#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dm7 n SER 2 N 0.00 -2.91 -3.62 1.61 7.64 -1.26 -4.93 113.62 110.15 2dm7 n SER 2 Ca 0.00 -0.97 -0.13 0.00 1.01 0.00 0.00 58.87 58.77 2dm7 n SER 2 Cb 0.00 -2.99 -0.07 0.00 -1.01 0.00 0.00 64.21 60.14 2dm7 n SER 2 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 2dm7 s SER 3 N -3.52 -0.67 0.00 6.43 1.04 -1.26 -5.11 113.70 110.61 2dm7 s SER 3 Ca 0.57 1.24 0.00 0.00 0.48 0.00 0.00 55.95 58.24 2dm7 s SER 3 Cb -0.31 1.23 0.00 0.00 0.10 0.00 0.00 66.02 67.05 2dm7 s SER 3 CO 0.91 -0.27 0.00 0.61 0.98 0.00 0.00 173.24 175.47 2dm7 n GLY 4 N 2.38 0.32 2.75 7.32 0.00 -1.26 -4.91 105.19 111.78 2dm7 n GLY 4 Ca -0.14 -1.19 -0.30 0.00 0.00 0.00 0.00 46.02 44.39 2dm7 n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2dm7 s SER 5 N -4.00 3.87 0.93 1.61 0.15 -1.26 -5.12 113.70 109.88 2dm7 s SER 5 Ca 0.00 -2.29 -0.15 0.00 0.70 0.00 0.00 55.95 54.21 2dm7 s SER 5 Cb 0.00 -1.04 0.17 0.00 -1.71 0.00 0.00 66.02 63.44 2dm7 s SER 5 CO 0.00 -0.32 1.28 -0.44 1.20 0.00 0.00 173.24 174.96 2dm7 s SER 6 N 0.78 3.41 0.00 5.45 0.01 -1.26 -5.08 113.70 117.01 2dm7 s SER 6 Ca 0.15 0.42 0.00 0.00 1.31 0.00 0.00 55.95 57.83 2dm7 s SER 6 Cb -0.22 -0.59 0.00 0.00 0.21 0.00 0.00 66.02 65.42 2dm7 s SER 6 CO -0.08 -2.56 0.00 0.61 0.41 0.00 0.00 173.24 171.62 2dm7 n GLY 7 N -3.55 0.96 3.77 3.44 0.00 -1.26 -5.10 105.19 103.45 2dm7 n GLY 7 Ca 0.13 -0.06 -0.38 0.00 0.00 0.00 0.00 46.02 45.71 2dm7 n GLY 7 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2dm7 s PRO 8 N 0.47 3.92 0.57 1.61 0.04 -1.26 -5.02 135.00 135.34 2dm7 s PRO 8 Ca 0.00 1.84 -0.16 0.00 0.04 0.00 0.00 61.00 62.72 2dm7 s PRO 8 Cb 0.00 -2.57 -0.05 0.00 0.04 0.00 0.00 34.50 31.92 2dm7 s PRO 8 CO 0.00 -0.43 1.04 0.00 0.04 0.00 0.00 177.00 177.65 2dm7 s ALA 9 N -1.46 2.81 0.30 8.56 0.00 -1.26 -4.95 121.76 125.76 2dm7 s ALA 9 Ca 0.60 0.36 0.02 0.00 0.00 0.00 0.00 51.96 52.94 2dm7 s ALA 9 Cb -0.30 -3.21 -0.05 0.00 0.00 0.00 0.00 23.12 19.56 2dm7 s ALA 9 CO 0.38 -0.67 0.10 -0.98 0.00 0.00 0.00 175.76 174.58 2dm7 s ARG 10 N -4.05 1.55 0.06 0.00 1.04 -1.26 -4.19 118.95 112.09 2dm7 s ARG 10 Ca 0.63 -1.86 -0.18 0.00 -1.04 0.00 0.00 55.73 53.28 2dm7 s ARG 10 Cb -0.15 -0.41 -0.06 0.00 -2.04 0.00 0.00 34.95 32.29 2dm7 s ARG 10 CO 0.35 -0.31 0.52 -0.06 -0.04 0.00 0.00 175.30 175.76 2dm7 s PHE 11 N -3.57 3.78 -0.26 5.89 0.40 -1.26 -0.04 117.98 122.91 2dm7 s PHE 11 Ca 0.36 1.19 0.09 0.00 -0.60 0.00 0.00 56.93 57.97 2dm7 s PHE 11 Cb 0.07 -2.43 -0.12 0.00 0.51 0.00 0.00 43.02 41.05 2dm7 s PHE 11 CO 0.15 0.60 0.32 0.25 0.70 0.00 0.00 175.22 177.23 2dm7 n THR 12 N 1.70 0.00 -3.56 0.64 -2.24 -1.19 -4.81 114.28 104.82 2dm7 n THR 12 Ca -0.11 -0.25 -0.18 0.00 -2.27 0.00 0.00 64.05 61.24 2dm7 n THR 12 Cb 0.51 0.69 -0.14 0.00 -2.10 0.00 0.00 70.33 69.30 2dm7 n THR 12 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 2dm7 s GLN 13 N -2.22 0.14 -0.03 -0.78 -0.21 -1.26 -5.00 119.66 110.31 2dm7 s GLN 13 Ca 0.01 0.34 -0.40 0.00 0.02 0.00 0.00 55.36 55.33 2dm7 s GLN 13 Cb 0.07 -0.87 -0.20 0.00 1.00 0.00 0.00 33.01 33.01 2dm7 s GLN 13 CO 0.39 -0.53 1.14 -0.40 -2.12 0.00 0.00 175.29 173.78 2dm7 n ASP 14 N 5.32 0.29 -3.36 5.90 5.68 -1.26 -3.77 116.55 125.36 2dm7 n ASP 14 Ca -0.05 1.16 -0.35 0.00 -0.50 0.00 0.00 54.79 55.04 2dm7 n ASP 14 Cb 0.50 -0.95 -0.01 0.00 -1.14 0.00 0.00 41.12 39.51 2dm7 n ASP 14 CO 0.00 0.00 0.00 -0.11 -1.33 0.00 0.00 177.20 175.76 2dm7 n LEU 15 N 1.83 -1.56 -4.49 -2.12 0.00 -1.26 -4.89 117.00 104.51 2dm7 n LEU 15 Ca 0.21 0.76 -0.32 0.00 0.00 0.00 0.00 56.01 56.65 2dm7 n LEU 15 Cb 0.08 -0.71 -0.12 0.00 0.00 0.00 0.00 43.42 42.67 2dm7 n LEU 15 CO 0.63 -2.75 -0.46 -0.75 0.00 0.00 0.00 177.39 174.07 2dm7 s LYS 16 N -0.77 2.33 0.20 1.96 2.36 0.96 -4.79 119.74 121.99 2dm7 s LYS 16 Ca 0.48 -0.82 0.01 0.00 -2.55 0.00 0.00 55.97 53.09 2dm7 s LYS 16 Cb -0.61 -2.32 -0.05 0.00 -1.05 0.00 0.00 37.83 33.80 2dm7 s LYS 16 CO 0.46 0.58 0.06 -0.08 1.55 0.00 0.00 175.35 177.92 2dm7 s THR 17 N -0.86 0.45 0.14 3.43 -1.32 -1.26 -1.92 115.64 114.29 2dm7 s THR 17 Ca 0.14 -1.98 0.04 0.00 -1.21 0.00 0.00 61.69 58.68 2dm7 s THR 17 Cb -0.11 -2.34 -0.04 0.00 -1.51 0.00 0.00 72.50 68.50 2dm7 s THR 17 CO 0.04 -0.24 -0.10 -1.59 -2.21 0.00 0.00 174.62 170.52 2dm7 s LYS 18 N -4.01 1.02 -0.39 7.08 0.00 -1.25 -5.01 119.74 117.18 2dm7 s LYS 18 Ca 0.31 -1.40 -0.15 0.00 0.00 0.00 0.00 55.97 54.73 2dm7 s LYS 18 Cb 0.07 -0.59 0.01 0.00 0.00 0.00 0.00 37.83 37.31 2dm7 s LYS 18 CO 0.08 0.07 0.31 -2.00 0.00 0.00 0.00 175.35 173.81 2dm7 s GLU 19 N -3.60 3.20 0.34 1.78 -6.30 -1.26 -3.91 118.70 108.94 2dm7 s GLU 19 Ca 0.15 -0.81 0.09 0.00 -2.50 0.00 0.00 54.97 51.90 2dm7 s GLU 19 Cb 0.02 -3.91 -0.06 0.00 0.00 0.00 0.00 34.13 30.17 2dm7 s GLU 19 CO 0.00 -0.66 -0.09 0.00 0.02 0.00 0.00 175.26 174.53 2dm7 s ALA 20 N 1.80 2.90 0.55 6.30 0.00 -0.85 -5.00 121.76 127.45 2dm7 s ALA 20 Ca 0.07 -2.08 0.02 0.00 0.00 0.00 0.00 51.96 49.98 2dm7 s ALA 20 Cb -0.18 -0.02 0.04 0.00 0.00 0.00 0.00 23.12 22.96 2dm7 s ALA 20 CO 0.11 0.06 0.76 -1.12 0.00 0.00 0.00 175.76 175.57 2dm7 s SER 21 N -3.59 5.25 0.32 0.00 0.01 -1.26 -0.68 113.70 113.74 2dm7 s SER 21 Ca 0.32 -0.14 -0.29 0.00 1.31 0.00 0.00 55.95 57.15 2dm7 s SER 21 Cb 0.03 -0.72 -0.12 0.00 0.21 0.00 0.00 66.02 65.42 2dm7 s SER 21 CO 0.16 -1.15 1.47 -0.62 0.41 0.00 0.00 173.24 173.51 2dm7 n GLU 22 N -2.31 2.49 0.00 12.44 1.02 0.26 -1.54 120.64 133.00 2dm7 n GLU 22 Ca 0.09 0.88 0.00 0.00 -0.02 0.00 0.00 57.16 58.11 2dm7 n GLU 22 Cb 0.60 -2.59 0.00 0.00 -0.02 0.00 0.00 31.44 29.43 2dm7 n GLU 22 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2dm7 n GLY 23 N 1.34 3.14 2.19 0.62 0.00 0.53 -4.88 105.19 108.13 2dm7 n GLY 23 Ca 0.06 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.90 2dm7 n GLY 23 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dm7 n ALA 24 N -0.67 -1.64 -4.04 4.61 0.00 -0.59 -3.96 120.51 114.21 2dm7 n ALA 24 Ca 0.00 -1.00 -0.32 0.00 0.00 0.00 0.00 53.44 52.12 2dm7 n ALA 24 Cb 0.00 -0.06 -0.16 0.00 0.00 0.00 0.00 19.45 19.23 2dm7 n ALA 24 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 2dm7 s THR 25 N -2.40 1.91 0.09 0.00 2.01 -1.26 -0.02 115.64 115.97 2dm7 s THR 25 Ca 0.44 -1.22 -0.30 0.00 0.31 0.00 0.00 61.69 60.91 2dm7 s THR 25 Cb -0.03 -1.95 -0.06 0.00 0.01 0.00 0.00 72.50 70.47 2dm7 s THR 25 CO 0.32 0.16 1.16 0.00 -0.69 0.00 0.00 174.62 175.58 2dm7 s ALA 26 N 1.27 3.38 -0.20 7.40 0.00 -0.98 -4.79 121.76 127.83 2dm7 s ALA 26 Ca -0.03 0.83 0.01 0.00 0.00 0.00 0.00 51.96 52.78 2dm7 s ALA 26 Cb -0.17 -3.42 0.03 0.00 0.00 0.00 0.00 23.12 19.57 2dm7 s ALA 26 CO -0.08 -0.37 -0.17 0.99 0.00 0.00 0.00 175.76 176.13 2dm7 s THR 27 N 0.69 2.11 0.14 0.00 2.01 -1.26 -0.83 115.64 118.51 2dm7 s THR 27 Ca 0.56 -1.13 0.08 0.00 0.31 0.00 0.00 61.69 61.51 2dm7 s THR 27 Cb -0.29 -1.99 -0.04 0.00 0.01 0.00 0.00 72.50 70.19 2dm7 s THR 27 CO 0.31 0.37 -0.13 -0.76 -0.69 0.00 0.00 174.62 173.73 2dm7 s LEU 28 N 1.24 2.89 0.01 4.42 1.02 -0.29 -3.95 118.68 124.01 2dm7 s LEU 28 Ca 0.01 -0.53 0.01 0.00 0.02 0.00 0.00 54.13 53.64 2dm7 s LEU 28 Cb -0.15 -1.66 -0.01 0.00 0.02 0.00 0.00 46.19 44.40 2dm7 s LEU 28 CO -0.11 0.15 -0.03 -1.10 0.02 0.00 0.00 176.35 175.28 2dm7 s GLN 29 N -2.46 0.23 -0.02 1.70 -0.21 -0.81 -0.99 119.66 117.10 2dm7 s GLN 29 Ca 0.22 -0.26 -0.04 0.00 0.02 0.00 0.00 55.36 55.30 2dm7 s GLN 29 Cb -0.10 -0.11 0.00 0.00 1.00 0.00 0.00 33.01 33.80 2dm7 s GLN 29 CO 0.13 0.02 0.09 0.00 -2.12 0.00 0.00 175.29 173.41 2dm7 s GLU 31 N -0.43 3.44 0.05 0.00 2.12 -1.25 -1.91 118.70 120.72 2dm7 s GLU 31 Ca -0.05 -0.72 -0.03 0.00 0.36 0.00 0.00 54.97 54.54 2dm7 s GLU 31 Cb -0.03 -2.86 -0.03 0.00 0.26 0.00 0.00 34.13 31.46 2dm7 s GLU 31 CO 0.00 0.39 0.02 -0.51 -0.54 0.00 0.00 175.26 174.63 2dm7 s LEU 32 N -4.02 2.21 0.41 2.70 1.43 -0.66 -3.18 118.68 117.58 2dm7 s LEU 32 Ca 0.35 -0.85 0.16 0.00 -1.03 0.00 0.00 54.13 52.76 2dm7 s LEU 32 Cb -0.09 0.38 0.90 0.00 0.03 0.00 0.00 46.19 47.41 2dm7 s LEU 32 CO 0.30 -0.59 1.89 -1.28 0.23 0.00 0.00 176.35 176.90 2dm7 h SER 33 N 3.26 0.00 -5.10 2.29 0.87 -0.77 -3.44 113.55 110.66 2dm7 h SER 33 Ca -0.34 0.00 0.14 0.00 -1.23 0.00 0.00 61.79 60.36 2dm7 h SER 33 Cb 1.16 0.00 -0.10 0.00 -0.44 0.00 0.00 62.40 63.02 2dm7 h SER 33 CO 0.61 0.30 0.45 -1.59 -0.53 0.00 0.00 176.83 176.06 2dm7 s LYS 34 N -4.19 1.15 -0.12 2.24 -2.85 -1.26 -4.99 119.74 109.72 2dm7 s LYS 34 Ca -0.03 -0.58 -0.30 0.00 -1.00 0.00 0.00 55.97 54.06 2dm7 s LYS 34 Cb 0.14 0.43 -0.08 0.00 -2.06 0.00 0.00 37.83 36.26 2dm7 s LYS 34 CO 0.69 -0.52 2.10 0.28 0.10 0.00 0.00 175.35 178.00 2dm7 n VAL 35 N -0.40 0.52 -3.67 1.79 0.31 -1.26 -4.85 118.33 110.77 2dm7 n VAL 35 Ca -0.07 -0.30 -0.15 0.00 -0.01 0.00 0.00 64.34 63.81 2dm7 n VAL 35 Cb 0.61 -2.35 -0.08 0.00 -0.91 0.00 0.00 33.84 31.11 2dm7 n VAL 35 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2dm7 s ALA 36 N 6.43 -1.20 0.25 3.52 0.00 -1.26 -5.02 121.76 124.47 2dm7 s ALA 36 Ca 0.96 0.86 -0.30 0.00 0.00 0.00 0.00 51.96 53.49 2dm7 s ALA 36 Cb -0.44 -0.11 -0.09 0.00 0.00 0.00 0.00 23.12 22.48 2dm7 s ALA 36 CO 0.40 -0.29 1.27 -1.25 0.00 0.00 0.00 175.76 175.89 2dm7 s PRO 37 N -1.00 4.42 0.29 0.00 0.04 -1.26 -5.01 135.00 132.48 2dm7 s PRO 37 Ca -0.10 2.05 0.01 0.00 0.04 0.00 0.00 61.00 63.00 2dm7 s PRO 37 Cb -0.03 -3.16 -0.00 0.00 0.04 0.00 0.00 34.50 31.34 2dm7 s PRO 37 CO 0.06 -0.16 0.04 1.33 0.04 0.00 0.00 177.00 178.31 2dm7 n VAL 38 N 1.92 0.00 -3.38 -0.36 0.24 -1.26 -4.06 118.33 111.43 2dm7 n VAL 38 Ca 0.03 -1.51 -0.05 0.00 -2.04 0.00 0.00 64.34 60.78 2dm7 n VAL 38 Cb 0.43 0.41 -0.06 0.00 -1.47 0.00 0.00 33.84 33.15 2dm7 n VAL 38 CO 0.00 0.00 0.00 -0.70 -2.14 0.00 0.00 176.83 173.99 2dm7 s GLU 39 N -3.08 0.43 0.23 7.34 2.12 -0.55 -4.97 118.70 120.22 2dm7 s GLU 39 Ca 0.06 0.85 -0.30 0.00 0.36 0.00 0.00 54.97 55.94 2dm7 s GLU 39 Cb 0.00 0.09 -0.09 0.00 0.26 0.00 0.00 34.13 34.40 2dm7 s GLU 39 CO 0.04 -0.52 1.09 -1.58 -0.54 0.00 0.00 175.26 173.75 2dm7 s TRP 40 N 2.68 3.62 0.02 5.30 0.52 -1.26 -2.12 118.94 127.70 2dm7 s TRP 40 Ca 0.10 1.67 0.03 0.00 0.02 0.00 0.00 56.10 57.93 2dm7 s TRP 40 Cb -0.14 -3.25 -0.02 0.00 -1.15 0.00 0.00 33.47 28.91 2dm7 s TRP 40 CO -0.17 -0.49 -0.10 0.15 0.02 0.00 0.00 176.95 176.36 2dm7 s LYS 41 N -0.94 0.71 -0.17 4.98 1.02 0.12 -3.31 119.74 122.15 2dm7 s LYS 41 Ca 0.46 -0.58 0.17 0.00 0.02 0.00 0.00 55.97 56.05 2dm7 s LYS 41 Cb -0.30 -0.64 0.47 0.00 -0.52 0.00 0.00 37.83 36.83 2dm7 s LYS 41 CO 0.37 0.16 1.35 1.17 -0.92 0.00 0.00 175.35 177.49 2dm7 n LYS 42 N 2.14 2.49 0.00 1.68 4.81 -1.26 -1.03 118.16 127.00 2dm7 n LYS 42 Ca -0.17 -2.78 0.00 0.00 -0.87 0.00 0.00 58.31 54.48 2dm7 n LYS 42 Cb 0.56 -1.76 0.00 0.00 0.02 0.00 0.00 35.03 33.85 2dm7 n LYS 42 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2dm7 n GLY 43 N -0.76 0.35 0.00 3.14 0.00 -1.26 -4.79 105.19 101.88 2dm7 n GLY 43 Ca 0.20 -1.24 0.05 0.00 0.00 0.00 0.00 46.02 45.02 2dm7 n GLY 43 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2dm7 n PRO 44 N 0.00 0.49 -4.55 1.61 -0.04 -1.26 -4.74 135.00 126.51 2dm7 n PRO 44 Ca 0.00 0.00 -0.31 0.00 -0.04 0.00 0.00 63.50 63.15 2dm7 n PRO 44 Cb 0.00 -1.30 -0.07 0.00 -0.04 0.00 0.00 33.50 32.10 2dm7 n PRO 44 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 2dm7 s GLU 45 N -2.00 2.19 0.16 0.54 2.02 -1.26 -5.16 118.70 115.18 2dm7 s GLU 45 Ca 0.14 -2.27 0.10 0.00 0.02 0.00 0.00 54.97 52.96 2dm7 s GLU 45 Cb 0.06 -1.67 -0.04 0.00 0.10 0.00 0.00 34.13 32.58 2dm7 s GLU 45 CO 0.11 -0.37 -0.24 0.99 0.02 0.00 0.00 175.26 175.77 2dm7 s THR 46 N -2.83 2.15 0.37 3.63 2.01 -1.26 -4.19 115.64 115.52 2dm7 s THR 46 Ca 0.16 -1.86 0.00 0.00 0.31 0.00 0.00 61.69 60.30 2dm7 s THR 46 Cb 0.02 -1.96 0.00 0.00 0.01 0.00 0.00 72.50 70.57 2dm7 s THR 46 CO 0.09 -0.07 0.03 0.18 -0.69 0.00 0.00 174.62 174.15 2dm7 n LEU 47 N 0.59 0.00 0.00 4.42 4.77 -1.21 -4.97 117.00 120.60 2dm7 n LEU 47 Ca -0.15 -2.30 -0.09 0.00 -0.03 0.00 0.00 56.01 53.43 2dm7 n LEU 47 Cb 0.55 0.23 -0.01 0.00 -2.33 0.00 0.00 43.42 41.86 2dm7 n LEU 47 CO 0.26 -0.34 0.19 0.54 -1.33 0.00 0.00 177.39 176.71 2dm7 n ARG 48 N -0.97 0.59 -3.73 3.23 5.12 -1.26 -4.84 116.66 114.80 2dm7 n ARG 48 Ca -0.14 -1.89 -0.38 0.00 -1.93 0.00 0.00 57.85 53.51 2dm7 n ARG 48 Cb 0.47 1.94 -0.12 0.00 -1.16 0.00 0.00 32.46 33.60 2dm7 n ARG 48 CO 0.00 0.00 0.00 0.34 -1.93 0.00 0.00 177.63 176.04 2dm7 s ASP 49 N -2.53 5.36 0.00 0.55 -1.08 -1.26 -4.78 116.67 112.92 2dm7 s ASP 49 Ca 0.18 -1.47 0.00 0.00 -0.52 0.00 0.00 52.55 50.74 2dm7 s ASP 49 Cb -0.01 -1.88 0.00 0.00 -1.46 0.00 0.00 42.92 39.56 2dm7 s ASP 49 CO 0.13 -0.44 0.00 0.61 0.52 0.00 0.00 175.17 176.00 2dm7 n GLY 50 N 4.78 -0.67 0.00 2.66 0.00 -1.00 -5.03 105.19 105.93 2dm7 n GLY 50 Ca -0.10 0.66 0.00 0.00 0.00 0.00 0.00 46.02 46.58 2dm7 n GLY 50 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2dm7 n GLY 51 N 0.00 0.09 0.51 -0.02 0.00 -1.26 -4.70 105.19 99.82 2dm7 n GLY 51 Ca 0.00 -1.86 0.38 0.00 0.00 0.00 0.00 46.02 44.54 2dm7 n GLY 51 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2dm7 h ARG 52 N 0.00 0.09 -4.86 1.61 3.08 -1.95 -3.33 114.38 109.02 2dm7 h ARG 52 Ca 0.00 -0.01 -0.65 0.00 0.07 0.00 0.00 59.98 59.39 2dm7 h ARG 52 Cb 0.00 -0.02 -0.17 0.00 0.08 0.00 0.00 29.97 29.85 2dm7 h ARG 52 CO 0.00 0.06 -0.46 0.71 -1.07 0.00 0.00 179.97 179.21 2dm7 s TYR 53 N -5.20 3.22 -0.17 3.04 2.02 -1.26 -1.36 117.35 117.65 2dm7 s TYR 53 Ca -0.07 0.02 0.00 0.00 -0.37 0.00 0.00 57.07 56.66 2dm7 s TYR 53 Cb 0.28 -2.45 0.03 0.00 -0.40 0.00 0.00 41.96 39.42 2dm7 s TYR 53 CO 0.83 -0.26 -0.12 -1.12 -1.57 0.00 0.00 175.55 173.32 2dm7 s SER 54 N 1.74 2.91 0.06 2.29 0.01 0.24 -2.37 113.70 118.58 2dm7 s SER 54 Ca 0.08 -0.63 0.05 0.00 1.31 0.00 0.00 55.95 56.76 2dm7 s SER 54 Cb -0.16 -1.15 -0.03 0.00 0.21 0.00 0.00 66.02 64.88 2dm7 s SER 54 CO 0.11 -0.10 -0.15 -1.48 0.41 0.00 0.00 173.24 172.02 2dm7 s LEU 55 N 1.48 2.22 0.02 2.44 2.34 -1.26 0.12 118.68 126.04 2dm7 s LEU 55 Ca 0.02 -0.54 0.02 0.00 0.06 0.00 0.00 54.13 53.70 2dm7 s LEU 55 Cb -0.14 -0.63 -0.01 0.00 -0.56 0.00 0.00 46.19 44.84 2dm7 s LEU 55 CO -0.09 0.01 -0.08 -0.75 -1.06 0.00 0.00 176.35 174.38 2dm7 s LYS 56 N -1.42 0.57 -0.31 1.48 2.47 -0.55 -5.00 119.74 116.98 2dm7 s LYS 56 Ca 0.01 -0.46 -0.09 0.00 -1.56 0.00 0.00 55.97 53.87 2dm7 s LYS 56 Cb -0.09 -0.49 -0.01 0.00 -1.46 0.00 0.00 37.83 35.79 2dm7 s LYS 56 CO 0.02 0.12 0.15 -1.14 0.16 0.00 0.00 175.35 174.66 2dm7 s GLN 57 N -0.73 3.31 -0.55 4.03 0.74 -1.26 -1.74 119.66 123.45 2dm7 s GLN 57 Ca -0.02 -0.74 -0.02 0.00 0.05 0.00 0.00 55.36 54.64 2dm7 s GLN 57 Cb -0.06 -3.56 0.14 0.00 1.10 0.00 0.00 33.01 30.64 2dm7 s GLN 57 CO 0.00 -0.43 0.34 -0.51 -0.55 0.00 0.00 175.29 174.15 2dm7 s ASP 58 N 1.60 5.11 1.37 6.67 1.11 0.83 -5.00 116.67 128.35 2dm7 s ASP 58 Ca 0.04 -2.65 0.00 0.00 0.18 0.00 0.00 52.55 50.13 2dm7 s ASP 58 Cb -0.17 -1.81 0.00 0.00 1.07 0.00 0.00 42.92 42.01 2dm7 s ASP 58 CO 0.06 -0.40 0.00 0.61 1.18 0.00 0.00 175.17 176.62 2dm7 n GLY 59 N 3.74 0.96 1.15 0.21 0.00 -1.26 -0.25 105.19 109.74 2dm7 n GLY 59 Ca 0.05 0.54 0.04 0.00 0.00 0.00 0.00 46.02 46.64 2dm7 n GLY 59 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2dm7 n THR 60 N 0.00 2.46 -3.83 2.61 -2.24 -1.26 -4.23 114.28 107.79 2dm7 n THR 60 Ca 0.00 -2.01 -0.16 0.00 -2.27 0.00 0.00 64.05 59.61 2dm7 n THR 60 Cb 0.00 -0.29 -0.16 0.00 -2.10 0.00 0.00 70.33 67.78 2dm7 n THR 60 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 2dm7 s ARG 61 N -2.94 0.11 0.22 -0.78 0.52 0.65 -1.65 118.95 115.06 2dm7 s ARG 61 Ca 0.45 0.15 0.07 0.00 -0.52 0.00 0.00 55.73 55.88 2dm7 s ARG 61 Cb 0.37 -0.37 -0.04 0.00 0.52 0.00 0.00 34.95 35.44 2dm7 s ARG 61 CO 0.08 -0.17 0.13 0.00 0.02 0.00 0.00 175.30 175.36 2dm7 s GLU 63 N -3.48 0.07 -0.14 0.00 2.12 -0.71 -2.70 118.70 113.86 2dm7 s GLU 63 Ca 0.31 0.29 -0.07 0.00 0.36 0.00 0.00 54.97 55.86 2dm7 s GLU 63 Cb -0.09 -0.93 -0.04 0.00 0.26 0.00 0.00 34.13 33.34 2dm7 s GLU 63 CO 0.23 -0.49 0.12 -1.17 -0.54 0.00 0.00 175.26 173.41 2dm7 s LEU 64 N 2.25 4.26 -0.16 2.70 2.96 -0.16 -1.48 118.68 129.05 2dm7 s LEU 64 Ca 0.04 0.38 -0.00 0.00 -0.22 0.00 0.00 54.13 54.33 2dm7 s LEU 64 Cb -0.14 -2.05 0.04 0.00 0.50 0.00 0.00 46.19 44.54 2dm7 s LEU 64 CO -0.08 0.35 -0.08 -1.10 -1.32 0.00 0.00 176.35 174.12 2dm7 s GLN 65 N -0.68 1.70 -0.68 1.98 -0.21 0.32 -1.14 119.66 120.96 2dm7 s GLN 65 Ca 0.13 -0.56 -0.11 0.00 0.02 0.00 0.00 55.36 54.84 2dm7 s GLN 65 Cb -0.12 -2.05 0.18 0.00 1.00 0.00 0.00 33.01 32.02 2dm7 s GLN 65 CO 0.03 -0.38 0.58 0.42 -2.12 0.00 0.00 175.29 173.81 2dm7 s ILE 66 N 1.57 4.86 0.57 1.08 1.01 -0.01 -0.59 121.20 129.69 2dm7 s ILE 66 Ca 0.01 -2.33 -0.18 0.00 0.00 0.00 0.00 60.65 58.15 2dm7 s ILE 66 Cb -0.15 -4.08 -0.05 0.00 0.01 0.00 0.00 42.46 38.20 2dm7 s ILE 66 CO -0.08 -0.93 1.09 -1.00 0.00 0.00 0.00 174.94 174.02 2dm7 s HIS 67 N 0.52 2.79 -0.95 3.97 3.76 -0.46 -2.31 115.29 122.60 2dm7 s HIS 67 Ca 0.13 1.55 -0.02 0.00 -0.15 0.00 0.00 55.06 56.57 2dm7 s HIS 67 Cb -0.18 -3.16 -0.02 0.00 1.11 0.00 0.00 32.58 30.33 2dm7 s HIS 67 CO -0.05 -1.36 0.80 -3.47 -0.85 0.00 0.00 174.74 169.82 2dm7 n ASP 68 N -1.64 -3.30 -4.65 1.40 2.03 -1.17 -4.85 116.55 104.38 2dm7 n ASP 68 Ca 0.10 -0.54 -0.33 0.00 0.52 0.00 0.00 54.79 54.54 2dm7 n ASP 68 Cb 0.52 -4.35 0.13 0.00 -0.72 0.00 0.00 41.12 36.70 2dm7 n ASP 68 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 2dm7 n LEU 69 N -3.37 3.56 -3.66 -2.67 4.77 0.98 -4.70 117.00 111.91 2dm7 n LEU 69 Ca -0.18 0.53 -0.13 0.00 -0.03 0.00 0.00 56.01 56.21 2dm7 n LEU 69 Cb 0.63 -1.46 -0.08 0.00 -2.33 0.00 0.00 43.42 40.18 2dm7 n LEU 69 CO 0.50 -2.05 0.30 -0.44 -1.33 0.00 0.00 177.39 174.36 2dm7 s SER 70 N -2.17 -0.67 0.49 -1.43 0.01 -1.26 -0.35 113.70 108.31 2dm7 s SER 70 Ca 0.70 1.26 0.38 0.00 1.31 0.00 0.00 55.95 59.60 2dm7 s SER 70 Cb -0.28 1.24 1.57 0.00 0.21 0.00 0.00 66.02 68.77 2dm7 s SER 70 CO 0.54 -0.22 1.59 -0.37 0.41 0.00 0.00 173.24 175.20 2dm7 h VAL 71 N 4.36 0.04 -0.59 3.43 -1.51 -1.89 1.32 116.25 121.42 2dm7 h VAL 71 Ca -0.29 -0.01 -0.06 0.00 -1.23 0.00 0.00 66.70 65.11 2dm7 h VAL 71 Cb 1.18 0.02 -0.02 0.00 -2.13 0.00 0.00 31.29 30.33 2dm7 h VAL 71 CO 0.13 0.00 0.12 0.00 -1.23 0.00 0.00 177.57 176.60 2dm7 h ALA 72 N 1.39 0.78 0.00 5.19 0.00 -1.97 -2.02 119.26 122.63 2dm7 h ALA 72 Ca 0.88 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 55.56 2dm7 h ALA 72 Cb 3.11 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 20.67 2dm7 h ALA 72 CO -0.29 0.50 0.00 -0.25 0.00 0.00 0.00 179.25 179.21 2dm7 n ASP 73 N -4.34 0.49 -4.57 0.00 9.92 0.45 -4.56 116.55 113.94 2dm7 n ASP 73 Ca 0.03 0.69 -0.40 0.00 -0.53 0.00 0.00 54.79 54.58 2dm7 n ASP 73 Cb 0.25 -0.77 -0.03 0.00 -0.64 0.00 0.00 41.12 39.94 2dm7 n ASP 73 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2dm7 s ALA 74 N -3.38 2.39 0.00 2.24 0.00 -0.76 -4.69 121.76 117.56 2dm7 s ALA 74 Ca 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 51.96 51.77 2dm7 s ALA 74 Cb 0.07 -4.19 0.00 0.00 0.00 0.00 0.00 23.12 18.99 2dm7 s ALA 74 CO 0.23 -3.45 0.00 0.41 0.00 0.00 0.00 175.76 172.95 2dm7 n GLY 75 N 5.62 1.53 2.85 0.00 0.00 -1.26 -5.00 105.19 108.94 2dm7 n GLY 75 Ca 0.23 0.32 -0.13 0.00 0.00 0.00 0.00 46.02 46.45 2dm7 n GLY 75 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2dm7 s GLU 76 N 2.49 -0.00 -0.14 1.61 -6.30 -1.26 -2.77 118.70 112.33 2dm7 s GLU 76 Ca 0.00 0.04 0.01 0.00 -2.50 0.00 0.00 54.97 52.52 2dm7 s GLU 76 Cb 0.00 -0.07 0.02 0.00 0.00 0.00 0.00 34.13 34.08 2dm7 s GLU 76 CO 0.00 -0.04 -0.16 0.71 0.02 0.00 0.00 175.26 175.79 2dm7 s TYR 77 N 0.27 2.21 0.03 5.30 1.51 -0.91 -4.30 117.35 121.46 2dm7 s TYR 77 Ca -0.02 -1.19 0.04 0.00 -1.01 0.00 0.00 57.07 54.89 2dm7 s TYR 77 Cb -0.03 -1.60 -0.04 0.00 -0.11 0.00 0.00 41.96 40.18 2dm7 s TYR 77 CO -0.01 -0.62 -0.07 -1.12 -1.11 0.00 0.00 175.55 172.62 2dm7 s SER 78 N 1.27 4.58 -0.17 2.29 0.01 -0.19 -0.80 113.70 120.69 2dm7 s SER 78 Ca 0.01 -0.20 0.01 0.00 1.31 0.00 0.00 55.95 57.07 2dm7 s SER 78 Cb -0.14 -1.03 0.03 0.00 0.21 0.00 0.00 66.02 65.09 2dm7 s SER 78 CO -0.08 0.25 -0.14 0.00 0.41 0.00 0.00 173.24 173.69 2dm7 s MET 80 N 1.43 4.19 -0.37 0.00 -1.94 -0.90 -2.53 119.30 119.18 2dm7 s MET 80 Ca 0.03 0.20 0.01 0.00 -1.71 0.00 0.00 55.69 54.22 2dm7 s MET 80 Cb -0.14 -3.52 0.12 0.00 2.01 0.00 0.00 34.83 33.29 2dm7 s MET 80 CO -0.10 -0.01 0.16 0.00 -0.01 0.00 0.00 175.02 175.06 2dm7 n GLY 82 N 4.24 1.98 0.00 0.00 0.00 -1.26 -3.17 105.19 106.98 2dm7 n GLY 82 Ca 0.03 0.14 0.00 0.00 0.00 0.00 0.00 46.02 46.19 2dm7 n GLY 82 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2dm7 n GLN 83 N 0.00 0.14 -1.09 1.61 6.02 -1.26 -5.03 117.38 117.77 2dm7 n GLN 83 Ca 0.00 0.00 -0.30 0.00 -0.01 0.00 0.00 57.00 56.69 2dm7 n GLN 83 Cb 0.00 -0.76 0.24 0.00 1.02 0.00 0.00 30.24 30.74 2dm7 n GLN 83 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 177.06 174.84 2dm7 s GLU 84 N -1.52 -1.27 -0.15 -1.09 8.01 -1.19 -5.09 118.70 116.40 2dm7 s GLU 84 Ca 0.00 -0.10 -0.29 0.00 0.01 0.00 0.00 54.97 54.59 2dm7 s GLU 84 Cb 0.00 -1.59 0.10 0.00 -4.31 0.00 0.00 34.13 28.32 2dm7 s GLU 84 CO 0.00 -3.73 0.84 0.50 0.01 0.00 0.00 175.26 172.88 2dm7 s ARG 85 N -5.44 0.80 0.02 1.61 3.52 -1.26 -2.91 118.95 115.28 2dm7 s ARG 85 Ca 0.71 0.37 0.01 0.00 -0.13 0.00 0.00 55.73 56.70 2dm7 s ARG 85 Cb -0.09 0.38 -0.02 0.00 -1.56 0.00 0.00 34.95 33.66 2dm7 s ARG 85 CO 0.56 -0.21 -0.05 -0.08 -0.81 0.00 0.00 175.30 174.70 2dm7 s THR 86 N -0.74 0.36 0.15 4.11 -1.32 -1.05 -4.98 115.64 112.17 2dm7 s THR 86 Ca -0.04 -0.70 0.10 0.00 -1.21 0.00 0.00 61.69 59.84 2dm7 s THR 86 Cb -0.02 -0.41 -0.04 0.00 -1.51 0.00 0.00 72.50 70.53 2dm7 s THR 86 CO 0.04 -0.23 -0.22 -0.94 -2.21 0.00 0.00 174.62 171.05 2dm7 s SER 87 N -1.00 3.57 -0.24 8.08 1.04 -1.26 -0.71 113.70 123.18 2dm7 s SER 87 Ca -0.07 -0.72 -0.03 0.00 0.48 0.00 0.00 55.95 55.62 2dm7 s SER 87 Cb -0.07 -0.35 0.13 0.00 0.10 0.00 0.00 66.02 65.83 2dm7 s SER 87 CO -0.00 0.16 0.37 0.00 0.98 0.00 0.00 173.24 174.75 2dm7 s ALA 88 N -1.29 -1.04 -0.13 5.32 0.00 0.02 -4.46 121.76 120.17 2dm7 s ALA 88 Ca 0.18 0.86 -0.29 0.00 0.00 0.00 0.00 51.96 52.70 2dm7 s ALA 88 Cb -0.10 -1.66 -0.03 0.00 0.00 0.00 0.00 23.12 21.34 2dm7 s ALA 88 CO 0.09 -1.27 1.36 0.99 0.00 0.00 0.00 175.76 176.93 2dm7 s THR 89 N 2.53 4.10 0.36 0.00 2.01 -1.26 -2.14 115.64 121.24 2dm7 s THR 89 Ca 0.12 1.33 -0.10 0.00 0.31 0.00 0.00 61.69 63.35 2dm7 s THR 89 Cb -0.15 -3.86 -0.07 0.00 0.01 0.00 0.00 72.50 68.43 2dm7 s THR 89 CO -0.16 -0.11 0.72 -0.22 -0.69 0.00 0.00 174.62 174.16 2dm7 s LEU 90 N 3.54 3.92 -0.14 4.42 2.96 -1.12 -4.89 118.68 127.38 2dm7 s LEU 90 Ca 0.59 1.08 0.02 0.00 -0.22 0.00 0.00 54.13 55.60 2dm7 s LEU 90 Cb -0.25 -3.93 0.00 0.00 0.50 0.00 0.00 46.19 42.51 2dm7 s LEU 90 CO 0.19 -0.32 -0.20 -0.89 -1.32 0.00 0.00 176.35 173.82 2dm7 s THR 91 N -2.23 2.32 -0.10 3.68 2.01 -1.25 -4.02 115.64 116.05 2dm7 s THR 91 Ca 0.50 -0.90 0.03 0.00 0.31 0.00 0.00 61.69 61.64 2dm7 s THR 91 Cb -0.10 -1.94 -0.01 0.00 0.01 0.00 0.00 72.50 70.46 2dm7 s THR 91 CO 0.28 0.54 -0.20 -0.69 -0.69 0.00 0.00 174.62 173.86 2dm7 s VAL 92 N 0.71 2.42 -0.18 3.82 1.01 -1.26 -2.01 120.40 124.91 2dm7 s VAL 92 Ca -0.09 -0.90 -0.08 0.00 0.00 0.00 0.00 61.98 60.91 2dm7 s VAL 92 Cb -0.16 -1.95 -0.04 0.00 0.00 0.00 0.00 36.38 34.23 2dm7 s VAL 92 CO 0.01 0.55 0.09 -0.60 0.00 0.00 0.00 175.10 175.15 2dm7 s ARG 93 N 0.18 3.97 0.30 2.72 3.52 0.14 -4.86 118.95 124.92 2dm7 s ARG 93 Ca -0.12 -0.29 -0.28 0.00 -0.13 0.00 0.00 55.73 54.91 2dm7 s ARG 93 Cb -0.16 -3.26 -0.09 0.00 -1.56 0.00 0.00 34.95 29.87 2dm7 s ARG 93 CO 0.06 0.34 1.09 0.00 -0.81 0.00 0.00 175.30 175.98 2dm7 s ALA 94 N 0.22 3.35 0.80 6.12 0.00 -1.26 0.89 121.76 131.87 2dm7 s ALA 94 Ca 0.06 0.87 -0.15 0.00 0.00 0.00 0.00 51.96 52.74 2dm7 s ALA 94 Cb -0.12 -3.32 -0.02 0.00 0.00 0.00 0.00 23.12 19.66 2dm7 s ALA 94 CO -0.00 -0.18 0.45 1.28 0.00 0.00 0.00 175.76 177.31 2dm7 n LEU 95 N 0.95 0.32 -4.61 0.00 4.77 -1.26 -4.82 117.00 112.35 2dm7 n LEU 95 Ca 0.00 0.50 -0.43 0.00 -0.03 0.00 0.00 56.01 56.05 2dm7 n LEU 95 Cb 0.46 -1.20 -0.03 0.00 -2.33 0.00 0.00 43.42 40.32 2dm7 n LEU 95 CO 0.52 -3.35 1.42 -2.16 -1.33 0.00 0.00 177.39 172.49 2dm7 s PRO 96 N -2.99 3.56 0.93 3.23 0.04 -1.26 -5.00 135.00 133.51 2dm7 s PRO 96 Ca 0.62 1.45 -0.12 0.00 0.04 0.00 0.00 61.00 62.99 2dm7 s PRO 96 Cb -0.30 -4.10 0.15 0.00 0.04 0.00 0.00 34.50 30.28 2dm7 s PRO 96 CO 0.61 -1.58 1.11 0.00 0.04 0.00 0.00 177.00 177.19 2dm7 s ALA 97 N 5.96 1.51 0.01 8.56 0.00 -1.26 -5.07 121.76 131.48 2dm7 s ALA 97 Ca 0.73 -0.40 0.07 0.00 0.00 0.00 0.00 51.96 52.36 2dm7 s ALA 97 Cb -0.22 -3.08 -0.03 0.00 0.00 0.00 0.00 23.12 19.79 2dm7 s ALA 97 CO 0.32 -2.43 -0.20 -0.98 0.00 0.00 0.00 175.76 172.47 2dm7 s ARG 98 N -5.13 2.12 -0.04 0.00 1.70 -1.26 -5.06 118.95 111.28 2dm7 s ARG 98 Ca 0.64 -0.94 -0.04 0.00 -0.47 0.00 0.00 55.73 54.92 2dm7 s ARG 98 Cb -0.16 -2.17 -0.01 0.00 -0.57 0.00 0.00 34.95 32.03 2dm7 s ARG 98 CO 0.55 0.56 -0.09 0.34 -1.08 0.00 0.00 175.30 175.58 2dm7 n PHE 99 N 1.87 0.00 -4.08 5.89 7.35 -1.26 -5.09 117.46 122.14 2dm7 n PHE 99 Ca -0.16 0.00 -0.07 0.00 -0.76 0.00 0.00 57.45 56.45 2dm7 n PHE 99 Cb 0.52 -0.12 -0.10 0.00 0.35 0.00 0.00 39.48 40.13 2dm7 n PHE 99 CO 0.00 0.00 0.00 0.95 -0.76 0.00 0.00 176.76 176.95 2dm7 s THR 100 N -1.53 0.23 0.33 -2.13 -4.23 -1.26 -5.18 115.64 101.87 2dm7 s THR 100 Ca -0.07 -1.74 0.04 0.00 -1.18 0.00 0.00 61.69 58.74 2dm7 s THR 100 Cb 0.01 -1.42 0.04 0.00 1.34 0.00 0.00 72.50 72.47 2dm7 s THR 100 CO 0.11 -0.96 0.33 -1.84 -0.54 0.00 0.00 174.62 171.72 2dm7 n GLU 101 N 0.23 0.92 0.00 3.99 0.28 -1.26 -5.07 120.64 119.72 2dm7 n GLU 101 Ca -0.15 -1.98 0.00 0.00 -0.16 0.00 0.00 57.16 54.87 2dm7 n GLU 101 Cb 0.61 0.09 0.00 0.00 1.43 0.00 0.00 31.44 33.56 2dm7 n GLU 101 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 2dm7 n GLY 102 N 0.96 1.35 3.09 -1.84 0.00 -1.26 -5.06 105.19 102.43 2dm7 n GLY 102 Ca 0.03 -1.08 -0.34 0.00 0.00 0.00 0.00 46.02 44.64 2dm7 n GLY 102 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2dm7 s SER 103 N 0.00 4.94 0.30 1.61 0.15 -1.26 -5.09 113.70 114.35 2dm7 s SER 103 Ca 0.00 -1.90 -0.17 0.00 0.70 0.00 0.00 55.95 54.58 2dm7 s SER 103 Cb 0.00 -1.71 -0.12 0.00 -1.71 0.00 0.00 66.02 62.48 2dm7 s SER 103 CO 0.00 -0.40 0.09 0.61 1.20 0.00 0.00 173.24 174.74 2dm7 n GLY 104 N 4.45 -2.08 3.77 9.45 0.00 -1.26 -4.86 105.19 114.67 2dm7 n GLY 104 Ca -0.03 0.01 -0.35 0.00 0.00 0.00 0.00 46.02 45.66 2dm7 n GLY 104 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2dm7 s PRO 105 N -0.78 3.33 -0.26 1.61 0.04 -1.26 -5.00 135.00 132.68 2dm7 s PRO 105 Ca 0.47 1.59 -0.09 0.00 0.04 0.00 0.00 61.00 63.00 2dm7 s PRO 105 Cb -0.52 -2.00 -0.13 0.00 0.04 0.00 0.00 34.50 31.89 2dm7 s PRO 105 CO 0.49 -0.87 -0.31 -1.13 0.04 0.00 0.00 177.00 175.22 2dm7 n SER 106 N -1.37 1.93 -2.95 6.66 3.41 -1.26 -5.02 113.62 115.01 2dm7 n SER 106 Ca 0.11 0.21 -0.18 0.00 -0.26 0.00 0.00 58.87 58.75 2dm7 n SER 106 Cb 0.51 -0.68 0.07 0.00 -0.26 0.00 0.00 64.21 63.84 2dm7 n SER 106 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 2dm7 n SER 107 N -3.95 -4.70 0.00 4.04 2.88 -1.26 -5.36 113.62 105.28 2dm7 n SER 107 Ca -0.50 -0.44 0.00 0.00 -1.33 0.00 0.00 58.87 56.59 2dm7 n SER 107 Cb 0.90 -4.12 0.00 0.00 -0.75 0.00 0.00 64.21 60.24 2dm7 n SER 107 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42