#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 -3.26 -1.28 0.00 1.02 -1.26 -5.02 120.64 110.84 1qip n GLU 2 Ca 0.00 0.37 -0.29 0.00 -0.02 0.00 0.00 57.16 57.23 1qip n GLU 2 Cb 0.00 -4.00 0.17 0.00 -0.02 0.00 0.00 31.44 27.58 1qip n GLU 2 CO 0.00 0.00 0.00 -1.25 1.18 0.00 0.00 177.13 177.06 1qip s PRO 3 N -5.10 0.58 0.01 3.49 0.04 -1.26 -4.98 135.00 127.78 1qip s PRO 3 Ca 0.13 0.41 -0.29 0.00 0.04 0.00 0.00 61.00 61.29 1qip s PRO 3 Cb -0.06 -1.76 -0.03 0.00 0.04 0.00 0.00 34.50 32.69 1qip s PRO 3 CO 0.32 -2.61 0.96 -1.14 0.04 0.00 0.00 177.00 174.57 1qip s GLN 4 N -5.07 4.56 0.66 4.56 0.74 -1.26 -5.02 119.66 118.83 1qip s GLN 4 Ca 0.65 1.38 -0.16 0.00 0.05 0.00 0.00 55.36 57.28 1qip s GLN 4 Cb -0.17 -3.45 0.00 0.00 1.10 0.00 0.00 33.01 30.49 1qip s GLN 4 CO 0.56 -0.01 1.15 -1.25 -0.55 0.00 0.00 175.29 175.19 1qip s PRO 5 N 0.88 2.67 1.13 1.67 0.04 -1.26 -4.99 135.00 135.14 1qip s PRO 5 Ca 0.50 1.55 -0.13 0.00 0.04 0.00 0.00 61.00 62.96 1qip s PRO 5 Cb -0.21 -1.92 0.24 0.00 0.04 0.00 0.00 34.50 32.64 1qip s PRO 5 CO 0.27 -1.38 0.86 -2.30 0.04 0.00 0.00 177.00 174.50 1qip n PRO 6 N -2.34 -2.01 -3.11 0.56 -0.02 -1.26 -4.94 135.00 121.89 1qip n PRO 6 Ca 0.12 -0.55 -0.39 0.00 -2.02 0.00 0.00 63.50 60.65 1qip n PRO 6 Cb 0.51 -2.11 -0.05 0.00 -0.02 0.00 0.00 33.50 31.83 1qip n PRO 6 CO 0.00 0.00 0.00 -1.12 1.98 0.00 0.00 175.50 176.36 1qip s SER 7 N -2.33 6.91 0.00 2.55 0.01 -1.26 -5.04 113.70 114.54 1qip s SER 7 Ca 0.66 1.10 0.00 0.00 1.31 0.00 0.00 55.95 59.02 1qip s SER 7 Cb -0.23 -2.38 0.00 0.00 0.21 0.00 0.00 66.02 63.62 1qip s SER 7 CO 0.64 -0.10 0.00 0.61 0.41 0.00 0.00 173.24 174.81 1qip n GLY 8 N 3.16 2.96 3.95 3.44 0.00 -1.26 -5.11 105.19 112.34 1qip n GLY 8 Ca -0.02 -1.74 -0.23 0.00 0.00 0.00 0.00 46.02 44.02 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 1.73 0.35 -0.02 0.00 -1.26 -5.06 107.32 103.07 1qip s GLY 9 Ca 0.00 -1.10 -0.25 0.00 0.00 0.00 0.00 44.72 43.37 1qip s GLY 9 CO 0.00 -0.78 0.96 1.08 0.00 0.00 0.00 173.10 174.36 1qip s LEU 10 N -4.94 4.25 0.90 0.66 1.43 -1.26 -5.05 118.68 114.67 1qip s LEU 10 Ca 0.57 1.84 -0.12 0.00 -1.03 0.00 0.00 54.13 55.39 1qip s LEU 10 Cb -0.10 -4.13 0.13 0.00 0.03 0.00 0.00 46.19 42.12 1qip s LEU 10 CO 0.41 -0.17 1.12 0.42 0.23 0.00 0.00 176.35 178.37 1qip s THR 11 N -1.72 2.20 0.19 5.49 -4.23 -1.26 -4.84 115.64 111.48 1qip s THR 11 Ca 0.53 0.06 -0.12 0.00 -1.18 0.00 0.00 61.69 60.99 1qip s THR 11 Cb -0.17 -2.77 0.12 0.00 1.34 0.00 0.00 72.50 71.01 1qip s THR 11 CO 0.22 -0.08 1.86 0.44 -0.54 0.00 0.00 174.62 176.51 1qip h ASP 12 N -1.48 0.72 -0.52 3.99 3.32 -2.00 -1.45 116.42 119.01 1qip h ASP 12 Ca -0.50 -0.01 -0.06 0.00 0.02 0.00 0.00 57.03 56.48 1qip h ASP 12 Cb 1.32 -0.17 -0.03 0.00 0.22 0.00 0.00 39.33 40.67 1qip h ASP 12 CO 0.61 0.52 0.13 -0.33 -1.72 0.00 0.00 179.24 178.44 1qip h GLU 13 N 0.85 0.88 -0.44 3.56 3.07 -1.99 -1.19 114.58 119.32 1qip h GLU 13 Ca 0.24 -0.19 -0.09 0.00 -0.50 0.00 0.00 59.36 58.82 1qip h GLU 13 Cb -0.07 -0.13 -0.01 0.00 -0.84 0.00 0.00 28.75 27.70 1qip h GLU 13 CO -0.07 0.80 -0.09 0.00 -1.40 0.00 0.00 179.01 178.26 1qip h ALA 14 N 1.29 0.61 -0.51 3.43 0.00 -1.78 -0.48 119.26 121.82 1qip h ALA 14 Ca 0.18 -0.32 -0.00 0.00 0.00 0.00 0.00 54.91 54.77 1qip h ALA 14 Cb 0.32 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 1qip h ALA 14 CO 0.00 0.48 0.30 0.00 0.00 0.00 0.00 179.25 180.03 1qip h ALA 15 N 0.87 0.65 -0.73 0.00 0.00 -1.09 -2.50 119.26 116.46 1qip h ALA 15 Ca 0.11 -0.07 0.05 0.00 0.00 0.00 0.00 54.91 55.00 1qip h ALA 15 Cb 0.62 -0.21 -0.05 0.00 0.00 0.00 0.00 17.79 18.15 1qip h ALA 15 CO 0.04 0.15 0.44 1.25 0.00 0.00 0.00 179.25 181.13 1qip h LEU 16 N 0.69 0.70 -2.70 0.00 5.85 -0.93 -1.39 115.31 117.53 1qip h LEU 16 Ca 0.18 0.01 -0.00 0.00 0.84 0.00 0.00 57.88 58.91 1qip h LEU 16 Cb 0.00 -0.14 -0.00 0.00 0.37 0.00 0.00 40.66 40.90 1qip h LEU 16 CO -0.03 0.47 -0.01 0.77 -0.34 0.00 0.00 178.44 179.30 1qip h SER 17 N 0.84 0.00 0.06 1.25 4.64 -0.65 -0.66 113.55 119.03 1qip h SER 17 Ca 0.31 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.63 1qip h SER 17 Cb 0.10 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.19 1qip h SER 17 CO -0.14 0.01 -0.13 0.00 -0.87 0.00 0.00 176.83 175.70 1qip s SER 20 N -0.40 4.66 0.55 0.00 0.01 -1.26 -5.01 113.70 112.25 1qip s SER 20 Ca 0.16 -0.36 -0.20 0.00 1.31 0.00 0.00 55.95 56.86 1qip s SER 20 Cb -0.13 -0.97 -0.05 0.00 0.21 0.00 0.00 66.02 65.08 1qip s SER 20 CO 0.05 0.14 1.23 -1.81 0.41 0.00 0.00 173.24 173.25 1qip s ASP 21 N -2.55 5.48 0.19 2.44 1.01 -1.26 -4.91 116.67 117.08 1qip s ASP 21 Ca 0.25 2.44 -0.32 0.00 0.71 0.00 0.00 52.55 55.63 1qip s ASP 21 Cb -0.10 -2.61 -0.11 0.00 1.01 0.00 0.00 42.92 41.11 1qip s ASP 21 CO 0.17 -1.40 1.63 0.00 0.21 0.00 0.00 175.17 175.78 1qip s ALA 22 N -1.52 3.84 0.36 5.23 0.00 -1.26 -4.95 121.76 123.46 1qip s ALA 22 Ca 0.72 1.48 -0.28 0.00 0.00 0.00 0.00 51.96 53.88 1qip s ALA 22 Cb -0.32 -3.65 -0.10 0.00 0.00 0.00 0.00 23.12 19.05 1qip s ALA 22 CO 0.36 -0.85 1.37 0.34 0.00 0.00 0.00 175.76 176.98 1qip s ASP 23 N 1.09 6.53 0.47 0.00 -1.08 -1.26 -4.89 116.67 117.53 1qip s ASP 23 Ca 0.71 2.82 0.24 0.00 -0.52 0.00 0.00 52.55 55.80 1qip s ASP 23 Cb -0.47 -2.65 1.27 0.00 -1.46 0.00 0.00 42.92 39.61 1qip s ASP 23 CO 0.33 -0.72 1.88 -0.65 0.52 0.00 0.00 175.17 176.53 1qip h PRO 24 N 3.12 0.21 0.00 4.34 0.11 -2.02 -0.01 132.00 137.74 1qip h PRO 24 Ca -0.50 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.60 1qip h PRO 24 Cb 1.23 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.30 1qip h PRO 24 CO 0.64 0.14 0.00 0.66 -0.21 0.00 0.00 178.00 179.23 1qip h SER 25 N 0.21 0.00 -0.29 -2.05 4.64 -2.03 -2.66 113.55 111.37 1qip h SER 25 Ca 0.44 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.76 1qip h SER 25 Cb 1.37 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.46 1qip h SER 25 CO -0.10 0.00 0.00 0.35 -0.87 0.00 0.00 176.83 176.21 1qip n THR 26 N -2.35 0.40 0.30 2.95 -2.24 -0.02 -4.63 114.28 108.70 1qip n THR 26 Ca 0.02 -0.70 0.15 0.00 -2.27 0.00 0.00 64.05 61.24 1qip n THR 26 Cb 0.22 1.07 0.67 0.00 -2.10 0.00 0.00 70.33 70.19 1qip n THR 26 CO 0.00 0.00 0.00 0.11 -0.57 0.00 0.00 175.07 174.61 1qip h LYS 27 N 4.10 0.00 -0.50 -0.78 1.79 -1.53 -1.57 116.57 118.08 1qip h LYS 27 Ca 0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 1qip h LYS 27 Cb 0.92 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.57 1qip h LYS 27 CO 0.00 0.00 0.00 -0.25 -1.08 0.00 0.00 179.45 178.12 1qip n ASP 28 N -2.55 3.36 -4.78 0.86 8.00 -1.26 -4.99 116.55 115.19 1qip n ASP 28 Ca -0.00 -1.99 -0.35 0.00 0.71 0.00 0.00 54.79 53.16 1qip n ASP 28 Cb 0.17 -0.33 -0.02 0.00 -0.02 0.00 0.00 41.12 40.91 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 -1.02 2.90 0.02 1.24 0.40 -0.59 -5.05 117.98 115.88 1qip s PHE 29 Ca 0.34 1.57 0.01 0.00 -0.60 0.00 0.00 56.93 58.25 1qip s PHE 29 Cb 0.18 -3.21 -0.02 0.00 0.51 0.00 0.00 43.02 40.49 1qip s PHE 29 CO 0.24 -1.18 -0.04 -0.48 0.70 0.00 0.00 175.22 174.46 1qip s LEU 30 N -3.40 2.22 -0.82 -0.37 0.05 -1.26 -5.08 118.68 110.02 1qip s LEU 30 Ca 0.67 -0.46 -0.22 0.00 0.05 0.00 0.00 54.13 54.17 1qip s LEU 30 Cb -0.22 0.01 0.08 0.00 -2.05 0.00 0.00 46.19 44.01 1qip s LEU 30 CO 0.26 -0.24 1.16 -0.22 -0.55 0.00 0.00 176.35 176.76 1qip s LEU 31 N -1.32 4.17 -0.01 1.48 2.96 -1.26 -4.85 118.68 119.85 1qip s LEU 31 Ca -0.12 -1.26 -0.13 0.00 -0.22 0.00 0.00 54.13 52.39 1qip s LEU 31 Cb -0.09 -2.47 -0.33 0.00 0.50 0.00 0.00 46.19 43.80 1qip s LEU 31 CO -0.01 -1.43 0.83 -0.61 -1.32 0.00 0.00 176.35 173.82 1qip h GLN 32 N 9.50 0.47 -3.45 1.98 -0.00 -1.93 -2.65 115.11 119.03 1qip h GLN 32 Ca -0.07 -0.80 -0.06 0.00 -0.00 0.00 0.00 58.65 57.72 1qip h GLN 32 Cb 1.04 0.30 -0.13 0.00 0.00 0.00 0.00 27.48 28.69 1qip h GLN 32 CO 1.23 1.38 -0.11 1.14 0.00 0.00 0.00 178.83 182.47 1qip s GLN 33 N -2.59 1.04 -0.13 1.69 -2.07 -1.26 -1.13 119.66 115.21 1qip s GLN 33 Ca -0.13 -0.75 0.00 0.00 -1.82 0.00 0.00 55.36 52.67 1qip s GLN 33 Cb 0.05 0.45 0.02 0.00 -1.09 0.00 0.00 33.01 32.44 1qip s GLN 33 CO 0.90 -0.40 -0.12 0.99 -1.32 0.00 0.00 175.29 175.33 1qip s THR 34 N -3.82 1.39 -0.21 3.63 2.01 -0.78 -4.95 115.64 112.92 1qip s THR 34 Ca 0.03 -0.53 -0.11 0.00 0.31 0.00 0.00 61.69 61.39 1qip s THR 34 Cb 0.02 -1.32 -0.05 0.00 0.01 0.00 0.00 72.50 71.16 1qip s THR 34 CO -0.12 0.43 0.19 -0.32 -0.69 0.00 0.00 174.62 174.12 1qip s MET 35 N 1.43 4.15 -0.03 4.92 1.75 -1.26 -0.90 119.30 129.36 1qip s MET 35 Ca 0.02 -0.15 0.04 0.00 -1.25 0.00 0.00 55.69 54.36 1qip s MET 35 Cb -0.13 -3.48 -0.01 0.00 2.84 0.00 0.00 34.83 34.05 1qip s MET 35 CO -0.08 0.15 -0.16 -0.51 -0.65 0.00 0.00 175.02 173.77 1qip s LEU 36 N 0.77 1.94 0.03 4.11 1.43 -0.51 -4.97 118.68 121.47 1qip s LEU 36 Ca 0.10 -0.32 -0.24 0.00 -1.03 0.00 0.00 54.13 52.64 1qip s LEU 36 Cb -0.13 -0.89 -0.05 0.00 0.03 0.00 0.00 46.19 45.15 1qip s LEU 36 CO 0.03 0.16 0.74 -0.13 0.23 0.00 0.00 176.35 177.38 1qip s ARG 37 N -0.08 4.47 -0.05 1.70 0.52 -1.26 -1.06 118.95 123.19 1qip s ARG 37 Ca -0.00 1.02 0.06 0.00 -0.52 0.00 0.00 55.73 56.29 1qip s ARG 37 Cb -0.10 -3.37 -0.01 0.00 0.52 0.00 0.00 34.95 32.00 1qip s ARG 37 CO 0.01 0.28 -0.24 0.14 0.02 0.00 0.00 175.30 175.51 1qip s VAL 38 N -0.00 1.94 0.16 3.52 -7.23 0.13 -4.87 120.40 114.05 1qip s VAL 38 Ca 0.38 -1.02 -0.10 0.00 -1.81 0.00 0.00 61.98 59.43 1qip s VAL 38 Cb -0.20 -1.64 0.01 0.00 0.56 0.00 0.00 36.38 35.11 1qip s VAL 38 CO 0.22 0.54 1.56 0.50 -0.31 0.00 0.00 175.10 177.61 1qip h LYS 39 N 5.95 1.00 -3.18 4.82 3.64 -1.95 -3.40 116.57 123.44 1qip h LYS 39 Ca -0.35 -0.42 -0.49 0.00 -1.27 0.00 0.00 60.65 58.12 1qip h LYS 39 Cb 1.16 -0.04 -0.41 0.00 -0.41 0.00 0.00 32.23 32.54 1qip h LYS 39 CO 0.47 1.10 -0.76 0.34 -2.27 0.00 0.00 179.45 178.34 1qip s ASP 40 N -6.72 2.69 0.47 4.20 -1.08 -1.26 -2.40 116.67 112.55 1qip s ASP 40 Ca -0.11 -0.78 0.18 0.00 -0.52 0.00 0.00 52.55 51.32 1qip s ASP 40 Cb 0.12 -0.38 1.12 0.00 -1.46 0.00 0.00 42.92 42.33 1qip s ASP 40 CO 0.87 -0.35 2.01 1.55 0.52 0.00 0.00 175.17 179.77 1qip h PRO 41 N 8.36 0.00 -0.46 4.34 0.13 -1.97 -2.14 132.00 140.25 1qip h PRO 41 Ca -0.16 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.94 1qip h PRO 41 Cb 1.12 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.23 1qip h PRO 41 CO 0.32 0.17 0.17 0.87 -0.23 0.00 0.00 178.00 179.31 1qip h LYS 42 N 0.00 0.69 -0.46 0.86 1.57 -1.99 0.24 116.57 117.48 1qip h LYS 42 Ca -0.00 -0.13 -0.13 0.00 -1.87 0.00 0.00 60.65 58.51 1qip h LYS 42 Cb 0.33 -0.11 -0.01 0.00 0.08 0.00 0.00 32.23 32.52 1qip h LYS 42 CO 0.02 0.63 -0.24 0.87 -0.57 0.00 0.00 179.45 180.16 1qip h LYS 43 N 0.60 0.96 -0.49 3.15 1.57 -1.86 -2.29 116.57 118.21 1qip h LYS 43 Ca 0.15 -0.42 -0.13 0.00 -1.87 0.00 0.00 60.65 58.38 1qip h LYS 43 Cb 0.21 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.48 1qip h LYS 43 CO -0.01 1.09 -0.19 0.77 -0.57 0.00 0.00 179.45 180.53 1qip h SER 44 N 0.82 1.01 -0.32 0.86 0.02 -1.16 -0.90 113.55 113.89 1qip h SER 44 Ca 0.10 -0.39 -0.02 0.00 -0.84 0.00 0.00 61.79 60.65 1qip h SER 44 Cb 0.82 -0.28 -0.01 0.00 0.14 0.00 0.00 62.40 63.06 1qip h SER 44 CO 0.07 1.17 0.13 -0.07 -1.14 0.00 0.00 176.83 177.00 1qip h LEU 45 N 0.85 0.43 -0.40 5.07 3.38 -0.48 0.14 115.31 124.30 1qip h LEU 45 Ca 0.11 -0.16 0.01 0.00 0.09 0.00 0.00 57.88 57.93 1qip h LEU 45 Cb 0.77 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 41.39 1qip h LEU 45 CO 0.06 0.47 0.25 -0.78 0.09 0.00 0.00 178.44 178.54 1qip h ASP 46 N 0.36 0.43 0.63 -0.43 3.58 -1.30 -1.49 116.42 118.20 1qip h ASP 46 Ca 0.11 -0.01 -0.03 0.00 0.42 0.00 0.00 57.03 57.52 1qip h ASP 46 Cb 0.17 -0.10 0.01 0.00 1.72 0.00 0.00 39.33 41.13 1qip h ASP 46 CO -0.01 0.31 -0.30 0.15 -2.88 0.00 0.00 179.24 176.51 1qip h PHE 47 N 0.51 -0.79 0.00 0.28 3.57 -0.70 -0.13 116.94 119.68 1qip h PHE 47 Ca 0.15 -0.02 -0.07 0.00 3.53 0.00 0.00 57.97 61.56 1qip h PHE 47 Cb -0.04 0.26 -0.01 0.00 2.79 0.00 0.00 35.95 38.95 1qip h PHE 47 CO -0.06 -0.49 -0.34 1.88 -2.23 0.00 0.00 178.31 177.08 1qip h TYR 48 N -0.86 0.00 0.00 0.41 0.05 -0.93 -1.03 116.97 114.60 1qip h TYR 48 Ca -0.09 0.00 -0.18 0.00 0.05 0.00 0.00 58.73 58.51 1qip h TYR 48 Cb 0.66 0.00 -0.03 0.00 1.01 0.00 0.00 36.73 38.37 1qip h TYR 48 CO -0.03 0.34 -0.98 1.79 -1.05 0.00 0.00 178.16 178.23 1qip h THR 49 N 0.00 1.09 -0.01 -2.88 1.35 -1.26 -0.26 112.91 110.94 1qip h THR 49 Ca -0.00 -2.20 -0.10 0.00 -0.55 0.00 0.00 66.41 63.56 1qip h THR 49 Cb 0.62 2.44 0.01 0.00 -1.73 0.00 0.00 68.15 69.49 1qip h THR 49 CO 0.04 0.37 -0.37 -0.09 -0.25 0.00 0.00 175.52 175.22 1qip h ARG 50 N -1.00 0.27 0.00 4.72 2.43 -1.10 -1.05 114.38 118.64 1qip h ARG 50 Ca -0.27 -0.27 -0.02 0.00 -0.81 0.00 0.00 59.98 58.61 1qip h ARG 50 Cb 1.23 0.08 0.00 0.00 -0.42 0.00 0.00 29.97 30.85 1qip h ARG 50 CO -0.16 0.98 -0.06 0.28 -1.51 0.00 0.00 179.97 179.49 1qip h VAL 51 N -0.34 1.62 -0.02 0.20 2.07 -1.23 -3.37 116.25 115.18 1qip h VAL 51 Ca -0.04 -1.89 0.00 0.00 0.82 0.00 0.00 66.70 65.58 1qip h VAL 51 Cb 1.10 2.88 0.00 0.00 -1.52 0.00 0.00 31.29 33.75 1qip h VAL 51 CO 0.07 0.50 -0.47 0.18 0.02 0.00 0.00 177.57 177.87 1qip n LEU 52 N -4.66 2.02 -0.27 2.57 4.77 -0.92 -4.99 117.00 115.52 1qip n LEU 52 Ca -0.09 -0.75 -0.04 0.00 -0.03 0.00 0.00 56.01 55.10 1qip n LEU 52 Cb 0.42 -0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.49 1qip n LEU 52 CO 0.35 0.38 -0.03 0.61 -1.33 0.00 0.00 177.39 177.36 1qip n GLY 53 N 1.42 0.66 3.90 -0.72 0.00 -0.40 -4.94 105.19 105.11 1qip n GLY 53 Ca 0.09 -0.67 -0.29 0.00 0.00 0.00 0.00 46.02 45.16 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 -1.95 1.97 -0.05 1.61 -1.94 -0.14 -4.90 119.30 113.89 1qip s MET 54 Ca 0.00 0.05 0.06 0.00 -1.71 0.00 0.00 55.69 54.09 1qip s MET 54 Cb 0.00 -1.98 -0.01 0.00 2.01 0.00 0.00 34.83 34.85 1qip s MET 54 CO 0.00 -1.56 -0.24 0.99 -0.01 0.00 0.00 175.02 174.19 1qip s THR 55 N -3.54 1.98 -0.40 2.05 2.01 0.39 -4.24 115.64 113.89 1qip s THR 55 Ca 0.62 -1.03 -0.29 0.00 0.31 0.00 0.00 61.69 61.30 1qip s THR 55 Cb -0.11 -1.67 0.01 0.00 0.01 0.00 0.00 72.50 70.74 1qip s THR 55 CO 0.48 0.55 1.42 -0.22 -0.69 0.00 0.00 174.62 176.17 1qip s LEU 56 N -0.21 3.60 -0.01 4.42 2.96 -1.26 -1.46 118.68 126.72 1qip s LEU 56 Ca -0.02 0.87 0.22 0.00 -0.22 0.00 0.00 54.13 54.98 1qip s LEU 56 Cb -0.13 -3.54 -0.28 0.00 0.50 0.00 0.00 46.19 42.74 1qip s LEU 56 CO 0.03 -1.42 0.62 2.30 -1.32 0.00 0.00 176.35 176.56 1qip n ILE 57 N 7.03 0.03 -3.60 6.68 -5.35 0.09 -4.99 119.36 119.25 1qip n ILE 57 Ca 0.17 -0.37 -0.14 0.00 -0.27 0.00 0.00 62.75 62.14 1qip n ILE 57 Cb 0.48 0.24 -0.07 0.00 -1.74 0.00 0.00 39.64 38.56 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 -3.37 0.84 -0.06 6.28 2.00 -1.22 -4.88 119.66 119.25 1qip s GLN 58 Ca -0.03 0.74 0.02 0.00 -2.00 0.00 0.00 55.36 54.08 1qip s GLN 58 Cb 0.14 0.41 0.02 0.00 0.80 0.00 0.00 33.01 34.38 1qip s GLN 58 CO 0.89 -0.15 -0.09 0.21 -0.50 0.00 0.00 175.29 175.64 1qip s LYS 59 N -0.08 1.38 -0.06 1.67 2.20 -1.26 -0.97 119.74 122.62 1qip s LYS 59 Ca -0.02 -0.30 0.03 0.00 -0.36 0.00 0.00 55.97 55.32 1qip s LYS 59 Cb -0.04 -1.20 0.00 0.00 -1.51 0.00 0.00 37.83 35.09 1qip s LYS 59 CO 0.02 -0.01 -0.16 0.00 -0.36 0.00 0.00 175.35 174.84 1qip s ASP 61 N 0.33 3.61 -0.51 0.00 1.01 -1.26 -0.28 116.67 119.58 1qip s ASP 61 Ca -0.10 -0.36 0.03 0.00 0.71 0.00 0.00 52.55 52.83 1qip s ASP 61 Cb -0.14 -1.01 0.14 0.00 1.01 0.00 0.00 42.92 42.92 1qip s ASP 61 CO 0.04 0.26 0.30 -0.36 0.21 0.00 0.00 175.17 175.62 1qip s PHE 62 N -0.24 2.47 0.25 4.23 0.08 0.06 -5.00 117.98 119.83 1qip s PHE 62 Ca -0.00 -2.76 -0.05 0.00 0.12 0.00 0.00 56.93 54.24 1qip s PHE 62 Cb -0.13 -2.16 0.29 0.00 -0.57 0.00 0.00 43.02 40.45 1qip s PHE 62 CO 0.03 -0.73 1.84 -1.00 -0.10 0.00 0.00 175.22 175.26 1qip h PRO 63 N 6.30 1.08 -0.24 0.24 0.13 -1.97 0.21 132.00 137.76 1qip h PRO 63 Ca 0.03 -0.17 -0.17 0.00 -0.87 0.00 0.00 66.00 64.83 1qip h PRO 63 Cb 0.88 -0.19 -0.00 0.00 0.13 0.00 0.00 31.00 31.82 1qip h PRO 63 CO 0.56 0.85 -0.52 0.82 -0.23 0.00 0.00 178.00 179.48 1qip h ILE 64 N 1.07 1.30 -0.00 -3.56 2.04 -1.95 -2.84 117.51 113.56 1qip h ILE 64 Ca 0.26 -1.74 0.00 0.00 1.00 0.00 0.00 64.86 64.38 1qip h ILE 64 Cb 0.15 1.68 0.00 0.00 -0.74 0.00 0.00 36.82 37.91 1qip h ILE 64 CO -0.03 0.55 -0.21 0.23 0.00 0.00 0.00 178.15 178.70 1qip n MET 65 N -3.99 0.40 -3.45 2.37 2.81 -1.07 -4.97 117.12 109.24 1qip n MET 65 Ca -0.03 -0.16 -0.19 0.00 -1.81 0.00 0.00 57.70 55.50 1qip n MET 65 Cb 0.60 -1.50 0.06 0.00 -0.71 0.00 0.00 33.22 31.68 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 -1.16 -3.49 -3.59 0.03 5.02 0.71 -4.92 118.16 110.77 1qip n LYS 66 Ca 0.10 0.75 -0.12 0.00 -2.02 0.00 0.00 58.31 57.02 1qip n LYS 66 Cb 0.31 -5.43 -0.05 0.00 -0.02 0.00 0.00 35.03 29.85 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 -3.45 -0.32 0.12 2.13 -0.71 -1.03 -1.43 117.98 113.29 1qip s PHE 67 Ca 0.28 0.14 0.05 0.00 -1.04 0.00 0.00 56.93 56.37 1qip s PHE 67 Cb -0.06 0.32 -0.04 0.00 -1.21 0.00 0.00 43.02 42.04 1qip s PHE 67 CO 0.77 -0.69 -0.13 -1.12 -1.34 0.00 0.00 175.22 172.71 1qip s SER 68 N -2.49 1.87 -0.05 1.98 0.01 -0.49 -0.76 113.70 113.78 1qip s SER 68 Ca -0.00 -0.82 0.06 0.00 1.31 0.00 0.00 55.95 56.49 1qip s SER 68 Cb 0.00 -0.05 -0.01 0.00 0.21 0.00 0.00 66.02 66.17 1qip s SER 68 CO -0.08 -0.18 -0.24 -0.76 0.41 0.00 0.00 173.24 172.39 1qip s LEU 69 N -2.50 2.04 -0.19 2.44 1.43 0.62 -0.95 118.68 121.58 1qip s LEU 69 Ca 0.09 -0.48 0.01 0.00 -1.03 0.00 0.00 54.13 52.72 1qip s LEU 69 Cb -0.04 -1.30 0.03 0.00 0.03 0.00 0.00 46.19 44.91 1qip s LEU 69 CO 0.02 0.24 -0.16 -0.31 0.23 0.00 0.00 176.35 176.38 1qip s TYR 70 N -0.19 2.66 -0.26 0.29 2.02 -0.16 -0.79 117.35 120.92 1qip s TYR 70 Ca -0.02 -1.66 -0.12 0.00 -0.37 0.00 0.00 57.07 54.91 1qip s TYR 70 Cb -0.13 -1.80 -0.05 0.00 -0.40 0.00 0.00 41.96 39.58 1qip s TYR 70 CO 0.03 -0.78 0.23 -0.06 -1.57 0.00 0.00 175.55 173.40 1qip s PHE 71 N 1.32 3.27 -0.06 2.71 0.40 -0.14 0.06 117.98 125.54 1qip s PHE 71 Ca 0.02 0.25 0.03 0.00 -0.60 0.00 0.00 56.93 56.63 1qip s PHE 71 Cb -0.15 -2.39 -0.02 0.00 0.51 0.00 0.00 43.02 40.97 1qip s PHE 71 CO -0.10 -0.08 -0.13 -0.51 0.70 0.00 0.00 175.22 175.09 1qip s LEU 72 N 1.52 2.77 0.20 -0.37 1.43 0.55 -0.73 118.68 124.05 1qip s LEU 72 Ca 0.10 -0.20 -0.16 0.00 -1.03 0.00 0.00 54.13 52.83 1qip s LEU 72 Cb -0.15 -1.57 0.02 0.00 0.03 0.00 0.00 46.19 44.52 1qip s LEU 72 CO 0.08 0.32 0.50 0.00 0.23 0.00 0.00 176.35 177.48 1qip s ALA 73 N -0.57 -0.76 -0.99 4.21 0.00 -0.53 -0.57 121.76 122.55 1qip s ALA 73 Ca 0.08 -0.39 -0.16 0.00 0.00 0.00 0.00 51.96 51.50 1qip s ALA 73 Cb -0.11 0.88 0.17 0.00 0.00 0.00 0.00 23.12 24.05 1qip s ALA 73 CO 0.01 -0.81 1.12 0.71 0.00 0.00 0.00 175.76 176.80 1qip s TYR 74 N -3.91 3.42 0.05 0.00 2.02 -1.26 -0.46 117.35 117.21 1qip s TYR 74 Ca 0.12 -1.77 0.00 0.00 -0.37 0.00 0.00 57.07 55.05 1qip s TYR 74 Cb -0.01 -4.17 -0.03 0.00 -0.40 0.00 0.00 41.96 37.35 1qip s TYR 74 CO -0.00 -1.33 -0.04 -1.21 -1.57 0.00 0.00 175.55 171.40 1qip s GLU 75 N 1.65 0.54 -0.02 -0.62 0.41 -1.26 -5.03 118.70 114.37 1qip s GLU 75 Ca 0.32 -1.00 -0.30 0.00 -0.41 0.00 0.00 54.97 53.58 1qip s GLU 75 Cb -0.06 0.07 -0.03 0.00 -1.78 0.00 0.00 34.13 32.33 1qip s GLU 75 CO -0.07 -0.06 1.09 0.34 -0.49 0.00 0.00 175.26 176.07 1qip s ASP 76 N -2.35 7.20 0.64 -0.19 -1.08 -1.26 -4.65 116.67 114.98 1qip s ASP 76 Ca -0.01 1.76 0.40 0.00 -0.52 0.00 0.00 52.55 54.18 1qip s ASP 76 Cb 0.00 -2.57 2.21 0.00 -1.46 0.00 0.00 42.92 41.11 1qip s ASP 76 CO -0.05 -0.42 2.33 0.07 0.52 0.00 0.00 175.17 177.61 1qip h LYS 77 N 7.01 0.00 0.00 4.34 2.10 -1.99 -0.62 116.57 127.41 1qip h LYS 77 Ca -0.38 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.27 1qip h LYS 77 Cb 1.19 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.52 1qip h LYS 77 CO 0.82 0.00 0.00 0.09 -2.00 0.00 0.00 179.45 178.36 1qip n ASN 78 N -3.33 0.00 0.00 7.07 3.02 -1.26 -2.71 115.26 118.05 1qip n ASN 78 Ca -0.03 -0.25 0.11 0.00 -0.03 0.00 0.00 54.58 54.38 1qip n ASN 78 Cb 0.08 -0.24 0.12 0.00 -0.61 0.00 0.00 39.78 39.14 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 -1.24 0.67 -4.62 6.41 8.00 -0.24 -4.86 116.55 120.67 1qip n ASP 79 Ca 0.15 -0.51 -0.43 0.00 0.71 0.00 0.00 54.79 54.71 1qip n ASP 79 Cb 0.20 0.51 -0.02 0.00 -0.02 0.00 0.00 41.12 41.79 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 -3.00 3.89 0.66 0.53 1.01 -1.10 -4.98 121.20 118.20 1qip s ILE 80 Ca 0.10 0.99 -0.18 0.00 0.00 0.00 0.00 60.65 61.56 1qip s ILE 80 Cb 0.17 -3.95 -0.01 0.00 0.01 0.00 0.00 42.46 38.68 1qip s ILE 80 CO 0.76 -0.44 1.18 -2.65 0.00 0.00 0.00 174.94 173.79 1qip n PRO 81 N 7.62 0.94 0.11 2.79 -0.02 -1.26 -4.96 135.00 140.23 1qip n PRO 81 Ca 0.17 0.38 -0.24 0.00 -2.02 0.00 0.00 63.50 61.79 1qip n PRO 81 Cb 0.46 -2.42 -0.15 0.00 -0.02 0.00 0.00 33.50 31.37 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 0.34 0.47 -6.62 -0.52 1.57 -1.97 -3.42 116.57 106.43 1qip h LYS 82 Ca -0.50 -0.80 -0.52 0.00 -1.87 0.00 0.00 60.65 56.95 1qip h LYS 82 Cb 1.34 0.30 0.02 0.00 0.08 0.00 0.00 32.23 33.97 1qip h LYS 82 CO 0.51 1.38 0.60 -2.00 -0.57 0.00 0.00 179.45 179.38 1qip s GLU 83 N -2.57 4.44 0.17 3.15 -6.30 -1.26 -4.92 118.70 111.41 1qip s GLU 83 Ca -0.12 1.92 -0.24 0.00 -2.50 0.00 0.00 54.97 54.04 1qip s GLU 83 Cb 0.04 -3.25 0.06 0.00 0.00 0.00 0.00 34.13 30.98 1qip s GLU 83 CO 0.91 -0.20 1.58 0.87 0.02 0.00 0.00 175.26 178.43 1qip h LYS 84 N 5.77 -0.21 -0.38 4.30 1.57 -1.99 0.22 116.57 125.84 1qip h LYS 84 Ca -0.44 0.01 -0.14 0.00 -1.87 0.00 0.00 60.65 58.21 1qip h LYS 84 Cb 1.21 0.05 -0.01 0.00 0.08 0.00 0.00 32.23 33.56 1qip h LYS 84 CO 0.78 -0.14 -0.34 -0.44 -0.57 0.00 0.00 179.45 178.74 1qip h ASP 85 N -0.22 0.91 -0.44 0.86 5.19 -1.98 -2.00 116.42 118.73 1qip h ASP 85 Ca 0.19 -0.39 -0.10 0.00 -0.62 0.00 0.00 57.03 56.11 1qip h ASP 85 Cb 0.56 -0.25 -0.02 0.00 0.18 0.00 0.00 39.33 39.80 1qip h ASP 85 CO -0.66 1.16 -0.09 -0.33 -3.12 0.00 0.00 179.24 176.20 1qip h GLU 86 N 0.72 0.89 -0.32 3.56 5.08 -1.91 -2.38 114.58 120.22 1qip h GLU 86 Ca 0.07 -0.30 0.01 0.00 -1.00 0.00 0.00 59.36 58.14 1qip h GLU 86 Cb 0.90 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 30.06 1qip h GLU 86 CO 0.08 0.95 0.18 -0.22 -1.00 0.00 0.00 179.01 179.00 1qip h LYS 87 N 0.81 0.37 0.06 2.33 3.64 -0.77 -0.70 116.57 122.30 1qip h LYS 87 Ca 0.13 -0.02 -0.00 0.00 -1.27 0.00 0.00 60.65 59.49 1qip h LYS 87 Cb 0.61 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 32.35 1qip h LYS 87 CO 0.04 0.24 -0.03 0.82 -2.27 0.00 0.00 179.45 178.25 1qip h ILE 88 N 0.38 0.96 -0.81 2.00 2.04 -1.25 0.26 117.51 121.09 1qip h ILE 88 Ca 0.13 -0.06 0.04 0.00 1.00 0.00 0.00 64.86 65.97 1qip h ILE 88 Cb 0.01 1.00 -0.05 0.00 -0.74 0.00 0.00 36.82 37.03 1qip h ILE 88 CO -0.06 0.02 0.51 0.00 0.00 0.00 0.00 178.15 178.61 1qip h ALA 89 N 0.83 1.09 0.26 1.87 0.00 -1.22 -0.47 119.26 121.61 1qip h ALA 89 Ca -0.01 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 1qip h ALA 89 Cb 0.09 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.63 1qip h ALA 89 CO 0.01 0.29 -0.13 2.35 0.00 0.00 0.00 179.25 181.78 1qip h TRP 90 N 0.96 -0.33 -0.53 0.00 7.01 -0.99 -2.77 115.95 119.30 1qip h TRP 90 Ca 0.34 -0.01 0.02 0.00 2.11 0.00 0.00 58.89 61.35 1qip h TRP 90 Cb 0.08 0.11 -0.03 0.00 -2.10 0.00 0.00 29.16 27.22 1qip h TRP 90 CO -0.03 0.00 0.32 0.00 -2.79 0.00 0.00 178.44 175.95 1qip h ALA 91 N -0.10 0.69 0.00 2.65 0.00 -0.73 -1.83 119.26 119.93 1qip h ALA 91 Ca -0.04 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1qip h ALA 91 Cb 0.48 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.11 1qip h ALA 91 CO 0.06 0.04 0.00 1.28 0.00 0.00 0.00 179.25 180.63 1qip n LEU 92 N -4.77 0.00 -0.81 0.00 4.77 -0.21 -2.30 117.00 113.68 1qip n LEU 92 Ca 0.04 0.10 0.07 0.00 -0.03 0.00 0.00 56.01 56.19 1qip n LEU 92 Cb 0.07 -0.10 0.18 0.00 -2.33 0.00 0.00 43.42 41.24 1qip n LEU 92 CO 0.33 -0.01 0.64 -1.54 -1.33 0.00 0.00 177.39 175.47 1qip n SER 93 N -1.10 3.06 -4.76 -1.43 3.41 -0.71 -4.95 113.62 107.14 1qip n SER 93 Ca 0.18 -1.93 -0.40 0.00 -0.26 0.00 0.00 58.87 56.46 1qip n SER 93 Cb 0.13 -0.25 -0.05 0.00 -0.26 0.00 0.00 64.21 63.78 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 -1.04 4.51 0.61 4.33 1.81 -0.97 -5.06 118.95 123.13 1qip s ARG 94 Ca 0.28 1.08 -0.06 0.00 -1.72 0.00 0.00 55.73 55.32 1qip s ARG 94 Cb 0.15 -3.33 0.02 0.00 -0.45 0.00 0.00 34.95 31.34 1qip s ARG 94 CO 0.21 0.38 0.92 -1.59 -0.68 0.00 0.00 175.30 174.54 1qip s LYS 95 N -0.41 2.83 -1.20 3.54 -2.85 -1.26 -4.47 119.74 115.92 1qip s LYS 95 Ca 0.37 -0.02 -0.00 0.00 -1.00 0.00 0.00 55.97 55.32 1qip s LYS 95 Cb -0.21 -2.25 -0.00 0.00 -2.06 0.00 0.00 37.83 33.30 1qip s LYS 95 CO 0.24 -0.78 0.99 0.00 0.10 0.00 0.00 175.35 175.90 1qip n ALA 96 N -2.64 -2.04 -2.74 0.59 0.00 -1.00 -4.94 120.51 107.75 1qip n ALA 96 Ca 0.05 -0.06 -0.22 0.00 0.00 0.00 0.00 53.44 53.21 1qip n ALA 96 Cb 0.58 -2.51 -0.05 0.00 0.00 0.00 0.00 19.45 17.46 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 -3.37 4.04 -0.15 0.00 -4.23 -0.29 -4.59 115.64 107.05 1qip s THR 97 Ca 0.02 -1.57 -0.03 0.00 -1.18 0.00 0.00 61.69 58.92 1qip s THR 97 Cb -0.00 -3.20 -0.03 0.00 1.34 0.00 0.00 72.50 70.61 1qip s THR 97 CO 0.73 -0.34 -0.04 -0.76 -0.54 0.00 0.00 174.62 173.67 1qip s LEU 98 N -3.80 3.23 -0.40 4.79 1.43 0.27 -1.86 118.68 122.34 1qip s LEU 98 Ca 0.33 -0.13 -0.10 0.00 -1.03 0.00 0.00 54.13 53.20 1qip s LEU 98 Cb -0.07 -1.78 0.06 0.00 0.03 0.00 0.00 46.19 44.43 1qip s LEU 98 CO 0.23 0.17 0.24 -0.70 0.23 0.00 0.00 176.35 176.52 1qip s GLU 99 N 0.34 2.71 -0.23 1.70 2.12 -0.08 -0.33 118.70 124.93 1qip s GLU 99 Ca -0.04 -1.29 -0.13 0.00 0.36 0.00 0.00 54.97 53.86 1qip s GLU 99 Cb -0.14 -3.76 -0.04 0.00 0.26 0.00 0.00 34.13 30.44 1qip s GLU 99 CO 0.03 -0.84 0.29 -0.51 -0.54 0.00 0.00 175.26 173.69 1qip s LEU 100 N 1.49 4.11 -0.26 2.70 1.43 0.11 -1.43 118.68 126.82 1qip s LEU 100 Ca 0.02 0.29 -0.10 0.00 -1.03 0.00 0.00 54.13 53.31 1qip s LEU 100 Cb -0.21 -2.32 -0.04 0.00 0.03 0.00 0.00 46.19 43.64 1qip s LEU 100 CO 0.04 -0.05 0.15 -0.89 0.23 0.00 0.00 176.35 175.84 1qip s THR 101 N 1.40 5.06 -0.35 5.49 2.01 -0.23 -0.99 115.64 128.03 1qip s THR 101 Ca 0.13 0.08 -0.10 0.00 0.31 0.00 0.00 61.69 62.12 1qip s THR 101 Cb -0.15 -3.39 0.03 0.00 0.01 0.00 0.00 72.50 69.00 1qip s THR 101 CO 0.07 0.29 0.17 -2.28 -0.69 0.00 0.00 174.62 172.19 1qip s HIS 102 N 1.56 3.23 -0.30 4.92 2.46 -0.13 -0.69 115.29 126.34 1qip s HIS 102 Ca 0.07 -1.03 -0.24 0.00 0.47 0.00 0.00 55.06 54.32 1qip s HIS 102 Cb -0.15 -2.38 0.00 0.00 -0.13 0.00 0.00 32.58 29.92 1qip s HIS 102 CO 0.08 -0.64 0.83 -0.80 -2.47 0.00 0.00 174.74 171.73 1qip s ASN 103 N 1.52 6.71 0.21 9.88 0.01 -1.26 -1.40 114.94 130.62 1qip s ASN 103 Ca 0.01 0.74 -0.32 0.00 -0.71 0.00 0.00 52.86 52.59 1qip s ASN 103 Cb -0.19 -2.43 -0.14 0.00 0.41 0.00 0.00 41.25 38.91 1qip s ASN 103 CO 0.05 -0.64 1.45 0.79 -1.51 0.00 0.00 177.10 177.24 1qip n TRP 104 N 6.27 2.15 0.00 2.20 8.01 -0.51 -2.73 117.44 132.83 1qip n TRP 104 Ca 0.05 0.40 0.00 0.00 -1.31 0.00 0.00 57.50 56.64 1qip n TRP 104 Cb 0.48 -2.48 0.00 0.00 -2.01 0.00 0.00 31.31 27.30 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 2.53 1.67 0.22 6.99 0.00 -1.26 -4.95 105.19 110.39 1qip n GLY 105 Ca 0.13 0.00 0.05 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 1.11 0.00 2.61 1.35 -1.74 -2.34 112.91 113.90 1qip h THR 106 Ca 0.00 -0.77 0.00 0.00 -0.55 0.00 0.00 66.41 65.09 1qip h THR 106 Cb 0.00 1.42 0.00 0.00 -1.73 0.00 0.00 68.15 67.84 1qip h THR 106 CO 0.00 0.22 0.00 1.05 -0.25 0.00 0.00 175.52 176.54 1qip h GLU 107 N 0.00 0.00 -0.27 4.72 9.09 -1.76 -2.51 114.58 123.85 1qip h GLU 107 Ca -0.00 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.41 1qip h GLU 107 Cb 0.40 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.50 1qip h GLU 107 CO 0.03 0.00 0.00 -0.25 0.05 0.00 0.00 179.01 178.84 1qip n ASP 108 N -2.93 2.95 -4.37 3.06 8.00 -0.89 -4.87 116.55 117.50 1qip n ASP 108 Ca 0.00 -1.86 -0.42 0.00 0.71 0.00 0.00 54.79 53.22 1qip n ASP 108 Cb 0.26 -0.17 -0.09 0.00 -0.02 0.00 0.00 41.12 41.09 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 -1.25 5.93 0.59 -2.24 -1.08 -0.95 -4.96 116.67 112.71 1qip s ASP 109 Ca 0.28 -1.19 0.38 0.00 -0.52 0.00 0.00 52.55 51.50 1qip s ASP 109 Cb 0.17 -2.10 1.74 0.00 -1.46 0.00 0.00 42.92 41.27 1qip s ASP 109 CO 0.24 -0.52 2.12 -0.33 0.52 0.00 0.00 175.17 177.20 1qip h GLU 110 N 8.57 0.00 0.00 4.34 5.08 -1.89 -2.39 114.58 128.30 1qip h GLU 110 Ca -0.26 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.10 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 0.77 0.00 -0.62 0.25 -1.00 0.00 0.00 179.01 178.41 1qip n THR 111 N -3.09 0.04 -3.31 1.13 -2.24 -1.26 -4.93 114.28 100.62 1qip n THR 111 Ca -0.01 -0.04 -0.36 0.00 -2.27 0.00 0.00 64.05 61.38 1qip n THR 111 Cb 0.23 0.32 -0.06 0.00 -2.10 0.00 0.00 70.33 68.72 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 4.05 -0.09 -0.78 -0.44 -0.90 -5.08 119.66 113.40 1qip s GLN 112 Ca 0.10 0.58 -0.30 0.00 -2.50 0.00 0.00 55.36 53.24 1qip s GLN 112 Cb 0.17 -2.97 0.10 0.00 -1.64 0.00 0.00 33.01 28.67 1qip s GLN 112 CO 0.73 0.49 0.86 -1.54 0.50 0.00 0.00 175.29 176.33 1qip s SER 113 N -1.62 -0.47 0.43 6.67 1.04 -1.26 -4.97 113.70 113.51 1qip s SER 113 Ca 0.37 0.42 -0.01 0.00 0.48 0.00 0.00 55.95 57.21 1qip s SER 113 Cb -0.16 0.40 -0.02 0.00 0.10 0.00 0.00 66.02 66.35 1qip s SER 113 CO 0.19 -0.50 0.67 -0.31 0.98 0.00 0.00 173.24 174.27 1qip s TYR 114 N -1.57 3.40 -0.17 5.02 2.02 -1.26 -5.09 117.35 119.70 1qip s TYR 114 Ca -0.04 0.43 -0.08 0.00 -0.37 0.00 0.00 57.07 57.01 1qip s TYR 114 Cb -0.00 -2.18 -0.04 0.00 -0.40 0.00 0.00 41.96 39.33 1qip s TYR 114 CO 0.02 -0.19 0.11 -1.58 -1.57 0.00 0.00 175.55 172.34 1qip s HIS 115 N -2.54 3.41 -2.01 2.71 5.65 -1.26 -4.99 115.29 116.27 1qip s HIS 115 Ca 0.45 0.32 0.29 0.00 0.25 0.00 0.00 55.06 56.37 1qip s HIS 115 Cb -0.10 -2.06 1.28 0.00 -1.18 0.00 0.00 32.58 30.51 1qip s HIS 115 CO 0.39 0.39 1.88 0.27 -0.65 0.00 0.00 174.74 177.02 1qip n ASN 116 N 3.04 0.75 0.00 9.88 0.23 -1.26 -4.93 115.26 122.97 1qip n ASN 116 Ca -0.17 -0.99 0.00 0.00 -0.53 0.00 0.00 54.58 52.88 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 1.19 1.26 0.96 4.83 0.00 -1.26 -4.65 105.19 107.51 1qip n GLY 117 Ca 0.18 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.30 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 3.06 -4.19 1.61 3.02 -1.26 -2.59 115.26 114.92 1qip n ASN 118 Ca 0.00 -1.92 -0.13 0.00 -0.03 0.00 0.00 54.58 52.50 1qip n ASN 118 Cb 0.00 -0.13 -0.10 0.00 -0.61 0.00 0.00 39.78 38.94 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 -1.56 1.42 0.24 6.41 1.04 -1.26 -4.98 113.70 115.02 1qip s SER 119 Ca 0.30 -0.93 -0.31 0.00 0.48 0.00 0.00 55.95 55.49 1qip s SER 119 Cb 0.19 0.04 -0.14 0.00 0.10 0.00 0.00 66.02 66.21 1qip s SER 119 CO 0.28 -0.35 1.28 0.47 0.98 0.00 0.00 173.24 175.90 1qip n ASP 120 N 0.14 2.24 -4.69 7.02 8.00 -1.26 -3.05 116.55 124.95 1qip n ASP 120 Ca -0.13 1.16 -0.40 0.00 0.71 0.00 0.00 54.79 56.13 1qip n ASP 120 Cb 0.60 -1.37 -0.05 0.00 -0.02 0.00 0.00 41.12 40.28 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 -0.74 4.34 0.59 -0.24 0.04 -1.26 -5.09 135.00 132.65 1qip s PRO 121 Ca 0.66 0.79 -0.09 0.00 0.04 0.00 0.00 61.00 62.40 1qip s PRO 121 Cb -0.69 -3.51 -0.03 0.00 0.04 0.00 0.00 34.50 30.31 1qip s PRO 121 CO 0.53 -0.08 0.97 1.03 0.04 0.00 0.00 177.00 179.48 1qip s ARG 122 N 1.35 3.42 0.00 4.56 0.52 -1.17 -4.73 118.95 122.89 1qip s ARG 122 Ca 0.34 0.50 0.00 0.00 -0.52 0.00 0.00 55.73 56.05 1qip s ARG 122 Cb -0.17 -2.16 0.00 0.00 0.52 0.00 0.00 34.95 33.14 1qip s ARG 122 CO 0.14 -0.56 0.00 0.41 0.02 0.00 0.00 175.30 175.31 1qip n GLY 123 N -2.65 -0.96 3.57 -3.53 0.00 -1.07 -5.04 105.19 95.51 1qip n GLY 123 Ca 0.05 0.63 -0.42 0.00 0.00 0.00 0.00 46.02 46.28 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 0.81 -0.02 1.61 7.35 -1.26 -4.95 117.46 121.00 1qip n PHE 124 Ca 0.00 0.60 -0.06 0.00 -0.76 0.00 0.00 57.45 57.23 1qip n PHE 124 Cb 0.00 -2.18 -0.02 0.00 0.35 0.00 0.00 39.48 37.64 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 1.33 -0.22 3.64 7.13 0.00 -1.26 -4.23 105.19 111.58 1qip n GLY 125 Ca 0.10 -0.11 -0.04 0.00 0.00 0.00 0.00 46.02 45.97 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 -2.31 -0.19 0.47 1.61 -3.43 -1.26 -4.32 115.29 105.86 1qip s HIS 126 Ca -0.12 -0.01 0.08 0.00 -0.80 0.00 0.00 55.06 54.21 1qip s HIS 126 Cb 0.03 0.58 0.02 0.00 -1.43 0.00 0.00 32.58 31.78 1qip s HIS 126 CO 0.17 -0.60 0.54 0.96 -2.00 0.00 0.00 174.74 173.82 1qip s ILE 127 N -3.03 2.53 -0.14 -5.38 -4.36 -0.83 -4.98 121.20 105.01 1qip s ILE 127 Ca 0.10 -1.17 -0.12 0.00 -0.26 0.00 0.00 60.65 59.20 1qip s ILE 127 Cb -0.00 -2.69 0.04 0.00 1.25 0.00 0.00 42.46 41.05 1qip s ILE 127 CO -0.03 0.00 0.36 -0.83 0.24 0.00 0.00 174.94 174.68 1qip s GLY 128 N -4.35 -0.27 -0.16 6.27 0.00 -1.26 -0.73 107.32 106.83 1qip s GLY 128 Ca 0.52 1.06 -0.01 0.00 0.00 0.00 0.00 44.72 46.29 1qip s GLY 128 CO 0.31 0.96 -0.11 -0.42 0.00 0.00 0.00 173.10 173.84 1qip s ILE 129 N 0.33 3.04 -0.06 0.90 -1.09 0.37 -4.91 121.20 119.78 1qip s ILE 129 Ca -0.01 -0.64 -0.23 0.00 -2.23 0.00 0.00 60.65 57.54 1qip s ILE 129 Cb -0.03 -2.31 -0.04 0.00 -1.58 0.00 0.00 42.46 38.50 1qip s ILE 129 CO -0.01 0.50 0.67 0.00 -1.23 0.00 0.00 174.94 174.87 1qip s ALA 130 N 0.75 3.36 0.22 9.38 0.00 -1.26 -1.89 121.76 132.32 1qip s ALA 130 Ca -0.05 0.10 0.05 0.00 0.00 0.00 0.00 51.96 52.07 1qip s ALA 130 Cb -0.15 -2.91 -0.05 0.00 0.00 0.00 0.00 23.12 20.01 1qip s ALA 130 CO 0.01 -0.06 -0.07 0.14 0.00 0.00 0.00 175.76 175.78 1qip s VAL 131 N 0.66 1.37 0.28 0.00 -7.23 -0.01 -4.94 120.40 110.53 1qip s VAL 131 Ca 0.36 -2.10 0.10 0.00 -1.81 0.00 0.00 61.98 58.53 1qip s VAL 131 Cb -0.18 -2.18 -0.02 0.00 0.56 0.00 0.00 36.38 34.56 1qip s VAL 131 CO 0.17 -0.48 1.63 -0.65 -0.31 0.00 0.00 175.10 175.46 1qip h PRO 132 N 2.52 0.02 -1.95 4.82 0.11 -1.98 -3.38 132.00 132.16 1qip h PRO 132 Ca -0.38 -0.01 -0.18 0.00 0.11 0.00 0.00 66.00 65.53 1qip h PRO 132 Cb 1.22 0.00 -0.30 0.00 0.11 0.00 0.00 31.00 32.03 1qip h PRO 132 CO 0.64 0.61 -0.51 0.34 -0.21 0.00 0.00 178.00 178.87 1qip s ASP 133 N -6.86 0.45 0.21 -2.05 -1.08 -1.26 -4.98 116.67 101.09 1qip s ASP 133 Ca -0.02 0.06 -0.06 0.00 -0.52 0.00 0.00 52.55 52.02 1qip s ASP 133 Cb 0.13 1.01 0.16 0.00 -1.46 0.00 0.00 42.92 42.75 1qip s ASP 133 CO 0.76 -0.31 1.64 0.58 0.52 0.00 0.00 175.17 178.36 1qip h VAL 134 N 6.20 1.27 -0.15 1.11 2.07 -1.87 -1.82 116.25 123.04 1qip h VAL 134 Ca -0.18 -1.25 -0.04 0.00 0.82 0.00 0.00 66.70 66.05 1qip h VAL 134 Cb 1.15 1.05 -0.00 0.00 -1.52 0.00 0.00 31.29 31.97 1qip h VAL 134 CO 0.28 0.43 -0.05 1.88 0.02 0.00 0.00 177.57 180.13 1qip h TYR 135 N 0.78 0.34 -0.42 1.57 0.05 -1.95 -0.75 116.97 116.59 1qip h TYR 135 Ca 0.12 -0.08 -0.11 0.00 0.05 0.00 0.00 58.73 58.72 1qip h TYR 135 Cb 0.66 -0.08 -0.02 0.00 1.01 0.00 0.00 36.73 38.31 1qip h TYR 135 CO 0.04 0.60 -0.17 0.66 -1.05 0.00 0.00 178.16 178.23 1qip h SER 136 N -0.01 0.80 -0.52 3.88 4.64 -1.99 -1.52 113.55 118.83 1qip h SER 136 Ca 0.04 -0.27 0.02 0.00 -0.47 0.00 0.00 61.79 61.11 1qip h SER 136 Cb 0.49 -0.22 -0.03 0.00 -0.31 0.00 0.00 62.40 62.34 1qip h SER 136 CO 0.02 0.97 0.32 0.00 -0.87 0.00 0.00 176.83 177.26 1qip h ALA 137 N 1.10 0.66 0.00 5.18 0.00 -1.24 -2.17 119.26 122.80 1qip h ALA 137 Ca 0.11 -0.02 -0.13 0.00 0.00 0.00 0.00 54.91 54.87 1qip h ALA 137 Cb 0.68 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.28 1qip h ALA 137 CO 0.05 0.04 -0.63 0.00 0.00 0.00 0.00 179.25 178.71 1qip h LYS 139 N 0.00 0.89 -0.46 0.00 3.64 -1.03 -0.14 116.57 119.47 1qip h LYS 139 Ca -0.01 -0.10 -0.10 0.00 -1.27 0.00 0.00 60.65 59.18 1qip h LYS 139 Cb 1.23 -0.18 -0.01 0.00 -0.41 0.00 0.00 32.23 32.86 1qip h LYS 139 CO 0.08 0.66 -0.09 -0.09 -2.27 0.00 0.00 179.45 177.75 1qip h ARG 140 N 0.88 0.87 -0.96 1.90 2.43 -1.10 -2.20 114.38 116.20 1qip h ARG 140 Ca 0.23 -0.32 0.03 0.00 -0.81 0.00 0.00 59.98 59.10 1qip h ARG 140 Cb 0.02 -0.06 -0.05 0.00 -0.42 0.00 0.00 29.97 29.46 1qip h ARG 140 CO -0.04 0.96 0.63 0.74 -1.51 0.00 0.00 179.97 180.75 1qip h PHE 141 N 0.72 1.18 -0.41 2.20 0.04 -0.92 -0.57 116.94 119.18 1qip h PHE 141 Ca 0.12 0.03 0.00 0.00 2.80 0.00 0.00 57.97 60.92 1qip h PHE 141 Cb 0.62 -0.40 -0.02 0.00 2.20 0.00 0.00 35.95 38.36 1qip h PHE 141 CO 0.05 0.70 0.26 0.93 -0.60 0.00 0.00 178.31 179.65 1qip h GLU 142 N 1.24 0.56 -0.51 1.51 5.08 -0.78 -1.46 114.58 120.21 1qip h GLU 142 Ca 0.37 -0.04 0.02 0.00 -1.00 0.00 0.00 59.36 58.71 1qip h GLU 142 Cb -0.05 -0.12 -0.03 0.00 0.50 0.00 0.00 28.75 29.06 1qip h GLU 142 CO -0.11 0.39 0.34 0.93 -1.00 0.00 0.00 179.01 179.57 1qip h GLU 143 N 0.55 0.61 -0.03 2.33 5.08 -0.72 -1.62 114.58 120.79 1qip h GLU 143 Ca 0.15 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.47 1qip h GLU 143 Cb -0.03 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 29.08 1qip h GLU 143 CO -0.03 0.40 0.00 1.28 -1.00 0.00 0.00 179.01 179.66 1qip n LEU 144 N -4.47 1.00 0.00 1.33 4.77 -0.30 -4.94 117.00 114.39 1qip n LEU 144 Ca 0.05 -0.35 0.00 0.00 -0.03 0.00 0.00 56.01 55.68 1qip n LEU 144 Cb 0.11 -0.01 0.00 0.00 -2.33 0.00 0.00 43.42 41.18 1qip n LEU 144 CO 0.35 0.17 0.00 0.61 -1.33 0.00 0.00 177.39 177.19 1qip n GLY 145 N 1.09 0.46 3.76 -0.72 0.00 -0.61 -5.01 105.19 104.17 1qip n GLY 145 Ca 0.20 -0.77 -0.41 0.00 0.00 0.00 0.00 46.02 45.04 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 -2.00 2.69 0.07 1.61 1.01 -0.61 -4.99 120.40 118.18 1qip s VAL 146 Ca 0.00 0.67 -0.28 0.00 0.00 0.00 0.00 61.98 62.36 1qip s VAL 146 Cb 0.00 -3.43 -0.05 0.00 0.00 0.00 0.00 36.38 32.90 1qip s VAL 146 CO 0.00 0.15 0.91 -0.75 0.00 0.00 0.00 175.10 175.41 1qip s LYS 147 N -1.52 4.62 0.03 2.72 2.47 -1.26 -4.73 119.74 122.07 1qip s LYS 147 Ca 0.51 1.33 0.03 0.00 -1.56 0.00 0.00 55.97 56.28 1qip s LYS 147 Cb -0.40 -3.39 -0.04 0.00 -1.46 0.00 0.00 37.83 32.54 1qip s LYS 147 CO 0.51 0.18 0.01 -0.06 0.16 0.00 0.00 175.35 176.15 1qip s PHE 148 N 0.19 3.06 -0.22 4.03 0.40 -1.26 -1.46 117.98 122.72 1qip s PHE 148 Ca 0.45 0.05 0.01 0.00 -0.60 0.00 0.00 56.93 56.85 1qip s PHE 148 Cb -0.22 -1.63 -0.20 0.00 0.51 0.00 0.00 43.02 41.48 1qip s PHE 148 CO 0.27 0.47 -0.04 0.28 0.70 0.00 0.00 175.22 176.90 1qip n VAL 149 N 1.06 1.56 -3.63 -0.44 0.31 0.31 -4.93 118.33 112.56 1qip n VAL 149 Ca -0.13 -0.62 -0.12 0.00 -0.01 0.00 0.00 64.34 63.46 1qip n VAL 149 Cb 0.52 -1.41 -0.12 0.00 -0.91 0.00 0.00 33.84 31.92 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 -2.53 0.21 0.57 5.55 2.20 -0.25 -4.91 119.74 120.58 1qip s LYS 150 Ca -0.29 0.78 -0.12 0.00 -0.36 0.00 0.00 55.97 55.98 1qip s LYS 150 Cb 0.08 -0.03 -0.05 0.00 -1.51 0.00 0.00 37.83 36.32 1qip s LYS 150 CO 0.66 -0.32 0.98 0.15 -0.36 0.00 0.00 175.35 176.46 1qip s LYS 151 N 2.48 3.70 0.41 4.03 1.02 -1.26 -0.90 119.74 129.21 1qip s LYS 151 Ca 0.02 0.74 0.13 0.00 0.02 0.00 0.00 55.97 56.87 1qip s LYS 151 Cb -0.12 -2.14 0.85 0.00 -0.52 0.00 0.00 37.83 35.89 1qip s LYS 151 CO -0.10 -0.43 1.91 -1.00 -0.92 0.00 0.00 175.35 174.81 1qip h PRO 152 N 0.15 0.04 -0.01 -1.68 0.13 -1.93 -1.93 132.00 126.77 1qip h PRO 152 Ca -0.45 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 1qip h PRO 152 Cb 1.19 -0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 1qip h PRO 152 CO 0.62 0.29 -0.05 -0.25 -0.23 0.00 0.00 178.00 178.39 1qip n ASP 153 N -4.22 0.76 -4.89 1.44 8.00 -1.26 -1.07 116.55 115.31 1qip n ASP 153 Ca -0.02 -1.06 -0.28 0.00 0.71 0.00 0.00 54.79 54.14 1qip n ASP 153 Cb 0.32 -0.01 -0.04 0.00 -0.02 0.00 0.00 41.12 41.36 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 -2.17 6.10 0.00 -2.24 1.01 -0.73 -4.99 116.67 113.66 1qip s ASP 154 Ca 0.37 0.12 0.00 0.00 0.71 0.00 0.00 52.55 53.75 1qip s ASP 154 Cb 0.21 -1.79 0.00 0.00 1.01 0.00 0.00 42.92 42.35 1qip s ASP 154 CO 0.40 0.10 0.00 0.61 0.21 0.00 0.00 175.17 176.48 1qip n GLY 155 N -0.21 -1.12 0.23 0.21 0.00 -1.26 -4.59 105.19 98.45 1qip n GLY 155 Ca -0.07 -1.61 -0.13 0.00 0.00 0.00 0.00 46.02 44.20 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 0.80 -5.75 1.61 3.64 -1.95 -3.40 116.57 111.53 1qip h LYS 156 Ca 0.00 -0.43 -0.61 0.00 -1.27 0.00 0.00 60.65 58.33 1qip h LYS 156 Cb 0.00 0.02 -0.13 0.00 -0.41 0.00 0.00 32.23 31.71 1qip h LYS 156 CO 0.00 1.07 0.56 -1.64 -2.27 0.00 0.00 179.45 177.17 1qip s MET 157 N -4.33 3.26 0.52 1.90 -1.94 -1.26 -4.85 119.30 112.60 1qip s MET 157 Ca -0.12 -0.43 -0.09 0.00 -1.71 0.00 0.00 55.69 53.35 1qip s MET 157 Cb 0.10 -4.10 -0.04 0.00 2.01 0.00 0.00 34.83 32.79 1qip s MET 157 CO 0.85 -1.59 0.88 0.15 -0.01 0.00 0.00 175.02 175.31 1qip s LYS 158 N 4.00 3.62 0.00 2.03 -0.14 -1.26 -4.29 119.74 123.70 1qip s LYS 158 Ca 0.28 0.47 0.00 0.00 -1.36 0.00 0.00 55.97 55.36 1qip s LYS 158 Cb -0.14 -2.26 0.00 0.00 -1.68 0.00 0.00 37.83 33.75 1qip s LYS 158 CO 0.17 -0.31 0.00 0.41 -0.76 0.00 0.00 175.35 174.85 1qip n GLY 159 N -2.26 0.48 2.99 -3.33 0.00 -0.23 -4.81 105.19 98.03 1qip n GLY 159 Ca 0.03 -0.41 -0.17 0.00 0.00 0.00 0.00 46.02 45.47 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 1.99 0.25 0.99 2.96 -1.26 -4.55 118.68 119.05 1qip s LEU 160 Ca 0.00 -0.13 0.03 0.00 -0.22 0.00 0.00 54.13 53.81 1qip s LEU 160 Cb 0.00 -0.38 -0.05 0.00 0.50 0.00 0.00 46.19 46.26 1qip s LEU 160 CO 0.00 0.08 0.02 0.00 -1.32 0.00 0.00 176.35 175.13 1qip s ALA 161 N -0.13 1.87 -0.06 5.97 0.00 -0.71 -3.93 121.76 124.77 1qip s ALA 161 Ca 0.02 -1.82 -0.01 0.00 0.00 0.00 0.00 51.96 50.16 1qip s ALA 161 Cb -0.03 0.59 0.03 0.00 0.00 0.00 0.00 23.12 23.70 1qip s ALA 161 CO -0.00 -0.29 -0.00 -0.06 0.00 0.00 0.00 175.76 175.41 1qip s PHE 162 N -3.45 0.60 0.51 0.00 0.08 -0.08 -1.01 117.98 114.63 1qip s PHE 162 Ca 0.31 -0.13 0.05 0.00 0.12 0.00 0.00 56.93 57.28 1qip s PHE 162 Cb 0.06 -0.70 0.01 0.00 -0.57 0.00 0.00 43.02 41.82 1qip s PHE 162 CO 0.10 -0.27 0.27 0.96 -0.10 0.00 0.00 175.22 176.19 1qip s ILE 163 N 1.64 1.69 0.05 0.64 -4.36 -0.08 -0.53 121.20 120.25 1qip s ILE 163 Ca -0.00 -1.64 0.06 0.00 -0.26 0.00 0.00 60.65 58.81 1qip s ILE 163 Cb -0.13 -2.33 -0.02 0.00 1.25 0.00 0.00 42.46 41.23 1qip s ILE 163 CO -0.04 0.00 -0.17 -1.10 0.24 0.00 0.00 174.94 173.88 1qip s GLN 164 N -4.12 1.08 0.68 0.37 -0.21 -0.54 -0.55 119.66 116.37 1qip s GLN 164 Ca 0.29 -0.87 -0.05 0.00 0.02 0.00 0.00 55.36 54.75 1qip s GLN 164 Cb -0.00 -1.15 0.14 0.00 1.00 0.00 0.00 33.01 33.01 1qip s GLN 164 CO 0.17 0.28 0.92 -0.40 -2.12 0.00 0.00 175.29 174.15 1qip n ASP 165 N 1.75 0.70 0.30 5.90 5.75 -0.61 -4.44 116.55 125.90 1qip n ASP 165 Ca -0.18 -1.72 0.15 0.00 -0.01 0.00 0.00 54.79 53.03 1qip n ASP 165 Cb 0.54 -0.65 0.92 0.00 -1.03 0.00 0.00 41.12 40.90 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 0.21 132.00 130.51 1qip h PRO 166 Ca -0.30 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.81 1qip h PRO 166 Cb 0.99 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.10 1qip h PRO 166 CO 0.27 0.00 -0.16 -0.25 -0.21 0.00 0.00 178.00 177.66 1qip n ASP 167 N -3.85 1.22 0.00 -2.05 8.00 -1.26 -4.93 116.55 113.68 1qip n ASP 167 Ca -0.03 -1.13 0.00 0.00 0.71 0.00 0.00 54.79 54.34 1qip n ASP 167 Cb 0.08 0.08 0.00 0.00 -0.02 0.00 0.00 41.12 41.26 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 0.06 -4.77 105.19 106.69 1qip n GLY 168 Ca 0.15 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.76 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 -2.46 3.17 0.26 1.61 2.02 -1.26 -4.69 117.35 116.00 1qip s TYR 169 Ca 0.00 1.42 -0.29 0.00 -0.37 0.00 0.00 57.07 57.83 1qip s TYR 169 Cb 0.00 -3.61 -0.09 0.00 -0.40 0.00 0.00 41.96 37.86 1qip s TYR 169 CO 0.00 -1.67 0.96 -1.58 -1.57 0.00 0.00 175.55 171.69 1qip s TRP 170 N -0.89 3.88 -0.16 2.71 0.52 -1.26 -1.57 118.94 122.17 1qip s TRP 170 Ca 0.50 1.87 -0.02 0.00 0.02 0.00 0.00 56.10 58.46 1qip s TRP 170 Cb -0.38 -3.00 0.05 0.00 -1.15 0.00 0.00 33.47 28.99 1qip s TRP 170 CO 0.48 0.29 0.01 0.42 0.02 0.00 0.00 176.95 178.18 1qip s ILE 171 N -1.27 0.55 0.38 2.03 1.01 0.29 -1.96 121.20 122.23 1qip s ILE 171 Ca 0.43 -0.37 -0.25 0.00 0.00 0.00 0.00 60.65 60.46 1qip s ILE 171 Cb -0.25 -0.92 -0.09 0.00 0.01 0.00 0.00 42.46 41.21 1qip s ILE 171 CO 0.31 -0.03 1.10 -0.70 0.00 0.00 0.00 174.94 175.62 1qip s GLU 172 N 1.86 4.21 -0.27 2.79 2.12 0.10 -0.90 118.70 128.60 1qip s GLU 172 Ca 0.01 1.68 0.01 0.00 0.36 0.00 0.00 54.97 57.03 1qip s GLU 172 Cb -0.15 -2.71 0.08 0.00 0.26 0.00 0.00 34.13 31.61 1qip s GLU 172 CO -0.07 -0.14 0.01 0.42 -0.54 0.00 0.00 175.26 174.94 1qip s ILE 173 N -1.48 1.54 0.10 -3.70 -1.09 -0.18 -0.48 121.20 115.90 1qip s ILE 173 Ca 0.55 -1.51 0.05 0.00 -2.23 0.00 0.00 60.65 57.51 1qip s ILE 173 Cb -0.27 -1.96 -0.03 0.00 -1.58 0.00 0.00 42.46 38.62 1qip s ILE 173 CO 0.34 -0.35 -0.13 -1.48 -1.23 0.00 0.00 174.94 172.09 1qip s LEU 174 N 1.34 2.36 -0.37 2.97 2.34 -0.79 -1.74 118.68 124.78 1qip s LEU 174 Ca 0.02 -0.74 -0.05 0.00 0.06 0.00 0.00 54.13 53.42 1qip s LEU 174 Cb -0.18 -0.46 0.07 0.00 -0.56 0.00 0.00 46.19 45.05 1qip s LEU 174 CO -0.11 -0.15 0.15 0.21 -1.06 0.00 0.00 176.35 175.39 1qip s ASN 175 N -2.17 5.29 0.55 1.48 3.84 -1.26 -0.83 114.94 121.83 1qip s ASN 175 Ca 0.04 -1.49 0.23 0.00 0.21 0.00 0.00 52.86 51.84 1qip s ASN 175 Cb -0.06 -1.85 1.46 0.00 -0.55 0.00 0.00 41.25 40.25 1qip s ASN 175 CO 0.02 -0.42 2.12 -0.65 -2.79 0.00 0.00 177.10 175.38 1qip h PRO 176 N 8.17 0.00 0.00 0.43 0.11 -1.97 -1.41 132.00 137.34 1qip h PRO 176 Ca -0.20 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.91 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 0.65 0.00 0.00 0.09 -0.21 0.00 0.00 178.00 178.53 1qip n ASN 177 N -4.24 0.00 0.00 -2.05 3.02 -1.26 -3.15 115.26 107.57 1qip n ASN 177 Ca 0.01 -0.15 0.00 0.00 -0.03 0.00 0.00 54.58 54.41 1qip n ASN 177 Cb 0.25 -0.26 0.00 0.00 -0.61 0.00 0.00 39.78 39.16 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 -1.26 -0.76 0.13 3.52 5.02 -0.55 -4.75 118.16 119.51 1qip n LYS 178 Ca 0.13 -0.48 0.01 0.00 -2.02 0.00 0.00 58.31 55.95 1qip n LYS 178 Cb 0.20 -0.94 0.31 0.00 -0.02 0.00 0.00 35.03 34.57 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 0.15 -0.04 1.97 2.86 -1.44 -2.86 114.93 115.57 1qip h MET 179 Ca 0.00 -0.06 -0.07 0.00 -2.06 0.00 0.00 59.70 57.52 1qip h MET 179 Cb 0.07 -0.01 -0.01 0.00 0.06 0.00 0.00 31.60 31.72 1qip h MET 179 CO 0.00 0.47 -0.29 0.00 1.06 0.00 0.00 176.91 178.15 1qip h ALA 180 N 1.53 1.45 0.00 6.32 0.00 -1.86 -2.50 119.26 124.21 1qip h ALA 180 Ca 0.02 -0.28 -0.12 0.00 0.00 0.00 0.00 54.91 54.52 1qip h ALA 180 Cb 0.66 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.37 1qip h ALA 180 CO 0.05 0.40 -0.64 1.79 0.00 0.00 0.00 179.25 180.85 1qip h THR 181 N 0.06 0.88 -4.08 0.00 1.35 -1.85 -3.47 112.91 105.79 1qip h THR 181 Ca 0.01 -2.27 -0.54 0.00 -0.55 0.00 0.00 66.41 63.06 1qip h THR 181 Cb 0.55 2.41 0.19 0.00 -1.73 0.00 0.00 68.15 69.56 1qip h THR 181 CO 0.04 0.50 0.20 0.18 -0.25 0.00 0.00 175.52 176.19 1qip n LEU 182 N -3.19 3.71 0.00 3.87 4.32 -0.94 -5.15 117.00 119.61 1qip n LEU 182 Ca 0.01 0.55 0.00 0.00 -0.02 0.00 0.00 56.01 56.54 1qip n LEU 182 Cb 0.76 -1.46 0.00 0.00 -1.62 0.00 0.00 43.42 41.10 1qip n LEU 182 CO 0.41 -1.99 0.00 1.15 -1.22 0.00 0.00 177.39 175.74