#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 -0.04 1.61 1.04 -1.26 -5.15 113.70 110.04 1x5u s SER 2 Ca 0.00 0.69 0.00 0.00 0.48 0.00 0.00 55.95 57.13 1x5u s SER 2 Cb 0.00 0.83 0.03 0.00 0.10 0.00 0.00 66.02 66.97 1x5u s SER 2 CO 0.00 -0.23 -0.01 -0.94 0.98 0.00 0.00 173.24 173.04 1x5u s SER 3 N 2.33 0.65 0.00 7.02 1.04 -1.26 -5.08 113.70 118.40 1x5u s SER 3 Ca -0.01 -0.05 0.00 0.00 0.48 0.00 0.00 55.95 56.37 1x5u s SER 3 Cb -0.12 -0.29 0.00 0.00 0.10 0.00 0.00 66.02 65.71 1x5u s SER 3 CO -0.10 -0.10 0.00 0.61 0.98 0.00 0.00 173.24 174.64 1x5u n GLY 4 N 4.20 -1.49 0.09 7.32 0.00 -1.26 -5.06 105.19 109.00 1x5u n GLY 4 Ca -0.24 0.91 -0.17 0.00 0.00 0.00 0.00 46.02 46.51 1x5u n GLY 4 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 1x5u h SER 5 N 0.00 0.18 0.00 1.61 0.87 -2.06 -3.45 113.55 110.70 1x5u h SER 5 Ca 0.00 -0.92 0.00 0.00 -1.23 0.00 0.00 61.79 59.64 1x5u h SER 5 Cb 0.00 -0.06 0.00 0.00 -0.44 0.00 0.00 62.40 61.90 1x5u h SER 5 CO 0.00 1.23 -0.02 -0.24 -0.53 0.00 0.00 176.83 177.27 1x5u n SER 6 N -4.38 0.71 0.00 6.23 2.88 -1.26 -5.03 113.62 112.77 1x5u n SER 6 Ca -0.15 0.09 0.00 0.00 -1.33 0.00 0.00 58.87 57.48 1x5u n SER 6 Cb 0.64 -0.23 0.00 0.00 -0.75 0.00 0.00 64.21 63.88 1x5u n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1x5u n GLY 7 N 3.43 1.39 0.02 0.46 0.00 -1.26 -4.69 105.19 104.55 1x5u n GLY 7 Ca -0.00 -0.78 0.00 0.00 0.00 0.00 0.00 46.02 45.24 1x5u n GLY 7 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1x5u n PRO 8 N 0.00 0.49 -1.61 1.61 -0.04 -1.26 -4.80 135.00 129.39 1x5u n PRO 8 Ca 0.00 0.00 -0.44 0.00 -0.04 0.00 0.00 63.50 63.02 1x5u n PRO 8 Cb 0.00 -1.01 -0.03 0.00 -0.04 0.00 0.00 33.50 32.42 1x5u n PRO 8 CO 0.00 0.00 0.00 1.51 -0.04 0.00 0.00 175.50 176.97 1x5u n ILE 9 N -0.47 0.43 -1.19 0.52 3.06 -1.26 -4.85 119.36 115.60 1x5u n ILE 9 Ca 0.00 -0.37 -0.24 0.00 -2.50 0.00 0.00 62.75 59.64 1x5u n ILE 9 Cb 0.00 -2.44 0.02 0.00 0.54 0.00 0.00 39.64 37.76 1x5u n ILE 9 CO 0.00 0.00 0.00 -0.24 -2.50 0.00 0.00 176.55 173.81 1x5u n SER 10 N 10.56 6.73 -4.59 9.51 2.88 -1.26 -4.99 113.62 132.45 1x5u n SER 10 Ca 0.28 -3.26 -0.40 0.00 -1.33 0.00 0.00 58.87 54.16 1x5u n SER 10 Cb 0.42 -1.10 0.03 0.00 -0.75 0.00 0.00 64.21 62.81 1x5u n SER 10 CO 0.00 0.00 0.00 1.21 -1.23 0.00 0.00 175.04 175.02 1x5u n GLU 11 N 0.26 1.12 -0.09 -1.46 4.07 -1.26 -4.95 120.64 118.33 1x5u n GLU 11 Ca 0.42 0.41 -0.15 0.00 -0.06 0.00 0.00 57.16 57.78 1x5u n GLU 11 Cb 0.56 -2.04 -0.08 0.00 -0.06 0.00 0.00 31.44 29.83 1x5u n GLU 11 CO 0.00 0.00 0.00 0.54 -0.06 0.00 0.00 177.13 177.61 1x5u n ARG 12 N -0.21 0.43 -1.33 5.31 5.12 -1.26 -4.59 116.66 120.14 1x5u n ARG 12 Ca 0.11 0.12 -0.32 0.00 -1.93 0.00 0.00 57.85 55.84 1x5u n ARG 12 Cb 0.42 -1.31 0.06 0.00 -1.16 0.00 0.00 32.46 30.48 1x5u n ARG 12 CO 0.00 0.00 0.00 0.09 -1.93 0.00 0.00 177.63 175.79 1x5u n ASN 13 N -3.26 7.38 -0.12 0.55 5.03 -1.26 -4.59 115.26 118.99 1x5u n ASN 13 Ca -0.33 -3.62 -0.11 0.00 0.87 0.00 0.00 54.58 51.39 1x5u n ASN 13 Cb 0.82 -1.02 -0.03 0.00 -1.02 0.00 0.00 39.78 38.53 1x5u n ASN 13 CO 0.00 0.00 0.00 -0.61 -1.83 0.00 0.00 177.26 174.82 1x5u h GLN 14 N 2.09 0.60 -0.99 3.52 -0.00 -1.99 -2.96 115.11 115.38 1x5u h GLN 14 Ca 0.53 -0.19 0.20 0.00 -0.00 0.00 0.00 58.65 59.19 1x5u h GLN 14 Cb 0.71 -0.05 -0.11 0.00 0.00 0.00 0.00 27.48 28.03 1x5u h GLN 14 CO 1.37 0.72 0.59 -0.44 0.00 0.00 0.00 178.83 181.07 1x5u h ASP 15 N 0.40 0.73 -0.26 -0.69 5.19 -1.95 0.08 116.42 119.92 1x5u h ASP 15 Ca 0.10 0.11 -0.18 0.00 -0.62 0.00 0.00 57.03 56.43 1x5u h ASP 15 Cb 0.45 -0.02 -0.07 0.00 0.18 0.00 0.00 39.33 39.87 1x5u h ASP 15 CO 0.02 0.22 0.16 0.00 -3.12 0.00 0.00 179.24 176.52 1x5u n ALA 16 N -2.33 4.83 -2.62 3.45 0.00 -1.12 -4.54 120.51 118.18 1x5u n ALA 16 Ca 0.24 -1.04 -0.17 0.00 0.00 0.00 0.00 53.44 52.46 1x5u n ALA 16 Cb 0.61 -1.34 -0.12 0.00 0.00 0.00 0.00 19.45 18.60 1x5u n ALA 16 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1x5u s THR 17 N -0.99 1.13 0.07 0.00 2.01 0.01 -0.99 115.64 116.88 1x5u s THR 17 Ca 0.22 -1.46 0.07 0.00 0.31 0.00 0.00 61.69 60.84 1x5u s THR 17 Cb 0.15 -1.22 -0.04 0.00 0.01 0.00 0.00 72.50 71.40 1x5u s THR 17 CO -0.02 -0.33 -0.15 0.68 -0.69 0.00 0.00 174.62 174.12 1x5u s VAL 18 N -1.68 3.06 -0.51 3.82 -7.23 -1.11 -0.64 120.40 116.10 1x5u s VAL 18 Ca 0.02 -1.23 -0.16 0.00 -1.81 0.00 0.00 61.98 58.79 1x5u s VAL 18 Cb -0.08 -2.36 0.10 0.00 0.56 0.00 0.00 36.38 34.60 1x5u s VAL 18 CO 0.02 0.23 0.47 -0.47 -0.31 0.00 0.00 175.10 175.04 1x5u s TYR 19 N -1.06 3.22 -0.39 2.82 6.14 0.88 -3.12 117.35 125.85 1x5u s TYR 19 Ca 0.17 -1.06 -0.20 0.00 0.64 0.00 0.00 57.07 56.62 1x5u s TYR 19 Cb -0.11 -3.50 0.01 0.00 0.42 0.00 0.00 41.96 38.78 1x5u s TYR 19 CO 0.09 -0.93 0.62 0.08 0.64 0.00 0.00 175.55 176.05 1x5u s VAL 20 N 1.73 4.88 -0.05 3.14 1.01 -0.43 -2.70 120.40 127.99 1x5u s VAL 20 Ca 0.05 0.35 0.05 0.00 0.00 0.00 0.00 61.98 62.42 1x5u s VAL 20 Cb -0.26 -4.11 -0.00 0.00 0.00 0.00 0.00 36.38 32.00 1x5u s VAL 20 CO 0.05 -0.42 -0.18 -0.83 0.00 0.00 0.00 175.10 173.72 1x5u s GLY 21 N 1.87 0.99 0.00 4.51 0.00 -0.54 0.78 107.32 114.93 1x5u s GLY 21 Ca 0.23 -0.75 0.00 0.00 0.00 0.00 0.00 44.72 44.20 1x5u s GLY 21 CO 0.16 -0.39 0.00 0.61 0.00 0.00 0.00 173.10 173.48 1x5u n GLY 22 N 3.14 0.62 3.93 0.20 0.00 0.15 -0.09 105.19 113.13 1x5u n GLY 22 Ca -0.18 -0.07 -0.27 0.00 0.00 0.00 0.00 46.02 45.49 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 -0.25 4.20 0.54 0.99 1.43 -0.48 -4.20 118.68 120.91 1x5u s LEU 23 Ca 0.00 0.43 0.08 0.00 -1.03 0.00 0.00 54.13 53.61 1x5u s LEU 23 Cb 0.00 -3.21 0.05 0.00 0.03 0.00 0.00 46.19 43.06 1x5u s LEU 23 CO 0.00 -0.08 0.57 -0.62 0.23 0.00 0.00 176.35 176.46 1x5u s ASP 24 N -3.24 4.90 0.20 2.29 2.15 -1.26 -4.63 116.67 117.08 1x5u s ASP 24 Ca 0.39 -1.01 -0.11 0.00 0.43 0.00 0.00 52.55 52.25 1x5u s ASP 24 Cb -0.11 0.25 0.20 0.00 -0.30 0.00 0.00 42.92 42.97 1x5u s ASP 24 CO 0.29 -1.16 1.79 1.05 -0.17 0.00 0.00 175.17 176.98 1x5u h GLU 25 N 0.52 0.57 -0.66 4.34 4.11 -1.96 -2.18 114.58 119.32 1x5u h GLU 25 Ca -0.34 -0.03 0.12 0.00 0.07 0.00 0.00 59.36 59.18 1x5u h GLU 25 Cb 1.29 -0.13 -0.09 0.00 0.50 0.00 0.00 28.75 30.33 1x5u h GLU 25 CO 0.50 0.37 0.19 0.87 0.07 0.00 0.00 179.01 181.01 1x5u h LYS 26 N 0.58 0.31 -6.35 1.06 1.57 -1.97 -3.42 116.57 108.36 1x5u h LYS 26 Ca 0.27 -0.02 -0.62 0.00 -1.87 0.00 0.00 60.65 58.41 1x5u h LYS 26 Cb 0.18 -0.07 0.11 0.00 0.08 0.00 0.00 32.23 32.53 1x5u h LYS 26 CO -0.18 0.21 -0.03 0.28 -0.57 0.00 0.00 179.45 179.15 1x5u n VAL 27 N -5.09 1.96 -4.16 0.50 0.31 -0.82 -4.99 118.33 106.04 1x5u n VAL 27 Ca 0.11 -0.49 -0.11 0.00 -0.01 0.00 0.00 64.34 63.84 1x5u n VAL 27 Cb 0.36 -0.74 -0.10 0.00 -0.91 0.00 0.00 33.84 32.45 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 -0.65 0.17 0.04 4.52 0.01 -1.26 -4.91 113.70 111.63 1x5u s SER 28 Ca 0.60 -1.28 -0.29 0.00 1.31 0.00 0.00 55.95 56.30 1x5u s SER 28 Cb -0.76 0.37 -0.17 0.00 0.21 0.00 0.00 66.02 65.67 1x5u s SER 28 CO 0.59 -0.83 1.45 -0.33 0.41 0.00 0.00 173.24 174.53 1x5u h GLU 29 N 2.66 -0.62 0.00 12.44 5.08 -1.97 -2.56 114.58 129.61 1x5u h GLU 29 Ca -0.35 0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.05 1x5u h GLU 29 Cb 1.23 0.14 0.00 0.00 0.50 0.00 0.00 28.75 30.62 1x5u h GLU 29 CO 0.53 -0.35 0.00 -0.35 -1.00 0.00 0.00 179.01 177.85 1x5u n PRO 30 N -5.31 0.49 -0.10 2.33 -0.04 -1.26 -2.97 135.00 128.14 1x5u n PRO 30 Ca -0.11 0.00 -0.23 0.00 -0.04 0.00 0.00 63.50 63.12 1x5u n PRO 30 Cb 0.30 -1.32 -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 -0.82 1.93 -0.29 1.53 7.94 -0.97 -4.24 117.00 122.08 1x5u n LEU 31 Ca 0.07 0.39 -0.05 0.00 -1.11 0.00 0.00 56.01 55.32 1x5u n LEU 31 Cb 0.03 -0.95 0.07 0.00 0.53 0.00 0.00 43.42 43.10 1x5u n LEU 31 CO 0.06 0.36 1.16 -0.07 -1.11 0.00 0.00 177.39 177.79 1x5u h LEU 32 N -0.93 0.94 0.00 -1.96 3.38 -1.43 -0.79 115.31 114.53 1x5u h LEU 32 Ca -0.41 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 57.50 1x5u h LEU 32 Cb 1.40 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 41.91 1x5u h LEU 32 CO -0.22 0.73 0.00 1.87 0.09 0.00 0.00 178.44 180.90 1x5u n TRP 33 N -4.48 0.00 -0.19 1.13 -0.00 -1.23 0.16 117.44 112.83 1x5u n TRP 33 Ca 0.07 0.00 -0.07 0.00 -0.00 0.00 0.00 57.50 57.50 1x5u n TRP 33 Cb 0.06 -0.50 0.02 0.00 -0.00 0.00 0.00 31.31 30.90 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 0.78 -0.14 5.87 4.81 -1.73 0.35 114.58 124.52 1x5u h GLU 34 Ca 0.00 -0.10 0.04 0.00 -0.13 0.00 0.00 59.36 59.17 1x5u h GLU 34 Cb 0.00 -0.15 -0.01 0.00 0.63 0.00 0.00 28.75 29.23 1x5u h GLU 34 CO 0.00 0.61 0.15 1.25 -0.73 0.00 0.00 179.01 180.29 1x5u h LEU 35 N 0.74 0.00 0.00 1.64 5.85 -0.56 -1.38 115.31 121.60 1x5u h LEU 35 Ca 0.19 0.00 -0.31 0.00 0.84 0.00 0.00 57.88 58.60 1x5u h LEU 35 Cb 0.07 0.00 -0.06 0.00 0.37 0.00 0.00 40.66 41.04 1x5u h LEU 35 CO -0.03 0.00 -2.04 0.49 -0.34 0.00 0.00 178.44 176.52 1x5u n PHE 36 N -3.91 0.45 -0.66 1.25 3.01 0.43 -4.27 117.46 113.76 1x5u n PHE 36 Ca 0.01 0.16 0.51 0.00 1.01 0.00 0.00 57.45 59.13 1x5u n PHE 36 Cb 0.27 -1.05 0.79 0.00 -0.01 0.00 0.00 39.48 39.47 1x5u n PHE 36 CO 0.00 0.00 0.00 1.28 1.01 0.00 0.00 176.76 179.05 1x5u n LEU 37 N -2.85 0.04 -0.20 4.37 4.77 0.12 0.11 117.00 123.36 1x5u n LEU 37 Ca -0.24 1.07 -0.01 0.00 -0.03 0.00 0.00 56.01 56.80 1x5u n LEU 37 Cb 1.07 -0.53 0.10 0.00 -2.33 0.00 0.00 43.42 41.73 1x5u n LEU 37 CO 0.44 -1.09 1.01 0.06 -1.33 0.00 0.00 177.39 176.48 1x5u h GLN 38 N 0.00 0.46 -0.21 3.23 3.07 -1.74 -2.43 115.11 117.48 1x5u h GLN 38 Ca 0.93 -0.03 -0.09 0.00 0.09 0.00 0.00 58.65 59.55 1x5u h GLN 38 Cb 3.58 -0.10 -0.00 0.00 0.08 0.00 0.00 27.48 31.03 1x5u h GLN 38 CO -0.10 0.30 -0.22 0.00 0.09 0.00 0.00 178.83 178.90 1x5u h ALA 39 N 1.39 0.31 -2.35 0.06 0.00 0.47 -3.49 119.26 115.64 1x5u h ALA 39 Ca 0.30 -0.36 0.20 0.00 0.00 0.00 0.00 54.91 55.04 1x5u h ALA 39 Cb 0.32 -0.07 -0.05 0.00 0.00 0.00 0.00 17.79 17.99 1x5u h ALA 39 CO -0.26 0.26 0.63 0.20 0.00 0.00 0.00 179.25 180.07 1x5u s GLY 40 N -3.55 -0.02 -1.02 0.00 0.00 -0.91 -4.79 107.32 97.01 1x5u s GLY 40 Ca -0.13 -0.12 -0.24 0.00 0.00 0.00 0.00 44.72 44.23 1x5u s GLY 40 CO 0.79 2.15 1.94 2.56 0.00 0.00 0.00 173.10 180.54 1x5u s PRO 41 N -2.38 2.53 0.21 2.90 0.04 -1.26 -3.83 135.00 133.21 1x5u s PRO 41 Ca 0.20 -0.66 -0.32 0.00 0.04 0.00 0.00 61.00 60.26 1x5u s PRO 41 Cb -0.01 -5.14 -0.14 0.00 0.04 0.00 0.00 34.50 29.25 1x5u s PRO 41 CO 0.03 -3.63 1.47 0.28 0.04 0.00 0.00 177.00 175.20 1x5u n VAL 42 N 7.84 0.57 -0.08 -0.36 0.31 -1.26 -2.57 118.33 122.78 1x5u n VAL 42 Ca 0.42 -0.14 -0.12 0.00 -0.01 0.00 0.00 64.34 64.48 1x5u n VAL 42 Cb 0.47 -1.48 -0.07 0.00 -0.91 0.00 0.00 33.84 31.84 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 3.27 0.67 -2.25 2.52 2.07 -0.55 -3.46 116.25 118.52 1x5u h VAL 43 Ca -0.45 -1.70 -0.04 0.00 0.82 0.00 0.00 66.70 65.33 1x5u h VAL 43 Cb 1.27 1.45 -0.17 0.00 -1.52 0.00 0.00 31.29 32.32 1x5u h VAL 43 CO 0.81 0.23 0.22 0.21 0.02 0.00 0.00 177.57 179.05 1x5u s ASN 44 N -6.24 -0.61 -0.08 0.57 2.47 -1.01 -5.03 114.94 105.01 1x5u s ASN 44 Ca -0.19 0.50 -0.01 0.00 0.42 0.00 0.00 52.86 53.58 1x5u s ASN 44 Cb 0.02 0.54 -0.03 0.00 -1.45 0.00 0.00 41.25 40.33 1x5u s ASN 44 CO 0.42 -0.69 -0.02 0.42 -3.72 0.00 0.00 177.10 173.51 1x5u s THR 45 N -1.90 4.14 -0.10 -5.21 -4.23 -1.26 -0.94 115.64 106.13 1x5u s THR 45 Ca -0.07 -0.32 0.02 0.00 -1.18 0.00 0.00 61.69 60.14 1x5u s THR 45 Cb -0.00 -2.73 0.01 0.00 1.34 0.00 0.00 72.50 71.12 1x5u s THR 45 CO 0.03 0.60 -0.17 -2.28 -0.54 0.00 0.00 174.62 172.26 1x5u s HIS 46 N -0.87 2.06 -0.18 3.99 2.46 -0.50 -4.99 115.29 117.27 1x5u s HIS 46 Ca 0.13 -0.93 -0.05 0.00 0.47 0.00 0.00 55.06 54.68 1x5u s HIS 46 Cb -0.11 -1.46 0.06 0.00 -0.13 0.00 0.00 32.58 30.95 1x5u s HIS 46 CO 0.02 -0.46 0.10 -1.64 -2.47 0.00 0.00 174.74 170.30 1x5u s MET 47 N 0.83 0.08 0.46 2.88 -1.94 -1.26 0.05 119.30 120.39 1x5u s MET 47 Ca -0.10 -0.06 -0.23 0.00 -1.71 0.00 0.00 55.69 53.59 1x5u s MET 47 Cb -0.16 -1.76 -0.07 0.00 2.01 0.00 0.00 34.83 34.85 1x5u s MET 47 CO 0.01 -0.68 1.16 -1.25 -0.01 0.00 0.00 175.02 174.25 1x5u s PRO 48 N 2.16 3.76 -0.11 2.03 0.04 -1.26 -5.00 135.00 136.62 1x5u s PRO 48 Ca 0.03 1.77 0.02 0.00 0.04 0.00 0.00 61.00 62.86 1x5u s PRO 48 Cb -0.16 -2.41 -0.01 0.00 0.04 0.00 0.00 34.50 31.96 1x5u s PRO 48 CO -0.10 -0.55 -0.19 0.15 0.04 0.00 0.00 177.00 176.36 1x5u s LYS 49 N -2.69 3.11 1.03 4.56 -0.14 -1.26 -4.09 119.74 120.26 1x5u s LYS 49 Ca 0.63 -0.79 -0.23 0.00 -1.36 0.00 0.00 55.97 54.23 1x5u s LYS 49 Cb -0.28 -2.43 -0.09 0.00 -1.68 0.00 0.00 37.83 33.34 1x5u s LYS 49 CO 0.35 0.25 -0.88 -3.47 -0.76 0.00 0.00 175.35 170.83 1x5u n ASP 50 N 3.38 -3.18 -0.03 2.83 2.03 -1.10 -4.78 116.55 115.70 1x5u n ASP 50 Ca -0.18 0.01 -0.01 0.00 0.52 0.00 0.00 54.79 55.13 1x5u n ASP 50 Cb 0.53 -0.71 -0.08 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 0.91 1.51 -0.01 -0.67 1.85 -1.26 -3.23 116.66 115.76 1x5u n ARG 51 Ca -0.01 -0.04 -0.17 0.00 -1.00 0.00 0.00 57.85 56.63 1x5u n ARG 51 Cb 0.68 -1.27 -0.14 0.00 -1.05 0.00 0.00 32.46 30.68 1x5u n ARG 51 CO 0.00 0.00 0.00 0.28 -0.01 0.00 0.00 177.63 177.90 1x5u h VAL 52 N 0.00 1.63 0.00 8.89 2.07 -1.98 -3.39 116.25 123.47 1x5u h VAL 52 Ca -0.17 -2.38 -0.28 0.00 0.82 0.00 0.00 66.70 64.68 1x5u h VAL 52 Cb 1.20 3.22 -0.05 0.00 -1.52 0.00 0.00 31.29 34.13 1x5u h VAL 52 CO 0.01 0.65 -2.13 0.35 0.02 0.00 0.00 177.57 176.47 1x5u n THR 53 N -4.36 1.07 -1.50 2.57 -2.24 -1.26 -5.02 114.28 103.54 1x5u n THR 53 Ca -0.12 -0.69 0.00 0.00 -2.27 0.00 0.00 64.05 60.97 1x5u n THR 53 Cb 0.65 -0.51 0.00 0.00 -2.10 0.00 0.00 70.33 68.37 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 1.93 0.51 3.15 3.38 0.00 -1.20 -5.01 105.19 107.94 1x5u n GLY 54 Ca -0.26 -0.86 -0.26 0.00 0.00 0.00 0.00 46.02 44.64 1x5u n GLY 54 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1x5u s GLN 55 N -3.07 1.75 -0.32 1.61 -1.52 -1.26 -4.64 119.66 112.21 1x5u s GLN 55 Ca 0.00 -0.62 -0.44 0.00 -1.95 0.00 0.00 55.36 52.35 1x5u s GLN 55 Cb 0.00 -1.55 -0.19 0.00 -0.22 0.00 0.00 33.01 31.05 1x5u s GLN 55 CO 0.00 0.27 1.47 -2.39 -0.25 0.00 0.00 175.29 174.39 1x5u n HIS 56 N 3.06 1.50 0.47 0.91 1.44 -1.26 -2.70 115.22 118.64 1x5u n HIS 56 Ca -0.18 1.03 -0.20 0.00 -2.01 0.00 0.00 57.72 56.37 1x5u n HIS 56 Cb 0.53 -2.23 -0.10 0.00 0.12 0.00 0.00 29.99 28.32 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 4.74 -1.20 0.00 -1.40 1.08 -1.94 -3.47 115.11 112.92 1x5u h GLN 57 Ca -0.46 0.08 0.00 0.00 -1.45 0.00 0.00 58.65 56.82 1x5u h GLN 57 Cb 1.38 0.27 0.00 0.00 -0.05 0.00 0.00 27.48 29.08 1x5u h GLN 57 CO 0.89 -0.80 0.00 0.41 -0.95 0.00 0.00 178.83 178.38 1x5u n GLY 58 N -1.63 0.00 3.59 3.46 0.00 -1.26 -4.94 105.19 104.41 1x5u n GLY 58 Ca -0.15 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.72 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 -0.71 0.00 1.61 1.13 -1.26 0.32 117.35 118.44 1x5u s TYR 59 Ca 0.00 1.55 0.00 0.00 -1.41 0.00 0.00 57.07 57.21 1x5u s TYR 59 Cb 0.00 0.33 0.00 0.00 -1.10 0.00 0.00 41.96 41.19 1x5u s TYR 59 CO 0.00 -0.45 0.00 0.41 -2.51 0.00 0.00 175.55 173.00 1x5u n GLY 60 N 1.97 5.28 3.42 5.49 0.00 0.23 -4.32 105.19 117.26 1x5u n GLY 60 Ca -0.16 -1.56 -0.16 0.00 0.00 0.00 0.00 46.02 44.15 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 -0.93 -0.49 -0.28 1.61 0.40 0.11 -1.31 117.98 117.09 1x5u s PHE 61 Ca 0.00 0.86 0.00 0.00 -0.60 0.00 0.00 56.93 57.19 1x5u s PHE 61 Cb 0.00 0.28 0.09 0.00 0.51 0.00 0.00 43.02 43.90 1x5u s PHE 61 CO 0.00 -0.50 0.04 0.08 0.70 0.00 0.00 175.22 175.54 1x5u s VAL 62 N -1.10 1.29 -0.68 -0.44 1.01 -1.18 -1.41 120.40 117.89 1x5u s VAL 62 Ca -0.11 -1.46 -0.26 0.00 0.00 0.00 0.00 61.98 60.15 1x5u s VAL 62 Cb -0.02 -1.84 0.04 0.00 0.00 0.00 0.00 36.38 34.55 1x5u s VAL 62 CO 0.07 -0.47 1.18 -0.70 0.00 0.00 0.00 175.10 175.18 1x5u s GLU 63 N 1.44 3.26 0.72 2.72 2.12 -0.12 -2.76 118.70 126.08 1x5u s GLU 63 Ca 0.05 -0.24 -0.11 0.00 0.36 0.00 0.00 54.97 55.03 1x5u s GLU 63 Cb -0.18 -4.14 0.03 0.00 0.26 0.00 0.00 34.13 30.09 1x5u s GLU 63 CO -0.15 -1.94 1.09 -0.06 -0.54 0.00 0.00 175.26 173.66 1x5u s PHE 64 N 5.13 3.19 0.14 5.30 0.08 -0.16 0.14 117.98 131.81 1x5u s PHE 64 Ca 0.34 1.12 -0.13 0.00 0.12 0.00 0.00 56.93 58.38 1x5u s PHE 64 Cb -0.10 -3.05 0.01 0.00 -0.57 0.00 0.00 43.02 39.32 1x5u s PHE 64 CO 0.17 -1.32 1.61 1.25 -0.10 0.00 0.00 175.22 176.83 1x5u h LEU 65 N -0.76 0.77 -8.01 -0.37 5.85 -1.79 -3.42 115.31 107.59 1x5u h LEU 65 Ca -0.45 -0.28 -0.42 0.00 0.84 0.00 0.00 57.88 57.56 1x5u h LEU 65 Cb 1.25 -0.21 -0.30 0.00 0.37 0.00 0.00 40.66 41.77 1x5u h LEU 65 CO 0.62 0.87 -0.79 -0.44 -0.34 0.00 0.00 178.44 178.36 1x5u s SER 66 N -6.25 1.21 0.23 1.25 0.01 -1.26 -5.04 113.70 103.85 1x5u s SER 66 Ca -0.13 -0.19 -0.15 0.00 1.31 0.00 0.00 55.95 56.80 1x5u s SER 66 Cb 0.11 -0.27 0.28 0.00 0.21 0.00 0.00 66.02 66.35 1x5u s SER 66 CO 0.80 0.08 1.57 -0.33 0.41 0.00 0.00 173.24 175.77 1x5u h GLU 67 N 6.23 -0.03 -0.99 12.44 3.07 -1.86 0.46 114.58 133.91 1x5u h GLU 67 Ca -0.33 0.00 0.33 0.00 -0.50 0.00 0.00 59.36 58.87 1x5u h GLU 67 Cb 1.17 0.01 -0.18 0.00 -0.84 0.00 0.00 28.75 28.91 1x5u h GLU 67 CO 0.49 -0.02 0.28 0.93 -1.40 0.00 0.00 179.01 179.29 1x5u h GLU 68 N -0.03 0.04 -0.61 2.33 5.08 -1.96 1.58 114.58 121.01 1x5u h GLU 68 Ca 0.36 -0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.70 1x5u h GLU 68 Cb 0.62 -0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.83 1x5u h GLU 68 CO -0.92 0.02 0.32 -0.44 -1.00 0.00 0.00 179.01 177.00 1x5u h ASP 69 N 0.04 0.76 0.61 1.42 3.32 -0.43 -2.89 116.42 119.25 1x5u h ASP 69 Ca 0.70 -0.06 -0.03 0.00 0.02 0.00 0.00 57.03 57.67 1x5u h ASP 69 Cb 1.66 -0.19 -0.00 0.00 0.22 0.00 0.00 39.33 41.01 1x5u h ASP 69 CO -0.83 0.62 -0.36 0.00 -1.72 0.00 0.00 179.24 176.95 1x5u h ALA 70 N 1.50 -1.19 -1.10 3.45 0.00 0.24 -1.21 119.26 120.96 1x5u h ALA 70 Ca 0.22 -0.19 0.32 0.00 0.00 0.00 0.00 54.91 55.25 1x5u h ALA 70 Cb 0.04 0.46 -0.12 0.00 0.00 0.00 0.00 17.79 18.18 1x5u h ALA 70 CO -0.03 -1.15 0.68 0.22 0.00 0.00 0.00 179.25 178.97 1x5u h ASP 71 N -0.91 0.44 -0.01 0.00 1.82 -1.44 0.85 116.42 117.16 1x5u h ASP 71 Ca -0.08 0.13 -0.11 0.00 -0.39 0.00 0.00 57.03 56.57 1x5u h ASP 71 Cb 0.72 0.07 -0.01 0.00 0.68 0.00 0.00 39.33 40.79 1x5u h ASP 71 CO 0.09 -0.03 -0.34 0.22 -1.61 0.00 0.00 179.24 177.58 1x5u h TYR 72 N 0.32 0.56 0.00 0.28 5.03 -1.25 -1.92 116.97 119.98 1x5u h TYR 72 Ca 0.69 -0.14 -0.17 0.00 2.58 0.00 0.00 58.73 61.68 1x5u h TYR 72 Cb 1.77 -0.13 -0.02 0.00 1.55 0.00 0.00 36.73 39.90 1x5u h TYR 72 CO -0.01 0.76 -0.82 0.00 -1.32 0.00 0.00 178.16 176.78 1x5u h ALA 73 N 1.23 0.59 0.00 1.82 0.00 0.18 -3.00 119.26 120.08 1x5u h ALA 73 Ca 0.05 -0.74 -0.03 0.00 0.00 0.00 0.00 54.91 54.19 1x5u h ALA 73 Cb 0.79 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.44 1x5u h ALA 73 CO 0.06 1.02 -0.13 0.82 0.00 0.00 0.00 179.25 181.03 1x5u h ILE 74 N 0.00 0.24 0.00 0.00 2.04 -0.59 0.63 117.51 119.82 1x5u h ILE 74 Ca -0.01 -1.21 -0.13 0.00 1.00 0.00 0.00 64.86 64.51 1x5u h ILE 74 Cb 1.50 2.01 -0.02 0.00 -0.74 0.00 0.00 36.82 39.57 1x5u h ILE 74 CO 0.11 0.13 -0.88 0.07 0.00 0.00 0.00 178.15 177.57 1x5u h LYS 75 N 0.00 0.00 0.00 2.37 2.10 -1.31 -3.21 116.57 116.52 1x5u h LYS 75 Ca -0.00 0.00 -0.34 0.00 -2.00 0.00 0.00 60.65 58.31 1x5u h LYS 75 Cb 1.00 0.00 -0.06 0.00 -0.90 0.00 0.00 32.23 32.27 1x5u h LYS 75 CO 0.02 0.43 -2.22 0.44 -2.00 0.00 0.00 179.45 176.12 1x5u n ILE 76 N -3.09 1.22 0.61 0.07 -5.35 -1.14 -4.44 119.36 107.24 1x5u n ILE 76 Ca -0.03 -0.41 -0.02 0.00 -0.27 0.00 0.00 62.75 62.03 1x5u n ILE 76 Cb 0.78 -1.45 0.06 0.00 -1.74 0.00 0.00 39.64 37.29 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 1.50 -4.11 6.28 2.81 0.22 -4.77 117.12 115.61 1x5u n MET 77 Ca -0.40 -0.58 -0.35 0.00 -1.81 0.00 0.00 57.70 54.56 1x5u n MET 77 Cb 0.87 -1.44 -0.07 0.00 -0.71 0.00 0.00 33.22 31.86 1x5u n MET 77 CO 0.00 0.00 0.00 0.34 1.51 0.00 0.00 175.97 177.82 1x5u s ASP 78 N 0.20 5.77 -1.22 7.83 2.15 -1.21 -4.09 116.67 126.10 1x5u s ASP 78 Ca 0.11 0.24 -0.07 0.00 0.43 0.00 0.00 52.55 53.25 1x5u s ASP 78 Cb 0.08 -1.72 0.06 0.00 -0.30 0.00 0.00 42.92 41.04 1x5u s ASP 78 CO 0.03 0.34 0.39 0.23 -0.17 0.00 0.00 175.17 175.99 1x5u n MET 79 N 1.64 -3.22 -2.25 4.34 2.81 -1.17 -4.93 117.12 114.35 1x5u n MET 79 Ca -0.16 0.49 -0.30 0.00 -1.81 0.00 0.00 57.70 55.92 1x5u n MET 79 Cb 0.54 -5.18 -0.00 0.00 -0.71 0.00 0.00 33.22 27.86 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 -2.86 4.73 -0.60 2.02 1.01 -1.23 -4.87 121.20 119.40 1x5u s ILE 80 Ca 0.32 0.75 -0.04 0.00 0.00 0.00 0.00 60.65 61.68 1x5u s ILE 80 Cb -0.17 -3.83 0.16 0.00 0.01 0.00 0.00 42.46 38.63 1x5u s ILE 80 CO 0.39 -0.93 0.42 -0.54 0.00 0.00 0.00 174.94 174.28 1x5u s LYS 81 N -4.73 2.54 0.02 2.79 1.02 -1.26 -1.76 119.74 118.35 1x5u s LYS 81 Ca 0.53 -2.40 0.00 0.00 0.02 0.00 0.00 55.97 54.13 1x5u s LYS 81 Cb -0.11 -3.76 -0.04 0.00 -0.52 0.00 0.00 37.83 33.40 1x5u s LYS 81 CO 0.45 -1.17 0.09 -1.17 -0.92 0.00 0.00 175.35 172.64 1x5u s LEU 82 N 0.18 3.92 -0.16 3.17 2.96 -0.96 -4.63 118.68 123.16 1x5u s LEU 82 Ca 0.15 0.13 -0.02 0.00 -0.22 0.00 0.00 54.13 54.17 1x5u s LEU 82 Cb -0.20 -2.36 0.00 0.00 0.50 0.00 0.00 46.19 44.13 1x5u s LEU 82 CO -0.04 0.25 0.04 -1.22 -1.32 0.00 0.00 176.35 174.06 1x5u n TYR 83 N 0.98 -0.15 -3.47 5.38 4.01 -1.26 0.12 117.16 122.78 1x5u n TYR 83 Ca -0.12 0.04 -0.20 0.00 -0.16 0.00 0.00 57.90 57.46 1x5u n TYR 83 Cb 0.52 -0.31 0.03 0.00 -0.31 0.00 0.00 39.34 39.27 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 -1.12 -1.13 3.21 2.72 0.00 -1.26 -4.92 105.19 102.69 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 -4.85 0.26 -1.04 1.61 1.02 0.33 -5.04 119.74 112.03 1x5u s LYS 85 Ca 0.31 0.51 -0.24 0.00 0.02 0.00 0.00 55.97 56.57 1x5u s LYS 85 Cb -0.09 0.29 -0.07 0.00 -0.52 0.00 0.00 37.83 37.45 1x5u s LYS 85 CO 0.82 -0.22 1.94 -1.25 -0.92 0.00 0.00 175.35 175.71 1x5u s PRO 86 N 2.78 2.53 0.77 -1.68 0.04 -1.26 -2.25 135.00 135.93 1x5u s PRO 86 Ca 0.01 -0.71 -0.14 0.00 0.04 0.00 0.00 61.00 60.20 1x5u s PRO 86 Cb -0.09 -5.15 0.06 0.00 0.04 0.00 0.00 34.50 29.36 1x5u s PRO 86 CO -0.14 -3.67 1.19 0.96 0.04 0.00 0.00 177.00 175.38 1x5u s ILE 87 N 10.53 2.33 -0.21 0.56 -4.36 -0.72 -4.86 121.20 124.47 1x5u s ILE 87 Ca 0.69 0.15 0.00 0.00 -0.26 0.00 0.00 60.65 61.23 1x5u s ILE 87 Cb -0.04 -2.60 0.05 0.00 1.25 0.00 0.00 42.46 41.12 1x5u s ILE 87 CO 0.06 -0.10 -0.07 -0.13 0.24 0.00 0.00 174.94 174.94 1x5u s ARG 88 N -4.13 1.72 -0.14 0.37 1.81 0.88 -3.04 118.95 116.42 1x5u s ARG 88 Ca 0.72 -0.84 -0.04 0.00 -1.72 0.00 0.00 55.73 53.85 1x5u s ARG 88 Cb -0.27 -2.42 -0.03 0.00 -0.45 0.00 0.00 34.95 31.78 1x5u s ARG 88 CO 0.48 -0.51 -0.02 0.08 -0.68 0.00 0.00 175.30 174.66 1x5u s VAL 89 N 1.45 4.09 0.18 3.52 1.01 -1.25 -1.46 120.40 127.94 1x5u s VAL 89 Ca -0.03 -0.30 -0.08 0.00 0.00 0.00 0.00 61.98 61.58 1x5u s VAL 89 Cb -0.17 -2.78 -0.02 0.00 0.00 0.00 0.00 36.38 33.41 1x5u s VAL 89 CO -0.07 0.52 0.27 0.21 0.00 0.00 0.00 175.10 176.03 1x5u s ASN 90 N 0.05 0.06 -0.14 3.32 2.47 -1.10 -4.79 114.94 114.82 1x5u s ASN 90 Ca 0.01 -1.00 -0.29 0.00 0.42 0.00 0.00 52.86 52.00 1x5u s ASN 90 Cb -0.13 0.44 -0.05 0.00 -1.45 0.00 0.00 41.25 40.06 1x5u s ASN 90 CO 0.02 -0.91 1.80 -0.54 -3.72 0.00 0.00 177.10 173.75 1x5u s LYS 91 N -4.02 3.82 0.30 0.43 -0.14 -1.26 -0.08 119.74 118.79 1x5u s LYS 91 Ca 0.22 2.02 0.05 0.00 -1.36 0.00 0.00 55.97 56.90 1x5u s LYS 91 Cb 0.04 -4.11 0.78 0.00 -1.68 0.00 0.00 37.83 32.86 1x5u s LYS 91 CO 0.04 -1.29 1.69 0.00 -0.76 0.00 0.00 175.35 175.02 1x5u h ALA 92 N 11.27 1.51 -0.61 5.17 0.00 -1.14 0.21 119.26 135.66 1x5u h ALA 92 Ca -0.39 0.17 -0.07 0.00 0.00 0.00 0.00 54.91 54.62 1x5u h ALA 92 Cb 1.19 0.16 -0.02 0.00 0.00 0.00 0.00 17.79 19.12 1x5u h ALA 92 CO 0.97 -0.38 0.10 1.03 0.00 0.00 0.00 179.25 180.97 1x5u h SER 93 N 0.38 0.97 -0.99 0.00 0.87 -1.78 -2.97 113.55 110.03 1x5u h SER 93 Ca 0.59 -0.26 0.36 0.00 -1.23 0.00 0.00 61.79 61.24 1x5u h SER 93 Cb 1.16 -0.26 -0.12 0.00 -0.44 0.00 0.00 62.40 62.75 1x5u h SER 93 CO -0.55 0.98 0.61 0.00 -0.53 0.00 0.00 176.83 177.34 1x5u n ALA 94 N -2.44 0.99 -0.90 6.23 0.00 0.73 -4.18 120.51 120.94 1x5u n ALA 94 Ca 0.03 0.70 -0.42 0.00 0.00 0.00 0.00 53.44 53.76 1x5u n ALA 94 Cb 0.28 -0.81 -0.09 0.00 0.00 0.00 0.00 19.45 18.83 1x5u n ALA 94 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1x5u n HIS 95 N -4.38 0.80 -3.91 0.00 8.25 -1.13 0.67 115.22 115.53 1x5u n HIS 95 Ca 0.31 0.53 -0.24 0.00 -0.26 0.00 0.00 57.72 58.06 1x5u n HIS 95 Cb 1.15 -1.63 -0.08 0.00 1.12 0.00 0.00 29.99 30.55 1x5u n HIS 95 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 1x5u n ASN 96 N 5.49 0.74 -4.76 0.41 3.02 -1.26 -4.81 115.26 114.08 1x5u n ASN 96 Ca 0.40 -0.99 -0.38 0.00 -0.03 0.00 0.00 54.58 53.58 1x5u n ASN 96 Cb -0.03 -1.23 0.03 0.00 -0.61 0.00 0.00 39.78 37.94 1x5u n ASN 96 CO 0.00 0.00 0.00 -0.75 -2.62 0.00 0.00 177.26 173.89 1x5u s LYS 97 N -6.39 3.31 0.19 3.52 2.47 0.21 -5.04 119.74 118.01 1x5u s LYS 97 Ca 0.00 2.05 0.11 0.00 -1.56 0.00 0.00 55.97 56.57 1x5u s LYS 97 Cb -0.00 -2.27 -0.04 0.00 -1.46 0.00 0.00 37.83 34.06 1x5u s LYS 97 CO 0.77 -1.00 -0.22 1.21 0.16 0.00 0.00 175.35 176.28 1x5u s ASN 98 N -1.15 3.57 -0.30 1.43 2.47 -1.26 -5.11 114.94 114.59 1x5u s ASN 98 Ca 0.70 -0.82 -0.13 0.00 0.42 0.00 0.00 52.86 53.03 1x5u s ASN 98 Cb -0.36 -0.33 -0.03 0.00 -1.45 0.00 0.00 41.25 39.08 1x5u s ASN 98 CO 0.42 0.12 0.26 -0.22 -3.72 0.00 0.00 177.10 173.96 1x5u s LEU 99 N -2.70 4.23 -0.00 3.21 0.20 -1.26 -4.98 118.68 117.38 1x5u s LEU 99 Ca 0.21 -0.11 -0.24 0.00 0.69 0.00 0.00 54.13 54.68 1x5u s LEU 99 Cb -0.08 -2.21 -0.16 0.00 -0.43 0.00 0.00 46.19 43.31 1x5u s LEU 99 CO 0.11 -0.17 1.18 0.28 -0.29 0.00 0.00 176.35 177.46 1x5u h SER 100 N 8.39 -0.31 -5.45 3.68 0.02 -2.06 -3.49 113.55 114.33 1x5u h SER 100 Ca -0.33 -0.21 0.35 0.00 -0.84 0.00 0.00 61.79 60.76 1x5u h SER 100 Cb 1.17 0.08 -0.15 0.00 0.14 0.00 0.00 62.40 63.64 1x5u h SER 100 CO 0.61 0.08 0.92 -0.83 -1.14 0.00 0.00 176.83 176.47 1x5u s GLY 101 N -2.82 -0.41 0.00 -3.77 0.00 -1.26 -4.99 107.32 94.07 1x5u s GLY 101 Ca -0.14 1.08 0.15 0.00 0.00 0.00 0.00 44.72 45.81 1x5u s GLY 101 CO 0.54 0.26 1.39 -1.55 0.00 0.00 0.00 173.10 173.74 1x5u n PRO 102 N -0.38 0.29 -3.98 2.90 -0.04 -1.26 -4.86 135.00 127.66 1x5u n PRO 102 Ca -0.06 0.11 -0.30 0.00 -0.04 0.00 0.00 63.50 63.21 1x5u n PRO 102 Cb 0.62 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.58 1x5u n PRO 102 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 1x5u n SER 103 N -1.21 -2.91 -4.63 3.54 7.64 -1.26 -4.86 113.62 109.94 1x5u n SER 103 Ca 0.08 -0.90 -0.43 0.00 1.01 0.00 0.00 58.87 58.64 1x5u n SER 103 Cb 0.10 -3.42 -0.02 0.00 -1.01 0.00 0.00 64.21 59.86 1x5u n SER 103 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 1x5u s SER 104 N -3.68 6.48 0.00 6.43 1.04 -1.26 -5.31 113.70 117.39 1x5u s SER 104 Ca 0.45 1.36 0.00 0.00 0.48 0.00 0.00 55.95 58.24 1x5u s SER 104 Cb -0.24 -2.54 0.00 0.00 0.10 0.00 0.00 66.02 63.35 1x5u s SER 104 CO 0.87 -1.22 0.00 0.61 0.98 0.00 0.00 173.24 174.48