#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x5r s SER 2 N 0.00 5.85 0.08 1.61 0.01 -1.26 -4.90 113.70 115.09 1x5r s SER 2 Ca 0.00 -0.04 0.00 0.00 1.31 0.00 0.00 55.95 57.22 1x5r s SER 2 Cb 0.00 -1.25 0.00 0.00 0.21 0.00 0.00 66.02 64.98 1x5r s SER 2 CO 0.00 -0.60 0.00 -1.20 0.41 0.00 0.00 173.24 171.85 1x5r n SER 3 N -1.85 -9.45 -4.52 2.44 7.64 -1.26 -4.85 113.62 101.77 1x5r n SER 3 Ca 0.02 1.73 -0.43 0.00 1.01 0.00 0.00 58.87 61.20 1x5r n SER 3 Cb 0.58 -5.20 -0.04 0.00 -1.01 0.00 0.00 64.21 58.54 1x5r n SER 3 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 1x5r s GLY 4 N -0.58 1.45 1.12 0.23 0.00 -1.26 -5.03 107.32 103.25 1x5r s GLY 4 Ca 0.00 -1.23 -0.12 0.00 0.00 0.00 0.00 44.72 43.37 1x5r s GLY 4 CO 0.00 2.00 1.05 -0.56 0.00 0.00 0.00 173.10 175.59 1x5r s SER 5 N 2.75 1.32 -0.45 1.64 0.01 -1.26 -4.74 113.70 112.98 1x5r s SER 5 Ca 0.30 1.69 -0.35 0.00 1.31 0.00 0.00 55.95 58.89 1x5r s SER 5 Cb -0.13 -2.38 -0.13 0.00 0.21 0.00 0.00 66.02 63.59 1x5r s SER 5 CO 0.19 -4.01 2.26 -1.20 0.41 0.00 0.00 173.24 170.89 1x5r n SER 6 N -4.80 1.74 0.00 2.44 7.64 -1.26 -4.21 113.62 115.17 1x5r n SER 6 Ca 0.05 0.34 0.00 0.00 1.01 0.00 0.00 58.87 60.27 1x5r n SER 6 Cb 0.54 -1.20 0.00 0.00 -1.01 0.00 0.00 64.21 62.53 1x5r n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1x5r n GLY 7 N 6.64 1.36 3.27 0.23 0.00 -1.26 -5.18 105.19 110.25 1x5r n GLY 7 Ca 0.46 -0.54 -0.16 0.00 0.00 0.00 0.00 46.02 45.77 1x5r n GLY 7 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1x5r s GLY 8 N 0.00 1.85 0.18 -0.02 0.00 -1.26 -5.09 107.32 102.99 1x5r s GLY 8 Ca 0.00 -1.81 0.06 0.00 0.00 0.00 0.00 44.72 42.97 1x5r s GLY 8 CO 0.00 -1.49 0.09 -0.32 0.00 0.00 0.00 173.10 171.38 1x5r s GLY 9 N -3.29 1.68 0.58 0.20 0.00 -1.26 -5.11 107.32 100.13 1x5r s GLY 9 Ca 0.38 -1.31 -0.17 0.00 0.00 0.00 0.00 44.72 43.62 1x5r s GLY 9 CO 0.17 -1.33 1.08 1.20 0.00 0.00 0.00 173.10 174.23 1x5r s GLN 10 N -3.16 3.28 0.83 2.90 -0.21 -1.26 -5.03 119.66 117.02 1x5r s GLN 10 Ca 0.30 1.37 -0.12 0.00 0.02 0.00 0.00 55.36 56.93 1x5r s GLN 10 Cb -0.09 -2.02 0.09 0.00 1.00 0.00 0.00 33.01 31.99 1x5r s GLN 10 CO 0.22 -0.86 1.11 0.96 -2.12 0.00 0.00 175.29 174.60 1x5r s ILE 11 N -2.19 2.66 -0.28 1.08 -4.36 -1.26 -5.08 121.20 111.76 1x5r s ILE 11 Ca 0.67 0.21 -0.15 0.00 -0.26 0.00 0.00 60.65 61.12 1x5r s ILE 11 Cb -0.19 -2.98 0.09 0.00 1.25 0.00 0.00 42.46 40.63 1x5r s ILE 11 CO 0.33 -0.28 0.71 0.54 0.24 0.00 0.00 174.94 176.48 1x5r s VAL 12 N -3.23 -0.14 0.22 8.37 0.11 -1.26 -5.06 120.40 119.41 1x5r s VAL 12 Ca 0.62 0.00 0.00 0.00 -2.93 0.00 0.00 61.98 59.67 1x5r s VAL 12 Cb -0.14 -1.00 0.00 0.00 -1.53 0.00 0.00 36.38 33.71 1x5r s VAL 12 CO 0.54 0.00 0.00 1.57 -3.33 0.00 0.00 175.10 173.88 1x5r n HIS 13 N 4.44 -2.19 -3.95 1.54 -0.00 -1.26 -5.12 115.22 108.68 1x5r n HIS 13 Ca -0.19 0.46 -0.28 0.00 -0.00 0.00 0.00 57.72 57.72 1x5r n HIS 13 Cb 0.57 1.02 -0.04 0.00 -0.00 0.00 0.00 29.99 31.55 1x5r n HIS 13 CO 0.00 0.00 0.00 0.99 -0.00 0.00 0.00 176.34 177.33 1x5r s THR 14 N -1.66 5.26 0.30 3.57 2.01 -1.26 -4.94 115.64 118.92 1x5r s THR 14 Ca 0.00 -0.60 0.03 0.00 0.31 0.00 0.00 61.69 61.43 1x5r s THR 14 Cb 0.00 -3.64 -0.03 0.00 0.01 0.00 0.00 72.50 68.84 1x5r s THR 14 CO 0.00 0.01 0.47 -1.61 -0.69 0.00 0.00 174.62 172.80 1x5r s GLU 15 N -2.90 3.44 0.00 4.92 0.41 0.00 -4.95 118.70 119.63 1x5r s GLU 15 Ca 0.34 -0.55 0.04 0.00 -0.41 0.00 0.00 54.97 54.39 1x5r s GLU 15 Cb -0.12 -2.76 -0.01 0.00 -1.78 0.00 0.00 34.13 29.45 1x5r s GLU 15 CO 0.28 0.26 -0.13 0.95 -0.49 0.00 0.00 175.26 176.12 1x5r s THR 16 N -2.17 1.04 -0.06 3.63 -4.23 -1.26 -2.30 115.64 110.29 1x5r s THR 16 Ca 0.38 -0.66 0.03 0.00 -1.18 0.00 0.00 61.69 60.25 1x5r s THR 16 Cb -0.09 -0.89 0.01 0.00 1.34 0.00 0.00 72.50 72.87 1x5r s THR 16 CO 0.33 0.22 -0.14 0.28 -0.54 0.00 0.00 174.62 174.76 1x5r s THR 17 N -0.44 1.27 -0.36 3.99 -1.32 -1.01 -4.95 115.64 112.82 1x5r s THR 17 Ca 0.04 -0.58 -0.15 0.00 -1.21 0.00 0.00 61.69 59.79 1x5r s THR 17 Cb -0.06 -1.13 -0.01 0.00 -1.51 0.00 0.00 72.50 69.80 1x5r s THR 17 CO -0.00 0.38 0.34 -0.70 -2.21 0.00 0.00 174.62 172.43 1x5r s GLU 18 N 0.43 3.44 -0.16 7.08 2.12 -1.25 -1.76 118.70 128.59 1x5r s GLU 18 Ca -0.11 -0.56 -0.07 0.00 0.36 0.00 0.00 54.97 54.59 1x5r s GLU 18 Cb -0.14 -3.84 -0.04 0.00 0.26 0.00 0.00 34.13 30.37 1x5r s GLU 18 CO 0.04 -0.57 0.06 0.08 -0.54 0.00 0.00 175.26 174.33 1x5r s VAL 19 N 1.95 4.81 -0.47 3.70 1.01 0.13 -4.89 120.40 126.64 1x5r s VAL 19 Ca 0.10 -0.03 -0.03 0.00 0.00 0.00 0.00 61.98 62.01 1x5r s VAL 19 Cb -0.17 -3.14 0.12 0.00 0.00 0.00 0.00 36.38 33.19 1x5r s VAL 19 CO 0.12 0.50 0.28 -0.69 0.00 0.00 0.00 175.10 175.30 1x5r s VAL 20 N 0.03 3.47 -0.07 2.92 1.01 -1.26 0.64 120.40 127.14 1x5r s VAL 20 Ca 0.06 -2.27 -0.19 0.00 0.00 0.00 0.00 61.98 59.58 1x5r s VAL 20 Cb -0.12 -3.34 -0.05 0.00 0.00 0.00 0.00 36.38 32.87 1x5r s VAL 20 CO 0.01 -0.75 0.52 -0.76 0.00 0.00 0.00 175.10 174.12 1x5r s LEU 21 N 0.85 4.34 0.16 3.92 1.02 -0.44 -4.89 118.68 123.63 1x5r s LEU 21 Ca 0.10 0.96 0.10 0.00 0.02 0.00 0.00 54.13 55.32 1x5r s LEU 21 Cb -0.22 -2.78 -0.04 0.00 0.02 0.00 0.00 46.19 43.16 1x5r s LEU 21 CO -0.04 0.05 -0.23 0.00 0.02 0.00 0.00 176.35 176.15 1x5r n GLY 23 N 0.58 -1.05 3.81 0.00 0.00 -0.92 -4.63 105.19 102.98 1x5r n GLY 23 Ca -0.15 -0.78 -0.22 0.00 0.00 0.00 0.00 46.02 44.87 1x5r n GLY 23 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1x5r s ASP 24 N -4.00 4.95 0.20 1.61 1.11 -1.05 -4.30 116.67 115.20 1x5r s ASP 24 Ca 0.00 -0.70 0.25 0.00 0.18 0.00 0.00 52.55 52.27 1x5r s ASP 24 Cb 0.00 -0.74 0.90 0.00 1.07 0.00 0.00 42.92 44.15 1x5r s ASP 24 CO 0.00 -0.44 1.74 -0.81 1.18 0.00 0.00 175.17 176.84 1x5r n PRO 25 N -1.34 0.20 -0.13 8.23 -0.04 -1.26 0.80 135.00 141.47 1x5r n PRO 25 Ca -0.01 0.29 -0.26 0.00 -0.04 0.00 0.00 63.50 63.48 1x5r n PRO 25 Cb 0.61 -1.80 -0.09 0.00 -0.04 0.00 0.00 33.50 32.19 1x5r n PRO 25 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1x5r n LEU 26 N -2.16 1.86 0.13 1.53 4.77 -1.26 -4.50 117.00 117.38 1x5r n LEU 26 Ca 0.04 0.32 -0.02 0.00 -0.03 0.00 0.00 56.01 56.32 1x5r n LEU 26 Cb 0.32 -0.77 0.16 0.00 -2.33 0.00 0.00 43.42 40.80 1x5r n LEU 26 CO 0.25 0.45 0.49 0.28 -1.33 0.00 0.00 177.39 177.53 1x5r h SER 27 N -0.95 0.04 0.00 -1.43 0.02 -1.97 -3.49 113.55 105.78 1x5r h SER 27 Ca -0.60 -0.03 0.00 0.00 -0.84 0.00 0.00 61.79 60.33 1x5r h SER 27 Cb 1.51 -0.01 0.00 0.00 0.14 0.00 0.00 62.40 64.04 1x5r h SER 27 CO -0.36 0.65 0.00 0.61 -1.14 0.00 0.00 176.83 176.59 1x5r n GLY 28 N 0.26 0.67 0.00 -3.77 0.00 0.24 -4.82 105.19 97.77 1x5r n GLY 28 Ca -0.01 -0.86 0.00 0.00 0.00 0.00 0.00 46.02 45.14 1x5r n GLY 28 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1x5r n PHE 29 N 10.98 0.00 0.00 1.61 3.72 -1.26 -2.52 117.46 129.99 1x5r n PHE 29 Ca 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.40 1x5r n PHE 29 Cb 0.00 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.54 1x5r n PHE 29 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1x5r n GLY 30 N 4.79 -0.78 3.44 1.37 0.00 -1.26 -4.00 105.19 108.75 1x5r n GLY 30 Ca 0.00 0.12 -0.13 0.00 0.00 0.00 0.00 46.02 46.02 1x5r n GLY 30 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 1x5r s LEU 31 N 0.00 -0.16 -0.14 0.99 0.05 -1.26 -2.69 118.68 115.46 1x5r s LEU 31 Ca 0.00 1.11 0.02 0.00 0.05 0.00 0.00 54.13 55.32 1x5r s LEU 31 Cb 0.00 1.86 0.01 0.00 -2.05 0.00 0.00 46.19 46.01 1x5r s LEU 31 CO 0.00 -0.19 -0.22 -1.10 -0.55 0.00 0.00 176.35 174.29 1x5r s GLN 32 N 0.54 3.00 0.50 1.48 -1.52 0.19 -4.98 119.66 118.88 1x5r s GLN 32 Ca -0.02 -0.85 -0.06 0.00 -1.95 0.00 0.00 55.36 52.49 1x5r s GLN 32 Cb -0.04 -2.43 -0.03 0.00 -0.22 0.00 0.00 33.01 30.29 1x5r s GLN 32 CO -0.03 -0.02 0.81 -0.51 -0.25 0.00 0.00 175.29 175.30 1x5r s LEU 33 N 0.83 3.55 -0.16 2.90 1.43 -1.26 0.19 118.68 126.16 1x5r s LEU 33 Ca -0.07 0.92 -0.04 0.00 -1.03 0.00 0.00 54.13 53.91 1x5r s LEU 33 Cb -0.15 -3.86 0.06 0.00 0.03 0.00 0.00 46.19 42.26 1x5r s LEU 33 CO -0.02 -0.66 0.11 -1.58 0.23 0.00 0.00 176.35 174.43 1x5r s GLN 34 N -4.80 0.06 0.00 1.70 0.74 0.25 -4.24 119.66 113.38 1x5r s GLN 34 Ca 0.49 0.03 0.00 0.00 0.05 0.00 0.00 55.36 55.93 1x5r s GLN 34 Cb -0.10 -1.55 0.00 0.00 1.10 0.00 0.00 33.01 32.46 1x5r s GLN 34 CO 0.45 -0.62 0.00 0.41 -0.55 0.00 0.00 175.29 174.98 1x5r n GLY 35 N 5.29 5.26 3.44 2.59 0.00 -1.26 -0.98 105.19 119.53 1x5r n GLY 35 Ca -0.06 -1.33 -0.45 0.00 0.00 0.00 0.00 46.02 44.18 1x5r n GLY 35 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1x5r n GLY 36 N 0.00 -1.48 0.37 -0.02 0.00 -1.26 -4.81 105.19 97.98 1x5r n GLY 36 Ca 0.00 0.22 0.07 0.00 0.00 0.00 0.00 46.02 46.30 1x5r n GLY 36 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1x5r h ILE 37 N 1.08 0.98 -3.61 -0.61 2.04 -2.00 -3.41 117.51 111.98 1x5r h ILE 37 Ca -0.35 -0.32 -0.50 0.00 1.00 0.00 0.00 64.86 64.69 1x5r h ILE 37 Cb 1.41 -0.02 -0.01 0.00 -0.74 0.00 0.00 36.82 37.46 1x5r h ILE 37 CO 0.55 0.17 0.05 -0.36 0.00 0.00 0.00 178.15 178.56 1x5r s PHE 38 N -5.84 3.44 -0.19 1.37 0.40 -1.26 -5.00 117.98 110.89 1x5r s PHE 38 Ca -0.11 1.01 0.05 0.00 -0.60 0.00 0.00 56.93 57.28 1x5r s PHE 38 Cb 0.21 -2.40 -0.21 0.00 0.51 0.00 0.00 43.02 41.13 1x5r s PHE 38 CO 0.80 0.02 0.06 0.00 0.70 0.00 0.00 175.22 176.80 1x5r n ALA 39 N -0.89 1.33 -2.68 5.36 0.00 -1.26 -4.66 120.51 117.71 1x5r n ALA 39 Ca 0.02 -1.01 -0.43 0.00 0.00 0.00 0.00 53.44 52.02 1x5r n ALA 39 Cb 0.54 -0.32 -0.00 0.00 0.00 0.00 0.00 19.45 19.66 1x5r n ALA 39 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1x5r s THR 40 N -2.53 4.37 0.00 0.00 -4.23 -1.26 -3.58 115.64 108.41 1x5r s THR 40 Ca -0.24 -2.09 0.00 0.00 -1.18 0.00 0.00 61.69 58.18 1x5r s THR 40 Cb 0.08 -5.11 0.00 0.00 1.34 0.00 0.00 72.50 68.80 1x5r s THR 40 CO 0.71 -1.91 0.00 -1.84 -0.54 0.00 0.00 174.62 171.04 1x5r n GLU 41 N 7.64 0.00 -1.04 3.99 0.28 -1.26 -5.08 120.64 125.16 1x5r n GLU 41 Ca 0.45 0.00 -0.36 0.00 -0.16 0.00 0.00 57.16 57.09 1x5r n GLU 41 Cb 0.45 0.00 0.07 0.00 1.43 0.00 0.00 31.44 33.39 1x5r n GLU 41 CO 0.00 0.00 0.00 2.41 -0.16 0.00 0.00 177.13 179.38 1x5r n THR 42 N 0.00 0.41 -3.66 3.84 -1.04 -1.26 -3.61 114.28 108.96 1x5r n THR 42 Ca 0.00 -0.39 -0.38 0.00 -2.04 0.00 0.00 64.05 61.24 1x5r n THR 42 Cb 0.00 -0.34 -0.12 0.00 -1.82 0.00 0.00 70.33 68.05 1x5r n THR 42 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 1x5r s LEU 43 N 3.18 3.83 0.20 -4.42 1.43 0.44 -4.79 118.68 118.55 1x5r s LEU 43 Ca 0.53 -0.18 0.23 0.00 -1.03 0.00 0.00 54.13 53.68 1x5r s LEU 43 Cb -0.27 -2.03 0.11 0.00 0.03 0.00 0.00 46.19 44.04 1x5r s LEU 43 CO 0.71 -0.07 1.16 0.28 0.23 0.00 0.00 176.35 178.65 1x5r h SER 44 N 8.32 0.00 -4.48 2.29 0.02 -1.88 -3.37 113.55 114.46 1x5r h SER 44 Ca -0.36 -0.06 -0.27 0.00 -0.84 0.00 0.00 61.79 60.26 1x5r h SER 44 Cb 1.18 0.00 -0.17 0.00 0.14 0.00 0.00 62.40 63.55 1x5r h SER 44 CO 0.57 0.03 -0.72 -0.94 -1.14 0.00 0.00 176.83 174.64 1x5r s SER 45 N -5.13 1.28 0.21 3.07 1.04 -1.26 -4.98 113.70 107.93 1x5r s SER 45 Ca 0.02 -0.88 -0.30 0.00 0.48 0.00 0.00 55.95 55.27 1x5r s SER 45 Cb 0.10 0.05 -0.08 0.00 0.10 0.00 0.00 66.02 66.19 1x5r s SER 45 CO 0.76 -0.35 1.11 -2.16 0.98 0.00 0.00 173.24 173.58 1x5r s PRO 46 N -3.16 4.60 0.41 4.02 0.04 -1.26 -4.73 135.00 134.92 1x5r s PRO 46 Ca 0.07 1.75 -0.24 0.00 0.04 0.00 0.00 61.00 62.63 1x5r s PRO 46 Cb 0.00 -3.25 -0.09 0.00 0.04 0.00 0.00 34.50 31.20 1x5r s PRO 46 CO -0.02 0.11 1.05 -1.25 0.04 0.00 0.00 177.00 176.93 1x5r s PRO 47 N -0.66 4.11 0.45 0.56 0.04 -1.26 -4.64 135.00 133.60 1x5r s PRO 47 Ca 0.48 1.50 0.03 0.00 0.04 0.00 0.00 61.00 63.05 1x5r s PRO 47 Cb -0.30 -2.49 0.01 0.00 0.04 0.00 0.00 34.50 31.76 1x5r s PRO 47 CO 0.37 -0.19 0.65 -0.51 0.04 0.00 0.00 177.00 177.36 1x5r s LEU 48 N -2.75 3.61 -1.03 -3.56 1.43 -0.15 -0.89 118.68 115.34 1x5r s LEU 48 Ca 0.59 0.02 -0.23 0.00 -1.03 0.00 0.00 54.13 53.48 1x5r s LEU 48 Cb -0.22 -2.93 0.01 0.00 0.03 0.00 0.00 46.19 43.08 1x5r s LEU 48 CO 0.27 -0.78 1.71 -0.69 0.23 0.00 0.00 176.35 177.08 1x5r s VAL 49 N -2.51 3.75 0.11 -1.59 1.01 0.33 0.87 120.40 122.36 1x5r s VAL 49 Ca 0.51 -0.79 -0.28 0.00 0.00 0.00 0.00 61.98 61.42 1x5r s VAL 49 Cb -0.10 -4.67 -0.10 0.00 0.00 0.00 0.00 36.38 31.51 1x5r s VAL 49 CO 0.36 -1.51 1.46 0.00 0.00 0.00 0.00 175.10 175.41 1x5r s PHE 51 N -5.24 0.66 0.02 0.00 2.19 -1.03 -4.80 117.98 109.78 1x5r s PHE 51 Ca -0.12 -0.98 0.01 0.00 0.33 0.00 0.00 56.93 56.17 1x5r s PHE 51 Cb 0.07 -0.18 -0.02 0.00 -1.31 0.00 0.00 43.02 41.58 1x5r s PHE 51 CO 0.52 -0.75 -0.05 0.42 1.83 0.00 0.00 175.22 177.19 1x5r s ILE 52 N -4.05 0.34 0.12 3.12 1.01 -1.26 0.52 121.20 121.01 1x5r s ILE 52 Ca 0.26 -0.71 -0.24 0.00 0.00 0.00 0.00 60.65 59.96 1x5r s ILE 52 Cb 0.04 -0.39 -0.07 0.00 0.01 0.00 0.00 42.46 42.04 1x5r s ILE 52 CO 0.06 -0.25 0.72 -1.61 0.00 0.00 0.00 174.94 173.86 1x5r s GLU 53 N -1.02 4.46 0.11 2.79 2.02 -1.10 -4.97 118.70 121.00 1x5r s GLU 53 Ca -0.07 1.03 -0.30 0.00 0.02 0.00 0.00 54.97 55.64 1x5r s GLU 53 Cb -0.07 -3.27 -0.06 0.00 0.10 0.00 0.00 34.13 30.83 1x5r s GLU 53 CO -0.00 0.56 1.15 -1.25 0.02 0.00 0.00 175.26 175.73 1x5r s PRO 54 N -1.00 4.51 0.00 0.39 0.04 -1.26 -2.42 135.00 135.26 1x5r s PRO 54 Ca 0.34 1.73 0.00 0.00 0.04 0.00 0.00 61.00 63.11 1x5r s PRO 54 Cb -0.22 -3.32 0.00 0.00 0.04 0.00 0.00 34.50 31.00 1x5r s PRO 54 CO 0.24 -0.11 0.00 -3.47 0.04 0.00 0.00 177.00 173.70 1x5r n ASP 55 N 3.23 -2.38 -4.27 6.66 2.03 -1.26 -5.00 116.55 115.55 1x5r n ASP 55 Ca 0.06 0.00 -0.28 0.00 0.52 0.00 0.00 54.79 55.09 1x5r n ASP 55 Cb 0.46 -1.05 0.17 0.00 -0.72 0.00 0.00 41.12 39.98 1x5r n ASP 55 CO 0.00 0.00 0.00 -0.94 -1.92 0.00 0.00 177.20 174.34 1x5r s SER 56 N -2.27 3.42 0.02 1.67 1.04 -1.01 -4.91 113.70 111.66 1x5r s SER 56 Ca 0.00 0.15 -0.19 0.00 0.48 0.00 0.00 55.95 56.39 1x5r s SER 56 Cb 0.00 -0.28 -0.22 0.00 0.10 0.00 0.00 66.02 65.63 1x5r s SER 56 CO 0.00 -2.52 1.15 1.55 0.98 0.00 0.00 173.24 174.40 1x5r h PRO 57 N -1.39 0.47 -0.09 4.02 0.13 -1.82 -1.55 132.00 131.76 1x5r h PRO 57 Ca -0.43 -0.46 0.03 0.00 -0.87 0.00 0.00 66.00 64.27 1x5r h PRO 57 Cb 1.24 0.12 -0.00 0.00 0.13 0.00 0.00 31.00 32.49 1x5r h PRO 57 CO 0.39 1.10 0.14 0.00 -0.23 0.00 0.00 178.00 179.41 1x5r h ALA 58 N 0.38 1.52 0.11 -0.56 0.00 -1.84 -0.86 119.26 118.00 1x5r h ALA 58 Ca -0.06 -0.00 -0.30 0.00 0.00 0.00 0.00 54.91 54.54 1x5r h ALA 58 Cb 1.28 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.07 1x5r h ALA 58 CO 0.12 -0.19 -1.55 1.49 0.00 0.00 0.00 179.25 179.12 1x5r h GLU 59 N 0.00 0.24 0.00 0.00 4.57 -1.73 -3.31 114.58 114.35 1x5r h GLU 59 Ca 0.04 -0.41 0.00 0.00 -1.18 0.00 0.00 59.36 57.81 1x5r h GLU 59 Cb 0.33 0.15 0.00 0.00 -0.16 0.00 0.00 28.75 29.07 1x5r h GLU 59 CO -0.00 1.20 0.22 0.00 -1.18 0.00 0.00 179.01 179.24 1x5r h ARG 60 N -0.25 0.00 0.00 1.92 3.08 -0.12 0.57 114.38 119.58 1x5r h ARG 60 Ca -0.34 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 59.70 1x5r h ARG 60 Cb 1.81 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 31.86 1x5r h ARG 60 CO 0.05 0.00 -0.09 0.00 -1.07 0.00 0.00 179.97 178.87 1x5r n GLY 62 N -0.96 0.72 0.28 0.00 0.00 0.20 -4.09 105.19 101.34 1x5r n GLY 62 Ca -0.02 -0.01 0.12 0.00 0.00 0.00 0.00 46.02 46.10 1x5r n GLY 62 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1x5r h LEU 63 N 0.00 0.00 -9.72 0.99 7.12 -1.87 -3.41 115.31 108.41 1x5r h LEU 63 Ca 0.00 0.00 -0.52 0.00 0.13 0.00 0.00 57.88 57.49 1x5r h LEU 63 Cb 0.00 0.00 0.02 0.00 -0.53 0.00 0.00 40.66 40.15 1x5r h LEU 63 CO 0.00 0.00 0.55 -0.22 -0.13 0.00 0.00 178.44 178.64 1x5r s LEU 64 N -8.36 4.47 -0.14 2.25 2.96 -1.26 -5.01 118.68 113.58 1x5r s LEU 64 Ca -0.05 2.30 -0.30 0.00 -0.22 0.00 0.00 54.13 55.86 1x5r s LEU 64 Cb 0.16 -3.62 0.12 0.00 0.50 0.00 0.00 46.19 43.36 1x5r s LEU 64 CO 0.61 -0.34 0.96 0.00 -1.32 0.00 0.00 176.35 176.26 1x5r s GLN 65 N -0.69 0.65 -0.03 1.98 -2.07 -1.26 -4.88 119.66 113.35 1x5r s GLN 65 Ca 0.51 0.14 -0.39 0.00 -1.82 0.00 0.00 55.36 53.79 1x5r s GLN 65 Cb -0.33 0.30 -0.19 0.00 -1.09 0.00 0.00 33.01 31.70 1x5r s GLN 65 CO 0.40 -0.20 1.25 0.28 -1.32 0.00 0.00 175.29 175.70 1x5r n VAL 66 N 0.72 0.02 0.00 3.63 0.31 -1.26 -0.96 118.33 120.79 1x5r n VAL 66 Ca -0.11 -0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.22 1x5r n VAL 66 Cb 0.58 -0.41 0.00 0.00 -0.91 0.00 0.00 33.84 33.10 1x5r n VAL 66 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1x5r n GLY 67 N 2.25 0.64 3.71 2.92 0.00 -1.12 -4.93 105.19 108.67 1x5r n GLY 67 Ca 0.21 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.81 1x5r n GLY 67 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1x5r s ASP 68 N -1.98 7.09 0.78 1.61 1.11 -0.13 -4.60 116.67 120.54 1x5r s ASP 68 Ca 0.00 1.97 -0.11 0.00 0.18 0.00 0.00 52.55 54.59 1x5r s ASP 68 Cb 0.00 -2.58 0.07 0.00 1.07 0.00 0.00 42.92 41.48 1x5r s ASP 68 CO 0.00 -0.48 1.15 -0.13 1.18 0.00 0.00 175.17 176.89 1x5r s ARG 69 N 1.23 2.13 -0.36 8.23 0.52 -1.26 0.12 118.95 129.56 1x5r s ARG 69 Ca 0.58 0.12 0.01 0.00 -0.52 0.00 0.00 55.73 55.91 1x5r s ARG 69 Cb -0.28 -1.99 0.14 0.00 0.52 0.00 0.00 34.95 33.34 1x5r s ARG 69 CO 0.28 -1.47 0.23 0.08 0.02 0.00 0.00 175.30 174.44 1x5r s VAL 70 N -3.50 0.22 0.06 3.52 1.01 -0.06 -4.14 120.40 117.50 1x5r s VAL 70 Ca 0.61 -1.85 -0.23 0.00 0.00 0.00 0.00 61.98 60.51 1x5r s VAL 70 Cb -0.11 -1.17 -0.11 0.00 0.00 0.00 0.00 36.38 34.99 1x5r s VAL 70 CO 0.49 -1.01 1.35 -0.07 0.00 0.00 0.00 175.10 175.86 1x5r h LEU 71 N 6.85 -0.92 -9.15 3.92 3.38 0.77 -3.37 115.31 116.79 1x5r h LEU 71 Ca 0.08 0.08 -0.47 0.00 0.09 0.00 0.00 57.88 57.66 1x5r h LEU 71 Cb 0.96 0.31 -0.14 0.00 0.09 0.00 0.00 40.66 41.88 1x5r h LEU 71 CO 0.28 -0.41 -0.64 -0.94 0.09 0.00 0.00 178.44 176.83 1x5r s SER 72 N -3.64 2.44 -0.18 -0.43 1.04 -1.23 -0.07 113.70 111.63 1x5r s SER 72 Ca -0.11 -1.29 -0.03 0.00 0.48 0.00 0.00 55.95 55.00 1x5r s SER 72 Cb 0.03 -0.10 0.06 0.00 0.10 0.00 0.00 66.02 66.10 1x5r s SER 72 CO 0.38 -0.50 0.03 -0.63 0.98 0.00 0.00 173.24 173.50 1x5r s ILE 73 N -3.21 0.52 0.00 -1.02 1.01 0.50 -2.48 121.20 116.52 1x5r s ILE 73 Ca 0.33 -0.48 0.00 0.00 0.00 0.00 0.00 60.65 60.50 1x5r s ILE 73 Cb 0.07 -0.98 0.00 0.00 0.01 0.00 0.00 42.46 41.56 1x5r s ILE 73 CO 0.13 -0.14 0.00 -3.20 0.00 0.00 0.00 174.94 171.73 1x5r n ASN 74 N 5.06 -1.17 0.00 3.58 2.85 0.50 -2.07 115.26 124.01 1x5r n ASN 74 Ca -0.09 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.38 1x5r n ASN 74 Cb 0.48 -0.75 0.00 0.00 1.24 0.00 0.00 39.78 40.74 1x5r n ASN 74 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1x5r n GLY 75 N -2.03 0.89 3.57 8.20 0.00 -1.26 -4.84 105.19 109.71 1x5r n GLY 75 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.67 1x5r n GLY 75 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1x5r s ILE 76 N -2.00 4.62 0.17 -0.61 -1.09 -0.88 -5.01 121.20 116.40 1x5r s ILE 76 Ca 0.00 -0.08 -0.31 0.00 -2.23 0.00 0.00 60.65 58.02 1x5r s ILE 76 Cb 0.00 -3.11 -0.10 0.00 -1.58 0.00 0.00 42.46 37.67 1x5r s ILE 76 CO 0.00 0.41 1.55 0.00 -1.23 0.00 0.00 174.94 175.67 1x5r s ALA 77 N 0.84 3.76 -0.54 9.38 0.00 -1.26 0.19 121.76 134.13 1x5r s ALA 77 Ca 0.04 1.36 0.24 0.00 0.00 0.00 0.00 51.96 53.60 1x5r s ALA 77 Cb -0.14 -3.61 0.94 0.00 0.00 0.00 0.00 23.12 20.31 1x5r s ALA 77 CO 0.02 -0.77 1.73 0.25 0.00 0.00 0.00 175.76 176.99 1x5r n THR 78 N 3.82 0.76 0.20 0.00 -2.24 0.90 -2.05 114.28 115.68 1x5r n THR 78 Ca 0.13 0.10 0.12 0.00 -2.27 0.00 0.00 64.05 62.13 1x5r n THR 78 Cb 0.39 -1.02 0.11 0.00 -2.10 0.00 0.00 70.33 67.72 1x5r n THR 78 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 1x5r h GLU 79 N 0.00 0.00 -1.51 -0.78 5.08 -1.72 -3.30 114.58 112.35 1x5r h GLU 79 Ca 0.00 0.00 -0.51 0.00 -1.00 0.00 0.00 59.36 57.85 1x5r h GLU 79 Cb 0.46 0.00 -0.21 0.00 0.50 0.00 0.00 28.75 29.51 1x5r h GLU 79 CO 0.00 0.00 0.62 -0.25 -1.00 0.00 0.00 179.01 178.38 1x5r n ASP 80 N -2.88 6.97 -1.31 1.42 8.00 -0.87 -4.05 116.55 123.83 1x5r n ASP 80 Ca 0.03 -3.40 0.00 0.00 0.71 0.00 0.00 54.79 52.13 1x5r n ASP 80 Cb 0.53 -1.07 0.00 0.00 -0.02 0.00 0.00 41.12 40.56 1x5r n ASP 80 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1x5r n GLY 81 N -0.03 0.57 3.92 0.44 0.00 -1.24 -4.94 105.19 103.91 1x5r n GLY 81 Ca 0.46 -0.85 -0.22 0.00 0.00 0.00 0.00 46.02 45.41 1x5r n GLY 81 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1x5r s THR 82 N -2.13 4.97 0.08 2.61 -4.23 -1.26 0.17 115.64 115.85 1x5r s THR 82 Ca 0.03 -1.12 -0.18 0.00 -1.18 0.00 0.00 61.69 59.24 1x5r s THR 82 Cb -0.00 -3.69 -0.05 0.00 1.34 0.00 0.00 72.50 70.10 1x5r s THR 82 CO -0.00 -0.32 1.30 -0.03 -0.54 0.00 0.00 174.62 175.03 1x5r h MET 83 N 1.34 -0.10 -0.52 3.99 4.05 -1.62 -1.17 114.93 120.89 1x5r h MET 83 Ca -0.51 0.01 0.06 0.00 -0.28 0.00 0.00 59.70 58.99 1x5r h MET 83 Cb 1.23 0.02 -0.09 0.00 -0.80 0.00 0.00 31.60 31.96 1x5r h MET 83 CO 0.61 -0.07 -0.53 1.49 0.23 0.00 0.00 176.91 178.65 1x5r h GLU 84 N -0.10 -0.30 -0.95 0.39 4.81 -1.88 0.25 114.58 116.79 1x5r h GLU 84 Ca 0.07 0.02 0.28 0.00 -0.13 0.00 0.00 59.36 59.60 1x5r h GLU 84 Cb 0.28 0.07 -0.18 0.00 0.63 0.00 0.00 28.75 29.55 1x5r h GLU 84 CO -0.43 -0.20 0.10 0.39 -0.73 0.00 0.00 179.01 178.14 1x5r n GLU 85 N -5.37 -0.07 -0.03 1.92 1.02 -0.54 0.19 120.64 117.75 1x5r n GLU 85 Ca -0.01 1.40 -0.09 0.00 -0.02 0.00 0.00 57.16 58.44 1x5r n GLU 85 Cb 0.34 -2.28 -0.03 0.00 -0.02 0.00 0.00 31.44 29.45 1x5r n GLU 85 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1x5r h ALA 86 N 1.90 0.18 -0.36 0.62 0.00 0.50 0.66 119.26 122.76 1x5r h ALA 86 Ca 0.61 0.03 -0.02 0.00 0.00 0.00 0.00 54.91 55.53 1x5r h ALA 86 Cb 1.34 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 19.15 1x5r h ALA 86 CO -0.87 -0.40 0.13 -0.91 0.00 0.00 0.00 179.25 177.21 1x5r h ASN 87 N 0.11 0.50 -0.37 0.00 2.35 0.27 -2.81 115.58 115.63 1x5r h ASN 87 Ca 0.08 -0.18 0.03 0.00 -0.55 0.00 0.00 56.30 55.68 1x5r h ASN 87 Cb 0.07 -0.13 -0.03 0.00 0.05 0.00 0.00 38.32 38.27 1x5r h ASN 87 CO -0.10 0.54 0.17 -0.61 -1.65 0.00 0.00 177.43 175.78 1x5r h GLN 88 N 0.43 0.34 -1.07 0.81 5.75 0.12 -0.13 115.11 121.36 1x5r h GLN 88 Ca 0.12 -0.02 0.30 0.00 -0.15 0.00 0.00 58.65 58.90 1x5r h GLN 88 Cb 0.21 -0.08 -0.06 0.00 1.07 0.00 0.00 27.48 28.62 1x5r h GLN 88 CO -0.01 0.23 0.75 -0.07 -2.65 0.00 0.00 178.83 177.07 1x5r h LEU 89 N 0.35 0.16 -0.23 -2.39 3.38 0.56 1.18 115.31 118.32 1x5r h LEU 89 Ca 0.16 0.03 -0.21 0.00 0.09 0.00 0.00 57.88 57.95 1x5r h LEU 89 Cb 0.09 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.85 1x5r h LEU 89 CO -0.13 0.03 -0.82 -0.07 0.09 0.00 0.00 178.44 177.54 1x5r h LEU 90 N 0.14 0.69 0.59 1.67 3.38 -0.86 -2.06 115.31 118.86 1x5r h LEU 90 Ca 0.55 -0.48 -0.02 0.00 0.09 0.00 0.00 57.88 58.01 1x5r h LEU 90 Cb 1.88 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 42.41 1x5r h LEU 90 CO -0.11 1.26 -0.46 -0.09 0.09 0.00 0.00 178.44 179.13 1x5r h ARG 91 N 0.37 -0.99 -0.89 1.13 2.43 0.20 0.56 114.38 117.20 1x5r h ARG 91 Ca -0.06 0.07 0.05 0.00 -0.81 0.00 0.00 59.98 59.22 1x5r h ARG 91 Cb 1.44 0.22 -0.06 0.00 -0.42 0.00 0.00 29.97 31.16 1x5r h ARG 91 CO 0.15 -0.66 0.57 0.22 -1.51 0.00 0.00 179.97 178.74 1x5r h ASP 92 N -1.03 0.92 -0.14 -3.80 3.58 -1.40 -1.73 116.42 112.82 1x5r h ASP 92 Ca -0.07 0.00 0.03 0.00 0.42 0.00 0.00 57.03 57.41 1x5r h ASP 92 Cb 0.86 -0.20 -0.03 0.00 1.72 0.00 0.00 39.33 41.69 1x5r h ASP 92 CO 0.01 0.62 -0.04 0.00 -2.88 0.00 0.00 179.24 176.95 1x5r h ALA 93 N 1.39 0.09 -0.97 -0.78 0.00 -0.87 -0.95 119.26 117.16 1x5r h ALA 93 Ca 0.37 0.06 0.18 0.00 0.00 0.00 0.00 54.91 55.51 1x5r h ALA 93 Cb 0.07 0.11 -0.10 0.00 0.00 0.00 0.00 17.79 17.87 1x5r h ALA 93 CO -0.14 -0.48 0.58 0.00 0.00 0.00 0.00 179.25 179.20 1x5r h ALA 94 N 1.14 1.58 0.00 0.00 0.00 0.97 1.44 119.26 124.40 1x5r h ALA 94 Ca 0.07 0.08 -0.00 0.00 0.00 0.00 0.00 54.91 55.05 1x5r h ALA 94 Cb 0.11 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 17.82 1x5r h ALA 94 CO -0.15 -0.04 -0.01 -0.07 0.00 0.00 0.00 179.25 178.98 1x5r h LEU 95 N 0.75 0.00 0.00 0.00 3.38 -0.49 0.28 115.31 119.23 1x5r h LEU 95 Ca 0.55 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.50 1x5r h LEU 95 Cb 0.82 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.57 1x5r h LEU 95 CO -0.37 0.01 -0.19 0.00 0.09 0.00 0.00 178.44 177.98 1x5r h ALA 96 N 1.99 0.90 0.00 1.53 0.00 0.25 -3.46 119.26 120.46 1x5r h ALA 96 Ca -0.00 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1x5r h ALA 96 Cb 0.12 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.90 1x5r h ALA 96 CO 0.00 0.11 0.00 0.72 0.00 0.00 0.00 179.25 180.08 1x5r n HIS 97 N -3.08 0.00 -3.68 0.00 8.25 0.98 -4.97 115.22 112.73 1x5r n HIS 97 Ca 0.03 0.00 -0.14 0.00 -0.26 0.00 0.00 57.72 57.35 1x5r n HIS 97 Cb 0.57 0.00 -0.07 0.00 1.12 0.00 0.00 29.99 31.61 1x5r n HIS 97 CO 0.00 0.00 0.00 0.21 0.64 0.00 0.00 176.34 177.19 1x5r s LYS 98 N -0.26 0.85 -0.01 -0.41 2.36 -1.24 -2.17 119.74 118.86 1x5r s LYS 98 Ca 0.00 -0.19 -0.24 0.00 -2.55 0.00 0.00 55.97 52.99 1x5r s LYS 98 Cb 0.00 0.38 0.05 0.00 -1.05 0.00 0.00 37.83 37.22 1x5r s LYS 98 CO 0.00 -0.27 0.54 0.54 1.55 0.00 0.00 175.35 177.72 1x5r s VAL 99 N -1.81 0.02 -0.13 4.02 0.11 -0.24 -4.57 120.40 117.80 1x5r s VAL 99 Ca -0.09 -0.19 -0.00 0.00 -2.93 0.00 0.00 61.98 58.76 1x5r s VAL 99 Cb -0.02 -0.90 -0.02 0.00 -1.53 0.00 0.00 36.38 33.91 1x5r s VAL 99 CO 0.02 -0.10 -0.12 -0.69 -3.33 0.00 0.00 175.10 170.88 1x5r s VAL 100 N -1.65 3.11 0.03 2.04 1.01 -1.25 -1.33 120.40 122.36 1x5r s VAL 100 Ca -0.10 -0.64 0.08 0.00 0.00 0.00 0.00 61.98 61.32 1x5r s VAL 100 Cb -0.01 -2.31 -0.03 0.00 0.00 0.00 0.00 36.38 34.02 1x5r s VAL 100 CO 0.05 0.52 -0.21 -0.76 0.00 0.00 0.00 175.10 174.69 1x5r s LEU 101 N 0.36 2.41 -0.22 3.92 1.43 0.21 0.19 118.68 126.99 1x5r s LEU 101 Ca -0.10 -0.47 0.01 0.00 -1.03 0.00 0.00 54.13 52.54 1x5r s LEU 101 Cb -0.16 -1.42 0.05 0.00 0.03 0.00 0.00 46.19 44.69 1x5r s LEU 101 CO 0.05 0.27 -0.11 -0.70 0.23 0.00 0.00 176.35 176.09 1x5r s GLU 102 N -1.23 2.19 0.27 1.70 2.12 -1.03 0.21 118.70 122.92 1x5r s GLU 102 Ca 0.13 -0.99 0.06 0.00 0.36 0.00 0.00 54.97 54.53 1x5r s GLU 102 Cb -0.10 -2.58 -0.03 0.00 0.26 0.00 0.00 34.13 31.68 1x5r s GLU 102 CO 0.03 -0.45 0.34 0.08 -0.54 0.00 0.00 175.26 174.72 1x5r s VAL 103 N 1.30 4.75 -0.17 3.70 1.01 -0.73 0.13 120.40 130.40 1x5r s VAL 103 Ca -0.03 -1.11 -0.02 0.00 0.00 0.00 0.00 61.98 60.83 1x5r s VAL 103 Cb -0.17 -3.63 0.05 0.00 0.00 0.00 0.00 36.38 32.63 1x5r s VAL 103 CO -0.08 -0.29 -0.00 -0.70 0.00 0.00 0.00 175.10 174.03 1x5r s GLU 104 N -3.99 0.94 0.19 2.72 2.12 -1.26 -2.41 118.70 117.01 1x5r s GLU 104 Ca 0.36 -0.42 -0.07 0.00 0.36 0.00 0.00 54.97 55.20 1x5r s GLU 104 Cb -0.09 -1.96 -0.02 0.00 0.26 0.00 0.00 34.13 32.32 1x5r s GLU 104 CO 0.28 -0.53 0.27 -0.59 -0.54 0.00 0.00 175.26 174.15 1x5r s PHE 105 N 1.77 0.61 -1.89 5.30 -0.12 -0.97 -4.65 117.98 118.04 1x5r s PHE 105 Ca -0.00 -0.94 0.21 0.00 -0.05 0.00 0.00 56.93 56.15 1x5r s PHE 105 Cb -0.16 -0.15 0.58 0.00 -0.63 0.00 0.00 43.02 42.65 1x5r s PHE 105 CO -0.07 -0.75 1.48 -3.47 -0.05 0.00 0.00 175.22 172.36 1x5r n ASP 106 N -0.26 3.77 -2.79 1.98 2.03 -1.26 -0.81 116.55 119.20 1x5r n ASP 106 Ca -0.04 -1.99 -0.04 0.00 0.52 0.00 0.00 54.79 53.24 1x5r n ASP 106 Cb 0.63 -0.43 -0.03 0.00 -0.72 0.00 0.00 41.12 40.58 1x5r n ASP 106 CO 0.00 0.00 0.00 -0.24 -1.92 0.00 0.00 177.20 175.04 1x5r n SER 107 N 1.49 -3.26 -0.01 1.67 2.88 -1.26 -4.96 113.62 110.18 1x5r n SER 107 Ca 0.22 1.20 0.00 0.00 -1.33 0.00 0.00 58.87 58.96 1x5r n SER 107 Cb 0.59 -3.81 0.00 0.00 -0.75 0.00 0.00 64.21 60.24 1x5r n SER 107 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1x5r n GLY 108 N 2.03 7.53 2.45 0.46 0.00 -1.26 -5.00 105.19 111.41 1x5r n GLY 108 Ca -0.26 -1.96 -0.28 0.00 0.00 0.00 0.00 46.02 43.53 1x5r n GLY 108 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1x5r n PRO 109 N 0.00 2.68 -2.42 1.61 -0.04 -1.26 -4.91 135.00 130.67 1x5r n PRO 109 Ca 0.00 -1.69 -0.41 0.00 -0.04 0.00 0.00 63.50 61.35 1x5r n PRO 109 Cb 0.00 -2.54 -0.03 0.00 -0.04 0.00 0.00 33.50 30.88 1x5r n PRO 109 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 1x5r s SER 110 N 2.82 7.12 0.00 3.54 0.01 -1.26 -4.99 113.70 120.95 1x5r s SER 110 Ca 0.52 2.14 0.00 0.00 1.31 0.00 0.00 55.95 59.92 1x5r s SER 110 Cb 0.14 -2.60 0.00 0.00 0.21 0.00 0.00 66.02 63.78 1x5r s SER 110 CO -0.04 -0.37 0.00 -0.24 0.41 0.00 0.00 173.24 173.00 1x5r n SER 111 N 2.88 0.00 0.00 2.44 2.88 -1.26 -5.21 113.62 115.34 1x5r n SER 111 Ca 0.05 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.59 1x5r n SER 111 Cb 0.45 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.91 1x5r n SER 111 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42