#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1qip s GLY 9 N 0.00 1.54 0.42 -0.02 0.00 -1.26 -5.06 107.32 102.93 1qip s GLY 9 Ca 0.00 -0.99 -0.25 0.00 0.00 0.00 0.00 44.72 43.48 1qip s GLY 9 CO 0.00 -0.83 1.19 1.08 0.00 0.00 0.00 173.10 174.54 1qip s LEU 10 N -4.56 4.15 0.76 0.66 1.43 -1.26 -5.02 118.68 114.85 1qip s LEU 10 Ca 0.47 2.39 -0.11 0.00 -1.03 0.00 0.00 54.13 55.85 1qip s LEU 10 Cb -0.10 -4.06 0.05 0.00 0.03 0.00 0.00 46.19 42.11 1qip s LEU 10 CO 0.38 -0.77 1.09 0.42 0.23 0.00 0.00 176.35 177.70 1qip s THR 11 N -1.42 3.33 0.24 5.49 -4.23 -1.26 -4.87 115.64 112.92 1qip s THR 11 Ca 0.59 0.43 -0.07 0.00 -1.18 0.00 0.00 61.69 61.46 1qip s THR 11 Cb -0.31 -3.22 0.22 0.00 1.34 0.00 0.00 72.50 70.52 1qip s THR 11 CO 0.39 -0.56 1.88 0.44 -0.54 0.00 0.00 174.62 176.23 1qip h ASP 12 N -0.94 1.12 -0.62 3.99 3.32 -2.00 -1.46 116.42 119.83 1qip h ASP 12 Ca -0.46 -0.07 -0.07 0.00 0.02 0.00 0.00 57.03 56.45 1qip h ASP 12 Cb 1.25 -0.28 -0.02 0.00 0.22 0.00 0.00 39.33 40.50 1qip h ASP 12 CO 0.60 0.86 0.13 -0.33 -1.72 0.00 0.00 179.24 178.78 1qip h GLU 13 N 1.28 1.01 -0.42 3.56 3.07 -1.99 -1.67 114.58 119.43 1qip h GLU 13 Ca 0.33 -0.26 -0.05 0.00 -0.50 0.00 0.00 59.36 58.88 1qip h GLU 13 Cb -0.05 -0.13 -0.02 0.00 -0.84 0.00 0.00 28.75 27.72 1qip h GLU 13 CO -0.06 0.93 0.05 0.00 -1.40 0.00 0.00 179.01 178.53 1qip h ALA 14 N 1.04 0.55 -0.52 3.43 0.00 -1.85 -0.78 119.26 121.13 1qip h ALA 14 Ca 0.19 -0.23 0.03 0.00 0.00 0.00 0.00 54.91 54.90 1qip h ALA 14 Cb 0.39 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 17.99 1qip h ALA 14 CO 0.01 0.29 0.30 0.00 0.00 0.00 0.00 179.25 179.85 1qip h ALA 15 N 0.92 0.67 -0.59 0.00 0.00 -1.06 -1.64 119.26 117.56 1qip h ALA 15 Ca 0.12 -0.00 -0.07 0.00 0.00 0.00 0.00 54.91 54.96 1qip h ALA 15 Cb 0.41 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.04 1qip h ALA 15 CO 0.01 -0.01 0.09 -0.07 0.00 0.00 0.00 179.25 179.28 1qip h LEU 16 N 0.59 0.90 -1.62 0.00 3.38 -1.08 -2.22 115.31 115.25 1qip h LEU 16 Ca 0.22 -0.20 -0.03 0.00 0.09 0.00 0.00 57.88 57.96 1qip h LEU 16 Cb 0.06 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.56 1qip h LEU 16 CO -0.11 0.90 -0.08 -1.28 0.09 0.00 0.00 178.44 177.96 1qip h SER 17 N 0.89 0.14 0.84 -0.43 0.87 -0.49 -2.15 113.55 113.21 1qip h SER 17 Ca 0.18 -0.02 0.00 0.00 -1.23 0.00 0.00 61.79 60.72 1qip h SER 17 Cb 0.39 -0.03 0.00 0.00 -0.44 0.00 0.00 62.40 62.32 1qip h SER 17 CO 0.01 0.24 0.00 0.00 -0.53 0.00 0.00 176.83 176.55 1qip s SER 20 N -1.75 3.63 0.72 0.00 0.01 -1.26 -5.00 113.70 110.05 1qip s SER 20 Ca 0.30 -0.74 -0.14 0.00 1.31 0.00 0.00 55.95 56.68 1qip s SER 20 Cb -0.14 -0.38 0.04 0.00 0.21 0.00 0.00 66.02 65.75 1qip s SER 20 CO 0.17 0.14 1.16 -1.81 0.41 0.00 0.00 173.24 173.31 1qip s ASP 21 N -2.50 4.41 -0.03 2.44 1.01 -1.26 -4.92 116.67 115.83 1qip s ASP 21 Ca 0.20 2.19 -0.30 0.00 0.71 0.00 0.00 52.55 55.35 1qip s ASP 21 Cb -0.09 -2.57 -0.06 0.00 1.01 0.00 0.00 42.92 41.21 1qip s ASP 21 CO 0.10 -2.11 1.61 0.00 0.21 0.00 0.00 175.17 174.98 1qip s ALA 22 N -2.22 3.63 0.49 5.23 0.00 -1.26 -4.97 121.76 122.66 1qip s ALA 22 Ca 0.70 0.96 -0.23 0.00 0.00 0.00 0.00 51.96 53.40 1qip s ALA 22 Cb -0.25 -3.71 -0.07 0.00 0.00 0.00 0.00 23.12 19.09 1qip s ALA 22 CO 0.46 -1.28 1.28 0.34 0.00 0.00 0.00 175.76 176.56 1qip s ASP 23 N 2.95 5.79 0.55 0.00 2.15 -1.26 -4.89 116.67 121.96 1qip s ASP 23 Ca 0.72 2.59 0.24 0.00 0.43 0.00 0.00 52.55 56.53 1qip s ASP 23 Cb -0.34 -2.63 1.47 0.00 -0.30 0.00 0.00 42.92 41.13 1qip s ASP 23 CO 0.29 -1.20 2.07 -0.65 -0.17 0.00 0.00 175.17 175.51 1qip h PRO 24 N 1.90 0.00 0.00 4.34 0.11 -2.01 0.96 132.00 137.31 1qip h PRO 24 Ca -0.50 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.61 1qip h PRO 24 Cb 1.27 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.38 1qip h PRO 24 CO 0.59 0.00 0.00 0.66 -0.21 0.00 0.00 178.00 179.04 1qip h SER 25 N 0.00 0.00 -0.68 -2.05 4.64 -2.03 -2.19 113.55 111.24 1qip h SER 25 Ca 0.13 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.45 1qip h SER 25 Cb 0.56 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.65 1qip h SER 25 CO -0.00 0.00 0.00 0.35 -0.87 0.00 0.00 176.83 176.31 1qip n THR 26 N -2.44 1.19 -1.90 2.95 -2.24 0.33 -4.96 114.28 107.21 1qip n THR 26 Ca 0.00 -1.00 -0.41 0.00 -2.27 0.00 0.00 64.05 60.38 1qip n THR 26 Cb 0.17 0.36 -0.01 0.00 -2.10 0.00 0.00 70.33 68.75 1qip n THR 26 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 1qip s LYS 27 N -1.29 4.19 0.00 -0.78 2.20 -0.83 -1.86 119.74 121.37 1qip s LYS 27 Ca 0.48 2.46 0.00 0.00 -0.36 0.00 0.00 55.97 58.54 1qip s LYS 27 Cb 0.27 -3.02 0.00 0.00 -1.51 0.00 0.00 37.83 33.57 1qip s LYS 27 CO 0.30 -0.46 0.00 -0.25 -0.36 0.00 0.00 175.35 174.58 1qip n ASP 28 N 1.07 -0.63 -4.76 1.43 9.92 -1.26 -5.01 116.55 117.31 1qip n ASP 28 Ca 0.03 0.00 -0.39 0.00 -0.53 0.00 0.00 54.79 53.90 1qip n ASP 28 Cb 0.40 -0.57 0.02 0.00 -0.64 0.00 0.00 41.12 40.32 1qip n ASP 28 CO 0.00 0.00 0.00 -0.36 0.13 0.00 0.00 177.20 176.97 1qip s PHE 29 N -3.15 2.50 -0.00 1.24 0.40 -0.78 -5.02 117.98 113.17 1qip s PHE 29 Ca 0.00 1.38 -0.08 0.00 -0.60 0.00 0.00 56.93 57.63 1qip s PHE 29 Cb 0.00 -3.74 0.00 0.00 0.51 0.00 0.00 43.02 39.79 1qip s PHE 29 CO 0.00 -2.56 0.15 -0.48 0.70 0.00 0.00 175.22 173.03 1qip s LEU 30 N -3.09 1.50 -0.62 -0.37 0.05 -1.26 -5.10 118.68 109.79 1qip s LEU 30 Ca 0.66 -0.15 -0.25 0.00 0.05 0.00 0.00 54.13 54.44 1qip s LEU 30 Cb -0.39 0.70 0.05 0.00 -2.05 0.00 0.00 46.19 44.50 1qip s LEU 30 CO 0.48 -0.35 1.03 -0.22 -0.55 0.00 0.00 176.35 176.74 1qip s LEU 31 N -1.27 3.96 -0.12 1.48 2.96 -1.26 -4.88 118.68 119.55 1qip s LEU 31 Ca -0.14 -0.51 0.01 0.00 -0.22 0.00 0.00 54.13 53.27 1qip s LEU 31 Cb -0.07 -2.70 -0.24 0.00 0.50 0.00 0.00 46.19 43.68 1qip s LEU 31 CO 0.02 -1.42 0.35 1.67 -1.32 0.00 0.00 176.35 175.64 1qip n GLN 32 N 7.97 0.71 -3.68 1.98 0.00 -1.26 -2.39 117.38 120.71 1qip n GLN 32 Ca 0.01 0.24 -0.10 0.00 -0.00 0.00 0.00 57.00 57.15 1qip n GLN 32 Cb 0.47 -1.70 -0.04 0.00 0.00 0.00 0.00 30.24 28.97 1qip n GLN 32 CO 0.00 0.00 0.00 1.14 0.00 0.00 0.00 177.06 178.20 1qip s GLN 33 N -2.56 1.19 -0.08 3.69 -2.07 -1.26 -1.15 119.66 117.42 1qip s GLN 33 Ca -0.19 -0.78 0.02 0.00 -1.82 0.00 0.00 55.36 52.60 1qip s GLN 33 Cb 0.07 0.49 0.02 0.00 -1.09 0.00 0.00 33.01 32.49 1qip s GLN 33 CO 0.77 -0.48 -0.12 0.99 -1.32 0.00 0.00 175.29 175.13 1qip s THR 34 N -3.83 1.16 -0.13 3.63 2.01 -0.74 -4.94 115.64 112.80 1qip s THR 34 Ca 0.06 -0.46 -0.03 0.00 0.31 0.00 0.00 61.69 61.56 1qip s THR 34 Cb 0.01 -1.09 -0.03 0.00 0.01 0.00 0.00 72.50 71.40 1qip s THR 34 CO -0.08 0.37 -0.00 -0.32 -0.69 0.00 0.00 174.62 173.89 1qip s MET 35 N 0.93 3.40 -0.02 4.92 1.75 -1.26 -0.73 119.30 128.29 1qip s MET 35 Ca -0.09 -0.44 0.03 0.00 -1.25 0.00 0.00 55.69 53.94 1qip s MET 35 Cb -0.15 -2.91 -0.00 0.00 2.84 0.00 0.00 34.83 34.61 1qip s MET 35 CO 0.00 0.46 -0.11 -0.51 -0.65 0.00 0.00 175.02 174.22 1qip s LEU 36 N -0.22 1.90 0.13 4.11 1.43 -0.45 -4.97 118.68 120.60 1qip s LEU 36 Ca 0.05 -0.21 -0.25 0.00 -1.03 0.00 0.00 54.13 52.68 1qip s LEU 36 Cb -0.12 -0.62 -0.07 0.00 0.03 0.00 0.00 46.19 45.41 1qip s LEU 36 CO 0.02 0.11 0.78 -0.13 0.23 0.00 0.00 176.35 177.36 1qip s ARG 37 N -0.02 4.55 -0.05 1.70 0.52 -1.26 -1.11 118.95 123.28 1qip s ARG 37 Ca -0.00 1.14 0.04 0.00 -0.52 0.00 0.00 55.73 56.40 1qip s ARG 37 Cb -0.07 -3.30 -0.00 0.00 0.52 0.00 0.00 34.95 32.10 1qip s ARG 37 CO 0.00 0.47 -0.18 0.14 0.02 0.00 0.00 175.30 175.74 1qip s VAL 38 N -0.75 1.55 0.12 3.52 -7.23 0.08 -4.88 120.40 112.81 1qip s VAL 38 Ca 0.37 -0.77 -0.15 0.00 -1.81 0.00 0.00 61.98 59.62 1qip s VAL 38 Cb -0.22 -1.34 -0.02 0.00 0.56 0.00 0.00 36.38 35.36 1qip s VAL 38 CO 0.25 0.44 1.57 0.50 -0.31 0.00 0.00 175.10 177.56 1qip h LYS 39 N 6.34 0.71 -3.42 4.82 3.64 -1.95 -3.40 116.57 123.31 1qip h LYS 39 Ca -0.31 -0.22 -0.49 0.00 -1.27 0.00 0.00 60.65 58.36 1qip h LYS 39 Cb 1.18 -0.06 -0.40 0.00 -0.41 0.00 0.00 32.23 32.54 1qip h LYS 39 CO 0.48 0.79 -0.76 0.34 -2.27 0.00 0.00 179.45 178.03 1qip s ASP 40 N -6.20 2.59 0.39 4.20 -1.08 -1.26 -2.90 116.67 112.41 1qip s ASP 40 Ca -0.13 -0.68 0.12 0.00 -0.52 0.00 0.00 52.55 51.34 1qip s ASP 40 Cb 0.10 -0.47 0.79 0.00 -1.46 0.00 0.00 42.92 41.88 1qip s ASP 40 CO 0.79 -0.31 1.88 1.55 0.52 0.00 0.00 175.17 179.61 1qip h PRO 41 N 8.31 0.08 -0.44 4.34 0.13 -1.98 -2.06 132.00 140.38 1qip h PRO 41 Ca -0.16 -0.02 -0.01 0.00 -0.87 0.00 0.00 66.00 64.93 1qip h PRO 41 Cb 1.13 -0.01 -0.02 0.00 0.13 0.00 0.00 31.00 32.23 1qip h PRO 41 CO 0.31 0.34 0.22 0.87 -0.23 0.00 0.00 178.00 179.52 1qip h LYS 42 N 0.08 0.62 -0.32 0.86 1.57 -1.99 0.15 116.57 117.54 1qip h LYS 42 Ca 0.01 -0.08 -0.08 0.00 -1.87 0.00 0.00 60.65 58.63 1qip h LYS 42 Cb 0.50 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 32.69 1qip h LYS 42 CO 0.04 0.52 -0.11 0.87 -0.57 0.00 0.00 179.45 180.20 1qip h LYS 43 N 0.57 0.64 -0.33 3.15 1.57 -1.92 -2.54 116.57 117.72 1qip h LYS 43 Ca 0.15 -0.26 -0.05 0.00 -1.87 0.00 0.00 60.65 58.62 1qip h LYS 43 Cb 0.09 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.36 1qip h LYS 43 CO -0.02 0.84 0.01 0.77 -0.57 0.00 0.00 179.45 180.48 1qip h SER 44 N 0.42 0.55 -0.79 0.86 0.02 -1.22 -1.05 113.55 112.34 1qip h SER 44 Ca 0.08 -0.30 -0.00 0.00 -0.84 0.00 0.00 61.79 60.73 1qip h SER 44 Cb 0.62 -0.15 -0.04 0.00 0.14 0.00 0.00 62.40 62.97 1qip h SER 44 CO 0.04 0.71 0.48 -0.07 -1.14 0.00 0.00 176.83 176.85 1qip h LEU 45 N 0.38 0.94 -0.44 5.07 3.38 -0.73 -0.57 115.31 123.33 1qip h LEU 45 Ca 0.09 -0.06 -0.01 0.00 0.09 0.00 0.00 57.88 57.99 1qip h LEU 45 Cb 0.42 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.91 1qip h LEU 45 CO 0.01 0.73 0.23 -0.78 0.09 0.00 0.00 178.44 178.73 1qip h ASP 46 N 1.08 0.56 0.34 -0.43 3.58 -1.30 -1.12 116.42 119.12 1qip h ASP 46 Ca 0.28 -0.10 -0.02 0.00 0.42 0.00 0.00 57.03 57.62 1qip h ASP 46 Cb -0.04 -0.14 0.00 0.00 1.72 0.00 0.00 39.33 40.87 1qip h ASP 46 CO -0.05 0.50 -0.16 0.15 -2.88 0.00 0.00 179.24 176.80 1qip h PHE 47 N 0.58 -0.42 -0.01 0.28 3.57 -0.84 0.67 116.94 120.78 1qip h PHE 47 Ca 0.15 -0.01 -0.10 0.00 3.53 0.00 0.00 57.97 61.55 1qip h PHE 47 Cb 0.07 0.14 -0.01 0.00 2.79 0.00 0.00 35.95 38.94 1qip h PHE 47 CO -0.02 -0.21 -0.47 1.88 -2.23 0.00 0.00 178.31 177.26 1qip h TYR 48 N -0.52 0.02 0.00 0.41 0.05 -1.09 -0.90 116.97 114.95 1qip h TYR 48 Ca -0.05 -0.01 -0.11 0.00 0.05 0.00 0.00 58.73 58.62 1qip h TYR 48 Cb 0.39 -0.01 -0.02 0.00 1.01 0.00 0.00 36.73 38.11 1qip h TYR 48 CO -0.03 0.48 -0.75 1.79 -1.05 0.00 0.00 178.16 178.60 1qip h THR 49 N 0.02 0.62 -0.06 -2.88 1.35 -1.20 -0.29 112.91 110.47 1qip h THR 49 Ca -0.00 -1.69 -0.05 0.00 -0.55 0.00 0.00 66.41 64.12 1qip h THR 49 Cb 0.83 1.40 0.00 0.00 -1.73 0.00 0.00 68.15 68.65 1qip h THR 49 CO 0.06 0.21 -0.14 -0.09 -0.25 0.00 0.00 175.52 175.31 1qip h ARG 50 N -1.00 0.20 0.01 4.72 2.43 -0.96 -1.09 114.38 118.69 1qip h ARG 50 Ca -0.16 -0.14 -0.00 0.00 -0.81 0.00 0.00 59.98 58.87 1qip h ARG 50 Cb 0.88 0.02 0.00 0.00 -0.42 0.00 0.00 29.97 30.45 1qip h ARG 50 CO -0.10 0.74 -0.00 0.28 -1.51 0.00 0.00 179.97 179.38 1qip h VAL 51 N -0.32 1.56 0.00 0.20 2.07 -1.19 -3.38 116.25 115.19 1qip h VAL 51 Ca -0.00 -1.88 0.00 0.00 0.82 0.00 0.00 66.70 65.64 1qip h VAL 51 Cb 0.75 2.81 0.00 0.00 -1.52 0.00 0.00 31.29 33.33 1qip h VAL 51 CO 0.03 0.47 -0.76 0.18 0.02 0.00 0.00 177.57 177.52 1qip n LEU 52 N -4.71 0.67 0.00 2.57 4.77 -0.74 -4.98 117.00 114.58 1qip n LEU 52 Ca -0.09 -0.15 0.00 0.00 -0.03 0.00 0.00 56.01 55.74 1qip n LEU 52 Cb 0.38 -0.14 0.00 0.00 -2.33 0.00 0.00 43.42 41.33 1qip n LEU 52 CO 0.32 0.14 0.00 0.61 -1.33 0.00 0.00 177.39 177.13 1qip n GLY 53 N 1.47 0.55 3.86 -0.72 0.00 -0.41 -4.97 105.19 104.97 1qip n GLY 53 Ca 0.04 -0.24 -0.30 0.00 0.00 0.00 0.00 46.02 45.52 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 -0.55 2.43 -0.07 1.61 -1.94 -0.15 -4.87 119.30 115.76 1qip s MET 54 Ca 0.00 0.44 0.04 0.00 -1.71 0.00 0.00 55.69 54.45 1qip s MET 54 Cb 0.00 -1.98 -0.02 0.00 2.01 0.00 0.00 34.83 34.85 1qip s MET 54 CO 0.00 -1.33 -0.18 0.99 -0.01 0.00 0.00 175.02 174.49 1qip s THR 55 N -3.34 2.64 -0.35 2.05 2.01 0.15 -4.20 115.64 114.60 1qip s THR 55 Ca 0.60 -0.85 -0.29 0.00 0.31 0.00 0.00 61.69 61.46 1qip s THR 55 Cb -0.12 -2.03 0.01 0.00 0.01 0.00 0.00 72.50 70.37 1qip s THR 55 CO 0.52 0.57 1.27 -0.22 -0.69 0.00 0.00 174.62 176.07 1qip s LEU 56 N -0.21 3.80 -0.01 4.42 2.96 -1.26 -1.29 118.68 127.08 1qip s LEU 56 Ca -0.01 1.01 0.18 0.00 -0.22 0.00 0.00 54.13 55.10 1qip s LEU 56 Cb -0.13 -3.54 -0.23 0.00 0.50 0.00 0.00 46.19 42.79 1qip s LEU 56 CO 0.03 -1.15 0.62 2.30 -1.32 0.00 0.00 176.35 176.83 1qip n ILE 57 N 6.42 0.00 -3.61 6.68 -5.35 0.56 -5.00 119.36 119.07 1qip n ILE 57 Ca 0.14 -0.21 -0.12 0.00 -0.27 0.00 0.00 62.75 62.29 1qip n ILE 57 Cb 0.47 0.65 -0.07 0.00 -1.74 0.00 0.00 39.64 38.96 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 -2.89 0.70 -0.05 6.28 2.00 -1.20 -4.85 119.66 119.64 1qip s GLN 58 Ca 0.02 0.58 0.00 0.00 -2.00 0.00 0.00 55.36 53.96 1qip s GLN 58 Cb 0.13 0.34 0.02 0.00 0.80 0.00 0.00 33.01 34.30 1qip s GLN 58 CO 0.74 -0.13 -0.03 0.21 -0.50 0.00 0.00 175.29 175.57 1qip s LYS 59 N -0.18 0.77 -0.03 1.67 2.20 -1.26 -0.62 119.74 122.29 1qip s LYS 59 Ca -0.01 -0.05 0.05 0.00 -0.36 0.00 0.00 55.97 55.60 1qip s LYS 59 Cb -0.03 -0.88 -0.01 0.00 -1.51 0.00 0.00 37.83 35.40 1qip s LYS 59 CO -0.00 -0.14 -0.18 0.00 -0.36 0.00 0.00 175.35 174.66 1qip s ASP 61 N -0.14 2.64 -0.57 0.00 1.01 -1.26 -0.71 116.67 117.64 1qip s ASP 61 Ca 0.00 -0.44 0.04 0.00 0.71 0.00 0.00 52.55 52.86 1qip s ASP 61 Cb -0.10 -0.74 0.14 0.00 1.01 0.00 0.00 42.92 43.23 1qip s ASP 61 CO 0.01 0.20 0.34 -0.36 0.21 0.00 0.00 175.17 175.57 1qip s PHE 62 N -0.05 3.11 0.33 4.23 0.40 -0.10 -4.99 117.98 120.90 1qip s PHE 62 Ca -0.04 -3.12 0.02 0.00 -0.60 0.00 0.00 56.93 53.18 1qip s PHE 62 Cb -0.13 -2.62 0.56 0.00 0.51 0.00 0.00 43.02 41.34 1qip s PHE 62 CO 0.03 -0.68 1.92 -1.00 0.70 0.00 0.00 175.22 176.18 1qip h PRO 63 N 6.14 0.73 -0.13 0.24 0.13 -1.97 0.72 132.00 137.87 1qip h PRO 63 Ca 0.01 -0.11 -0.02 0.00 -0.87 0.00 0.00 66.00 65.02 1qip h PRO 63 Cb 0.85 -0.13 -0.01 0.00 0.13 0.00 0.00 31.00 31.84 1qip h PRO 63 CO 0.67 0.61 0.02 0.82 -0.23 0.00 0.00 178.00 179.88 1qip h ILE 64 N 0.73 1.22 -0.00 -3.56 2.04 -1.95 -3.03 117.51 112.96 1qip h ILE 64 Ca 0.18 -0.72 0.00 0.00 1.00 0.00 0.00 64.86 65.32 1qip h ILE 64 Cb 0.15 1.45 0.00 0.00 -0.74 0.00 0.00 36.82 37.68 1qip h ILE 64 CO -0.02 0.21 -0.14 0.23 0.00 0.00 0.00 178.15 178.44 1qip n MET 65 N -4.81 0.57 -3.27 2.37 2.81 -1.15 -4.97 117.12 108.67 1qip n MET 65 Ca -0.05 -0.20 -0.15 0.00 -1.81 0.00 0.00 57.70 55.48 1qip n MET 65 Cb 0.18 -1.50 0.07 0.00 -0.71 0.00 0.00 33.22 31.27 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 -1.04 -2.72 -3.59 0.03 5.02 0.21 -4.92 118.16 111.15 1qip n LYS 66 Ca 0.13 0.86 -0.12 0.00 -2.02 0.00 0.00 58.31 57.17 1qip n LYS 66 Cb 0.29 -5.83 -0.04 0.00 -0.02 0.00 0.00 35.03 29.43 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 -3.39 -0.30 0.15 2.13 -0.12 -0.99 -1.15 117.98 114.32 1qip s PHE 67 Ca 0.41 0.09 0.07 0.00 -0.05 0.00 0.00 56.93 57.45 1qip s PHE 67 Cb -0.05 0.31 -0.04 0.00 -0.63 0.00 0.00 43.02 42.61 1qip s PHE 67 CO 0.74 -0.70 -0.15 -1.12 -0.05 0.00 0.00 175.22 173.94 1qip s SER 68 N -2.56 2.27 -0.07 1.98 0.01 -0.08 -0.92 113.70 114.32 1qip s SER 68 Ca 0.00 -0.89 0.05 0.00 1.31 0.00 0.00 55.95 56.42 1qip s SER 68 Cb 0.01 -0.10 -0.00 0.00 0.21 0.00 0.00 66.02 66.14 1qip s SER 68 CO -0.09 -0.14 -0.22 -0.76 0.41 0.00 0.00 173.24 172.43 1qip s LEU 69 N -2.77 2.00 -0.18 2.44 1.43 0.11 -1.11 118.68 120.61 1qip s LEU 69 Ca 0.14 -0.48 0.01 0.00 -1.03 0.00 0.00 54.13 52.77 1qip s LEU 69 Cb -0.03 -1.26 0.02 0.00 0.03 0.00 0.00 46.19 44.94 1qip s LEU 69 CO 0.04 0.17 -0.18 -0.31 0.23 0.00 0.00 176.35 176.30 1qip s TYR 70 N 0.16 2.79 -0.24 0.29 1.51 -0.04 -0.87 117.35 120.96 1qip s TYR 70 Ca -0.11 -1.55 -0.10 0.00 -1.01 0.00 0.00 57.07 54.30 1qip s TYR 70 Cb -0.15 -1.93 -0.05 0.00 -0.11 0.00 0.00 41.96 39.72 1qip s TYR 70 CO 0.06 -0.77 0.14 -0.06 -1.11 0.00 0.00 175.55 173.81 1qip s PHE 71 N 1.28 3.28 0.06 2.71 0.40 0.21 -0.21 117.98 125.70 1qip s PHE 71 Ca 0.04 0.14 0.08 0.00 -0.60 0.00 0.00 56.93 56.59 1qip s PHE 71 Cb -0.13 -2.25 -0.03 0.00 0.51 0.00 0.00 43.02 41.11 1qip s PHE 71 CO -0.11 0.02 -0.20 -0.51 0.70 0.00 0.00 175.22 175.12 1qip s LEU 72 N 1.07 2.51 0.20 -0.37 1.43 0.38 -0.32 118.68 123.58 1qip s LEU 72 Ca 0.07 -0.50 -0.22 0.00 -1.03 0.00 0.00 54.13 52.45 1qip s LEU 72 Cb -0.14 -1.46 0.05 0.00 0.03 0.00 0.00 46.19 44.68 1qip s LEU 72 CO 0.04 0.24 0.63 0.00 0.23 0.00 0.00 176.35 177.49 1qip s ALA 73 N -0.94 -1.41 -0.85 4.21 0.00 -0.41 -0.63 121.76 121.73 1qip s ALA 73 Ca 0.14 0.17 -0.19 0.00 0.00 0.00 0.00 51.96 52.09 1qip s ALA 73 Cb -0.10 0.87 0.13 0.00 0.00 0.00 0.00 23.12 24.02 1qip s ALA 73 CO 0.05 -0.86 1.01 0.71 0.00 0.00 0.00 175.76 176.68 1qip s TYR 74 N -3.82 3.14 0.04 0.00 2.02 -1.26 -0.67 117.35 116.80 1qip s TYR 74 Ca 0.05 -1.33 -0.00 0.00 -0.37 0.00 0.00 57.07 55.42 1qip s TYR 74 Cb -0.03 -4.19 -0.03 0.00 -0.40 0.00 0.00 41.96 37.31 1qip s TYR 74 CO -0.06 -1.42 -0.04 -1.21 -1.57 0.00 0.00 175.55 171.26 1qip s GLU 75 N 2.50 0.51 -0.07 -0.62 0.41 -1.26 -5.03 118.70 115.14 1qip s GLU 75 Ca 0.27 -0.97 -0.30 0.00 -0.41 0.00 0.00 54.97 53.57 1qip s GLU 75 Cb -0.09 0.11 -0.02 0.00 -1.78 0.00 0.00 34.13 32.34 1qip s GLU 75 CO -0.05 -0.07 1.10 0.34 -0.49 0.00 0.00 175.26 176.08 1qip s ASP 76 N -2.29 7.16 0.58 -0.19 -1.08 -1.26 -4.71 116.67 114.89 1qip s ASP 76 Ca -0.02 1.69 0.28 0.00 -0.52 0.00 0.00 52.55 53.97 1qip s ASP 76 Cb -0.00 -2.56 1.60 0.00 -1.46 0.00 0.00 42.92 40.50 1qip s ASP 76 CO -0.05 -0.49 2.08 0.50 0.52 0.00 0.00 175.17 177.72 1qip h LYS 77 N 7.21 0.00 0.00 4.34 3.64 -1.99 0.23 116.57 130.01 1qip h LYS 77 Ca -0.34 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.04 1qip h LYS 77 Cb 1.16 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.98 1qip h LYS 77 CO 0.86 0.00 0.00 0.09 -2.27 0.00 0.00 179.45 178.13 1qip n ASN 78 N -3.88 0.00 -0.08 4.20 3.02 -1.26 -2.85 115.26 114.41 1qip n ASN 78 Ca 0.03 0.10 0.12 0.00 -0.03 0.00 0.00 54.58 54.80 1qip n ASN 78 Cb 0.36 -0.35 0.27 0.00 -0.61 0.00 0.00 39.78 39.44 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 -1.35 0.70 -4.67 6.41 8.00 0.07 -4.86 116.55 120.85 1qip n ASP 79 Ca 0.10 -0.50 -0.42 0.00 0.71 0.00 0.00 54.79 54.68 1qip n ASP 79 Cb 0.24 0.26 -0.03 0.00 -0.02 0.00 0.00 41.12 41.57 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 -2.84 3.69 0.61 0.53 1.01 -1.13 -4.97 121.20 118.10 1qip s ILE 80 Ca 0.15 0.93 -0.19 0.00 0.00 0.00 0.00 60.65 61.54 1qip s ILE 80 Cb 0.18 -3.60 -0.02 0.00 0.01 0.00 0.00 42.46 39.03 1qip s ILE 80 CO 0.65 -0.06 1.30 -2.84 0.00 0.00 0.00 174.94 174.00 1qip s PRO 81 N 3.45 2.75 0.08 2.79 0.02 -1.26 -4.96 135.00 137.86 1qip s PRO 81 Ca 0.68 2.08 -0.04 0.00 0.02 0.00 0.00 61.00 63.74 1qip s PRO 81 Cb -0.31 -1.96 -0.28 0.00 0.02 0.00 0.00 34.50 31.96 1qip s PRO 81 CO 0.26 -1.45 1.14 0.87 -0.33 0.00 0.00 177.00 177.50 1qip h LYS 82 N 0.83 0.27 -6.82 5.54 1.57 -1.96 -3.42 116.57 112.58 1qip h LYS 82 Ca -0.51 -0.47 -0.48 0.00 -1.87 0.00 0.00 60.65 57.32 1qip h LYS 82 Cb 1.32 0.17 -0.02 0.00 0.08 0.00 0.00 32.23 33.79 1qip h LYS 82 CO 0.54 1.22 0.31 -2.00 -0.57 0.00 0.00 179.45 178.96 1qip s GLU 83 N -2.66 4.57 0.12 3.15 -6.30 -1.26 -4.94 118.70 111.38 1qip s GLU 83 Ca -0.04 1.28 -0.30 0.00 -2.50 0.00 0.00 54.97 53.41 1qip s GLU 83 Cb 0.07 -2.88 -0.08 0.00 0.00 0.00 0.00 34.13 31.24 1qip s GLU 83 CO 0.88 0.33 1.59 -0.22 0.02 0.00 0.00 175.26 177.87 1qip h LYS 84 N 3.35 -0.55 -0.38 4.30 3.64 -1.99 0.64 116.57 125.59 1qip h LYS 84 Ca -0.47 0.04 -0.13 0.00 -1.27 0.00 0.00 60.65 58.82 1qip h LYS 84 Cb 1.19 0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 33.13 1qip h LYS 84 CO 0.65 -0.36 -0.28 -0.44 -2.27 0.00 0.00 179.45 176.75 1qip h ASP 85 N -0.57 0.82 -0.47 4.20 3.32 -1.98 -1.83 116.42 119.91 1qip h ASP 85 Ca 0.05 -0.33 -0.09 0.00 0.02 0.00 0.00 57.03 56.68 1qip h ASP 85 Cb 0.64 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 39.94 1qip h ASP 85 CO -0.30 1.05 -0.03 -0.08 -1.72 0.00 0.00 179.24 178.17 1qip h GLU 86 N 0.68 0.91 -0.52 3.56 4.81 -1.93 -2.50 114.58 119.58 1qip h GLU 86 Ca 0.08 -0.28 -0.04 0.00 -0.13 0.00 0.00 59.36 59.00 1qip h GLU 86 Cb 0.82 -0.09 -0.02 0.00 0.63 0.00 0.00 28.75 30.09 1qip h GLU 86 CO 0.07 0.92 0.19 -0.22 -0.73 0.00 0.00 179.01 179.24 1qip h LYS 87 N 0.83 0.80 -0.14 1.92 3.64 -0.57 -1.17 116.57 121.89 1qip h LYS 87 Ca 0.15 -0.16 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 1qip h LYS 87 Cb 0.54 -0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 32.23 1qip h LYS 87 CO 0.03 0.72 0.09 0.82 -2.27 0.00 0.00 179.45 178.84 1qip h ILE 88 N 0.71 1.04 -0.40 2.00 2.04 -1.21 0.12 117.51 121.81 1qip h ILE 88 Ca 0.17 -0.09 -0.05 0.00 1.00 0.00 0.00 64.86 65.89 1qip h ILE 88 Cb 0.23 0.86 -0.02 0.00 -0.74 0.00 0.00 36.82 37.15 1qip h ILE 88 CO -0.01 0.04 0.02 0.00 0.00 0.00 0.00 178.15 178.20 1qip h ALA 89 N 1.04 1.29 -0.05 1.87 0.00 -1.29 -1.39 119.26 120.73 1qip h ALA 89 Ca 0.05 -0.22 -0.03 0.00 0.00 0.00 0.00 54.91 54.72 1qip h ALA 89 Cb -0.01 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 17.61 1qip h ALA 89 CO -0.01 0.49 -0.08 2.35 0.00 0.00 0.00 179.25 182.00 1qip h TRP 90 N 0.60 0.18 -0.60 0.00 7.01 -1.02 -2.84 115.95 119.29 1qip h TRP 90 Ca 0.13 -0.06 -0.02 0.00 2.11 0.00 0.00 58.89 61.05 1qip h TRP 90 Cb 0.35 -0.03 -0.03 0.00 -2.10 0.00 0.00 29.16 27.35 1qip h TRP 90 CO 0.01 0.65 0.31 0.00 -2.79 0.00 0.00 178.44 176.63 1qip h ALA 91 N 0.50 0.76 -0.01 2.65 0.00 -0.57 -2.18 119.26 120.42 1qip h ALA 91 Ca 0.00 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.80 1qip h ALA 91 Cb 0.63 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.18 1qip h ALA 91 CO 0.02 0.30 0.00 1.28 0.00 0.00 0.00 179.25 180.85 1qip n LEU 92 N -4.56 0.15 -0.50 0.00 4.77 -0.54 -2.53 117.00 113.79 1qip n LEU 92 Ca 0.04 -0.06 0.05 0.00 -0.03 0.00 0.00 56.01 56.01 1qip n LEU 92 Cb 0.10 -0.00 0.10 0.00 -2.33 0.00 0.00 43.42 41.28 1qip n LEU 92 CO 0.37 0.03 0.53 -1.54 -1.33 0.00 0.00 177.39 175.45 1qip n SER 93 N -0.79 2.40 -4.75 -1.43 3.41 -0.84 -4.98 113.62 106.64 1qip n SER 93 Ca 0.19 -1.74 -0.40 0.00 -0.26 0.00 0.00 58.87 56.65 1qip n SER 93 Cb 0.11 -0.12 -0.05 0.00 -0.26 0.00 0.00 64.21 63.90 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 -0.93 4.73 0.67 4.33 1.81 -1.05 -5.03 118.95 123.47 1qip s ARG 94 Ca 0.17 1.60 -0.13 0.00 -1.72 0.00 0.00 55.73 55.65 1qip s ARG 94 Cb 0.10 -3.28 0.00 0.00 -0.45 0.00 0.00 34.95 31.32 1qip s ARG 94 CO 0.14 0.30 1.07 0.15 -0.68 0.00 0.00 175.30 176.28 1qip s LYS 95 N -0.84 2.90 -1.28 3.54 1.02 -1.26 -4.34 119.74 119.48 1qip s LYS 95 Ca 0.45 1.15 -0.02 0.00 0.02 0.00 0.00 55.97 57.57 1qip s LYS 95 Cb -0.27 -1.98 0.01 0.00 -0.52 0.00 0.00 37.83 35.06 1qip s LYS 95 CO 0.34 -1.14 0.90 0.00 -0.92 0.00 0.00 175.35 174.53 1qip n ALA 96 N -2.72 -1.91 -2.91 5.17 0.00 -1.00 -4.93 120.51 112.21 1qip n ALA 96 Ca 0.09 -0.04 -0.22 0.00 0.00 0.00 0.00 53.44 53.26 1qip n ALA 96 Cb 0.53 -2.64 -0.02 0.00 0.00 0.00 0.00 19.45 17.32 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 -3.47 5.24 -0.21 0.00 -4.23 -0.30 -4.62 115.64 108.04 1qip s THR 97 Ca 0.10 -0.83 -0.03 0.00 -1.18 0.00 0.00 61.69 59.74 1qip s THR 97 Cb -0.04 -3.84 -0.01 0.00 1.34 0.00 0.00 72.50 69.95 1qip s THR 97 CO 0.77 -0.33 -0.06 -0.22 -0.54 0.00 0.00 174.62 174.24 1qip s LEU 98 N -3.91 2.82 -0.32 4.79 2.96 0.19 -1.80 118.68 123.41 1qip s LEU 98 Ca 0.35 -0.42 -0.13 0.00 -0.22 0.00 0.00 54.13 53.72 1qip s LEU 98 Cb -0.09 -1.71 -0.03 0.00 0.50 0.00 0.00 46.19 44.86 1qip s LEU 98 CO 0.30 -0.01 0.24 -0.70 -1.32 0.00 0.00 176.35 174.86 1qip s GLU 99 N 1.44 3.69 -0.20 1.98 2.12 0.09 -0.47 118.70 127.35 1qip s GLU 99 Ca 0.05 -0.47 -0.08 0.00 0.36 0.00 0.00 54.97 54.84 1qip s GLU 99 Cb -0.14 -3.75 -0.04 0.00 0.26 0.00 0.00 34.13 30.46 1qip s GLU 99 CO -0.04 -0.35 0.07 -0.51 -0.54 0.00 0.00 175.26 173.89 1qip s LEU 100 N 1.79 3.75 -0.24 2.70 1.43 0.70 -1.34 118.68 127.48 1qip s LEU 100 Ca 0.07 0.03 -0.09 0.00 -1.03 0.00 0.00 54.13 53.11 1qip s LEU 100 Cb -0.17 -1.96 -0.04 0.00 0.03 0.00 0.00 46.19 44.05 1qip s LEU 100 CO 0.11 0.13 0.11 -0.89 0.23 0.00 0.00 176.35 176.04 1qip s THR 101 N 0.64 4.87 -0.33 5.49 2.01 -0.26 -0.86 115.64 127.21 1qip s THR 101 Ca 0.03 0.01 -0.06 0.00 0.31 0.00 0.00 61.69 61.98 1qip s THR 101 Cb -0.13 -3.27 0.03 0.00 0.01 0.00 0.00 72.50 69.14 1qip s THR 101 CO 0.02 0.35 0.09 -2.28 -0.69 0.00 0.00 174.62 172.10 1qip s HIS 102 N 1.24 3.23 -0.37 4.92 5.04 -0.27 -0.75 115.29 128.33 1qip s HIS 102 Ca 0.06 -1.35 -0.25 0.00 -1.54 0.00 0.00 55.06 51.98 1qip s HIS 102 Cb -0.14 -2.26 0.01 0.00 0.04 0.00 0.00 32.58 30.23 1qip s HIS 102 CO 0.05 -0.70 0.89 -0.80 -2.34 0.00 0.00 174.74 171.84 1qip s ASN 103 N 1.42 6.64 0.33 9.88 0.01 -1.26 -0.90 114.94 131.05 1qip s ASN 103 Ca -0.01 0.51 -0.29 0.00 -0.71 0.00 0.00 52.86 52.36 1qip s ASN 103 Cb -0.19 -2.45 -0.12 0.00 0.41 0.00 0.00 41.25 38.90 1qip s ASN 103 CO 0.02 -0.83 1.38 0.79 -1.51 0.00 0.00 177.10 176.95 1qip n TRP 104 N 6.68 2.46 0.00 2.20 8.01 -0.30 -2.62 117.44 133.87 1qip n TRP 104 Ca 0.06 0.48 0.00 0.00 -1.31 0.00 0.00 57.50 56.73 1qip n TRP 104 Cb 0.48 -2.46 0.00 0.00 -2.01 0.00 0.00 31.31 27.32 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 1.06 2.35 0.26 6.99 0.00 -1.26 -4.96 105.19 109.63 1qip n GLY 105 Ca 0.05 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.10 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 1.15 0.00 2.61 1.35 -1.74 -2.16 112.91 114.13 1qip h THR 106 Ca 0.00 -0.61 -0.00 0.00 -0.55 0.00 0.00 66.41 65.25 1qip h THR 106 Cb 0.00 1.03 -0.00 0.00 -1.73 0.00 0.00 68.15 67.44 1qip h THR 106 CO 0.00 0.20 -0.01 -0.33 -0.25 0.00 0.00 175.52 175.13 1qip h GLU 107 N 0.31 0.00 -0.00 4.72 3.07 -1.82 -2.67 114.58 118.19 1qip h GLU 107 Ca 0.07 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.93 1qip h GLU 107 Cb 0.26 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.17 1qip h GLU 107 CO 0.01 0.01 -0.50 -0.25 -1.40 0.00 0.00 179.01 176.88 1qip n ASP 108 N -3.11 0.96 -4.37 1.42 8.00 -0.82 -4.79 116.55 113.85 1qip n ASP 108 Ca -0.01 -0.76 -0.45 0.00 0.71 0.00 0.00 54.79 54.29 1qip n ASP 108 Cb 0.24 0.37 -0.06 0.00 -0.02 0.00 0.00 41.12 41.65 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 -2.76 6.18 0.54 -2.24 -1.08 -1.01 -4.93 116.67 111.36 1qip s ASP 109 Ca 0.16 -1.42 0.24 0.00 -0.52 0.00 0.00 52.55 51.01 1qip s ASP 109 Cb 0.18 -2.25 1.49 0.00 -1.46 0.00 0.00 42.92 40.88 1qip s ASP 109 CO 0.65 -0.90 2.15 1.05 0.52 0.00 0.00 175.17 178.64 1qip h GLU 110 N 8.97 0.00 0.00 4.34 4.11 -1.86 -1.83 114.58 128.31 1qip h GLU 110 Ca -0.29 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.14 1qip h GLU 110 Cb 1.10 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.35 1qip h GLU 110 CO 1.01 0.06 -0.13 0.25 0.07 0.00 0.00 179.01 180.27 1qip n THR 111 N -4.01 0.14 -3.36 -1.06 -2.24 -1.26 -4.90 114.28 97.59 1qip n THR 111 Ca -0.03 -0.07 -0.37 0.00 -2.27 0.00 0.00 64.05 61.31 1qip n THR 111 Cb 0.15 -0.36 -0.06 0.00 -2.10 0.00 0.00 70.33 67.96 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 -3.03 4.06 0.01 -0.78 -0.44 -0.69 -5.08 119.66 113.72 1qip s GLN 112 Ca 0.12 0.58 -0.28 0.00 -2.50 0.00 0.00 55.36 53.29 1qip s GLN 112 Cb 0.17 -3.14 0.07 0.00 -1.64 0.00 0.00 33.01 28.47 1qip s GLN 112 CO 0.59 0.61 0.63 -1.54 0.50 0.00 0.00 175.29 176.07 1qip s SER 113 N -1.29 -0.60 0.40 6.67 1.04 -1.26 -4.99 113.70 113.67 1qip s SER 113 Ca 0.30 0.46 -0.01 0.00 0.48 0.00 0.00 55.95 57.18 1qip s SER 113 Cb -0.17 0.54 -0.03 0.00 0.10 0.00 0.00 66.02 66.46 1qip s SER 113 CO 0.18 -0.71 0.62 -0.31 0.98 0.00 0.00 173.24 174.00 1qip s TYR 114 N -1.98 3.45 -0.18 5.02 2.02 -1.26 -5.09 117.35 119.34 1qip s TYR 114 Ca -0.07 0.41 -0.09 0.00 -0.37 0.00 0.00 57.07 56.94 1qip s TYR 114 Cb -0.00 -2.07 -0.05 0.00 -0.40 0.00 0.00 41.96 39.44 1qip s TYR 114 CO 0.03 -0.07 0.13 -1.58 -1.57 0.00 0.00 175.55 172.49 1qip s HIS 115 N -2.45 3.45 -2.38 2.71 5.65 -1.26 -4.99 115.29 116.02 1qip s HIS 115 Ca 0.43 0.37 0.28 0.00 0.25 0.00 0.00 55.06 56.39 1qip s HIS 115 Cb -0.10 -2.09 1.16 0.00 -1.18 0.00 0.00 32.58 30.37 1qip s HIS 115 CO 0.38 0.40 1.80 0.27 -0.65 0.00 0.00 174.74 176.95 1qip n ASN 116 N 3.10 1.23 0.00 9.88 0.23 -1.26 -4.94 115.26 123.50 1qip n ASN 116 Ca -0.17 -1.44 0.00 0.00 -0.53 0.00 0.00 54.58 52.44 1qip n ASN 116 Cb 0.53 -0.01 0.00 0.00 -2.08 0.00 0.00 39.78 38.22 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 1.13 0.93 0.99 4.83 0.00 -1.26 -4.66 105.19 107.15 1qip n GLY 117 Ca 0.19 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.31 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 3.25 -4.16 1.61 3.02 -1.26 -2.88 115.26 114.83 1qip n ASN 118 Ca 0.00 -1.93 -0.10 0.00 -0.03 0.00 0.00 54.58 52.52 1qip n ASN 118 Cb 0.00 -0.25 -0.10 0.00 -0.61 0.00 0.00 39.78 38.82 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 -1.24 1.06 0.26 6.41 1.04 -1.26 -5.00 113.70 114.97 1qip s SER 119 Ca 0.34 -0.99 -0.31 0.00 0.48 0.00 0.00 55.95 55.47 1qip s SER 119 Cb 0.19 0.10 -0.13 0.00 0.10 0.00 0.00 66.02 66.29 1qip s SER 119 CO 0.26 -0.47 1.46 0.47 0.98 0.00 0.00 173.24 175.95 1qip n ASP 120 N 0.03 3.11 -4.73 7.02 8.00 -1.26 -3.08 116.55 125.63 1qip n ASP 120 Ca -0.13 1.15 -0.40 0.00 0.71 0.00 0.00 54.79 56.12 1qip n ASP 120 Cb 0.61 -1.48 -0.05 0.00 -0.02 0.00 0.00 41.12 40.17 1qip n ASP 120 CO 0.00 0.00 0.00 -2.16 -0.39 0.00 0.00 177.20 174.65 1qip s PRO 121 N -0.50 4.43 0.46 -0.24 0.04 -1.26 -5.08 135.00 132.84 1qip s PRO 121 Ca 0.66 0.89 -0.02 0.00 0.04 0.00 0.00 61.00 62.57 1qip s PRO 121 Cb -0.60 -3.41 -0.02 0.00 0.04 0.00 0.00 34.50 30.52 1qip s PRO 121 CO 0.50 0.17 0.72 1.03 0.04 0.00 0.00 177.00 179.45 1qip s ARG 122 N 0.43 3.29 0.00 4.56 0.52 -1.18 -4.68 118.95 121.90 1qip s ARG 122 Ca 0.36 -0.15 0.00 0.00 -0.52 0.00 0.00 55.73 55.43 1qip s ARG 122 Cb -0.18 -2.48 0.00 0.00 0.52 0.00 0.00 34.95 32.81 1qip s ARG 122 CO 0.19 -0.22 0.00 0.41 0.02 0.00 0.00 175.30 175.70 1qip n GLY 123 N -2.15 -1.10 3.70 -3.53 0.00 -1.14 -5.05 105.19 95.91 1qip n GLY 123 Ca 0.00 0.65 -0.39 0.00 0.00 0.00 0.00 46.02 46.29 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 1.82 -0.03 1.61 7.35 -1.26 -4.95 117.46 121.99 1qip n PHE 124 Ca 0.00 0.45 -0.08 0.00 -0.76 0.00 0.00 57.45 57.06 1qip n PHE 124 Cb 0.00 -2.30 -0.03 0.00 0.35 0.00 0.00 39.48 37.51 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 0.93 -0.23 3.65 7.13 0.00 -1.26 -4.30 105.19 111.12 1qip n GLY 125 Ca 0.11 -0.11 -0.03 0.00 0.00 0.00 0.00 46.02 45.99 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 -2.32 -0.15 0.35 1.61 -3.43 -1.26 -4.41 115.29 105.68 1qip s HIS 126 Ca -0.15 -0.04 0.07 0.00 -0.80 0.00 0.00 55.06 54.15 1qip s HIS 126 Cb 0.04 0.58 -0.03 0.00 -1.43 0.00 0.00 32.58 31.75 1qip s HIS 126 CO 0.20 -0.56 0.31 0.96 -2.00 0.00 0.00 174.74 173.64 1qip s ILE 127 N -2.94 3.44 -0.02 -5.38 -4.36 -0.92 -4.96 121.20 106.06 1qip s ILE 127 Ca 0.11 -1.36 -0.02 0.00 -0.26 0.00 0.00 60.65 59.12 1qip s ILE 127 Cb 0.00 -3.17 0.01 0.00 1.25 0.00 0.00 42.46 40.55 1qip s ILE 127 CO -0.02 -0.15 0.05 -0.83 0.24 0.00 0.00 174.94 174.23 1qip s GLY 128 N -4.02 -0.03 -0.16 6.27 0.00 -1.26 -0.22 107.32 107.90 1qip s GLY 128 Ca 0.42 0.17 -0.03 0.00 0.00 0.00 0.00 44.72 45.28 1qip s GLY 128 CO 0.27 0.17 -0.06 -0.42 0.00 0.00 0.00 173.10 173.05 1qip s ILE 129 N 0.09 3.60 -0.10 0.90 -1.09 0.46 -4.91 121.20 120.15 1qip s ILE 129 Ca -0.01 -0.46 -0.21 0.00 -2.23 0.00 0.00 60.65 57.75 1qip s ILE 129 Cb -0.01 -2.57 -0.04 0.00 -1.58 0.00 0.00 42.46 38.26 1qip s ILE 129 CO -0.00 0.49 0.59 0.00 -1.23 0.00 0.00 174.94 174.79 1qip s ALA 130 N 0.54 3.41 0.13 9.38 0.00 -1.26 -1.72 121.76 132.24 1qip s ALA 130 Ca -0.04 -0.03 0.05 0.00 0.00 0.00 0.00 51.96 51.93 1qip s ALA 130 Cb -0.15 -2.81 -0.04 0.00 0.00 0.00 0.00 23.12 20.12 1qip s ALA 130 CO 0.03 -0.07 -0.12 0.14 0.00 0.00 0.00 175.76 175.74 1qip s VAL 131 N 0.76 1.21 0.16 0.00 -7.23 0.22 -4.94 120.40 110.58 1qip s VAL 131 Ca 0.32 -1.86 0.19 0.00 -1.81 0.00 0.00 61.98 58.81 1qip s VAL 131 Cb -0.16 -1.64 0.13 0.00 0.56 0.00 0.00 36.38 35.26 1qip s VAL 131 CO 0.14 -0.58 1.72 1.55 -0.31 0.00 0.00 175.10 177.62 1qip h PRO 132 N 3.19 0.00 -1.78 4.82 0.13 -1.98 -3.38 132.00 133.01 1qip h PRO 132 Ca -0.38 0.00 -0.17 0.00 -0.87 0.00 0.00 66.00 64.58 1qip h PRO 132 Cb 1.19 0.00 -0.29 0.00 0.13 0.00 0.00 31.00 32.03 1qip h PRO 132 CO 0.57 0.38 -0.51 0.34 -0.23 0.00 0.00 178.00 178.55 1qip s ASP 133 N -6.44 0.32 0.18 1.44 -1.08 -1.26 -5.01 116.67 104.82 1qip s ASP 133 Ca 0.00 -0.10 -0.11 0.00 -0.52 0.00 0.00 52.55 51.82 1qip s ASP 133 Cb 0.11 1.12 0.10 0.00 -1.46 0.00 0.00 42.92 42.79 1qip s ASP 133 CO 0.69 -0.33 1.77 0.58 0.52 0.00 0.00 175.17 178.40 1qip h VAL 134 N 6.17 1.22 -0.13 1.11 2.07 -1.89 -1.68 116.25 123.11 1qip h VAL 134 Ca -0.14 -0.62 -0.00 0.00 0.82 0.00 0.00 66.70 66.76 1qip h VAL 134 Cb 1.13 0.44 -0.01 0.00 -1.52 0.00 0.00 31.29 31.34 1qip h VAL 134 CO 0.27 0.25 0.07 1.88 0.02 0.00 0.00 177.57 180.07 1qip h TYR 135 N 0.89 0.18 -0.13 1.57 0.05 -1.96 -1.24 116.97 116.33 1qip h TYR 135 Ca 0.22 -0.01 -0.15 0.00 0.05 0.00 0.00 58.73 58.85 1qip h TYR 135 Cb 0.12 -0.06 -0.01 0.00 1.01 0.00 0.00 36.73 37.79 1qip h TYR 135 CO 0.00 0.20 -0.55 0.66 -1.05 0.00 0.00 178.16 177.43 1qip h SER 136 N 0.11 0.42 -0.56 3.88 4.64 -1.98 -0.75 113.55 119.31 1qip h SER 136 Ca 0.05 -0.22 -0.02 0.00 -0.47 0.00 0.00 61.79 61.13 1qip h SER 136 Cb 0.08 -0.12 -0.03 0.00 -0.31 0.00 0.00 62.40 62.02 1qip h SER 136 CO -0.01 0.88 0.27 0.00 -0.87 0.00 0.00 176.83 177.10 1qip h ALA 137 N 1.13 0.72 0.00 5.18 0.00 -1.25 -2.29 119.26 122.74 1qip h ALA 137 Ca 0.01 -0.12 -0.11 0.00 0.00 0.00 0.00 54.91 54.68 1qip h ALA 137 Cb 1.05 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.61 1qip h ALA 137 CO 0.09 0.27 -0.51 0.00 0.00 0.00 0.00 179.25 179.11 1qip h LYS 139 N 0.00 0.89 -0.63 0.00 3.64 -0.91 -0.47 116.57 119.09 1qip h LYS 139 Ca -0.01 -0.21 -0.09 0.00 -1.27 0.00 0.00 60.65 59.07 1qip h LYS 139 Cb 1.07 -0.12 -0.02 0.00 -0.41 0.00 0.00 32.23 32.75 1qip h LYS 139 CO 0.07 0.83 0.03 -0.09 -2.27 0.00 0.00 179.45 178.02 1qip h ARG 140 N 0.80 1.09 -0.89 1.90 2.43 -1.18 -2.06 114.38 116.46 1qip h ARG 140 Ca 0.18 -0.33 -0.01 0.00 -0.81 0.00 0.00 59.98 59.01 1qip h ARG 140 Cb 0.34 -0.11 -0.04 0.00 -0.42 0.00 0.00 29.97 29.74 1qip h ARG 140 CO 0.00 1.04 0.52 0.74 -1.51 0.00 0.00 179.97 180.76 1qip h PHE 141 N 1.00 1.19 -0.61 2.20 0.04 -0.76 -1.54 116.94 118.46 1qip h PHE 141 Ca 0.18 -0.01 -0.06 0.00 2.80 0.00 0.00 57.97 60.88 1qip h PHE 141 Cb 0.53 -0.39 -0.03 0.00 2.20 0.00 0.00 35.95 38.26 1qip h PHE 141 CO 0.04 0.80 0.17 0.93 -0.60 0.00 0.00 178.31 179.65 1qip h GLU 142 N 1.24 0.97 -0.06 1.51 5.08 -0.89 -0.95 114.58 121.48 1qip h GLU 142 Ca 0.32 -0.22 -0.03 0.00 -1.00 0.00 0.00 59.36 58.43 1qip h GLU 142 Cb -0.03 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.09 1qip h GLU 142 CO -0.06 0.88 -0.09 0.93 -1.00 0.00 0.00 179.01 179.67 1qip h GLU 143 N 0.89 0.09 -0.08 2.33 5.08 -0.81 -1.59 114.58 120.49 1qip h GLU 143 Ca 0.19 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.54 1qip h GLU 143 Cb 0.33 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.56 1qip h GLU 143 CO -0.00 0.19 0.00 1.28 -1.00 0.00 0.00 179.01 179.48 1qip n LEU 144 N -4.38 1.27 -0.28 1.33 4.77 -0.63 -4.93 117.00 114.15 1qip n LEU 144 Ca -0.02 -0.48 -0.03 0.00 -0.03 0.00 0.00 56.01 55.45 1qip n LEU 144 Cb 0.19 -0.05 -0.01 0.00 -2.33 0.00 0.00 43.42 41.23 1qip n LEU 144 CO 0.36 0.24 -0.03 0.61 -1.33 0.00 0.00 177.39 177.24 1qip n GLY 145 N 1.10 0.51 3.77 -0.72 0.00 -0.60 -5.00 105.19 104.25 1qip n GLY 145 Ca 0.18 -0.88 -0.39 0.00 0.00 0.00 0.00 46.02 44.92 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 -2.13 2.70 -0.11 1.61 1.01 -0.40 -4.98 120.40 118.10 1qip s VAL 146 Ca 0.00 0.63 -0.26 0.00 0.00 0.00 0.00 61.98 62.35 1qip s VAL 146 Cb 0.00 -3.38 -0.02 0.00 0.00 0.00 0.00 36.38 32.98 1qip s VAL 146 CO 0.00 0.10 0.85 -0.54 0.00 0.00 0.00 175.10 175.51 1qip s LYS 147 N -2.19 4.38 -0.03 2.72 3.01 -1.26 -4.76 119.74 121.61 1qip s LYS 147 Ca 0.56 1.11 -0.01 0.00 -1.01 0.00 0.00 55.97 56.62 1qip s LYS 147 Cb -0.37 -3.53 -0.04 0.00 -1.01 0.00 0.00 37.83 32.88 1qip s LYS 147 CO 0.48 -0.21 0.04 -0.06 0.51 0.00 0.00 175.35 176.11 1qip s PHE 148 N 1.69 3.20 -0.17 3.18 0.40 -1.26 -1.15 117.98 123.87 1qip s PHE 148 Ca 0.42 0.18 -0.08 0.00 -0.60 0.00 0.00 56.93 56.85 1qip s PHE 148 Cb -0.18 -1.74 -0.22 0.00 0.51 0.00 0.00 43.02 41.39 1qip s PHE 148 CO 0.17 0.51 0.17 0.28 0.70 0.00 0.00 175.22 177.04 1qip n VAL 149 N 1.58 1.66 -3.67 -0.44 0.31 0.61 -4.92 118.33 113.47 1qip n VAL 149 Ca -0.16 -0.51 -0.16 0.00 -0.01 0.00 0.00 64.34 63.51 1qip n VAL 149 Cb 0.53 -1.74 -0.15 0.00 -0.91 0.00 0.00 33.84 31.57 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 -2.51 0.06 0.65 5.55 2.20 -0.66 -4.94 119.74 120.09 1qip s LYS 150 Ca -0.27 0.60 -0.11 0.00 -0.36 0.00 0.00 55.97 55.82 1qip s LYS 150 Cb 0.08 -0.22 -0.02 0.00 -1.51 0.00 0.00 37.83 36.16 1qip s LYS 150 CO 0.68 -0.30 1.05 0.15 -0.36 0.00 0.00 175.35 176.58 1qip s LYS 151 N 2.29 3.31 0.31 4.03 1.02 -1.26 -0.85 119.74 128.59 1qip s LYS 151 Ca 0.02 0.68 0.06 0.00 0.02 0.00 0.00 55.97 56.75 1qip s LYS 151 Cb -0.12 -2.05 0.83 0.00 -0.52 0.00 0.00 37.83 35.97 1qip s LYS 151 CO -0.06 -0.76 1.64 -1.35 -0.92 0.00 0.00 175.35 173.90 1qip h PRO 152 N -0.46 0.21 -0.42 -1.68 0.11 -1.94 -1.36 132.00 126.46 1qip h PRO 152 Ca -0.44 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.65 1qip h PRO 152 Cb 1.21 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.27 1qip h PRO 152 CO 0.62 0.14 0.00 -0.25 -0.21 0.00 0.00 178.00 178.30 1qip n ASP 153 N -5.20 4.18 -4.76 -2.05 8.00 -1.26 -0.12 116.55 115.33 1qip n ASP 153 Ca 0.25 -2.65 -0.39 0.00 0.71 0.00 0.00 54.79 52.71 1qip n ASP 153 Cb 0.79 -0.51 -0.06 0.00 -0.02 0.00 0.00 41.12 41.32 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 -1.32 7.51 0.61 -2.24 1.01 -0.51 -4.91 116.67 116.82 1qip s ASP 154 Ca 0.42 1.91 0.00 0.00 0.71 0.00 0.00 52.55 55.59 1qip s ASP 154 Cb 0.30 -2.60 0.00 0.00 1.01 0.00 0.00 42.92 41.64 1qip s ASP 154 CO 0.15 0.06 0.00 0.61 0.21 0.00 0.00 175.17 176.20 1qip n GLY 155 N 1.10 -0.13 0.22 0.21 0.00 -1.26 -4.45 105.19 100.88 1qip n GLY 155 Ca -0.00 -1.03 -0.14 0.00 0.00 0.00 0.00 46.02 44.85 1qip n GLY 155 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1qip h LYS 156 N 0.00 -0.46 -5.90 1.61 3.64 -1.99 -3.42 116.57 110.05 1qip h LYS 156 Ca 0.00 0.03 -0.61 0.00 -1.27 0.00 0.00 60.65 58.80 1qip h LYS 156 Cb 0.00 0.11 -0.12 0.00 -0.41 0.00 0.00 32.23 31.80 1qip h LYS 156 CO 0.00 -0.17 0.50 -1.64 -2.27 0.00 0.00 179.45 175.87 1qip s MET 157 N -4.96 3.40 0.21 1.90 -1.94 -1.26 -5.03 119.30 111.63 1qip s MET 157 Ca -0.15 -0.11 -0.26 0.00 -1.71 0.00 0.00 55.69 53.46 1qip s MET 157 Cb 0.03 -3.99 -0.09 0.00 2.01 0.00 0.00 34.83 32.79 1qip s MET 157 CO 0.56 -1.30 0.83 0.15 -0.01 0.00 0.00 175.02 175.25 1qip s LYS 158 N 3.68 4.60 0.00 2.03 -0.14 -1.26 -3.87 119.74 124.79 1qip s LYS 158 Ca 0.32 1.23 0.00 0.00 -1.36 0.00 0.00 55.97 56.16 1qip s LYS 158 Cb -0.12 -3.15 0.00 0.00 -1.68 0.00 0.00 37.83 32.88 1qip s LYS 158 CO 0.22 0.50 0.00 0.41 -0.76 0.00 0.00 175.35 175.72 1qip n GLY 159 N 1.31 0.62 2.90 -3.33 0.00 0.83 -4.94 105.19 102.59 1qip n GLY 159 Ca -0.03 -0.68 -0.18 0.00 0.00 0.00 0.00 46.02 45.13 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 1.52 0.24 0.99 2.96 -1.14 -4.57 118.68 118.68 1qip s LEU 160 Ca 0.00 -0.10 0.06 0.00 -0.22 0.00 0.00 54.13 53.87 1qip s LEU 160 Cb 0.00 -0.35 -0.05 0.00 0.50 0.00 0.00 46.19 46.28 1qip s LEU 160 CO 0.00 -0.02 -0.08 0.00 -1.32 0.00 0.00 176.35 174.92 1qip s ALA 161 N 0.59 2.09 -0.06 5.97 0.00 -0.80 -3.96 121.76 125.58 1qip s ALA 161 Ca -0.07 -1.77 -0.01 0.00 0.00 0.00 0.00 51.96 50.11 1qip s ALA 161 Cb -0.11 0.12 0.03 0.00 0.00 0.00 0.00 23.12 23.16 1qip s ALA 161 CO -0.00 -0.05 -0.01 -0.06 0.00 0.00 0.00 175.76 175.64 1qip s PHE 162 N -3.08 0.65 0.46 0.00 0.40 -0.02 -0.26 117.98 116.13 1qip s PHE 162 Ca 0.26 -0.16 0.06 0.00 -0.60 0.00 0.00 56.93 56.49 1qip s PHE 162 Cb 0.02 -0.74 -0.02 0.00 0.51 0.00 0.00 43.02 42.80 1qip s PHE 162 CO 0.09 -0.28 0.24 0.96 0.70 0.00 0.00 175.22 176.93 1qip s ILE 163 N 1.68 2.00 0.06 0.64 -4.36 -0.29 -0.28 121.20 120.66 1qip s ILE 163 Ca 0.00 -1.64 0.07 0.00 -0.26 0.00 0.00 60.65 58.82 1qip s ILE 163 Cb -0.13 -2.64 -0.03 0.00 1.25 0.00 0.00 42.46 40.91 1qip s ILE 163 CO -0.04 0.00 -0.20 -1.10 0.24 0.00 0.00 174.94 173.84 1qip s GLN 164 N -4.03 1.23 0.57 0.37 -0.21 -0.30 -0.25 119.66 117.04 1qip s GLN 164 Ca 0.35 -1.00 -0.05 0.00 0.02 0.00 0.00 55.36 54.68 1qip s GLN 164 Cb 0.01 -1.38 0.12 0.00 1.00 0.00 0.00 33.01 32.77 1qip s GLN 164 CO 0.20 0.34 0.78 -0.40 -2.12 0.00 0.00 175.29 174.09 1qip n ASP 165 N 1.56 0.53 0.27 5.90 5.75 -0.51 -4.47 116.55 125.57 1qip n ASP 165 Ca -0.18 -1.57 0.10 0.00 -0.01 0.00 0.00 54.79 53.13 1qip n ASP 165 Cb 0.54 -0.55 0.71 0.00 -1.03 0.00 0.00 41.12 40.78 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 0.00 -0.01 0.11 0.11 -1.91 0.65 132.00 130.95 1qip h PRO 166 Ca -0.26 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.85 1qip h PRO 166 Cb 0.82 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.93 1qip h PRO 166 CO 0.22 0.04 -0.15 -0.25 -0.21 0.00 0.00 178.00 177.65 1qip n ASP 167 N -4.24 0.79 0.00 -2.05 8.00 -1.26 -4.93 116.55 112.86 1qip n ASP 167 Ca -0.03 -0.83 0.00 0.00 0.71 0.00 0.00 54.79 54.65 1qip n ASP 167 Cb 0.12 0.02 0.00 0.00 -0.02 0.00 0.00 41.12 41.24 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 1.28 0.73 3.76 0.44 0.00 0.22 -4.78 105.19 106.85 1qip n GLY 168 Ca 0.14 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.75 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 -2.54 2.89 0.19 1.61 2.02 -1.26 -4.68 117.35 115.58 1qip s TYR 169 Ca 0.00 1.19 -0.28 0.00 -0.37 0.00 0.00 57.07 57.61 1qip s TYR 169 Cb 0.00 -3.85 -0.08 0.00 -0.40 0.00 0.00 41.96 37.63 1qip s TYR 169 CO 0.00 -2.54 0.86 -1.58 -1.57 0.00 0.00 175.55 170.72 1qip s TRP 170 N -0.73 3.94 -0.17 2.71 0.52 -1.26 -1.43 118.94 122.52 1qip s TRP 170 Ca 0.54 1.77 -0.01 0.00 0.02 0.00 0.00 56.10 58.41 1qip s TRP 170 Cb -0.43 -2.88 0.05 0.00 -1.15 0.00 0.00 33.47 29.06 1qip s TRP 170 CO 0.53 0.47 -0.02 0.42 0.02 0.00 0.00 176.95 178.37 1qip s ILE 171 N -1.09 0.91 0.38 2.03 1.01 0.65 -2.16 121.20 122.93 1qip s ILE 171 Ca 0.39 -0.61 -0.26 0.00 0.00 0.00 0.00 60.65 60.16 1qip s ILE 171 Cb -0.24 -1.20 -0.09 0.00 0.01 0.00 0.00 42.46 40.94 1qip s ILE 171 CO 0.29 0.00 1.16 -0.70 0.00 0.00 0.00 174.94 175.70 1qip s GLU 172 N 1.70 4.18 -0.29 2.79 2.12 0.70 -1.13 118.70 128.77 1qip s GLU 172 Ca -0.00 1.84 0.02 0.00 0.36 0.00 0.00 54.97 57.19 1qip s GLU 172 Cb -0.16 -2.78 0.08 0.00 0.26 0.00 0.00 34.13 31.53 1qip s GLU 172 CO -0.07 -0.22 -0.02 0.42 -0.54 0.00 0.00 175.26 174.83 1qip s ILE 173 N -1.37 1.94 0.09 -3.70 -1.09 0.64 -0.41 121.20 117.31 1qip s ILE 173 Ca 0.55 -1.76 0.07 0.00 -2.23 0.00 0.00 60.65 57.27 1qip s ILE 173 Cb -0.31 -2.25 -0.03 0.00 -1.58 0.00 0.00 42.46 38.29 1qip s ILE 173 CO 0.39 -0.30 -0.17 -1.48 -1.23 0.00 0.00 174.94 172.15 1qip s LEU 174 N 1.15 2.31 -0.32 2.97 0.05 -0.70 -1.91 118.68 122.23 1qip s LEU 174 Ca 0.00 -0.67 -0.05 0.00 0.05 0.00 0.00 54.13 53.46 1qip s LEU 174 Cb -0.19 -0.69 0.04 0.00 -2.05 0.00 0.00 46.19 43.30 1qip s LEU 174 CO -0.08 -0.02 0.06 0.21 -0.55 0.00 0.00 176.35 175.97 1qip s ASN 175 N -1.92 5.10 0.46 1.48 3.84 -1.26 -0.61 114.94 122.04 1qip s ASN 175 Ca 0.03 -1.12 0.21 0.00 0.21 0.00 0.00 52.86 52.20 1qip s ASN 175 Cb -0.09 -1.81 1.20 0.00 -0.55 0.00 0.00 41.25 40.00 1qip s ASN 175 CO 0.03 -0.28 1.89 -0.65 -2.79 0.00 0.00 177.10 175.30 1qip h PRO 176 N 8.14 0.27 0.00 0.43 0.11 -1.96 0.01 132.00 138.99 1qip h PRO 176 Ca -0.24 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.85 1qip h PRO 176 Cb 1.08 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.13 1qip h PRO 176 CO 0.58 0.18 0.00 0.09 -0.21 0.00 0.00 178.00 178.63 1qip n ASN 177 N -4.44 0.00 -0.26 -2.05 3.02 -1.26 -3.48 115.26 106.78 1qip n ASN 177 Ca 0.17 0.32 0.03 0.00 -0.03 0.00 0.00 54.58 55.07 1qip n ASN 177 Cb 0.71 -0.44 0.03 0.00 -0.61 0.00 0.00 39.78 39.47 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 -1.44 0.04 0.18 3.52 4.76 -0.03 -4.64 118.16 120.54 1qip n LYS 178 Ca 0.08 -0.88 0.03 0.00 -2.87 0.00 0.00 58.31 54.67 1qip n LYS 178 Cb 0.29 -1.12 0.31 0.00 -1.84 0.00 0.00 35.03 32.66 1qip n LYS 178 CO 0.00 0.00 0.00 0.52 -1.37 0.00 0.00 177.40 176.55 1qip h MET 179 N 1.30 0.00 0.00 1.97 2.86 -1.54 -3.11 114.93 116.41 1qip h MET 179 Ca 0.00 0.00 -0.03 0.00 -2.06 0.00 0.00 59.70 57.61 1qip h MET 179 Cb 0.28 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 31.93 1qip h MET 179 CO 0.00 0.44 -0.16 0.00 1.06 0.00 0.00 176.91 178.25 1qip h ALA 180 N 1.56 1.38 0.00 6.32 0.00 -1.82 -2.75 119.26 123.95 1qip h ALA 180 Ca -0.00 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.76 1qip h ALA 180 Cb 0.88 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.65 1qip h ALA 180 CO 0.06 0.20 0.00 2.41 0.00 0.00 0.00 179.25 181.92 1qip n THR 181 N -3.84 0.47 1.53 0.00 -1.04 -1.17 -2.90 114.28 107.32 1qip n THR 181 Ca -0.02 0.08 0.02 0.00 -2.04 0.00 0.00 64.05 62.10 1qip n THR 181 Cb 0.26 -0.73 0.06 0.00 -1.82 0.00 0.00 70.33 68.10 1qip n THR 181 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 1qip n LEU 182 N -1.60 0.78 0.00 -4.42 4.77 -1.04 -5.07 117.00 110.42 1qip n LEU 182 Ca 0.05 -0.39 0.00 0.00 -0.03 0.00 0.00 56.01 55.64 1qip n LEU 182 Cb 0.28 -0.11 0.00 0.00 -2.33 0.00 0.00 43.42 41.26 1qip n LEU 182 CO 0.22 0.19 0.00 0.23 -1.33 0.00 0.00 177.39 176.70