#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2owe s GLU 2 N 0.00 4.07 -0.06 2.12 2.12 -1.26 -1.47 118.70 124.23 2owe s GLU 2 Ca 0.00 2.05 0.03 0.00 0.36 0.00 0.00 54.97 57.41 2owe s GLU 2 Cb 0.00 -4.00 0.01 0.00 0.26 0.00 0.00 34.13 30.40 2owe s GLU 2 CO 0.00 -0.97 -0.14 -0.51 -0.54 0.00 0.00 175.26 173.10 2owe s LEU 3 N 4.39 1.77 -0.25 2.70 1.43 0.48 -3.26 118.68 125.93 2owe s LEU 3 Ca 0.73 -0.32 -0.14 0.00 -1.03 0.00 0.00 54.13 53.37 2owe s LEU 3 Cb -0.31 -0.88 -0.04 0.00 0.03 0.00 0.00 46.19 44.99 2owe s LEU 3 CO 0.29 0.08 0.33 0.26 0.23 0.00 0.00 176.35 177.53 2owe s TRP 4 N 0.42 3.29 -0.27 0.29 0.52 -0.51 -0.49 118.94 122.20 2owe s TRP 4 Ca -0.11 0.41 -0.08 0.00 0.02 0.00 0.00 56.10 56.34 2owe s TRP 4 Cb -0.14 -2.49 -0.02 0.00 -1.15 0.00 0.00 33.47 29.67 2owe s TRP 4 CO 0.03 -0.11 0.10 -0.51 0.02 0.00 0.00 176.95 176.49 2owe s LEU 5 N 1.64 3.68 -0.21 2.99 1.43 0.51 -0.06 118.68 128.67 2owe s LEU 5 Ca 0.14 -0.30 -0.04 0.00 -1.03 0.00 0.00 54.13 52.90 2owe s LEU 5 Cb -0.15 -1.96 -0.02 0.00 0.03 0.00 0.00 46.19 44.09 2owe s LEU 5 CO 0.08 -0.08 -0.02 -0.69 0.23 0.00 0.00 176.35 175.87 2owe s VAL 6 N 1.62 3.72 -0.00 -1.59 1.01 0.19 -1.26 120.40 124.09 2owe s VAL 6 Ca 0.06 -0.39 -0.23 0.00 0.00 0.00 0.00 61.98 61.41 2owe s VAL 6 Cb -0.16 -2.68 -0.05 0.00 0.00 0.00 0.00 36.38 33.49 2owe s VAL 6 CO 0.05 0.43 0.71 -0.60 0.00 0.00 0.00 175.10 175.68 2owe s ARG 7 N 1.16 4.43 0.90 2.72 3.52 -0.41 -0.64 118.95 130.63 2owe s ARG 7 Ca 0.02 0.93 -0.10 0.00 -0.13 0.00 0.00 55.73 56.45 2owe s ARG 7 Cb -0.14 -3.38 0.13 0.00 -1.56 0.00 0.00 34.95 30.00 2owe s ARG 7 CO 0.00 0.24 1.14 -3.38 -0.81 0.00 0.00 175.30 172.49 2owe s HIS 8 N 0.18 1.72 1.18 5.12 -3.43 -0.82 -1.54 115.29 117.70 2owe s HIS 8 Ca 0.36 1.77 -0.14 0.00 -0.80 0.00 0.00 55.06 56.25 2owe s HIS 8 Cb -0.19 -3.32 0.28 0.00 -1.43 0.00 0.00 32.58 27.93 2owe s HIS 8 CO 0.20 -2.71 1.03 0.20 -2.00 0.00 0.00 174.74 171.46 2owe s GLY 9 N -2.73 1.53 0.38 -1.38 0.00 -1.26 -1.81 107.32 102.04 2owe s GLY 9 Ca 0.66 -0.33 -0.28 0.00 0.00 0.00 0.00 44.72 44.78 2owe s GLY 9 CO 0.57 0.43 1.40 -2.21 0.00 0.00 0.00 173.10 173.29 2owe n GLU 10 N -4.91 2.40 -4.51 2.90 2.13 -1.26 -4.72 120.64 112.66 2owe n GLU 10 Ca 0.05 0.84 -0.24 0.00 0.66 0.00 0.00 57.16 58.46 2owe n GLU 10 Cb 0.56 -2.53 -0.11 0.00 0.27 0.00 0.00 31.44 29.63 2owe n GLU 10 CO 0.00 0.00 0.00 0.95 -0.41 0.00 0.00 177.13 177.67 2owe s THR 11 N -1.12 1.96 0.28 6.31 -4.23 -1.26 -1.23 115.64 116.34 2owe s THR 11 Ca 0.55 -2.14 -0.02 0.00 -1.18 0.00 0.00 61.69 58.90 2owe s THR 11 Cb -0.51 -2.64 0.27 0.00 1.34 0.00 0.00 72.50 70.96 2owe s THR 11 CO 0.62 -0.19 1.91 0.25 -0.54 0.00 0.00 174.62 176.67 2owe h LEU 12 N 2.07 1.01 -1.24 4.79 5.85 -1.93 -1.91 115.31 123.95 2owe h LEU 12 Ca -0.42 -0.00 -0.05 0.00 0.84 0.00 0.00 57.88 58.25 2owe h LEU 12 Cb 1.24 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 42.04 2owe h LEU 12 CO 0.71 0.67 -0.24 -0.50 -0.34 0.00 0.00 178.44 178.74 2owe h TRP 13 N 1.16 0.00 0.00 1.25 4.06 -1.95 -1.59 115.95 118.88 2owe h TRP 13 Ca 0.39 0.00 -0.06 0.00 2.06 0.00 0.00 58.89 61.28 2owe h TRP 13 Cb 0.08 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.23 2owe h TRP 13 CO -0.00 0.24 -0.29 -0.91 -3.56 0.00 0.00 178.44 173.91 2owe h ASN 14 N 0.00 0.00 0.16 -3.49 -0.26 -1.59 -1.20 115.58 109.20 2owe h ASN 14 Ca -0.00 0.00 -0.23 0.00 -0.56 0.00 0.00 56.30 55.51 2owe h ASN 14 Cb 0.69 0.00 0.03 0.00 -1.06 0.00 0.00 38.32 37.98 2owe h ASN 14 CO 0.03 0.29 -1.01 -0.09 -1.06 0.00 0.00 177.43 175.60 2owe h ARG 15 N 0.00 0.40 -0.10 0.81 2.43 -1.25 -3.36 114.38 113.31 2owe h ARG 15 Ca -0.00 -0.64 0.00 0.00 -0.81 0.00 0.00 59.98 58.52 2owe h ARG 15 Cb 0.59 0.23 0.00 0.00 -0.42 0.00 0.00 29.97 30.37 2owe h ARG 15 CO 0.04 1.30 0.00 0.39 -1.51 0.00 0.00 179.97 180.19 2owe n GLU 16 N -4.00 1.39 -3.24 0.20 1.02 -0.67 -4.91 120.64 110.42 2owe n GLU 16 Ca -0.14 -0.59 -0.15 0.00 -0.02 0.00 0.00 57.16 56.26 2owe n GLU 16 Cb 0.90 -1.30 0.07 0.00 -0.02 0.00 0.00 31.44 31.09 2owe n GLU 16 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2owe n GLY 17 N 0.93 -0.75 3.18 0.62 0.00 -0.88 -4.86 105.19 103.44 2owe n GLY 17 Ca 0.13 0.34 -0.27 0.00 0.00 0.00 0.00 46.02 46.22 2owe n GLY 17 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2owe s ARG 18 N -4.73 1.88 0.15 1.61 0.52 -0.51 -2.22 118.95 115.65 2owe s ARG 18 Ca 0.25 -0.70 -0.31 0.00 -0.52 0.00 0.00 55.73 54.45 2owe s ARG 18 Cb -0.03 -1.67 -0.11 0.00 0.52 0.00 0.00 34.95 33.66 2owe s ARG 18 CO 0.70 0.33 1.81 -0.51 0.02 0.00 0.00 175.30 177.64 2owe s LEU 19 N -0.16 4.39 -0.23 2.53 1.43 -0.62 -4.57 118.68 121.45 2owe s LEU 19 Ca -0.00 2.80 0.01 0.00 -1.03 0.00 0.00 54.13 55.91 2owe s LEU 19 Cb -0.11 -3.58 0.06 0.00 0.03 0.00 0.00 46.19 42.59 2owe s LEU 19 CO 0.02 -1.00 -0.07 -0.22 0.23 0.00 0.00 176.35 175.30 2owe s LEU 20 N 2.31 2.58 0.00 1.79 2.96 -1.26 0.00 118.68 127.06 2owe s LEU 20 Ca 0.79 -1.12 0.00 0.00 -0.22 0.00 0.00 54.13 53.58 2owe s LEU 20 Cb -0.47 -1.23 0.00 0.00 0.50 0.00 0.00 46.19 44.99 2owe s LEU 20 CO 0.35 -0.21 0.00 0.61 -1.32 0.00 0.00 176.35 175.78 2owe n GLY 21 N 4.65 0.78 0.16 7.98 0.00 -1.26 -4.88 105.19 112.62 2owe n GLY 21 Ca -0.13 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.01 2owe n GLY 21 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 2owe n TRP 22 N 0.00 0.00 -1.76 1.61 7.02 -1.26 -4.60 117.44 118.45 2owe n TRP 22 Ca 0.00 0.00 -0.42 0.00 -1.02 0.00 0.00 57.50 56.06 2owe n TRP 22 Cb 0.00 -0.15 -0.03 0.00 -2.42 0.00 0.00 31.31 28.71 2owe n TRP 22 CO 0.00 0.00 0.00 0.99 -2.02 0.00 0.00 177.69 176.66 2owe s THR 23 N -2.70 2.41 -1.50 -0.99 2.01 -1.26 -4.85 115.64 108.76 2owe s THR 23 Ca 0.19 0.11 -0.09 0.00 0.31 0.00 0.00 61.69 62.21 2owe s THR 23 Cb 0.18 -3.07 0.00 0.00 0.01 0.00 0.00 72.50 69.62 2owe s THR 23 CO 0.60 0.00 2.68 -0.67 -0.69 0.00 0.00 174.62 176.55 2owe n ASP 24 N 4.92 8.08 -4.78 3.53 -0.08 -1.26 -4.98 116.55 121.98 2owe n ASP 24 Ca 0.17 -2.80 -0.37 0.00 -1.51 0.00 0.00 54.79 50.27 2owe n ASP 24 Cb 0.37 -1.50 -0.04 0.00 2.34 0.00 0.00 41.12 42.29 2owe n ASP 24 CO 0.00 0.00 0.00 -0.76 0.12 0.00 0.00 177.20 176.56 2owe s LEU 25 N -0.50 4.21 0.66 -2.67 1.43 -1.26 -4.84 118.68 115.71 2owe s LEU 25 Ca 0.62 2.04 -0.07 0.00 -1.03 0.00 0.00 54.13 55.69 2owe s LEU 25 Cb 0.18 -4.10 0.03 0.00 0.03 0.00 0.00 46.19 42.33 2owe s LEU 25 CO -0.07 -0.40 0.98 -2.16 0.23 0.00 0.00 176.35 174.93 2owe s PRO 26 N -2.32 2.56 0.53 1.29 0.04 -1.26 -3.75 135.00 132.08 2owe s PRO 26 Ca 0.55 -0.07 -0.18 0.00 0.04 0.00 0.00 61.00 61.35 2owe s PRO 26 Cb -0.23 -2.19 -0.07 0.00 0.04 0.00 0.00 34.50 32.05 2owe s PRO 26 CO 0.29 -1.00 1.02 -0.51 0.04 0.00 0.00 177.00 176.84 2owe s LEU 27 N -5.16 3.67 0.87 -3.56 1.43 -1.26 -4.41 118.68 110.26 2owe s LEU 27 Ca 0.57 1.78 -0.11 0.00 -1.03 0.00 0.00 54.13 55.34 2owe s LEU 27 Cb -0.11 -4.54 0.16 0.00 0.03 0.00 0.00 46.19 41.74 2owe s LEU 27 CO 0.46 -0.83 1.21 0.42 0.23 0.00 0.00 176.35 177.83 2owe s THR 28 N -2.33 2.06 0.24 5.49 -4.23 -0.36 -4.83 115.64 111.67 2owe s THR 28 Ca 0.63 -0.16 -0.07 0.00 -1.18 0.00 0.00 61.69 60.92 2owe s THR 28 Cb -0.14 -2.90 0.21 0.00 1.34 0.00 0.00 72.50 71.01 2owe s THR 28 CO 0.28 0.00 1.85 0.00 -0.54 0.00 0.00 174.62 176.22 2owe h ALA 29 N -1.24 1.17 -0.24 3.99 0.00 -1.97 -0.95 119.26 120.01 2owe h ALA 29 Ca -0.43 -0.14 -0.13 0.00 0.00 0.00 0.00 54.91 54.22 2owe h ALA 29 Cb 1.26 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 18.68 2owe h ALA 29 CO 0.43 0.66 -0.39 1.49 0.00 0.00 0.00 179.25 181.45 2owe h GLU 30 N 1.25 0.55 -0.98 0.00 4.57 -1.93 -1.21 114.58 116.83 2owe h GLU 30 Ca 0.31 -0.27 0.03 0.00 -1.18 0.00 0.00 59.36 58.25 2owe h GLU 30 Cb 0.04 0.00 -0.05 0.00 -0.16 0.00 0.00 28.75 28.58 2owe h GLU 30 CO -0.05 0.85 0.64 0.78 -1.18 0.00 0.00 179.01 180.05 2owe h GLY 31 N 1.06 1.41 1.12 1.92 0.00 -1.46 0.78 103.07 107.89 2owe h GLY 31 Ca 0.04 -0.49 -0.15 0.00 0.00 0.00 0.00 47.33 46.73 2owe h GLY 31 CO 0.08 0.44 -0.29 0.83 0.00 0.00 0.00 176.54 177.59 2owe h GLU 32 N 1.26 0.98 -0.93 4.80 5.08 -0.80 -2.30 114.58 122.67 2owe h GLU 32 Ca 0.38 -0.46 -0.00 0.00 -1.00 0.00 0.00 59.36 58.27 2owe h GLU 32 Cb -0.04 -0.01 -0.05 0.00 0.50 0.00 0.00 28.75 29.16 2owe h GLU 32 CO -0.11 1.13 0.57 0.00 -1.00 0.00 0.00 179.01 179.60 2owe h ALA 33 N 0.83 1.25 -0.64 3.43 0.00 -0.26 -0.63 119.26 123.24 2owe h ALA 33 Ca 0.09 -0.10 -0.04 0.00 0.00 0.00 0.00 54.91 54.86 2owe h ALA 33 Cb 0.88 -0.38 -0.03 0.00 0.00 0.00 0.00 17.79 18.27 2owe h ALA 33 CO 0.08 0.65 0.24 1.96 0.00 0.00 0.00 179.25 182.18 2owe h GLN 34 N 1.28 0.97 -0.67 0.00 4.20 -0.71 -2.01 115.11 118.17 2owe h GLN 34 Ca 0.34 -0.19 -0.07 0.00 0.06 0.00 0.00 58.65 58.79 2owe h GLN 34 Cb -0.07 -0.15 -0.03 0.00 0.30 0.00 0.00 27.48 27.53 2owe h GLN 34 CO -0.06 0.83 0.16 0.00 -0.67 0.00 0.00 178.83 179.08 2owe h ALA 35 N 1.10 0.88 -0.17 3.87 0.00 -0.79 -2.59 119.26 121.56 2owe h ALA 35 Ca 0.21 -0.24 -0.07 0.00 0.00 0.00 0.00 54.91 54.81 2owe h ALA 35 Cb 0.23 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 2owe h ALA 35 CO -0.01 0.60 -0.19 0.00 0.00 0.00 0.00 179.25 179.65 2owe h ARG 36 N 1.00 0.28 0.00 0.00 3.08 -0.87 -2.10 114.38 115.77 2owe h ARG 36 Ca 0.21 -0.08 0.00 0.00 0.07 0.00 0.00 59.98 60.18 2owe h ARG 36 Cb 0.37 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.39 2owe h ARG 36 CO 0.00 0.47 0.00 0.54 -1.07 0.00 0.00 179.97 179.91 2owe n ARG 37 N -4.21 0.20 0.20 0.04 1.74 -0.78 -1.78 116.66 112.06 2owe n ARG 37 Ca -0.01 0.48 0.12 0.00 -0.77 0.00 0.00 57.85 57.67 2owe n ARG 37 Cb 0.32 -1.92 0.15 0.00 -1.02 0.00 0.00 32.46 30.00 2owe n ARG 37 CO 0.00 0.00 0.00 -0.07 -1.52 0.00 0.00 177.63 176.04 2owe h LEU 38 N 0.00 0.00 -9.27 0.55 3.38 -1.33 -3.42 115.31 105.22 2owe h LEU 38 Ca 0.00 -0.00 -0.54 0.00 0.09 0.00 0.00 57.88 57.42 2owe h LEU 38 Cb 0.29 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.05 2owe h LEU 38 CO 0.00 0.00 1.21 -0.75 0.09 0.00 0.00 178.44 178.99 2owe s LYS 39 N -3.23 4.04 0.00 1.13 2.20 -0.74 -1.28 119.74 121.86 2owe s LYS 39 Ca 0.06 2.37 0.00 0.00 -0.36 0.00 0.00 55.97 58.04 2owe s LYS 39 Cb 0.06 -4.12 0.00 0.00 -1.51 0.00 0.00 37.83 32.26 2owe s LYS 39 CO 0.69 -1.05 0.00 0.41 -0.36 0.00 0.00 175.35 175.03 2owe n GLY 40 N 4.55 2.62 0.11 5.54 0.00 -1.26 -4.85 105.19 111.89 2owe n GLY 40 Ca 0.20 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.25 2owe n GLY 40 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2owe h ALA 41 N 0.00 0.62 -2.81 4.61 0.00 -1.44 -3.46 119.26 116.78 2owe h ALA 41 Ca 0.00 -0.57 -0.64 0.00 0.00 0.00 0.00 54.91 53.71 2owe h ALA 41 Cb 0.00 0.17 -0.05 0.00 0.00 0.00 0.00 17.79 17.91 2owe h ALA 41 CO 0.00 0.62 -0.49 -0.51 0.00 0.00 0.00 179.25 178.88 2owe s LEU 42 N -5.74 4.37 0.45 0.00 1.43 -1.14 -5.07 118.68 112.98 2owe s LEU 42 Ca -0.01 0.35 -0.25 0.00 -1.03 0.00 0.00 54.13 53.18 2owe s LEU 42 Cb 0.09 -2.66 -0.08 0.00 0.03 0.00 0.00 46.19 43.57 2owe s LEU 42 CO 0.80 0.25 1.39 -2.84 0.23 0.00 0.00 176.35 176.17 2owe s PRO 43 N -2.00 3.70 -0.35 1.29 0.02 -1.26 -4.85 135.00 131.56 2owe s PRO 43 Ca 0.28 2.33 -0.07 0.00 0.02 0.00 0.00 61.00 63.56 2owe s PRO 43 Cb -0.13 -2.64 -0.22 0.00 0.02 0.00 0.00 34.50 31.54 2owe s PRO 43 CO 0.20 -0.77 3.36 0.43 -0.33 0.00 0.00 177.00 179.88 2owe n SER 44 N -0.20 5.77 -4.89 2.53 7.64 -1.26 -4.91 113.62 118.29 2owe n SER 44 Ca 0.05 -2.46 -0.29 0.00 1.01 0.00 0.00 58.87 57.18 2owe n SER 44 Cb 0.43 -1.39 0.04 0.00 -1.01 0.00 0.00 64.21 62.27 2owe n SER 44 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 2owe s LEU 45 N 0.04 2.99 0.42 -3.43 1.43 -1.26 -4.99 118.68 113.88 2owe s LEU 45 Ca 0.65 1.04 -0.25 0.00 -1.03 0.00 0.00 54.13 54.53 2owe s LEU 45 Cb 0.28 -3.85 -0.10 0.00 0.03 0.00 0.00 46.19 42.55 2owe s LEU 45 CO -0.01 -1.26 1.25 -2.65 0.23 0.00 0.00 176.35 173.91 2owe n PRO 46 N -2.89 1.87 -4.47 1.29 -0.02 -1.26 -4.54 135.00 124.97 2owe n PRO 46 Ca 0.06 0.66 -0.30 0.00 -2.02 0.00 0.00 63.50 61.90 2owe n PRO 46 Cb 0.57 -2.35 -0.11 0.00 -0.02 0.00 0.00 33.50 31.59 2owe n PRO 46 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2owe s ALA 47 N -1.21 2.76 0.08 3.55 0.00 -1.26 -1.47 121.76 124.21 2owe s ALA 47 Ca 0.61 -1.21 0.06 0.00 0.00 0.00 0.00 51.96 51.43 2owe s ALA 47 Cb -0.51 -0.82 -0.03 0.00 0.00 0.00 0.00 23.12 21.76 2owe s ALA 47 CO 0.58 0.60 -0.17 -0.06 0.00 0.00 0.00 175.76 176.71 2owe s PHE 48 N -1.04 1.42 0.03 0.00 0.08 -0.31 -2.17 117.98 115.98 2owe s PHE 48 Ca 0.17 -0.44 -0.12 0.00 0.12 0.00 0.00 56.93 56.66 2owe s PHE 48 Cb -0.11 -0.79 0.01 0.00 -0.57 0.00 0.00 43.02 41.57 2owe s PHE 48 CO 0.08 0.11 0.25 0.45 -0.10 0.00 0.00 175.22 176.01 2owe s SER 49 N -1.77 -0.06 0.72 1.36 0.15 -0.27 -0.69 113.70 113.15 2owe s SER 49 Ca 0.01 -0.22 -0.14 0.00 0.70 0.00 0.00 55.95 56.30 2owe s SER 49 Cb -0.10 0.31 0.04 0.00 -1.71 0.00 0.00 66.02 64.56 2owe s SER 49 CO 0.03 -0.55 1.14 -0.55 1.20 0.00 0.00 173.24 174.51 2owe s SER 50 N -1.90 4.52 0.00 5.45 0.15 -0.69 -0.38 113.70 120.84 2owe s SER 50 Ca -0.07 2.09 0.29 0.00 0.70 0.00 0.00 55.95 58.96 2owe s SER 50 Cb -0.02 -2.56 1.35 0.00 -1.71 0.00 0.00 66.02 63.08 2owe s SER 50 CO -0.02 -2.03 1.93 -0.90 1.20 0.00 0.00 173.24 173.42 2owe n ASP 51 N -2.87 0.43 -4.76 5.45 5.75 -1.25 -4.07 116.55 115.22 2owe n ASP 51 Ca 0.11 -0.66 -0.41 0.00 -0.01 0.00 0.00 54.79 53.83 2owe n ASP 51 Cb 0.52 -0.08 -0.03 0.00 -1.03 0.00 0.00 41.12 40.50 2owe n ASP 51 CO 0.00 0.00 0.00 -0.76 -0.11 0.00 0.00 177.20 176.33 2owe s LEU 52 N -2.38 4.47 0.22 -2.12 1.43 -1.26 -4.85 118.68 114.19 2owe s LEU 52 Ca 0.32 2.52 -0.15 0.00 -1.03 0.00 0.00 54.13 55.80 2owe s LEU 52 Cb 0.20 -3.64 0.25 0.00 0.03 0.00 0.00 46.19 43.04 2owe s LEU 52 CO 0.45 -0.40 1.59 0.25 0.23 0.00 0.00 176.35 178.46 2owe h LEU 53 N 3.68 -0.99 -1.68 1.79 5.85 -1.88 -1.44 115.31 120.63 2owe h LEU 53 Ca -0.48 0.25 0.08 0.00 0.84 0.00 0.00 57.88 58.57 2owe h LEU 53 Cb 1.22 0.56 -0.03 0.00 0.37 0.00 0.00 40.66 42.78 2owe h LEU 53 CO 0.67 -0.28 0.36 0.08 -0.34 0.00 0.00 178.44 178.92 2owe h ARG 54 N -0.05 0.36 0.06 1.25 0.11 -1.91 0.18 114.38 114.38 2owe h ARG 54 Ca 0.33 -0.02 -0.12 0.00 0.10 0.00 0.00 59.98 60.27 2owe h ARG 54 Cb 0.58 -0.08 0.01 0.00 1.11 0.00 0.00 29.97 31.59 2owe h ARG 54 CO -0.80 0.24 -0.49 0.00 0.10 0.00 0.00 179.97 179.02 2owe h ALA 55 N 1.73 -0.02 -0.45 0.08 0.00 -1.59 -2.53 119.26 116.48 2owe h ALA 55 Ca 0.24 -0.58 0.05 0.00 0.00 0.00 0.00 54.91 54.62 2owe h ALA 55 Cb 0.46 0.05 -0.05 0.00 0.00 0.00 0.00 17.79 18.25 2owe h ALA 55 CO -0.06 0.23 0.18 0.00 0.00 0.00 0.00 179.25 179.60 2owe h ARG 56 N -0.48 0.35 -0.83 0.00 3.08 -0.92 -1.20 114.38 114.39 2owe h ARG 56 Ca -0.08 -0.02 -0.03 0.00 0.07 0.00 0.00 59.98 59.93 2owe h ARG 56 Cb 1.31 -0.08 -0.04 0.00 0.08 0.00 0.00 29.97 31.24 2owe h ARG 56 CO 0.09 0.23 0.41 -0.09 -1.07 0.00 0.00 179.97 179.55 2owe h ARG 57 N 0.36 1.18 -0.40 0.04 9.65 -0.73 -1.53 114.38 122.95 2owe h ARG 57 Ca 0.21 -0.16 -0.01 0.00 -1.10 0.00 0.00 59.98 58.91 2owe h ARG 57 Cb 0.18 -0.22 -0.02 0.00 -1.39 0.00 0.00 29.97 28.52 2owe h ARG 57 CO -0.19 0.90 0.20 1.15 2.80 0.00 0.00 179.97 184.82 2owe h THR 58 N 1.17 1.17 -0.23 0.20 2.02 -0.94 -0.97 112.91 115.33 2owe h THR 58 Ca 0.29 -0.47 0.02 0.00 0.77 0.00 0.00 66.41 67.01 2owe h THR 58 Cb 0.09 0.74 -0.02 0.00 -1.74 0.00 0.00 68.15 67.23 2owe h THR 58 CO -0.04 0.18 0.10 0.00 0.37 0.00 0.00 175.52 176.13 2owe h ALA 59 N 1.05 0.27 -0.11 6.16 0.00 -0.90 -0.73 119.26 125.00 2owe h ALA 59 Ca 0.14 0.01 0.03 0.00 0.00 0.00 0.00 54.91 55.09 2owe h ALA 59 Cb 0.11 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 17.85 2owe h ALA 59 CO -0.02 -0.31 -0.06 1.49 0.00 0.00 0.00 179.25 180.36 2owe h GLU 60 N 0.22 -0.05 0.00 0.00 4.81 -1.04 -0.99 114.58 117.53 2owe h GLU 60 Ca 0.10 0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.31 2owe h GLU 60 Cb 0.04 0.01 -0.00 0.00 0.63 0.00 0.00 28.75 29.43 2owe h GLU 60 CO -0.08 -0.03 -0.10 -0.07 -0.73 0.00 0.00 179.01 177.99 2owe h LEU 61 N -0.05 0.00 -0.21 1.64 3.38 -0.98 -1.88 115.31 117.21 2owe h LEU 61 Ca 0.06 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.03 2owe h LEU 61 Cb 0.15 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.90 2owe h LEU 61 CO -0.14 0.10 -0.01 0.00 0.09 0.00 0.00 178.44 178.48 2owe n ALA 62 N -2.19 2.66 -0.43 1.53 0.00 -0.30 -4.13 120.51 117.66 2owe n ALA 62 Ca -0.01 -0.25 0.00 0.00 0.00 0.00 0.00 53.44 53.18 2owe n ALA 62 Cb 0.30 -1.43 0.00 0.00 0.00 0.00 0.00 19.45 18.32 2owe n ALA 62 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2owe n GLY 63 N 1.08 0.76 3.72 0.00 0.00 -0.71 -3.71 105.19 106.34 2owe n GLY 63 Ca 0.21 -0.23 -0.23 0.00 0.00 0.00 0.00 46.02 45.77 2owe n GLY 63 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2owe s PHE 64 N -2.00 2.89 -0.64 1.61 0.40 -0.44 -5.03 117.98 114.78 2owe s PHE 64 Ca 0.00 -0.16 0.05 0.00 -0.60 0.00 0.00 56.93 56.21 2owe s PHE 64 Cb 0.00 -1.30 0.17 0.00 0.51 0.00 0.00 43.02 42.40 2owe s PHE 64 CO 0.00 0.57 0.46 -1.12 0.70 0.00 0.00 175.22 175.82 2owe s SER 65 N -3.65 4.07 0.65 1.36 0.01 -1.26 -3.81 113.70 111.06 2owe s SER 65 Ca 0.32 -3.66 -0.12 0.00 1.31 0.00 0.00 55.95 53.79 2owe s SER 65 Cb -0.07 -1.37 -0.01 0.00 0.21 0.00 0.00 66.02 64.77 2owe s SER 65 CO 0.22 -0.11 1.05 -2.16 0.41 0.00 0.00 173.24 172.65 2owe s PRO 66 N -1.10 3.18 0.00 12.44 0.04 -1.26 -4.73 135.00 143.58 2owe s PRO 66 Ca 0.26 0.98 -0.15 0.00 0.04 0.00 0.00 61.00 62.13 2owe s PRO 66 Cb -0.03 -2.02 -0.06 0.00 0.04 0.00 0.00 34.50 32.43 2owe s PRO 66 CO -0.17 -0.91 0.43 1.03 0.04 0.00 0.00 177.00 177.42 2owe s ARG 67 N -4.78 3.97 -0.16 4.56 0.52 -0.92 -4.89 118.95 117.25 2owe s ARG 67 Ca 0.59 0.45 -0.21 0.00 -0.52 0.00 0.00 55.73 56.04 2owe s ARG 67 Cb -0.14 -3.23 -0.03 0.00 0.52 0.00 0.00 34.95 32.07 2owe s ARG 67 CO 0.49 0.66 0.63 -1.64 0.02 0.00 0.00 175.30 175.46 2owe s MET 68 N -1.00 4.27 -0.09 3.54 -1.94 -1.26 -1.12 119.30 121.70 2owe s MET 68 Ca 0.24 0.65 -0.00 0.00 -1.71 0.00 0.00 55.69 54.87 2owe s MET 68 Cb -0.17 -3.54 0.02 0.00 2.01 0.00 0.00 34.83 33.16 2owe s MET 68 CO 0.14 -0.13 -0.05 0.71 -0.01 0.00 0.00 175.02 175.67 2owe s TYR 69 N 1.55 1.16 0.53 -0.03 2.02 0.49 -4.92 117.35 118.15 2owe s TYR 69 Ca 0.30 -0.50 0.30 0.00 -0.37 0.00 0.00 57.07 56.80 2owe s TYR 69 Cb -0.16 -1.04 1.73 0.00 -0.40 0.00 0.00 41.96 42.08 2owe s TYR 69 CO 0.12 -0.42 2.20 -1.35 -1.57 0.00 0.00 175.55 174.52 2owe h PRO 70 N 8.10 0.00 0.00 -1.71 0.11 -1.94 -2.55 132.00 134.01 2owe h PRO 70 Ca -0.27 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.84 2owe h PRO 70 Cb 1.13 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.24 2owe h PRO 70 CO 0.37 0.04 0.00 0.93 -0.21 0.00 0.00 178.00 179.13 2owe h GLU 71 N 0.00 0.00 -0.36 1.05 3.07 -1.94 -1.29 114.58 115.11 2owe h GLU 71 Ca -0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 2owe h GLU 71 Cb 0.13 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.04 2owe h GLU 71 CO 0.01 0.00 0.00 1.28 -1.40 0.00 0.00 179.01 178.90 2owe n LEU 72 N -2.49 2.48 -4.74 1.33 4.77 -0.96 -4.32 117.00 113.07 2owe n LEU 72 Ca -0.01 -1.15 -0.35 0.00 -0.03 0.00 0.00 56.01 54.48 2owe n LEU 72 Cb 0.10 -0.24 0.06 0.00 -2.33 0.00 0.00 43.42 41.01 2owe n LEU 72 CO 0.15 0.57 0.81 -0.13 -1.33 0.00 0.00 177.39 177.46 2owe s ARG 73 N -1.52 2.56 0.93 3.23 0.52 -0.49 -4.34 118.95 119.85 2owe s ARG 73 Ca 0.34 1.75 -0.11 0.00 -0.52 0.00 0.00 55.73 57.18 2owe s ARG 73 Cb 0.18 -1.89 0.15 0.00 0.52 0.00 0.00 34.95 33.92 2owe s ARG 73 CO 0.25 -1.51 1.09 -2.00 0.02 0.00 0.00 175.30 173.16 2owe s GLU 74 N -3.69 0.95 0.45 3.54 2.56 -1.26 -4.86 118.70 116.39 2owe s GLU 74 Ca 0.75 0.96 -0.24 0.00 0.00 0.00 0.00 54.97 56.44 2owe s GLU 74 Cb -0.29 -1.76 -0.08 0.00 2.00 0.00 0.00 34.13 34.00 2owe s GLU 74 CO 0.40 -2.49 1.30 -1.50 -0.56 0.00 0.00 175.26 172.40 2owe s ILE 75 N -2.82 2.56 -0.14 -3.70 2.07 -1.26 -4.73 121.20 113.19 2owe s ILE 75 Ca 0.65 0.47 -0.28 0.00 -1.41 0.00 0.00 60.65 60.08 2owe s ILE 75 Cb -0.20 -3.26 -0.01 0.00 0.13 0.00 0.00 42.46 39.12 2owe s ILE 75 CO 0.58 0.04 0.93 -2.28 -1.91 0.00 0.00 174.94 172.30 2owe s HIS 76 N -1.32 3.46 -1.79 3.50 5.65 -1.26 -4.18 115.29 119.36 2owe s HIS 76 Ca 0.61 1.43 0.27 0.00 0.25 0.00 0.00 55.06 57.63 2owe s HIS 76 Cb -0.37 -3.11 0.97 0.00 -1.18 0.00 0.00 32.58 28.88 2owe s HIS 76 CO 0.46 -0.25 1.70 1.19 -0.65 0.00 0.00 174.74 177.19 2owe n PHE 77 N 5.19 0.00 0.00 3.88 3.72 -1.26 -1.43 117.46 127.55 2owe n PHE 77 Ca 0.07 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.47 2owe n PHE 77 Cb 0.49 -0.13 0.00 0.00 -0.94 0.00 0.00 39.48 38.89 2owe n PHE 77 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2owe n GLY 78 N 1.30 3.73 0.00 1.37 0.00 -1.26 -1.03 105.19 109.30 2owe n GLY 78 Ca 0.14 -0.04 0.07 0.00 0.00 0.00 0.00 46.02 46.19 2owe n GLY 78 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2owe n ALA 79 N 11.99 1.85 0.91 4.61 0.00 0.17 -2.14 120.51 137.90 2owe n ALA 79 Ca 0.00 -0.07 0.12 0.00 0.00 0.00 0.00 53.44 53.49 2owe n ALA 79 Cb 0.00 -1.24 0.24 0.00 0.00 0.00 0.00 19.45 18.45 2owe n ALA 79 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2owe n LEU 80 N -1.28 2.72 -4.71 0.00 4.77 -0.20 -4.84 117.00 113.46 2owe n LEU 80 Ca 0.07 -1.03 -0.43 0.00 -0.03 0.00 0.00 56.01 54.60 2owe n LEU 80 Cb 0.12 -0.09 -0.03 0.00 -2.33 0.00 0.00 43.42 41.09 2owe n LEU 80 CO 0.11 0.51 1.33 -0.62 -1.33 0.00 0.00 177.39 177.40 2owe n GLU 81 N 1.06 2.65 0.00 3.23 -0.58 -0.91 -0.89 120.64 125.20 2owe n GLU 81 Ca 0.17 0.95 0.00 0.00 -0.42 0.00 0.00 57.16 57.86 2owe n GLU 81 Cb 0.53 -2.78 0.00 0.00 -0.57 0.00 0.00 31.44 28.61 2owe n GLU 81 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2owe n GLY 82 N 3.78 2.86 3.60 0.62 0.00 0.10 -4.97 105.19 111.18 2owe n GLY 82 Ca 0.16 0.00 -0.47 0.00 0.00 0.00 0.00 46.02 45.71 2owe n GLY 82 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2owe n ALA 83 N 0.05 -0.31 -2.55 4.61 0.00 -0.07 -4.40 120.51 117.83 2owe n ALA 83 Ca 0.00 0.44 -0.43 0.00 0.00 0.00 0.00 53.44 53.45 2owe n ALA 83 Cb 0.00 -2.07 -0.02 0.00 0.00 0.00 0.00 19.45 17.36 2owe n ALA 83 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2owe s LEU 84 N 0.51 4.19 0.54 0.00 1.43 -1.26 -1.59 118.68 122.50 2owe s LEU 84 Ca 0.69 1.59 0.24 0.00 -1.03 0.00 0.00 54.13 55.62 2owe s LEU 84 Cb -0.78 -3.55 1.41 0.00 0.03 0.00 0.00 46.19 43.30 2owe s LEU 84 CO 0.54 -0.64 2.05 -0.25 0.23 0.00 0.00 176.35 178.28 2owe h TRP 85 N 7.61 0.00 -0.36 0.29 2.91 -1.78 -2.27 115.95 122.35 2owe h TRP 85 Ca -0.27 0.00 -0.01 0.00 1.13 0.00 0.00 58.89 59.75 2owe h TRP 85 Cb 1.11 0.00 -0.02 0.00 -0.51 0.00 0.00 29.16 29.74 2owe h TRP 85 CO 0.75 0.00 0.20 1.49 -1.03 0.00 0.00 178.44 179.86 2owe h GLU 86 N 0.00 0.50 -0.43 2.65 4.81 -1.90 -3.07 114.58 117.13 2owe h GLU 86 Ca 0.17 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.34 2owe h GLU 86 Cb 0.70 -0.10 0.00 0.00 0.63 0.00 0.00 28.75 29.98 2owe h GLU 86 CO -0.00 0.40 0.00 0.25 -0.73 0.00 0.00 179.01 178.93 2owe n THR 87 N -4.77 0.56 -1.87 0.32 -2.24 -0.90 -4.96 114.28 100.41 2owe n THR 87 Ca -0.01 -0.71 -0.41 0.00 -2.27 0.00 0.00 64.05 60.65 2owe n THR 87 Cb 0.07 0.70 -0.02 0.00 -2.10 0.00 0.00 70.33 68.98 2owe n THR 87 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 2owe s LEU 88 N -1.35 4.36 0.10 3.22 2.96 -0.91 -4.88 118.68 122.19 2owe s LEU 88 Ca 0.39 2.84 -0.35 0.00 -0.22 0.00 0.00 54.13 56.79 2owe s LEU 88 Cb 0.22 -3.63 -0.14 0.00 0.50 0.00 0.00 46.19 43.13 2owe s LEU 88 CO 0.30 -0.83 1.57 -0.67 -1.32 0.00 0.00 176.35 175.40 2owe n ASP 89 N 2.14 2.82 -0.29 3.68 -0.08 -1.26 -4.71 116.55 118.85 2owe n ASP 89 Ca 0.07 1.08 0.34 0.00 -1.51 0.00 0.00 54.79 54.77 2owe n ASP 89 Cb 0.39 -1.36 0.73 0.00 2.34 0.00 0.00 41.12 43.22 2owe n ASP 89 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 2owe h PRO 90 N 6.06 0.00 -0.52 -0.67 0.11 -1.97 0.18 132.00 135.19 2owe h PRO 90 Ca -0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 2owe h PRO 90 Cb 1.27 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.36 2owe h PRO 90 CO 0.87 0.00 0.33 0.07 -0.21 0.00 0.00 178.00 179.07 2owe h ARG 91 N 0.00 0.69 -0.09 1.05 0.11 -2.00 0.26 114.38 114.40 2owe h ARG 91 Ca 0.54 -0.05 -0.11 0.00 0.10 0.00 0.00 59.98 60.46 2owe h ARG 91 Cb 2.27 -0.15 0.00 0.00 1.11 0.00 0.00 29.97 33.21 2owe h ARG 91 CO -0.01 0.47 -0.39 1.88 0.10 0.00 0.00 179.97 182.02 2owe h TYR 92 N 0.70 0.56 -0.51 4.08 0.05 -1.03 -2.75 116.97 118.07 2owe h TYR 92 Ca 0.19 -0.24 0.09 0.00 0.05 0.00 0.00 58.73 58.81 2owe h TYR 92 Cb -0.06 -0.09 -0.07 0.00 1.01 0.00 0.00 36.73 37.52 2owe h TYR 92 CO -0.03 0.99 0.09 0.87 -1.05 0.00 0.00 178.16 179.03 2owe h LYS 93 N -0.04 0.22 -0.64 4.88 1.57 -1.12 0.34 116.57 121.77 2owe h LYS 93 Ca -0.02 -0.01 -0.07 0.00 -1.87 0.00 0.00 60.65 58.67 2owe h LYS 93 Cb 1.04 -0.05 -0.03 0.00 0.08 0.00 0.00 32.23 33.27 2owe h LYS 93 CO 0.08 0.15 0.13 0.93 -0.57 0.00 0.00 179.45 180.17 2owe h GLU 94 N 0.23 1.05 -0.42 3.15 4.39 -1.00 -1.37 114.58 120.60 2owe h GLU 94 Ca 0.26 -0.27 -0.08 0.00 0.34 0.00 0.00 59.36 59.61 2owe h GLU 94 Cb 0.35 -0.13 -0.02 0.00 -0.10 0.00 0.00 28.75 28.85 2owe h GLU 94 CO -0.34 0.95 -0.08 0.00 -1.16 0.00 0.00 179.01 178.39 2owe h ALA 95 N 1.05 1.08 -0.42 3.43 0.00 -1.06 -1.33 119.26 122.01 2owe h ALA 95 Ca 0.20 -0.29 -0.15 0.00 0.00 0.00 0.00 54.91 54.67 2owe h ALA 95 Cb 0.39 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 2owe h ALA 95 CO 0.01 0.57 -0.34 -0.07 0.00 0.00 0.00 179.25 179.42 2owe h LEU 96 N 0.66 1.01 -0.52 0.00 3.38 -0.68 0.21 115.31 119.38 2owe h LEU 96 Ca 0.12 -0.44 -0.09 0.00 0.09 0.00 0.00 57.88 57.56 2owe h LEU 96 Cb 0.52 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.97 2owe h LEU 96 CO 0.03 1.24 -0.02 -0.07 0.09 0.00 0.00 178.44 179.71 2owe h LEU 97 N 0.80 0.92 -0.29 1.67 3.38 -1.02 -2.90 115.31 117.86 2owe h LEU 97 Ca 0.08 -0.32 -0.07 0.00 0.09 0.00 0.00 57.88 57.66 2owe h LEU 97 Cb 0.93 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 41.42 2owe h LEU 97 CO 0.09 1.01 -0.33 0.03 0.09 0.00 0.00 178.44 179.33 2owe h ARG 98 N 0.80 0.00 -4.60 1.13 3.08 -1.21 -3.48 114.38 110.11 2owe h ARG 98 Ca 0.14 0.00 -0.24 0.00 0.07 0.00 0.00 59.98 59.95 2owe h ARG 98 Cb 0.56 0.00 0.12 0.00 0.08 0.00 0.00 29.97 30.73 2owe h ARG 98 CO 0.03 0.33 -0.54 0.34 -1.07 0.00 0.00 179.97 179.06 2owe n PHE 99 N -3.24 -1.64 -3.59 3.04 7.35 0.68 -5.03 117.46 115.03 2owe n PHE 99 Ca 0.02 0.68 -0.13 0.00 -0.76 0.00 0.00 57.45 57.26 2owe n PHE 99 Cb 0.61 -4.17 -0.06 0.00 0.35 0.00 0.00 39.48 36.21 2owe n PHE 99 CO 0.00 0.00 0.00 1.14 -0.76 0.00 0.00 176.76 177.14 2owe s GLN 100 N -5.11 0.76 -0.97 -4.13 -2.07 -0.84 -4.96 119.66 102.33 2owe s GLN 100 Ca 0.06 0.47 -0.04 0.00 -1.82 0.00 0.00 55.36 54.03 2owe s GLN 100 Cb -0.03 0.36 0.00 0.00 -1.09 0.00 0.00 33.01 32.26 2owe s GLN 100 CO 0.52 -0.18 0.49 0.41 -1.32 0.00 0.00 175.29 175.21 2owe n GLY 101 N 1.55 -0.07 3.09 2.60 0.00 -1.26 -4.57 105.19 106.53 2owe n GLY 101 Ca -0.14 -0.16 -0.32 0.00 0.00 0.00 0.00 46.02 45.40 2owe n GLY 101 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2owe s PHE 102 N -3.02 2.52 -0.33 1.61 5.36 -1.26 -4.86 117.98 118.00 2owe s PHE 102 Ca 0.24 -1.43 0.00 0.00 -0.96 0.00 0.00 56.93 54.79 2owe s PHE 102 Cb -0.11 -1.77 0.14 0.00 -0.34 0.00 0.00 43.02 40.94 2owe s PHE 102 CO 0.30 -0.72 0.26 -1.58 -1.46 0.00 0.00 175.22 172.02 2owe s HIS 103 N 1.26 0.10 0.26 10.12 5.65 -1.26 -0.77 115.29 130.66 2owe s HIS 103 Ca 0.03 -0.96 -0.30 0.00 0.25 0.00 0.00 55.06 54.08 2owe s HIS 103 Cb -0.13 -0.67 -0.10 0.00 -1.18 0.00 0.00 32.58 30.50 2owe s HIS 103 CO -0.10 -0.89 1.44 -1.25 -0.65 0.00 0.00 174.74 173.29 2owe s PRO 104 N 1.63 4.26 -0.33 2.88 0.04 -1.26 -4.87 135.00 137.35 2owe s PRO 104 Ca 0.14 2.32 -0.39 0.00 0.04 0.00 0.00 61.00 63.12 2owe s PRO 104 Cb -0.18 -3.09 -0.14 0.00 0.04 0.00 0.00 34.50 31.13 2owe s PRO 104 CO -0.14 -0.42 1.95 -2.30 0.04 0.00 0.00 177.00 176.14 2owe n PRO 105 N 2.11 1.01 -0.53 0.56 -0.02 -1.26 0.17 135.00 137.04 2owe n PRO 105 Ca 0.06 0.33 0.00 0.00 -2.02 0.00 0.00 63.50 61.87 2owe n PRO 105 Cb 0.40 -2.17 0.00 0.00 -0.02 0.00 0.00 33.50 31.71 2owe n PRO 105 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2owe n GLY 106 N 5.43 1.44 0.00 -1.23 0.00 -1.26 0.43 105.19 110.01 2owe n GLY 106 Ca 0.35 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.37 2owe n GLY 106 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2owe n GLY 107 N -2.00 2.99 3.90 -0.02 0.00 0.13 -4.28 105.19 105.90 2owe n GLY 107 Ca 0.00 -2.01 -0.32 0.00 0.00 0.00 0.00 46.02 43.69 2owe n GLY 107 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2owe s GLU 108 N 2.79 3.57 0.54 1.61 2.02 -0.52 -4.81 118.70 123.91 2owe s GLU 108 Ca 0.00 -0.15 -0.18 0.00 0.02 0.00 0.00 54.97 54.66 2owe s GLU 108 Cb 0.00 -2.97 -0.06 0.00 0.10 0.00 0.00 34.13 31.20 2owe s GLU 108 CO 0.00 0.56 1.04 -1.54 0.02 0.00 0.00 175.26 175.33 2owe s SER 109 N -2.20 6.14 0.48 -0.19 1.04 -1.26 -4.04 113.70 113.65 2owe s SER 109 Ca 0.35 1.82 0.16 0.00 0.48 0.00 0.00 55.95 58.76 2owe s SER 109 Cb -0.13 -2.54 1.13 0.00 0.10 0.00 0.00 66.02 64.58 2owe s SER 109 CO 0.23 -0.92 2.05 0.25 0.98 0.00 0.00 173.24 175.83 2owe h LEU 110 N 0.95 0.00 -0.30 2.42 5.85 -1.37 -1.32 115.31 121.55 2owe h LEU 110 Ca -0.48 0.00 -0.14 0.00 0.84 0.00 0.00 57.88 58.10 2owe h LEU 110 Cb 1.21 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 42.24 2owe h LEU 110 CO 0.59 0.12 -0.35 0.77 -0.34 0.00 0.00 178.44 179.22 2owe h SER 111 N 0.00 0.83 -0.23 1.25 4.64 -1.91 -1.38 113.55 116.74 2owe h SER 111 Ca -0.00 -0.49 -0.15 0.00 -0.47 0.00 0.00 61.79 60.68 2owe h SER 111 Cb 0.21 -0.23 -0.01 0.00 -0.31 0.00 0.00 62.40 62.06 2owe h SER 111 CO 0.02 1.15 -0.40 0.00 -0.87 0.00 0.00 176.83 176.72 2owe h ALA 112 N 0.70 0.69 -0.07 5.18 0.00 -1.82 -2.05 119.26 121.89 2owe h ALA 112 Ca 0.04 -0.45 -0.00 0.00 0.00 0.00 0.00 54.91 54.50 2owe h ALA 112 Cb 0.94 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.61 2owe h ALA 112 CO 0.08 0.67 0.04 0.35 0.00 0.00 0.00 179.25 180.39 2owe h PHE 113 N 0.63 0.10 0.00 0.00 3.57 -1.20 -2.28 116.94 117.77 2owe h PHE 113 Ca 0.05 -0.00 -0.08 0.00 3.53 0.00 0.00 57.97 61.47 2owe h PHE 113 Cb 0.96 -0.03 -0.01 0.00 2.79 0.00 0.00 35.95 39.66 2owe h PHE 113 CO 0.05 0.15 -0.38 1.96 -2.23 0.00 0.00 178.31 177.86 2owe h GLN 114 N 0.02 0.00 -0.38 1.11 4.20 -1.23 -2.17 115.11 116.67 2owe h GLN 114 Ca 0.03 0.00 -0.11 0.00 0.06 0.00 0.00 58.65 58.63 2owe h GLN 114 Cb 0.08 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.85 2owe h GLN 114 CO -0.00 0.38 -0.18 1.49 -0.67 0.00 0.00 178.83 179.85 2owe h GLU 115 N 0.00 0.79 -0.05 1.46 4.81 -1.15 -1.47 114.58 118.96 2owe h GLU 115 Ca -0.00 -0.34 -0.13 0.00 -0.13 0.00 0.00 59.36 58.76 2owe h GLU 115 Cb 0.78 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 30.12 2owe h GLU 115 CO 0.05 0.96 -0.56 0.07 -0.73 0.00 0.00 179.01 178.80 2owe h ARG 116 N 0.59 0.15 0.25 1.92 0.11 -1.22 -1.10 114.38 115.08 2owe h ARG 116 Ca 0.09 -0.10 -0.01 0.00 0.10 0.00 0.00 59.98 60.06 2owe h ARG 116 Cb 0.72 0.01 0.00 0.00 1.11 0.00 0.00 29.97 31.82 2owe h ARG 116 CO 0.05 0.67 -0.12 0.28 0.10 0.00 0.00 179.97 180.95 2owe h VAL 117 N 0.12 0.80 -0.14 0.08 2.07 -1.26 -2.06 116.25 115.86 2owe h VAL 117 Ca -0.00 -0.57 -0.09 0.00 0.82 0.00 0.00 66.70 66.85 2owe h VAL 117 Cb 1.02 1.12 -0.01 0.00 -1.52 0.00 0.00 31.29 31.90 2owe h VAL 117 CO 0.08 0.12 -0.33 -0.26 0.02 0.00 0.00 177.57 177.21 2owe h PHE 118 N -0.64 0.31 -0.74 1.57 0.04 -1.29 -2.17 116.94 114.02 2owe h PHE 118 Ca -0.03 -0.07 -0.02 0.00 2.80 0.00 0.00 57.97 60.65 2owe h PHE 118 Cb 0.46 -0.08 -0.03 0.00 2.20 0.00 0.00 35.95 38.50 2owe h PHE 118 CO 0.02 0.58 0.39 -0.09 -0.60 0.00 0.00 178.31 178.60 2owe h ARG 119 N 0.24 1.05 -0.25 1.51 2.43 -1.18 -1.53 114.38 116.65 2owe h ARG 119 Ca 0.03 -0.14 -0.01 0.00 -0.81 0.00 0.00 59.98 59.06 2owe h ARG 119 Cb 0.70 -0.20 -0.01 0.00 -0.42 0.00 0.00 29.97 30.04 2owe h ARG 119 CO 0.05 0.80 0.13 0.35 -1.51 0.00 0.00 179.97 179.79 2owe h PHE 120 N 1.03 0.35 -0.54 2.20 3.57 -0.88 -2.50 116.94 120.16 2owe h PHE 120 Ca 0.26 -0.01 0.05 0.00 3.53 0.00 0.00 57.97 61.80 2owe h PHE 120 Cb 0.07 -0.11 -0.03 0.00 2.79 0.00 0.00 35.95 38.67 2owe h PHE 120 CO 0.00 0.31 0.36 -0.07 -2.23 0.00 0.00 178.31 176.69 2owe h LEU 121 N 0.29 0.47 -1.72 0.59 3.38 -1.00 -1.08 115.31 116.24 2owe h LEU 121 Ca 0.09 -0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.03 2owe h LEU 121 Cb 0.08 -0.10 -0.00 0.00 0.09 0.00 0.00 40.66 40.72 2owe h LEU 121 CO -0.01 0.32 -0.11 -0.33 0.09 0.00 0.00 178.44 178.40 2owe h GLU 122 N 0.54 0.00 -0.01 1.13 3.07 -0.84 -2.81 114.58 115.67 2owe h GLU 122 Ca 0.23 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.09 2owe h GLU 122 Cb 0.22 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.13 2owe h GLU 122 CO -0.06 0.11 -0.03 0.41 -1.40 0.00 0.00 179.01 178.03 2owe n GLY 123 N -0.34 -0.46 3.73 -3.84 0.00 -0.41 -4.87 105.19 99.00 2owe n GLY 123 Ca -0.01 -0.35 -0.41 0.00 0.00 0.00 0.00 46.02 45.26 2owe n GLY 123 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2owe s LEU 124 N -2.11 4.44 -0.07 0.99 1.43 -1.06 -4.96 118.68 117.34 2owe s LEU 124 Ca 0.38 1.57 0.19 0.00 -1.03 0.00 0.00 54.13 55.25 2owe s LEU 124 Cb 0.21 -3.38 -0.29 0.00 0.03 0.00 0.00 46.19 42.76 2owe s LEU 124 CO 0.38 -0.06 0.34 0.29 0.23 0.00 0.00 176.35 177.52 2owe n LYS 125 N 3.03 0.71 -4.06 1.70 4.76 -1.26 -5.01 118.16 118.03 2owe n LYS 125 Ca 0.00 -0.13 -0.08 0.00 -2.87 0.00 0.00 58.31 55.23 2owe n LYS 125 Cb 0.50 -1.48 -0.10 0.00 -1.84 0.00 0.00 35.03 32.11 2owe n LYS 125 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2owe s ALA 126 N -3.13 0.40 0.50 7.82 0.00 -1.26 -5.13 121.76 120.95 2owe s ALA 126 Ca -0.08 -1.04 -0.20 0.00 0.00 0.00 0.00 51.96 50.64 2owe s ALA 126 Cb 0.11 0.24 -0.10 0.00 0.00 0.00 0.00 23.12 23.37 2owe s ALA 126 CO 0.81 -0.32 0.61 -2.30 0.00 0.00 0.00 175.76 174.57 2owe n PRO 127 N 0.49 0.66 -3.82 0.00 -0.02 -1.26 -4.99 135.00 126.07 2owe n PRO 127 Ca -0.17 0.25 -0.08 0.00 -2.02 0.00 0.00 63.50 61.48 2owe n PRO 127 Cb 0.59 -1.69 -0.03 0.00 -0.02 0.00 0.00 33.50 32.36 2owe n PRO 127 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2owe s ALA 128 N -1.56 -1.06 -0.19 3.55 0.00 -1.20 -4.41 121.76 116.89 2owe s ALA 128 Ca 0.66 -0.31 -0.04 0.00 0.00 0.00 0.00 51.96 52.28 2owe s ALA 128 Cb -0.52 0.89 -0.02 0.00 0.00 0.00 0.00 23.12 23.47 2owe s ALA 128 CO 0.56 -0.95 -0.03 0.08 0.00 0.00 0.00 175.76 175.42 2owe s VAL 129 N -3.91 3.69 -0.34 0.00 1.01 -0.54 -1.42 120.40 118.89 2owe s VAL 129 Ca 0.12 -0.41 -0.06 0.00 0.00 0.00 0.00 61.98 61.62 2owe s VAL 129 Cb -0.04 -2.65 0.04 0.00 0.00 0.00 0.00 36.38 33.73 2owe s VAL 129 CO 0.04 0.45 0.11 -0.76 0.00 0.00 0.00 175.10 174.94 2owe s LEU 130 N 0.92 4.36 -0.44 3.92 1.43 0.91 -1.17 118.68 128.61 2owe s LEU 130 Ca -0.00 -1.17 -0.25 0.00 -1.03 0.00 0.00 54.13 51.68 2owe s LEU 130 Cb -0.15 -1.87 0.02 0.00 0.03 0.00 0.00 46.19 44.23 2owe s LEU 130 CO 0.01 -0.34 0.91 -0.36 0.23 0.00 0.00 176.35 176.81 2owe s PHE 131 N 1.40 2.96 0.00 0.29 0.08 0.14 -0.63 117.98 122.21 2owe s PHE 131 Ca -0.01 0.46 0.00 0.00 0.12 0.00 0.00 56.93 57.49 2owe s PHE 131 Cb -0.20 -3.87 0.00 0.00 -0.57 0.00 0.00 43.02 38.38 2owe s PHE 131 CO 0.03 -1.03 0.00 -2.37 -0.10 0.00 0.00 175.22 171.75 2owe n THR 132 N 6.30 0.00 -4.50 0.64 5.66 0.19 -1.71 114.28 120.85 2owe n THR 132 Ca 0.06 0.00 -0.24 0.00 -3.05 0.00 0.00 64.05 60.82 2owe n THR 132 Cb 0.48 0.00 -0.10 0.00 -1.55 0.00 0.00 70.33 69.16 2owe n THR 132 CO 0.00 0.00 0.00 -1.00 -3.05 0.00 0.00 175.07 171.02 2owe s HIS 133 N 0.52 2.21 0.27 1.09 3.76 -1.26 -1.95 115.29 119.93 2owe s HIS 133 Ca 0.00 -0.60 -0.01 0.00 -0.15 0.00 0.00 55.06 54.30 2owe s HIS 133 Cb 0.00 -1.28 0.51 0.00 1.11 0.00 0.00 32.58 32.92 2owe s HIS 133 CO 0.00 0.44 1.80 0.78 -0.85 0.00 0.00 174.74 176.91 2owe h GLY 134 N 2.13 1.46 1.48 -2.22 0.00 -1.94 -1.18 103.07 102.79 2owe h GLY 134 Ca -0.41 -0.34 -0.04 0.00 0.00 0.00 0.00 47.33 46.55 2owe h GLY 134 CO 0.69 0.08 0.13 -1.33 0.00 0.00 0.00 176.54 176.11 2owe h GLY 135 N 0.81 0.71 0.59 4.60 0.00 -1.96 0.18 103.07 108.01 2owe h GLY 135 Ca 0.46 -0.38 -0.04 0.00 0.00 0.00 0.00 47.33 47.37 2owe h GLY 135 CO -0.29 0.36 -0.13 -2.08 0.00 0.00 0.00 176.54 174.39 2owe h VAL 136 N 0.65 1.42 -0.77 4.60 2.07 -1.59 -1.91 116.25 120.72 2owe h VAL 136 Ca 0.15 -1.45 0.03 0.00 0.82 0.00 0.00 66.70 66.25 2owe h VAL 136 Cb 0.22 2.22 -0.04 0.00 -1.52 0.00 0.00 31.29 32.16 2owe h VAL 136 CO -0.01 0.40 0.49 0.58 0.02 0.00 0.00 177.57 179.06 2owe h VAL 137 N -0.29 1.14 -0.67 2.57 2.07 -1.13 -2.22 116.25 117.72 2owe h VAL 137 Ca 0.00 -0.34 -0.03 0.00 0.82 0.00 0.00 66.70 67.16 2owe h VAL 137 Cb 0.72 0.07 -0.03 0.00 -1.52 0.00 0.00 31.29 30.53 2owe h VAL 137 CO 0.03 0.18 0.32 -0.09 0.02 0.00 0.00 177.57 178.03 2owe h ARG 138 N 0.98 0.97 -0.35 1.57 2.43 -0.93 -0.93 114.38 118.12 2owe h ARG 138 Ca 0.30 -0.14 0.00 0.00 -0.81 0.00 0.00 59.98 59.33 2owe h ARG 138 Cb -0.02 -0.17 -0.02 0.00 -0.42 0.00 0.00 29.97 29.34 2owe h ARG 138 CO -0.10 0.77 0.23 0.00 -1.51 0.00 0.00 179.97 179.36 2owe h ALA 139 N 1.15 0.44 -0.05 2.80 0.00 -0.89 -0.04 119.26 122.67 2owe h ALA 139 Ca 0.23 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.11 2owe h ALA 139 Cb 0.12 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 17.78 2owe h ALA 139 CO -0.03 -0.10 0.01 0.28 0.00 0.00 0.00 179.25 179.41 2owe h VAL 140 N 0.46 1.19 -0.80 0.00 2.07 -1.21 -2.22 116.25 115.75 2owe h VAL 140 Ca 0.13 -0.58 -0.00 0.00 0.82 0.00 0.00 66.70 67.07 2owe h VAL 140 Cb -0.05 1.49 -0.04 0.00 -1.52 0.00 0.00 31.29 31.18 2owe h VAL 140 CO -0.03 0.16 0.50 -0.07 0.02 0.00 0.00 177.57 178.14 2owe h LEU 141 N -0.15 0.95 -0.60 2.57 3.38 -1.04 -2.37 115.31 118.05 2owe h LEU 141 Ca 0.01 -0.06 -0.03 0.00 0.09 0.00 0.00 57.88 57.90 2owe h LEU 141 Cb 0.24 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.73 2owe h LEU 141 CO 0.00 0.73 0.27 0.03 0.09 0.00 0.00 178.44 179.55 2owe h ARG 142 N 1.10 0.87 -0.16 1.13 3.08 -0.55 -1.08 114.38 118.76 2owe h ARG 142 Ca 0.29 -0.14 0.05 0.00 0.07 0.00 0.00 59.98 60.24 2owe h ARG 142 Cb -0.06 -0.15 -0.01 0.00 0.08 0.00 0.00 29.97 29.83 2owe h ARG 142 CO -0.06 0.72 0.12 0.00 -1.07 0.00 0.00 179.97 179.68 2owe h ALA 143 N 1.11 2.09 -0.32 0.04 0.00 -1.00 0.24 119.26 121.42 2owe h ALA 143 Ca 0.20 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.11 2owe h ALA 143 Cb 0.15 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.95 2owe h ALA 143 CO -0.02 -0.20 0.00 1.28 0.00 0.00 0.00 179.25 180.31 2owe n LEU 144 N -4.40 2.20 -0.03 0.00 4.77 -0.54 -4.89 117.00 114.11 2owe n LEU 144 Ca 0.01 -1.11 -0.00 0.00 -0.03 0.00 0.00 56.01 54.88 2owe n LEU 144 Cb 0.25 -0.33 -0.00 0.00 -2.33 0.00 0.00 43.42 41.00 2owe n LEU 144 CO 0.34 0.44 -0.00 0.61 -1.33 0.00 0.00 177.39 177.45 2owe n GLY 145 N 0.81 0.45 3.46 -0.72 0.00 0.07 -4.90 105.19 104.37 2owe n GLY 145 Ca 0.12 -0.11 -0.27 0.00 0.00 0.00 0.00 46.02 45.76 2owe n GLY 145 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2owe s GLU 146 N -0.54 1.67 0.26 1.61 2.02 -0.52 -5.01 118.70 118.19 2owe s GLU 146 Ca 0.00 -1.49 -0.30 0.00 0.02 0.00 0.00 54.97 53.20 2owe s GLU 146 Cb 0.00 -1.91 -0.09 0.00 0.10 0.00 0.00 34.13 32.23 2owe s GLU 146 CO 0.00 0.40 1.09 0.34 0.02 0.00 0.00 175.26 177.11 2owe s ASP 147 N -2.80 7.30 -0.46 -0.19 -1.08 -1.26 -2.27 116.67 115.90 2owe s ASP 147 Ca 0.23 2.21 0.04 0.00 -0.52 0.00 0.00 52.55 54.50 2owe s ASP 147 Cb -0.08 -2.62 0.60 0.00 -1.46 0.00 0.00 42.92 39.36 2owe s ASP 147 CO 0.12 -0.13 1.85 0.61 0.52 0.00 0.00 175.17 178.13 2owe n GLY 148 N 1.39 4.86 3.60 2.66 0.00 -1.26 -4.85 105.19 111.58 2owe n GLY 148 Ca -0.00 -1.37 -0.42 0.00 0.00 0.00 0.00 46.02 44.22 2owe n GLY 148 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2owe s LEU 149 N -3.40 4.06 0.17 0.99 1.43 -1.26 -3.79 118.68 116.88 2owe s LEU 149 Ca 0.56 0.49 0.07 0.00 -1.03 0.00 0.00 54.13 54.22 2owe s LEU 149 Cb 0.47 -3.16 -0.04 0.00 0.03 0.00 0.00 46.19 43.49 2owe s LEU 149 CO 0.07 -0.80 -0.14 0.68 0.23 0.00 0.00 176.35 176.39 2owe s VAL 150 N 3.31 1.53 0.49 -1.59 -7.23 -1.26 -5.14 120.40 110.51 2owe s VAL 150 Ca 0.35 -2.01 -0.17 0.00 -1.81 0.00 0.00 61.98 58.34 2owe s VAL 150 Cb -0.12 -1.84 -0.08 0.00 0.56 0.00 0.00 36.38 34.89 2owe s VAL 150 CO 0.18 -0.54 0.96 -2.16 -0.31 0.00 0.00 175.10 173.23 2owe s PRO 151 N -3.29 3.98 0.59 4.82 0.04 -1.26 -5.00 135.00 134.89 2owe s PRO 151 Ca 0.17 0.94 -0.20 0.00 0.04 0.00 0.00 61.00 61.95 2owe s PRO 151 Cb -0.02 -2.17 -0.04 0.00 0.04 0.00 0.00 34.50 32.32 2owe s PRO 151 CO 0.05 -0.21 1.30 -2.30 0.04 0.00 0.00 177.00 175.88 2owe n PRO 152 N -1.38 1.42 -1.05 0.56 -0.02 -1.26 -2.08 135.00 131.19 2owe n PRO 152 Ca 0.06 0.53 -0.02 0.00 -2.02 0.00 0.00 63.50 62.06 2owe n PRO 152 Cb 0.54 -2.52 -0.01 0.00 -0.02 0.00 0.00 33.50 31.49 2owe n PRO 152 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2owe n GLY 153 N 0.87 0.50 3.74 -1.23 0.00 -0.59 -4.76 105.19 103.71 2owe n GLY 153 Ca 0.13 -0.23 -0.24 0.00 0.00 0.00 0.00 46.02 45.67 2owe n GLY 153 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2owe s SER 154 N -2.27 4.47 0.07 1.61 1.04 -0.88 -4.82 113.70 112.91 2owe s SER 154 Ca 0.00 -1.02 0.01 0.00 0.48 0.00 0.00 55.95 55.43 2owe s SER 154 Cb 0.00 -0.52 -0.03 0.00 0.10 0.00 0.00 66.02 65.57 2owe s SER 154 CO 0.00 -0.50 -0.06 0.00 0.98 0.00 0.00 173.24 173.66 2owe s ALA 155 N -2.57 0.72 -0.02 5.32 0.00 0.17 -1.28 121.76 124.10 2owe s ALA 155 Ca 0.41 -1.08 0.01 0.00 0.00 0.00 0.00 51.96 51.29 2owe s ALA 155 Cb 0.02 0.14 0.02 0.00 0.00 0.00 0.00 23.12 23.30 2owe s ALA 155 CO 0.23 -0.18 -0.01 0.14 0.00 0.00 0.00 175.76 175.94 2owe s VAL 156 N -2.77 0.20 -0.13 0.00 -7.23 -0.39 0.84 120.40 110.91 2owe s VAL 156 Ca 0.02 0.02 -0.06 0.00 -1.81 0.00 0.00 61.98 60.15 2owe s VAL 156 Cb -0.01 -0.26 -0.04 0.00 0.56 0.00 0.00 36.38 36.64 2owe s VAL 156 CO -0.04 0.12 0.09 0.00 -0.31 0.00 0.00 175.10 174.97 2owe s ALA 157 N 0.72 3.60 0.11 1.32 0.00 0.80 -0.36 121.76 127.95 2owe s ALA 157 Ca -0.07 -0.71 0.06 0.00 0.00 0.00 0.00 51.96 51.23 2owe s ALA 157 Cb -0.10 -1.86 -0.04 0.00 0.00 0.00 0.00 23.12 21.12 2owe s ALA 157 CO -0.01 0.46 -0.14 0.14 0.00 0.00 0.00 175.76 176.21 2owe s VAL 158 N -0.52 1.26 -0.99 0.00 -7.23 0.36 -0.08 120.40 113.19 2owe s VAL 158 Ca 0.11 -1.66 -0.02 0.00 -1.81 0.00 0.00 61.98 58.60 2owe s VAL 158 Cb -0.12 -1.46 0.31 0.00 0.56 0.00 0.00 36.38 35.67 2owe s VAL 158 CO 0.02 -0.41 1.45 -0.67 -0.31 0.00 0.00 175.10 175.18 2owe n ASP 159 N 0.62 6.24 -4.70 4.85 -0.08 0.33 -0.39 116.55 123.41 2owe n ASP 159 Ca -0.16 -3.50 -0.43 0.00 -1.51 0.00 0.00 54.79 49.19 2owe n ASP 159 Cb 0.57 -1.13 -0.01 0.00 2.34 0.00 0.00 41.12 42.88 2owe n ASP 159 CO 0.00 0.00 0.00 1.87 0.12 0.00 0.00 177.20 179.19 2owe n TRP 160 N 0.84 2.35 -1.42 -0.67 -0.00 -0.54 -0.36 117.44 117.64 2owe n TRP 160 Ca 0.32 0.49 -0.26 0.00 -0.00 0.00 0.00 57.50 58.04 2owe n TRP 160 Cb 0.33 -2.45 0.12 0.00 -0.00 0.00 0.00 31.31 29.30 2owe n TRP 160 CO 0.00 0.00 0.00 -0.35 -0.00 0.00 0.00 177.69 177.34 2owe n PRO 161 N 1.08 2.58 -0.10 5.87 -0.04 -1.26 0.15 135.00 143.27 2owe n PRO 161 Ca 0.07 -3.33 -0.13 0.00 -0.04 0.00 0.00 63.50 60.07 2owe n PRO 161 Cb 0.35 -2.19 -0.05 0.00 -0.04 0.00 0.00 33.50 31.57 2owe n PRO 161 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2owe n ARG 162 N -0.98 0.53 -3.78 0.54 1.74 0.52 -5.00 116.66 110.22 2owe n ARG 162 Ca 0.55 0.30 -0.11 0.00 -0.77 0.00 0.00 57.85 57.83 2owe n ARG 162 Cb 1.02 -1.51 0.01 0.00 -1.02 0.00 0.00 32.46 30.96 2owe n ARG 162 CO 0.00 0.00 0.00 2.89 -1.52 0.00 0.00 177.63 179.00 2owe n ARG 163 N -4.44 0.96 -3.58 5.56 1.85 -1.06 -4.98 116.66 110.97 2owe n ARG 163 Ca -0.22 -2.38 -0.37 0.00 -1.00 0.00 0.00 57.85 53.88 2owe n ARG 163 Cb 0.56 2.69 -0.06 0.00 -1.05 0.00 0.00 32.46 34.60 2owe n ARG 163 CO 0.00 0.00 0.00 0.08 -0.01 0.00 0.00 177.63 177.70 2owe s VAL 164 N -2.37 5.12 -0.25 8.89 1.01 -1.26 0.12 120.40 131.66 2owe s VAL 164 Ca 0.20 0.64 -0.15 0.00 0.00 0.00 0.00 61.98 62.66 2owe s VAL 164 Cb -0.03 -3.65 -0.11 0.00 0.00 0.00 0.00 36.38 32.59 2owe s VAL 164 CO 0.15 0.51 -0.33 0.18 0.00 0.00 0.00 175.10 175.61 2owe n LEU 165 N 1.59 1.95 -3.58 3.92 4.77 0.88 -4.79 117.00 121.75 2owe n LEU 165 Ca -0.13 0.35 -0.16 0.00 -0.03 0.00 0.00 56.01 56.03 2owe n LEU 165 Cb 0.53 -0.81 -0.07 0.00 -2.33 0.00 0.00 43.42 40.74 2owe n LEU 165 CO 0.38 0.33 0.39 0.54 -1.33 0.00 0.00 177.39 177.70 2owe s VAL 166 N -2.60 0.00 -0.23 4.08 0.11 -1.03 -4.99 120.40 115.75 2owe s VAL 166 Ca -0.36 -0.03 -0.05 0.00 -2.93 0.00 0.00 61.98 58.61 2owe s VAL 166 Cb 0.12 -0.95 -0.02 0.00 -1.53 0.00 0.00 36.38 33.99 2owe s VAL 166 CO 0.47 -0.02 0.01 -0.13 -3.33 0.00 0.00 175.10 172.10 2owe s ARG 167 N -0.68 3.53 -0.29 1.54 0.52 -1.26 -0.14 118.95 122.17 2owe s ARG 167 Ca -0.07 -0.55 -0.06 0.00 -0.52 0.00 0.00 55.73 54.53 2owe s ARG 167 Cb -0.02 -3.14 0.01 0.00 0.52 0.00 0.00 34.95 32.32 2owe s ARG 167 CO 0.07 -0.15 0.06 -1.17 0.02 0.00 0.00 175.30 174.13 2owe s LEU 168 N 1.42 3.78 -0.01 2.53 2.96 0.25 -4.99 118.68 124.61 2owe s LEU 168 Ca 0.05 -0.73 0.00 0.00 -0.22 0.00 0.00 54.13 53.24 2owe s LEU 168 Cb -0.15 -1.86 0.02 0.00 0.50 0.00 0.00 46.19 44.70 2owe s LEU 168 CO 0.00 -0.18 0.01 0.00 -1.32 0.00 0.00 176.35 174.86 2owe s ALA 169 N 1.48 0.14 0.00 5.97 0.00 -1.26 -0.65 121.76 127.44 2owe s ALA 169 Ca 0.02 0.13 0.00 0.00 0.00 0.00 0.00 51.96 52.12 2owe s ALA 169 Cb -0.17 -0.18 0.00 0.00 0.00 0.00 0.00 23.12 22.77 2owe s ALA 169 CO 0.02 -0.05 0.00 1.47 0.00 0.00 0.00 175.76 177.20