#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k3o h TYR 3 N 0.00 0.39 -0.49 1.43 0.05 -1.98 -2.70 116.97 113.67 2k3o h TYR 3 Ca 0.00 -0.17 -0.04 0.00 0.05 0.00 0.00 58.73 58.57 2k3o h TYR 3 Cb 0.00 -0.06 -0.02 0.00 1.01 0.00 0.00 36.73 37.66 2k3o h TYR 3 CO 0.00 0.88 0.13 0.66 -1.05 0.00 0.00 178.16 178.79 2k3o h SER 4 N 0.20 0.73 -0.16 3.88 4.64 -1.94 -0.10 113.55 120.80 2k3o h SER 4 Ca -0.02 -0.22 -0.07 0.00 -0.47 0.00 0.00 61.79 61.01 2k3o h SER 4 Cb 1.23 -0.19 -0.02 0.00 -0.31 0.00 0.00 62.40 63.11 2k3o h SER 4 CO 0.11 0.76 -0.10 0.28 -0.87 0.00 0.00 176.83 177.01 2k3o h SER 5 N 0.66 0.49 -0.11 4.97 0.02 -1.96 -0.05 113.55 117.58 2k3o h SER 5 Ca 0.16 -0.12 -0.07 0.00 -0.84 0.00 0.00 61.79 60.91 2k3o h SER 5 Cb 0.30 -0.13 0.00 0.00 0.14 0.00 0.00 62.40 62.71 2k3o h SER 5 CO -0.00 0.63 -0.22 0.00 -1.14 0.00 0.00 176.83 176.09 2k3o h ALA 6 N 1.43 0.17 -0.36 3.77 0.00 -1.30 -0.63 119.26 122.34 2k3o h ALA 6 Ca 0.09 -0.38 0.06 0.00 0.00 0.00 0.00 54.91 54.68 2k3o h ALA 6 Cb 0.46 -0.03 -0.05 0.00 0.00 0.00 0.00 17.79 18.17 2k3o h ALA 6 CO 0.03 0.14 0.05 0.35 0.00 0.00 0.00 179.25 179.81 2k3o h PHE 7 N -0.09 0.07 0.00 0.00 3.04 -0.97 -2.27 116.94 116.72 2k3o h PHE 7 Ca 0.00 0.02 -0.05 0.00 3.98 0.00 0.00 57.97 61.93 2k3o h PHE 7 Cb 0.81 0.02 -0.01 0.00 2.56 0.00 0.00 35.95 39.34 2k3o h PHE 7 CO 0.11 -0.01 -0.22 0.00 -2.02 0.00 0.00 178.31 176.16 2k3o h ALA 8 N 1.29 1.53 0.15 2.41 0.00 -0.98 0.15 119.26 123.79 2k3o h ALA 8 Ca 0.17 -0.20 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 2k3o h ALA 8 Cb 0.22 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.97 2k3o h ALA 8 CO -0.25 0.28 -0.07 1.96 0.00 0.00 0.00 179.25 181.17 2k3o h GLN 9 N 0.00 -0.19 -0.31 0.00 4.20 -0.56 1.00 115.11 119.25 2k3o h GLN 9 Ca -0.00 0.01 -0.07 0.00 0.06 0.00 0.00 58.65 58.65 2k3o h GLN 9 Cb 0.42 0.04 -0.01 0.00 0.30 0.00 0.00 27.48 28.24 2k3o h GLN 9 CO 0.03 0.11 -0.08 0.00 -0.67 0.00 0.00 178.83 178.21 2k3o h ALA 10 N 0.30 0.43 -0.26 3.87 0.00 -1.33 0.00 119.26 122.28 2k3o h ALA 10 Ca -0.02 -0.29 0.03 0.00 0.00 0.00 0.00 54.91 54.63 2k3o h ALA 10 Cb 0.39 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.03 2k3o h ALA 10 CO 0.03 0.26 0.05 0.00 0.00 0.00 0.00 179.25 179.59 2k3o h ALA 11 N 0.79 0.26 -0.77 0.00 0.00 -1.00 -2.12 119.26 116.43 2k3o h ALA 11 Ca 0.08 0.05 -0.03 0.00 0.00 0.00 0.00 54.91 55.01 2k3o h ALA 11 Cb 0.57 0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.39 2k3o h ALA 11 CO 0.03 -0.37 0.38 1.03 0.00 0.00 0.00 179.25 180.33 2k3o h SER 12 N 0.15 1.00 -0.51 0.00 0.87 -0.70 0.19 113.55 114.55 2k3o h SER 12 Ca 0.12 -0.13 0.08 0.00 -1.23 0.00 0.00 61.79 60.63 2k3o h SER 12 Cb 0.12 -0.26 -0.06 0.00 -0.44 0.00 0.00 62.40 61.76 2k3o h SER 12 CO -0.16 0.84 0.15 -1.28 -0.53 0.00 0.00 176.83 175.86 2k3o h SER 13 N 1.08 0.12 -0.01 6.23 0.87 -0.58 0.20 113.55 121.46 2k3o h SER 13 Ca 0.27 0.07 -0.25 0.00 -1.23 0.00 0.00 61.79 60.65 2k3o h SER 13 Cb 0.10 0.07 0.01 0.00 -0.44 0.00 0.00 62.40 62.15 2k3o h SER 13 CO -0.04 0.09 -0.94 0.28 -0.53 0.00 0.00 176.83 175.70 2k3o h SER 14 N 0.31 0.88 0.14 6.23 0.02 -1.13 -2.94 113.55 117.07 2k3o h SER 14 Ca 0.25 -0.65 -0.10 0.00 -0.84 0.00 0.00 61.79 60.45 2k3o h SER 14 Cb 0.30 -0.26 -0.01 0.00 0.14 0.00 0.00 62.40 62.56 2k3o h SER 14 CO -0.28 1.45 -0.34 -0.07 -1.14 0.00 0.00 176.83 176.45 2k3o h LEU 15 N 0.43 0.30 -0.56 5.07 3.38 -0.27 -1.26 115.31 122.38 2k3o h LEU 15 Ca -0.10 -0.11 -0.16 0.00 0.09 0.00 0.00 57.88 57.61 2k3o h LEU 15 Cb 1.58 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 42.23 2k3o h LEU 15 CO 0.18 0.63 -0.68 0.00 0.09 0.00 0.00 178.44 178.66 2k3o h ALA 16 N 1.39 0.78 0.00 1.53 0.00 -0.71 -2.98 119.26 119.28 2k3o h ALA 16 Ca 0.03 -0.60 0.00 0.00 0.00 0.00 0.00 54.91 54.34 2k3o h ALA 16 Cb 0.73 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.43 2k3o h ALA 16 CO 0.06 0.79 -0.07 -2.37 0.00 0.00 0.00 179.25 177.66 2k3o n THR 17 N -3.80 0.29 -2.90 0.00 5.66 -1.11 -4.61 114.28 107.81 2k3o n THR 17 Ca -0.02 -0.14 -0.44 0.00 -3.05 0.00 0.00 64.05 60.39 2k3o n THR 17 Cb 0.67 -0.47 -0.01 0.00 -1.55 0.00 0.00 70.33 68.97 2k3o n THR 17 CO 0.00 0.00 0.00 -0.55 -3.05 0.00 0.00 175.07 171.47 2k3o s SER 18 N -3.76 6.89 0.58 1.09 0.15 -0.49 -4.86 113.70 113.30 2k3o s SER 18 Ca 0.12 -2.59 0.28 0.00 0.70 0.00 0.00 55.95 54.46 2k3o s SER 18 Cb 0.16 -2.42 1.51 0.00 -1.71 0.00 0.00 66.02 63.56 2k3o s SER 18 CO 0.58 -0.91 1.97 0.28 1.20 0.00 0.00 173.24 176.36 2k3o h SER 19 N 7.82 0.00 -0.30 5.45 0.02 -1.82 -0.95 113.55 123.77 2k3o h SER 19 Ca 0.27 0.00 -0.08 0.00 -0.84 0.00 0.00 61.79 61.14 2k3o h SER 19 Cb 0.93 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.45 2k3o h SER 19 CO 1.22 0.00 -0.07 0.00 -1.14 0.00 0.00 176.83 176.84 2k3o h ALA 20 N 1.60 1.12 -0.19 3.77 0.00 -1.94 -0.08 119.26 123.54 2k3o h ALA 20 Ca 0.19 -0.28 -0.18 0.00 0.00 0.00 0.00 54.91 54.64 2k3o h ALA 20 Cb 0.97 -0.17 0.01 0.00 0.00 0.00 0.00 17.79 18.60 2k3o h ALA 20 CO -0.00 0.56 -0.60 0.82 0.00 0.00 0.00 179.25 180.02 2k3o h ILE 21 N 0.64 1.30 -0.48 0.00 1.08 -1.51 -0.62 117.51 117.92 2k3o h ILE 21 Ca 0.12 -1.82 0.01 0.00 -0.39 0.00 0.00 64.86 62.78 2k3o h ILE 21 Cb 0.50 1.90 -0.03 0.00 -3.07 0.00 0.00 36.82 36.13 2k3o h ILE 21 CO 0.03 0.57 0.30 -1.28 -0.69 0.00 0.00 178.15 177.09 2k3o h SER 22 N 0.46 0.51 -0.69 1.72 0.87 -1.31 -1.67 113.55 113.45 2k3o h SER 22 Ca -0.02 -0.00 -0.05 0.00 -1.23 0.00 0.00 61.79 60.48 2k3o h SER 22 Cb 1.22 -0.12 -0.03 0.00 -0.44 0.00 0.00 62.40 63.04 2k3o h SER 22 CO 0.13 0.37 0.24 0.03 -0.53 0.00 0.00 176.83 177.06 2k3o h ARG 23 N 0.62 1.07 -0.29 2.24 3.08 -1.01 -0.80 114.38 119.28 2k3o h ARG 23 Ca 0.19 -0.21 0.06 0.00 0.07 0.00 0.00 59.98 60.08 2k3o h ARG 23 Cb -0.03 -0.17 -0.05 0.00 0.08 0.00 0.00 29.97 29.80 2k3o h ARG 23 CO -0.06 0.90 -0.06 0.00 -1.07 0.00 0.00 179.97 179.68 2k3o h ALA 24 N 1.22 0.21 0.00 0.04 0.00 -0.68 0.57 119.26 120.61 2k3o h ALA 24 Ca 0.23 0.11 -0.12 0.00 0.00 0.00 0.00 54.91 55.13 2k3o h ALA 24 Cb 0.26 0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.24 2k3o h ALA 24 CO -0.01 -0.45 -0.57 0.74 0.00 0.00 0.00 179.25 178.95 2k3o h PHE 25 N 0.02 0.00 0.00 0.00 0.04 -1.10 -3.13 116.94 112.77 2k3o h PHE 25 Ca 0.14 0.00 -0.14 0.00 2.80 0.00 0.00 57.97 60.77 2k3o h PHE 25 Cb 0.21 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.34 2k3o h PHE 25 CO -0.27 0.57 -0.69 0.00 -0.60 0.00 0.00 178.31 177.33 2k3o h ALA 26 N 1.43 0.55 -0.11 2.45 0.00 -0.94 -3.35 119.26 119.30 2k3o h ALA 26 Ca -0.01 -0.62 -0.01 0.00 0.00 0.00 0.00 54.91 54.27 2k3o h ALA 26 Cb 1.05 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.73 2k3o h ALA 26 CO 0.07 0.86 0.01 1.03 0.00 0.00 0.00 179.25 181.22 2k3o h SER 27 N 0.00 0.18 -4.02 0.00 0.87 -0.83 -3.44 113.55 106.31 2k3o h SER 27 Ca -0.01 -0.27 -0.52 0.00 -1.23 0.00 0.00 61.79 59.76 2k3o h SER 27 Cb 1.53 -0.05 0.09 0.00 -0.44 0.00 0.00 62.40 63.53 2k3o h SER 27 CO 0.09 0.41 0.52 0.68 -0.53 0.00 0.00 176.83 178.00 2k3o s VAL 28 N -5.11 2.77 -0.02 2.23 -7.23 -1.20 -4.78 120.40 107.06 2k3o s VAL 28 Ca -0.14 0.58 0.03 0.00 -1.81 0.00 0.00 61.98 60.64 2k3o s VAL 28 Cb 0.05 -3.29 0.05 0.00 0.56 0.00 0.00 36.38 33.75 2k3o s VAL 28 CO 0.70 -0.01 0.86 -0.24 -0.31 0.00 0.00 175.10 176.10 2k3o n SER 29 N -0.67 1.00 -3.86 4.85 2.88 -1.26 -4.88 113.62 111.68 2k3o n SER 29 Ca 0.08 -1.86 -0.12 0.00 -1.33 0.00 0.00 58.87 55.64 2k3o n SER 29 Cb 0.47 -0.12 -0.14 0.00 -0.75 0.00 0.00 64.21 63.67 2k3o n SER 29 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 2k3o s SER 30 N -1.00 -0.00 0.48 -3.46 0.01 -1.26 -4.93 113.70 103.54 2k3o s SER 30 Ca 0.06 0.02 0.13 0.00 1.31 0.00 0.00 55.95 57.47 2k3o s SER 30 Cb 0.05 0.01 1.14 0.00 0.21 0.00 0.00 66.02 67.43 2k3o s SER 30 CO 0.01 -0.01 2.12 0.00 0.41 0.00 0.00 173.24 175.76 2k3o h ALA 31 N 6.24 1.92 -0.01 1.44 0.00 -1.94 0.04 119.26 126.95 2k3o h ALA 31 Ca -0.26 -0.01 -0.15 0.00 0.00 0.00 0.00 54.91 54.50 2k3o h ALA 31 Cb 1.20 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.92 2k3o h ALA 31 CO 0.50 0.07 -0.68 0.77 0.00 0.00 0.00 179.25 179.92 2k3o h SER 32 N 0.18 0.05 -0.23 0.00 0.02 -1.97 0.85 113.55 112.44 2k3o h SER 32 Ca 0.05 -0.03 -0.20 0.00 -0.84 0.00 0.00 61.79 60.77 2k3o h SER 32 Cb 0.00 -0.01 0.01 0.00 0.14 0.00 0.00 62.40 62.54 2k3o h SER 32 CO -0.01 0.71 -0.65 0.00 -1.14 0.00 0.00 176.83 175.74 2k3o h ALA 33 N 1.29 0.39 -0.28 3.77 0.00 -1.68 -0.91 119.26 121.84 2k3o h ALA 33 Ca -0.01 -0.55 -0.04 0.00 0.00 0.00 0.00 54.91 54.31 2k3o h ALA 33 Cb 1.20 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.93 2k3o h ALA 33 CO 0.09 0.68 0.04 0.00 0.00 0.00 0.00 179.25 180.06 2k3o h ALA 34 N 0.62 0.37 -0.47 0.00 0.00 -0.98 -0.21 119.26 118.60 2k3o h ALA 34 Ca -0.02 -0.20 -0.08 0.00 0.00 0.00 0.00 54.91 54.62 2k3o h ALA 34 Cb 1.27 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.94 2k3o h ALA 34 CO 0.14 0.07 -0.03 0.66 0.00 0.00 0.00 179.25 180.10 2k3o h SER 35 N 0.28 0.76 -0.29 0.00 4.64 -0.89 -1.03 113.55 117.03 2k3o h SER 35 Ca 0.08 -0.19 -0.13 0.00 -0.47 0.00 0.00 61.79 61.08 2k3o h SER 35 Cb 0.35 -0.20 -0.01 0.00 -0.31 0.00 0.00 62.40 62.23 2k3o h SER 35 CO 0.01 0.85 -0.28 -1.28 -0.87 0.00 0.00 176.83 175.26 2k3o h SER 36 N 0.73 0.82 -0.27 4.97 0.87 -1.07 0.12 113.55 119.73 2k3o h SER 36 Ca 0.14 -0.32 -0.00 0.00 -1.23 0.00 0.00 61.79 60.37 2k3o h SER 36 Cb 0.48 -0.23 -0.01 0.00 -0.44 0.00 0.00 62.40 62.20 2k3o h SER 36 CO 0.02 1.05 0.16 0.17 -0.53 0.00 0.00 176.83 177.70 2k3o h LEU 37 N 0.68 0.34 -1.63 2.23 8.10 -0.86 -0.25 115.31 123.92 2k3o h LEU 37 Ca 0.08 -0.07 -0.04 0.00 0.11 0.00 0.00 57.88 57.96 2k3o h LEU 37 Cb 0.81 -0.09 -0.01 0.00 -0.44 0.00 0.00 40.66 40.94 2k3o h LEU 37 CO 0.07 0.31 -0.15 0.00 -4.11 0.00 0.00 178.44 174.56 2k3o h ALA 38 N 1.04 1.69 0.19 0.17 0.00 -1.02 -0.08 119.26 121.24 2k3o h ALA 38 Ca 0.10 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 2k3o h ALA 38 Cb 0.04 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.80 2k3o h ALA 38 CO -0.02 0.23 -0.09 -0.92 0.00 0.00 0.00 179.25 178.45 2k3o h TYR 39 N 0.05 -0.24 0.14 0.00 3.20 -0.49 -1.92 116.97 117.71 2k3o h TYR 39 Ca 0.01 -0.01 -0.00 0.00 3.14 0.00 0.00 58.73 61.87 2k3o h TYR 39 Cb 0.30 0.08 -0.00 0.00 1.54 0.00 0.00 36.73 38.64 2k3o h TYR 39 CO 0.00 0.15 -0.08 -0.91 -1.64 0.00 0.00 178.16 175.68 2k3o h ASN 40 N -0.70 -0.21 0.29 -2.11 4.21 -0.50 0.56 115.58 117.12 2k3o h ASN 40 Ca -0.03 0.01 -0.05 0.00 1.21 0.00 0.00 56.30 57.44 2k3o h ASN 40 Cb 0.49 0.06 -0.01 0.00 -1.12 0.00 0.00 38.32 37.74 2k3o h ASN 40 CO 0.04 -0.14 -0.25 0.16 -1.29 0.00 0.00 177.43 175.95 2k3o h ILE 41 N -0.22 1.11 -0.22 2.81 -0.00 -1.17 -2.65 117.51 117.18 2k3o h ILE 41 Ca -0.01 -0.87 -0.20 0.00 -0.00 0.00 0.00 64.86 63.78 2k3o h ILE 41 Cb 0.18 1.48 0.01 0.00 -0.00 0.00 0.00 36.82 38.49 2k3o h ILE 41 CO 0.02 0.24 -0.63 1.23 -0.00 0.00 0.00 178.15 179.01 2k3o h GLY 42 N 0.82 0.90 1.00 0.16 0.00 -0.88 -1.32 103.07 103.74 2k3o h GLY 42 Ca -0.00 -1.15 -0.00 0.00 0.00 0.00 0.00 47.33 46.18 2k3o h GLY 42 CO 0.03 1.03 0.34 1.41 0.00 0.00 0.00 176.54 179.34 2k3o h LEU 43 N 0.57 0.64 -0.09 3.11 3.38 -0.75 0.99 115.31 123.16 2k3o h LEU 43 Ca -0.02 -0.04 -0.00 0.00 0.09 0.00 0.00 57.88 57.91 2k3o h LEU 43 Cb 1.26 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 41.84 2k3o h LEU 43 CO 0.14 0.50 0.05 0.28 0.09 0.00 0.00 178.44 179.49 2k3o h SER 44 N 0.73 0.11 -0.45 -0.43 0.02 -1.47 -0.54 113.55 111.51 2k3o h SER 44 Ca 0.20 -0.06 -0.01 0.00 -0.84 0.00 0.00 61.79 61.07 2k3o h SER 44 Cb -0.04 -0.03 -0.02 0.00 0.14 0.00 0.00 62.40 62.46 2k3o h SER 44 CO -0.04 0.14 0.23 0.00 -1.14 0.00 0.00 176.83 176.02 2k3o h ALA 45 N 0.97 0.58 -0.76 3.77 0.00 -1.12 -1.56 119.26 121.14 2k3o h ALA 45 Ca 0.03 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 2k3o h ALA 45 Cb 0.05 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 17.63 2k3o h ALA 45 CO -0.01 0.13 0.45 0.00 0.00 0.00 0.00 179.25 179.82 2k3o h ALA 46 N 1.07 0.97 -0.47 0.00 0.00 -0.71 -0.48 119.26 119.64 2k3o h ALA 46 Ca 0.16 -0.10 -0.07 0.00 0.00 0.00 0.00 54.91 54.90 2k3o h ALA 46 Cb 0.10 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.56 2k3o h ALA 46 CO -0.02 0.45 0.02 0.00 0.00 0.00 0.00 179.25 179.69 2k3o h ARG 47 N 1.04 0.82 -0.35 0.00 3.08 -0.98 0.08 114.38 118.08 2k3o h ARG 47 Ca 0.27 -0.25 -0.04 0.00 0.07 0.00 0.00 59.98 60.03 2k3o h ARG 47 Cb -0.02 -0.08 -0.02 0.00 0.08 0.00 0.00 29.97 29.94 2k3o h ARG 47 CO -0.05 0.86 0.03 0.77 -1.07 0.00 0.00 179.97 180.51 2k3o h SER 48 N 0.67 0.49 0.98 7.04 0.02 -1.02 -2.99 113.55 118.74 2k3o h SER 48 Ca 0.13 -0.08 0.00 0.00 -0.84 0.00 0.00 61.79 61.00 2k3o h SER 48 Cb 0.48 -0.13 0.00 0.00 0.14 0.00 0.00 62.40 62.89 2k3o h SER 48 CO 0.02 0.54 -0.45 0.18 -1.14 0.00 0.00 176.83 175.98 2k3o n LEU 49 N -4.30 0.69 0.00 5.07 4.77 -0.21 -4.99 117.00 118.02 2k3o n LEU 49 Ca 0.02 0.30 0.00 0.00 -0.03 0.00 0.00 56.01 56.30 2k3o n LEU 49 Cb 0.22 -0.23 0.00 0.00 -2.33 0.00 0.00 43.42 41.08 2k3o n LEU 49 CO 0.38 -0.07 0.00 0.61 -1.33 0.00 0.00 177.39 176.99 2k3o n GLY 50 N 1.35 0.85 3.74 -0.72 0.00 -0.07 -5.06 105.19 105.28 2k3o n GLY 50 Ca 0.04 -0.50 -0.41 0.00 0.00 0.00 0.00 46.02 45.15 2k3o n GLY 50 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2k3o s ILE 51 N -2.00 2.82 -2.00 -0.61 1.09 -0.67 -4.94 121.20 114.90 2k3o s ILE 51 Ca 0.00 0.69 0.26 0.00 -1.10 0.00 0.00 60.65 60.50 2k3o s ILE 51 Cb 0.00 -3.44 0.74 0.00 -1.06 0.00 0.00 42.46 38.70 2k3o s ILE 51 CO 0.00 0.11 1.95 0.00 -0.10 0.00 0.00 174.94 176.89 2k3o n ALA 52 N 2.46 2.55 -2.90 9.38 0.00 -1.26 -4.14 120.51 126.60 2k3o n ALA 52 Ca 0.07 -0.16 -0.12 0.00 0.00 0.00 0.00 53.44 53.22 2k3o n ALA 52 Cb 0.41 -1.42 0.04 0.00 0.00 0.00 0.00 19.45 18.47 2k3o n ALA 52 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2k3o n SER 53 N -0.96 -0.64 -0.28 0.00 2.88 -1.26 -5.02 113.62 108.34 2k3o n SER 53 Ca 0.20 -3.19 0.05 0.00 -1.33 0.00 0.00 58.87 54.60 2k3o n SER 53 Cb 0.09 0.57 0.19 0.00 -0.75 0.00 0.00 64.21 64.31 2k3o n SER 53 CO 0.00 0.00 0.00 0.44 -1.23 0.00 0.00 175.04 174.25 2k3o h ASP 54 N 2.89 0.46 -0.14 -3.46 3.32 -1.94 -0.97 116.42 116.58 2k3o h ASP 54 Ca -0.04 0.09 0.02 0.00 0.02 0.00 0.00 57.03 57.11 2k3o h ASP 54 Cb 1.08 0.01 -0.01 0.00 0.22 0.00 0.00 39.33 40.64 2k3o h ASP 54 CO 0.29 0.21 0.09 0.71 -1.72 0.00 0.00 179.24 178.83 2k3o h THR 55 N 0.59 0.99 0.20 0.35 1.35 -1.96 -0.24 112.91 114.19 2k3o h THR 55 Ca 0.42 -0.04 -0.26 0.00 -0.55 0.00 0.00 66.41 65.99 2k3o h THR 55 Cb 0.56 0.87 0.03 0.00 -1.73 0.00 0.00 68.15 67.88 2k3o h THR 55 CO -0.34 0.02 -1.12 0.00 -0.25 0.00 0.00 175.52 173.82 2k3o h ALA 56 N 1.92 -0.13 -0.03 6.62 0.00 -1.61 -1.21 119.26 124.83 2k3o h ALA 56 Ca 0.06 -0.77 -0.01 0.00 0.00 0.00 0.00 54.91 54.19 2k3o h ALA 56 Cb 0.09 0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.01 2k3o h ALA 56 CO -0.01 0.52 -0.00 1.25 0.00 0.00 0.00 179.25 181.01 2k3o h LEU 57 N -0.14 0.05 -1.44 0.00 6.46 -1.27 -0.50 115.31 118.47 2k3o h LEU 57 Ca -0.20 -0.34 -0.01 0.00 -0.12 0.00 0.00 57.88 57.21 2k3o h LEU 57 Cb 1.89 -0.01 -0.02 0.00 -0.73 0.00 0.00 40.66 41.78 2k3o h LEU 57 CO 0.21 0.38 0.21 0.00 -0.62 0.00 0.00 178.44 178.61 2k3o h ALA 58 N 0.68 1.57 -0.65 1.25 0.00 -1.19 -1.25 119.26 119.67 2k3o h ALA 58 Ca 0.01 -0.09 -0.07 0.00 0.00 0.00 0.00 54.91 54.76 2k3o h ALA 58 Cb 0.35 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.94 2k3o h ALA 58 CO 0.00 0.35 0.12 0.78 0.00 0.00 0.00 179.25 180.50 2k3o h GLY 59 N 0.70 1.15 1.08 0.00 0.00 -1.10 0.15 103.07 105.04 2k3o h GLY 59 Ca 0.15 -0.75 -0.06 0.00 0.00 0.00 0.00 47.33 46.67 2k3o h GLY 59 CO -0.02 0.70 0.24 0.00 0.00 0.00 0.00 176.54 177.46 2k3o h ALA 60 N 1.04 1.01 -0.47 3.60 0.00 -0.50 -1.38 119.26 122.57 2k3o h ALA 60 Ca 0.20 -0.22 -0.08 0.00 0.00 0.00 0.00 54.91 54.81 2k3o h ALA 60 Cb 0.42 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 2k3o h ALA 60 CO 0.01 0.66 -0.02 -0.07 0.00 0.00 0.00 179.25 179.83 2k3o h LEU 61 N 1.11 0.76 -0.04 0.00 3.38 -0.98 0.56 115.31 120.09 2k3o h LEU 61 Ca 0.24 -0.19 -0.00 0.00 0.09 0.00 0.00 57.88 58.02 2k3o h LEU 61 Cb 0.30 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 40.84 2k3o h LEU 61 CO -0.01 0.84 0.03 0.00 0.09 0.00 0.00 178.44 179.39 2k3o h ALA 62 N 1.24 0.05 -0.14 1.53 0.00 -0.78 -1.53 119.26 119.64 2k3o h ALA 62 Ca 0.14 -0.02 -0.06 0.00 0.00 0.00 0.00 54.91 54.96 2k3o h ALA 62 Cb 0.48 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 2k3o h ALA 62 CO 0.02 -0.43 -0.18 1.96 0.00 0.00 0.00 179.25 180.63 2k3o h GLN 63 N 0.02 0.23 0.11 0.00 4.20 -1.11 -0.80 115.11 117.77 2k3o h GLN 63 Ca 0.02 -0.06 -0.01 0.00 0.06 0.00 0.00 58.65 58.66 2k3o h GLN 63 Cb 0.04 -0.03 0.00 0.00 0.30 0.00 0.00 27.48 27.79 2k3o h GLN 63 CO -0.00 0.42 -0.05 0.00 -0.67 0.00 0.00 178.83 178.52 2k3o h ALA 64 N 1.60 -0.15 -0.45 3.87 0.00 -0.59 -0.41 119.26 123.13 2k3o h ALA 64 Ca 0.04 -0.13 -0.09 0.00 0.00 0.00 0.00 54.91 54.74 2k3o h ALA 64 Cb 0.45 0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.29 2k3o h ALA 64 CO 0.03 -0.47 -0.05 0.28 0.00 0.00 0.00 179.25 179.03 2k3o h VAL 65 N -0.38 1.27 0.00 0.00 2.07 -1.24 -2.47 116.25 115.50 2k3o h VAL 65 Ca -0.02 -1.14 -0.01 0.00 0.82 0.00 0.00 66.70 66.36 2k3o h VAL 65 Cb 0.31 1.09 -0.00 0.00 -1.52 0.00 0.00 31.29 31.16 2k3o h VAL 65 CO 0.03 0.39 -0.03 1.23 0.02 0.00 0.00 177.57 179.21 2k3o h GLY 66 N 0.68 0.00 1.58 2.17 0.00 -1.17 -1.93 103.07 104.41 2k3o h GLY 66 Ca 0.12 0.00 -0.11 0.00 0.00 0.00 0.00 47.33 47.35 2k3o h GLY 66 CO 0.03 0.00 -0.30 -1.33 0.00 0.00 0.00 176.54 174.94 2k3o h GLY 67 N 0.68 0.52 1.15 4.60 0.00 -0.57 -2.98 103.07 106.47 2k3o h GLY 67 Ca -0.00 -0.45 -0.32 0.00 0.00 0.00 0.00 47.33 46.56 2k3o h GLY 67 CO 0.00 0.41 -1.59 -2.08 0.00 0.00 0.00 176.54 173.28 2k3o h VAL 68 N 0.41 1.10 -0.84 4.60 2.07 -1.55 -3.52 116.25 118.52 2k3o h VAL 68 Ca 0.05 -2.71 0.09 0.00 0.82 0.00 0.00 66.70 64.96 2k3o h VAL 68 Cb 0.74 2.77 -0.03 0.00 -1.52 0.00 0.00 31.29 33.25 2k3o h VAL 68 CO 0.06 0.83 -0.21 0.61 0.02 0.00 0.00 177.57 178.88 2k3o n GLY 69 N 1.72 -1.97 3.70 2.17 0.00 -0.74 -4.99 105.19 105.09 2k3o n GLY 69 Ca -0.19 -1.41 -0.33 0.00 0.00 0.00 0.00 46.02 44.09 2k3o n GLY 69 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2k3o s ALA 70 N -2.10 1.86 -0.32 4.61 0.00 -1.26 -4.34 121.76 120.21 2k3o s ALA 70 Ca 0.00 0.81 -0.00 0.00 0.00 0.00 0.00 51.96 52.76 2k3o s ALA 70 Cb 0.00 -3.48 -0.00 0.00 0.00 0.00 0.00 23.12 19.64 2k3o s ALA 70 CO 0.00 -2.25 0.27 0.41 0.00 0.00 0.00 175.76 174.19 2k3o n GLY 71 N 0.39 0.24 3.18 0.00 0.00 -1.26 -4.99 105.19 102.75 2k3o n GLY 71 Ca 0.13 -0.29 -0.11 0.00 0.00 0.00 0.00 46.02 45.75 2k3o n GLY 71 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2k3o s ALA 72 N -3.10 1.04 0.53 4.61 0.00 -1.26 -5.16 121.76 118.42 2k3o s ALA 72 Ca 0.02 -1.49 -0.22 0.00 0.00 0.00 0.00 51.96 50.27 2k3o s ALA 72 Cb -0.00 0.64 -0.05 0.00 0.00 0.00 0.00 23.12 23.70 2k3o s ALA 72 CO 0.20 -0.39 1.33 0.45 0.00 0.00 0.00 175.76 177.34 2k3o s SER 73 N -3.09 5.43 0.46 0.00 0.15 -1.26 -4.93 113.70 110.46 2k3o s SER 73 Ca 0.22 2.70 0.18 0.00 0.70 0.00 0.00 55.95 59.75 2k3o s SER 73 Cb 0.07 -2.63 1.15 0.00 -1.71 0.00 0.00 66.02 62.90 2k3o s SER 73 CO 0.01 -1.46 1.97 0.00 1.20 0.00 0.00 173.24 174.96 2k3o h ALA 74 N 1.58 2.20 -0.59 5.45 0.00 -1.96 -1.68 119.26 124.26 2k3o h ALA 74 Ca -0.51 -0.01 -0.08 0.00 0.00 0.00 0.00 54.91 54.31 2k3o h ALA 74 Cb 1.29 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 19.02 2k3o h ALA 74 CO 0.58 -0.36 0.05 1.03 0.00 0.00 0.00 179.25 180.55 2k3o h SER 75 N 0.28 0.95 -0.11 0.00 0.87 -1.94 -0.52 113.55 113.08 2k3o h SER 75 Ca 0.30 -0.24 -0.01 0.00 -1.23 0.00 0.00 61.79 60.61 2k3o h SER 75 Cb 0.78 -0.25 -0.00 0.00 -0.44 0.00 0.00 62.40 62.48 2k3o h SER 75 CO -0.07 0.98 0.02 0.00 -0.53 0.00 0.00 176.83 177.23 2k3o h ALA 76 N 1.13 0.15 -0.39 6.23 0.00 -1.68 0.23 119.26 124.92 2k3o h ALA 76 Ca 0.18 -0.15 -0.06 0.00 0.00 0.00 0.00 54.91 54.87 2k3o h ALA 76 Cb 0.46 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.20 2k3o h ALA 76 CO 0.02 -0.20 -0.01 1.88 0.00 0.00 0.00 179.25 180.94 2k3o h TYR 77 N -0.05 0.76 -0.54 0.00 0.05 -1.49 -1.47 116.97 114.23 2k3o h TYR 77 Ca 0.03 -0.13 -0.02 0.00 0.05 0.00 0.00 58.73 58.66 2k3o h TYR 77 Cb 0.29 -0.20 -0.02 0.00 1.01 0.00 0.00 36.73 37.81 2k3o h TYR 77 CO 0.02 0.78 0.26 0.00 -1.05 0.00 0.00 178.16 178.16 2k3o h ALA 78 N 0.88 0.70 -0.53 3.88 0.00 -1.03 -0.13 119.26 123.02 2k3o h ALA 78 Ca 0.11 -0.13 -0.07 0.00 0.00 0.00 0.00 54.91 54.82 2k3o h ALA 78 Cb 0.48 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 2k3o h ALA 78 CO 0.02 0.26 0.06 -0.97 0.00 0.00 0.00 179.25 178.62 2k3o h ASN 79 N 0.73 0.87 -0.26 0.00 -0.73 -0.95 0.07 115.58 115.30 2k3o h ASN 79 Ca 0.19 -0.27 0.00 0.00 1.87 0.00 0.00 56.30 58.08 2k3o h ASN 79 Cb 0.12 -0.23 -0.01 0.00 0.27 0.00 0.00 38.32 38.47 2k3o h ASN 79 CO -0.02 0.93 0.17 0.00 -0.37 0.00 0.00 177.43 178.14 2k3o h ALA 80 N 0.97 0.33 -0.09 1.57 0.00 -0.97 0.12 119.26 121.20 2k3o h ALA 80 Ca 0.16 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.05 2k3o h ALA 80 Cb 0.44 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.12 2k3o h ALA 80 CO 0.02 -0.19 0.06 0.82 0.00 0.00 0.00 179.25 179.95 2k3o h ILE 81 N 0.35 1.03 0.00 0.00 2.04 -0.95 -1.16 117.51 118.83 2k3o h ILE 81 Ca 0.10 -0.07 -0.07 0.00 1.00 0.00 0.00 64.86 65.82 2k3o h ILE 81 Cb -0.03 0.92 -0.01 0.00 -0.74 0.00 0.00 36.82 36.96 2k3o h ILE 81 CO -0.02 0.03 -0.33 0.00 0.00 0.00 0.00 178.15 177.82 2k3o h ALA 82 N 1.02 1.28 -0.01 1.87 0.00 -0.76 0.15 119.26 122.80 2k3o h ALA 82 Ca 0.03 -0.30 -0.22 0.00 0.00 0.00 0.00 54.91 54.42 2k3o h ALA 82 Cb -0.00 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 17.73 2k3o h ALA 82 CO -0.01 0.42 -0.90 0.07 0.00 0.00 0.00 179.25 178.83 2k3o h ARG 83 N 0.00 0.38 -0.00 0.00 0.11 -0.62 0.65 114.38 114.89 2k3o h ARG 83 Ca -0.00 -0.39 -0.07 0.00 0.10 0.00 0.00 59.98 59.62 2k3o h ARG 83 Cb 0.66 0.11 0.01 0.00 1.11 0.00 0.00 29.97 31.85 2k3o h ARG 83 CO 0.04 1.06 -0.26 0.00 0.10 0.00 0.00 179.97 180.92 2k3o h ALA 84 N 0.80 0.03 -0.49 0.08 0.00 -0.67 0.67 119.26 119.68 2k3o h ALA 84 Ca -0.07 -0.47 0.08 0.00 0.00 0.00 0.00 54.91 54.46 2k3o h ALA 84 Cb 1.53 0.01 -0.07 0.00 0.00 0.00 0.00 17.79 19.26 2k3o h ALA 84 CO 0.15 0.09 0.09 0.00 0.00 0.00 0.00 179.25 179.59 2k3o h ALA 85 N 0.26 0.54 -0.45 0.00 0.00 -0.88 -2.16 119.26 116.57 2k3o h ALA 85 Ca -0.03 0.10 0.09 0.00 0.00 0.00 0.00 54.91 55.07 2k3o h ALA 85 Cb 1.02 0.14 -0.08 0.00 0.00 0.00 0.00 17.79 18.87 2k3o h ALA 85 CO 0.05 -0.31 -0.06 0.78 0.00 0.00 0.00 179.25 179.70 2k3o h GLY 86 N 0.23 0.38 0.94 0.00 0.00 -0.72 0.12 103.07 104.01 2k3o h GLY 86 Ca 0.25 0.11 0.02 0.00 0.00 0.00 0.00 47.33 47.70 2k3o h GLY 86 CO -0.33 -0.15 0.40 1.46 0.00 0.00 0.00 176.54 177.92 2k3o h GLN 87 N 0.04 0.77 -0.23 4.80 4.20 -0.73 -0.10 115.11 123.86 2k3o h GLN 87 Ca 0.22 -0.05 -0.04 0.00 0.06 0.00 0.00 58.65 58.84 2k3o h GLN 87 Cb 0.33 -0.17 -0.01 0.00 0.30 0.00 0.00 27.48 27.93 2k3o h GLN 87 CO -0.42 0.51 0.00 0.35 -0.67 0.00 0.00 178.83 178.60 2k3o h PHE 88 N 0.80 0.45 0.00 2.96 3.04 -0.57 -1.46 116.94 122.16 2k3o h PHE 88 Ca 0.24 -0.08 -0.08 0.00 3.98 0.00 0.00 57.97 62.03 2k3o h PHE 88 Cb -0.04 -0.12 -0.01 0.00 2.56 0.00 0.00 35.95 38.35 2k3o h PHE 88 CO -0.04 0.58 -0.39 -0.07 -2.02 0.00 0.00 178.31 176.37 2k3o h LEU 89 N 0.19 0.00 -0.16 0.59 4.07 -0.76 -1.50 115.31 117.73 2k3o h LEU 89 Ca 0.07 0.00 -0.03 0.00 0.08 0.00 0.00 57.88 57.99 2k3o h LEU 89 Cb 0.40 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 42.14 2k3o h LEU 89 CO 0.01 0.39 -0.04 0.00 -1.08 0.00 0.00 178.44 177.73 2k3o h ALA 90 N 1.61 0.22 0.00 1.53 0.00 -0.89 -0.85 119.26 120.88 2k3o h ALA 90 Ca -0.00 -0.23 -0.04 0.00 0.00 0.00 0.00 54.91 54.63 2k3o h ALA 90 Cb 0.79 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.52 2k3o h ALA 90 CO 0.05 -0.02 -0.18 1.79 0.00 0.00 0.00 179.25 180.88 2k3o h THR 91 N 0.02 0.65 0.00 0.00 1.35 -1.07 -1.34 112.91 112.52 2k3o h THR 91 Ca 0.04 -0.80 0.00 0.00 -0.55 0.00 0.00 66.41 65.10 2k3o h THR 91 Cb 0.46 1.51 0.00 0.00 -1.73 0.00 0.00 68.15 68.40 2k3o h THR 91 CO 0.02 0.18 0.00 0.00 -0.25 0.00 0.00 175.52 175.47 2k3o n GLN 92 N -3.62 0.06 -1.08 4.72 1.13 -0.58 -4.94 117.38 113.07 2k3o n GLN 92 Ca -0.01 0.09 -0.03 0.00 -1.94 0.00 0.00 57.00 55.11 2k3o n GLN 92 Cb 0.32 -1.58 -0.01 0.00 0.11 0.00 0.00 30.24 29.08 2k3o n GLN 92 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2k3o n GLY 93 N 1.23 0.52 0.25 1.08 0.00 -0.51 -4.91 105.19 102.85 2k3o n GLY 93 Ca 0.06 -0.17 -0.01 0.00 0.00 0.00 0.00 46.02 45.90 2k3o n GLY 93 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2k3o h VAL 94 N 0.00 1.22 -3.08 1.61 2.07 -1.42 -3.41 116.25 113.25 2k3o h VAL 94 Ca -0.06 -1.00 -0.57 0.00 0.82 0.00 0.00 66.70 65.89 2k3o h VAL 94 Cb 0.51 1.17 -0.05 0.00 -1.52 0.00 0.00 31.29 31.40 2k3o h VAL 94 CO 0.09 0.32 0.78 -0.76 0.02 0.00 0.00 177.57 178.02 2k3o s LEU 95 N -8.83 4.15 0.10 2.57 1.43 -1.11 -4.83 118.68 112.16 2k3o s LEU 95 Ca -0.07 1.49 -0.13 0.00 -1.03 0.00 0.00 54.13 54.39 2k3o s LEU 95 Cb 0.15 -3.54 0.02 0.00 0.03 0.00 0.00 46.19 42.85 2k3o s LEU 95 CO 0.77 -0.65 0.32 0.54 0.23 0.00 0.00 176.35 177.56 2k3o s ASN 96 N 1.35 -0.11 0.05 2.29 2.20 -1.26 -4.91 114.94 114.56 2k3o s ASN 96 Ca 0.47 -0.39 0.09 0.00 -0.94 0.00 0.00 52.86 52.09 2k3o s ASN 96 Cb -0.17 0.41 0.40 0.00 -2.00 0.00 0.00 41.25 39.89 2k3o s ASN 96 CO 0.11 -0.77 1.28 0.00 -2.94 0.00 0.00 177.10 174.77 2k3o n ALA 97 N -0.02 1.27 -0.02 3.54 0.00 -1.26 -0.90 120.51 123.13 2k3o n ALA 97 Ca -0.16 0.01 -0.09 0.00 0.00 0.00 0.00 53.44 53.20 2k3o n ALA 97 Cb 0.62 -1.14 -0.04 0.00 0.00 0.00 0.00 19.45 18.90 2k3o n ALA 97 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2k3o h VAL 98 N 0.00 0.81 0.00 0.00 2.07 -1.98 -3.44 116.25 113.72 2k3o h VAL 98 Ca 0.00 0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.48 2k3o h VAL 98 Cb 0.11 0.81 -0.04 0.00 -1.52 0.00 0.00 31.29 30.66 2k3o h VAL 98 CO 0.00 0.00 -0.07 -0.46 0.02 0.00 0.00 177.57 177.06 2k3o n ASN 99 N -5.19 -0.33 -0.28 0.57 2.04 -1.04 -5.02 115.26 106.02 2k3o n ASN 99 Ca -0.03 -1.01 0.27 0.00 -0.44 0.00 0.00 54.58 53.36 2k3o n ASN 99 Cb 0.12 0.14 0.63 0.00 -2.53 0.00 0.00 39.78 38.14 2k3o n ASN 99 CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 2k3o h ALA 100 N 0.16 2.63 0.37 -2.53 0.00 -1.31 -0.93 119.26 117.65 2k3o h ALA 100 Ca -0.13 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.77 2k3o h ALA 100 Cb 0.95 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.79 2k3o h ALA 100 CO -0.06 -0.96 -0.18 1.03 0.00 0.00 0.00 179.25 179.08 2k3o h SER 101 N 0.19 -0.43 -0.11 0.00 0.87 -1.84 -3.24 113.55 108.98 2k3o h SER 101 Ca 0.53 0.02 0.03 0.00 -1.23 0.00 0.00 61.79 61.14 2k3o h SER 101 Cb 1.72 0.11 -0.00 0.00 -0.44 0.00 0.00 62.40 63.79 2k3o h SER 101 CO -0.13 -0.30 0.10 0.28 -0.53 0.00 0.00 176.83 176.24 2k3o h SER 102 N -0.50 0.00 0.40 6.23 0.02 -1.63 0.47 113.55 118.54 2k3o h SER 102 Ca -0.05 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 60.89 2k3o h SER 102 Cb 0.38 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.92 2k3o h SER 102 CO 0.08 0.00 -0.04 -0.07 -1.14 0.00 0.00 176.83 175.66 2k3o h LEU 103 N 0.00 0.00 -0.42 5.07 3.38 -1.29 -2.13 115.31 119.92 2k3o h LEU 103 Ca 0.05 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.96 2k3o h LEU 103 Cb 0.25 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.98 2k3o h LEU 103 CO -0.00 0.04 0.02 1.23 0.09 0.00 0.00 178.44 179.82 2k3o h GLY 104 N 0.84 0.79 0.97 0.83 0.00 -0.94 -0.49 103.07 105.07 2k3o h GLY 104 Ca -0.00 -0.57 0.02 0.00 0.00 0.00 0.00 47.33 46.78 2k3o h GLY 104 CO 0.01 0.52 0.57 1.76 0.00 0.00 0.00 176.54 179.40 2k3o h SER 105 N 0.57 0.97 -0.66 0.19 0.02 -1.50 -0.55 113.55 112.60 2k3o h SER 105 Ca 0.12 -0.02 -0.02 0.00 -0.84 0.00 0.00 61.79 61.03 2k3o h SER 105 Cb 0.46 -0.24 -0.03 0.00 0.14 0.00 0.00 62.40 62.73 2k3o h SER 105 CO 0.02 0.69 0.35 0.00 -1.14 0.00 0.00 176.83 176.75 2k3o h ALA 106 N 1.33 0.85 -0.14 3.77 0.00 -1.10 0.89 119.26 124.85 2k3o h ALA 106 Ca 0.32 -0.12 -0.02 0.00 0.00 0.00 0.00 54.91 55.10 2k3o h ALA 106 Cb -0.10 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.43 2k3o h ALA 106 CO -0.08 0.38 0.03 1.25 0.00 0.00 0.00 179.25 180.83 2k3o h LEU 107 N 0.91 0.22 -1.66 0.00 5.85 -0.95 -2.13 115.31 117.56 2k3o h LEU 107 Ca 0.23 -0.24 0.08 0.00 0.84 0.00 0.00 57.88 58.78 2k3o h LEU 107 Cb 0.07 -0.06 -0.03 0.00 0.37 0.00 0.00 40.66 41.01 2k3o h LEU 107 CO -0.03 0.41 0.36 0.00 -0.34 0.00 0.00 178.44 178.84 2k3o h ALA 108 N 0.82 1.98 -0.48 1.25 0.00 -0.83 0.23 119.26 122.23 2k3o h ALA 108 Ca 0.04 -0.01 -0.10 0.00 0.00 0.00 0.00 54.91 54.84 2k3o h ALA 108 Cb 0.28 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.96 2k3o h ALA 108 CO 0.00 -0.09 -0.10 -0.91 0.00 0.00 0.00 179.25 178.16 2k3o h ASN 109 N 0.40 0.91 -0.28 0.00 2.35 -0.69 0.56 115.58 118.84 2k3o h ASN 109 Ca 0.24 -0.35 -0.00 0.00 -0.55 0.00 0.00 56.30 55.64 2k3o h ASN 109 Cb 0.43 -0.25 -0.01 0.00 0.05 0.00 0.00 38.32 38.54 2k3o h ASN 109 CO -0.06 1.05 0.16 0.00 -1.65 0.00 0.00 177.43 176.93 2k3o h ALA 110 N 0.89 0.35 -0.63 -0.83 0.00 -0.42 -0.45 119.26 118.17 2k3o h ALA 110 Ca 0.12 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.95 2k3o h ALA 110 Cb 0.64 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.29 2k3o h ALA 110 CO 0.04 -0.14 0.26 -0.07 0.00 0.00 0.00 179.25 179.35 2k3o h LEU 111 N 0.34 0.84 -0.32 0.00 3.38 -0.99 -1.46 115.31 117.09 2k3o h LEU 111 Ca 0.10 -0.11 -0.04 0.00 0.09 0.00 0.00 57.88 57.92 2k3o h LEU 111 Cb 0.03 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.55 2k3o h LEU 111 CO -0.02 0.74 0.03 -1.28 0.09 0.00 0.00 178.44 178.01 2k3o h SER 112 N 0.91 0.53 -0.48 -0.43 0.87 -0.65 0.12 113.55 114.41 2k3o h SER 112 Ca 0.22 -0.28 0.07 0.00 -1.23 0.00 0.00 61.79 60.57 2k3o h SER 112 Cb 0.16 -0.14 -0.06 0.00 -0.44 0.00 0.00 62.40 61.92 2k3o h SER 112 CO -0.02 0.67 0.16 0.44 -0.53 0.00 0.00 176.83 177.55 2k3o h ASP 113 N 0.37 0.14 -0.74 6.23 3.32 -0.92 -0.53 116.42 124.28 2k3o h ASP 113 Ca 0.10 0.06 -0.03 0.00 0.02 0.00 0.00 57.03 57.18 2k3o h ASP 113 Cb 0.38 0.06 -0.03 0.00 0.22 0.00 0.00 39.33 39.95 2k3o h ASP 113 CO 0.01 0.11 0.35 0.28 -1.72 0.00 0.00 179.24 178.27 2k3o h SER 114 N 0.32 0.97 0.44 6.45 0.02 -0.95 0.10 113.55 120.89 2k3o h SER 114 Ca 0.23 -0.14 -0.20 0.00 -0.84 0.00 0.00 61.79 60.85 2k3o h SER 114 Cb 0.25 -0.25 -0.01 0.00 0.14 0.00 0.00 62.40 62.54 2k3o h SER 114 CO -0.25 0.83 -0.84 0.00 -1.14 0.00 0.00 176.83 175.43 2k3o h ALA 115 N 1.17 0.52 -0.57 3.77 0.00 -0.50 -1.73 119.26 121.93 2k3o h ALA 115 Ca 0.25 -0.68 -0.07 0.00 0.00 0.00 0.00 54.91 54.41 2k3o h ALA 115 Cb 0.12 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 2k3o h ALA 115 CO -0.03 0.84 0.10 0.00 0.00 0.00 0.00 179.25 180.16 2k3o h ALA 116 N 0.92 0.75 -0.12 0.00 0.00 -1.08 -2.93 119.26 116.80 2k3o h ALA 116 Ca -0.05 -0.25 0.03 0.00 0.00 0.00 0.00 54.91 54.65 2k3o h ALA 116 Cb 1.45 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 19.02 2k3o h ALA 116 CO 0.14 0.49 0.11 -0.97 0.00 0.00 0.00 179.25 179.01 2k3o h ASN 117 N 0.83 0.00 -0.02 0.00 -1.24 -0.77 -1.83 115.58 112.55 2k3o h ASN 117 Ca 0.17 0.00 0.01 0.00 0.71 0.00 0.00 56.30 57.19 2k3o h ASN 117 Cb 0.40 0.00 -0.00 0.00 0.73 0.00 0.00 38.32 39.45 2k3o h ASN 117 CO 0.01 0.00 0.12 0.28 -1.29 0.00 0.00 177.43 176.55 2k3o h SER 118 N 0.00 0.00 0.89 1.15 0.02 -1.12 0.16 113.55 114.66 2k3o h SER 118 Ca 0.06 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.01 2k3o h SER 118 Cb 0.27 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.81 2k3o h SER 118 CO -0.00 0.00 0.00 0.00 -1.14 0.00 0.00 176.83 175.69 2k3o n ALA 119 N -2.06 1.92 -0.25 3.77 0.00 -0.69 -3.13 120.51 120.07 2k3o n ALA 119 Ca -0.02 -0.01 -0.04 0.00 0.00 0.00 0.00 53.44 53.37 2k3o n ALA 119 Cb 0.19 -1.38 0.06 0.00 0.00 0.00 0.00 19.45 18.32 2k3o n ALA 119 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2k3o h VAL 120 N 0.00 1.16 0.00 0.00 2.07 -1.13 -2.71 116.25 115.63 2k3o h VAL 120 Ca 0.00 -0.32 -0.03 0.00 0.82 0.00 0.00 66.70 67.17 2k3o h VAL 120 Cb 0.44 0.14 -0.00 0.00 -1.52 0.00 0.00 31.29 30.35 2k3o h VAL 120 CO 0.00 0.17 -0.15 0.28 0.02 0.00 0.00 177.57 177.89 2k3o h SER 121 N 0.93 0.00 -5.17 0.57 0.02 -1.71 -3.47 113.55 104.72 2k3o h SER 121 Ca 0.27 0.00 -0.35 0.00 -0.84 0.00 0.00 61.79 60.87 2k3o h SER 121 Cb -0.07 0.00 -0.06 0.00 0.14 0.00 0.00 62.40 62.40 2k3o h SER 121 CO -0.07 0.15 -0.51 0.61 -1.14 0.00 0.00 176.83 175.87 2k3o n GLY 122 N -0.19 -0.49 0.00 -3.77 0.00 -1.02 -4.67 105.19 95.04 2k3o n GLY 122 Ca -0.01 0.07 0.00 0.00 0.00 0.00 0.00 46.02 46.09 2k3o n GLY 122 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2k3o n ASN 123 N -2.21 0.00 0.22 1.61 0.23 -1.26 -4.88 115.26 108.98 2k3o n ASN 123 Ca -0.04 0.00 0.07 0.00 -0.53 0.00 0.00 54.58 54.08 2k3o n ASN 123 Cb 0.55 0.00 0.52 0.00 -2.08 0.00 0.00 39.78 38.77 2k3o n ASN 123 CO 0.00 0.00 0.00 0.22 -0.93 0.00 0.00 177.26 176.55 2k3o h TYR 124 N 0.00 0.00 0.00 -2.53 5.03 -1.85 -3.16 116.97 114.46 2k3o h TYR 124 Ca 0.00 0.00 0.00 0.00 2.58 0.00 0.00 58.73 61.31 2k3o h TYR 124 Cb 0.00 0.00 0.00 0.00 1.55 0.00 0.00 36.73 38.28 2k3o h TYR 124 CO 0.00 0.24 0.00 1.28 -1.32 0.00 0.00 178.16 178.36 2k3o n LEU 125 N -3.94 3.57 0.00 2.82 4.77 -1.26 -4.77 117.00 118.20 2k3o n LEU 125 Ca -0.02 -1.63 0.00 0.00 -0.03 0.00 0.00 56.01 54.33 2k3o n LEU 125 Cb 0.32 -0.74 0.00 0.00 -2.33 0.00 0.00 43.42 40.67 2k3o n LEU 125 CO 0.35 0.67 0.00 0.61 -1.33 0.00 0.00 177.39 177.69 2k3o n GLY 126 N 1.48 1.12 1.38 -0.72 0.00 -1.19 -4.83 105.19 102.43 2k3o n GLY 126 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2k3o n GLY 126 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 2k3o n VAL 127 N 0.00 -3.16 -3.86 1.61 3.14 -1.24 -5.03 118.33 109.80 2k3o n VAL 127 Ca 0.00 1.51 -0.09 0.00 -2.96 0.00 0.00 64.34 62.80 2k3o n VAL 127 Cb 0.00 -2.34 -0.04 0.00 -1.06 0.00 0.00 33.84 30.40 2k3o n VAL 127 CO 0.00 0.00 0.00 -0.44 -6.46 0.00 0.00 176.83 169.93 2k3o s SER 128 N -4.60 -0.19 -0.04 6.55 0.01 -1.26 -5.09 113.70 109.09 2k3o s SER 128 Ca 0.00 -0.67 0.25 0.00 1.31 0.00 0.00 55.95 56.85 2k3o s SER 128 Cb 0.00 0.60 0.44 0.00 0.21 0.00 0.00 66.02 67.27 2k3o s SER 128 CO 0.00 -1.13 1.16 0.00 0.41 0.00 0.00 173.24 173.68 2k3o n GLN 129 N -0.37 0.27 0.00 12.44 10.64 -1.26 -5.18 117.38 133.91 2k3o n GLN 129 Ca -0.06 -2.23 0.01 0.00 -1.83 0.00 0.00 57.00 52.89 2k3o n GLN 129 Cb 0.62 -0.25 0.01 0.00 -0.86 0.00 0.00 30.24 29.76 2k3o n GLN 129 CO 0.00 0.00 0.00 0.09 -1.83 0.00 0.00 177.06 175.32