#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 6.51 -0.03 1.61 0.01 -1.26 -5.10 113.70 115.45 1x5u s SER 2 Ca 0.00 0.62 -0.03 0.00 1.31 0.00 0.00 55.95 57.85 1x5u s SER 2 Cb 0.00 -2.13 0.01 0.00 0.21 0.00 0.00 66.02 64.11 1x5u s SER 2 CO 0.00 0.37 0.08 -0.55 0.41 0.00 0.00 173.24 173.55 1x5u s SER 3 N -0.98 -0.08 0.12 2.44 0.15 -1.26 -5.16 113.70 108.93 1x5u s SER 3 Ca 0.18 0.15 -0.24 0.00 0.70 0.00 0.00 55.95 56.73 1x5u s SER 3 Cb -0.13 0.15 0.08 0.00 -1.71 0.00 0.00 66.02 64.41 1x5u s SER 3 CO 0.07 -0.03 1.11 -0.83 1.20 0.00 0.00 173.24 174.76 1x5u s GLY 4 N 0.12 -0.01 0.67 9.45 0.00 -1.26 -4.84 107.32 111.45 1x5u s GLY 4 Ca -0.01 -0.14 -0.17 0.00 0.00 0.00 0.00 44.72 44.41 1x5u s GLY 4 CO -0.00 2.89 0.44 1.44 0.00 0.00 0.00 173.10 177.86 1x5u n SER 5 N -1.08 -1.48 -4.65 1.64 7.64 -1.26 -4.92 113.62 109.51 1x5u n SER 5 Ca -0.02 0.63 -0.40 0.00 1.01 0.00 0.00 58.87 60.09 1x5u n SER 5 Cb 0.60 -1.16 -0.07 0.00 -1.01 0.00 0.00 64.21 62.57 1x5u n SER 5 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 1x5u s SER 6 N -1.33 6.57 0.00 6.43 0.01 -1.26 -5.01 113.70 119.12 1x5u s SER 6 Ca 0.65 0.69 0.00 0.00 1.31 0.00 0.00 55.95 58.60 1x5u s SER 6 Cb -0.38 -2.31 0.00 0.00 0.21 0.00 0.00 66.02 63.54 1x5u s SER 6 CO 0.58 -0.23 0.00 0.61 0.41 0.00 0.00 173.24 174.61 1x5u n GLY 7 N 3.97 1.03 0.00 3.44 0.00 -1.26 -5.00 105.19 107.36 1x5u n GLY 7 Ca -0.04 0.50 0.07 0.00 0.00 0.00 0.00 46.02 46.56 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 0.14 -0.11 1.61 -0.04 -1.26 -3.02 135.00 132.32 1x5u n PRO 8 Ca 0.00 0.18 -0.23 0.00 -0.04 0.00 0.00 63.50 63.41 1x5u n PRO 8 Cb 0.00 -1.50 -0.12 0.00 -0.04 0.00 0.00 33.50 31.84 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 -1.35 1.56 -3.70 0.52 0.13 -1.26 -4.96 119.36 110.30 1x5u n ILE 9 Ca 0.06 -0.45 -0.29 0.00 -1.10 0.00 0.00 62.75 60.97 1x5u n ILE 9 Cb 0.13 -1.71 -0.05 0.00 -0.84 0.00 0.00 39.64 37.17 1x5u n ILE 9 CO 0.00 0.00 0.00 -1.20 2.80 0.00 0.00 176.55 178.15 1x5u n SER 10 N -3.79 -1.40 -3.57 9.51 7.64 -1.17 -4.84 113.62 115.99 1x5u n SER 10 Ca -0.45 -0.76 -0.23 0.00 1.01 0.00 0.00 58.87 58.44 1x5u n SER 10 Cb 0.92 -1.25 0.20 0.00 -1.01 0.00 0.00 64.21 63.07 1x5u n SER 10 CO 0.00 0.00 0.00 -1.84 -3.01 0.00 0.00 175.04 170.19 1x5u n GLU 11 N -3.23 -3.03 -3.25 1.43 0.00 -1.26 -4.91 120.64 106.39 1x5u n GLU 11 Ca 0.08 -0.90 -0.46 0.00 0.00 0.00 0.00 57.16 55.89 1x5u n GLU 11 Cb 0.39 -1.65 -0.04 0.00 0.00 0.00 0.00 31.44 30.13 1x5u n GLU 11 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.13 177.63 1x5u s ARG 12 N -3.98 3.08 0.28 3.44 6.06 -1.26 -4.92 118.95 121.65 1x5u s ARG 12 Ca 0.48 -1.69 0.02 0.00 -2.50 0.00 0.00 55.73 52.04 1x5u s ARG 12 Cb -0.09 -4.32 0.62 0.00 0.06 0.00 0.00 34.95 31.22 1x5u s ARG 12 CO 0.44 -1.39 1.79 -0.91 -2.50 0.00 0.00 175.30 172.72 1x5u h ASN 13 N 8.85 0.76 -2.86 -2.12 2.35 -2.02 -3.45 115.58 117.09 1x5u h ASN 13 Ca -0.24 0.08 -0.37 0.00 -0.55 0.00 0.00 56.30 55.22 1x5u h ASN 13 Cb 1.09 -0.06 -0.04 0.00 0.05 0.00 0.00 38.32 39.36 1x5u h ASN 13 CO 1.03 0.33 -0.44 0.00 -1.65 0.00 0.00 177.43 176.69 1x5u n GLN 14 N -4.75 -1.77 0.00 0.81 6.02 -1.26 -4.76 117.38 111.67 1x5u n GLN 14 Ca 0.20 0.92 0.00 0.00 -0.01 0.00 0.00 57.00 58.11 1x5u n GLN 14 Cb 0.46 -5.51 0.00 0.00 1.02 0.00 0.00 30.24 26.21 1x5u n GLN 14 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 177.06 172.58 1x5u n ASP 15 N -1.78 2.61 -0.01 1.08 2.03 -1.26 -3.65 116.55 115.56 1x5u n ASP 15 Ca -0.21 0.00 0.05 0.00 0.52 0.00 0.00 54.79 55.15 1x5u n ASP 15 Cb 0.65 0.13 -0.06 0.00 -0.72 0.00 0.00 41.12 41.12 1x5u n ASP 15 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1x5u n ALA 16 N -1.79 3.46 -2.29 -1.67 0.00 -1.26 -4.63 120.51 112.32 1x5u n ALA 16 Ca 0.00 -0.33 -0.29 0.00 0.00 0.00 0.00 53.44 52.82 1x5u n ALA 16 Cb 0.29 -0.41 -0.03 0.00 0.00 0.00 0.00 19.45 19.31 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 -2.05 4.87 0.28 0.00 2.01 -1.26 -1.72 115.64 117.78 1x5u s THR 17 Ca 0.05 0.38 0.09 0.00 0.31 0.00 0.00 61.69 62.52 1x5u s THR 17 Cb 0.09 -3.76 -0.04 0.00 0.01 0.00 0.00 72.50 68.80 1x5u s THR 17 CO 0.46 -0.53 0.04 0.68 -0.69 0.00 0.00 174.62 174.58 1x5u s VAL 18 N -2.36 3.39 -0.42 3.82 -7.23 -0.55 -3.66 120.40 113.39 1x5u s VAL 18 Ca 0.48 -1.84 -0.08 0.00 -1.81 0.00 0.00 61.98 58.74 1x5u s VAL 18 Cb -0.10 -2.90 0.09 0.00 0.56 0.00 0.00 36.38 34.02 1x5u s VAL 18 CO 0.33 -0.33 0.24 -0.47 -0.31 0.00 0.00 175.10 174.57 1x5u s TYR 19 N -2.34 3.38 -0.25 2.82 6.14 0.46 -3.23 117.35 124.34 1x5u s TYR 19 Ca 0.33 -1.74 -0.14 0.00 0.64 0.00 0.00 57.07 56.16 1x5u s TYR 19 Cb -0.05 -3.01 -0.04 0.00 0.42 0.00 0.00 41.96 39.28 1x5u s TYR 19 CO 0.21 -0.88 0.32 0.08 0.64 0.00 0.00 175.55 175.92 1x5u s VAL 20 N 1.36 5.23 -0.25 3.14 1.01 -0.80 -2.67 120.40 127.43 1x5u s VAL 20 Ca 0.04 0.49 -0.04 0.00 0.00 0.00 0.00 61.98 62.48 1x5u s VAL 20 Cb -0.23 -3.65 0.08 0.00 0.00 0.00 0.00 36.38 32.58 1x5u s VAL 20 CO 0.00 0.23 0.10 -0.83 0.00 0.00 0.00 175.10 174.60 1x5u s GLY 21 N 1.38 0.58 0.00 4.51 0.00 -0.39 -1.06 107.32 112.33 1x5u s GLY 21 Ca 0.14 -0.91 0.00 0.00 0.00 0.00 0.00 44.72 43.95 1x5u s GLY 21 CO 0.08 1.80 0.00 0.61 0.00 0.00 0.00 173.10 175.60 1x5u n GLY 22 N 5.16 0.90 3.88 0.20 0.00 0.18 -2.65 105.19 112.85 1x5u n GLY 22 Ca -0.06 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.62 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 1.09 0.99 1.43 -0.31 -3.81 118.68 122.40 1x5u s LEU 23 Ca 0.00 0.71 -0.15 0.00 -1.03 0.00 0.00 54.13 53.65 1x5u s LEU 23 Cb 0.00 -2.97 0.23 0.00 0.03 0.00 0.00 46.19 43.48 1x5u s LEU 23 CO 0.00 0.17 1.11 -0.62 0.23 0.00 0.00 176.35 177.24 1x5u s ASP 24 N -1.86 1.90 0.13 2.29 2.15 -1.26 -4.50 116.67 115.51 1x5u s ASP 24 Ca 0.33 0.91 -0.14 0.00 0.43 0.00 0.00 52.55 54.08 1x5u s ASP 24 Cb -0.13 -1.38 -0.03 0.00 -0.30 0.00 0.00 42.92 41.08 1x5u s ASP 24 CO 0.19 -3.55 1.53 1.05 -0.17 0.00 0.00 175.17 174.22 1x5u h GLU 25 N -2.18 0.78 -0.48 4.34 4.11 -1.98 -3.12 114.58 116.05 1x5u h GLU 25 Ca -0.50 -0.30 0.05 0.00 0.07 0.00 0.00 59.36 58.67 1x5u h GLU 25 Cb 1.32 -0.04 -0.05 0.00 0.50 0.00 0.00 28.75 30.48 1x5u h GLU 25 CO 0.48 0.92 0.21 0.87 0.07 0.00 0.00 179.01 181.56 1x5u h LYS 26 N 0.60 0.41 -3.82 1.06 1.57 -1.97 -3.44 116.57 110.98 1x5u h LYS 26 Ca 0.10 -0.02 -0.41 0.00 -1.87 0.00 0.00 60.65 58.45 1x5u h LYS 26 Cb 0.63 -0.09 0.09 0.00 0.08 0.00 0.00 32.23 32.94 1x5u h LYS 26 CO 0.04 0.27 -0.50 0.28 -0.57 0.00 0.00 179.45 178.97 1x5u n VAL 27 N -4.94 0.74 -4.24 0.50 0.31 -1.18 -4.97 118.33 104.55 1x5u n VAL 27 Ca 0.04 -0.32 -0.15 0.00 -0.01 0.00 0.00 64.34 63.90 1x5u n VAL 27 Cb 0.15 0.00 -0.09 0.00 -0.91 0.00 0.00 33.84 32.99 1x5u n VAL 27 CO 0.00 0.00 0.00 -0.94 -1.32 0.00 0.00 176.83 174.57 1x5u s SER 28 N -0.64 0.84 0.01 4.52 1.04 -1.26 -4.98 113.70 113.23 1x5u s SER 28 Ca 0.39 -1.55 -0.25 0.00 0.48 0.00 0.00 55.95 55.02 1x5u s SER 28 Cb -0.48 0.45 -0.17 0.00 0.10 0.00 0.00 66.02 65.93 1x5u s SER 28 CO 0.38 -0.93 1.24 -0.33 0.98 0.00 0.00 173.24 174.57 1x5u h GLU 29 N 2.40 -0.38 0.00 4.02 5.08 -1.96 -2.89 114.58 120.84 1x5u h GLU 29 Ca -0.31 0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.07 1x5u h GLU 29 Cb 1.24 0.09 0.00 0.00 0.50 0.00 0.00 28.75 30.58 1x5u h GLU 29 CO 0.46 -0.06 0.00 -0.35 -1.00 0.00 0.00 179.01 178.05 1x5u n PRO 30 N -5.12 0.49 -0.11 2.33 -0.04 -1.26 -3.02 135.00 128.26 1x5u n PRO 30 Ca -0.09 0.00 -0.22 0.00 -0.04 0.00 0.00 63.50 63.14 1x5u n PRO 30 Cb 0.26 -1.30 -0.10 0.00 -0.04 0.00 0.00 33.50 32.32 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 1.88 -0.29 1.53 7.94 -1.10 -4.32 117.00 121.84 1x5u n LEU 31 Ca 0.07 0.41 0.02 0.00 -1.11 0.00 0.00 56.01 55.40 1x5u n LEU 31 Cb 0.03 -0.91 0.15 0.00 0.53 0.00 0.00 43.42 43.22 1x5u n LEU 31 CO 0.05 0.28 1.15 -0.07 -1.11 0.00 0.00 177.39 177.69 1x5u h LEU 32 N -1.00 0.71 0.00 -1.96 3.38 -1.47 -0.79 115.31 114.18 1x5u h LEU 32 Ca -0.41 0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.60 1x5u h LEU 32 Cb 1.32 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 41.96 1x5u h LEU 32 CO -0.25 0.43 0.00 1.87 0.09 0.00 0.00 178.44 180.58 1x5u n TRP 33 N -4.71 0.00 -0.18 1.13 -0.00 -1.24 0.14 117.44 112.58 1x5u n TRP 33 Ca 0.13 0.00 -0.07 0.00 -0.00 0.00 0.00 57.50 57.56 1x5u n TRP 33 Cb 0.23 -0.44 0.03 0.00 -0.00 0.00 0.00 31.31 31.13 1x5u n TRP 33 CO 0.00 0.00 0.00 0.93 -0.00 0.00 0.00 177.69 178.62 1x5u h GLU 34 N 0.00 0.70 -0.37 5.87 5.08 -1.73 0.52 114.58 124.64 1x5u h GLU 34 Ca 0.00 -0.04 0.11 0.00 -1.00 0.00 0.00 59.36 58.43 1x5u h GLU 34 Cb 0.00 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 29.08 1x5u h GLU 34 CO 0.00 0.46 0.30 1.25 -1.00 0.00 0.00 179.01 180.02 1x5u h LEU 35 N 0.72 0.00 0.00 1.33 5.85 -0.50 -1.11 115.31 121.60 1x5u h LEU 35 Ca 0.20 0.00 -0.31 0.00 0.84 0.00 0.00 57.88 58.61 1x5u h LEU 35 Cb -0.08 0.00 -0.06 0.00 0.37 0.00 0.00 40.66 40.90 1x5u h LEU 35 CO -0.05 0.00 -2.02 0.49 -0.34 0.00 0.00 178.44 176.52 1x5u n PHE 36 N -4.19 0.49 -0.53 1.25 3.01 0.37 -4.27 117.46 113.59 1x5u n PHE 36 Ca 0.06 0.17 0.43 0.00 1.01 0.00 0.00 57.45 59.13 1x5u n PHE 36 Cb 0.48 -1.07 0.71 0.00 -0.01 0.00 0.00 39.48 39.60 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 0.15 -0.73 4.37 3.38 0.13 0.78 115.31 123.39 1x5u h LEU 37 Ca -0.39 0.12 0.14 0.00 0.09 0.00 0.00 57.88 57.84 1x5u h LEU 37 Cb 2.06 0.13 -0.10 0.00 0.09 0.00 0.00 40.66 42.84 1x5u h LEU 37 CO 0.05 -0.21 0.27 0.06 0.09 0.00 0.00 178.44 178.70 1x5u h GLN 38 N 0.00 0.39 -0.25 1.13 3.07 -1.74 -1.54 115.11 116.17 1x5u h GLN 38 Ca 0.90 -0.02 -0.07 0.00 0.09 0.00 0.00 58.65 59.54 1x5u h GLN 38 Cb 3.06 -0.09 -0.01 0.00 0.08 0.00 0.00 27.48 30.52 1x5u h GLN 38 CO -0.37 0.26 -0.12 0.00 0.09 0.00 0.00 178.83 178.69 1x5u h ALA 39 N 1.54 0.36 -2.42 0.06 0.00 0.28 -3.49 119.26 115.60 1x5u h ALA 39 Ca 0.40 -0.31 0.20 0.00 0.00 0.00 0.00 54.91 55.20 1x5u h ALA 39 Cb 0.62 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 18.28 1x5u h ALA 39 CO -0.41 0.22 0.64 0.41 0.00 0.00 0.00 179.25 180.11 1x5u n GLY 40 N -0.03 0.53 3.57 0.00 0.00 -0.58 -4.77 105.19 103.91 1x5u n GLY 40 Ca -0.04 -1.12 -0.27 0.00 0.00 0.00 0.00 46.02 44.59 1x5u n GLY 40 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1x5u s PRO 41 N -2.04 2.52 0.21 1.61 0.04 -1.26 -3.93 135.00 132.15 1x5u s PRO 41 Ca 0.24 -0.78 -0.32 0.00 0.04 0.00 0.00 61.00 60.18 1x5u s PRO 41 Cb -0.02 -5.16 -0.13 0.00 0.04 0.00 0.00 34.50 29.22 1x5u s PRO 41 CO 0.04 -3.72 1.50 0.28 0.04 0.00 0.00 177.00 175.14 1x5u n VAL 42 N 7.84 0.55 -0.08 -0.36 0.31 -1.26 -2.55 118.33 122.78 1x5u n VAL 42 Ca 0.43 -0.14 -0.14 0.00 -0.01 0.00 0.00 64.34 64.48 1x5u n VAL 42 Cb 0.47 -1.56 -0.09 0.00 -0.91 0.00 0.00 33.84 31.75 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 3.32 0.90 -2.95 2.52 2.07 -1.02 -3.46 116.25 117.63 1x5u h VAL 43 Ca -0.45 -1.87 0.01 0.00 0.82 0.00 0.00 66.70 65.20 1x5u h VAL 43 Cb 1.26 1.90 -0.11 0.00 -1.52 0.00 0.00 31.29 32.82 1x5u h VAL 43 CO 0.82 0.31 0.23 0.21 0.02 0.00 0.00 177.57 179.16 1x5u s ASN 44 N -6.30 -0.49 -0.10 0.57 2.47 -1.07 -4.79 114.94 105.22 1x5u s ASN 44 Ca -0.20 -0.12 0.01 0.00 0.42 0.00 0.00 52.86 52.97 1x5u s ASN 44 Cb 0.02 0.61 -0.02 0.00 -1.45 0.00 0.00 41.25 40.41 1x5u s ASN 44 CO 0.48 -1.02 -0.11 0.42 -3.72 0.00 0.00 177.10 173.14 1x5u s THR 45 N -3.74 3.29 -0.15 -5.21 -4.23 -1.26 -1.87 115.64 102.46 1x5u s THR 45 Ca 0.03 -0.61 0.02 0.00 -1.18 0.00 0.00 61.69 59.95 1x5u s THR 45 Cb -0.02 -2.35 0.01 0.00 1.34 0.00 0.00 72.50 71.47 1x5u s THR 45 CO -0.09 0.56 -0.20 -2.28 -0.54 0.00 0.00 174.62 172.06 1x5u s HIS 46 N -0.21 2.70 -0.18 3.99 2.46 -0.51 -5.01 115.29 118.53 1x5u s HIS 46 Ca 0.01 -1.31 -0.05 0.00 0.47 0.00 0.00 55.06 54.18 1x5u s HIS 46 Cb -0.13 -1.84 0.07 0.00 -0.13 0.00 0.00 32.58 30.55 1x5u s HIS 46 CO 0.03 -0.60 0.12 -1.64 -2.47 0.00 0.00 174.74 170.17 1x5u s MET 47 N 0.86 0.09 0.23 2.88 -1.94 -1.26 0.21 119.30 120.37 1x5u s MET 47 Ca -0.06 -0.04 -0.30 0.00 -1.71 0.00 0.00 55.69 53.58 1x5u s MET 47 Cb -0.15 -1.68 -0.09 0.00 2.01 0.00 0.00 34.83 34.92 1x5u s MET 47 CO -0.03 -0.68 1.28 -1.25 -0.01 0.00 0.00 175.02 174.33 1x5u s PRO 48 N 2.18 4.41 -0.27 2.03 0.04 -1.26 -4.96 135.00 137.18 1x5u s PRO 48 Ca 0.03 2.05 0.03 0.00 0.04 0.00 0.00 61.00 63.15 1x5u s PRO 48 Cb -0.16 -3.17 0.06 0.00 0.04 0.00 0.00 34.50 31.27 1x5u s PRO 48 CO -0.11 -0.18 -0.09 0.15 0.04 0.00 0.00 177.00 176.80 1x5u s LYS 49 N -0.57 2.16 0.19 4.56 -0.14 -1.26 -3.70 119.74 120.97 1x5u s LYS 49 Ca 0.54 -1.38 -0.27 0.00 -1.36 0.00 0.00 55.97 53.49 1x5u s LYS 49 Cb -0.36 -2.91 -0.16 0.00 -1.68 0.00 0.00 37.83 32.71 1x5u s LYS 49 CO 0.41 -0.60 0.52 -3.47 -0.76 0.00 0.00 175.35 171.45 1x5u n ASP 50 N 4.42 -1.16 -1.56 2.83 -0.08 -1.26 -4.67 116.55 115.08 1x5u n ASP 50 Ca -0.12 1.09 -0.09 0.00 -1.51 0.00 0.00 54.79 54.16 1x5u n ASP 50 Cb 0.42 -0.91 0.04 0.00 2.34 0.00 0.00 41.12 43.00 1x5u n ASP 50 CO 0.00 0.00 0.00 -2.11 0.12 0.00 0.00 177.20 175.21 1x5u n ARG 51 N 0.98 1.43 0.00 -0.67 1.85 -1.26 -1.39 116.66 117.60 1x5u n ARG 51 Ca 0.17 -0.91 0.00 0.00 -1.00 0.00 0.00 57.85 56.12 1x5u n ARG 51 Cb 0.24 -1.35 0.00 0.00 -1.05 0.00 0.00 32.46 30.29 1x5u n ARG 51 CO 0.00 0.00 0.00 1.33 -0.01 0.00 0.00 177.63 178.95 1x5u n VAL 52 N 0.44 0.00 0.00 8.89 0.24 -1.26 -4.92 118.33 121.72 1x5u n VAL 52 Ca 0.18 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.48 1x5u n VAL 52 Cb 0.68 -0.28 0.00 0.00 -1.47 0.00 0.00 33.84 32.77 1x5u n VAL 52 CO 0.00 0.00 0.00 0.35 -2.14 0.00 0.00 176.83 175.04 1x5u n THR 53 N -1.18 0.00 -1.59 3.34 -2.24 -1.23 -5.04 114.28 106.34 1x5u n THR 53 Ca 0.00 0.00 -0.01 0.00 -2.27 0.00 0.00 64.05 61.77 1x5u n THR 53 Cb 0.16 -0.35 -0.00 0.00 -2.10 0.00 0.00 70.33 68.04 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 1.91 0.38 3.08 3.38 0.00 -0.49 -5.02 105.19 108.44 1x5u n GLY 54 Ca 0.00 -0.94 -0.32 0.00 0.00 0.00 0.00 46.02 44.76 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 -3.20 2.67 0.21 1.61 -0.21 -1.26 -4.84 119.66 114.64 1x5u s GLN 55 Ca 0.00 -0.71 -0.24 0.00 0.02 0.00 0.00 55.36 54.43 1x5u s GLN 55 Cb 0.00 -2.33 -0.15 0.00 1.00 0.00 0.00 33.01 31.53 1x5u s GLN 55 CO 0.00 -0.19 0.41 -2.39 -2.12 0.00 0.00 175.29 170.99 1x5u n HIS 56 N 4.60 -0.67 -0.60 0.91 1.44 -1.26 -4.08 115.22 115.56 1x5u n HIS 56 Ca -0.19 0.83 -0.03 0.00 -2.01 0.00 0.00 57.72 56.31 1x5u n HIS 56 Cb 0.50 -1.74 -0.01 0.00 0.12 0.00 0.00 29.99 28.86 1x5u n HIS 56 CO 0.00 0.00 0.00 1.04 -2.81 0.00 0.00 176.34 174.57 1x5u n GLN 57 N 0.95 1.20 -3.42 -1.40 1.13 -1.24 -4.71 117.38 109.89 1x5u n GLN 57 Ca 0.15 -0.31 -0.25 0.00 -1.94 0.00 0.00 57.00 54.66 1x5u n GLN 57 Cb 0.25 -1.17 0.04 0.00 0.11 0.00 0.00 30.24 29.46 1x5u n GLN 57 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1x5u n GLY 58 N 1.43 -0.52 3.58 1.08 0.00 -1.26 -4.86 105.19 104.63 1x5u n GLY 58 Ca 0.08 0.18 -0.12 0.00 0.00 0.00 0.00 46.02 46.16 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 -3.21 -0.46 0.00 1.61 1.13 -1.26 0.47 117.35 115.63 1x5u s TYR 59 Ca 0.48 0.86 0.00 0.00 -1.41 0.00 0.00 57.07 57.00 1x5u s TYR 59 Cb -0.22 0.42 0.00 0.00 -1.10 0.00 0.00 41.96 41.06 1x5u s TYR 59 CO 0.59 -0.38 0.00 0.41 -2.51 0.00 0.00 175.55 173.66 1x5u n GLY 60 N 1.05 3.87 3.38 5.49 0.00 -0.22 -4.37 105.19 114.39 1x5u n GLY 60 Ca -0.13 -0.72 -0.13 0.00 0.00 0.00 0.00 46.02 45.04 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 -0.91 -0.40 -0.25 1.61 0.40 0.13 -1.90 117.98 116.66 1x5u s PHE 61 Ca 0.00 0.38 -0.02 0.00 -0.60 0.00 0.00 56.93 56.70 1x5u s PHE 61 Cb 0.00 0.34 0.08 0.00 0.51 0.00 0.00 43.02 43.95 1x5u s PHE 61 CO 0.00 -0.66 0.06 0.08 0.70 0.00 0.00 175.22 175.39 1x5u s VAL 62 N -2.70 0.72 -0.41 -0.44 1.01 -1.20 -1.43 120.40 115.95 1x5u s VAL 62 Ca -0.04 -0.95 -0.27 0.00 0.00 0.00 0.00 61.98 60.72 1x5u s VAL 62 Cb -0.00 -1.34 0.02 0.00 0.00 0.00 0.00 36.38 35.06 1x5u s VAL 62 CO -0.04 -0.40 1.03 -0.70 0.00 0.00 0.00 175.10 174.99 1x5u s GLU 63 N 1.74 3.80 0.50 2.72 2.12 -0.78 -1.48 118.70 127.31 1x5u s GLU 63 Ca 0.03 0.61 -0.04 0.00 0.36 0.00 0.00 54.97 55.93 1x5u s GLU 63 Cb -0.17 -3.84 -0.02 0.00 0.26 0.00 0.00 34.13 30.36 1x5u s GLU 63 CO -0.16 -1.13 0.79 -0.06 -0.54 0.00 0.00 175.26 174.16 1x5u s PHE 64 N 3.88 3.41 0.03 5.30 0.40 -0.70 -0.45 117.98 129.86 1x5u s PHE 64 Ca 0.43 0.64 -0.24 0.00 -0.60 0.00 0.00 56.93 57.15 1x5u s PHE 64 Cb -0.10 -2.41 -0.18 0.00 0.51 0.00 0.00 43.02 40.84 1x5u s PHE 64 CO 0.24 -0.43 1.49 1.25 0.70 0.00 0.00 175.22 178.46 1x5u h LEU 65 N 0.16 0.00 -9.14 -0.37 5.85 -1.80 -3.43 115.31 106.58 1x5u h LEU 65 Ca -0.47 -0.25 -0.64 0.00 0.84 0.00 0.00 57.88 57.36 1x5u h LEU 65 Cb 1.23 -0.00 -0.17 0.00 0.37 0.00 0.00 40.66 42.09 1x5u h LEU 65 CO 0.61 0.26 -0.79 -0.44 -0.34 0.00 0.00 178.44 177.74 1x5u s SER 66 N -5.46 3.75 0.18 1.25 0.01 -1.26 -5.03 113.70 107.14 1x5u s SER 66 Ca -0.15 -0.75 -0.14 0.00 1.31 0.00 0.00 55.95 56.22 1x5u s SER 66 Cb 0.04 -0.43 0.11 0.00 0.21 0.00 0.00 66.02 65.95 1x5u s SER 66 CO 0.67 0.11 1.79 -0.08 0.41 0.00 0.00 173.24 176.15 1x5u h GLU 67 N 3.10 0.51 -0.84 12.44 4.81 -1.87 -1.68 114.58 131.05 1x5u h GLU 67 Ca -0.47 -0.03 0.16 0.00 -0.13 0.00 0.00 59.36 58.89 1x5u h GLU 67 Cb 1.21 -0.11 -0.06 0.00 0.63 0.00 0.00 28.75 30.41 1x5u h GLU 67 CO 0.50 0.34 0.55 1.05 -0.73 0.00 0.00 179.01 180.72 1x5u h GLU 68 N 0.52 0.51 -0.78 1.92 9.09 -1.96 0.36 114.58 124.25 1x5u h GLU 68 Ca 0.21 -0.03 -0.01 0.00 0.05 0.00 0.00 59.36 59.58 1x5u h GLU 68 Cb 0.09 -0.11 -0.04 0.00 -1.65 0.00 0.00 28.75 27.03 1x5u h GLU 68 CO -0.13 0.34 0.44 -0.44 0.05 0.00 0.00 179.01 179.27 1x5u h ASP 69 N 0.52 0.95 0.85 3.06 3.32 -1.66 -2.22 116.42 121.24 1x5u h ASP 69 Ca 0.42 -0.07 -0.04 0.00 0.02 0.00 0.00 57.03 57.36 1x5u h ASP 69 Cb 0.86 -0.24 0.01 0.00 0.22 0.00 0.00 39.33 40.17 1x5u h ASP 69 CO -0.17 0.75 -0.41 0.00 -1.72 0.00 0.00 179.24 177.70 1x5u h ALA 70 N 1.41 -1.16 -1.02 3.45 0.00 -0.86 -2.08 119.26 119.01 1x5u h ALA 70 Ca 0.28 -0.25 0.24 0.00 0.00 0.00 0.00 54.91 55.18 1x5u h ALA 70 Cb -0.00 0.44 -0.11 0.00 0.00 0.00 0.00 17.79 18.12 1x5u h ALA 70 CO -0.05 -1.07 0.63 0.22 0.00 0.00 0.00 179.25 178.98 1x5u h ASP 71 N -1.29 0.59 -0.68 0.00 1.82 -1.45 0.24 116.42 115.66 1x5u h ASP 71 Ca -0.12 0.11 -0.06 0.00 -0.39 0.00 0.00 57.03 56.57 1x5u h ASP 71 Cb 0.87 0.01 -0.03 0.00 0.68 0.00 0.00 39.33 40.86 1x5u h ASP 71 CO 0.19 0.13 0.21 0.22 -1.61 0.00 0.00 179.24 178.37 1x5u h TYR 72 N 0.53 1.11 0.00 0.28 5.03 -1.26 -2.39 116.97 120.27 1x5u h TYR 72 Ca 0.61 -0.11 -0.07 0.00 2.58 0.00 0.00 58.73 61.73 1x5u h TYR 72 Cb 1.29 -0.32 -0.01 0.00 1.55 0.00 0.00 36.73 39.24 1x5u h TYR 72 CO -0.00 0.89 -0.34 0.00 -1.32 0.00 0.00 178.16 177.39 1x5u h ALA 73 N 1.09 1.00 0.00 1.82 0.00 0.11 -2.67 119.26 120.61 1x5u h ALA 73 Ca 0.22 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.82 1x5u h ALA 73 Cb 0.31 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.05 1x5u h ALA 73 CO -0.01 0.42 0.00 -0.89 0.00 0.00 0.00 179.25 178.78 1x5u n ILE 74 N -3.49 0.56 -0.02 0.00 5.41 -0.15 0.68 119.36 122.34 1x5u n ILE 74 Ca -0.00 -0.13 -0.05 0.00 1.00 0.00 0.00 62.75 63.57 1x5u n ILE 74 Cb 0.49 -0.69 -0.13 0.00 -0.71 0.00 0.00 39.64 38.61 1x5u n ILE 74 CO 0.00 0.00 0.00 2.29 0.00 0.00 0.00 176.55 178.84 1x5u n LYS 75 N -2.10 0.64 -0.11 0.38 2.85 -0.99 -3.95 118.16 114.88 1x5u n LYS 75 Ca 0.05 0.17 -0.15 0.00 -1.05 0.00 0.00 58.31 57.33 1x5u n LYS 75 Cb 0.37 -1.72 -0.11 0.00 -0.65 0.00 0.00 35.03 32.92 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 -2.87 1.30 0.24 0.58 -5.35 -1.12 -4.41 119.36 107.73 1x5u n ILE 76 Ca -0.18 -0.52 -0.07 0.00 -0.27 0.00 0.00 62.75 61.71 1x5u n ILE 76 Cb 0.98 -1.24 0.07 0.00 -1.74 0.00 0.00 39.64 37.71 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 -3.12 1.56 -3.53 6.28 2.81 0.21 -4.79 117.12 116.55 1x5u n MET 77 Ca -0.39 -1.05 -0.37 0.00 -1.81 0.00 0.00 57.70 54.08 1x5u n MET 77 Cb 0.94 -1.46 -0.07 0.00 -0.71 0.00 0.00 33.22 31.93 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 0.14 6.54 -1.70 7.83 -4.77 -1.25 -3.84 116.67 119.62 1x5u s ASP 78 Ca 0.20 0.64 -0.14 0.00 -3.30 0.00 0.00 52.55 49.95 1x5u s ASP 78 Cb 0.16 -2.20 0.13 0.00 -1.09 0.00 0.00 42.92 39.93 1x5u s ASP 78 CO 0.04 0.16 0.51 0.80 0.70 0.00 0.00 175.17 177.38 1x5u n MET 79 N 3.08 -1.87 -2.18 2.11 0.00 -1.20 -4.89 117.12 112.17 1x5u n MET 79 Ca -0.12 0.24 -0.32 0.00 0.00 0.00 0.00 57.70 57.49 1x5u n MET 79 Cb 0.52 -4.58 -0.01 0.00 0.00 0.00 0.00 33.22 29.16 1x5u n MET 79 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 175.97 176.39 1x5u s ILE 80 N -3.59 4.21 -0.59 1.12 1.01 -1.21 -4.76 121.20 117.38 1x5u s ILE 80 Ca 0.52 1.02 -0.08 0.00 0.00 0.00 0.00 60.65 62.11 1x5u s ILE 80 Cb -0.30 -3.57 0.15 0.00 0.01 0.00 0.00 42.46 38.76 1x5u s ILE 80 CO 0.97 -0.65 0.47 -0.54 0.00 0.00 0.00 174.94 175.19 1x5u s LYS 81 N -4.18 2.75 0.01 2.79 1.02 -1.26 -0.41 119.74 120.46 1x5u s LYS 81 Ca 0.61 -2.15 0.01 0.00 0.02 0.00 0.00 55.97 54.46 1x5u s LYS 81 Cb -0.13 -3.98 -0.04 0.00 -0.52 0.00 0.00 37.83 33.17 1x5u s LYS 81 CO 0.36 -1.21 0.03 -1.17 -0.92 0.00 0.00 175.35 172.44 1x5u s LEU 82 N 0.68 3.62 -0.18 3.17 2.96 -0.77 -4.67 118.68 123.49 1x5u s LEU 82 Ca 0.12 0.02 -0.02 0.00 -0.22 0.00 0.00 54.13 54.02 1x5u s LEU 82 Cb -0.21 -2.12 0.00 0.00 0.50 0.00 0.00 46.19 44.36 1x5u s LEU 82 CO -0.03 0.26 0.05 -1.22 -1.32 0.00 0.00 176.35 174.08 1x5u n TYR 83 N 1.21 -0.17 -3.38 5.38 4.01 -1.26 0.13 117.16 123.08 1x5u n TYR 83 Ca -0.13 0.04 -0.18 0.00 -0.16 0.00 0.00 57.90 57.47 1x5u n TYR 83 Cb 0.53 -0.37 0.04 0.00 -0.31 0.00 0.00 39.34 39.23 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 -1.15 -1.14 3.18 2.72 0.00 -1.26 -4.87 105.19 102.67 1x5u n GLY 84 Ca -0.03 0.52 0.05 0.00 0.00 0.00 0.00 46.02 46.56 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 -4.66 0.27 -1.09 1.61 1.02 0.34 -5.00 119.74 112.23 1x5u s LYS 85 Ca 0.35 0.50 -0.23 0.00 0.02 0.00 0.00 55.97 56.61 1x5u s LYS 85 Cb -0.08 0.28 -0.07 0.00 -0.52 0.00 0.00 37.83 37.44 1x5u s LYS 85 CO 0.79 -0.27 1.94 -1.25 -0.92 0.00 0.00 175.35 175.64 1x5u s PRO 86 N 2.87 2.53 1.21 -1.68 0.04 -1.25 -1.85 135.00 136.86 1x5u s PRO 86 Ca 0.03 -0.89 -0.14 0.00 0.04 0.00 0.00 61.00 60.05 1x5u s PRO 86 Cb -0.11 -5.19 0.30 0.00 0.04 0.00 0.00 34.50 29.54 1x5u s PRO 86 CO -0.14 -3.77 0.94 0.44 0.04 0.00 0.00 177.00 174.50 1x5u n ILE 87 N 7.82 0.00 -3.82 0.56 -5.35 0.46 -4.80 119.36 114.22 1x5u n ILE 87 Ca 0.43 -0.48 -0.19 0.00 -0.27 0.00 0.00 62.75 62.24 1x5u n ILE 87 Cb 0.47 -0.97 -0.17 0.00 -1.74 0.00 0.00 39.64 37.23 1x5u n ILE 87 CO 0.00 0.00 0.00 -0.60 -1.76 0.00 0.00 176.55 174.19 1x5u s ARG 88 N -4.32 0.26 0.03 6.28 6.06 -1.08 -3.20 118.95 122.97 1x5u s ARG 88 Ca 0.68 0.16 0.08 0.00 -2.50 0.00 0.00 55.73 54.16 1x5u s ARG 88 Cb -0.25 -0.59 -0.03 0.00 0.06 0.00 0.00 34.95 34.15 1x5u s ARG 88 CO 0.66 -0.22 -0.25 0.08 -2.50 0.00 0.00 175.30 173.07 1x5u s VAL 89 N 1.52 2.01 0.17 7.11 1.01 -1.25 -1.26 120.40 129.70 1x5u s VAL 89 Ca -0.03 -1.26 -0.24 0.00 0.00 0.00 0.00 61.98 60.45 1x5u s VAL 89 Cb -0.13 -1.70 0.06 0.00 0.00 0.00 0.00 36.38 34.61 1x5u s VAL 89 CO -0.03 0.40 0.92 0.21 0.00 0.00 0.00 175.10 176.60 1x5u s ASN 90 N -1.02 -0.20 0.08 3.32 3.04 -1.09 -4.81 114.94 114.26 1x5u s ASN 90 Ca 0.10 -0.42 -0.31 0.00 0.04 0.00 0.00 52.86 52.28 1x5u s ASN 90 Cb -0.10 0.52 -0.09 0.00 -1.54 0.00 0.00 41.25 40.05 1x5u s ASN 90 CO 0.01 -0.96 1.76 -0.54 -3.04 0.00 0.00 177.10 174.33 1x5u s LYS 91 N -3.38 4.16 0.37 0.43 -0.14 -1.26 -0.40 119.74 119.52 1x5u s LYS 91 Ca 0.12 2.46 0.11 0.00 -1.36 0.00 0.00 55.97 57.30 1x5u s LYS 91 Cb -0.02 -3.69 0.89 0.00 -1.68 0.00 0.00 37.83 33.33 1x5u s LYS 91 CO 0.02 -0.81 1.87 0.00 -0.76 0.00 0.00 175.35 175.68 1x5u h ALA 92 N 8.78 1.92 -0.34 5.17 0.00 -1.83 -1.14 119.26 131.82 1x5u h ALA 92 Ca -0.45 0.02 -0.27 0.00 0.00 0.00 0.00 54.91 54.21 1x5u h ALA 92 Cb 1.21 -0.10 -0.11 0.00 0.00 0.00 0.00 17.79 18.79 1x5u h ALA 92 CO 0.94 -0.16 0.26 -1.13 0.00 0.00 0.00 179.25 179.15 1x5u n SER 93 N -4.55 6.13 0.01 0.00 3.41 -1.24 -3.93 113.62 113.45 1x5u n SER 93 Ca 0.17 -2.90 0.00 0.00 -0.26 0.00 0.00 58.87 55.89 1x5u n SER 93 Cb 0.51 -1.13 0.00 0.00 -0.26 0.00 0.00 64.21 63.33 1x5u n SER 93 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1x5u n ALA 94 N 0.85 3.00 -1.47 7.33 0.00 -0.43 -5.08 120.51 124.71 1x5u n ALA 94 Ca 0.27 0.00 -0.44 0.00 0.00 0.00 0.00 53.44 53.27 1x5u n ALA 94 Cb 0.58 0.27 -0.01 0.00 0.00 0.00 0.00 19.45 20.29 1x5u n ALA 94 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 177.50 175.11 1x5u n HIS 95 N -2.84 -0.04 -2.54 0.00 1.44 -1.25 -4.83 115.22 105.16 1x5u n HIS 95 Ca 0.00 0.73 -0.41 0.00 -2.01 0.00 0.00 57.72 56.03 1x5u n HIS 95 Cb 0.26 -2.05 -0.03 0.00 0.12 0.00 0.00 29.99 28.29 1x5u n HIS 95 CO 0.00 0.00 0.00 -0.80 -2.81 0.00 0.00 176.34 172.73 1x5u s ASN 96 N -0.85 6.15 -0.27 4.39 -0.87 -1.26 -4.94 114.94 117.29 1x5u s ASN 96 Ca 0.62 -0.41 -0.24 0.00 -1.57 0.00 0.00 52.86 51.25 1x5u s ASN 96 Cb -0.72 -2.56 0.07 0.00 -0.02 0.00 0.00 41.25 38.03 1x5u s ASN 96 CO 0.58 -1.84 0.74 -0.54 -2.57 0.00 0.00 177.10 173.48 1x5u s LYS 97 N 5.74 0.80 -0.43 -0.60 1.02 -1.26 -5.12 119.74 119.89 1x5u s LYS 97 Ca 0.36 0.98 -0.46 0.00 0.02 0.00 0.00 55.97 56.87 1x5u s LYS 97 Cb -0.08 0.38 -0.20 0.00 -0.52 0.00 0.00 37.83 37.41 1x5u s LYS 97 CO 0.16 -0.10 1.55 0.09 -0.92 0.00 0.00 175.35 176.12 1x5u n ASN 98 N 2.76 1.13 -3.58 2.83 3.02 -1.26 -4.93 115.26 115.23 1x5u n ASN 98 Ca -0.14 1.18 -0.22 0.00 -0.03 0.00 0.00 54.58 55.37 1x5u n ASN 98 Cb 0.55 -0.90 -0.06 0.00 -0.61 0.00 0.00 39.78 38.76 1x5u n ASN 98 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1x5u n LEU 99 N 3.78 0.00 -4.81 3.41 -0.00 -1.26 -5.15 117.00 112.97 1x5u n LEU 99 Ca 0.30 -2.77 -0.34 0.00 -0.00 0.00 0.00 56.01 53.19 1x5u n LEU 99 Cb -0.04 0.94 -0.07 0.00 -0.00 0.00 0.00 43.42 44.25 1x5u n LEU 99 CO 0.86 -0.43 0.66 -0.94 -0.00 0.00 0.00 177.39 177.54 1x5u s SER 100 N -3.22 7.01 0.00 1.45 1.04 -1.26 -5.03 113.70 113.69 1x5u s SER 100 Ca 0.19 1.75 0.00 0.00 0.48 0.00 0.00 55.95 58.36 1x5u s SER 100 Cb 0.01 -2.55 0.00 0.00 0.10 0.00 0.00 66.02 63.58 1x5u s SER 100 CO 0.13 -0.31 0.00 0.61 0.98 0.00 0.00 173.24 174.65 1x5u n GLY 101 N -0.31 -0.12 3.57 7.32 0.00 -1.26 -4.95 105.19 109.44 1x5u n GLY 101 Ca 0.06 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.67 1x5u n GLY 101 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1x5u s PRO 102 N -0.29 2.96 0.23 1.61 0.04 -1.26 -4.99 135.00 133.30 1x5u s PRO 102 Ca 0.00 0.92 0.03 0.00 0.04 0.00 0.00 61.00 61.98 1x5u s PRO 102 Cb 0.00 -4.29 -0.03 0.00 0.04 0.00 0.00 34.50 30.22 1x5u s PRO 102 CO 0.00 -2.33 0.38 0.45 0.04 0.00 0.00 177.00 175.54 1x5u s SER 103 N 7.02 6.33 -0.79 6.66 0.15 -1.26 -4.50 113.70 127.31 1x5u s SER 103 Ca 0.71 0.21 -0.04 0.00 0.70 0.00 0.00 55.95 57.53 1x5u s SER 103 Cb -0.16 -1.92 0.00 0.00 -1.71 0.00 0.00 66.02 62.23 1x5u s SER 103 CO 0.26 -0.07 0.69 -0.24 1.20 0.00 0.00 173.24 175.08 1x5u n SER 104 N -1.13 -3.91 -0.92 5.45 2.88 -1.26 -5.30 113.62 109.42 1x5u n SER 104 Ca -0.07 -0.34 0.12 0.00 -1.33 0.00 0.00 58.87 57.24 1x5u n SER 104 Cb 0.56 -3.26 0.10 0.00 -0.75 0.00 0.00 64.21 60.85 1x5u n SER 104 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42