.24 174.07 1x51 n GLY 45 N 0.68 -1.61 0.29 3.44 0.00 -1.26 -4.34 105.19 102.39 1x51 n GLY 45 Ca -0.05 -1.79 -0.12 0.00 0.00 0.00 0.00 46.02 44.05 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 2.10 -2.39 0.99 7.99 -1.26 -4.64 117.00 119.79 1x51 n LEU 46 Ca 0.00 0.04 -0.29 0.00 -0.01 0.00 0.00 56.01 55.75 1x51 n LEU 46 Cb 0.00 -0.45 0.02 0.00 -0.11 0.00 0.00 43.42 42.88 1x51 n LEU 46 CO 0.00 0.54 1.45 0.18 -1.51 0.00 0.00 177.39 178.05 1x51 n LEU 47 N -3.24 7.04 -4.93 2.23 4.77 -1.26 -4.96 117.00 116.65 1x51 n LEU 47 Ca -0.26 -4.10 -0.25 0.00 -0.03 0.00 0.00 56.01 51.37 1x51 n LEU 47 Cb 0.73 -1.09 0.02 0.00 -2.33 0.00 0.00 43.42 40.75 1x51 n LEU 47 CO 0.08 1.54 0.42 0.00 -1.33 0.00 0.00 177.39 178.10 1x51 s ALA 48 N -2.82 3.48 -0.16 -1.18 0.00 -1.26 -4.38 121.76 115.45 1x51 s ALA 48 Ca 0.52 -0.79 0.00 0.00 0.00 0.00 0.00 51.96 51.69 1x51 s ALA 48 Cb 0.39 -2.43 0.00 0.00 0.00 0.00 0.00 23.12 21.08 1x51 s ALA 48 CO -0.15 -0.56 0.00 0.41 0.00 0.00 0.00 175.76 175.46 1x51 n GLY 49 N -2.34 0.37 3.57 0.00 0.00 -1.26 -5.04 105.19 100.49 1x51 n GLY 49 Ca 0.03 -0.88 -0.24 0.00 0.00 0.00 0.00 46.02 44.92 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 -0.45 2.93 -0.30 0.99 2.01 -1.26 -4.96 118.68 117.64 1x51 s LEU 50 Ca 0.00 -0.75 -0.05 0.00 0.01 0.00 0.00 54.13 53.33 1x51 s LEU 50 Cb 0.00 -1.50 0.02 0.00 0.01 0.00 0.00 46.19 44.73 1x51 s LEU 50 CO 0.00 0.04 0.05 0.26 1.01 0.00 0.00 176.35 177.72 1x51 s TRP 51 N -2.20 3.17 0.31 0.29 0.52 -0.72 -2.83 118.94 117.48 1x51 s TRP 51 Ca 0.29 -1.27 0.05 0.00 0.02 0.00 0.00 56.10 55.19 1x51 s TRP 51 Cb -0.07 -2.21 -0.03 0.00 -1.15 0.00 0.00 33.47 30.01 1x51 s TRP 51 CO 0.17 -0.66 0.21 -1.83 0.02 0.00 0.00 176.95 174.86 1x51 s GLU 52 N 1.42 1.63 0.49 4.98 1.03 0.70 -4.30 118.70 124.65 1x51 s GLU 52 Ca 0.00 -1.94 -0.20 0.00 0.03 0.00 0.00 54.97 52.87 1x51 s GLU 52 Cb -0.18 0.14 -0.08 0.00 -0.80 0.00 0.00 34.13 33.21 1x51 s GLU 52 CO 0.01 -0.54 1.03 -0.06 -1.33 0.00 0.00 175.26 174.37 1x51 s PHE 53 N -3.60 3.04 0.38 4.83 0.08 -1.26 0.50 117.98 121.95 1x51 s PHE 53 Ca 0.38 1.57 -0.26 0.00 0.12 0.00 0.00 56.93 58.74 1x51 s PHE 53 Cb 0.04 -3.03 -0.09 0.00 -0.57 0.00 0.00 43.02 39.37 1x51 s PHE 53 CO 0.21 -0.78 1.20 -1.25 -0.10 0.00 0.00 175.22 174.50 1x51 s PRO 54 N -3.33 4.13 0.09 0.24 0.04 -1.26 -4.82 135.00 130.08 1x51 s PRO 54 Ca 0.66 1.92 -0.08 0.00 0.04 0.00 0.00 61.00 63.54 1x51 s PRO 54 Cb -0.15 -2.78 -0.00 0.00 0.04 0.00 0.00 34.50 31.61 1x51 s PRO 54 CO 0.21 -0.28 0.18 -1.54 0.04 0.00 0.00 177.00 175.61 1x51 s SER 55 N -0.98 0.14 0.49 6.66 1.04 -1.26 -3.01 113.70 116.77 1x51 s SER 55 Ca 0.55 -0.67 0.02 0.00 0.48 0.00 0.00 55.95 56.33 1x51 s SER 55 Cb -0.33 0.33 -0.01 0.00 0.10 0.00 0.00 66.02 66.12 1x51 s SER 55 CO 0.42 -0.72 0.06 0.68 0.98 0.00 0.00 173.24 174.65 1x51 s VAL 56 N -3.86 0.83 0.28 5.02 -7.23 -0.63 -4.95 120.40 109.86 1x51 s VAL 56 Ca 0.05 -2.00 -0.30 0.00 -1.81 0.00 0.00 61.98 57.92 1x51 s VAL 56 Cb 0.05 -2.13 -0.10 0.00 0.56 0.00 0.00 36.38 34.76 1x51 s VAL 56 CO -0.11 0.00 1.43 0.42 -0.31 0.00 0.00 175.10 176.53 1x51 s THR 57 N -3.01 2.57 1.16 5.32 -4.23 -1.26 -2.22 115.64 113.97 1x51 s THR 57 Ca 0.09 0.50 -0.15 0.00 -1.18 0.00 0.00 61.69 60.95 1x51 s THR 57 Cb 0.01 -3.32 0.22 0.00 1.34 0.00 0.00 72.50 70.75 1x51 s THR 57 CO 0.06 0.09 0.62 1.87 -0.54 0.00 0.00 174.62 176.73 1x51 n TRP 58 N 1.86 -1.36 -3.71 3.99 -0.00 -1.20 -4.61 117.44 112.42 1x51 n TRP 58 Ca 0.05 -0.05 -0.12 0.00 -0.00 0.00 0.00 57.50 57.38 1x51 n TRP 58 Cb 0.40 -1.64 -0.10 0.00 -0.00 0.00 0.00 31.31 29.97 1x51 n TRP 58 CO 0.00 0.00 0.00 -1.21 -0.00 0.00 0.00 177.69 176.48 1x51 s GLU 59 N -4.02 0.49 0.55 5.87 0.41 -1.26 -4.95 118.70 115.79 1x51 s GLU 59 Ca 0.64 0.72 0.34 0.00 -0.41 0.00 0.00 54.97 56.26 1x51 s GLU 59 Cb -0.20 0.15 1.42 0.00 -1.78 0.00 0.00 34.13 33.71 1x51 s GLU 59 CO 0.66 -0.10 2.00 -1.00 -0.49 0.00 0.00 175.26 176.32 1x51 h PRO 60 N 6.15 0.00 -6.22 0.39 0.13 -1.98 -3.44 132.00 127.03 1x51 h PRO 60 Ca -0.31 0.00 -0.54 0.00 -0.87 0.00 0.00 66.00 64.28 1x51 h PRO 60 Cb 1.18 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.29 1x51 h PRO 60 CO 0.24 0.00 -0.33 0.45 -0.23 0.00 0.00 178.00 178.14 1x51 s SER 61 N -5.64 6.39 0.27 1.44 0.15 -1.26 -5.01 113.70 110.05 1x51 s SER 61 Ca 0.01 0.41 0.13 0.00 0.70 0.00 0.00 55.95 57.21 1x51 s SER 61 Cb 0.09 -2.02 0.28 0.00 -1.71 0.00 0.00 66.02 62.67 1x51 s SER 61 CO 0.53 -0.04 1.55 -0.08 1.20 0.00 0.00 173.24 176.40 1x51 h GLU 62 N 2.03 0.00 0.00 5.44 4.81 -2.02 -3.15 114.58 121.70 1x51 h GLU 62 Ca -0.48 0.00 -0.04 0.00 -0.13 0.00 0.00 59.36 58.72 1x51 h GLU 62 Cb 1.19 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.56 1x51 h GLU 62 CO 0.68 0.60 -0.41 0.37 -0.73 0.00 0.00 179.01 179.52 1x51 h GLN 63 N 0.00 0.00 -1.04 1.92 5.75 -1.96 -3.36 115.11 116.42 1x51 h GLN 63 Ca -0.01 0.00 0.37 0.00 -0.15 0.00 0.00 58.65 58.86 1x51 h GLN 63 Cb 1.24 0.00 -0.16 0.00 1.07 0.00 0.00 27.48 29.63 1x51 h GLN 63 CO 0.08 0.26 0.59 -0.07 -2.65 0.00 0.00 178.83 177.04 1x51 h LEU 64 N -1.00 0.42 -0.20 -2.39 4.07 -1.96 0.36 115.31 114.61 1x51 h LEU 64 Ca -0.05 0.21 0.05 0.00 0.08 0.00 0.00 57.88 58.16 1x51 h LEU 64 Cb 0.52 0.18 -0.05 0.00 1.08 0.00 0.00 40.66 42.39 1x51 h LEU 64 CO -0.03 -0.24 -0.13 -0.61 -1.08 0.00 0.00 178.44 176.35 1x51 h GLN 65 N 0.19 -0.11 -0.23 1.13 5.75 -1.70 -2.37 115.11 117.76 1x51 h GLN 65 Ca 0.78 0.01 -0.10 0.00 -0.15 0.00 0.00 58.65 59.18 1x51 h GLN 65 Cb 1.97 0.03 -0.00 0.00 1.07 0.00 0.00 27.48 30.54 1x51 h GLN 65 CO -0.64 -0.08 -0.26 0.00 -2.65 0.00 0.00 178.83 175.21 1x51 h ARG 66 N -0.12 0.59 -0.86 1.69 3.08 -0.52 -0.50 114.38 117.74 1x51 h ARG 66 Ca 0.11 -0.32 0.18 0.00 0.07 0.00 0.00 59.98 60.03 1x51 h ARG 66 Cb 0.29 0.02 -0.16 0.00 0.08 0.00 0.00 29.97 30.19 1x51 h ARG 66 CO -0.27 0.92 -0.15 0.87 -1.07 0.00 0.00 179.97 180.27 1x51 h LYS 67 N 0.29 0.02 0.00 0.04 1.57 -0.68 -1.59 116.57 116.22 1x51 h LYS 67 Ca 0.03 -0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.78 1x51 h LYS 67 Cb 0.83 -0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.13 1x51 h LYS 67 CO 0.06 0.01 -0.18 0.00 -0.57 0.00 0.00 179.45 178.77 1x51 h ALA 68 N 1.85 0.03 -1.09 3.86 0.00 -1.44 -3.01 119.26 119.46 1x51 h ALA 68 Ca 0.44 -0.46 0.36 0.00 0.00 0.00 0.00 54.91 55.25 1x51 h ALA 68 Cb 0.72 0.12 -0.09 0.00 0.00 0.00 0.00 17.79 18.54 1x51 h ALA 68 CO -0.85 0.11 0.73 -0.11 0.00 0.00 0.00 179.25 179.13 1x51 n LEU 69 N -4.63 0.12 -0.09 0.00 7.94 -0.20 0.10 117.00 120.24 1x51 n LEU 69 Ca -0.10 0.94 -0.20 0.00 -1.11 0.00 0.00 56.01 55.54 1x51 n LEU 69 Cb 0.37 -0.46 -0.12 0.00 0.53 0.00 0.00 43.42 43.74 1x51 n LEU 69 CO 0.22 -1.01 -0.26 -0.07 -1.11 0.00 0.00 177.39 175.17 1x51 h LEU 70 N 0.00 0.01 -1.54 -1.96 3.38 -1.42 -3.25 115.31 110.53 1x51 h LEU 70 Ca 0.65 -0.66 0.48 0.00 0.09 0.00 0.00 57.88 58.44 1x51 h LEU 70 Cb 2.20 -0.00 -0.12 0.00 0.09 0.00 0.00 40.66 42.83 1x51 h LEU 70 CO -0.26 1.35 0.99 0.06 0.09 0.00 0.00 178.44 180.67 1x51 h GLN 71 N -0.99 0.03 0.09 1.13 3.07 0.84 0.81 115.11 120.09 1x51 h GLN 71 Ca -0.25 -0.00 -0.00 0.00 0.09 0.00 0.00 58.65 58.49 1x51 h GLN 71 Cb 1.22 -0.01 0.00 0.00 0.08 0.00 0.00 27.48 28.78 1x51 h GLN 71 CO -0.15 0.02 -0.04 1.49 0.09 0.00 0.00 178.83 180.24 1x51 h GLU 72 N 0.03 -0.12 -0.99 0.06 4.57 -1.47 -3.30 114.58 113.37 1x51 h GLU 72 Ca 0.87 0.01 0.22 0.00 -1.18 0.00 0.00 59.36 59.27 1x51 h GLU 72 Cb 2.93 0.03 -0.19 0.00 -0.16 0.00 0.00 28.75 31.36 1x51 h GLU 72 CO -0.34 0.14 -0.18 1.28 -1.18 0.00 0.00 179.01 178.73 1x51 n LEU 73 N -4.83 -0.29 -0.18 1.64 4.77 0.20 0.73 117.00 119.04 1x51 n LEU 73 Ca -0.04 1.69 -0.01 0.00 -0.03 0.00 0.00 56.01 57.63 1x51 n LEU 73 Cb 0.15 -0.54 0.08 0.00 -2.33 0.00 0.00 43.42 40.79 1x51 n LEU 73 CO 0.12 -1.65 0.87 1.56 -1.33 0.00 0.00 177.39 176.97 1x51 h GLN 74 N 0.00 0.17 -0.77 3.23 4.20 -1.47 0.22 115.11 120.70 1x51 h GLN 74 Ca 0.51 -0.01 0.22 0.00 0.06 0.00 0.00 58.65 59.43 1x51 h GLN 74 Cb 0.86 -0.04 -0.03 0.00 0.30 0.00 0.00 27.48 28.57 1x51 h GLN 74 CO -0.99 0.11 0.71 0.00 -0.67 0.00 0.00 178.83 177.99 1x51 h ARG 75 N 0.18 0.00 0.00 1.46 3.08 0.24 -1.35 114.38 117.98 1x51 h ARG 75 Ca 0.28 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.33 1x51 h ARG 75 Cb 0.43 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.48 1x51 h ARG 75 CO -0.42 0.00 0.00 0.91 -1.07 0.00 0.00 179.97 179.39 1x51 n TRP 76 N -3.79 0.00 0.00 3.04 7.02 0.68 -4.74 117.44 119.65 1x51 n TRP 76 Ca 0.16 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.64 1x51 n TRP 76 Cb 0.98 -0.17 0.00 0.00 -2.42 0.00 0.00 31.31 29.70 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 -1.90 -0.02 0.00 6.99 0.00 -0.59 -4.02 120.51 120.98 1x51 n ALA 77 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 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 1.86 -0.61 3.66 0.00 0.00 -0.52 -4.60 105.19 104.98 1x51 n GLY 78 Ca 0.00 0.20 -0.43 0.00 0.00 0.00 0.00 46.02 45.80 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 4.17 -0.06 1.61 0.04 -1.26 -3.99 135.00 135.50 1x51 s PRO 79 Ca 0.00 1.99 0.03 0.00 0.04 0.00 0.00 61.00 63.06 1x51 s PRO 79 Cb 0.00 -3.92 0.01 0.00 0.04 0.00 0.00 34.50 30.63 1x51 s PRO 79 CO 0.00 -0.84 -0.14 -0.51 0.04 0.00 0.00 177.00 175.55 1x51 s LEU 80 N 3.97 1.76 1.24 -3.56 2.01 -1.26 -5.00 118.68 117.83 1x51 s LEU 80 Ca 0.68 -0.33 -0.20 0.00 0.01 0.00 0.00 54.13 54.28 1x51 s LEU 80 Cb -0.29 -0.91 0.30 0.00 0.01 0.00 0.00 46.19 45.30 1x51 s LEU 80 CO 0.25 0.07 1.11 -2.16 1.01 0.00 0.00 176.35 176.63 1x51 s PRO 81 N 0.48 -1.52 0.13 1.29 0.04 -1.26 -5.05 135.00 129.11 1x51 s PRO 81 Ca -0.13 -0.17 0.00 0.00 0.04 0.00 0.00 61.00 60.75 1x51 s PRO 81 Cb -0.15 -1.57 0.00 0.00 0.04 0.00 0.00 34.50 32.82 1x51 s PRO 81 CO 0.04 -3.89 0.00 0.00 0.04 0.00 0.00 177.00 173.19 1x51 n ALA 82 N -4.86 3.00 -0.09 8.56 0.00 -1.26 -4.73 120.51 121.12 1x51 n ALA 82 Ca 0.15 0.00 -0.06 0.00 0.00 0.00 0.00 53.44 53.53 1x51 n ALA 82 Cb 0.60 0.17 0.01 0.00 0.00 0.00 0.00 19.45 20.22 1x51 n ALA 82 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 1x51 h THR 83 N 0.00 0.71 -0.73 0.00 1.35 -2.03 -2.03 112.91 110.17 1x51 h THR 83 Ca 0.00 -0.02 0.16 0.00 -0.55 0.00 0.00 66.41 66.01 1x51 h THR 83 Cb 0.00 0.66 -0.13 0.00 -1.73 0.00 0.00 68.15 66.95 1x51 h THR 83 CO 0.00 0.01 0.01 0.45 -0.25 0.00 0.00 175.52 175.73 1x51 h HIS 84 N 0.04 -0.04 -1.49 4.73 -0.00 -1.96 -3.41 115.15 113.02 1x51 h HIS 84 Ca 0.16 0.05 -0.69 0.00 -0.00 0.00 0.00 60.37 59.89 1x51 h HIS 84 Cb 0.23 0.13 0.08 0.00 -0.00 0.00 0.00 27.41 27.86 1x51 h HIS 84 CO -0.27 -0.22 0.06 -0.11 -0.00 0.00 0.00 177.93 177.38 1x51 n LEU 85 N -5.33 0.57 -3.67 2.43 7.94 -0.77 -4.86 117.00 113.31 1x51 n LEU 85 Ca 0.13 1.14 -0.10 0.00 -1.11 0.00 0.00 56.01 56.07 1x51 n LEU 85 Cb 0.45 -1.08 -0.08 0.00 0.53 0.00 0.00 43.42 43.23 1x51 n LEU 85 CO 0.06 -1.79 0.24 -0.13 -1.11 0.00 0.00 177.39 174.66 1x51 s ARG 86 N -0.37 0.61 -0.02 1.96 0.52 -1.07 -5.02 118.95 115.57 1x51 s ARG 86 Ca 0.77 0.97 -0.30 0.00 -0.52 0.00 0.00 55.73 56.65 1x51 s ARG 86 Cb -0.99 0.16 -0.04 0.00 0.52 0.00 0.00 34.95 34.60 1x51 s ARG 86 CO 0.54 -0.13 1.28 -1.58 0.02 0.00 0.00 175.30 175.43 1x51 s HIS 87 N 1.13 3.10 -0.38 -0.53 5.65 -1.26 -1.17 115.29 121.82 1x51 s HIS 87 Ca -0.07 1.08 0.02 0.00 0.25 0.00 0.00 55.06 56.34 1x51 s HIS 87 Cb -0.06 -3.51 0.12 0.00 -1.18 0.00 0.00 32.58 27.95 1x51 s HIS 87 CO -0.11 -1.74 0.16 -0.51 -0.65 0.00 0.00 174.74 171.89 1x51 s LEU 88 N 2.11 3.02 0.00 8.88 1.43 -0.35 -4.92 118.68 128.84 1x51 s LEU 88 Ca 0.59 -2.24 0.00 0.00 -1.03 0.00 0.00 54.13 51.46 1x51 s LEU 88 Cb -0.28 -1.13 0.00 0.00 0.03 0.00 0.00 46.19 44.81 1x51 s LEU 88 CO 0.25 -0.33 0.00 0.61 0.23 0.00 0.00 176.35 177.10 1x51 n GLY 89 N 4.08 -1.82 3.43 -3.19 0.00 -1.26 -4.50 105.19 101.93 1x51 n GLY 89 Ca 0.04 -1.29 -0.10 0.00 0.00 0.00 0.00 46.02 44.67 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 -0.78 1.36 -0.23 1.61 -1.05 -1.26 -2.81 118.70 115.54 1x51 s GLU 90 Ca 0.00 -1.33 -0.04 0.00 -0.15 0.00 0.00 54.97 53.46 1x51 s GLU 90 Cb 0.00 0.40 0.08 0.00 -0.44 0.00 0.00 34.13 34.16 1x51 s GLU 90 CO 0.00 -0.52 0.09 0.08 0.95 0.00 0.00 175.26 175.85 1x51 s VAL 91 N -4.04 0.22 -0.32 1.83 1.01 -0.54 -4.82 120.40 113.73 1x51 s VAL 91 Ca 0.25 -0.60 0.03 0.00 0.00 0.00 0.00 61.98 61.66 1x51 s VAL 91 Cb 0.02 -0.96 0.09 0.00 0.00 0.00 0.00 36.38 35.53 1x51 s VAL 91 CO 0.07 -0.43 0.02 -0.69 0.00 0.00 0.00 175.10 174.08 1x51 s VAL 92 N 1.98 2.39 -0.40 2.92 1.01 -1.26 -0.62 120.40 126.41 1x51 s VAL 92 Ca 0.04 -2.09 -0.16 0.00 0.00 0.00 0.00 61.98 59.77 1x51 s VAL 92 Cb -0.16 -2.64 0.01 0.00 0.00 0.00 0.00 36.38 33.59 1x51 s VAL 92 CO -0.18 -0.44 0.35 -2.28 0.00 0.00 0.00 175.10 172.55 1x51 s HIS 93 N 0.99 3.21 -0.48 5.22 2.46 -1.11 -4.98 115.29 120.61 1x51 s HIS 93 Ca 0.05 -0.42 -0.27 0.00 0.47 0.00 0.00 55.06 54.89 1x51 s HIS 93 Cb -0.20 -2.69 0.03 0.00 -0.13 0.00 0.00 32.58 29.59 1x51 s HIS 93 CO -0.06 -0.59 1.04 0.99 -2.47 0.00 0.00 174.74 173.65 1x51 s THR 94 N 1.88 4.32 0.58 0.89 2.01 -1.26 -2.85 115.64 121.20 1x51 s THR 94 Ca 0.08 0.96 -0.09 0.00 0.31 0.00 0.00 61.69 62.96 1x51 s THR 94 Cb -0.18 -4.53 0.13 0.00 0.01 0.00 0.00 72.50 67.93 1x51 s THR 94 CO 0.11 -0.95 0.78 0.49 -0.69 0.00 0.00 174.62 174.37 1x51 n PHE 95 N 7.56 -3.90 0.08 4.92 3.72 0.22 -4.99 117.46 125.08 1x51 n PHE 95 Ca 0.09 -0.75 -0.05 0.00 -0.05 0.00 0.00 57.45 56.68 1x51 n PHE 95 Cb 0.49 -0.60 -0.03 0.00 -0.94 0.00 0.00 39.48 38.39 1x51 n PHE 95 CO 0.00 0.00 0.00 0.77 -0.05 0.00 0.00 176.76 177.48 1x51 h SER 96 N -0.98 -0.43 -0.02 4.37 0.02 -2.05 -3.32 113.55 111.14 1x51 h SER 96 Ca -0.25 0.04 -0.01 0.00 -0.84 0.00 0.00 61.79 60.72 1x51 h SER 96 Cb 0.72 0.14 -0.01 0.00 0.14 0.00 0.00 62.40 63.40 1x51 h SER 96 CO 0.19 -0.20 -0.27 0.00 -1.14 0.00 0.00 176.83 175.41 1x51 n HIS 97 N -3.25 0.08 -3.91 3.45 -0.00 -1.26 -5.02 115.22 105.31 1x51 n HIS 97 Ca -0.03 -1.29 -0.11 0.00 -0.00 0.00 0.00 57.72 56.29 1x51 n HIS 97 Cb 0.14 -0.22 -0.11 0.00 -0.00 0.00 0.00 29.99 29.79 1x51 n HIS 97 CO 0.00 0.00 0.00 0.42 -0.00 0.00 0.00 176.34 176.76 1x51 s ILE 98 N -3.09 0.08 -0.23 0.61 1.01 -1.25 -4.50 121.20 113.83 1x51 s ILE 98 Ca 0.36 -0.63 0.00 0.00 0.00 0.00 0.00 60.65 60.38 1x51 s ILE 98 Cb 0.34 -0.30 0.06 0.00 0.01 0.00 0.00 42.46 42.57 1x51 s ILE 98 CO -0.02 -0.35 -0.04 -0.75 0.00 0.00 0.00 174.94 173.78 1x51 s LYS 99 N -1.11 1.45 -0.09 2.79 2.20 -0.97 0.71 119.74 124.72 1x51 s LYS 99 Ca -0.12 -0.89 -0.09 0.00 -0.36 0.00 0.00 55.97 54.51 1x51 s LYS 99 Cb -0.07 -2.51 -0.04 0.00 -1.51 0.00 0.00 37.83 33.70 1x51 s LYS 99 CO 0.00 -0.61 0.21 -0.51 -0.36 0.00 0.00 175.35 174.08 1x51 s LEU 100 N 1.48 4.41 -0.29 5.43 2.01 -1.13 -3.61 118.68 126.98 1x51 s LEU 100 Ca -0.05 0.60 0.00 0.00 0.01 0.00 0.00 54.13 54.69 1x51 s LEU 100 Cb -0.19 -2.20 0.09 0.00 0.01 0.00 0.00 46.19 43.90 1x51 s LEU 100 CO -0.06 0.39 0.06 -0.89 1.01 0.00 0.00 176.35 176.85 1x51 s THR 101 N -1.04 1.22 0.03 5.49 2.01 -0.82 -2.73 115.64 119.79 1x51 s THR 101 Ca 0.17 -1.46 0.00 0.00 0.31 0.00 0.00 61.69 60.72 1x51 s THR 101 Cb -0.13 -1.82 -0.04 0.00 0.01 0.00 0.00 72.50 70.52 1x51 s THR 101 CO 0.06 -0.51 0.12 -0.31 -0.69 0.00 0.00 174.62 173.29 1x51 s TYR 102 N 1.47 3.33 -0.30 4.92 1.51 0.21 -2.03 117.35 126.45 1x51 s TYR 102 Ca 0.06 0.20 -0.06 0.00 -1.01 0.00 0.00 57.07 56.26 1x51 s TYR 102 Cb -0.18 -1.72 0.02 0.00 -0.11 0.00 0.00 41.96 39.97 1x51 s TYR 102 CO -0.17 0.56 0.06 -0.65 -1.11 0.00 0.00 175.55 174.25 1x51 s GLN 103 N -2.09 2.88 -0.03 -0.62 -1.52 -0.90 -1.47 119.66 115.91 1x51 s GLN 103 Ca 0.27 -0.99 -0.30 0.00 -1.95 0.00 0.00 55.36 52.39 1x51 s GLN 103 Cb -0.12 -3.34 -0.05 0.00 -0.22 0.00 0.00 33.01 29.28 1x51 s GLN 103 CO 0.19 -0.51 1.37 0.08 -0.25 0.00 0.00 175.29 176.17 1x51 s VAL 104 N 1.43 3.84 -0.02 1.09 1.01 -1.12 -2.17 120.40 124.47 1x51 s VAL 104 Ca 0.01 1.19 0.03 0.00 0.00 0.00 0.00 61.98 63.21 1x51 s VAL 104 Cb -0.18 -3.76 -0.01 0.00 0.00 0.00 0.00 36.38 32.43 1x51 s VAL 104 CO 0.01 -0.02 -0.11 -0.31 0.00 0.00 0.00 175.10 174.67 1x51 s TYR 105 N 2.59 1.06 -0.04 5.22 2.02 -0.64 -1.21 117.35 126.35 1x51 s TYR 105 Ca 0.62 -0.23 0.00 0.00 -0.37 0.00 0.00 57.07 57.10 1x51 s TYR 105 Cb -0.29 -0.70 -0.03 0.00 -0.40 0.00 0.00 41.96 40.53 1x51 s TYR 105 CO 0.25 -0.05 0.00 0.20 -1.57 0.00 0.00 175.55 174.38 1x51 s GLY 106 N -0.12 1.86 -0.29 0.71 0.00 -0.32 0.29 107.32 109.45 1x51 s GLY 106 Ca 0.02 -0.89 -0.14 0.00 0.00 0.00 0.00 44.72 43.71 1x51 s GLY 106 CO -0.00 -0.71 0.73 -2.27 0.00 0.00 0.00 173.10 170.85 1x51 s LEU 107 N -1.27 -0.95 0.07 0.66 1.98 0.05 -2.59 118.68 116.63 1x51 s LEU 107 Ca 0.17 1.41 -0.07 0.00 -2.89 0.00 0.00 54.13 52.75 1x51 s LEU 107 Cb -0.11 2.24 -0.01 0.00 0.66 0.00 0.00 46.19 48.97 1x51 s LEU 107 CO 0.07 -0.21 0.14 0.00 -1.89 0.00 0.00 176.35 174.45 1x51 s ALA 108 N 2.10 -0.10 -0.27 5.97 0.00 -1.26 -1.64 121.76 126.57 1x51 s ALA 108 Ca -0.08 -0.65 -0.14 0.00 0.00 0.00 0.00 51.96 51.09 1x51 s ALA 108 Cb -0.07 0.38 -0.04 0.00 0.00 0.00 0.00 23.12 23.38 1x51 s ALA 108 CO -0.19 -0.43 0.34 -0.51 0.00 0.00 0.00 175.76 174.98 1x51 s LEU 109 N -2.62 4.03 0.25 0.00 1.43 -0.59 -4.95 118.68 116.24 1x51 s LEU 109 Ca 0.02 0.24 0.01 0.00 -1.03 0.00 0.00 54.13 53.37 1x51 s LEU 109 Cb 0.03 -2.38 0.31 0.00 0.03 0.00 0.00 46.19 44.19 1x51 s LEU 109 CO -0.09 -0.16 1.65 1.05 0.23 0.00 0.00 176.35 179.03 1x51 h GLU 110 N 8.20 0.50 0.00 1.70 4.11 -1.99 -3.37 114.58 123.73 1x51 h GLU 110 Ca -0.32 -0.22 0.00 0.00 0.07 0.00 0.00 59.36 58.88 1x51 h GLU 110 Cb 1.17 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.41 1x51 h GLU 110 CO 0.63 0.78 0.00 0.41 0.07 0.00 0.00 179.01 180.90 1x51 n GLY 111 N -0.17 -0.66 0.54 1.06 0.00 -1.26 -4.99 105.19 99.72 1x51 n GLY 111 Ca -0.01 0.17 0.00 0.00 0.00 0.00 0.00 46.02 46.18 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 0.00 -3.76 1.61 1.13 -1.26 -5.11 117.38 109.99 1x51 n GLN 112 Ca 0.00 0.00 -0.13 0.00 -1.94 0.00 0.00 57.00 54.93 1x51 n GLN 112 Cb 0.00 -0.07 -0.11 0.00 0.11 0.00 0.00 30.24 30.17 1x51 n GLN 112 CO 0.00 0.00 0.00 0.95 -1.44 0.00 0.00 177.06 176.57 1x51 s THR 113 N -0.69 -0.01 1.03 5.09 -4.23 -1.26 -5.17 115.64 110.41 1x51 s THR 113 Ca 0.00 0.03 -0.13 0.00 -1.18 0.00 0.00 61.69 60.41 1x51 s THR 113 Cb 0.00 -0.44 0.21 0.00 1.34 0.00 0.00 72.50 73.61 1x51 s THR 113 CO 0.00 0.01 1.09 -2.16 -0.54 0.00 0.00 174.62 173.02 1x51 s PRO 114 N 0.40 0.14 -0.25 3.99 0.04 -1.26 -5.02 135.00 133.05 1x51 s PRO 114 Ca -0.02 0.43 0.02 0.00 0.04 0.00 0.00 61.00 61.47 1x51 s PRO 114 Cb -0.04 -1.71 -0.16 0.00 0.04 0.00 0.00 34.50 32.63 1x51 s PRO 114 CO -0.02 -2.90 -0.22 1.55 0.04 0.00 0.00 177.00 175.45 1x51 n VAL 115 N -4.28 1.43 -2.68 -0.36 3.14 -1.26 -4.95 118.33 109.36 1x51 n VAL 115 Ca 0.06 -0.55 -0.14 0.00 -2.96 0.00 0.00 64.34 60.75 1x51 n VAL 115 Cb 0.58 -1.36 -0.03 0.00 -1.06 0.00 0.00 33.84 31.97 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 -3.22 0.00 -3.67 1.55 -2.24 -1.26 -4.81 114.28 100.63 1x51 n THR 116 Ca -0.44 0.00 -0.09 0.00 -2.27 0.00 0.00 64.05 61.25 1x51 n THR 116 Cb 0.97 -0.16 -0.09 0.00 -2.10 0.00 0.00 70.33 68.95 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 -1.93 -0.03 -0.28 4.28 2.01 -1.26 -5.16 115.64 113.27 1x51 s THR 117 Ca 0.27 0.05 -0.23 0.00 0.31 0.00 0.00 61.69 62.09 1x51 s THR 117 Cb -0.16 -0.79 0.11 0.00 0.01 0.00 0.00 72.50 71.67 1x51 s THR 117 CO 0.33 0.02 0.89 0.54 -0.69 0.00 0.00 174.62 175.71 1x51 s VAL 118 N 1.54 0.00 0.88 3.82 0.11 -1.26 -4.33 120.40 121.16 1x51 s VAL 118 Ca -0.10 0.00 -0.11 0.00 -2.93 0.00 0.00 61.98 58.84 1x51 s VAL 118 Cb -0.07 -1.00 0.12 0.00 -1.53 0.00 0.00 36.38 33.90 1x51 s VAL 118 CO -0.16 0.00 1.09 -2.16 -3.33 0.00 0.00 175.10 170.54 1x51 s PRO 119 N 0.59 1.42 0.00 1.54 0.04 -1.26 -4.90 135.00 132.43 1x51 s PRO 119 Ca -0.01 0.88 0.11 0.00 0.04 0.00 0.00 61.00 62.02 1x51 s PRO 119 Cb -0.05 -1.82 0.67 0.00 0.04 0.00 0.00 34.50 33.34 1x51 s PRO 119 CO -0.07 -2.15 1.10 -0.35 0.04 0.00 0.00 177.00 175.58 1x51 n PRO 120 N -3.83 0.49 -0.68 0.56 -0.04 -1.26 -2.53 135.00 127.71 1x51 n PRO 120 Ca 0.07 0.00 0.03 0.00 -0.04 0.00 0.00 63.50 63.57 1x51 n PRO 120 Cb 0.55 -1.36 0.28 0.00 -0.04 0.00 0.00 33.50 32.93 1x51 n PRO 120 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1x51 n GLY 121 N -0.02 3.97 3.41 0.55 0.00 -1.26 -4.99 105.19 106.84 1x51 n GLY 121 Ca 0.08 -1.05 -0.12 0.00 0.00 0.00 0.00 46.02 44.93 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 -2.92 0.66 -0.21 4.61 0.00 -1.05 -3.14 121.76 119.71 1x51 s ALA 122 Ca 0.47 -1.41 -0.18 0.00 0.00 0.00 0.00 51.96 50.83 1x51 s ALA 122 Cb 0.38 1.23 0.05 0.00 0.00 0.00 0.00 23.12 24.79 1x51 s ALA 122 CO 0.09 -0.74 0.54 -0.98 0.00 0.00 0.00 175.76 174.68 1x51 s ARG 123 N -3.75 0.63 -0.46 0.00 1.70 0.11 -4.92 118.95 112.25 1x51 s ARG 123 Ca 0.31 0.77 -0.12 0.00 -0.47 0.00 0.00 55.73 56.22 1x51 s ARG 123 Cb 0.02 0.29 0.09 0.00 -0.57 0.00 0.00 34.95 34.78 1x51 s ARG 123 CO 0.15 -0.08 0.36 -1.58 -1.08 0.00 0.00 175.30 173.06 1x51 s TRP 124 N 0.38 3.30 0.37 5.89 0.52 -1.26 -0.69 118.94 127.45 1x51 s TRP 124 Ca -0.01 -1.33 0.07 0.00 0.02 0.00 0.00 56.10 54.86 1x51 s TRP 124 Cb -0.04 -3.23 -0.07 0.00 -1.15 0.00 0.00 33.47 28.97 1x51 s TRP 124 CO -0.01 -0.88 -0.02 -0.48 0.02 0.00 0.00 176.95 175.58 1x51 s LEU 125 N 1.52 2.71 0.70 2.99 0.05 -1.07 -5.00 118.68 120.58 1x51 s LEU 125 Ca 0.04 -1.30 -0.11 0.00 0.05 0.00 0.00 54.13 52.80 1x51 s LEU 125 Cb -0.25 -0.84 0.01 0.00 -2.05 0.00 0.00 46.19 43.06 1x51 s LEU 125 CO 0.03 -0.38 1.09 0.42 -0.55 0.00 0.00 176.35 176.96 1x51 s THR 126 N -2.78 3.60 0.25 5.48 -4.23 -1.26 -1.48 115.64 115.22 1x51 s THR 126 Ca 0.34 0.52 -0.03 0.00 -1.18 0.00 0.00 61.69 61.33 1x51 s THR 126 Cb 0.07 -3.49 0.22 0.00 1.34 0.00 0.00 72.50 70.64 1x51 s THR 126 CO 0.17 -0.68 1.79 1.56 -0.54 0.00 0.00 174.62 176.91 1x51 h GLN 127 N -0.66 0.67 0.31 3.99 4.20 -1.91 -2.00 115.11 119.73 1x51 h GLN 127 Ca -0.45 -0.04 -0.02 0.00 0.06 0.00 0.00 58.65 58.20 1x51 h GLN 127 Cb 1.25 -0.15 0.00 0.00 0.30 0.00 0.00 27.48 28.88 1x51 h GLN 127 CO 0.63 0.45 -0.15 0.93 -0.67 0.00 0.00 178.83 180.02 1x51 h GLU 128 N 0.69 -0.40 -1.15 1.46 5.08 -1.96 -2.91 114.58 115.39 1x51 h GLU 128 Ca 0.41 0.03 0.33 0.00 -1.00 0.00 0.00 59.36 59.13 1x51 h GLU 128 Cb 0.47 0.09 -0.09 0.00 0.50 0.00 0.00 28.75 29.73 1x51 h GLU 128 CO -0.29 -0.11 0.77 0.93 -1.00 0.00 0.00 179.01 179.31 1x51 h GLU 129 N -0.70 0.21 0.53 2.33 5.08 -1.83 -0.63 114.58 119.57 1x51 h GLU 129 Ca -0.04 -0.01 -0.03 0.00 -1.00 0.00 0.00 59.36 58.28 1x51 h GLU 129 Cb 0.48 -0.05 0.01 0.00 0.50 0.00 0.00 28.75 29.69 1x51 h GLU 129 CO 0.07 0.14 -0.25 0.35 -1.00 0.00 0.00 179.01 178.32 1x51 h PHE 130 N 0.22 -0.66 -0.88 4.33 3.04 -1.19 -0.04 116.94 121.76 1x51 h PHE 130 Ca 0.63 -0.02 0.14 0.00 3.98 0.00 0.00 57.97 62.71 1x51 h PHE 130 Cb 1.96 0.22 -0.14 0.00 2.56 0.00 0.00 35.95 40.55 1x51 h PHE 130 CO -0.00 -0.33 -0.34 0.72 -2.02 0.00 0.00 178.31 176.33 1x51 n HIS 131 N -5.31 0.03 -0.05 0.41 8.25 -0.25 -0.11 115.22 118.19 1x51 n HIS 131 Ca -0.11 1.08 -0.13 0.00 -0.26 0.00 0.00 57.72 58.30 1x51 n HIS 131 Cb 0.32 -0.83 -0.07 0.00 1.12 0.00 0.00 29.99 30.53 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 1.34 -1.43 1.59 1.35 -1.53 -3.46 112.91 110.77 1x51 h THR 132 Ca 0.31 -1.30 -0.62 0.00 -0.55 0.00 0.00 66.41 64.25 1x51 h THR 132 Cb 0.53 1.87 0.14 0.00 -1.73 0.00 0.00 68.15 68.95 1x51 h THR 132 CO -0.87 0.38 -0.80 0.00 -0.25 0.00 0.00 175.52 173.98 1x51 n ALA 133 N -2.42 -2.91 -1.85 6.62 0.00 0.85 -4.71 120.51 116.08 1x51 n ALA 133 Ca -0.06 0.20 -0.40 0.00 0.00 0.00 0.00 53.44 53.18 1x51 n ALA 133 Cb 0.36 -1.47 -0.03 0.00 0.00 0.00 0.00 19.45 18.32 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 -1.43 2.36 0.06 0.00 0.00 -1.26 -4.95 121.76 116.54 1x51 s ALA 134 Ca 0.59 0.02 0.04 0.00 0.00 0.00 0.00 51.96 52.61 1x51 s ALA 134 Cb -0.70 -4.18 -0.03 0.00 0.00 0.00 0.00 23.12 18.21 1x51 s ALA 134 CO 0.59 -3.44 -0.11 0.08 0.00 0.00 0.00 175.76 172.87 1x51 s VAL 135 N 8.95 0.87 0.59 0.00 1.01 -1.26 -1.75 120.40 128.81 1x51 s VAL 135 Ca 0.83 -1.17 -0.18 0.00 0.00 0.00 0.00 61.98 61.46 1x51 s VAL 135 Cb -0.20 -0.87 -0.04 0.00 0.00 0.00 0.00 36.38 35.28 1x51 s VAL 135 CO 0.28 -0.26 1.15 -0.44 0.00 0.00 0.00 175.10 175.84 1x51 s SER 136 N -1.59 5.36 0.17 3.32 0.01 -1.26 -4.76 113.70 114.94 1x51 s SER 136 Ca -0.05 2.22 -0.24 0.00 1.31 0.00 0.00 55.95 59.19 1x51 s SER 136 Cb -0.10 -2.58 0.04 0.00 0.21 0.00 0.00 66.02 63.60 1x51 s SER 136 CO 0.01 -1.47 1.58 0.74 0.41 0.00 0.00 173.24 174.52 1x51 h THR 137 N 0.80 0.15 0.03 1.44 2.02 -2.01 0.18 112.91 115.52 1x51 h THR 137 Ca -0.49 0.00 0.01 0.00 0.77 0.00 0.00 66.41 66.69 1x51 h THR 137 Cb 1.27 0.15 -0.02 0.00 -1.74 0.00 0.00 68.15 67.81 1x51 h THR 137 CO 0.55 0.00 -0.20 0.00 0.37 0.00 0.00 175.52 176.25 1x51 h ALA 138 N 0.65 -0.71 -0.75 6.16 0.00 -1.98 -1.98 119.26 120.65 1x51 h ALA 138 Ca 0.17 -0.04 0.17 0.00 0.00 0.00 0.00 54.91 55.21 1x51 h ALA 138 Cb 0.56 0.63 -0.13 0.00 0.00 0.00 0.00 17.79 18.85 1x51 h ALA 138 CO -0.60 -0.76 -0.02 0.52 0.00 0.00 0.00 179.25 178.39 1x51 h MET 139 N -0.27 0.09 -0.98 0.00 2.07 -1.86 0.53 114.93 114.50 1x51 h MET 139 Ca -0.00 -0.01 0.24 0.00 -2.07 0.00 0.00 59.70 57.87 1x51 h MET 139 Cb 0.28 -0.02 -0.07 0.00 -1.87 0.00 0.00 31.60 29.91 1x51 h MET 139 CO -0.11 0.06 0.65 0.87 1.07 0.00 0.00 176.91 179.45 1x51 h LYS 140 N 0.09 0.33 -0.04 1.72 1.57 -0.15 0.31 116.57 120.39 1x51 h LYS 140 Ca 0.40 -0.02 -0.19 0.00 -1.87 0.00 0.00 60.65 58.97 1x51 h LYS 140 Cb 0.70 -0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.93 1x51 h LYS 140 CO -0.67 0.22 -0.79 0.87 -0.57 0.00 0.00 179.45 178.50 1x51 h LYS 141 N 0.34 0.34 0.00 3.15 1.57 0.76 -3.05 116.57 119.69 1x51 h LYS 141 Ca 0.53 -0.31 0.00 0.00 -1.87 0.00 0.00 60.65 59.00 1x51 h LYS 141 Cb 1.43 0.07 0.00 0.00 0.08 0.00 0.00 32.23 33.81 1x51 h LYS 141 CO -0.20 0.97 0.22 0.28 -0.57 0.00 0.00 179.45 180.15 1x51 h VAL 142 N 0.22 0.00 0.00 0.50 2.07 0.21 -2.08 116.25 117.17 1x51 h VAL 142 Ca -0.04 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.48 1x51 h VAL 142 Cb 1.39 0.50 0.00 0.00 -1.52 0.00 0.00 31.29 31.66 1x51 h VAL 142 CO 0.13 0.00 -0.04 0.33 0.02 0.00 0.00 177.57 178.02 1x51 n PHE 143 N -2.43 0.05 -0.59 1.57 -0.00 -1.15 -3.38 117.46 111.54 1x51 n PHE 143 Ca -0.02 0.02 0.47 0.00 -0.00 0.00 0.00 57.45 57.92 1x51 n PHE 143 Cb 0.25 -0.24 0.75 0.00 -0.00 0.00 0.00 39.48 40.24 1x51 n PHE 143 CO 0.00 0.00 0.00 2.89 -0.00 0.00 0.00 176.76 179.65 1x51 n ARG 144 N -2.43 -0.02 0.02 -4.13 -4.01 -1.14 0.19 116.66 105.13 1x51 n ARG 144 Ca -0.01 1.19 -0.19 0.00 -1.04 0.00 0.00 57.85 57.80 1x51 n ARG 144 Cb 0.02 -2.51 -0.10 0.00 -3.04 0.00 0.00 32.46 26.83 1x51 n ARG 144 CO 0.00 0.00 0.00 0.28 -3.04 0.00 0.00 177.63 174.87 1x51 h VAL 145 N 0.00 1.32 -0.10 8.89 2.07 -1.57 -3.23 116.25 123.62 1x51 h VAL 145 Ca 0.92 -2.12 -0.11 0.00 0.82 0.00 0.00 66.70 66.20 1x51 h VAL 145 Cb 3.30 2.34 -0.01 0.00 -1.52 0.00 0.00 31.29 35.40 1x51 h VAL 145 CO -0.26 0.65 -0.44 0.22 0.02 0.00 0.00 177.57 177.75 1x51 h TYR 146 N 0.29 0.28 0.01 1.57 3.20 0.20 -3.19 116.97 119.34 1x51 h TYR 146 Ca -0.10 -0.08 0.02 0.00 3.14 0.00 0.00 58.73 61.71 1x51 h TYR 146 Cb 1.52 -0.06 -0.03 0.00 1.54 0.00 0.00 36.73 39.70 1x51 h TYR 146 CO 0.11 0.64 -0.13 1.96 -1.64 0.00 0.00 178.16 179.10 1x51 h GLN 147 N 0.20 -0.22 -0.76 1.82 1.08 -0.78 -2.42 115.11 114.03 1x51 h GLN 147 Ca 0.01 0.01 0.31 0.00 -1.45 0.00 0.00 58.65 57.53 1x51 h GLN 147 Cb 0.87 0.05 -0.12 0.00 -0.05 0.00 0.00 27.48 28.22 1x51 h GLN 147 CO 0.07 -0.15 0.43 0.41 -0.95 0.00 0.00 178.83 178.64 1x51 n GLY 148 N -1.26 -0.54 3.14 3.46 0.00 -1.20 -3.20 105.19 105.59 1x51 n GLY 148 Ca -0.05 0.57 -0.35 0.00 0.00 0.00 0.00 46.02 46.18 1x51 n GLY 148 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1x51 s GLN 149 N -5.02 2.20 -0.30 1.61 1.11 -0.91 -5.05 119.66 113.30 1x51 s GLN 149 Ca -0.06 -1.51 -0.11 0.00 0.01 0.00 0.00 55.36 53.69 1x51 s GLN 149 Cb 0.24 -3.33 0.14 0.00 -1.01 0.00 0.00 33.01 29.05 1x51 s GLN 149 CO 0.56 -0.81 0.73 0.45 0.01 0.00 0.00 175.29 176.24 1x51 s SER 150 N 1.42 -1.02 -0.39 5.90 0.15 -1.19 -4.93 113.70 113.64 1x51 s SER 150 Ca 0.01 1.33 -0.15 0.00 0.70 0.00 0.00 55.95 57.83 1x51 s SER 150 Cb -0.21 2.13 0.01 0.00 -1.71 0.00 0.00 66.02 66.24 1x51 s SER 150 CO -0.03 -0.19 0.35 -0.83 1.20 0.00 0.00 173.24 173.74 1x51 s GLY 151 N 2.79 1.95 0.01 9.45 0.00 -1.26 -4.96 107.32 115.30 1x51 s GLY 151 Ca -0.03 -1.51 -0.23 0.00 0.00 0.00 0.00 44.72 42.95 1x51 s GLY 151 CO -0.19 0.99 1.31 -0.56 0.00 0.00 0.00 173.10 174.65 1x51 h PRO 152 N 8.61 0.19 0.00 2.90 0.13 -2.00 -3.42 132.00 138.40 1x51 h PRO 152 Ca -0.28 -0.10 -0.04 0.00 -0.87 0.00 0.00 66.00 64.71 1x51 h PRO 152 Cb 1.13 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.25 1x51 h PRO 152 CO 0.73 0.62 -0.70 0.43 -0.23 0.00 0.00 178.00 178.85 1x51 n SER 153 N -4.70 0.92 -4.48 1.44 7.64 -1.26 -4.92 113.62 108.27 1x51 n SER 153 Ca -0.07 0.13 -0.43 0.00 1.01 0.00 0.00 58.87 59.51 1x51 n SER 153 Cb 0.31 -0.32 -0.03 0.00 -1.01 0.00 0.00 64.21 63.16 1x51 n SER 153 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 1x51 s SER 154 N -5.79 6.39 0.00 6.43 0.01 -1.26 -5.24 113.70 114.24 1x51 s SER 154 Ca -0.07 -1.40 0.00 0.00 1.31 0.00 0.00 55.95 55.79 1x51 s SER 154 Cb 0.02 -2.44 0.00 0.00 0.21 0.00 0.00 66.02 63.80 1x51 s SER 154 CO 0.10 -1.35 0.00 0.61 0.41 0.00 0.00 173.24 173.01