#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1oft s ALA 44 N 0.00 3.92 -1.50 0.55 0.00 -1.26 -4.27 121.76 119.20 1oft s ALA 44 Ca 0.00 -0.88 0.00 0.00 0.00 0.00 0.00 51.96 51.08 1oft s ALA 44 Cb 0.00 -1.89 0.00 0.00 0.00 0.00 0.00 23.12 21.23 1oft s ALA 44 CO 0.00 0.58 0.00 0.00 0.00 0.00 0.00 175.76 176.34 1oft n ALA 45 N -0.34 -0.21 -2.70 0.00 0.00 -1.26 -4.56 120.51 111.43 1oft n ALA 45 Ca -0.05 0.23 -0.18 0.00 0.00 0.00 0.00 53.44 53.43 1oft n ALA 45 Cb 0.53 -1.78 -0.13 0.00 0.00 0.00 0.00 19.45 18.07 1oft n ALA 45 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.50 177.62 1oft s PHE 46 N -2.17 1.04 -0.07 0.00 5.36 -1.26 -0.14 117.98 120.73 1oft s PHE 46 Ca 0.00 -0.36 -0.28 0.00 -0.96 0.00 0.00 56.93 55.33 1oft s PHE 46 Cb 0.00 -0.62 0.06 0.00 -0.34 0.00 0.00 43.02 42.13 1oft s PHE 46 CO 0.00 0.01 0.64 -1.12 -1.46 0.00 0.00 175.22 173.29 1oft s SER 47 N -1.14 -0.62 -0.02 6.13 0.01 -0.78 -4.74 113.70 112.55 1oft s SER 47 Ca -0.01 0.72 0.06 0.00 1.31 0.00 0.00 55.95 58.04 1oft s SER 47 Cb -0.08 0.61 -0.01 0.00 0.21 0.00 0.00 66.02 66.75 1oft s SER 47 CO 0.01 -0.55 -0.20 -0.70 0.41 0.00 0.00 173.24 172.21 1oft s GLU 48 N -1.03 1.69 -0.13 12.44 2.12 -1.26 -1.49 118.70 131.03 1oft s GLU 48 Ca -0.10 -0.71 0.03 0.00 0.36 0.00 0.00 54.97 54.55 1oft s GLU 48 Cb -0.01 -1.59 0.01 0.00 0.26 0.00 0.00 34.13 32.79 1oft s GLU 48 CO 0.08 0.40 -0.22 -1.17 -0.54 0.00 0.00 175.26 173.81 1oft s LEU 49 N -0.38 2.11 -0.12 2.70 0.20 0.08 -4.96 118.68 118.31 1oft s LEU 49 Ca 0.05 -0.59 0.02 0.00 0.69 0.00 0.00 54.13 54.30 1oft s LEU 49 Cb -0.09 -1.44 -0.00 0.00 -0.43 0.00 0.00 46.19 44.23 1oft s LEU 49 CO -0.00 0.10 -0.19 -0.44 -0.29 0.00 0.00 176.35 175.54 1oft s SER 50 N 0.68 3.50 -0.17 3.68 0.01 -1.26 -0.78 113.70 119.36 1oft s SER 50 Ca -0.10 -0.47 0.01 0.00 1.31 0.00 0.00 55.95 56.70 1oft s SER 50 Cb -0.16 -1.51 0.02 0.00 0.21 0.00 0.00 66.02 64.58 1oft s SER 50 CO 0.01 0.14 -0.18 -0.76 0.41 0.00 0.00 173.24 172.86 1oft s LEU 51 N 0.45 1.99 0.00 2.44 1.43 -0.83 -4.98 118.68 119.19 1oft s LEU 51 Ca -0.13 -0.60 0.07 0.00 -1.03 0.00 0.00 54.13 52.43 1oft s LEU 51 Cb -0.17 -1.39 -0.02 0.00 0.03 0.00 0.00 46.19 44.65 1oft s LEU 51 CO 0.06 -0.02 -0.20 -0.94 0.23 0.00 0.00 176.35 175.48 1oft s SER 52 N 1.35 2.39 0.00 2.29 1.04 -1.26 -1.77 113.70 117.74 1oft s SER 52 Ca 0.05 -0.41 0.00 0.00 0.48 0.00 0.00 55.95 56.07 1oft s SER 52 Cb -0.13 -0.24 0.00 0.00 0.10 0.00 0.00 66.02 65.75 1oft s SER 52 CO -0.12 0.22 0.00 0.61 0.98 0.00 0.00 173.24 174.93 1oft n GLY 53 N 2.35 0.95 3.63 7.32 0.00 -1.26 -4.93 105.19 113.24 1oft n GLY 53 Ca -0.16 -1.94 -0.58 0.00 0.00 0.00 0.00 46.02 43.34 1oft n GLY 53 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1oft n LEU 54 N 0.00 1.32 -0.33 0.99 7.99 -1.26 -4.75 117.00 120.97 1oft n LEU 54 Ca 0.00 1.13 0.26 0.00 -0.01 0.00 0.00 56.01 57.39 1oft n LEU 54 Cb 0.00 -1.05 0.56 0.00 -0.11 0.00 0.00 43.42 42.82 1oft n LEU 54 CO 0.00 -1.07 1.24 1.55 -1.51 0.00 0.00 177.39 177.59 1oft h PRO 55 N 4.90 0.29 0.24 3.23 0.13 -1.98 -0.49 132.00 138.32 1oft h PRO 55 Ca -0.48 -0.02 -0.01 0.00 -0.87 0.00 0.00 66.00 64.63 1oft h PRO 55 Cb 1.36 -0.07 0.00 0.00 0.13 0.00 0.00 31.00 32.43 1oft h PRO 55 CO 0.83 0.19 -0.11 0.78 -0.23 0.00 0.00 178.00 179.46 1oft h GLY 56 N 0.30 -0.33 -0.04 1.56 0.00 -2.01 -2.94 103.07 99.61 1oft h GLY 56 Ca 0.60 0.12 0.06 0.00 0.00 0.00 0.00 47.33 48.11 1oft h GLY 56 CO -0.25 -0.12 -0.36 0.45 0.00 0.00 0.00 176.54 176.26 1oft h HIS 57 N -0.57 -1.01 -0.88 5.60 3.86 -1.47 -1.17 115.15 119.52 1oft h HIS 57 Ca -0.03 0.05 0.22 0.00 -1.16 0.00 0.00 60.37 59.45 1oft h HIS 57 Cb 0.42 0.48 -0.16 0.00 1.06 0.00 0.00 27.41 29.21 1oft h HIS 57 CO 0.01 -0.42 0.03 0.00 0.86 0.00 0.00 177.93 178.41 1oft h LEU 59 N 0.07 0.78 -0.49 0.00 3.38 -1.05 -1.09 115.31 116.91 1oft h LEU 59 Ca 0.51 -0.15 0.06 0.00 0.09 0.00 0.00 57.88 58.39 1oft h LEU 59 Cb 0.97 -0.20 -0.06 0.00 0.09 0.00 0.00 40.66 41.46 1oft h LEU 59 CO -0.79 0.71 0.18 0.74 0.09 0.00 0.00 178.44 179.37 1oft h THR 60 N 0.80 0.84 0.00 0.22 2.02 0.12 -0.23 112.91 116.68 1oft h THR 60 Ca 0.20 -0.12 -0.03 0.00 0.77 0.00 0.00 66.41 67.22 1oft h THR 60 Cb 0.15 0.46 -0.00 0.00 -1.74 0.00 0.00 68.15 67.01 1oft h THR 60 CO -0.02 0.06 -0.17 -0.07 0.37 0.00 0.00 175.52 175.70 1oft h LEU 61 N 0.36 0.00 0.17 2.58 4.07 -0.30 -3.10 115.31 119.08 1oft h LEU 61 Ca 0.23 0.00 -0.24 0.00 0.08 0.00 0.00 57.88 57.96 1oft h LEU 61 Cb 0.24 0.00 0.03 0.00 1.08 0.00 0.00 40.66 42.00 1oft h LEU 61 CO -0.23 0.17 -1.03 0.25 -1.08 0.00 0.00 178.44 176.52 1oft h LEU 62 N 0.00 0.61 -0.84 1.67 6.46 0.19 -3.39 115.31 120.02 1oft h LEU 62 Ca -0.00 -0.93 0.08 0.00 -0.12 0.00 0.00 57.88 56.91 1oft h LEU 62 Cb 0.46 -0.20 -0.10 0.00 -0.73 0.00 0.00 40.66 40.09 1oft h LEU 62 CO 0.02 1.49 -0.52 0.00 -0.62 0.00 0.00 178.44 178.81 1oft h ALA 63 N 0.13 -0.52 -1.03 1.25 0.00 -1.05 0.19 119.26 118.23 1oft h ALA 63 Ca -0.18 0.10 0.26 0.00 0.00 0.00 0.00 54.91 55.09 1oft h ALA 63 Cb 1.80 1.31 -0.10 0.00 0.00 0.00 0.00 17.79 20.80 1oft h ALA 63 CO 0.19 -0.88 0.65 -1.00 0.00 0.00 0.00 179.25 178.21 1oft h PRO 64 N -0.04 0.45 -0.01 0.00 0.13 -1.75 0.19 132.00 130.98 1oft h PRO 64 Ca 0.13 -0.03 -0.00 0.00 -0.87 0.00 0.00 66.00 65.23 1oft h PRO 64 Cb 0.38 -0.10 -0.00 0.00 0.13 0.00 0.00 31.00 31.41 1oft h PRO 64 CO -0.81 0.30 -0.01 0.82 -0.23 0.00 0.00 178.00 178.07 1oft h ILE 65 N 0.46 1.35 -0.64 -3.56 2.04 -0.85 0.12 117.51 116.43 1oft h ILE 65 Ca 0.61 -1.05 0.01 0.00 1.00 0.00 0.00 64.86 65.43 1oft h ILE 65 Cb 1.41 2.04 -0.03 0.00 -0.74 0.00 0.00 36.82 39.49 1oft h ILE 65 CO -0.36 0.28 0.42 -0.07 0.00 0.00 0.00 178.15 178.42 1oft h LEU 66 N -0.41 0.74 -0.50 1.44 3.38 -0.47 0.24 115.31 119.73 1oft h LEU 66 Ca 0.00 -0.02 0.02 0.00 0.09 0.00 0.00 57.88 57.97 1oft h LEU 66 Cb 0.45 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 40.98 1oft h LEU 66 CO 0.00 0.54 0.30 -0.09 0.09 0.00 0.00 178.44 179.28 1oft h ARG 67 N 0.87 0.57 -0.40 1.13 2.43 -0.60 0.15 114.38 118.53 1oft h ARG 67 Ca 0.23 -0.03 -0.03 0.00 -0.81 0.00 0.00 59.98 59.34 1oft h ARG 67 Cb -0.09 -0.13 -0.02 0.00 -0.42 0.00 0.00 29.97 29.31 1oft h ARG 67 CO -0.05 0.38 0.13 1.49 -1.51 0.00 0.00 179.97 180.41 1oft h GLU 68 N 0.59 0.62 -0.04 0.20 4.57 -0.25 -1.21 114.58 119.06 1oft h GLU 68 Ca 0.20 -0.13 -0.00 0.00 -1.18 0.00 0.00 59.36 58.25 1oft h GLU 68 Cb 0.03 -0.09 -0.00 0.00 -0.16 0.00 0.00 28.75 28.53 1oft h GLU 68 CO -0.10 0.62 0.02 -0.07 -1.18 0.00 0.00 179.01 178.30 1oft h LEU 69 N 0.50 0.04 0.14 1.64 3.38 -0.13 -3.22 115.31 117.66 1oft h LEU 69 Ca 0.13 -0.08 0.00 0.00 0.09 0.00 0.00 57.88 58.03 1oft h LEU 69 Cb 0.25 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 40.98 1oft h LEU 69 CO -0.00 0.11 -0.12 0.77 0.09 0.00 0.00 178.44 179.28 1oft h SER 70 N -0.02 -0.31 -0.25 -0.43 4.64 -0.59 -2.84 113.55 113.74 1oft h SER 70 Ca 0.01 0.03 -0.23 0.00 -0.47 0.00 0.00 61.79 61.13 1oft h SER 70 Cb 0.07 0.11 -0.08 0.00 -0.31 0.00 0.00 62.40 62.19 1oft h SER 70 CO -0.00 -0.19 -0.11 -1.84 -0.87 0.00 0.00 176.83 173.82 1oft n GLU 71 N -5.24 1.90 -3.33 4.77 0.28 -0.47 -4.91 120.64 113.65 1oft n GLU 71 Ca -0.08 -1.15 -0.22 0.00 -0.16 0.00 0.00 57.16 55.55 1oft n GLU 71 Cb 0.16 -1.84 -0.00 0.00 1.43 0.00 0.00 31.44 31.19 1oft n GLU 71 CO 0.00 0.00 0.00 -2.00 -0.16 0.00 0.00 177.13 174.97 1oft s GLU 72 N 0.09 3.29 0.46 3.44 2.12 -1.08 -4.97 118.70 122.05 1oft s GLU 72 Ca 0.52 -0.53 0.24 0.00 0.36 0.00 0.00 54.97 55.55 1oft s GLU 72 Cb 0.27 -2.68 1.13 0.00 0.26 0.00 0.00 34.13 33.12 1oft s GLU 72 CO -0.05 0.03 1.94 0.37 -0.54 0.00 0.00 175.26 177.01 1oft h GLN 73 N 0.70 0.00 -6.23 4.30 5.75 -1.90 -3.42 115.11 114.30 1oft h GLN 73 Ca -0.48 0.00 -0.57 0.00 -0.15 0.00 0.00 58.65 57.45 1oft h GLN 73 Cb 1.24 0.00 -0.05 0.00 1.07 0.00 0.00 27.48 29.73 1oft h GLN 73 CO 0.59 0.21 0.88 0.34 -2.65 0.00 0.00 178.83 178.20 1oft s ASP 74 N -6.31 6.90 0.00 -0.69 -1.08 -1.26 -4.91 116.67 109.33 1oft s ASP 74 Ca -0.02 1.31 0.00 0.00 -0.52 0.00 0.00 52.55 53.32 1oft s ASP 74 Cb 0.12 -2.54 0.00 0.00 -1.46 0.00 0.00 42.92 39.04 1oft s ASP 74 CO 0.63 -0.86 0.00 0.00 0.52 0.00 0.00 175.17 175.46 1oft n ALA 75 N 6.89 1.29 -2.02 3.66 0.00 -1.26 -4.77 120.51 124.29 1oft n ALA 75 Ca 0.13 0.00 -0.20 0.00 0.00 0.00 0.00 53.44 53.37 1oft n ALA 75 Cb 0.46 -0.89 0.07 0.00 0.00 0.00 0.00 19.45 19.09 1oft n ALA 75 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1oft s ARG 76 N -1.70 2.22 0.84 0.00 0.52 -1.26 -5.08 118.95 114.49 1oft s ARG 76 Ca 0.00 -1.44 -0.12 0.00 -0.52 0.00 0.00 55.73 53.65 1oft s ARG 76 Cb 0.00 -2.58 0.10 0.00 0.52 0.00 0.00 34.95 32.99 1oft s ARG 76 CO 0.00 -0.93 1.11 -1.58 0.02 0.00 0.00 175.30 173.92 1oft s TRP 77 N -2.75 2.70 -0.32 -0.53 0.52 -0.62 -4.53 118.94 113.42 1oft s TRP 77 Ca 0.62 1.02 0.03 0.00 0.02 0.00 0.00 56.10 57.79 1oft s TRP 77 Cb -0.06 -3.24 0.09 0.00 -1.15 0.00 0.00 33.47 29.11 1oft s TRP 77 CO 0.40 -2.01 0.03 -1.17 0.02 0.00 0.00 176.95 174.22 1oft s LEU 78 N -5.88 4.22 -0.14 2.99 2.96 -0.76 -0.63 118.68 121.44 1oft s LEU 78 Ca 0.62 -1.97 -0.08 0.00 -0.22 0.00 0.00 54.13 52.47 1oft s LEU 78 Cb -0.14 -1.51 -0.04 0.00 0.50 0.00 0.00 46.19 44.99 1oft s LEU 78 CO 0.54 -0.36 0.16 0.42 -1.32 0.00 0.00 176.35 175.79 1oft s THR 79 N 1.03 5.45 -0.16 3.68 -4.23 -0.82 -2.28 115.64 118.31 1oft s THR 79 Ca 0.08 0.25 -0.05 0.00 -1.18 0.00 0.00 61.69 60.79 1oft s THR 79 Cb -0.19 -3.44 -0.03 0.00 1.34 0.00 0.00 72.50 70.17 1oft s THR 79 CO -0.10 0.56 0.02 -0.76 -0.54 0.00 0.00 174.62 173.80 1oft s LEU 80 N -0.61 3.59 -0.22 4.79 1.43 -0.09 -1.04 118.68 126.53 1oft s LEU 80 Ca 0.14 0.02 0.01 0.00 -1.03 0.00 0.00 54.13 53.27 1oft s LEU 80 Cb -0.12 -1.88 0.03 0.00 0.03 0.00 0.00 46.19 44.25 1oft s LEU 80 CO 0.03 0.20 -0.14 -0.63 0.23 0.00 0.00 176.35 176.04 1oft s ILE 81 N 0.19 2.26 -1.15 -0.59 1.01 -0.32 -1.73 121.20 120.88 1oft s ILE 81 Ca 0.02 -1.18 -0.01 0.00 0.00 0.00 0.00 60.65 59.48 1oft s ILE 81 Cb -0.13 -2.11 0.00 0.00 0.01 0.00 0.00 42.46 40.23 1oft s ILE 81 CO 0.01 0.29 0.96 0.00 0.00 0.00 0.00 174.94 176.21 1oft n ALA 82 N 4.57 -1.85 -1.71 9.38 0.00 -0.58 -4.06 120.51 126.26 1oft n ALA 82 Ca -0.18 -0.02 -0.34 0.00 0.00 0.00 0.00 53.44 52.90 1oft n ALA 82 Cb 0.47 -2.57 0.01 0.00 0.00 0.00 0.00 19.45 17.36 1oft n ALA 82 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1oft s PRO 83 N -5.37 3.31 0.91 0.00 0.04 -1.26 -4.64 135.00 127.99 1oft s PRO 83 Ca 0.05 1.47 -0.10 0.00 0.04 0.00 0.00 61.00 62.46 1oft s PRO 83 Cb -0.02 -2.01 0.14 0.00 0.04 0.00 0.00 34.50 32.65 1oft s PRO 83 CO 0.69 -0.86 1.14 -1.25 0.04 0.00 0.00 177.00 176.77 1oft s PRO 84 N -3.54 1.05 0.32 0.56 0.04 -1.26 -4.88 135.00 127.29 1oft s PRO 84 Ca 0.69 1.52 0.09 0.00 0.04 0.00 0.00 61.00 63.35 1oft s PRO 84 Cb -0.21 -1.73 0.87 0.00 0.04 0.00 0.00 34.50 33.47 1oft s PRO 84 CO 0.30 -2.60 1.75 0.00 0.04 0.00 0.00 177.00 176.49 1oft h ALA 85 N -1.85 1.81 -0.98 8.56 0.00 -2.04 -2.25 119.26 122.51 1oft h ALA 85 Ca -0.43 0.11 0.18 0.00 0.00 0.00 0.00 54.91 54.76 1oft h ALA 85 Cb 1.27 -0.01 -0.18 0.00 0.00 0.00 0.00 17.79 18.87 1oft h ALA 85 CO 0.42 -0.25 -0.29 0.43 0.00 0.00 0.00 179.25 179.56 1oft n SER 86 N -4.83 -0.45 -3.83 0.00 7.64 -1.26 -3.35 113.62 107.54 1oft n SER 86 Ca 0.26 1.69 -0.37 0.00 1.01 0.00 0.00 58.87 61.45 1oft n SER 86 Cb 0.71 -0.47 -0.10 0.00 -1.01 0.00 0.00 64.21 63.34 1oft n SER 86 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 1oft n LEU 87 N -5.54 1.82 -4.73 -3.43 4.32 -0.85 -4.80 117.00 103.79 1oft n LEU 87 Ca 0.14 -2.10 -0.31 0.00 -0.02 0.00 0.00 56.01 53.72 1oft n LEU 87 Cb 0.45 -0.97 0.12 0.00 -1.62 0.00 0.00 43.42 41.40 1oft n LEU 87 CO -0.12 -2.03 0.68 -0.89 -1.22 0.00 0.00 177.39 173.81 1oft s THR 88 N 9.12 2.92 0.33 -5.08 2.01 -1.21 -4.84 115.64 118.90 1oft s THR 88 Ca 0.69 0.30 0.02 0.00 0.31 0.00 0.00 61.69 63.02 1oft s THR 88 Cb 0.10 -2.69 0.28 0.00 0.01 0.00 0.00 72.50 70.19 1oft s THR 88 CO 0.26 -0.39 1.96 -0.74 -0.69 0.00 0.00 174.62 175.02 1oft h HIS 89 N -1.40 0.88 -0.09 4.92 2.76 -1.92 -2.11 115.15 118.19 1oft h HIS 89 Ca -0.45 0.02 -0.07 0.00 -2.20 0.00 0.00 60.37 57.67 1oft h HIS 89 Cb 1.25 -0.29 0.00 0.00 1.55 0.00 0.00 27.41 29.92 1oft h HIS 89 CO 0.52 0.50 -0.23 1.49 -1.30 0.00 0.00 177.93 178.92 1oft h GLU 90 N 0.91 0.31 -0.81 5.26 4.81 -1.96 -3.21 114.58 119.89 1oft h GLU 90 Ca 0.31 -0.22 0.18 0.00 -0.13 0.00 0.00 59.36 59.50 1oft h GLU 90 Cb 0.09 0.03 -0.11 0.00 0.63 0.00 0.00 28.75 29.39 1oft h GLU 90 CO -0.09 0.83 0.30 2.35 -0.73 0.00 0.00 179.01 181.67 1oft h TRP 91 N -0.16 0.50 0.21 0.92 7.01 -1.71 0.27 115.95 122.99 1oft h TRP 91 Ca -0.00 0.04 -0.01 0.00 2.11 0.00 0.00 58.89 61.03 1oft h TRP 91 Cb 0.84 -0.10 0.00 0.00 -2.10 0.00 0.00 29.16 27.80 1oft h TRP 91 CO 0.12 -0.02 -0.10 -0.07 -2.79 0.00 0.00 178.44 175.58 1oft h LEU 92 N 0.38 -0.24 -0.92 0.65 4.07 -1.46 0.47 115.31 118.25 1oft h LEU 92 Ca 0.47 -0.04 -0.11 0.00 0.08 0.00 0.00 57.88 58.28 1oft h LEU 92 Cb 0.81 0.06 -0.01 0.00 1.08 0.00 0.00 40.66 42.60 1oft h LEU 92 CO -0.48 -0.12 -0.47 0.08 -1.08 0.00 0.00 178.44 176.37 1oft h ARG 93 N -0.35 0.17 -0.30 1.13 0.11 -1.37 -2.24 114.38 111.53 1oft h ARG 93 Ca -0.03 -0.09 -0.12 0.00 0.10 0.00 0.00 59.98 59.84 1oft h ARG 93 Cb 0.27 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.34 1oft h ARG 93 CO 0.05 0.60 -0.31 0.00 0.10 0.00 0.00 179.97 180.41 1oft h ARG 94 N 0.14 0.64 0.00 0.08 3.08 -0.28 0.39 114.38 118.43 1oft h ARG 94 Ca 0.01 -0.28 0.00 0.00 0.07 0.00 0.00 59.98 59.77 1oft h ARG 94 Cb 0.88 -0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.91 1oft h ARG 94 CO 0.07 0.87 0.00 0.00 -1.07 0.00 0.00 179.97 179.84 1oft n ALA 95 N -2.50 2.22 -3.97 0.04 0.00 0.16 -4.85 120.51 111.61 1oft n ALA 95 Ca -0.01 -0.07 -0.28 0.00 0.00 0.00 0.00 53.44 53.08 1oft n ALA 95 Cb 0.47 -1.18 -0.02 0.00 0.00 0.00 0.00 19.45 18.71 1oft n ALA 95 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1oft n GLY 96 N 0.24 -0.36 3.88 0.00 0.00 0.14 -4.90 105.19 104.19 1oft n GLY 96 Ca 0.08 0.21 -0.37 0.00 0.00 0.00 0.00 46.02 45.95 1oft n GLY 96 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 1oft s LEU 97 N -6.99 4.39 -0.21 0.99 2.34 -0.94 -4.97 118.68 113.28 1oft s LEU 97 Ca 0.10 0.45 -0.18 0.00 0.06 0.00 0.00 54.13 54.56 1oft s LEU 97 Cb -0.04 -2.14 -0.20 0.00 -0.56 0.00 0.00 46.19 43.24 1oft s LEU 97 CO 0.91 0.39 1.33 -3.20 -1.06 0.00 0.00 176.35 174.71 1oft n ASN 98 N 1.84 0.15 0.00 1.48 4.05 -1.26 -4.76 115.26 116.76 1oft n ASN 98 Ca -0.19 -1.83 0.00 0.00 0.45 0.00 0.00 54.58 53.02 1oft n ASN 98 Cb 0.55 -0.62 0.00 0.00 1.23 0.00 0.00 39.78 40.94 1oft n ASN 98 CO 0.00 0.00 0.00 0.54 -3.05 0.00 0.00 177.26 174.75 1oft n ARG 99 N 6.38 0.00 -1.06 1.20 1.74 -1.26 -1.08 116.66 122.58 1oft n ARG 99 Ca 0.27 0.16 -0.13 0.00 -0.77 0.00 0.00 57.85 57.38 1oft n ARG 99 Cb 0.39 -1.72 0.23 0.00 -1.02 0.00 0.00 32.46 30.35 1oft n ARG 99 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 1oft n GLU 100 N -1.09 2.76 0.00 5.56 1.02 -1.26 -3.92 120.64 123.71 1oft n GLU 100 Ca 0.00 -3.06 0.00 0.00 -0.02 0.00 0.00 57.16 54.08 1oft n GLU 100 Cb 0.22 -2.12 0.00 0.00 -0.02 0.00 0.00 31.44 29.51 1oft n GLU 100 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 1oft n ARG 101 N -0.76 0.00 -4.34 3.49 1.74 -0.24 -5.09 116.66 111.46 1oft n ARG 101 Ca 0.47 -0.16 -0.33 0.00 -0.77 0.00 0.00 57.85 57.06 1oft n ARG 101 Cb 1.44 -0.22 -0.15 0.00 -1.02 0.00 0.00 32.46 32.51 1oft n ARG 101 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1oft s ILE 102 N 0.00 2.51 0.02 0.55 1.01 -1.25 -1.83 121.20 122.22 1oft s ILE 102 Ca 0.00 -0.81 -0.01 0.00 0.00 0.00 0.00 60.65 59.84 1oft s ILE 102 Cb 0.00 -2.07 -0.04 0.00 0.01 0.00 0.00 42.46 40.36 1oft s ILE 102 CO 0.00 0.51 0.15 -0.76 0.00 0.00 0.00 174.94 174.84 1oft s LEU 103 N 1.05 4.16 -0.33 2.97 1.43 -0.97 -4.98 118.68 122.01 1oft s LEU 103 Ca -0.01 0.22 -0.02 0.00 -1.03 0.00 0.00 54.13 53.30 1oft s LEU 103 Cb -0.14 -2.58 0.12 0.00 0.03 0.00 0.00 46.19 43.62 1oft s LEU 103 CO -0.05 0.23 0.17 -0.22 0.23 0.00 0.00 176.35 176.72 1oft s LEU 104 N -2.08 0.97 0.22 1.79 0.20 -1.26 -0.91 118.68 117.61 1oft s LEU 104 Ca 0.28 -1.79 -0.11 0.00 0.69 0.00 0.00 54.13 53.21 1oft s LEU 104 Cb -0.12 -0.44 -0.07 0.00 -0.43 0.00 0.00 46.19 45.12 1oft s LEU 104 CO 0.20 -0.37 0.55 -0.76 -0.29 0.00 0.00 176.35 175.68 1oft s LEU 105 N 1.51 4.20 0.03 -0.68 1.02 -0.71 -4.99 118.68 119.06 1oft s LEU 105 Ca 0.14 0.95 0.04 0.00 0.02 0.00 0.00 54.13 55.28 1oft s LEU 105 Cb -0.20 -3.62 -0.04 0.00 0.02 0.00 0.00 46.19 42.36 1oft s LEU 105 CO -0.17 -0.04 -0.05 -1.58 0.02 0.00 0.00 176.35 174.52 1oft s GLN 106 N -2.67 2.51 0.07 1.70 2.00 -1.26 -1.52 119.66 120.48 1oft s GLN 106 Ca 0.46 -0.78 0.02 0.00 -2.00 0.00 0.00 55.36 53.06 1oft s GLN 106 Cb -0.12 -2.50 -0.03 0.00 0.80 0.00 0.00 33.01 31.16 1oft s GLN 106 CO 0.21 0.58 -0.08 0.00 -0.50 0.00 0.00 175.29 175.50 1oft s ALA 107 N -1.09 0.78 -0.22 1.58 0.00 -1.26 -4.86 121.76 116.69 1oft s ALA 107 Ca 0.19 -1.01 0.10 0.00 0.00 0.00 0.00 51.96 51.25 1oft s ALA 107 Cb -0.11 0.08 -0.22 0.00 0.00 0.00 0.00 23.12 22.87 1oft s ALA 107 CO 0.11 -0.09 -0.02 1.63 0.00 0.00 0.00 175.76 177.38 1oft n LYS 108 N 0.86 0.67 -4.51 0.00 5.02 -1.26 -4.90 118.16 114.04 1oft n LYS 108 Ca -0.18 0.08 -0.34 0.00 -2.02 0.00 0.00 58.31 55.84 1oft n LYS 108 Cb 0.57 -1.54 -0.11 0.00 -0.02 0.00 0.00 35.03 33.93 1oft n LYS 108 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 1oft s ASP 109 N -6.00 4.82 0.00 4.39 -1.08 -1.26 -4.94 116.67 112.60 1oft s ASP 109 Ca -0.21 -0.01 0.00 0.00 -0.52 0.00 0.00 52.55 51.81 1oft s ASP 109 Cb 0.07 -1.40 0.00 0.00 -1.46 0.00 0.00 42.92 40.13 1oft s ASP 109 CO 0.73 0.32 0.63 -3.20 0.52 0.00 0.00 175.17 174.17 1oft n ASN 110 N 2.55 0.00 -0.09 -0.34 2.85 -1.26 0.69 115.26 119.67 1oft n ASN 110 Ca -0.18 0.13 -0.11 0.00 -0.11 0.00 0.00 54.58 54.32 1oft n ASN 110 Cb 0.53 -0.13 -0.10 0.00 1.24 0.00 0.00 39.78 41.32 1oft n ASN 110 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1oft n ALA 111 N -1.13 1.60 -0.07 5.20 0.00 -1.26 -3.83 120.51 121.03 1oft n ALA 111 Ca 0.00 -0.91 -0.05 0.00 0.00 0.00 0.00 53.44 52.48 1oft n ALA 111 Cb 0.00 -0.01 0.16 0.00 0.00 0.00 0.00 19.45 19.60 1oft n ALA 111 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1oft h ALA 112 N 0.36 1.05 -0.58 0.00 0.00 -0.11 -1.84 119.26 118.13 1oft h ALA 112 Ca -0.42 -0.31 -0.03 0.00 0.00 0.00 0.00 54.91 54.15 1oft h ALA 112 Cb 1.80 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 19.40 1oft h ALA 112 CO -0.02 0.58 0.23 0.00 0.00 0.00 0.00 179.25 180.04 1oft h ALA 113 N 1.23 0.76 0.00 0.00 0.00 -0.34 0.14 119.26 121.04 1oft h ALA 113 Ca 0.11 -0.17 -0.03 0.00 0.00 0.00 0.00 54.91 54.83 1oft h ALA 113 Cb 0.58 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 18.13 1oft h ALA 113 CO 0.04 0.37 -0.13 1.25 0.00 0.00 0.00 179.25 180.78 1oft h LEU 114 N 0.81 0.00 0.22 0.00 6.46 -1.54 -0.22 115.31 121.04 1oft h LEU 114 Ca 0.19 0.00 -0.01 0.00 -0.12 0.00 0.00 57.88 57.94 1oft h LEU 114 Cb 0.20 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 40.14 1oft h LEU 114 CO -0.02 0.13 -0.11 0.00 -0.62 0.00 0.00 178.44 177.83 1oft h ALA 115 N 1.87 -0.30 -0.35 1.25 0.00 -0.43 -2.93 119.26 118.38 1oft h ALA 115 Ca -0.00 -0.18 0.07 0.00 0.00 0.00 0.00 54.91 54.80 1oft h ALA 115 Cb 0.33 0.12 -0.06 0.00 0.00 0.00 0.00 17.79 18.17 1oft h ALA 115 CO 0.02 -0.33 -0.04 -0.07 0.00 0.00 0.00 179.25 178.83 1oft h LEU 116 N -0.97 -0.23 -1.37 0.00 3.38 -0.83 -0.48 115.31 114.80 1oft h LEU 116 Ca -0.03 0.09 0.19 0.00 0.09 0.00 0.00 57.88 58.22 1oft h LEU 116 Cb 0.45 0.18 -0.07 0.00 0.09 0.00 0.00 40.66 41.30 1oft h LEU 116 CO 0.05 -0.07 0.60 0.28 0.09 0.00 0.00 178.44 179.38 1oft h SER 117 N 0.05 0.53 0.21 -0.43 0.02 -1.13 0.17 113.55 112.97 1oft h SER 117 Ca 0.17 0.05 -0.25 0.00 -0.84 0.00 0.00 61.79 60.92 1oft h SER 117 Cb 0.25 -0.05 0.01 0.00 0.14 0.00 0.00 62.40 62.75 1oft h SER 117 CO -0.32 0.22 -1.03 0.00 -1.14 0.00 0.00 176.83 174.55 1oft h GLU 119 N 0.28 -0.74 -0.89 0.00 5.08 -0.01 -0.31 114.58 118.00 1oft h GLU 119 Ca -0.11 0.05 0.14 0.00 -1.00 0.00 0.00 59.36 58.44 1oft h GLU 119 Cb 1.69 0.17 -0.15 0.00 0.50 0.00 0.00 28.75 30.96 1oft h GLU 119 CO 0.19 -0.43 -0.38 0.00 -1.00 0.00 0.00 179.01 177.39 1oft h ALA 120 N -0.67 0.10 0.02 3.43 0.00 -0.81 0.86 119.26 122.19 1oft h ALA 120 Ca -0.08 0.25 -0.00 0.00 0.00 0.00 0.00 54.91 55.08 1oft h ALA 120 Cb 0.65 0.95 0.00 0.00 0.00 0.00 0.00 17.79 19.39 1oft h ALA 120 CO 0.13 -0.64 -0.01 -0.07 0.00 0.00 0.00 179.25 178.66 1oft h LEU 121 N -0.04 -0.02 -0.25 0.00 3.38 -1.39 -3.21 115.31 113.77 1oft h LEU 121 Ca 0.32 -0.03 0.06 0.00 0.09 0.00 0.00 57.88 58.31 1oft h LEU 121 Cb 0.58 0.01 -0.07 0.00 0.09 0.00 0.00 40.66 41.27 1oft h LEU 121 CO -0.91 0.02 -0.28 -0.09 0.09 0.00 0.00 178.44 177.27 1oft h ARG 122 N -0.07 -0.28 -0.20 1.13 2.43 0.94 -1.36 114.38 116.97 1oft h ARG 122 Ca -0.00 0.02 0.06 0.00 -0.81 0.00 0.00 59.98 59.24 1oft h ARG 122 Cb 0.06 0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 29.66 1oft h ARG 122 CO 0.00 -0.19 0.35 -0.07 -1.51 0.00 0.00 179.97 178.56 1oft h LEU 123 N -0.29 0.00 2.47 3.80 -0.00 -1.14 -3.27 115.31 116.87 1oft h LEU 123 Ca 0.13 0.00 -0.35 0.00 -0.00 0.00 0.00 57.88 57.66 1oft h LEU 123 Cb 0.50 0.00 -0.02 0.00 -0.00 0.00 0.00 40.66 41.14 1oft h LEU 123 CO -0.41 0.00 -0.45 0.61 -0.00 0.00 0.00 178.44 178.19 1oft n GLY 124 N -1.36 -0.30 0.85 0.83 0.00 -0.51 -4.88 105.19 99.82 1oft n GLY 124 Ca 0.02 -0.15 0.08 0.00 0.00 0.00 0.00 46.02 45.98 1oft n GLY 124 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1oft n ARG 125 N -2.68 2.57 -4.69 1.61 1.74 -1.26 -4.88 116.66 109.07 1oft n ARG 125 Ca -0.21 -2.14 -0.25 0.00 -0.77 0.00 0.00 57.85 54.48 1oft n ARG 125 Cb 0.66 -1.36 -0.16 0.00 -1.02 0.00 0.00 32.46 30.57 1oft n ARG 125 CO 0.00 0.00 0.00 -1.12 -1.52 0.00 0.00 177.63 174.99 1oft s SER 126 N -1.04 1.89 0.29 0.55 0.01 -1.26 -1.59 113.70 112.56 1oft s SER 126 Ca 0.30 -0.31 0.16 0.00 1.31 0.00 0.00 55.95 57.41 1oft s SER 126 Cb 0.16 -0.63 0.19 0.00 0.21 0.00 0.00 66.02 65.96 1oft s SER 126 CO 0.22 0.10 1.50 1.12 0.41 0.00 0.00 173.24 176.59 1oft h HIS 127 N 6.48 0.00 -3.28 2.43 2.07 -1.11 -3.43 115.15 118.32 1oft h HIS 127 Ca -0.32 0.00 -0.19 0.00 -2.85 0.00 0.00 60.37 57.01 1oft h HIS 127 Cb 1.18 0.00 -0.27 0.00 2.57 0.00 0.00 27.41 30.89 1oft h HIS 127 CO 0.45 0.50 -0.52 0.99 -3.07 0.00 0.00 177.93 176.28 1oft s THR 128 N -3.09 -0.01 -0.18 6.12 2.01 -1.24 -1.22 115.64 118.04 1oft s THR 128 Ca 0.03 0.03 0.00 0.00 0.31 0.00 0.00 61.69 62.07 1oft s THR 128 Cb 0.08 -0.26 0.04 0.00 0.01 0.00 0.00 72.50 72.37 1oft s THR 128 CO 0.73 0.01 -0.10 -0.69 -0.69 0.00 0.00 174.62 173.88 1oft s VAL 129 N 0.30 1.52 -0.25 3.82 1.01 -0.66 -1.95 120.40 124.19 1oft s VAL 129 Ca -0.02 -0.83 -0.15 0.00 0.00 0.00 0.00 61.98 60.98 1oft s VAL 129 Cb -0.03 -1.57 -0.04 0.00 0.00 0.00 0.00 36.38 34.75 1oft s VAL 129 CO -0.01 0.25 0.38 -0.69 0.00 0.00 0.00 175.10 175.02 1oft s VAL 130 N 1.47 5.19 0.23 2.92 1.01 -0.21 -2.48 120.40 128.53 1oft s VAL 130 Ca 0.01 0.60 0.06 0.00 0.00 0.00 0.00 61.98 62.65 1oft s VAL 130 Cb -0.15 -3.70 -0.03 0.00 0.00 0.00 0.00 36.38 32.49 1oft s VAL 130 CO -0.09 0.19 0.24 -0.44 0.00 0.00 0.00 175.10 175.01 1oft s SER 131 N 1.43 5.80 -0.40 3.32 0.01 0.56 -1.17 113.70 123.24 1oft s SER 131 Ca 0.16 -0.12 0.11 0.00 1.31 0.00 0.00 55.95 57.41 1oft s SER 131 Cb -0.15 -1.57 0.39 0.00 0.21 0.00 0.00 66.02 64.90 1oft s SER 131 CO 0.09 -0.03 0.90 0.79 0.41 0.00 0.00 173.24 175.40 1oft n TRP 132 N -1.14 1.73 -3.64 2.43 7.02 -1.26 0.03 117.44 122.61 1oft n TRP 132 Ca -0.08 -3.41 -0.36 0.00 -1.02 0.00 0.00 57.50 52.63 1oft n TRP 132 Cb 0.57 -0.36 -0.09 0.00 -2.42 0.00 0.00 31.31 29.01 1oft n TRP 132 CO 0.00 0.00 0.00 -0.51 -2.02 0.00 0.00 177.69 175.16 1oft s LEU 133 N -3.02 4.16 -0.26 -0.99 1.43 -1.26 -4.96 118.68 113.77 1oft s LEU 133 Ca 0.39 0.23 -0.15 0.00 -1.03 0.00 0.00 54.13 53.57 1oft s LEU 133 Cb 0.38 -2.17 0.08 0.00 0.03 0.00 0.00 46.19 44.51 1oft s LEU 133 CO -0.07 0.09 0.65 -1.83 0.23 0.00 0.00 176.35 175.41 1oft s GLU 134 N 0.82 0.66 1.02 1.70 -1.05 -1.26 -4.40 118.70 116.18 1oft s GLU 134 Ca 0.10 1.17 -0.13 0.00 -0.15 0.00 0.00 54.97 55.95 1oft s GLU 134 Cb -0.13 0.14 0.20 0.00 -0.44 0.00 0.00 34.13 33.90 1oft s GLU 134 CO 0.03 -0.15 1.10 -2.14 0.95 0.00 0.00 175.26 175.05 1oft s PRO 135 N 1.64 0.23 -0.28 -4.83 0.02 -1.26 -5.08 135.00 125.45 1oft s PRO 135 Ca -0.10 0.39 -0.04 0.00 0.02 0.00 0.00 61.00 61.27 1oft s PRO 135 Cb -0.06 -1.72 0.10 0.00 0.02 0.00 0.00 34.50 32.83 1oft s PRO 135 CO -0.19 -2.84 0.12 -1.17 -0.33 0.00 0.00 177.00 172.60 1oft s LEU 136 N -6.49 0.53 0.91 -5.54 2.96 -1.26 -5.12 118.68 104.67 1oft s LEU 136 Ca 0.66 -1.21 -0.12 0.00 -0.22 0.00 0.00 54.13 53.24 1oft s LEU 136 Cb -0.17 -0.34 0.10 0.00 0.50 0.00 0.00 46.19 46.27 1oft s LEU 136 CO 0.57 -0.43 0.88 -1.54 -1.32 0.00 0.00 176.35 174.51 1oft n SER 137 N 5.25 -0.46 0.27 3.68 3.41 -1.26 -4.79 113.62 119.72 1oft n SER 137 Ca -0.06 0.42 0.18 0.00 -0.26 0.00 0.00 58.87 59.15 1oft n SER 137 Cb 0.43 -1.38 0.80 0.00 -0.26 0.00 0.00 64.21 63.80 1oft n SER 137 CO 0.00 0.00 0.00 -0.09 -0.16 0.00 0.00 175.04 174.79 1oft h ARG 138 N -1.60 0.00 0.24 4.33 2.43 -2.00 -2.34 114.38 115.44 1oft h ARG 138 Ca -0.44 0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 58.72 1oft h ARG 138 Cb 1.28 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.83 1oft h ARG 138 CO 0.39 0.00 -0.12 0.00 -1.51 0.00 0.00 179.97 178.74 1oft h ALA 139 N 2.03 -0.40 -0.97 2.80 0.00 -2.00 -2.93 119.26 117.80 1oft h ALA 139 Ca 0.00 -0.07 0.24 0.00 0.00 0.00 0.00 54.91 55.08 1oft h ALA 139 Cb 0.33 0.13 -0.18 0.00 0.00 0.00 0.00 17.79 18.06 1oft h ALA 139 CO 0.00 -0.37 -0.06 0.00 0.00 0.00 0.00 179.25 178.81 1oft n ALA 140 N -2.58 0.41 0.15 0.00 0.00 -1.03 0.37 120.51 117.83 1oft n ALA 140 Ca -0.04 1.05 -0.13 0.00 0.00 0.00 0.00 53.44 54.32 1oft n ALA 140 Cb 0.13 -0.72 -0.06 0.00 0.00 0.00 0.00 19.45 18.79 1oft n ALA 140 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1oft h ARG 141 N 0.00 -0.41 -0.98 0.00 3.08 -1.50 -0.96 114.38 113.60 1oft h ARG 141 Ca 0.55 0.03 0.19 0.00 0.07 0.00 0.00 59.98 60.82 1oft h ARG 141 Cb 1.06 0.09 -0.10 0.00 0.08 0.00 0.00 29.97 31.11 1oft h ARG 141 CO -0.94 -0.28 0.61 0.87 -1.07 0.00 0.00 179.97 179.17 1oft h LYS 142 N -0.43 0.69 0.06 0.04 1.57 0.12 0.40 116.57 119.02 1oft h LYS 142 Ca 0.00 -0.04 -0.00 0.00 -1.87 0.00 0.00 60.65 58.74 1oft h LYS 142 Cb 0.40 -0.15 0.00 0.00 0.08 0.00 0.00 32.23 32.56 1oft h LYS 142 CO -0.05 0.45 -0.03 1.96 -0.57 0.00 0.00 179.45 181.22 1oft h GLN 143 N 0.71 -0.08 -0.66 3.15 4.20 0.09 -1.17 115.11 121.35 1oft h GLN 143 Ca 0.55 0.01 -0.01 0.00 0.06 0.00 0.00 58.65 59.25 1oft h GLN 143 Cb 0.93 0.02 -0.03 0.00 0.30 0.00 0.00 27.48 28.69 1oft h GLN 143 CO -0.32 -0.04 0.36 -0.07 -0.67 0.00 0.00 178.83 178.09 1oft h LEU 144 N -0.09 0.82 -0.65 1.46 3.38 0.23 -1.16 115.31 119.30 1oft h LEU 144 Ca -0.01 -0.09 0.06 0.00 0.09 0.00 0.00 57.88 57.93 1oft h LEU 144 Cb 0.07 -0.21 -0.06 0.00 0.09 0.00 0.00 40.66 40.56 1oft h LEU 144 CO 0.01 0.68 0.35 -1.28 0.09 0.00 0.00 178.44 178.29 1oft h SER 145 N 0.90 0.50 -0.17 -0.43 0.87 0.07 0.28 113.55 115.58 1oft h SER 145 Ca 0.23 0.04 -0.07 0.00 -1.23 0.00 0.00 61.79 60.75 1oft h SER 145 Cb 0.04 -0.06 -0.00 0.00 -0.44 0.00 0.00 62.40 61.93 1oft h SER 145 CO -0.04 0.32 -0.19 -0.09 -0.53 0.00 0.00 176.83 176.31 1oft h ARG 146 N 0.64 0.42 -0.67 2.24 2.43 -0.93 -1.59 114.38 116.91 1oft h ARG 146 Ca 0.30 -0.23 0.06 0.00 -0.81 0.00 0.00 59.98 59.30 1oft h ARG 146 Cb 0.21 0.01 -0.06 0.00 -0.42 0.00 0.00 29.97 29.72 1oft h ARG 146 CO -0.20 0.80 0.37 0.00 -1.51 0.00 0.00 179.97 179.44 1oft h ALA 147 N 0.61 0.91 -0.63 2.80 0.00 -0.89 -0.80 119.26 121.26 1oft h ALA 147 Ca 0.02 0.02 0.01 0.00 0.00 0.00 0.00 54.91 54.96 1oft h ALA 147 Cb 0.73 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.37 1oft h ALA 147 CO 0.05 0.04 0.41 0.00 0.00 0.00 0.00 179.25 179.75 1oft h ALA 148 N 1.36 0.80 -0.23 0.00 0.00 -0.32 -2.09 119.26 118.78 1oft h ALA 148 Ca 0.31 -0.04 -0.13 0.00 0.00 0.00 0.00 54.91 55.05 1oft h ALA 148 Cb 0.21 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 1oft h ALA 148 CO -0.19 0.21 -0.39 1.96 0.00 0.00 0.00 179.25 180.84 1oft h GLN 149 N 0.84 0.52 -0.22 0.00 4.20 -0.52 0.39 115.11 120.31 1oft h GLN 149 Ca 0.24 -0.25 -0.01 0.00 0.06 0.00 0.00 58.65 58.68 1oft h GLN 149 Cb -0.08 -0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.69 1oft h GLN 149 CO -0.06 0.82 0.08 -0.07 -0.67 0.00 0.00 178.83 178.93 1oft h LEU 150 N 0.43 0.31 0.00 1.46 3.38 -0.87 -2.31 115.31 117.70 1oft h LEU 150 Ca 0.04 -0.18 0.00 0.00 0.09 0.00 0.00 57.88 57.83 1oft h LEU 150 Cb 0.87 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.54 1oft h LEU 150 CO 0.07 0.41 0.00 0.61 0.09 0.00 0.00 178.44 179.62 1oft n GLY 151 N -0.67 -0.93 3.94 0.83 0.00 -0.81 -4.85 105.19 102.69 1oft n GLY 151 Ca -0.04 -0.05 -0.28 0.00 0.00 0.00 0.00 46.02 45.66 1oft n GLY 151 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1oft n GLN 152 N -0.63 -4.22 -3.16 1.61 6.02 -0.83 -4.38 117.38 111.79 1oft n GLN 152 Ca 0.06 0.50 -0.13 0.00 -0.01 0.00 0.00 57.00 57.41 1oft n GLN 152 Cb 0.03 -5.03 -0.03 0.00 1.02 0.00 0.00 30.24 26.22 1oft n GLN 152 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1oft n ALA 153 N -4.44 0.25 -2.73 -1.58 0.00 0.13 -4.91 120.51 107.22 1oft n ALA 153 Ca -0.14 -1.00 -0.31 0.00 0.00 0.00 0.00 53.44 51.99 1oft n ALA 153 Cb 0.61 0.63 -0.16 0.00 0.00 0.00 0.00 19.45 20.52 1oft n ALA 153 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1oft s GLN 154 N -2.76 2.40 -0.19 0.00 -1.52 -0.36 -4.39 119.66 112.83 1oft s GLN 154 Ca 0.07 -0.86 -0.06 0.00 -1.95 0.00 0.00 55.36 52.55 1oft s GLN 154 Cb 0.00 -2.06 -0.03 0.00 -0.22 0.00 0.00 33.01 30.70 1oft s GLN 154 CO 0.05 0.37 0.04 0.45 -0.25 0.00 0.00 175.29 175.94 1oft s SER 155 N -0.16 5.27 -0.13 5.90 0.15 0.80 -1.66 113.70 123.87 1oft s SER 155 Ca -0.03 -0.05 -0.00 0.00 0.70 0.00 0.00 55.95 56.57 1oft s SER 155 Cb -0.13 -1.90 0.02 0.00 -1.71 0.00 0.00 66.02 62.30 1oft s SER 155 CO 0.03 0.12 -0.10 -0.22 1.20 0.00 0.00 173.24 174.27 1oft s LEU 156 N 0.67 1.40 -0.16 3.45 2.96 -1.04 -1.87 118.68 124.09 1oft s LEU 156 Ca 0.02 -0.38 -0.04 0.00 -0.22 0.00 0.00 54.13 53.51 1oft s LEU 156 Cb -0.14 -0.98 -0.03 0.00 0.50 0.00 0.00 46.19 45.55 1oft s LEU 156 CO 0.02 -0.09 -0.04 0.21 -1.32 0.00 0.00 176.35 175.13 1oft s ASN 157 N 1.59 4.77 -0.21 3.68 2.47 -0.56 -0.32 114.94 126.37 1oft s ASN 157 Ca 0.04 -0.15 -0.04 0.00 0.42 0.00 0.00 52.86 53.14 1oft s ASN 157 Cb -0.13 -1.78 -0.01 0.00 -1.45 0.00 0.00 41.25 37.88 1oft s ASN 157 CO -0.09 0.15 -0.05 -0.63 -3.72 0.00 0.00 177.10 172.77 1oft s ILE 158 N 0.45 3.43 -0.66 -5.21 1.01 0.10 -0.74 121.20 119.58 1oft s ILE 158 Ca -0.04 -0.48 -0.10 0.00 0.00 0.00 0.00 60.65 60.03 1oft s ILE 158 Cb -0.14 -2.55 0.17 0.00 0.01 0.00 0.00 42.46 39.95 1oft s ILE 158 CO 0.03 0.44 0.55 -0.13 0.00 0.00 0.00 174.94 175.83 1oft s ARG 159 N 1.28 3.00 0.56 2.79 0.52 0.04 -4.26 118.95 122.88 1oft s ARG 159 Ca 0.03 -2.22 -0.16 0.00 -0.52 0.00 0.00 55.73 52.86 1oft s ARG 159 Cb -0.14 -4.12 -0.06 0.00 0.52 0.00 0.00 34.95 31.15 1oft s ARG 159 CO -0.02 -1.24 1.02 -0.51 0.02 0.00 0.00 175.30 174.57 1oft s LEU 160 N 0.56 3.54 0.00 2.53 1.43 -1.26 -1.97 118.68 123.52 1oft s LEU 160 Ca 0.13 1.69 0.00 0.00 -1.03 0.00 0.00 54.13 54.92 1oft s LEU 160 Cb -0.19 -4.52 0.00 0.00 0.03 0.00 0.00 46.19 41.51 1oft s LEU 160 CO -0.04 -0.89 0.00 0.61 0.23 0.00 0.00 176.35 176.26