#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dd5 h SER 3 N 0.00 0.96 -0.28 4.04 0.87 -2.05 0.40 113.55 117.50 2dd5 h SER 3 Ca 0.00 -0.25 -0.11 0.00 -1.23 0.00 0.00 61.79 60.20 2dd5 h SER 3 Cb 0.00 -0.26 -0.02 0.00 -0.44 0.00 0.00 62.40 61.69 2dd5 h SER 3 CO 0.00 0.97 -0.19 -1.28 -0.53 0.00 0.00 176.83 175.80 2dd5 h SER 4 N 0.92 0.74 0.24 6.23 0.87 -2.05 0.43 113.55 120.93 2dd5 h SER 4 Ca 0.19 -0.25 -0.01 0.00 -1.23 0.00 0.00 61.79 60.49 2dd5 h SER 4 Cb 0.40 -0.20 0.00 0.00 -0.44 0.00 0.00 62.40 62.16 2dd5 h SER 4 CO 0.01 0.93 -0.11 0.40 -0.53 0.00 0.00 176.83 177.52 2dd5 h ILE 5 N 0.65 0.83 -0.86 2.23 1.08 -1.89 -1.32 117.51 118.23 2dd5 h ILE 5 Ca 0.10 -0.43 0.04 0.00 -0.39 0.00 0.00 64.86 64.17 2dd5 h ILE 5 Cb 0.68 1.07 -0.05 0.00 -3.07 0.00 0.00 36.82 35.45 2dd5 h ILE 5 CO 0.05 0.09 0.56 0.03 -0.69 0.00 0.00 178.15 178.20 2dd5 h ARG 6 N -0.54 1.03 -0.86 2.37 2.47 -0.83 0.08 114.38 118.09 2dd5 h ARG 6 Ca -0.03 -0.06 -0.02 0.00 -1.26 0.00 0.00 59.98 58.60 2dd5 h ARG 6 Cb 0.40 -0.23 -0.04 0.00 -1.65 0.00 0.00 29.97 28.45 2dd5 h ARG 6 CO 0.05 0.68 0.44 0.93 0.56 0.00 0.00 179.97 182.64 2dd5 h GLU 7 N 1.06 1.22 -0.12 0.04 5.08 -0.74 -1.09 114.58 120.03 2dd5 h GLU 7 Ca 0.34 -0.16 -0.14 0.00 -1.00 0.00 0.00 59.36 58.40 2dd5 h GLU 7 Cb 0.03 -0.23 -0.01 0.00 0.50 0.00 0.00 28.75 29.04 2dd5 h GLU 7 CO -0.10 0.92 -0.53 1.49 -1.00 0.00 0.00 179.01 179.78 2dd5 h GLU 8 N 1.22 0.36 -0.04 2.33 4.81 -0.14 -1.60 114.58 121.51 2dd5 h GLU 8 Ca 0.30 -0.22 -0.00 0.00 -0.13 0.00 0.00 59.36 59.31 2dd5 h GLU 8 Cb 0.07 0.02 -0.00 0.00 0.63 0.00 0.00 28.75 29.47 2dd5 h GLU 8 CO -0.04 0.80 0.01 0.28 -0.73 0.00 0.00 179.01 179.33 2dd5 h VAL 9 N 0.28 1.16 -0.32 0.32 2.07 -0.48 -0.52 116.25 118.76 2dd5 h VAL 9 Ca 0.01 -0.47 -0.09 0.00 0.82 0.00 0.00 66.70 66.97 2dd5 h VAL 9 Cb 1.03 1.40 -0.02 0.00 -1.52 0.00 0.00 31.29 32.18 2dd5 h VAL 9 CO 0.09 0.13 -0.16 0.45 0.02 0.00 0.00 177.57 178.09 2dd5 h HIS 10 N -0.12 0.63 -0.74 1.57 3.86 -1.18 -0.93 115.15 118.25 2dd5 h HIS 10 Ca 0.01 -0.11 -0.05 0.00 -1.16 0.00 0.00 60.37 59.06 2dd5 h HIS 10 Cb 0.20 -0.16 -0.03 0.00 1.06 0.00 0.00 27.41 28.47 2dd5 h HIS 10 CO -0.01 0.71 0.26 -0.09 0.86 0.00 0.00 177.93 179.66 2dd5 h ARG 11 N 0.52 1.12 0.13 2.45 2.43 -1.15 -2.38 114.38 117.49 2dd5 h ARG 11 Ca 0.09 -0.21 -0.01 0.00 -0.81 0.00 0.00 59.98 59.04 2dd5 h ARG 11 Cb 0.58 -0.17 0.00 0.00 -0.42 0.00 0.00 29.97 29.96 2dd5 h ARG 11 CO 0.04 0.93 -0.06 1.25 -1.51 0.00 0.00 179.97 180.61 2dd5 h HIS 12 N 1.08 -0.17 -0.54 2.20 2.76 -0.46 -1.20 115.15 118.83 2dd5 h HIS 12 Ca 0.24 -0.00 0.16 0.00 -2.20 0.00 0.00 60.37 58.56 2dd5 h HIS 12 Cb 0.25 0.06 -0.02 0.00 1.55 0.00 0.00 27.41 29.24 2dd5 h HIS 12 CO 0.02 0.02 0.40 -0.07 -1.30 0.00 0.00 177.93 177.00 2dd5 h LEU 13 N -0.33 0.00 0.09 0.26 3.38 -0.97 -1.47 115.31 116.27 2dd5 h LEU 13 Ca -0.02 0.00 -0.31 0.00 0.09 0.00 0.00 57.88 57.64 2dd5 h LEU 13 Cb 0.27 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.00 2dd5 h LEU 13 CO 0.03 0.00 -1.64 1.23 0.09 0.00 0.00 178.44 178.15 2dd5 h GLY 14 N 0.00 0.21 1.13 0.83 0.00 -1.20 -3.38 103.07 100.66 2dd5 h GLY 14 Ca 0.26 -0.55 -0.14 0.00 0.00 0.00 0.00 47.33 46.90 2dd5 h GLY 14 CO -0.00 0.48 -0.25 -0.84 0.00 0.00 0.00 176.54 175.93 2dd5 h THR 15 N 0.05 1.27 -0.04 4.70 2.02 -0.24 -2.96 112.91 117.71 2dd5 h THR 15 Ca -0.28 -1.41 0.01 0.00 0.77 0.00 0.00 66.41 65.50 2dd5 h THR 15 Cb 2.01 1.17 -0.00 0.00 -1.74 0.00 0.00 68.15 69.58 2dd5 h THR 15 CO 0.13 0.49 0.06 -0.37 0.37 0.00 0.00 175.52 176.19 2dd5 h VAL 16 N 0.84 0.41 0.00 3.16 -1.51 -1.50 -0.26 116.25 117.39 2dd5 h VAL 16 Ca 0.10 0.00 -0.02 0.00 -1.23 0.00 0.00 66.70 65.55 2dd5 h VAL 16 Cb 0.83 0.95 -0.00 0.00 -2.13 0.00 0.00 31.29 30.94 2dd5 h VAL 16 CO 0.07 0.00 -0.10 0.00 -1.23 0.00 0.00 177.57 176.31 2dd5 h ALA 17 N 1.92 1.68 0.00 5.19 0.00 -1.69 -0.99 119.26 125.37 2dd5 h ALA 17 Ca 0.02 -0.09 -0.05 0.00 0.00 0.00 0.00 54.91 54.79 2dd5 h ALA 17 Cb 0.14 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 2dd5 h ALA 17 CO -0.00 0.13 -0.22 -0.07 0.00 0.00 0.00 179.25 179.09 2dd5 h LEU 18 N 0.00 0.00 -1.84 0.00 3.38 -1.19 -2.71 115.31 112.95 2dd5 h LEU 18 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2dd5 h LEU 18 Cb 0.20 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.95 2dd5 h LEU 18 CO 0.01 0.22 0.00 0.23 0.09 0.00 0.00 178.44 178.99 2dd5 n MET 19 N -3.72 2.20 -1.66 1.13 2.81 -0.39 -4.94 117.12 112.56 2dd5 n MET 19 Ca -0.01 -1.82 -0.51 0.00 -1.81 0.00 0.00 57.70 53.55 2dd5 n MET 19 Cb 0.33 -1.46 -0.05 0.00 -0.71 0.00 0.00 33.22 31.32 2dd5 n MET 19 CO 0.00 0.00 0.00 0.94 1.51 0.00 0.00 175.97 178.42 2dd5 n GLN 20 N 1.04 1.81 -1.75 0.03 -0.06 -1.02 -4.89 117.38 112.53 2dd5 n GLN 20 Ca 0.18 0.64 -0.38 0.00 -2.00 0.00 0.00 57.00 55.44 2dd5 n GLN 20 Cb 0.50 -2.53 0.05 0.00 -4.06 0.00 0.00 30.24 24.20 2dd5 n GLN 20 CO 0.00 0.00 0.00 -2.14 -0.20 0.00 0.00 177.06 174.72 2dd5 s PRO 21 N 4.35 2.98 0.20 3.69 0.02 -1.26 -5.03 135.00 139.95 2dd5 s PRO 21 Ca 0.97 2.21 -0.21 0.00 0.02 0.00 0.00 61.00 63.99 2dd5 s PRO 21 Cb -0.78 -2.15 0.04 0.00 0.02 0.00 0.00 34.50 31.63 2dd5 s PRO 21 CO 0.54 -1.31 0.61 0.00 -0.33 0.00 0.00 177.00 176.51 2dd5 s ALA 22 N -1.31 -1.31 -0.49 -1.55 0.00 -1.26 -5.09 121.76 110.74 2dd5 s ALA 22 Ca 0.75 0.07 -0.14 0.00 0.00 0.00 0.00 51.96 52.64 2dd5 s ALA 22 Cb -0.40 0.86 0.10 0.00 0.00 0.00 0.00 23.12 23.69 2dd5 s ALA 22 CO 0.46 -0.85 0.42 -0.51 0.00 0.00 0.00 175.76 175.28 2dd5 s LEU 23 N -2.83 5.81 -0.43 0.00 1.43 -1.26 -5.03 118.68 116.37 2dd5 s LEU 23 Ca 0.06 -1.61 -0.15 0.00 -1.03 0.00 0.00 54.13 51.40 2dd5 s LEU 23 Cb -0.02 -2.15 0.04 0.00 0.03 0.00 0.00 46.19 44.09 2dd5 s LEU 23 CO -0.05 -0.73 0.32 -2.28 0.23 0.00 0.00 176.35 173.85 2dd5 s HIS 24 N 1.56 3.24 -0.42 0.29 2.46 -1.26 -5.05 115.29 116.12 2dd5 s HIS 24 Ca 0.04 -0.76 -0.08 0.00 0.47 0.00 0.00 55.06 54.73 2dd5 s HIS 24 Cb -0.27 -2.77 0.08 0.00 -0.13 0.00 0.00 32.58 29.50 2dd5 s HIS 24 CO 0.04 -0.67 0.26 -1.14 -2.47 0.00 0.00 174.74 170.75 2dd5 s GLN 25 N 1.65 2.54 0.38 2.88 0.74 -1.26 -5.07 119.66 121.52 2dd5 s GLN 25 Ca 0.04 -1.51 -0.26 0.00 0.05 0.00 0.00 55.36 53.68 2dd5 s GLN 25 Cb -0.21 -3.76 -0.09 0.00 1.10 0.00 0.00 33.01 30.05 2dd5 s GLN 25 CO 0.08 -0.98 1.27 -0.65 -0.55 0.00 0.00 175.29 174.46 2dd5 s GLN 26 N 1.39 4.09 -0.15 1.67 -0.21 -1.26 -5.01 119.66 120.18 2dd5 s GLN 26 Ca 0.03 2.08 -0.03 0.00 0.02 0.00 0.00 55.36 57.46 2dd5 s GLN 26 Cb -0.23 -2.82 -0.03 0.00 1.00 0.00 0.00 33.01 30.93 2dd5 s GLN 26 CO 0.01 -0.37 -0.04 0.95 -2.12 0.00 0.00 175.29 173.72 2dd5 s THR 27 N -1.27 3.83 -0.50 -0.19 -4.23 -1.26 -5.05 115.64 106.97 2dd5 s THR 27 Ca 0.55 -0.38 0.05 0.00 -1.18 0.00 0.00 61.69 60.73 2dd5 s THR 27 Cb -0.36 -2.67 0.20 0.00 1.34 0.00 0.00 72.50 71.00 2dd5 s THR 27 CO 0.47 0.50 0.47 0.00 -0.54 0.00 0.00 174.62 175.52 2dd5 n HIS 28 N 3.51 0.77 -3.62 3.99 1.44 -1.26 -4.94 115.22 115.10 2dd5 n HIS 28 Ca -0.17 -3.71 -0.26 0.00 -2.01 0.00 0.00 57.72 51.56 2dd5 n HIS 28 Cb 0.52 -0.19 0.03 0.00 0.12 0.00 0.00 29.99 30.47 2dd5 n HIS 28 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 2dd5 n ALA 29 N 2.03 -2.59 -1.23 1.59 0.00 -1.26 -4.92 120.51 114.13 2dd5 n ALA 29 Ca 0.26 -0.22 -0.32 0.00 0.00 0.00 0.00 53.44 53.15 2dd5 n ALA 29 Cb 0.45 -3.15 0.10 0.00 0.00 0.00 0.00 19.45 16.85 2dd5 n ALA 29 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2dd5 s PRO 30 N -5.41 2.11 0.76 0.00 0.04 -1.26 -5.00 135.00 126.24 2dd5 s PRO 30 Ca 0.33 1.43 -0.12 0.00 0.04 0.00 0.00 61.00 62.68 2dd5 s PRO 30 Cb -0.12 -1.86 0.05 0.00 0.04 0.00 0.00 34.50 32.61 2dd5 s PRO 30 CO 0.85 -1.79 1.11 0.00 0.04 0.00 0.00 177.00 177.21 2dd5 s ALA 31 N -2.52 2.21 0.45 8.56 0.00 -1.26 -4.90 121.76 124.31 2dd5 s ALA 31 Ca 0.66 0.42 0.18 0.00 0.00 0.00 0.00 51.96 53.22 2dd5 s ALA 31 Cb -0.22 -3.32 1.14 0.00 0.00 0.00 0.00 23.12 20.73 2dd5 s ALA 31 CO 0.50 -1.76 1.94 -1.35 0.00 0.00 0.00 175.76 175.09 2dd5 h PRO 32 N -0.86 0.30 0.00 0.00 0.11 -1.95 0.09 132.00 129.68 2dd5 h PRO 32 Ca -0.45 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.65 2dd5 h PRO 32 Cb 1.24 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.29 2dd5 h PRO 32 CO 0.51 0.20 0.00 0.25 -0.21 0.00 0.00 178.00 178.74 2dd5 n THR 33 N -4.45 0.96 0.82 -1.15 -2.24 -1.26 -1.62 114.28 105.34 2dd5 n THR 33 Ca 0.13 0.24 0.12 0.00 -2.27 0.00 0.00 64.05 62.27 2dd5 n THR 33 Cb 0.54 -1.00 0.14 0.00 -2.10 0.00 0.00 70.33 67.91 2dd5 n THR 33 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2dd5 n GLU 34 N -1.45 2.37 -3.60 -0.78 -0.58 0.02 -4.84 120.64 111.77 2dd5 n GLU 34 Ca 0.04 -2.01 -0.40 0.00 -0.42 0.00 0.00 57.16 54.37 2dd5 n GLU 34 Cb 0.15 -1.48 -0.11 0.00 -0.57 0.00 0.00 31.44 29.43 2dd5 n GLU 34 CO 0.00 0.00 0.00 0.42 -0.48 0.00 0.00 177.13 177.07 2dd5 s ILE 35 N -1.86 4.49 0.78 -3.67 -1.09 -0.64 -5.00 121.20 114.21 2dd5 s ILE 35 Ca 0.31 -0.94 -0.10 0.00 -2.23 0.00 0.00 60.65 57.69 2dd5 s ILE 35 Cb 0.21 -3.54 0.08 0.00 -1.58 0.00 0.00 42.46 37.63 2dd5 s ILE 35 CO 0.31 -0.27 1.12 0.42 -1.23 0.00 0.00 174.94 175.29 2dd5 s THR 36 N 1.53 2.11 0.21 2.92 -4.23 -1.26 -4.84 115.64 112.08 2dd5 s THR 36 Ca 0.02 -0.11 -0.09 0.00 -1.18 0.00 0.00 61.69 60.32 2dd5 s THR 36 Cb -0.20 -2.99 0.17 0.00 1.34 0.00 0.00 72.50 70.82 2dd5 s THR 36 CO 0.06 0.00 1.87 -0.74 -0.54 0.00 0.00 174.62 175.27 2dd5 h HIS 37 N -0.91 1.03 -0.33 3.99 2.76 -1.99 0.12 115.15 119.82 2dd5 h HIS 37 Ca -0.45 0.01 0.02 0.00 -2.20 0.00 0.00 60.37 57.74 2dd5 h HIS 37 Cb 1.32 -0.34 -0.02 0.00 1.55 0.00 0.00 27.41 29.91 2dd5 h HIS 37 CO 0.23 0.68 0.18 1.15 -1.30 0.00 0.00 177.93 178.87 2dd5 h THR 38 N 1.08 1.02 -0.62 6.26 2.02 -1.99 -0.38 112.91 120.29 2dd5 h THR 38 Ca 0.29 -0.13 -0.07 0.00 0.77 0.00 0.00 66.41 67.27 2dd5 h THR 38 Cb -0.07 0.61 -0.03 0.00 -1.74 0.00 0.00 68.15 66.93 2dd5 h THR 38 CO -0.06 0.07 0.13 -0.07 0.37 0.00 0.00 175.52 175.97 2dd5 h LEU 39 N 0.38 0.96 -0.25 2.58 4.07 -1.84 -1.18 115.31 120.02 2dd5 h LEU 39 Ca 0.13 -0.24 0.02 0.00 0.08 0.00 0.00 57.88 57.87 2dd5 h LEU 39 Cb 0.02 -0.25 -0.02 0.00 1.08 0.00 0.00 40.66 41.49 2dd5 h LEU 39 CO -0.07 0.95 0.12 0.15 -1.08 0.00 0.00 178.44 178.51 2dd5 h PHE 40 N 0.92 0.22 -0.56 1.13 3.57 -0.52 0.10 116.94 121.80 2dd5 h PHE 40 Ca 0.19 0.01 -0.06 0.00 3.53 0.00 0.00 57.97 61.65 2dd5 h PHE 40 Cb 0.38 -0.06 -0.03 0.00 2.79 0.00 0.00 35.95 39.03 2dd5 h PHE 40 CO 0.03 0.12 0.12 -0.09 -2.23 0.00 0.00 178.31 176.26 2dd5 h ARG 41 N 0.26 0.88 -0.29 1.11 2.43 -0.89 -1.95 114.38 115.93 2dd5 h ARG 41 Ca 0.10 -0.19 -0.08 0.00 -0.81 0.00 0.00 59.98 59.00 2dd5 h ARG 41 Cb 0.03 -0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 29.45 2dd5 h ARG 41 CO -0.07 0.80 -0.13 0.00 -1.51 0.00 0.00 179.97 179.06 2dd5 h ALA 42 N 1.29 0.40 -0.05 2.80 0.00 -0.66 -2.57 119.26 120.47 2dd5 h ALA 42 Ca 0.18 -0.32 -0.10 0.00 0.00 0.00 0.00 54.91 54.68 2dd5 h ALA 42 Cb 0.33 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 2dd5 h ALA 42 CO 0.00 0.28 -0.43 1.88 0.00 0.00 0.00 179.25 180.98 2dd5 h TYR 43 N 0.34 0.12 -0.53 0.00 0.05 -0.70 -2.91 116.97 113.35 2dd5 h TYR 43 Ca 0.07 -0.03 0.00 0.00 0.05 0.00 0.00 58.73 58.81 2dd5 h TYR 43 Cb 0.64 -0.03 0.00 0.00 1.01 0.00 0.00 36.73 38.35 2dd5 h TYR 43 CO 0.06 0.52 0.00 0.25 -1.05 0.00 0.00 178.16 177.93 2dd5 n THR 44 N -4.02 1.46 -1.04 -2.88 -2.24 -0.74 -4.96 114.28 99.86 2dd5 n THR 44 Ca -0.02 -0.94 -0.30 0.00 -2.27 0.00 0.00 64.05 60.52 2dd5 n THR 44 Cb 0.47 0.05 0.15 0.00 -2.10 0.00 0.00 70.33 68.89 2dd5 n THR 44 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2dd5 s ARG 45 N -1.78 1.13 -0.35 -0.78 1.70 -0.97 -4.98 118.95 112.92 2dd5 s ARG 45 Ca 0.41 1.03 -0.17 0.00 -0.47 0.00 0.00 55.73 56.53 2dd5 s ARG 45 Cb 0.26 -1.78 -0.01 0.00 -0.57 0.00 0.00 34.95 32.86 2dd5 s ARG 45 CO 0.20 -2.39 0.47 0.08 -1.08 0.00 0.00 175.30 172.58 2dd5 s VAL 46 N -2.81 5.06 0.39 4.99 1.01 -1.26 -4.98 120.40 122.80 2dd5 s VAL 46 Ca 0.64 0.26 0.20 0.00 0.00 0.00 0.00 61.98 63.08 2dd5 s VAL 46 Cb -0.20 -3.92 0.40 0.00 0.00 0.00 0.00 36.38 32.67 2dd5 s VAL 46 CO 0.58 -0.17 1.70 -0.65 0.00 0.00 0.00 175.10 176.56 2dd5 h PRO 47 N 8.45 0.29 0.00 2.72 0.11 -1.83 -2.57 132.00 139.18 2dd5 h PRO 47 Ca -0.28 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.81 2dd5 h PRO 47 Cb 1.13 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.17 2dd5 h PRO 47 CO 0.75 0.19 0.00 -2.39 -0.21 0.00 0.00 178.00 176.34 2dd5 n HIS 48 N -4.76 0.67 -2.69 0.65 1.44 -1.16 -4.47 115.22 104.91 2dd5 n HIS 48 Ca 0.30 0.24 -0.43 0.00 -2.01 0.00 0.00 57.72 55.82 2dd5 n HIS 48 Cb 1.06 -0.89 -0.00 0.00 0.12 0.00 0.00 29.99 30.27 2dd5 n HIS 48 CO 0.00 0.00 0.00 0.34 -2.81 0.00 0.00 176.34 173.87 2dd5 s ASP 49 N -4.05 6.85 0.00 4.39 2.15 -0.97 -4.71 116.67 120.33 2dd5 s ASP 49 Ca 0.07 -2.45 0.16 0.00 0.43 0.00 0.00 52.55 50.75 2dd5 s ASP 49 Cb 0.11 -2.52 -0.08 0.00 -0.30 0.00 0.00 42.92 40.12 2dd5 s ASP 49 CO 0.43 -1.10 0.77 1.33 -0.17 0.00 0.00 175.17 176.43 2dd5 n VAL 50 N 5.95 0.00 -1.66 1.11 0.24 -1.26 -4.99 118.33 117.71 2dd5 n VAL 50 Ca 0.43 -0.24 -0.51 0.00 -2.04 0.00 0.00 64.34 61.97 2dd5 n VAL 50 Cb 0.46 1.11 -0.06 0.00 -1.47 0.00 0.00 33.84 33.88 2dd5 n VAL 50 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2dd5 n GLY 51 N 1.25 0.99 0.40 7.63 0.00 -1.26 -1.88 105.19 112.30 2dd5 n GLY 51 Ca 0.05 0.79 0.00 0.00 0.00 0.00 0.00 46.02 46.86 2dd5 n GLY 51 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2dd5 n GLY 52 N 3.67 0.57 3.77 -0.02 0.00 -1.26 -5.06 105.19 106.86 2dd5 n GLY 52 Ca 0.21 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.84 2dd5 n GLY 52 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2dd5 s GLU 53 N -0.87 4.31 0.32 1.61 2.02 -0.79 -4.97 118.70 120.34 2dd5 s GLU 53 Ca 0.00 1.97 -0.29 0.00 0.02 0.00 0.00 54.97 56.68 2dd5 s GLU 53 Cb 0.00 -2.95 -0.10 0.00 0.10 0.00 0.00 34.13 31.18 2dd5 s GLU 53 CO 0.00 -0.14 1.27 0.00 0.02 0.00 0.00 175.26 176.42 2dd5 s ALA 54 N -1.25 3.48 0.18 5.21 0.00 -1.26 -5.02 121.76 123.11 2dd5 s ALA 54 Ca 0.51 1.20 -0.14 0.00 0.00 0.00 0.00 51.96 53.53 2dd5 s ALA 54 Cb -0.34 -3.45 0.01 0.00 0.00 0.00 0.00 23.12 19.34 2dd5 s ALA 54 CO 0.45 -0.57 0.43 0.34 0.00 0.00 0.00 175.76 176.41 2dd5 s ASP 55 N -0.54 -0.15 0.55 0.00 -1.08 -1.26 -5.18 116.67 109.01 2dd5 s ASP 55 Ca 0.48 -0.62 0.00 0.00 -0.52 0.00 0.00 52.55 51.90 2dd5 s ASP 55 Cb -0.39 0.52 0.03 0.00 -1.46 0.00 0.00 42.92 41.63 2dd5 s ASP 55 CO 0.51 -0.99 0.78 0.68 0.52 0.00 0.00 175.17 176.67 2dd5 s VAL 56 N -3.90 2.85 0.28 1.11 -7.23 -1.26 -5.07 120.40 107.18 2dd5 s VAL 56 Ca 0.12 -0.59 -0.27 0.00 -1.81 0.00 0.00 61.98 59.43 2dd5 s VAL 56 Cb 0.01 -3.08 -0.09 0.00 0.56 0.00 0.00 36.38 33.77 2dd5 s VAL 56 CO -0.02 -0.06 0.91 -2.84 -0.31 0.00 0.00 175.10 172.78 2dd5 s PRO 57 N -4.77 4.64 0.03 4.82 0.02 -1.26 -5.05 135.00 133.43 2dd5 s PRO 57 Ca 0.56 1.33 0.00 0.00 0.02 0.00 0.00 61.00 62.91 2dd5 s PRO 57 Cb -0.10 -2.99 -0.02 0.00 0.02 0.00 0.00 34.50 31.41 2dd5 s PRO 57 CO 0.39 0.38 -0.04 0.96 -0.33 0.00 0.00 177.00 178.36 2dd5 s ILE 58 N -1.44 0.25 -0.70 2.83 -0.00 -1.26 -5.08 121.20 115.80 2dd5 s ILE 58 Ca 0.46 -1.10 -0.27 0.00 -0.00 0.00 0.00 60.65 59.73 2dd5 s ILE 58 Cb -0.21 -0.56 0.03 0.00 -0.00 0.00 0.00 42.46 41.72 2dd5 s ILE 58 CO 0.26 -0.55 1.27 -0.70 -0.00 0.00 0.00 174.94 175.23 2dd5 s GLU 59 N -1.89 3.26 0.39 0.37 2.12 -1.26 -4.97 118.70 116.72 2dd5 s GLU 59 Ca -0.11 -0.10 -0.27 0.00 0.36 0.00 0.00 54.97 54.85 2dd5 s GLU 59 Cb -0.07 -4.14 -0.11 0.00 0.26 0.00 0.00 34.13 30.07 2dd5 s GLU 59 CO -0.02 -2.05 1.40 0.66 -0.54 0.00 0.00 175.26 174.71 2dd5 n TYR 60 N 9.22 2.66 -4.28 5.30 4.01 -1.26 -5.02 117.16 127.79 2dd5 n TYR 60 Ca 0.05 0.48 -0.16 0.00 -0.16 0.00 0.00 57.90 58.11 2dd5 n TYR 60 Cb 0.49 -2.47 -0.10 0.00 -0.31 0.00 0.00 39.34 36.95 2dd5 n TYR 60 CO 0.00 0.00 0.00 -3.38 -0.46 0.00 0.00 176.86 173.02 2dd5 s HIS 61 N -1.13 1.40 0.49 -0.72 -3.43 -1.26 -5.15 115.29 105.49 2dd5 s HIS 61 Ca 0.56 -0.75 0.01 0.00 -0.80 0.00 0.00 55.06 54.08 2dd5 s HIS 61 Cb -0.50 -0.72 0.01 0.00 -1.43 0.00 0.00 32.58 29.94 2dd5 s HIS 61 CO 0.62 0.12 0.71 -1.21 -2.00 0.00 0.00 174.74 172.97 2dd5 s GLU 62 N -3.75 2.86 -0.07 -0.38 0.41 -1.26 -5.11 118.70 111.40 2dd5 s GLU 62 Ca 0.20 -0.61 -0.04 0.00 -0.41 0.00 0.00 54.97 54.10 2dd5 s GLU 62 Cb 0.02 -2.53 0.03 0.00 -1.78 0.00 0.00 34.13 29.87 2dd5 s GLU 62 CO 0.03 -0.44 0.17 0.21 -0.49 0.00 0.00 175.26 174.74 2dd5 s LYS 63 N -4.63 0.15 0.47 1.61 2.20 -1.26 -5.14 119.74 113.14 2dd5 s LYS 63 Ca 0.52 0.33 -0.24 0.00 -0.36 0.00 0.00 55.97 56.23 2dd5 s LYS 63 Cb -0.10 -0.06 -0.07 0.00 -1.51 0.00 0.00 37.83 36.09 2dd5 s LYS 63 CO 0.38 -0.11 1.28 -1.21 -0.36 0.00 0.00 175.35 175.33 2dd5 s GLU 64 N 0.74 3.64 0.06 4.03 2.02 -1.26 -4.97 118.70 122.97 2dd5 s GLU 64 Ca -0.05 2.07 -0.30 0.00 0.02 0.00 0.00 54.97 56.70 2dd5 s GLU 64 Cb -0.07 -2.49 -0.05 0.00 0.10 0.00 0.00 34.13 31.62 2dd5 s GLU 64 CO -0.04 -0.74 0.96 -2.00 0.02 0.00 0.00 175.26 173.46 2dd5 s GLU 65 N -2.60 4.64 0.40 1.61 2.12 -1.26 -5.04 118.70 118.57 2dd5 s GLU 65 Ca 0.64 1.42 -0.20 0.00 0.36 0.00 0.00 54.97 57.18 2dd5 s GLU 65 Cb -0.36 -3.41 -0.10 0.00 0.26 0.00 0.00 34.13 30.52 2dd5 s GLU 65 CO 0.44 0.11 0.90 -1.21 -0.54 0.00 0.00 175.26 174.97 2dd5 s GLU 66 N 0.39 4.21 0.21 4.30 0.41 -1.26 -4.96 118.70 122.00 2dd5 s GLU 66 Ca 0.48 1.03 -0.09 0.00 -0.41 0.00 0.00 54.97 55.99 2dd5 s GLU 66 Cb -0.22 -2.29 0.25 0.00 -1.78 0.00 0.00 34.13 30.09 2dd5 s GLU 66 CO 0.29 0.04 1.81 0.82 -0.49 0.00 0.00 175.26 177.73 2dd5 h ILE 67 N 1.99 0.96 0.00 -1.63 1.08 -2.00 -1.31 117.51 116.61 2dd5 h ILE 67 Ca -0.49 -0.24 -0.06 0.00 -0.39 0.00 0.00 64.86 63.68 2dd5 h ILE 67 Cb 1.18 0.21 -0.01 0.00 -3.07 0.00 0.00 36.82 35.13 2dd5 h ILE 67 CO 0.62 0.13 -0.29 4.11 -0.69 0.00 0.00 178.15 182.03 2dd5 h TRP 68 N 0.70 0.00 -0.34 1.37 5.08 -1.99 -1.46 115.95 119.31 2dd5 h TRP 68 Ca 0.31 0.00 -0.09 0.00 1.08 0.00 0.00 58.89 60.19 2dd5 h TRP 68 Cb 0.20 0.00 -0.01 0.00 -3.00 0.00 0.00 29.16 26.35 2dd5 h TRP 68 CO -0.08 0.29 -0.13 0.93 -1.28 0.00 0.00 178.44 178.17 2dd5 h GLU 69 N 0.00 0.69 -0.41 0.12 5.08 -1.64 0.19 114.58 118.60 2dd5 h GLU 69 Ca -0.00 -0.29 -0.02 0.00 -1.00 0.00 0.00 59.36 58.05 2dd5 h GLU 69 Cb 0.55 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.76 2dd5 h GLU 69 CO 0.04 0.88 0.17 1.25 -1.00 0.00 0.00 179.01 180.35 2dd5 h LEU 70 N 0.47 0.55 -1.01 1.33 5.85 -1.05 0.68 115.31 122.14 2dd5 h LEU 70 Ca 0.08 -0.15 -0.03 0.00 0.84 0.00 0.00 57.88 58.62 2dd5 h LEU 70 Cb 0.65 -0.14 -0.04 0.00 0.37 0.00 0.00 40.66 41.50 2dd5 h LEU 70 CO 0.04 0.56 0.37 0.78 -0.34 0.00 0.00 178.44 179.85 2dd5 h ASN 71 N 0.52 0.97 -0.30 1.25 2.35 -1.11 -0.20 115.58 119.06 2dd5 h ASN 71 Ca 0.14 -0.10 -0.04 0.00 -0.55 0.00 0.00 56.30 55.74 2dd5 h ASN 71 Cb 0.17 -0.25 -0.01 0.00 0.05 0.00 0.00 38.32 38.28 2dd5 h ASN 71 CO -0.01 0.81 0.01 0.74 -1.65 0.00 0.00 177.43 177.34 2dd5 h THR 72 N 1.07 1.25 -0.36 2.81 2.02 -0.19 -0.37 112.91 119.14 2dd5 h THR 72 Ca 0.26 -0.90 0.01 0.00 0.77 0.00 0.00 66.41 66.55 2dd5 h THR 72 Cb 0.09 1.25 -0.02 0.00 -1.74 0.00 0.00 68.15 67.73 2dd5 h THR 72 CO -0.04 0.29 0.22 0.15 0.37 0.00 0.00 175.52 176.52 2dd5 h PHE 73 N 0.32 0.41 -0.86 3.16 3.57 -0.46 -0.56 116.94 122.53 2dd5 h PHE 73 Ca 0.09 0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.58 2dd5 h PHE 73 Cb 0.41 -0.13 -0.04 0.00 2.79 0.00 0.00 35.95 38.97 2dd5 h PHE 73 CO 0.03 0.25 0.45 0.00 -2.23 0.00 0.00 178.31 176.80 2dd5 h ALA 74 N 1.15 1.10 -0.39 2.41 0.00 -0.92 -1.87 119.26 120.75 2dd5 h ALA 74 Ca 0.14 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 2dd5 h ALA 74 Cb -0.01 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 17.42 2dd5 h ALA 74 CO -0.06 0.63 0.19 1.15 0.00 0.00 0.00 179.25 181.16 2dd5 h THR 75 N 1.20 1.17 -0.75 0.00 2.02 -0.48 -0.08 112.91 115.99 2dd5 h THR 75 Ca 0.30 -0.48 -0.05 0.00 0.77 0.00 0.00 66.41 66.95 2dd5 h THR 75 Cb 0.07 0.78 -0.03 0.00 -1.74 0.00 0.00 68.15 67.22 2dd5 h THR 75 CO -0.04 0.18 0.27 0.00 0.37 0.00 0.00 175.52 176.30 2dd5 h GLU 77 N 1.10 0.34 -0.27 0.00 4.39 -1.21 -2.72 114.58 116.20 2dd5 h GLU 77 Ca 0.25 -0.25 -0.11 0.00 0.34 0.00 0.00 59.36 59.58 2dd5 h GLU 77 Cb 0.25 0.05 -0.01 0.00 -0.10 0.00 0.00 28.75 28.94 2dd5 h GLU 77 CO -0.02 0.88 -0.31 0.00 -1.16 0.00 0.00 179.01 178.41 2dd5 h LEU 79 N 0.49 0.43 -0.02 0.00 3.38 -1.09 -0.12 115.31 118.39 2dd5 h LEU 79 Ca 0.06 -0.13 -0.08 0.00 0.09 0.00 0.00 57.88 57.82 2dd5 h LEU 79 Cb 0.78 -0.12 0.01 0.00 0.09 0.00 0.00 40.66 41.42 2dd5 h LEU 79 CO 0.06 0.65 -0.31 0.00 0.09 0.00 0.00 178.44 178.94 2dd5 h ALA 80 N 1.39 0.06 -0.56 1.53 0.00 -1.13 0.22 119.26 120.77 2dd5 h ALA 80 Ca 0.07 -0.47 0.11 0.00 0.00 0.00 0.00 54.91 54.62 2dd5 h ALA 80 Cb 0.58 0.01 -0.09 0.00 0.00 0.00 0.00 17.79 18.30 2dd5 h ALA 80 CO 0.04 0.13 0.03 2.35 0.00 0.00 0.00 179.25 181.81 2dd5 h TRP 81 N -0.37 0.02 -0.17 0.00 7.01 -0.07 -0.84 115.95 121.53 2dd5 h TRP 81 Ca -0.03 0.04 0.00 0.00 2.11 0.00 0.00 58.89 61.01 2dd5 h TRP 81 Cb 1.03 0.08 0.00 0.00 -2.10 0.00 0.00 29.16 28.16 2dd5 h TRP 81 CO 0.16 -0.11 0.00 0.54 -2.79 0.00 0.00 178.44 176.24 2dd5 n ARG 82 N -5.22 1.69 -1.01 2.65 5.12 -0.07 -4.92 116.66 114.90 2dd5 n ARG 82 Ca 0.07 -0.75 -0.00 0.00 -1.93 0.00 0.00 57.85 55.24 2dd5 n ARG 82 Cb 0.31 -1.39 -0.00 0.00 -1.16 0.00 0.00 32.46 30.22 2dd5 n ARG 82 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2dd5 n GLY 83 N 0.53 0.47 0.20 -0.13 0.00 -0.32 -4.92 105.19 101.01 2dd5 n GLY 83 Ca 0.07 -0.17 -0.02 0.00 0.00 0.00 0.00 46.02 45.90 2dd5 n GLY 83 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2dd5 h VAL 84 N 0.00 1.30 -2.67 1.61 2.07 -0.79 -3.47 116.25 114.30 2dd5 h VAL 84 Ca -0.01 -1.45 0.12 0.00 0.82 0.00 0.00 66.70 66.19 2dd5 h VAL 84 Cb 0.10 1.62 -0.07 0.00 -1.52 0.00 0.00 31.29 31.42 2dd5 h VAL 84 CO 0.01 0.44 0.36 -1.66 0.02 0.00 0.00 177.57 176.73 2dd5 s TRP 85 N -4.21 -0.16 0.27 1.57 -2.14 -1.22 -5.02 118.94 108.03 2dd5 s TRP 85 Ca -0.05 -0.22 0.07 0.00 2.66 0.00 0.00 56.10 58.56 2dd5 s TRP 85 Cb 0.13 0.67 -0.03 0.00 -3.10 0.00 0.00 33.47 31.15 2dd5 s TRP 85 CO 0.77 -1.03 0.27 0.95 -2.66 0.00 0.00 176.95 175.25 2dd5 s THR 86 N -3.60 4.44 0.40 0.66 -4.23 -1.26 -4.08 115.64 107.97 2dd5 s THR 86 Ca 0.12 -1.27 0.09 0.00 -1.18 0.00 0.00 61.69 59.44 2dd5 s THR 86 Cb -0.04 -3.47 0.30 0.00 1.34 0.00 0.00 72.50 70.63 2dd5 s THR 86 CO 0.05 -0.30 1.99 0.00 -0.54 0.00 0.00 174.62 175.81 2dd5 h ALA 87 N 1.33 1.81 -0.57 3.99 0.00 -1.96 -1.53 119.26 122.34 2dd5 h ALA 87 Ca -0.48 -0.02 -0.07 0.00 0.00 0.00 0.00 54.91 54.34 2dd5 h ALA 87 Cb 1.24 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.86 2dd5 h ALA 87 CO 0.60 0.09 0.09 0.93 0.00 0.00 0.00 179.25 180.95 2dd5 h GLU 88 N 0.59 0.92 -0.59 0.00 4.39 -1.99 0.13 114.58 118.02 2dd5 h GLU 88 Ca 0.26 -0.22 -0.09 0.00 0.34 0.00 0.00 59.36 59.66 2dd5 h GLU 88 Cb 0.29 -0.12 -0.02 0.00 -0.10 0.00 0.00 28.75 28.80 2dd5 h GLU 88 CO -0.08 0.85 0.03 0.93 -1.16 0.00 0.00 179.01 179.59 2dd5 h GLU 89 N 0.87 1.02 -0.01 2.33 5.08 -1.70 -2.12 114.58 120.06 2dd5 h GLU 89 Ca 0.18 -0.31 0.00 0.00 -1.00 0.00 0.00 59.36 58.23 2dd5 h GLU 89 Cb 0.39 -0.10 -0.00 0.00 0.50 0.00 0.00 28.75 29.53 2dd5 h GLU 89 CO 0.01 0.99 0.00 -0.09 -1.00 0.00 0.00 179.01 178.92 2dd5 h ARG 90 N 0.92 0.01 -0.62 2.33 2.43 -0.68 -2.04 114.38 116.73 2dd5 h ARG 90 Ca 0.17 -0.00 0.05 0.00 -0.81 0.00 0.00 59.98 59.40 2dd5 h ARG 90 Cb 0.51 -0.00 -0.05 0.00 -0.42 0.00 0.00 29.97 30.01 2dd5 h ARG 90 CO 0.02 0.00 0.33 0.00 -1.51 0.00 0.00 179.97 178.82 2dd5 h ARG 91 N 0.01 0.60 -0.53 0.20 3.08 -0.62 0.44 114.38 117.57 2dd5 h ARG 91 Ca 0.00 -0.04 -0.01 0.00 0.07 0.00 0.00 59.98 60.00 2dd5 h ARG 91 Cb 0.00 -0.14 -0.02 0.00 0.08 0.00 0.00 29.97 29.89 2dd5 h ARG 91 CO -0.00 0.40 0.28 -0.09 -1.07 0.00 0.00 179.97 179.48 2dd5 h ARG 92 N 0.62 0.75 -0.15 0.04 1.12 -1.25 0.28 114.38 115.79 2dd5 h ARG 92 Ca 0.28 -0.10 -0.18 0.00 -1.11 0.00 0.00 59.98 58.87 2dd5 h ARG 92 Cb 0.17 -0.14 0.01 0.00 -0.01 0.00 0.00 29.97 30.00 2dd5 h ARG 92 CO -0.18 0.59 -0.61 0.87 -3.11 0.00 0.00 179.97 177.53 2dd5 h LYS 93 N 0.71 0.68 0.01 0.20 1.57 -0.95 -0.37 116.57 118.42 2dd5 h LYS 93 Ca 0.18 -0.53 -0.21 0.00 -1.87 0.00 0.00 60.65 58.22 2dd5 h LYS 93 Cb 0.08 0.10 0.02 0.00 0.08 0.00 0.00 32.23 32.51 2dd5 h LYS 93 CO -0.03 1.15 -0.84 0.37 -0.57 0.00 0.00 179.45 179.53 2dd5 h GLN 94 N 0.37 0.54 -0.01 3.15 4.15 -0.02 -3.02 115.11 120.28 2dd5 h GLN 94 Ca -0.03 -0.61 0.00 0.00 0.77 0.00 0.00 58.65 58.78 2dd5 h GLN 94 Cb 1.25 0.18 0.00 0.00 0.21 0.00 0.00 27.48 29.11 2dd5 h GLN 94 CO 0.13 1.22 -0.52 0.09 -1.93 0.00 0.00 178.83 177.83 2dd5 n ASN 95 N -4.03 1.57 0.06 -0.69 3.02 0.98 -4.55 115.26 111.63 2dd5 n ASN 95 Ca -0.11 -1.29 0.00 0.00 -0.03 0.00 0.00 54.58 53.15 2dd5 n ASN 95 Cb 0.79 0.61 0.00 0.00 -0.61 0.00 0.00 39.78 40.57 2dd5 n ASN 95 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2dd5 h ASP 97 N 0.00 0.00 0.34 0.00 5.19 -1.05 -2.02 116.42 118.88 2dd5 h ASP 97 Ca 0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 2dd5 h ASP 97 Cb 0.18 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.69 2dd5 h ASP 97 CO 0.00 0.00 0.00 -0.37 -3.12 0.00 0.00 179.24 175.75 2dd5 h VAL 98 N 0.00 0.00 0.00 -1.35 -1.51 -1.77 -3.49 116.25 108.14 2dd5 h VAL 98 Ca 0.11 -0.13 0.00 0.00 -1.23 0.00 0.00 66.70 65.44 2dd5 h VAL 98 Cb 0.50 0.85 0.00 0.00 -2.13 0.00 0.00 31.29 30.51 2dd5 h VAL 98 CO -0.00 0.00 0.00 0.61 -1.23 0.00 0.00 177.57 176.95 2dd5 n GLY 99 N -0.71 -2.51 0.33 5.19 0.00 -0.76 -4.33 105.19 102.40 2dd5 n GLY 99 Ca -0.00 -1.38 -0.03 0.00 0.00 0.00 0.00 46.02 44.61 2dd5 n GLY 99 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 2dd5 h GLN 100 N 0.00 -0.10 0.17 1.61 5.75 -1.94 -0.10 115.11 120.50 2dd5 h GLN 100 Ca 0.00 0.01 0.00 0.00 -0.15 0.00 0.00 58.65 58.51 2dd5 h GLN 100 Cb 0.00 0.02 -0.01 0.00 1.07 0.00 0.00 27.48 28.56 2dd5 h GLN 100 CO 0.00 -0.06 -0.16 1.15 -2.65 0.00 0.00 178.83 177.11 2dd5 h THR 101 N -0.10 0.65 -0.34 2.39 2.02 -2.00 -2.49 112.91 113.04 2dd5 h THR 101 Ca 0.28 0.00 -0.13 0.00 0.77 0.00 0.00 66.41 67.33 2dd5 h THR 101 Cb 0.56 0.65 -0.01 0.00 -1.74 0.00 0.00 68.15 67.60 2dd5 h THR 101 CO -0.74 0.00 -0.33 0.58 0.37 0.00 0.00 175.52 175.40 2dd5 h VAL 102 N -0.35 1.28 -0.78 3.16 2.07 -1.72 0.17 116.25 120.08 2dd5 h VAL 102 Ca 0.00 -1.48 0.15 0.00 0.82 0.00 0.00 66.70 66.19 2dd5 h VAL 102 Cb 0.33 1.37 -0.10 0.00 -1.52 0.00 0.00 31.29 31.37 2dd5 h VAL 102 CO -0.03 0.48 0.33 0.22 0.02 0.00 0.00 177.57 178.59 2dd5 h TYR 103 N 0.63 0.56 0.00 1.57 3.20 -0.78 -1.78 116.97 120.37 2dd5 h TYR 103 Ca 0.07 0.04 0.00 0.00 3.14 0.00 0.00 58.73 61.97 2dd5 h TYR 103 Cb 0.86 -0.13 0.00 0.00 1.54 0.00 0.00 36.73 39.00 2dd5 h TYR 103 CO 0.04 0.07 -1.23 1.28 -1.64 0.00 0.00 178.16 176.69 2dd5 n LEU 104 N -4.99 0.39 0.05 2.82 4.77 -0.96 -4.56 117.00 114.53 2dd5 n LEU 104 Ca 0.15 -0.26 -0.13 0.00 -0.03 0.00 0.00 56.01 55.74 2dd5 n LEU 104 Cb 0.43 0.00 -0.14 0.00 -2.33 0.00 0.00 43.42 41.39 2dd5 n LEU 104 CO 0.18 0.10 -0.25 1.23 -1.33 0.00 0.00 177.39 177.32 2dd5 h GLY 105 N 3.41 0.18 -2.46 -0.72 0.00 -0.42 -3.47 103.07 99.60 2dd5 h GLY 105 Ca 0.00 -0.46 -0.44 0.00 0.00 0.00 0.00 47.33 46.42 2dd5 h GLY 105 CO 0.00 0.40 -0.21 1.06 0.00 0.00 0.00 176.54 177.79 2dd5 s MET 106 N -2.64 3.00 0.65 4.80 -1.94 -0.69 -5.04 119.30 117.45 2dd5 s MET 106 Ca -0.06 -0.82 -0.14 0.00 -1.71 0.00 0.00 55.69 52.96 2dd5 s MET 106 Cb 0.08 -2.69 -0.01 0.00 2.01 0.00 0.00 34.83 34.22 2dd5 s MET 106 CO 0.84 -0.18 1.07 -2.14 -0.01 0.00 0.00 175.02 174.61 2dd5 s PRO 107 N -4.39 3.01 0.09 2.03 0.02 -1.26 -4.91 135.00 129.58 2dd5 s PRO 107 Ca 0.49 1.19 -0.22 0.00 0.02 0.00 0.00 61.00 62.47 2dd5 s PRO 107 Cb -0.10 -1.99 -0.07 0.00 0.02 0.00 0.00 34.50 32.36 2dd5 s PRO 107 CO 0.34 -1.06 1.37 -0.92 -0.33 0.00 0.00 177.00 176.40 2dd5 h TYR 108 N -0.07 -1.17 0.00 6.54 3.20 -1.97 -0.50 116.97 123.00 2dd5 h TYR 108 Ca -0.46 0.06 0.00 0.00 3.14 0.00 0.00 58.73 61.47 2dd5 h TYR 108 Cb 1.22 0.55 0.00 0.00 1.54 0.00 0.00 36.73 40.04 2dd5 h TYR 108 CO 0.58 -0.33 0.00 0.66 -1.64 0.00 0.00 178.16 177.43 2dd5 n TYR 109 N -4.51 0.81 -0.12 -3.82 4.01 -1.26 -2.17 117.16 110.09 2dd5 n TYR 109 Ca -0.02 0.32 -0.08 0.00 -0.16 0.00 0.00 57.90 57.96 2dd5 n TYR 109 Cb 0.23 -1.01 0.08 0.00 -0.31 0.00 0.00 39.34 38.33 2dd5 n TYR 109 CO 0.00 0.00 0.00 0.78 -0.46 0.00 0.00 176.86 177.18 2dd5 h GLY 110 N 2.30 0.93 1.23 2.72 0.00 -1.46 -1.49 103.07 107.30 2dd5 h GLY 110 Ca 0.00 -0.74 -0.16 0.00 0.00 0.00 0.00 47.33 46.42 2dd5 h GLY 110 CO 0.00 0.68 -0.46 3.21 0.00 0.00 0.00 176.54 179.97 2dd5 h ARG 111 N 0.77 0.82 -0.36 4.80 3.08 -0.93 -1.14 114.38 121.43 2dd5 h ARG 111 Ca 0.12 -0.47 0.02 0.00 0.07 0.00 0.00 59.98 59.72 2dd5 h ARG 111 Cb 0.65 0.03 -0.03 0.00 0.08 0.00 0.00 29.97 30.71 2dd5 h ARG 111 CO 0.05 1.10 0.19 -1.49 -1.07 0.00 0.00 179.97 178.75 2dd5 h TRP 112 N 0.66 0.36 -0.22 3.04 4.06 -1.39 -1.72 115.95 120.73 2dd5 h TRP 112 Ca 0.04 0.01 -0.02 0.00 2.06 0.00 0.00 58.89 60.98 2dd5 h TRP 112 Cb 1.04 -0.11 -0.01 0.00 -1.00 0.00 0.00 29.16 29.08 2dd5 h TRP 112 CO 0.06 0.20 0.05 1.25 -3.56 0.00 0.00 178.44 176.44 2dd5 h LEU 113 N 0.40 0.34 -1.05 -4.49 5.85 -1.14 -1.83 115.31 113.38 2dd5 h LEU 113 Ca 0.14 -0.24 0.03 0.00 0.84 0.00 0.00 57.88 58.65 2dd5 h LEU 113 Cb 0.03 -0.09 -0.05 0.00 0.37 0.00 0.00 40.66 40.92 2dd5 h LEU 113 CO -0.08 0.50 0.64 -0.07 -0.34 0.00 0.00 178.44 179.08 2dd5 h LEU 114 N 0.17 1.07 -0.80 2.25 3.38 -1.12 -1.76 115.31 118.50 2dd5 h LEU 114 Ca 0.07 -0.02 -0.13 0.00 0.09 0.00 0.00 57.88 57.89 2dd5 h LEU 114 Cb 0.29 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.77 2dd5 h LEU 114 CO 0.00 0.75 -0.57 0.74 0.09 0.00 0.00 178.44 179.45 2dd5 h THR 115 N 1.25 1.40 -0.41 0.22 2.02 -1.19 0.49 112.91 116.69 2dd5 h THR 115 Ca 0.37 -1.95 -0.13 0.00 0.77 0.00 0.00 66.41 65.47 2dd5 h THR 115 Cb -0.05 2.03 -0.01 0.00 -1.74 0.00 0.00 68.15 68.37 2dd5 h THR 115 CO -0.10 0.56 -0.26 0.00 0.37 0.00 0.00 175.52 176.08 2dd5 h ALA 116 N 1.36 0.75 -0.54 6.16 0.00 -0.69 -0.30 119.26 126.00 2dd5 h ALA 116 Ca -0.00 -0.40 -0.07 0.00 0.00 0.00 0.00 54.91 54.44 2dd5 h ALA 116 Cb 1.03 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.65 2dd5 h ALA 116 CO 0.08 0.66 0.08 0.00 0.00 0.00 0.00 179.25 180.07 2dd5 h ALA 117 N 0.95 0.72 -0.29 0.00 0.00 -1.02 -3.10 119.26 116.52 2dd5 h ALA 117 Ca 0.09 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.75 2dd5 h ALA 117 Cb 0.82 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.39 2dd5 h ALA 117 CO 0.07 0.47 0.19 -0.09 0.00 0.00 0.00 179.25 179.90 2dd5 h ARG 118 N 0.79 0.38 -0.34 0.00 9.65 -0.47 -2.78 114.38 121.62 2dd5 h ARG 118 Ca 0.16 -0.02 -0.01 0.00 -1.10 0.00 0.00 59.98 59.01 2dd5 h ARG 118 Cb 0.42 -0.09 -0.02 0.00 -1.39 0.00 0.00 29.97 28.90 2dd5 h ARG 118 CO 0.01 0.25 0.17 0.97 2.80 0.00 0.00 179.97 184.17 2dd5 h ILE 119 N 0.40 1.12 -0.83 1.20 6.09 -1.02 0.86 117.51 125.32 2dd5 h ILE 119 Ca 0.11 -0.33 0.00 0.00 -1.37 0.00 0.00 64.86 63.27 2dd5 h ILE 119 Cb -0.04 0.68 -0.04 0.00 0.47 0.00 0.00 36.82 37.89 2dd5 h ILE 119 CO -0.03 0.14 0.53 -0.07 -3.07 0.00 0.00 178.15 175.65 2dd5 h LEU 120 N 0.47 0.97 0.15 2.19 3.38 -1.42 -2.10 115.31 118.95 2dd5 h LEU 120 Ca 0.12 -0.04 -0.24 0.00 0.09 0.00 0.00 57.88 57.81 2dd5 h LEU 120 Cb 0.05 -0.24 0.02 0.00 0.09 0.00 0.00 40.66 40.57 2dd5 h LEU 120 CO -0.02 0.72 -1.09 0.58 0.09 0.00 0.00 178.44 178.72 2dd5 h VAL 121 N 1.13 1.33 -0.46 1.22 2.07 -1.33 0.84 116.25 121.05 2dd5 h VAL 121 Ca 0.30 -2.52 -0.02 0.00 0.82 0.00 0.00 66.70 65.28 2dd5 h VAL 121 Cb -0.10 3.04 -0.02 0.00 -1.52 0.00 0.00 31.29 32.69 2dd5 h VAL 121 CO -0.06 0.73 0.19 0.44 0.02 0.00 0.00 177.57 178.89 2dd5 h ASP 122 N -0.27 0.58 -0.24 0.57 3.32 -0.84 -0.63 116.42 118.91 2dd5 h ASP 122 Ca -0.21 -0.06 0.00 0.00 0.02 0.00 0.00 57.03 56.78 2dd5 h ASP 122 Cb 1.76 -0.15 0.00 0.00 0.22 0.00 0.00 39.33 41.16 2dd5 h ASP 122 CO 0.14 0.53 0.00 0.29 -1.72 0.00 0.00 179.24 178.48 2dd5 n LYS 123 N -4.37 1.79 -2.93 3.56 4.76 -0.80 -4.93 118.16 115.25 2dd5 n LYS 123 Ca 0.03 -1.20 -0.22 0.00 -2.87 0.00 0.00 58.31 54.06 2dd5 n LYS 123 Cb 0.14 -1.36 0.02 0.00 -1.84 0.00 0.00 35.03 32.00 2dd5 n LYS 123 CO 0.00 0.00 0.00 1.04 -1.37 0.00 0.00 177.40 177.07 2dd5 n GLN 124 N 0.44 -3.91 0.17 1.97 6.02 -0.24 -4.86 117.38 116.98 2dd5 n GLN 124 Ca 0.15 0.83 0.07 0.00 -0.01 0.00 0.00 57.00 58.04 2dd5 n GLN 124 Cb 0.33 -5.62 0.09 0.00 1.02 0.00 0.00 30.24 26.06 2dd5 n GLN 124 CO 0.00 0.00 0.00 0.74 -1.01 0.00 0.00 177.06 176.79 2dd5 h PHE 125 N -0.98 0.00 -3.69 1.08 0.04 -1.09 -3.45 116.94 108.85 2dd5 h PHE 125 Ca -0.49 0.00 -0.15 0.00 2.80 0.00 0.00 57.97 60.13 2dd5 h PHE 125 Cb 1.34 0.00 -0.21 0.00 2.20 0.00 0.00 35.95 39.29 2dd5 h PHE 125 CO 0.57 0.26 -0.57 0.14 -0.60 0.00 0.00 178.31 178.11 2dd5 s VAL 126 N -3.08 0.09 0.50 -0.55 -7.23 -0.83 -5.03 120.40 104.27 2dd5 s VAL 126 Ca 0.05 -0.78 -0.06 0.00 -1.81 0.00 0.00 61.98 59.38 2dd5 s VAL 126 Cb 0.06 -0.38 -0.04 0.00 0.56 0.00 0.00 36.38 36.59 2dd5 s VAL 126 CO 0.71 -0.43 0.82 0.42 -0.31 0.00 0.00 175.10 176.31 2dd5 s THR 127 N -1.45 4.88 0.42 5.32 -4.23 -1.26 -4.20 115.64 115.12 2dd5 s THR 127 Ca -0.15 0.29 0.10 0.00 -1.18 0.00 0.00 61.69 60.76 2dd5 s THR 127 Cb -0.08 -3.86 0.20 0.00 1.34 0.00 0.00 72.50 70.10 2dd5 s THR 127 CO 0.00 -0.88 1.99 0.25 -0.54 0.00 0.00 174.62 175.44 2dd5 h LEU 128 N 0.17 0.23 -0.48 4.79 5.85 -1.96 -1.65 115.31 122.26 2dd5 h LEU 128 Ca -0.47 -0.03 -0.01 0.00 0.84 0.00 0.00 57.88 58.21 2dd5 h LEU 128 Cb 1.20 -0.06 -0.02 0.00 0.37 0.00 0.00 40.66 42.15 2dd5 h LEU 128 CO 0.62 0.30 0.25 0.74 -0.34 0.00 0.00 178.44 180.00 2dd5 h THR 129 N 0.25 1.18 -0.84 1.05 2.02 -1.99 0.06 112.91 114.64 2dd5 h THR 129 Ca 0.06 -0.47 -0.02 0.00 0.77 0.00 0.00 66.41 66.74 2dd5 h THR 129 Cb 0.21 0.61 -0.04 0.00 -1.74 0.00 0.00 68.15 67.19 2dd5 h THR 129 CO 0.01 0.19 0.43 -0.33 0.37 0.00 0.00 175.52 176.18 2dd5 h GLU 130 N 0.63 1.18 -0.20 6.66 5.08 -1.70 -0.12 114.58 126.12 2dd5 h GLU 130 Ca 0.17 -0.16 -0.02 0.00 -1.00 0.00 0.00 59.36 58.35 2dd5 h GLU 130 Cb 0.08 -0.22 -0.01 0.00 0.50 0.00 0.00 28.75 29.10 2dd5 h GLU 130 CO -0.02 0.89 0.03 1.25 -1.00 0.00 0.00 179.01 180.15 2dd5 h LEU 131 N 1.18 0.32 -0.77 1.33 5.85 -0.90 -0.66 115.31 121.66 2dd5 h LEU 131 Ca 0.29 -0.27 -0.00 0.00 0.84 0.00 0.00 57.88 58.74 2dd5 h LEU 131 Cb 0.08 -0.08 -0.04 0.00 0.37 0.00 0.00 40.66 40.98 2dd5 h LEU 131 CO -0.04 0.50 0.48 0.45 -0.34 0.00 0.00 178.44 179.49 2dd5 h HIS 132 N 0.12 1.01 -0.50 1.25 3.86 -0.72 -1.51 115.15 118.66 2dd5 h HIS 132 Ca 0.06 0.00 -0.08 0.00 -1.16 0.00 0.00 60.37 59.19 2dd5 h HIS 132 Cb 0.32 -0.33 -0.02 0.00 1.06 0.00 0.00 27.41 28.44 2dd5 h HIS 132 CO 0.02 0.67 -0.02 -0.91 0.86 0.00 0.00 177.93 178.55 2dd5 h ASN 133 N 1.06 0.83 -0.55 2.45 2.35 -0.88 -2.39 115.58 118.45 2dd5 h ASN 133 Ca 0.28 -0.22 -0.04 0.00 -0.55 0.00 0.00 56.30 55.77 2dd5 h ASN 133 Cb -0.06 -0.22 -0.02 0.00 0.05 0.00 0.00 38.32 38.06 2dd5 h ASN 133 CO -0.05 0.91 0.19 0.50 -1.65 0.00 0.00 177.43 177.32 2dd5 h LYS 134 N 0.79 0.85 -0.88 0.81 1.63 -0.58 -0.59 116.57 118.59 2dd5 h LYS 134 Ca 0.15 -0.17 -0.00 0.00 -0.85 0.00 0.00 60.65 59.77 2dd5 h LYS 134 Cb 0.50 -0.13 -0.04 0.00 -0.60 0.00 0.00 32.23 31.96 2dd5 h LYS 134 CO 0.03 0.76 0.54 0.82 -3.45 0.00 0.00 179.45 178.14 2dd5 h ILE 135 N 0.76 1.24 -0.51 2.00 2.04 -1.06 0.48 117.51 122.47 2dd5 h ILE 135 Ca 0.18 -0.52 -0.03 0.00 1.00 0.00 0.00 64.86 65.49 2dd5 h ILE 135 Cb 0.25 -0.01 -0.02 0.00 -0.74 0.00 0.00 36.82 36.30 2dd5 h ILE 135 CO -0.01 0.25 0.19 0.58 0.00 0.00 0.00 178.15 179.16 2dd5 h VAL 136 N 1.21 1.22 -0.88 1.67 2.07 -1.07 -1.62 116.25 118.84 2dd5 h VAL 136 Ca 0.32 -0.71 0.02 0.00 0.82 0.00 0.00 66.70 67.15 2dd5 h VAL 136 Cb -0.06 0.73 -0.05 0.00 -1.52 0.00 0.00 31.29 30.39 2dd5 h VAL 136 CO -0.06 0.26 0.58 -0.08 0.02 0.00 0.00 177.57 178.29 2dd5 h GLU 137 N 0.69 1.12 -0.66 1.57 4.81 -0.23 -0.55 114.58 121.34 2dd5 h GLU 137 Ca 0.17 -0.07 -0.09 0.00 -0.13 0.00 0.00 59.36 59.24 2dd5 h GLU 137 Cb 0.23 -0.25 -0.03 0.00 0.63 0.00 0.00 28.75 29.33 2dd5 h GLU 137 CO -0.01 0.74 0.07 1.98 -0.73 0.00 0.00 179.01 181.07 2dd5 h MET 138 N 1.16 1.11 -0.23 1.92 4.05 -0.62 -1.84 114.93 120.47 2dd5 h MET 138 Ca 0.34 -0.32 -0.11 0.00 -0.28 0.00 0.00 59.70 59.33 2dd5 h MET 138 Cb -0.07 -0.12 -0.01 0.00 -0.80 0.00 0.00 31.60 30.60 2dd5 h MET 138 CO -0.09 1.03 -0.32 0.00 0.23 0.00 0.00 176.91 177.76 2dd5 h ARG 139 N 1.03 0.47 -0.18 0.39 3.08 -0.76 -2.64 114.38 115.77 2dd5 h ARG 139 Ca 0.20 -0.20 -0.09 0.00 0.07 0.00 0.00 59.98 59.95 2dd5 h ARG 139 Cb 0.48 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.51 2dd5 h ARG 139 CO 0.02 0.74 -0.30 0.93 -1.07 0.00 0.00 179.97 180.29 2dd5 h GLU 140 N 0.41 0.35 -0.36 0.04 5.08 -0.78 -1.93 114.58 117.39 2dd5 h GLU 140 Ca 0.05 -0.14 -0.02 0.00 -1.00 0.00 0.00 59.36 58.25 2dd5 h GLU 140 Cb 0.76 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.98 2dd5 h GLU 140 CO 0.06 0.62 0.13 0.00 -1.00 0.00 0.00 179.01 178.82 2dd5 h ARG 141 N 0.31 0.55 -0.22 2.33 3.08 -1.00 0.43 114.38 119.85 2dd5 h ARG 141 Ca 0.04 -0.11 0.03 0.00 0.07 0.00 0.00 59.98 60.02 2dd5 h ARG 141 Cb 0.68 -0.08 -0.03 0.00 0.08 0.00 0.00 29.97 30.62 2dd5 h ARG 141 CO 0.05 0.55 0.02 0.28 -1.07 0.00 0.00 179.97 179.80 2dd5 h VAL 142 N 0.43 0.88 0.47 2.04 2.07 -1.18 -2.17 116.25 118.79 2dd5 h VAL 142 Ca 0.12 -0.04 -0.02 0.00 0.82 0.00 0.00 66.70 67.58 2dd5 h VAL 142 Cb 0.22 0.77 0.00 0.00 -1.52 0.00 0.00 31.29 30.76 2dd5 h VAL 142 CO -0.01 0.02 -0.22 0.00 0.02 0.00 0.00 177.57 177.38 2dd5 h ALA 143 N 1.17 -0.63 0.00 1.67 0.00 -1.14 -3.08 119.26 117.25 2dd5 h ALA 143 Ca 0.10 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.82 2dd5 h ALA 143 Cb 0.11 0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.14 2dd5 h ALA 143 CO -0.15 -0.67 0.23 -1.13 0.00 0.00 0.00 179.25 177.54 2dd5 n SER 144 N -5.23 0.21 -0.34 0.00 3.41 0.15 -4.76 113.62 107.06 2dd5 n SER 144 Ca -0.10 0.46 -0.04 0.00 -0.26 0.00 0.00 58.87 58.93 2dd5 n SER 144 Cb 0.30 -0.44 -0.02 0.00 -0.26 0.00 0.00 64.21 63.79 2dd5 n SER 144 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2dd5 n GLY 145 N -1.29 0.71 0.28 5.00 0.00 -0.95 -4.88 105.19 104.05 2dd5 n GLY 145 Ca -0.01 -0.87 0.11 0.00 0.00 0.00 0.00 46.02 45.26 2dd5 n GLY 145 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2dd5 n GLN 146 N -2.84 1.37 -1.17 1.61 6.02 -0.86 -0.66 117.38 120.85 2dd5 n GLN 146 Ca -0.04 -0.55 0.15 0.00 -0.01 0.00 0.00 57.00 56.54 2dd5 n GLN 146 Cb 0.15 -1.39 -0.07 0.00 1.02 0.00 0.00 30.24 29.96 2dd5 n GLN 146 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2dd5 n GLY 147 N 1.01 -2.84 2.57 1.08 0.00 -1.22 -4.33 105.19 101.46 2dd5 n GLY 147 Ca 0.17 -1.15 -0.28 0.00 0.00 0.00 0.00 46.02 44.75 2dd5 n GLY 147 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2dd5 s LEU 148 N -6.75 0.60 0.00 0.99 1.02 0.20 -4.66 118.68 110.08 2dd5 s LEU 148 Ca 0.00 -1.17 0.00 0.00 0.02 0.00 0.00 54.13 52.98 2dd5 s LEU 148 Cb 0.00 -0.36 0.00 0.00 0.02 0.00 0.00 46.19 45.85 2dd5 s LEU 148 CO 0.00 -0.42 0.00 0.61 0.02 0.00 0.00 176.35 176.56 2dd5 n GLY 149 N 5.23 2.28 0.72 -3.19 0.00 -1.26 -1.30 105.19 107.66 2dd5 n GLY 149 Ca -0.06 -0.24 0.06 0.00 0.00 0.00 0.00 46.02 45.78 2dd5 n GLY 149 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 2dd5 n GLU 150 N 14.00 1.93 0.02 1.61 0.28 -1.26 -3.88 120.64 133.34 2dd5 n GLU 150 Ca 0.00 -1.33 0.04 0.00 -0.16 0.00 0.00 57.16 55.71 2dd5 n GLU 150 Cb 0.00 -1.33 -0.09 0.00 1.43 0.00 0.00 31.44 31.44 2dd5 n GLU 150 CO 0.00 0.00 0.00 0.66 -0.16 0.00 0.00 177.13 177.63 2dd5 n TYR 151 N 0.55 0.62 -3.46 -1.84 4.01 -0.42 -4.93 117.16 111.68 2dd5 n TYR 151 Ca 0.12 0.20 0.01 0.00 -0.16 0.00 0.00 57.90 58.07 2dd5 n TYR 151 Cb 0.34 -0.91 -0.05 0.00 -0.31 0.00 0.00 39.34 38.42 2dd5 n TYR 151 CO 0.00 0.00 0.00 -1.17 -0.46 0.00 0.00 176.86 175.23 2dd5 s LEU 152 N -5.34 -0.56 0.71 7.72 2.96 -1.09 -4.94 118.68 118.15 2dd5 s LEU 152 Ca -0.04 0.79 -0.11 0.00 -0.22 0.00 0.00 54.13 54.54 2dd5 s LEU 152 Cb 0.10 1.67 0.02 0.00 0.50 0.00 0.00 46.19 48.48 2dd5 s LEU 152 CO 0.83 -0.11 1.07 -2.16 -1.32 0.00 0.00 176.35 174.66 2dd5 s PRO 153 N 2.18 2.80 0.94 0.98 0.04 -1.26 0.58 135.00 141.26 2dd5 s PRO 153 Ca -0.04 0.71 -0.11 0.00 0.04 0.00 0.00 61.00 61.60 2dd5 s PRO 153 Cb -0.05 -1.99 0.16 0.00 0.04 0.00 0.00 34.50 32.65 2dd5 s PRO 153 CO -0.17 -1.14 1.10 -2.14 0.04 0.00 0.00 177.00 174.69 2dd5 s PRO 154 N -5.18 0.85 0.22 0.56 0.02 -1.26 -4.15 135.00 126.06 2dd5 s PRO 154 Ca 0.58 1.14 -0.32 0.00 0.02 0.00 0.00 61.00 62.43 2dd5 s PRO 154 Cb -0.13 -1.74 -0.14 0.00 0.02 0.00 0.00 34.50 32.51 2dd5 s PRO 154 CO 0.54 -2.62 1.29 1.63 -0.33 0.00 0.00 177.00 177.51 2dd5 n LYS 155 N -4.18 1.65 0.00 5.54 4.76 0.17 -4.88 118.16 121.21 2dd5 n LYS 155 Ca 0.08 0.59 0.00 0.00 -2.87 0.00 0.00 58.31 56.11 2dd5 n LYS 155 Cb 0.54 -2.16 0.00 0.00 -1.84 0.00 0.00 35.03 31.56 2dd5 n LYS 155 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2dd5 n ALA 156 N 1.62 0.00 0.43 7.82 0.00 -1.26 -5.09 120.51 124.03 2dd5 n ALA 156 Ca 0.13 0.00 0.05 0.00 0.00 0.00 0.00 53.44 53.62 2dd5 n ALA 156 Cb 0.29 0.00 0.04 0.00 0.00 0.00 0.00 19.45 19.78 2dd5 n ALA 156 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86