#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x5u s SER 2 N 0.00 0.13 0.16 1.61 0.15 -1.26 -5.16 113.70 109.34 1x5u s SER 2 Ca 0.00 0.05 0.10 0.00 0.70 0.00 0.00 55.95 56.80 1x5u s SER 2 Cb 0.00 1.21 -0.04 0.00 -1.71 0.00 0.00 66.02 65.48 1x5u s SER 2 CO 0.00 -0.32 -0.18 -0.94 1.20 0.00 0.00 173.24 173.00 1x5u s SER 3 N 2.57 3.81 0.00 5.45 1.04 -1.26 -5.11 113.70 120.21 1x5u s SER 3 Ca 0.12 -0.68 0.00 0.00 0.48 0.00 0.00 55.95 55.87 1x5u s SER 3 Cb -0.14 -0.48 0.00 0.00 0.10 0.00 0.00 66.02 65.50 1x5u s SER 3 CO -0.22 0.14 0.00 0.61 0.98 0.00 0.00 173.24 174.75 1x5u n GLY 4 N 0.41 -0.05 3.25 7.32 0.00 -1.26 -5.18 105.19 109.69 1x5u n GLY 4 Ca -0.13 0.73 -0.13 0.00 0.00 0.00 0.00 46.02 46.49 1x5u n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1x5u s SER 5 N 0.00 -0.21 -0.27 1.61 1.04 -1.26 -5.11 113.70 109.50 1x5u s SER 5 Ca 0.00 0.10 -0.37 0.00 0.48 0.00 0.00 55.95 56.16 1x5u s SER 5 Cb 0.00 0.33 -0.13 0.00 0.10 0.00 0.00 66.02 66.32 1x5u s SER 5 CO 0.00 -0.47 1.98 -1.54 0.98 0.00 0.00 173.24 174.19 1x5u n SER 6 N 1.19 2.48 0.00 7.02 3.41 -1.26 -4.83 113.62 121.64 1x5u n SER 6 Ca -0.21 0.75 0.00 0.00 -0.26 0.00 0.00 58.87 59.15 1x5u n SER 6 Cb 0.56 -1.24 0.00 0.00 -0.26 0.00 0.00 64.21 63.27 1x5u n SER 6 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1x5u n GLY 7 N 5.35 0.35 3.77 5.00 0.00 -1.26 -5.07 105.19 113.32 1x5u n GLY 7 Ca 0.33 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.95 1x5u n GLY 7 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1x5u s PRO 8 N 0.00 4.37 -0.28 1.61 0.04 -1.26 -4.97 135.00 134.51 1x5u s PRO 8 Ca 0.00 2.02 0.09 0.00 0.04 0.00 0.00 61.00 63.15 1x5u s PRO 8 Cb 0.00 -3.02 0.46 0.00 0.04 0.00 0.00 34.50 31.98 1x5u s PRO 8 CO 0.00 -0.10 1.19 0.44 0.04 0.00 0.00 177.00 178.56 1x5u n ILE 9 N 0.75 2.39 -0.26 0.56 -5.35 -1.26 -4.87 119.36 111.32 1x5u n ILE 9 Ca 0.01 -4.03 0.15 0.00 -0.27 0.00 0.00 62.75 58.60 1x5u n ILE 9 Cb 0.44 -0.87 0.29 0.00 -1.74 0.00 0.00 39.64 37.75 1x5u n ILE 9 CO 0.00 0.00 0.00 -0.24 -1.76 0.00 0.00 176.55 174.55 1x5u n SER 10 N -0.72 0.00 -4.44 7.28 2.88 -1.26 -4.50 113.62 112.86 1x5u n SER 10 Ca 0.39 1.32 -0.50 0.00 -1.33 0.00 0.00 58.87 58.75 1x5u n SER 10 Cb 0.94 -0.52 -0.04 0.00 -0.75 0.00 0.00 64.21 63.84 1x5u n SER 10 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 1x5u n GLU 11 N -5.01 0.15 -4.09 -1.46 1.02 -1.26 -4.96 120.64 105.03 1x5u n GLU 11 Ca 0.21 0.05 -0.24 0.00 -0.02 0.00 0.00 57.16 57.17 1x5u n GLU 11 Cb 0.70 -1.20 -0.05 0.00 -0.02 0.00 0.00 31.44 30.88 1x5u n GLU 11 CO 0.00 0.00 0.00 0.50 1.18 0.00 0.00 177.13 178.81 1x5u s ARG 12 N -0.82 2.95 -1.09 3.49 6.06 -1.26 -4.59 118.95 123.69 1x5u s ARG 12 Ca 0.69 -0.97 -0.04 0.00 -2.50 0.00 0.00 55.73 52.92 1x5u s ARG 12 Cb -0.98 -2.61 0.00 0.00 0.06 0.00 0.00 34.95 31.43 1x5u s ARG 12 CO 0.56 0.43 0.93 0.09 -2.50 0.00 0.00 175.30 174.82 1x5u n ASN 13 N -0.87 -3.91 -0.02 -2.12 4.13 -1.26 -4.92 115.26 106.29 1x5u n ASN 13 Ca -0.08 -0.49 -0.13 0.00 1.68 0.00 0.00 54.58 55.56 1x5u n ASN 13 Cb 0.57 -4.39 -0.07 0.00 -1.54 0.00 0.00 39.78 34.34 1x5u n ASN 13 CO 0.00 0.00 0.00 -0.61 0.28 0.00 0.00 177.26 176.93 1x5u h GLN 14 N -1.96 -0.48 -0.60 3.52 5.75 -1.93 -2.48 115.11 116.92 1x5u h GLN 14 Ca -0.49 0.03 0.06 0.00 -0.15 0.00 0.00 58.65 58.10 1x5u h GLN 14 Cb 1.30 0.11 -0.09 0.00 1.07 0.00 0.00 27.48 29.87 1x5u h GLN 14 CO 0.45 -0.32 -0.53 0.38 -2.65 0.00 0.00 178.83 176.16 1x5u h ASP 15 N -0.50 -1.86 -1.10 -0.69 3.04 -1.93 0.81 116.42 114.19 1x5u h ASP 15 Ca 0.07 0.26 0.32 0.00 -3.24 0.00 0.00 57.03 54.44 1x5u h ASP 15 Cb 0.64 0.79 -0.04 0.00 -1.04 0.00 0.00 39.33 39.67 1x5u h ASP 15 CO -0.43 -0.31 1.01 0.00 -2.04 0.00 0.00 179.24 177.47 1x5u h ALA 16 N 0.08 2.98 -2.62 4.15 0.00 -1.73 -3.39 119.26 118.73 1x5u h ALA 16 Ca 0.10 -0.04 -0.52 0.00 0.00 0.00 0.00 54.91 54.45 1x5u h ALA 16 Cb 0.49 0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.33 1x5u h ALA 16 CO -0.69 -1.58 0.16 0.99 0.00 0.00 0.00 179.25 178.13 1x5u s THR 17 N -4.66 4.44 0.18 0.00 2.01 0.28 -2.43 115.64 115.46 1x5u s THR 17 Ca -0.04 1.54 0.04 0.00 0.31 0.00 0.00 61.69 63.54 1x5u s THR 17 Cb 0.19 -4.01 -0.03 0.00 0.01 0.00 0.00 72.50 68.65 1x5u s THR 17 CO 0.63 0.37 0.29 0.68 -0.69 0.00 0.00 174.62 175.90 1x5u s VAL 18 N -1.33 5.19 -0.48 3.82 -7.23 -0.68 -3.05 120.40 116.65 1x5u s VAL 18 Ca 0.40 -0.84 -0.13 0.00 -1.81 0.00 0.00 61.98 59.60 1x5u s VAL 18 Cb -0.20 -3.72 0.10 0.00 0.56 0.00 0.00 36.38 33.12 1x5u s VAL 18 CO 0.24 -0.17 0.38 -0.47 -0.31 0.00 0.00 175.10 174.77 1x5u s TYR 19 N -1.83 3.30 -0.41 2.82 6.14 0.40 -3.11 117.35 124.67 1x5u s TYR 19 Ca 0.34 -1.34 -0.17 0.00 0.64 0.00 0.00 57.07 56.55 1x5u s TYR 19 Cb -0.10 -3.35 0.02 0.00 0.42 0.00 0.00 41.96 38.94 1x5u s TYR 19 CO 0.28 -0.90 0.40 0.08 0.64 0.00 0.00 175.55 176.05 1x5u s VAL 20 N 1.53 5.13 -0.34 3.14 1.01 -0.15 -2.83 120.40 127.89 1x5u s VAL 20 Ca 0.04 -0.35 0.02 0.00 0.00 0.00 0.00 61.98 61.69 1x5u s VAL 20 Cb -0.26 -3.99 0.10 0.00 0.00 0.00 0.00 36.38 32.24 1x5u s VAL 20 CO 0.03 -0.35 0.09 -0.83 0.00 0.00 0.00 175.10 174.04 1x5u s GLY 21 N 1.78 1.53 0.00 4.51 0.00 -0.76 0.93 107.32 115.30 1x5u s GLY 21 Ca 0.11 -2.15 0.00 0.00 0.00 0.00 0.00 44.72 42.68 1x5u s GLY 21 CO 0.13 1.30 0.00 0.61 0.00 0.00 0.00 173.10 175.13 1x5u n GLY 22 N 4.46 0.36 3.82 0.20 0.00 0.70 -3.05 105.19 111.69 1x5u n GLY 22 Ca 0.01 -0.11 -0.36 0.00 0.00 0.00 0.00 46.02 45.56 1x5u n GLY 22 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1x5u s LEU 23 N 0.00 4.34 1.19 0.99 1.43 -1.03 -3.88 118.68 121.72 1x5u s LEU 23 Ca 0.00 0.44 -0.17 0.00 -1.03 0.00 0.00 54.13 53.37 1x5u s LEU 23 Cb 0.00 -2.14 0.28 0.00 0.03 0.00 0.00 46.19 44.36 1x5u s LEU 23 CO 0.00 0.32 1.06 -0.62 0.23 0.00 0.00 176.35 177.34 1x5u s ASP 24 N -0.54 0.96 0.13 2.29 2.15 -1.26 -4.65 116.67 115.75 1x5u s ASP 24 Ca 0.14 0.91 -0.16 0.00 0.43 0.00 0.00 52.55 53.87 1x5u s ASP 24 Cb -0.12 -1.35 -0.01 0.00 -0.30 0.00 0.00 42.92 41.14 1x5u s ASP 24 CO 0.03 -4.13 1.65 1.05 -0.17 0.00 0.00 175.17 173.61 1x5u h GLU 25 N -2.58 0.60 -0.38 4.34 4.11 -1.95 -3.04 114.58 115.68 1x5u h GLU 25 Ca -0.49 -0.13 0.07 0.00 0.07 0.00 0.00 59.36 58.88 1x5u h GLU 25 Cb 1.32 -0.09 -0.07 0.00 0.50 0.00 0.00 28.75 30.41 1x5u h GLU 25 CO 0.41 0.60 -0.05 0.87 0.07 0.00 0.00 179.01 180.92 1x5u h LYS 26 N 0.49 0.05 -4.15 1.06 1.57 -1.96 -3.43 116.57 110.18 1x5u h LYS 26 Ca 0.13 -0.00 -0.44 0.00 -1.87 0.00 0.00 60.65 58.46 1x5u h LYS 26 Cb 0.24 -0.01 0.10 0.00 0.08 0.00 0.00 32.23 32.64 1x5u h LYS 26 CO -0.01 0.03 -0.56 0.28 -0.57 0.00 0.00 179.45 178.63 1x5u n VAL 27 N -5.24 0.77 -4.22 0.50 0.31 -1.15 -4.97 118.33 104.33 1x5u n VAL 27 Ca 0.02 -0.35 -0.15 0.00 -0.01 0.00 0.00 64.34 63.85 1x5u n VAL 27 Cb 0.20 0.00 -0.09 0.00 -0.91 0.00 0.00 33.84 33.05 1x5u n VAL 27 CO 0.00 0.00 0.00 -0.44 -1.32 0.00 0.00 176.83 175.07 1x5u s SER 28 N -0.69 0.83 -0.00 4.52 0.01 -1.26 -4.96 113.70 112.14 1x5u s SER 28 Ca 0.42 -1.53 -0.24 0.00 1.31 0.00 0.00 55.95 55.91 1x5u s SER 28 Cb -0.51 0.48 -0.16 0.00 0.21 0.00 0.00 66.02 66.04 1x5u s SER 28 CO 0.42 -0.98 1.15 -0.33 0.41 0.00 0.00 173.24 173.91 1x5u h GLU 29 N 2.37 -0.44 0.00 12.44 5.08 -1.97 -2.97 114.58 129.10 1x5u h GLU 29 Ca -0.30 0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.09 1x5u h GLU 29 Cb 1.24 0.10 0.00 0.00 0.50 0.00 0.00 28.75 30.59 1x5u h GLU 29 CO 0.44 -0.11 0.00 -0.35 -1.00 0.00 0.00 179.01 177.99 1x5u n PRO 30 N -5.13 0.49 -0.11 2.33 -0.04 -1.26 -3.00 135.00 128.27 1x5u n PRO 30 Ca -0.09 0.00 -0.23 0.00 -0.04 0.00 0.00 63.50 63.14 1x5u n PRO 30 Cb 0.27 -1.30 -0.11 0.00 -0.04 0.00 0.00 33.50 32.33 1x5u n PRO 30 CO 0.00 0.00 0.00 -0.11 -0.04 0.00 0.00 175.50 175.35 1x5u n LEU 31 N -0.80 1.87 -0.37 1.53 7.94 -1.13 -4.28 117.00 121.77 1x5u n LEU 31 Ca 0.07 0.41 0.03 0.00 -1.11 0.00 0.00 56.01 55.41 1x5u n LEU 31 Cb 0.03 -0.94 0.18 0.00 0.53 0.00 0.00 43.42 43.22 1x5u n LEU 31 CO 0.05 0.30 1.27 -0.07 -1.11 0.00 0.00 177.39 177.83 1x5u h LEU 32 N -1.00 1.04 0.00 -1.96 3.38 -1.50 -0.85 115.31 114.42 1x5u h LEU 32 Ca -0.40 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.58 1x5u h LEU 32 Cb 1.33 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 41.87 1x5u h LEU 32 CO -0.24 0.66 0.00 1.87 0.09 0.00 0.00 178.44 180.82 1x5u n TRP 33 N -4.51 0.00 -0.30 1.13 -0.00 -1.24 0.14 117.44 112.66 1x5u n TRP 33 Ca 0.16 0.00 -0.04 0.00 -0.00 0.00 0.00 57.50 57.62 1x5u n TRP 33 Cb 0.19 -0.41 0.08 0.00 -0.00 0.00 0.00 31.31 31.17 1x5u n TRP 33 CO 0.00 0.00 0.00 1.49 -0.00 0.00 0.00 177.69 179.18 1x5u h GLU 34 N 0.00 1.09 -0.17 5.87 4.81 -1.73 0.46 114.58 124.91 1x5u h GLU 34 Ca 0.00 -0.07 0.05 0.00 -0.13 0.00 0.00 59.36 59.21 1x5u h GLU 34 Cb 0.00 -0.25 -0.01 0.00 0.63 0.00 0.00 28.75 29.13 1x5u h GLU 34 CO 0.00 0.72 0.13 1.25 -0.73 0.00 0.00 179.01 180.38 1x5u h LEU 35 N 1.12 0.00 0.00 1.64 5.85 -0.61 -1.63 115.31 121.68 1x5u h LEU 35 Ca 0.31 0.00 -0.21 0.00 0.84 0.00 0.00 57.88 58.82 1x5u h LEU 35 Cb -0.12 0.00 -0.04 0.00 0.37 0.00 0.00 40.66 40.87 1x5u h LEU 35 CO -0.07 0.00 -1.83 0.49 -0.34 0.00 0.00 178.44 176.69 1x5u n PHE 36 N -4.39 0.53 -0.56 1.25 3.01 0.37 -4.25 117.46 113.41 1x5u n PHE 36 Ca 0.01 0.18 0.45 0.00 1.01 0.00 0.00 57.45 59.10 1x5u n PHE 36 Cb 0.26 -0.97 0.74 0.00 -0.01 0.00 0.00 39.48 39.50 1x5u n PHE 36 CO 0.00 0.00 0.00 -0.07 1.01 0.00 0.00 176.76 177.70 1x5u h LEU 37 N 0.00 0.11 -0.66 4.37 3.38 0.89 0.86 115.31 124.27 1x5u h LEU 37 Ca -0.26 0.08 0.08 0.00 0.09 0.00 0.00 57.88 57.87 1x5u h LEU 37 Cb 1.72 0.08 -0.07 0.00 0.09 0.00 0.00 40.66 42.48 1x5u h LEU 37 CO 0.04 -0.12 0.32 0.06 0.09 0.00 0.00 178.44 178.83 1x5u h GLN 38 N 0.02 0.56 -0.23 1.13 3.07 -1.74 -2.39 115.11 115.53 1x5u h GLN 38 Ca 0.88 -0.03 -0.09 0.00 0.09 0.00 0.00 58.65 59.50 1x5u h GLN 38 Cb 3.18 -0.13 -0.00 0.00 0.08 0.00 0.00 27.48 30.61 1x5u h GLN 38 CO -0.24 0.37 -0.20 0.00 0.09 0.00 0.00 178.83 178.84 1x5u h ALA 39 N 1.39 0.34 -2.46 0.06 0.00 0.46 -3.49 119.26 115.56 1x5u h ALA 39 Ca 0.32 -0.36 0.20 0.00 0.00 0.00 0.00 54.91 55.07 1x5u h ALA 39 Cb 0.31 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 17.98 1x5u h ALA 39 CO -0.25 0.28 0.65 0.20 0.00 0.00 0.00 179.25 180.13 1x5u s GLY 40 N -3.53 0.08 -1.19 0.00 0.00 -0.90 -4.79 107.32 96.98 1x5u s GLY 40 Ca -0.13 -0.28 -0.23 0.00 0.00 0.00 0.00 44.72 44.09 1x5u s GLY 40 CO 0.79 3.14 1.94 2.56 0.00 0.00 0.00 173.10 181.52 1x5u s PRO 41 N -2.12 2.48 -0.01 2.90 0.04 -1.26 -3.85 135.00 133.18 1x5u s PRO 41 Ca 0.24 -1.18 -0.37 0.00 0.04 0.00 0.00 61.00 59.72 1x5u s PRO 41 Cb -0.02 -5.24 -0.16 0.00 0.04 0.00 0.00 34.50 29.11 1x5u s PRO 41 CO 0.04 -4.01 1.47 0.28 0.04 0.00 0.00 177.00 174.82 1x5u n VAL 42 N 7.81 0.09 -0.07 -0.36 0.31 -1.26 -3.02 118.33 121.84 1x5u n VAL 42 Ca 0.45 -0.02 -0.08 0.00 -0.01 0.00 0.00 64.34 64.68 1x5u n VAL 42 Cb 0.47 -0.99 -0.06 0.00 -0.91 0.00 0.00 33.84 32.34 1x5u n VAL 42 CO 0.00 0.00 0.00 0.58 -1.32 0.00 0.00 176.83 176.09 1x5u h VAL 43 N 3.89 0.69 -3.08 2.52 2.07 -0.83 -3.46 116.25 118.04 1x5u h VAL 43 Ca -0.47 -1.58 -0.02 0.00 0.82 0.00 0.00 66.70 65.45 1x5u h VAL 43 Cb 1.32 1.36 -0.12 0.00 -1.52 0.00 0.00 31.29 32.34 1x5u h VAL 43 CO 0.83 0.23 0.15 0.21 0.02 0.00 0.00 177.57 179.02 1x5u s ASN 44 N -5.95 -0.49 -0.08 0.57 2.47 -1.06 -5.03 114.94 105.37 1x5u s ASN 44 Ca -0.12 -0.10 0.02 0.00 0.42 0.00 0.00 52.86 53.08 1x5u s ASN 44 Cb 0.00 0.58 -0.02 0.00 -1.45 0.00 0.00 41.25 40.36 1x5u s ASN 44 CO 0.33 -0.97 -0.12 0.42 -3.72 0.00 0.00 177.10 173.04 1x5u s THR 45 N -3.77 3.24 -0.12 -5.21 -4.23 -1.26 -1.60 115.64 102.68 1x5u s THR 45 Ca 0.02 -0.64 0.03 0.00 -1.18 0.00 0.00 61.69 59.92 1x5u s THR 45 Cb -0.01 -2.31 0.01 0.00 1.34 0.00 0.00 72.50 71.53 1x5u s THR 45 CO -0.12 0.57 -0.21 -2.28 -0.54 0.00 0.00 174.62 172.05 1x5u s HIS 46 N -0.40 2.46 -0.18 3.99 2.46 -0.24 -5.00 115.29 118.38 1x5u s HIS 46 Ca 0.05 -1.16 -0.05 0.00 0.47 0.00 0.00 55.06 54.37 1x5u s HIS 46 Cb -0.12 -1.69 0.07 0.00 -0.13 0.00 0.00 32.58 30.71 1x5u s HIS 46 CO 0.02 -0.53 0.14 -1.64 -2.47 0.00 0.00 174.74 170.26 1x5u s MET 47 N 0.72 0.11 0.08 2.88 -1.94 -1.26 -0.20 119.30 119.69 1x5u s MET 47 Ca -0.10 0.04 -0.31 0.00 -1.71 0.00 0.00 55.69 53.61 1x5u s MET 47 Cb -0.16 -1.55 -0.07 0.00 2.01 0.00 0.00 34.83 35.06 1x5u s MET 47 CO 0.01 -0.65 1.39 -1.25 -0.01 0.00 0.00 175.02 174.51 1x5u s PRO 48 N 2.21 4.31 -0.18 2.03 0.04 -1.26 -4.96 135.00 137.19 1x5u s PRO 48 Ca 0.04 2.03 -0.06 0.00 0.04 0.00 0.00 61.00 63.05 1x5u s PRO 48 Cb -0.16 -3.36 -0.04 0.00 0.04 0.00 0.00 34.50 30.99 1x5u s PRO 48 CO -0.10 -0.47 0.04 0.15 0.04 0.00 0.00 177.00 176.65 1x5u s LYS 49 N 1.52 3.86 1.02 4.56 -0.14 -1.26 -3.75 119.74 125.54 1x5u s LYS 49 Ca 0.64 -0.41 -0.21 0.00 -1.36 0.00 0.00 55.97 54.63 1x5u s LYS 49 Cb -0.35 -3.15 -0.03 0.00 -1.68 0.00 0.00 37.83 32.62 1x5u s LYS 49 CO 0.29 0.21 -0.68 -3.47 -0.76 0.00 0.00 175.35 170.94 1x5u n ASP 50 N 3.71 -2.70 -0.08 2.83 2.03 -1.22 -4.77 116.55 116.35 1x5u n ASP 50 Ca -0.17 -0.09 -0.10 0.00 0.52 0.00 0.00 54.79 54.95 1x5u n ASP 50 Cb 0.52 -0.70 -0.10 0.00 -0.72 0.00 0.00 41.12 40.13 1x5u n ASP 50 CO 0.00 0.00 0.00 -2.11 -1.92 0.00 0.00 177.20 173.17 1x5u n ARG 51 N 0.27 1.09 0.09 -0.67 0.00 -1.26 -3.20 116.66 112.97 1x5u n ARG 51 Ca -0.00 0.05 -0.23 0.00 -0.00 0.00 0.00 57.85 57.67 1x5u n ARG 51 Cb 0.62 -1.36 -0.15 0.00 -0.00 0.00 0.00 32.46 31.57 1x5u n ARG 51 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.63 177.91 1x5u h VAL 52 N 0.00 1.13 0.02 8.89 2.07 -2.00 -3.38 116.25 122.98 1x5u h VAL 52 Ca -0.39 -2.56 -0.35 0.00 0.82 0.00 0.00 66.70 64.23 1x5u h VAL 52 Cb 1.74 2.90 -0.06 0.00 -1.52 0.00 0.00 31.29 34.36 1x5u h VAL 52 CO -0.02 0.80 -2.12 0.35 0.02 0.00 0.00 177.57 176.60 1x5u n THR 53 N -3.75 1.53 -2.30 2.57 -2.24 -1.26 -5.00 114.28 103.83 1x5u n THR 53 Ca -0.21 -0.77 -0.10 0.00 -2.27 0.00 0.00 64.05 60.70 1x5u n THR 53 Cb 1.03 -0.97 0.00 0.00 -2.10 0.00 0.00 70.33 68.30 1x5u n THR 53 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1x5u n GLY 54 N 1.79 -0.01 2.86 3.38 0.00 -1.19 -4.97 105.19 107.04 1x5u n GLY 54 Ca -0.29 -0.44 -0.17 0.00 0.00 0.00 0.00 46.02 45.12 1x5u n GLY 54 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1x5u s GLN 55 N -4.64 0.40 -0.39 1.61 -2.07 -1.26 -4.72 119.66 108.58 1x5u s GLN 55 Ca 0.04 -0.00 -0.36 0.00 -1.82 0.00 0.00 55.36 53.21 1x5u s GLN 55 Cb -0.02 -0.51 -0.15 0.00 -1.09 0.00 0.00 33.01 31.24 1x5u s GLN 55 CO 0.04 -0.08 1.37 -2.39 -1.32 0.00 0.00 175.29 172.91 1x5u n HIS 56 N 3.87 1.24 0.23 9.60 1.44 -1.26 -3.46 115.22 126.89 1x5u n HIS 56 Ca -0.24 0.81 -0.16 0.00 -2.01 0.00 0.00 57.72 56.13 1x5u n HIS 56 Cb 0.52 -1.75 -0.09 0.00 0.12 0.00 0.00 29.99 28.79 1x5u n HIS 56 CO 0.00 0.00 0.00 1.96 -2.81 0.00 0.00 176.34 175.49 1x5u h GLN 57 N 4.79 -0.82 0.00 -1.40 4.20 -1.95 -3.46 115.11 116.47 1x5u h GLN 57 Ca -0.27 0.06 0.00 0.00 0.06 0.00 0.00 58.65 58.50 1x5u h GLN 57 Cb 1.08 0.19 0.00 0.00 0.30 0.00 0.00 27.48 29.05 1x5u h GLN 57 CO 0.79 -0.55 0.00 0.41 -0.67 0.00 0.00 178.83 178.81 1x5u n GLY 58 N -1.49 0.00 3.61 3.46 0.00 -1.26 -4.99 105.19 104.52 1x5u n GLY 58 Ca -0.10 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.81 1x5u n GLY 58 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1x5u s TYR 59 N 0.00 -0.49 0.00 1.61 1.13 -1.26 -0.21 117.35 118.13 1x5u s TYR 59 Ca 0.00 1.05 0.00 0.00 -1.41 0.00 0.00 57.07 56.71 1x5u s TYR 59 Cb 0.00 0.39 0.00 0.00 -1.10 0.00 0.00 41.96 41.25 1x5u s TYR 59 CO 0.00 -0.31 0.00 0.41 -2.51 0.00 0.00 175.55 173.14 1x5u n GLY 60 N 1.66 4.65 3.41 5.49 0.00 0.26 -4.28 105.19 116.39 1x5u n GLY 60 Ca -0.12 -1.34 -0.16 0.00 0.00 0.00 0.00 46.02 44.40 1x5u n GLY 60 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1x5u s PHE 61 N -1.60 -0.48 -0.26 1.61 0.40 0.72 -0.98 117.98 117.39 1x5u s PHE 61 Ca 0.00 0.86 0.01 0.00 -0.60 0.00 0.00 56.93 57.21 1x5u s PHE 61 Cb 0.00 0.27 0.07 0.00 0.51 0.00 0.00 43.02 43.87 1x5u s PHE 61 CO 0.00 -0.48 -0.02 0.08 0.70 0.00 0.00 175.22 175.50 1x5u s VAL 62 N -1.03 1.59 -0.44 -0.44 1.01 -1.18 -1.08 120.40 118.83 1x5u s VAL 62 Ca -0.10 -1.45 -0.27 0.00 0.00 0.00 0.00 61.98 60.15 1x5u s VAL 62 Cb -0.02 -1.95 0.03 0.00 0.00 0.00 0.00 36.38 34.43 1x5u s VAL 62 CO 0.07 -0.26 1.02 -0.70 0.00 0.00 0.00 175.10 175.22 1x5u s GLU 63 N 1.33 3.70 0.54 2.72 2.12 -0.63 -1.68 118.70 126.80 1x5u s GLU 63 Ca -0.01 0.46 -0.06 0.00 0.36 0.00 0.00 54.97 55.73 1x5u s GLU 63 Cb -0.19 -3.88 -0.01 0.00 0.26 0.00 0.00 34.13 30.31 1x5u s GLU 63 CO -0.09 -1.21 0.85 -0.06 -0.54 0.00 0.00 175.26 174.21 1x5u s PHE 64 N 3.97 3.41 0.07 5.30 0.08 -1.02 -0.17 117.98 129.63 1x5u s PHE 64 Ca 0.42 0.75 -0.19 0.00 0.12 0.00 0.00 56.93 58.03 1x5u s PHE 64 Cb -0.09 -2.53 -0.10 0.00 -0.57 0.00 0.00 43.02 39.73 1x5u s PHE 64 CO 0.26 -0.56 1.46 1.25 -0.10 0.00 0.00 175.22 177.54 1x5u h LEU 65 N 0.01 0.43 -8.60 -0.37 5.85 -1.87 -3.43 115.31 107.33 1x5u h LEU 65 Ca -0.46 -0.37 -0.66 0.00 0.84 0.00 0.00 57.88 57.23 1x5u h LEU 65 Cb 1.23 -0.12 -0.29 0.00 0.37 0.00 0.00 40.66 41.86 1x5u h LEU 65 CO 0.61 0.69 -0.87 -0.44 -0.34 0.00 0.00 178.44 178.09 1x5u s SER 66 N -6.02 2.88 0.21 1.25 0.01 -1.26 -5.04 113.70 105.73 1x5u s SER 66 Ca -0.14 -0.48 -0.17 0.00 1.31 0.00 0.00 55.95 56.47 1x5u s SER 66 Cb 0.07 -0.30 0.21 0.00 0.21 0.00 0.00 66.02 66.21 1x5u s SER 66 CO 0.75 0.27 1.59 -0.08 0.41 0.00 0.00 173.24 176.18 1x5u h GLU 67 N 5.28 -0.08 -0.71 12.44 4.81 -1.89 0.17 114.58 134.59 1x5u h GLU 67 Ca -0.43 0.01 0.13 0.00 -0.13 0.00 0.00 59.36 58.94 1x5u h GLU 67 Cb 1.13 0.02 -0.13 0.00 0.63 0.00 0.00 28.75 30.40 1x5u h GLU 67 CO 0.46 -0.06 -0.27 0.93 -0.73 0.00 0.00 179.01 179.35 1x5u h GLU 68 N -0.09 -0.06 -0.93 1.92 5.08 -1.96 0.33 114.58 118.88 1x5u h GLU 68 Ca 0.29 0.00 0.24 0.00 -1.00 0.00 0.00 59.36 58.90 1x5u h GLU 68 Cb 0.56 0.01 -0.13 0.00 0.50 0.00 0.00 28.75 29.69 1x5u h GLU 68 CO -0.76 -0.04 0.43 -0.44 -1.00 0.00 0.00 179.01 177.21 1x5u h ASP 69 N -0.07 0.37 0.85 1.42 3.32 -1.29 -0.90 116.42 120.13 1x5u h ASP 69 Ca 0.31 0.16 -0.04 0.00 0.02 0.00 0.00 57.03 57.48 1x5u h ASP 69 Cb 0.56 0.14 0.01 0.00 0.22 0.00 0.00 39.33 40.25 1x5u h ASP 69 CO -0.76 -0.03 -0.41 0.00 -1.72 0.00 0.00 179.24 176.33 1x5u h ALA 70 N 1.75 -1.23 -1.03 3.45 0.00 -0.23 -2.05 119.26 119.91 1x5u h ALA 70 Ca 0.60 -0.25 0.28 0.00 0.00 0.00 0.00 54.91 55.54 1x5u h ALA 70 Cb 1.20 0.44 -0.12 0.00 0.00 0.00 0.00 17.79 19.31 1x5u h ALA 70 CO -0.55 -1.15 0.63 0.22 0.00 0.00 0.00 179.25 178.40 1x5u h ASP 71 N -1.21 0.56 -0.67 0.00 3.58 -0.92 0.43 116.42 118.18 1x5u h ASP 71 Ca -0.12 0.13 -0.06 0.00 0.42 0.00 0.00 57.03 57.40 1x5u h ASP 71 Cb 0.87 0.05 -0.03 0.00 1.72 0.00 0.00 39.33 41.94 1x5u h ASP 71 CO 0.19 0.04 0.17 0.22 -2.88 0.00 0.00 179.24 176.99 1x5u h TYR 72 N 0.46 1.13 0.00 0.28 3.20 -1.00 -2.13 116.97 118.91 1x5u h TYR 72 Ca 0.66 -0.13 -0.07 0.00 3.14 0.00 0.00 58.73 62.33 1x5u h TYR 72 Cb 1.46 -0.32 -0.01 0.00 1.54 0.00 0.00 36.73 39.39 1x5u h TYR 72 CO -0.01 0.92 -0.34 0.00 -1.64 0.00 0.00 178.16 177.09 1x5u h ALA 73 N 1.15 0.98 0.00 1.82 0.00 0.50 -2.55 119.26 121.16 1x5u h ALA 73 Ca 0.22 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.81 1x5u h ALA 73 Cb 0.35 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.09 1x5u h ALA 73 CO 0.00 0.43 -0.03 0.82 0.00 0.00 0.00 179.25 180.47 1x5u h ILE 74 N 0.00 0.00 0.00 0.00 2.04 -0.59 0.47 117.51 119.44 1x5u h ILE 74 Ca -0.00 -0.68 -0.18 0.00 1.00 0.00 0.00 64.86 65.00 1x5u h ILE 74 Cb 0.90 1.66 -0.03 0.00 -0.74 0.00 0.00 36.82 38.60 1x5u h ILE 74 CO 0.04 0.00 -1.66 2.29 0.00 0.00 0.00 178.15 178.83 1x5u n LYS 75 N -2.57 0.64 -0.11 2.37 2.85 -0.85 -3.97 118.16 116.52 1x5u n LYS 75 Ca 0.05 0.13 -0.18 0.00 -1.05 0.00 0.00 58.31 57.26 1x5u n LYS 75 Cb 0.47 -1.72 -0.09 0.00 -0.65 0.00 0.00 35.03 33.03 1x5u n LYS 75 CO 0.00 0.00 0.00 0.44 -0.05 0.00 0.00 177.40 177.79 1x5u n ILE 76 N -2.79 1.25 0.70 0.58 -5.35 -0.98 -4.43 119.36 108.33 1x5u n ILE 76 Ca -0.13 -0.42 -0.02 0.00 -0.27 0.00 0.00 62.75 61.91 1x5u n ILE 76 Cb 0.86 -1.45 0.03 0.00 -1.74 0.00 0.00 39.64 37.35 1x5u n ILE 76 CO 0.00 0.00 0.00 0.23 -1.76 0.00 0.00 176.55 175.02 1x5u n MET 77 N -3.44 1.28 -3.45 6.28 2.81 0.17 -4.80 117.12 115.96 1x5u n MET 77 Ca -0.41 -0.42 -0.38 0.00 -1.81 0.00 0.00 57.70 54.68 1x5u n MET 77 Cb 0.88 -1.29 -0.06 0.00 -0.71 0.00 0.00 33.22 32.04 1x5u n MET 77 CO 0.00 0.00 0.00 0.16 1.51 0.00 0.00 175.97 177.64 1x5u s ASP 78 N 0.46 6.72 -1.49 7.83 -4.77 -1.25 -4.20 116.67 119.97 1x5u s ASP 78 Ca 0.08 0.86 -0.14 0.00 -3.30 0.00 0.00 52.55 50.04 1x5u s ASP 78 Cb 0.06 -2.25 0.12 0.00 -1.09 0.00 0.00 42.92 39.76 1x5u s ASP 78 CO 0.02 0.20 0.69 0.23 0.70 0.00 0.00 175.17 177.00 1x5u n MET 79 N 2.61 -3.53 -2.01 2.11 2.81 -1.07 -4.90 117.12 113.14 1x5u n MET 79 Ca -0.12 0.43 -0.34 0.00 -1.81 0.00 0.00 57.70 55.87 1x5u n MET 79 Cb 0.52 -5.17 0.02 0.00 -0.71 0.00 0.00 33.22 27.88 1x5u n MET 79 CO 0.00 0.00 0.00 0.42 1.51 0.00 0.00 175.97 177.90 1x5u s ILE 80 N -3.12 3.31 -0.73 2.02 1.01 -1.06 -4.76 121.20 117.87 1x5u s ILE 80 Ca 0.60 0.69 -0.04 0.00 0.00 0.00 0.00 60.65 61.90 1x5u s ILE 80 Cb -0.32 -3.22 0.19 0.00 0.01 0.00 0.00 42.46 39.12 1x5u s ILE 80 CO 0.73 -0.30 0.58 -0.54 0.00 0.00 0.00 174.94 175.41 1x5u s LYS 81 N -3.75 2.90 -0.02 2.79 1.02 -1.26 -0.85 119.74 120.57 1x5u s LYS 81 Ca 0.69 -2.72 -0.02 0.00 0.02 0.00 0.00 55.97 53.93 1x5u s LYS 81 Cb -0.21 -3.89 -0.04 0.00 -0.52 0.00 0.00 37.83 33.17 1x5u s LYS 81 CO 0.35 -1.21 0.14 -1.17 -0.92 0.00 0.00 175.35 172.53 1x5u s LEU 82 N -0.38 4.18 -0.21 3.17 2.96 -0.92 -4.60 118.68 122.87 1x5u s LEU 82 Ca 0.20 0.28 -0.03 0.00 -0.22 0.00 0.00 54.13 54.36 1x5u s LEU 82 Cb -0.16 -2.41 0.00 0.00 0.50 0.00 0.00 46.19 44.12 1x5u s LEU 82 CO -0.06 0.28 0.05 -1.22 -1.32 0.00 0.00 176.35 174.08 1x5u n TYR 83 N 1.16 -0.20 -3.42 5.38 4.01 -1.26 0.11 117.16 122.94 1x5u n TYR 83 Ca -0.13 0.05 -0.18 0.00 -0.16 0.00 0.00 57.90 57.48 1x5u n TYR 83 Cb 0.53 -0.43 0.04 0.00 -0.31 0.00 0.00 39.34 39.17 1x5u n TYR 83 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1x5u n GLY 84 N -1.18 -1.14 3.21 2.72 0.00 -1.26 -4.90 105.19 102.64 1x5u n GLY 84 Ca -0.03 0.51 0.04 0.00 0.00 0.00 0.00 46.02 46.54 1x5u n GLY 84 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1x5u s LYS 85 N -4.68 0.30 -1.08 1.61 1.02 0.30 -5.00 119.74 112.21 1x5u s LYS 85 Ca 0.30 0.59 -0.23 0.00 0.02 0.00 0.00 55.97 56.64 1x5u s LYS 85 Cb -0.08 0.33 -0.07 0.00 -0.52 0.00 0.00 37.83 37.49 1x5u s LYS 85 CO 0.80 -0.28 1.94 -1.25 -0.92 0.00 0.00 175.35 175.65 1x5u s PRO 86 N 2.82 2.51 0.48 -1.68 0.04 -1.25 -2.17 135.00 135.76 1x5u s PRO 86 Ca 0.04 -0.84 -0.23 0.00 0.04 0.00 0.00 61.00 60.00 1x5u s PRO 86 Cb -0.10 -5.18 -0.07 0.00 0.04 0.00 0.00 34.50 29.19 1x5u s PRO 86 CO -0.15 -3.77 1.26 0.96 0.04 0.00 0.00 177.00 175.35 1x5u s ILE 87 N 10.69 2.64 -0.07 0.56 -4.36 -0.03 -4.82 121.20 125.82 1x5u s ILE 87 Ca 0.69 0.49 0.01 0.00 -0.26 0.00 0.00 60.65 61.58 1x5u s ILE 87 Cb -0.03 -3.26 -0.03 0.00 1.25 0.00 0.00 42.46 40.39 1x5u s ILE 87 CO 0.08 0.01 -0.07 -0.60 0.24 0.00 0.00 174.94 174.60 1x5u s ARG 88 N -2.70 2.76 -0.02 0.37 6.06 -1.17 -2.55 118.95 121.69 1x5u s ARG 88 Ca 0.65 -0.56 0.01 0.00 -2.50 0.00 0.00 55.73 53.34 1x5u s ARG 88 Cb -0.35 -2.59 0.01 0.00 0.06 0.00 0.00 34.95 32.09 1x5u s ARG 88 CO 0.42 0.65 -0.05 0.08 -2.50 0.00 0.00 175.30 173.90 1x5u s VAL 89 N -0.77 0.48 0.22 7.11 1.01 -1.25 -1.82 120.40 125.38 1x5u s VAL 89 Ca 0.12 -0.17 -0.21 0.00 0.00 0.00 0.00 61.98 61.72 1x5u s VAL 89 Cb -0.11 -0.46 0.04 0.00 0.00 0.00 0.00 36.38 35.85 1x5u s VAL 89 CO 0.01 0.17 0.63 0.21 0.00 0.00 0.00 175.10 176.13 1x5u s ASN 90 N 0.40 -0.38 0.07 3.32 2.47 -1.13 -4.82 114.94 114.87 1x5u s ASN 90 Ca -0.05 -0.35 -0.30 0.00 0.42 0.00 0.00 52.86 52.58 1x5u s ASN 90 Cb -0.09 0.65 -0.09 0.00 -1.45 0.00 0.00 41.25 40.27 1x5u s ASN 90 CO -0.00 -1.14 1.92 -0.54 -3.72 0.00 0.00 177.10 173.61 1x5u s LYS 91 N -3.85 4.14 0.40 0.43 -0.14 -1.26 -0.45 119.74 119.01 1x5u s LYS 91 Ca 0.07 2.61 0.13 0.00 -1.36 0.00 0.00 55.97 57.41 1x5u s LYS 91 Cb -0.03 -3.96 0.96 0.00 -1.68 0.00 0.00 37.83 33.12 1x5u s LYS 91 CO -0.03 -0.92 1.90 0.00 -0.76 0.00 0.00 175.35 175.55 1x5u h ALA 92 N 9.89 2.00 -0.03 5.17 0.00 -1.76 -1.97 119.26 132.56 1x5u h ALA 92 Ca -0.48 0.00 -0.09 0.00 0.00 0.00 0.00 54.91 54.34 1x5u h ALA 92 Cb 1.23 -0.09 0.01 0.00 0.00 0.00 0.00 17.79 18.94 1x5u h ALA 92 CO 0.94 -0.21 -0.34 0.77 0.00 0.00 0.00 179.25 180.41 1x5u h SER 93 N 0.53 0.34 -0.70 0.00 0.02 -1.84 -3.28 113.55 108.62 1x5u h SER 93 Ca 0.39 -0.72 0.25 0.00 -0.84 0.00 0.00 61.79 60.87 1x5u h SER 93 Cb 0.78 -0.10 -0.13 0.00 0.14 0.00 0.00 62.40 63.09 1x5u h SER 93 CO -0.15 1.02 0.22 0.00 -1.14 0.00 0.00 176.83 176.78 1x5u n ALA 94 N -2.53 0.57 -1.82 3.77 0.00 -0.74 -3.40 120.51 116.35 1x5u n ALA 94 Ca -0.09 0.73 -0.21 0.00 0.00 0.00 0.00 53.44 53.87 1x5u n ALA 94 Cb 0.53 -0.64 -0.08 0.00 0.00 0.00 0.00 19.45 19.26 1x5u n ALA 94 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.50 176.49 1x5u s HIS 95 N -5.29 1.52 0.35 0.00 3.76 -1.22 -4.91 115.29 109.50 1x5u s HIS 95 Ca -0.07 1.40 -0.28 0.00 -0.15 0.00 0.00 55.06 55.96 1x5u s HIS 95 Cb 0.22 -3.68 -0.12 0.00 1.11 0.00 0.00 32.58 30.12 1x5u s HIS 95 CO 0.54 -1.20 1.45 0.27 -0.85 0.00 0.00 174.74 174.95 1x5u n ASN 96 N 16.90 3.50 -4.73 1.40 0.23 -1.22 -5.01 115.26 126.33 1x5u n ASN 96 Ca 0.43 1.21 -0.26 0.00 -0.53 0.00 0.00 54.58 55.43 1x5u n ASN 96 Cb 0.46 -1.57 -0.08 0.00 -2.08 0.00 0.00 39.78 36.51 1x5u n ASN 96 CO 0.00 0.00 0.00 -1.59 -0.93 0.00 0.00 177.26 174.74 1x5u s LYS 97 N -1.74 2.17 -0.59 -3.83 -2.85 -1.26 -5.10 119.74 106.54 1x5u s LYS 97 Ca 0.56 -1.96 -0.01 0.00 -1.00 0.00 0.00 55.97 53.56 1x5u s LYS 97 Cb -0.51 -1.88 0.15 0.00 -2.06 0.00 0.00 37.83 33.53 1x5u s LYS 97 CO 0.61 -0.16 0.39 0.54 0.10 0.00 0.00 175.35 176.82 1x5u s ASN 98 N -3.89 5.05 -0.08 0.03 4.22 -1.26 -5.04 114.94 113.97 1x5u s ASN 98 Ca 0.36 -2.84 -0.31 0.00 -2.14 0.00 0.00 52.86 47.93 1x5u s ASN 98 Cb 0.04 -1.81 0.12 0.00 1.28 0.00 0.00 41.25 40.89 1x5u s ASN 98 CO 0.20 -0.35 1.02 -0.22 -2.04 0.00 0.00 177.10 175.71 1x5u s LEU 99 N -0.04 -0.27 -0.71 3.54 2.96 -1.26 -5.11 118.68 117.79 1x5u s LEU 99 Ca 0.16 -0.01 -0.14 0.00 -0.22 0.00 0.00 54.13 53.93 1x5u s LEU 99 Cb -0.21 1.76 0.18 0.00 0.50 0.00 0.00 46.19 48.42 1x5u s LEU 99 CO -0.03 -0.47 0.65 -0.44 -1.32 0.00 0.00 176.35 174.74 1x5u s SER 100 N -2.37 6.45 0.64 3.68 0.01 -1.26 -5.06 113.70 115.80 1x5u s SER 100 Ca 0.07 -2.39 0.01 0.00 1.31 0.00 0.00 55.95 54.95 1x5u s SER 100 Cb -0.01 -2.18 0.09 0.00 0.21 0.00 0.00 66.02 64.13 1x5u s SER 100 CO -0.07 -0.65 0.89 -0.83 0.41 0.00 0.00 173.24 172.98 1x5u s GLY 101 N 2.54 1.78 0.02 3.44 0.00 -1.26 -5.04 107.32 108.80 1x5u s GLY 101 Ca 0.13 -1.61 -0.30 0.00 0.00 0.00 0.00 44.72 42.93 1x5u s GLY 101 CO -0.05 -1.17 1.43 2.56 0.00 0.00 0.00 173.10 175.88 1x5u s PRO 102 N -4.95 4.28 -0.28 2.90 0.04 -1.26 -5.00 135.00 130.72 1x5u s PRO 102 Ca 0.62 2.03 -0.15 0.00 0.04 0.00 0.00 61.00 63.54 1x5u s PRO 102 Cb -0.07 -3.53 0.09 0.00 0.04 0.00 0.00 34.50 31.02 1x5u s PRO 102 CO 0.41 -0.58 0.69 0.45 0.04 0.00 0.00 177.00 178.02 1x5u s SER 103 N 1.85 -0.96 -0.09 6.66 0.15 -1.26 -5.08 113.70 114.97 1x5u s SER 103 Ca 0.65 1.51 -0.02 0.00 0.70 0.00 0.00 55.95 58.79 1x5u s SER 103 Cb -0.33 1.47 -0.01 0.00 -1.71 0.00 0.00 66.02 65.44 1x5u s SER 103 CO 0.28 -0.23 -0.04 0.28 1.20 0.00 0.00 173.24 174.72 1x5u h SER 104 N 7.07 0.00 0.00 5.45 0.02 -2.08 -3.56 113.55 120.45 1x5u h SER 104 Ca -0.29 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.66 1x5u h SER 104 Cb 1.22 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.76 1x5u h SER 104 CO 0.16 0.45 0.00 0.61 -1.14 0.00 0.00 176.83 176.91