#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x5f s SER 2 N 0.00 5.97 -0.03 1.61 0.15 -1.26 -5.11 113.70 115.03 1x5f s SER 2 Ca 0.00 0.16 -0.29 0.00 0.70 0.00 0.00 55.95 56.53 1x5f s SER 2 Cb 0.00 -1.75 0.10 0.00 -1.71 0.00 0.00 66.02 62.66 1x5f s SER 2 CO 0.00 0.20 0.85 -0.55 1.20 0.00 0.00 173.24 174.94 1x5f s SER 3 N -2.27 -0.43 0.00 5.45 0.15 -1.26 -5.15 113.70 110.18 1x5f s SER 3 Ca 0.30 0.20 0.00 0.00 0.70 0.00 0.00 55.95 57.15 1x5f s SER 3 Cb -0.13 0.41 0.00 0.00 -1.71 0.00 0.00 66.02 64.60 1x5f s SER 3 CO 0.22 -0.60 0.00 0.61 1.20 0.00 0.00 173.24 174.68 1x5f n GLY 4 N 0.14 0.97 2.09 9.45 0.00 -1.26 -4.99 105.19 111.59 1x5f n GLY 4 Ca -0.12 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.66 1x5f n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1x5f n SER 5 N 0.00 4.95 -4.25 1.61 7.64 -1.26 -5.03 113.62 117.27 1x5f n SER 5 Ca 0.00 -3.75 -0.14 0.00 1.01 0.00 0.00 58.87 55.99 1x5f n SER 5 Cb 0.00 -0.37 -0.10 0.00 -1.01 0.00 0.00 64.21 62.73 1x5f n SER 5 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 1x5f s SER 6 N -3.56 1.81 -0.39 6.43 1.04 -1.26 -5.13 113.70 112.65 1x5f s SER 6 Ca 0.51 -1.02 0.01 0.00 0.48 0.00 0.00 55.95 55.94 1x5f s SER 6 Cb 0.41 -0.01 0.12 0.00 0.10 0.00 0.00 66.02 66.64 1x5f s SER 6 CO 0.01 -0.33 0.17 -0.83 0.98 0.00 0.00 173.24 173.24 1x5f s GLY 7 N -3.17 1.53 -0.75 7.32 0.00 -1.26 -5.03 107.32 105.95 1x5f s GLY 7 Ca 0.17 -2.30 0.03 0.00 0.00 0.00 0.00 44.72 42.62 1x5f s GLY 7 CO 0.01 1.48 0.67 -1.84 0.00 0.00 0.00 173.10 173.41 1x5f n GLU 8 N 4.05 2.31 -0.09 2.90 0.28 -1.26 -4.86 120.64 123.98 1x5f n GLU 8 Ca 0.04 -4.54 -0.09 0.00 -0.16 0.00 0.00 57.16 52.41 1x5f n GLU 8 Cb 0.38 -2.32 -0.03 0.00 1.43 0.00 0.00 31.44 30.90 1x5f n GLU 8 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 177.13 177.69 1x5f n HIS 9 N 1.73 0.04 -1.29 -1.84 8.25 -1.26 -5.00 115.22 115.84 1x5f n HIS 9 Ca 0.23 0.02 -0.39 0.00 -0.26 0.00 0.00 57.72 57.31 1x5f n HIS 9 Cb 0.37 -0.52 0.01 0.00 1.12 0.00 0.00 29.99 30.97 1x5f n HIS 9 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1x5f n ALA 10 N -4.42 -2.77 -2.08 -1.41 0.00 -1.26 -4.77 120.51 103.80 1x5f n ALA 10 Ca -0.14 -0.01 -0.42 0.00 0.00 0.00 0.00 53.44 52.87 1x5f n ALA 10 Cb 0.52 -1.48 -0.03 0.00 0.00 0.00 0.00 19.45 18.46 1x5f n ALA 10 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1x5f s PRO 11 N -1.15 3.20 0.46 0.00 0.04 -1.26 -4.95 135.00 131.34 1x5f s PRO 11 Ca 0.59 1.12 -0.21 0.00 0.04 0.00 0.00 61.00 62.54 1x5f s PRO 11 Cb -0.52 -4.21 -0.12 0.00 0.04 0.00 0.00 34.50 29.69 1x5f s PRO 11 CO 0.64 -2.02 0.46 0.00 0.04 0.00 0.00 177.00 176.12 1x5f n ALA 12 N 10.63 -1.62 -1.76 8.56 0.00 -1.26 -4.90 120.51 130.15 1x5f n ALA 12 Ca 0.21 0.10 -0.35 0.00 0.00 0.00 0.00 53.44 53.41 1x5f n ALA 12 Cb 0.48 -1.74 0.00 0.00 0.00 0.00 0.00 19.45 18.19 1x5f n ALA 12 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1x5f s THR 13 N -1.58 3.22 0.08 0.00 -4.23 -1.26 -5.06 115.64 106.82 1x5f s THR 13 Ca 0.64 0.75 0.02 0.00 -1.18 0.00 0.00 61.69 61.91 1x5f s THR 13 Cb -0.56 -3.29 -0.04 0.00 1.34 0.00 0.00 72.50 69.94 1x5f s THR 13 CO 0.58 -0.18 -0.07 0.42 -0.54 0.00 0.00 174.62 174.84 1x5f s THR 14 N -1.82 0.63 0.00 3.99 -4.23 -1.26 -4.98 115.64 107.96 1x5f s THR 14 Ca 0.72 -1.72 0.00 0.00 -1.18 0.00 0.00 61.69 59.51 1x5f s THR 14 Cb -0.23 -1.42 0.00 0.00 1.34 0.00 0.00 72.50 72.19 1x5f s THR 14 CO 0.27 -0.77 0.00 0.61 -0.54 0.00 0.00 174.62 174.20 1x5f n GLY 15 N 0.32 1.29 3.76 3.99 0.00 -1.26 -5.17 105.19 108.12 1x5f n GLY 15 Ca -0.15 -0.57 -0.31 0.00 0.00 0.00 0.00 46.02 44.99 1x5f n GLY 15 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1x5f s PRO 16 N 1.18 2.02 0.14 1.61 0.04 -1.26 -5.06 135.00 133.67 1x5f s PRO 16 Ca 0.00 1.09 0.05 0.00 0.04 0.00 0.00 61.00 62.18 1x5f s PRO 16 Cb 0.00 -1.88 -0.04 0.00 0.04 0.00 0.00 34.50 32.62 1x5f s PRO 16 CO 0.00 -1.78 0.08 -0.51 0.04 0.00 0.00 177.00 174.83 1x5f s LEU 17 N -5.99 3.67 0.00 -3.56 1.43 -1.26 -4.99 118.68 107.97 1x5f s LEU 17 Ca 0.62 -0.16 0.00 0.00 -1.03 0.00 0.00 54.13 53.56 1x5f s LEU 17 Cb -0.17 -2.32 0.00 0.00 0.03 0.00 0.00 46.19 43.73 1x5f s LEU 17 CO 0.56 0.11 0.00 -0.81 0.23 0.00 0.00 176.35 176.44 1x5f n PRO 18 N -0.02 -1.00 -4.97 1.29 -0.04 -1.26 -4.95 135.00 124.05 1x5f n PRO 18 Ca -0.09 0.00 -0.27 0.00 -0.04 0.00 0.00 63.50 63.10 1x5f n PRO 18 Cb 0.54 0.00 -0.16 0.00 -0.04 0.00 0.00 33.50 33.84 1x5f n PRO 18 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 1x5f s SER 19 N -1.51 2.36 0.68 3.54 0.01 -1.26 -3.83 113.70 113.70 1x5f s SER 19 Ca 0.00 -0.37 -0.17 0.00 1.31 0.00 0.00 55.95 56.72 1x5f s SER 19 Cb 0.00 -0.38 -0.07 0.00 0.21 0.00 0.00 66.02 65.78 1x5f s SER 19 CO 0.00 0.23 0.37 0.00 0.41 0.00 0.00 173.24 174.24 1x5f n ALA 20 N 2.74 -1.88 -1.17 1.44 0.00 -0.75 -4.62 120.51 116.27 1x5f n ALA 20 Ca -0.16 -0.20 -0.29 0.00 0.00 0.00 0.00 53.44 52.79 1x5f n ALA 20 Cb 0.53 -1.75 0.17 0.00 0.00 0.00 0.00 19.45 18.40 1x5f n ALA 20 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1x5f s PRO 21 N -2.37 0.46 0.48 0.00 0.04 -1.26 -4.57 135.00 127.78 1x5f s PRO 21 Ca 0.63 0.53 0.00 0.00 0.04 0.00 0.00 61.00 62.21 1x5f s PRO 21 Cb -0.37 -1.74 0.00 0.00 0.04 0.00 0.00 34.50 32.43 1x5f s PRO 21 CO 0.60 -2.71 0.01 0.54 0.04 0.00 0.00 177.00 175.47 1x5f n ARG 22 N -4.17 0.85 -3.91 4.56 1.74 -1.24 -4.73 116.66 109.76 1x5f n ARG 22 Ca 0.05 -3.47 -0.31 0.00 -0.77 0.00 0.00 57.85 53.36 1x5f n ARG 22 Cb 0.57 0.92 0.02 0.00 -1.02 0.00 0.00 32.46 32.95 1x5f n ARG 22 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 1x5f n ASP 23 N -1.30 -4.66 -4.57 0.55 -0.08 -1.26 -0.83 116.55 104.41 1x5f n ASP 23 Ca -0.20 -0.78 -0.40 0.00 -1.51 0.00 0.00 54.79 51.90 1x5f n ASP 23 Cb 0.60 -3.73 -0.03 0.00 2.34 0.00 0.00 41.12 40.31 1x5f n ASP 23 CO 0.00 0.00 0.00 -0.69 0.12 0.00 0.00 177.20 176.63 1x5f s VAL 24 N -3.27 3.54 0.09 5.18 1.01 -1.26 -4.08 120.40 121.60 1x5f s VAL 24 Ca 0.66 0.42 0.00 0.00 0.00 0.00 0.00 61.98 63.07 1x5f s VAL 24 Cb -0.34 -4.11 -0.04 0.00 0.00 0.00 0.00 36.38 31.89 1x5f s VAL 24 CO 0.82 -0.96 -0.04 0.68 0.00 0.00 0.00 175.10 175.60 1x5f s VAL 25 N 7.48 0.46 -0.53 2.92 -7.23 0.05 -5.00 120.40 118.55 1x5f s VAL 25 Ca 0.63 -1.89 -0.18 0.00 -1.81 0.00 0.00 61.98 58.73 1x5f s VAL 25 Cb -0.13 -1.67 0.09 0.00 0.56 0.00 0.00 36.38 35.22 1x5f s VAL 25 CO 0.24 -0.87 0.58 0.00 -0.31 0.00 0.00 175.10 174.74 1x5f s ALA 26 N -3.77 3.48 0.61 1.32 0.00 -1.26 0.79 121.76 122.92 1x5f s ALA 26 Ca 0.12 -2.14 0.29 0.00 0.00 0.00 0.00 51.96 50.22 1x5f s ALA 26 Cb 0.07 -3.34 1.55 0.00 0.00 0.00 0.00 23.12 21.40 1x5f s ALA 26 CO -0.06 -2.07 1.94 1.03 0.00 0.00 0.00 175.76 176.61 1x5f h SER 27 N 8.99 0.00 -4.54 0.00 0.87 -1.22 -3.43 113.55 114.22 1x5f h SER 27 Ca -0.29 0.00 0.04 0.00 -1.23 0.00 0.00 61.79 60.31 1x5f h SER 27 Cb 1.10 0.00 -0.20 0.00 -0.44 0.00 0.00 62.40 62.86 1x5f h SER 27 CO 1.01 0.00 0.41 -0.22 -0.53 0.00 0.00 176.83 177.49 1x5f s LEU 28 N -7.09 -0.47 -0.29 2.23 0.20 -1.08 -4.98 118.68 107.21 1x5f s LEU 28 Ca -0.04 0.41 0.01 0.00 0.69 0.00 0.00 54.13 55.20 1x5f s LEU 28 Cb 0.14 2.14 0.09 0.00 -0.43 0.00 0.00 46.19 48.13 1x5f s LEU 28 CO 0.49 -0.51 0.03 -0.69 -0.29 0.00 0.00 176.35 175.38 1x5f s VAL 29 N -1.65 1.52 0.52 1.68 1.01 -1.26 0.11 120.40 122.34 1x5f s VAL 29 Ca -0.03 -1.62 -0.03 0.00 0.00 0.00 0.00 61.98 60.30 1x5f s VAL 29 Cb -0.00 -2.01 -0.00 0.00 0.00 0.00 0.00 36.38 34.36 1x5f s VAL 29 CO 0.01 -0.45 0.80 -0.55 0.00 0.00 0.00 175.10 174.91 1x5f s SER 30 N 1.33 5.75 0.41 3.32 0.15 0.23 -4.61 113.70 120.27 1x5f s SER 30 Ca 0.05 0.56 0.22 0.00 0.70 0.00 0.00 55.95 57.48 1x5f s SER 30 Cb -0.18 -1.69 0.59 0.00 -1.71 0.00 0.00 66.02 63.03 1x5f s SER 30 CO -0.13 -0.87 1.68 0.71 1.20 0.00 0.00 173.24 175.83 1x5f h THR 31 N 0.09 0.44 -0.00 6.45 1.35 -1.96 -3.22 112.91 116.06 1x5f h THR 31 Ca -0.46 -1.33 0.00 0.00 -0.55 0.00 0.00 66.41 64.07 1x5f h THR 31 Cb 1.25 1.98 0.00 0.00 -1.73 0.00 0.00 68.15 69.65 1x5f h THR 31 CO 0.59 0.22 -0.10 0.54 -0.25 0.00 0.00 175.52 176.52 1x5f n ARG 32 N -3.24 2.12 -3.71 4.72 1.74 -1.26 -2.10 116.66 114.93 1x5f n ARG 32 Ca 0.02 -0.49 -0.08 0.00 -0.77 0.00 0.00 57.85 56.54 1x5f n ARG 32 Cb 0.53 -0.95 0.03 0.00 -1.02 0.00 0.00 32.46 31.04 1x5f n ARG 32 CO 0.00 0.00 0.00 1.97 -1.52 0.00 0.00 177.63 178.08 1x5f n PHE 33 N -0.28 -2.14 -3.70 -1.55 1.16 -1.22 -0.91 117.46 108.82 1x5f n PHE 33 Ca 0.02 -1.69 -0.12 0.00 -1.87 0.00 0.00 57.45 53.79 1x5f n PHE 33 Cb 0.11 0.84 -0.12 0.00 -1.61 0.00 0.00 39.48 38.71 1x5f n PHE 33 CO 0.00 0.00 0.00 0.42 -1.87 0.00 0.00 176.76 175.31 1x5f s ILE 34 N -2.12 -0.19 -0.13 1.97 1.01 -1.04 0.74 121.20 121.44 1x5f s ILE 34 Ca 0.17 0.17 -0.26 0.00 0.00 0.00 0.00 60.65 60.72 1x5f s ILE 34 Cb -0.04 -0.49 -0.02 0.00 0.01 0.00 0.00 42.46 41.92 1x5f s ILE 34 CO 0.10 0.07 0.85 -0.75 0.00 0.00 0.00 174.94 175.22 1x5f s LYS 35 N 1.71 4.36 0.16 2.79 2.47 0.30 -2.38 119.74 129.16 1x5f s LYS 35 Ca -0.06 1.09 0.06 0.00 -1.56 0.00 0.00 55.97 55.50 1x5f s LYS 35 Cb -0.10 -3.54 -0.04 0.00 -1.46 0.00 0.00 37.83 32.69 1x5f s LYS 35 CO -0.10 -0.24 0.05 -0.51 0.16 0.00 0.00 175.35 174.71 1x5f s LEU 36 N 1.81 3.51 -0.25 5.43 2.01 -0.17 -0.81 118.68 130.21 1x5f s LEU 36 Ca 0.41 -0.27 -0.12 0.00 0.01 0.00 0.00 54.13 54.16 1x5f s LEU 36 Cb -0.17 -2.16 0.09 0.00 0.01 0.00 0.00 46.19 43.96 1x5f s LEU 36 CO 0.16 0.09 0.58 0.42 1.01 0.00 0.00 176.35 178.60 1x5f s THR 37 N -1.69 -0.32 0.18 5.49 -4.23 0.24 -2.25 115.64 113.05 1x5f s THR 37 Ca 0.29 0.05 -0.02 0.00 -1.18 0.00 0.00 61.69 60.82 1x5f s THR 37 Cb -0.10 -0.86 -0.04 0.00 1.34 0.00 0.00 72.50 72.84 1x5f s THR 37 CO 0.20 0.02 0.14 -1.66 -0.54 0.00 0.00 174.62 172.78 1x5f s TRP 38 N 2.01 0.99 0.59 3.99 -2.14 -1.01 -0.77 118.94 122.59 1x5f s TRP 38 Ca -0.08 -1.27 0.10 0.00 2.66 0.00 0.00 56.10 57.51 1x5f s TRP 38 Cb -0.08 -0.47 0.09 0.00 -3.10 0.00 0.00 33.47 29.91 1x5f s TRP 38 CO -0.17 -0.63 0.80 1.03 -2.66 0.00 0.00 176.95 175.32 1x5f s ARG 39 N -4.11 2.25 0.37 3.25 0.52 -0.01 -4.64 118.95 116.59 1x5f s ARG 39 Ca 0.33 -1.70 -0.26 0.00 -0.52 0.00 0.00 55.73 53.58 1x5f s ARG 39 Cb 0.06 -2.61 -0.09 0.00 0.52 0.00 0.00 34.95 32.83 1x5f s ARG 39 CO 0.08 -0.91 1.10 0.95 0.02 0.00 0.00 175.30 176.54 1x5f s THR 40 N -2.70 3.48 0.66 0.02 -4.23 -1.26 -3.61 115.64 107.99 1x5f s THR 40 Ca 0.61 1.24 -0.15 0.00 -1.18 0.00 0.00 61.69 62.22 1x5f s THR 40 Cb -0.05 -3.70 -0.00 0.00 1.34 0.00 0.00 72.50 70.09 1x5f s THR 40 CO 0.39 0.11 1.11 -2.16 -0.54 0.00 0.00 174.62 173.53 1x5f s PRO 41 N -2.21 2.81 0.28 3.99 0.04 -1.05 -4.38 135.00 134.48 1x5f s PRO 41 Ca 0.55 1.39 0.00 0.00 0.04 0.00 0.00 61.00 62.98 1x5f s PRO 41 Cb -0.27 -1.95 0.51 0.00 0.04 0.00 0.00 34.50 32.83 1x5f s PRO 41 CO 0.34 -1.24 1.85 0.00 0.04 0.00 0.00 177.00 177.99 1x5f h ALA 42 N 0.04 1.48 -0.58 8.56 0.00 -1.82 -1.49 119.26 125.45 1x5f h ALA 42 Ca -0.47 0.01 -0.10 0.00 0.00 0.00 0.00 54.91 54.34 1x5f h ALA 42 Cb 1.25 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.77 1x5f h ALA 42 CO 0.54 0.30 -0.04 0.66 0.00 0.00 0.00 179.25 180.71 1x5f h SER 43 N 1.06 1.05 -3.58 0.00 4.64 -1.92 -3.38 113.55 111.41 1x5f h SER 43 Ca 0.48 -0.32 -0.62 0.00 -0.47 0.00 0.00 61.79 60.85 1x5f h SER 43 Cb 0.38 -0.28 -0.40 0.00 -0.31 0.00 0.00 62.40 61.79 1x5f h SER 43 CO -0.23 1.12 -0.72 -1.81 -0.87 0.00 0.00 176.83 174.31 1x5f s ASP 44 N -6.59 4.17 0.00 4.97 1.01 -0.58 -4.96 116.67 114.69 1x5f s ASP 44 Ca -0.12 -2.25 0.15 0.00 0.71 0.00 0.00 52.55 51.04 1x5f s ASP 44 Cb 0.13 -1.23 0.75 0.00 1.01 0.00 0.00 42.92 43.57 1x5f s ASP 44 CO 0.86 -0.34 1.41 -0.81 0.21 0.00 0.00 175.17 176.50 1x5f n PRO 45 N 4.07 0.21 0.00 8.23 -0.04 -1.10 -2.53 135.00 143.84 1x5f n PRO 45 Ca 0.04 0.15 0.00 0.00 -0.04 0.00 0.00 63.50 63.64 1x5f n PRO 45 Cb 0.38 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.34 1x5f n PRO 45 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 1x5f n HIS 46 N -1.29 0.00 -2.83 0.54 8.25 -1.26 -4.77 115.22 113.86 1x5f n HIS 46 Ca 0.07 0.00 -0.17 0.00 -0.26 0.00 0.00 57.72 57.36 1x5f n HIS 46 Cb 0.12 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.20 1x5f n HIS 46 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1x5f n GLY 47 N 2.74 -0.29 0.09 -1.41 0.00 -1.13 -4.68 105.19 100.51 1x5f n GLY 47 Ca 0.00 0.03 0.12 0.00 0.00 0.00 0.00 46.02 46.17 1x5f n GLY 47 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 1x5f h ASP 48 N -0.34 0.00 -0.34 1.61 1.82 -1.88 -3.29 116.42 113.99 1x5f h ASP 48 Ca -0.24 -0.12 -0.04 0.00 -0.39 0.00 0.00 57.03 56.24 1x5f h ASP 48 Cb 0.81 0.00 -0.02 0.00 0.68 0.00 0.00 39.33 40.80 1x5f h ASP 48 CO 0.35 0.06 0.02 -0.46 -1.61 0.00 0.00 179.24 177.60 1x5f n ASN 49 N -2.38 4.00 -3.76 2.28 2.04 -1.26 -4.58 115.26 111.61 1x5f n ASN 49 Ca 0.02 -3.11 -0.12 0.00 -0.44 0.00 0.00 54.58 50.92 1x5f n ASN 49 Cb 0.48 -0.59 -0.12 0.00 -2.53 0.00 0.00 39.78 37.03 1x5f n ASN 49 CO 0.00 0.00 0.00 -1.48 -0.44 0.00 0.00 177.26 175.34 1x5f s LEU 50 N -2.89 0.72 0.47 -4.53 0.05 -1.25 -4.31 118.68 106.95 1x5f s LEU 50 Ca 0.45 0.52 -0.09 0.00 0.05 0.00 0.00 54.13 55.06 1x5f s LEU 50 Cb 0.37 0.81 -0.05 0.00 -2.05 0.00 0.00 46.19 45.26 1x5f s LEU 50 CO 0.09 -0.13 0.83 -0.89 -0.55 0.00 0.00 176.35 175.70 1x5f s THR 51 N 0.70 4.80 -0.08 5.48 2.01 0.38 -2.72 115.64 126.20 1x5f s THR 51 Ca -0.05 0.56 0.02 0.00 0.31 0.00 0.00 61.69 62.53 1x5f s THR 51 Cb -0.06 -3.80 -0.02 0.00 0.01 0.00 0.00 72.50 68.63 1x5f s THR 51 CO -0.04 -0.74 -0.13 -0.31 -0.69 0.00 0.00 174.62 172.71 1x5f s TYR 52 N -2.64 2.77 -0.12 4.92 2.02 -1.26 0.17 117.35 123.21 1x5f s TYR 52 Ca 0.51 -0.32 -0.02 0.00 -0.37 0.00 0.00 57.07 56.87 1x5f s TYR 52 Cb -0.10 -1.72 -0.03 0.00 -0.40 0.00 0.00 41.96 39.71 1x5f s TYR 52 CO 0.39 0.05 -0.06 -1.12 -1.57 0.00 0.00 175.55 173.24 1x5f s SER 53 N -0.31 4.63 -0.28 2.29 0.01 0.79 -2.59 113.70 118.25 1x5f s SER 53 Ca 0.03 -0.12 -0.02 0.00 1.31 0.00 0.00 55.95 57.14 1x5f s SER 53 Cb -0.13 -1.57 0.03 0.00 0.21 0.00 0.00 66.02 64.57 1x5f s SER 53 CO 0.03 0.23 -0.01 -0.69 0.41 0.00 0.00 173.24 173.20 1x5f s VAL 54 N -0.01 3.08 -0.26 3.43 1.01 -1.14 -0.65 120.40 125.86 1x5f s VAL 54 Ca -0.00 -1.15 -0.10 0.00 0.00 0.00 0.00 61.98 60.73 1x5f s VAL 54 Cb -0.13 -2.66 -0.04 0.00 0.00 0.00 0.00 36.38 33.54 1x5f s VAL 54 CO 0.03 0.04 0.15 -0.36 0.00 0.00 0.00 175.10 174.96 1x5f s PHE 55 N 1.32 3.21 0.03 5.22 0.40 0.17 -1.74 117.98 126.60 1x5f s PHE 55 Ca -0.02 0.02 0.08 0.00 -0.60 0.00 0.00 56.93 56.41 1x5f s PHE 55 Cb -0.18 -2.31 -0.03 0.00 0.51 0.00 0.00 43.02 41.01 1x5f s PHE 55 CO -0.02 -0.14 -0.24 1.52 0.70 0.00 0.00 175.22 177.05 1x5f s TYR 56 N 1.51 2.07 0.18 0.36 1.13 -1.02 0.21 117.35 121.79 1x5f s TYR 56 Ca 0.07 -0.39 -0.22 0.00 -1.41 0.00 0.00 57.07 55.11 1x5f s TYR 56 Cb -0.15 -1.26 0.06 0.00 -1.10 0.00 0.00 41.96 39.51 1x5f s TYR 56 CO 0.08 0.08 0.60 -0.08 -2.51 0.00 0.00 175.55 173.72 1x5f s THR 57 N -0.75 0.01 -0.05 -3.49 -1.32 -1.14 -2.35 115.64 106.55 1x5f s THR 57 Ca 0.10 -0.23 -0.30 0.00 -1.21 0.00 0.00 61.69 60.05 1x5f s THR 57 Cb -0.09 -1.20 -0.03 0.00 -1.51 0.00 0.00 72.50 69.67 1x5f s THR 57 CO 0.01 -0.02 1.12 -0.75 -2.21 0.00 0.00 174.62 172.77 1x5f s LYS 58 N -3.79 4.40 0.33 7.08 2.20 -1.25 -0.37 119.74 128.34 1x5f s LYS 58 Ca 0.03 1.58 0.22 0.00 -0.36 0.00 0.00 55.97 57.44 1x5f s LYS 58 Cb -0.02 -3.52 1.14 0.00 -1.51 0.00 0.00 37.83 33.93 1x5f s LYS 58 CO -0.09 -0.34 1.25 -1.91 -0.36 0.00 0.00 175.35 173.90 1x5f n GLU 59 N 4.84 -0.04 0.11 4.03 2.13 -1.26 0.19 120.64 130.65 1x5f n GLU 59 Ca 0.10 1.05 -0.22 0.00 0.66 0.00 0.00 57.16 58.75 1x5f n GLU 59 Cb 0.47 -1.98 -0.15 0.00 0.27 0.00 0.00 31.44 30.05 1x5f n GLU 59 CO 0.00 0.00 0.00 0.78 -0.41 0.00 0.00 177.13 177.50 1x5f h GLY 60 N 0.00 0.49 -3.48 8.31 0.00 -1.93 -3.46 103.07 103.01 1x5f h GLY 60 Ca 0.69 -1.26 -0.51 0.00 0.00 0.00 0.00 47.33 46.25 1x5f h GLY 60 CO -0.49 1.11 0.10 -0.42 0.00 0.00 0.00 176.54 176.83 1x5f s ILE 61 N -2.61 4.61 -0.11 2.60 -1.09 0.51 -4.99 121.20 120.13 1x5f s ILE 61 Ca -0.10 1.18 0.16 0.00 -2.23 0.00 0.00 60.65 59.66 1x5f s ILE 61 Cb 0.05 -3.79 -0.20 0.00 -1.58 0.00 0.00 42.46 36.94 1x5f s ILE 61 CO 0.91 0.11 0.59 0.00 -1.23 0.00 0.00 174.94 175.31 1x5f n ALA 62 N 0.45 1.76 -1.80 9.38 0.00 -1.26 -3.88 120.51 125.15 1x5f n ALA 62 Ca -0.01 -0.78 -0.42 0.00 0.00 0.00 0.00 53.44 52.23 1x5f n ALA 62 Cb 0.52 -0.75 -0.03 0.00 0.00 0.00 0.00 19.45 19.19 1x5f n ALA 62 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 1x5f s ARG 63 N -2.77 4.16 0.03 0.00 3.52 -1.26 -4.97 118.95 117.66 1x5f s ARG 63 Ca -0.05 2.50 0.03 0.00 -0.13 0.00 0.00 55.73 58.08 1x5f s ARG 63 Cb 0.08 -3.37 -0.02 0.00 -1.56 0.00 0.00 34.95 30.08 1x5f s ARG 63 CO 0.83 -0.75 -0.09 -1.83 -0.81 0.00 0.00 175.30 172.64 1x5f s GLU 64 N 2.01 0.62 -0.02 5.12 1.03 -1.26 -4.43 118.70 121.76 1x5f s GLU 64 Ca 0.76 -0.63 0.01 0.00 0.03 0.00 0.00 54.97 55.14 1x5f s GLU 64 Cb -0.45 -0.51 -0.03 0.00 -0.80 0.00 0.00 34.13 32.33 1x5f s GLU 64 CO 0.33 0.12 -0.01 1.03 -1.33 0.00 0.00 175.26 175.40 1x5f s ARG 65 N -1.13 2.77 -0.14 -4.83 0.52 -0.99 -4.88 118.95 110.27 1x5f s ARG 65 Ca -0.04 -0.60 -0.08 0.00 -0.52 0.00 0.00 55.73 54.49 1x5f s ARG 65 Cb -0.08 -2.65 -0.04 0.00 0.52 0.00 0.00 34.95 32.70 1x5f s ARG 65 CO 0.01 0.63 0.14 0.54 0.02 0.00 0.00 175.30 176.64 1x5f s VAL 66 N -1.03 5.47 -0.26 3.52 0.11 -1.26 -2.44 120.40 124.51 1x5f s VAL 66 Ca 0.18 0.22 0.01 0.00 -2.93 0.00 0.00 61.98 59.45 1x5f s VAL 66 Cb -0.11 -3.43 0.07 0.00 -1.53 0.00 0.00 36.38 31.38 1x5f s VAL 66 CO 0.08 0.57 -0.01 -0.70 -3.33 0.00 0.00 175.10 171.71 1x5f s GLU 67 N -0.63 1.41 0.04 1.54 -6.30 -0.71 -4.91 118.70 109.15 1x5f s GLU 67 Ca 0.13 -1.10 -0.31 0.00 -2.50 0.00 0.00 54.97 51.20 1x5f s GLU 67 Cb -0.12 -2.56 -0.06 0.00 0.00 0.00 0.00 34.13 31.39 1x5f s GLU 67 CO 0.02 -0.71 1.30 -0.80 0.02 0.00 0.00 175.26 175.10 1x5f s ASN 68 N 1.38 6.95 -0.04 -1.70 0.01 -1.26 -2.87 114.94 117.41 1x5f s ASN 68 Ca -0.01 2.10 -0.37 0.00 -0.71 0.00 0.00 52.86 53.87 1x5f s ASN 68 Cb -0.19 -2.57 -0.15 0.00 0.41 0.00 0.00 41.25 38.75 1x5f s ASN 68 CO -0.09 -0.60 1.61 0.35 -1.51 0.00 0.00 177.10 176.86 1x5f n THR 69 N 4.21 0.20 -0.43 1.60 -2.24 -1.07 -4.75 114.28 111.81 1x5f n THR 69 Ca 0.11 -0.04 0.35 0.00 -2.27 0.00 0.00 64.05 62.20 1x5f n THR 69 Cb 0.45 -1.28 0.56 0.00 -2.10 0.00 0.00 70.33 67.95 1x5f n THR 69 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 1x5f n SER 70 N 4.33 0.10 -4.09 3.42 2.88 -1.26 -4.14 113.62 114.86 1x5f n SER 70 Ca 0.21 0.94 -0.18 0.00 -1.33 0.00 0.00 58.87 58.51 1x5f n SER 70 Cb 0.21 -0.46 -0.13 0.00 -0.75 0.00 0.00 64.21 63.08 1x5f n SER 70 CO 0.00 0.00 0.00 -1.00 -1.23 0.00 0.00 175.04 172.81 1x5f s HIS 71 N -4.68 0.97 -0.08 0.66 3.76 -1.26 -5.12 115.29 109.55 1x5f s HIS 71 Ca -0.05 -0.31 -0.30 0.00 -0.15 0.00 0.00 55.06 54.25 1x5f s HIS 71 Cb 0.22 -0.59 -0.04 0.00 1.11 0.00 0.00 32.58 33.28 1x5f s HIS 71 CO 0.64 -0.00 1.51 -1.25 -0.85 0.00 0.00 174.74 174.80 1x5f s PRO 72 N -0.93 4.21 0.00 8.40 0.04 -1.26 -3.01 135.00 142.45 1x5f s PRO 72 Ca -0.00 2.01 0.00 0.00 0.04 0.00 0.00 61.00 63.05 1x5f s PRO 72 Cb -0.07 -3.87 0.00 0.00 0.04 0.00 0.00 34.50 30.60 1x5f s PRO 72 CO 0.01 -0.77 0.00 0.41 0.04 0.00 0.00 177.00 176.68 1x5f n GLY 73 N 3.92 1.35 3.72 0.56 0.00 -1.10 -4.83 105.19 108.81 1x5f n GLY 73 Ca 0.16 -0.26 -0.39 0.00 0.00 0.00 0.00 46.02 45.52 1x5f n GLY 73 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1x5f s GLU 74 N -1.47 4.42 -0.27 1.61 2.12 -1.16 -4.82 118.70 119.12 1x5f s GLU 74 Ca 0.00 0.83 0.04 0.00 0.36 0.00 0.00 54.97 56.20 1x5f s GLU 74 Cb 0.00 -3.43 0.49 0.00 0.26 0.00 0.00 34.13 31.45 1x5f s GLU 74 CO 0.00 0.12 1.56 -1.33 -0.54 0.00 0.00 175.26 175.08 1x5f n MET 75 N 3.58 2.31 -3.64 4.30 2.81 -1.26 -4.86 117.12 120.36 1x5f n MET 75 Ca -0.03 -2.09 -0.05 0.00 -1.81 0.00 0.00 57.70 53.72 1x5f n MET 75 Cb 0.51 -1.86 -0.06 0.00 -0.71 0.00 0.00 33.22 31.10 1x5f n MET 75 CO 0.00 0.00 0.00 1.14 1.51 0.00 0.00 175.97 178.62 1x5f s GLN 76 N -2.25 0.24 0.03 0.03 1.03 -1.26 -2.41 119.66 115.07 1x5f s GLN 76 Ca 0.39 0.21 -0.17 0.00 0.04 0.00 0.00 55.36 55.83 1x5f s GLN 76 Cb 0.32 0.12 0.03 0.00 0.03 0.00 0.00 33.01 33.51 1x5f s GLN 76 CO 0.08 -0.04 0.38 0.54 -2.54 0.00 0.00 175.29 173.71 1x5f s VAL 77 N -0.22 0.06 -0.14 3.63 0.11 -0.95 -4.93 120.40 117.96 1x5f s VAL 77 Ca 0.05 -0.49 -0.03 0.00 -2.93 0.00 0.00 61.98 58.58 1x5f s VAL 77 Cb -0.04 -0.89 -0.03 0.00 -1.53 0.00 0.00 36.38 33.89 1x5f s VAL 77 CO -0.10 -0.27 -0.04 -0.89 -3.33 0.00 0.00 175.10 170.47 1x5f s THR 78 N -2.24 3.89 -0.60 5.04 2.01 -1.26 -1.00 115.64 121.48 1x5f s THR 78 Ca -0.07 -0.37 -0.05 0.00 0.31 0.00 0.00 61.69 61.51 1x5f s THR 78 Cb -0.02 -2.69 0.16 0.00 0.01 0.00 0.00 72.50 69.96 1x5f s THR 78 CO -0.01 0.51 0.44 -0.63 -0.69 0.00 0.00 174.62 174.24 1x5f s ILE 79 N 0.16 3.97 0.82 1.82 -1.09 -1.00 -4.97 121.20 120.90 1x5f s ILE 79 Ca -0.02 -2.62 -0.08 0.00 -2.23 0.00 0.00 60.65 55.70 1x5f s ILE 79 Cb -0.14 -3.59 0.14 0.00 -1.58 0.00 0.00 42.46 37.30 1x5f s ILE 79 CO 0.03 -0.86 1.14 -1.10 -1.23 0.00 0.00 174.94 172.91 1x5f s GLN 80 N 0.32 1.37 -0.47 2.79 -0.21 -1.26 -2.51 119.66 119.69 1x5f s GLN 80 Ca 0.14 -0.63 -0.01 0.00 0.02 0.00 0.00 55.36 54.88 1x5f s GLN 80 Cb -0.20 -2.09 0.00 0.00 1.00 0.00 0.00 33.01 31.72 1x5f s GLN 80 CO -0.04 -1.80 0.40 0.09 -2.12 0.00 0.00 175.29 171.82 1x5f n ASN 81 N -3.24 -2.49 -4.57 5.90 3.02 -0.90 -4.93 115.26 108.05 1x5f n ASN 81 Ca 0.13 -0.22 -0.27 0.00 -0.03 0.00 0.00 54.58 54.20 1x5f n ASN 81 Cb 0.60 -2.23 -0.11 0.00 -0.61 0.00 0.00 39.78 37.43 1x5f n ASN 81 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1x5f s LEU 82 N -3.56 2.77 -0.12 3.41 1.43 -0.09 -5.02 118.68 117.49 1x5f s LEU 82 Ca 0.06 -1.29 -0.04 0.00 -1.03 0.00 0.00 54.13 51.84 1x5f s LEU 82 Cb -0.03 -0.91 -0.03 0.00 0.03 0.00 0.00 46.19 45.25 1x5f s LEU 82 CO 0.27 -0.35 0.03 -0.32 0.23 0.00 0.00 176.35 176.21 1x5f s MET 83 N -3.68 3.35 0.64 1.70 -2.45 -1.26 -4.48 119.30 113.13 1x5f s MET 83 Ca 0.34 -0.37 -0.15 0.00 -1.25 0.00 0.00 55.69 54.25 1x5f s MET 83 Cb 0.06 -2.95 -0.01 0.00 1.25 0.00 0.00 34.83 33.18 1x5f s MET 83 CO 0.17 0.56 1.11 -1.25 1.05 0.00 0.00 175.02 176.66 1x5f s PRO 84 N -0.46 2.87 -1.50 4.11 0.04 -0.89 -3.45 135.00 135.72 1x5f s PRO 84 Ca 0.09 1.41 -0.04 0.00 0.04 0.00 0.00 61.00 62.50 1x5f s PRO 84 Cb -0.12 -1.96 0.02 0.00 0.04 0.00 0.00 34.50 32.48 1x5f s PRO 84 CO 0.02 -1.20 0.40 0.00 0.04 0.00 0.00 177.00 176.27 1x5f n ALA 85 N -2.28 -0.90 -3.69 8.56 0.00 -1.20 -4.86 120.51 116.13 1x5f n ALA 85 Ca 0.10 0.21 -0.19 0.00 0.00 0.00 0.00 53.44 53.56 1x5f n ALA 85 Cb 0.52 -3.11 -0.18 0.00 0.00 0.00 0.00 19.45 16.68 1x5f n ALA 85 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1x5f s THR 86 N -3.05 -0.10 0.84 0.00 2.01 -1.22 -4.91 115.64 109.21 1x5f s THR 86 Ca 0.23 0.39 -0.11 0.00 0.31 0.00 0.00 61.69 62.50 1x5f s THR 86 Cb -0.11 -0.14 0.10 0.00 0.01 0.00 0.00 72.50 72.36 1x5f s THR 86 CO 0.28 0.16 1.14 0.68 -0.69 0.00 0.00 174.62 176.20 1x5f s VAL 87 N 1.95 2.45 -0.21 3.82 -7.23 -1.26 -3.48 120.40 116.44 1x5f s VAL 87 Ca 0.02 0.16 -0.06 0.00 -1.81 0.00 0.00 61.98 60.30 1x5f s VAL 87 Cb -0.12 -2.42 0.10 0.00 0.56 0.00 0.00 36.38 34.50 1x5f s VAL 87 CO -0.03 -0.18 0.40 -0.31 -0.31 0.00 0.00 175.10 174.68 1x5f s TYR 88 N -2.57 -0.80 -0.66 2.82 2.02 0.32 -4.10 117.35 114.38 1x5f s TYR 88 Ca 0.67 1.31 -0.27 0.00 -0.37 0.00 0.00 57.07 58.41 1x5f s TYR 88 Cb -0.23 0.21 0.01 0.00 -0.40 0.00 0.00 41.96 41.56 1x5f s TYR 88 CO 0.54 -0.55 1.46 0.42 -1.57 0.00 0.00 175.55 175.86 1x5f s ILE 89 N 2.59 3.64 0.10 2.71 -1.09 0.50 -2.80 121.20 126.85 1x5f s ILE 89 Ca 0.03 0.42 -0.17 0.00 -2.23 0.00 0.00 60.65 58.71 1x5f s ILE 89 Cb -0.13 -4.54 -0.07 0.00 -1.58 0.00 0.00 42.46 36.14 1x5f s ILE 89 CO -0.14 -1.44 0.54 -0.36 -1.23 0.00 0.00 174.94 172.32 1x5f s PHE 90 N 6.68 3.71 -0.13 3.97 0.40 -0.32 -2.88 117.98 129.43 1x5f s PHE 90 Ca 0.48 1.15 -0.02 0.00 -0.60 0.00 0.00 56.93 57.94 1x5f s PHE 90 Cb -0.10 -2.42 0.04 0.00 0.51 0.00 0.00 43.02 41.05 1x5f s PHE 90 CO 0.19 0.53 0.01 1.03 0.70 0.00 0.00 175.22 177.67 1x5f s ARG 91 N -1.47 0.75 -0.28 0.44 0.52 0.13 -1.28 118.95 117.77 1x5f s ARG 91 Ca 0.32 -0.17 -0.12 0.00 -0.52 0.00 0.00 55.73 55.24 1x5f s ARG 91 Cb -0.17 -1.53 -0.05 0.00 0.52 0.00 0.00 34.95 33.72 1x5f s ARG 91 CO 0.18 -0.44 0.26 0.08 0.02 0.00 0.00 175.30 175.40 1x5f s VAL 92 N 1.89 5.26 0.18 3.52 1.01 -1.26 -0.65 120.40 130.35 1x5f s VAL 92 Ca 0.02 0.32 0.08 0.00 0.00 0.00 0.00 61.98 62.40 1x5f s VAL 92 Cb -0.14 -3.59 -0.04 0.00 0.00 0.00 0.00 36.38 32.60 1x5f s VAL 92 CO -0.07 0.22 -0.15 -0.32 0.00 0.00 0.00 175.10 174.77 1x5f s MET 93 N 1.87 1.28 0.15 2.72 0.00 0.17 0.10 119.30 125.59 1x5f s MET 93 Ca 0.10 -1.50 0.04 0.00 0.00 0.00 0.00 55.69 54.33 1x5f s MET 93 Cb -0.16 -1.16 -0.04 0.00 0.00 0.00 0.00 34.83 33.48 1x5f s MET 93 CO 0.11 0.21 0.19 0.00 0.00 0.00 0.00 175.02 175.53 1x5f s ALA 94 N -2.61 3.75 -0.09 4.11 0.00 -1.26 -0.15 121.76 125.51 1x5f s ALA 94 Ca 0.19 -1.11 -0.04 0.00 0.00 0.00 0.00 51.96 51.01 1x5f s ALA 94 Cb -0.03 -1.56 0.05 0.00 0.00 0.00 0.00 23.12 21.58 1x5f s ALA 94 CO 0.06 0.56 0.19 -0.65 0.00 0.00 0.00 175.76 175.92 1x5f s GLN 95 N -3.06 0.09 0.30 0.00 -0.21 0.45 -2.94 119.66 114.28 1x5f s GLN 95 Ca 0.32 0.54 0.00 0.00 0.02 0.00 0.00 55.36 56.25 1x5f s GLN 95 Cb -0.11 -0.19 0.00 0.00 1.00 0.00 0.00 33.01 33.72 1x5f s GLN 95 CO 0.26 -0.25 0.01 0.27 -2.12 0.00 0.00 175.29 173.46 1x5f n ASN 96 N 4.92 2.77 0.08 5.90 0.23 -1.08 0.14 115.26 128.22 1x5f n ASN 96 Ca -0.13 -2.28 0.16 0.00 -0.53 0.00 0.00 54.58 51.80 1x5f n ASN 96 Cb 0.51 0.19 0.37 0.00 -2.08 0.00 0.00 39.78 38.77 1x5f n ASN 96 CO 0.00 0.00 0.00 0.07 -0.93 0.00 0.00 177.26 176.40 1x5f h LYS 97 N 0.00 0.00 0.00 -3.83 5.09 -2.01 -1.81 116.57 114.01 1x5f h LYS 97 Ca -0.24 0.00 0.00 0.00 0.09 0.00 0.00 60.65 60.50 1x5f h LYS 97 Cb 0.74 0.00 0.00 0.00 0.10 0.00 0.00 32.23 33.07 1x5f h LYS 97 CO 0.40 0.00 0.00 0.72 -2.09 0.00 0.00 179.45 178.48 1x5f n HIS 98 N -3.00 0.00 0.00 0.07 8.25 -1.26 -5.09 115.22 114.19 1x5f n HIS 98 Ca 0.10 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.56 1x5f n HIS 98 Cb 1.09 -0.37 0.00 0.00 1.12 0.00 0.00 29.99 31.83 1x5f n HIS 98 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1x5f n GLY 99 N 1.55 -0.40 3.35 -1.41 0.00 -0.68 -5.11 105.19 102.49 1x5f n GLY 99 Ca 0.00 0.33 -0.36 0.00 0.00 0.00 0.00 46.02 45.98 1x5f n GLY 99 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1x5f s SER 100 N -4.00 4.88 0.00 1.61 1.04 -1.26 -2.65 113.70 113.32 1x5f s SER 100 Ca 0.00 -0.54 0.00 0.00 0.48 0.00 0.00 55.95 55.89 1x5f s SER 100 Cb 0.00 -1.84 0.00 0.00 0.10 0.00 0.00 66.02 64.28 1x5f s SER 100 CO 0.00 -0.11 0.00 0.61 0.98 0.00 0.00 173.24 174.72 1x5f n GLY 101 N 4.85 0.81 3.57 7.32 0.00 -1.15 -4.98 105.19 115.61 1x5f n GLY 101 Ca -0.16 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.52 1x5f n GLY 101 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1x5f s GLU 102 N 0.42 3.36 0.05 1.61 2.56 -1.25 -5.00 118.70 120.46 1x5f s GLU 102 Ca 0.00 -0.48 -0.26 0.00 0.00 0.00 0.00 54.97 54.23 1x5f s GLU 102 Cb 0.00 -2.85 -0.05 0.00 2.00 0.00 0.00 34.13 33.23 1x5f s GLU 102 CO 0.00 0.44 0.80 0.45 -0.56 0.00 0.00 175.26 176.39 1x5f s SER 103 N -0.17 7.25 1.18 -1.70 0.15 -1.26 -1.81 113.70 117.34 1x5f s SER 103 Ca 0.04 1.49 -0.18 0.00 0.70 0.00 0.00 55.95 58.01 1x5f s SER 103 Cb -0.13 -2.49 0.22 0.00 -1.71 0.00 0.00 66.02 61.92 1x5f s SER 103 CO 0.02 -0.01 0.46 -1.54 1.20 0.00 0.00 173.24 173.37 1x5f n SER 104 N 2.89 -2.99 -4.76 5.45 3.41 0.11 -4.87 113.62 112.87 1x5f n SER 104 Ca -0.01 -0.42 -0.37 0.00 -0.26 0.00 0.00 58.87 57.81 1x5f n SER 104 Cb 0.50 -0.94 0.02 0.00 -0.26 0.00 0.00 64.21 63.53 1x5f n SER 104 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1x5f s ALA 105 N -2.16 2.75 -0.28 7.33 0.00 -1.26 -4.59 121.76 123.55 1x5f s ALA 105 Ca 0.53 1.05 -0.29 0.00 0.00 0.00 0.00 51.96 53.25 1x5f s ALA 105 Cb -0.12 -3.45 -0.02 0.00 0.00 0.00 0.00 23.12 19.53 1x5f s ALA 105 CO 0.52 -1.02 1.65 -1.25 0.00 0.00 0.00 175.76 175.66 1x5f s PRO 106 N -3.03 3.62 -0.12 0.00 0.04 -1.26 -4.68 135.00 129.58 1x5f s PRO 106 Ca 0.71 1.51 -0.18 0.00 0.04 0.00 0.00 61.00 63.08 1x5f s PRO 106 Cb -0.32 -4.09 -0.04 0.00 0.04 0.00 0.00 34.50 30.10 1x5f s PRO 106 CO 0.36 -1.50 0.47 -1.17 0.04 0.00 0.00 177.00 175.20 1x5f s LEU 107 N 5.76 4.28 -0.56 -3.56 2.96 -0.40 -4.89 118.68 122.27 1x5f s LEU 107 Ca 0.73 0.81 -0.18 0.00 -0.22 0.00 0.00 54.13 55.27 1x5f s LEU 107 Cb -0.23 -2.68 0.10 0.00 0.50 0.00 0.00 46.19 43.88 1x5f s LEU 107 CO 0.31 0.02 0.64 -0.60 -1.32 0.00 0.00 176.35 175.39 1x5f s ARG 108 N 0.55 3.05 -0.16 1.98 3.52 -1.26 -1.17 118.95 125.46 1x5f s ARG 108 Ca 0.25 -1.30 -0.03 0.00 -0.13 0.00 0.00 55.73 54.52 1x5f s ARG 108 Cb -0.15 -4.23 -0.02 0.00 -1.56 0.00 0.00 34.95 28.99 1x5f s ARG 108 CO 0.10 -1.41 -0.06 0.08 -0.81 0.00 0.00 175.30 173.20 1x5f s VAL 109 N 2.44 3.65 -0.20 7.11 1.01 -1.12 -4.92 120.40 128.36 1x5f s VAL 109 Ca 0.10 -0.44 -0.05 0.00 0.00 0.00 0.00 61.98 61.59 1x5f s VAL 109 Cb -0.24 -2.60 -0.02 0.00 0.00 0.00 0.00 36.38 33.52 1x5f s VAL 109 CO 0.07 0.49 0.01 -0.70 0.00 0.00 0.00 175.10 174.96 1x5f s GLU 110 N 0.54 3.62 1.24 2.72 2.12 -1.26 -0.52 118.70 127.16 1x5f s GLU 110 Ca -0.04 -0.52 -0.21 0.00 0.36 0.00 0.00 54.97 54.56 1x5f s GLU 110 Cb -0.15 -3.10 0.31 0.00 0.26 0.00 0.00 34.13 31.46 1x5f s GLU 110 CO 0.03 -0.00 1.00 0.25 -0.54 0.00 0.00 175.26 175.99 1x5f n THR 111 N 4.30 0.00 -4.16 -1.70 -2.24 -1.23 -4.93 114.28 104.32 1x5f n THR 111 Ca -0.17 -0.35 -0.35 0.00 -2.27 0.00 0.00 64.05 60.90 1x5f n THR 111 Cb 0.52 -1.16 -0.08 0.00 -2.10 0.00 0.00 70.33 67.51 1x5f n THR 111 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 1x5f s GLN 112 N -5.30 3.15 -0.87 -0.78 -1.52 -1.26 -3.79 119.66 109.29 1x5f s GLN 112 Ca 0.67 -0.33 -0.25 0.00 -1.95 0.00 0.00 55.36 53.51 1x5f s GLN 112 Cb -0.08 -2.94 -0.04 0.00 -0.22 0.00 0.00 33.01 29.73 1x5f s GLN 112 CO 0.53 0.72 1.94 -1.25 -0.25 0.00 0.00 175.29 176.98 1x5f s PRO 113 N -1.07 2.56 0.46 2.91 0.04 -1.26 -3.27 135.00 135.36 1x5f s PRO 113 Ca 0.15 -0.20 -0.19 0.00 0.04 0.00 0.00 61.00 60.81 1x5f s PRO 113 Cb -0.12 -4.99 -0.10 0.00 0.04 0.00 0.00 34.50 29.33 1x5f s PRO 113 CO 0.05 -3.32 0.95 -1.83 0.04 0.00 0.00 177.00 172.89 1x5f s GLU 114 N 7.02 4.10 -0.27 4.56 -1.05 -1.26 -4.99 118.70 126.80 1x5f s GLU 114 Ca 0.70 1.01 -0.02 0.00 -0.15 0.00 0.00 54.97 56.51 1x5f s GLU 114 Cb -0.07 -2.18 0.16 0.00 -0.44 0.00 0.00 34.13 31.60 1x5f s GLU 114 CO 0.01 -0.11 0.49 -1.54 0.95 0.00 0.00 175.26 175.06 1x5f s SER 115 N -2.55 -0.60 0.33 0.83 1.04 -1.26 -5.06 113.70 106.44 1x5f s SER 115 Ca 0.60 0.57 0.00 0.00 0.48 0.00 0.00 55.95 57.60 1x5f s SER 115 Cb -0.09 1.66 0.00 0.00 0.10 0.00 0.00 66.02 67.68 1x5f s SER 115 CO 0.21 -0.28 0.00 0.61 0.98 0.00 0.00 173.24 174.76 1x5f n GLY 116 N 5.40 -3.15 3.58 7.32 0.00 -1.26 -4.71 105.19 112.37 1x5f n GLY 116 Ca -0.02 -1.19 -0.41 0.00 0.00 0.00 0.00 46.02 44.40 1x5f n GLY 116 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1x5f s PRO 117 N -3.96 3.05 -0.12 1.61 0.04 -1.26 -4.98 135.00 129.38 1x5f s PRO 117 Ca 0.00 0.99 -0.16 0.00 0.04 0.00 0.00 61.00 61.87 1x5f s PRO 117 Cb 0.00 -4.26 -0.04 0.00 0.04 0.00 0.00 34.50 30.24 1x5f s PRO 117 CO 0.00 -2.21 0.41 0.45 0.04 0.00 0.00 177.00 175.69 1x5f s SER 118 N 6.69 6.61 -0.18 6.66 0.15 -1.26 -5.06 113.70 127.31 1x5f s SER 118 Ca 0.72 0.72 -0.21 0.00 0.70 0.00 0.00 55.95 57.88 1x5f s SER 118 Cb -0.17 -2.25 -0.03 0.00 -1.71 0.00 0.00 66.02 61.87 1x5f s SER 118 CO 0.28 0.06 0.62 -0.55 1.20 0.00 0.00 173.24 174.84 1x5f s SER 119 N 0.44 6.71 0.00 5.45 0.15 -1.26 -5.21 113.70 119.98 1x5f s SER 119 Ca 0.23 0.86 0.00 0.00 0.70 0.00 0.00 55.95 57.73 1x5f s SER 119 Cb -0.14 -2.35 0.00 0.00 -1.71 0.00 0.00 66.02 61.82 1x5f s SER 119 CO 0.08 -0.23 0.24 0.61 1.20 0.00 0.00 173.24 175.14