#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1um1 n SER 2 N 0.00 -3.39 -4.74 1.61 7.64 -1.26 -4.88 113.62 108.61 1um1 n SER 2 Ca 0.00 1.23 -0.37 0.00 1.01 0.00 0.00 58.87 60.74 1um1 n SER 2 Cb 0.00 -4.26 0.06 0.00 -1.01 0.00 0.00 64.21 59.00 1um1 n SER 2 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1um1 s SER 3 N -0.68 4.79 0.03 6.43 0.15 -1.26 -5.03 113.70 118.13 1um1 s SER 3 Ca -0.17 2.65 0.00 0.00 0.70 0.00 0.00 55.95 59.13 1um1 s SER 3 Cb 0.01 -2.62 0.00 0.00 -1.71 0.00 0.00 66.02 61.70 1um1 s SER 3 CO 0.58 -1.88 0.00 0.61 1.20 0.00 0.00 173.24 173.75 1um1 n GLY 4 N 0.84 1.84 0.42 9.45 0.00 -1.26 -5.09 105.19 111.39 1um1 n GLY 4 Ca 0.14 -2.11 -0.07 0.00 0.00 0.00 0.00 46.02 43.98 1um1 n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1um1 n SER 5 N -2.82 1.63 0.00 1.61 7.64 -1.26 -5.07 113.62 115.35 1um1 n SER 5 Ca 0.00 0.26 0.00 0.00 1.01 0.00 0.00 58.87 60.14 1um1 n SER 5 Cb 0.00 -0.60 0.00 0.00 -1.01 0.00 0.00 64.21 62.60 1um1 n SER 5 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 1um1 n SER 6 N -4.10 0.00 -3.28 6.43 2.88 -1.26 -5.09 113.62 109.20 1um1 n SER 6 Ca -0.11 0.00 -0.18 0.00 -1.33 0.00 0.00 58.87 57.24 1um1 n SER 6 Cb 0.38 0.00 0.02 0.00 -0.75 0.00 0.00 64.21 63.85 1um1 n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1um1 n GLY 7 N 0.00 0.09 3.72 0.46 0.00 -1.26 -4.98 105.19 103.21 1um1 n GLY 7 Ca 0.00 0.54 -0.27 0.00 0.00 0.00 0.00 46.02 46.29 1um1 n GLY 7 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1um1 s TYR 8 N -1.18 2.43 0.32 1.61 -0.85 -1.26 -5.01 117.35 113.41 1um1 s TYR 8 Ca 0.18 -0.67 0.09 0.00 -0.52 0.00 0.00 57.07 56.14 1um1 s TYR 8 Cb -0.02 -1.86 -0.06 0.00 0.38 0.00 0.00 41.96 40.40 1um1 s TYR 8 CO 0.40 0.23 -0.09 0.54 -1.52 0.00 0.00 175.55 175.11 1um1 s VAL 9 N -2.68 2.09 -0.06 -3.49 0.11 -1.26 -0.86 120.40 114.25 1um1 s VAL 9 Ca 0.35 -2.20 -0.08 0.00 -2.93 0.00 0.00 61.98 57.12 1um1 s VAL 9 Cb 0.05 -2.57 0.02 0.00 -1.53 0.00 0.00 36.38 32.35 1um1 s VAL 9 CO 0.19 -0.24 0.22 0.72 -3.33 0.00 0.00 175.10 172.65 1um1 s PHE 10 N -2.71 -0.19 0.34 1.54 -0.71 0.25 -4.84 117.98 111.65 1um1 s PHE 10 Ca 0.31 0.45 -0.08 0.00 -1.04 0.00 0.00 56.93 56.57 1um1 s PHE 10 Cb 0.02 0.06 -0.06 0.00 -1.21 0.00 0.00 43.02 41.83 1um1 s PHE 10 CO 0.15 -0.17 0.66 0.99 -1.34 0.00 0.00 175.22 175.51 1um1 s THR 11 N -0.26 4.89 -0.19 -4.49 2.01 -1.26 -0.84 115.64 115.49 1um1 s THR 11 Ca -0.04 0.40 -0.01 0.00 0.31 0.00 0.00 61.69 62.36 1um1 s THR 11 Cb -0.03 -3.71 0.05 0.00 0.01 0.00 0.00 72.50 68.82 1um1 s THR 11 CO 0.01 -0.37 -0.03 -0.69 -0.69 0.00 0.00 174.62 172.85 1um1 s VAL 12 N -2.17 1.09 -0.28 3.82 1.01 0.63 -4.90 120.40 119.60 1um1 s VAL 12 Ca 0.48 -0.80 -0.12 0.00 0.00 0.00 0.00 61.98 61.54 1um1 s VAL 12 Cb -0.11 -1.38 -0.04 0.00 0.00 0.00 0.00 36.38 34.85 1um1 s VAL 12 CO 0.29 -0.03 0.26 -1.61 0.00 0.00 0.00 175.10 174.00 1um1 s GLU 13 N 1.61 3.96 0.21 2.72 2.02 -1.26 -1.82 118.70 126.14 1um1 s GLU 13 Ca -0.02 -0.21 0.02 0.00 0.02 0.00 0.00 54.97 54.78 1um1 s GLU 13 Cb -0.17 -3.66 -0.05 0.00 0.10 0.00 0.00 34.13 30.35 1um1 s GLU 13 CO -0.07 -0.22 0.04 -0.51 0.02 0.00 0.00 175.26 174.51 1um1 s LEU 14 N 1.87 1.93 -0.25 1.80 1.43 0.12 -5.00 118.68 120.58 1um1 s LEU 14 Ca 0.10 -1.26 0.00 0.00 -1.03 0.00 0.00 54.13 51.94 1um1 s LEU 14 Cb -0.16 -0.04 0.04 0.00 0.03 0.00 0.00 46.19 46.06 1um1 s LEU 14 CO 0.11 -0.63 -0.09 -0.70 0.23 0.00 0.00 176.35 175.27 1um1 s GLU 15 N -3.96 2.61 -0.62 1.70 2.12 -1.26 0.40 118.70 119.69 1um1 s GLU 15 Ca 0.30 -1.12 -0.37 0.00 0.36 0.00 0.00 54.97 54.14 1um1 s GLU 15 Cb 0.07 -2.92 -0.17 0.00 0.26 0.00 0.00 34.13 31.37 1um1 s GLU 15 CO 0.08 -0.46 2.34 -2.13 -0.54 0.00 0.00 175.26 174.56 1um1 n ARG 16 N 4.58 0.33 -0.65 4.30 0.63 -0.84 -4.82 116.66 120.18 1um1 n ARG 16 Ca -0.16 0.07 -0.16 0.00 -0.92 0.00 0.00 57.85 56.68 1um1 n ARG 16 Cb 0.45 -1.87 0.13 0.00 0.45 0.00 0.00 32.46 31.62 1um1 n ARG 16 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1um1 n GLY 17 N 6.86 -2.39 0.22 5.14 0.00 -1.26 -4.86 105.19 108.90 1um1 n GLY 17 Ca 0.54 -1.51 0.14 0.00 0.00 0.00 0.00 46.02 45.19 1um1 n GLY 17 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1um1 h PRO 18 N 0.00 0.00 0.00 1.61 0.13 -1.95 -2.85 132.00 128.94 1um1 h PRO 18 Ca -0.23 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 64.85 1um1 h PRO 18 Cb 0.68 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.80 1um1 h PRO 18 CO 0.15 0.00 -1.14 0.43 -0.23 0.00 0.00 178.00 177.21 1um1 n SER 19 N -2.87 0.86 -0.09 1.44 7.64 -1.26 -4.98 113.62 114.36 1um1 n SER 19 Ca 0.03 0.35 0.00 0.00 1.01 0.00 0.00 58.87 60.25 1um1 n SER 19 Cb 0.39 0.34 0.00 0.00 -1.01 0.00 0.00 64.21 63.93 1um1 n SER 19 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1um1 n GLY 20 N 1.25 0.50 7.00 0.23 0.00 -1.08 -4.95 105.19 108.15 1um1 n GLY 20 Ca -0.03 -0.04 0.00 0.00 0.00 0.00 0.00 46.02 45.95 1um1 n GLY 20 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1um1 n LEU 21 N -0.09 0.00 0.00 0.99 4.77 -1.26 -4.78 117.00 116.64 1um1 n LEU 21 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 1um1 n LEU 21 Cb 0.04 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.13 1um1 n LEU 21 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 176.67 1um1 n GLY 22 N 0.00 -1.84 2.77 -0.72 0.00 -1.26 -4.44 105.19 99.71 1um1 n GLY 22 Ca 0.00 0.81 -0.17 0.00 0.00 0.00 0.00 46.02 46.65 1um1 n GLY 22 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1um1 s MET 23 N 0.00 0.16 -0.93 1.61 1.00 -1.26 -1.21 119.30 118.67 1um1 s MET 23 Ca 0.00 0.16 -0.14 0.00 0.00 0.00 0.00 55.69 55.71 1um1 s MET 23 Cb 0.00 -0.46 0.21 0.00 0.00 0.00 0.00 34.83 34.58 1um1 s MET 23 CO 0.00 -0.19 0.96 0.20 0.00 0.00 0.00 175.02 175.99 1um1 s GLY 24 N 1.32 2.59 0.12 -0.03 0.00 -0.29 -4.95 107.32 106.07 1um1 s GLY 24 Ca -0.06 -3.30 -0.30 0.00 0.00 0.00 0.00 44.72 41.06 1um1 s GLY 24 CO -0.03 1.50 0.97 1.08 0.00 0.00 0.00 173.10 176.63 1um1 s LEU 25 N 0.56 4.50 0.19 0.66 2.01 -1.26 0.12 118.68 125.46 1um1 s LEU 25 Ca 0.25 1.82 0.11 0.00 0.01 0.00 0.00 54.13 56.32 1um1 s LEU 25 Cb -0.08 -3.59 -0.04 0.00 0.01 0.00 0.00 46.19 42.48 1um1 s LEU 25 CO -0.08 -0.08 -0.23 -0.51 1.01 0.00 0.00 176.35 176.46 1um1 s ILE 26 N -0.02 2.24 -0.17 -0.59 2.07 0.24 -4.87 121.20 120.09 1um1 s ILE 26 Ca 0.47 -2.00 -0.29 0.00 -1.41 0.00 0.00 60.65 57.41 1um1 s ILE 26 Cb -0.24 -2.06 -0.03 0.00 0.13 0.00 0.00 42.46 40.26 1um1 s ILE 26 CO 0.30 -0.16 1.52 -0.62 -1.91 0.00 0.00 174.94 174.07 1um1 s ASP 27 N -2.66 6.61 0.52 4.50 2.15 -1.26 -2.08 116.67 124.44 1um1 s ASP 27 Ca 0.20 1.76 0.38 0.00 0.43 0.00 0.00 52.55 55.31 1um1 s ASP 27 Cb -0.08 -2.53 1.54 0.00 -0.30 0.00 0.00 42.92 41.55 1um1 s ASP 27 CO 0.09 -1.05 1.71 1.23 -0.17 0.00 0.00 175.17 176.99 1um1 h GLY 28 N 10.80 0.30 1.50 2.66 0.00 -0.73 1.40 103.07 119.00 1um1 h GLY 28 Ca -0.33 -0.04 -0.16 0.00 0.00 0.00 0.00 47.33 46.80 1um1 h GLY 28 CO 0.99 -0.07 -0.56 -0.33 0.00 0.00 0.00 176.54 176.57 1um1 h MET 29 N 0.05 0.53 -0.61 4.80 2.86 -0.92 -1.54 114.93 120.10 1um1 h MET 29 Ca 0.71 -0.34 -0.04 0.00 -2.06 0.00 0.00 59.70 57.97 1um1 h MET 29 Cb 2.65 0.04 -0.03 0.00 0.06 0.00 0.00 31.60 34.32 1um1 h MET 29 CO -0.09 0.95 0.22 0.45 1.06 0.00 0.00 176.91 179.49 1um1 h HIS 30 N 0.40 0.92 -4.20 -0.22 3.86 0.16 -3.36 115.15 112.71 1um1 h HIS 30 Ca 0.01 -0.06 -0.48 0.00 -1.16 0.00 0.00 60.37 58.68 1um1 h HIS 30 Cb 1.10 -0.28 0.02 0.00 1.06 0.00 0.00 27.41 29.31 1um1 h HIS 30 CO 0.04 0.72 0.37 0.95 0.86 0.00 0.00 177.93 180.88 1um1 s THR 31 N -5.37 4.56 0.59 2.45 -4.23 -0.91 -4.89 115.64 107.84 1um1 s THR 31 Ca -0.10 1.16 0.32 0.00 -1.18 0.00 0.00 61.69 61.89 1um1 s THR 31 Cb 0.16 -3.74 0.46 0.00 1.34 0.00 0.00 72.50 70.72 1um1 s THR 31 CO 0.80 -0.74 1.59 -0.74 -0.54 0.00 0.00 174.62 174.99 1um1 h HIS 32 N 0.77 0.00 -1.04 3.99 2.76 -1.60 0.75 115.15 120.79 1um1 h HIS 32 Ca -0.46 0.00 0.27 0.00 -2.20 0.00 0.00 60.37 57.98 1um1 h HIS 32 Cb 1.19 0.00 -0.12 0.00 1.55 0.00 0.00 27.41 30.03 1um1 h HIS 32 CO 0.64 0.00 0.63 1.25 -1.30 0.00 0.00 177.93 179.15 1um1 h LEU 33 N 0.00 0.55 2.66 0.26 5.85 -1.71 -3.44 115.31 119.48 1um1 h LEU 33 Ca 0.48 0.13 -0.30 0.00 0.84 0.00 0.00 57.88 59.03 1um1 h LEU 33 Cb 2.42 0.05 -0.01 0.00 0.37 0.00 0.00 40.66 43.48 1um1 h LEU 33 CO -0.01 0.05 -0.38 0.61 -0.34 0.00 0.00 178.44 178.37 1um1 n GLY 34 N -1.38 -0.50 3.42 3.75 0.00 0.26 -4.95 105.19 105.80 1um1 n GLY 34 Ca 0.28 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 46.03 1um1 n GLY 34 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1um1 s ALA 35 N -2.74 2.52 0.51 4.61 0.00 -1.01 -4.75 121.76 120.90 1um1 s ALA 35 Ca 0.01 -1.61 -0.19 0.00 0.00 0.00 0.00 51.96 50.17 1um1 s ALA 35 Cb -0.00 -0.35 -0.08 0.00 0.00 0.00 0.00 23.12 22.69 1um1 s ALA 35 CO 0.01 0.45 1.04 -1.25 0.00 0.00 0.00 175.76 176.01 1um1 s PRO 36 N -2.57 3.72 0.00 0.00 0.04 -1.26 -0.32 135.00 134.61 1um1 s PRO 36 Ca 0.20 1.32 0.00 0.00 0.04 0.00 0.00 61.00 62.56 1um1 s PRO 36 Cb -0.08 -2.08 0.00 0.00 0.04 0.00 0.00 34.50 32.37 1um1 s PRO 36 CO 0.09 -0.49 0.00 0.41 0.04 0.00 0.00 177.00 177.05 1um1 n GLY 37 N -0.42 2.79 3.54 0.56 0.00 -1.26 -4.82 105.19 105.58 1um1 n GLY 37 Ca 0.09 -2.07 -0.34 0.00 0.00 0.00 0.00 46.02 43.70 1um1 n GLY 37 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1um1 s LEU 38 N 0.00 3.41 0.09 0.99 2.01 -1.26 -0.35 118.68 123.56 1um1 s LEU 38 Ca 0.00 -0.07 0.07 0.00 0.01 0.00 0.00 54.13 54.15 1um1 s LEU 38 Cb 0.00 -1.83 -0.03 0.00 0.01 0.00 0.00 46.19 44.34 1um1 s LEU 38 CO 0.00 0.17 -0.19 -0.31 1.01 0.00 0.00 176.35 177.04 1um1 s TYR 39 N 0.34 1.63 -0.03 0.29 1.51 -0.88 -0.32 117.35 119.89 1um1 s TYR 39 Ca -0.02 -0.42 -0.30 0.00 -1.01 0.00 0.00 57.07 55.32 1um1 s TYR 39 Cb -0.14 -0.90 -0.06 0.00 -0.11 0.00 0.00 41.96 40.75 1um1 s TYR 39 CO 0.02 0.15 1.56 0.42 -1.11 0.00 0.00 175.55 176.59 1um1 s ILE 40 N -1.15 3.56 -0.12 2.71 1.01 -0.33 -0.59 121.20 126.29 1um1 s ILE 40 Ca 0.04 0.83 0.12 0.00 0.00 0.00 0.00 60.65 61.64 1um1 s ILE 40 Cb -0.10 -3.53 -0.17 0.00 0.01 0.00 0.00 42.46 38.67 1um1 s ILE 40 CO 0.03 -0.04 0.06 1.67 0.00 0.00 0.00 174.94 176.67 1um1 n GLN 41 N 6.35 1.77 -4.00 2.79 -0.06 0.33 0.12 117.38 124.68 1um1 n GLN 41 Ca 0.16 -0.02 -0.09 0.00 -2.00 0.00 0.00 57.00 55.05 1um1 n GLN 41 Cb 0.43 -1.33 -0.05 0.00 -4.06 0.00 0.00 30.24 25.22 1um1 n GLN 41 CO 0.00 0.00 0.00 0.95 -0.20 0.00 0.00 177.06 177.81 1um1 s THR 42 N -2.36 0.00 -0.08 1.69 -4.23 -0.96 -4.86 115.64 104.84 1um1 s THR 42 Ca -0.06 -1.41 -0.03 0.00 -1.18 0.00 0.00 61.69 59.01 1um1 s THR 42 Cb 0.04 -2.19 0.05 0.00 1.34 0.00 0.00 72.50 71.74 1um1 s THR 42 CO 0.54 -0.01 0.17 -0.76 -0.54 0.00 0.00 174.62 174.02 1um1 s LEU 43 N -3.02 0.20 0.79 4.79 1.43 -1.26 -1.14 118.68 120.48 1um1 s LEU 43 Ca 0.22 0.35 -0.11 0.00 -1.03 0.00 0.00 54.13 53.57 1um1 s LEU 43 Cb -0.00 0.37 0.07 0.00 0.03 0.00 0.00 46.19 46.65 1um1 s LEU 43 CO 0.09 -0.21 1.11 -0.76 0.23 0.00 0.00 176.35 176.81 1um1 s LEU 44 N 1.86 3.02 0.00 1.79 1.02 -0.35 -4.95 118.68 121.07 1um1 s LEU 44 Ca -0.02 1.91 0.00 0.00 0.02 0.00 0.00 54.13 56.04 1um1 s LEU 44 Cb -0.12 -4.53 0.00 0.00 0.02 0.00 0.00 46.19 41.56 1um1 s LEU 44 CO -0.06 -2.24 0.08 -0.81 0.02 0.00 0.00 176.35 173.35 1um1 n PRO 45 N -3.60 0.00 -0.58 1.29 -0.04 -1.26 -4.19 135.00 126.61 1um1 n PRO 45 Ca 0.10 0.00 -0.16 0.00 -0.04 0.00 0.00 63.50 63.40 1um1 n PRO 45 Cb 0.53 -0.46 -0.02 0.00 -0.04 0.00 0.00 33.50 33.50 1um1 n PRO 45 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1um1 n GLY 46 N 1.91 2.72 3.36 0.55 0.00 -1.26 -4.63 105.19 107.85 1um1 n GLY 46 Ca 0.00 -0.67 -0.18 0.00 0.00 0.00 0.00 46.02 45.17 1um1 n GLY 46 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1um1 s SER 47 N 3.55 2.11 0.14 1.61 1.04 -1.26 -4.97 113.70 115.91 1um1 s SER 47 Ca 0.32 -1.21 -0.05 0.00 0.48 0.00 0.00 55.95 55.49 1um1 s SER 47 Cb 0.09 -0.04 -0.06 0.00 0.10 0.00 0.00 66.02 66.11 1um1 s SER 47 CO -0.02 -0.46 1.34 1.55 0.98 0.00 0.00 173.24 176.62 1um1 h PRO 48 N 2.42 0.46 0.34 4.02 0.13 -1.86 -2.46 132.00 135.04 1um1 h PRO 48 Ca -0.39 -0.44 -0.01 0.00 -0.87 0.00 0.00 66.00 64.29 1um1 h PRO 48 Cb 1.23 0.11 -0.01 0.00 0.13 0.00 0.00 31.00 32.46 1um1 h PRO 48 CO 0.65 1.09 -0.32 0.00 -0.23 0.00 0.00 178.00 179.19 1um1 h ALA 49 N 0.77 -1.02 -0.81 -0.56 0.00 -1.88 0.24 119.26 115.99 1um1 h ALA 49 Ca -0.06 -0.13 0.12 0.00 0.00 0.00 0.00 54.91 54.84 1um1 h ALA 49 Cb 1.49 0.55 -0.06 0.00 0.00 0.00 0.00 17.79 19.77 1um1 h ALA 49 CO 0.15 -1.04 0.53 0.00 0.00 0.00 0.00 179.25 178.89 1um1 h ALA 50 N -1.24 1.87 -0.70 0.00 0.00 -1.74 0.10 119.26 117.55 1um1 h ALA 50 Ca -0.04 0.00 0.04 0.00 0.00 0.00 0.00 54.91 54.91 1um1 h ALA 50 Cb 0.57 -0.13 -0.05 0.00 0.00 0.00 0.00 17.79 18.18 1um1 h ALA 50 CO -0.03 -0.07 0.43 0.00 0.00 0.00 0.00 179.25 179.58 1um1 h ALA 51 N 1.61 0.93 -0.11 0.00 0.00 -0.84 -2.37 119.26 118.48 1um1 h ALA 51 Ca 0.39 -0.01 0.04 0.00 0.00 0.00 0.00 54.91 55.33 1um1 h ALA 51 Cb 0.63 -0.20 -0.06 0.00 0.00 0.00 0.00 17.79 18.16 1um1 h ALA 51 CO -0.15 0.17 -0.36 0.22 0.00 0.00 0.00 179.25 179.13 1um1 h ASP 52 N 0.82 -1.11 0.00 0.00 3.58 0.21 -3.47 116.42 116.45 1um1 h ASP 52 Ca 0.29 0.15 0.00 0.00 0.42 0.00 0.00 57.03 57.90 1um1 h ASP 52 Cb 0.08 0.46 0.00 0.00 1.72 0.00 0.00 39.33 41.59 1um1 h ASP 52 CO -0.13 -0.39 0.00 0.61 -2.88 0.00 0.00 179.24 176.45 1um1 n GLY 53 N -1.42 2.63 0.39 -0.78 0.00 -0.89 -4.85 105.19 100.27 1um1 n GLY 53 Ca -0.04 -0.70 -0.07 0.00 0.00 0.00 0.00 46.02 45.22 1um1 n GLY 53 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1um1 h ARG 54 N 0.00 -0.12 -5.43 1.61 1.12 -1.88 -3.38 114.38 106.29 1um1 h ARG 54 Ca 0.00 0.01 -0.62 0.00 -1.11 0.00 0.00 59.98 58.26 1um1 h ARG 54 Cb 0.00 0.03 -0.07 0.00 -0.01 0.00 0.00 29.97 29.92 1um1 h ARG 54 CO 0.00 -0.08 1.56 1.28 -3.11 0.00 0.00 179.97 179.62 1um1 n LEU 55 N -5.40 0.49 -4.59 3.80 4.77 -1.26 -4.87 117.00 109.94 1um1 n LEU 55 Ca 0.04 0.40 -0.24 0.00 -0.03 0.00 0.00 56.01 56.19 1um1 n LEU 55 Cb 0.35 -0.91 -0.08 0.00 -2.33 0.00 0.00 43.42 40.45 1um1 n LEU 55 CO -0.07 -0.74 -0.38 -0.94 -1.33 0.00 0.00 177.39 173.94 1um1 s SER 56 N 7.64 4.27 0.15 -1.43 1.04 -1.26 -4.88 113.70 119.23 1um1 s SER 56 Ca 1.28 -0.73 -0.31 0.00 0.48 0.00 0.00 55.95 56.68 1um1 s SER 56 Cb -1.36 -0.70 -0.08 0.00 0.10 0.00 0.00 66.02 63.98 1um1 s SER 56 CO 0.56 0.03 1.39 -0.76 0.98 0.00 0.00 173.24 175.44 1um1 s LEU 57 N -3.51 4.38 0.00 2.42 1.43 -1.26 -2.36 118.68 119.78 1um1 s LEU 57 Ca 0.30 2.39 0.00 0.00 -1.03 0.00 0.00 54.13 55.79 1um1 s LEU 57 Cb -0.06 -3.60 0.00 0.00 0.03 0.00 0.00 46.19 42.56 1um1 s LEU 57 CO 0.18 -0.64 0.00 0.61 0.23 0.00 0.00 176.35 176.73 1um1 n GLY 58 N 3.14 2.99 3.17 -3.19 0.00 0.32 -4.78 105.19 106.84 1um1 n GLY 58 Ca 0.10 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.77 1um1 n GLY 58 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1um1 n ASP 59 N 0.00 -3.74 -3.88 1.61 8.00 -1.00 -4.50 116.55 113.04 1um1 n ASP 59 Ca 0.00 0.15 -0.22 0.00 0.71 0.00 0.00 54.79 55.43 1um1 n ASP 59 Cb 0.00 -0.89 -0.17 0.00 -0.02 0.00 0.00 41.12 40.05 1um1 n ASP 59 CO 0.00 0.00 0.00 -0.60 -0.39 0.00 0.00 177.20 176.21 1um1 s ARG 60 N -2.74 0.96 0.14 -1.24 3.52 -1.26 -1.18 118.95 117.15 1um1 s ARG 60 Ca 0.47 -0.11 -0.28 0.00 -0.13 0.00 0.00 55.73 55.68 1um1 s ARG 60 Cb -0.13 -1.02 -0.07 0.00 -1.56 0.00 0.00 34.95 32.17 1um1 s ARG 60 CO 0.73 -0.14 0.88 0.42 -0.81 0.00 0.00 175.30 176.37 1um1 s ILE 61 N 1.23 4.41 -0.08 4.11 -1.09 0.57 -1.80 121.20 128.55 1um1 s ILE 61 Ca -0.06 1.91 0.05 0.00 -2.23 0.00 0.00 60.65 60.32 1um1 s ILE 61 Cb -0.14 -4.24 -0.08 0.00 -1.58 0.00 0.00 42.46 36.42 1um1 s ILE 61 CO -0.02 0.42 -0.00 0.18 -1.23 0.00 0.00 174.94 174.29 1um1 n LEU 62 N 2.21 0.79 -3.74 2.97 4.77 0.30 -4.46 117.00 119.84 1um1 n LEU 62 Ca -0.01 -0.01 -0.14 0.00 -0.03 0.00 0.00 56.01 55.82 1um1 n LEU 62 Cb 0.49 0.05 -0.08 0.00 -2.33 0.00 0.00 43.42 41.54 1um1 n LEU 62 CO 0.49 0.30 0.05 -1.61 -1.33 0.00 0.00 177.39 175.30 1um1 s GLU 63 N -2.18 0.70 -0.24 3.23 2.02 -1.24 -1.12 118.70 119.87 1um1 s GLU 63 Ca -0.06 -0.17 -0.00 0.00 0.02 0.00 0.00 54.97 54.76 1um1 s GLU 63 Cb 0.02 0.31 0.07 0.00 0.10 0.00 0.00 34.13 34.64 1um1 s GLU 63 CO 0.28 -0.20 0.01 0.08 0.02 0.00 0.00 175.26 175.45 1um1 s VAL 64 N -1.35 1.13 -0.96 2.63 1.01 -1.12 -0.31 120.40 121.43 1um1 s VAL 64 Ca -0.13 -1.12 0.00 0.00 0.00 0.00 0.00 61.98 60.72 1um1 s VAL 64 Cb -0.05 -1.59 0.00 0.00 0.00 0.00 0.00 36.38 34.74 1um1 s VAL 64 CO 0.05 -0.28 0.00 0.59 0.00 0.00 0.00 175.10 175.45 1um1 n ASN 65 N 4.80 -5.52 -0.10 3.32 3.02 0.40 -1.79 115.26 119.40 1um1 n ASN 65 Ca -0.08 0.22 0.00 0.00 -0.03 0.00 0.00 54.58 54.69 1um1 n ASN 65 Cb 0.44 -3.82 0.00 0.00 -0.61 0.00 0.00 39.78 35.80 1um1 n ASN 65 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1um1 n GLY 66 N 0.03 0.92 2.89 7.41 0.00 -1.26 -4.97 105.19 110.21 1um1 n GLY 66 Ca -0.09 -0.11 -0.30 0.00 0.00 0.00 0.00 46.02 45.52 1um1 n GLY 66 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1um1 s SER 67 N -2.05 4.32 -0.44 1.61 0.01 -0.74 -5.07 113.70 111.34 1um1 s SER 67 Ca 0.00 -1.78 -0.44 0.00 1.31 0.00 0.00 55.95 55.04 1um1 s SER 67 Cb 0.00 -1.25 -0.18 0.00 0.21 0.00 0.00 66.02 64.80 1um1 s SER 67 CO 0.00 -0.37 1.83 -1.54 0.41 0.00 0.00 173.24 173.57 1um1 n SER 68 N 4.56 1.42 -3.33 2.44 3.41 -1.26 -2.79 113.62 118.07 1um1 n SER 68 Ca -0.01 0.96 -0.33 0.00 -0.26 0.00 0.00 58.87 59.23 1um1 n SER 68 Cb 0.42 -0.97 -0.02 0.00 -0.26 0.00 0.00 64.21 63.38 1um1 n SER 68 CO 0.00 0.00 0.00 -0.11 -0.16 0.00 0.00 175.04 174.77 1um1 n LEU 69 N 5.76 5.58 0.00 1.04 0.00 -0.27 -4.80 117.00 124.30 1um1 n LEU 69 Ca 0.37 -5.52 0.00 0.00 0.00 0.00 0.00 56.01 50.87 1um1 n LEU 69 Cb 0.01 -0.84 0.00 0.00 0.00 0.00 0.00 43.42 42.59 1um1 n LEU 69 CO 0.86 2.16 0.00 0.18 0.00 0.00 0.00 177.39 180.60 1um1 n LEU 70 N 0.07 1.06 -2.00 -1.96 4.77 -1.26 -4.60 117.00 113.08 1um1 n LEU 70 Ca 0.36 0.00 -0.22 0.00 -0.03 0.00 0.00 56.01 56.12 1um1 n LEU 70 Cb 0.34 0.00 0.09 0.00 -2.33 0.00 0.00 43.42 41.52 1um1 n LEU 70 CO 0.44 0.00 1.21 0.61 -1.33 0.00 0.00 177.39 178.33 1um1 n GLY 71 N 2.61 4.42 3.59 -0.72 0.00 -1.26 -4.41 105.19 109.43 1um1 n GLY 71 Ca 0.00 -1.27 -0.38 0.00 0.00 0.00 0.00 46.02 44.37 1um1 n GLY 71 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1um1 s LEU 72 N -2.57 4.02 0.00 0.99 1.43 -1.26 -5.08 118.68 116.21 1um1 s LEU 72 Ca 0.44 -0.01 -0.16 0.00 -1.03 0.00 0.00 54.13 53.37 1um1 s LEU 72 Cb 0.35 -2.13 0.25 0.00 0.03 0.00 0.00 46.19 44.69 1um1 s LEU 72 CO 0.03 -0.05 0.70 0.61 0.23 0.00 0.00 176.35 177.86 1um1 n GLY 73 N 5.05 -3.31 0.17 -3.19 0.00 -1.26 -4.59 105.19 98.06 1um1 n GLY 73 Ca -0.14 -1.37 -0.06 0.00 0.00 0.00 0.00 46.02 44.44 1um1 n GLY 73 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 1um1 h TYR 74 N -2.79 -0.38 -1.25 1.61 5.03 -1.98 0.22 116.97 117.43 1um1 h TYR 74 Ca -0.29 -0.01 0.36 0.00 2.58 0.00 0.00 58.73 61.38 1um1 h TYR 74 Cb 0.92 0.13 -0.05 0.00 1.55 0.00 0.00 36.73 39.28 1um1 h TYR 74 CO 0.00 -0.24 0.95 -0.07 -1.32 0.00 0.00 178.16 177.48 1um1 h LEU 75 N -0.52 0.00 -0.00 2.82 4.07 -1.97 1.65 115.31 121.36 1um1 h LEU 75 Ca -0.04 0.00 -0.00 0.00 0.08 0.00 0.00 57.88 57.92 1um1 h LEU 75 Cb 0.32 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.06 1um1 h LEU 75 CO 0.07 0.00 -0.01 0.03 -1.08 0.00 0.00 178.44 177.45 1um1 h ARG 76 N 0.00 0.00 0.34 1.13 2.47 -1.85 -2.95 114.38 113.53 1um1 h ARG 76 Ca 0.59 -0.00 -0.02 0.00 -1.26 0.00 0.00 59.98 59.29 1um1 h ARG 76 Cb 2.49 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 30.81 1um1 h ARG 76 CO -0.01 0.76 -0.17 0.00 0.56 0.00 0.00 179.97 181.12 1um1 h ALA 77 N 0.24 -0.46 -1.00 0.04 0.00 0.34 -2.75 119.26 115.67 1um1 h ALA 77 Ca -0.00 -0.19 0.38 0.00 0.00 0.00 0.00 54.91 55.11 1um1 h ALA 77 Cb 0.77 0.18 -0.18 0.00 0.00 0.00 0.00 17.79 18.55 1um1 h ALA 77 CO 0.00 -0.53 0.42 -0.24 0.00 0.00 0.00 179.25 178.90 1um1 h VAL 78 N -0.93 0.00 0.16 0.00 3.04 0.20 1.35 116.25 120.07 1um1 h VAL 78 Ca -0.05 -0.00 -0.01 0.00 -1.01 0.00 0.00 66.70 65.63 1um1 h VAL 78 Cb 0.53 -0.00 0.00 0.00 -2.01 0.00 0.00 31.29 29.81 1um1 h VAL 78 CO 0.08 0.00 -0.08 -0.78 -1.01 0.00 0.00 177.57 175.78 1um1 h ASP 79 N 0.00 -0.18 -0.85 3.17 3.58 -1.42 0.28 116.42 121.00 1um1 h ASP 79 Ca 0.79 -0.07 0.10 0.00 0.42 0.00 0.00 57.03 58.28 1um1 h ASP 79 Cb 2.01 0.05 -0.12 0.00 1.72 0.00 0.00 39.33 42.98 1um1 h ASP 79 CO -0.81 -0.05 -0.50 -0.07 -2.88 0.00 0.00 179.24 174.93 1um1 h LEU 80 N -0.30 -1.79 0.03 2.28 3.38 0.21 0.68 115.31 119.79 1um1 h LEU 80 Ca -0.02 0.30 -0.00 0.00 0.09 0.00 0.00 57.88 58.24 1um1 h LEU 80 Cb 0.24 0.82 0.00 0.00 0.09 0.00 0.00 40.66 41.81 1um1 h LEU 80 CO 0.04 -0.29 -0.02 0.40 0.09 0.00 0.00 178.44 178.66 1um1 h ILE 81 N -0.09 1.04 -0.70 1.22 5.03 -1.24 -1.55 117.51 121.22 1um1 h ILE 81 Ca 0.21 -0.22 0.10 0.00 -0.12 0.00 0.00 64.86 64.83 1um1 h ILE 81 Cb 0.51 1.18 -0.12 0.00 -3.03 0.00 0.00 36.82 35.37 1um1 h ILE 81 CO -0.86 0.06 -0.43 0.03 -0.68 0.00 0.00 178.15 176.27 1um1 h ARG 82 N -0.14 -0.15 -1.20 2.37 3.08 0.25 0.92 114.38 119.51 1um1 h ARG 82 Ca -0.00 0.01 -0.37 0.00 0.07 0.00 0.00 59.98 59.69 1um1 h ARG 82 Cb 0.13 0.03 -0.18 0.00 0.08 0.00 0.00 29.97 30.03 1um1 h ARG 82 CO 0.01 -0.10 0.47 0.72 -1.07 0.00 0.00 179.97 180.00 1um1 n HIS 83 N -5.41 1.94 0.00 3.04 8.25 0.21 -4.89 115.22 118.35 1um1 n HIS 83 Ca 0.04 -1.80 0.00 0.00 -0.26 0.00 0.00 57.72 55.70 1um1 n HIS 83 Cb 0.35 -0.89 0.00 0.00 1.12 0.00 0.00 29.99 30.57 1um1 n HIS 83 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1um1 n GLY 84 N -0.24 -1.46 3.20 -1.41 0.00 0.32 -4.95 105.19 100.65 1um1 n GLY 84 Ca 0.38 -1.16 -0.10 0.00 0.00 0.00 0.00 46.02 45.14 1um1 n GLY 84 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1um1 s GLY 85 N 0.00 1.02 0.42 -0.02 0.00 -1.26 -5.01 107.32 102.47 1um1 s GLY 85 Ca 0.00 -1.43 0.29 0.00 0.00 0.00 0.00 44.72 43.58 1um1 s GLY 85 CO 0.00 -1.27 1.61 1.70 0.00 0.00 0.00 173.10 175.13 1um1 h LYS 86 N 2.74 0.06 -4.63 2.90 3.64 -1.95 -3.20 116.57 116.13 1um1 h LYS 86 Ca -0.35 -0.00 -0.70 0.00 -1.27 0.00 0.00 60.65 58.33 1um1 h LYS 86 Cb 1.22 -0.01 -0.28 0.00 -0.41 0.00 0.00 32.23 32.74 1um1 h LYS 86 CO 0.55 0.04 -0.58 0.15 -2.27 0.00 0.00 179.45 177.35 1um1 s LYS 87 N -5.34 2.62 -0.27 1.90 1.02 -1.26 -2.00 119.74 116.42 1um1 s LYS 87 Ca -0.08 -1.22 -0.20 0.00 0.02 0.00 0.00 55.97 54.49 1um1 s LYS 87 Cb 0.31 -3.54 -0.02 0.00 -0.52 0.00 0.00 37.83 34.06 1um1 s LYS 87 CO 0.82 -0.72 0.60 -1.64 -0.92 0.00 0.00 175.35 173.49 1um1 s MET 88 N 1.41 4.05 -0.13 1.68 -1.94 0.16 -4.92 119.30 119.61 1um1 s MET 88 Ca -0.00 0.43 0.00 0.00 -1.71 0.00 0.00 55.69 54.41 1um1 s MET 88 Cb -0.20 -3.67 -0.01 0.00 2.01 0.00 0.00 34.83 32.96 1um1 s MET 88 CO 0.03 -0.43 -0.14 1.03 -0.01 0.00 0.00 175.02 175.50 1um1 s ARG 89 N 2.48 3.33 -0.04 2.03 0.52 -1.26 -0.70 118.95 125.31 1um1 s ARG 89 Ca 0.25 -0.71 0.03 0.00 -0.52 0.00 0.00 55.73 54.78 1um1 s ARG 89 Cb -0.15 -2.62 0.01 0.00 0.52 0.00 0.00 34.95 32.70 1um1 s ARG 89 CO 0.09 0.17 -0.12 -0.06 0.02 0.00 0.00 175.30 175.40 1um1 s PHE 90 N 0.46 1.29 -0.91 -0.53 0.08 -0.75 0.15 117.98 117.77 1um1 s PHE 90 Ca -0.10 -0.39 -0.16 0.00 0.12 0.00 0.00 56.93 56.40 1um1 s PHE 90 Cb -0.16 -0.92 0.17 0.00 -0.57 0.00 0.00 43.02 41.55 1um1 s PHE 90 CO 0.05 -0.17 0.99 -1.17 -0.10 0.00 0.00 175.22 174.82 1um1 s LEU 91 N 0.33 5.81 -0.05 -0.37 2.96 0.57 -0.27 118.68 127.66 1um1 s LEU 91 Ca -0.07 -2.41 -0.20 0.00 -0.22 0.00 0.00 54.13 51.23 1um1 s LEU 91 Cb -0.12 -2.31 -0.05 0.00 0.50 0.00 0.00 46.19 44.21 1um1 s LEU 91 CO 0.02 -0.82 0.57 -0.69 -1.32 0.00 0.00 176.35 174.11 1um1 s VAL 92 N 1.46 5.02 -0.15 1.68 1.01 -0.02 0.11 120.40 129.51 1um1 s VAL 92 Ca 0.27 1.17 -0.10 0.00 0.00 0.00 0.00 61.98 63.32 1um1 s VAL 92 Cb -0.07 -3.91 -0.05 0.00 0.00 0.00 0.00 36.38 32.36 1um1 s VAL 92 CO -0.09 0.37 0.19 0.00 0.00 0.00 0.00 175.10 175.57 1um1 s ALA 93 N 0.17 3.73 -0.65 5.51 0.00 -0.74 0.87 121.76 130.64 1um1 s ALA 93 Ca 0.30 -0.59 -0.26 0.00 0.00 0.00 0.00 51.96 51.42 1um1 s ALA 93 Cb -0.17 -2.17 -0.06 0.00 0.00 0.00 0.00 23.12 20.72 1um1 s ALA 93 CO 0.15 0.32 2.13 0.21 0.00 0.00 0.00 175.76 178.58 1um1 s LYS 94 N -0.19 2.29 0.34 0.00 2.36 -0.04 -4.23 119.74 120.27 1um1 s LYS 94 Ca 0.13 0.69 0.00 0.00 -2.55 0.00 0.00 55.97 54.24 1um1 s LYS 94 Cb -0.12 -4.63 -0.03 0.00 -1.05 0.00 0.00 37.83 32.00 1um1 s LYS 94 CO 0.02 -3.28 0.55 -1.12 1.55 0.00 0.00 175.35 173.07 1um1 s SER 95 N 9.82 6.30 0.77 1.43 0.01 -1.26 -4.56 113.70 126.21 1um1 s SER 95 Ca 0.81 0.46 -0.12 0.00 1.31 0.00 0.00 55.95 58.41 1um1 s SER 95 Cb -0.13 -2.04 0.05 0.00 0.21 0.00 0.00 66.02 64.12 1um1 s SER 95 CO 0.17 -0.29 1.14 -1.81 0.41 0.00 0.00 173.24 172.86 1um1 s ASP 96 N -3.98 4.90 0.28 2.44 1.01 -1.26 -4.95 116.67 115.10 1um1 s ASP 96 Ca 0.40 0.98 -0.02 0.00 0.71 0.00 0.00 52.55 54.62 1um1 s ASP 96 Cb -0.10 -1.63 0.41 0.00 1.01 0.00 0.00 42.92 42.62 1um1 s ASP 96 CO 0.36 -1.68 1.91 0.58 0.21 0.00 0.00 175.17 176.55 1um1 h VAL 97 N -0.89 1.13 -0.49 -1.27 2.07 -1.99 -2.08 116.25 112.73 1um1 h VAL 97 Ca -0.46 -0.40 0.10 0.00 0.82 0.00 0.00 66.70 66.76 1um1 h VAL 97 Cb 1.29 -0.15 -0.10 0.00 -1.52 0.00 0.00 31.29 30.82 1um1 h VAL 97 CO 0.64 0.21 -0.19 -0.33 0.02 0.00 0.00 177.57 177.93 1um1 h GLU 98 N 1.17 -0.08 -1.01 1.57 5.08 -1.99 0.55 114.58 119.89 1um1 h GLU 98 Ca 0.40 0.01 0.27 0.00 -1.00 0.00 0.00 59.36 59.03 1um1 h GLU 98 Cb 0.08 0.02 -0.06 0.00 0.50 0.00 0.00 28.75 29.28 1um1 h GLU 98 CO -0.14 -0.05 0.69 1.15 -1.00 0.00 0.00 179.01 179.66 1um1 h THR 99 N -0.08 0.54 0.17 1.13 2.02 -1.74 0.36 112.91 115.30 1um1 h THR 99 Ca 0.23 -0.07 -0.28 0.00 0.77 0.00 0.00 66.41 67.06 1um1 h THR 99 Cb 0.44 0.31 0.03 0.00 -1.74 0.00 0.00 68.15 67.19 1um1 h THR 99 CO -0.54 0.04 -1.18 0.00 0.37 0.00 0.00 175.52 174.20 1um1 h ALA 100 N 1.55 -0.08 -0.66 6.16 0.00 -0.06 -3.00 119.26 123.17 1um1 h ALA 100 Ca 0.52 -0.77 0.13 0.00 0.00 0.00 0.00 54.91 54.79 1um1 h ALA 100 Cb 1.66 0.13 -0.13 0.00 0.00 0.00 0.00 17.79 19.45 1um1 h ALA 100 CO -0.13 0.59 -0.17 0.87 0.00 0.00 0.00 179.25 180.41 1um1 h LYS 101 N 0.05 -0.00 -0.25 0.00 1.57 0.29 1.12 116.57 119.35 1um1 h LYS 101 Ca -0.19 0.00 -0.06 0.00 -1.87 0.00 0.00 60.65 58.53 1um1 h LYS 101 Cb 1.90 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 34.20 1um1 h LYS 101 CO 0.22 -0.00 -0.09 0.87 -0.57 0.00 0.00 179.45 179.88 1um1 h LYS 102 N -0.00 0.41 -0.21 3.15 1.57 -1.42 -1.65 116.57 118.41 1um1 h LYS 102 Ca 0.32 -0.10 -0.09 0.00 -1.87 0.00 0.00 60.65 58.91 1um1 h LYS 102 Cb 0.49 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.73 1um1 h LYS 102 CO -0.68 0.51 -0.24 0.82 -0.57 0.00 0.00 179.45 179.29 1um1 h ILE 103 N 0.39 1.25 -3.48 1.86 1.08 0.10 -1.94 117.51 116.77 1um1 h ILE 103 Ca 0.08 -1.20 -0.52 0.00 -0.39 0.00 0.00 64.86 62.83 1um1 h ILE 103 Cb 0.41 1.36 0.02 0.00 -3.07 0.00 0.00 36.82 35.54 1um1 h ILE 103 CO 0.02 0.37 0.58 -1.00 -0.69 0.00 0.00 178.15 177.43 1um1 s HIS 104 N -4.50 3.38 -0.13 1.37 3.76 0.25 -4.85 115.29 114.57 1um1 s HIS 104 Ca -0.06 1.39 0.01 0.00 -0.15 0.00 0.00 55.06 56.25 1um1 s HIS 104 Cb 0.14 -3.47 -0.01 0.00 1.11 0.00 0.00 32.58 30.35 1um1 s HIS 104 CO 0.77 -1.35 -0.17 -1.12 -0.85 0.00 0.00 174.74 172.03 1um1 s SER 105 N 0.13 3.67 0.13 1.40 0.01 -1.26 -4.86 113.70 112.92 1um1 s SER 105 Ca 0.53 -0.42 -0.11 0.00 1.31 0.00 0.00 55.95 57.26 1um1 s SER 105 Cb -0.34 -1.54 -0.06 0.00 0.21 0.00 0.00 66.02 64.29 1um1 s SER 105 CO 0.38 0.15 0.48 -0.83 0.41 0.00 0.00 173.24 173.82 1um1 s GLY 106 N 0.44 2.37 -0.33 3.44 0.00 -1.26 -5.03 107.32 106.96 1um1 s GLY 106 Ca -0.12 -0.28 -0.29 0.00 0.00 0.00 0.00 44.72 44.03 1um1 s GLY 106 CO 0.05 -0.06 1.36 2.56 0.00 0.00 0.00 173.10 177.02 1um1 s PRO 107 N -2.11 3.80 0.11 2.90 0.04 -1.26 -4.77 135.00 133.71 1um1 s PRO 107 Ca 0.37 1.19 0.00 0.00 0.04 0.00 0.00 61.00 62.61 1um1 s PRO 107 Cb -0.14 -3.94 0.00 0.00 0.04 0.00 0.00 34.50 30.46 1um1 s PRO 107 CO 0.19 -1.27 0.00 0.43 0.04 0.00 0.00 177.00 176.39 1um1 n SER 108 N 8.06 0.30 -4.68 6.66 7.64 -1.26 -5.07 113.62 125.26 1um1 n SER 108 Ca 0.16 0.18 -0.42 0.00 1.01 0.00 0.00 58.87 59.80 1um1 n SER 108 Cb 0.47 0.01 0.00 0.00 -1.01 0.00 0.00 64.21 63.68 1um1 n SER 108 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 1um1 n SER 109 N -3.08 2.44 0.00 6.43 2.88 -1.26 -5.37 113.62 115.66 1um1 n SER 109 Ca 0.00 1.16 0.00 0.00 -1.33 0.00 0.00 58.87 58.70 1um1 n SER 109 Cb 0.00 -1.46 0.00 0.00 -0.75 0.00 0.00 64.21 62.00 1um1 n SER 109 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42