#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kdx s SER 2 N 0.00 5.10 -0.03 1.61 1.04 -1.26 -4.91 113.70 115.26 2kdx s SER 2 Ca 0.00 -0.32 -0.03 0.00 0.48 0.00 0.00 55.95 56.09 2kdx s SER 2 Cb 0.00 -2.55 0.01 0.00 0.10 0.00 0.00 66.02 63.58 2kdx s SER 2 CO 0.00 -2.70 0.07 -0.32 0.98 0.00 0.00 173.24 171.28 2kdx s MET 3 N 7.14 0.10 0.17 4.02 -2.45 -1.26 -5.09 119.30 121.92 2kdx s MET 3 Ca 0.71 0.09 -0.14 0.00 -1.25 0.00 0.00 55.69 55.10 2kdx s MET 3 Cb -0.09 0.05 0.14 0.00 1.25 0.00 0.00 34.83 36.18 2kdx s MET 3 CO 0.06 -0.01 1.74 1.25 1.05 0.00 0.00 175.02 179.11 2kdx h HIS 4 N 5.99 0.23 0.00 4.11 -0.00 -2.00 -1.29 115.15 122.18 2kdx h HIS 4 Ca -0.25 0.02 0.00 0.00 -0.00 0.00 0.00 60.37 60.15 2kdx h HIS 4 Cb 1.20 -0.04 0.00 0.00 -0.00 0.00 0.00 27.41 28.58 2kdx h HIS 4 CO 0.41 0.07 0.00 1.05 -0.00 0.00 0.00 177.93 179.46 2kdx h GLU 5 N 0.29 0.00 -0.02 5.26 4.11 -1.99 -1.96 114.58 120.28 2kdx h GLU 5 Ca 0.22 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.65 2kdx h GLU 5 Cb 0.24 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.49 2kdx h GLU 5 CO -0.24 0.00 -0.25 0.66 0.07 0.00 0.00 179.01 179.24 2kdx n TYR 6 N -2.66 0.00 0.02 2.06 4.01 -0.58 -4.51 117.16 115.50 2kdx n TYR 6 Ca -0.00 0.00 -0.11 0.00 -0.16 0.00 0.00 57.90 57.63 2kdx n TYR 6 Cb 0.16 0.00 -0.05 0.00 -0.31 0.00 0.00 39.34 39.14 2kdx n TYR 6 CO 0.00 0.00 0.00 1.03 -0.46 0.00 0.00 176.86 177.43 2kdx h SER 7 N 2.70 -0.10 0.01 7.72 0.87 -0.50 -0.67 113.55 123.58 2kdx h SER 7 Ca 0.00 0.03 0.03 0.00 -1.23 0.00 0.00 61.79 60.61 2kdx h SER 7 Cb 0.70 0.06 -0.03 0.00 -0.44 0.00 0.00 62.40 62.68 2kdx h SER 7 CO 0.00 -0.04 -0.18 0.58 -0.53 0.00 0.00 176.83 176.66 2kdx h VAL 8 N -0.03 0.57 0.61 2.23 2.07 -1.79 -1.14 116.25 118.76 2kdx h VAL 8 Ca 0.03 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.53 2kdx h VAL 8 Cb 0.08 0.57 -0.01 0.00 -1.52 0.00 0.00 31.29 30.41 2kdx h VAL 8 CO -0.08 0.00 -0.48 0.58 0.02 0.00 0.00 177.57 177.61 2kdx h VAL 9 N -0.30 0.05 -0.86 2.57 2.07 -1.75 -0.59 116.25 117.44 2kdx h VAL 9 Ca 0.05 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.60 2kdx h VAL 9 Cb 0.36 0.05 -0.05 0.00 -1.52 0.00 0.00 31.29 30.13 2kdx h VAL 9 CO -0.16 0.00 0.56 -1.28 0.02 0.00 0.00 177.57 176.71 2kdx h SER 10 N -1.06 0.94 0.24 0.57 0.87 -1.16 -2.22 113.55 111.73 2kdx h SER 10 Ca -0.08 -0.01 -0.01 0.00 -1.23 0.00 0.00 61.79 60.46 2kdx h SER 10 Cb 0.89 -0.22 0.00 0.00 -0.44 0.00 0.00 62.40 62.63 2kdx h SER 10 CO 0.01 0.65 -0.11 -1.28 -0.53 0.00 0.00 176.83 175.57 2kdx h SER 11 N 1.10 -0.27 0.27 6.23 0.87 -0.96 -0.46 113.55 120.33 2kdx h SER 11 Ca 0.34 -0.04 0.01 0.00 -1.23 0.00 0.00 61.79 60.87 2kdx h SER 11 Cb -0.03 0.07 -0.03 0.00 -0.44 0.00 0.00 62.40 61.98 2kdx h SER 11 CO -0.11 -0.14 -0.35 0.25 -0.53 0.00 0.00 176.83 175.95 2kdx h LEU 12 N -0.38 -0.97 -0.28 2.23 7.12 -0.97 -1.51 115.31 120.54 2kdx h LEU 12 Ca -0.03 0.09 0.04 0.00 0.13 0.00 0.00 57.88 58.11 2kdx h LEU 12 Cb 0.29 0.34 -0.04 0.00 -0.53 0.00 0.00 40.66 40.72 2kdx h LEU 12 CO 0.05 -0.47 0.05 0.40 -0.13 0.00 0.00 178.44 178.35 2kdx h ILE 13 N -0.67 0.87 -0.37 4.05 2.04 -1.42 -0.71 117.51 121.30 2kdx h ILE 13 Ca -0.00 -0.05 -0.01 0.00 1.00 0.00 0.00 64.86 65.79 2kdx h ILE 13 Cb 0.64 0.69 -0.02 0.00 -0.74 0.00 0.00 36.82 37.39 2kdx h ILE 13 CO -0.11 0.03 0.18 0.00 0.00 0.00 0.00 178.15 178.24 2kdx h ALA 14 N 1.21 0.48 -0.31 1.87 0.00 -0.95 0.19 119.26 121.75 2kdx h ALA 14 Ca 0.13 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.94 2kdx h ALA 14 Cb 0.14 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 2kdx h ALA 14 CO -0.17 0.04 0.20 -0.07 0.00 0.00 0.00 179.25 179.26 2kdx h LEU 15 N 0.47 0.35 -0.41 0.00 -0.00 -1.12 -0.44 115.31 114.16 2kdx h LEU 15 Ca 0.13 -0.01 0.08 0.00 -0.00 0.00 0.00 57.88 58.08 2kdx h LEU 15 Cb 0.12 -0.09 -0.07 0.00 -0.00 0.00 0.00 40.66 40.62 2kdx h LEU 15 CO -0.02 0.25 -0.04 0.00 -0.00 0.00 0.00 178.44 178.64 2kdx h GLU 17 N 0.06 0.90 -0.22 0.00 4.81 -0.69 -1.37 114.58 118.06 2kdx h GLU 17 Ca 0.20 -0.07 -0.04 0.00 -0.13 0.00 0.00 59.36 59.32 2kdx h GLU 17 Cb 0.29 -0.19 -0.01 0.00 0.63 0.00 0.00 28.75 29.47 2kdx h GLU 17 CO -0.37 0.63 -0.01 1.49 -0.73 0.00 0.00 179.01 180.02 2kdx h GLU 18 N 0.92 0.40 -0.77 1.92 4.57 -0.37 -2.58 114.58 118.67 2kdx h GLU 18 Ca 0.24 -0.13 -0.01 0.00 -1.18 0.00 0.00 59.36 58.27 2kdx h GLU 18 Cb -0.04 -0.03 -0.04 0.00 -0.16 0.00 0.00 28.75 28.48 2kdx h GLU 18 CO -0.05 0.60 0.43 0.45 -1.18 0.00 0.00 179.01 179.26 2kdx h HIS 19 N 0.16 1.05 0.36 0.92 3.86 -1.06 -2.72 115.15 117.73 2kdx h HIS 19 Ca 0.06 -0.02 -0.02 0.00 -1.16 0.00 0.00 60.37 59.23 2kdx h HIS 19 Cb 0.42 -0.34 0.00 0.00 1.06 0.00 0.00 27.41 28.56 2kdx h HIS 19 CO 0.04 0.74 -0.17 0.00 0.86 0.00 0.00 177.93 179.39 2kdx h ALA 20 N 1.22 -0.48 -0.20 2.45 0.00 -1.18 -0.64 119.26 120.43 2kdx h ALA 20 Ca 0.27 -0.12 -0.02 0.00 0.00 0.00 0.00 54.91 55.04 2kdx h ALA 20 Cb 0.03 0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 2kdx h ALA 20 CO -0.04 -0.75 0.02 1.57 0.00 0.00 0.00 179.25 180.05 2kdx h LYS 21 N -0.53 0.29 -0.14 0.00 2.10 -1.51 0.77 116.57 117.55 2kdx h LYS 21 Ca -0.05 -0.04 -0.20 0.00 -2.00 0.00 0.00 60.65 58.36 2kdx h LYS 21 Cb 0.40 -0.05 0.00 0.00 -0.90 0.00 0.00 32.23 31.68 2kdx h LYS 21 CO 0.08 0.30 -0.72 -0.22 -2.00 0.00 0.00 179.45 176.89 2kdx h LYS 22 N 0.28 0.64 -0.00 0.07 1.63 -1.23 -2.67 116.57 115.29 2kdx h LYS 22 Ca 0.07 -0.50 0.00 0.00 -0.85 0.00 0.00 60.65 59.37 2kdx h LYS 22 Cb 0.16 0.10 0.00 0.00 -0.60 0.00 0.00 32.23 31.89 2kdx h LYS 22 CO 0.00 1.12 -0.01 -1.71 -3.45 0.00 0.00 179.45 175.39 2kdx n ASN 23 N -3.91 0.27 -2.80 4.20 5.15 -0.27 -4.94 115.26 112.96 2kdx n ASN 23 Ca -0.06 -0.91 -0.19 0.00 -0.60 0.00 0.00 54.58 52.83 2kdx n ASN 23 Cb 0.71 -0.05 0.00 0.00 -0.53 0.00 0.00 39.78 39.92 2kdx n ASN 23 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2kdx n GLN 24 N -0.86 -3.09 0.08 1.20 6.02 -0.26 -4.91 117.38 115.54 2kdx n GLN 24 Ca 0.21 0.72 -0.11 0.00 -0.01 0.00 0.00 57.00 57.81 2kdx n GLN 24 Cb 0.18 -5.43 -0.03 0.00 1.02 0.00 0.00 30.24 25.99 2kdx n GLN 24 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2kdx h ALA 25 N 0.99 0.43 0.00 -1.58 0.00 -1.20 -3.48 119.26 114.43 2kdx h ALA 25 Ca -0.42 -0.72 0.00 0.00 0.00 0.00 0.00 54.91 53.76 2kdx h ALA 25 Cb 1.30 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.04 2kdx h ALA 25 CO 0.49 0.87 0.00 0.72 0.00 0.00 0.00 179.25 181.33 2kdx n HIS 26 N -3.69 0.00 -3.81 0.00 8.25 -1.26 -4.87 115.22 109.84 2kdx n HIS 26 Ca -0.05 0.00 -0.05 0.00 -0.26 0.00 0.00 57.72 57.36 2kdx n HIS 26 Cb 0.83 -1.49 -0.01 0.00 1.12 0.00 0.00 29.99 30.44 2kdx n HIS 26 CO 0.00 0.00 0.00 -1.59 0.64 0.00 0.00 176.34 175.39 2kdx s LYS 27 N -1.16 1.48 0.08 -0.41 -2.85 -1.26 -4.22 119.74 111.40 2kdx s LYS 27 Ca 0.00 -0.83 0.05 0.00 -1.00 0.00 0.00 55.97 54.19 2kdx s LYS 27 Cb 0.00 0.50 -0.03 0.00 -2.06 0.00 0.00 37.83 36.24 2kdx s LYS 27 CO 0.00 -0.68 -0.13 0.42 0.10 0.00 0.00 175.35 175.06 2kdx s ILE 28 N -3.50 1.04 -0.15 3.79 -1.09 -1.00 -4.66 121.20 115.64 2kdx s ILE 28 Ca 0.12 -1.35 -0.11 0.00 -2.23 0.00 0.00 60.65 57.07 2kdx s ILE 28 Cb -0.03 -1.09 -0.04 0.00 -1.58 0.00 0.00 42.46 39.72 2kdx s ILE 28 CO 0.05 -0.30 -0.22 1.21 -1.23 0.00 0.00 174.94 174.44 2kdx n GLU 29 N 1.15 0.46 -3.80 2.79 2.13 -0.16 -3.83 120.64 119.38 2kdx n GLU 29 Ca -0.20 0.42 -0.09 0.00 0.66 0.00 0.00 57.16 57.94 2kdx n GLU 29 Cb 0.55 -1.57 -0.04 0.00 0.27 0.00 0.00 31.44 30.64 2kdx n GLU 29 CO 0.00 0.00 0.00 -0.98 -0.41 0.00 0.00 177.13 175.74 2kdx s ARG 30 N -2.39 1.37 -0.15 5.31 1.70 -0.83 -2.44 118.95 121.51 2kdx s ARG 30 Ca -0.18 -0.95 0.00 0.00 -0.47 0.00 0.00 55.73 54.13 2kdx s ARG 30 Cb 0.03 0.50 0.03 0.00 -0.57 0.00 0.00 34.95 34.93 2kdx s ARG 30 CO 0.27 -0.57 -0.10 0.14 -1.08 0.00 0.00 175.30 173.96 2kdx s VAL 31 N -3.90 1.36 -0.15 4.99 -7.23 -0.17 -0.58 120.40 114.72 2kdx s VAL 31 Ca 0.12 -0.62 -0.19 0.00 -1.81 0.00 0.00 61.98 59.48 2kdx s VAL 31 Cb -0.00 -1.38 -0.04 0.00 0.56 0.00 0.00 36.38 35.52 2kdx s VAL 31 CO -0.01 0.32 0.52 -0.69 -0.31 0.00 0.00 175.10 174.92 2kdx s VAL 32 N 1.55 5.14 -0.11 1.32 1.01 0.39 -0.76 120.40 128.94 2kdx s VAL 32 Ca 0.03 1.00 0.00 0.00 0.00 0.00 0.00 61.98 63.01 2kdx s VAL 32 Cb -0.14 -3.85 0.02 0.00 0.00 0.00 0.00 36.38 32.42 2kdx s VAL 32 CO -0.09 0.26 -0.09 -0.69 0.00 0.00 0.00 175.10 174.49 2kdx s VAL 33 N 1.07 1.07 -0.26 2.92 1.01 -0.46 -0.65 120.40 125.09 2kdx s VAL 33 Ca 0.26 -0.33 -0.21 0.00 0.00 0.00 0.00 61.98 61.70 2kdx s VAL 33 Cb -0.15 -1.06 -0.02 0.00 0.00 0.00 0.00 36.38 35.15 2kdx s VAL 33 CO 0.11 0.37 0.65 -0.83 0.00 0.00 0.00 175.10 175.40 2kdx s GLY 34 N 1.53 1.80 -0.07 4.51 0.00 0.02 -0.66 107.32 114.46 2kdx s GLY 34 Ca 0.02 -0.42 0.02 0.00 0.00 0.00 0.00 44.72 44.34 2kdx s GLY 34 CO -0.07 1.49 -0.12 -0.42 0.00 0.00 0.00 173.10 173.98 2kdx s ILE 35 N 2.56 1.13 0.48 0.90 1.01 -0.18 -1.82 121.20 125.27 2kdx s ILE 35 Ca 0.27 -0.47 -0.24 0.00 0.00 0.00 0.00 60.65 60.21 2kdx s ILE 35 Cb -0.15 -1.03 -0.07 0.00 0.01 0.00 0.00 42.46 41.21 2kdx s ILE 35 CO 0.09 0.35 1.40 0.61 0.00 0.00 0.00 174.94 177.39 2kdx n GLY 36 N 3.86 0.91 0.10 6.18 0.00 -1.26 -0.79 105.19 114.19 2kdx n GLY 36 Ca -0.23 0.14 -0.03 0.00 0.00 0.00 0.00 46.02 45.90 2kdx n GLY 36 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 2kdx h GLU 37 N 2.03 0.00 -0.09 1.61 9.09 -1.21 -2.97 114.58 123.04 2kdx h GLU 37 Ca -0.51 0.00 0.00 0.00 0.05 0.00 0.00 59.36 58.90 2kdx h GLU 37 Cb 1.28 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.38 2kdx h GLU 37 CO 0.60 0.77 0.00 0.54 0.05 0.00 0.00 179.01 180.97 2kdx n ARG 38 N -3.42 1.94 0.28 1.06 5.12 -1.26 -4.54 116.66 115.84 2kdx n ARG 38 Ca 0.00 -1.38 0.17 0.00 -1.93 0.00 0.00 57.85 54.72 2kdx n ARG 38 Cb 0.80 -1.46 0.81 0.00 -1.16 0.00 0.00 32.46 31.45 2kdx n ARG 38 CO 0.00 0.00 0.00 0.66 -1.93 0.00 0.00 177.63 176.36 2kdx h SER 39 N 3.14 0.00 -1.89 0.55 4.64 -1.83 -3.47 113.55 114.69 2kdx h SER 39 Ca 0.00 0.00 -0.30 0.00 -0.47 0.00 0.00 61.79 61.02 2kdx h SER 39 Cb 0.67 0.00 -0.09 0.00 -0.31 0.00 0.00 62.40 62.67 2kdx h SER 39 CO 0.00 0.05 -0.31 0.00 -0.87 0.00 0.00 176.83 175.70 2kdx n ALA 40 N -2.14 -0.36 -1.73 5.18 0.00 -1.26 -4.96 120.51 115.24 2kdx n ALA 40 Ca -0.01 0.21 -0.42 0.00 0.00 0.00 0.00 53.44 53.22 2kdx n ALA 40 Cb 0.25 -1.59 -0.01 0.00 0.00 0.00 0.00 19.45 18.09 2kdx n ALA 40 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 2kdx n MET 41 N -2.22 2.50 -1.09 0.00 2.81 -1.26 -4.89 117.12 112.96 2kdx n MET 41 Ca -0.16 0.88 -0.32 0.00 -1.81 0.00 0.00 57.70 56.29 2kdx n MET 41 Cb 0.53 -2.61 -0.02 0.00 -0.71 0.00 0.00 33.22 30.40 2kdx n MET 41 CO 0.00 0.00 0.00 -0.25 1.51 0.00 0.00 175.97 177.23 2kdx n ASP 42 N 1.80 6.38 -0.15 7.83 8.00 -1.26 -4.76 116.55 134.38 2kdx n ASP 42 Ca 0.08 -2.49 0.17 0.00 0.71 0.00 0.00 54.79 53.25 2kdx n ASP 42 Cb 0.36 -1.34 0.54 0.00 -0.02 0.00 0.00 41.12 40.65 2kdx n ASP 42 CO 0.00 0.00 0.00 0.07 -0.39 0.00 0.00 177.20 176.88 2kdx h LYS 43 N 5.82 0.33 -0.53 -1.24 2.10 -1.99 -1.03 116.57 120.03 2kdx h LYS 43 Ca 0.66 -0.02 -0.01 0.00 -2.00 0.00 0.00 60.65 59.28 2kdx h LYS 43 Cb 0.28 -0.07 -0.02 0.00 -0.90 0.00 0.00 32.23 31.51 2kdx h LYS 43 CO 1.67 0.22 0.28 1.03 -2.00 0.00 0.00 179.45 180.64 2kdx h SER 44 N 0.34 0.67 -0.42 7.07 0.87 -2.00 -1.67 113.55 118.40 2kdx h SER 44 Ca 0.37 -0.10 -0.07 0.00 -1.23 0.00 0.00 61.79 60.75 2kdx h SER 44 Cb 0.95 -0.17 -0.01 0.00 -0.44 0.00 0.00 62.40 62.72 2kdx h SER 44 CO -0.10 0.58 -0.03 -0.07 -0.53 0.00 0.00 176.83 176.68 2kdx h LEU 45 N 0.70 0.75 0.39 2.23 3.38 -1.63 -2.53 115.31 118.60 2kdx h LEU 45 Ca 0.18 -0.32 -0.01 0.00 0.09 0.00 0.00 57.88 57.82 2kdx h LEU 45 Cb 0.07 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.61 2kdx h LEU 45 CO -0.03 0.89 -0.24 0.15 0.09 0.00 0.00 178.44 179.30 2kdx h PHE 46 N 0.59 -0.64 -0.73 1.13 3.57 -1.04 0.79 116.94 120.61 2kdx h PHE 46 Ca 0.12 -0.01 0.01 0.00 3.53 0.00 0.00 57.97 61.62 2kdx h PHE 46 Cb 0.52 0.23 -0.04 0.00 2.79 0.00 0.00 35.95 39.46 2kdx h PHE 46 CO 0.04 -0.38 0.48 -0.24 -2.23 0.00 0.00 178.31 175.98 2kdx h VAL 47 N -0.61 1.17 -0.20 1.41 3.04 -1.42 -1.66 116.25 117.98 2kdx h VAL 47 Ca -0.04 -0.33 -0.01 0.00 -1.01 0.00 0.00 66.70 65.30 2kdx h VAL 47 Cb 0.50 0.11 -0.01 0.00 -2.01 0.00 0.00 31.29 29.88 2kdx h VAL 47 CO 0.04 0.18 0.06 -1.28 -1.01 0.00 0.00 177.57 175.56 2kdx h SER 48 N 0.98 0.24 -0.10 3.17 0.87 -1.02 0.21 113.55 117.90 2kdx h SER 48 Ca 0.27 -0.02 -0.07 0.00 -1.23 0.00 0.00 61.79 60.75 2kdx h SER 48 Cb -0.09 -0.06 0.00 0.00 -0.44 0.00 0.00 62.40 61.81 2kdx h SER 48 CO -0.07 0.24 -0.21 0.00 -0.53 0.00 0.00 176.83 176.26 2kdx h ALA 49 N 1.80 0.15 -0.51 6.23 0.00 -0.49 -1.02 119.26 125.42 2kdx h ALA 49 Ca 0.07 -0.38 0.09 0.00 0.00 0.00 0.00 54.91 54.69 2kdx h ALA 49 Cb 0.09 -0.02 -0.08 0.00 0.00 0.00 0.00 17.79 17.78 2kdx h ALA 49 CO -0.01 0.11 0.06 0.35 0.00 0.00 0.00 179.25 179.76 2kdx h PHE 50 N -0.14 0.08 -0.58 0.00 3.57 -0.72 -0.95 116.94 118.20 2kdx h PHE 50 Ca 0.00 0.03 -0.02 0.00 3.53 0.00 0.00 57.97 61.52 2kdx h PHE 50 Cb 0.81 0.04 -0.03 0.00 2.79 0.00 0.00 35.95 39.56 2kdx h PHE 50 CO 0.11 -0.06 0.29 0.93 -2.23 0.00 0.00 178.31 177.36 2kdx h GLU 51 N 0.18 0.83 -0.68 1.11 4.39 -0.99 -2.20 114.58 117.22 2kdx h GLU 51 Ca 0.26 -0.11 0.03 0.00 0.34 0.00 0.00 59.36 59.87 2kdx h GLU 51 Cb 0.37 -0.15 -0.04 0.00 -0.10 0.00 0.00 28.75 28.82 2kdx h GLU 51 CO -0.37 0.66 0.42 1.15 -1.16 0.00 0.00 179.01 179.71 2kdx h THR 52 N 0.79 1.08 -0.00 1.13 2.02 -0.64 -2.67 112.91 114.62 2kdx h THR 52 Ca 0.20 -0.28 0.00 0.00 0.77 0.00 0.00 66.41 67.10 2kdx h THR 52 Cb 0.09 0.18 0.00 0.00 -1.74 0.00 0.00 68.15 66.69 2kdx h THR 52 CO -0.03 0.15 -0.02 0.49 0.37 0.00 0.00 175.52 176.48 2kdx n PHE 53 N -4.68 0.00 0.28 3.16 3.01 -0.41 -4.29 117.46 114.53 2kdx n PHE 53 Ca 0.07 0.00 0.13 0.00 1.01 0.00 0.00 57.45 58.67 2kdx n PHE 53 Cb 0.09 -0.11 0.83 0.00 -0.01 0.00 0.00 39.48 40.28 2kdx n PHE 53 CO 0.00 0.00 0.00 0.07 1.01 0.00 0.00 176.76 177.84 2kdx h ARG 54 N 0.36 0.00 0.00 -1.08 0.11 -1.03 -1.95 114.38 110.79 2kdx h ARG 54 Ca 0.00 0.00 -0.02 0.00 0.10 0.00 0.00 59.98 60.06 2kdx h ARG 54 Cb 0.20 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 31.27 2kdx h ARG 54 CO 0.00 0.03 -0.09 0.93 0.10 0.00 0.00 179.97 180.95 2kdx h GLU 55 N 0.00 0.00 0.00 0.08 5.08 -1.80 -3.17 114.58 114.77 2kdx h GLU 55 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2kdx h GLU 55 Cb 0.08 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.33 2kdx h GLU 55 CO 0.00 0.09 0.00 0.93 -1.00 0.00 0.00 179.01 179.03 2kdx h GLU 56 N 0.00 0.00 -3.73 2.33 5.08 -1.68 -3.42 114.58 113.15 2kdx h GLU 56 Ca -0.00 0.00 -0.49 0.00 -1.00 0.00 0.00 59.36 57.87 2kdx h GLU 56 Cb 0.39 0.00 -0.39 0.00 0.50 0.00 0.00 28.75 29.26 2kdx h GLU 56 CO 0.01 0.00 -0.77 -1.12 -1.00 0.00 0.00 179.01 176.13 2kdx s SER 57 N -4.96 2.25 0.45 1.42 0.01 -1.20 -5.06 113.70 106.61 2kdx s SER 57 Ca 0.07 -0.43 0.12 0.00 1.31 0.00 0.00 55.95 57.02 2kdx s SER 57 Cb 0.10 -0.58 1.03 0.00 0.21 0.00 0.00 66.02 66.78 2kdx s SER 57 CO 0.56 -0.23 2.06 -0.07 0.41 0.00 0.00 173.24 175.96 2kdx h LEU 58 N 8.26 0.16 -0.87 2.44 3.38 -1.82 -0.18 115.31 126.68 2kdx h LEU 58 Ca -0.20 -0.01 -0.08 0.00 0.09 0.00 0.00 57.88 57.68 2kdx h LEU 58 Cb 1.12 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.82 2kdx h LEU 58 CO 0.31 0.19 -0.38 -0.37 0.09 0.00 0.00 178.44 178.28 2kdx h VAL 59 N 0.18 0.88 0.00 1.22 -1.51 -1.91 -3.31 116.25 111.81 2kdx h VAL 59 Ca 0.05 -1.57 0.00 0.00 -1.23 0.00 0.00 66.70 63.95 2kdx h VAL 59 Cb 0.11 1.96 0.00 0.00 -2.13 0.00 0.00 31.29 31.23 2kdx h VAL 59 CO 0.00 0.38 -0.48 0.00 -1.23 0.00 0.00 177.57 176.24 2kdx h LYS 61 N 0.00 0.30 -0.00 0.00 6.56 -1.54 -1.74 116.57 120.15 2kdx h LYS 61 Ca 0.00 -0.02 0.00 0.00 -1.06 0.00 0.00 60.65 59.57 2kdx h LYS 61 Cb 0.78 -0.07 0.00 0.00 -0.57 0.00 0.00 32.23 32.38 2kdx h LYS 61 CO 0.00 0.20 -0.33 -0.25 -2.06 0.00 0.00 179.45 177.01 2kdx n ASP 62 N -4.45 0.42 -4.75 0.86 8.00 -1.25 -4.98 116.55 110.40 2kdx n ASP 62 Ca 0.11 -0.14 -0.30 0.00 0.71 0.00 0.00 54.79 55.17 2kdx n ASP 62 Cb 0.49 0.03 0.11 0.00 -0.02 0.00 0.00 41.12 41.73 2kdx n ASP 62 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2kdx s ALA 63 N -2.92 1.96 -0.00 2.24 0.00 -0.66 -4.63 121.76 117.75 2kdx s ALA 63 Ca 0.14 0.08 0.02 0.00 0.00 0.00 0.00 51.96 52.20 2kdx s ALA 63 Cb 0.18 -3.22 -0.01 0.00 0.00 0.00 0.00 23.12 20.08 2kdx s ALA 63 CO 0.63 -2.00 -0.06 0.42 0.00 0.00 0.00 175.76 174.74 2kdx s ILE 64 N -2.94 0.49 -0.04 0.00 1.01 -1.02 -4.95 121.20 113.74 2kdx s ILE 64 Ca 0.62 -0.33 -0.26 0.00 0.00 0.00 0.00 60.65 60.67 2kdx s ILE 64 Cb -0.17 -0.43 -0.03 0.00 0.01 0.00 0.00 42.46 41.84 2kdx s ILE 64 CO 0.56 0.09 0.82 -0.22 0.00 0.00 0.00 174.94 176.19 2kdx s LEU 65 N -0.27 4.33 -0.63 2.97 1.98 -1.26 -1.00 118.68 124.80 2kdx s LEU 65 Ca 0.01 1.37 0.04 0.00 -2.89 0.00 0.00 54.13 52.66 2kdx s LEU 65 Cb -0.03 -3.28 0.15 0.00 0.66 0.00 0.00 46.19 43.69 2kdx s LEU 65 CO -0.00 -0.18 0.41 -0.62 -1.89 0.00 0.00 176.35 174.06 2kdx s ASP 66 N 0.89 4.70 0.06 3.68 2.15 0.06 -4.93 116.67 123.28 2kdx s ASP 66 Ca 0.43 -3.42 -0.31 0.00 0.43 0.00 0.00 52.55 49.69 2kdx s ASP 66 Cb -0.19 -1.67 -0.06 0.00 -0.30 0.00 0.00 42.92 40.70 2kdx s ASP 66 CO 0.22 -0.17 1.22 -0.63 -0.17 0.00 0.00 175.17 175.64 2kdx s ILE 67 N -0.85 3.97 -0.21 4.11 1.01 -1.26 -1.36 121.20 126.61 2kdx s ILE 67 Ca 0.21 1.41 -0.00 0.00 0.00 0.00 0.00 60.65 62.27 2kdx s ILE 67 Cb -0.15 -3.90 0.02 0.00 0.01 0.00 0.00 42.46 38.43 2kdx s ILE 67 CO -0.08 0.10 -0.14 -0.69 0.00 0.00 0.00 174.94 174.13 2kdx s VAL 68 N 1.14 2.46 -0.80 2.92 1.01 0.17 -4.94 120.40 122.37 2kdx s VAL 68 Ca 0.59 -0.94 -0.26 0.00 0.00 0.00 0.00 61.98 61.38 2kdx s VAL 68 Cb -0.30 -2.14 0.01 0.00 0.00 0.00 0.00 36.38 33.95 2kdx s VAL 68 CO 0.29 0.40 1.59 1.51 0.00 0.00 0.00 175.10 178.89 2kdx s ASP 69 N 1.31 5.82 0.01 3.32 -4.77 -1.26 -1.01 116.67 120.09 2kdx s ASP 69 Ca 0.03 -0.50 -0.29 0.00 -3.30 0.00 0.00 52.55 48.49 2kdx s ASP 69 Cb -0.15 -2.55 -0.04 0.00 -1.09 0.00 0.00 42.92 39.10 2kdx s ASP 69 CO -0.09 -2.07 0.93 -1.61 0.70 0.00 0.00 175.17 173.03 2kdx s GLU 70 N 6.15 4.56 0.23 2.11 2.02 0.03 -4.84 118.70 128.95 2kdx s GLU 70 Ca 0.52 1.33 -0.31 0.00 0.02 0.00 0.00 54.97 56.53 2kdx s GLU 70 Cb -0.07 -3.44 -0.12 0.00 0.10 0.00 0.00 34.13 30.60 2kdx s GLU 70 CO 0.08 0.01 1.67 0.15 0.02 0.00 0.00 175.26 177.19 2kdx s LYS 71 N 0.80 4.13 0.51 1.61 -0.14 -1.26 -0.65 119.74 124.75 2kdx s LYS 71 Ca 0.49 2.57 -0.18 0.00 -1.36 0.00 0.00 55.97 57.50 2kdx s LYS 71 Cb -0.21 -3.06 -0.08 0.00 -1.68 0.00 0.00 37.83 32.80 2kdx s LYS 71 CO 0.27 -0.70 1.00 0.08 -0.76 0.00 0.00 175.35 175.24 2kdx s VAL 72 N 0.78 4.23 -0.03 3.17 1.01 -1.26 -4.53 120.40 123.77 2kdx s VAL 72 Ca 0.71 1.17 -0.08 0.00 0.00 0.00 0.00 61.98 63.77 2kdx s VAL 72 Cb -0.49 -3.58 0.01 0.00 0.00 0.00 0.00 36.38 32.33 2kdx s VAL 72 CO 0.37 -0.52 0.18 -0.70 0.00 0.00 0.00 175.10 174.44 2kdx s GLU 73 N -3.79 0.40 -0.21 2.72 2.12 -0.53 -4.61 118.70 114.79 2kdx s GLU 73 Ca 0.62 -0.09 -0.00 0.00 0.36 0.00 0.00 54.97 55.85 2kdx s GLU 73 Cb -0.12 0.17 0.02 0.00 0.26 0.00 0.00 34.13 34.46 2kdx s GLU 73 CO 0.28 -0.08 -0.13 -0.51 -0.54 0.00 0.00 175.26 174.28 2kdx s LEU 74 N -0.75 2.66 0.19 2.70 2.01 0.02 -1.16 118.68 124.37 2kdx s LEU 74 Ca -0.08 -0.72 0.02 0.00 0.01 0.00 0.00 54.13 53.36 2kdx s LEU 74 Cb -0.05 -1.58 -0.04 0.00 0.01 0.00 0.00 46.19 44.53 2kdx s LEU 74 CO 0.01 -0.05 0.34 -1.83 1.01 0.00 0.00 176.35 175.83 2kdx s GLU 75 N 1.32 3.46 0.62 1.70 -1.05 -0.15 -1.13 118.70 123.46 2kdx s GLU 75 Ca 0.03 -0.56 -0.11 0.00 -0.15 0.00 0.00 54.97 54.18 2kdx s GLU 75 Cb -0.15 -2.90 -0.03 0.00 -0.44 0.00 0.00 34.13 30.61 2kdx s GLU 75 CO -0.08 0.45 1.02 0.00 0.95 0.00 0.00 175.26 177.60 2kdx h LYS 77 N -0.32 -0.01 -2.16 0.00 1.79 -1.93 -3.42 116.57 110.53 2kdx h LYS 77 Ca -0.44 0.00 -0.57 0.00 -2.18 0.00 0.00 60.65 57.46 2kdx h LYS 77 Cb 1.20 0.00 -0.42 0.00 -1.58 0.00 0.00 32.23 31.43 2kdx h LYS 77 CO 0.62 -0.00 -0.74 -0.25 -1.08 0.00 0.00 179.45 178.00 2kdx n ASP 78 N -2.02 3.95 0.00 0.86 8.00 -1.26 -5.01 116.55 121.07 2kdx n ASP 78 Ca -0.00 -3.58 0.00 0.00 0.71 0.00 0.00 54.79 51.92 2kdx n ASP 78 Cb 0.00 -0.56 0.00 0.00 -0.02 0.00 0.00 41.12 40.54 2kdx n ASP 78 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2kdx n SER 80 N 0.00 0.00 -4.18 0.00 3.41 -1.26 -5.06 113.62 106.52 2kdx n SER 80 Ca 0.00 -1.51 -0.17 0.00 -0.26 0.00 0.00 58.87 56.93 2kdx n SER 80 Cb 0.00 -0.10 -0.11 0.00 -0.26 0.00 0.00 64.21 63.73 2kdx n SER 80 CO 0.00 0.00 0.00 -2.28 -0.16 0.00 0.00 175.04 172.60 2kdx s HIS 81 N 0.00 1.19 -0.08 7.33 5.65 -1.26 -5.10 115.29 123.01 2kdx s HIS 81 Ca 0.00 -0.54 -0.07 0.00 0.25 0.00 0.00 55.06 54.70 2kdx s HIS 81 Cb 0.00 -0.65 0.03 0.00 -1.18 0.00 0.00 32.58 30.77 2kdx s HIS 81 CO 0.00 0.06 0.22 0.08 -0.65 0.00 0.00 174.74 174.45 2kdx s VAL 82 N -1.81 -0.01 0.32 0.89 1.01 -1.26 -2.60 120.40 116.94 2kdx s VAL 82 Ca 0.02 0.03 0.03 0.00 0.00 0.00 0.00 61.98 62.06 2kdx s VAL 82 Cb -0.07 -0.32 -0.02 0.00 0.00 0.00 0.00 36.38 35.97 2kdx s VAL 82 CO 0.02 0.01 0.33 0.72 0.00 0.00 0.00 175.10 176.18 2kdx s PHE 83 N 0.35 1.44 -0.04 5.22 -0.12 -0.29 -5.01 117.98 119.54 2kdx s PHE 83 Ca -0.02 -1.49 -0.01 0.00 -0.05 0.00 0.00 56.93 55.36 2kdx s PHE 83 Cb -0.03 -0.47 -0.04 0.00 -0.63 0.00 0.00 43.02 41.85 2kdx s PHE 83 CO -0.01 -0.94 0.06 -1.59 -0.05 0.00 0.00 175.22 172.68 2kdx s LYS 84 N -3.40 3.05 -0.28 1.99 0.00 -1.26 -0.80 119.74 119.04 2kdx s LYS 84 Ca 0.37 -0.44 -0.29 0.00 0.00 0.00 0.00 55.97 55.61 2kdx s LYS 84 Cb 0.02 -2.85 -0.01 0.00 0.00 0.00 0.00 37.83 34.98 2kdx s LYS 84 CO 0.23 0.67 1.51 -1.25 0.00 0.00 0.00 175.35 176.51 2kdx s PRO 85 N -1.41 3.76 0.06 1.78 0.04 -1.26 -4.96 135.00 133.01 2kdx s PRO 85 Ca 0.19 1.41 -0.07 0.00 0.04 0.00 0.00 61.00 62.57 2kdx s PRO 85 Cb -0.12 -4.00 -0.01 0.00 0.04 0.00 0.00 34.50 30.42 2kdx s PRO 85 CO 0.09 -1.33 0.14 -0.80 0.04 0.00 0.00 177.00 175.14 2kdx s ASN 86 N 3.91 0.15 0.30 6.66 -0.87 -1.26 -5.16 114.94 118.68 2kdx s ASN 86 Ca 0.66 -0.58 0.00 0.00 -1.57 0.00 0.00 52.86 51.37 2kdx s ASN 86 Cb -0.20 0.28 0.00 0.00 -0.02 0.00 0.00 41.25 41.30 2kdx s ASN 86 CO 0.28 -0.61 0.00 0.00 -2.57 0.00 0.00 177.10 174.20 2kdx n ALA 87 N 0.39 -3.28 0.01 0.60 0.00 -1.26 -4.62 120.51 112.35 2kdx n ALA 87 Ca -0.17 0.36 0.00 0.00 0.00 0.00 0.00 53.44 53.63 2kdx n ALA 87 Cb 0.60 -1.10 0.00 0.00 0.00 0.00 0.00 19.45 18.95 2kdx n ALA 87 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 177.50 178.97 2kdx n LEU 88 N 0.00 0.02 0.28 0.00 -0.00 -1.26 -4.60 117.00 111.44 2kdx n LEU 88 Ca 0.01 0.05 0.15 0.00 -0.00 0.00 0.00 56.01 56.22 2kdx n LEU 88 Cb 0.52 0.03 0.85 0.00 -0.00 0.00 0.00 43.42 44.81 2kdx n LEU 88 CO 0.01 -0.42 1.05 -0.78 -0.00 0.00 0.00 177.39 177.25 2kdx h ASP 89 N 0.00 0.00 0.00 1.45 3.58 -2.05 -2.90 116.42 116.50 2kdx h ASP 89 Ca 0.00 0.00 -0.04 0.00 0.42 0.00 0.00 57.03 57.41 2kdx h ASP 89 Cb 0.23 0.00 -0.09 0.00 1.72 0.00 0.00 39.33 41.19 2kdx h ASP 89 CO 0.00 0.06 -0.49 0.00 -2.88 0.00 0.00 179.24 175.93 2kdx n TYR 90 N -3.60 0.00 1.56 0.28 4.11 -1.26 -4.91 117.16 113.34 2kdx n TYR 90 Ca -0.02 -0.69 0.00 0.00 -0.00 0.00 0.00 57.90 57.19 2kdx n TYR 90 Cb 0.17 -0.14 0.00 0.00 -0.00 0.00 0.00 39.34 39.37 2kdx n TYR 90 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.86 177.27 2kdx n GLY 91 N -0.50 0.10 3.67 -7.48 0.00 -1.09 -4.91 105.19 94.97 2kdx n GLY 91 Ca 0.10 -0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.82 2kdx n GLY 91 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2kdx s VAL 92 N -1.57 2.17 0.29 1.61 -7.23 -1.26 -4.86 120.40 109.54 2kdx s VAL 92 Ca 0.00 0.05 -0.30 0.00 -1.81 0.00 0.00 61.98 59.93 2kdx s VAL 92 Cb 0.00 -2.51 -0.11 0.00 0.56 0.00 0.00 36.38 34.32 2kdx s VAL 92 CO 0.00 -0.07 1.53 0.00 -0.31 0.00 0.00 175.10 176.25 2kdx h GLU 94 N 4.73 1.27 0.36 0.00 4.39 -1.95 -3.17 114.58 120.21 2kdx h GLU 94 Ca -0.47 -0.12 -0.02 0.00 0.34 0.00 0.00 59.36 59.09 2kdx h GLU 94 Cb 1.22 -0.26 0.00 0.00 -0.10 0.00 0.00 28.75 29.61 2kdx h GLU 94 CO 0.77 0.89 -0.17 0.87 -1.16 0.00 0.00 179.01 180.22 2kdx h LYS 95 N 1.29 -0.46 -4.88 2.33 1.57 -1.99 -3.46 116.57 110.96 2kdx h LYS 95 Ca 0.33 0.03 -0.67 0.00 -1.87 0.00 0.00 60.65 58.47 2kdx h LYS 95 Cb -0.04 0.11 -0.35 0.00 0.08 0.00 0.00 32.23 32.03 2kdx h LYS 95 CO -0.06 -0.27 -0.77 0.00 -0.57 0.00 0.00 179.45 177.78 2kdx n HIS 97 N 4.55 2.50 -4.05 0.00 8.25 -1.25 -3.37 115.22 121.85 2kdx n HIS 97 Ca -0.15 -2.36 -0.08 0.00 -0.26 0.00 0.00 57.72 54.87 2kdx n HIS 97 Cb 0.44 -2.08 -0.09 0.00 1.12 0.00 0.00 29.99 29.38 2kdx n HIS 97 CO 0.00 0.00 0.00 -1.12 0.64 0.00 0.00 176.34 175.86 2kdx s SER 98 N 3.97 0.38 -0.05 0.41 0.01 -1.26 -4.93 113.70 112.23 2kdx s SER 98 Ca 0.53 -0.96 0.11 0.00 1.31 0.00 0.00 55.95 56.94 2kdx s SER 98 Cb 0.14 0.25 0.41 0.00 0.21 0.00 0.00 66.02 67.03 2kdx s SER 98 CO 0.01 -0.65 1.27 0.29 0.41 0.00 0.00 173.24 174.57 2kdx n LYS 99 N 0.04 2.44 0.00 12.44 4.76 -1.26 -1.89 118.16 134.69 2kdx n LYS 99 Ca -0.13 -1.62 0.04 0.00 -2.87 0.00 0.00 58.31 53.74 2kdx n LYS 99 Cb 0.62 -1.55 0.19 0.00 -1.84 0.00 0.00 35.03 32.44 2kdx n LYS 99 CO 0.00 0.00 0.00 0.27 -1.37 0.00 0.00 177.40 176.30 2kdx n ASN 100 N 0.59 0.00 -4.59 4.39 6.94 -1.26 -4.89 115.26 116.44 2kdx n ASN 100 Ca 0.15 0.35 -0.37 0.00 -0.02 0.00 0.00 54.58 54.69 2kdx n ASN 100 Cb 0.52 -0.40 0.07 0.00 -2.36 0.00 0.00 39.78 37.60 2kdx n ASN 100 CO 0.00 0.00 0.00 1.33 -1.03 0.00 0.00 177.26 177.56 2kdx n VAL 101 N -1.40 3.15 -4.27 3.53 0.24 -1.26 -4.50 118.33 113.82 2kdx n VAL 101 Ca 0.03 -0.44 -0.19 0.00 -2.04 0.00 0.00 64.34 61.69 2kdx n VAL 101 Cb 0.08 -1.06 -0.11 0.00 -1.47 0.00 0.00 33.84 31.28 2kdx n VAL 101 CO 0.00 0.00 0.00 0.27 -2.14 0.00 0.00 176.83 174.96 2kdx s ILE 102 N -1.68 1.48 -0.49 1.34 -0.00 -0.02 -4.97 121.20 116.86 2kdx s ILE 102 Ca 0.74 -1.74 -0.29 0.00 -0.00 0.00 0.00 60.65 59.37 2kdx s ILE 102 Cb -0.38 -1.59 0.02 0.00 -0.00 0.00 0.00 42.46 40.51 2kdx s ILE 102 CO 0.49 -0.35 1.22 -0.63 -0.00 0.00 0.00 174.94 175.68 2kdx s ILE 103 N -1.99 4.08 -1.09 8.37 1.09 -1.26 -0.98 121.20 129.41 2kdx s ILE 103 Ca 0.10 1.07 0.26 0.00 -1.10 0.00 0.00 60.65 60.98 2kdx s ILE 103 Cb -0.06 -4.53 0.09 0.00 -1.06 0.00 0.00 42.46 36.90 2kdx s ILE 103 CO 0.04 -1.03 1.54 1.07 -0.10 0.00 0.00 174.94 176.46 2kdx n THR 104 N 6.88 0.00 -3.63 2.92 5.66 -0.31 -4.74 114.28 121.07 2kdx n THR 104 Ca 0.12 -0.01 -0.04 0.00 -3.05 0.00 0.00 64.05 61.07 2kdx n THR 104 Cb 0.49 0.12 -0.06 0.00 -1.55 0.00 0.00 70.33 69.32 2kdx n THR 104 CO 0.00 0.00 0.00 -1.58 -3.05 0.00 0.00 175.07 170.44 2kdx s GLN 105 N -2.93 0.61 0.00 1.09 2.00 -1.19 -4.94 119.66 114.29 2kdx s GLN 105 Ca 0.14 1.17 0.00 0.00 -2.00 0.00 0.00 55.36 54.67 2kdx s GLN 105 Cb 0.18 0.33 0.00 0.00 0.80 0.00 0.00 33.01 34.32 2kdx s GLN 105 CO 0.64 -0.15 0.00 0.41 -0.50 0.00 0.00 175.29 175.70 2kdx n GLY 106 N 4.55 0.52 0.36 2.59 0.00 -1.26 -1.46 105.19 110.49 2kdx n GLY 106 Ca -0.17 -0.24 0.04 0.00 0.00 0.00 0.00 46.02 45.66 2kdx n GLY 106 CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 2kdx h ASN 107 N 0.00 0.82 -5.46 1.61 -0.73 -1.92 -3.41 115.58 106.48 2kdx h ASN 107 Ca 0.00 0.00 -0.18 0.00 1.87 0.00 0.00 56.30 57.99 2kdx h ASN 107 Cb 0.00 -0.17 -0.12 0.00 0.27 0.00 0.00 38.32 38.30 2kdx h ASN 107 CO 0.00 0.53 -0.36 -1.83 -0.37 0.00 0.00 177.43 175.41 2kdx s GLU 108 N -5.82 1.46 0.13 6.67 -1.05 -1.26 -5.06 118.70 113.77 2kdx s GLU 108 Ca -0.11 -1.52 0.06 0.00 -0.15 0.00 0.00 54.97 53.25 2kdx s GLU 108 Cb 0.19 0.38 -0.04 0.00 -0.44 0.00 0.00 34.13 34.22 2kdx s GLU 108 CO 0.79 -0.56 0.02 0.00 0.95 0.00 0.00 175.26 176.46 2kdx s MET 109 N -3.92 2.56 0.22 -4.83 0.23 -1.26 -4.59 119.30 107.70 2kdx s MET 109 Ca 0.31 -0.94 -0.22 0.00 -1.03 0.00 0.00 55.69 53.81 2kdx s MET 109 Cb 0.03 -2.49 0.04 0.00 -1.53 0.00 0.00 34.83 30.88 2kdx s MET 109 CO 0.13 0.50 0.69 -0.98 -2.03 0.00 0.00 175.02 173.32 2kdx s ARG 110 N -2.67 1.53 0.80 3.16 1.70 -0.76 -5.04 118.95 117.68 2kdx s ARG 110 Ca 0.27 -0.75 -0.14 0.00 -0.47 0.00 0.00 55.73 54.65 2kdx s ARG 110 Cb -0.11 0.59 0.07 0.00 -0.57 0.00 0.00 34.95 34.93 2kdx s ARG 110 CO 0.19 -0.69 1.13 1.47 -1.08 0.00 0.00 175.30 176.32 2kdx n LEU 111 N -0.42 4.05 0.00 -1.89 -0.00 -1.26 -0.80 117.00 116.67 2kdx n LEU 111 Ca -0.09 0.59 0.00 0.00 -0.00 0.00 0.00 56.01 56.50 2kdx n LEU 111 Cb 0.62 -1.48 0.00 0.00 -0.00 0.00 0.00 43.42 42.56 2kdx n LEU 111 CO 0.14 -1.84 -0.28 -0.11 -0.00 0.00 0.00 177.39 175.29 2kdx n LEU 112 N -2.91 0.17 -3.85 1.47 7.94 0.17 -4.61 117.00 115.38 2kdx n LEU 112 Ca 0.13 0.00 -0.06 0.00 -1.11 0.00 0.00 56.01 54.97 2kdx n LEU 112 Cb 0.50 0.00 0.02 0.00 0.53 0.00 0.00 43.42 44.48 2kdx n LEU 112 CO 0.48 -0.17 0.67 -0.94 -1.11 0.00 0.00 177.39 176.33 2kdx s SER 113 N -4.86 0.02 0.14 1.96 1.04 -1.08 -5.02 113.70 105.90 2kdx s SER 113 Ca 0.00 -0.94 0.01 0.00 0.48 0.00 0.00 55.95 55.50 2kdx s SER 113 Cb 0.00 0.69 -0.04 0.00 0.10 0.00 0.00 66.02 66.76 2kdx s SER 113 CO 0.00 -1.37 0.01 -0.76 0.98 0.00 0.00 173.24 172.10 2kdx s LEU 114 N -3.25 2.09 0.01 2.42 1.02 -1.26 -0.46 118.68 119.24 2kdx s LEU 114 Ca 0.19 -1.15 -0.01 0.00 0.02 0.00 0.00 54.13 53.18 2kdx s LEU 114 Cb -0.04 0.08 -0.01 0.00 0.02 0.00 0.00 46.19 46.24 2kdx s LEU 114 CO 0.09 -0.61 0.00 -0.70 0.02 0.00 0.00 176.35 175.15 2kdx s GLU 115 N -3.95 0.23 0.07 1.70 2.56 0.25 -4.95 118.70 114.62 2kdx s GLU 115 Ca 0.21 -0.37 0.05 0.00 0.00 0.00 0.00 54.97 54.85 2kdx s GLU 115 Cb 0.07 0.09 -0.03 0.00 2.00 0.00 0.00 34.13 36.25 2kdx s GLU 115 CO 0.01 -0.04 -0.13 -1.64 -0.56 0.00 0.00 175.26 172.90 2kdx s MET 116 N -0.96 0.79 -0.54 4.30 -1.94 -1.26 -0.99 119.30 118.70 2kdx s MET 116 Ca -0.11 -0.97 -0.29 0.00 -1.71 0.00 0.00 55.69 52.62 2kdx s MET 116 Cb -0.06 -0.71 0.03 0.00 2.01 0.00 0.00 34.83 36.09 2kdx s MET 116 CO -0.00 0.15 1.18 -1.17 -0.01 0.00 0.00 175.02 175.17 2kdx s LEU 117 N -1.85 3.52 0.00 -0.03 2.96 -1.26 -4.73 118.68 117.28 2kdx s LEU 117 Ca -0.02 0.26 0.00 0.00 -0.22 0.00 0.00 54.13 54.15 2kdx s LEU 117 Cb -0.09 -3.32 0.00 0.00 0.50 0.00 0.00 46.19 43.29 2kdx s LEU 117 CO 0.02 -1.40 0.00 0.00 -1.32 0.00 0.00 176.35 173.65 2kdx n ALA 118 N 8.25 2.58 -0.27 5.97 0.00 -1.26 -5.02 120.51 130.76 2kdx n ALA 118 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.54 2kdx n ALA 118 Cb 0.49 0.49 0.00 0.00 0.00 0.00 0.00 19.45 20.43 2kdx n ALA 118 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89