#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1pr9 n GLU 2 N 0.00 2.50 -0.06 2.12 4.07 -1.26 -4.83 120.64 123.19 1pr9 n GLU 2 Ca 0.00 0.87 0.07 0.00 -0.06 0.00 0.00 57.16 58.04 1pr9 n GLU 2 Cb 0.00 -2.99 0.10 0.00 -0.06 0.00 0.00 31.44 28.48 1pr9 n GLU 2 CO 0.00 0.00 0.00 1.28 -0.06 0.00 0.00 177.13 178.35 1pr9 n LEU 3 N 8.44 2.46 -3.91 4.31 4.77 -1.26 -4.84 117.00 126.98 1pr9 n LEU 3 Ca 0.23 -1.25 -0.40 0.00 -0.03 0.00 0.00 56.01 54.56 1pr9 n LEU 3 Cb 0.39 -0.08 0.03 0.00 -2.33 0.00 0.00 43.42 41.44 1pr9 n LEU 3 CO 0.69 0.50 -0.13 0.49 -1.33 0.00 0.00 177.39 177.61 1pr9 n PHE 4 N 0.82 -1.61 -0.02 -1.77 3.72 -1.26 -4.35 117.46 112.99 1pr9 n PHE 4 Ca 0.10 0.23 0.01 0.00 -0.05 0.00 0.00 57.45 57.75 1pr9 n PHE 4 Cb 0.39 -3.07 -0.13 0.00 -0.94 0.00 0.00 39.48 35.73 1pr9 n PHE 4 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 176.76 177.99 1pr9 n LEU 5 N -4.69 0.28 -4.57 4.37 4.77 -1.26 -4.90 117.00 110.99 1pr9 n LEU 5 Ca -0.10 0.12 -0.45 0.00 -0.03 0.00 0.00 56.01 55.55 1pr9 n LEU 5 Cb 0.58 0.17 -0.02 0.00 -2.33 0.00 0.00 43.42 41.82 1pr9 n LEU 5 CO 0.71 0.19 0.53 0.00 -1.33 0.00 0.00 177.39 177.49 1pr9 n ALA 6 N -2.45 -0.45 0.00 -1.18 0.00 -1.25 -1.26 120.51 113.92 1pr9 n ALA 6 Ca -0.14 0.40 0.00 0.00 0.00 0.00 0.00 53.44 53.69 1pr9 n ALA 6 Cb 0.83 -1.99 0.00 0.00 0.00 0.00 0.00 19.45 18.29 1pr9 n ALA 6 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1pr9 n GLY 7 N 1.30 3.00 3.92 0.00 0.00 -0.93 -4.89 105.19 107.59 1pr9 n GLY 7 Ca 0.10 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.86 1pr9 n GLY 7 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1pr9 s ARG 8 N -0.00 3.52 -0.30 1.61 1.81 -0.39 -4.70 118.95 120.50 1pr9 s ARG 8 Ca 0.00 0.03 -0.16 0.00 -1.72 0.00 0.00 55.73 53.88 1pr9 s ARG 8 Cb 0.00 -2.47 -0.02 0.00 -0.45 0.00 0.00 34.95 32.01 1pr9 s ARG 8 CO 0.00 -0.09 0.42 0.50 -0.68 0.00 0.00 175.30 175.45 1pr9 s ARG 9 N -4.60 3.84 -0.09 3.54 3.52 -1.26 -0.61 118.95 123.29 1pr9 s ARG 9 Ca 0.45 -0.06 0.01 0.00 -0.13 0.00 0.00 55.73 56.00 1pr9 s ARG 9 Cb -0.10 -3.72 -0.02 0.00 -1.56 0.00 0.00 34.95 29.55 1pr9 s ARG 9 CO 0.42 -0.42 -0.12 0.08 -0.81 0.00 0.00 175.30 174.45 1pr9 s VAL 10 N 2.17 3.20 -0.17 7.11 1.01 0.21 -0.54 120.40 133.40 1pr9 s VAL 10 Ca 0.16 -0.64 -0.07 0.00 0.00 0.00 0.00 61.98 61.43 1pr9 s VAL 10 Cb -0.16 -2.31 -0.04 0.00 0.00 0.00 0.00 36.38 33.87 1pr9 s VAL 10 CO 0.11 0.56 0.08 -0.22 0.00 0.00 0.00 175.10 175.63 1pr9 s LEU 11 N -0.23 3.96 -0.14 3.92 0.20 0.60 -0.72 118.68 126.28 1pr9 s LEU 11 Ca 0.01 0.18 0.01 0.00 0.69 0.00 0.00 54.13 55.02 1pr9 s LEU 11 Cb -0.13 -1.99 0.02 0.00 -0.43 0.00 0.00 46.19 43.66 1pr9 s LEU 11 CO 0.03 0.23 -0.15 -0.69 -0.29 0.00 0.00 176.35 175.48 1pr9 s VAL 12 N 0.02 1.58 0.22 1.68 1.01 -0.36 -0.43 120.40 124.13 1pr9 s VAL 12 Ca 0.07 -0.65 -0.03 0.00 0.00 0.00 0.00 61.98 61.37 1pr9 s VAL 12 Cb -0.12 -1.47 -0.05 0.00 0.00 0.00 0.00 36.38 34.74 1pr9 s VAL 12 CO 0.00 0.46 0.44 0.42 0.00 0.00 0.00 175.10 176.43 1pr9 s THR 13 N 1.35 5.14 -1.31 3.92 -4.23 -0.64 -1.51 115.64 118.35 1pr9 s THR 13 Ca 0.02 -0.17 -0.07 0.00 -1.18 0.00 0.00 61.69 60.29 1pr9 s THR 13 Cb -0.13 -3.72 0.01 0.00 1.34 0.00 0.00 72.50 70.00 1pr9 s THR 13 CO -0.08 -0.19 1.14 0.61 -0.54 0.00 0.00 174.62 175.55 1pr9 n GLY 14 N -0.65 -0.49 0.00 3.99 0.00 -0.22 -3.09 105.19 104.73 1pr9 n GLY 14 Ca -0.03 0.22 0.14 0.00 0.00 0.00 0.00 46.02 46.35 1pr9 n GLY 14 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1pr9 n ALA 15 N -4.81 2.39 0.10 4.61 0.00 -0.53 -3.93 120.51 118.34 1pr9 n ALA 15 Ca -0.04 -0.12 -0.05 0.00 0.00 0.00 0.00 53.44 53.22 1pr9 n ALA 15 Cb 0.58 -1.48 0.07 0.00 0.00 0.00 0.00 19.45 18.63 1pr9 n ALA 15 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1pr9 h GLY 16 N 4.96 0.17 -2.37 0.00 0.00 -1.89 -3.11 103.07 100.83 1pr9 h GLY 16 Ca 0.00 -0.25 -0.32 0.00 0.00 0.00 0.00 47.33 46.76 1pr9 h GLY 16 CO 0.00 0.22 -0.60 0.54 0.00 0.00 0.00 176.54 176.71 1pr9 s LYS 17 N -3.48 1.37 3.66 4.80 1.02 -1.26 -4.79 119.74 121.07 1pr9 s LYS 17 Ca -0.03 -1.75 0.00 0.00 0.02 0.00 0.00 55.97 54.22 1pr9 s LYS 17 Cb 0.11 0.08 0.00 0.00 -0.52 0.00 0.00 37.83 37.50 1pr9 s LYS 17 CO 0.80 -0.40 0.00 0.41 -0.92 0.00 0.00 175.35 175.24 1pr9 n GLY 18 N -0.40 2.72 0.34 -3.33 0.00 -1.26 -1.73 105.19 101.52 1pr9 n GLY 18 Ca 0.02 -0.15 -0.05 0.00 0.00 0.00 0.00 46.02 45.84 1pr9 n GLY 18 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1pr9 h ILE 19 N 0.00 1.26 -0.52 -0.61 2.04 -1.95 -1.01 117.51 116.71 1pr9 h ILE 19 Ca 0.00 -0.81 -0.01 0.00 1.00 0.00 0.00 64.86 65.04 1pr9 h ILE 19 Cb 0.00 0.33 -0.02 0.00 -0.74 0.00 0.00 36.82 36.39 1pr9 h ILE 19 CO 0.00 0.33 0.29 1.23 0.00 0.00 0.00 178.15 180.00 1pr9 h GLY 20 N 1.15 0.78 1.01 5.37 0.00 -1.66 0.21 103.07 109.93 1pr9 h GLY 20 Ca 0.26 -0.35 -0.02 0.00 0.00 0.00 0.00 47.33 47.23 1pr9 h GLY 20 CO -0.02 0.33 0.43 -0.09 0.00 0.00 0.00 176.54 177.19 1pr9 h ARG 21 N 0.70 1.10 -0.13 4.80 2.43 -0.74 -1.62 114.38 120.91 1pr9 h ARG 21 Ca 0.18 -0.13 -0.09 0.00 -0.81 0.00 0.00 59.98 59.14 1pr9 h ARG 21 Cb 0.03 -0.21 -0.01 0.00 -0.42 0.00 0.00 29.97 29.36 1pr9 h ARG 21 CO -0.03 0.81 -0.30 0.78 -1.51 0.00 0.00 179.97 179.72 1pr9 h GLY 22 N 1.09 0.27 0.99 2.80 0.00 -0.95 -2.48 103.07 104.79 1pr9 h GLY 22 Ca 0.28 -0.22 -0.10 0.00 0.00 0.00 0.00 47.33 47.29 1pr9 h GLY 22 CO -0.04 0.20 -0.15 -0.84 0.00 0.00 0.00 176.54 175.71 1pr9 h THR 23 N 0.22 1.28 -0.52 4.70 2.02 -0.52 -2.52 112.91 117.57 1pr9 h THR 23 Ca 0.03 -1.26 0.01 0.00 0.77 0.00 0.00 66.41 65.97 1pr9 h THR 23 Cb 0.65 1.28 -0.03 0.00 -1.74 0.00 0.00 68.15 68.31 1pr9 h THR 23 CO 0.05 0.42 0.33 0.58 0.37 0.00 0.00 175.52 177.27 1pr9 h VAL 24 N 0.58 1.09 -0.38 3.16 2.07 -1.10 -1.19 116.25 120.49 1pr9 h VAL 24 Ca 0.09 -0.23 -0.01 0.00 0.82 0.00 0.00 66.70 67.37 1pr9 h VAL 24 Cb 0.69 0.37 -0.02 0.00 -1.52 0.00 0.00 31.29 30.81 1pr9 h VAL 24 CO 0.05 0.12 0.20 1.56 0.02 0.00 0.00 177.57 179.52 1pr9 h GLN 25 N 0.66 0.53 -0.37 1.57 4.20 -1.40 0.28 115.11 120.59 1pr9 h GLN 25 Ca 0.20 -0.07 0.02 0.00 0.06 0.00 0.00 58.65 58.87 1pr9 h GLN 25 Cb -0.03 -0.10 -0.03 0.00 0.30 0.00 0.00 27.48 27.62 1pr9 h GLN 25 CO -0.07 0.44 0.19 0.00 -0.67 0.00 0.00 178.83 178.73 1pr9 h ALA 26 N 1.06 0.46 -0.41 3.87 0.00 -1.35 0.11 119.26 122.99 1pr9 h ALA 26 Ca 0.13 0.01 -0.04 0.00 0.00 0.00 0.00 54.91 55.00 1pr9 h ALA 26 Cb 0.08 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 1pr9 h ALA 26 CO -0.02 -0.16 0.08 -0.07 0.00 0.00 0.00 179.25 179.08 1pr9 h LEU 27 N 0.40 0.64 -1.03 0.00 3.38 -0.86 -2.13 115.31 115.71 1pr9 h LEU 27 Ca 0.15 -0.25 0.08 0.00 0.09 0.00 0.00 57.88 57.96 1pr9 h LEU 27 Cb 0.05 -0.17 -0.07 0.00 0.09 0.00 0.00 40.66 40.55 1pr9 h LEU 27 CO -0.10 0.72 0.64 -0.74 0.09 0.00 0.00 178.44 179.05 1pr9 h HIS 28 N 0.53 1.16 -0.03 1.13 2.76 -0.08 0.13 115.15 120.76 1pr9 h HIS 28 Ca 0.13 0.03 -0.09 0.00 -2.20 0.00 0.00 60.37 58.24 1pr9 h HIS 28 Cb 0.34 -0.38 -0.01 0.00 1.55 0.00 0.00 27.41 28.91 1pr9 h HIS 28 CO 0.02 0.56 -0.38 0.00 -1.30 0.00 0.00 177.93 176.83 1pr9 h ALA 29 N 1.49 1.31 -0.26 5.26 0.00 -0.32 -2.68 119.26 124.06 1pr9 h ALA 29 Ca 0.45 -0.36 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1pr9 h ALA 29 Cb 0.28 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.00 1pr9 h ALA 29 CO -0.20 0.50 0.00 0.25 0.00 0.00 0.00 179.25 179.81 1pr9 n THR 30 N -4.07 0.34 -0.61 0.00 -2.24 0.01 -4.88 114.28 102.83 1pr9 n THR 30 Ca -0.02 -0.35 0.00 0.00 -2.27 0.00 0.00 64.05 61.41 1pr9 n THR 30 Cb 0.43 0.18 0.00 0.00 -2.10 0.00 0.00 70.33 68.84 1pr9 n THR 30 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1pr9 n GLY 31 N 0.93 0.70 3.83 3.38 0.00 -1.01 -3.92 105.19 109.09 1pr9 n GLY 31 Ca 0.09 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.80 1pr9 n GLY 31 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1pr9 s ALA 32 N -2.03 2.87 -0.19 4.61 0.00 -1.10 -2.18 121.76 123.74 1pr9 s ALA 32 Ca 0.00 0.19 -0.14 0.00 0.00 0.00 0.00 51.96 52.01 1pr9 s ALA 32 Cb 0.00 -3.16 -0.04 0.00 0.00 0.00 0.00 23.12 19.91 1pr9 s ALA 32 CO 0.00 -0.73 0.30 1.03 0.00 0.00 0.00 175.76 176.36 1pr9 s ARG 33 N -4.46 4.19 -0.12 0.00 0.52 0.22 -4.61 118.95 114.68 1pr9 s ARG 33 Ca 0.60 0.05 -0.00 0.00 -0.52 0.00 0.00 55.73 55.85 1pr9 s ARG 33 Cb -0.13 -3.49 -0.02 0.00 0.52 0.00 0.00 34.95 31.83 1pr9 s ARG 33 CO 0.42 0.10 -0.11 0.08 0.02 0.00 0.00 175.30 175.81 1pr9 s VAL 34 N 0.91 3.26 -0.30 3.52 1.01 -1.26 0.67 120.40 128.21 1pr9 s VAL 34 Ca 0.15 -0.59 -0.10 0.00 0.00 0.00 0.00 61.98 61.43 1pr9 s VAL 34 Cb -0.14 -2.37 -0.03 0.00 0.00 0.00 0.00 36.38 33.84 1pr9 s VAL 34 CO 0.05 0.53 0.17 -0.69 0.00 0.00 0.00 175.10 175.16 1pr9 s VAL 35 N 0.18 4.95 -0.29 2.92 1.01 0.10 -0.83 120.40 128.44 1pr9 s VAL 35 Ca -0.06 -0.13 -0.06 0.00 0.00 0.00 0.00 61.98 61.73 1pr9 s VAL 35 Cb -0.15 -3.44 0.01 0.00 0.00 0.00 0.00 36.38 32.81 1pr9 s VAL 35 CO 0.04 0.16 0.07 0.00 0.00 0.00 0.00 175.10 175.37 1pr9 s ALA 36 N 1.69 3.02 -0.17 5.51 0.00 0.15 -1.23 121.76 130.74 1pr9 s ALA 36 Ca 0.06 -1.48 -0.04 0.00 0.00 0.00 0.00 51.96 50.51 1pr9 s ALA 36 Cb -0.16 -2.11 -0.03 0.00 0.00 0.00 0.00 23.12 20.82 1pr9 s ALA 36 CO 0.08 -0.94 -0.03 0.08 0.00 0.00 0.00 175.76 174.95 1pr9 s VAL 37 N 1.47 3.87 0.20 0.00 1.01 -0.57 -0.07 120.40 126.31 1pr9 s VAL 37 Ca 0.02 -0.36 -0.19 0.00 0.00 0.00 0.00 61.98 61.45 1pr9 s VAL 37 Cb -0.17 -2.71 0.04 0.00 0.00 0.00 0.00 36.38 33.54 1pr9 s VAL 37 CO 0.02 0.48 0.57 -0.55 0.00 0.00 0.00 175.10 175.62 1pr9 s SER 38 N 0.52 -0.33 0.14 3.32 0.15 -0.81 -1.05 113.70 115.64 1pr9 s SER 38 Ca -0.03 -0.38 0.04 0.00 0.70 0.00 0.00 55.95 56.27 1pr9 s SER 38 Cb -0.14 0.61 -0.12 0.00 -1.71 0.00 0.00 66.02 64.65 1pr9 s SER 38 CO 0.03 -1.08 1.31 -0.09 1.20 0.00 0.00 173.24 174.60 1pr9 h ARG 39 N 2.12 0.11 -5.06 5.44 2.43 -1.88 -2.26 114.38 115.28 1pr9 h ARG 39 Ca -0.28 -0.16 -0.66 0.00 -0.81 0.00 0.00 59.98 58.07 1pr9 h ARG 39 Cb 1.27 0.05 -0.27 0.00 -0.42 0.00 0.00 29.97 30.60 1pr9 h ARG 39 CO 0.35 1.00 -0.72 0.99 -1.51 0.00 0.00 179.97 180.08 1pr9 s THR 40 N -2.91 3.38 0.26 0.20 2.01 -1.26 -4.59 115.64 112.73 1pr9 s THR 40 Ca -0.01 -0.50 -0.03 0.00 0.31 0.00 0.00 61.69 61.46 1pr9 s THR 40 Cb 0.10 -2.52 0.24 0.00 0.01 0.00 0.00 72.50 70.33 1pr9 s THR 40 CO 0.83 0.44 1.85 -0.61 -0.69 0.00 0.00 174.62 176.44 1pr9 h GLN 41 N 7.82 0.98 0.00 4.92 5.75 -1.98 -2.03 115.11 130.56 1pr9 h GLN 41 Ca -0.39 -0.06 -0.05 0.00 -0.15 0.00 0.00 58.65 58.00 1pr9 h GLN 41 Cb 1.17 -0.22 -0.01 0.00 1.07 0.00 0.00 27.48 29.49 1pr9 h GLN 41 CO 0.60 0.65 -0.24 0.00 -2.65 0.00 0.00 178.83 177.18 1pr9 h ALA 42 N 1.45 1.12 -0.48 3.38 0.00 -1.99 0.10 119.26 122.84 1pr9 h ALA 42 Ca 0.42 -0.22 -0.11 0.00 0.00 0.00 0.00 54.91 54.99 1pr9 h ALA 42 Cb 0.25 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.99 1pr9 h ALA 42 CO -0.20 0.30 -0.14 -0.44 0.00 0.00 0.00 179.25 178.77 1pr9 h ASP 43 N 0.00 0.92 0.63 0.00 3.45 -1.71 -2.71 116.42 117.00 1pr9 h ASP 43 Ca -0.00 -0.31 -0.21 0.00 0.43 0.00 0.00 57.03 56.94 1pr9 h ASP 43 Cb 0.65 -0.25 -0.01 0.00 -0.56 0.00 0.00 39.33 39.16 1pr9 h ASP 43 CO 0.03 1.06 -0.95 -0.07 -1.57 0.00 0.00 179.24 177.74 1pr9 h LEU 44 N 0.81 0.27 -0.24 1.55 3.38 -1.01 -2.63 115.31 117.44 1pr9 h LEU 44 Ca 0.12 -0.23 0.04 0.00 0.09 0.00 0.00 57.88 57.90 1pr9 h LEU 44 Cb 0.68 -0.08 -0.03 0.00 0.09 0.00 0.00 40.66 41.31 1pr9 h LEU 44 CO 0.05 1.08 0.03 0.44 0.09 0.00 0.00 178.44 180.13 1pr9 h ASP 45 N 0.10 -0.02 1.02 -0.43 3.32 -0.70 0.30 116.42 120.01 1pr9 h ASP 45 Ca -0.06 0.04 -0.06 0.00 0.02 0.00 0.00 57.03 56.98 1pr9 h ASP 45 Cb 1.62 0.06 -0.01 0.00 0.22 0.00 0.00 39.33 41.22 1pr9 h ASP 45 CO 0.15 0.02 -0.29 0.77 -1.72 0.00 0.00 179.24 178.17 1pr9 h SER 46 N 0.12 0.00 -0.34 6.45 4.64 -1.53 -2.28 113.55 120.62 1pr9 h SER 46 Ca 0.11 0.00 -0.16 0.00 -0.47 0.00 0.00 61.79 61.28 1pr9 h SER 46 Cb 0.12 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.21 1pr9 h SER 46 CO -0.16 0.29 -0.38 0.25 -0.87 0.00 0.00 176.83 175.96 1pr9 h LEU 47 N 0.00 0.95 -1.18 5.97 5.85 -1.03 -1.52 115.31 124.35 1pr9 h LEU 47 Ca -0.00 -0.43 -0.09 0.00 0.84 0.00 0.00 57.88 58.20 1pr9 h LEU 47 Cb 0.88 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 41.63 1pr9 h LEU 47 CO 0.04 1.21 -0.41 -0.37 -0.34 0.00 0.00 178.44 178.58 1pr9 h VAL 48 N 0.73 1.29 -0.13 1.05 -1.51 -0.66 0.15 116.25 117.17 1pr9 h VAL 48 Ca 0.06 -1.40 -0.14 0.00 -1.23 0.00 0.00 66.70 63.99 1pr9 h VAL 48 Cb 0.97 1.75 -0.01 0.00 -2.13 0.00 0.00 31.29 31.87 1pr9 h VAL 48 CO 0.09 0.40 -0.53 0.03 -1.23 0.00 0.00 177.57 176.33 1pr9 h ARG 49 N 0.01 0.36 0.00 5.19 3.08 -1.12 -2.81 114.38 119.08 1pr9 h ARG 49 Ca -0.00 -0.22 -0.21 0.00 0.07 0.00 0.00 59.98 59.61 1pr9 h ARG 49 Cb 0.72 0.02 -0.03 0.00 0.08 0.00 0.00 29.97 30.76 1pr9 h ARG 49 CO 0.05 0.81 -1.26 0.93 -1.07 0.00 0.00 179.97 179.43 1pr9 h GLU 50 N 0.28 0.00 -2.47 0.04 5.08 -0.96 -3.40 114.58 113.15 1pr9 h GLU 50 Ca 0.01 0.00 -0.60 0.00 -1.00 0.00 0.00 59.36 57.77 1pr9 h GLU 50 Cb 1.03 0.00 -0.41 0.00 0.50 0.00 0.00 28.75 29.87 1pr9 h GLU 50 CO 0.09 0.59 -0.72 0.00 -1.00 0.00 0.00 179.01 177.97 1pr9 n PRO 52 N 1.57 2.55 0.00 0.00 -0.02 -1.07 -2.74 135.00 135.29 1pr9 n PRO 52 Ca 0.25 0.90 0.00 0.00 -2.02 0.00 0.00 63.50 62.63 1pr9 n PRO 52 Cb 0.42 -2.66 0.00 0.00 -0.02 0.00 0.00 33.50 31.24 1pr9 n PRO 52 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1pr9 n GLY 53 N 0.49 3.16 3.76 -1.23 0.00 -1.26 -5.08 105.19 105.03 1pr9 n GLY 53 Ca 0.02 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.69 1pr9 n GLY 53 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1pr9 s ILE 54 N -2.76 2.93 -0.38 -0.61 -4.36 -1.11 -4.77 121.20 110.14 1pr9 s ILE 54 Ca 0.00 0.54 -0.16 0.00 -0.26 0.00 0.00 60.65 60.77 1pr9 s ILE 54 Cb 0.00 -3.17 0.00 0.00 1.25 0.00 0.00 42.46 40.55 1pr9 s ILE 54 CO 0.00 -0.16 0.40 -1.61 0.24 0.00 0.00 174.94 173.81 1pr9 s GLU 55 N -3.50 3.33 0.19 0.37 2.02 -0.01 -4.97 118.70 116.14 1pr9 s GLU 55 Ca 0.73 -0.58 -0.23 0.00 0.02 0.00 0.00 54.97 54.91 1pr9 s GLU 55 Cb -0.26 -3.89 -0.08 0.00 0.10 0.00 0.00 34.13 30.00 1pr9 s GLU 55 CO 0.33 -0.69 0.75 -1.25 0.02 0.00 0.00 175.26 174.42 1pr9 s PRO 56 N 2.08 4.41 -0.13 0.39 0.04 -1.26 -0.67 135.00 139.86 1pr9 s PRO 56 Ca 0.12 1.02 -0.00 0.00 0.04 0.00 0.00 61.00 62.18 1pr9 s PRO 56 Cb -0.17 -3.07 0.02 0.00 0.04 0.00 0.00 34.50 31.33 1pr9 s PRO 56 CO 0.13 0.48 -0.10 0.08 0.04 0.00 0.00 177.00 177.62 1pr9 s VAL 57 N -1.34 1.28 -0.31 -0.36 1.01 0.90 -4.90 120.40 116.68 1pr9 s VAL 57 Ca 0.39 -0.46 -0.09 0.00 0.00 0.00 0.00 61.98 61.82 1pr9 s VAL 57 Cb -0.20 -1.25 -0.01 0.00 0.00 0.00 0.00 36.38 34.92 1pr9 s VAL 57 CO 0.23 0.40 0.15 0.00 0.00 0.00 0.00 175.10 175.88 1pr9 s VAL 59 N 1.62 0.00 -0.45 0.00 0.11 -0.85 -4.99 120.40 115.84 1pr9 s VAL 59 Ca 0.05 0.00 -0.24 0.00 -2.93 0.00 0.00 61.98 58.86 1pr9 s VAL 59 Cb -0.17 -1.00 0.03 0.00 -1.53 0.00 0.00 36.38 33.71 1pr9 s VAL 59 CO 0.06 0.00 0.82 -0.62 -3.33 0.00 0.00 175.10 172.04 1pr9 s ASP 60 N -1.32 6.44 0.25 3.54 -1.08 -1.26 -3.75 116.67 119.49 1pr9 s ASP 60 Ca -0.09 -0.03 0.23 0.00 -0.52 0.00 0.00 52.55 52.14 1pr9 s ASP 60 Cb -0.00 -2.40 0.97 0.00 -1.46 0.00 0.00 42.92 40.03 1pr9 s ASP 60 CO 0.07 -0.95 1.69 0.18 0.52 0.00 0.00 175.17 176.68 1pr9 n LEU 61 N 6.83 0.62 0.00 -1.34 4.77 -1.26 -1.53 117.00 125.09 1pr9 n LEU 61 Ca 0.03 0.66 0.11 0.00 -0.03 0.00 0.00 56.01 56.78 1pr9 n LEU 61 Cb 0.48 -0.59 0.57 0.00 -2.33 0.00 0.00 43.42 41.55 1pr9 n LEU 61 CO 0.60 -0.58 0.84 0.61 -1.33 0.00 0.00 177.39 177.53 1pr9 n GLY 62 N -0.13 -0.88 3.24 -0.72 0.00 -1.26 -4.53 105.19 100.91 1pr9 n GLY 62 Ca 0.02 -0.11 -0.41 0.00 0.00 0.00 0.00 46.02 45.51 1pr9 n GLY 62 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1pr9 s ASP 63 N -2.37 5.75 0.13 1.61 -1.08 -0.58 -4.84 116.67 115.29 1pr9 s ASP 63 Ca 0.25 -1.79 -0.21 0.00 -0.52 0.00 0.00 52.55 50.28 1pr9 s ASP 63 Cb 0.14 -2.03 -0.02 0.00 -1.46 0.00 0.00 42.92 39.55 1pr9 s ASP 63 CO 0.30 -0.67 1.69 -0.25 0.52 0.00 0.00 175.17 176.76 1pr9 h TRP 64 N 8.49 -0.20 -0.43 -5.34 2.91 -1.86 -0.52 115.95 119.00 1pr9 h TRP 64 Ca -0.23 0.02 -0.04 0.00 1.13 0.00 0.00 58.89 59.77 1pr9 h TRP 64 Cb 1.08 0.12 -0.02 0.00 -0.51 0.00 0.00 29.16 29.83 1pr9 h TRP 64 CO 0.64 -0.13 0.11 0.93 -1.03 0.00 0.00 178.44 178.96 1pr9 h GLU 65 N -0.06 0.69 -0.65 2.65 3.07 -1.96 -1.71 114.58 116.61 1pr9 h GLU 65 Ca 0.10 -0.16 -0.06 0.00 -0.50 0.00 0.00 59.36 58.74 1pr9 h GLU 65 Cb 0.21 -0.09 -0.03 0.00 -0.84 0.00 0.00 28.75 28.00 1pr9 h GLU 65 CO -0.22 0.69 0.18 0.00 -1.40 0.00 0.00 179.01 178.26 1pr9 h ALA 66 N 0.97 1.09 -0.34 3.43 0.00 -1.84 -2.35 119.26 120.23 1pr9 h ALA 66 Ca 0.14 -0.22 -0.02 0.00 0.00 0.00 0.00 54.91 54.81 1pr9 h ALA 66 Cb 0.31 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 1pr9 h ALA 66 CO 0.00 0.61 0.15 1.15 0.00 0.00 0.00 179.25 181.16 1pr9 h THR 67 N 0.96 1.17 -0.46 0.00 2.02 -0.82 0.23 112.91 116.01 1pr9 h THR 67 Ca 0.21 -0.52 0.06 0.00 0.77 0.00 0.00 66.41 66.94 1pr9 h THR 67 Cb 0.31 0.89 -0.05 0.00 -1.74 0.00 0.00 68.15 67.56 1pr9 h THR 67 CO -0.00 0.18 0.16 -0.08 0.37 0.00 0.00 175.52 176.15 1pr9 h GLU 68 N 0.40 0.32 -0.28 6.66 4.81 -1.24 0.40 114.58 125.64 1pr9 h GLU 68 Ca 0.11 -0.02 -0.10 0.00 -0.13 0.00 0.00 59.36 59.23 1pr9 h GLU 68 Cb 0.15 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 29.45 1pr9 h GLU 68 CO -0.01 0.21 -0.23 0.00 -0.73 0.00 0.00 179.01 178.24 1pr9 h ARG 69 N 0.33 0.54 -0.02 1.92 3.08 -0.98 0.75 114.38 119.99 1pr9 h ARG 69 Ca 0.22 -0.20 -0.23 0.00 0.07 0.00 0.00 59.98 59.84 1pr9 h ARG 69 Cb 0.23 -0.03 0.01 0.00 0.08 0.00 0.00 29.97 30.25 1pr9 h ARG 69 CO -0.23 0.74 -0.93 0.00 -1.07 0.00 0.00 179.97 178.48 1pr9 h ALA 70 N 1.27 0.32 -0.01 0.04 0.00 0.04 -3.38 119.26 117.56 1pr9 h ALA 70 Ca 0.07 -0.68 0.00 0.00 0.00 0.00 0.00 54.91 54.30 1pr9 h ALA 70 Cb 0.67 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.45 1pr9 h ALA 70 CO 0.05 0.76 -0.40 1.28 0.00 0.00 0.00 179.25 180.94 1pr9 n LEU 71 N -3.80 1.20 0.22 0.00 4.77 0.13 -4.54 117.00 114.98 1pr9 n LEU 71 Ca -0.08 -0.68 0.05 0.00 -0.03 0.00 0.00 56.01 55.28 1pr9 n LEU 71 Cb 0.82 0.00 0.49 0.00 -2.33 0.00 0.00 43.42 42.40 1pr9 n LEU 71 CO 0.52 0.24 0.87 1.23 -1.33 0.00 0.00 177.39 178.93 1pr9 h GLY 72 N 3.05 0.00 -3.69 -0.72 0.00 -1.02 -2.96 103.07 97.72 1pr9 h GLY 72 Ca 0.00 0.00 -0.56 0.00 0.00 0.00 0.00 47.33 46.77 1pr9 h GLY 72 CO 0.00 0.00 0.38 -1.14 0.00 0.00 0.00 176.54 175.78 1pr9 n SER 73 N -4.25 5.78 0.02 0.19 3.41 -1.26 -4.71 113.62 112.79 1pr9 n SER 73 Ca -0.02 -3.75 0.11 0.00 -0.26 0.00 0.00 58.87 54.94 1pr9 n SER 73 Cb 0.27 -0.79 -0.08 0.00 -0.26 0.00 0.00 64.21 63.36 1pr9 n SER 73 CO 0.00 0.00 0.00 0.55 -0.16 0.00 0.00 175.04 175.43 1pr9 n VAL 74 N -0.95 0.13 0.00 -3.33 3.14 -1.12 -5.08 118.33 111.12 1pr9 n VAL 74 Ca 0.55 -0.34 0.00 0.00 -2.96 0.00 0.00 64.34 61.59 1pr9 n VAL 74 Cb 0.95 0.19 0.00 0.00 -1.06 0.00 0.00 33.84 33.92 1pr9 n VAL 74 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1pr9 n GLY 75 N 1.33 -1.72 3.67 7.55 0.00 -1.26 -4.90 105.19 109.86 1pr9 n GLY 75 Ca -0.00 -2.05 -0.42 0.00 0.00 0.00 0.00 46.02 43.55 1pr9 n GLY 75 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1pr9 s PRO 76 N 0.00 4.23 -0.12 1.61 0.04 -1.26 -4.99 135.00 134.52 1pr9 s PRO 76 Ca 0.00 2.01 0.01 0.00 0.04 0.00 0.00 61.00 63.06 1pr9 s PRO 76 Cb 0.00 -3.75 0.02 0.00 0.04 0.00 0.00 34.50 30.81 1pr9 s PRO 76 CO 0.00 -0.70 -0.14 0.08 0.04 0.00 0.00 177.00 176.28 1pr9 s VAL 77 N 3.17 1.42 -0.12 -0.36 1.01 -1.26 -4.76 120.40 119.50 1pr9 s VAL 77 Ca 0.66 -0.58 0.06 0.00 0.00 0.00 0.00 61.98 62.12 1pr9 s VAL 77 Cb -0.31 -1.33 -0.24 0.00 0.00 0.00 0.00 36.38 34.51 1pr9 s VAL 77 CO 0.26 0.43 0.37 0.47 0.00 0.00 0.00 175.10 176.63 1pr9 n ASP 78 N 4.43 1.30 -3.99 3.32 10.43 0.30 -4.69 116.55 127.66 1pr9 n ASP 78 Ca -0.18 0.22 -0.15 0.00 2.57 0.00 0.00 54.79 57.25 1pr9 n ASP 78 Cb 0.51 -0.22 -0.14 0.00 1.84 0.00 0.00 41.12 43.11 1pr9 n ASP 78 CO 0.00 0.00 0.00 -0.76 -1.07 0.00 0.00 177.20 175.37 1pr9 s LEU 79 N -6.37 2.08 -0.03 0.64 1.43 -1.09 -3.48 118.68 111.85 1pr9 s LEU 79 Ca -0.15 -0.22 0.01 0.00 -1.03 0.00 0.00 54.13 52.74 1pr9 s LEU 79 Cb 0.07 -0.24 0.02 0.00 0.03 0.00 0.00 46.19 46.08 1pr9 s LEU 79 CO 0.78 -0.01 -0.04 -0.22 0.23 0.00 0.00 176.35 177.09 1pr9 s LEU 80 N -0.52 1.41 -0.25 1.79 2.96 -0.87 -0.29 118.68 122.92 1pr9 s LEU 80 Ca -0.01 -0.10 0.02 0.00 -0.22 0.00 0.00 54.13 53.81 1pr9 s LEU 80 Cb -0.04 -0.38 0.05 0.00 0.50 0.00 0.00 46.19 46.32 1pr9 s LEU 80 CO -0.00 -0.04 -0.12 -0.69 -1.32 0.00 0.00 176.35 174.18 1pr9 s VAL 81 N 0.75 2.22 -0.78 1.68 1.01 0.43 -1.03 120.40 124.68 1pr9 s VAL 81 Ca -0.09 -1.46 -0.20 0.00 0.00 0.00 0.00 61.98 60.23 1pr9 s VAL 81 Cb -0.12 -2.22 0.11 0.00 0.00 0.00 0.00 36.38 34.14 1pr9 s VAL 81 CO -0.00 0.09 1.00 0.20 0.00 0.00 0.00 175.10 176.39 1pr9 s ASN 82 N 1.16 6.41 -0.04 3.32 0.01 0.01 -1.63 114.94 124.18 1pr9 s ASN 82 Ca -0.06 -1.61 0.06 0.00 -0.71 0.00 0.00 52.86 50.55 1pr9 s ASN 82 Cb -0.18 -2.39 -0.09 0.00 0.41 0.00 0.00 41.25 39.00 1pr9 s ASN 82 CO -0.06 -1.19 0.08 -3.20 -1.51 0.00 0.00 177.10 171.22 1pr9 n ASN 83 N 6.85 3.50 -4.76 -1.22 2.85 -1.23 -0.79 115.26 120.46 1pr9 n ASN 83 Ca 0.09 0.00 -0.41 0.00 -0.11 0.00 0.00 54.58 54.15 1pr9 n ASN 83 Cb 0.47 0.97 -0.01 0.00 1.24 0.00 0.00 39.78 42.45 1pr9 n ASN 83 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1pr9 n ALA 84 N -1.98 2.44 -3.48 5.20 0.00 -1.18 -4.82 120.51 116.69 1pr9 n ALA 84 Ca -0.06 0.36 -0.11 0.00 0.00 0.00 0.00 53.44 53.63 1pr9 n ALA 84 Cb 0.44 -2.44 -0.02 0.00 0.00 0.00 0.00 19.45 17.43 1pr9 n ALA 84 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1pr9 s ALA 85 N -0.54 -1.58 0.03 0.00 0.00 -1.26 -4.63 121.76 113.78 1pr9 s ALA 85 Ca 0.59 0.44 0.08 0.00 0.00 0.00 0.00 51.96 53.07 1pr9 s ALA 85 Cb -0.49 0.85 -0.02 0.00 0.00 0.00 0.00 23.12 23.45 1pr9 s ALA 85 CO 0.56 -0.79 -0.23 0.14 0.00 0.00 0.00 175.76 175.44 1pr9 s VAL 86 N -3.71 1.82 -0.40 0.00 -7.23 -1.26 -5.03 120.40 104.59 1pr9 s VAL 86 Ca 0.02 -1.21 0.03 0.00 -1.81 0.00 0.00 61.98 59.01 1pr9 s VAL 86 Cb -0.02 -1.56 0.11 0.00 0.56 0.00 0.00 36.38 35.47 1pr9 s VAL 86 CO -0.10 0.30 0.13 0.00 -0.31 0.00 0.00 175.10 175.12 1pr9 s ALA 87 N -0.75 3.05 -0.46 1.32 0.00 -1.26 -4.94 121.76 118.71 1pr9 s ALA 87 Ca 0.09 -2.70 -0.13 0.00 0.00 0.00 0.00 51.96 49.22 1pr9 s ALA 87 Cb -0.09 -2.11 0.08 0.00 0.00 0.00 0.00 23.12 21.00 1pr9 s ALA 87 CO 0.01 -1.79 0.36 -0.51 0.00 0.00 0.00 175.76 173.84 1pr9 s LEU 88 N 0.69 5.53 -0.25 0.00 1.43 -1.26 -5.05 118.68 119.77 1pr9 s LEU 88 Ca 0.12 -1.47 -0.16 0.00 -1.03 0.00 0.00 54.13 51.59 1pr9 s LEU 88 Cb -0.21 -2.11 -0.04 0.00 0.03 0.00 0.00 46.19 43.87 1pr9 s LEU 88 CO -0.06 -0.64 0.40 -0.76 0.23 0.00 0.00 176.35 175.53 1pr9 s LEU 89 N 1.55 4.07 -0.04 1.79 1.43 -1.26 -4.61 118.68 121.61 1pr9 s LEU 89 Ca 0.04 0.38 -0.06 0.00 -1.03 0.00 0.00 54.13 53.46 1pr9 s LEU 89 Cb -0.25 -2.48 0.01 0.00 0.03 0.00 0.00 46.19 43.50 1pr9 s LEU 89 CO 0.04 -0.17 0.15 -1.10 0.23 0.00 0.00 176.35 175.50 1pr9 s GLN 90 N 1.90 0.30 0.41 1.70 -0.21 -0.84 -5.03 119.66 117.89 1pr9 s GLN 90 Ca 0.17 -0.02 -0.25 0.00 0.02 0.00 0.00 55.36 55.27 1pr9 s GLN 90 Cb -0.15 0.13 -0.10 0.00 1.00 0.00 0.00 33.01 33.89 1pr9 s GLN 90 CO 0.09 -0.06 1.21 -2.30 -2.12 0.00 0.00 175.29 172.11 1pr9 n PRO 91 N 2.39 1.79 -0.28 2.91 -0.02 -1.26 -4.30 135.00 136.24 1pr9 n PRO 91 Ca -0.16 0.64 0.09 0.00 -2.02 0.00 0.00 63.50 62.05 1pr9 n PRO 91 Cb 0.58 -2.29 0.23 0.00 -0.02 0.00 0.00 33.50 32.00 1pr9 n PRO 91 CO 0.00 0.00 0.00 0.35 1.98 0.00 0.00 175.50 177.83 1pr9 h PHE 92 N 1.99 0.18 0.00 6.00 3.57 -1.99 0.53 116.94 127.23 1pr9 h PHE 92 Ca -0.47 0.05 0.00 0.00 3.53 0.00 0.00 57.97 61.09 1pr9 h PHE 92 Cb 1.30 0.05 0.00 0.00 2.79 0.00 0.00 35.95 40.09 1pr9 h PHE 92 CO 0.47 -0.21 0.00 1.28 -2.23 0.00 0.00 178.31 177.62 1pr9 n LEU 93 N -5.27 0.00 -0.50 0.59 4.77 -1.26 -2.42 117.00 112.91 1pr9 n LEU 93 Ca 0.18 0.39 0.05 0.00 -0.03 0.00 0.00 56.01 56.60 1pr9 n LEU 93 Cb 0.58 -0.39 0.09 0.00 -2.33 0.00 0.00 43.42 41.38 1pr9 n LEU 93 CO 0.06 -0.13 0.52 -0.62 -1.33 0.00 0.00 177.39 175.89 1pr9 n GLU 94 N -1.39 1.71 -1.69 3.23 1.02 0.18 -5.01 120.64 118.68 1pr9 n GLU 94 Ca 0.07 -1.58 -0.44 0.00 -0.02 0.00 0.00 57.16 55.19 1pr9 n GLU 94 Cb 0.19 -1.22 -0.03 0.00 -0.02 0.00 0.00 31.44 30.36 1pr9 n GLU 94 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 1pr9 n VAL 95 N 0.50 0.29 -4.10 2.62 0.31 -0.84 -4.87 118.33 112.24 1pr9 n VAL 95 Ca 0.08 -0.07 -0.23 0.00 -0.01 0.00 0.00 64.34 64.12 1pr9 n VAL 95 Cb 0.34 -1.71 -0.04 0.00 -0.91 0.00 0.00 33.84 31.51 1pr9 n VAL 95 CO 0.00 0.00 0.00 0.42 -1.32 0.00 0.00 176.83 175.93 1pr9 s THR 96 N 0.71 4.52 0.22 2.52 -4.23 -1.26 -5.01 115.64 113.11 1pr9 s THR 96 Ca 0.74 -1.30 -0.08 0.00 -1.18 0.00 0.00 61.69 59.87 1pr9 s THR 96 Cb -0.60 -3.42 0.17 0.00 1.34 0.00 0.00 72.50 69.99 1pr9 s THR 96 CO 0.40 -0.30 1.73 0.50 -0.54 0.00 0.00 174.62 176.41 1pr9 h LYS 97 N 1.66 0.38 -0.39 3.99 3.64 -1.99 -1.38 116.57 122.48 1pr9 h LYS 97 Ca -0.49 -0.02 -0.04 0.00 -1.27 0.00 0.00 60.65 58.83 1pr9 h LYS 97 Cb 1.23 -0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 32.95 1pr9 h LYS 97 CO 0.61 0.25 0.07 0.93 -2.27 0.00 0.00 179.45 179.04 1pr9 h GLU 98 N 0.39 0.64 -0.66 1.90 3.07 -1.99 0.03 114.58 117.95 1pr9 h GLU 98 Ca 0.34 -0.17 -0.05 0.00 -0.50 0.00 0.00 59.36 58.99 1pr9 h GLU 98 Cb 0.48 -0.08 -0.03 0.00 -0.84 0.00 0.00 28.75 28.28 1pr9 h GLU 98 CO -0.36 0.69 0.22 0.00 -1.40 0.00 0.00 179.01 178.15 1pr9 h ALA 99 N 0.93 1.14 0.59 3.43 0.00 -1.89 -1.86 119.26 121.59 1pr9 h ALA 99 Ca 0.12 -0.20 -0.03 0.00 0.00 0.00 0.00 54.91 54.80 1pr9 h ALA 99 Cb 0.35 -0.26 0.01 0.00 0.00 0.00 0.00 17.79 17.88 1pr9 h ALA 99 CO 0.01 0.60 -0.28 0.35 0.00 0.00 0.00 179.25 179.92 1pr9 h PHE 100 N 0.97 -0.73 -0.29 0.00 3.57 -0.83 -1.91 116.94 117.72 1pr9 h PHE 100 Ca 0.22 -0.02 0.03 0.00 3.53 0.00 0.00 57.97 61.73 1pr9 h PHE 100 Cb 0.26 0.24 -0.03 0.00 2.79 0.00 0.00 35.95 39.21 1pr9 h PHE 100 CO 0.02 -0.45 0.12 -0.44 -2.23 0.00 0.00 178.31 175.33 1pr9 h ASP 101 N -0.81 0.15 -0.59 0.41 3.32 -0.74 -1.70 116.42 116.46 1pr9 h ASP 101 Ca -0.08 0.02 0.01 0.00 0.02 0.00 0.00 57.03 57.01 1pr9 h ASP 101 Cb 0.61 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 40.13 1pr9 h ASP 101 CO 0.13 0.12 0.38 -0.09 -1.72 0.00 0.00 179.24 178.07 1pr9 h ARG 102 N 0.26 0.75 -0.49 3.56 9.65 -1.38 -0.21 114.38 126.52 1pr9 h ARG 102 Ca 0.13 -0.04 -0.07 0.00 -1.10 0.00 0.00 59.98 58.90 1pr9 h ARG 102 Cb 0.08 -0.17 -0.02 0.00 -1.39 0.00 0.00 29.97 28.47 1pr9 h ARG 102 CO -0.11 0.49 0.05 0.77 2.80 0.00 0.00 179.97 183.97 1pr9 h SER 103 N 0.77 0.80 0.89 -3.80 0.02 -0.85 -2.56 113.55 108.83 1pr9 h SER 103 Ca 0.23 -0.28 -0.13 0.00 -0.84 0.00 0.00 61.79 60.77 1pr9 h SER 103 Cb -0.05 -0.21 -0.02 0.00 0.14 0.00 0.00 62.40 62.26 1pr9 h SER 103 CO -0.07 0.88 -0.60 -0.26 -1.14 0.00 0.00 176.83 175.64 1pr9 h PHE 104 N 0.70 0.00 -0.44 3.45 -1.00 -1.14 -0.51 116.94 118.00 1pr9 h PHE 104 Ca 0.15 0.00 -0.13 0.00 2.81 0.00 0.00 57.97 60.79 1pr9 h PHE 104 Cb 0.44 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 39.99 1pr9 h PHE 104 CO 0.03 0.60 -0.26 0.93 -1.61 0.00 0.00 178.31 178.01 1pr9 h GLU 105 N 0.00 0.93 0.01 1.51 5.08 -0.86 -0.06 114.58 121.19 1pr9 h GLU 105 Ca -0.01 -0.41 -0.11 0.00 -1.00 0.00 0.00 59.36 57.84 1pr9 h GLU 105 Cb 1.21 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 30.42 1pr9 h GLU 105 CO 0.08 1.07 -0.57 0.28 -1.00 0.00 0.00 179.01 178.87 1pr9 h VAL 106 N 0.79 1.42 0.00 3.13 2.07 -1.45 -1.79 116.25 120.42 1pr9 h VAL 106 Ca 0.10 -2.29 0.00 0.00 0.82 0.00 0.00 66.70 65.32 1pr9 h VAL 106 Cb 0.82 2.92 0.00 0.00 -1.52 0.00 0.00 31.29 33.51 1pr9 h VAL 106 CO 0.07 0.51 0.00 0.78 0.02 0.00 0.00 177.57 178.95 1pr9 h ASN 107 N -0.95 0.00 0.00 0.57 4.21 -1.21 -3.36 115.58 114.84 1pr9 h ASN 107 Ca -0.15 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.36 1pr9 h ASN 107 Cb 1.17 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 38.37 1pr9 h ASN 107 CO -0.07 0.00 -0.23 -0.11 -1.29 0.00 0.00 177.43 175.73 1pr9 n LEU 108 N -2.84 0.00 -0.21 1.61 7.94 -1.03 -4.71 117.00 117.77 1pr9 n LEU 108 Ca 0.04 0.01 -0.01 0.00 -1.11 0.00 0.00 56.01 54.94 1pr9 n LEU 108 Cb 0.49 0.01 0.21 0.00 0.53 0.00 0.00 43.42 44.65 1pr9 n LEU 108 CO 0.32 -0.39 1.15 -0.09 -1.11 0.00 0.00 177.39 177.27 1pr9 h ARG 109 N 0.00 0.98 -0.20 1.96 2.43 -1.02 -1.37 114.38 117.16 1pr9 h ARG 109 Ca 0.00 -0.11 -0.07 0.00 -0.81 0.00 0.00 59.98 58.99 1pr9 h ARG 109 Cb 0.23 -0.20 -0.01 0.00 -0.42 0.00 0.00 29.97 29.57 1pr9 h ARG 109 CO 0.00 0.72 -0.19 0.00 -1.51 0.00 0.00 179.97 178.99 1pr9 h ALA 110 N 1.43 1.32 -0.69 2.80 0.00 -1.47 -1.84 119.26 120.81 1pr9 h ALA 110 Ca 0.25 -0.27 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 1pr9 h ALA 110 Cb 0.03 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.68 1pr9 h ALA 110 CO -0.04 0.46 0.38 0.28 0.00 0.00 0.00 179.25 180.33 1pr9 h VAL 111 N 0.31 1.21 0.03 0.00 2.07 -1.47 -0.84 116.25 117.56 1pr9 h VAL 111 Ca 0.05 -0.51 -0.00 0.00 0.82 0.00 0.00 66.70 67.06 1pr9 h VAL 111 Cb 0.52 0.30 0.00 0.00 -1.52 0.00 0.00 31.29 30.59 1pr9 h VAL 111 CO 0.03 0.23 -0.01 0.40 0.02 0.00 0.00 177.57 178.24 1pr9 h ILE 112 N 0.94 1.09 0.03 4.57 2.04 -1.06 -2.03 117.51 123.09 1pr9 h ILE 112 Ca 0.24 -0.37 -0.00 0.00 1.00 0.00 0.00 64.86 65.73 1pr9 h ILE 112 Cb 0.02 1.34 0.00 0.00 -0.74 0.00 0.00 36.82 37.44 1pr9 h ILE 112 CO -0.04 0.09 -0.01 -0.61 0.00 0.00 0.00 178.15 177.58 1pr9 h GLN 113 N -0.20 -0.04 -0.56 2.37 4.15 -1.09 -0.72 115.11 119.03 1pr9 h GLN 113 Ca -0.00 0.00 -0.07 0.00 0.77 0.00 0.00 58.65 59.35 1pr9 h GLN 113 Cb 0.19 0.01 -0.02 0.00 0.21 0.00 0.00 27.48 27.86 1pr9 h GLN 113 CO 0.01 0.06 0.07 0.28 -1.93 0.00 0.00 178.83 177.32 1pr9 h VAL 114 N -0.13 1.26 -0.79 2.39 2.07 -1.22 -2.55 116.25 117.28 1pr9 h VAL 114 Ca -0.00 -1.00 0.01 0.00 0.82 0.00 0.00 66.70 66.52 1pr9 h VAL 114 Cb 0.12 0.82 -0.04 0.00 -1.52 0.00 0.00 31.29 30.67 1pr9 h VAL 114 CO 0.01 0.36 0.52 0.28 0.02 0.00 0.00 177.57 178.76 1pr9 h SER 115 N 0.82 0.90 -0.56 0.57 0.02 -1.23 -1.78 113.55 112.30 1pr9 h SER 115 Ca 0.17 -0.02 -0.01 0.00 -0.84 0.00 0.00 61.79 61.08 1pr9 h SER 115 Cb 0.44 -0.23 -0.03 0.00 0.14 0.00 0.00 62.40 62.73 1pr9 h SER 115 CO 0.01 0.66 0.32 1.56 -1.14 0.00 0.00 176.83 178.24 1pr9 h GLN 116 N 1.07 0.78 -0.40 3.45 4.20 -0.86 0.31 115.11 123.66 1pr9 h GLN 116 Ca 0.29 -0.08 -0.03 0.00 0.06 0.00 0.00 58.65 58.89 1pr9 h GLN 116 Cb -0.12 -0.16 -0.02 0.00 0.30 0.00 0.00 27.48 27.48 1pr9 h GLN 116 CO -0.06 0.59 0.14 0.82 -0.67 0.00 0.00 178.83 179.64 1pr9 h ILE 117 N 0.76 1.21 -0.26 2.54 2.04 -1.05 0.56 117.51 123.31 1pr9 h ILE 117 Ca 0.20 -0.66 -0.10 0.00 1.00 0.00 0.00 64.86 65.30 1pr9 h ILE 117 Cb 0.03 0.89 -0.00 0.00 -0.74 0.00 0.00 36.82 37.00 1pr9 h ILE 117 CO -0.03 0.23 -0.21 0.58 0.00 0.00 0.00 178.15 178.72 1pr9 h VAL 118 N 0.50 1.31 -0.62 1.67 2.07 -1.16 -3.05 116.25 116.96 1pr9 h VAL 118 Ca 0.13 -1.36 -0.07 0.00 0.82 0.00 0.00 66.70 66.22 1pr9 h VAL 118 Cb 0.23 1.62 -0.02 0.00 -1.52 0.00 0.00 31.29 31.59 1pr9 h VAL 118 CO -0.01 0.43 0.11 0.00 0.02 0.00 0.00 177.57 178.12 1pr9 h ALA 119 N 0.70 0.83 -0.60 1.67 0.00 -0.27 -2.13 119.26 119.45 1pr9 h ALA 119 Ca 0.05 -0.26 0.04 0.00 0.00 0.00 0.00 54.91 54.73 1pr9 h ALA 119 Cb 0.76 -0.24 -0.04 0.00 0.00 0.00 0.00 17.79 18.27 1pr9 h ALA 119 CO 0.05 0.58 0.35 0.00 0.00 0.00 0.00 179.25 180.24 1pr9 h ARG 120 N 0.94 0.67 -0.68 0.00 3.08 -0.89 -1.73 114.38 115.76 1pr9 h ARG 120 Ca 0.19 -0.04 -0.05 0.00 0.07 0.00 0.00 59.98 60.15 1pr9 h ARG 120 Cb 0.42 -0.15 -0.03 0.00 0.08 0.00 0.00 29.97 30.29 1pr9 h ARG 120 CO 0.01 0.44 0.22 0.78 -1.07 0.00 0.00 179.97 180.35 1pr9 h GLY 121 N 0.69 1.14 1.17 0.04 0.00 -1.42 -1.03 103.07 103.66 1pr9 h GLY 121 Ca 0.25 -0.67 -0.08 0.00 0.00 0.00 0.00 47.33 46.84 1pr9 h GLY 121 CO -0.13 0.62 0.07 1.41 0.00 0.00 0.00 176.54 178.51 1pr9 h LEU 122 N 1.00 0.97 -0.52 3.11 3.38 -1.03 -1.63 115.31 120.59 1pr9 h LEU 122 Ca 0.22 -0.23 -0.15 0.00 0.09 0.00 0.00 57.88 57.80 1pr9 h LEU 122 Cb 0.29 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.77 1pr9 h LEU 122 CO -0.01 0.98 -0.47 0.40 0.09 0.00 0.00 178.44 179.44 1pr9 h ILE 123 N 0.94 1.30 -0.65 1.22 2.04 -1.12 -0.46 117.51 120.78 1pr9 h ILE 123 Ca 0.18 -1.66 -0.04 0.00 1.00 0.00 0.00 64.86 64.34 1pr9 h ILE 123 Cb 0.45 1.60 -0.03 0.00 -0.74 0.00 0.00 36.82 38.10 1pr9 h ILE 123 CO 0.02 0.53 0.27 0.00 0.00 0.00 0.00 178.15 178.96 1pr9 h ALA 124 N 0.94 0.84 0.00 1.87 0.00 -0.96 -1.97 119.26 119.98 1pr9 h ALA 124 Ca 0.03 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.77 1pr9 h ALA 124 Cb 1.01 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.55 1pr9 h ALA 124 CO 0.10 0.45 0.00 0.54 0.00 0.00 0.00 179.25 180.34 1pr9 n ARG 125 N -4.42 0.15 -2.98 0.00 1.74 -0.63 -4.91 116.66 105.60 1pr9 n ARG 125 Ca 0.04 0.02 -0.19 0.00 -0.77 0.00 0.00 57.85 56.96 1pr9 n ARG 125 Cb 0.17 -1.50 0.04 0.00 -1.02 0.00 0.00 32.46 30.14 1pr9 n ARG 125 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1pr9 n GLY 126 N 1.26 -0.34 3.43 -0.13 0.00 -0.29 -5.02 105.19 104.11 1pr9 n GLY 126 Ca 0.09 0.01 -0.26 0.00 0.00 0.00 0.00 46.02 45.86 1pr9 n GLY 126 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1pr9 s VAL 127 N -3.11 2.38 0.66 1.61 -7.23 -0.56 -5.03 120.40 109.13 1pr9 s VAL 127 Ca 0.29 -2.11 -0.11 0.00 -1.81 0.00 0.00 61.98 58.24 1pr9 s VAL 127 Cb -0.13 -2.17 -0.01 0.00 0.56 0.00 0.00 36.38 34.63 1pr9 s VAL 127 CO 0.36 -0.18 1.05 -2.84 -0.31 0.00 0.00 175.10 173.18 1pr9 s PRO 128 N -2.85 3.25 0.08 4.82 0.02 -1.26 -4.60 135.00 134.46 1pr9 s PRO 128 Ca 0.23 0.85 -0.03 0.00 0.02 0.00 0.00 61.00 62.07 1pr9 s PRO 128 Cb -0.07 -2.03 0.01 0.00 0.02 0.00 0.00 34.50 32.43 1pr9 s PRO 128 CO 0.11 -0.85 0.16 0.41 -0.33 0.00 0.00 177.00 176.50 1pr9 n GLY 129 N -2.36 1.85 3.45 0.52 0.00 -0.72 -4.99 105.19 102.94 1pr9 n GLY 129 Ca 0.07 -1.08 -0.14 0.00 0.00 0.00 0.00 46.02 44.86 1pr9 n GLY 129 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1pr9 s ALA 130 N -1.26 -1.39 -0.05 4.61 0.00 -1.23 -2.01 121.76 120.43 1pr9 s ALA 130 Ca 0.03 1.39 0.03 0.00 0.00 0.00 0.00 51.96 53.41 1pr9 s ALA 130 Cb -0.01 -0.63 0.01 0.00 0.00 0.00 0.00 23.12 22.49 1pr9 s ALA 130 CO 0.03 -0.29 -0.14 0.42 0.00 0.00 0.00 175.76 175.78 1pr9 s ILE 131 N -0.18 1.26 -0.15 0.00 1.01 0.67 -2.05 121.20 121.75 1pr9 s ILE 131 Ca -0.04 -0.59 0.01 0.00 0.00 0.00 0.00 60.65 60.03 1pr9 s ILE 131 Cb -0.03 -1.12 0.00 0.00 0.01 0.00 0.00 42.46 41.32 1pr9 s ILE 131 CO 0.03 0.38 -0.16 -0.69 0.00 0.00 0.00 174.94 174.49 1pr9 s VAL 132 N 0.36 2.56 -0.22 2.92 1.01 -0.20 -1.15 120.40 125.68 1pr9 s VAL 132 Ca -0.10 -0.81 -0.11 0.00 0.00 0.00 0.00 61.98 60.97 1pr9 s VAL 132 Cb -0.14 -2.07 -0.05 0.00 0.00 0.00 0.00 36.38 34.12 1pr9 s VAL 132 CO 0.03 0.52 0.17 0.20 0.00 0.00 0.00 175.10 176.02 1pr9 s ASN 133 N 0.82 6.18 -0.43 3.32 0.01 0.32 -0.81 114.94 124.34 1pr9 s ASN 133 Ca -0.05 0.19 -0.22 0.00 -0.71 0.00 0.00 52.86 52.06 1pr9 s ASN 133 Cb -0.15 -2.11 0.02 0.00 0.41 0.00 0.00 41.25 39.42 1pr9 s ASN 133 CO -0.00 0.09 0.72 -0.69 -1.51 0.00 0.00 177.10 175.71 1pr9 s VAL 134 N 0.85 4.74 0.00 1.60 1.01 0.03 -1.57 120.40 127.06 1pr9 s VAL 134 Ca 0.09 0.35 0.00 0.00 0.00 0.00 0.00 61.98 62.41 1pr9 s VAL 134 Cb -0.13 -4.26 0.00 0.00 0.00 0.00 0.00 36.38 32.00 1pr9 s VAL 134 CO 0.03 -0.63 0.00 -0.24 0.00 0.00 0.00 175.10 174.26 1pr9 n SER 135 N 6.49 0.00 -3.52 3.32 2.88 0.66 -4.87 113.62 118.58 1pr9 n SER 135 Ca 0.01 0.00 -0.12 0.00 -1.33 0.00 0.00 58.87 57.43 1pr9 n SER 135 Cb 0.48 0.00 -0.04 0.00 -0.75 0.00 0.00 64.21 63.90 1pr9 n SER 135 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 1pr9 s SER 136 N -0.76 -0.46 0.44 -3.46 0.15 -1.25 -4.43 113.70 103.92 1pr9 s SER 136 Ca 0.00 0.31 0.16 0.00 0.70 0.00 0.00 55.95 57.11 1pr9 s SER 136 Cb 0.00 0.42 1.07 0.00 -1.71 0.00 0.00 66.02 65.81 1pr9 s SER 136 CO 0.00 -0.57 1.96 -0.61 1.20 0.00 0.00 173.24 175.22 1pr9 h GLN 137 N 2.43 0.36 0.00 5.44 4.15 -1.16 -0.82 115.11 125.51 1pr9 h GLN 137 Ca -0.23 -0.02 0.00 0.00 0.77 0.00 0.00 58.65 59.16 1pr9 h GLN 137 Cb 1.20 -0.08 0.00 0.00 0.21 0.00 0.00 27.48 28.81 1pr9 h GLN 137 CO 0.34 0.24 0.00 0.00 -1.93 0.00 0.00 178.83 177.47 1pr9 h SER 139 N 0.00 0.00 0.00 0.00 4.64 -1.40 -3.30 113.55 113.49 1pr9 h SER 139 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1pr9 h SER 139 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1pr9 h SER 139 CO 0.00 0.02 0.00 0.00 -0.87 0.00 0.00 176.83 175.98 1pr9 n GLN 140 N -3.14 -0.11 -3.85 4.77 6.02 -1.04 -4.08 117.38 115.95 1pr9 n GLN 140 Ca -0.01 -0.38 -0.20 0.00 -0.01 0.00 0.00 57.00 56.40 1pr9 n GLN 140 Cb 0.23 -0.74 -0.17 0.00 1.02 0.00 0.00 30.24 30.58 1pr9 n GLN 140 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.06 177.08 1pr9 s ARG 141 N -0.09 0.38 0.46 -1.09 1.81 -1.21 -5.14 118.95 114.06 1pr9 s ARG 141 Ca 0.00 0.12 -0.23 0.00 -1.72 0.00 0.00 55.73 53.90 1pr9 s ARG 141 Cb 0.00 -0.67 -0.07 0.00 -0.45 0.00 0.00 34.95 33.76 1pr9 s ARG 141 CO 0.00 -0.22 1.17 0.00 -0.68 0.00 0.00 175.30 175.58 1pr9 s ALA 142 N 1.51 2.98 -0.03 2.13 0.00 -1.26 -4.40 121.76 122.69 1pr9 s ALA 142 Ca -0.03 0.95 0.02 0.00 0.00 0.00 0.00 51.96 52.90 1pr9 s ALA 142 Cb -0.13 -3.39 0.01 0.00 0.00 0.00 0.00 23.12 19.61 1pr9 s ALA 142 CO -0.03 -0.68 -0.07 0.08 0.00 0.00 0.00 175.76 175.07 1pr9 s VAL 143 N -1.53 0.62 0.28 0.00 1.01 -1.26 -5.09 120.40 114.43 1pr9 s VAL 143 Ca 0.63 -0.24 -0.28 0.00 0.00 0.00 0.00 61.98 62.09 1pr9 s VAL 143 Cb -0.29 -0.59 -0.14 0.00 0.00 0.00 0.00 36.38 35.36 1pr9 s VAL 143 CO 0.35 0.22 0.96 0.41 0.00 0.00 0.00 175.10 177.04 1pr9 n THR 144 N 3.53 1.99 -0.93 3.92 -1.04 -1.26 -1.68 114.28 118.80 1pr9 n THR 144 Ca -0.20 -0.50 0.00 0.00 -2.04 0.00 0.00 64.05 61.31 1pr9 n THR 144 Cb 0.54 -0.90 0.00 0.00 -1.82 0.00 0.00 70.33 68.14 1pr9 n THR 144 CO 0.00 0.00 0.00 0.59 -0.64 0.00 0.00 175.07 175.02 1pr9 n ASN 145 N 1.30 -2.87 -0.96 8.00 3.02 -1.26 -4.86 115.26 117.63 1pr9 n ASN 145 Ca 0.10 0.00 -0.00 0.00 -0.03 0.00 0.00 54.58 54.65 1pr9 n ASN 145 Cb 0.31 -1.54 0.20 0.00 -0.61 0.00 0.00 39.78 38.15 1pr9 n ASN 145 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 1pr9 n HIS 146 N -2.39 0.75 0.06 3.10 8.25 -0.68 -1.98 115.22 122.33 1pr9 n HIS 146 Ca 0.00 -1.51 -0.12 0.00 -0.26 0.00 0.00 57.72 55.83 1pr9 n HIS 146 Cb 0.14 -0.41 -0.07 0.00 1.12 0.00 0.00 29.99 30.78 1pr9 n HIS 146 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 1pr9 h SER 147 N 1.00 -0.07 0.01 0.41 4.64 -1.78 0.21 113.55 117.97 1pr9 h SER 147 Ca 0.14 0.01 -0.00 0.00 -0.47 0.00 0.00 61.79 61.47 1pr9 h SER 147 Cb 1.45 0.03 0.00 0.00 -0.31 0.00 0.00 62.40 63.56 1pr9 h SER 147 CO 0.26 -0.05 -0.00 0.58 -0.87 0.00 0.00 176.83 176.75 1pr9 h VAL 148 N -0.07 1.27 -0.26 0.95 2.07 -1.87 -1.62 116.25 116.71 1pr9 h VAL 148 Ca 0.00 -0.81 0.04 0.00 0.82 0.00 0.00 66.70 66.75 1pr9 h VAL 148 Cb 0.06 1.82 -0.04 0.00 -1.52 0.00 0.00 31.29 31.61 1pr9 h VAL 148 CO -0.01 0.21 0.01 0.22 0.02 0.00 0.00 177.57 178.03 1pr9 h TYR 149 N -0.35 0.02 -0.50 1.57 3.20 -1.78 -0.55 116.97 118.57 1pr9 h TYR 149 Ca -0.00 0.02 -0.02 0.00 3.14 0.00 0.00 58.73 61.87 1pr9 h TYR 149 Cb 0.35 0.03 -0.02 0.00 1.54 0.00 0.00 36.73 38.63 1pr9 h TYR 149 CO 0.04 -0.02 0.22 0.00 -1.64 0.00 0.00 178.16 176.76 1pr9 h SER 151 N 0.70 0.82 -0.12 0.00 0.02 -0.58 0.19 113.55 114.58 1pr9 h SER 151 Ca 0.17 -0.24 -0.06 0.00 -0.84 0.00 0.00 61.79 60.83 1pr9 h SER 151 Cb 0.10 -0.22 -0.02 0.00 0.14 0.00 0.00 62.40 62.41 1pr9 h SER 151 CO -0.02 0.93 -0.09 0.71 -1.14 0.00 0.00 176.83 177.21 1pr9 h THR 152 N 0.76 1.21 0.09 -2.27 1.35 -0.52 0.61 112.91 114.13 1pr9 h THR 152 Ca 0.13 -0.90 -0.26 0.00 -0.55 0.00 0.00 66.41 64.83 1pr9 h THR 152 Cb 0.57 1.11 -0.00 0.00 -1.73 0.00 0.00 68.15 68.10 1pr9 h THR 152 CO 0.03 0.30 -1.17 0.11 -0.25 0.00 0.00 175.52 174.54 1pr9 h LYS 153 N 0.41 0.23 -0.74 4.72 1.79 -0.99 -0.92 116.57 121.07 1pr9 h LYS 153 Ca 0.08 -0.37 -0.05 0.00 -2.18 0.00 0.00 60.65 58.13 1pr9 h LYS 153 Cb 0.42 0.14 -0.03 0.00 -1.58 0.00 0.00 32.23 31.18 1pr9 h LYS 153 CO 0.02 1.16 0.25 0.78 -1.08 0.00 0.00 179.45 180.59 1pr9 h GLY 154 N 1.82 1.21 1.41 3.86 0.00 -0.45 -1.00 103.07 109.93 1pr9 h GLY 154 Ca -0.11 -0.69 -0.07 0.00 0.00 0.00 0.00 47.33 46.46 1pr9 h GLY 154 CO 0.19 0.65 -0.02 0.00 0.00 0.00 0.00 176.54 177.35 1pr9 h ALA 155 N 1.18 1.15 -0.47 3.60 0.00 -0.75 -2.93 119.26 121.04 1pr9 h ALA 155 Ca 0.24 -0.26 -0.05 0.00 0.00 0.00 0.00 54.91 54.85 1pr9 h ALA 155 Cb 0.27 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 1pr9 h ALA 155 CO -0.01 0.55 0.11 1.25 0.00 0.00 0.00 179.25 181.14 1pr9 h LEU 156 N 0.68 0.73 -0.33 0.00 5.85 -0.68 0.56 115.31 122.12 1pr9 h LEU 156 Ca 0.13 -0.24 0.05 0.00 0.84 0.00 0.00 57.88 58.67 1pr9 h LEU 156 Cb 0.45 -0.19 -0.05 0.00 0.37 0.00 0.00 40.66 41.24 1pr9 h LEU 156 CO 0.02 0.78 0.03 0.44 -0.34 0.00 0.00 178.44 179.37 1pr9 h ASP 157 N 0.64 -0.06 -0.10 1.25 5.19 -1.10 -0.84 116.42 121.41 1pr9 h ASP 157 Ca 0.15 0.06 -0.13 0.00 -0.62 0.00 0.00 57.03 56.49 1pr9 h ASP 157 Cb 0.34 0.10 -0.01 0.00 0.18 0.00 0.00 39.33 39.94 1pr9 h ASP 157 CO 0.00 0.01 -0.37 -0.03 -3.12 0.00 0.00 179.24 175.73 1pr9 h MET 158 N 0.14 0.61 -0.77 3.56 4.05 -1.31 -2.78 114.93 118.42 1pr9 h MET 158 Ca 0.16 -0.30 0.02 0.00 -0.28 0.00 0.00 59.70 59.30 1pr9 h MET 158 Cb 0.19 -0.00 -0.04 0.00 -0.80 0.00 0.00 31.60 30.95 1pr9 h MET 158 CO -0.23 0.89 0.50 1.25 0.23 0.00 0.00 176.91 179.54 1pr9 h LEU 159 N 0.51 0.84 -0.81 3.39 5.85 -0.46 -1.77 115.31 122.85 1pr9 h LEU 159 Ca 0.05 -0.01 0.15 0.00 0.84 0.00 0.00 57.88 58.91 1pr9 h LEU 159 Cb 0.87 -0.19 -0.10 0.00 0.37 0.00 0.00 40.66 41.61 1pr9 h LEU 159 CO 0.08 0.59 0.37 0.74 -0.34 0.00 0.00 178.44 179.87 1pr9 h THR 160 N 0.99 0.66 -0.25 1.05 2.02 -0.91 0.11 112.91 116.58 1pr9 h THR 160 Ca 0.30 -0.18 -0.13 0.00 0.77 0.00 0.00 66.41 67.17 1pr9 h THR 160 Cb -0.03 0.11 -0.00 0.00 -1.74 0.00 0.00 68.15 66.49 1pr9 h THR 160 CO -0.10 0.09 -0.37 0.11 0.37 0.00 0.00 175.52 175.63 1pr9 h LYS 161 N 0.51 0.69 -0.25 6.66 1.57 -1.10 -0.17 116.57 124.49 1pr9 h LYS 161 Ca 0.45 -0.41 -0.16 0.00 -1.87 0.00 0.00 60.65 58.66 1pr9 h LYS 161 Cb 0.69 0.04 -0.01 0.00 0.08 0.00 0.00 32.23 33.03 1pr9 h LYS 161 CO -0.40 1.03 -0.50 0.28 -0.57 0.00 0.00 179.45 179.28 1pr9 h VAL 162 N 0.41 1.30 -0.17 0.50 2.07 -0.70 -1.65 116.25 118.02 1pr9 h VAL 162 Ca 0.02 -1.71 0.03 0.00 0.82 0.00 0.00 66.70 65.86 1pr9 h VAL 162 Cb 0.96 1.65 -0.03 0.00 -1.52 0.00 0.00 31.29 32.35 1pr9 h VAL 162 CO 0.09 0.55 -0.00 0.24 0.02 0.00 0.00 177.57 178.46 1pr9 h MET 163 N 0.54 0.05 -0.85 1.57 2.86 -0.75 -0.55 114.93 117.79 1pr9 h MET 163 Ca 0.02 -0.00 0.12 0.00 -2.06 0.00 0.00 59.70 57.78 1pr9 h MET 163 Cb 1.06 -0.01 -0.08 0.00 0.06 0.00 0.00 31.60 32.63 1pr9 h MET 163 CO 0.10 0.03 0.47 0.00 1.06 0.00 0.00 176.91 178.58 1pr9 h ALA 164 N 1.14 1.26 0.30 6.32 0.00 -0.83 0.94 119.26 128.39 1pr9 h ALA 164 Ca 0.08 0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.03 1pr9 h ALA 164 Cb 0.10 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.80 1pr9 h ALA 164 CO -0.13 0.02 -0.14 1.25 0.00 0.00 0.00 179.25 180.24 1pr9 h LEU 165 N 0.73 -0.34 -0.85 0.00 5.85 -0.68 -1.37 115.31 118.65 1pr9 h LEU 165 Ca 0.44 -0.16 -0.10 0.00 0.84 0.00 0.00 57.88 58.90 1pr9 h LEU 165 Cb 0.52 0.09 -0.01 0.00 0.37 0.00 0.00 40.66 41.62 1pr9 h LEU 165 CO -0.30 -0.02 -0.47 -0.33 -0.34 0.00 0.00 178.44 176.98 1pr9 h GLU 166 N -0.68 0.00 -0.00 1.25 5.08 -0.89 -3.22 114.58 116.12 1pr9 h GLU 166 Ca -0.04 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.32 1pr9 h GLU 166 Cb 0.47 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.72 1pr9 h GLU 166 CO 0.07 0.47 -0.90 1.28 -1.00 0.00 0.00 179.01 178.93 1pr9 n LEU 167 N -3.62 0.96 -0.20 1.33 4.77 0.30 -4.35 117.00 116.19 1pr9 n LEU 167 Ca -0.01 -0.43 0.00 0.00 -0.03 0.00 0.00 56.01 55.55 1pr9 n LEU 167 Cb 0.56 -0.04 0.08 0.00 -2.33 0.00 0.00 43.42 41.69 1pr9 n LEU 167 CO 0.39 0.24 0.79 1.23 -1.33 0.00 0.00 177.39 178.70 1pr9 h GLY 168 N 4.99 0.56 2.00 -0.72 0.00 -1.26 -0.46 103.07 108.19 1pr9 h GLY 168 Ca 0.00 0.14 -0.00 0.00 0.00 0.00 0.00 47.33 47.47 1pr9 h GLY 168 CO 0.00 -0.22 -0.00 -2.55 0.00 0.00 0.00 176.54 173.77 1pr9 h PRO 169 N 0.06 0.00 -0.46 4.80 0.11 -1.78 -1.79 132.00 132.94 1pr9 h PRO 169 Ca 0.31 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.42 1pr9 h PRO 169 Cb 0.50 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.61 1pr9 h PRO 169 CO -0.58 0.00 0.00 0.72 -0.21 0.00 0.00 178.00 177.93 1pr9 n HIS 170 N -3.14 0.61 -2.77 0.65 8.25 -0.20 -4.94 115.22 113.69 1pr9 n HIS 170 Ca -0.02 -0.31 -0.18 0.00 -0.26 0.00 0.00 57.72 56.95 1pr9 n HIS 170 Cb 0.11 0.00 0.02 0.00 1.12 0.00 0.00 29.99 31.24 1pr9 n HIS 170 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 1pr9 n LYS 171 N 0.85 -3.50 -4.10 -0.41 5.02 -0.67 -4.64 118.16 110.71 1pr9 n LYS 171 Ca 0.15 0.76 -0.34 0.00 -2.02 0.00 0.00 58.31 56.87 1pr9 n LYS 171 Cb 0.39 -5.26 -0.15 0.00 -0.02 0.00 0.00 35.03 29.99 1pr9 n LYS 171 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1pr9 s ILE 172 N -3.02 2.88 0.13 -0.18 1.01 -1.13 -1.76 121.20 119.13 1pr9 s ILE 172 Ca 0.20 -0.67 -0.11 0.00 0.00 0.00 0.00 60.65 60.07 1pr9 s ILE 172 Cb -0.09 -2.27 -0.06 0.00 0.01 0.00 0.00 42.46 40.05 1pr9 s ILE 172 CO 0.25 0.48 0.46 -0.13 0.00 0.00 0.00 174.94 176.00 1pr9 s ARG 173 N 1.26 3.82 -0.08 2.79 0.52 -0.85 -3.87 118.95 122.54 1pr9 s ARG 173 Ca 0.03 0.26 -0.01 0.00 -0.52 0.00 0.00 55.73 55.49 1pr9 s ARG 173 Cb -0.14 -2.92 0.03 0.00 0.52 0.00 0.00 34.95 32.44 1pr9 s ARG 173 CO -0.05 0.49 -0.00 0.08 0.02 0.00 0.00 175.30 175.84 1pr9 s VAL 174 N -1.50 0.43 0.21 3.52 1.01 -1.26 -0.24 120.40 122.57 1pr9 s VAL 174 Ca 0.37 0.04 0.02 0.00 0.00 0.00 0.00 61.98 62.41 1pr9 s VAL 174 Cb -0.14 -0.61 -0.05 0.00 0.00 0.00 0.00 36.38 35.59 1pr9 s VAL 174 CO 0.19 0.23 0.04 0.20 0.00 0.00 0.00 175.10 175.76 1pr9 s ASN 175 N 1.95 1.22 0.10 3.32 0.01 -0.30 0.23 114.94 121.46 1pr9 s ASN 175 Ca 0.05 -1.27 0.10 0.00 -0.71 0.00 0.00 52.86 51.03 1pr9 s ASN 175 Cb -0.13 0.14 -0.04 0.00 0.41 0.00 0.00 41.25 41.63 1pr9 s ASN 175 CO -0.06 -0.64 -0.26 0.00 -1.51 0.00 0.00 177.10 174.63 1pr9 s ALA 176 N -3.69 2.30 -0.05 0.60 0.00 0.11 -0.53 121.76 120.50 1pr9 s ALA 176 Ca 0.30 -1.38 0.02 0.00 0.00 0.00 0.00 51.96 50.90 1pr9 s ALA 176 Cb 0.07 -0.41 -0.03 0.00 0.00 0.00 0.00 23.12 22.75 1pr9 s ALA 176 CO 0.08 0.53 -0.11 0.14 0.00 0.00 0.00 175.76 176.40 1pr9 s VAL 177 N -0.97 3.35 -0.61 0.00 -7.23 -0.61 -0.99 120.40 113.35 1pr9 s VAL 177 Ca 0.13 -0.63 0.05 0.00 -1.81 0.00 0.00 61.98 59.72 1pr9 s VAL 177 Cb -0.10 -2.34 0.17 0.00 0.56 0.00 0.00 36.38 34.67 1pr9 s VAL 177 CO 0.04 0.59 0.44 0.20 -0.31 0.00 0.00 175.10 176.06 1pr9 s ASN 178 N -0.79 3.68 0.51 4.85 -0.87 0.02 -0.24 114.94 122.09 1pr9 s ASN 178 Ca 0.12 -3.59 -0.18 0.00 -1.57 0.00 0.00 52.86 47.64 1pr9 s ASN 178 Cb -0.11 -1.23 -0.08 0.00 -0.02 0.00 0.00 41.25 39.82 1pr9 s ASN 178 CO 0.01 -0.11 1.01 -2.84 -2.57 0.00 0.00 177.10 172.60 1pr9 s PRO 179 N -0.94 3.80 0.00 -0.60 0.02 -1.26 -1.57 135.00 134.45 1pr9 s PRO 179 Ca 0.27 1.15 0.00 0.00 0.02 0.00 0.00 61.00 62.45 1pr9 s PRO 179 Cb -0.02 -2.11 0.00 0.00 0.02 0.00 0.00 34.50 32.39 1pr9 s PRO 179 CO -0.18 -0.40 0.00 -2.37 -0.33 0.00 0.00 177.00 173.72 1pr9 n THR 180 N -1.36 0.00 -1.71 0.99 5.66 -0.88 -0.98 114.28 115.99 1pr9 n THR 180 Ca 0.08 0.00 -0.43 0.00 -3.05 0.00 0.00 64.05 60.65 1pr9 n THR 180 Cb 0.53 -1.42 -0.01 0.00 -1.55 0.00 0.00 70.33 67.88 1pr9 n THR 180 CO 0.00 0.00 0.00 0.52 -3.05 0.00 0.00 175.07 172.54 1pr9 n VAL 181 N -1.88 1.64 -4.76 1.08 0.31 -1.26 -4.80 118.33 108.65 1pr9 n VAL 181 Ca 0.00 -0.41 -0.24 0.00 -0.01 0.00 0.00 64.34 63.68 1pr9 n VAL 181 Cb 0.00 -1.69 -0.15 0.00 -0.91 0.00 0.00 33.84 31.09 1pr9 n VAL 181 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 1pr9 s VAL 182 N -0.72 1.27 -0.26 2.52 1.01 -1.26 -2.21 120.40 120.74 1pr9 s VAL 182 Ca 0.59 -0.68 -0.04 0.00 0.00 0.00 0.00 61.98 61.85 1pr9 s VAL 182 Cb -0.56 -1.06 -0.02 0.00 0.00 0.00 0.00 36.38 34.75 1pr9 s VAL 182 CO 0.58 0.36 2.85 0.23 0.00 0.00 0.00 175.10 179.12 1pr9 n MET 183 N 2.72 2.08 -0.53 2.72 2.81 -1.26 -3.28 117.12 122.39 1pr9 n MET 183 Ca -0.15 -1.65 -0.12 0.00 -1.81 0.00 0.00 57.70 53.97 1pr9 n MET 183 Cb 0.54 -1.93 0.10 0.00 -0.71 0.00 0.00 33.22 31.22 1pr9 n MET 183 CO 0.00 0.00 0.00 0.25 1.51 0.00 0.00 175.97 177.73 1pr9 n THR 184 N 1.32 0.00 -0.32 2.03 -2.24 -1.26 -4.61 114.28 109.19 1pr9 n THR 184 Ca 0.40 -0.26 0.09 0.00 -2.27 0.00 0.00 64.05 62.01 1pr9 n THR 184 Cb 0.66 -1.29 0.29 0.00 -2.10 0.00 0.00 70.33 67.89 1pr9 n THR 184 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 1pr9 h SER 185 N -1.44 0.83 -0.72 3.42 4.64 -1.98 0.52 113.55 118.82 1pr9 h SER 185 Ca -0.17 0.04 -0.06 0.00 -0.47 0.00 0.00 61.79 61.13 1pr9 h SER 185 Cb 0.51 -0.13 -0.03 0.00 -0.31 0.00 0.00 62.40 62.45 1pr9 h SER 185 CO 0.12 0.44 0.21 -0.03 -0.87 0.00 0.00 176.83 176.70 1pr9 h MET 186 N 0.89 1.13 0.11 4.77 -1.53 -1.91 -2.57 114.93 115.83 1pr9 h MET 186 Ca 0.47 -0.25 -0.27 0.00 -3.44 0.00 0.00 59.70 56.21 1pr9 h MET 186 Cb 0.54 -0.16 0.01 0.00 -0.55 0.00 0.00 31.60 31.44 1pr9 h MET 186 CO -0.23 0.98 -1.21 0.78 0.14 0.00 0.00 176.91 177.37 1pr9 h GLY 187 N 1.08 0.34 2.00 1.39 0.00 -1.11 -3.31 103.07 103.46 1pr9 h GLY 187 Ca 0.23 -0.81 -0.06 0.00 0.00 0.00 0.00 47.33 46.69 1pr9 h GLY 187 CO -0.00 0.71 -0.29 1.46 0.00 0.00 0.00 176.54 178.41 1pr9 h GLN 188 N 0.10 0.00 0.00 4.80 7.50 0.04 -2.35 115.11 125.20 1pr9 h GLN 188 Ca -0.13 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.02 1pr9 h GLN 188 Cb 1.92 0.00 0.00 0.00 0.05 0.00 0.00 27.48 29.45 1pr9 h GLN 188 CO 0.20 0.29 0.00 0.00 -1.50 0.00 0.00 178.83 177.82 1pr9 h ALA 189 N 1.71 1.00 0.00 3.87 0.00 -1.54 -3.30 119.26 120.99 1pr9 h ALA 189 Ca -0.00 0.00 -0.21 0.00 0.00 0.00 0.00 54.91 54.69 1pr9 h ALA 189 Cb 0.61 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.37 1pr9 h ALA 189 CO 0.04 0.00 -1.71 2.41 0.00 0.00 0.00 179.25 179.99 1pr9 n THR 190 N -3.09 0.70 -0.71 0.00 -1.04 -1.15 -4.79 114.28 104.20 1pr9 n THR 190 Ca 0.01 -0.18 0.09 0.00 -2.04 0.00 0.00 64.05 61.93 1pr9 n THR 190 Cb 0.34 -1.67 0.38 0.00 -1.82 0.00 0.00 70.33 67.55 1pr9 n THR 190 CO 0.00 0.00 0.00 0.79 -0.64 0.00 0.00 175.07 175.22 1pr9 n TRP 191 N -3.57 1.66 0.13 -1.42 7.02 -0.89 -4.32 117.44 116.06 1pr9 n TRP 191 Ca -0.25 -0.64 0.02 0.00 -1.02 0.00 0.00 57.50 55.61 1pr9 n TRP 191 Cb 0.68 -0.32 0.01 0.00 -2.42 0.00 0.00 31.31 29.26 1pr9 n TRP 191 CO 0.00 0.00 0.00 0.66 -2.02 0.00 0.00 177.69 176.33 1pr9 h SER 192 N 4.10 0.00 -2.75 -0.99 4.64 -1.74 -3.33 113.55 113.48 1pr9 h SER 192 Ca 0.00 0.00 -0.52 0.00 -0.47 0.00 0.00 61.79 60.80 1pr9 h SER 192 Cb 1.61 0.00 0.05 0.00 -0.31 0.00 0.00 62.40 63.74 1pr9 h SER 192 CO 0.30 0.51 0.94 -0.62 -0.87 0.00 0.00 176.83 177.10 1pr9 s ASP 193 N -6.39 6.52 0.31 4.97 2.15 -1.26 -4.87 116.67 118.09 1pr9 s ASP 193 Ca 0.03 2.68 -0.00 0.00 0.43 0.00 0.00 52.55 55.69 1pr9 s ASP 193 Cb 0.08 -2.59 0.48 0.00 -0.30 0.00 0.00 42.92 40.59 1pr9 s ASP 193 CO 0.75 -0.88 1.91 -0.65 -0.17 0.00 0.00 175.17 176.13 1pr9 h PRO 194 N 7.03 0.87 0.00 4.34 0.11 -1.98 0.14 132.00 142.51 1pr9 h PRO 194 Ca -0.43 -0.11 -0.02 0.00 0.11 0.00 0.00 66.00 65.54 1pr9 h PRO 194 Cb 1.20 -0.16 -0.00 0.00 0.11 0.00 0.00 31.00 32.15 1pr9 h PRO 194 CO 0.93 0.68 -0.12 1.25 -0.21 0.00 0.00 178.00 180.53 1pr9 h HIS 195 N 0.87 0.00 0.43 0.65 -0.00 -1.95 -2.58 115.15 112.57 1pr9 h HIS 195 Ca 0.21 0.00 -0.02 0.00 -0.00 0.00 0.00 60.37 60.56 1pr9 h HIS 195 Cb 0.10 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 27.51 1pr9 h HIS 195 CO 0.01 0.12 -0.21 0.87 -0.00 0.00 0.00 177.93 178.72 1pr9 h LYS 196 N 0.00 -0.55 -0.11 5.26 1.79 -1.07 -3.15 116.57 118.74 1pr9 h LYS 196 Ca -0.00 0.04 0.03 0.00 -2.18 0.00 0.00 60.65 58.54 1pr9 h LYS 196 Cb 0.41 0.13 -0.00 0.00 -1.58 0.00 0.00 32.23 31.18 1pr9 h LYS 196 CO 0.02 -0.31 0.09 0.00 -1.08 0.00 0.00 179.45 178.16 1pr9 h ALA 197 N -1.00 1.97 -0.07 3.86 0.00 -1.43 -2.71 119.26 119.87 1pr9 h ALA 197 Ca -0.06 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 1pr9 h ALA 197 Cb 0.50 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.29 1pr9 h ALA 197 CO 0.10 -0.14 0.02 -0.22 0.00 0.00 0.00 179.25 179.00 1pr9 h LYS 198 N 0.00 0.11 -0.72 0.00 1.63 -1.50 0.85 116.57 116.95 1pr9 h LYS 198 Ca 0.05 -0.03 0.13 0.00 -0.85 0.00 0.00 60.65 59.95 1pr9 h LYS 198 Cb 0.23 -0.01 -0.09 0.00 -0.60 0.00 0.00 32.23 31.76 1pr9 h LYS 198 CO -0.00 0.30 0.28 1.15 -3.45 0.00 0.00 179.45 177.74 1pr9 h THR 199 N -0.10 0.69 0.20 1.00 2.02 -1.44 -2.20 112.91 113.09 1pr9 h THR 199 Ca 0.02 -0.15 -0.32 0.00 0.77 0.00 0.00 66.41 66.73 1pr9 h THR 199 Cb 0.24 0.21 0.02 0.00 -1.74 0.00 0.00 68.15 66.89 1pr9 h THR 199 CO 0.00 0.08 -1.45 -0.03 0.37 0.00 0.00 175.52 174.50 1pr9 h MET 200 N 0.44 0.43 -0.96 6.66 1.85 -1.60 -3.34 114.93 118.42 1pr9 h MET 200 Ca 0.38 -0.73 0.07 0.00 -0.61 0.00 0.00 59.70 58.81 1pr9 h MET 200 Cb 0.55 0.27 -0.06 0.00 0.43 0.00 0.00 31.60 32.79 1pr9 h MET 200 CO -0.37 1.34 0.62 -0.07 -0.40 0.00 0.00 176.91 178.02 1pr9 h LEU 201 N 0.12 0.97 -1.25 3.39 -0.00 -0.51 0.84 115.31 118.86 1pr9 h LEU 201 Ca -0.23 0.01 0.00 0.00 -0.00 0.00 0.00 57.88 57.66 1pr9 h LEU 201 Cb 2.10 -0.20 0.00 0.00 -0.00 0.00 0.00 40.66 42.56 1pr9 h LEU 201 CO 0.24 0.61 0.00 0.78 -0.00 0.00 0.00 178.44 180.07 1pr9 h ASN 202 N 1.09 0.00 -0.56 -0.43 2.35 -1.52 -2.10 115.58 114.41 1pr9 h ASN 202 Ca 0.42 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.17 1pr9 h ASN 202 Cb 0.21 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.58 1pr9 h ASN 202 CO -0.17 0.00 0.00 0.54 -1.65 0.00 0.00 177.43 176.15 1pr9 n ARG 203 N -2.55 2.58 -3.78 0.81 1.74 0.28 -4.80 116.66 110.93 1pr9 n ARG 203 Ca 0.01 -2.42 -0.37 0.00 -0.77 0.00 0.00 57.85 54.29 1pr9 n ARG 203 Cb 0.20 -1.54 -0.12 0.00 -1.02 0.00 0.00 32.46 29.98 1pr9 n ARG 203 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1pr9 s ILE 204 N -1.26 3.55 0.35 0.55 1.01 -0.79 -4.33 121.20 120.27 1pr9 s ILE 204 Ca 0.44 -1.32 0.13 0.00 0.00 0.00 0.00 60.65 59.89 1pr9 s ILE 204 Cb 0.24 -3.08 0.34 0.00 0.01 0.00 0.00 42.46 39.97 1pr9 s ILE 204 CO 0.32 -0.24 1.75 -0.65 0.00 0.00 0.00 174.94 176.12 1pr9 h PRO 205 N 8.16 0.50 -0.01 2.79 0.11 -1.80 0.47 132.00 142.22 1pr9 h PRO 205 Ca -0.21 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.87 1pr9 h PRO 205 Cb 1.07 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 32.07 1pr9 h PRO 205 CO 0.61 0.33 0.00 1.28 -0.21 0.00 0.00 178.00 180.01 1pr9 n LEU 206 N -4.78 0.50 -3.72 2.35 4.77 -1.05 -4.92 117.00 110.16 1pr9 n LEU 206 Ca 0.26 -0.17 -0.26 0.00 -0.03 0.00 0.00 56.01 55.81 1pr9 n LEU 206 Cb 0.79 -0.00 0.06 0.00 -2.33 0.00 0.00 43.42 41.94 1pr9 n LEU 206 CO 0.20 0.09 0.17 0.61 -1.33 0.00 0.00 177.39 177.13 1pr9 n GLY 207 N 1.05 -0.51 3.67 -0.72 0.00 0.16 -4.98 105.19 103.87 1pr9 n GLY 207 Ca 0.22 0.22 -0.08 0.00 0.00 0.00 0.00 46.02 46.38 1pr9 n GLY 207 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1pr9 s LYS 208 N -6.37 1.43 0.55 1.61 -2.85 -1.26 -5.07 119.74 107.77 1pr9 s LYS 208 Ca 0.56 -0.70 -0.04 0.00 -1.00 0.00 0.00 55.97 54.79 1pr9 s LYS 208 Cb -0.26 0.55 0.01 0.00 -2.06 0.00 0.00 37.83 36.06 1pr9 s LYS 208 CO 0.77 -0.64 0.83 -0.06 0.10 0.00 0.00 175.35 176.35 1pr9 s PHE 209 N -3.68 3.23 0.34 1.78 0.08 -1.26 -4.85 117.98 113.62 1pr9 s PHE 209 Ca 0.07 0.50 -0.26 0.00 0.12 0.00 0.00 56.93 57.36 1pr9 s PHE 209 Cb -0.03 -2.61 -0.09 0.00 -0.57 0.00 0.00 43.02 39.72 1pr9 s PHE 209 CO -0.02 -0.68 1.00 0.00 -0.10 0.00 0.00 175.22 175.42 1pr9 s ALA 210 N -2.85 3.20 0.23 5.36 0.00 -0.94 -5.04 121.76 121.72 1pr9 s ALA 210 Ca 0.52 0.63 -0.03 0.00 0.00 0.00 0.00 51.96 53.08 1pr9 s ALA 210 Cb -0.10 -3.23 -0.05 0.00 0.00 0.00 0.00 23.12 19.74 1pr9 s ALA 210 CO 0.43 0.01 0.46 -1.21 0.00 0.00 0.00 175.76 175.44 1pr9 s GLU 211 N -2.07 3.59 0.28 0.00 0.41 -1.26 -4.01 118.70 115.64 1pr9 s GLU 211 Ca 0.51 -0.15 0.02 0.00 -0.41 0.00 0.00 54.97 54.95 1pr9 s GLU 211 Cb -0.22 -2.76 0.67 0.00 -1.78 0.00 0.00 34.13 30.04 1pr9 s GLU 211 CO 0.28 0.34 1.71 0.28 -0.49 0.00 0.00 175.26 177.37 1pr9 h VAL 212 N 1.56 0.53 -0.26 2.63 2.07 -1.98 -1.54 116.25 119.27 1pr9 h VAL 212 Ca -0.47 -0.15 -0.04 0.00 0.82 0.00 0.00 66.70 66.86 1pr9 h VAL 212 Cb 1.19 0.05 -0.01 0.00 -1.52 0.00 0.00 31.29 30.99 1pr9 h VAL 212 CO 0.68 0.08 -0.00 1.05 0.02 0.00 0.00 177.57 179.40 1pr9 h GLU 213 N 0.44 0.39 -0.72 1.57 4.11 -1.98 -0.21 114.58 118.18 1pr9 h GLU 213 Ca 0.53 -0.07 -0.02 0.00 0.07 0.00 0.00 59.36 59.87 1pr9 h GLU 213 Cb 0.95 -0.06 -0.03 0.00 0.50 0.00 0.00 28.75 30.11 1pr9 h GLU 213 CO -0.49 0.42 0.35 0.45 0.07 0.00 0.00 179.01 179.81 1pr9 h HIS 214 N 0.38 1.00 -0.14 2.06 3.86 -1.68 -0.18 115.15 120.45 1pr9 h HIS 214 Ca 0.09 -0.04 -0.10 0.00 -1.16 0.00 0.00 60.37 59.16 1pr9 h HIS 214 Cb 0.26 -0.32 0.00 0.00 1.06 0.00 0.00 27.41 28.41 1pr9 h HIS 214 CO 0.01 0.72 -0.31 0.28 0.86 0.00 0.00 177.93 179.49 1pr9 h VAL 215 N 1.01 1.36 -0.77 2.45 2.07 -1.02 -2.95 116.25 118.41 1pr9 h VAL 215 Ca 0.25 -1.58 0.01 0.00 0.82 0.00 0.00 66.70 66.20 1pr9 h VAL 215 Cb 0.09 2.02 -0.04 0.00 -1.52 0.00 0.00 31.29 31.84 1pr9 h VAL 215 CO -0.03 0.47 0.51 0.58 0.02 0.00 0.00 177.57 179.12 1pr9 h VAL 216 N 0.07 1.20 -0.79 2.57 2.07 -0.94 -0.70 116.25 119.72 1pr9 h VAL 216 Ca 0.00 -0.36 0.11 0.00 0.82 0.00 0.00 66.70 67.27 1pr9 h VAL 216 Cb 0.91 0.07 -0.08 0.00 -1.52 0.00 0.00 31.29 30.67 1pr9 h VAL 216 CO 0.07 0.19 0.42 0.78 0.02 0.00 0.00 177.57 179.05 1pr9 h ASN 217 N 1.04 0.57 -0.40 0.57 2.35 -0.98 0.10 115.58 118.82 1pr9 h ASN 217 Ca 0.28 0.06 -0.13 0.00 -0.55 0.00 0.00 56.30 55.97 1pr9 h ASN 217 Cb -0.12 -0.04 -0.01 0.00 0.05 0.00 0.00 38.32 38.20 1pr9 h ASN 217 CO -0.06 0.31 -0.22 0.00 -1.65 0.00 0.00 177.43 175.80 1pr9 h ALA 218 N 1.47 0.76 -0.41 -0.83 0.00 -1.22 -1.90 119.26 117.14 1pr9 h ALA 218 Ca 0.40 -0.39 -0.04 0.00 0.00 0.00 0.00 54.91 54.88 1pr9 h ALA 218 Cb 0.43 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.05 1pr9 h ALA 218 CO -0.28 0.66 0.10 0.82 0.00 0.00 0.00 179.25 180.55 1pr9 h ILE 219 N 0.79 1.23 -0.88 0.00 2.04 -0.09 -2.24 117.51 118.36 1pr9 h ILE 219 Ca 0.10 -0.79 -0.03 0.00 1.00 0.00 0.00 64.86 65.15 1pr9 h ILE 219 Cb 0.77 0.96 -0.04 0.00 -0.74 0.00 0.00 36.82 37.77 1pr9 h ILE 219 CO 0.06 0.28 0.45 -0.07 0.00 0.00 0.00 178.15 178.87 1pr9 h LEU 220 N 0.53 1.13 -0.37 1.44 3.38 -0.94 -1.16 115.31 119.32 1pr9 h LEU 220 Ca 0.13 -0.12 -0.02 0.00 0.09 0.00 0.00 57.88 57.96 1pr9 h LEU 220 Cb 0.31 -0.29 -0.02 0.00 0.09 0.00 0.00 40.66 40.76 1pr9 h LEU 220 CO 0.00 0.93 0.15 0.15 0.09 0.00 0.00 178.44 179.76 1pr9 h PHE 221 N 1.24 0.56 0.00 1.13 3.04 -1.09 -2.12 116.94 119.71 1pr9 h PHE 221 Ca 0.31 -0.04 -0.03 0.00 3.98 0.00 0.00 57.97 62.18 1pr9 h PHE 221 Cb 0.08 -0.17 -0.00 0.00 2.56 0.00 0.00 35.95 38.41 1pr9 h PHE 221 CO 0.01 0.51 -0.16 -0.07 -2.02 0.00 0.00 178.31 176.58 1pr9 h LEU 222 N 0.45 0.00 0.00 0.59 3.38 -1.16 -2.50 115.31 116.07 1pr9 h LEU 222 Ca 0.12 0.00 -0.18 0.00 0.09 0.00 0.00 57.88 57.91 1pr9 h LEU 222 Cb 0.18 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.91 1pr9 h LEU 222 CO -0.01 0.16 -1.01 -0.07 0.09 0.00 0.00 178.44 177.60 1pr9 h LEU 223 N 0.00 0.00-10.34 1.67 3.38 -0.90 -3.47 115.31 105.65 1pr9 h LEU 223 Ca -0.00 0.00 -0.51 0.00 0.09 0.00 0.00 57.88 57.46 1pr9 h LEU 223 Cb 0.54 0.00 0.06 0.00 0.09 0.00 0.00 40.66 41.35 1pr9 h LEU 223 CO 0.02 0.79 0.40 -0.94 0.09 0.00 0.00 178.44 178.81 1pr9 s SER 224 N -6.41 6.05 0.00 -0.43 1.04 -0.82 -4.81 113.70 108.31 1pr9 s SER 224 Ca 0.01 1.49 0.22 0.00 0.48 0.00 0.00 55.95 58.14 1pr9 s SER 224 Cb 0.09 -2.48 1.18 0.00 0.10 0.00 0.00 66.02 64.91 1pr9 s SER 224 CO 0.80 -0.99 1.72 0.47 0.98 0.00 0.00 173.24 176.22 1pr9 n ASP 225 N -2.74 0.00 0.28 7.02 8.00 -1.26 -2.10 116.55 125.75 1pr9 n ASP 225 Ca 0.06 -0.22 0.12 0.00 0.71 0.00 0.00 54.79 55.46 1pr9 n ASP 225 Cb 0.54 -0.21 0.77 0.00 -0.02 0.00 0.00 41.12 42.20 1pr9 n ASP 225 CO 0.00 0.00 0.00 0.03 -0.39 0.00 0.00 177.20 176.84 1pr9 h ARG 226 N 0.00 0.00 -0.71 -1.24 2.47 -1.88 -2.91 114.38 110.11 1pr9 h ARG 226 Ca 0.00 0.00 -0.44 0.00 -1.26 0.00 0.00 59.98 58.28 1pr9 h ARG 226 Cb 0.15 0.00 -0.25 0.00 -1.65 0.00 0.00 29.97 28.22 1pr9 h ARG 226 CO 0.00 0.02 0.16 -1.13 0.56 0.00 0.00 179.97 179.58 1pr9 n SER 227 N -4.13 4.43 0.13 7.04 3.41 -0.89 -4.83 113.62 118.78 1pr9 n SER 227 Ca -0.03 -3.75 0.19 0.00 -0.26 0.00 0.00 58.87 55.02 1pr9 n SER 227 Cb 0.11 -0.71 0.77 0.00 -0.26 0.00 0.00 64.21 64.12 1pr9 n SER 227 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 1pr9 h GLY 228 N 1.46 0.00 -1.86 5.00 0.00 -1.71 0.57 103.07 106.53 1pr9 h GLY 228 Ca 0.43 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.76 1pr9 h GLY 228 CO 0.89 0.00 0.00 1.03 0.00 0.00 0.00 176.54 178.46 1pr9 n MET 229 N -3.64 3.19 -3.83 4.80 2.81 -1.26 -4.91 117.12 114.28 1pr9 n MET 229 Ca 0.05 -2.73 -0.36 0.00 -1.81 0.00 0.00 57.70 52.86 1pr9 n MET 229 Cb 0.55 -1.78 -0.13 0.00 -0.71 0.00 0.00 33.22 31.15 1pr9 n MET 229 CO 0.00 0.00 0.00 0.99 1.51 0.00 0.00 175.97 178.47 1pr9 s THR 230 N -2.38 3.61 -0.06 2.03 2.01 0.19 -5.07 115.64 115.97 1pr9 s THR 230 Ca 0.40 -0.77 -0.13 0.00 0.31 0.00 0.00 61.69 61.50 1pr9 s THR 230 Cb 0.30 -2.84 0.03 0.00 0.01 0.00 0.00 72.50 70.00 1pr9 s THR 230 CO 0.12 0.14 0.31 0.28 -0.69 0.00 0.00 174.62 174.78 1pr9 s THR 231 N 1.45 0.03 0.00 -0.82 -1.32 -1.26 -4.75 115.64 108.97 1pr9 s THR 231 Ca 0.02 -0.28 0.00 0.00 -1.21 0.00 0.00 61.69 60.22 1pr9 s THR 231 Cb -0.17 -0.54 0.00 0.00 -1.51 0.00 0.00 72.50 70.29 1pr9 s THR 231 CO 0.00 -0.16 0.00 0.61 -2.21 0.00 0.00 174.62 172.87 1pr9 n GLY 232 N 1.99 0.49 3.99 6.08 0.00 0.14 -4.97 105.19 112.89 1pr9 n GLY 232 Ca -0.18 -0.21 -0.20 0.00 0.00 0.00 0.00 46.02 45.44 1pr9 n GLY 232 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1pr9 s SER 233 N -2.19 5.43 -0.35 1.61 1.04 -1.26 -4.65 113.70 113.34 1pr9 s SER 233 Ca 0.00 -0.16 0.03 0.00 0.48 0.00 0.00 55.95 56.30 1pr9 s SER 233 Cb 0.00 -0.81 0.10 0.00 0.10 0.00 0.00 66.02 65.41 1pr9 s SER 233 CO 0.00 -0.99 0.07 0.42 0.98 0.00 0.00 173.24 173.72 1pr9 s THR 234 N -2.60 2.08 -0.40 2.02 -4.23 -1.26 -0.71 115.64 110.54 1pr9 s THR 234 Ca 0.56 -2.27 -0.26 0.00 -1.18 0.00 0.00 61.69 58.55 1pr9 s THR 234 Cb -0.10 -2.54 0.02 0.00 1.34 0.00 0.00 72.50 71.22 1pr9 s THR 234 CO 0.36 -0.63 0.93 -0.22 -0.54 0.00 0.00 174.62 174.52 1pr9 s LEU 235 N 0.93 3.99 0.15 4.79 0.20 -0.16 -4.88 118.68 123.70 1pr9 s LEU 235 Ca 0.11 0.43 -0.30 0.00 0.69 0.00 0.00 54.13 55.06 1pr9 s LEU 235 Cb -0.19 -3.24 -0.07 0.00 -0.43 0.00 0.00 46.19 42.25 1pr9 s LEU 235 CO -0.10 -0.92 1.20 -2.16 -0.29 0.00 0.00 176.35 174.08 1pr9 s PRO 236 N 3.57 4.47 -0.50 0.98 0.04 -1.26 -0.80 135.00 141.50 1pr9 s PRO 236 Ca 0.38 1.85 0.07 0.00 0.04 0.00 0.00 61.00 63.33 1pr9 s PRO 236 Cb -0.11 -3.27 0.37 0.00 0.04 0.00 0.00 34.50 31.53 1pr9 s PRO 236 CO 0.21 -0.14 0.96 0.28 0.04 0.00 0.00 177.00 178.36 1pr9 n VAL 237 N 2.96 2.32 -1.58 -0.36 0.31 -0.61 -4.86 118.33 116.51 1pr9 n VAL 237 Ca 0.06 -5.11 0.06 0.00 -0.01 0.00 0.00 64.34 59.35 1pr9 n VAL 237 Cb 0.45 -1.07 0.13 0.00 -0.91 0.00 0.00 33.84 32.44 1pr9 n VAL 237 CO 0.00 0.00 0.00 -1.84 -1.32 0.00 0.00 176.83 173.67 1pr9 n GLU 238 N -0.23 1.08 -1.68 5.55 -0.00 -1.26 -2.08 120.64 122.02 1pr9 n GLU 238 Ca 0.31 -2.60 -0.18 0.00 -0.00 0.00 0.00 57.16 54.69 1pr9 n GLU 238 Cb 0.53 -1.23 -0.06 0.00 -0.00 0.00 0.00 31.44 30.68 1pr9 n GLU 238 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1pr9 n GLY 239 N -0.89 1.28 0.81 -1.84 0.00 -1.26 -1.63 105.19 101.66 1pr9 n GLY 239 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.16 1pr9 n GLY 239 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1pr9 n GLY 240 N -0.44 0.80 0.32 -0.02 0.00 -1.26 -2.52 105.19 102.06 1pr9 n GLY 240 Ca -0.18 -0.00 0.14 0.00 0.00 0.00 0.00 46.02 45.98 1pr9 n GLY 240 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1pr9 h PHE 241 N 0.00 0.65 0.00 1.61 3.57 -1.50 -0.75 116.94 120.51 1pr9 h PHE 241 Ca 0.00 0.04 -0.04 0.00 3.53 0.00 0.00 57.97 61.51 1pr9 h PHE 241 Cb 0.00 -0.14 -0.01 0.00 2.79 0.00 0.00 35.95 38.59 1pr9 h PHE 241 CO 0.00 -0.07 -0.17 -1.49 -2.23 0.00 0.00 178.31 174.35 1pr9 h TRP 242 N 0.38 0.00 0.00 0.41 6.55 -1.89 -3.15 115.95 118.24 1pr9 h TRP 242 Ca 0.57 0.00 -0.02 0.00 0.95 0.00 0.00 58.89 60.40 1pr9 h TRP 242 Cb 1.12 0.00 -0.00 0.00 -0.86 0.00 0.00 29.16 29.42 1pr9 h TRP 242 CO -0.14 0.17 -0.09 0.00 -1.05 0.00 0.00 178.44 177.33 1pr9 h ALA 243 N 1.83 0.98 0.00 1.49 0.00 -1.52 -3.54 119.26 118.51 1pr9 h ALA 243 Ca -0.00 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1pr9 h ALA 243 Cb 0.67 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.45 1pr9 h ALA 243 CO 0.02 0.11 0.00 0.00 0.00 0.00 0.00 179.25 179.39