#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1qip n GLU 2 N 0.00 0.18 -2.13 0.00 4.07 -1.26 -5.05 120.64 116.45 1qip n GLU 2 Ca 0.00 0.07 -0.38 0.00 -0.06 0.00 0.00 57.16 56.79 1qip n GLU 2 Cb 0.00 -0.82 -0.00 0.00 -0.06 0.00 0.00 31.44 30.56 1qip n GLU 2 CO 0.00 0.00 0.00 -1.25 -0.06 0.00 0.00 177.13 175.82 1qip s PRO 3 N -2.30 3.80 0.04 5.31 0.04 -1.26 -4.93 135.00 135.70 1qip s PRO 3 Ca -0.10 1.97 -0.30 0.00 0.04 0.00 0.00 61.00 62.61 1qip s PRO 3 Cb 0.02 -2.55 -0.08 0.00 0.04 0.00 0.00 34.50 31.92 1qip s PRO 3 CO 0.15 -0.57 1.83 -1.14 0.04 0.00 0.00 177.00 177.31 1qip s GLN 4 N -2.49 4.16 0.63 4.56 0.74 -1.26 -4.92 119.66 121.08 1qip s GLN 4 Ca 0.61 2.48 -0.18 0.00 0.05 0.00 0.00 55.36 58.32 1qip s GLN 4 Cb -0.34 -3.95 -0.02 0.00 1.10 0.00 0.00 33.01 29.81 1qip s GLN 4 CO 0.42 -0.88 1.25 -1.25 -0.55 0.00 0.00 175.29 174.28 1qip s PRO 5 N 3.82 2.69 0.66 1.67 0.04 -1.26 -4.96 135.00 137.65 1qip s PRO 5 Ca 0.82 1.94 -0.18 0.00 0.04 0.00 0.00 61.00 63.62 1qip s PRO 5 Cb -0.41 -1.88 -0.00 0.00 0.04 0.00 0.00 34.50 32.25 1qip s PRO 5 CO 0.37 -1.46 1.27 -2.14 0.04 0.00 0.00 177.00 175.08 1qip s PRO 6 N -3.41 2.50 0.27 0.56 0.02 -1.26 -4.95 135.00 128.74 1qip s PRO 6 Ca 0.80 1.99 -0.29 0.00 0.02 0.00 0.00 61.00 63.51 1qip s PRO 6 Cb -0.34 -1.85 -0.09 0.00 0.02 0.00 0.00 34.50 32.24 1qip s PRO 6 CO 0.37 -1.62 1.12 -1.12 -0.33 0.00 0.00 177.00 175.43 1qip s SER 7 N -1.53 7.21 0.00 2.53 0.01 -1.26 -5.01 113.70 115.66 1qip s SER 7 Ca 0.81 2.30 0.00 0.00 1.31 0.00 0.00 55.95 60.36 1qip s SER 7 Cb -0.35 -2.63 0.00 0.00 0.21 0.00 0.00 66.02 63.25 1qip s SER 7 CO 0.40 -0.19 0.00 0.61 0.41 0.00 0.00 173.24 174.47 1qip n GLY 8 N 1.26 5.17 3.85 3.44 0.00 -1.26 -5.12 105.19 112.53 1qip n GLY 8 Ca -0.01 -1.64 -0.32 0.00 0.00 0.00 0.00 46.02 44.06 1qip n GLY 8 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1qip s GLY 9 N 0.00 2.14 0.35 -0.02 0.00 -1.26 -5.03 107.32 103.50 1qip s GLY 9 Ca 0.00 0.11 -0.26 0.00 0.00 0.00 0.00 44.72 44.57 1qip s GLY 9 CO 0.00 0.35 1.04 1.08 0.00 0.00 0.00 173.10 175.57 1qip s LEU 10 N -3.67 4.29 0.85 0.66 1.43 -1.26 -5.04 118.68 115.95 1qip s LEU 10 Ca 0.57 2.07 -0.12 0.00 -1.03 0.00 0.00 54.13 55.62 1qip s LEU 10 Cb -0.10 -4.00 0.10 0.00 0.03 0.00 0.00 46.19 42.22 1qip s LEU 10 CO 0.26 -0.33 1.10 0.42 0.23 0.00 0.00 176.35 178.03 1qip s THR 11 N -1.51 2.76 0.26 5.49 -4.23 -1.26 -4.84 115.64 112.30 1qip s THR 11 Ca 0.53 0.25 -0.05 0.00 -1.18 0.00 0.00 61.69 61.24 1qip s THR 11 Cb -0.24 -2.88 0.26 0.00 1.34 0.00 0.00 72.50 70.98 1qip s THR 11 CO 0.31 -0.32 1.92 0.44 -0.54 0.00 0.00 174.62 176.42 1qip h ASP 12 N -1.34 1.11 -0.36 3.99 3.32 -2.00 -1.47 116.42 119.68 1qip h ASP 12 Ca -0.49 -0.02 -0.04 0.00 0.02 0.00 0.00 57.03 56.51 1qip h ASP 12 Cb 1.28 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 40.56 1qip h ASP 12 CO 0.58 0.78 0.08 -0.33 -1.72 0.00 0.00 179.24 178.62 1qip h GLU 13 N 1.30 0.58 -0.74 3.56 3.07 -1.99 -1.73 114.58 118.64 1qip h GLU 13 Ca 0.39 -0.15 -0.01 0.00 -0.50 0.00 0.00 59.36 59.09 1qip h GLU 13 Cb -0.05 -0.07 -0.03 0.00 -0.84 0.00 0.00 28.75 27.75 1qip h GLU 13 CO -0.11 0.63 0.41 0.00 -1.40 0.00 0.00 179.01 178.55 1qip h ALA 14 N 0.92 0.94 -0.05 3.43 0.00 -1.75 -0.65 119.26 122.12 1qip h ALA 14 Ca 0.11 -0.11 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 1qip h ALA 14 Cb 0.32 -0.30 -0.00 0.00 0.00 0.00 0.00 17.79 17.81 1qip h ALA 14 CO 0.00 0.45 0.03 0.00 0.00 0.00 0.00 179.25 179.73 1qip h ALA 15 N 1.21 0.06 -0.08 0.00 0.00 -1.20 -2.81 119.26 116.44 1qip h ALA 15 Ca 0.26 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 55.12 1qip h ALA 15 Cb 0.02 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 1qip h ALA 15 CO -0.04 -0.43 -0.09 -0.07 0.00 0.00 0.00 179.25 178.61 1qip h LEU 16 N 0.03 0.11 -2.52 0.00 3.38 -0.96 -1.49 115.31 113.87 1qip h LEU 16 Ca 0.02 -0.02 -0.00 0.00 0.09 0.00 0.00 57.88 57.97 1qip h LEU 16 Cb 0.03 -0.03 -0.00 0.00 0.09 0.00 0.00 40.66 40.75 1qip h LEU 16 CO -0.00 0.23 -0.01 0.77 0.09 0.00 0.00 178.44 179.51 1qip h SER 17 N 0.12 0.00 -0.37 -0.43 4.64 -0.86 -1.24 113.55 115.41 1qip h SER 17 Ca 0.03 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.35 1qip h SER 17 Cb 0.25 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.34 1qip h SER 17 CO 0.01 0.01 0.00 0.00 -0.87 0.00 0.00 176.83 175.99 1qip s SER 20 N -0.31 4.27 0.74 0.00 0.01 -1.26 -5.01 113.70 112.15 1qip s SER 20 Ca 0.10 -0.36 -0.15 0.00 1.31 0.00 0.00 55.95 56.85 1qip s SER 20 Cb -0.12 -0.81 0.05 0.00 0.21 0.00 0.00 66.02 65.35 1qip s SER 20 CO 0.01 0.21 1.20 -1.81 0.41 0.00 0.00 173.24 173.26 1qip s ASP 21 N -1.89 4.15 0.02 2.44 1.01 -1.26 -4.91 116.67 116.23 1qip s ASP 21 Ca 0.19 2.32 -0.30 0.00 0.71 0.00 0.00 52.55 55.46 1qip s ASP 21 Cb -0.11 -2.58 -0.06 0.00 1.01 0.00 0.00 42.92 41.18 1qip s ASP 21 CO 0.10 -2.29 1.40 0.00 0.21 0.00 0.00 175.17 174.59 1qip s ALA 22 N -2.07 3.58 0.42 5.23 0.00 -1.26 -4.99 121.76 122.67 1qip s ALA 22 Ca 0.73 0.93 -0.25 0.00 0.00 0.00 0.00 51.96 53.36 1qip s ALA 22 Cb -0.28 -3.58 -0.08 0.00 0.00 0.00 0.00 23.12 19.17 1qip s ALA 22 CO 0.46 -0.85 1.29 0.34 0.00 0.00 0.00 175.76 176.99 1qip s ASP 23 N 1.75 6.26 0.55 0.00 2.15 -1.26 -4.90 116.67 121.21 1qip s ASP 23 Ca 0.64 2.61 0.27 0.00 0.43 0.00 0.00 52.55 56.50 1qip s ASP 23 Cb -0.32 -2.63 1.45 0.00 -0.30 0.00 0.00 42.92 41.11 1qip s ASP 23 CO 0.27 -0.88 1.99 -0.65 -0.17 0.00 0.00 175.17 175.72 1qip h PRO 24 N 2.56 0.00 0.00 4.34 0.11 -2.02 -0.96 132.00 136.04 1qip h PRO 24 Ca -0.50 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.60 1qip h PRO 24 Cb 1.25 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.36 1qip h PRO 24 CO 0.62 0.00 -0.05 0.66 -0.21 0.00 0.00 178.00 179.02 1qip h SER 25 N 0.00 0.00 -0.57 -2.05 4.64 -2.04 -2.34 113.55 111.20 1qip h SER 25 Ca 0.24 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.56 1qip h SER 25 Cb 1.02 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.11 1qip h SER 25 CO -0.00 0.05 0.00 0.35 -0.87 0.00 0.00 176.83 176.35 1qip n THR 26 N -3.37 0.75 0.30 2.95 -2.24 -0.36 -4.68 114.28 107.63 1qip n THR 26 Ca -0.02 -0.83 0.17 0.00 -2.27 0.00 0.00 64.05 61.10 1qip n THR 26 Cb 0.18 0.61 0.94 0.00 -2.10 0.00 0.00 70.33 69.96 1qip n THR 26 CO 0.00 0.00 0.00 0.07 -0.57 0.00 0.00 175.07 174.57 1qip h LYS 27 N 4.05 0.00 -0.44 -0.78 2.10 -1.51 -1.59 116.57 118.39 1qip h LYS 27 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 1qip h LYS 27 Cb 0.91 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.24 1qip h LYS 27 CO 0.00 0.03 0.00 -0.25 -2.00 0.00 0.00 179.45 177.23 1qip n ASP 28 N -3.56 3.22 -4.77 7.07 8.00 -1.26 -5.00 116.55 120.24 1qip n ASP 28 Ca -0.03 -1.95 -0.37 0.00 0.71 0.00 0.00 54.79 53.15 1qip n ASP 28 Cb 0.13 -0.29 -0.00 0.00 -0.02 0.00 0.00 41.12 40.94 1qip n ASP 28 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 1qip s PHE 29 N -1.05 2.78 0.02 1.24 0.40 -0.60 -5.04 117.98 115.73 1qip s PHE 29 Ca 0.32 1.51 0.00 0.00 -0.60 0.00 0.00 56.93 58.16 1qip s PHE 29 Cb 0.17 -3.44 -0.02 0.00 0.51 0.00 0.00 43.02 40.24 1qip s PHE 29 CO 0.23 -1.71 -0.03 -0.48 0.70 0.00 0.00 175.22 173.93 1qip s LEU 30 N -3.12 2.24 -0.62 -0.37 0.05 -1.26 -5.10 118.68 110.50 1qip s LEU 30 Ca 0.65 -0.50 -0.24 0.00 0.05 0.00 0.00 54.13 54.09 1qip s LEU 30 Cb -0.30 0.10 0.05 0.00 -2.05 0.00 0.00 46.19 43.99 1qip s LEU 30 CO 0.36 -0.30 1.00 -0.22 -0.55 0.00 0.00 176.35 176.65 1qip s LEU 31 N -1.45 4.07 -0.08 1.48 2.96 -1.26 -4.89 118.68 119.51 1qip s LEU 31 Ca -0.16 -0.60 -0.03 0.00 -0.22 0.00 0.00 54.13 53.12 1qip s LEU 31 Cb -0.10 -2.64 -0.26 0.00 0.50 0.00 0.00 46.19 43.69 1qip s LEU 31 CO -0.01 -1.40 0.51 -0.61 -1.32 0.00 0.00 176.35 173.52 1qip h GLN 32 N 9.51 0.22 -3.39 1.98 -0.00 -1.94 -2.59 115.11 118.91 1qip h GLN 32 Ca -0.27 -0.38 -0.04 0.00 -0.00 0.00 0.00 58.65 57.95 1qip h GLN 32 Cb 1.07 0.14 -0.12 0.00 0.00 0.00 0.00 27.48 28.57 1qip h GLN 32 CO 1.15 1.06 -0.05 1.14 0.00 0.00 0.00 178.83 182.14 1qip s GLN 33 N -2.58 1.19 -0.10 1.69 -2.07 -1.26 -1.13 119.66 115.40 1qip s GLN 33 Ca -0.17 -0.79 0.02 0.00 -1.82 0.00 0.00 55.36 52.60 1qip s GLN 33 Cb 0.07 0.48 0.01 0.00 -1.09 0.00 0.00 33.01 32.48 1qip s GLN 33 CO 0.80 -0.48 -0.15 0.99 -1.32 0.00 0.00 175.29 175.13 1qip s THR 34 N -3.84 1.48 -0.19 3.63 2.01 -0.87 -4.94 115.64 112.92 1qip s THR 34 Ca 0.06 -0.64 -0.09 0.00 0.31 0.00 0.00 61.69 61.34 1qip s THR 34 Cb 0.01 -1.34 -0.04 0.00 0.01 0.00 0.00 72.50 71.13 1qip s THR 34 CO -0.08 0.44 0.09 -0.32 -0.69 0.00 0.00 174.62 174.06 1qip s MET 35 N 0.89 4.07 -0.03 4.92 1.75 -1.26 -0.61 119.30 129.03 1qip s MET 35 Ca -0.09 -0.29 0.03 0.00 -1.25 0.00 0.00 55.69 54.09 1qip s MET 35 Cb -0.15 -3.30 0.00 0.00 2.84 0.00 0.00 34.83 34.22 1qip s MET 35 CO 0.00 0.28 -0.11 -0.51 -0.65 0.00 0.00 175.02 174.03 1qip s LEU 36 N 0.37 1.82 0.06 4.11 1.43 -0.53 -4.97 118.68 120.97 1qip s LEU 36 Ca 0.05 -0.24 -0.26 0.00 -1.03 0.00 0.00 54.13 52.66 1qip s LEU 36 Cb -0.12 -0.67 -0.06 0.00 0.03 0.00 0.00 46.19 45.37 1qip s LEU 36 CO -0.01 0.09 0.81 -0.13 0.23 0.00 0.00 176.35 177.34 1qip s ARG 37 N 0.16 4.54 -0.04 1.70 0.52 -1.26 -1.12 118.95 123.45 1qip s ARG 37 Ca -0.03 1.15 0.06 0.00 -0.52 0.00 0.00 55.73 56.39 1qip s ARG 37 Cb -0.10 -3.36 -0.01 0.00 0.52 0.00 0.00 34.95 32.00 1qip s ARG 37 CO 0.01 0.28 -0.22 0.14 0.02 0.00 0.00 175.30 175.53 1qip s VAL 38 N -0.09 1.80 0.17 3.52 -7.23 -0.09 -4.87 120.40 113.62 1qip s VAL 38 Ca 0.40 -0.94 -0.08 0.00 -1.81 0.00 0.00 61.98 59.55 1qip s VAL 38 Cb -0.21 -1.52 0.01 0.00 0.56 0.00 0.00 36.38 35.22 1qip s VAL 38 CO 0.25 0.51 1.57 0.50 -0.31 0.00 0.00 175.10 177.61 1qip h LYS 39 N 6.03 0.94 -3.23 4.82 3.64 -1.95 -3.40 116.57 123.41 1qip h LYS 39 Ca -0.34 -0.40 -0.50 0.00 -1.27 0.00 0.00 60.65 58.14 1qip h LYS 39 Cb 1.17 -0.03 -0.40 0.00 -0.41 0.00 0.00 32.23 32.55 1qip h LYS 39 CO 0.47 1.06 -0.76 0.34 -2.27 0.00 0.00 179.45 178.29 1qip s ASP 40 N -6.74 2.88 0.47 4.20 -1.08 -1.26 -2.25 116.67 112.89 1qip s ASP 40 Ca -0.11 -0.88 0.14 0.00 -0.52 0.00 0.00 52.55 51.18 1qip s ASP 40 Cb 0.12 -0.44 1.08 0.00 -1.46 0.00 0.00 42.92 42.23 1qip s ASP 40 CO 0.86 -0.35 2.06 1.55 0.52 0.00 0.00 175.17 179.81 1qip h PRO 41 N 8.33 0.07 -0.42 4.34 0.13 -1.97 -1.79 132.00 140.68 1qip h PRO 41 Ca -0.16 -0.01 -0.03 0.00 -0.87 0.00 0.00 66.00 64.93 1qip h PRO 41 Cb 1.11 -0.01 -0.02 0.00 0.13 0.00 0.00 31.00 32.21 1qip h PRO 41 CO 0.35 0.14 0.16 0.87 -0.23 0.00 0.00 178.00 179.28 1qip h LYS 42 N 0.07 0.63 -0.41 0.86 1.57 -1.99 0.31 116.57 117.61 1qip h LYS 42 Ca 0.02 -0.12 -0.11 0.00 -1.87 0.00 0.00 60.65 58.56 1qip h LYS 42 Cb 0.16 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.36 1qip h LYS 42 CO 0.01 0.60 -0.17 0.87 -0.57 0.00 0.00 179.45 180.18 1qip h LYS 43 N 0.54 0.85 -0.53 3.15 1.57 -1.90 -2.13 116.57 118.11 1qip h LYS 43 Ca 0.14 -0.36 -0.08 0.00 -1.87 0.00 0.00 60.65 58.48 1qip h LYS 43 Cb 0.21 -0.03 -0.02 0.00 0.08 0.00 0.00 32.23 32.47 1qip h LYS 43 CO -0.01 1.00 0.02 0.77 -0.57 0.00 0.00 179.45 180.66 1qip h SER 44 N 0.66 0.90 -0.45 0.86 0.02 -1.07 -0.81 113.55 113.66 1qip h SER 44 Ca 0.10 -0.29 -0.03 0.00 -0.84 0.00 0.00 61.79 60.72 1qip h SER 44 Cb 0.73 -0.24 -0.02 0.00 0.14 0.00 0.00 62.40 63.01 1qip h SER 44 CO 0.06 0.97 0.17 -0.07 -1.14 0.00 0.00 176.83 176.82 1qip h LEU 45 N 0.80 0.63 -0.40 5.07 3.38 -0.34 -1.02 115.31 123.44 1qip h LEU 45 Ca 0.15 -0.18 0.03 0.00 0.09 0.00 0.00 57.88 57.97 1qip h LEU 45 Cb 0.50 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 41.05 1qip h LEU 45 CO 0.02 0.64 0.21 -0.78 0.09 0.00 0.00 178.44 178.62 1qip h ASP 46 N 0.58 0.31 0.57 -0.43 3.58 -1.21 -1.55 116.42 118.28 1qip h ASP 46 Ca 0.15 0.02 -0.03 0.00 0.42 0.00 0.00 57.03 57.59 1qip h ASP 46 Cb 0.22 -0.05 0.00 0.00 1.72 0.00 0.00 39.33 41.22 1qip h ASP 46 CO -0.01 0.23 -0.30 0.15 -2.88 0.00 0.00 179.24 176.43 1qip h PHE 47 N 0.42 -0.78 -0.19 0.28 3.57 -0.87 0.92 116.94 120.30 1qip h PHE 47 Ca 0.17 -0.01 -0.05 0.00 3.53 0.00 0.00 57.97 61.60 1qip h PHE 47 Cb 0.06 0.26 -0.01 0.00 2.79 0.00 0.00 35.95 39.05 1qip h PHE 47 CO -0.09 -0.47 -0.12 1.88 -2.23 0.00 0.00 178.31 177.28 1qip h TYR 48 N -0.80 0.31 0.00 0.41 0.05 -1.14 -0.80 116.97 114.99 1qip h TYR 48 Ca -0.07 -0.04 -0.17 0.00 0.05 0.00 0.00 58.73 58.50 1qip h TYR 48 Cb 0.63 -0.09 -0.03 0.00 1.01 0.00 0.00 36.73 38.25 1qip h TYR 48 CO -0.05 0.42 -1.00 1.79 -1.05 0.00 0.00 178.16 178.26 1qip h THR 49 N 0.28 0.82 -0.11 -2.88 1.35 -1.26 -0.16 112.91 110.96 1qip h THR 49 Ca 0.06 -1.98 -0.15 0.00 -0.55 0.00 0.00 66.41 63.79 1qip h THR 49 Cb 0.39 1.92 0.01 0.00 -1.73 0.00 0.00 68.15 68.73 1qip h THR 49 CO 0.02 0.28 -0.51 -0.09 -0.25 0.00 0.00 175.52 174.97 1qip h ARG 50 N -1.00 0.54 0.05 4.72 2.43 -0.88 -0.47 114.38 119.77 1qip h ARG 50 Ca -0.25 -0.43 -0.07 0.00 -0.81 0.00 0.00 59.98 58.41 1qip h ARG 50 Cb 1.12 0.09 0.01 0.00 -0.42 0.00 0.00 29.97 30.77 1qip h ARG 50 CO -0.15 1.06 -0.30 0.28 -1.51 0.00 0.00 179.97 179.34 1qip h VAL 51 N 0.15 1.69 -0.01 0.20 2.07 -1.22 -3.39 116.25 115.74 1qip h VAL 51 Ca -0.03 -2.41 0.00 0.00 0.82 0.00 0.00 66.70 65.07 1qip h VAL 51 Cb 1.15 3.32 0.00 0.00 -1.52 0.00 0.00 31.29 34.24 1qip h VAL 51 CO 0.11 0.65 -0.50 0.18 0.02 0.00 0.00 177.57 178.03 1qip n LEU 52 N -4.43 1.79 -0.57 2.57 4.77 -0.83 -4.98 117.00 115.32 1qip n LEU 52 Ca -0.11 -0.66 -0.07 0.00 -0.03 0.00 0.00 56.01 55.14 1qip n LEU 52 Cb 0.61 -0.02 -0.03 0.00 -2.33 0.00 0.00 43.42 41.65 1qip n LEU 52 CO 0.39 0.34 -0.07 0.61 -1.33 0.00 0.00 177.39 177.34 1qip n GLY 53 N 1.42 0.78 3.91 -0.72 0.00 -0.18 -4.95 105.19 105.45 1qip n GLY 53 Ca 0.09 -0.71 -0.28 0.00 0.00 0.00 0.00 46.02 45.12 1qip n GLY 53 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1qip s MET 54 N -2.87 2.46 -0.06 1.61 -1.94 -0.10 -4.89 119.30 113.51 1qip s MET 54 Ca 0.00 0.08 0.05 0.00 -1.71 0.00 0.00 55.69 54.11 1qip s MET 54 Cb 0.00 -2.09 -0.01 0.00 2.01 0.00 0.00 34.83 34.73 1qip s MET 54 CO 0.00 -1.17 -0.22 0.99 -0.01 0.00 0.00 175.02 174.61 1qip s THR 55 N -3.31 2.30 -0.47 2.05 2.01 0.32 -4.24 115.64 114.29 1qip s THR 55 Ca 0.59 -0.98 -0.29 0.00 0.31 0.00 0.00 61.69 61.32 1qip s THR 55 Cb -0.11 -1.85 0.02 0.00 0.01 0.00 0.00 72.50 70.57 1qip s THR 55 CO 0.48 0.57 1.35 -0.22 -0.69 0.00 0.00 174.62 176.11 1qip s LEU 56 N -0.27 3.54 -0.00 4.42 2.96 -1.26 -1.33 118.68 126.74 1qip s LEU 56 Ca -0.00 0.58 0.18 0.00 -0.22 0.00 0.00 54.13 54.67 1qip s LEU 56 Cb -0.13 -3.40 -0.20 0.00 0.50 0.00 0.00 46.19 42.96 1qip s LEU 56 CO 0.03 -1.48 0.77 2.30 -1.32 0.00 0.00 176.35 176.65 1qip n ILE 57 N 6.97 0.00 -3.62 6.68 -5.35 -0.10 -4.98 119.36 118.96 1qip n ILE 57 Ca 0.14 -0.07 -0.09 0.00 -0.27 0.00 0.00 62.75 62.46 1qip n ILE 57 Cb 0.49 0.99 -0.06 0.00 -1.74 0.00 0.00 39.64 39.32 1qip n ILE 57 CO 0.00 0.00 0.00 -1.58 -1.76 0.00 0.00 176.55 173.21 1qip s GLN 58 N -2.73 0.48 -0.04 6.28 2.00 -1.23 -4.81 119.66 119.61 1qip s GLN 58 Ca 0.07 0.36 0.01 0.00 -2.00 0.00 0.00 55.36 53.81 1qip s GLN 58 Cb 0.14 0.23 0.02 0.00 0.80 0.00 0.00 33.01 34.19 1qip s GLN 58 CO 0.75 -0.10 -0.06 0.21 -0.50 0.00 0.00 175.29 175.59 1qip s LYS 59 N -0.31 0.91 -0.02 1.67 2.20 -1.26 -0.19 119.74 122.75 1qip s LYS 59 Ca 0.02 -0.18 0.04 0.00 -0.36 0.00 0.00 55.97 55.50 1qip s LYS 59 Cb -0.03 -0.87 -0.01 0.00 -1.51 0.00 0.00 37.83 35.41 1qip s LYS 59 CO -0.04 -0.02 -0.15 0.00 -0.36 0.00 0.00 175.35 174.77 1qip s ASP 61 N -0.22 2.32 -0.56 0.00 1.01 -1.26 -0.30 116.67 117.65 1qip s ASP 61 Ca 0.03 -0.38 0.04 0.00 0.71 0.00 0.00 52.55 52.95 1qip s ASP 61 Cb -0.07 -0.66 0.15 0.00 1.01 0.00 0.00 42.92 43.35 1qip s ASP 61 CO 0.00 0.17 0.35 -0.36 0.21 0.00 0.00 175.17 175.54 1qip s PHE 62 N 0.02 2.81 0.23 4.23 0.08 -0.25 -5.01 117.98 120.10 1qip s PHE 62 Ca -0.04 -2.97 -0.07 0.00 0.12 0.00 0.00 56.93 53.97 1qip s PHE 62 Cb -0.12 -2.35 0.25 0.00 -0.57 0.00 0.00 43.02 40.23 1qip s PHE 62 CO 0.03 -0.69 1.88 -1.00 -0.10 0.00 0.00 175.22 175.34 1qip h PRO 63 N 6.06 1.06 -0.37 0.24 0.13 -1.98 0.13 132.00 137.27 1qip h PRO 63 Ca 0.06 -0.06 -0.06 0.00 -0.87 0.00 0.00 66.00 65.06 1qip h PRO 63 Cb 0.85 -0.24 -0.01 0.00 0.13 0.00 0.00 31.00 31.73 1qip h PRO 63 CO 0.62 0.70 -0.02 0.82 -0.23 0.00 0.00 178.00 179.88 1qip h ILE 64 N 1.09 1.26 -0.00 -3.56 1.08 -1.95 -3.06 117.51 112.37 1qip h ILE 64 Ca 0.34 -1.03 0.00 0.00 -0.39 0.00 0.00 64.86 63.77 1qip h ILE 64 Cb -0.02 1.20 0.00 0.00 -3.07 0.00 0.00 36.82 34.93 1qip h ILE 64 CO -0.11 0.34 -0.08 0.23 -0.69 0.00 0.00 178.15 177.85 1qip n MET 65 N -4.46 0.73 -3.55 2.37 2.81 -1.09 -4.95 117.12 108.98 1qip n MET 65 Ca -0.01 -0.21 -0.23 0.00 -1.81 0.00 0.00 57.70 55.43 1qip n MET 65 Cb 0.30 -1.50 0.05 0.00 -0.71 0.00 0.00 33.22 31.36 1qip n MET 65 CO 0.00 0.00 0.00 1.63 1.51 0.00 0.00 175.97 179.11 1qip n LYS 66 N -0.95 -2.79 -3.63 0.03 5.02 0.01 -4.93 118.16 110.92 1qip n LYS 66 Ca 0.16 0.64 -0.11 0.00 -2.02 0.00 0.00 58.31 56.97 1qip n LYS 66 Cb 0.26 -5.00 -0.05 0.00 -0.02 0.00 0.00 35.03 30.22 1qip n LYS 66 CO 0.00 0.00 0.00 -0.59 -0.52 0.00 0.00 177.40 176.29 1qip s PHE 67 N -3.50 -0.25 0.12 2.13 -0.12 -1.11 -1.43 117.98 113.81 1qip s PHE 67 Ca 0.31 0.05 0.06 0.00 -0.05 0.00 0.00 56.93 57.30 1qip s PHE 67 Cb -0.08 0.27 -0.04 0.00 -0.63 0.00 0.00 43.02 42.54 1qip s PHE 67 CO 0.81 -0.67 -0.14 -1.12 -0.05 0.00 0.00 175.22 174.05 1qip s SER 68 N -2.51 1.96 -0.06 1.98 0.01 -0.37 -1.09 113.70 113.63 1qip s SER 68 Ca -0.00 -0.82 0.05 0.00 1.31 0.00 0.00 55.95 56.49 1qip s SER 68 Cb 0.01 -0.06 -0.00 0.00 0.21 0.00 0.00 66.02 66.17 1qip s SER 68 CO -0.08 -0.16 -0.21 -0.76 0.41 0.00 0.00 173.24 172.44 1qip s LEU 69 N -2.49 1.99 -0.20 2.44 1.43 0.58 -0.77 118.68 121.66 1qip s LEU 69 Ca 0.09 -0.44 0.01 0.00 -1.03 0.00 0.00 54.13 52.76 1qip s LEU 69 Cb -0.04 -1.19 0.02 0.00 0.03 0.00 0.00 46.19 45.01 1qip s LEU 69 CO 0.03 0.19 -0.17 -0.31 0.23 0.00 0.00 176.35 176.31 1qip s TYR 70 N 0.03 2.88 -0.25 0.29 1.51 0.00 -0.54 117.35 121.28 1qip s TYR 70 Ca -0.06 -1.71 -0.14 0.00 -1.01 0.00 0.00 57.07 54.15 1qip s TYR 70 Cb -0.14 -1.94 -0.04 0.00 -0.11 0.00 0.00 41.96 39.73 1qip s TYR 70 CO 0.04 -0.80 0.32 -0.06 -1.11 0.00 0.00 175.55 173.94 1qip s PHE 71 N 1.27 3.29 -0.01 2.71 0.40 0.73 0.24 117.98 126.62 1qip s PHE 71 Ca 0.03 0.40 0.05 0.00 -0.60 0.00 0.00 56.93 56.80 1qip s PHE 71 Cb -0.14 -2.48 -0.03 0.00 0.51 0.00 0.00 43.02 40.87 1qip s PHE 71 CO -0.11 -0.11 -0.13 -0.51 0.70 0.00 0.00 175.22 175.06 1qip s LEU 72 N 1.64 2.82 0.19 -0.37 1.43 0.46 -0.92 118.68 123.94 1qip s LEU 72 Ca 0.14 -0.25 -0.22 0.00 -1.03 0.00 0.00 54.13 52.77 1qip s LEU 72 Cb -0.15 -1.62 0.05 0.00 0.03 0.00 0.00 46.19 44.50 1qip s LEU 72 CO 0.08 0.30 0.62 0.00 0.23 0.00 0.00 176.35 177.59 1qip s ALA 73 N -0.87 -1.45 -1.03 4.21 0.00 -0.44 -0.21 121.76 121.97 1qip s ALA 73 Ca 0.14 0.24 -0.18 0.00 0.00 0.00 0.00 51.96 52.15 1qip s ALA 73 Cb -0.11 0.87 0.12 0.00 0.00 0.00 0.00 23.12 24.01 1qip s ALA 73 CO 0.04 -0.84 1.30 0.71 0.00 0.00 0.00 175.76 176.97 1qip s TYR 74 N -3.80 3.07 0.05 0.00 2.02 -1.26 -0.52 117.35 116.90 1qip s TYR 74 Ca 0.04 -1.47 0.01 0.00 -0.37 0.00 0.00 57.07 55.28 1qip s TYR 74 Cb -0.02 -4.40 -0.03 0.00 -0.40 0.00 0.00 41.96 37.11 1qip s TYR 74 CO -0.07 -1.57 -0.06 -1.21 -1.57 0.00 0.00 175.55 171.06 1qip s GLU 75 N 2.98 0.54 -0.05 -0.62 0.41 -1.26 -5.03 118.70 115.67 1qip s GLU 75 Ca 0.39 -0.88 -0.30 0.00 -0.41 0.00 0.00 54.97 53.77 1qip s GLU 75 Cb -0.03 -0.13 -0.03 0.00 -1.78 0.00 0.00 34.13 32.16 1qip s GLU 75 CO -0.06 -0.00 1.19 0.34 -0.49 0.00 0.00 175.26 176.23 1qip s ASP 76 N -1.97 7.06 0.51 -0.19 -1.08 -1.26 -4.69 116.67 115.05 1qip s ASP 76 Ca -0.05 1.80 0.27 0.00 -0.52 0.00 0.00 52.55 54.05 1qip s ASP 76 Cb -0.05 -2.56 1.36 0.00 -1.46 0.00 0.00 42.92 40.21 1qip s ASP 76 CO -0.02 -0.57 1.90 0.50 0.52 0.00 0.00 175.17 177.50 1qip h LYS 77 N 7.41 0.10 0.00 4.34 3.64 -1.98 -0.67 116.57 129.41 1qip h LYS 77 Ca -0.34 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.03 1qip h LYS 77 Cb 1.16 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.96 1qip h LYS 77 CO 0.88 0.07 0.00 0.09 -2.27 0.00 0.00 179.45 178.21 1qip n ASN 78 N -4.35 0.65 0.03 4.20 3.02 -1.26 -2.41 115.26 115.14 1qip n ASN 78 Ca 0.17 0.63 0.13 0.00 -0.03 0.00 0.00 54.58 55.48 1qip n ASN 78 Cb 0.83 -0.78 0.42 0.00 -0.61 0.00 0.00 39.78 39.64 1qip n ASN 78 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 1qip n ASP 79 N -2.19 0.37 -4.62 6.41 8.00 -0.26 -4.81 116.55 119.45 1qip n ASP 79 Ca 0.03 0.26 -0.43 0.00 0.71 0.00 0.00 54.79 55.36 1qip n ASP 79 Cb 0.27 -0.25 -0.03 0.00 -0.02 0.00 0.00 41.12 41.09 1qip n ASP 79 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1qip s ILE 80 N -3.04 3.65 0.78 0.53 1.01 -1.01 -4.97 121.20 118.15 1qip s ILE 80 Ca 0.12 0.71 -0.15 0.00 0.00 0.00 0.00 60.65 61.33 1qip s ILE 80 Cb 0.17 -3.73 0.02 0.00 0.01 0.00 0.00 42.46 38.93 1qip s ILE 80 CO 0.61 -0.36 0.85 -2.65 0.00 0.00 0.00 174.94 173.40 1qip n PRO 81 N 7.90 0.26 0.04 2.79 -0.02 -1.26 -4.96 135.00 139.74 1qip n PRO 81 Ca 0.20 0.14 -0.22 0.00 -2.02 0.00 0.00 63.50 61.60 1qip n PRO 81 Cb 0.46 -2.14 -0.14 0.00 -0.02 0.00 0.00 33.50 31.65 1qip n PRO 81 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 1qip h LYS 82 N -0.65 0.31 -6.84 -0.52 1.57 -1.96 -3.42 116.57 105.07 1qip h LYS 82 Ca -0.46 -0.53 -0.52 0.00 -1.87 0.00 0.00 60.65 57.27 1qip h LYS 82 Cb 1.32 0.20 0.05 0.00 0.08 0.00 0.00 32.23 33.87 1qip h LYS 82 CO 0.44 1.26 0.58 -1.21 -0.57 0.00 0.00 179.45 179.94 1qip s GLU 83 N -2.50 4.46 0.20 3.15 2.02 -1.26 -4.91 118.70 119.87 1qip s GLU 83 Ca -0.17 2.06 -0.10 0.00 0.02 0.00 0.00 54.97 56.78 1qip s GLU 83 Cb 0.04 -3.12 0.26 0.00 0.10 0.00 0.00 34.13 31.41 1qip s GLU 83 CO 0.81 -0.05 1.74 -0.22 0.02 0.00 0.00 175.26 177.56 1qip h LYS 84 N 3.70 0.37 0.04 1.61 3.64 -1.99 0.96 116.57 124.91 1qip h LYS 84 Ca -0.48 -0.02 -0.27 0.00 -1.27 0.00 0.00 60.65 58.61 1qip h LYS 84 Cb 1.22 -0.08 0.02 0.00 -0.41 0.00 0.00 32.23 32.97 1qip h LYS 84 CO 0.67 0.25 -1.09 -0.44 -2.27 0.00 0.00 179.45 176.57 1qip h ASP 85 N 0.39 0.76 -0.31 4.20 3.32 -1.99 -2.86 116.42 119.92 1qip h ASP 85 Ca 0.30 -0.65 -0.12 0.00 0.02 0.00 0.00 57.03 56.58 1qip h ASP 85 Cb 0.37 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.67 1qip h ASP 85 CO -0.31 1.46 -0.23 -0.08 -1.72 0.00 0.00 179.24 178.36 1qip h GLU 86 N 0.29 0.80 -0.43 3.56 4.81 -1.92 -2.41 114.58 119.29 1qip h GLU 86 Ca -0.13 -0.33 0.00 0.00 -0.13 0.00 0.00 59.36 58.77 1qip h GLU 86 Cb 1.75 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 31.07 1qip h GLU 86 CO 0.20 0.95 0.28 -0.22 -0.73 0.00 0.00 179.01 179.50 1qip h LYS 87 N 0.70 0.57 -0.22 1.92 3.64 -0.83 -1.51 116.57 120.84 1qip h LYS 87 Ca 0.09 -0.04 -0.01 0.00 -1.27 0.00 0.00 60.65 59.43 1qip h LYS 87 Cb 0.75 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 32.44 1qip h LYS 87 CO 0.06 0.39 0.10 0.82 -2.27 0.00 0.00 179.45 178.54 1qip h ILE 88 N 0.58 1.15 -0.83 2.00 2.04 -1.39 0.32 117.51 121.37 1qip h ILE 88 Ca 0.16 -0.45 -0.01 0.00 1.00 0.00 0.00 64.86 65.56 1qip h ILE 88 Cb -0.05 1.04 -0.04 0.00 -0.74 0.00 0.00 36.82 37.03 1qip h ILE 88 CO -0.03 0.15 0.49 0.00 0.00 0.00 0.00 178.15 178.76 1qip h ALA 89 N 0.95 1.30 -0.06 1.87 0.00 -1.30 -0.81 119.26 121.21 1qip h ALA 89 Ca 0.07 -0.10 -0.03 0.00 0.00 0.00 0.00 54.91 54.85 1qip h ALA 89 Cb 0.15 -0.34 -0.00 0.00 0.00 0.00 0.00 17.79 17.60 1qip h ALA 89 CO -0.01 0.60 -0.10 2.35 0.00 0.00 0.00 179.25 182.09 1qip h TRP 90 N 1.15 0.21 -0.70 0.00 7.01 -1.10 -2.90 115.95 119.62 1qip h TRP 90 Ca 0.30 -0.07 -0.04 0.00 2.11 0.00 0.00 58.89 61.18 1qip h TRP 90 Cb -0.03 -0.04 -0.03 0.00 -2.10 0.00 0.00 29.16 26.96 1qip h TRP 90 CO 0.01 0.68 0.27 0.00 -2.79 0.00 0.00 178.44 176.61 1qip h ALA 91 N 0.50 0.91 -0.01 2.65 0.00 -0.77 -2.22 119.26 120.32 1qip h ALA 91 Ca 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.73 1qip h ALA 91 Cb 0.66 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 18.18 1qip h ALA 91 CO 0.02 0.54 0.00 1.28 0.00 0.00 0.00 179.25 181.10 1qip n LEU 92 N -4.36 0.21 -0.59 0.00 4.77 -0.32 -2.39 117.00 114.32 1qip n LEU 92 Ca 0.05 -0.08 0.06 0.00 -0.03 0.00 0.00 56.01 56.01 1qip n LEU 92 Cb 0.18 -0.01 0.12 0.00 -2.33 0.00 0.00 43.42 41.38 1qip n LEU 92 CO 0.40 0.04 0.56 -1.54 -1.33 0.00 0.00 177.39 175.52 1qip n SER 93 N -0.77 2.58 -4.77 -1.43 3.41 -0.85 -4.99 113.62 106.80 1qip n SER 93 Ca 0.20 -1.80 -0.38 0.00 -0.26 0.00 0.00 58.87 56.63 1qip n SER 93 Cb 0.13 -0.15 -0.06 0.00 -0.26 0.00 0.00 64.21 63.87 1qip n SER 93 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 1qip s ARG 94 N -0.98 4.65 0.72 4.33 1.81 -1.01 -5.05 118.95 123.43 1qip s ARG 94 Ca 0.20 1.33 -0.11 0.00 -1.72 0.00 0.00 55.73 55.43 1qip s ARG 94 Cb 0.11 -3.04 0.02 0.00 -0.45 0.00 0.00 34.95 31.60 1qip s ARG 94 CO 0.16 0.41 1.07 0.15 -0.68 0.00 0.00 175.30 176.41 1qip s LYS 95 N -1.62 2.70 -1.18 3.54 1.02 -1.26 -4.44 119.74 118.49 1qip s LYS 95 Ca 0.44 0.83 -0.19 0.00 0.02 0.00 0.00 55.97 57.08 1qip s LYS 95 Cb -0.22 -1.97 -0.00 0.00 -0.52 0.00 0.00 37.83 35.12 1qip s LYS 95 CO 0.27 -1.23 0.73 0.00 -0.92 0.00 0.00 175.35 174.20 1qip n ALA 96 N -3.20 -2.47 -2.74 5.17 0.00 -0.98 -4.95 120.51 111.34 1qip n ALA 96 Ca 0.07 -0.27 -0.22 0.00 0.00 0.00 0.00 53.44 53.02 1qip n ALA 96 Cb 0.55 -3.62 -0.05 0.00 0.00 0.00 0.00 19.45 16.32 1qip n ALA 96 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1qip s THR 97 N -3.54 4.08 -0.14 0.00 -4.23 -0.28 -4.62 115.64 106.90 1qip s THR 97 Ca 0.40 -1.54 -0.03 0.00 -1.18 0.00 0.00 61.69 59.35 1qip s THR 97 Cb -0.15 -3.23 -0.03 0.00 1.34 0.00 0.00 72.50 70.43 1qip s THR 97 CO 0.87 -0.34 -0.04 -0.76 -0.54 0.00 0.00 174.62 173.82 1qip s LEU 98 N -3.82 3.28 -0.38 4.79 1.43 0.71 -2.05 118.68 122.64 1qip s LEU 98 Ca 0.33 -0.09 -0.10 0.00 -1.03 0.00 0.00 54.13 53.24 1qip s LEU 98 Cb -0.07 -1.78 0.05 0.00 0.03 0.00 0.00 46.19 44.42 1qip s LEU 98 CO 0.24 0.21 0.21 -0.70 0.23 0.00 0.00 176.35 176.54 1qip s GLU 99 N 0.12 2.72 -0.25 1.70 2.12 0.22 -0.40 118.70 124.94 1qip s GLU 99 Ca -0.01 -1.22 -0.13 0.00 0.36 0.00 0.00 54.97 53.97 1qip s GLU 99 Cb -0.14 -3.71 -0.04 0.00 0.26 0.00 0.00 34.13 30.50 1qip s GLU 99 CO 0.03 -0.78 0.29 -0.51 -0.54 0.00 0.00 175.26 173.75 1qip s LEU 100 N 1.49 4.09 -0.28 2.70 1.43 0.14 -1.46 118.68 126.79 1qip s LEU 100 Ca 0.02 0.25 -0.11 0.00 -1.03 0.00 0.00 54.13 53.26 1qip s LEU 100 Cb -0.20 -2.31 -0.05 0.00 0.03 0.00 0.00 46.19 43.66 1qip s LEU 100 CO 0.05 -0.07 0.17 -0.89 0.23 0.00 0.00 176.35 175.84 1qip s THR 101 N 1.55 5.16 -0.35 5.49 2.01 -0.28 -0.82 115.64 128.41 1qip s THR 101 Ca 0.13 0.10 -0.09 0.00 0.31 0.00 0.00 61.69 62.14 1qip s THR 101 Cb -0.15 -3.46 0.03 0.00 0.01 0.00 0.00 72.50 68.93 1qip s THR 101 CO 0.08 0.25 0.15 -2.28 -0.69 0.00 0.00 174.62 172.13 1qip s HIS 102 N 1.74 3.24 -0.41 4.92 2.46 0.05 -0.91 115.29 126.38 1qip s HIS 102 Ca 0.07 -1.18 -0.25 0.00 0.47 0.00 0.00 55.06 54.17 1qip s HIS 102 Cb -0.16 -2.35 0.02 0.00 -0.13 0.00 0.00 32.58 29.96 1qip s HIS 102 CO 0.10 -0.68 0.92 -0.80 -2.47 0.00 0.00 174.74 171.81 1qip s ASN 103 N 1.48 6.59 0.17 9.88 0.01 -1.26 -1.24 114.94 130.57 1qip s ASN 103 Ca 0.00 0.35 -0.33 0.00 -0.71 0.00 0.00 52.86 52.18 1qip s ASN 103 Cb -0.19 -2.45 -0.16 0.00 0.41 0.00 0.00 41.25 38.85 1qip s ASN 103 CO 0.05 -0.94 1.10 0.79 -1.51 0.00 0.00 177.10 176.59 1qip n TRP 104 N 6.94 1.12 0.00 2.20 8.01 -0.52 -2.58 117.44 132.61 1qip n TRP 104 Ca 0.06 0.73 0.00 0.00 -1.31 0.00 0.00 57.50 56.98 1qip n TRP 104 Cb 0.48 -2.24 0.00 0.00 -2.01 0.00 0.00 31.31 27.54 1qip n TRP 104 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1qip n GLY 105 N 1.93 2.63 0.29 6.99 0.00 -1.26 -4.94 105.19 110.83 1qip n GLY 105 Ca 0.15 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.21 1qip n GLY 105 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1qip h THR 106 N 0.00 1.12 0.00 2.61 1.35 -1.73 -2.45 112.91 113.82 1qip h THR 106 Ca 0.00 -0.35 -0.01 0.00 -0.55 0.00 0.00 66.41 65.50 1qip h THR 106 Cb 0.00 0.71 -0.00 0.00 -1.73 0.00 0.00 68.15 67.13 1qip h THR 106 CO 0.00 0.14 -0.05 1.05 -0.25 0.00 0.00 175.52 176.41 1qip h GLU 107 N 0.45 0.00 -0.10 4.72 9.09 -1.74 -2.32 114.58 124.68 1qip h GLU 107 Ca 0.12 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.53 1qip h GLU 107 Cb 0.07 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.17 1qip h GLU 107 CO -0.02 0.05 0.00 -0.25 0.05 0.00 0.00 179.01 178.85 1qip n ASP 108 N -3.55 2.72 -4.39 3.06 8.00 -0.93 -4.84 116.55 116.63 1qip n ASP 108 Ca -0.02 -1.82 -0.44 0.00 0.71 0.00 0.00 54.79 53.21 1qip n ASP 108 Cb 0.16 -0.05 -0.06 0.00 -0.02 0.00 0.00 41.12 41.15 1qip n ASP 108 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1qip s ASP 109 N -1.51 6.19 0.61 -2.24 -1.08 -0.88 -4.92 116.67 112.85 1qip s ASP 109 Ca 0.25 -1.28 0.39 0.00 -0.52 0.00 0.00 52.55 51.38 1qip s ASP 109 Cb 0.17 -2.27 1.98 0.00 -1.46 0.00 0.00 42.92 41.33 1qip s ASP 109 CO 0.24 -0.94 2.22 -0.33 0.52 0.00 0.00 175.17 176.88 1qip h GLU 110 N 9.02 0.00 -0.01 4.34 5.08 -1.88 -2.13 114.58 129.01 1qip h GLU 110 Ca -0.29 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.07 1qip h GLU 110 Cb 1.09 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.34 1qip h GLU 110 CO 1.02 0.02 -0.19 0.25 -1.00 0.00 0.00 179.01 179.10 1qip n THR 111 N -3.20 0.00 -3.90 1.13 -2.24 -1.26 -4.92 114.28 99.89 1qip n THR 111 Ca -0.02 -0.14 -0.35 0.00 -2.27 0.00 0.00 64.05 61.28 1qip n THR 111 Cb 0.16 0.34 -0.05 0.00 -2.10 0.00 0.00 70.33 68.67 1qip n THR 111 CO 0.00 0.00 0.00 -1.58 -0.57 0.00 0.00 175.07 172.92 1qip s GLN 112 N -2.40 3.44 -0.08 -0.78 -0.44 -0.80 -5.09 119.66 113.50 1qip s GLN 112 Ca 0.28 -0.25 -0.30 0.00 -2.50 0.00 0.00 55.36 52.59 1qip s GLN 112 Cb 0.20 -3.13 0.10 0.00 -1.64 0.00 0.00 33.01 28.53 1qip s GLN 112 CO 0.48 0.72 0.83 -1.54 0.50 0.00 0.00 175.29 176.28 1qip s SER 113 N -1.59 -0.50 0.57 6.67 1.04 -1.26 -4.98 113.70 113.65 1qip s SER 113 Ca 0.23 0.45 -0.04 0.00 0.48 0.00 0.00 55.95 57.07 1qip s SER 113 Cb -0.12 0.43 0.02 0.00 0.10 0.00 0.00 66.02 66.44 1qip s SER 113 CO 0.13 -0.52 0.85 -0.31 0.98 0.00 0.00 173.24 174.37 1qip s TYR 114 N -1.56 3.13 -0.14 5.02 2.02 -1.26 -5.09 117.35 119.47 1qip s TYR 114 Ca -0.04 0.42 -0.04 0.00 -0.37 0.00 0.00 57.07 57.04 1qip s TYR 114 Cb -0.00 -2.73 -0.03 0.00 -0.40 0.00 0.00 41.96 38.79 1qip s TYR 114 CO 0.03 -0.84 0.00 -1.58 -1.57 0.00 0.00 175.55 171.59 1qip s HIS 115 N -2.91 3.13 -2.38 2.71 5.65 -1.26 -5.00 115.29 115.22 1qip s HIS 115 Ca 0.54 -0.05 0.24 0.00 0.25 0.00 0.00 55.06 56.05 1qip s HIS 115 Cb -0.10 -1.94 0.90 0.00 -1.18 0.00 0.00 32.58 30.26 1qip s HIS 115 CO 0.42 0.17 1.65 0.27 -0.65 0.00 0.00 174.74 176.60 1qip n ASN 116 N 3.11 1.58 0.00 9.88 0.23 -1.26 -4.94 115.26 123.86 1qip n ASN 116 Ca -0.18 -1.60 0.00 0.00 -0.53 0.00 0.00 54.58 52.27 1qip n ASN 116 Cb 0.53 -0.05 0.00 0.00 -2.08 0.00 0.00 39.78 38.17 1qip n ASN 116 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1qip n GLY 117 N 1.15 1.25 1.04 4.83 0.00 -1.26 -4.66 105.19 107.54 1qip n GLY 117 Ca 0.18 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.29 1qip n GLY 117 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1qip n ASN 118 N 0.00 3.36 -4.19 1.61 3.02 -1.26 -2.43 115.26 115.36 1qip n ASN 118 Ca 0.00 -1.95 -0.12 0.00 -0.03 0.00 0.00 54.58 52.49 1qip n ASN 118 Cb 0.00 -0.29 -0.10 0.00 -0.61 0.00 0.00 39.78 38.78 1qip n ASN 118 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 1qip s SER 119 N -1.19 1.30 0.15 6.41 1.04 -1.26 -4.99 113.70 115.16 1qip s SER 119 Ca 0.36 -1.01 -0.34 0.00 0.48 0.00 0.00 55.95 55.43 1qip s SER 119 Cb 0.20 0.07 -0.15 0.00 0.10 0.00 0.00 66.02 66.24 1qip s SER 119 CO 0.27 -0.44 1.38 -0.67 0.98 0.00 0.00 173.24 174.76 1qip n ASP 120 N -0.09 2.15 -4.71 7.02 2.03 -1.26 -3.00 116.55 118.69 1qip n ASP 120 Ca -0.11 1.12 -0.40 0.00 0.52 0.00 0.00 54.79 55.92 1qip n ASP 120 Cb 0.61 -1.30 -0.05 0.00 -0.72 0.00 0.00 41.12 39.66 1qip n ASP 120 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 1qip s PRO 121 N 0.26 4.41 0.60 -0.67 0.04 -1.26 -5.09 135.00 133.30 1qip s PRO 121 Ca 0.78 0.88 -0.10 0.00 0.04 0.00 0.00 61.00 62.60 1qip s PRO 121 Cb -0.81 -3.47 -0.03 0.00 0.04 0.00 0.00 34.50 30.23 1qip s PRO 121 CO 0.46 0.01 0.98 1.03 0.04 0.00 0.00 177.00 179.52 1qip s ARG 122 N 1.00 3.49 0.00 4.56 0.52 -1.16 -4.75 118.95 122.61 1qip s ARG 122 Ca 0.37 0.59 0.00 0.00 -0.52 0.00 0.00 55.73 56.17 1qip s ARG 122 Cb -0.17 -2.14 0.00 0.00 0.52 0.00 0.00 34.95 33.16 1qip s ARG 122 CO 0.17 -0.55 0.00 0.41 0.02 0.00 0.00 175.30 175.35 1qip n GLY 123 N -2.67 -0.99 3.60 -3.53 0.00 -1.02 -5.04 105.19 95.54 1qip n GLY 123 Ca 0.05 0.64 -0.41 0.00 0.00 0.00 0.00 46.02 46.30 1qip n GLY 123 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1qip n PHE 124 N 0.00 1.10 -0.03 1.61 7.35 -1.26 -4.96 117.46 121.27 1qip n PHE 124 Ca 0.00 0.55 -0.08 0.00 -0.76 0.00 0.00 57.45 57.16 1qip n PHE 124 Cb 0.00 -2.22 -0.03 0.00 0.35 0.00 0.00 39.48 37.59 1qip n PHE 124 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1qip n GLY 125 N 1.21 -0.24 3.64 7.13 0.00 -1.26 -4.20 105.19 111.46 1qip n GLY 125 Ca 0.10 -0.11 -0.02 0.00 0.00 0.00 0.00 46.02 45.98 1qip n GLY 125 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 1qip s HIS 126 N -2.33 -0.12 0.43 1.61 -3.43 -1.26 -4.38 115.29 105.81 1qip s HIS 126 Ca -0.15 -0.03 0.08 0.00 -0.80 0.00 0.00 55.06 54.16 1qip s HIS 126 Cb 0.04 0.56 0.00 0.00 -1.43 0.00 0.00 32.58 31.75 1qip s HIS 126 CO 0.20 -0.44 0.50 0.96 -2.00 0.00 0.00 174.74 173.97 1qip s ILE 127 N -2.73 2.82 -0.06 -5.38 -4.36 -0.83 -4.97 121.20 105.68 1qip s ILE 127 Ca 0.12 -1.14 -0.06 0.00 -0.26 0.00 0.00 60.65 59.31 1qip s ILE 127 Cb 0.01 -2.95 0.02 0.00 1.25 0.00 0.00 42.46 40.79 1qip s ILE 127 CO -0.03 0.00 0.17 -0.83 0.24 0.00 0.00 174.94 174.49 1qip s GLY 128 N -4.28 -0.12 -0.12 6.27 0.00 -1.26 -0.50 107.32 107.31 1qip s GLY 128 Ca 0.52 0.47 0.02 0.00 0.00 0.00 0.00 44.72 45.73 1qip s GLY 128 CO 0.31 0.41 -0.19 -0.42 0.00 0.00 0.00 173.10 173.21 1qip s ILE 129 N 0.09 2.50 -0.08 0.90 1.01 0.33 -4.91 121.20 121.04 1qip s ILE 129 Ca -0.00 -0.86 -0.21 0.00 0.00 0.00 0.00 60.65 59.58 1qip s ILE 129 Cb -0.01 -2.01 -0.04 0.00 0.01 0.00 0.00 42.46 40.41 1qip s ILE 129 CO 0.00 0.54 0.59 0.00 0.00 0.00 0.00 174.94 176.07 1qip s ALA 130 N 0.39 3.41 0.24 9.38 0.00 -1.26 -1.88 121.76 132.05 1qip s ALA 130 Ca -0.14 -0.02 0.05 0.00 0.00 0.00 0.00 51.96 51.85 1qip s ALA 130 Cb -0.17 -2.80 -0.05 0.00 0.00 0.00 0.00 23.12 20.10 1qip s ALA 130 CO 0.07 -0.03 -0.05 0.14 0.00 0.00 0.00 175.76 175.89 1qip s VAL 131 N 0.60 1.39 -0.17 0.00 -7.23 0.35 -4.94 120.40 110.41 1qip s VAL 131 Ca 0.32 -2.10 0.18 0.00 -1.81 0.00 0.00 61.98 58.57 1qip s VAL 131 Cb -0.17 -2.30 0.15 0.00 0.56 0.00 0.00 36.38 34.62 1qip s VAL 131 CO 0.15 -0.39 1.54 -0.65 -0.31 0.00 0.00 175.10 175.43 1qip h PRO 132 N 2.43 0.00 -1.74 4.82 0.11 -1.98 -3.37 132.00 132.27 1qip h PRO 132 Ca -0.39 0.00 -0.12 0.00 0.11 0.00 0.00 66.00 65.60 1qip h PRO 132 Cb 1.22 0.00 -0.28 0.00 0.11 0.00 0.00 31.00 32.05 1qip h PRO 132 CO 0.65 0.36 -0.46 0.34 -0.21 0.00 0.00 178.00 178.68 1qip s ASP 133 N -6.37 0.03 0.18 -2.05 -1.08 -1.26 -5.00 116.67 101.12 1qip s ASP 133 Ca 0.04 0.22 -0.10 0.00 -0.52 0.00 0.00 52.55 52.19 1qip s ASP 133 Cb 0.07 1.26 0.08 0.00 -1.46 0.00 0.00 42.92 42.87 1qip s ASP 133 CO 0.71 -0.30 1.67 0.58 0.52 0.00 0.00 175.17 178.35 1qip h VAL 134 N 6.15 1.26 -0.36 1.11 2.07 -1.88 -1.84 116.25 122.77 1qip h VAL 134 Ca -0.18 -1.04 -0.05 0.00 0.82 0.00 0.00 66.70 66.25 1qip h VAL 134 Cb 1.15 0.72 -0.01 0.00 -1.52 0.00 0.00 31.29 31.62 1qip h VAL 134 CO 0.27 0.39 0.04 1.88 0.02 0.00 0.00 177.57 180.16 1qip h TYR 135 N 0.96 0.65 -0.35 1.57 0.05 -1.96 -1.03 116.97 116.87 1qip h TYR 135 Ca 0.19 -0.10 -0.13 0.00 0.05 0.00 0.00 58.73 58.74 1qip h TYR 135 Cb 0.46 -0.17 -0.01 0.00 1.01 0.00 0.00 36.73 38.01 1qip h TYR 135 CO 0.03 0.68 -0.31 0.66 -1.05 0.00 0.00 178.16 178.17 1qip h SER 136 N 0.43 0.79 -0.46 3.88 4.64 -1.98 -1.09 113.55 119.78 1qip h SER 136 Ca 0.11 -0.32 -0.02 0.00 -0.47 0.00 0.00 61.79 61.08 1qip h SER 136 Cb 0.39 -0.22 -0.02 0.00 -0.31 0.00 0.00 62.40 62.24 1qip h SER 136 CO 0.01 1.05 0.21 0.00 -0.87 0.00 0.00 176.83 177.22 1qip h ALA 137 N 1.00 0.59 0.00 5.18 0.00 -1.24 -2.59 119.26 122.21 1qip h ALA 137 Ca 0.07 -0.12 -0.11 0.00 0.00 0.00 0.00 54.91 54.75 1qip h ALA 137 Cb 0.84 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.44 1qip h ALA 137 CO 0.07 0.17 -0.51 0.00 0.00 0.00 0.00 179.25 178.98 1qip h LYS 139 N 0.00 0.96 -0.34 0.00 3.64 -1.04 -0.14 116.57 119.65 1qip h LYS 139 Ca -0.01 -0.15 -0.07 0.00 -1.27 0.00 0.00 60.65 59.16 1qip h LYS 139 Cb 0.94 -0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 32.58 1qip h LYS 139 CO 0.07 0.78 -0.05 -0.09 -2.27 0.00 0.00 179.45 177.89 1qip h ARG 140 N 0.92 0.64 -0.86 1.90 2.43 -1.12 -1.87 114.38 116.43 1qip h ARG 140 Ca 0.23 -0.23 0.07 0.00 -0.81 0.00 0.00 59.98 59.23 1qip h ARG 140 Cb 0.14 -0.05 -0.06 0.00 -0.42 0.00 0.00 29.97 29.59 1qip h ARG 140 CO -0.03 0.79 0.53 0.74 -1.51 0.00 0.00 179.97 180.49 1qip h PHE 141 N 0.44 0.97 -0.49 2.20 0.04 -0.82 -0.87 116.94 118.40 1qip h PHE 141 Ca 0.09 0.03 -0.05 0.00 2.80 0.00 0.00 57.97 60.84 1qip h PHE 141 Cb 0.53 -0.31 -0.02 0.00 2.20 0.00 0.00 35.95 38.35 1qip h PHE 141 CO 0.05 0.48 0.13 0.93 -0.60 0.00 0.00 178.31 179.29 1qip h GLU 142 N 0.95 0.79 -0.71 1.51 5.08 -0.81 -1.28 114.58 120.12 1qip h GLU 142 Ca 0.38 -0.18 0.05 0.00 -1.00 0.00 0.00 59.36 58.61 1qip h GLU 142 Cb 0.20 -0.11 -0.04 0.00 0.50 0.00 0.00 28.75 29.30 1qip h GLU 142 CO -0.18 0.76 0.46 0.93 -1.00 0.00 0.00 179.01 179.98 1qip h GLU 143 N 0.67 0.74 -0.00 2.33 5.08 -0.59 -1.55 114.58 121.27 1qip h GLU 143 Ca 0.16 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.47 1qip h GLU 143 Cb 0.32 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 29.40 1qip h GLU 143 CO 0.00 0.49 -0.02 1.28 -1.00 0.00 0.00 179.01 179.77 1qip n LEU 144 N -4.47 0.27 -0.04 1.33 4.77 -0.40 -4.92 117.00 113.54 1qip n LEU 144 Ca 0.10 -0.02 -0.00 0.00 -0.03 0.00 0.00 56.01 56.05 1qip n LEU 144 Cb 0.20 -0.07 -0.00 0.00 -2.33 0.00 0.00 43.42 41.21 1qip n LEU 144 CO 0.34 0.05 -0.00 0.61 -1.33 0.00 0.00 177.39 177.05 1qip n GLY 145 N 1.11 0.41 3.77 -0.72 0.00 -0.58 -5.01 105.19 104.16 1qip n GLY 145 Ca 0.20 -1.05 -0.40 0.00 0.00 0.00 0.00 46.02 44.77 1qip n GLY 145 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1qip s VAL 146 N -2.02 2.70 0.05 1.61 1.01 -0.53 -4.98 120.40 118.24 1qip s VAL 146 Ca 0.00 0.69 -0.28 0.00 0.00 0.00 0.00 61.98 62.40 1qip s VAL 146 Cb 0.00 -3.44 -0.05 0.00 0.00 0.00 0.00 36.38 32.89 1qip s VAL 146 CO 0.00 0.16 0.88 -0.54 0.00 0.00 0.00 175.10 175.60 1qip s LYS 147 N -1.87 4.59 0.05 2.72 -0.14 -1.26 -4.74 119.74 119.08 1qip s LYS 147 Ca 0.50 1.28 0.04 0.00 -1.36 0.00 0.00 55.97 56.43 1qip s LYS 147 Cb -0.39 -3.39 -0.04 0.00 -1.68 0.00 0.00 37.83 32.32 1qip s LYS 147 CO 0.52 0.17 -0.03 -0.06 -0.76 0.00 0.00 175.35 175.19 1qip s PHE 148 N 0.24 2.94 -0.24 3.18 0.40 -1.26 -1.07 117.98 122.18 1qip s PHE 148 Ca 0.45 -0.03 -0.04 0.00 -0.60 0.00 0.00 56.93 56.71 1qip s PHE 148 Cb -0.22 -1.57 -0.17 0.00 0.51 0.00 0.00 43.02 41.57 1qip s PHE 148 CO 0.26 0.44 -0.14 0.28 0.70 0.00 0.00 175.22 176.76 1qip n VAL 149 N 1.03 1.55 -3.63 -0.44 0.31 0.48 -4.90 118.33 112.73 1qip n VAL 149 Ca -0.13 -0.51 -0.16 0.00 -0.01 0.00 0.00 64.34 63.53 1qip n VAL 149 Cb 0.52 -1.60 -0.14 0.00 -0.91 0.00 0.00 33.84 31.71 1qip n VAL 149 CO 0.00 0.00 0.00 -0.75 -1.32 0.00 0.00 176.83 174.76 1qip s LYS 150 N -2.52 0.11 0.67 5.55 2.20 -0.50 -4.94 119.74 120.32 1qip s LYS 150 Ca -0.34 0.56 -0.12 0.00 -0.36 0.00 0.00 55.97 55.71 1qip s LYS 150 Cb 0.10 -0.39 -0.00 0.00 -1.51 0.00 0.00 37.83 36.03 1qip s LYS 150 CO 0.60 -0.38 1.06 0.15 -0.36 0.00 0.00 175.35 176.42 1qip s LYS 151 N 2.35 3.02 0.27 4.03 1.02 -1.26 -0.98 119.74 128.19 1qip s LYS 151 Ca 0.03 1.04 0.00 0.00 0.02 0.00 0.00 55.97 57.06 1qip s LYS 151 Cb -0.13 -2.00 0.59 0.00 -0.52 0.00 0.00 37.83 35.78 1qip s LYS 151 CO -0.08 -1.04 1.72 -1.35 -0.92 0.00 0.00 175.35 173.68 1qip h PRO 152 N -0.39 0.45 -0.65 -1.68 0.11 -1.94 -1.10 132.00 126.80 1qip h PRO 152 Ca -0.45 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.64 1qip h PRO 152 Cb 1.21 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.22 1qip h PRO 152 CO 0.57 0.30 0.00 -0.25 -0.21 0.00 0.00 178.00 178.40 1qip n ASP 153 N -5.00 4.51 -4.79 -2.05 8.00 -1.26 -0.61 116.55 115.35 1qip n ASP 153 Ca 0.18 -2.43 -0.38 0.00 0.71 0.00 0.00 54.79 52.88 1qip n ASP 153 Cb 0.53 -0.56 -0.06 0.00 -0.02 0.00 0.00 41.12 41.00 1qip n ASP 153 CO 0.00 0.00 0.00 -1.81 -0.39 0.00 0.00 177.20 175.00 1qip s ASP 154 N -0.86 7.29 0.56 -2.24 1.01 -0.42 -4.95 116.67 117.07 1qip s ASP 154 Ca 0.48 1.63 0.00 0.00 0.71 0.00 0.00 52.55 55.37 1qip s ASP 154 Cb 0.31 -2.50 0.00 0.00 1.01 0.00 0.00 42.92 41.74 1qip s ASP 154 CO 0.23 0.10 0.00 0.61 0.21 0.00 0.00 175.17 176.32 1qip n GLY 155 N 1.13 -0.71 0.17 0.21 0.00 -1.26 -4.54 105.19 100.18 1qip n GLY 155 Ca -0.03 -1.10 -0.21 0.00 0.00 0.00 0.00 46.02 44.67 1qip n GLY 155 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1qip h LYS 156 N 0.00 0.58 -5.41 1.61 1.57 -1.97 -3.40 116.57 109.55 1qip h LYS 156 Ca 0.00 -0.75 -0.67 0.00 -1.87 0.00 0.00 60.65 57.36 1qip h LYS 156 Cb 0.00 0.25 -0.14 0.00 0.08 0.00 0.00 32.23 32.41 1qip h LYS 156 CO 0.00 1.33 1.23 -1.64 -0.57 0.00 0.00 179.45 179.80 1qip s MET 157 N -2.98 3.69 0.23 3.15 -1.94 -1.26 -4.86 119.30 115.33 1qip s MET 157 Ca -0.10 -1.68 -0.30 0.00 -1.71 0.00 0.00 55.69 51.90 1qip s MET 157 Cb 0.05 -5.13 -0.09 0.00 2.01 0.00 0.00 34.83 31.67 1qip s MET 157 CO 0.91 -1.95 1.21 0.15 -0.01 0.00 0.00 175.02 175.32 1qip s LYS 158 N 3.40 4.49 0.00 2.03 -0.14 -1.26 -3.29 119.74 124.98 1qip s LYS 158 Ca 0.40 1.93 0.00 0.00 -1.36 0.00 0.00 55.97 56.94 1qip s LYS 158 Cb -0.02 -3.20 0.00 0.00 -1.68 0.00 0.00 37.83 32.93 1qip s LYS 158 CO -0.07 -0.05 0.00 0.41 -0.76 0.00 0.00 175.35 174.88 1qip n GLY 159 N 1.77 0.74 3.20 -3.33 0.00 0.22 -4.99 105.19 102.80 1qip n GLY 159 Ca 0.03 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.77 1qip n GLY 159 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1qip s LEU 160 N 0.00 2.00 0.23 0.99 2.96 -1.21 -4.62 118.68 119.04 1qip s LEU 160 Ca 0.00 -0.40 0.06 0.00 -0.22 0.00 0.00 54.13 53.57 1qip s LEU 160 Cb 0.00 -1.11 -0.05 0.00 0.50 0.00 0.00 46.19 45.53 1qip s LEU 160 CO 0.00 0.21 -0.07 0.00 -1.32 0.00 0.00 176.35 175.17 1qip s ALA 161 N -0.20 2.04 -0.06 5.97 0.00 -0.75 -4.05 121.76 124.71 1qip s ALA 161 Ca 0.00 -1.77 -0.00 0.00 0.00 0.00 0.00 51.96 50.20 1qip s ALA 161 Cb -0.11 0.17 0.02 0.00 0.00 0.00 0.00 23.12 23.21 1qip s ALA 161 CO 0.01 -0.08 -0.03 -0.06 0.00 0.00 0.00 175.76 175.61 1qip s PHE 162 N -3.13 0.81 0.48 0.00 0.40 -0.15 -0.38 117.98 116.01 1qip s PHE 162 Ca 0.26 -0.25 0.05 0.00 -0.60 0.00 0.00 56.93 56.39 1qip s PHE 162 Cb 0.03 -0.79 -0.02 0.00 0.51 0.00 0.00 43.02 42.75 1qip s PHE 162 CO 0.09 -0.29 0.20 0.96 0.70 0.00 0.00 175.22 176.88 1qip s ILE 163 N 1.45 1.83 0.11 0.64 -4.36 0.03 -0.39 121.20 120.52 1qip s ILE 163 Ca -0.02 -1.72 0.08 0.00 -0.26 0.00 0.00 60.65 58.73 1qip s ILE 163 Cb -0.13 -2.54 -0.04 0.00 1.25 0.00 0.00 42.46 41.00 1qip s ILE 163 CO -0.03 0.00 -0.21 -1.10 0.24 0.00 0.00 174.94 173.84 1qip s GLN 164 N -4.01 1.17 0.43 0.37 -0.21 -0.23 -0.36 119.66 116.82 1qip s GLN 164 Ca 0.30 -1.22 -0.01 0.00 0.02 0.00 0.00 55.36 54.45 1qip s GLN 164 Cb 0.02 -1.42 0.09 0.00 1.00 0.00 0.00 33.01 32.69 1qip s GLN 164 CO 0.17 0.33 0.58 -0.40 -2.12 0.00 0.00 175.29 173.85 1qip n ASP 165 N 0.94 0.69 0.06 5.90 5.75 -0.64 -4.39 116.55 124.86 1qip n ASP 165 Ca -0.18 -1.60 0.14 0.00 -0.01 0.00 0.00 54.79 53.13 1qip n ASP 165 Cb 0.54 -0.39 0.62 0.00 -1.03 0.00 0.00 41.12 40.86 1qip n ASP 165 CO 0.00 0.00 0.00 -0.65 -0.11 0.00 0.00 177.20 176.44 1qip h PRO 166 N 0.00 0.12 -0.01 0.11 0.11 -1.91 -0.41 132.00 130.02 1qip h PRO 166 Ca -0.19 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.91 1qip h PRO 166 Cb 0.69 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 31.77 1qip h PRO 166 CO 0.20 0.08 -0.19 -0.25 -0.21 0.00 0.00 178.00 177.63 1qip n ASP 167 N -4.45 0.84 0.00 -2.05 8.00 -1.26 -4.93 116.55 112.69 1qip n ASP 167 Ca 0.06 -0.80 0.00 0.00 0.71 0.00 0.00 54.79 54.75 1qip n ASP 167 Cb 0.37 0.05 0.00 0.00 -0.02 0.00 0.00 41.12 41.52 1qip n ASP 167 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1qip n GLY 168 N 1.31 0.76 3.76 0.44 0.00 -0.16 -4.79 105.19 106.50 1qip n GLY 168 Ca 0.13 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.74 1qip n GLY 168 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1qip s TYR 169 N -2.33 2.94 0.29 1.61 2.02 -1.26 -4.67 117.35 115.95 1qip s TYR 169 Ca 0.00 1.12 -0.28 0.00 -0.37 0.00 0.00 57.07 57.54 1qip s TYR 169 Cb 0.00 -3.84 -0.09 0.00 -0.40 0.00 0.00 41.96 37.63 1qip s TYR 169 CO 0.00 -2.59 0.99 -1.58 -1.57 0.00 0.00 175.55 170.80 1qip s TRP 170 N -0.44 3.74 -0.17 2.71 0.52 -1.26 -1.62 118.94 122.41 1qip s TRP 170 Ca 0.56 1.80 -0.02 0.00 0.02 0.00 0.00 56.10 58.47 1qip s TRP 170 Cb -0.42 -3.06 0.05 0.00 -1.15 0.00 0.00 33.47 28.89 1qip s TRP 170 CO 0.49 0.03 0.00 0.42 0.02 0.00 0.00 176.95 177.91 1qip s ILE 171 N -1.33 0.70 0.28 2.03 1.01 0.51 -1.96 121.20 122.44 1qip s ILE 171 Ca 0.46 -0.49 -0.29 0.00 0.00 0.00 0.00 60.65 60.33 1qip s ILE 171 Cb -0.25 -1.05 -0.10 0.00 0.01 0.00 0.00 42.46 41.08 1qip s ILE 171 CO 0.32 -0.03 1.10 -0.70 0.00 0.00 0.00 174.94 175.62 1qip s GLU 172 N 1.80 4.63 -0.29 2.79 2.12 0.35 -0.79 118.70 129.31 1qip s GLU 172 Ca 0.00 1.80 0.03 0.00 0.36 0.00 0.00 54.97 57.16 1qip s GLU 172 Cb -0.16 -3.17 0.08 0.00 0.26 0.00 0.00 34.13 31.14 1qip s GLU 172 CO -0.07 0.20 -0.03 0.42 -0.54 0.00 0.00 175.26 175.24 1qip s ILE 173 N -1.18 2.05 0.10 -3.70 -1.09 0.49 -0.51 121.20 117.36 1qip s ILE 173 Ca 0.45 -1.84 0.05 0.00 -2.23 0.00 0.00 60.65 57.08 1qip s ILE 173 Cb -0.32 -2.33 -0.03 0.00 -1.58 0.00 0.00 42.46 38.20 1qip s ILE 173 CO 0.41 -0.29 -0.13 -1.48 -1.23 0.00 0.00 174.94 172.22 1qip s LEU 174 N 1.10 2.37 -0.34 2.97 2.34 -0.79 -1.82 118.68 124.51 1qip s LEU 174 Ca 0.00 -0.75 -0.04 0.00 0.06 0.00 0.00 54.13 53.40 1qip s LEU 174 Cb -0.19 -0.46 0.05 0.00 -0.56 0.00 0.00 46.19 45.04 1qip s LEU 174 CO -0.07 -0.16 0.09 0.21 -1.06 0.00 0.00 176.35 175.35 1qip s ASN 175 N -2.23 5.17 0.52 1.48 3.84 -1.26 -0.49 114.94 121.97 1qip s ASN 175 Ca 0.04 -1.32 0.20 0.00 0.21 0.00 0.00 52.86 52.00 1qip s ASN 175 Cb -0.06 -1.81 1.32 0.00 -0.55 0.00 0.00 41.25 40.15 1qip s ASN 175 CO 0.02 -0.34 2.07 -0.65 -2.79 0.00 0.00 177.10 175.41 1qip h PRO 176 N 8.13 0.01 0.00 0.43 0.11 -1.97 -1.60 132.00 137.12 1qip h PRO 176 Ca -0.21 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.90 1qip h PRO 176 Cb 1.07 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.18 1qip h PRO 176 CO 0.60 0.01 0.00 0.09 -0.21 0.00 0.00 178.00 178.48 1qip n ASN 177 N -4.46 0.00 0.00 -2.05 3.02 -1.26 -3.06 115.26 107.45 1qip n ASN 177 Ca 0.04 -0.94 0.00 0.00 -0.03 0.00 0.00 54.58 53.64 1qip n ASN 177 Cb 0.35 -0.01 0.00 0.00 -0.61 0.00 0.00 39.78 39.51 1qip n ASN 177 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1qip n LYS 178 N -1.01 1.78 0.22 3.52 5.02 -0.63 -4.75 118.16 122.30 1qip n LYS 178 Ca 0.23 -0.28 0.05 0.00 -2.02 0.00 0.00 58.31 56.29 1qip n LYS 178 Cb 0.11 -0.76 0.49 0.00 -0.02 0.00 0.00 35.03 34.86 1qip n LYS 178 CO 0.00 0.00 0.00 0.52 -0.52 0.00 0.00 177.40 177.40 1qip h MET 179 N 0.00 0.01 0.00 1.97 2.86 -1.40 -2.55 114.93 115.82 1qip h MET 179 Ca 0.00 -0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 1qip h MET 179 Cb 0.04 -0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.69 1qip h MET 179 CO 0.00 0.20 0.00 0.00 1.06 0.00 0.00 176.91 178.17 1qip h ALA 180 N 1.80 1.00 -0.77 6.32 0.00 -1.86 -2.51 119.26 123.25 1qip h ALA 180 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 54.91 54.57 1qip h ALA 180 Cb 0.34 0.00 -0.20 0.00 0.00 0.00 0.00 17.79 17.92 1qip h ALA 180 CO 0.02 0.00 0.38 0.25 0.00 0.00 0.00 179.25 179.90 1qip n THR 181 N -2.89 2.97 -4.17 0.00 -2.24 -0.96 -4.94 114.28 102.05 1qip n THR 181 Ca 0.00 -2.00 -0.35 0.00 -2.27 0.00 0.00 64.05 59.44 1qip n THR 181 Cb 0.25 -0.40 -0.09 0.00 -2.10 0.00 0.00 70.33 67.98 1qip n THR 181 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 1qip s LEU 182 N -3.18 3.73 0.00 3.22 2.96 -0.95 -5.09 118.68 119.37 1qip s LEU 182 Ca 0.54 0.12 0.00 0.00 -0.22 0.00 0.00 54.13 54.57 1qip s LEU 182 Cb 0.45 -1.90 0.00 0.00 0.50 0.00 0.00 46.19 45.24 1qip s LEU 182 CO 0.09 0.27 0.00 0.80 -1.32 0.00 0.00 176.35 176.20