#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dkq n SER 2 N 0.00 -3.57 -3.76 1.61 2.88 -1.26 -5.04 113.62 104.48 2dkq n SER 2 Ca 0.00 -0.26 -0.13 0.00 -1.33 0.00 0.00 58.87 57.15 2dkq n SER 2 Cb 0.00 -2.59 -0.14 0.00 -0.75 0.00 0.00 64.21 60.74 2dkq n SER 2 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 2dkq s SER 3 N -3.25 -0.17 -0.31 -3.46 1.04 -1.26 -5.05 113.70 101.25 2dkq s SER 3 Ca 0.21 0.37 0.02 0.00 0.48 0.00 0.00 55.95 57.03 2dkq s SER 3 Cb -0.09 0.28 0.12 0.00 0.10 0.00 0.00 66.02 66.43 2dkq s SER 3 CO 0.33 -0.13 1.15 0.61 0.98 0.00 0.00 173.24 176.18 2dkq n GLY 4 N 3.92 -1.12 3.56 7.32 0.00 -1.26 -5.09 105.19 112.52 2dkq n GLY 4 Ca -0.23 0.26 -0.40 0.00 0.00 0.00 0.00 46.02 45.66 2dkq n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2dkq s SER 5 N -0.10 6.34 -0.24 1.61 0.15 -1.26 -4.97 113.70 115.23 2dkq s SER 5 Ca 0.07 -1.28 -0.10 0.00 0.70 0.00 0.00 55.95 55.34 2dkq s SER 5 Cb 0.11 -2.57 -0.04 0.00 -1.71 0.00 0.00 66.02 61.81 2dkq s SER 5 CO -0.07 -1.65 0.13 -0.55 1.20 0.00 0.00 173.24 172.30 2dkq s SER 6 N 5.18 5.85 0.09 5.45 0.15 -1.26 -4.89 113.70 124.27 2dkq s SER 6 Ca 0.47 0.03 0.00 0.00 0.70 0.00 0.00 55.95 57.15 2dkq s SER 6 Cb -0.01 -2.05 0.00 0.00 -1.71 0.00 0.00 66.02 62.24 2dkq s SER 6 CO -0.07 0.04 0.00 0.61 1.20 0.00 0.00 173.24 175.03 2dkq n GLY 7 N 4.42 -0.99 3.44 9.45 0.00 -1.26 -5.15 105.19 115.11 2dkq n GLY 7 Ca -0.15 0.20 -0.26 0.00 0.00 0.00 0.00 46.02 45.81 2dkq n GLY 7 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2dkq s MET 8 N -1.24 1.59 -0.01 1.61 -1.94 -1.26 -5.07 119.30 112.99 2dkq s MET 8 Ca 0.00 -1.58 -0.07 0.00 -1.71 0.00 0.00 55.69 52.33 2dkq s MET 8 Cb 0.00 -1.84 -0.02 0.00 2.01 0.00 0.00 34.83 34.98 2dkq s MET 8 CO 0.00 0.38 -0.13 0.45 -0.01 0.00 0.00 175.02 175.71 2dkq n SER 9 N 0.00 1.41 -4.08 3.03 2.88 -1.26 -4.99 113.62 110.61 2dkq n SER 9 Ca -0.10 0.21 -0.31 0.00 -1.33 0.00 0.00 58.87 57.33 2dkq n SER 9 Cb 0.57 -0.49 -0.08 0.00 -0.75 0.00 0.00 64.21 63.47 2dkq n SER 9 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16 2dkq n THR 10 N -3.84 -0.47 -0.29 2.46 -2.24 -1.26 -4.68 114.28 103.97 2dkq n THR 10 Ca -0.05 -0.23 0.27 0.00 -2.27 0.00 0.00 64.05 61.76 2dkq n THR 10 Cb 0.19 -0.66 0.47 0.00 -2.10 0.00 0.00 70.33 68.24 2dkq n THR 10 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2dkq n ALA 11 N -3.83 0.88 0.00 6.98 0.00 -1.26 0.89 120.51 124.17 2dkq n ALA 11 Ca -0.11 0.72 -0.10 0.00 0.00 0.00 0.00 53.44 53.95 2dkq n ALA 11 Cb 0.50 -0.78 -0.04 0.00 0.00 0.00 0.00 19.45 19.13 2dkq n ALA 11 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2dkq h ALA 12 N 1.38 -0.33 -0.55 0.00 0.00 -2.00 -1.34 119.26 116.42 2dkq h ALA 12 Ca 0.65 0.03 0.05 0.00 0.00 0.00 0.00 54.91 55.64 2dkq h ALA 12 Cb 1.89 0.57 -0.07 0.00 0.00 0.00 0.00 17.79 20.17 2dkq h ALA 12 CO -0.48 -0.77 -0.39 -0.44 0.00 0.00 0.00 179.25 177.16 2dkq h ASP 13 N -0.37 -1.40 0.19 0.00 5.19 0.18 -1.30 116.42 118.90 2dkq h ASP 13 Ca 0.10 0.20 0.01 0.00 -0.62 0.00 0.00 57.03 56.72 2dkq h ASP 13 Cb 0.52 0.60 -0.04 0.00 0.18 0.00 0.00 39.33 40.59 2dkq h ASP 13 CO -0.34 -0.19 -0.49 -0.07 -3.12 0.00 0.00 179.24 175.03 2dkq h LEU 14 N -0.09 -1.44 -0.81 1.55 -0.00 -1.57 -2.42 115.31 110.54 2dkq h LEU 14 Ca 0.09 0.15 0.13 0.00 -0.00 0.00 0.00 57.88 58.25 2dkq h LEU 14 Cb 0.32 0.52 -0.14 0.00 -0.00 0.00 0.00 40.66 41.36 2dkq h LEU 14 CO -0.56 -0.56 -0.28 0.18 -0.00 0.00 0.00 178.44 177.22 2dkq n LEU 15 N -5.49 -0.46 -0.24 1.67 4.77 -0.53 0.14 117.00 116.86 2dkq n LEU 15 Ca -0.09 1.40 0.04 0.00 -0.03 0.00 0.00 56.01 57.34 2dkq n LEU 15 Cb 0.41 -0.35 0.15 0.00 -2.33 0.00 0.00 43.42 41.31 2dkq n LEU 15 CO 0.19 -1.28 0.87 0.03 -1.33 0.00 0.00 177.39 175.86 2dkq h ARG 16 N 0.00 0.16 0.19 3.23 3.08 -0.75 -2.97 114.38 117.32 2dkq h ARG 16 Ca 0.31 -0.01 -0.01 0.00 0.07 0.00 0.00 59.98 60.34 2dkq h ARG 16 Cb 0.51 -0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.53 2dkq h ARG 16 CO -0.81 0.11 -0.09 1.96 -1.07 0.00 0.00 179.97 180.07 2dkq h GLN 17 N 0.17 -0.24 -1.71 0.04 1.08 0.13 -3.51 115.11 111.07 2dkq h GLN 17 Ca 0.39 0.02 0.00 0.00 -1.45 0.00 0.00 58.65 57.61 2dkq h GLN 17 Cb 0.68 0.06 0.00 0.00 -0.05 0.00 0.00 27.48 28.16 2dkq h GLN 17 CO -0.57 -0.16 -0.43 0.41 -0.95 0.00 0.00 178.83 177.12 2dkq n GLY 18 N 0.98 -3.55 3.05 3.46 0.00 0.81 -4.98 105.19 104.95 2dkq n GLY 18 Ca -0.03 -1.03 -0.30 0.00 0.00 0.00 0.00 46.02 44.66 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 -3.72 1.85 -0.05 4.61 0.00 -1.26 -5.07 121.76 118.12 2dkq s ALA 19 Ca 0.00 -0.88 -0.00 0.00 0.00 0.00 0.00 51.96 51.08 2dkq s ALA 19 Cb 0.00 -0.99 0.03 0.00 0.00 0.00 0.00 23.12 22.16 2dkq s ALA 19 CO 0.00 -0.26 -0.01 0.00 0.00 0.00 0.00 175.76 175.49 2dkq s ALA 20 N 1.27 0.57 0.25 0.00 0.00 -1.26 -3.52 121.76 119.07 2dkq s ALA 20 Ca 0.00 -0.01 -0.18 0.00 0.00 0.00 0.00 51.96 51.78 2dkq s ALA 20 Cb -0.14 -0.52 0.02 0.00 0.00 0.00 0.00 23.12 22.48 2dkq s ALA 20 CO -0.07 -0.21 0.60 0.00 0.00 0.00 0.00 175.76 176.08 2dkq s SER 22 N -2.93 7.12 0.46 0.00 0.01 -1.26 0.23 113.70 117.32 2dkq s SER 22 Ca 0.14 1.34 0.06 0.00 1.31 0.00 0.00 55.95 58.80 2dkq s SER 22 Cb -0.03 -2.45 -0.02 0.00 0.21 0.00 0.00 66.02 63.72 2dkq s SER 22 CO 0.05 -0.08 0.20 0.68 0.41 0.00 0.00 173.24 174.50 2dkq s VAL 23 N 0.48 1.97 -0.37 3.43 -7.23 0.13 -4.14 120.40 114.66 2dkq s VAL 23 Ca 0.40 -1.70 -0.10 0.00 -1.81 0.00 0.00 61.98 58.77 2dkq s VAL 23 Cb -0.19 -2.66 0.03 0.00 0.56 0.00 0.00 36.38 34.12 2dkq s VAL 23 CO 0.21 0.00 0.20 -0.22 -0.31 0.00 0.00 175.10 174.98 2dkq s LEU 24 N -3.99 4.70 -0.46 1.32 1.98 -0.69 -2.79 118.68 118.75 2dkq s LEU 24 Ca 0.34 -1.05 -0.28 0.00 -2.89 0.00 0.00 54.13 50.24 2dkq s LEU 24 Cb 0.02 -2.00 0.03 0.00 0.66 0.00 0.00 46.19 44.90 2dkq s LEU 24 CO 0.19 -0.39 1.09 -0.47 -1.89 0.00 0.00 176.35 174.88 2dkq s TYR 25 N 1.52 2.86 0.00 5.38 5.04 -0.42 -0.71 117.35 131.02 2dkq s TYR 25 Ca 0.01 0.69 0.00 0.00 -2.44 0.00 0.00 57.07 55.33 2dkq s TYR 25 Cb -0.19 -4.30 0.00 0.00 0.35 0.00 0.00 41.96 37.82 2dkq s TYR 25 CO 0.06 -1.20 0.00 1.28 -1.34 0.00 0.00 175.55 174.35 2dkq n LEU 26 N 7.65 0.27 -3.64 6.97 4.77 -1.22 -0.79 117.00 131.01 2dkq n LEU 26 Ca 0.11 0.45 -0.05 0.00 -0.03 0.00 0.00 56.01 56.49 2dkq n LEU 26 Cb 0.49 -0.46 -0.06 0.00 -2.33 0.00 0.00 43.42 41.06 2dkq n LEU 26 CO 0.69 -0.46 1.02 0.28 -1.33 0.00 0.00 177.39 177.60 2dkq s THR 27 N -0.91 0.00 -0.31 -5.08 -1.32 -1.26 -4.23 115.64 102.53 2dkq s THR 27 Ca 0.00 0.00 -0.11 0.00 -1.21 0.00 0.00 61.69 60.37 2dkq s THR 27 Cb 0.00 -1.00 -0.02 0.00 -1.51 0.00 0.00 72.50 69.97 2dkq s THR 27 CO 0.00 0.00 0.18 -0.55 -2.21 0.00 0.00 174.62 172.04 2dkq s SER 28 N -0.24 5.80 -0.12 8.08 0.15 -1.26 -2.26 113.70 123.85 2dkq s SER 28 Ca 0.06 -0.34 -0.06 0.00 0.70 0.00 0.00 55.95 56.31 2dkq s SER 28 Cb -0.04 -2.07 -0.04 0.00 -1.71 0.00 0.00 66.02 62.16 2dkq s SER 28 CO -0.10 -0.16 0.11 -0.69 1.20 0.00 0.00 173.24 173.60 2dkq s VAL 29 N 1.69 5.25 -0.03 4.45 1.01 -1.09 -4.99 120.40 126.69 2dkq s VAL 29 Ca 0.06 0.11 -0.30 0.00 0.00 0.00 0.00 61.98 61.86 2dkq s VAL 29 Cb -0.17 -3.29 -0.07 0.00 0.00 0.00 0.00 36.38 32.86 2dkq s VAL 29 CO 0.09 0.59 1.80 -1.61 0.00 0.00 0.00 175.10 175.97 2dkq s GLU 30 N -0.81 4.12 -0.41 2.72 2.02 -1.26 -2.84 118.70 122.23 2dkq s GLU 30 Ca 0.13 2.34 0.05 0.00 0.02 0.00 0.00 54.97 57.51 2dkq s GLU 30 Cb -0.12 -4.07 0.44 0.00 0.10 0.00 0.00 34.13 30.48 2dkq s GLU 30 CO 0.03 -0.95 1.35 0.25 0.02 0.00 0.00 175.26 175.96 2dkq n THR 31 N 5.62 2.73 -0.19 3.63 -2.24 -0.42 -4.81 114.28 118.59 2dkq n THR 31 Ca 0.19 -4.16 0.00 0.00 -2.27 0.00 0.00 64.05 57.81 2dkq n THR 31 Cb 0.42 -1.17 0.10 0.00 -2.10 0.00 0.00 70.33 67.58 2dkq n THR 31 CO 0.00 0.00 0.00 1.05 -0.57 0.00 0.00 175.07 175.55 2dkq h GLU 32 N 2.27 0.23 0.00 -0.78 4.11 -1.45 -1.99 114.58 116.98 2dkq h GLU 32 Ca 0.40 -0.01 -0.18 0.00 0.07 0.00 0.00 59.36 59.64 2dkq h GLU 32 Cb 1.22 -0.05 -0.03 0.00 0.50 0.00 0.00 28.75 30.39 2dkq h GLU 32 CO 0.95 0.15 -1.28 1.03 0.07 0.00 0.00 179.01 179.93 2dkq h SER 33 N 0.24 0.00 -3.51 3.06 0.87 -1.87 -3.36 113.55 108.99 2dkq h SER 33 Ca 0.31 0.00 -0.47 0.00 -1.23 0.00 0.00 61.79 60.39 2dkq h SER 33 Cb 0.46 0.00 0.05 0.00 -0.44 0.00 0.00 62.40 62.47 2dkq h SER 33 CO -0.40 0.64 0.14 -0.76 -0.53 0.00 0.00 176.83 175.92 2dkq s LEU 34 N -5.98 3.28 -0.11 2.23 1.43 -0.75 -5.07 118.68 113.71 2dkq s LEU 34 Ca -0.02 0.64 -0.33 0.00 -1.03 0.00 0.00 54.13 53.39 2dkq s LEU 34 Cb 0.08 -3.47 0.13 0.00 0.03 0.00 0.00 46.19 42.97 2dkq s LEU 34 CO 0.80 -1.02 1.23 0.28 0.23 0.00 0.00 176.35 177.87 2dkq s THR 35 N -2.93 0.00 0.00 5.49 -1.32 -1.26 -4.73 115.64 110.89 2dkq s THR 35 Ca 0.53 -0.10 0.00 0.00 -1.21 0.00 0.00 61.69 60.91 2dkq s THR 35 Cb -0.10 -1.40 0.00 0.00 -1.51 0.00 0.00 72.50 69.48 2dkq s THR 35 CO 0.44 0.00 0.00 0.61 -2.21 0.00 0.00 174.62 173.46 2dkq n GLY 36 N -0.25 2.64 0.14 6.08 0.00 -1.26 -3.21 105.19 109.33 2dkq n GLY 36 Ca -0.03 -0.33 -0.13 0.00 0.00 0.00 0.00 46.02 45.52 2dkq n GLY 36 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dkq h PRO 37 N 0.00 0.37 -0.14 1.61 0.13 -1.98 -3.32 132.00 128.67 2dkq h PRO 37 Ca 0.00 -0.19 0.02 0.00 -0.87 0.00 0.00 66.00 64.95 2dkq h PRO 37 Cb 0.00 0.01 -0.03 0.00 0.13 0.00 0.00 31.00 31.11 2dkq h PRO 37 CO 0.00 0.75 -0.20 0.37 -0.23 0.00 0.00 178.00 178.69 2dkq h GLN 38 N -0.00 -0.14 -0.81 0.86 5.75 -1.99 -0.49 115.11 118.29 2dkq h GLN 38 Ca 0.02 0.01 0.24 0.00 -0.15 0.00 0.00 58.65 58.77 2dkq h GLN 38 Cb 0.68 0.03 -0.15 0.00 1.07 0.00 0.00 27.48 29.11 2dkq h GLN 38 CO 0.04 -0.10 0.08 0.00 -2.65 0.00 0.00 178.83 176.20 2dkq n ALA 39 N -2.83 0.47 -0.32 3.38 0.00 -1.21 0.23 120.51 120.23 2dkq n ALA 39 Ca -0.01 0.86 -0.02 0.00 0.00 0.00 0.00 53.44 54.27 2dkq n ALA 39 Cb 0.12 -0.66 0.10 0.00 0.00 0.00 0.00 19.45 19.01 2dkq n ALA 39 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2dkq h VAL 40 N 0.00 1.18 -0.13 0.00 2.07 -1.20 -2.60 116.25 115.58 2dkq h VAL 40 Ca 0.52 -0.39 -0.02 0.00 0.82 0.00 0.00 66.70 67.63 2dkq h VAL 40 Cb 1.13 -0.06 -0.00 0.00 -1.52 0.00 0.00 31.29 30.83 2dkq h VAL 40 CO -0.74 0.21 0.00 0.00 0.02 0.00 0.00 177.57 177.06 2dkq h ALA 41 N 1.34 0.18 -0.32 1.67 0.00 0.35 -3.16 119.26 119.32 2dkq h ALA 41 Ca 0.34 -0.19 0.07 0.00 0.00 0.00 0.00 54.91 55.13 2dkq h ALA 41 Cb -0.06 -0.05 -0.08 0.00 0.00 0.00 0.00 17.79 17.60 2dkq h ALA 41 CO -0.09 -0.13 -0.36 -0.09 0.00 0.00 0.00 179.25 178.57 2dkq h ARG 42 N -0.03 -0.32 -0.56 0.00 2.43 -0.94 0.23 114.38 115.19 2dkq h ARG 42 Ca 0.04 0.02 0.09 0.00 -0.81 0.00 0.00 59.98 59.32 2dkq h ARG 42 Cb 0.36 0.07 -0.11 0.00 -0.42 0.00 0.00 29.97 29.88 2dkq h ARG 42 CO 0.01 -0.21 -0.41 0.00 -1.51 0.00 0.00 179.97 177.84 2dkq h ALA 43 N 0.53 -0.28 0.90 2.80 0.00 -1.48 0.13 119.26 121.85 2dkq h ALA 43 Ca 0.14 0.11 -0.04 0.00 0.00 0.00 0.00 54.91 55.12 2dkq h ALA 43 Cb 0.56 0.92 0.01 0.00 0.00 0.00 0.00 17.79 19.28 2dkq h ALA 43 CO -0.50 -0.80 -0.43 0.66 0.00 0.00 0.00 179.25 178.18 2dkq h SER 44 N -0.23 -1.02 -1.02 0.00 4.64 -1.33 0.36 113.55 114.95 2dkq h SER 44 Ca 0.18 0.03 0.36 0.00 -0.47 0.00 0.00 61.79 61.90 2dkq h SER 44 Cb 0.56 0.26 -0.16 0.00 -0.31 0.00 0.00 62.40 62.76 2dkq h SER 44 CO -0.67 -0.70 0.58 0.28 -0.87 0.00 0.00 176.83 175.45 2dkq h SER 45 N -1.27 0.43 0.27 4.97 0.02 -0.13 0.85 113.55 118.71 2dkq h SER 45 Ca -0.12 0.21 -0.24 0.00 -0.84 0.00 0.00 61.79 60.80 2dkq h SER 45 Cb 0.93 0.18 0.01 0.00 0.14 0.00 0.00 62.40 63.65 2dkq h SER 45 CO 0.20 -0.23 -0.97 0.00 -1.14 0.00 0.00 176.83 174.69 2dkq h ALA 46 N 1.88 0.31 -0.85 3.77 0.00 -0.50 0.15 119.26 124.02 2dkq h ALA 46 Ca 0.78 -0.71 0.12 0.00 0.00 0.00 0.00 54.91 55.09 2dkq h ALA 46 Cb 1.92 -0.00 -0.06 0.00 0.00 0.00 0.00 17.79 19.65 2dkq h ALA 46 CO -0.64 0.79 0.55 0.00 0.00 0.00 0.00 179.25 179.95 2dkq h ALA 47 N 0.67 1.79 0.04 0.00 0.00 0.29 0.37 119.26 122.42 2dkq h ALA 47 Ca -0.09 0.00 -0.36 0.00 0.00 0.00 0.00 54.91 54.46 2dkq h ALA 47 Cb 1.61 -0.15 -0.05 0.00 0.00 0.00 0.00 17.79 19.20 2dkq h ALA 47 CO 0.17 0.01 -2.21 1.28 0.00 0.00 0.00 179.25 178.51 2dkq n LEU 48 N -4.53 1.99 0.15 0.00 4.32 -0.78 -4.48 117.00 113.67 2dkq n LEU 48 Ca 0.15 0.07 -0.14 0.00 -0.02 0.00 0.00 56.01 56.08 2dkq n LEU 48 Cb 0.39 -0.54 -0.08 0.00 -1.62 0.00 0.00 43.42 41.57 2dkq n LEU 48 CO 0.31 0.75 0.66 0.28 -1.22 0.00 0.00 177.39 178.17 2dkq h SER 49 N 0.02 -0.30 -3.99 -1.43 0.02 -0.41 -3.43 113.55 104.02 2dkq h SER 49 Ca -0.48 -0.12 -0.49 0.00 -0.84 0.00 0.00 61.79 59.85 2dkq h SER 49 Cb 2.02 0.08 0.03 0.00 0.14 0.00 0.00 62.40 64.67 2dkq h SER 49 CO 0.01 -0.05 0.42 0.00 -1.14 0.00 0.00 176.83 176.08 2dkq s SER 51 N -1.59 -0.03 0.84 0.00 1.04 -1.26 -4.26 113.70 108.44 2dkq s SER 51 Ca 0.61 -0.26 -0.11 0.00 0.48 0.00 0.00 55.95 56.67 2dkq s SER 51 Cb -0.23 0.30 0.10 0.00 0.10 0.00 0.00 66.02 66.30 2dkq s SER 51 CO 0.28 -0.55 1.09 -2.16 0.98 0.00 0.00 173.24 172.88 2dkq s PRO 52 N -2.34 1.68 0.42 4.02 0.04 -1.26 -5.09 135.00 132.46 2dkq s PRO 52 Ca -0.07 0.97 -0.26 0.00 0.04 0.00 0.00 61.00 61.68 2dkq s PRO 52 Cb -0.02 -1.85 -0.10 0.00 0.04 0.00 0.00 34.50 32.58 2dkq s PRO 52 CO -0.02 -1.99 1.44 0.54 0.04 0.00 0.00 177.00 177.00 2dkq n ARG 53 N -3.73 2.37 -1.63 4.56 1.74 -1.26 -4.97 116.66 113.74 2dkq n ARG 53 Ca 0.08 0.84 -0.32 0.00 -0.77 0.00 0.00 57.85 57.67 2dkq n ARG 53 Cb 0.54 -2.62 0.06 0.00 -1.02 0.00 0.00 32.46 29.42 2dkq n ARG 53 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 2dkq s PRO 54 N -2.29 2.66 -0.39 5.56 0.04 -1.26 -5.01 135.00 134.31 2dkq s PRO 54 Ca 0.58 1.33 -0.18 0.00 0.04 0.00 0.00 61.00 62.77 2dkq s PRO 54 Cb -0.47 -1.94 0.01 0.00 0.04 0.00 0.00 34.50 32.14 2dkq s PRO 54 CO 0.60 -1.35 0.50 0.99 0.04 0.00 0.00 177.00 177.78 2dkq s THR 55 N -2.49 5.01 0.92 1.26 2.01 -1.26 -5.03 115.64 116.07 2dkq s THR 55 Ca 0.65 0.08 -0.12 0.00 0.31 0.00 0.00 61.69 62.62 2dkq s THR 55 Cb -0.20 -4.02 0.14 0.00 0.01 0.00 0.00 72.50 68.44 2dkq s THR 55 CO 0.45 -0.34 1.09 -2.16 -0.69 0.00 0.00 174.62 172.98 2dkq s PRO 56 N 2.37 1.03 0.02 4.92 0.04 -1.26 -4.98 135.00 137.15 2dkq s PRO 56 Ca 0.17 0.74 0.01 0.00 0.04 0.00 0.00 61.00 61.96 2dkq s PRO 56 Cb -0.16 -1.79 -0.01 0.00 0.04 0.00 0.00 34.50 32.58 2dkq s PRO 56 CO 0.14 -2.37 -0.05 0.00 0.04 0.00 0.00 177.00 174.76 2dkq s ALA 57 N -2.94 0.34 -0.12 8.56 0.00 0.03 -4.97 121.76 122.66 2dkq s ALA 57 Ca 0.64 -0.42 -0.28 0.00 0.00 0.00 0.00 51.96 51.91 2dkq s ALA 57 Cb -0.18 0.00 -0.02 0.00 0.00 0.00 0.00 23.12 22.93 2dkq s ALA 57 CO 0.57 0.00 0.92 0.08 0.00 0.00 0.00 175.76 177.33 2dkq s VAL 58 N -0.73 4.84 0.06 0.00 1.01 -1.26 -1.31 120.40 123.01 2dkq s VAL 58 Ca -0.05 1.85 -0.03 0.00 0.00 0.00 0.00 61.98 63.75 2dkq s VAL 58 Cb -0.06 -4.23 -0.03 0.00 0.00 0.00 0.00 36.38 32.07 2dkq s VAL 58 CO -0.00 0.04 0.03 0.68 0.00 0.00 0.00 175.10 175.84 2dkq s VAL 59 N 1.92 0.19 0.84 2.92 -7.23 -1.12 -4.59 120.40 113.34 2dkq s VAL 59 Ca 0.44 -1.60 -0.12 0.00 -1.81 0.00 0.00 61.98 58.89 2dkq s VAL 59 Cb -0.18 -1.40 0.10 0.00 0.56 0.00 0.00 36.38 35.46 2dkq s VAL 59 CO 0.16 -0.88 1.15 -2.28 -0.31 0.00 0.00 175.10 172.94 2dkq s HIS 60 N -3.74 2.79 -0.07 2.82 2.46 -1.14 -0.70 115.29 117.71 2dkq s HIS 60 Ca 0.05 0.85 -0.04 0.00 0.47 0.00 0.00 55.06 56.38 2dkq s HIS 60 Cb 0.06 -3.39 0.03 0.00 -0.13 0.00 0.00 32.58 29.15 2dkq s HIS 60 CO -0.10 -1.98 0.16 0.12 -2.47 0.00 0.00 174.74 170.47 2dkq s PHE 61 N -3.40 -0.18 -0.08 3.88 5.36 0.13 -4.28 117.98 119.40 2dkq s PHE 61 Ca 0.62 0.48 -0.06 0.00 -0.96 0.00 0.00 56.93 57.01 2dkq s PHE 61 Cb -0.13 -0.00 0.03 0.00 -0.34 0.00 0.00 43.02 42.58 2dkq s PHE 61 CO 0.51 -0.13 0.21 0.21 -1.46 0.00 0.00 175.22 174.56 2dkq s LYS 62 N 0.65 0.22 -0.18 10.12 2.47 -1.00 -1.70 119.74 130.31 2dkq s LYS 62 Ca -0.05 0.36 0.01 0.00 -1.56 0.00 0.00 55.97 54.73 2dkq s LYS 62 Cb -0.06 0.03 0.03 0.00 -1.46 0.00 0.00 37.83 36.37 2dkq s LYS 62 CO -0.03 -0.08 -0.12 0.08 0.16 0.00 0.00 175.35 175.36 2dkq s VAL 63 N 0.51 1.64 0.20 4.02 1.01 -1.23 -1.98 120.40 124.57 2dkq s VAL 63 Ca -0.03 -0.87 0.04 0.00 0.00 0.00 0.00 61.98 61.11 2dkq s VAL 63 Cb -0.05 -1.64 -0.01 0.00 0.00 0.00 0.00 36.38 34.68 2dkq s VAL 63 CO -0.03 0.29 0.19 -1.20 0.00 0.00 0.00 175.10 174.35 2dkq n SER 64 N 4.71 -0.48 -0.18 3.32 7.64 -0.04 -4.53 113.62 124.05 2dkq n SER 64 Ca -0.16 -2.29 -0.07 0.00 1.01 0.00 0.00 58.87 57.36 2dkq n SER 64 Cb 0.48 1.08 0.02 0.00 -1.01 0.00 0.00 64.21 64.78 2dkq n SER 64 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2dkq h ALA 65 N 1.66 0.66 -0.00 -0.43 0.00 -1.99 -1.66 119.26 117.50 2dkq h ALA 65 Ca -0.14 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.67 2dkq h ALA 65 Cb 0.72 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 18.30 2dkq h ALA 65 CO 0.21 0.19 0.03 1.96 0.00 0.00 0.00 179.25 181.63 2dkq h GLN 66 N 0.69 0.00 0.00 0.00 1.08 -1.97 -3.40 115.11 111.50 2dkq h GLN 66 Ca 0.18 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.38 2dkq h GLN 66 Cb 0.06 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.49 2dkq h GLN 66 CO -0.03 0.00 0.00 0.41 -0.95 0.00 0.00 178.83 178.26 2dkq n GLY 67 N -1.11 0.46 3.06 3.46 0.00 -0.63 -0.17 105.19 110.27 2dkq n GLY 67 Ca -0.03 -1.03 -0.22 0.00 0.00 0.00 0.00 46.02 44.74 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 0.00 0.97 -0.01 -0.61 1.01 -1.24 -0.86 121.20 120.46 2dkq s ILE 68 Ca 0.00 -0.49 0.06 0.00 0.00 0.00 0.00 60.65 60.22 2dkq s ILE 68 Cb 0.00 -0.83 -0.03 0.00 0.01 0.00 0.00 42.46 41.61 2dkq s ILE 68 CO 0.00 0.28 -0.18 -0.89 0.00 0.00 0.00 174.94 174.15 2dkq s THR 69 N -0.04 2.76 0.02 2.92 2.01 -0.84 -3.26 115.64 119.20 2dkq s THR 69 Ca 0.00 -0.99 0.00 0.00 0.31 0.00 0.00 61.69 61.02 2dkq s THR 69 Cb -0.07 -2.09 -0.02 0.00 0.01 0.00 0.00 72.50 70.33 2dkq s THR 69 CO 0.00 0.49 -0.03 -0.76 -0.69 0.00 0.00 174.62 173.62 2dkq s LEU 70 N -1.00 2.18 -0.14 4.42 1.43 -1.24 -2.38 118.68 121.96 2dkq s LEU 70 Ca 0.12 -0.39 -0.04 0.00 -1.03 0.00 0.00 54.13 52.80 2dkq s LEU 70 Cb -0.10 0.01 0.07 0.00 0.03 0.00 0.00 46.19 46.20 2dkq s LEU 70 CO 0.02 -0.20 0.22 -0.89 0.23 0.00 0.00 176.35 175.73 2dkq s THR 71 N -1.09 -0.34 -0.08 5.49 2.01 -1.26 -2.54 115.64 117.83 2dkq s THR 71 Ca -0.11 0.20 0.00 0.00 0.31 0.00 0.00 61.69 62.09 2dkq s THR 71 Cb -0.08 -0.46 -0.03 0.00 0.01 0.00 0.00 72.50 71.95 2dkq s THR 71 CO -0.01 0.04 -0.08 -0.62 -0.69 0.00 0.00 174.62 173.27 2dkq s ASP 72 N 2.35 4.55 -0.14 3.53 -1.08 -1.26 -2.89 116.67 121.74 2dkq s ASP 72 Ca 0.03 -0.08 -0.22 0.00 -0.52 0.00 0.00 52.55 51.77 2dkq s ASP 72 Cb -0.13 -1.25 -0.19 0.00 -1.46 0.00 0.00 42.92 39.89 2dkq s ASP 72 CO -0.09 0.32 0.54 0.78 0.52 0.00 0.00 175.17 177.25 2dkq h ASN 73 N 5.56 0.00 1.16 -0.34 -0.26 -1.92 -3.34 115.58 116.44 2dkq h ASN 73 Ca -0.44 -0.72 -0.04 0.00 -0.56 0.00 0.00 56.30 54.54 2dkq h ASN 73 Cb 1.18 0.00 -0.01 0.00 -1.06 0.00 0.00 38.32 38.43 2dkq h ASN 73 CO 0.54 0.91 -0.19 1.56 -1.06 0.00 0.00 177.43 179.19 2dkq h GLN 74 N -1.00 0.00 -4.98 0.81 1.08 -1.94 -3.46 115.11 105.62 2dkq h GLN 74 Ca -0.02 0.00 -0.18 0.00 -1.45 0.00 0.00 58.65 57.00 2dkq h GLN 74 Cb 0.78 0.00 -0.11 0.00 -0.05 0.00 0.00 27.48 28.10 2dkq h GLN 74 CO -0.01 0.19 -0.26 2.89 -0.95 0.00 0.00 178.83 180.69 2dkq n ARG 75 N -3.27 -1.95 -0.27 1.46 1.85 -1.25 -4.71 116.66 108.52 2dkq n ARG 75 Ca 0.01 0.04 0.07 0.00 -1.00 0.00 0.00 57.85 56.97 2dkq n ARG 75 Cb 0.46 -3.67 0.31 0.00 -1.05 0.00 0.00 32.46 28.51 2dkq n ARG 75 CO 0.00 0.00 0.00 0.87 -0.01 0.00 0.00 177.63 178.49 2dkq h LYS 76 N -0.25 0.83 0.00 2.89 1.57 -1.94 -3.14 116.57 116.53 2dkq h LYS 76 Ca -0.17 -0.05 -0.35 0.00 -1.87 0.00 0.00 60.65 58.21 2dkq h LYS 76 Cb 0.91 -0.19 -0.06 0.00 0.08 0.00 0.00 32.23 32.97 2dkq h LYS 76 CO 0.26 0.55 -2.31 1.28 -0.57 0.00 0.00 179.45 178.65 2dkq n LEU 77 N -4.52 2.65 -3.53 2.94 7.99 -1.26 -5.06 117.00 116.21 2dkq n LEU 77 Ca 0.14 -0.11 -0.11 0.00 -0.01 0.00 0.00 56.01 55.93 2dkq n LEU 77 Cb 0.30 -0.67 -0.04 0.00 -0.11 0.00 0.00 43.42 42.90 2dkq n LEU 77 CO 0.32 0.84 0.68 0.72 -1.51 0.00 0.00 177.39 178.44 2dkq s PHE 78 N -2.46 -0.40 0.41 -1.77 -0.71 -1.19 -5.16 117.98 106.70 2dkq s PHE 78 Ca -0.29 0.51 0.08 0.00 -1.04 0.00 0.00 56.93 56.19 2dkq s PHE 78 Cb 0.08 0.49 0.00 0.00 -1.21 0.00 0.00 43.02 42.37 2dkq s PHE 78 CO 0.56 -0.48 0.51 0.12 -1.34 0.00 0.00 175.22 174.59 2dkq s PHE 79 N -2.06 2.81 0.06 3.49 5.36 -1.26 -4.20 117.98 122.18 2dkq s PHE 79 Ca -0.00 -0.41 -0.25 0.00 -0.96 0.00 0.00 56.93 55.31 2dkq s PHE 79 Cb -0.01 -2.29 -0.14 0.00 -0.34 0.00 0.00 43.02 40.25 2dkq s PHE 79 CO -0.02 -0.31 0.60 2.89 -1.46 0.00 0.00 175.22 176.92 2dkq n ARG 80 N -1.75 0.00 -3.70 10.12 -4.01 -1.26 -4.81 116.66 111.25 2dkq n ARG 80 Ca 0.06 0.00 -0.14 0.00 -1.04 0.00 0.00 57.85 56.73 2dkq n ARG 80 Cb 0.60 -0.93 -0.14 0.00 -3.04 0.00 0.00 32.46 28.94 2dkq n ARG 80 CO 0.00 0.00 0.00 0.50 -3.04 0.00 0.00 177.63 175.09 2dkq s ARG 81 N -0.32 0.11 -0.28 2.89 3.52 -1.05 -4.99 118.95 118.83 2dkq s ARG 81 Ca 0.57 0.55 -0.11 0.00 -0.13 0.00 0.00 55.73 56.62 2dkq s ARG 81 Cb -0.81 -0.16 -0.05 0.00 -1.56 0.00 0.00 34.95 32.37 2dkq s ARG 81 CO 0.41 -0.23 0.17 -1.58 -0.81 0.00 0.00 175.30 173.26 2dkq s HIS 82 N 1.80 3.20 -0.05 5.12 5.65 -1.26 -3.60 115.29 126.15 2dkq s HIS 82 Ca -0.03 0.05 0.00 0.00 0.25 0.00 0.00 55.06 55.33 2dkq s HIS 82 Cb -0.12 -2.36 -0.03 0.00 -1.18 0.00 0.00 32.58 28.89 2dkq s HIS 82 CO -0.07 -0.18 -0.02 0.71 -0.65 0.00 0.00 174.74 174.52 2dkq s TYR 83 N 1.73 3.06 0.69 3.88 2.02 -1.20 -5.07 117.35 122.45 2dkq s TYR 83 Ca 0.07 0.10 -0.14 0.00 -0.37 0.00 0.00 57.07 56.73 2dkq s TYR 83 Cb -0.16 -1.73 0.01 0.00 -0.40 0.00 0.00 41.96 39.69 2dkq s TYR 83 CO 0.10 0.42 1.11 -1.25 -1.57 0.00 0.00 175.55 174.36 2dkq s PRO 84 N -1.06 2.66 0.54 -1.71 0.04 -1.26 -3.66 135.00 130.55 2dkq s PRO 84 Ca 0.15 1.34 0.24 0.00 0.04 0.00 0.00 61.00 62.76 2dkq s PRO 84 Cb -0.11 -1.94 1.50 0.00 0.04 0.00 0.00 34.50 33.99 2dkq s PRO 84 CO 0.04 -1.35 2.15 -0.24 0.04 0.00 0.00 177.00 177.64 2dkq h VAL 85 N -0.26 0.73 0.54 -0.36 3.04 -0.78 -3.08 116.25 116.08 2dkq h VAL 85 Ca -0.46 -0.22 -0.03 0.00 -1.01 0.00 0.00 66.70 64.99 2dkq h VAL 85 Cb 1.24 1.13 0.01 0.00 -2.01 0.00 0.00 31.29 31.66 2dkq h VAL 85 CO 0.53 0.06 -0.26 -1.13 -1.01 0.00 0.00 177.57 175.76 2dkq h ASN 86 N 0.00 -0.62 -0.83 3.17 -1.24 -1.91 -3.21 115.58 110.95 2dkq h ASN 86 Ca -0.00 0.02 0.15 0.00 0.71 0.00 0.00 56.30 57.18 2dkq h ASN 86 Cb 0.13 0.16 -0.14 0.00 0.73 0.00 0.00 38.32 39.19 2dkq h ASN 86 CO 0.01 -0.38 -0.27 -1.20 -1.29 0.00 0.00 177.43 174.30 2dkq n SER 87 N -4.31 -0.43 -4.56 1.15 7.64 -1.16 -3.67 113.62 108.28 2dkq n SER 87 Ca -0.09 1.43 -0.24 0.00 1.01 0.00 0.00 58.87 60.98 2dkq n SER 87 Cb 0.29 -0.38 -0.05 0.00 -1.01 0.00 0.00 64.21 63.06 2dkq n SER 87 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 2dkq s ILE 88 N -5.90 3.12 -0.24 0.44 1.01 -1.21 -3.65 121.20 114.77 2dkq s ILE 88 Ca -0.12 -0.05 -0.02 0.00 0.00 0.00 0.00 60.65 60.47 2dkq s ILE 88 Cb 0.19 -3.30 -0.14 0.00 0.01 0.00 0.00 42.46 39.23 2dkq s ILE 88 CO 0.62 -0.28 -0.23 0.35 0.00 0.00 0.00 174.94 175.39 2dkq n THR 89 N 8.25 1.34 -4.69 2.92 -2.24 -1.24 -4.85 114.28 113.78 2dkq n THR 89 Ca 0.40 -0.47 -0.23 0.00 -2.27 0.00 0.00 64.05 61.48 2dkq n THR 89 Cb 0.48 -1.44 -0.15 0.00 -2.10 0.00 0.00 70.33 67.11 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 -2.46 1.34 -0.30 4.78 2.19 -1.25 -4.92 117.98 117.36 2dkq s PHE 90 Ca -0.32 -0.27 0.02 0.00 0.33 0.00 0.00 56.93 56.69 2dkq s PHE 90 Cb 0.09 -0.87 0.19 0.00 -1.31 0.00 0.00 43.02 41.13 2dkq s PHE 90 CO 0.51 -0.04 0.60 0.45 1.83 0.00 0.00 175.22 178.58 2dkq s SER 91 N -0.29 -1.48 0.03 6.13 0.15 -1.26 -1.24 113.70 115.74 2dkq s SER 91 Ca 0.04 0.59 -0.23 0.00 0.70 0.00 0.00 55.95 57.06 2dkq s SER 91 Cb -0.06 2.10 0.05 0.00 -1.71 0.00 0.00 66.02 66.40 2dkq s SER 91 CO -0.00 -0.27 0.51 -0.55 1.20 0.00 0.00 173.24 174.13 2dkq s SER 92 N 2.85 -0.43 1.03 5.45 0.15 -1.24 -4.59 113.70 116.90 2dkq s SER 92 Ca 0.16 0.23 -0.20 0.00 0.70 0.00 0.00 55.95 56.84 2dkq s SER 92 Cb -0.13 0.48 -0.05 0.00 -1.71 0.00 0.00 66.02 64.61 2dkq s SER 92 CO -0.23 -0.67 -0.54 0.35 1.20 0.00 0.00 173.24 173.34 2dkq n THR 93 N 0.56 0.00 -2.15 6.45 -2.24 -1.26 -4.13 114.28 111.51 2dkq n THR 93 Ca -0.19 -0.24 -0.41 0.00 -2.27 0.00 0.00 64.05 60.95 2dkq n THR 93 Cb 0.59 -0.30 -0.02 0.00 -2.10 0.00 0.00 70.33 68.50 2dkq n THR 93 CO 0.00 0.00 0.00 1.51 -0.57 0.00 0.00 175.07 176.01 2dkq s ASP 94 N -1.45 6.82 0.33 3.42 -4.77 -1.01 -4.85 116.67 115.16 2dkq s ASP 94 Ca 0.47 2.63 0.13 0.00 -3.30 0.00 0.00 52.55 52.48 2dkq s ASP 94 Cb -0.09 -2.64 0.58 0.00 -1.09 0.00 0.00 42.92 39.68 2dkq s ASP 94 CO 0.70 -0.50 1.73 1.55 0.70 0.00 0.00 175.17 179.35 2dkq h PRO 95 N 3.61 0.00 0.00 2.11 0.13 -1.90 -2.86 132.00 133.10 2dkq h PRO 95 Ca -0.48 0.00 -0.08 0.00 -0.87 0.00 0.00 66.00 64.57 2dkq h PRO 95 Cb 1.22 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.34 2dkq h PRO 95 CO 0.67 0.47 -0.38 1.96 -0.23 0.00 0.00 178.00 180.48 2dkq h GLN 96 N 0.00 0.00 -6.01 0.86 1.08 -1.96 -3.47 115.11 105.60 2dkq h GLN 96 Ca -0.00 0.00 -0.41 0.00 -1.45 0.00 0.00 58.65 56.78 2dkq h GLN 96 Cb 0.85 0.00 0.07 0.00 -0.05 0.00 0.00 27.48 28.35 2dkq h GLN 96 CO 0.06 0.38 -0.76 -3.47 -0.95 0.00 0.00 178.83 174.09 2dkq n ASP 97 N -3.34 -3.65 -4.90 1.46 2.03 -1.08 -4.98 116.55 102.08 2dkq n ASP 97 Ca 0.01 -0.70 -0.24 0.00 0.52 0.00 0.00 54.79 54.38 2dkq n ASP 97 Cb 0.60 -4.44 0.06 0.00 -0.72 0.00 0.00 41.12 36.62 2dkq n ASP 97 CO 0.00 0.00 0.00 -0.13 -1.92 0.00 0.00 177.20 175.15 2dkq s ARG 98 N -6.13 2.25 -0.10 -0.67 0.52 -1.26 -4.99 118.95 108.57 2dkq s ARG 98 Ca 0.34 -0.57 0.00 0.00 -0.52 0.00 0.00 55.73 54.97 2dkq s ARG 98 Cb -0.16 -2.31 -0.03 0.00 0.52 0.00 0.00 34.95 32.97 2dkq s ARG 98 CO 0.78 -1.07 -0.08 1.03 0.02 0.00 0.00 175.30 175.98 2dkq s ARG 99 N -5.05 3.03 -0.49 3.54 1.81 -1.26 -3.49 118.95 117.05 2dkq s ARG 99 Ca 0.60 -0.58 -0.16 0.00 -1.72 0.00 0.00 55.73 53.86 2dkq s ARG 99 Cb -0.10 -2.64 0.08 0.00 -0.45 0.00 0.00 34.95 31.84 2dkq s ARG 99 CO 0.42 0.49 0.47 -0.46 -0.68 0.00 0.00 175.30 175.54 2dkq s TRP 100 N -0.34 3.19 -0.74 -0.53 -0.11 -0.80 -4.85 118.94 114.76 2dkq s TRP 100 Ca 0.05 -0.88 -0.26 0.00 1.22 0.00 0.00 56.10 56.23 2dkq s TRP 100 Cb -0.12 -3.35 -0.03 0.00 -1.50 0.00 0.00 33.47 28.47 2dkq s TRP 100 CO 0.02 -0.89 1.87 0.99 -4.62 0.00 0.00 176.95 174.32 2dkq s THR 101 N 1.90 3.42 0.98 5.86 2.01 -1.26 -2.96 115.64 125.60 2dkq s THR 101 Ca 0.07 -0.04 -0.15 0.00 0.31 0.00 0.00 61.69 61.87 2dkq s THR 101 Cb -0.24 -4.02 -0.04 0.00 0.01 0.00 0.00 72.50 68.21 2dkq s THR 101 CO 0.07 -0.98 -0.17 0.59 -0.69 0.00 0.00 174.62 173.44 2dkq n ASN 102 N 13.04 -3.63 0.00 3.53 3.02 0.27 -4.78 115.26 126.71 2dkq n ASN 102 Ca 0.28 0.22 0.06 0.00 -0.03 0.00 0.00 54.58 55.11 2dkq n ASN 102 Cb 0.50 -0.99 0.35 0.00 -0.61 0.00 0.00 39.78 39.03 2dkq n ASN 102 CO 0.00 0.00 0.00 -0.81 -2.62 0.00 0.00 177.26 173.83 2dkq n PRO 103 N 0.04 0.49 -0.09 3.52 -0.04 -1.26 -2.25 135.00 135.41 2dkq n PRO 103 Ca 0.03 0.00 -0.08 0.00 -0.04 0.00 0.00 63.50 63.41 2dkq n PRO 103 Cb 0.56 -1.37 -0.14 0.00 -0.04 0.00 0.00 33.50 32.51 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 -0.87 0.53 0.00 3.54 9.92 -1.26 -5.00 116.55 123.41 2dkq n ASP 104 Ca 0.09 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.35 2dkq n ASP 104 Cb 0.04 0.99 0.00 0.00 -0.64 0.00 0.00 41.12 41.51 2dkq n ASP 104 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2dkq n GLY 105 N 1.86 1.62 3.55 0.44 0.00 -0.96 -5.14 105.19 106.57 2dkq n GLY 105 Ca -0.28 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.48 2dkq n GLY 105 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2dkq s THR 106 N -1.72 3.06 0.17 2.61 -4.23 -1.26 -4.92 115.64 109.35 2dkq s THR 106 Ca 0.00 -1.82 0.05 0.00 -1.18 0.00 0.00 61.69 58.74 2dkq s THR 106 Cb 0.00 -2.54 -0.04 0.00 1.34 0.00 0.00 72.50 71.26 2dkq s THR 106 CO 0.00 -0.18 0.12 0.42 -0.54 0.00 0.00 174.62 174.44 2dkq s THR 107 N -1.88 4.40 0.32 3.99 -4.23 -1.26 0.95 115.64 117.92 2dkq s THR 107 Ca 0.26 -1.13 -0.10 0.00 -1.18 0.00 0.00 61.69 59.55 2dkq s THR 107 Cb -0.08 -3.25 0.01 0.00 1.34 0.00 0.00 72.50 70.53 2dkq s THR 107 CO 0.15 -0.11 0.55 -0.44 -0.54 0.00 0.00 174.62 174.23 2dkq s SER 108 N -3.10 0.33 0.05 3.99 0.01 -1.15 -4.93 113.70 108.89 2dkq s SER 108 Ca 0.31 -1.19 -0.19 0.00 1.31 0.00 0.00 55.95 56.18 2dkq s SER 108 Cb -0.10 0.68 -0.06 0.00 0.21 0.00 0.00 66.02 66.74 2dkq s SER 108 CO 0.23 -1.33 0.57 -0.75 0.41 0.00 0.00 173.24 172.37 2dkq s LYS 109 N -3.27 4.22 -0.13 12.44 2.47 -1.26 -1.90 119.74 132.31 2dkq s LYS 109 Ca 0.24 0.73 -0.14 0.00 -1.56 0.00 0.00 55.97 55.24 2dkq s LYS 109 Cb -0.02 -3.26 -0.05 0.00 -1.46 0.00 0.00 37.83 33.04 2dkq s LYS 109 CO 0.14 0.57 0.32 0.42 0.16 0.00 0.00 175.35 176.96 2dkq s ILE 110 N -0.88 5.27 0.24 5.43 1.01 -1.23 -2.40 121.20 128.63 2dkq s ILE 110 Ca 0.29 0.61 -0.16 0.00 0.00 0.00 0.00 60.65 61.39 2dkq s ILE 110 Cb -0.19 -3.65 0.01 0.00 0.01 0.00 0.00 42.46 38.64 2dkq s ILE 110 CO 0.18 0.43 0.54 0.72 0.00 0.00 0.00 174.94 176.81 2dkq s PHE 111 N 0.14 0.11 0.00 3.97 -0.71 0.25 -2.41 117.98 119.33 2dkq s PHE 111 Ca 0.18 -0.49 0.00 0.00 -1.04 0.00 0.00 56.93 55.59 2dkq s PHE 111 Cb -0.14 0.35 0.00 0.00 -1.21 0.00 0.00 43.02 42.03 2dkq s PHE 111 CO 0.06 -1.02 0.00 0.41 -1.34 0.00 0.00 175.22 173.33 2dkq n GLY 112 N -0.38 2.17 3.72 1.99 0.00 -1.26 0.17 105.19 111.60 2dkq n GLY 112 Ca -0.05 -0.69 -0.25 0.00 0.00 0.00 0.00 46.02 45.04 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 2.61 -0.21 1.61 -0.71 -1.21 -3.71 117.98 114.36 2dkq s PHE 113 Ca 0.00 -0.55 0.00 0.00 -1.04 0.00 0.00 56.93 55.34 2dkq s PHE 113 Cb 0.00 -1.87 0.03 0.00 -1.21 0.00 0.00 43.02 39.96 2dkq s PHE 113 CO 0.00 0.24 -0.15 0.08 -1.34 0.00 0.00 175.22 174.05 2dkq s VAL 114 N -2.58 2.35 0.11 -2.49 1.01 -0.37 -1.52 120.40 116.91 2dkq s VAL 114 Ca 0.40 -1.03 0.10 0.00 0.00 0.00 0.00 61.98 61.45 2dkq s VAL 114 Cb 0.03 -2.10 -0.04 0.00 0.00 0.00 0.00 36.38 34.27 2dkq s VAL 114 CO 0.22 0.37 -0.25 0.00 0.00 0.00 0.00 175.10 175.44 2dkq s ALA 115 N 1.28 2.18 0.59 5.51 0.00 -0.84 -3.66 121.76 126.81 2dkq s ALA 115 Ca 0.02 -1.37 -0.17 0.00 0.00 0.00 0.00 51.96 50.45 2dkq s ALA 115 Cb -0.15 -0.35 -0.04 0.00 0.00 0.00 0.00 23.12 22.58 2dkq s ALA 115 CO -0.09 0.49 1.07 0.15 0.00 0.00 0.00 175.76 177.37 2dkq s LYS 116 N -1.88 3.29 0.15 0.00 1.02 -1.24 -1.03 119.74 120.04 2dkq s LYS 116 Ca 0.11 1.30 -0.30 0.00 0.02 0.00 0.00 55.97 57.10 2dkq s LYS 116 Cb -0.10 -2.02 -0.07 0.00 -0.52 0.00 0.00 37.83 35.12 2dkq s LYS 116 CO 0.05 -0.85 1.18 0.21 -0.92 0.00 0.00 175.35 175.02 2dkq s LYS 117 N -3.89 4.50 0.35 1.68 2.20 -0.34 -4.79 119.74 119.45 2dkq s LYS 117 Ca 0.66 1.81 0.27 0.00 -0.36 0.00 0.00 55.97 58.35 2dkq s LYS 117 Cb -0.18 -3.28 1.12 0.00 -1.51 0.00 0.00 37.83 33.99 2dkq s LYS 117 CO 0.35 -0.10 1.80 -1.00 -0.36 0.00 0.00 175.35 176.04 2dkq h PRO 118 N 5.67 0.00 0.00 4.03 0.13 -1.94 -2.98 132.00 136.91 2dkq h PRO 118 Ca -0.44 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.67 2dkq h PRO 118 Cb 1.21 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.34 2dkq h PRO 118 CO 0.76 0.00 -1.83 0.41 -0.23 0.00 0.00 178.00 177.11 2dkq n GLY 119 N -0.02 -0.80 2.63 1.56 0.00 -1.26 -4.88 105.19 102.42 2dkq n GLY 119 Ca 0.02 -0.40 -0.28 0.00 0.00 0.00 0.00 46.02 45.36 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 -4.11 2.94 0.00 1.61 0.01 -1.12 -4.99 113.70 108.04 2dkq s SER 120 Ca -0.07 -0.93 0.15 0.00 1.31 0.00 0.00 55.95 56.41 2dkq s SER 120 Cb 0.11 -0.40 0.77 0.00 0.21 0.00 0.00 66.02 66.70 2dkq s SER 120 CO 0.72 -0.37 1.41 -0.81 0.41 0.00 0.00 173.24 174.60 2dkq n PRO 121 N 5.19 0.23 -0.37 12.44 -0.04 -1.25 -2.01 135.00 149.19 2dkq n PRO 121 Ca -0.07 0.13 0.08 0.00 -0.04 0.00 0.00 63.50 63.60 2dkq n PRO 121 Cb 0.46 -1.50 0.23 0.00 -0.04 0.00 0.00 33.50 32.65 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 -1.26 0.81 -3.66 0.54 2.14 -1.26 -4.91 117.44 109.83 2dkq n TRP 122 Ca 0.07 -0.77 -0.23 0.00 2.07 0.00 0.00 57.50 58.65 2dkq n TRP 122 Cb 0.11 -0.23 -0.17 0.00 -0.81 0.00 0.00 31.31 30.21 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 -2.30 0.09 0.11 -2.67 2.02 -0.85 -4.94 118.70 110.15 2dkq s GLU 123 Ca 0.37 0.13 -0.08 0.00 0.02 0.00 0.00 54.97 55.40 2dkq s GLU 123 Cb 0.28 -1.15 -0.06 0.00 0.10 0.00 0.00 34.13 33.30 2dkq s GLU 123 CO 0.11 -0.47 0.40 -0.80 0.02 0.00 0.00 175.26 174.52 2dkq s ASN 124 N 2.12 6.60 -0.06 -0.19 0.01 -1.25 -1.19 114.94 120.98 2dkq s ASN 124 Ca 0.04 0.75 0.00 0.00 -0.71 0.00 0.00 52.86 52.93 2dkq s ASN 124 Cb -0.14 -2.16 0.02 0.00 0.41 0.00 0.00 41.25 39.39 2dkq s ASN 124 CO -0.06 0.12 -0.03 -0.69 -1.51 0.00 0.00 177.10 174.93 2dkq s VAL 125 N -1.50 0.53 0.04 1.60 1.01 -0.20 -1.08 120.40 120.81 2dkq s VAL 125 Ca 0.36 -0.06 -0.12 0.00 0.00 0.00 0.00 61.98 62.16 2dkq s VAL 125 Cb -0.13 -0.60 -0.06 0.00 0.00 0.00 0.00 36.38 35.59 2dkq s VAL 125 CO 0.20 0.25 0.40 0.00 0.00 0.00 0.00 175.10 175.95 2dkq s HIS 127 N -1.26 3.51 0.63 0.00 3.76 -0.58 -2.67 115.29 118.68 2dkq s HIS 127 Ca 0.29 -2.37 -0.17 0.00 -0.15 0.00 0.00 55.06 52.66 2dkq s HIS 127 Cb -0.15 -2.77 -0.02 0.00 1.11 0.00 0.00 32.58 30.75 2dkq s HIS 127 CO 0.16 -0.91 1.15 -1.17 -0.85 0.00 0.00 174.74 173.11 2dkq s LEU 128 N 1.12 3.53 0.33 0.89 2.96 -0.96 -3.32 118.68 123.22 2dkq s LEU 128 Ca 0.04 2.17 -0.17 0.00 -0.22 0.00 0.00 54.13 55.95 2dkq s LEU 128 Cb -0.21 -4.57 0.03 0.00 0.50 0.00 0.00 46.19 41.94 2dkq s LEU 128 CO -0.04 -1.60 0.71 -0.36 -1.32 0.00 0.00 176.35 173.74 2dkq s PHE 129 N -2.00 0.08 -0.20 5.38 0.08 0.44 -3.41 117.98 118.36 2dkq s PHE 129 Ca 0.71 -0.61 -0.18 0.00 0.12 0.00 0.00 56.93 56.98 2dkq s PHE 129 Cb -0.24 0.66 0.05 0.00 -0.57 0.00 0.00 43.02 42.92 2dkq s PHE 129 CO 0.36 -1.35 0.54 0.00 -0.10 0.00 0.00 175.22 174.68 2dkq s ALA 130 N -3.20 -1.35 -0.20 5.36 0.00 0.12 -0.58 121.76 121.91 2dkq s ALA 130 Ca 0.15 1.56 -0.36 0.00 0.00 0.00 0.00 51.96 53.31 2dkq s ALA 130 Cb -0.05 -0.91 -0.13 0.00 0.00 0.00 0.00 23.12 22.04 2dkq s ALA 130 CO 0.10 -0.26 1.91 -0.85 0.00 0.00 0.00 175.76 176.66 2dkq n GLU 131 N 2.91 1.65 -0.08 0.00 -0.00 -1.01 -1.71 120.64 122.40 2dkq n GLU 131 Ca -0.14 0.58 -0.07 0.00 -0.00 0.00 0.00 57.16 57.52 2dkq n GLU 131 Cb 0.56 -2.46 -0.03 0.00 -0.00 0.00 0.00 31.44 29.51 2dkq n GLU 131 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.13 177.02 2dkq n LEU 132 N 7.04 1.83 -4.72 -1.84 0.00 -1.26 -4.66 117.00 113.38 2dkq n LEU 132 Ca 0.28 0.57 -0.40 0.00 0.00 0.00 0.00 56.01 56.46 2dkq n LEU 132 Cb 0.24 -0.87 -0.05 0.00 0.00 0.00 0.00 43.42 42.74 2dkq n LEU 132 CO 0.76 -0.35 0.39 -0.62 0.00 0.00 0.00 177.39 177.57 2dkq s ASP 133 N -5.91 7.00 0.13 1.96 -1.08 -1.26 -4.94 116.67 112.57 2dkq s ASP 133 Ca -0.18 1.20 0.19 0.00 -0.52 0.00 0.00 52.55 53.24 2dkq s ASP 133 Cb 0.03 -2.41 0.79 0.00 -1.46 0.00 0.00 42.92 39.87 2dkq s ASP 133 CO 0.29 -0.08 1.58 -0.81 0.52 0.00 0.00 175.17 176.66 2dkq n PRO 134 N 3.60 0.09 0.24 4.34 -0.04 -1.26 -2.37 135.00 139.60 2dkq n PRO 134 Ca -0.02 0.34 0.13 0.00 -0.04 0.00 0.00 63.50 63.91 2dkq n PRO 134 Cb 0.51 -1.68 0.45 0.00 -0.04 0.00 0.00 33.50 32.74 2dkq n PRO 134 CO 0.00 0.00 0.00 0.38 -0.04 0.00 0.00 175.50 175.84 2dkq h ASP 135 N 0.00 0.00 -2.84 3.54 2.03 -2.02 -3.40 116.42 113.73 2dkq h ASP 135 Ca 0.00 0.00 -0.47 0.00 -0.73 0.00 0.00 57.03 55.83 2dkq h ASP 135 Cb 0.30 0.00 -0.40 0.00 -0.83 0.00 0.00 39.33 38.40 2dkq h ASP 135 CO 0.00 0.09 -0.75 -1.10 -1.03 0.00 0.00 179.24 176.45 2dkq s GLN 136 N -3.49 0.14 0.41 4.15 -1.52 -1.00 -5.14 119.66 113.21 2dkq s GLN 136 Ca 0.03 -0.26 -0.25 0.00 -1.95 0.00 0.00 55.36 52.92 2dkq s GLN 136 Cb 0.08 -1.41 -0.08 0.00 -0.22 0.00 0.00 33.01 31.37 2dkq s GLN 136 CO 0.61 -0.85 1.19 -1.25 -0.25 0.00 0.00 175.29 174.74 2dkq s PRO 137 N 2.15 4.01 0.28 2.91 0.04 -1.26 -4.64 135.00 138.48 2dkq s PRO 137 Ca 0.06 1.88 -0.06 0.00 0.04 0.00 0.00 61.00 62.92 2dkq s PRO 137 Cb -0.16 -2.66 0.49 0.00 0.04 0.00 0.00 34.50 32.21 2dkq s PRO 137 CO -0.23 -0.37 1.51 0.00 0.04 0.00 0.00 177.00 177.95 2dkq n ALA 138 N 0.02 0.27 -0.16 8.56 0.00 -1.26 -0.70 120.51 127.24 2dkq n ALA 138 Ca 0.05 1.06 -0.12 0.00 0.00 0.00 0.00 53.44 54.43 2dkq n ALA 138 Cb 0.46 -0.66 -0.07 0.00 0.00 0.00 0.00 19.45 19.18 2dkq n ALA 138 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 2dkq h GLY 139 N 0.00 -0.79 -0.46 0.00 0.00 -1.97 0.16 103.07 100.02 2dkq h GLY 139 Ca 0.48 0.65 0.31 0.00 0.00 0.00 0.00 47.33 48.78 2dkq h GLY 139 CO -0.99 -0.14 0.62 0.00 0.00 0.00 0.00 176.54 176.04 2dkq h ALA 140 N 0.22 2.05 0.01 3.60 0.00 -1.28 0.11 119.26 123.97 2dkq h ALA 140 Ca 0.11 0.15 -0.00 0.00 0.00 0.00 0.00 54.91 55.17 2dkq h ALA 140 Cb 0.58 0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.49 2dkq h ALA 140 CO -0.63 -0.61 -0.00 0.82 0.00 0.00 0.00 179.25 178.83 2dkq h ILE 141 N 0.36 0.00 -0.89 0.00 2.04 -0.61 -1.51 117.51 116.90 2dkq h ILE 141 Ca 0.71 -0.00 0.23 0.00 1.00 0.00 0.00 64.86 66.80 2dkq h ILE 141 Cb 1.67 0.00 -0.16 0.00 -0.74 0.00 0.00 36.82 37.59 2dkq h ILE 141 CO -0.51 0.00 0.08 -0.37 0.00 0.00 0.00 178.15 177.35 2dkq h VAL 142 N -0.01 0.20 0.12 1.67 -1.51 -0.86 0.12 116.25 115.97 2dkq h VAL 142 Ca -0.00 -0.03 -0.00 0.00 -1.23 0.00 0.00 66.70 65.44 2dkq h VAL 142 Cb 0.01 0.10 -0.00 0.00 -2.13 0.00 0.00 31.29 29.26 2dkq h VAL 142 CO 0.00 0.02 -0.08 0.74 -1.23 0.00 0.00 177.57 177.02 2dkq h THR 143 N 0.09 0.82 -0.89 7.19 2.02 -0.87 -2.30 112.91 118.98 2dkq h THR 143 Ca 0.53 0.00 0.15 0.00 0.77 0.00 0.00 66.41 67.87 2dkq h THR 143 Cb 1.06 0.82 -0.07 0.00 -1.74 0.00 0.00 68.15 68.22 2dkq h THR 143 CO -0.77 0.00 0.57 0.15 0.37 0.00 0.00 175.52 175.84 2dkq h PHE 144 N -0.20 0.77 0.00 3.16 3.04 0.28 0.46 116.94 124.44 2dkq h PHE 144 Ca -0.01 0.02 0.00 0.00 3.98 0.00 0.00 57.97 61.97 2dkq h PHE 144 Cb 0.17 -0.24 0.00 0.00 2.56 0.00 0.00 35.95 38.44 2dkq h PHE 144 CO -0.09 0.27 0.00 -0.89 -2.02 0.00 0.00 178.31 175.58 2dkq n ILE 145 N -4.56 0.00 -0.29 1.41 5.41 -0.50 -2.57 119.36 118.26 2dkq n ILE 145 Ca 0.18 1.19 0.29 0.00 1.00 0.00 0.00 62.75 65.41 2dkq n ILE 145 Cb 0.51 -2.15 0.66 0.00 -0.71 0.00 0.00 39.64 37.95 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 0.48 -0.17 1.39 1.35 -1.37 0.99 112.91 115.58 2dkq h THR 146 Ca 0.00 -0.05 0.04 0.00 -0.55 0.00 0.00 66.41 65.85 2dkq h THR 146 Cb 0.00 0.32 -0.04 0.00 -1.73 0.00 0.00 68.15 66.70 2dkq h THR 146 CO 0.00 0.03 -0.10 0.11 -0.25 0.00 0.00 175.52 175.30 2dkq h LYS 147 N 0.15 -0.09 0.00 4.72 1.79 -0.86 0.25 116.57 122.53 2dkq h LYS 147 Ca 0.55 0.01 -0.24 0.00 -2.18 0.00 0.00 60.65 58.78 2dkq h LYS 147 Cb 1.87 0.02 -0.04 0.00 -1.58 0.00 0.00 32.23 32.50 2dkq h LYS 147 CO -0.11 -0.06 -1.54 1.55 -1.08 0.00 0.00 179.45 178.20 2dkq n VAL 148 N -5.25 1.51 0.00 0.50 3.14 -0.05 -3.15 118.33 115.02 2dkq n VAL 148 Ca -0.02 -0.08 0.00 0.00 -2.96 0.00 0.00 64.34 61.27 2dkq n VAL 148 Cb 0.17 -2.09 0.00 0.00 -1.06 0.00 0.00 33.84 30.86 2dkq n VAL 148 CO 0.00 0.00 0.00 0.18 -6.46 0.00 0.00 176.83 170.55 2dkq n LEU 149 N -4.40 0.00 -0.21 6.55 7.99 0.32 -2.99 117.00 124.26 2dkq n LEU 149 Ca -0.33 0.99 -0.08 0.00 -0.01 0.00 0.00 56.01 56.58 2dkq n LEU 149 Cb 0.66 -0.49 0.03 0.00 -0.11 0.00 0.00 43.42 43.51 2dkq n LEU 149 CO 0.12 -0.49 0.95 -0.07 -1.51 0.00 0.00 177.39 176.40 2dkq h LEU 150 N 0.00 0.84 -2.85 2.23 4.07 -1.47 -3.49 115.31 114.64 2dkq h LEU 150 Ca 0.00 -0.20 0.00 0.00 0.08 0.00 0.00 57.88 57.76 2dkq h LEU 150 Cb 0.00 -0.22 -0.01 0.00 1.08 0.00 0.00 40.66 41.51 2dkq h LEU 150 CO 0.00 0.81 -0.92 0.61 -1.08 0.00 0.00 178.44 177.86 2dkq n GLY 151 N -0.74 -1.78 0.43 0.83 0.00 0.83 -4.66 105.19 100.09 2dkq n GLY 151 Ca 0.03 0.30 -0.13 0.00 0.00 0.00 0.00 46.02 46.22 2dkq n GLY 151 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 2dkq h GLN 152 N 3.67 -0.30 -0.87 1.61 7.50 -1.78 -0.95 115.11 123.99 2dkq h GLN 152 Ca -0.05 0.02 0.15 0.00 0.50 0.00 0.00 58.65 59.27 2dkq h GLN 152 Cb 0.59 0.07 -0.15 0.00 0.05 0.00 0.00 27.48 28.04 2dkq h GLN 152 CO 0.03 -0.20 -0.34 0.00 -1.50 0.00 0.00 178.83 176.82 2dkq h ARG 153 N -0.32 -0.04 -6.13 1.46 3.08 -1.94 -3.39 114.38 107.10 2dkq h ARG 153 Ca 0.08 0.00 -0.73 0.00 0.07 0.00 0.00 59.98 59.40 2dkq h ARG 153 Cb 0.54 0.01 0.01 0.00 0.08 0.00 0.00 29.97 30.61 2dkq h ARG 153 CO -0.62 -0.03 0.96 1.63 -1.07 0.00 0.00 179.97 180.84 2dkq n LYS 154 N -5.48 1.14 -3.64 0.04 5.02 -0.36 -4.91 118.16 109.97 2dkq n LYS 154 Ca 0.09 0.41 -0.39 0.00 -2.02 0.00 0.00 58.31 56.41 2dkq n LYS 154 Cb 0.40 -2.13 -0.09 0.00 -0.02 0.00 0.00 35.03 33.19 2dkq n LYS 154 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 2dkq s SER 155 N 3.95 5.54 -0.53 4.39 0.01 -1.26 -4.82 113.70 120.98 2dkq s SER 155 Ca 1.00 -2.31 -0.25 0.00 1.31 0.00 0.00 55.95 55.70 2dkq s SER 155 Cb -1.06 -1.93 0.04 0.00 0.21 0.00 0.00 66.02 63.27 2dkq s SER 155 CO 0.64 -0.55 0.64 0.61 0.41 0.00 0.00 173.24 175.00 2dkq n GLY 156 N 4.30 -0.50 0.21 3.44 0.00 -1.26 -4.84 105.19 106.54 2dkq n GLY 156 Ca 0.00 1.05 0.15 0.00 0.00 0.00 0.00 46.02 47.23 2dkq n GLY 156 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dkq h PRO 157 N 1.57 0.00 -6.64 1.61 0.13 -1.99 -3.46 132.00 123.23 2dkq h PRO 157 Ca -0.41 0.00 -0.54 0.00 -0.87 0.00 0.00 66.00 64.18 2dkq h PRO 157 Cb 1.29 0.00 -0.30 0.00 0.13 0.00 0.00 31.00 32.12 2dkq h PRO 157 CO 0.25 0.00 -0.79 0.45 -0.23 0.00 0.00 178.00 177.68 2dkq n SER 158 N -2.68 -1.05 -4.14 1.44 2.88 -1.26 -4.89 113.62 103.93 2dkq n SER 158 Ca 0.01 -1.07 -0.29 0.00 -1.33 0.00 0.00 58.87 56.19 2dkq n SER 158 Cb 0.26 -1.37 -0.17 0.00 -0.75 0.00 0.00 64.21 62.19 2dkq n SER 158 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2dkq s SER 159 N -3.20 2.59 0.00 -3.46 0.15 -1.26 -5.28 113.70 103.24 2dkq s SER 159 Ca 0.56 -0.46 0.00 0.00 0.70 0.00 0.00 55.95 56.75 2dkq s SER 159 Cb -0.33 -1.19 0.00 0.00 -1.71 0.00 0.00 66.02 62.79 2dkq s SER 159 CO 0.87 0.11 0.00 0.61 1.20 0.00 0.00 173.24 176.03