#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 0.93 0.04 1.61 0.15 -1.26 -5.16 113.70 110.01 2kdx s SER 2 Ca 0.00 0.13 -0.01 0.00 0.70 0.00 0.00 55.95 56.76 2kdx s SER 2 Cb 0.00 0.48 -0.03 0.00 -1.71 0.00 0.00 66.02 64.77 2kdx s SER 2 CO 0.00 -0.29 -0.01 -0.04 1.20 0.00 0.00 173.24 174.11 2kdx s MET 3 N 2.36 0.49 -0.01 5.44 1.00 -1.26 -5.07 119.30 122.24 2kdx s MET 3 Ca 0.05 -0.89 0.21 0.00 0.00 0.00 0.00 55.69 55.06 2kdx s MET 3 Cb -0.14 0.17 -0.25 0.00 0.00 0.00 0.00 34.83 34.61 2kdx s MET 3 CO -0.10 -0.09 0.77 0.72 0.00 0.00 0.00 175.02 176.32 2kdx n HIS 4 N 0.83 0.00 -0.24 -0.03 -0.00 -1.26 -4.61 115.22 109.91 2kdx n HIS 4 Ca -0.19 0.00 -0.02 0.00 -0.00 0.00 0.00 57.72 57.51 2kdx n HIS 4 Cb 0.58 -0.13 0.09 0.00 -0.00 0.00 0.00 29.99 30.54 2kdx n HIS 4 CO 0.00 0.00 0.00 1.49 -0.00 0.00 0.00 176.34 177.83 2kdx h GLU 5 N 0.00 0.76 -0.01 -0.41 4.57 -2.04 -1.92 114.58 115.53 2kdx h GLU 5 Ca 0.00 -0.05 0.00 0.00 -1.18 0.00 0.00 59.36 58.13 2kdx h GLU 5 Cb 0.62 -0.17 0.00 0.00 -0.16 0.00 0.00 28.75 29.04 2kdx h GLU 5 CO 0.00 0.50 -0.05 0.66 -1.18 0.00 0.00 179.01 178.94 2kdx n TYR 6 N -4.72 0.00 0.26 0.92 4.01 -1.26 -4.20 117.16 112.17 2kdx n TYR 6 Ca 0.08 0.00 -0.15 0.00 -0.16 0.00 0.00 57.90 57.67 2kdx n TYR 6 Cb 0.14 -0.06 -0.08 0.00 -0.31 0.00 0.00 39.34 39.03 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 1.21 -0.54 -0.91 7.72 0.87 -1.60 -1.25 113.55 119.04 2kdx h SER 7 Ca 0.00 -0.05 0.05 0.00 -1.23 0.00 0.00 61.79 60.56 2kdx h SER 7 Cb 0.34 0.14 -0.06 0.00 -0.44 0.00 0.00 62.40 62.38 2kdx h SER 7 CO 0.00 -0.28 0.58 1.62 -0.53 0.00 0.00 176.83 178.22 2kdx h VAL 8 N -0.78 1.12 0.35 2.23 3.04 -1.73 -0.67 116.25 119.81 2kdx h VAL 8 Ca -0.07 -0.38 -0.02 0.00 -1.01 0.00 0.00 66.70 65.23 2kdx h VAL 8 Cb 0.55 -0.08 -0.00 0.00 -2.01 0.00 0.00 31.29 29.75 2kdx h VAL 8 CO 0.11 0.20 -0.22 0.58 -1.01 0.00 0.00 177.57 177.23 2kdx h VAL 9 N 1.10 0.00 -0.80 1.51 2.07 -1.74 -0.55 116.25 117.85 2kdx h VAL 9 Ca 0.37 0.00 0.12 0.00 0.82 0.00 0.00 66.70 68.01 2kdx h VAL 9 Cb 0.07 0.00 -0.08 0.00 -1.52 0.00 0.00 31.29 29.75 2kdx h VAL 9 CO -0.14 0.00 0.41 -1.28 0.02 0.00 0.00 177.57 176.58 2kdx h SER 10 N -0.54 0.52 0.15 0.57 0.87 -1.18 -1.93 113.55 112.01 2kdx h SER 10 Ca -0.05 0.08 -0.00 0.00 -1.23 0.00 0.00 61.79 60.59 2kdx h SER 10 Cb 0.43 -0.01 -0.00 0.00 -0.44 0.00 0.00 62.40 62.38 2kdx h SER 10 CO 0.04 0.26 -0.10 -1.28 -0.53 0.00 0.00 176.83 175.22 2kdx h SER 11 N 0.64 -0.26 0.15 6.23 0.87 -1.07 -1.95 113.55 118.16 2kdx h SER 11 Ca 0.41 0.02 -0.00 0.00 -1.23 0.00 0.00 61.79 60.99 2kdx h SER 11 Cb 0.51 0.08 -0.00 0.00 -0.44 0.00 0.00 62.40 62.55 2kdx h SER 11 CO -0.32 -0.17 -0.09 -0.07 -0.53 0.00 0.00 176.83 175.66 2kdx h LEU 12 N -0.26 -0.22 -0.44 2.23 3.38 -0.78 -0.49 115.31 118.73 2kdx h LEU 12 Ca -0.01 0.01 0.07 0.00 0.09 0.00 0.00 57.88 58.04 2kdx h LEU 12 Cb 0.22 0.07 -0.06 0.00 0.09 0.00 0.00 40.66 40.98 2kdx h LEU 12 CO 0.01 -0.15 0.10 0.40 0.09 0.00 0.00 178.44 178.88 2kdx h ILE 13 N -0.23 0.78 -0.25 1.22 2.04 -1.33 0.56 117.51 120.29 2kdx h ILE 13 Ca -0.01 -0.08 -0.01 0.00 1.00 0.00 0.00 64.86 65.76 2kdx h ILE 13 Cb 0.19 0.52 -0.01 0.00 -0.74 0.00 0.00 36.82 36.78 2kdx h ILE 13 CO 0.01 0.04 0.12 0.00 0.00 0.00 0.00 178.15 178.33 2kdx h ALA 14 N 1.33 0.32 -0.17 1.87 0.00 -1.24 -2.03 119.26 119.34 2kdx h ALA 14 Ca 0.22 -0.09 0.01 0.00 0.00 0.00 0.00 54.91 55.05 2kdx h ALA 14 Cb 0.26 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 2kdx h ALA 14 CO -0.27 -0.12 0.07 1.25 0.00 0.00 0.00 179.25 180.17 2kdx h LEU 15 N 0.27 0.09 -0.74 0.00 5.85 -0.60 -1.25 115.31 118.93 2kdx h LEU 15 Ca 0.09 0.01 -0.04 0.00 0.84 0.00 0.00 57.88 58.78 2kdx h LEU 15 Cb 0.11 -0.00 -0.03 0.00 0.37 0.00 0.00 40.66 41.10 2kdx h LEU 15 CO -0.01 0.08 0.33 0.00 -0.34 0.00 0.00 178.44 178.49 2kdx h GLU 17 N 1.06 0.33 -0.68 0.00 4.22 -1.20 -0.44 114.58 117.87 2kdx h GLU 17 Ca 0.25 -0.02 0.00 0.00 0.08 0.00 0.00 59.36 59.68 2kdx h GLU 17 Cb 0.17 -0.08 -0.03 0.00 0.50 0.00 0.00 28.75 29.31 2kdx h GLU 17 CO -0.03 0.22 0.44 1.49 -2.18 0.00 0.00 179.01 178.95 2kdx h GLU 18 N 0.34 0.90 -0.61 1.92 4.81 -0.93 -1.82 114.58 119.20 2kdx h GLU 18 Ca 0.12 -0.06 -0.03 0.00 -0.13 0.00 0.00 59.36 59.26 2kdx h GLU 18 Cb 0.02 -0.20 -0.03 0.00 0.63 0.00 0.00 28.75 29.17 2kdx h GLU 18 CO -0.07 0.61 0.28 0.45 -0.73 0.00 0.00 179.01 179.54 2kdx h HIS 19 N 0.92 0.89 -0.50 0.92 3.86 -1.05 -2.57 115.15 117.62 2kdx h HIS 19 Ca 0.25 -0.05 -0.05 0.00 -1.16 0.00 0.00 60.37 59.36 2kdx h HIS 19 Cb -0.08 -0.27 -0.02 0.00 1.06 0.00 0.00 27.41 28.09 2kdx h HIS 19 CO -0.02 0.69 0.13 0.00 0.86 0.00 0.00 177.93 179.59 2kdx h ALA 20 N 1.11 0.66 -0.15 2.45 0.00 -0.55 0.31 119.26 123.09 2kdx h ALA 20 Ca 0.21 -0.20 -0.08 0.00 0.00 0.00 0.00 54.91 54.84 2kdx h ALA 20 Cb 0.15 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 2kdx h ALA 20 CO -0.02 0.34 -0.26 1.57 0.00 0.00 0.00 179.25 180.88 2kdx h LYS 21 N 0.69 0.27 -0.09 0.00 2.10 -1.39 0.15 116.57 118.30 2kdx h LYS 21 Ca 0.16 -0.09 -0.22 0.00 -2.00 0.00 0.00 60.65 58.50 2kdx h LYS 21 Cb 0.31 -0.02 0.01 0.00 -0.90 0.00 0.00 32.23 31.64 2kdx h LYS 21 CO -0.00 0.51 -0.81 -0.22 -2.00 0.00 0.00 179.45 176.94 2kdx h LYS 22 N 0.24 0.70 0.00 0.07 1.63 -1.02 -2.77 116.57 115.43 2kdx h LYS 22 Ca 0.04 -0.64 0.00 0.00 -0.85 0.00 0.00 60.65 59.20 2kdx h LYS 22 Cb 0.59 0.15 0.00 0.00 -0.60 0.00 0.00 32.23 32.37 2kdx h LYS 22 CO 0.04 1.24 0.00 -1.71 -3.45 0.00 0.00 179.45 175.57 2kdx n ASN 23 N -3.98 0.00 -2.31 4.20 2.85 0.06 -4.93 115.26 111.16 2kdx n ASN 23 Ca -0.09 0.23 -0.19 0.00 -0.11 0.00 0.00 54.58 54.43 2kdx n ASN 23 Cb 0.76 -0.40 -0.02 0.00 1.24 0.00 0.00 39.78 41.37 2kdx n ASN 23 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2kdx n GLN 24 N -1.40 -1.78 0.00 1.20 6.02 -0.63 -4.92 117.38 115.87 2kdx n GLN 24 Ca 0.09 0.93 -0.10 0.00 -0.01 0.00 0.00 57.00 57.90 2kdx n GLN 24 Cb 0.25 -5.54 0.04 0.00 1.02 0.00 0.00 30.24 26.00 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 0.91 0.65 -0.13 -1.58 0.00 -1.02 -3.48 119.26 114.62 2kdx h ALA 25 Ca -0.44 -0.52 -0.03 0.00 0.00 0.00 0.00 54.91 53.92 2kdx h ALA 25 Cb 1.32 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 19.01 2kdx h ALA 25 CO 0.53 0.69 -0.03 0.72 0.00 0.00 0.00 179.25 181.16 2kdx n HIS 26 N -3.95 -0.03 -3.83 0.00 8.25 -1.19 -4.87 115.22 109.61 2kdx n HIS 26 Ca -0.03 0.00 -0.07 0.00 -0.26 0.00 0.00 57.72 57.35 2kdx n HIS 26 Cb 0.62 -1.73 0.02 0.00 1.12 0.00 0.00 29.99 30.02 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 -1.65 1.96 0.32 -0.41 -2.85 -1.26 -4.57 119.74 111.28 2kdx s LYS 27 Ca 0.00 -1.25 0.10 0.00 -1.00 0.00 0.00 55.97 53.82 2kdx s LYS 27 Cb 0.00 0.55 -0.06 0.00 -2.06 0.00 0.00 37.83 36.27 2kdx s LYS 27 CO 0.00 -0.92 -0.09 0.42 0.10 0.00 0.00 175.35 174.86 2kdx s ILE 28 N -2.33 2.44 -0.08 3.79 1.01 -1.22 -4.60 121.20 120.21 2kdx s ILE 28 Ca 0.17 -2.19 -0.10 0.00 0.00 0.00 0.00 60.65 58.53 2kdx s ILE 28 Cb -0.04 -2.60 -0.03 0.00 0.01 0.00 0.00 42.46 39.79 2kdx s ILE 28 CO 0.09 -0.26 -0.19 1.21 0.00 0.00 0.00 174.94 175.79 2kdx n GLU 29 N -0.79 0.29 -3.33 2.79 4.07 0.17 -4.42 120.64 119.42 2kdx n GLU 29 Ca -0.05 0.12 -0.03 0.00 -0.06 0.00 0.00 57.16 57.14 2kdx n GLU 29 Cb 0.62 -0.98 -0.05 0.00 -0.06 0.00 0.00 31.44 30.97 2kdx n GLU 29 CO 0.00 0.00 0.00 0.50 -0.06 0.00 0.00 177.13 177.57 2kdx s ARG 30 N -2.26 0.46 0.32 5.31 3.52 -0.71 -3.13 118.95 122.46 2kdx s ARG 30 Ca -0.16 0.87 -0.28 0.00 -0.13 0.00 0.00 55.73 56.03 2kdx s ARG 30 Cb 0.02 0.16 -0.09 0.00 -1.56 0.00 0.00 34.95 33.48 2kdx s ARG 30 CO 0.24 -0.55 1.08 0.14 -0.81 0.00 0.00 175.30 175.40 2kdx s VAL 31 N 2.71 3.56 -0.11 7.11 -7.23 0.04 -0.77 120.40 125.72 2kdx s VAL 31 Ca 0.13 1.44 0.02 0.00 -1.81 0.00 0.00 61.98 61.76 2kdx s VAL 31 Cb -0.15 -3.87 0.01 0.00 0.56 0.00 0.00 36.38 32.94 2kdx s VAL 31 CO -0.18 0.24 -0.16 -0.69 -0.31 0.00 0.00 175.10 174.01 2kdx s VAL 32 N -1.33 1.54 0.01 1.32 1.01 0.17 -1.06 120.40 122.07 2kdx s VAL 32 Ca 0.49 -0.67 0.02 0.00 0.00 0.00 0.00 61.98 61.82 2kdx s VAL 32 Cb -0.29 -1.40 -0.01 0.00 0.00 0.00 0.00 36.38 34.68 2kdx s VAL 32 CO 0.36 0.45 -0.08 -0.69 0.00 0.00 0.00 175.10 175.14 2kdx s VAL 33 N 0.93 0.61 -0.17 2.92 1.01 -0.34 -0.83 120.40 124.54 2kdx s VAL 33 Ca -0.07 -0.52 -0.06 0.00 0.00 0.00 0.00 61.98 61.32 2kdx s VAL 33 Cb -0.15 -0.55 -0.04 0.00 0.00 0.00 0.00 36.38 35.64 2kdx s VAL 33 CO -0.01 0.04 0.03 -0.83 0.00 0.00 0.00 175.10 174.33 2kdx s GLY 34 N -0.54 1.86 -0.16 4.51 0.00 0.41 -0.39 107.32 113.01 2kdx s GLY 34 Ca 0.00 -0.76 0.01 0.00 0.00 0.00 0.00 44.72 43.96 2kdx s GLY 34 CO 0.00 -0.03 -0.16 -0.42 0.00 0.00 0.00 173.10 172.50 2kdx s ILE 35 N 0.26 1.72 0.42 0.90 1.01 -0.41 -1.13 121.20 123.97 2kdx s ILE 35 Ca 0.02 -0.73 -0.26 0.00 0.00 0.00 0.00 60.65 59.68 2kdx s ILE 35 Cb -0.13 -1.60 -0.09 0.00 0.01 0.00 0.00 42.46 40.66 2kdx s ILE 35 CO 0.01 0.48 1.41 -0.83 0.00 0.00 0.00 174.94 176.01 2kdx s GLY 36 N 1.43 2.93 0.00 6.18 0.00 -1.26 -0.78 107.32 115.82 2kdx s GLY 36 Ca 0.05 1.43 0.18 0.00 0.00 0.00 0.00 44.72 46.38 2kdx s GLY 36 CO -0.11 2.06 1.49 -1.84 0.00 0.00 0.00 173.10 174.70 2kdx n GLU 37 N 0.05 0.38 -0.01 2.90 0.28 -0.12 -1.33 120.64 122.79 2kdx n GLU 37 Ca 0.04 0.07 0.00 0.00 -0.16 0.00 0.00 57.16 57.11 2kdx n GLU 37 Cb 0.42 -1.50 0.01 0.00 1.43 0.00 0.00 31.44 31.79 2kdx n GLU 37 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 177.13 177.51 2kdx n ARG 38 N -1.16 2.39 0.18 3.44 5.12 -1.26 -4.83 116.66 120.53 2kdx n ARG 38 Ca 0.10 -1.37 0.13 0.00 -1.93 0.00 0.00 57.85 54.79 2kdx n ARG 38 Cb 0.10 -0.93 0.60 0.00 -1.16 0.00 0.00 32.46 31.08 2kdx n ARG 38 CO 0.00 0.00 0.00 1.03 -1.93 0.00 0.00 177.63 176.73 2kdx h SER 39 N 0.00 0.00 0.00 0.55 0.87 -1.36 -3.47 113.55 110.14 2kdx h SER 39 Ca 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 2kdx h SER 39 Cb 0.61 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.57 2kdx h SER 39 CO 0.00 0.00 0.00 0.00 -0.53 0.00 0.00 176.83 176.30 2kdx n ALA 40 N -1.85 0.00 -1.77 6.23 0.00 -1.26 -4.95 120.51 116.91 2kdx n ALA 40 Ca 0.01 0.00 -0.33 0.00 0.00 0.00 0.00 53.44 53.12 2kdx n ALA 40 Cb 0.18 -1.00 -0.03 0.00 0.00 0.00 0.00 19.45 18.60 2kdx n ALA 40 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2kdx s MET 41 N -1.02 3.76 -0.64 0.00 0.23 -1.26 -5.02 119.30 115.35 2kdx s MET 41 Ca 0.00 1.14 -0.24 0.00 -1.03 0.00 0.00 55.69 55.56 2kdx s MET 41 Cb 0.00 -2.10 0.05 0.00 -1.53 0.00 0.00 34.83 31.25 2kdx s MET 41 CO 0.00 -0.44 1.03 -0.51 -2.03 0.00 0.00 175.02 173.06 2kdx s ASP 42 N -2.62 6.22 0.34 -1.18 1.01 -1.26 -4.93 116.67 114.25 2kdx s ASP 42 Ca 0.63 -0.68 0.10 0.00 0.71 0.00 0.00 52.55 53.31 2kdx s ASP 42 Cb -0.13 -2.45 0.85 0.00 1.01 0.00 0.00 42.92 42.20 2kdx s ASP 42 CO 0.28 -1.46 1.79 0.07 0.21 0.00 0.00 175.17 176.06 2kdx h LYS 43 N 9.59 0.63 -0.15 8.23 2.10 -1.99 -0.90 116.57 134.07 2kdx h LYS 43 Ca -0.28 -0.04 -0.01 0.00 -2.00 0.00 0.00 60.65 58.33 2kdx h LYS 43 Cb 1.07 -0.14 -0.01 0.00 -0.90 0.00 0.00 32.23 32.25 2kdx h LYS 43 CO 1.18 0.42 0.06 1.03 -2.00 0.00 0.00 179.45 180.13 2kdx h SER 44 N 0.65 0.21 -0.54 7.07 0.87 -2.00 -1.96 113.55 117.85 2kdx h SER 44 Ca 0.56 -0.16 -0.00 0.00 -1.23 0.00 0.00 61.79 60.96 2kdx h SER 44 Cb 1.03 -0.05 -0.03 0.00 -0.44 0.00 0.00 62.40 62.91 2kdx h SER 44 CO -0.34 0.32 0.34 0.25 -0.53 0.00 0.00 176.83 176.87 2kdx h LEU 45 N 0.09 0.64 0.49 2.23 5.85 -1.74 -1.28 115.31 121.59 2kdx h LEU 45 Ca 0.05 -0.04 -0.01 0.00 0.84 0.00 0.00 57.88 58.71 2kdx h LEU 45 Cb 0.17 -0.16 -0.01 0.00 0.37 0.00 0.00 40.66 41.03 2kdx h LEU 45 CO -0.00 0.50 -0.38 0.15 -0.34 0.00 0.00 178.44 178.36 2kdx h PHE 46 N 0.73 -1.02 -0.47 1.25 3.57 -1.14 -0.72 116.94 119.14 2kdx h PHE 46 Ca 0.20 -0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.69 2kdx h PHE 46 Cb -0.04 0.38 -0.02 0.00 2.79 0.00 0.00 35.95 39.06 2kdx h PHE 46 CO -0.03 -0.55 0.27 -0.24 -2.23 0.00 0.00 178.31 175.53 2kdx h VAL 47 N -0.86 1.16 0.00 1.41 3.04 -1.33 -1.60 116.25 118.06 2kdx h VAL 47 Ca -0.05 -0.37 -0.06 0.00 -1.01 0.00 0.00 66.70 65.21 2kdx h VAL 47 Cb 0.73 0.55 -0.01 0.00 -2.01 0.00 0.00 31.29 30.56 2kdx h VAL 47 CO 0.00 0.16 -0.27 0.77 -1.01 0.00 0.00 177.57 177.22 2kdx h SER 48 N 0.62 0.00 -0.14 3.17 4.64 -1.20 0.41 113.55 121.06 2kdx h SER 48 Ca 0.17 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.44 2kdx h SER 48 Cb 0.02 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.11 2kdx h SER 48 CO -0.03 0.27 -0.09 0.00 -0.87 0.00 0.00 176.83 176.11 2kdx h ALA 49 N 1.73 0.19 -0.45 5.18 0.00 -0.92 -0.60 119.26 124.40 2kdx h ALA 49 Ca -0.00 -0.28 0.07 0.00 0.00 0.00 0.00 54.91 54.70 2kdx h ALA 49 Cb 0.55 -0.04 -0.06 0.00 0.00 0.00 0.00 17.79 18.24 2kdx h ALA 49 CO 0.03 0.02 0.09 0.35 0.00 0.00 0.00 179.25 179.74 2kdx h PHE 50 N -0.06 0.15 -0.79 0.00 3.04 -0.65 -1.24 116.94 117.40 2kdx h PHE 50 Ca 0.03 0.03 -0.05 0.00 3.98 0.00 0.00 57.97 61.96 2kdx h PHE 50 Cb 0.58 0.00 -0.03 0.00 2.56 0.00 0.00 35.95 39.06 2kdx h PHE 50 CO 0.07 0.01 0.30 0.93 -2.02 0.00 0.00 178.31 177.61 2kdx h GLU 51 N 0.23 1.18 -0.33 1.11 4.39 -0.96 -2.30 114.58 117.90 2kdx h GLU 51 Ca 0.22 -0.22 0.01 0.00 0.34 0.00 0.00 59.36 59.71 2kdx h GLU 51 Cb 0.28 -0.19 -0.02 0.00 -0.10 0.00 0.00 28.75 28.72 2kdx h GLU 51 CO -0.29 0.97 0.20 1.15 -1.16 0.00 0.00 179.01 179.88 2kdx h THR 52 N 1.15 1.05 -0.00 1.13 2.02 -0.64 -2.90 112.91 114.71 2kdx h THR 52 Ca 0.26 -0.14 0.00 0.00 0.77 0.00 0.00 66.41 67.30 2kdx h THR 52 Cb 0.23 0.60 0.00 0.00 -1.74 0.00 0.00 68.15 67.24 2kdx h THR 52 CO -0.02 0.08 -0.00 0.49 0.37 0.00 0.00 175.52 176.43 2kdx n PHE 53 N -4.89 0.00 0.18 3.16 3.72 -0.51 -4.28 117.46 114.84 2kdx n PHE 53 Ca -0.00 0.00 0.15 0.00 -0.05 0.00 0.00 57.45 57.55 2kdx n PHE 53 Cb 0.05 -0.02 0.75 0.00 -0.94 0.00 0.00 39.48 39.32 2kdx n PHE 53 CO 0.00 0.00 0.00 0.07 -0.05 0.00 0.00 176.76 176.78 2kdx h ARG 54 N 0.50 0.00 0.00 -1.08 0.11 -1.20 -2.20 114.38 110.51 2kdx h ARG 54 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 2kdx h ARG 54 Cb 0.13 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.21 2kdx h ARG 54 CO 0.00 0.00 0.25 0.93 0.10 0.00 0.00 179.97 181.25 2kdx h GLU 55 N 0.00 0.00 -0.27 0.08 5.08 -1.81 -1.92 114.58 115.73 2kdx h GLU 55 Ca 0.09 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.42 2kdx h GLU 55 Cb 0.43 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.67 2kdx h GLU 55 CO -0.00 0.00 0.02 1.49 -1.00 0.00 0.00 179.01 179.52 2kdx h GLU 56 N 0.00 0.40 -3.42 2.33 4.57 -1.75 -3.45 114.58 113.27 2kdx h GLU 56 Ca 0.00 -0.07 -0.33 0.00 -1.18 0.00 0.00 59.36 57.78 2kdx h GLU 56 Cb 0.50 -0.07 -0.36 0.00 -0.16 0.00 0.00 28.75 28.66 2kdx h GLU 56 CO 0.00 0.41 -0.73 -1.12 -1.18 0.00 0.00 179.01 176.39 2kdx s SER 57 N -6.79 0.57 0.39 1.04 0.01 -0.72 -5.05 113.70 103.14 2kdx s SER 57 Ca -0.07 0.06 0.09 0.00 1.31 0.00 0.00 55.95 57.34 2kdx s SER 57 Cb 0.16 -0.10 0.84 0.00 0.21 0.00 0.00 66.02 67.13 2kdx s SER 57 CO 0.74 -0.19 1.97 0.25 0.41 0.00 0.00 173.24 176.42 2kdx h LEU 58 N 7.84 0.56 -1.78 2.44 7.12 -1.87 -0.79 115.31 128.83 2kdx h LEU 58 Ca -0.30 0.01 -0.03 0.00 0.13 0.00 0.00 57.88 57.68 2kdx h LEU 58 Cb 1.12 -0.11 -0.00 0.00 -0.53 0.00 0.00 40.66 41.13 2kdx h LEU 58 CO 0.32 0.35 -0.16 -0.37 -0.13 0.00 0.00 178.44 178.46 2kdx h VAL 59 N 0.63 0.82 0.00 1.05 -1.51 -1.92 -3.10 116.25 112.22 2kdx h VAL 59 Ca 0.29 -0.61 -0.20 0.00 -1.23 0.00 0.00 66.70 64.95 2kdx h VAL 59 Cb 0.34 1.36 -0.03 0.00 -2.13 0.00 0.00 31.29 30.83 2kdx h VAL 59 CO -0.09 0.16 -1.28 0.00 -1.23 0.00 0.00 177.57 175.13 2kdx n LYS 61 N -3.08 0.09 -3.14 0.00 5.02 -1.15 -3.04 118.16 112.85 2kdx n LYS 61 Ca -0.08 0.39 -0.23 0.00 -2.02 0.00 0.00 58.31 56.37 2kdx n LYS 61 Cb 0.91 -1.69 -0.05 0.00 -0.02 0.00 0.00 35.03 34.18 2kdx n LYS 61 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 2kdx n ASP 62 N -1.86 2.28 -4.07 4.39 2.03 -1.25 -5.10 116.55 112.98 2kdx n ASP 62 Ca 0.02 -3.24 -0.12 0.00 0.52 0.00 0.00 54.79 51.97 2kdx n ASP 62 Cb 0.15 -0.61 -0.09 0.00 -0.72 0.00 0.00 41.12 39.86 2kdx n ASP 62 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2kdx s ALA 63 N -2.58 0.97 0.03 -1.67 0.00 -1.17 -4.18 121.76 113.16 2kdx s ALA 63 Ca 0.42 -1.58 0.02 0.00 0.00 0.00 0.00 51.96 50.82 2kdx s ALA 63 Cb 0.27 1.34 -0.02 0.00 0.00 0.00 0.00 23.12 24.71 2kdx s ALA 63 CO -0.10 -0.65 -0.07 0.42 0.00 0.00 0.00 175.76 175.36 2kdx s ILE 64 N -4.05 0.54 -0.28 0.00 1.01 -1.18 -5.01 121.20 112.23 2kdx s ILE 64 Ca 0.36 -0.89 0.03 0.00 0.00 0.00 0.00 60.65 60.15 2kdx s ILE 64 Cb 0.05 -0.57 0.07 0.00 0.01 0.00 0.00 42.46 42.02 2kdx s ILE 64 CO 0.13 -0.26 -0.06 -0.22 0.00 0.00 0.00 174.94 174.53 2kdx s LEU 65 N -1.24 3.62 -0.53 2.97 2.96 -1.26 -0.78 118.68 124.42 2kdx s LEU 65 Ca -0.07 -1.55 -0.18 0.00 -0.22 0.00 0.00 54.13 52.11 2kdx s LEU 65 Cb -0.08 -1.51 0.08 0.00 0.50 0.00 0.00 46.19 45.18 2kdx s LEU 65 CO 0.00 -0.24 0.58 -0.62 -1.32 0.00 0.00 176.35 174.74 2kdx s ASP 66 N 1.10 6.19 -0.19 3.68 2.15 -0.22 -5.01 116.67 124.36 2kdx s ASP 66 Ca -0.04 -1.29 -0.27 0.00 0.43 0.00 0.00 52.55 51.39 2kdx s ASP 66 Cb -0.20 -2.26 -0.00 0.00 -0.30 0.00 0.00 42.92 40.16 2kdx s ASP 66 CO -0.06 -0.89 0.93 -0.63 -0.17 0.00 0.00 175.17 174.35 2kdx s ILE 67 N 2.26 4.79 -0.12 4.11 1.01 -1.26 -1.20 121.20 130.80 2kdx s ILE 67 Ca 0.10 1.83 -0.14 0.00 0.00 0.00 0.00 60.65 62.43 2kdx s ILE 67 Cb -0.23 -4.22 -0.05 0.00 0.01 0.00 0.00 42.46 37.96 2kdx s ILE 67 CO 0.08 -0.06 0.34 -0.69 0.00 0.00 0.00 174.94 174.60 2kdx s VAL 68 N 2.59 5.24 -0.63 2.92 1.01 0.48 -4.99 120.40 127.02 2kdx s VAL 68 Ca 0.41 0.66 -0.27 0.00 0.00 0.00 0.00 61.98 62.78 2kdx s VAL 68 Cb -0.16 -3.67 0.01 0.00 0.00 0.00 0.00 36.38 32.56 2kdx s VAL 68 CO 0.10 0.43 1.53 -1.81 0.00 0.00 0.00 175.10 175.35 2kdx s ASP 69 N 0.11 5.85 0.30 3.32 1.01 -1.26 -1.28 116.67 124.71 2kdx s ASP 69 Ca 0.20 0.09 -0.25 0.00 0.71 0.00 0.00 52.55 53.29 2kdx s ASP 69 Cb -0.14 -2.54 -0.10 0.00 1.01 0.00 0.00 42.92 41.15 2kdx s ASP 69 CO 0.07 -1.97 0.91 -1.61 0.21 0.00 0.00 175.17 172.78 2kdx s GLU 70 N 6.09 4.55 0.80 8.23 0.41 0.04 -4.89 118.70 133.93 2kdx s GLU 70 Ca 0.52 1.27 -0.11 0.00 -0.41 0.00 0.00 54.97 56.24 2kdx s GLU 70 Cb -0.11 -2.85 0.08 0.00 -1.78 0.00 0.00 34.13 29.46 2kdx s GLU 70 CO 0.20 0.32 1.10 0.15 -0.49 0.00 0.00 175.26 176.54 2kdx s LYS 71 N -1.96 2.00 0.02 1.61 3.01 -1.26 -0.94 119.74 122.21 2kdx s LYS 71 Ca 0.48 1.17 0.05 0.00 -1.01 0.00 0.00 55.97 56.65 2kdx s LYS 71 Cb -0.19 -1.87 -0.02 0.00 -1.01 0.00 0.00 37.83 34.75 2kdx s LYS 71 CO 0.24 -1.83 -0.14 0.08 0.51 0.00 0.00 175.35 174.21 2kdx s VAL 72 N -2.88 1.09 -0.04 3.17 1.01 -1.26 -3.90 120.40 117.59 2kdx s VAL 72 Ca 0.62 -0.83 -0.08 0.00 0.00 0.00 0.00 61.98 61.70 2kdx s VAL 72 Cb -0.18 -0.96 0.01 0.00 0.00 0.00 0.00 36.38 35.26 2kdx s VAL 72 CO 0.56 0.12 0.18 -0.70 0.00 0.00 0.00 175.10 175.27 2kdx s GLU 73 N -0.80 0.36 -0.33 2.72 2.12 -1.04 -4.57 118.70 117.17 2kdx s GLU 73 Ca 0.03 -0.02 0.01 0.00 0.36 0.00 0.00 54.97 55.35 2kdx s GLU 73 Cb -0.07 0.16 0.08 0.00 0.26 0.00 0.00 34.13 34.57 2kdx s GLU 73 CO 0.01 -0.07 0.04 -0.51 -0.54 0.00 0.00 175.26 174.18 2kdx s LEU 74 N -0.58 4.42 0.42 2.70 2.01 0.15 -0.88 118.68 126.93 2kdx s LEU 74 Ca -0.07 -1.82 -0.16 0.00 0.01 0.00 0.00 54.13 52.09 2kdx s LEU 74 Cb -0.04 -1.66 -0.09 0.00 0.01 0.00 0.00 46.19 44.41 2kdx s LEU 74 CO 0.01 -0.35 0.87 -1.83 1.01 0.00 0.00 176.35 176.06 2kdx s GLU 75 N 1.05 4.01 0.60 1.70 -1.05 -0.33 -1.06 118.70 123.63 2kdx s GLU 75 Ca 0.03 0.83 -0.14 0.00 -0.15 0.00 0.00 54.97 55.55 2kdx s GLU 75 Cb -0.20 -2.27 -0.04 0.00 -0.44 0.00 0.00 34.13 31.18 2kdx s GLU 75 CO -0.05 -0.05 1.04 0.00 0.95 0.00 0.00 175.26 177.14 2kdx h LYS 77 N 0.16 -0.93 -1.81 0.00 1.79 -1.92 -3.41 116.57 110.44 2kdx h LYS 77 Ca -0.46 0.06 -0.51 0.00 -2.18 0.00 0.00 60.65 57.56 2kdx h LYS 77 Cb 1.21 0.21 -0.41 0.00 -1.58 0.00 0.00 32.23 31.66 2kdx h LYS 77 CO 0.59 -0.62 -0.93 -3.47 -1.08 0.00 0.00 179.45 173.94 2kdx n ASP 78 N -4.82 2.88 0.00 0.86 2.03 -1.26 -5.04 116.55 111.20 2kdx n ASP 78 Ca -0.12 -3.31 0.00 0.00 0.52 0.00 0.00 54.79 51.88 2kdx n ASP 78 Cb 0.38 -0.55 0.00 0.00 -0.72 0.00 0.00 41.12 40.23 2kdx n ASP 78 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2kdx n SER 80 N 0.00 0.00 -4.20 0.00 3.41 -1.26 -5.04 113.62 106.53 2kdx n SER 80 Ca 0.00 -1.64 -0.20 0.00 -0.26 0.00 0.00 58.87 56.76 2kdx n SER 80 Cb 0.00 -0.13 -0.12 0.00 -0.26 0.00 0.00 64.21 63.70 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 1.39 0.04 7.33 5.65 -1.26 -5.10 115.29 123.35 2kdx s HIS 81 Ca 0.00 -0.43 0.01 0.00 0.25 0.00 0.00 55.06 54.89 2kdx s HIS 81 Cb 0.00 -0.79 -0.03 0.00 -1.18 0.00 0.00 32.58 30.59 2kdx s HIS 81 CO 0.00 0.09 -0.05 0.14 -0.65 0.00 0.00 174.74 174.27 2kdx s VAL 82 N -1.16 0.38 0.34 0.89 -7.23 -1.26 -2.38 120.40 109.97 2kdx s VAL 82 Ca 0.01 -1.20 0.08 0.00 -1.81 0.00 0.00 61.98 59.06 2kdx s VAL 82 Cb -0.10 -0.71 -0.03 0.00 0.56 0.00 0.00 36.38 36.11 2kdx s VAL 82 CO 0.03 -0.54 0.29 0.72 -0.31 0.00 0.00 175.10 175.28 2kdx s PHE 83 N -1.93 1.78 0.00 2.82 -0.12 -0.22 -4.96 117.98 115.35 2kdx s PHE 83 Ca -0.08 -1.68 -0.07 0.00 -0.05 0.00 0.00 56.93 55.05 2kdx s PHE 83 Cb -0.06 -0.71 -0.05 0.00 -0.63 0.00 0.00 43.02 41.56 2kdx s PHE 83 CO -0.02 -0.89 0.27 0.15 -0.05 0.00 0.00 175.22 174.68 2kdx s LYS 84 N -3.39 3.60 1.22 1.99 1.02 -1.26 -0.67 119.74 122.24 2kdx s LYS 84 Ca 0.41 -0.04 -0.20 0.00 0.02 0.00 0.00 55.97 56.16 2kdx s LYS 84 Cb 0.02 -3.09 0.29 0.00 -0.52 0.00 0.00 37.83 34.54 2kdx s LYS 84 CO 0.29 0.65 1.10 -1.25 -0.92 0.00 0.00 175.35 175.22 2kdx s PRO 85 N -1.68 -1.36 0.00 -1.68 0.04 -1.26 -4.39 135.00 124.67 2kdx s PRO 85 Ca 0.27 -0.08 0.00 0.00 0.04 0.00 0.00 61.00 61.22 2kdx s PRO 85 Cb -0.13 -1.58 0.00 0.00 0.04 0.00 0.00 34.50 32.82 2kdx s PRO 85 CO 0.15 -3.80 0.00 -1.71 0.04 0.00 0.00 177.00 171.69 2kdx n ASN 86 N -4.82 0.00 -4.70 6.66 5.15 -1.26 -5.03 115.26 111.26 2kdx n ASN 86 Ca 0.13 0.00 -0.42 0.00 -0.60 0.00 0.00 54.58 53.69 2kdx n ASN 86 Cb 0.60 0.00 -0.03 0.00 -0.53 0.00 0.00 39.78 39.82 2kdx n ASN 86 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2kdx s ALA 87 N -3.36 3.67 -0.01 5.20 0.00 -1.26 -4.92 121.76 121.08 2kdx s ALA 87 Ca 0.00 1.16 0.00 0.00 0.00 0.00 0.00 51.96 53.13 2kdx s ALA 87 Cb 0.00 -3.64 -0.01 0.00 0.00 0.00 0.00 23.12 19.47 2kdx s ALA 87 CO 0.00 -0.93 -0.01 1.47 0.00 0.00 0.00 175.76 176.30 2kdx n LEU 88 N 4.98 2.09 0.18 0.00 -0.00 -1.26 -3.85 117.00 119.14 2kdx n LEU 88 Ca 0.14 -0.00 0.11 0.00 -0.00 0.00 0.00 56.01 56.25 2kdx n LEU 88 Cb 0.41 -0.02 0.12 0.00 -0.00 0.00 0.00 43.42 43.93 2kdx n LEU 88 CO 0.61 0.37 0.60 -0.78 -0.00 0.00 0.00 177.39 178.18 2kdx h ASP 89 N 0.00 0.00 0.00 1.45 3.58 -2.04 -3.36 116.42 116.05 2kdx h ASP 89 Ca -0.02 0.00 -0.14 0.00 0.42 0.00 0.00 57.03 57.29 2kdx h ASP 89 Cb 1.04 0.00 -0.30 0.00 1.72 0.00 0.00 39.33 41.79 2kdx h ASP 89 CO -0.00 0.07 -0.91 0.00 -2.88 0.00 0.00 179.24 175.51 2kdx n TYR 90 N -3.03 0.00 1.07 0.28 4.11 -1.26 -4.95 117.16 113.38 2kdx n TYR 90 Ca 0.03 -0.57 0.10 0.00 -0.00 0.00 0.00 57.90 57.45 2kdx n TYR 90 Cb 0.56 -0.15 0.54 0.00 -0.00 0.00 0.00 39.34 40.30 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 0.24 -0.86 3.77 -7.48 0.00 -1.25 -4.80 105.19 94.80 2kdx n GLY 91 Ca 0.07 -0.11 -0.30 0.00 0.00 0.00 0.00 46.02 45.68 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 -2.39 3.10 0.18 1.61 -7.23 -1.26 -4.76 120.40 109.65 2kdx s VAL 92 Ca 0.23 0.36 -0.32 0.00 -1.81 0.00 0.00 61.98 60.44 2kdx s VAL 92 Cb 0.14 -2.96 -0.11 0.00 0.56 0.00 0.00 36.38 34.01 2kdx s VAL 92 CO 0.29 -0.47 1.68 0.00 -0.31 0.00 0.00 175.10 176.29 2kdx h GLU 94 N 7.07 0.00 0.00 0.00 5.08 -1.92 -3.01 114.58 121.81 2kdx h GLU 94 Ca -0.43 0.00 -0.06 0.00 -1.00 0.00 0.00 59.36 57.87 2kdx h GLU 94 Cb 1.20 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.44 2kdx h GLU 94 CO 0.94 0.07 -0.40 0.87 -1.00 0.00 0.00 179.01 179.50 2kdx h LYS 95 N 0.00 0.00 -4.57 2.33 1.57 -1.98 -3.46 116.57 110.45 2kdx h LYS 95 Ca -0.00 0.00 -0.64 0.00 -1.87 0.00 0.00 60.65 58.14 2kdx h LYS 95 Cb 0.32 0.00 -0.38 0.00 0.08 0.00 0.00 32.23 32.26 2kdx h LYS 95 CO 0.01 0.63 -0.79 0.00 -0.57 0.00 0.00 179.45 178.73 2kdx n HIS 97 N 4.57 0.44 -4.14 0.00 1.44 -1.23 -3.31 115.22 112.99 2kdx n HIS 97 Ca -0.13 -0.95 -0.09 0.00 -2.01 0.00 0.00 57.72 54.54 2kdx n HIS 97 Cb 0.43 -0.95 -0.10 0.00 0.12 0.00 0.00 29.99 29.49 2kdx n HIS 97 CO 0.00 0.00 0.00 -1.12 -2.81 0.00 0.00 176.34 172.41 2kdx s SER 98 N 4.24 0.49 -0.29 4.39 0.01 -1.26 -4.93 113.70 116.35 2kdx s SER 98 Ca 0.14 -1.13 0.11 0.00 1.31 0.00 0.00 55.95 56.38 2kdx s SER 98 Cb 0.04 0.24 0.62 0.00 0.21 0.00 0.00 66.02 67.13 2kdx s SER 98 CO -0.01 -0.66 1.63 0.29 0.41 0.00 0.00 173.24 174.90 2kdx n LYS 99 N -0.04 2.87 0.00 12.44 5.02 -1.26 -1.17 118.16 136.02 2kdx n LYS 99 Ca -0.09 -3.05 0.07 0.00 -2.02 0.00 0.00 58.31 53.22 2kdx n LYS 99 Cb 0.63 -2.01 0.37 0.00 -0.02 0.00 0.00 35.03 33.99 2kdx n LYS 99 CO 0.00 0.00 0.00 0.27 -0.52 0.00 0.00 177.40 177.15 2kdx n ASN 100 N -0.61 0.00 -4.56 4.39 6.94 -1.26 -4.92 115.26 115.24 2kdx n ASN 100 Ca 0.36 -0.17 -0.36 0.00 -0.02 0.00 0.00 54.58 54.39 2kdx n ASN 100 Cb 1.20 -0.14 0.08 0.00 -2.36 0.00 0.00 39.78 38.56 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 -1.14 2.34 -4.25 3.53 0.24 -1.26 -4.50 118.33 113.29 2kdx n VAL 101 Ca 0.08 -0.37 -0.18 0.00 -2.04 0.00 0.00 64.34 61.83 2kdx n VAL 101 Cb 0.07 -0.95 -0.11 0.00 -1.47 0.00 0.00 33.84 31.38 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 -1.87 1.38 -0.45 1.34 -0.00 -0.07 -4.97 121.20 116.55 2kdx s ILE 102 Ca 0.70 -1.77 -0.29 0.00 -0.00 0.00 0.00 60.65 59.29 2kdx s ILE 102 Cb -0.34 -1.59 0.02 0.00 -0.00 0.00 0.00 42.46 40.54 2kdx s ILE 102 CO 0.53 -0.43 1.31 -0.63 -0.00 0.00 0.00 174.94 175.72 2kdx s ILE 103 N -2.23 4.01 -1.07 8.37 1.09 -1.26 -1.18 121.20 128.93 2kdx s ILE 103 Ca 0.10 1.02 0.25 0.00 -1.10 0.00 0.00 60.65 60.93 2kdx s ILE 103 Cb -0.04 -4.37 0.03 0.00 -1.06 0.00 0.00 42.46 37.02 2kdx s ILE 103 CO 0.03 -0.88 1.44 1.07 -0.10 0.00 0.00 174.94 176.50 2kdx n THR 104 N 6.99 0.00 -3.65 2.92 5.66 -0.05 -4.72 114.28 121.43 2kdx n THR 104 Ca 0.15 -0.01 -0.06 0.00 -3.05 0.00 0.00 64.05 61.07 2kdx n THR 104 Cb 0.48 0.25 -0.07 0.00 -1.55 0.00 0.00 70.33 69.45 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 -2.95 0.64 -0.13 1.09 2.00 -1.22 -4.95 119.66 114.13 2kdx s GLN 105 Ca 0.12 1.22 0.00 0.00 -2.00 0.00 0.00 55.36 54.71 2kdx s GLN 105 Cb 0.18 0.28 0.00 0.00 0.80 0.00 0.00 33.01 34.27 2kdx s GLN 105 CO 0.68 -0.16 0.00 0.41 -0.50 0.00 0.00 175.29 175.72 2kdx n GLY 106 N 4.58 0.50 0.22 2.59 0.00 -1.25 -2.48 105.19 109.34 2kdx n GLY 106 Ca -0.18 -0.70 0.05 0.00 0.00 0.00 0.00 46.02 45.19 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 0.01 -5.49 1.61 -1.24 -1.90 -3.37 115.58 105.21 2kdx h ASN 107 Ca -0.02 -0.00 -0.20 0.00 0.71 0.00 0.00 56.30 56.78 2kdx h ASN 107 Cb 0.10 -0.00 -0.12 0.00 0.73 0.00 0.00 38.32 39.03 2kdx h ASN 107 CO 0.04 0.22 -0.39 -1.83 -1.29 0.00 0.00 177.43 174.17 2kdx s GLU 108 N -4.59 1.45 0.89 6.67 -1.05 -1.26 -4.62 118.70 116.18 2kdx s GLU 108 Ca -0.04 -1.55 -0.12 0.00 -0.15 0.00 0.00 54.97 53.12 2kdx s GLU 108 Cb 0.16 0.36 0.13 0.00 -0.44 0.00 0.00 34.13 34.34 2kdx s GLU 108 CO 0.70 -0.54 1.10 0.00 0.95 0.00 0.00 175.26 177.46 2kdx s MET 109 N -3.92 1.28 -0.07 -4.83 0.23 -1.26 -4.29 119.30 106.43 2kdx s MET 109 Ca 0.32 0.71 -0.22 0.00 -1.03 0.00 0.00 55.69 55.48 2kdx s MET 109 Cb 0.03 -1.82 0.05 0.00 -1.53 0.00 0.00 34.83 31.56 2kdx s MET 109 CO 0.13 -2.20 0.51 -0.98 -2.03 0.00 0.00 175.02 170.45 2kdx s ARG 110 N -5.00 0.81 0.62 3.16 1.70 -0.28 -5.01 118.95 114.94 2kdx s ARG 110 Ca 0.63 0.20 -0.16 0.00 -0.47 0.00 0.00 55.73 55.93 2kdx s ARG 110 Cb -0.17 0.38 -0.02 0.00 -0.57 0.00 0.00 34.95 34.56 2kdx s ARG 110 CO 0.56 -0.21 1.11 -0.48 -1.08 0.00 0.00 175.30 175.19 2kdx s LEU 111 N -0.90 3.51 -0.01 -1.89 2.34 -1.26 -0.45 118.68 120.02 2kdx s LEU 111 Ca -0.09 2.02 -0.05 0.00 0.06 0.00 0.00 54.13 56.07 2kdx s LEU 111 Cb -0.03 -4.56 -0.02 0.00 -0.56 0.00 0.00 46.19 41.02 2kdx s LEU 111 CO 0.06 -1.44 -0.10 0.18 -1.06 0.00 0.00 176.35 173.99 2kdx n LEU 112 N -2.04 1.08 -3.83 1.48 4.32 -0.01 -4.76 117.00 113.24 2kdx n LEU 112 Ca 0.10 0.16 -0.08 0.00 -0.02 0.00 0.00 56.01 56.18 2kdx n LEU 112 Cb 0.52 -0.38 -0.02 0.00 -1.62 0.00 0.00 43.42 41.92 2kdx n LEU 112 CO 0.46 -0.36 0.44 -0.55 -1.22 0.00 0.00 177.39 176.17 2kdx s SER 113 N -5.88 -0.28 -0.22 -1.43 0.15 -1.06 -5.03 113.70 99.94 2kdx s SER 113 Ca -0.09 -0.57 0.01 0.00 0.70 0.00 0.00 55.95 56.00 2kdx s SER 113 Cb 0.02 0.71 0.06 0.00 -1.71 0.00 0.00 66.02 65.09 2kdx s SER 113 CO 0.13 -1.30 -0.06 -0.76 1.20 0.00 0.00 173.24 172.45 2kdx s LEU 114 N -2.91 2.45 0.06 3.45 1.43 -1.26 -0.66 118.68 121.25 2kdx s LEU 114 Ca 0.11 -1.10 -0.30 0.00 -1.03 0.00 0.00 54.13 51.81 2kdx s LEU 114 Cb -0.05 -1.16 -0.05 0.00 0.03 0.00 0.00 46.19 44.96 2kdx s LEU 114 CO 0.05 -0.22 1.02 -1.61 0.23 0.00 0.00 176.35 175.82 2kdx s GLU 115 N 1.41 4.59 0.09 1.70 0.41 0.05 -4.97 118.70 121.99 2kdx s GLU 115 Ca -0.05 1.51 0.10 0.00 -0.41 0.00 0.00 54.97 56.13 2kdx s GLU 115 Cb -0.18 -3.40 -0.03 0.00 -1.78 0.00 0.00 34.13 28.74 2kdx s GLU 115 CO -0.07 0.02 -0.26 -1.64 -0.49 0.00 0.00 175.26 172.82 2kdx s MET 116 N 0.54 1.52 0.96 1.61 -1.94 -1.26 -0.66 119.30 120.07 2kdx s MET 116 Ca 0.51 -1.22 -0.12 0.00 -1.71 0.00 0.00 55.69 53.15 2kdx s MET 116 Cb -0.24 -1.86 0.17 0.00 2.01 0.00 0.00 34.83 34.90 2kdx s MET 116 CO 0.30 0.46 1.09 -0.51 -0.01 0.00 0.00 175.02 176.34 2kdx s LEU 117 N -1.70 1.95 0.00 -0.03 1.43 -1.26 -3.91 118.68 115.16 2kdx s LEU 117 Ca 0.12 1.47 0.00 0.00 -1.03 0.00 0.00 54.13 54.70 2kdx s LEU 117 Cb -0.10 -3.77 0.00 0.00 0.03 0.00 0.00 46.19 42.36 2kdx s LEU 117 CO 0.04 -3.01 0.00 0.00 0.23 0.00 0.00 176.35 173.61 2kdx n ALA 118 N -4.12 0.00 0.65 4.21 0.00 -1.26 -4.98 120.51 115.00 2kdx n ALA 118 Ca 0.06 0.00 0.05 0.00 0.00 0.00 0.00 53.44 53.55 2kdx n ALA 118 Cb 0.55 -0.09 0.31 0.00 0.00 0.00 0.00 19.45 20.22 2kdx n ALA 118 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59