#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2e9j s SER 2 N 0.00 0.64 0.09 1.61 1.04 -1.26 -5.19 113.70 110.63 2e9j s SER 2 Ca 0.00 -1.37 -0.27 0.00 0.48 0.00 0.00 55.95 54.80 2e9j s SER 2 Cb 0.00 0.70 0.09 0.00 0.10 0.00 0.00 66.02 66.90 2e9j s SER 2 CO 0.00 -1.37 1.10 -0.44 0.98 0.00 0.00 173.24 173.51 2e9j s SER 3 N -3.18 -0.10 0.00 7.02 0.01 -1.26 -5.19 113.70 110.99 2e9j s SER 3 Ca 0.27 -0.33 0.00 0.00 1.31 0.00 0.00 55.95 57.19 2e9j s SER 3 Cb -0.01 0.36 0.00 0.00 0.21 0.00 0.00 66.02 66.57 2e9j s SER 3 CO 0.17 -0.67 0.00 0.61 0.41 0.00 0.00 173.24 173.76 2e9j n GLY 4 N -0.52 4.30 3.59 3.44 0.00 -1.26 -5.18 105.19 109.56 2e9j n GLY 4 Ca -0.06 -1.85 -0.07 0.00 0.00 0.00 0.00 46.02 44.03 2e9j n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2e9j s SER 5 N -0.81 -0.33 0.10 1.61 0.15 -1.26 -5.19 113.70 107.97 2e9j s SER 5 Ca 0.00 -0.17 -0.01 0.00 0.70 0.00 0.00 55.95 56.47 2e9j s SER 5 Cb 0.00 0.48 -0.04 0.00 -1.71 0.00 0.00 66.02 64.75 2e9j s SER 5 CO 0.00 -0.82 0.02 -0.44 1.20 0.00 0.00 173.24 173.20 2e9j s SER 6 N -2.70 0.42 -0.77 5.45 0.01 -1.26 -5.08 113.70 109.78 2e9j s SER 6 Ca 0.07 -1.12 0.01 0.00 1.31 0.00 0.00 55.95 56.22 2e9j s SER 6 Cb -0.01 0.25 0.35 0.00 0.21 0.00 0.00 66.02 66.82 2e9j s SER 6 CO -0.05 -0.67 1.55 0.61 0.41 0.00 0.00 173.24 175.10 2e9j n GLY 7 N -0.02 5.83 3.09 3.44 0.00 -1.26 -4.98 105.19 111.30 2e9j n GLY 7 Ca -0.09 -2.64 -0.12 0.00 0.00 0.00 0.00 46.02 43.17 2e9j n GLY 7 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2e9j s ARG 8 N -3.93 0.35 -0.89 1.61 0.52 -1.26 -5.10 118.95 110.25 2e9j s ARG 8 Ca 0.47 -0.03 -0.05 0.00 -0.52 0.00 0.00 55.73 55.60 2e9j s ARG 8 Cb 0.32 0.15 0.22 0.00 0.52 0.00 0.00 34.95 36.17 2e9j s ARG 8 CO -0.22 -0.07 0.79 0.45 0.02 0.00 0.00 175.30 176.27 2e9j s SER 9 N -0.57 6.23 -0.42 0.23 0.15 -1.26 -5.04 113.70 113.02 2e9j s SER 9 Ca -0.07 -3.46 -0.28 0.00 0.70 0.00 0.00 55.95 52.84 2e9j s SER 9 Cb -0.04 -1.99 -0.01 0.00 -1.71 0.00 0.00 66.02 62.26 2e9j s SER 9 CO 0.01 -0.27 1.74 -2.16 1.20 0.00 0.00 173.24 173.76 2e9j s PRO 10 N -0.99 3.21 -0.30 5.44 0.04 -1.26 -4.93 135.00 136.21 2e9j s PRO 10 Ca 0.26 1.13 -0.14 0.00 0.04 0.00 0.00 61.00 62.28 2e9j s PRO 10 Cb -0.10 -4.21 0.14 0.00 0.04 0.00 0.00 34.50 30.37 2e9j s PRO 10 CO -0.10 -2.02 0.88 0.12 0.04 0.00 0.00 177.00 175.92 2e9j s PHE 11 N 7.15 -0.84 -0.03 0.56 5.36 -1.26 -5.18 117.98 123.74 2e9j s PHE 11 Ca 0.73 1.52 -0.31 0.00 -0.96 0.00 0.00 56.93 57.91 2e9j s PHE 11 Cb -0.18 0.50 0.12 0.00 -0.34 0.00 0.00 43.02 43.12 2e9j s PHE 11 CO 0.30 -0.41 1.22 0.21 -1.46 0.00 0.00 175.22 175.08 2e9j s LYS 12 N 2.17 0.48 0.55 10.12 2.20 -1.26 -5.15 119.74 128.84 2e9j s LYS 12 Ca -0.06 -0.25 -0.20 0.00 -0.36 0.00 0.00 55.97 55.11 2e9j s LYS 12 Cb -0.07 0.17 -0.07 0.00 -1.51 0.00 0.00 37.83 36.35 2e9j s LYS 12 CO -0.17 -0.22 0.84 0.28 -0.36 0.00 0.00 175.35 175.72 2e9j n VAL 13 N -0.40 2.96 -3.74 4.02 0.31 -1.26 -4.97 118.33 115.25 2e9j n VAL 13 Ca -0.06 -0.50 -0.38 0.00 -0.01 0.00 0.00 64.34 63.39 2e9j n VAL 13 Cb 0.62 -1.00 -0.12 0.00 -0.91 0.00 0.00 33.84 32.42 2e9j n VAL 13 CO 0.00 0.00 0.00 -0.75 -1.32 0.00 0.00 176.83 174.76 2e9j s LYS 14 N -2.36 2.94 0.01 5.55 2.47 -1.26 -5.08 119.74 122.01 2e9j s LYS 14 Ca 0.71 -0.96 0.05 0.00 -1.56 0.00 0.00 55.97 54.21 2e9j s LYS 14 Cb -0.46 -3.44 -0.02 0.00 -1.46 0.00 0.00 37.83 32.45 2e9j s LYS 14 CO 0.52 -0.53 -0.17 0.14 0.16 0.00 0.00 175.35 175.47 2e9j s VAL 15 N 1.48 1.33 0.48 4.02 -7.23 -1.26 -5.12 120.40 114.10 2e9j s VAL 15 Ca 0.01 -0.87 -0.24 0.00 -1.81 0.00 0.00 61.98 59.07 2e9j s VAL 15 Cb -0.18 -1.14 -0.08 0.00 0.56 0.00 0.00 36.38 35.55 2e9j s VAL 15 CO 0.03 0.25 1.32 0.18 -0.31 0.00 0.00 175.10 176.57 2e9j n LEU 16 N 2.32 4.76 -4.75 1.32 4.32 -1.26 -4.98 117.00 118.73 2e9j n LEU 16 Ca -0.16 1.05 -0.30 0.00 -0.02 0.00 0.00 56.01 56.58 2e9j n LEU 16 Cb 0.54 -1.54 0.11 0.00 -1.62 0.00 0.00 43.42 40.91 2e9j n LEU 16 CO 0.24 -0.58 0.69 -2.16 -1.22 0.00 0.00 177.39 174.35 2e9j s PRO 17 N -2.52 1.82 0.10 3.23 0.04 -1.26 -4.98 135.00 131.44 2e9j s PRO 17 Ca 0.65 1.02 0.20 0.00 0.04 0.00 0.00 61.00 62.92 2e9j s PRO 17 Cb -0.46 -1.86 -0.11 0.00 0.04 0.00 0.00 34.50 32.11 2e9j s PRO 17 CO 0.54 -1.90 0.84 2.41 0.04 0.00 0.00 177.00 178.93 2e9j n THR 18 N -3.68 0.75 -2.12 1.26 -1.04 -1.26 -4.93 114.28 103.26 2e9j n THR 18 Ca 0.08 -0.60 -0.38 0.00 -2.04 0.00 0.00 64.05 61.11 2e9j n THR 18 Cb 0.54 -0.43 0.00 0.00 -1.82 0.00 0.00 70.33 68.63 2e9j n THR 18 CO 0.00 0.00 0.00 -0.72 -0.64 0.00 0.00 175.07 173.71 2e9j s TYR 19 N -3.20 2.73 -0.21 -1.42 -0.85 -1.26 -4.60 117.35 108.53 2e9j s TYR 19 Ca -0.03 1.48 -0.04 0.00 -0.52 0.00 0.00 57.07 57.97 2e9j s TYR 19 Cb 0.10 -3.52 0.10 0.00 0.38 0.00 0.00 41.96 39.02 2e9j s TYR 19 CO 0.82 -1.91 0.25 -0.51 -1.52 0.00 0.00 175.55 172.67 2e9j s ASP 20 N -1.19 1.20 0.19 -0.18 1.11 -1.25 -4.97 116.67 111.60 2e9j s ASP 20 Ca 0.65 -0.15 -0.10 0.00 0.18 0.00 0.00 52.55 53.12 2e9j s ASP 20 Cb -0.33 0.49 0.12 0.00 1.07 0.00 0.00 42.92 44.28 2e9j s ASP 20 CO 0.40 -0.32 1.79 0.00 1.18 0.00 0.00 175.17 178.21 2e9j h ALA 21 N 8.29 0.90 -1.09 5.23 0.00 -1.86 -2.28 119.26 128.44 2e9j h ALA 21 Ca -0.17 -0.14 0.32 0.00 0.00 0.00 0.00 54.91 54.92 2e9j h ALA 21 Cb 1.15 -0.28 -0.04 0.00 0.00 0.00 0.00 17.79 18.62 2e9j h ALA 21 CO 0.28 0.45 0.82 0.77 0.00 0.00 0.00 179.25 181.57 2e9j h SER 22 N 0.96 0.00 -0.14 0.00 0.02 -1.91 1.16 113.55 113.64 2e9j h SER 22 Ca 0.24 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 61.18 2e9j h SER 22 Cb 0.10 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.63 2e9j h SER 22 CO -0.03 0.00 0.01 0.29 -1.14 0.00 0.00 176.83 175.96 2e9j n LYS 23 N -4.09 1.88 -4.33 3.45 4.76 -0.86 -4.77 118.16 114.20 2e9j n LYS 23 Ca 0.23 -0.74 -0.34 0.00 -2.87 0.00 0.00 58.31 54.60 2e9j n LYS 23 Cb 1.19 -1.66 -0.15 0.00 -1.84 0.00 0.00 35.03 32.57 2e9j n LYS 23 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 2e9j s VAL 24 N -1.38 2.92 0.05 -0.18 1.01 0.40 -3.54 120.40 119.68 2e9j s VAL 24 Ca 0.13 -0.67 0.03 0.00 0.00 0.00 0.00 61.98 61.46 2e9j s VAL 24 Cb 0.10 -2.26 -0.03 0.00 0.00 0.00 0.00 36.38 34.19 2e9j s VAL 24 CO 0.04 0.49 -0.09 0.42 0.00 0.00 0.00 175.10 175.96 2e9j s THR 25 N 0.98 0.66 0.06 3.92 -4.23 -1.11 -4.93 115.64 110.98 2e9j s THR 25 Ca -0.02 -1.13 0.03 0.00 -1.18 0.00 0.00 61.69 59.40 2e9j s THR 25 Cb -0.15 -0.70 -0.03 0.00 1.34 0.00 0.00 72.50 72.96 2e9j s THR 25 CO -0.02 -0.35 -0.09 0.00 -0.54 0.00 0.00 174.62 173.62 2e9j s ALA 26 N -1.36 0.79 0.06 3.99 0.00 -1.26 0.23 121.76 124.22 2e9j s ALA 26 Ca -0.08 -0.91 -0.11 0.00 0.00 0.00 0.00 51.96 50.86 2e9j s ALA 26 Cb -0.10 0.02 0.01 0.00 0.00 0.00 0.00 23.12 23.05 2e9j s ALA 26 CO 0.01 -0.00 0.24 -1.12 0.00 0.00 0.00 175.76 174.89 2e9j s SER 27 N -1.83 -0.02 0.00 0.00 0.01 -0.77 -4.98 113.70 106.11 2e9j s SER 27 Ca -0.05 -0.38 0.00 0.00 1.31 0.00 0.00 55.95 56.83 2e9j s SER 27 Cb -0.08 0.34 0.00 0.00 0.21 0.00 0.00 66.02 66.49 2e9j s SER 27 CO 0.00 -0.64 0.00 0.61 0.41 0.00 0.00 173.24 173.62 2e9j n GLY 28 N 0.39 0.99 0.23 3.44 0.00 -1.26 -2.39 105.19 106.58 2e9j n GLY 28 Ca -0.18 -1.92 -0.08 0.00 0.00 0.00 0.00 46.02 43.85 2e9j n GLY 28 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2e9j h PRO 29 N 7.27 0.60 -0.60 1.61 0.13 -1.99 -2.97 132.00 136.05 2e9j h PRO 29 Ca 0.00 -0.32 0.17 0.00 -0.87 0.00 0.00 66.00 64.99 2e9j h PRO 29 Cb 0.00 0.01 -0.03 0.00 0.13 0.00 0.00 31.00 31.12 2e9j h PRO 29 CO 0.00 0.91 0.43 0.78 -0.23 0.00 0.00 178.00 179.89 2e9j h GLY 30 N 1.03 0.04 -1.53 1.56 0.00 -1.88 0.31 103.07 102.58 2e9j h GLY 30 Ca 0.04 -0.01 -0.09 0.00 0.00 0.00 0.00 47.33 47.27 2e9j h GLY 30 CO 0.08 0.00 -0.10 1.04 0.00 0.00 0.00 176.54 177.56 2e9j n LEU 31 N -4.37 3.66 -4.66 3.11 4.77 -1.16 -4.99 117.00 113.37 2e9j n LEU 31 Ca 0.11 -3.53 -0.42 0.00 -0.03 0.00 0.00 56.01 52.15 2e9j n LEU 31 Cb 0.66 -0.57 -0.03 0.00 -2.33 0.00 0.00 43.42 41.15 2e9j n LEU 31 CO 0.37 1.07 1.48 -0.55 -1.33 0.00 0.00 177.39 178.43 2e9j s SER 32 N -2.53 6.55 0.21 -1.43 0.15 0.10 -4.88 113.70 111.86 2e9j s SER 32 Ca 0.42 2.41 -0.07 0.00 0.70 0.00 0.00 55.95 59.41 2e9j s SER 32 Cb 0.37 -2.53 0.15 0.00 -1.71 0.00 0.00 66.02 62.30 2e9j s SER 32 CO 0.01 -1.00 1.71 0.77 1.20 0.00 0.00 173.24 175.93 2e9j h SER 33 N 10.10 1.01 -0.27 5.45 4.64 -1.89 -2.59 113.55 129.99 2e9j h SER 33 Ca -0.44 -0.24 0.00 0.00 -0.47 0.00 0.00 61.79 60.64 2e9j h SER 33 Cb 1.20 -0.27 -0.01 0.00 -0.31 0.00 0.00 62.40 63.01 2e9j h SER 33 CO 0.95 1.01 0.18 1.88 -0.87 0.00 0.00 176.83 179.98 2e9j h TYR 34 N 0.98 0.34 0.00 4.77 -1.99 -1.97 -3.45 116.97 115.65 2e9j h TYR 34 Ca 0.19 0.01 0.00 0.00 2.00 0.00 0.00 58.73 60.93 2e9j h TYR 34 Cb 0.45 -0.11 0.00 0.00 2.00 0.00 0.00 36.73 39.06 2e9j h TYR 34 CO 0.03 0.21 0.00 0.41 -0.00 0.00 0.00 178.16 178.81 2e9j n GLY 35 N -1.50 4.50 3.46 3.88 0.00 -0.98 -4.96 105.19 109.59 2e9j n GLY 35 Ca 0.01 -1.36 -0.30 0.00 0.00 0.00 0.00 46.02 44.37 2e9j n GLY 35 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2e9j s VAL 36 N -2.00 2.73 -0.19 1.61 -7.23 -0.79 -4.74 120.40 109.79 2e9j s VAL 36 Ca 0.00 -1.44 -0.29 0.00 -1.81 0.00 0.00 61.98 58.44 2e9j s VAL 36 Cb 0.00 -2.21 -0.03 0.00 0.56 0.00 0.00 36.38 34.70 2e9j s VAL 36 CO 0.00 0.18 1.59 -2.16 -0.31 0.00 0.00 175.10 174.39 2e9j s PRO 37 N -1.90 3.90 0.78 4.82 0.04 -1.26 0.17 135.00 141.55 2e9j s PRO 37 Ca 0.16 1.74 -0.12 0.00 0.04 0.00 0.00 61.00 62.83 2e9j s PRO 37 Cb -0.10 -4.00 0.07 0.00 0.04 0.00 0.00 34.50 30.50 2e9j s PRO 37 CO 0.08 -1.17 1.12 0.00 0.04 0.00 0.00 177.00 177.07 2e9j s ALA 38 N 4.85 2.09 -1.45 8.56 0.00 -0.71 -3.27 121.76 131.83 2e9j s ALA 38 Ca 0.70 0.47 -0.11 0.00 0.00 0.00 0.00 51.96 53.02 2e9j s ALA 38 Cb -0.26 -3.35 0.07 0.00 0.00 0.00 0.00 23.12 19.59 2e9j s ALA 38 CO 0.28 -1.93 0.71 0.43 0.00 0.00 0.00 175.76 175.25 2e9j n SER 39 N -3.40 -4.47 -3.73 0.00 7.64 -1.04 -4.95 113.62 103.67 2e9j n SER 39 Ca 0.10 -0.56 -0.15 0.00 1.01 0.00 0.00 58.87 59.28 2e9j n SER 39 Cb 0.52 -3.63 -0.15 0.00 -1.01 0.00 0.00 64.21 59.95 2e9j n SER 39 CO 0.00 0.00 0.00 -0.22 -3.01 0.00 0.00 175.04 171.81 2e9j s LEU 40 N -6.87 0.54 -0.66 -3.43 1.98 -1.20 -5.05 118.68 104.00 2e9j s LEU 40 Ca 0.51 0.28 -0.26 0.00 -2.89 0.00 0.00 54.13 51.76 2e9j s LEU 40 Cb -0.26 0.28 -0.03 0.00 0.66 0.00 0.00 46.19 46.85 2e9j s LEU 40 CO 0.63 -0.17 1.88 -2.16 -1.89 0.00 0.00 176.35 174.63 2e9j s PRO 41 N 1.47 2.61 -0.02 0.98 0.04 -1.26 -4.53 135.00 134.29 2e9j s PRO 41 Ca -0.06 0.47 0.02 0.00 0.04 0.00 0.00 61.00 61.47 2e9j s PRO 41 Cb -0.12 -4.49 -0.03 0.00 0.04 0.00 0.00 34.50 29.90 2e9j s PRO 41 CO -0.06 -2.84 -0.04 0.54 0.04 0.00 0.00 177.00 174.65 2e9j s VAL 42 N 9.25 3.88 0.01 -0.36 0.11 -1.19 -4.93 120.40 127.17 2e9j s VAL 42 Ca 0.68 -0.62 0.02 0.00 -2.93 0.00 0.00 61.98 59.13 2e9j s VAL 42 Cb -0.12 -2.68 -0.01 0.00 -1.53 0.00 0.00 36.38 32.04 2e9j s VAL 42 CO 0.17 0.45 -0.07 1.51 -3.33 0.00 0.00 175.10 173.83 2e9j s ASP 43 N -1.30 0.76 0.54 3.54 1.47 -1.26 -2.32 116.67 118.10 2e9j s ASP 43 Ca 0.17 -0.26 0.05 0.00 1.18 0.00 0.00 52.55 53.69 2e9j s ASP 43 Cb -0.11 -0.04 0.05 0.00 -0.34 0.00 0.00 42.92 42.48 2e9j s ASP 43 CO 0.07 -0.02 0.46 2.22 0.68 0.00 0.00 175.17 178.57 2e9j n PHE 44 N 2.41 -0.85 -4.27 2.11 -1.74 -1.18 -4.38 117.46 109.56 2e9j n PHE 44 Ca -0.16 -2.24 -0.23 0.00 -0.56 0.00 0.00 57.45 54.26 2e9j n PHE 44 Cb 0.57 -0.45 -0.17 0.00 1.52 0.00 0.00 39.48 40.95 2e9j n PHE 44 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 2e9j s ALA 45 N -2.76 1.06 -0.42 1.98 0.00 -1.01 -3.57 121.76 117.04 2e9j s ALA 45 Ca 0.35 -0.31 -0.16 0.00 0.00 0.00 0.00 51.96 51.83 2e9j s ALA 45 Cb -0.03 -0.60 0.03 0.00 0.00 0.00 0.00 23.12 22.52 2e9j s ALA 45 CO 0.22 -0.06 0.38 0.42 0.00 0.00 0.00 175.76 176.72 2e9j s ILE 46 N 1.03 5.17 -0.32 0.00 1.01 -0.43 -1.85 121.20 125.80 2e9j s ILE 46 Ca -0.09 -0.53 -0.14 0.00 0.00 0.00 0.00 60.65 59.89 2e9j s ILE 46 Cb -0.14 -4.01 -0.02 0.00 0.01 0.00 0.00 42.46 38.30 2e9j s ILE 46 CO -0.00 -0.40 0.29 -0.62 0.00 0.00 0.00 174.94 174.21 2e9j s ASP 47 N 1.83 6.12 -0.17 3.58 -1.08 0.14 -2.70 116.67 124.38 2e9j s ASP 47 Ca 0.09 -0.21 -0.02 0.00 -0.52 0.00 0.00 52.55 51.88 2e9j s ASP 47 Cb -0.18 -2.17 -0.01 0.00 -1.46 0.00 0.00 42.92 39.10 2e9j s ASP 47 CO 0.12 -0.24 -0.08 0.00 0.52 0.00 0.00 175.17 175.48 2e9j s ALA 48 N 1.88 2.76 -0.19 3.66 0.00 -1.25 -2.76 121.76 125.85 2e9j s ALA 48 Ca 0.09 -1.00 -0.15 0.00 0.00 0.00 0.00 51.96 50.91 2e9j s ALA 48 Cb -0.17 -1.47 -0.09 0.00 0.00 0.00 0.00 23.12 21.40 2e9j s ALA 48 CO 0.11 -0.05 -0.20 0.54 0.00 0.00 0.00 175.76 176.16 2e9j n ARG 49 N 4.07 0.52 -0.68 0.00 5.12 -1.23 -4.67 116.66 119.78 2e9j n ARG 49 Ca -0.18 0.38 0.06 0.00 -1.93 0.00 0.00 57.85 56.18 2e9j n ARG 49 Cb 0.52 -1.58 0.19 0.00 -1.16 0.00 0.00 32.46 30.43 2e9j n ARG 49 CO 0.00 0.00 0.00 -3.47 -1.93 0.00 0.00 177.63 172.23 2e9j n ASP 50 N -4.46 1.64 -0.12 0.55 -0.08 -1.26 -4.73 116.55 108.09 2e9j n ASP 50 Ca -0.23 -3.70 0.00 0.00 -1.51 0.00 0.00 54.79 49.35 2e9j n ASP 50 Cb 0.54 -0.50 0.00 0.00 2.34 0.00 0.00 41.12 43.50 2e9j n ASP 50 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2e9j n ALA 51 N -0.96 2.45 -0.27 -1.67 0.00 -1.25 -4.37 120.51 114.45 2e9j n ALA 51 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.62 2e9j n ALA 51 Cb 0.74 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 19.19 2e9j n ALA 51 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2e9j n GLY 52 N 0.36 2.82 2.70 0.00 0.00 -1.26 -3.74 105.19 106.07 2e9j n GLY 52 Ca 0.00 0.03 -0.19 0.00 0.00 0.00 0.00 46.02 45.87 2e9j n GLY 52 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2e9j s GLU 53 N 0.00 -0.07 0.26 1.61 -1.05 -1.26 -5.00 118.70 113.19 2e9j s GLU 53 Ca 0.00 0.32 -0.19 0.00 -0.15 0.00 0.00 54.97 54.95 2e9j s GLU 53 Cb 0.00 -0.43 0.02 0.00 -0.44 0.00 0.00 34.13 33.27 2e9j s GLU 53 CO 0.00 -0.28 0.64 0.20 0.95 0.00 0.00 175.26 176.77 2e9j s GLY 54 N 1.85 0.02 -0.33 -3.83 0.00 -1.26 -4.66 107.32 99.10 2e9j s GLY 54 Ca 0.01 -0.39 -0.29 0.00 0.00 0.00 0.00 44.72 44.05 2e9j s GLY 54 CO -0.03 -0.21 1.16 -2.27 0.00 0.00 0.00 173.10 171.75 2e9j s LEU 55 N -2.93 3.88 -0.06 0.66 2.96 -1.26 -4.75 118.68 117.17 2e9j s LEU 55 Ca 0.13 1.03 -0.23 0.00 -0.22 0.00 0.00 54.13 54.84 2e9j s LEU 55 Cb -0.04 -3.54 -0.04 0.00 0.50 0.00 0.00 46.19 43.07 2e9j s LEU 55 CO 0.06 -0.99 0.68 -0.22 -1.32 0.00 0.00 176.35 174.56 2e9j s LEU 56 N 3.99 4.33 -0.05 -0.68 2.96 -1.26 -2.55 118.68 125.42 2e9j s LEU 56 Ca 0.49 1.17 0.06 0.00 -0.22 0.00 0.00 54.13 55.63 2e9j s LEU 56 Cb -0.13 -3.05 -0.01 0.00 0.50 0.00 0.00 46.19 43.50 2e9j s LEU 56 CO 0.20 -0.09 -0.22 0.00 -1.32 0.00 0.00 176.35 174.92 2e9j s ALA 57 N 0.69 1.92 -0.18 5.97 0.00 -0.91 -5.02 121.76 124.22 2e9j s ALA 57 Ca 0.36 -0.93 -0.02 0.00 0.00 0.00 0.00 51.96 51.38 2e9j s ALA 57 Cb -0.18 -0.59 -0.01 0.00 0.00 0.00 0.00 23.12 22.35 2e9j s ALA 57 CO 0.18 0.38 -0.10 0.08 0.00 0.00 0.00 175.76 176.30 2e9j s VAL 58 N -0.17 3.04 -0.23 0.00 1.01 -1.26 -2.63 120.40 120.16 2e9j s VAL 58 Ca -0.01 -0.62 0.01 0.00 0.00 0.00 0.00 61.98 61.36 2e9j s VAL 58 Cb -0.12 -2.33 0.05 0.00 0.00 0.00 0.00 36.38 33.98 2e9j s VAL 58 CO 0.02 0.48 -0.09 -1.58 0.00 0.00 0.00 175.10 173.93 2e9j s GLN 59 N 1.08 1.98 -0.15 2.72 0.74 -1.23 -5.02 119.66 119.78 2e9j s GLN 59 Ca 0.00 -1.05 -0.02 0.00 0.05 0.00 0.00 55.36 54.35 2e9j s GLN 59 Cb -0.15 -2.63 -0.02 0.00 1.10 0.00 0.00 33.01 31.32 2e9j s GLN 59 CO -0.02 -0.52 -0.09 0.42 -0.55 0.00 0.00 175.29 174.52 2e9j s ILE 60 N 1.30 3.30 0.12 -2.34 1.01 -1.26 -1.14 121.20 122.19 2e9j s ILE 60 Ca -0.05 -0.56 0.06 0.00 0.00 0.00 0.00 60.65 60.10 2e9j s ILE 60 Cb -0.18 -2.43 -0.04 0.00 0.01 0.00 0.00 42.46 39.82 2e9j s ILE 60 CO -0.07 0.50 -0.14 0.42 0.00 0.00 0.00 174.94 175.65 2e9j s THR 61 N 0.58 1.37 0.32 2.92 -4.23 -0.82 -2.60 115.64 113.19 2e9j s THR 61 Ca -0.06 -1.73 0.02 0.00 -1.18 0.00 0.00 61.69 58.74 2e9j s THR 61 Cb -0.15 -1.56 0.02 0.00 1.34 0.00 0.00 72.50 72.15 2e9j s THR 61 CO 0.03 -0.40 0.13 -0.90 -0.54 0.00 0.00 174.62 172.94 2e9j n ASP 62 N 0.52 2.42 -0.07 3.99 5.75 -1.23 -2.15 116.55 125.78 2e9j n ASP 62 Ca -0.15 -2.22 0.25 0.00 -0.01 0.00 0.00 54.79 52.66 2e9j n ASP 62 Cb 0.57 0.09 0.71 0.00 -1.03 0.00 0.00 41.12 41.46 2e9j n ASP 62 CO 0.00 0.00 0.00 0.06 -0.11 0.00 0.00 177.20 177.15 2e9j h GLN 63 N 0.00 0.00 0.00 0.11 3.07 -1.91 0.78 115.11 117.15 2e9j h GLN 63 Ca -0.23 0.00 -0.12 0.00 0.09 0.00 0.00 58.65 58.40 2e9j h GLN 63 Cb 0.76 0.00 -0.02 0.00 0.08 0.00 0.00 27.48 28.30 2e9j h GLN 63 CO 0.37 0.00 -0.55 1.49 0.09 0.00 0.00 178.83 180.23 2e9j h GLU 64 N 0.00 0.00 0.00 0.06 4.57 -1.94 -3.48 114.58 113.80 2e9j h GLU 64 Ca 0.33 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.51 2e9j h GLU 64 Cb 1.54 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 30.13 2e9j h GLU 64 CO -0.00 0.55 0.00 0.41 -1.18 0.00 0.00 179.01 178.79 2e9j n GLY 65 N 1.18 0.68 3.91 1.92 0.00 0.27 -5.06 105.19 108.09 2e9j n GLY 65 Ca 0.02 -0.16 -0.29 0.00 0.00 0.00 0.00 46.02 45.58 2e9j n GLY 65 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2e9j s LYS 66 N -0.60 3.58 0.03 1.61 -2.85 -1.26 -4.79 119.74 115.46 2e9j s LYS 66 Ca 0.00 -0.19 -0.30 0.00 -1.00 0.00 0.00 55.97 54.48 2e9j s LYS 66 Cb 0.00 -2.80 -0.06 0.00 -2.06 0.00 0.00 37.83 32.90 2e9j s LYS 66 CO 0.00 0.39 1.43 -1.25 0.10 0.00 0.00 175.35 176.01 2e9j s PRO 67 N -3.13 4.28 0.72 1.78 0.04 -1.26 -3.55 135.00 133.87 2e9j s PRO 67 Ca 0.40 2.03 -0.00 0.00 0.04 0.00 0.00 61.00 63.47 2e9j s PRO 67 Cb -0.11 -3.51 0.13 0.00 0.04 0.00 0.00 34.50 31.04 2e9j s PRO 67 CO 0.28 -0.56 0.99 0.15 0.04 0.00 0.00 177.00 177.89 2e9j s LYS 68 N 2.17 1.69 -0.38 4.56 -0.14 -1.07 -5.05 119.74 121.53 2e9j s LYS 68 Ca 0.65 -1.14 -0.17 0.00 -1.36 0.00 0.00 55.97 53.94 2e9j s LYS 68 Cb -0.33 -2.34 0.00 0.00 -1.68 0.00 0.00 37.83 33.48 2e9j s LYS 68 CO 0.28 -1.43 0.47 0.50 -0.76 0.00 0.00 175.35 174.41 2e9j s ARG 69 N -5.12 3.44 0.08 1.68 3.52 -1.26 -4.90 118.95 116.38 2e9j s ARG 69 Ca 0.66 -0.40 0.06 0.00 -0.13 0.00 0.00 55.73 55.93 2e9j s ARG 69 Cb -0.05 -3.86 -0.03 0.00 -1.56 0.00 0.00 34.95 29.44 2e9j s ARG 69 CO 0.44 -0.71 -0.16 0.00 -0.81 0.00 0.00 175.30 174.06 2e9j s ALA 70 N 2.28 1.37 -0.04 6.12 0.00 -1.26 -4.38 121.76 125.85 2e9j s ALA 70 Ca 0.16 -1.09 -0.02 0.00 0.00 0.00 0.00 51.96 51.02 2e9j s ALA 70 Cb -0.16 -0.14 -0.04 0.00 0.00 0.00 0.00 23.12 22.79 2e9j s ALA 70 CO 0.14 0.22 0.07 0.42 0.00 0.00 0.00 175.76 176.60 2e9j s ILE 71 N -1.30 4.73 -0.25 0.00 1.01 0.03 -4.99 121.20 120.43 2e9j s ILE 71 Ca 0.01 -0.30 -0.04 0.00 0.00 0.00 0.00 60.65 60.32 2e9j s ILE 71 Cb -0.10 -3.11 0.00 0.00 0.01 0.00 0.00 42.46 39.26 2e9j s ILE 71 CO 0.03 0.44 -0.00 0.54 0.00 0.00 0.00 174.94 175.95 2e9j s VAL 72 N -1.11 3.51 -0.25 2.92 0.11 -1.26 -2.23 120.40 122.10 2e9j s VAL 72 Ca 0.20 -0.65 -0.09 0.00 -2.93 0.00 0.00 61.98 58.51 2e9j s VAL 72 Cb -0.12 -2.71 -0.04 0.00 -1.53 0.00 0.00 36.38 31.99 2e9j s VAL 72 CO 0.10 0.26 0.12 -2.28 -3.33 0.00 0.00 175.10 169.97 2e9j s HIS 73 N 1.46 3.18 -0.37 1.54 2.46 0.10 -5.03 115.29 118.64 2e9j s HIS 73 Ca 0.04 -0.08 -0.13 0.00 0.47 0.00 0.00 55.06 55.35 2e9j s HIS 73 Cb -0.16 -2.26 0.01 0.00 -0.13 0.00 0.00 32.58 30.04 2e9j s HIS 73 CO -0.01 -0.16 0.25 0.16 -2.47 0.00 0.00 174.74 172.50 2e9j s ASP 74 N 1.39 5.95 -0.07 9.88 -4.77 -1.26 -2.70 116.67 125.09 2e9j s ASP 74 Ca 0.06 -0.72 0.15 0.00 -3.30 0.00 0.00 52.55 48.73 2e9j s ASP 74 Cb -0.15 -2.11 -0.23 0.00 -1.09 0.00 0.00 42.92 39.35 2e9j s ASP 74 CO 0.06 -0.34 0.53 0.59 0.70 0.00 0.00 175.17 176.71 2e9j n ASN 75 N 5.09 0.64 -2.18 2.11 3.02 -1.26 -4.97 115.26 117.71 2e9j n ASN 75 Ca -0.12 0.30 -0.18 0.00 -0.03 0.00 0.00 54.58 54.55 2e9j n ASN 75 Cb 0.48 0.26 -0.03 0.00 -0.61 0.00 0.00 39.78 39.88 2e9j n ASN 75 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 2e9j n LYS 76 N -2.94 -1.73 -0.31 3.52 4.76 -1.26 -4.83 118.16 115.37 2e9j n LYS 76 Ca -0.20 0.94 0.08 0.00 -2.87 0.00 0.00 58.31 56.26 2e9j n LYS 76 Cb 1.05 -5.51 0.15 0.00 -1.84 0.00 0.00 35.03 28.87 2e9j n LYS 76 CO 0.00 0.00 0.00 -0.25 -1.37 0.00 0.00 177.40 175.78 2e9j n ASP 77 N -1.73 1.94 0.00 4.39 8.00 -1.26 -4.95 116.55 122.94 2e9j n ASP 77 Ca -0.21 -3.22 0.00 0.00 0.71 0.00 0.00 54.79 52.07 2e9j n ASP 77 Cb 0.65 -0.44 0.00 0.00 -0.02 0.00 0.00 41.12 41.31 2e9j n ASP 77 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2e9j n GLY 78 N -1.17 3.19 3.87 0.44 0.00 -1.26 -5.03 105.19 105.23 2e9j n GLY 78 Ca 0.15 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.91 2e9j n GLY 78 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2e9j s THR 79 N -2.76 1.76 -0.08 2.61 -4.23 -1.26 -3.80 115.64 107.88 2e9j s THR 79 Ca 0.00 -1.55 -0.12 0.00 -1.18 0.00 0.00 61.69 58.84 2e9j s THR 79 Cb 0.00 -2.31 0.03 0.00 1.34 0.00 0.00 72.50 71.56 2e9j s THR 79 CO 0.00 0.00 0.31 -0.31 -0.54 0.00 0.00 174.62 174.08 2e9j s TYR 80 N -2.74 -0.28 -0.05 3.99 1.51 -1.10 -4.22 117.35 114.47 2e9j s TYR 80 Ca 0.33 0.63 0.06 0.00 -1.01 0.00 0.00 57.07 57.08 2e9j s TYR 80 Cb -0.01 0.11 -0.01 0.00 -0.11 0.00 0.00 41.96 41.93 2e9j s TYR 80 CO 0.20 -0.25 -0.23 0.00 -1.11 0.00 0.00 175.55 174.16 2e9j s ALA 81 N -0.39 2.02 -0.06 3.71 0.00 -1.10 -1.32 121.76 124.62 2e9j s ALA 81 Ca -0.05 -0.97 0.00 0.00 0.00 0.00 0.00 51.96 50.94 2e9j s ALA 81 Cb -0.03 -0.63 0.02 0.00 0.00 0.00 0.00 23.12 22.48 2e9j s ALA 81 CO 0.02 0.39 -0.05 0.08 0.00 0.00 0.00 175.76 176.20 2e9j s VAL 82 N -0.14 0.68 -0.10 0.00 1.01 -1.23 0.00 120.40 120.61 2e9j s VAL 82 Ca -0.03 -0.15 -0.05 0.00 0.00 0.00 0.00 61.98 61.75 2e9j s VAL 82 Cb -0.13 -0.71 -0.04 0.00 0.00 0.00 0.00 36.38 35.50 2e9j s VAL 82 CO 0.03 0.28 0.07 -0.89 0.00 0.00 0.00 175.10 174.59 2e9j s THR 83 N 1.23 4.94 -0.16 3.92 2.01 -0.95 -3.12 115.64 123.51 2e9j s THR 83 Ca -0.06 -0.01 -0.07 0.00 0.31 0.00 0.00 61.69 61.86 2e9j s THR 83 Cb -0.14 -3.12 0.06 0.00 0.01 0.00 0.00 72.50 69.32 2e9j s THR 83 CO -0.02 0.61 0.36 -0.72 -0.69 0.00 0.00 174.62 174.16 2e9j s TYR 84 N -0.94 -0.56 -0.53 4.92 -0.85 -0.98 -0.79 117.35 117.62 2e9j s TYR 84 Ca 0.14 1.19 -0.08 0.00 -0.52 0.00 0.00 57.07 57.80 2e9j s TYR 84 Cb -0.12 0.19 0.14 0.00 0.38 0.00 0.00 41.96 42.55 2e9j s TYR 84 CO 0.03 -0.35 0.39 0.42 -1.52 0.00 0.00 175.55 174.53 2e9j s ILE 85 N 1.70 4.15 -0.40 -3.49 1.01 -1.26 -3.18 121.20 119.73 2e9j s ILE 85 Ca -0.07 -2.12 -0.28 0.00 0.00 0.00 0.00 60.65 58.18 2e9j s ILE 85 Cb -0.10 -3.72 -0.01 0.00 0.01 0.00 0.00 42.46 38.64 2e9j s ILE 85 CO -0.11 -0.81 1.73 -2.16 0.00 0.00 0.00 174.94 173.58 2e9j s PRO 86 N 0.94 3.25 -0.01 2.79 0.04 -1.26 -4.86 135.00 135.88 2e9j s PRO 86 Ca 0.09 1.16 -0.09 0.00 0.04 0.00 0.00 61.00 62.20 2e9j s PRO 86 Cb -0.23 -4.20 -0.31 0.00 0.04 0.00 0.00 34.50 29.80 2e9j s PRO 86 CO -0.03 -1.97 0.82 0.38 0.04 0.00 0.00 177.00 176.24 2e9j h ASP 87 N 12.82 0.60 -3.10 6.66 2.03 -1.98 -2.76 116.42 130.70 2e9j h ASP 87 Ca -0.31 -0.79 -0.60 0.00 -0.73 0.00 0.00 57.03 54.60 2e9j h ASP 87 Cb 1.15 -0.19 -0.05 0.00 -0.83 0.00 0.00 39.33 39.41 2e9j h ASP 87 CO 1.08 1.65 -0.15 -0.54 -1.03 0.00 0.00 179.24 180.25 2e9j s LYS 88 N -2.60 4.02 -0.17 4.15 -0.14 -1.26 -4.80 119.74 118.94 2e9j s LYS 88 Ca -0.12 0.51 -0.13 0.00 -1.36 0.00 0.00 55.97 54.88 2e9j s LYS 88 Cb 0.06 -3.24 -0.05 0.00 -1.68 0.00 0.00 37.83 32.92 2e9j s LYS 88 CO 0.88 0.65 0.25 0.95 -0.76 0.00 0.00 175.35 177.32 2e9j s THR 89 N -1.00 5.33 0.00 2.17 -4.23 -1.26 -4.91 115.64 111.74 2e9j s THR 89 Ca 0.25 0.46 0.00 0.00 -1.18 0.00 0.00 61.69 61.22 2e9j s THR 89 Cb -0.17 -3.59 0.00 0.00 1.34 0.00 0.00 72.50 70.07 2e9j s THR 89 CO 0.15 0.40 0.00 0.61 -0.54 0.00 0.00 174.62 175.24 2e9j n GLY 90 N 3.43 -0.51 3.52 3.99 0.00 -1.26 -5.01 105.19 109.35 2e9j n GLY 90 Ca -0.13 0.10 -0.34 0.00 0.00 0.00 0.00 46.02 45.65 2e9j n GLY 90 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2e9j s ARG 91 N 0.00 3.18 -0.08 1.61 1.70 -1.26 -3.25 118.95 120.85 2e9j s ARG 91 Ca 0.00 -0.56 0.03 0.00 -0.47 0.00 0.00 55.73 54.73 2e9j s ARG 91 Cb 0.00 -2.71 0.01 0.00 -0.57 0.00 0.00 34.95 31.68 2e9j s ARG 91 CO 0.00 0.44 -0.18 0.71 -1.08 0.00 0.00 175.30 175.19 2e9j s TYR 92 N -0.20 1.95 -0.18 5.89 2.02 -0.90 -2.82 117.35 123.11 2e9j s TYR 92 Ca 0.02 -0.75 0.01 0.00 -0.37 0.00 0.00 57.07 55.98 2e9j s TYR 92 Cb -0.13 -1.35 0.02 0.00 -0.40 0.00 0.00 41.96 40.10 2e9j s TYR 92 CO 0.03 -0.33 -0.19 1.41 -1.57 0.00 0.00 175.55 174.90 2e9j s MET 93 N 0.48 3.02 -0.26 -0.62 1.75 -0.91 -2.41 119.30 120.34 2e9j s MET 93 Ca -0.16 -0.82 -0.05 0.00 -1.25 0.00 0.00 55.69 53.42 2e9j s MET 93 Cb -0.16 -2.58 0.01 0.00 2.84 0.00 0.00 34.83 34.93 2e9j s MET 93 CO 0.06 -0.18 0.01 0.42 -0.65 0.00 0.00 175.02 174.68 2e9j s ILE 94 N 1.24 3.58 -0.68 10.11 1.01 -1.12 -1.94 121.20 133.39 2e9j s ILE 94 Ca 0.04 -0.67 -0.11 0.00 0.00 0.00 0.00 60.65 59.91 2e9j s ILE 94 Cb -0.13 -2.77 0.18 0.00 0.01 0.00 0.00 42.46 39.75 2e9j s ILE 94 CO -0.11 0.22 0.59 -0.83 0.00 0.00 0.00 174.94 174.81 2e9j s GLY 95 N 1.46 2.45 0.04 6.18 0.00 -0.29 -1.78 107.32 115.37 2e9j s GLY 95 Ca 0.03 -3.08 -0.28 0.00 0.00 0.00 0.00 44.72 41.39 2e9j s GLY 95 CO -0.01 1.19 0.89 0.14 0.00 0.00 0.00 173.10 175.32 2e9j s VAL 96 N 0.49 4.74 0.07 1.40 1.01 -1.26 -3.50 120.40 123.36 2e9j s VAL 96 Ca 0.14 1.90 0.06 0.00 0.00 0.00 0.00 61.98 64.08 2e9j s VAL 96 Cb -0.18 -4.24 -0.03 0.00 0.00 0.00 0.00 36.38 31.93 2e9j s VAL 96 CO -0.05 0.27 -0.17 0.42 0.00 0.00 0.00 175.10 175.57 2e9j s THR 97 N 0.43 1.35 -0.10 3.92 -4.23 -1.08 -2.59 115.64 113.33 2e9j s THR 97 Ca 0.46 -1.32 -0.01 0.00 -1.18 0.00 0.00 61.69 59.63 2e9j s THR 97 Cb -0.21 -1.24 0.03 0.00 1.34 0.00 0.00 72.50 72.42 2e9j s THR 97 CO 0.26 -0.10 -0.00 -0.47 -0.54 0.00 0.00 174.62 173.77 2e9j s TYR 98 N -1.13 0.86 -1.34 3.99 5.04 0.42 -2.15 117.35 123.04 2e9j s TYR 98 Ca 0.02 -0.38 -0.07 0.00 -2.44 0.00 0.00 57.07 54.19 2e9j s TYR 98 Cb -0.10 -0.91 0.01 0.00 0.35 0.00 0.00 41.96 41.32 2e9j s TYR 98 CO 0.03 -0.41 1.12 0.41 -1.34 0.00 0.00 175.55 175.36 2e9j n GLY 99 N 5.10 -0.50 2.29 8.97 0.00 -1.06 -1.99 105.19 118.01 2e9j n GLY 99 Ca -0.08 0.22 -0.13 0.00 0.00 0.00 0.00 46.02 46.03 2e9j n GLY 99 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2e9j n GLY 100 N -1.79 -0.14 2.92 -0.02 0.00 -1.26 -4.99 105.19 99.90 2e9j n GLY 100 Ca -0.06 -0.33 -0.15 0.00 0.00 0.00 0.00 46.02 45.49 2e9j n GLY 100 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2e9j s ASP 101 N -2.50 0.64 0.17 1.61 1.11 -0.84 -5.13 116.67 111.73 2e9j s ASP 101 Ca 0.03 0.35 -0.31 0.00 0.18 0.00 0.00 52.55 52.81 2e9j s ASP 101 Cb -0.02 0.59 -0.09 0.00 1.07 0.00 0.00 42.92 44.48 2e9j s ASP 101 CO 0.04 -0.26 1.36 1.51 1.18 0.00 0.00 175.17 179.00 2e9j s ASP 102 N 2.39 6.84 0.71 0.27 1.47 -1.26 -0.44 116.67 126.65 2e9j s ASP 102 Ca 0.03 2.40 -0.15 0.00 1.18 0.00 0.00 52.55 56.02 2e9j s ASP 102 Cb -0.13 -2.60 0.03 0.00 -0.34 0.00 0.00 42.92 39.88 2e9j s ASP 102 CO -0.09 -0.60 1.16 0.27 0.68 0.00 0.00 175.17 176.59 2e9j s ILE 103 N 0.50 2.69 -2.00 2.11 -4.36 -1.07 -4.87 121.20 114.19 2e9j s ILE 103 Ca 0.60 0.32 0.11 0.00 -0.26 0.00 0.00 60.65 61.42 2e9j s ILE 103 Cb -0.37 -2.84 0.31 0.00 1.25 0.00 0.00 42.46 40.81 2e9j s ILE 103 CO 0.36 -0.20 1.09 -0.81 0.24 0.00 0.00 174.94 175.62 2e9j n PRO 104 N -2.69 0.49 -0.08 0.37 -0.04 -1.26 -2.22 135.00 129.57 2e9j n PRO 104 Ca 0.12 0.00 -0.06 0.00 -0.04 0.00 0.00 63.50 63.52 2e9j n PRO 104 Cb 0.51 -1.35 -0.16 0.00 -0.04 0.00 0.00 33.50 32.46 2e9j n PRO 104 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 2e9j n LEU 105 N -0.85 0.00 -4.86 1.53 4.77 -1.26 -4.97 117.00 111.35 2e9j n LEU 105 Ca 0.08 0.00 -0.31 0.00 -0.03 0.00 0.00 56.01 55.75 2e9j n LEU 105 Cb 0.04 0.41 -0.03 0.00 -2.33 0.00 0.00 43.42 41.50 2e9j n LEU 105 CO 0.06 0.41 0.54 -0.94 -1.33 0.00 0.00 177.39 176.13 2e9j s SER 106 N -5.29 6.56 1.19 -1.43 1.04 -0.94 -4.40 113.70 110.42 2e9j s SER 106 Ca -0.10 1.32 -0.16 0.00 0.48 0.00 0.00 55.95 57.49 2e9j s SER 106 Cb 0.07 -2.40 0.23 0.00 0.10 0.00 0.00 66.02 64.02 2e9j s SER 106 CO 0.84 -0.48 0.82 -0.81 0.98 0.00 0.00 173.24 174.59 2e9j n PRO 107 N -1.44 -2.63 -4.58 4.02 -0.04 -1.26 -4.88 135.00 124.19 2e9j n PRO 107 Ca 0.04 -1.32 -0.30 0.00 -0.04 0.00 0.00 63.50 61.88 2e9j n PRO 107 Cb 0.54 -1.24 -0.17 0.00 -0.04 0.00 0.00 33.50 32.60 2e9j n PRO 107 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 2e9j s TYR 108 N -2.49 2.24 -0.22 0.54 1.51 -0.74 -4.91 117.35 113.28 2e9j s TYR 108 Ca 0.54 -1.07 -0.17 0.00 -1.01 0.00 0.00 57.07 55.35 2e9j s TYR 108 Cb -0.05 -1.57 -0.03 0.00 -0.11 0.00 0.00 41.96 40.20 2e9j s TYR 108 CO 0.41 -0.52 0.46 -0.98 -1.11 0.00 0.00 175.55 173.82 2e9j s ARG 109 N 0.88 4.15 0.05 -0.62 1.70 -1.26 -2.81 118.95 121.04 2e9j s ARG 109 Ca -0.08 0.29 -0.04 0.00 -0.47 0.00 0.00 55.73 55.43 2e9j s ARG 109 Cb -0.15 -3.58 -0.02 0.00 -0.57 0.00 0.00 34.95 30.63 2e9j s ARG 109 CO -0.01 -0.16 0.05 0.42 -1.08 0.00 0.00 175.30 174.53 2e9j s ILE 110 N 1.68 0.17 -0.06 4.99 1.01 -1.01 -4.85 121.20 123.13 2e9j s ILE 110 Ca 0.21 -1.37 0.00 0.00 0.00 0.00 0.00 60.65 59.50 2e9j s ILE 110 Cb -0.15 -1.16 0.02 0.00 0.01 0.00 0.00 42.46 41.18 2e9j s ILE 110 CO 0.09 -0.75 -0.05 -0.13 0.00 0.00 0.00 174.94 174.10 2e9j s ARG 111 N -3.23 0.95 -0.47 2.79 3.00 -1.26 -2.12 118.95 118.61 2e9j s ARG 111 Ca 0.00 -0.10 -0.28 0.00 0.00 0.00 0.00 55.73 55.35 2e9j s ARG 111 Cb 0.03 -1.03 0.03 0.00 0.00 0.00 0.00 34.95 33.98 2e9j s ARG 111 CO -0.07 -0.15 1.10 0.00 0.00 0.00 0.00 175.30 176.18 2e9j s ALA 112 N 1.25 3.18 -0.32 2.13 0.00 -1.20 -1.89 121.76 124.91 2e9j s ALA 112 Ca -0.05 -0.52 -0.29 0.00 0.00 0.00 0.00 51.96 51.09 2e9j s ALA 112 Cb -0.14 -3.85 0.02 0.00 0.00 0.00 0.00 23.12 19.15 2e9j s ALA 112 CO -0.02 -2.21 1.10 0.95 0.00 0.00 0.00 175.76 175.58 2e9j s THR 113 N 4.32 4.48 -0.48 0.00 -4.23 0.13 -4.38 115.64 115.47 2e9j s THR 113 Ca 0.46 1.70 -0.02 0.00 -1.18 0.00 0.00 61.69 62.65 2e9j s THR 113 Cb -0.08 -4.39 0.22 0.00 1.34 0.00 0.00 72.50 69.60 2e9j s THR 113 CO 0.31 -0.47 2.27 1.67 -0.54 0.00 0.00 174.62 177.85 2e9j n GLN 114 N 6.90 2.26 -1.96 3.99 -0.06 -1.26 -1.74 117.38 125.51 2e9j n GLN 114 Ca 0.12 -2.33 -0.42 0.00 -2.00 0.00 0.00 57.00 52.37 2e9j n GLN 114 Cb 0.47 -1.98 -0.03 0.00 -4.06 0.00 0.00 30.24 24.65 2e9j n GLN 114 CO 0.00 0.00 0.00 0.95 -0.20 0.00 0.00 177.06 177.81 2e9j s THR 115 N -3.03 3.02 0.00 1.69 -4.23 -1.26 -4.76 115.64 107.07 2e9j s THR 115 Ca 0.48 0.54 0.00 0.00 -1.18 0.00 0.00 61.69 61.53 2e9j s THR 115 Cb 0.36 -3.34 0.00 0.00 1.34 0.00 0.00 72.50 70.85 2e9j s THR 115 CO -0.12 0.01 0.00 0.61 -0.54 0.00 0.00 174.62 174.58 2e9j n GLY 116 N 3.92 -0.00 3.51 3.99 0.00 -1.26 -5.00 105.19 110.34 2e9j n GLY 116 Ca 0.15 -2.25 -0.14 0.00 0.00 0.00 0.00 46.02 43.78 2e9j n GLY 116 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2e9j s ASP 117 N -4.00 -0.62 0.24 1.61 2.15 -1.26 -5.15 116.67 109.63 2e9j s ASP 117 Ca 0.00 1.10 -0.30 0.00 0.43 0.00 0.00 52.55 53.79 2e9j s ASP 117 Cb 0.00 1.10 -0.09 0.00 -0.30 0.00 0.00 42.92 43.63 2e9j s ASP 117 CO 0.00 -0.29 1.21 0.00 -0.17 0.00 0.00 175.17 175.93 2e9j s ALA 118 N 0.01 3.46 0.00 3.66 0.00 -1.26 -5.31 121.76 122.32 2e9j s ALA 118 Ca -0.02 1.02 0.00 0.00 0.00 0.00 0.00 51.96 52.96 2e9j s ALA 118 Cb -0.04 -3.42 0.00 0.00 0.00 0.00 0.00 23.12 19.67 2e9j s ALA 118 CO 0.02 -0.40 0.14 0.45 0.00 0.00 0.00 175.76 175.97