#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 3.69 -0.02 1.61 0.15 -1.26 -5.10 113.70 112.77 1x5u s SER 2 Ca 0.00 -1.09 -0.28 0.00 0.70 0.00 0.00 55.95 55.28 1x5u s SER 2 Cb 0.00 -1.17 0.10 0.00 -1.71 0.00 0.00 66.02 63.23 1x5u s SER 2 CO 0.00 -0.21 0.81 -0.44 1.20 0.00 0.00 173.24 174.60 1x5u s SER 3 N 1.41 -0.47 0.00 5.45 0.01 -1.26 -5.17 113.70 113.67 1x5u s SER 3 Ca -0.05 0.25 0.00 0.00 1.31 0.00 0.00 55.95 57.47 1x5u s SER 3 Cb -0.18 0.44 0.00 0.00 0.21 0.00 0.00 66.02 66.49 1x5u s SER 3 CO -0.07 -0.62 0.00 0.61 0.41 0.00 0.00 173.24 173.58 1x5u n GLY 4 N 0.22 0.69 3.70 3.44 0.00 -1.26 -5.07 105.19 106.91 1x5u n GLY 4 Ca -0.13 -2.07 -0.35 0.00 0.00 0.00 0.00 46.02 43.47 1x5u n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1x5u s SER 5 N -3.82 5.64 -0.06 1.61 0.01 -1.26 -5.08 113.70 110.74 1x5u s SER 5 Ca 0.00 0.19 -0.30 0.00 1.31 0.00 0.00 55.95 57.15 1x5u s SER 5 Cb 0.00 -1.81 -0.02 0.00 0.21 0.00 0.00 66.02 64.39 1x5u s SER 5 CO 0.00 0.30 1.02 -0.94 0.41 0.00 0.00 173.24 174.03 1x5u s SER 6 N -0.38 7.26 0.00 2.44 1.04 -1.26 -4.91 113.70 117.89 1x5u s SER 6 Ca 0.09 1.61 0.00 0.00 0.48 0.00 0.00 55.95 58.13 1x5u s SER 6 Cb -0.12 -2.56 0.00 0.00 0.10 0.00 0.00 66.02 63.44 1x5u s SER 6 CO 0.02 -0.40 0.00 0.61 0.98 0.00 0.00 173.24 174.45 1x5u n GLY 7 N 3.06 1.00 3.77 7.32 0.00 -1.26 -5.11 105.19 113.97 1x5u n GLY 7 Ca 0.08 -1.96 -0.36 0.00 0.00 0.00 0.00 46.02 43.77 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 -1.27 3.61 -0.13 1.61 0.04 -1.26 -5.05 135.00 132.55 1x5u s PRO 8 Ca 0.00 1.71 -0.04 0.00 0.04 0.00 0.00 61.00 62.71 1x5u s PRO 8 Cb 0.00 -2.26 0.06 0.00 0.04 0.00 0.00 34.50 32.34 1x5u s PRO 8 CO 0.00 -0.66 0.17 0.42 0.04 0.00 0.00 177.00 176.97 1x5u s ILE 9 N -1.63 -0.27 0.31 0.56 1.01 -1.26 -5.03 121.20 114.90 1x5u s ILE 9 Ca 0.67 0.17 0.05 0.00 0.00 0.00 0.00 60.65 61.54 1x5u s ILE 9 Cb -0.27 -0.43 0.36 0.00 0.01 0.00 0.00 42.46 42.12 1x5u s ILE 9 CO 0.32 0.00 1.61 -1.28 0.00 0.00 0.00 174.94 175.59 1x5u h SER 10 N 8.35 -0.11 -3.42 3.58 0.87 -2.00 -3.41 113.55 117.42 1x5u h SER 10 Ca -0.14 0.24 -0.41 0.00 -1.23 0.00 0.00 61.79 60.25 1x5u h SER 10 Cb 1.13 0.34 0.20 0.00 -0.44 0.00 0.00 62.40 63.63 1x5u h SER 10 CO 0.20 -0.27 0.11 -1.61 -0.53 0.00 0.00 176.83 174.72 1x5u s GLU 11 N -5.89 -1.56 -0.32 2.24 2.02 -1.26 -4.84 118.70 109.09 1x5u s GLU 11 Ca -0.12 -0.13 -0.41 0.00 0.02 0.00 0.00 54.97 54.33 1x5u s GLU 11 Cb 0.28 -1.56 -0.16 0.00 0.10 0.00 0.00 34.13 32.79 1x5u s GLU 11 CO 0.78 -3.92 1.71 0.54 0.02 0.00 0.00 175.26 174.39 1x5u n ARG 12 N -4.90 0.93 -3.77 1.61 3.00 -1.26 -4.90 116.66 107.37 1x5u n ARG 12 Ca 0.14 0.34 -0.34 0.00 -0.01 0.00 0.00 57.85 57.99 1x5u n ARG 12 Cb 0.60 -1.99 -0.10 0.00 0.00 0.00 0.00 32.46 30.97 1x5u n ARG 12 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.63 178.17 1x5u s ASN 13 N 3.41 5.25 0.24 0.55 2.20 -1.26 -4.94 114.94 120.39 1x5u s ASN 13 Ca 1.00 -3.38 -0.06 0.00 -0.94 0.00 0.00 52.86 49.48 1x5u s ASN 13 Cb -1.15 -1.79 0.45 0.00 -2.00 0.00 0.00 41.25 36.75 1x5u s ASN 13 CO 0.69 -0.23 1.67 -0.61 -2.94 0.00 0.00 177.10 175.68 1x5u h GLN 14 N 6.27 0.22 -0.87 3.55 5.75 -1.97 -0.24 115.11 127.81 1x5u h GLN 14 Ca 0.07 -0.01 0.21 0.00 -0.15 0.00 0.00 58.65 58.77 1x5u h GLN 14 Cb 0.86 -0.05 -0.15 0.00 1.07 0.00 0.00 27.48 29.20 1x5u h GLN 14 CO 0.75 0.14 0.01 -0.44 -2.65 0.00 0.00 178.83 176.65 1x5u h ASP 15 N 0.22 -0.41 -0.28 -0.69 3.32 -1.99 0.46 116.42 117.06 1x5u h ASP 15 Ca 0.41 0.23 -0.19 0.00 0.02 0.00 0.00 57.03 57.50 1x5u h ASP 15 Cb 0.71 0.41 -0.08 0.00 0.22 0.00 0.00 39.33 40.59 1x5u h ASP 15 CO -0.54 -0.25 0.18 0.00 -1.72 0.00 0.00 179.24 176.91 1x5u n ALA 16 N -3.04 4.85 -2.64 3.45 0.00 -0.10 -4.85 120.51 118.18 1x5u n ALA 16 Ca 0.18 -1.08 -0.18 0.00 0.00 0.00 0.00 53.44 52.36 1x5u n ALA 16 Cb 0.59 -1.35 -0.12 0.00 0.00 0.00 0.00 19.45 18.58 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 -1.07 1.14 0.08 0.00 2.01 0.16 0.69 115.64 118.64 1x5u s THR 17 Ca 0.23 -1.43 0.05 0.00 0.31 0.00 0.00 61.69 60.86 1x5u s THR 17 Cb 0.16 -1.20 -0.04 0.00 0.01 0.00 0.00 72.50 71.43 1x5u s THR 17 CO -0.02 -0.30 -0.05 0.68 -0.69 0.00 0.00 174.62 174.24 1x5u s VAL 18 N -1.58 3.71 -0.51 3.82 -7.23 -0.93 -3.26 120.40 114.41 1x5u s VAL 18 Ca 0.01 -1.04 -0.16 0.00 -1.81 0.00 0.00 61.98 58.98 1x5u s VAL 18 Cb -0.08 -2.72 0.10 0.00 0.56 0.00 0.00 36.38 34.23 1x5u s VAL 18 CO 0.02 0.18 0.48 -0.47 -0.31 0.00 0.00 175.10 175.00 1x5u s TYR 19 N -1.21 3.21 -0.34 2.82 6.14 0.27 -3.07 117.35 125.18 1x5u s TYR 19 Ca 0.22 -1.06 -0.18 0.00 0.64 0.00 0.00 57.07 56.69 1x5u s TYR 19 Cb -0.11 -3.53 -0.01 0.00 0.42 0.00 0.00 41.96 38.74 1x5u s TYR 19 CO 0.14 -0.94 0.52 0.08 0.64 0.00 0.00 175.55 175.98 1x5u s VAL 20 N 1.77 5.02 -0.20 3.14 1.01 -0.48 -1.96 120.40 128.68 1x5u s VAL 20 Ca 0.05 0.39 -0.02 0.00 0.00 0.00 0.00 61.98 62.40 1x5u s VAL 20 Cb -0.26 -3.96 0.06 0.00 0.00 0.00 0.00 36.38 32.22 1x5u s VAL 20 CO 0.05 -0.20 0.02 -0.83 0.00 0.00 0.00 175.10 174.14 1x5u s GLY 21 N 1.75 0.84 0.00 4.51 0.00 -0.11 0.81 107.32 115.11 1x5u s GLY 21 Ca 0.19 -0.85 0.00 0.00 0.00 0.00 0.00 44.72 44.06 1x5u s GLY 21 CO 0.13 1.31 0.00 0.61 0.00 0.00 0.00 173.10 175.15 1x5u n GLY 22 N 4.96 0.87 3.91 0.20 0.00 0.81 -1.91 105.19 114.04 1x5u n GLY 22 Ca -0.10 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.64 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 4.13 0.28 0.99 1.43 -1.13 -3.99 118.68 120.39 1x5u s LEU 23 Ca 0.00 0.59 0.04 0.00 -1.03 0.00 0.00 54.13 53.74 1x5u s LEU 23 Cb 0.00 -3.39 -0.03 0.00 0.03 0.00 0.00 46.19 42.80 1x5u s LEU 23 CO 0.00 -0.13 0.42 -0.62 0.23 0.00 0.00 176.35 176.25 1x5u s ASP 24 N -3.12 6.24 0.37 2.29 2.15 -1.26 -4.57 116.67 118.76 1x5u s ASP 24 Ca 0.42 0.09 0.18 0.00 0.43 0.00 0.00 52.55 53.67 1x5u s ASP 24 Cb -0.11 -1.76 1.12 0.00 -0.30 0.00 0.00 42.92 41.87 1x5u s ASP 24 CO 0.29 -0.19 1.70 1.05 -0.17 0.00 0.00 175.17 177.85 1x5u h GLU 25 N 1.03 0.34 -0.06 4.34 -0.00 -1.96 0.77 114.58 119.03 1x5u h GLU 25 Ca -0.50 -0.02 0.03 0.00 -0.00 0.00 0.00 59.36 58.87 1x5u h GLU 25 Cb 1.23 -0.08 -0.04 0.00 -0.00 0.00 0.00 28.75 29.87 1x5u h GLU 25 CO 0.59 0.22 -0.16 0.87 -0.00 0.00 0.00 179.01 180.53 1x5u h LYS 26 N 0.35 -0.23 -5.32 1.06 1.57 -1.96 -3.43 116.57 108.60 1x5u h LYS 26 Ca 0.69 0.02 -0.53 0.00 -1.87 0.00 0.00 60.65 58.96 1x5u h LYS 26 Cb 1.71 0.05 0.16 0.00 0.08 0.00 0.00 32.23 34.24 1x5u h LYS 26 CO -0.45 -0.15 -1.07 0.28 -0.57 0.00 0.00 179.45 177.49 1x5u n VAL 27 N -5.30 0.00 -3.93 0.50 0.31 0.26 -4.99 118.33 105.18 1x5u n VAL 27 Ca -0.04 -0.44 -0.10 0.00 -0.01 0.00 0.00 64.34 63.75 1x5u n VAL 27 Cb 0.22 0.00 -0.06 0.00 -0.91 0.00 0.00 33.84 33.08 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 -0.89 -0.01 0.07 4.52 0.01 -1.26 -4.95 113.70 111.20 1x5u s SER 28 Ca 0.49 -0.81 -0.33 0.00 1.31 0.00 0.00 55.95 56.62 1x5u s SER 28 Cb -0.42 0.46 -0.19 0.00 0.21 0.00 0.00 66.02 66.08 1x5u s SER 28 CO 0.60 -0.92 1.63 -0.33 0.41 0.00 0.00 173.24 174.63 1x5u h GLU 29 N 2.49 -0.84 0.00 12.44 5.08 -1.97 -2.12 114.58 129.65 1x5u h GLU 29 Ca -0.31 0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.11 1x5u h GLU 29 Cb 1.23 0.19 0.00 0.00 0.50 0.00 0.00 28.75 30.67 1x5u h GLU 29 CO 0.46 -0.56 0.00 -0.35 -1.00 0.00 0.00 179.01 177.56 1x5u n PRO 30 N -5.47 0.49 -0.11 2.33 -0.04 -1.26 -3.04 135.00 127.90 1x5u n PRO 30 Ca -0.13 0.00 -0.21 0.00 -0.04 0.00 0.00 63.50 63.11 1x5u n PRO 30 Cb 0.35 -1.32 -0.10 0.00 -0.04 0.00 0.00 33.50 32.40 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 1.88 -0.20 1.53 7.94 -0.82 -4.29 117.00 122.23 1x5u n LEU 31 Ca 0.07 0.42 -0.04 0.00 -1.11 0.00 0.00 56.01 55.35 1x5u n LEU 31 Cb 0.03 -0.91 0.06 0.00 0.53 0.00 0.00 43.42 43.13 1x5u n LEU 31 CO 0.06 0.24 1.08 -0.07 -1.11 0.00 0.00 177.39 177.58 1x5u h LEU 32 N -1.00 0.54 0.00 -1.96 3.38 -1.42 0.91 115.31 115.76 1x5u h LEU 32 Ca -0.38 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.60 1x5u h LEU 32 Cb 1.27 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.92 1x5u h LEU 32 CO -0.23 0.37 0.00 1.87 0.09 0.00 0.00 178.44 180.55 1x5u n TRP 33 N -4.77 0.00 -0.18 1.13 -0.00 -1.22 0.17 117.44 112.56 1x5u n TRP 33 Ca 0.05 0.00 -0.09 0.00 -0.00 0.00 0.00 57.50 57.47 1x5u n TRP 33 Cb 0.10 -0.45 0.01 0.00 -0.00 0.00 0.00 31.31 30.97 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 -0.19 5.87 4.81 -1.73 0.05 114.58 124.16 1x5u h GLU 34 Ca 0.00 -0.16 0.05 0.00 -0.13 0.00 0.00 59.36 59.12 1x5u h GLU 34 Cb 0.00 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 29.26 1x5u h GLU 34 CO 0.00 0.72 0.22 1.25 -0.73 0.00 0.00 179.01 180.47 1x5u h LEU 35 N 0.68 0.00 0.00 1.64 5.85 -0.15 -0.44 115.31 122.89 1x5u h LEU 35 Ca 0.16 0.00 -0.27 0.00 0.84 0.00 0.00 57.88 58.61 1x5u h LEU 35 Cb 0.27 0.00 -0.05 0.00 0.37 0.00 0.00 40.66 41.25 1x5u h LEU 35 CO -0.01 0.00 -1.93 0.49 -0.34 0.00 0.00 178.44 176.66 1x5u n PHE 36 N -3.72 0.54 0.01 1.25 3.01 0.45 -4.21 117.46 114.78 1x5u n PHE 36 Ca 0.02 0.19 0.17 0.00 1.01 0.00 0.00 57.45 58.84 1x5u n PHE 36 Cb 0.34 -1.04 0.29 0.00 -0.01 0.00 0.00 39.48 39.06 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 0.00 -0.43 4.37 3.38 0.77 0.52 115.31 123.91 1x5u h LEU 37 Ca -0.34 0.00 0.05 0.00 0.09 0.00 0.00 57.88 57.68 1x5u h LEU 37 Cb 1.93 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 42.64 1x5u h LEU 37 CO 0.05 0.00 0.18 1.56 0.09 0.00 0.00 178.44 180.31 1x5u h GLN 38 N 0.00 0.35 0.11 1.13 4.20 -1.73 -3.07 115.11 116.09 1x5u h GLN 38 Ca 0.29 -0.02 -0.01 0.00 0.06 0.00 0.00 58.65 58.98 1x5u h GLN 38 Cb 2.49 -0.08 0.00 0.00 0.30 0.00 0.00 27.48 30.19 1x5u h GLN 38 CO -0.00 0.23 -0.05 0.00 -0.67 0.00 0.00 178.83 178.34 1x5u h ALA 39 N 1.26 -0.15 -2.89 3.87 0.00 -0.26 -3.49 119.26 117.61 1x5u h ALA 39 Ca 0.20 -0.25 -0.01 0.00 0.00 0.00 0.00 54.91 54.85 1x5u h ALA 39 Cb 0.16 0.06 0.01 0.00 0.00 0.00 0.00 17.79 18.01 1x5u h ALA 39 CO -0.18 -0.28 0.29 0.41 0.00 0.00 0.00 179.25 179.49 1x5u n GLY 40 N 0.51 1.00 3.55 0.00 0.00 -1.16 -4.82 105.19 104.27 1x5u n GLY 40 Ca -0.08 -1.23 -0.35 0.00 0.00 0.00 0.00 46.02 44.36 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 -2.08 2.60 -0.00 1.61 0.04 -1.26 -3.86 135.00 132.04 1x5u s PRO 41 Ca 0.16 0.31 -0.30 0.00 0.04 0.00 0.00 61.00 61.21 1x5u s PRO 41 Cb -0.04 -4.61 -0.06 0.00 0.04 0.00 0.00 34.50 29.82 1x5u s PRO 41 CO 0.11 -2.95 1.56 0.08 0.04 0.00 0.00 177.00 175.84 1x5u s VAL 42 N 9.43 3.48 -0.09 -0.36 1.01 -1.26 -2.17 120.40 130.44 1x5u s VAL 42 Ca 0.68 0.78 -0.20 0.00 0.00 0.00 0.00 61.98 63.25 1x5u s VAL 42 Cb -0.11 -3.50 -0.16 0.00 0.00 0.00 0.00 36.38 32.61 1x5u s VAL 42 CO 0.14 -0.03 0.69 0.58 0.00 0.00 0.00 175.10 176.48 1x5u h VAL 43 N 5.14 1.00 -2.96 2.92 2.07 -1.17 -3.47 116.25 119.78 1x5u h VAL 43 Ca -0.39 -1.48 -0.02 0.00 0.82 0.00 0.00 66.70 65.63 1x5u h VAL 43 Cb 1.18 1.79 -0.12 0.00 -1.52 0.00 0.00 31.29 32.62 1x5u h VAL 43 CO 0.93 0.30 0.22 0.21 0.02 0.00 0.00 177.57 179.25 1x5u s ASN 44 N -5.73 -0.56 -0.04 0.57 2.47 -1.11 -5.05 114.94 105.49 1x5u s ASN 44 Ca -0.12 0.01 0.03 0.00 0.42 0.00 0.00 52.86 53.19 1x5u s ASN 44 Cb -0.01 0.59 -0.03 0.00 -1.45 0.00 0.00 41.25 40.36 1x5u s ASN 44 CO 0.46 -0.95 -0.10 0.42 -3.72 0.00 0.00 177.10 173.20 1x5u s THR 45 N -3.70 3.42 -0.11 -5.21 -4.23 -1.26 -1.61 115.64 102.93 1x5u s THR 45 Ca 0.01 -0.67 0.02 0.00 -1.18 0.00 0.00 61.69 59.87 1x5u s THR 45 Cb -0.01 -2.40 0.01 0.00 1.34 0.00 0.00 72.50 71.44 1x5u s THR 45 CO -0.13 0.54 -0.17 -2.28 -0.54 0.00 0.00 174.62 172.04 1x5u s HIS 46 N -0.83 2.15 -0.18 3.99 2.46 -0.75 -5.01 115.29 117.13 1x5u s HIS 46 Ca 0.13 -1.02 -0.04 0.00 0.47 0.00 0.00 55.06 54.59 1x5u s HIS 46 Cb -0.11 -1.52 0.07 0.00 -0.13 0.00 0.00 32.58 30.90 1x5u s HIS 46 CO 0.03 -0.50 0.14 -1.64 -2.47 0.00 0.00 174.74 170.29 1x5u s MET 47 N 0.92 0.11 0.35 2.88 -1.94 -1.26 -0.93 119.30 119.42 1x5u s MET 47 Ca -0.07 0.06 -0.27 0.00 -1.71 0.00 0.00 55.69 53.69 1x5u s MET 47 Cb -0.15 -1.51 -0.09 0.00 2.01 0.00 0.00 34.83 35.08 1x5u s MET 47 CO -0.01 -0.65 1.21 -1.25 -0.01 0.00 0.00 175.02 174.31 1x5u s PRO 48 N 2.22 4.29 -0.10 2.03 0.04 -1.26 -4.93 135.00 137.28 1x5u s PRO 48 Ca 0.04 1.99 0.02 0.00 0.04 0.00 0.00 61.00 63.09 1x5u s PRO 48 Cb -0.16 -2.94 -0.01 0.00 0.04 0.00 0.00 34.50 31.43 1x5u s PRO 48 CO -0.10 -0.16 -0.18 0.15 0.04 0.00 0.00 177.00 176.75 1x5u s LYS 49 N -1.92 3.05 0.97 4.56 1.02 -1.26 -2.27 119.74 123.89 1x5u s LYS 49 Ca 0.51 -0.77 -0.16 0.00 0.02 0.00 0.00 55.97 55.58 1x5u s LYS 49 Cb -0.35 -2.44 0.07 0.00 -0.52 0.00 0.00 37.83 34.59 1x5u s LYS 49 CO 0.45 0.29 -0.12 -3.47 -0.92 0.00 0.00 175.35 171.58 1x5u n ASP 50 N 3.26 -2.73 -0.05 2.83 -0.08 -1.21 -4.78 116.55 113.79 1x5u n ASP 50 Ca -0.18 -0.21 -0.06 0.00 -1.51 0.00 0.00 54.79 52.83 1x5u n ASP 50 Cb 0.53 -0.73 -0.07 0.00 2.34 0.00 0.00 41.12 43.18 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 -0.65 1.77 0.07 -0.67 -4.01 -1.26 -3.03 116.66 108.89 1x5u n ARG 51 Ca 0.02 0.02 -0.00 0.00 -1.04 0.00 0.00 57.85 56.85 1x5u n ARG 51 Cb 0.45 -1.25 -0.05 0.00 -3.04 0.00 0.00 32.46 28.57 1x5u n ARG 51 CO 0.00 0.00 0.00 -0.39 -3.04 0.00 0.00 177.63 174.20 1x5u h VAL 52 N 0.00 0.79 0.00 8.89 -1.51 -2.01 -3.38 116.25 119.02 1x5u h VAL 52 Ca -0.27 -2.27 -0.08 0.00 -1.23 0.00 0.00 66.70 62.85 1x5u h VAL 52 Cb 1.54 2.29 -0.02 0.00 -2.13 0.00 0.00 31.29 32.98 1x5u h VAL 52 CO -0.00 0.45 -1.30 0.35 -1.23 0.00 0.00 177.57 175.83 1x5u n THR 53 N -3.07 0.31 -3.06 7.19 -2.24 -1.26 -5.03 114.28 107.10 1x5u n THR 53 Ca -0.05 -0.19 -0.18 0.00 -2.27 0.00 0.00 64.05 61.37 1x5u n THR 53 Cb 0.82 -0.88 0.04 0.00 -2.10 0.00 0.00 70.33 68.22 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 2.74 -0.25 3.12 3.38 0.00 -1.17 -4.95 105.19 108.07 1x5u n GLY 54 Ca -0.07 -0.01 -0.29 0.00 0.00 0.00 0.00 46.02 45.64 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 -5.69 2.45 0.05 1.61 -1.52 -1.26 -4.72 119.66 110.58 1x5u s GLN 55 Ca 0.33 -0.67 -0.29 0.00 -1.95 0.00 0.00 55.36 52.78 1x5u s GLN 55 Cb -0.15 -1.94 -0.15 0.00 -0.22 0.00 0.00 33.01 30.55 1x5u s GLN 55 CO 0.41 0.07 0.73 -2.39 -0.25 0.00 0.00 175.29 173.86 1x5u n HIS 56 N 3.79 0.25 -1.81 0.91 1.44 -1.26 -3.33 115.22 115.21 1x5u n HIS 56 Ca -0.20 0.83 -0.29 0.00 -2.01 0.00 0.00 57.72 56.05 1x5u n HIS 56 Cb 0.52 -1.65 0.13 0.00 0.12 0.00 0.00 29.99 29.11 1x5u n HIS 56 CO 0.00 0.00 0.00 -0.65 -2.81 0.00 0.00 176.34 172.88 1x5u s GLN 57 N -0.23 1.27 0.00 -1.40 -0.21 -0.96 -4.90 119.66 113.23 1x5u s GLN 57 Ca 0.67 -0.02 -0.03 0.00 0.02 0.00 0.00 55.36 56.00 1x5u s GLN 57 Cb -0.94 -1.88 -0.15 0.00 1.00 0.00 0.00 33.01 31.03 1x5u s GLN 57 CO 0.46 -2.05 2.70 0.41 -2.12 0.00 0.00 175.29 174.69 1x5u n GLY 58 N -3.14 2.56 3.63 3.09 0.00 -1.26 -4.72 105.19 105.35 1x5u n GLY 58 Ca 0.10 -0.68 -0.05 0.00 0.00 0.00 0.00 46.02 45.38 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 0.92 -0.21 0.00 1.61 1.13 -1.26 -0.13 117.35 119.41 1x5u s TYR 59 Ca 0.38 0.46 0.00 0.00 -1.41 0.00 0.00 57.07 56.50 1x5u s TYR 59 Cb 0.18 0.45 0.00 0.00 -1.10 0.00 0.00 41.96 41.49 1x5u s TYR 59 CO 0.00 -0.13 0.00 0.41 -2.51 0.00 0.00 175.55 173.32 1x5u n GLY 60 N 1.43 4.94 3.48 5.49 0.00 0.24 -4.52 105.19 116.25 1x5u n GLY 60 Ca -0.09 -1.20 -0.16 0.00 0.00 0.00 0.00 46.02 44.58 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 -0.50 -0.61 -0.24 1.61 0.08 -0.11 -1.39 117.98 116.83 1x5u s PHE 61 Ca 0.00 0.80 -0.03 0.00 0.12 0.00 0.00 56.93 57.83 1x5u s PHE 61 Cb 0.00 0.47 0.08 0.00 -0.57 0.00 0.00 43.02 43.00 1x5u s PHE 61 CO 0.00 -0.71 0.07 0.08 -0.10 0.00 0.00 175.22 174.56 1x5u s VAL 62 N -2.24 0.52 -0.48 -0.44 1.01 -1.17 -1.80 120.40 115.79 1x5u s VAL 62 Ca -0.06 -0.79 -0.28 0.00 0.00 0.00 0.00 61.98 60.85 1x5u s VAL 62 Cb -0.00 -1.18 0.03 0.00 0.00 0.00 0.00 36.38 35.23 1x5u s VAL 62 CO 0.01 -0.40 1.09 -0.70 0.00 0.00 0.00 175.10 175.10 1x5u s GLU 63 N 1.84 3.67 0.54 2.72 2.12 -0.63 -2.20 118.70 126.75 1x5u s GLU 63 Ca 0.03 0.46 -0.06 0.00 0.36 0.00 0.00 54.97 55.75 1x5u s GLU 63 Cb -0.17 -3.92 -0.02 0.00 0.26 0.00 0.00 34.13 30.28 1x5u s GLU 63 CO -0.16 -1.36 0.86 -0.06 -0.54 0.00 0.00 175.26 174.00 1x5u s PHE 64 N 4.32 3.46 0.02 5.30 0.08 0.22 -0.66 117.98 130.72 1x5u s PHE 64 Ca 0.45 0.82 -0.25 0.00 0.12 0.00 0.00 56.93 58.07 1x5u s PHE 64 Cb -0.08 -2.51 -0.17 0.00 -0.57 0.00 0.00 43.02 39.69 1x5u s PHE 64 CO 0.30 -0.53 1.37 1.25 -0.10 0.00 0.00 175.22 177.52 1x5u h LEU 65 N 0.01 -0.24 -9.09 -0.37 5.85 -1.71 -3.43 115.31 106.33 1x5u h LEU 65 Ca -0.46 -0.19 -0.68 0.00 0.84 0.00 0.00 57.88 57.39 1x5u h LEU 65 Cb 1.22 0.06 -0.19 0.00 0.37 0.00 0.00 40.66 42.12 1x5u h LEU 65 CO 0.61 0.07 -0.74 -0.44 -0.34 0.00 0.00 178.44 177.60 1x5u s SER 66 N -5.18 4.30 0.22 1.25 0.01 -1.26 -4.98 113.70 108.05 1x5u s SER 66 Ca -0.15 -0.24 -0.10 0.00 1.31 0.00 0.00 55.95 56.78 1x5u s SER 66 Cb 0.03 -0.91 0.32 0.00 0.21 0.00 0.00 66.02 65.68 1x5u s SER 66 CO 0.60 0.28 1.67 -0.08 0.41 0.00 0.00 173.24 176.12 1x5u h GLU 67 N 4.63 0.14 -0.82 12.44 4.81 -1.89 0.33 114.58 134.21 1x5u h GLU 67 Ca -0.48 -0.01 0.16 0.00 -0.13 0.00 0.00 59.36 58.90 1x5u h GLU 67 Cb 1.16 -0.03 -0.10 0.00 0.63 0.00 0.00 28.75 30.41 1x5u h GLU 67 CO 0.51 0.09 0.38 1.05 -0.73 0.00 0.00 179.01 180.32 1x5u h GLU 68 N 0.14 0.51 -0.92 1.92 4.11 -1.95 0.95 114.58 119.35 1x5u h GLU 68 Ca 0.34 -0.03 0.14 0.00 0.07 0.00 0.00 59.36 59.88 1x5u h GLU 68 Cb 0.55 -0.12 -0.08 0.00 0.50 0.00 0.00 28.75 29.61 1x5u h GLU 68 CO -0.52 0.34 0.59 -0.44 0.07 0.00 0.00 179.01 179.04 1x5u h ASP 69 N 0.53 0.71 0.96 3.06 3.32 -1.29 -1.64 116.42 122.06 1x5u h ASP 69 Ca 0.46 0.05 -0.05 0.00 0.02 0.00 0.00 57.03 57.51 1x5u h ASP 69 Cb 0.70 -0.09 0.01 0.00 0.22 0.00 0.00 39.33 40.17 1x5u h ASP 69 CO -0.40 0.35 -0.46 0.00 -1.72 0.00 0.00 179.24 177.01 1x5u h ALA 70 N 1.59 -1.30 -0.93 3.45 0.00 -0.70 -2.07 119.26 119.30 1x5u h ALA 70 Ca 0.47 -0.28 0.18 0.00 0.00 0.00 0.00 54.91 55.27 1x5u h ALA 70 Cb 0.70 0.50 -0.11 0.00 0.00 0.00 0.00 17.79 18.88 1x5u h ALA 70 CO -0.23 -1.20 0.51 0.22 0.00 0.00 0.00 179.25 178.55 1x5u h ASP 71 N -1.34 0.61 -0.64 0.00 1.82 -1.33 0.21 116.42 115.75 1x5u h ASP 71 Ca -0.13 0.11 0.01 0.00 -0.39 0.00 0.00 57.03 56.62 1x5u h ASP 71 Cb 0.99 0.01 -0.03 0.00 0.68 0.00 0.00 39.33 40.98 1x5u h ASP 71 CO 0.22 0.20 0.42 0.22 -1.61 0.00 0.00 179.24 178.69 1x5u h TYR 72 N 0.64 0.81 0.00 0.28 5.03 -1.15 -1.44 116.97 121.14 1x5u h TYR 72 Ca 0.53 0.02 -0.12 0.00 2.58 0.00 0.00 58.73 61.74 1x5u h TYR 72 Cb 0.84 -0.27 -0.02 0.00 1.55 0.00 0.00 36.73 38.83 1x5u h TYR 72 CO -0.06 0.51 -0.57 0.00 -1.32 0.00 0.00 178.16 176.73 1x5u h ALA 73 N 1.60 0.68 0.00 1.82 0.00 0.04 -3.10 119.26 120.30 1x5u h ALA 73 Ca 0.23 -0.51 0.00 0.00 0.00 0.00 0.00 54.91 54.63 1x5u h ALA 73 Cb -0.10 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.60 1x5u h ALA 73 CO -0.05 0.71 0.00 -0.89 0.00 0.00 0.00 179.25 179.02 1x5u n ILE 74 N -3.31 0.64 0.01 0.00 5.41 -0.11 0.74 119.36 122.73 1x5u n ILE 74 Ca 0.01 -0.15 -0.00 0.00 1.00 0.00 0.00 62.75 63.61 1x5u n ILE 74 Cb 0.73 -0.73 -0.10 0.00 -0.71 0.00 0.00 39.64 38.82 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 -2.24 0.63 -0.10 0.38 2.85 -0.79 -3.63 118.16 115.26 1x5u n LYS 75 Ca 0.05 0.14 -0.13 0.00 -1.05 0.00 0.00 58.31 57.32 1x5u n LYS 75 Cb 0.38 -1.73 -0.10 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 -2.80 1.18 0.65 0.58 -5.35 -1.18 -4.40 119.36 108.04 1x5u n ILE 76 Ca -0.13 -0.50 0.03 0.00 -0.27 0.00 0.00 62.75 61.89 1x5u n ILE 76 Cb 0.86 -1.11 0.13 0.00 -1.74 0.00 0.00 39.64 37.77 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 -3.02 2.09 -3.64 6.28 2.81 0.23 -4.73 117.12 117.14 1x5u n MET 77 Ca -0.35 -1.04 -0.36 0.00 -1.81 0.00 0.00 57.70 54.14 1x5u n MET 77 Cb 0.92 -1.56 -0.08 0.00 -0.71 0.00 0.00 33.22 31.79 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 -0.54 6.27 -1.39 7.83 2.15 -1.24 -4.07 116.67 125.68 1x5u s ASP 78 Ca 0.18 0.31 -0.01 0.00 0.43 0.00 0.00 52.55 53.46 1x5u s ASP 78 Cb 0.13 -2.13 0.00 0.00 -0.30 0.00 0.00 42.92 40.62 1x5u s ASP 78 CO 0.08 0.12 0.10 0.23 -0.17 0.00 0.00 175.17 175.53 1x5u n MET 79 N 3.72 -1.86 -1.87 4.34 2.81 -1.23 -4.97 117.12 118.06 1x5u n MET 79 Ca -0.14 0.79 -0.31 0.00 -1.81 0.00 0.00 57.70 56.23 1x5u n MET 79 Cb 0.52 -5.24 0.02 0.00 -0.71 0.00 0.00 33.22 27.81 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 -2.88 4.28 -0.61 2.02 1.01 -1.26 -4.85 121.20 118.91 1x5u s ILE 80 Ca 0.05 0.85 -0.01 0.00 0.00 0.00 0.00 60.65 61.53 1x5u s ILE 80 Cb -0.02 -3.59 0.16 0.00 0.01 0.00 0.00 42.46 39.02 1x5u s ILE 80 CO 0.06 -0.86 0.41 -0.54 0.00 0.00 0.00 174.94 174.01 1x5u s LYS 81 N -4.78 2.46 0.02 2.79 1.02 -1.26 -1.78 119.74 118.22 1x5u s LYS 81 Ca 0.58 -2.60 0.00 0.00 0.02 0.00 0.00 55.97 53.97 1x5u s LYS 81 Cb -0.13 -3.64 -0.04 0.00 -0.52 0.00 0.00 37.83 33.50 1x5u s LYS 81 CO 0.48 -1.16 0.11 -1.17 -0.92 0.00 0.00 175.35 172.69 1x5u s LEU 82 N -0.19 4.01 -0.25 3.17 2.96 -1.02 -4.62 118.68 122.74 1x5u s LEU 82 Ca 0.17 0.16 -0.03 0.00 -0.22 0.00 0.00 54.13 54.21 1x5u s LEU 82 Cb -0.21 -2.47 0.00 0.00 0.50 0.00 0.00 46.19 44.01 1x5u s LEU 82 CO -0.03 0.23 0.06 -1.22 -1.32 0.00 0.00 176.35 174.08 1x5u n TYR 83 N 0.86 -0.24 -3.48 5.38 4.01 -1.26 0.87 117.16 123.30 1x5u n TYR 83 Ca -0.11 0.06 -0.20 0.00 -0.16 0.00 0.00 57.90 57.50 1x5u n TYR 83 Cb 0.52 -0.50 0.03 0.00 -0.31 0.00 0.00 39.34 39.08 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 -1.22 -1.15 3.18 2.72 0.00 -1.26 -4.92 105.19 102.54 1x5u n GLY 84 Ca -0.04 0.50 0.05 0.00 0.00 0.00 0.00 46.02 46.53 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 -4.78 0.25 -1.08 1.61 1.02 0.25 -5.05 119.74 111.97 1x5u s LYS 85 Ca 0.25 0.47 -0.23 0.00 0.02 0.00 0.00 55.97 56.48 1x5u s LYS 85 Cb -0.08 0.27 -0.07 0.00 -0.52 0.00 0.00 37.83 37.42 1x5u s LYS 85 CO 0.82 -0.25 1.94 -1.25 -0.92 0.00 0.00 175.35 175.69 1x5u s PRO 86 N 2.87 2.52 1.24 -1.68 0.04 -1.26 -2.44 135.00 136.29 1x5u s PRO 86 Ca 0.02 -0.85 -0.16 0.00 0.04 0.00 0.00 61.00 60.05 1x5u s PRO 86 Cb -0.10 -5.18 0.28 0.00 0.04 0.00 0.00 34.50 29.54 1x5u s PRO 86 CO -0.13 -3.75 0.78 0.44 0.04 0.00 0.00 177.00 174.38 1x5u n ILE 87 N 7.83 0.00 -3.65 0.56 -5.35 -0.73 -4.86 119.36 113.15 1x5u n ILE 87 Ca 0.43 -0.36 -0.20 0.00 -0.27 0.00 0.00 62.75 62.35 1x5u n ILE 87 Cb 0.47 -0.91 -0.17 0.00 -1.74 0.00 0.00 39.64 37.29 1x5u n ILE 87 CO 0.00 0.00 0.00 -0.13 -1.76 0.00 0.00 176.55 174.66 1x5u s ARG 88 N -4.31 -0.00 -0.10 6.28 1.81 -0.80 -3.54 118.95 118.28 1x5u s ARG 88 Ca 0.65 0.34 -0.00 0.00 -1.72 0.00 0.00 55.73 55.00 1x5u s ARG 88 Cb -0.20 -0.72 -0.03 0.00 -0.45 0.00 0.00 34.95 33.55 1x5u s ARG 88 CO 0.63 -0.41 -0.07 0.08 -0.68 0.00 0.00 175.30 174.85 1x5u s VAL 89 N 2.21 3.62 -0.04 3.52 1.01 -1.25 -0.94 120.40 128.53 1x5u s VAL 89 Ca 0.04 -0.49 -0.31 0.00 0.00 0.00 0.00 61.98 61.23 1x5u s VAL 89 Cb -0.13 -2.51 0.07 0.00 0.00 0.00 0.00 36.38 33.81 1x5u s VAL 89 CO -0.06 0.56 0.68 0.20 0.00 0.00 0.00 175.10 176.48 1x5u s ASN 90 N -0.28 -0.65 -0.30 3.32 -0.87 -0.83 -4.81 114.94 110.52 1x5u s ASN 90 Ca 0.04 0.68 -0.39 0.00 -1.57 0.00 0.00 52.86 51.61 1x5u s ASN 90 Cb -0.13 0.54 -0.15 0.00 -0.02 0.00 0.00 41.25 41.50 1x5u s ASN 90 CO 0.03 -0.63 1.83 0.29 -2.57 0.00 0.00 177.10 176.05 1x5u n LYS 91 N 0.84 1.13 -0.21 -0.60 4.76 -1.26 0.97 118.16 123.79 1x5u n LYS 91 Ca -0.19 0.40 -0.01 0.00 -2.87 0.00 0.00 58.31 55.65 1x5u n LYS 91 Cb 0.57 -2.15 0.10 0.00 -1.84 0.00 0.00 35.03 31.72 1x5u n LYS 91 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1x5u h ALA 92 N 8.10 0.82 0.01 7.82 0.00 -1.82 -2.51 119.26 131.67 1x5u h ALA 92 Ca -0.42 0.06 -0.00 0.00 0.00 0.00 0.00 54.91 54.54 1x5u h ALA 92 Cb 1.32 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.10 1x5u h ALA 92 CO 0.98 -0.11 -0.00 0.66 0.00 0.00 0.00 179.25 180.77 1x5u h SER 93 N 0.50 -0.01 -0.80 0.00 4.64 -1.84 -3.01 113.55 113.03 1x5u h SER 93 Ca 0.30 -0.11 0.17 0.00 -0.47 0.00 0.00 61.79 61.68 1x5u h SER 93 Cb 0.31 0.00 -0.15 0.00 -0.31 0.00 0.00 62.40 62.25 1x5u h SER 93 CO -0.25 0.11 -0.15 0.00 -0.87 0.00 0.00 176.83 175.66 1x5u n ALA 94 N -2.15 0.24 -1.46 5.18 0.00 -0.95 -4.46 120.51 116.91 1x5u n ALA 94 Ca -0.07 0.88 -0.38 0.00 0.00 0.00 0.00 53.44 53.86 1x5u n ALA 94 Cb 0.09 -0.55 0.04 0.00 0.00 0.00 0.00 19.45 19.02 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 -5.27 -0.65 -4.43 0.00 8.25 -1.14 -5.01 115.22 106.97 1x5u n HIS 95 Ca 0.14 0.43 -0.21 0.00 -0.26 0.00 0.00 57.72 57.82 1x5u n HIS 95 Cb 0.45 -1.96 -0.10 0.00 1.12 0.00 0.00 29.99 29.50 1x5u n HIS 95 CO 0.00 0.00 0.00 -0.80 0.64 0.00 0.00 176.34 176.18 1x5u s ASN 96 N -1.20 2.19 0.14 0.41 -0.87 -1.26 -5.06 114.94 109.29 1x5u s ASN 96 Ca 0.69 -1.45 -0.04 0.00 -1.57 0.00 0.00 52.86 50.49 1x5u s ASN 96 Cb -0.44 0.12 -0.03 0.00 -0.02 0.00 0.00 41.25 40.89 1x5u s ASN 96 CO 0.54 -0.72 0.13 -0.54 -2.57 0.00 0.00 177.10 173.94 1x5u s LYS 97 N -3.88 0.99 0.11 -0.60 1.02 -1.26 -5.07 119.74 111.05 1x5u s LYS 97 Ca 0.34 -1.35 -0.27 0.00 0.02 0.00 0.00 55.97 54.71 1x5u s LYS 97 Cb 0.07 0.28 -0.09 0.00 -0.52 0.00 0.00 37.83 37.57 1x5u s LYS 97 CO 0.15 -0.31 1.64 -0.97 -0.92 0.00 0.00 175.35 174.94 1x5u h ASN 98 N 2.77 -0.74 -6.90 2.83 -1.24 -2.07 -3.46 115.58 106.77 1x5u h ASN 98 Ca -0.34 0.08 -0.51 0.00 0.71 0.00 0.00 56.30 56.24 1x5u h ASN 98 Cb 1.21 0.28 -0.10 0.00 0.73 0.00 0.00 38.32 40.44 1x5u h ASN 98 CO 0.56 -0.36 -0.83 -0.11 -1.29 0.00 0.00 177.43 175.40 1x5u n LEU 99 N -5.38 -0.44 -4.75 0.34 -0.00 -1.26 -4.88 117.00 100.63 1x5u n LEU 99 Ca -0.07 -1.08 -0.30 0.00 -0.00 0.00 0.00 56.01 54.56 1x5u n LEU 99 Cb 0.29 -1.32 0.12 0.00 -0.00 0.00 0.00 43.42 42.51 1x5u n LEU 99 CO 0.25 0.54 0.68 -0.94 -0.00 0.00 0.00 177.39 177.93 1x5u s SER 100 N -3.97 3.76 0.00 1.96 1.04 -1.26 -5.02 113.70 110.21 1x5u s SER 100 Ca 0.20 1.37 0.00 0.00 0.48 0.00 0.00 55.95 58.00 1x5u s SER 100 Cb -0.11 -2.06 0.00 0.00 0.10 0.00 0.00 66.02 63.95 1x5u s SER 100 CO 0.83 -2.44 0.00 0.61 0.98 0.00 0.00 173.24 173.21 1x5u n GLY 101 N -1.53 -1.61 0.00 7.32 0.00 -1.26 -5.01 105.19 103.10 1x5u n GLY 101 Ca 0.07 0.86 0.08 0.00 0.00 0.00 0.00 46.02 47.02 1x5u n GLY 101 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1x5u n PRO 102 N 0.00 0.47 -0.05 1.61 -0.04 -1.26 -3.03 135.00 132.70 1x5u n PRO 102 Ca 0.00 0.01 -0.15 0.00 -0.04 0.00 0.00 63.50 63.32 1x5u n PRO 102 Cb 0.00 -1.50 -0.13 0.00 -0.04 0.00 0.00 33.50 31.83 1x5u n PRO 102 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1x5u h SER 103 N 0.00 0.09 -3.10 3.54 4.64 -2.03 -3.46 113.55 113.23 1x5u h SER 103 Ca 0.00 -0.99 -0.18 0.00 -0.47 0.00 0.00 61.79 60.15 1x5u h SER 103 Cb 0.01 -0.03 -0.30 0.00 -0.31 0.00 0.00 62.40 61.77 1x5u h SER 103 CO 0.00 1.08 -0.45 -0.55 -0.87 0.00 0.00 176.83 176.04 1x5u s SER 104 N -6.37 -0.13 0.00 4.97 0.15 -1.17 -5.34 113.70 105.81 1x5u s SER 104 Ca -0.18 0.66 0.32 0.00 0.70 0.00 0.00 55.95 57.45 1x5u s SER 104 Cb -0.02 0.65 1.82 0.00 -1.71 0.00 0.00 66.02 66.76 1x5u s SER 104 CO 0.72 -0.20 2.18 0.61 1.20 0.00 0.00 173.24 177.75