#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dkq h SER 2 N 0.00 -0.33 -1.70 1.61 0.02 -2.14 -3.41 113.55 107.60 2dkq h SER 2 Ca 0.00 -0.05 -0.46 0.00 -0.84 0.00 0.00 61.79 60.44 2dkq h SER 2 Cb 0.00 0.09 -0.04 0.00 0.14 0.00 0.00 62.40 62.58 2dkq h SER 2 CO 0.00 0.14 1.20 -0.55 -1.14 0.00 0.00 176.83 176.47 2dkq s SER 3 N -5.13 5.35 -0.75 3.07 0.15 -1.26 -4.91 113.70 110.22 2dkq s SER 3 Ca -0.07 -0.00 0.00 0.00 0.70 0.00 0.00 55.95 56.58 2dkq s SER 3 Cb 0.01 -2.54 0.19 0.00 -1.71 0.00 0.00 66.02 61.96 2dkq s SER 3 CO 0.23 -2.39 0.58 -0.83 1.20 0.00 0.00 173.24 172.03 2dkq s GLY 4 N 7.65 2.87 -0.12 9.45 0.00 -1.26 -5.02 107.32 120.87 2dkq s GLY 4 Ca 0.65 -3.67 -0.06 0.00 0.00 0.00 0.00 44.72 41.64 2dkq s GLY 4 CO 0.15 1.13 0.28 -1.35 0.00 0.00 0.00 173.10 173.30 2dkq s SER 5 N -0.37 -0.13 -0.22 1.64 1.04 -1.26 -5.14 113.70 109.26 2dkq s SER 5 Ca 0.24 0.61 -0.09 0.00 0.48 0.00 0.00 55.95 57.19 2dkq s SER 5 Cb -0.11 0.57 0.09 0.00 0.10 0.00 0.00 66.02 66.67 2dkq s SER 5 CO -0.11 -0.19 0.48 -0.44 0.98 0.00 0.00 173.24 173.96 2dkq s SER 6 N 1.64 -0.51 0.00 7.02 0.01 -1.26 -5.12 113.70 115.48 2dkq s SER 6 Ca -0.06 1.11 0.00 0.00 1.31 0.00 0.00 55.95 58.31 2dkq s SER 6 Cb -0.11 1.39 0.00 0.00 0.21 0.00 0.00 66.02 67.51 2dkq s SER 6 CO -0.09 -0.22 0.00 0.61 0.41 0.00 0.00 173.24 173.94 2dkq n GLY 7 N 5.07 3.58 2.92 3.44 0.00 -1.26 -5.13 105.19 113.81 2dkq n GLY 7 Ca -0.13 -0.89 -0.26 0.00 0.00 0.00 0.00 46.02 44.73 2dkq n GLY 7 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 2dkq s MET 8 N -4.47 1.50 0.00 1.61 0.00 -1.26 -5.13 119.30 111.55 2dkq s MET 8 Ca 0.00 -0.26 0.05 0.00 0.00 0.00 0.00 55.69 55.48 2dkq s MET 8 Cb 0.00 -1.53 -0.03 0.00 0.00 0.00 0.00 34.83 33.27 2dkq s MET 8 CO 0.00 -0.22 -0.15 0.45 0.00 0.00 0.00 175.02 175.09 2dkq s SER 9 N 1.56 3.98 0.22 -1.18 0.15 -1.26 -5.12 113.70 112.05 2dkq s SER 9 Ca 0.02 -0.31 -0.20 0.00 0.70 0.00 0.00 55.95 56.16 2dkq s SER 9 Cb -0.13 -0.75 -0.08 0.00 -1.71 0.00 0.00 66.02 63.35 2dkq s SER 9 CO -0.06 0.29 0.74 0.42 1.20 0.00 0.00 173.24 175.82 2dkq s THR 10 N -0.86 4.55 0.16 6.45 -4.23 -1.26 -4.89 115.64 115.55 2dkq s THR 10 Ca 0.14 1.32 -0.22 0.00 -1.18 0.00 0.00 61.69 61.75 2dkq s THR 10 Cb -0.11 -3.88 0.06 0.00 1.34 0.00 0.00 72.50 69.92 2dkq s THR 10 CO 0.04 0.22 1.60 0.00 -0.54 0.00 0.00 174.62 175.94 2dkq h ALA 11 N 3.44 -0.15 -0.99 3.99 0.00 -1.94 0.19 119.26 123.81 2dkq h ALA 11 Ca -0.48 0.11 0.27 0.00 0.00 0.00 0.00 54.91 54.81 2dkq h ALA 11 Cb 1.19 0.67 -0.18 0.00 0.00 0.00 0.00 17.79 19.47 2dkq h ALA 11 CO 0.65 -0.70 0.04 0.00 0.00 0.00 0.00 179.25 179.24 2dkq h ALA 12 N 0.80 1.19 0.02 0.00 0.00 -1.94 0.11 119.26 119.45 2dkq h ALA 12 Ca 0.17 0.34 -0.00 0.00 0.00 0.00 0.00 54.91 55.42 2dkq h ALA 12 Cb 0.53 0.59 0.00 0.00 0.00 0.00 0.00 17.79 18.90 2dkq h ALA 12 CO -0.52 -0.58 -0.01 0.22 0.00 0.00 0.00 179.25 178.36 2dkq h ASP 13 N 0.01 -0.02 0.00 0.00 1.82 -1.54 -3.23 116.42 113.46 2dkq h ASP 13 Ca 0.60 -0.76 0.00 0.00 -0.39 0.00 0.00 57.03 56.48 2dkq h ASP 13 Cb 1.25 0.00 0.00 0.00 0.68 0.00 0.00 39.33 41.27 2dkq h ASP 13 CO -0.92 0.79 0.00 0.18 -1.61 0.00 0.00 179.24 177.68 2dkq n LEU 14 N -4.71 0.00 -0.36 2.28 4.77 0.52 0.19 117.00 119.69 2dkq n LEU 14 Ca -0.09 0.93 0.30 0.00 -0.03 0.00 0.00 56.01 57.11 2dkq n LEU 14 Cb 0.38 -0.43 0.56 0.00 -2.33 0.00 0.00 43.42 41.60 2dkq n LEU 14 CO 0.31 -0.43 1.14 -0.07 -1.33 0.00 0.00 177.39 177.02 2dkq h LEU 15 N 0.00 0.39 -0.75 2.23 3.38 -1.36 1.26 115.31 120.46 2dkq h LEU 15 Ca 0.00 0.19 -0.11 0.00 0.09 0.00 0.00 57.88 58.04 2dkq h LEU 15 Cb 0.00 0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.90 2dkq h LEU 15 CO 0.00 -0.21 -0.26 -0.09 0.09 0.00 0.00 178.44 177.97 2dkq h ARG 16 N 0.18 0.67 -0.10 1.13 2.43 -0.67 -3.15 114.38 114.86 2dkq h ARG 16 Ca 0.78 -0.28 -0.01 0.00 -0.81 0.00 0.00 59.98 59.66 2dkq h ARG 16 Cb 2.07 -0.03 -0.00 0.00 -0.42 0.00 0.00 29.97 31.59 2dkq h ARG 16 CO -0.57 0.86 0.01 0.37 -1.51 0.00 0.00 179.97 179.13 2dkq h GLN 17 N 0.58 0.16 -4.20 0.20 5.75 0.59 -3.50 115.11 114.69 2dkq h GLN 17 Ca 0.08 -0.04 0.00 0.00 -0.15 0.00 0.00 58.65 58.53 2dkq h GLN 17 Cb 0.75 -0.02 0.00 0.00 1.07 0.00 0.00 27.48 29.28 2dkq h GLN 17 CO 0.06 0.37 -0.97 0.41 -2.65 0.00 0.00 178.83 176.05 2dkq n GLY 18 N -0.41 -5.12 2.97 2.39 0.00 -0.64 -5.00 105.19 99.39 2dkq n GLY 18 Ca -0.06 -0.40 -0.28 0.00 0.00 0.00 0.00 46.02 45.28 2dkq n GLY 18 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dkq s ALA 19 N -1.87 1.53 -0.06 4.61 0.00 -1.26 -5.10 121.76 119.60 2dkq s ALA 19 Ca 0.00 -0.67 -0.02 0.00 0.00 0.00 0.00 51.96 51.27 2dkq s ALA 19 Cb 0.00 -0.92 0.04 0.00 0.00 0.00 0.00 23.12 22.24 2dkq s ALA 19 CO 0.00 -0.32 0.11 0.00 0.00 0.00 0.00 175.76 175.55 2dkq s ALA 20 N 1.47 -0.07 0.30 0.00 0.00 -1.26 -3.21 121.76 118.99 2dkq s ALA 20 Ca 0.02 0.47 -0.03 0.00 0.00 0.00 0.00 51.96 52.43 2dkq s ALA 20 Cb -0.13 -0.59 0.01 0.00 0.00 0.00 0.00 23.12 22.41 2dkq s ALA 20 CO -0.07 -0.37 0.44 0.00 0.00 0.00 0.00 175.76 175.76 2dkq s SER 22 N -2.80 7.10 0.14 0.00 0.01 -1.26 -0.50 113.70 116.38 2dkq s SER 22 Ca 0.23 1.32 0.09 0.00 1.31 0.00 0.00 55.95 58.89 2dkq s SER 22 Cb -0.01 -2.38 -0.04 0.00 0.21 0.00 0.00 66.02 63.80 2dkq s SER 22 CO 0.16 0.24 -0.20 0.68 0.41 0.00 0.00 173.24 174.53 2dkq s VAL 23 N -1.16 1.83 -0.44 3.43 -7.23 -0.70 -3.92 120.40 112.23 2dkq s VAL 23 Ca 0.31 -1.74 -0.16 0.00 -1.81 0.00 0.00 61.98 58.58 2dkq s VAL 23 Cb -0.20 -1.74 0.04 0.00 0.56 0.00 0.00 36.38 35.04 2dkq s VAL 23 CO 0.20 -0.16 0.39 -0.22 -0.31 0.00 0.00 175.10 175.00 2dkq s LEU 24 N -2.28 5.17 -0.08 1.32 1.98 0.18 -2.74 118.68 122.22 2dkq s LEU 24 Ca 0.12 -0.95 -0.30 0.00 -2.89 0.00 0.00 54.13 50.11 2dkq s LEU 24 Cb -0.08 -2.25 -0.02 0.00 0.66 0.00 0.00 46.19 44.50 2dkq s LEU 24 CO 0.06 -0.57 1.10 -0.47 -1.89 0.00 0.00 176.35 174.57 2dkq s TYR 25 N 1.87 3.36 -0.05 5.38 5.04 -0.66 0.11 117.35 132.40 2dkq s TYR 25 Ca 0.08 1.41 -0.04 0.00 -2.44 0.00 0.00 57.07 56.07 2dkq s TYR 25 Cb -0.20 -3.30 -0.01 0.00 0.35 0.00 0.00 41.96 38.79 2dkq s TYR 25 CO 0.10 -0.76 -0.09 1.28 -1.34 0.00 0.00 175.55 174.75 2dkq n LEU 26 N 5.11 0.57 0.00 6.97 4.77 -1.07 -1.75 117.00 131.59 2dkq n LEU 26 Ca 0.10 0.20 -0.02 0.00 -0.03 0.00 0.00 56.01 56.26 2dkq n LEU 26 Cb 0.47 -0.59 0.02 0.00 -2.33 0.00 0.00 43.42 40.99 2dkq n LEU 26 CO 0.54 -0.45 0.74 1.07 -1.33 0.00 0.00 177.39 177.95 2dkq n THR 27 N -3.04 0.00 -3.67 -5.08 5.66 -1.23 -4.33 114.28 102.59 2dkq n THR 27 Ca -0.03 -0.43 -0.18 0.00 -3.05 0.00 0.00 64.05 60.36 2dkq n THR 27 Cb 0.13 0.64 -0.17 0.00 -1.55 0.00 0.00 70.33 69.38 2dkq n THR 27 CO 0.00 0.00 0.00 -0.94 -3.05 0.00 0.00 175.07 171.08 2dkq s SER 28 N -3.14 0.87 -0.25 1.09 1.04 -1.26 0.25 113.70 112.29 2dkq s SER 28 Ca 0.21 0.22 -0.03 0.00 0.48 0.00 0.00 55.95 56.83 2dkq s SER 28 Cb -0.02 0.10 0.02 0.00 0.10 0.00 0.00 66.02 66.22 2dkq s SER 28 CO 0.04 -0.24 -0.03 -0.69 0.98 0.00 0.00 173.24 173.29 2dkq s VAL 29 N 2.19 3.11 0.14 5.02 1.01 -1.23 -5.02 120.40 125.63 2dkq s VAL 29 Ca 0.03 -0.92 -0.35 0.00 0.00 0.00 0.00 61.98 60.75 2dkq s VAL 29 Cb -0.12 -2.57 -0.15 0.00 0.00 0.00 0.00 36.38 33.53 2dkq s VAL 29 CO -0.05 0.20 1.39 -0.62 0.00 0.00 0.00 175.10 176.02 2dkq n GLU 30 N 4.72 1.52 -1.42 2.72 1.02 -1.26 -3.95 120.64 123.98 2dkq n GLU 30 Ca -0.16 0.55 -0.13 0.00 -0.02 0.00 0.00 57.16 57.39 2dkq n GLU 30 Cb 0.47 -2.21 0.10 0.00 -0.02 0.00 0.00 31.44 29.79 2dkq n GLU 30 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 2dkq n THR 31 N 2.56 2.50 -0.24 2.62 -2.24 0.88 -4.85 114.28 115.51 2dkq n THR 31 Ca 0.17 -3.70 0.12 0.00 -2.27 0.00 0.00 64.05 58.36 2dkq n THR 31 Cb 0.24 -0.78 0.23 0.00 -2.10 0.00 0.00 70.33 67.92 2dkq n THR 31 CO 0.00 0.00 0.00 -1.84 -0.57 0.00 0.00 175.07 172.66 2dkq n GLU 32 N -0.89 -0.05 -0.06 -0.78 0.00 -0.08 0.34 120.64 119.12 2dkq n GLU 32 Ca 0.36 1.02 -0.15 0.00 0.00 0.00 0.00 57.16 58.40 2dkq n GLU 32 Cb 0.88 -1.65 -0.14 0.00 0.00 0.00 0.00 31.44 30.52 2dkq n GLU 32 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.13 177.58 2dkq n SER 33 N -4.88 1.27 -4.79 -1.84 2.88 -1.26 -4.31 113.62 100.69 2dkq n SER 33 Ca 0.18 0.11 -0.34 0.00 -1.33 0.00 0.00 58.87 57.49 2dkq n SER 33 Cb 0.58 -0.10 -0.00 0.00 -0.75 0.00 0.00 64.21 63.94 2dkq n SER 33 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 2dkq s LEU 34 N -6.30 3.68 -0.12 2.46 2.01 0.15 -5.05 118.68 115.52 2dkq s LEU 34 Ca -0.19 1.99 -0.31 0.00 0.01 0.00 0.00 54.13 55.63 2dkq s LEU 34 Cb 0.07 -4.56 0.13 0.00 0.01 0.00 0.00 46.19 41.84 2dkq s LEU 34 CO 0.75 -1.10 1.03 0.28 1.01 0.00 0.00 176.35 178.33 2dkq s THR 35 N -2.07 0.00 0.00 5.49 -1.32 -1.26 -4.71 115.64 111.77 2dkq s THR 35 Ca 0.68 0.00 0.00 0.00 -1.21 0.00 0.00 61.69 61.16 2dkq s THR 35 Cb -0.19 -1.00 0.00 0.00 -1.51 0.00 0.00 72.50 69.80 2dkq s THR 35 CO 0.28 0.00 0.00 0.61 -2.21 0.00 0.00 174.62 173.30 2dkq n GLY 36 N 0.15 -0.84 0.00 6.08 0.00 -1.26 -3.65 105.19 105.67 2dkq n GLY 36 Ca -0.06 -1.22 0.05 0.00 0.00 0.00 0.00 46.02 44.79 2dkq n GLY 36 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2dkq n PRO 37 N 0.00 0.49 -0.09 1.61 -0.04 -1.26 -2.63 135.00 133.08 2dkq n PRO 37 Ca 0.00 0.00 -0.19 0.00 -0.04 0.00 0.00 63.50 63.27 2dkq n PRO 37 Cb 0.00 -1.34 -0.13 0.00 -0.04 0.00 0.00 33.50 32.00 2dkq n PRO 37 CO 0.00 0.00 0.00 0.94 -0.04 0.00 0.00 175.50 176.40 2dkq n GLN 38 N -0.84 0.68 -0.30 0.54 -0.06 -1.24 -4.23 117.38 111.94 2dkq n GLN 38 Ca 0.08 0.19 0.01 0.00 -2.00 0.00 0.00 57.00 55.27 2dkq n GLN 38 Cb 0.04 -1.58 0.14 0.00 -4.06 0.00 0.00 30.24 24.78 2dkq n GLN 38 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 2dkq h ALA 39 N 0.02 1.14 -0.37 1.69 0.00 -1.60 -0.97 119.26 119.17 2dkq h ALA 39 Ca -0.53 0.00 0.01 0.00 0.00 0.00 0.00 54.91 54.39 2dkq h ALA 39 Cb 1.94 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 19.51 2dkq h ALA 39 CO -0.04 0.21 0.24 0.28 0.00 0.00 0.00 179.25 179.95 2dkq h VAL 40 N 0.90 1.07 0.57 0.00 2.07 -1.77 -3.04 116.25 116.05 2dkq h VAL 40 Ca 0.37 -0.16 -0.03 0.00 0.82 0.00 0.00 66.70 67.70 2dkq h VAL 40 Cb 0.21 0.57 0.01 0.00 -1.52 0.00 0.00 31.29 30.56 2dkq h VAL 40 CO -0.19 0.08 -0.27 0.00 0.02 0.00 0.00 177.57 177.22 2dkq h ALA 41 N 1.78 -0.82 -0.80 1.67 0.00 -1.36 -3.24 119.26 116.49 2dkq h ALA 41 Ca 0.14 -0.17 0.07 0.00 0.00 0.00 0.00 54.91 54.96 2dkq h ALA 41 Cb -0.01 0.29 -0.10 0.00 0.00 0.00 0.00 17.79 17.98 2dkq h ALA 41 CO -0.03 -0.77 -0.46 -2.13 0.00 0.00 0.00 179.25 175.86 2dkq n ARG 42 N -4.99 -0.34 -0.36 0.00 0.63 -0.98 -0.40 116.66 110.22 2dkq n ARG 42 Ca -0.09 1.20 -0.11 0.00 -0.92 0.00 0.00 57.85 57.93 2dkq n ARG 42 Cb 0.30 -1.77 -0.10 0.00 0.45 0.00 0.00 32.46 31.34 2dkq n ARG 42 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2dkq h ALA 43 N 0.43 -0.59 0.22 5.13 0.00 -1.63 0.20 119.26 123.02 2dkq h ALA 43 Ca 0.13 0.09 0.01 0.00 0.00 0.00 0.00 54.91 55.15 2dkq h ALA 43 Cb 0.33 1.32 -0.03 0.00 0.00 0.00 0.00 17.79 19.41 2dkq h ALA 43 CO -0.75 -0.97 -0.38 0.77 0.00 0.00 0.00 179.25 177.92 2dkq h SER 44 N -0.08 -1.07 -1.10 0.00 0.02 -0.74 0.11 113.55 110.68 2dkq h SER 44 Ca 0.14 0.11 0.30 0.00 -0.84 0.00 0.00 61.79 61.50 2dkq h SER 44 Cb 0.44 0.39 -0.08 0.00 0.14 0.00 0.00 62.40 63.28 2dkq h SER 44 CO -0.85 -0.48 0.74 -1.28 -1.14 0.00 0.00 176.83 173.82 2dkq h SER 45 N -0.67 0.28 0.09 3.07 0.87 0.10 0.26 113.55 117.53 2dkq h SER 45 Ca 0.00 0.06 -0.29 0.00 -1.23 0.00 0.00 61.79 60.33 2dkq h SER 45 Cb 0.66 0.02 0.03 0.00 -0.44 0.00 0.00 62.40 62.66 2dkq h SER 45 CO -0.16 0.04 -1.18 0.00 -0.53 0.00 0.00 176.83 175.00 2dkq h ALA 46 N 1.55 0.04 -0.30 6.23 0.00 0.56 0.26 119.26 127.59 2dkq h ALA 46 Ca 0.60 -0.75 0.06 0.00 0.00 0.00 0.00 54.91 54.82 2dkq h ALA 46 Cb 1.83 0.10 -0.01 0.00 0.00 0.00 0.00 17.79 19.70 2dkq h ALA 46 CO -0.20 0.69 0.21 0.00 0.00 0.00 0.00 179.25 179.94 2dkq h ALA 47 N 0.33 2.11 0.03 0.00 0.00 0.20 0.26 119.26 122.18 2dkq h ALA 47 Ca -0.17 -0.01 -0.38 0.00 0.00 0.00 0.00 54.91 54.35 2dkq h ALA 47 Cb 1.85 -0.02 -0.06 0.00 0.00 0.00 0.00 17.79 19.56 2dkq h ALA 47 CO 0.23 -0.18 -2.35 1.28 0.00 0.00 0.00 179.25 178.23 2dkq n LEU 48 N -4.48 2.54 0.11 0.00 4.77 -0.75 -4.52 117.00 114.66 2dkq n LEU 48 Ca 0.03 -0.04 -0.13 0.00 -0.03 0.00 0.00 56.01 55.84 2dkq n LEU 48 Cb 0.28 -0.77 -0.08 0.00 -2.33 0.00 0.00 43.42 40.52 2dkq n LEU 48 CO 0.35 0.86 0.69 -1.28 -1.33 0.00 0.00 177.39 176.68 2dkq h SER 49 N 0.01 -0.21 -4.01 -1.43 0.87 -0.24 -3.44 113.55 105.10 2dkq h SER 49 Ca -0.54 -0.16 -0.47 0.00 -1.23 0.00 0.00 61.79 59.40 2dkq h SER 49 Cb 1.97 0.05 0.01 0.00 -0.44 0.00 0.00 62.40 63.99 2dkq h SER 49 CO -0.04 0.04 0.38 0.00 -0.53 0.00 0.00 176.83 176.68 2dkq s SER 51 N -1.86 -0.04 0.48 0.00 0.01 -1.26 -4.14 113.70 106.88 2dkq s SER 51 Ca 0.61 -0.54 -0.22 0.00 1.31 0.00 0.00 55.95 57.11 2dkq s SER 51 Cb -0.17 0.41 -0.07 0.00 0.21 0.00 0.00 66.02 66.41 2dkq s SER 51 CO 0.21 -0.81 1.16 -2.16 0.41 0.00 0.00 173.24 172.05 2dkq s PRO 52 N -3.85 3.68 0.33 12.44 0.04 -1.26 -5.08 135.00 141.30 2dkq s PRO 52 Ca 0.06 1.74 -0.23 0.00 0.04 0.00 0.00 61.00 62.61 2dkq s PRO 52 Cb 0.03 -2.33 -0.16 0.00 0.04 0.00 0.00 34.50 32.09 2dkq s PRO 52 CO -0.10 -0.61 0.22 2.89 0.04 0.00 0.00 177.00 179.45 2dkq n ARG 53 N -0.64 0.00 -1.23 4.56 1.85 -1.26 -4.90 116.66 115.04 2dkq n ARG 53 Ca 0.08 0.00 -0.30 0.00 -1.00 0.00 0.00 57.85 56.63 2dkq n ARG 53 Cb 0.49 -0.98 0.12 0.00 -1.05 0.00 0.00 32.46 31.03 2dkq n ARG 53 CO 0.00 0.00 0.00 -1.25 -0.01 0.00 0.00 177.63 176.37 2dkq s PRO 54 N -0.98 1.73 -0.42 2.89 0.04 -1.26 -5.01 135.00 131.99 2dkq s PRO 54 Ca 0.60 0.99 -0.15 0.00 0.04 0.00 0.00 61.00 62.48 2dkq s PRO 54 Cb -0.72 -1.85 0.03 0.00 0.04 0.00 0.00 34.50 32.00 2dkq s PRO 54 CO 0.59 -1.96 0.33 0.99 0.04 0.00 0.00 177.00 176.99 2dkq s THR 55 N -2.92 5.24 1.09 1.26 2.01 -1.26 -5.07 115.64 115.99 2dkq s THR 55 Ca 0.62 -0.71 -0.15 0.00 0.31 0.00 0.00 61.69 61.76 2dkq s THR 55 Cb -0.18 -3.98 0.23 0.00 0.01 0.00 0.00 72.50 68.59 2dkq s THR 55 CO 0.56 -0.37 1.10 -2.16 -0.69 0.00 0.00 174.62 173.06 2dkq s PRO 56 N 1.71 -0.31 0.04 4.92 0.04 -1.26 -4.97 135.00 135.17 2dkq s PRO 56 Ca 0.05 0.26 -0.09 0.00 0.04 0.00 0.00 61.00 61.26 2dkq s PRO 56 Cb -0.20 -1.67 0.00 0.00 0.04 0.00 0.00 34.50 32.67 2dkq s PRO 56 CO 0.10 -3.17 0.19 0.00 0.04 0.00 0.00 177.00 174.15 2dkq s ALA 57 N -2.98 -0.32 -0.18 8.56 0.00 -0.72 -4.99 121.76 121.13 2dkq s ALA 57 Ca 0.68 -0.33 -0.17 0.00 0.00 0.00 0.00 51.96 52.13 2dkq s ALA 57 Cb -0.15 0.30 -0.04 0.00 0.00 0.00 0.00 23.12 23.23 2dkq s ALA 57 CO 0.57 -0.37 0.46 0.08 0.00 0.00 0.00 175.76 176.50 2dkq s VAL 58 N -2.68 5.16 0.34 0.00 1.01 -1.26 -1.66 120.40 121.32 2dkq s VAL 58 Ca -0.04 0.86 0.05 0.00 0.00 0.00 0.00 61.98 62.85 2dkq s VAL 58 Cb -0.01 -3.79 -0.02 0.00 0.00 0.00 0.00 36.38 32.56 2dkq s VAL 58 CO -0.05 0.24 0.34 0.68 0.00 0.00 0.00 175.10 176.32 2dkq s VAL 59 N 1.25 0.00 0.33 2.92 -7.23 -1.11 -4.71 120.40 111.85 2dkq s VAL 59 Ca 0.22 -1.89 0.07 0.00 -1.81 0.00 0.00 61.98 58.57 2dkq s VAL 59 Cb -0.15 -2.55 -0.02 0.00 0.56 0.00 0.00 36.38 34.22 2dkq s VAL 59 CO 0.09 0.00 0.37 -2.28 -0.31 0.00 0.00 175.10 172.97 2dkq s HIS 60 N -3.29 3.00 -0.04 2.82 2.46 0.15 -1.71 115.29 118.67 2dkq s HIS 60 Ca 0.38 -0.26 -0.04 0.00 0.47 0.00 0.00 55.06 55.61 2dkq s HIS 60 Cb 0.01 -1.88 0.01 0.00 -0.13 0.00 0.00 32.58 30.60 2dkq s HIS 60 CO 0.27 0.10 0.12 0.12 -2.47 0.00 0.00 174.74 172.87 2dkq s PHE 61 N -2.25 -0.13 -0.06 3.88 2.19 0.34 -3.55 117.98 118.40 2dkq s PHE 61 Ca 0.43 0.32 -0.05 0.00 0.33 0.00 0.00 56.93 57.96 2dkq s PHE 61 Cb -0.07 0.03 0.02 0.00 -1.31 0.00 0.00 43.02 41.68 2dkq s PHE 61 CO 0.29 -0.07 0.16 0.21 1.83 0.00 0.00 175.22 177.63 2dkq s LYS 62 N 0.19 0.16 -0.23 10.12 2.20 -0.93 -2.29 119.74 128.96 2dkq s LYS 62 Ca -0.01 0.28 0.00 0.00 -0.36 0.00 0.00 55.97 55.88 2dkq s LYS 62 Cb -0.02 -0.00 0.03 0.00 -1.51 0.00 0.00 37.83 36.33 2dkq s LYS 62 CO -0.01 -0.07 -0.12 0.08 -0.36 0.00 0.00 175.35 174.88 2dkq s VAL 63 N 0.47 2.48 0.34 4.02 1.01 -1.20 -2.67 120.40 124.85 2dkq s VAL 63 Ca -0.03 -1.11 0.07 0.00 0.00 0.00 0.00 61.98 60.91 2dkq s VAL 63 Cb -0.05 -2.23 -0.03 0.00 0.00 0.00 0.00 36.38 34.08 2dkq s VAL 63 CO -0.02 0.27 0.27 -0.44 0.00 0.00 0.00 175.10 175.18 2dkq s SER 64 N 1.27 1.86 0.52 3.32 0.01 -1.04 -4.50 113.70 115.14 2dkq s SER 64 Ca -0.00 -1.78 0.32 0.00 1.31 0.00 0.00 55.95 55.80 2dkq s SER 64 Cb -0.16 0.57 1.27 0.00 0.21 0.00 0.00 66.02 67.91 2dkq s SER 64 CO -0.07 -1.07 1.94 0.00 0.41 0.00 0.00 173.24 174.45 2dkq h ALA 65 N 2.08 1.00 0.00 1.44 0.00 -1.96 -2.55 119.26 119.26 2dkq h ALA 65 Ca -0.25 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.65 2dkq h ALA 65 Cb 1.23 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 19.02 2dkq h ALA 65 CO 0.37 0.00 -0.05 1.96 0.00 0.00 0.00 179.25 181.53 2dkq h GLN 66 N 0.00 0.00 0.00 0.00 7.50 -1.96 -3.43 115.11 117.23 2dkq h GLN 66 Ca 0.00 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.15 2dkq h GLN 66 Cb 0.53 0.00 0.00 0.00 0.05 0.00 0.00 27.48 28.06 2dkq h GLN 66 CO 0.00 0.05 0.00 0.41 -1.50 0.00 0.00 178.83 177.79 2dkq n GLY 67 N 1.05 0.68 3.81 3.46 0.00 -0.96 -0.57 105.19 112.65 2dkq n GLY 67 Ca 0.04 -1.87 -0.34 0.00 0.00 0.00 0.00 46.02 43.84 2dkq n GLY 67 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2dkq s ILE 68 N -2.31 4.95 -0.03 -0.61 1.01 -1.13 -2.49 121.20 120.58 2dkq s ILE 68 Ca 0.00 -0.21 0.02 0.00 0.00 0.00 0.00 60.65 60.46 2dkq s ILE 68 Cb 0.00 -3.22 0.01 0.00 0.01 0.00 0.00 42.46 39.26 2dkq s ILE 68 CO 0.00 0.45 -0.07 -0.89 0.00 0.00 0.00 174.94 174.42 2dkq s THR 69 N -1.13 0.67 -0.25 2.92 2.01 -1.09 -1.26 115.64 117.50 2dkq s THR 69 Ca 0.20 -0.28 0.00 0.00 0.31 0.00 0.00 61.69 61.93 2dkq s THR 69 Cb -0.12 -0.62 0.07 0.00 0.01 0.00 0.00 72.50 71.84 2dkq s THR 69 CO 0.11 0.22 0.00 -0.76 -0.69 0.00 0.00 174.62 173.50 2dkq s LEU 70 N 0.37 2.54 -0.09 4.42 1.43 -0.21 -2.19 118.68 124.94 2dkq s LEU 70 Ca -0.05 -1.32 -0.02 0.00 -1.03 0.00 0.00 54.13 51.71 2dkq s LEU 70 Cb -0.10 -1.08 -0.03 0.00 0.03 0.00 0.00 46.19 45.01 2dkq s LEU 70 CO 0.00 -0.30 0.00 -0.89 0.23 0.00 0.00 176.35 175.40 2dkq s THR 71 N 1.45 4.32 0.02 5.49 2.01 -1.23 -0.16 115.64 127.54 2dkq s THR 71 Ca -0.00 -0.24 0.04 0.00 0.31 0.00 0.00 61.69 61.79 2dkq s THR 71 Cb -0.18 -2.82 -0.02 0.00 0.01 0.00 0.00 72.50 69.49 2dkq s THR 71 CO -0.10 0.60 -0.12 1.51 -0.69 0.00 0.00 174.62 175.82 2dkq s ASP 72 N -0.83 1.40 -0.17 3.53 -4.77 -1.26 0.29 116.67 114.87 2dkq s ASP 72 Ca 0.13 -0.35 0.17 0.00 -3.30 0.00 0.00 52.55 49.19 2dkq s ASP 72 Cb -0.11 -0.11 0.51 0.00 -1.09 0.00 0.00 42.92 42.12 2dkq s ASP 72 CO 0.02 0.05 1.40 0.59 0.70 0.00 0.00 175.17 177.94 2dkq n ASN 73 N 2.25 3.78 -0.09 2.11 3.02 -1.26 -4.49 115.26 120.59 2dkq n ASN 73 Ca -0.17 -2.98 -0.18 0.00 -0.03 0.00 0.00 54.58 51.23 2dkq n ASN 73 Cb 0.55 -0.53 -0.13 0.00 -0.61 0.00 0.00 39.78 39.07 2dkq n ASN 73 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2dkq n GLN 74 N -0.51 0.68 -2.53 3.52 6.02 -1.26 -4.98 117.38 118.32 2dkq n GLN 74 Ca 0.21 0.16 -0.18 0.00 -0.01 0.00 0.00 57.00 57.18 2dkq n GLN 74 Cb 0.86 -1.57 -0.00 0.00 1.02 0.00 0.00 30.24 30.55 2dkq n GLN 74 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 2dkq n ARG 75 N -3.25 -2.30 -0.01 -1.09 1.74 -1.25 -4.88 116.66 105.61 2dkq n ARG 75 Ca -0.40 0.81 -0.02 0.00 -0.77 0.00 0.00 57.85 57.47 2dkq n ARG 75 Cb 1.02 -5.48 -0.01 0.00 -1.02 0.00 0.00 32.46 26.98 2dkq n ARG 75 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 2dkq n LYS 76 N -3.07 0.09 0.00 5.56 5.02 -1.26 -4.77 118.16 119.73 2dkq n LYS 76 Ca -0.18 0.04 -0.18 0.00 -2.02 0.00 0.00 58.31 55.97 2dkq n LYS 76 Cb 0.64 -0.64 -0.11 0.00 -0.02 0.00 0.00 35.03 34.90 2dkq n LYS 76 CO 0.00 0.00 0.00 1.25 -0.52 0.00 0.00 177.40 178.13 2dkq h LEU 77 N -0.17 0.59 0.00 -0.35 5.85 -1.99 -3.48 115.31 115.75 2dkq h LEU 77 Ca 0.00 -0.74 0.02 0.00 0.84 0.00 0.00 57.88 58.00 2dkq h LEU 77 Cb 0.17 -0.18 -0.00 0.00 0.37 0.00 0.00 40.66 41.02 2dkq h LEU 77 CO 0.00 1.25 0.35 2.22 -0.34 0.00 0.00 178.44 181.92 2dkq n PHE 78 N -4.18 -2.03 -4.49 1.25 -1.74 -1.26 -5.19 117.46 99.82 2dkq n PHE 78 Ca -0.10 -1.62 -0.28 0.00 -0.56 0.00 0.00 57.45 54.89 2dkq n PHE 78 Cb 0.69 0.80 -0.09 0.00 1.52 0.00 0.00 39.48 42.40 2dkq n PHE 78 CO 0.00 0.00 0.00 0.12 -0.56 0.00 0.00 176.76 176.32 2dkq s PHE 79 N -2.41 2.45 0.33 2.97 5.36 -1.26 -3.89 117.98 121.52 2dkq s PHE 79 Ca 0.17 -0.68 -0.24 0.00 -0.96 0.00 0.00 56.93 55.22 2dkq s PHE 79 Cb -0.04 -1.81 -0.16 0.00 -0.34 0.00 0.00 43.02 40.67 2dkq s PHE 79 CO 0.10 0.33 0.28 -2.13 -1.46 0.00 0.00 175.22 172.34 2dkq n ARG 80 N -1.09 0.04 -3.66 10.12 0.63 -1.26 -4.80 116.66 116.63 2dkq n ARG 80 Ca -0.05 0.01 -0.13 0.00 -0.92 0.00 0.00 57.85 56.76 2dkq n ARG 80 Cb 0.66 -1.03 -0.12 0.00 0.45 0.00 0.00 32.46 32.42 2dkq n ARG 80 CO 0.00 0.00 0.00 1.03 -2.51 0.00 0.00 177.63 176.15 2dkq s ARG 81 N -1.03 0.18 -0.02 -0.14 0.52 0.78 -4.99 118.95 114.25 2dkq s ARG 81 Ca 0.61 0.80 0.04 0.00 -0.52 0.00 0.00 55.73 56.66 2dkq s ARG 81 Cb -0.75 0.04 -0.03 0.00 0.52 0.00 0.00 34.95 34.73 2dkq s ARG 81 CO 0.60 -0.28 -0.11 -1.58 0.02 0.00 0.00 175.30 173.95 2dkq s HIS 82 N 2.45 2.79 0.04 -0.53 5.65 -1.26 -1.05 115.29 123.38 2dkq s HIS 82 Ca 0.01 -0.10 0.05 0.00 0.25 0.00 0.00 55.06 55.27 2dkq s HIS 82 Cb -0.12 -1.61 -0.02 0.00 -1.18 0.00 0.00 32.58 29.65 2dkq s HIS 82 CO -0.09 0.29 -0.16 0.71 -0.65 0.00 0.00 174.74 174.84 2dkq s TYR 83 N -0.88 1.36 1.02 3.88 1.51 -0.39 -5.03 117.35 118.83 2dkq s TYR 83 Ca 0.14 -0.36 -0.13 0.00 -1.01 0.00 0.00 57.07 55.72 2dkq s TYR 83 Cb -0.11 -0.81 0.20 0.00 -0.11 0.00 0.00 41.96 41.14 2dkq s TYR 83 CO 0.04 0.05 1.09 -1.25 -1.11 0.00 0.00 175.55 174.37 2dkq s PRO 84 N -1.14 0.23 0.08 -1.71 0.04 -1.26 -2.86 135.00 128.38 2dkq s PRO 84 Ca 0.03 0.46 0.25 0.00 0.04 0.00 0.00 61.00 61.78 2dkq s PRO 84 Cb -0.08 -1.72 0.60 0.00 0.04 0.00 0.00 34.50 33.34 2dkq s PRO 84 CO 0.01 -2.86 1.51 1.55 0.04 0.00 0.00 177.00 177.26 2dkq n VAL 85 N -4.25 0.24 0.32 -0.36 3.14 0.26 -3.54 118.33 114.14 2dkq n VAL 85 Ca 0.05 -0.16 0.12 0.00 -2.96 0.00 0.00 64.34 61.40 2dkq n VAL 85 Cb 0.57 -0.15 0.20 0.00 -1.06 0.00 0.00 33.84 33.40 2dkq n VAL 85 CO 0.00 0.00 0.00 0.78 -6.46 0.00 0.00 176.83 171.15 2dkq h ASN 86 N 0.00 0.00 0.27 6.55 2.35 -1.93 -3.30 115.58 119.52 2dkq h ASN 86 Ca 0.00 -0.02 -0.34 0.00 -0.55 0.00 0.00 56.30 55.40 2dkq h ASN 86 Cb 0.64 0.00 0.01 0.00 0.05 0.00 0.00 38.32 39.02 2dkq h ASN 86 CO 0.00 0.01 -1.65 -1.28 -1.65 0.00 0.00 177.43 172.86 2dkq h SER 87 N 0.00 0.60 -3.03 5.81 0.87 -1.94 -3.45 113.55 112.41 2dkq h SER 87 Ca 0.00 -0.83 -0.57 0.00 -1.23 0.00 0.00 61.79 59.16 2dkq h SER 87 Cb 0.92 -0.20 -0.04 0.00 -0.44 0.00 0.00 62.40 62.64 2dkq h SER 87 CO 0.00 1.69 0.95 -0.63 -0.53 0.00 0.00 176.83 178.31 2dkq s ILE 88 N -2.59 4.17 0.00 2.23 1.01 -1.24 -3.01 121.20 121.76 2dkq s ILE 88 Ca -0.13 1.36 0.00 0.00 0.00 0.00 0.00 60.65 61.88 2dkq s ILE 88 Cb 0.06 -4.07 0.00 0.00 0.01 0.00 0.00 42.46 38.46 2dkq s ILE 88 CO 0.87 -0.33 0.00 0.35 0.00 0.00 0.00 174.94 175.83 2dkq n THR 89 N 5.90 0.00 -4.78 2.92 -2.24 -1.22 -4.95 114.28 109.91 2dkq n THR 89 Ca 0.15 0.00 -0.29 0.00 -2.27 0.00 0.00 64.05 61.64 2dkq n THR 89 Cb 0.46 -0.60 -0.14 0.00 -2.10 0.00 0.00 70.33 67.94 2dkq n THR 89 CO 0.00 0.00 0.00 0.12 -0.57 0.00 0.00 175.07 174.62 2dkq s PHE 90 N -1.92 2.18 -0.30 4.78 5.36 -1.21 -4.96 117.98 121.91 2dkq s PHE 90 Ca 0.00 -0.40 -0.12 0.00 -0.96 0.00 0.00 56.93 55.45 2dkq s PHE 90 Cb 0.00 -1.29 0.18 0.00 -0.34 0.00 0.00 43.02 41.56 2dkq s PHE 90 CO 0.00 0.14 0.98 0.45 -1.46 0.00 0.00 175.22 175.33 2dkq s SER 91 N -1.32 -0.60 -0.18 6.13 0.15 -1.26 -1.00 113.70 115.62 2dkq s SER 91 Ca 0.11 0.51 -0.28 0.00 0.70 0.00 0.00 55.95 56.98 2dkq s SER 91 Cb -0.10 1.55 0.11 0.00 -1.71 0.00 0.00 66.02 65.88 2dkq s SER 91 CO 0.02 -0.11 0.91 -0.55 1.20 0.00 0.00 173.24 174.71 2dkq s SER 92 N 2.76 -0.49 0.56 5.45 0.15 -1.22 -4.67 113.70 116.24 2dkq s SER 92 Ca 0.01 0.70 -0.18 0.00 0.70 0.00 0.00 55.95 57.18 2dkq s SER 92 Cb -0.09 0.63 -0.10 0.00 -1.71 0.00 0.00 66.02 64.74 2dkq s SER 92 CO -0.14 -0.34 0.32 0.35 1.20 0.00 0.00 173.24 174.63 2dkq n THR 93 N 1.36 1.57 -1.64 6.45 -2.24 -1.26 -4.34 114.28 114.18 2dkq n THR 93 Ca -0.13 -0.50 -0.42 0.00 -2.27 0.00 0.00 64.05 60.73 2dkq n THR 93 Cb 0.57 -0.48 0.00 0.00 -2.10 0.00 0.00 70.33 68.32 2dkq n THR 93 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 2dkq n ASP 94 N 1.09 1.83 -0.12 3.42 5.75 -1.20 -4.91 116.55 122.41 2dkq n ASP 94 Ca 0.10 1.12 -0.13 0.00 -0.01 0.00 0.00 54.79 55.87 2dkq n ASP 94 Cb 0.47 -1.39 -0.03 0.00 -1.03 0.00 0.00 41.12 39.14 2dkq n ASP 94 CO 0.00 0.00 0.00 1.55 -0.11 0.00 0.00 177.20 178.64 2dkq h PRO 95 N 1.96 0.90 0.00 0.11 0.13 -1.88 -2.94 132.00 130.27 2dkq h PRO 95 Ca -0.44 -0.47 0.00 0.00 -0.87 0.00 0.00 66.00 64.22 2dkq h PRO 95 Cb 1.32 0.02 0.00 0.00 0.13 0.00 0.00 31.00 32.46 2dkq h PRO 95 CO 0.59 1.12 0.00 1.96 -0.23 0.00 0.00 178.00 181.44 2dkq h GLN 96 N 0.70 0.00 -6.46 0.86 7.50 -1.95 -3.47 115.11 112.30 2dkq h GLN 96 Ca 0.06 0.00 -0.50 0.00 0.50 0.00 0.00 58.65 58.71 2dkq h GLN 96 Cb 0.95 0.00 -0.07 0.00 0.05 0.00 0.00 27.48 28.41 2dkq h GLN 96 CO 0.09 0.00 -0.84 -0.25 -1.50 0.00 0.00 178.83 176.33 2dkq n ASP 97 N -2.81 -1.96 -4.89 1.46 9.92 -1.11 -4.94 116.55 112.21 2dkq n ASP 97 Ca 0.02 -0.94 -0.29 0.00 -0.53 0.00 0.00 54.79 53.05 2dkq n ASP 97 Cb 0.32 -3.29 0.01 0.00 -0.64 0.00 0.00 41.12 37.51 2dkq n ASP 97 CO 0.00 0.00 0.00 -0.60 0.13 0.00 0.00 177.20 176.73 2dkq s ARG 98 N -6.57 3.54 0.04 -1.24 6.06 -1.26 -4.92 118.95 114.60 2dkq s ARG 98 Ca 0.30 0.44 0.00 0.00 -2.50 0.00 0.00 55.73 53.97 2dkq s ARG 98 Cb -0.16 -2.24 -0.04 0.00 0.06 0.00 0.00 34.95 32.58 2dkq s ARG 98 CO 0.88 -0.39 0.15 1.03 -2.50 0.00 0.00 175.30 174.47 2dkq s ARG 99 N -4.95 3.24 -0.26 5.12 1.81 -1.26 -2.75 118.95 119.90 2dkq s ARG 99 Ca 0.51 -0.48 -0.05 0.00 -1.72 0.00 0.00 55.73 53.99 2dkq s ARG 99 Cb -0.11 -2.95 0.01 0.00 -0.45 0.00 0.00 34.95 31.45 2dkq s ARG 99 CO 0.49 0.62 0.01 -0.46 -0.68 0.00 0.00 175.30 175.28 2dkq s TRP 100 N -1.39 3.07 -0.76 -0.53 -0.11 0.59 -4.86 118.94 114.95 2dkq s TRP 100 Ca 0.30 -1.10 -0.26 0.00 1.22 0.00 0.00 56.10 56.26 2dkq s TRP 100 Cb -0.13 -2.16 0.02 0.00 -1.50 0.00 0.00 33.47 29.71 2dkq s TRP 100 CO 0.22 -0.60 1.40 0.99 -4.62 0.00 0.00 176.95 174.35 2dkq s THR 101 N 1.45 3.69 0.87 5.86 2.01 -1.26 -1.96 115.64 126.31 2dkq s THR 101 Ca 0.03 0.20 -0.10 0.00 0.31 0.00 0.00 61.69 62.13 2dkq s THR 101 Cb -0.16 -4.78 0.12 0.00 0.01 0.00 0.00 72.50 67.69 2dkq s THR 101 CO -0.01 -1.72 1.12 0.20 -0.69 0.00 0.00 174.62 173.52 2dkq s ASN 102 N 4.62 3.43 0.00 3.53 0.01 0.94 -4.88 114.94 122.59 2dkq s ASN 102 Ca 0.42 1.99 0.14 0.00 -0.71 0.00 0.00 52.86 54.70 2dkq s ASN 102 Cb -0.08 -2.52 0.65 0.00 0.41 0.00 0.00 41.25 39.72 2dkq s ASN 102 CO 0.12 -2.75 1.43 -0.81 -1.51 0.00 0.00 177.10 173.59 2dkq n PRO 103 N -3.99 0.07 -0.10 -0.60 -0.04 -1.26 -2.13 135.00 126.96 2dkq n PRO 103 Ca 0.10 0.22 0.09 0.00 -0.04 0.00 0.00 63.50 63.87 2dkq n PRO 103 Cb 0.53 -1.50 0.33 0.00 -0.04 0.00 0.00 33.50 32.82 2dkq n PRO 103 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 2dkq n ASP 104 N -1.42 1.60 -1.85 3.54 8.00 -1.26 -4.93 116.55 120.22 2dkq n ASP 104 Ca 0.05 -1.76 -0.03 0.00 0.71 0.00 0.00 54.79 53.75 2dkq n ASP 104 Cb 0.15 -0.13 0.02 0.00 -0.02 0.00 0.00 41.12 41.14 2dkq n ASP 104 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2dkq n GLY 105 N 1.09 0.44 3.56 0.44 0.00 -0.90 -5.08 105.19 104.73 2dkq n GLY 105 Ca 0.15 -0.11 -0.09 0.00 0.00 0.00 0.00 46.02 45.96 2dkq n GLY 105 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2dkq s THR 106 N -3.08 0.00 0.17 2.61 -1.32 -1.24 -5.00 115.64 107.77 2dkq s THR 106 Ca 0.09 -0.23 0.06 0.00 -1.21 0.00 0.00 61.69 60.40 2dkq s THR 106 Cb -0.01 -1.28 -0.04 0.00 -1.51 0.00 0.00 72.50 69.66 2dkq s THR 106 CO 0.16 0.00 0.06 0.42 -2.21 0.00 0.00 174.62 173.05 2dkq s THR 107 N -3.50 4.07 0.12 5.08 -4.23 -1.26 -0.04 115.64 115.88 2dkq s THR 107 Ca 0.05 -1.26 -0.11 0.00 -1.18 0.00 0.00 61.69 59.19 2dkq s THR 107 Cb -0.02 -3.06 0.01 0.00 1.34 0.00 0.00 72.50 70.77 2dkq s THR 107 CO -0.07 -0.11 0.28 -0.94 -0.54 0.00 0.00 174.62 173.25 2dkq s SER 108 N -3.00 -0.02 0.21 3.99 1.04 -0.83 -4.91 113.70 110.19 2dkq s SER 108 Ca 0.29 -0.58 -0.30 0.00 0.48 0.00 0.00 55.95 55.84 2dkq s SER 108 Cb -0.10 0.41 -0.08 0.00 0.10 0.00 0.00 66.02 66.35 2dkq s SER 108 CO 0.21 -0.81 0.96 -0.75 0.98 0.00 0.00 173.24 173.83 2dkq s LYS 109 N -3.86 4.79 -0.03 4.02 2.36 -1.26 -0.30 119.74 125.46 2dkq s LYS 109 Ca 0.06 1.52 -0.13 0.00 -2.55 0.00 0.00 55.97 54.87 2dkq s LYS 109 Cb 0.03 -3.30 -0.05 0.00 -1.05 0.00 0.00 37.83 33.47 2dkq s LYS 109 CO -0.09 0.41 0.35 0.42 1.55 0.00 0.00 175.35 177.99 2dkq s ILE 110 N -0.86 5.14 0.31 5.43 1.01 -1.11 -2.31 121.20 128.80 2dkq s ILE 110 Ca 0.43 0.71 -0.18 0.00 0.00 0.00 0.00 60.65 61.61 2dkq s ILE 110 Cb -0.26 -3.65 0.03 0.00 0.01 0.00 0.00 42.46 38.59 2dkq s ILE 110 CO 0.32 0.58 0.71 0.72 0.00 0.00 0.00 174.94 177.28 2dkq s PHE 111 N -1.01 0.00 0.00 3.97 -0.71 0.60 -3.26 117.98 117.58 2dkq s PHE 111 Ca 0.22 -0.52 0.00 0.00 -1.04 0.00 0.00 56.93 55.59 2dkq s PHE 111 Cb -0.16 0.68 0.00 0.00 -1.21 0.00 0.00 43.02 42.33 2dkq s PHE 111 CO 0.11 -1.32 0.00 0.41 -1.34 0.00 0.00 175.22 173.08 2dkq n GLY 112 N -0.48 1.01 3.30 1.99 0.00 -1.26 0.98 105.19 110.73 2dkq n GLY 112 Ca -0.05 -0.97 -0.17 0.00 0.00 0.00 0.00 46.02 44.83 2dkq n GLY 112 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2dkq s PHE 113 N -2.00 1.54 -0.28 1.61 -0.71 -1.23 -3.42 117.98 113.49 2dkq s PHE 113 Ca 0.00 -0.63 -0.08 0.00 -1.04 0.00 0.00 56.93 55.19 2dkq s PHE 113 Cb 0.00 -0.74 -0.01 0.00 -1.21 0.00 0.00 43.02 41.06 2dkq s PHE 113 CO 0.00 0.25 0.09 0.08 -1.34 0.00 0.00 175.22 174.30 2dkq s VAL 114 N -2.97 4.23 0.05 -2.49 1.01 -0.17 -2.23 120.40 117.83 2dkq s VAL 114 Ca 0.19 -0.45 0.05 0.00 0.00 0.00 0.00 61.98 61.77 2dkq s VAL 114 Cb -0.00 -3.11 -0.02 0.00 0.00 0.00 0.00 36.38 33.25 2dkq s VAL 114 CO 0.04 0.17 -0.15 0.00 0.00 0.00 0.00 175.10 175.16 2dkq s ALA 115 N 1.57 1.21 0.56 5.51 0.00 -1.24 -3.30 121.76 126.06 2dkq s ALA 115 Ca 0.04 -0.87 -0.20 0.00 0.00 0.00 0.00 51.96 50.94 2dkq s ALA 115 Cb -0.16 -0.18 -0.05 0.00 0.00 0.00 0.00 23.12 22.73 2dkq s ALA 115 CO 0.04 0.22 1.19 0.15 0.00 0.00 0.00 175.76 177.36 2dkq s LYS 116 N -1.24 3.21 0.37 0.00 1.02 -1.16 -2.98 119.74 118.96 2dkq s LYS 116 Ca 0.01 1.79 -0.28 0.00 0.02 0.00 0.00 55.97 57.51 2dkq s LYS 116 Cb -0.08 -2.05 -0.11 0.00 -0.52 0.00 0.00 37.83 35.07 2dkq s LYS 116 CO 0.01 -1.00 1.49 0.21 -0.92 0.00 0.00 175.35 175.15 2dkq s LYS 117 N -3.19 4.10 0.00 1.68 2.20 -0.45 -4.87 119.74 119.21 2dkq s LYS 117 Ca 0.74 2.58 0.14 0.00 -0.36 0.00 0.00 55.97 59.07 2dkq s LYS 117 Cb -0.29 -2.97 0.65 0.00 -1.51 0.00 0.00 37.83 33.71 2dkq s LYS 117 CO 0.32 -0.54 1.44 -0.35 -0.36 0.00 0.00 175.35 175.86 2dkq n PRO 118 N 0.50 0.06 0.00 4.03 -0.04 -1.26 -2.54 135.00 135.75 2dkq n PRO 118 Ca 0.01 0.22 0.00 0.00 -0.04 0.00 0.00 63.50 63.70 2dkq n PRO 118 Cb 0.39 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.35 2dkq n PRO 118 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2dkq n GLY 119 N -0.03 -0.53 3.10 0.55 0.00 -1.26 -4.96 105.19 102.06 2dkq n GLY 119 Ca 0.04 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.08 2dkq n GLY 119 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dkq s SER 120 N -0.35 -1.12 0.00 1.61 0.01 -1.05 -5.01 113.70 107.78 2dkq s SER 120 Ca 0.00 0.40 0.14 0.00 1.31 0.00 0.00 55.95 57.81 2dkq s SER 120 Cb 0.00 1.89 0.67 0.00 0.21 0.00 0.00 66.02 68.79 2dkq s SER 120 CO 0.00 -0.29 1.43 -0.81 0.41 0.00 0.00 173.24 173.98 2dkq n PRO 121 N 5.41 0.09 -0.13 12.44 -0.04 -1.25 -1.92 135.00 149.61 2dkq n PRO 121 Ca 0.01 0.21 0.12 0.00 -0.04 0.00 0.00 63.50 63.80 2dkq n PRO 121 Cb 0.52 -1.50 0.24 0.00 -0.04 0.00 0.00 33.50 32.72 2dkq n PRO 121 CO 0.00 0.00 0.00 -2.67 -0.04 0.00 0.00 175.50 172.79 2dkq n TRP 122 N -1.40 0.33 -4.82 0.54 2.14 -1.26 -4.86 117.44 108.10 2dkq n TRP 122 Ca 0.05 -0.16 -0.31 0.00 2.07 0.00 0.00 57.50 59.15 2dkq n TRP 122 Cb 0.14 0.00 -0.17 0.00 -0.81 0.00 0.00 31.31 30.48 2dkq n TRP 122 CO 0.00 0.00 0.00 -1.21 2.07 0.00 0.00 177.69 178.55 2dkq s GLU 123 N -1.67 2.77 -0.12 -2.67 2.02 -0.81 -5.02 118.70 113.20 2dkq s GLU 123 Ca 0.35 -0.77 -0.06 0.00 0.02 0.00 0.00 54.97 54.52 2dkq s GLU 123 Cb 0.21 -2.19 -0.04 0.00 0.10 0.00 0.00 34.13 32.21 2dkq s GLU 123 CO 0.30 0.05 0.09 -0.80 0.02 0.00 0.00 175.26 174.92 2dkq s ASN 124 N 0.66 5.95 -0.23 -0.19 0.01 -1.26 -1.34 114.94 118.54 2dkq s ASN 124 Ca -0.12 0.32 -0.04 0.00 -0.71 0.00 0.00 52.86 52.31 2dkq s ASN 124 Cb -0.16 -1.88 0.13 0.00 0.41 0.00 0.00 41.25 39.74 2dkq s ASN 124 CO 0.03 0.36 0.41 0.54 -1.51 0.00 0.00 177.10 176.93 2dkq s VAL 125 N -0.76 -0.65 0.45 1.60 0.11 -1.16 -0.08 120.40 119.90 2dkq s VAL 125 Ca 0.13 0.00 -0.09 0.00 -2.93 0.00 0.00 61.98 59.09 2dkq s VAL 125 Cb -0.12 -0.79 -0.05 0.00 -1.53 0.00 0.00 36.38 33.89 2dkq s VAL 125 CO 0.03 -0.06 0.80 0.00 -3.33 0.00 0.00 175.10 172.54 2dkq s HIS 127 N -2.55 2.81 0.33 0.00 3.76 -0.95 -3.50 115.29 115.20 2dkq s HIS 127 Ca 0.51 -1.46 -0.26 0.00 -0.15 0.00 0.00 55.06 53.69 2dkq s HIS 127 Cb -0.10 -1.95 -0.09 0.00 1.11 0.00 0.00 32.58 31.54 2dkq s HIS 127 CO 0.37 -0.73 1.00 -1.17 -0.85 0.00 0.00 174.74 173.36 2dkq s LEU 128 N 1.27 4.33 0.29 0.89 2.96 0.14 -3.52 118.68 125.04 2dkq s LEU 128 Ca 0.04 1.98 -0.11 0.00 -0.22 0.00 0.00 54.13 55.82 2dkq s LEU 128 Cb -0.14 -3.97 0.00 0.00 0.50 0.00 0.00 46.19 42.58 2dkq s LEU 128 CO -0.10 -0.20 0.52 -0.36 -1.32 0.00 0.00 176.35 174.89 2dkq s PHE 129 N -1.52 0.47 0.04 5.38 0.40 0.28 -2.60 117.98 120.43 2dkq s PHE 129 Ca 0.51 -0.84 -0.07 0.00 -0.60 0.00 0.00 56.93 55.93 2dkq s PHE 129 Cb -0.22 0.22 -0.01 0.00 0.51 0.00 0.00 43.02 43.52 2dkq s PHE 129 CO 0.28 -1.10 0.12 0.00 0.70 0.00 0.00 175.22 175.23 2dkq s ALA 130 N -3.61 -0.14 -0.50 5.36 0.00 0.31 -0.29 121.76 122.89 2dkq s ALA 130 Ca 0.23 -0.50 -0.27 0.00 0.00 0.00 0.00 51.96 51.42 2dkq s ALA 130 Cb -0.01 0.27 -0.03 0.00 0.00 0.00 0.00 23.12 23.34 2dkq s ALA 130 CO 0.12 -0.34 2.00 -1.83 0.00 0.00 0.00 175.76 175.71 2dkq s GLU 131 N -2.68 2.69 0.07 0.00 -1.05 -0.98 -0.65 118.70 116.10 2dkq s GLU 131 Ca -0.04 1.07 -0.36 0.00 -0.15 0.00 0.00 54.97 55.49 2dkq s GLU 131 Cb -0.01 -4.39 -0.19 0.00 -0.44 0.00 0.00 34.13 29.11 2dkq s GLU 131 CO -0.05 -2.63 1.57 1.25 0.95 0.00 0.00 175.26 176.36 2dkq h LEU 132 N 16.49 -1.21 -9.90 1.83 7.12 -1.82 -3.44 115.31 124.38 2dkq h LEU 132 Ca -0.28 0.07 -0.62 0.00 0.13 0.00 0.00 57.88 57.18 2dkq h LEU 132 Cb 1.19 0.36 -0.04 0.00 -0.53 0.00 0.00 40.66 41.64 2dkq h LEU 132 CO 1.15 -0.72 -0.50 -1.81 -0.13 0.00 0.00 178.44 176.42 2dkq s ASP 133 N -4.22 6.31 0.11 1.25 1.01 -1.26 -4.96 116.67 114.91 2dkq s ASP 133 Ca -0.19 0.25 -0.14 0.00 0.71 0.00 0.00 52.55 53.18 2dkq s ASP 133 Cb 0.03 -1.93 -0.07 0.00 1.01 0.00 0.00 42.92 41.97 2dkq s ASP 133 CO 0.61 0.16 1.44 1.55 0.21 0.00 0.00 175.17 179.14 2dkq h PRO 134 N 3.02 0.78 -0.93 8.23 0.13 -1.99 -3.17 132.00 138.07 2dkq h PRO 134 Ca -0.45 -0.41 0.13 0.00 -0.87 0.00 0.00 66.00 64.39 2dkq h PRO 134 Cb 1.16 0.01 -0.09 0.00 0.13 0.00 0.00 31.00 32.22 2dkq h PRO 134 CO 0.75 1.04 0.55 0.22 -0.23 0.00 0.00 178.00 180.33 2dkq h ASP 135 N 0.55 0.77 -4.00 1.44 3.58 -1.99 -3.27 116.42 113.51 2dkq h ASP 135 Ca 0.05 0.06 -0.73 0.00 0.42 0.00 0.00 57.03 56.84 2dkq h ASP 135 Cb 0.89 -0.09 -0.32 0.00 1.72 0.00 0.00 39.33 41.54 2dkq h ASP 135 CO 0.08 0.39 -0.19 -1.10 -2.88 0.00 0.00 179.24 175.54 2dkq s GLN 136 N -5.97 2.97 0.69 0.28 -0.21 -1.20 -5.08 119.66 111.16 2dkq s GLN 136 Ca -0.12 -2.60 -0.14 0.00 0.02 0.00 0.00 55.36 52.52 2dkq s GLN 136 Cb 0.22 -3.97 0.02 0.00 1.00 0.00 0.00 33.01 30.27 2dkq s GLN 136 CO 0.80 -1.22 1.10 -1.25 -2.12 0.00 0.00 175.29 172.60 2dkq s PRO 137 N -0.15 2.64 0.20 2.91 0.04 -1.24 -4.48 135.00 134.93 2dkq s PRO 137 Ca 0.18 1.33 -0.13 0.00 0.04 0.00 0.00 61.00 62.42 2dkq s PRO 137 Cb -0.16 -1.93 0.23 0.00 0.04 0.00 0.00 34.50 32.68 2dkq s PRO 137 CO -0.06 -1.36 1.65 0.00 0.04 0.00 0.00 177.00 177.27 2dkq h ALA 138 N -0.31 0.46 -0.62 8.56 0.00 -1.89 -1.27 119.26 124.19 2dkq h ALA 138 Ca -0.46 0.21 0.13 0.00 0.00 0.00 0.00 54.91 54.79 2dkq h ALA 138 Cb 1.24 0.39 -0.11 0.00 0.00 0.00 0.00 17.79 19.31 2dkq h ALA 138 CO 0.53 -0.42 -0.05 0.78 0.00 0.00 0.00 179.25 180.09 2dkq h GLY 139 N 0.04 0.60 1.40 0.00 0.00 -1.95 0.56 103.07 103.72 2dkq h GLY 139 Ca 0.29 0.13 0.00 0.00 0.00 0.00 0.00 47.33 47.74 2dkq h GLY 139 CO -0.56 -0.22 0.30 0.00 0.00 0.00 0.00 176.54 176.06 2dkq h ALA 140 N 1.59 1.29 -1.15 3.60 0.00 -1.59 -0.64 119.26 122.37 2dkq h ALA 140 Ca 0.32 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.23 2dkq h ALA 140 Cb 0.52 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.31 2dkq h ALA 140 CO -0.57 -0.29 0.00 -0.89 0.00 0.00 0.00 179.25 177.49 2dkq n ILE 141 N -2.89 0.00 -0.37 0.00 5.41 0.19 -3.37 119.36 118.33 2dkq n ILE 141 Ca -0.02 0.31 0.30 0.00 1.00 0.00 0.00 62.75 64.33 2dkq n ILE 141 Cb 0.34 -1.04 0.56 0.00 -0.71 0.00 0.00 39.64 38.80 2dkq n ILE 141 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 176.55 176.18 2dkq h VAL 142 N 0.00 0.24 0.70 1.39 -1.51 -1.37 0.39 116.25 116.08 2dkq h VAL 142 Ca 0.00 -0.07 -0.03 0.00 -1.23 0.00 0.00 66.70 65.36 2dkq h VAL 142 Cb 0.00 0.01 0.01 0.00 -2.13 0.00 0.00 31.29 29.17 2dkq h VAL 142 CO 0.00 0.04 -0.33 0.74 -1.23 0.00 0.00 177.57 176.78 2dkq h THR 143 N 0.21 0.29 -0.81 7.19 2.02 -1.30 -1.94 112.91 118.57 2dkq h THR 143 Ca 0.76 -0.07 0.15 0.00 0.77 0.00 0.00 66.41 68.01 2dkq h THR 143 Cb 2.05 0.31 -0.06 0.00 -1.74 0.00 0.00 68.15 68.72 2dkq h THR 143 CO -0.50 0.01 0.54 0.15 0.37 0.00 0.00 175.52 176.09 2dkq h PHE 144 N -0.99 0.62 0.00 3.16 3.57 -0.97 -1.32 116.94 121.02 2dkq h PHE 144 Ca -0.10 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.42 2dkq h PHE 144 Cb 0.73 -0.20 0.00 0.00 2.79 0.00 0.00 35.95 39.28 2dkq h PHE 144 CO -0.02 0.23 0.00 -0.89 -2.23 0.00 0.00 178.31 175.40 2dkq n ILE 145 N -4.51 0.00 0.27 1.41 5.41 -0.64 -2.04 119.36 119.25 2dkq n ILE 145 Ca 0.16 1.23 0.09 0.00 1.00 0.00 0.00 62.75 65.23 2dkq n ILE 145 Cb 0.51 -2.19 0.50 0.00 -0.71 0.00 0.00 39.64 37.74 2dkq n ILE 145 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 176.55 177.26 2dkq h THR 146 N 0.00 0.00 -0.00 1.39 1.35 -1.26 1.05 112.91 115.44 2dkq h THR 146 Ca 0.00 0.00 -0.01 0.00 -0.55 0.00 0.00 66.41 65.85 2dkq h THR 146 Cb 0.00 0.40 0.00 0.00 -1.73 0.00 0.00 68.15 66.82 2dkq h THR 146 CO 0.00 0.00 -0.03 0.11 -0.25 0.00 0.00 175.52 175.35 2dkq h LYS 147 N 0.00 0.03 0.00 4.72 1.57 -1.04 -1.49 116.57 120.36 2dkq h LYS 147 Ca 0.00 -0.03 -0.39 0.00 -1.87 0.00 0.00 60.65 58.36 2dkq h LYS 147 Cb 0.89 0.01 -0.06 0.00 0.08 0.00 0.00 32.23 33.15 2dkq h LYS 147 CO 0.00 0.74 -2.13 1.55 -0.57 0.00 0.00 179.45 179.03 2dkq n VAL 148 N -4.71 1.53 0.01 0.50 3.14 0.29 -3.14 118.33 115.94 2dkq n VAL 148 Ca -0.09 -0.28 -0.00 0.00 -2.96 0.00 0.00 64.34 61.01 2dkq n VAL 148 Cb 0.37 -1.92 -0.00 0.00 -1.06 0.00 0.00 33.84 31.22 2dkq n VAL 148 CO 0.00 0.00 0.00 -0.07 -6.46 0.00 0.00 176.83 170.30 2dkq h LEU 149 N -0.97 -0.02 -0.69 6.55 -0.00 0.79 -3.00 115.31 117.96 2dkq h LEU 149 Ca -0.59 0.00 -0.12 0.00 -0.00 0.00 0.00 57.88 57.18 2dkq h LEU 149 Cb 1.53 0.01 -0.01 0.00 -0.00 0.00 0.00 40.66 42.18 2dkq h LEU 149 CO -0.35 -0.01 -0.22 -0.07 -0.00 0.00 0.00 178.44 177.78 2dkq h LEU 150 N -0.02 0.79 0.00 1.67 4.07 -1.58 -3.41 115.31 116.83 2dkq h LEU 150 Ca -0.00 -0.28 0.00 0.00 0.08 0.00 0.00 57.88 57.67 2dkq h LEU 150 Cb 0.02 -0.22 0.00 0.00 1.08 0.00 0.00 40.66 41.54 2dkq h LEU 150 CO -0.00 0.99 0.00 0.61 -1.08 0.00 0.00 178.44 178.96 2dkq n GLY 151 N -0.23 -2.40 3.68 0.83 0.00 -0.56 -5.01 105.19 101.50 2dkq n GLY 151 Ca 0.00 -0.05 -0.09 0.00 0.00 0.00 0.00 46.02 45.88 2dkq n GLY 151 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2dkq s GLN 152 N 0.00 1.79 0.35 1.61 0.74 -1.14 -4.98 119.66 118.03 2dkq s GLN 152 Ca 0.00 -1.30 0.04 0.00 0.05 0.00 0.00 55.36 54.15 2dkq s GLN 152 Cb 0.00 0.53 -0.07 0.00 1.10 0.00 0.00 33.01 34.57 2dkq s GLN 152 CO 0.00 -0.78 0.05 -0.98 -0.55 0.00 0.00 175.29 173.03 2dkq s ARG 153 N -3.53 1.74 0.05 1.67 1.04 -1.26 -4.69 118.95 113.98 2dkq s ARG 153 Ca 0.20 -1.98 0.00 0.00 -1.04 0.00 0.00 55.73 52.91 2dkq s ARG 153 Cb -0.03 -1.05 0.00 0.00 -2.04 0.00 0.00 34.95 31.83 2dkq s ARG 153 CO 0.11 -0.17 0.00 1.63 -0.04 0.00 0.00 175.30 176.83 2dkq n LYS 154 N -0.77 0.00 -4.26 3.89 4.76 -1.26 -4.99 118.16 115.53 2dkq n LYS 154 Ca -0.03 0.00 -0.14 0.00 -2.87 0.00 0.00 58.31 55.26 2dkq n LYS 154 Cb 0.67 -0.33 -0.10 0.00 -1.84 0.00 0.00 35.03 33.43 2dkq n LYS 154 CO 0.00 0.00 0.00 -1.12 -1.37 0.00 0.00 177.40 174.91 2dkq s SER 155 N -5.21 1.35 -0.13 4.39 0.01 -1.26 -5.12 113.70 107.73 2dkq s SER 155 Ca 0.00 -1.19 0.02 0.00 1.31 0.00 0.00 55.95 56.08 2dkq s SER 155 Cb 0.00 0.10 -0.00 0.00 0.21 0.00 0.00 66.02 66.33 2dkq s SER 155 CO 0.00 -0.56 -0.18 -0.83 0.41 0.00 0.00 173.24 172.07 2dkq s GLY 156 N -3.21 1.43 -0.70 3.44 0.00 -1.26 -5.01 107.32 102.01 2dkq s GLY 156 Ca 0.26 -1.01 -0.26 0.00 0.00 0.00 0.00 44.72 43.71 2dkq s GLY 156 CO 0.05 -0.11 1.89 2.56 0.00 0.00 0.00 173.10 177.50 2dkq s PRO 157 N 0.62 2.60 -0.18 2.90 0.04 -1.26 -4.97 135.00 134.76 2dkq s PRO 157 Ca -0.10 0.35 -0.08 0.00 0.04 0.00 0.00 61.00 61.21 2dkq s PRO 157 Cb -0.16 -4.59 -0.04 0.00 0.04 0.00 0.00 34.50 29.75 2dkq s PRO 157 CO 0.03 -2.93 0.08 0.45 0.04 0.00 0.00 177.00 174.67 2dkq s SER 158 N 8.11 5.83 -0.40 6.66 0.15 -1.26 -5.06 113.70 127.73 2dkq s SER 158 Ca 0.68 0.16 -0.29 0.00 0.70 0.00 0.00 55.95 57.20 2dkq s SER 158 Cb -0.11 -1.98 0.02 0.00 -1.71 0.00 0.00 66.02 62.24 2dkq s SER 158 CO 0.14 0.21 1.18 -0.94 1.20 0.00 0.00 173.24 175.03 2dkq s SER 159 N 0.18 6.68 0.00 5.45 1.04 -1.26 -5.34 113.70 120.45 2dkq s SER 159 Ca 0.06 0.77 0.00 0.00 0.48 0.00 0.00 55.95 57.26 2dkq s SER 159 Cb -0.12 -2.55 0.00 0.00 0.10 0.00 0.00 66.02 63.46 2dkq s SER 159 CO -0.00 -1.16 0.00 0.61 0.98 0.00 0.00 173.24 173.67