#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 0.27 -0.00 1.61 0.15 -1.26 -5.08 113.70 109.39 2kdx s SER 2 Ca 0.00 -1.18 0.01 0.00 0.70 0.00 0.00 55.95 55.48 2kdx s SER 2 Cb 0.00 0.32 0.01 0.00 -1.71 0.00 0.00 66.02 64.64 2kdx s SER 2 CO 0.00 -0.75 0.75 0.23 1.20 0.00 0.00 173.24 174.66 2kdx n MET 3 N -0.12 1.30 0.26 5.44 0.00 -1.26 -4.91 117.12 117.83 2kdx n MET 3 Ca -0.05 -1.00 0.17 0.00 0.00 0.00 0.00 57.70 56.81 2kdx n MET 3 Cb 0.64 -0.74 0.90 0.00 0.00 0.00 0.00 33.22 34.02 2kdx n MET 3 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 175.97 177.22 2kdx h HIS 4 N 0.00 0.00 -0.01 2.03 -0.00 -2.02 -1.09 115.15 114.05 2kdx h HIS 4 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.37 2kdx h HIS 4 Cb 0.81 0.00 -0.00 0.00 -0.00 0.00 0.00 27.41 28.21 2kdx h HIS 4 CO 0.00 0.00 0.03 1.05 -0.00 0.00 0.00 177.93 179.01 2kdx h GLU 5 N 0.00 0.00 -0.23 5.26 4.11 -2.06 -1.60 114.58 120.06 2kdx h GLU 5 Ca 0.04 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.47 2kdx h GLU 5 Cb 0.22 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.47 2kdx h GLU 5 CO -0.00 0.00 0.00 0.66 0.07 0.00 0.00 179.01 179.74 2kdx n TYR 6 N -3.45 0.29 0.14 2.06 4.01 -0.41 -4.42 117.16 115.38 2kdx n TYR 6 Ca -0.03 -0.15 -0.14 0.00 -0.16 0.00 0.00 57.90 57.43 2kdx n TYR 6 Cb 0.10 0.00 -0.07 0.00 -0.31 0.00 0.00 39.34 39.07 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 2.56 -0.93 -0.27 7.72 0.87 -1.43 -1.33 113.55 120.74 2kdx h SER 7 Ca 0.00 0.10 0.04 0.00 -1.23 0.00 0.00 61.79 60.70 2kdx h SER 7 Cb 0.57 0.34 -0.04 0.00 -0.44 0.00 0.00 62.40 62.83 2kdx h SER 7 CO 0.00 -0.43 0.04 0.58 -0.53 0.00 0.00 176.83 176.49 2kdx h VAL 8 N -0.59 0.86 0.32 2.23 2.07 -1.81 -2.12 116.25 117.21 2kdx h VAL 8 Ca 0.01 -0.05 0.00 0.00 0.82 0.00 0.00 66.70 67.49 2kdx h VAL 8 Cb 0.60 0.71 -0.03 0.00 -1.52 0.00 0.00 31.29 31.05 2kdx h VAL 8 CO -0.15 0.02 -0.39 0.58 0.02 0.00 0.00 177.57 177.65 2kdx h VAL 9 N 0.14 0.21 -0.65 2.57 2.07 -1.75 0.11 116.25 118.94 2kdx h VAL 9 Ca 0.13 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.69 2kdx h VAL 9 Cb 0.14 0.21 -0.05 0.00 -1.52 0.00 0.00 31.29 30.07 2kdx h VAL 9 CO -0.18 0.00 0.39 -1.28 0.02 0.00 0.00 177.57 176.52 2kdx h SER 10 N -0.76 0.61 -0.64 0.57 0.87 -1.27 -2.62 113.55 110.31 2kdx h SER 10 Ca -0.02 0.01 -0.06 0.00 -1.23 0.00 0.00 61.79 60.49 2kdx h SER 10 Cb 0.70 -0.11 -0.03 0.00 -0.44 0.00 0.00 62.40 62.52 2kdx h SER 10 CO -0.10 0.41 0.15 0.28 -0.53 0.00 0.00 176.83 177.04 2kdx h SER 11 N 0.74 0.99 0.39 6.23 0.02 -0.89 -0.63 113.55 120.40 2kdx h SER 11 Ca 0.27 -0.20 -0.01 0.00 -0.84 0.00 0.00 61.79 61.01 2kdx h SER 11 Cb 0.09 -0.26 -0.01 0.00 0.14 0.00 0.00 62.40 62.36 2kdx h SER 11 CO -0.13 0.95 -0.24 0.25 -1.14 0.00 0.00 176.83 176.52 2kdx h LEU 12 N 0.99 -0.60 -0.35 5.07 7.12 -0.60 -0.64 115.31 126.30 2kdx h LEU 12 Ca 0.21 0.04 0.06 0.00 0.13 0.00 0.00 57.88 58.31 2kdx h LEU 12 Cb 0.36 0.18 -0.05 0.00 -0.53 0.00 0.00 40.66 40.62 2kdx h LEU 12 CO 0.00 -0.38 0.04 0.40 -0.13 0.00 0.00 178.44 178.37 2kdx h ILE 13 N -0.61 0.78 -0.38 4.05 2.04 -1.37 -0.92 117.51 121.11 2kdx h ILE 13 Ca -0.04 -0.05 0.02 0.00 1.00 0.00 0.00 64.86 65.79 2kdx h ILE 13 Cb 0.50 0.63 -0.03 0.00 -0.74 0.00 0.00 36.82 37.18 2kdx h ILE 13 CO 0.04 0.03 0.20 0.00 0.00 0.00 0.00 178.15 178.42 2kdx h ALA 14 N 1.28 0.47 0.07 1.87 0.00 -0.97 -0.20 119.26 121.79 2kdx h ALA 14 Ca 0.17 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.08 2kdx h ALA 14 Cb 0.21 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.93 2kdx h ALA 14 CO -0.25 -0.15 -0.04 -0.07 0.00 0.00 0.00 179.25 178.74 2kdx h LEU 15 N 0.41 -0.09 -0.44 0.00 3.38 -0.89 -1.31 115.31 116.38 2kdx h LEU 15 Ca 0.16 0.00 0.06 0.00 0.09 0.00 0.00 57.88 58.19 2kdx h LEU 15 Cb 0.04 0.03 -0.05 0.00 0.09 0.00 0.00 40.66 40.77 2kdx h LEU 15 CO -0.10 -0.06 0.12 0.00 0.09 0.00 0.00 178.44 178.49 2kdx h GLU 17 N 0.27 -0.45 -0.21 0.00 4.81 -0.95 -1.28 114.58 116.77 2kdx h GLU 17 Ca 0.21 0.03 0.01 0.00 -0.13 0.00 0.00 59.36 59.49 2kdx h GLU 17 Cb 0.24 0.10 -0.02 0.00 0.63 0.00 0.00 28.75 29.70 2kdx h GLU 17 CO -0.25 -0.30 0.10 1.49 -0.73 0.00 0.00 179.01 179.33 2kdx h GLU 18 N -0.46 0.22 -0.75 1.92 4.81 -0.90 -1.68 114.58 117.74 2kdx h GLU 18 Ca 0.04 -0.01 -0.00 0.00 -0.13 0.00 0.00 59.36 59.26 2kdx h GLU 18 Cb 0.52 -0.05 -0.04 0.00 0.63 0.00 0.00 28.75 29.81 2kdx h GLU 18 CO -0.20 0.14 0.46 0.45 -0.73 0.00 0.00 179.01 179.14 2kdx h HIS 19 N 0.22 0.97 -0.27 0.92 3.86 -0.99 -1.79 115.15 118.08 2kdx h HIS 19 Ca 0.09 0.00 -0.06 0.00 -1.16 0.00 0.00 60.37 59.24 2kdx h HIS 19 Cb 0.02 -0.32 -0.01 0.00 1.06 0.00 0.00 27.41 28.16 2kdx h HIS 19 CO -0.09 0.65 -0.05 0.00 0.86 0.00 0.00 177.93 179.29 2kdx h ALA 20 N 1.25 0.37 -0.15 2.45 0.00 -0.93 -0.41 119.26 121.84 2kdx h ALA 20 Ca 0.27 -0.26 -0.07 0.00 0.00 0.00 0.00 54.91 54.84 2kdx h ALA 20 Cb -0.05 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 2kdx h ALA 20 CO -0.05 0.16 -0.24 1.57 0.00 0.00 0.00 179.25 180.70 2kdx h LYS 21 N 0.27 0.27 -0.02 0.00 2.10 -1.29 0.16 116.57 118.06 2kdx h LYS 21 Ca 0.07 -0.09 -0.24 0.00 -2.00 0.00 0.00 60.65 58.40 2kdx h LYS 21 Cb 0.51 -0.02 0.01 0.00 -0.90 0.00 0.00 32.23 31.83 2kdx h LYS 21 CO 0.02 0.50 -0.95 -0.22 -2.00 0.00 0.00 179.45 176.80 2kdx h LYS 22 N 0.24 0.56 0.00 0.07 1.63 -1.15 -2.63 116.57 115.30 2kdx h LYS 22 Ca 0.04 -0.58 0.00 0.00 -0.85 0.00 0.00 60.65 59.27 2kdx h LYS 22 Cb 0.56 0.16 0.00 0.00 -0.60 0.00 0.00 32.23 32.34 2kdx h LYS 22 CO 0.04 1.20 0.00 -1.71 -3.45 0.00 0.00 179.45 175.52 2kdx n ASN 23 N -3.81 0.00 -2.17 4.20 5.15 -0.18 -4.93 115.26 113.52 2kdx n ASN 23 Ca -0.08 -0.66 -0.17 0.00 -0.60 0.00 0.00 54.58 53.07 2kdx n ASN 23 Cb 0.83 -0.11 -0.03 0.00 -0.53 0.00 0.00 39.78 39.95 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 -1.11 -1.78 0.10 1.20 6.02 -0.62 -4.89 117.38 116.31 2kdx n GLN 24 Ca 0.20 0.87 -0.15 0.00 -0.01 0.00 0.00 57.00 57.91 2kdx n GLN 24 Cb 0.15 -5.42 -0.13 0.00 1.02 0.00 0.00 30.24 25.87 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 0.83 0.14 0.00 -1.58 0.00 -1.00 -3.48 119.26 114.17 2kdx h ALA 25 Ca -0.39 -0.86 0.00 0.00 0.00 0.00 0.00 54.91 53.66 2kdx h ALA 25 Cb 1.25 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.04 2kdx h ALA 25 CO 0.49 0.96 0.00 0.72 0.00 0.00 0.00 179.25 181.42 2kdx n HIS 26 N -3.56 0.00 -3.97 0.00 8.25 -1.11 -4.89 115.22 109.95 2kdx n HIS 26 Ca -0.08 0.00 -0.09 0.00 -0.26 0.00 0.00 57.72 57.29 2kdx n HIS 26 Cb 1.00 -1.67 -0.04 0.00 1.12 0.00 0.00 29.99 30.40 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 -1.56 1.66 0.28 -0.41 -2.85 -1.26 -4.45 119.74 111.16 2kdx s LYS 27 Ca 0.00 -1.25 0.07 0.00 -1.00 0.00 0.00 55.97 53.79 2kdx s LYS 27 Cb 0.00 0.51 -0.03 0.00 -2.06 0.00 0.00 37.83 36.25 2kdx s LYS 27 CO 0.00 -0.71 0.30 0.42 0.10 0.00 0.00 175.35 175.46 2kdx s ILE 28 N -3.82 4.34 -0.20 3.79 1.01 -1.22 -4.80 121.20 120.28 2kdx s ILE 28 Ca 0.20 -1.24 -0.17 0.00 0.00 0.00 0.00 60.65 59.44 2kdx s ILE 28 Cb -0.02 -3.45 -0.07 0.00 0.01 0.00 0.00 42.46 38.93 2kdx s ILE 28 CO 0.10 -0.27 -0.35 1.21 0.00 0.00 0.00 174.94 175.63 2kdx n GLU 29 N -1.35 0.54 -3.91 2.79 2.13 0.11 -4.62 120.64 116.33 2kdx n GLU 29 Ca -0.05 0.23 -0.10 0.00 0.66 0.00 0.00 57.16 57.89 2kdx n GLU 29 Cb 0.58 -1.45 -0.09 0.00 0.27 0.00 0.00 31.44 30.75 2kdx n GLU 29 CO 0.00 0.00 0.00 0.50 -0.41 0.00 0.00 177.13 177.22 2kdx s ARG 30 N -2.81 0.57 0.08 5.31 3.52 -0.81 -2.94 118.95 121.87 2kdx s ARG 30 Ca -0.31 -0.66 0.08 0.00 -0.13 0.00 0.00 55.73 54.71 2kdx s ARG 30 Cb 0.07 0.23 -0.03 0.00 -1.56 0.00 0.00 34.95 33.65 2kdx s ARG 30 CO 0.44 -0.14 -0.23 0.54 -0.81 0.00 0.00 175.30 175.10 2kdx s VAL 31 N -2.32 1.85 -0.14 7.11 0.11 -0.20 -0.62 120.40 126.19 2kdx s VAL 31 Ca -0.07 -1.43 -0.00 0.00 -2.93 0.00 0.00 61.98 57.55 2kdx s VAL 31 Cb -0.03 -1.63 0.03 0.00 -1.53 0.00 0.00 36.38 33.22 2kdx s VAL 31 CO -0.03 0.13 -0.10 -0.69 -3.33 0.00 0.00 175.10 171.08 2kdx s VAL 32 N -0.96 1.25 -0.05 2.04 1.01 -0.14 -0.71 120.40 122.84 2kdx s VAL 32 Ca 0.09 -0.49 -0.00 0.00 0.00 0.00 0.00 61.98 61.57 2kdx s VAL 32 Cb -0.10 -1.26 -0.03 0.00 0.00 0.00 0.00 36.38 34.99 2kdx s VAL 32 CO 0.03 0.35 -0.00 0.54 0.00 0.00 0.00 175.10 176.02 2kdx s VAL 33 N 1.61 4.23 -0.24 2.92 0.11 -0.24 -0.88 120.40 127.89 2kdx s VAL 33 Ca 0.04 -0.39 -0.06 0.00 -2.93 0.00 0.00 61.98 58.64 2kdx s VAL 33 Cb -0.13 -2.81 -0.02 0.00 -1.53 0.00 0.00 36.38 31.88 2kdx s VAL 33 CO -0.09 0.52 0.04 -0.83 -3.33 0.00 0.00 175.10 171.41 2kdx s GLY 34 N -1.13 1.72 -0.13 6.54 0.00 0.35 -0.53 107.32 114.16 2kdx s GLY 34 Ca 0.16 -1.15 0.01 0.00 0.00 0.00 0.00 44.72 43.74 2kdx s GLY 34 CO 0.05 0.51 -0.15 -0.42 0.00 0.00 0.00 173.10 173.09 2kdx s ILE 35 N 1.58 1.57 0.44 0.90 1.01 -0.34 -0.91 121.20 125.46 2kdx s ILE 35 Ca 0.06 -0.66 -0.25 0.00 0.00 0.00 0.00 60.65 59.80 2kdx s ILE 35 Cb -0.15 -1.45 -0.08 0.00 0.01 0.00 0.00 42.46 40.79 2kdx s ILE 35 CO 0.02 0.46 1.31 -0.83 0.00 0.00 0.00 174.94 175.89 2kdx s GLY 36 N 1.20 2.90 0.16 6.18 0.00 -1.26 -0.78 107.32 115.72 2kdx s GLY 36 Ca -0.01 1.23 0.19 0.00 0.00 0.00 0.00 44.72 46.13 2kdx s GLY 36 CO -0.06 1.80 1.59 -1.84 0.00 0.00 0.00 173.10 174.58 2kdx n GLU 37 N -0.14 0.11 -0.05 2.90 0.28 -0.04 -1.47 120.64 122.23 2kdx n GLU 37 Ca 0.05 0.38 0.02 0.00 -0.16 0.00 0.00 57.16 57.45 2kdx n GLU 37 Cb 0.44 -1.73 0.05 0.00 1.43 0.00 0.00 31.44 31.63 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 -1.94 2.56 0.14 3.44 5.12 -1.26 -4.71 116.66 120.01 2kdx n ARG 38 Ca 0.02 -1.58 0.11 0.00 -1.93 0.00 0.00 57.85 54.48 2kdx n ARG 38 Cb 0.19 -1.09 0.52 0.00 -1.16 0.00 0.00 32.46 30.92 2kdx n ARG 38 CO 0.00 0.00 0.00 0.43 -1.93 0.00 0.00 177.63 176.13 2kdx n SER 39 N -0.11 0.61 -0.56 0.55 7.64 -0.54 -4.90 113.62 116.31 2kdx n SER 39 Ca 0.04 0.70 -0.07 0.00 1.01 0.00 0.00 58.87 60.55 2kdx n SER 39 Cb 0.29 -0.81 -0.03 0.00 -1.01 0.00 0.00 64.21 62.64 2kdx n SER 39 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2kdx n ALA 40 N -1.77 -0.11 -1.62 -0.43 0.00 -1.26 -4.94 120.51 110.39 2kdx n ALA 40 Ca 0.01 0.11 -0.29 0.00 0.00 0.00 0.00 53.44 53.27 2kdx n ALA 40 Cb 0.15 -1.60 0.16 0.00 0.00 0.00 0.00 19.45 18.16 2kdx n ALA 40 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 2kdx s MET 41 N -2.51 0.74 -0.31 0.00 -1.94 -1.26 -5.08 119.30 108.94 2kdx s MET 41 Ca 0.00 0.02 0.02 0.00 -1.71 0.00 0.00 55.69 54.02 2kdx s MET 41 Cb 0.00 -1.82 0.09 0.00 2.01 0.00 0.00 34.83 35.11 2kdx s MET 41 CO 0.00 -2.42 0.03 0.34 -0.01 0.00 0.00 175.02 172.97 2kdx s ASP 42 N -4.31 4.36 0.43 3.03 -1.08 -1.26 -5.01 116.67 112.82 2kdx s ASP 42 Ca 0.67 -1.77 0.13 0.00 -0.52 0.00 0.00 52.55 51.06 2kdx s ASP 42 Cb -0.10 -1.32 1.00 0.00 -1.46 0.00 0.00 42.92 41.03 2kdx s ASP 42 CO 0.53 -0.35 1.98 0.07 0.52 0.00 0.00 175.17 177.92 2kdx h LYS 43 N 7.82 0.43 -0.36 4.34 2.10 -1.99 -1.84 116.57 127.08 2kdx h LYS 43 Ca -0.10 -0.03 -0.05 0.00 -2.00 0.00 0.00 60.65 58.47 2kdx h LYS 43 Cb 1.03 -0.10 -0.01 0.00 -0.90 0.00 0.00 32.23 32.25 2kdx h LYS 43 CO 0.48 0.29 0.04 1.03 -2.00 0.00 0.00 179.45 179.28 2kdx h SER 44 N 0.44 0.60 -0.41 7.07 0.87 -2.00 -1.74 113.55 118.38 2kdx h SER 44 Ca 0.28 -0.28 -0.02 0.00 -1.23 0.00 0.00 61.79 60.54 2kdx h SER 44 Cb 0.50 -0.16 -0.02 0.00 -0.44 0.00 0.00 62.40 62.28 2kdx h SER 44 CO -0.08 0.73 0.20 -0.07 -0.53 0.00 0.00 176.83 177.08 2kdx h LEU 45 N 0.45 0.54 0.42 2.23 3.38 -1.90 -2.21 115.31 118.22 2kdx h LEU 45 Ca 0.11 -0.13 -0.02 0.00 0.09 0.00 0.00 57.88 57.93 2kdx h LEU 45 Cb 0.40 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.01 2kdx h LEU 45 CO 0.01 0.52 -0.21 0.15 0.09 0.00 0.00 178.44 179.00 2kdx h PHE 46 N 0.53 -0.56 -0.66 1.13 3.57 -1.00 0.82 116.94 120.78 2kdx h PHE 46 Ca 0.14 -0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.61 2kdx h PHE 46 Cb 0.12 0.19 -0.03 0.00 2.79 0.00 0.00 35.95 39.02 2kdx h PHE 46 CO -0.01 -0.34 0.32 -0.24 -2.23 0.00 0.00 178.31 175.81 2kdx h VAL 47 N -0.58 1.22 -0.23 1.41 3.04 -1.42 -1.93 116.25 117.75 2kdx h VAL 47 Ca -0.06 -0.61 -0.01 0.00 -1.01 0.00 0.00 66.70 65.01 2kdx h VAL 47 Cb 0.46 0.41 -0.01 0.00 -2.01 0.00 0.00 31.29 30.13 2kdx h VAL 47 CO 0.09 0.25 0.08 -1.28 -1.01 0.00 0.00 177.57 175.70 2kdx h SER 48 N 0.91 0.29 -0.10 3.17 0.87 -1.07 0.45 113.55 118.07 2kdx h SER 48 Ca 0.23 -0.02 -0.04 0.00 -1.23 0.00 0.00 61.79 60.72 2kdx h SER 48 Cb 0.10 -0.07 -0.00 0.00 -0.44 0.00 0.00 62.40 61.99 2kdx h SER 48 CO -0.03 0.28 -0.10 0.00 -0.53 0.00 0.00 176.83 176.45 2kdx h ALA 49 N 1.77 0.14 -0.32 6.23 0.00 -0.55 -0.80 119.26 125.73 2kdx h ALA 49 Ca 0.08 -0.30 0.07 0.00 0.00 0.00 0.00 54.91 54.76 2kdx h ALA 49 Cb 0.09 -0.03 -0.06 0.00 0.00 0.00 0.00 17.79 17.79 2kdx h ALA 49 CO -0.01 -0.02 -0.09 0.35 0.00 0.00 0.00 179.25 179.48 2kdx h PHE 50 N -0.18 -0.21 -0.36 0.00 3.57 -0.81 -0.53 116.94 118.42 2kdx h PHE 50 Ca 0.01 0.03 -0.04 0.00 3.53 0.00 0.00 57.97 61.50 2kdx h PHE 50 Cb 0.62 0.14 -0.02 0.00 2.79 0.00 0.00 35.95 39.49 2kdx h PHE 50 CO 0.09 -0.16 0.04 0.93 -2.23 0.00 0.00 178.31 176.98 2kdx h GLU 51 N -0.02 0.54 0.02 1.11 4.39 -0.93 -0.44 114.58 119.25 2kdx h GLU 51 Ca 0.16 -0.10 -0.00 0.00 0.34 0.00 0.00 59.36 59.75 2kdx h GLU 51 Cb 0.26 -0.09 0.00 0.00 -0.10 0.00 0.00 28.75 28.82 2kdx h GLU 51 CO -0.34 0.54 -0.01 1.15 -1.16 0.00 0.00 179.01 179.19 2kdx h THR 52 N 0.53 1.14 0.00 1.13 2.02 -0.77 -3.27 112.91 113.69 2kdx h THR 52 Ca 0.12 -0.50 0.00 0.00 0.77 0.00 0.00 66.41 66.80 2kdx h THR 52 Cb 0.28 1.48 0.00 0.00 -1.74 0.00 0.00 68.15 68.17 2kdx h THR 52 CO 0.00 0.13 0.00 0.49 0.37 0.00 0.00 175.52 176.51 2kdx n PHE 53 N -5.00 0.00 0.07 3.16 3.01 -0.24 -4.28 117.46 114.17 2kdx n PHE 53 Ca -0.08 0.00 0.20 0.00 1.01 0.00 0.00 57.45 58.58 2kdx n PHE 53 Cb 0.13 -0.41 0.74 0.00 -0.01 0.00 0.00 39.48 39.93 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 0.00 0.00 -1.10 -1.08 0.11 -1.14 -1.50 114.38 109.68 2kdx h ARG 54 Ca 0.00 0.00 0.31 0.00 0.10 0.00 0.00 59.98 60.39 2kdx h ARG 54 Cb 0.38 0.00 -0.05 0.00 1.11 0.00 0.00 29.97 31.41 2kdx h ARG 54 CO 0.00 0.00 0.78 0.93 0.10 0.00 0.00 179.97 181.78 2kdx h GLU 55 N 0.00 0.07 0.00 0.08 4.39 -1.84 -1.51 114.58 115.77 2kdx h GLU 55 Ca 0.20 -0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.90 2kdx h GLU 55 Cb 0.95 -0.02 0.00 0.00 -0.10 0.00 0.00 28.75 29.58 2kdx h GLU 55 CO -0.00 0.05 0.00 1.49 -1.16 0.00 0.00 179.01 179.38 2kdx h GLU 56 N 0.07 0.00 -3.05 2.33 4.57 -1.62 -3.43 114.58 113.46 2kdx h GLU 56 Ca 0.54 0.00 -0.18 0.00 -1.18 0.00 0.00 59.36 58.55 2kdx h GLU 56 Cb 2.01 0.00 -0.28 0.00 -0.16 0.00 0.00 28.75 30.32 2kdx h GLU 56 CO -0.06 0.00 -0.44 0.45 -1.18 0.00 0.00 179.01 177.78 2kdx s SER 57 N -4.86 -0.28 0.55 1.04 0.15 -0.57 -5.04 113.70 104.69 2kdx s SER 57 Ca -0.04 0.54 0.21 0.00 0.70 0.00 0.00 55.95 57.36 2kdx s SER 57 Cb 0.11 0.48 1.46 0.00 -1.71 0.00 0.00 66.02 66.36 2kdx s SER 57 CO 0.36 -0.13 2.16 -0.07 1.20 0.00 0.00 173.24 176.76 2kdx h LEU 58 N 6.50 0.00 -0.74 3.45 -0.00 -1.83 -2.06 115.31 120.63 2kdx h LEU 58 Ca -0.33 0.00 -0.13 0.00 -0.00 0.00 0.00 57.88 57.42 2kdx h LEU 58 Cb 1.17 0.00 -0.01 0.00 -0.00 0.00 0.00 40.66 41.82 2kdx h LEU 58 CO 0.36 0.00 -0.49 -0.37 -0.00 0.00 0.00 178.44 177.94 2kdx h VAL 59 N 0.00 1.33 0.00 1.22 -1.51 -1.91 -3.28 116.25 112.10 2kdx h VAL 59 Ca 0.03 -1.71 -0.11 0.00 -1.23 0.00 0.00 66.70 63.68 2kdx h VAL 59 Cb 0.12 1.76 -0.02 0.00 -2.13 0.00 0.00 31.29 31.03 2kdx h VAL 59 CO -0.00 0.52 -0.59 0.00 -1.23 0.00 0.00 177.57 176.26 2kdx n LYS 61 N -3.18 0.02 -3.05 0.00 5.02 -1.14 -3.52 118.16 112.32 2kdx n LYS 61 Ca 0.01 0.29 -0.18 0.00 -2.02 0.00 0.00 58.31 56.41 2kdx n LYS 61 Cb 0.74 -1.54 -0.02 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 -1.59 1.44 -4.09 4.39 2.03 -1.25 -5.10 116.55 112.39 2kdx n ASP 62 Ca 0.03 -3.05 -0.10 0.00 0.52 0.00 0.00 54.79 52.19 2kdx n ASP 62 Cb 0.17 -0.59 -0.07 0.00 -0.72 0.00 0.00 41.12 39.90 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 -2.70 0.43 0.00 -1.67 0.00 -1.23 -4.55 121.76 112.04 2kdx s ALA 63 Ca 0.39 -1.27 0.05 0.00 0.00 0.00 0.00 51.96 51.13 2kdx s ALA 63 Cb 0.36 1.22 -0.01 0.00 0.00 0.00 0.00 23.12 24.69 2kdx s ALA 63 CO -0.07 -0.73 -0.16 0.42 0.00 0.00 0.00 175.76 175.22 2kdx s ILE 64 N -4.08 1.25 -0.33 0.00 1.09 -1.15 -5.03 121.20 112.95 2kdx s ILE 64 Ca 0.30 -0.76 -0.03 0.00 -1.10 0.00 0.00 60.65 59.06 2kdx s ILE 64 Cb 0.03 -1.06 0.06 0.00 -1.06 0.00 0.00 42.46 40.43 2kdx s ILE 64 CO 0.11 0.28 0.07 -0.22 -0.10 0.00 0.00 174.94 175.08 2kdx s LEU 65 N -0.55 4.30 0.07 2.97 2.96 -1.26 -1.04 118.68 126.13 2kdx s LEU 65 Ca 0.05 -1.41 -0.10 0.00 -0.22 0.00 0.00 54.13 52.46 2kdx s LEU 65 Cb -0.07 -1.77 -0.06 0.00 0.50 0.00 0.00 46.19 44.79 2kdx s LEU 65 CO -0.00 -0.34 0.39 -1.81 -1.32 0.00 0.00 176.35 173.27 2kdx s ASP 66 N 1.42 6.63 0.01 3.68 1.11 0.12 -4.99 116.67 124.64 2kdx s ASP 66 Ca -0.01 0.77 -0.00 0.00 0.18 0.00 0.00 52.55 53.48 2kdx s ASP 66 Cb -0.20 -2.17 -0.04 0.00 1.07 0.00 0.00 42.92 41.58 2kdx s ASP 66 CO -0.01 0.18 0.10 -0.63 1.18 0.00 0.00 175.17 175.99 2kdx s ILE 67 N -1.39 4.83 -0.13 0.77 -1.09 -1.26 -1.08 121.20 121.85 2kdx s ILE 67 Ca 0.33 -0.42 0.00 0.00 -2.23 0.00 0.00 60.65 58.33 2kdx s ILE 67 Cb -0.14 -3.24 0.02 0.00 -1.58 0.00 0.00 42.46 37.53 2kdx s ILE 67 CO 0.18 0.31 -0.12 -0.69 -1.23 0.00 0.00 174.94 173.39 2kdx s VAL 68 N -1.25 1.36 -0.64 2.92 1.01 0.31 -4.92 120.40 119.20 2kdx s VAL 68 Ca 0.25 -0.51 -0.27 0.00 0.00 0.00 0.00 61.98 61.45 2kdx s VAL 68 Cb -0.12 -1.30 -0.01 0.00 0.00 0.00 0.00 36.38 34.95 2kdx s VAL 68 CO 0.16 0.42 1.78 -1.81 0.00 0.00 0.00 175.10 175.66 2kdx s ASP 69 N 1.47 5.39 0.21 3.32 1.01 -1.26 -1.19 116.67 125.62 2kdx s ASP 69 Ca 0.03 0.20 -0.30 0.00 0.71 0.00 0.00 52.55 53.19 2kdx s ASP 69 Cb -0.13 -2.53 -0.08 0.00 1.01 0.00 0.00 42.92 41.18 2kdx s ASP 69 CO -0.08 -2.31 1.15 -1.61 0.21 0.00 0.00 175.17 172.52 2kdx s GLU 70 N 6.86 4.56 0.98 8.23 0.41 0.04 -4.86 118.70 134.92 2kdx s GLU 70 Ca 0.63 1.82 -0.11 0.00 -0.41 0.00 0.00 54.97 56.90 2kdx s GLU 70 Cb -0.12 -3.23 0.18 0.00 -1.78 0.00 0.00 34.13 29.18 2kdx s GLU 70 CO 0.19 0.04 1.09 0.15 -0.49 0.00 0.00 175.26 176.24 2kdx s LYS 71 N -0.65 0.54 0.24 1.61 -0.14 -1.26 -0.86 119.74 119.22 2kdx s LYS 71 Ca 0.49 1.12 0.10 0.00 -1.36 0.00 0.00 55.97 56.33 2kdx s LYS 71 Cb -0.32 -1.70 -0.05 0.00 -1.68 0.00 0.00 37.83 34.08 2kdx s LYS 71 CO 0.38 -2.82 -0.17 0.14 -0.76 0.00 0.00 175.35 172.12 2kdx s VAL 72 N -2.68 2.11 -0.18 3.17 -7.23 -1.26 -3.97 120.40 110.36 2kdx s VAL 72 Ca 0.66 -2.31 -0.16 0.00 -1.81 0.00 0.00 61.98 58.36 2kdx s VAL 72 Cb -0.22 -2.17 0.05 0.00 0.56 0.00 0.00 36.38 34.60 2kdx s VAL 72 CO 0.60 -0.50 0.47 -0.70 -0.31 0.00 0.00 175.10 174.66 2kdx s GLU 73 N -3.57 0.55 -0.43 4.82 2.12 -1.08 -4.82 118.70 116.29 2kdx s GLU 73 Ca 0.26 0.67 -0.06 0.00 0.36 0.00 0.00 54.97 56.20 2kdx s GLU 73 Cb -0.03 0.26 0.11 0.00 0.26 0.00 0.00 34.13 34.73 2kdx s GLU 73 CO 0.11 -0.07 0.25 -0.51 -0.54 0.00 0.00 175.26 174.50 2kdx s LEU 74 N 0.31 5.34 0.30 2.70 1.43 0.42 -1.21 118.68 127.96 2kdx s LEU 74 Ca -0.00 -1.89 -0.21 0.00 -1.03 0.00 0.00 54.13 50.99 2kdx s LEU 74 Cb -0.04 -1.91 -0.09 0.00 0.03 0.00 0.00 46.19 44.19 2kdx s LEU 74 CO -0.00 -0.58 0.82 -0.70 0.23 0.00 0.00 176.35 176.11 2kdx s GLU 75 N 1.26 4.29 0.34 1.70 2.12 -0.58 -1.34 118.70 126.50 2kdx s GLU 75 Ca 0.06 0.99 -0.16 0.00 0.36 0.00 0.00 54.97 56.22 2kdx s GLU 75 Cb -0.24 -2.68 -0.09 0.00 0.26 0.00 0.00 34.13 31.38 2kdx s GLU 75 CO -0.02 0.26 0.77 0.00 -0.54 0.00 0.00 175.26 175.73 2kdx h LYS 77 N 2.18 -1.22 -1.95 0.00 1.79 -1.93 -3.39 116.57 112.05 2kdx h LYS 77 Ca -0.48 0.08 -0.52 0.00 -2.18 0.00 0.00 60.65 57.56 2kdx h LYS 77 Cb 1.18 0.28 -0.41 0.00 -1.58 0.00 0.00 32.23 31.69 2kdx h LYS 77 CO 0.65 -0.81 -0.96 -3.47 -1.08 0.00 0.00 179.45 173.77 2kdx n ASP 78 N -5.63 2.54 0.00 0.86 2.03 -1.26 -5.05 116.55 110.04 2kdx n ASP 78 Ca -0.16 -3.28 0.00 0.00 0.52 0.00 0.00 54.79 51.87 2kdx n ASP 78 Cb 0.50 -0.57 0.00 0.00 -0.72 0.00 0.00 41.12 40.33 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 -4.07 0.00 3.41 -1.26 -5.07 113.62 106.64 2kdx n SER 80 Ca 0.00 -1.34 -0.13 0.00 -0.26 0.00 0.00 58.87 57.14 2kdx n SER 80 Cb 0.00 -0.07 -0.11 0.00 -0.26 0.00 0.00 64.21 63.77 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 0.67 0.04 7.33 5.65 -1.26 -5.12 115.29 122.60 2kdx s HIS 81 Ca 0.00 -0.52 0.01 0.00 0.25 0.00 0.00 55.06 54.80 2kdx s HIS 81 Cb 0.00 -0.40 -0.03 0.00 -1.18 0.00 0.00 32.58 30.97 2kdx s HIS 81 CO 0.00 -0.09 -0.05 0.14 -0.65 0.00 0.00 174.74 174.09 2kdx s VAL 82 N -1.50 0.33 0.20 0.89 -7.23 -1.26 -3.00 120.40 108.83 2kdx s VAL 82 Ca -0.09 -1.16 0.05 0.00 -1.81 0.00 0.00 61.98 58.97 2kdx s VAL 82 Cb -0.09 -0.65 -0.02 0.00 0.56 0.00 0.00 36.38 36.18 2kdx s VAL 82 CO 0.00 -0.54 0.17 2.22 -0.31 0.00 0.00 175.10 176.64 2kdx n PHE 83 N 1.25 -0.47 -4.76 2.82 1.16 -0.45 -4.98 117.46 112.03 2kdx n PHE 83 Ca -0.21 -1.69 -0.30 0.00 -1.87 0.00 0.00 57.45 53.37 2kdx n PHE 83 Cb 0.56 0.17 -0.14 0.00 -1.61 0.00 0.00 39.48 38.46 2kdx n PHE 83 CO 0.00 0.00 0.00 0.15 -1.87 0.00 0.00 176.76 175.04 2kdx s LYS 84 N -2.82 1.82 -0.25 3.97 1.02 -1.26 -0.43 119.74 121.79 2kdx s LYS 84 Ca 0.24 -1.11 -0.29 0.00 0.02 0.00 0.00 55.97 54.83 2kdx s LYS 84 Cb 0.01 -2.03 -0.03 0.00 -0.52 0.00 0.00 37.83 35.26 2kdx s LYS 84 CO 0.17 0.51 1.89 -1.25 -0.92 0.00 0.00 175.35 175.75 2kdx s PRO 85 N -1.41 3.43 0.27 -1.68 0.04 -1.26 -4.68 135.00 129.70 2kdx s PRO 85 Ca 0.13 1.72 0.00 0.00 0.04 0.00 0.00 61.00 62.89 2kdx s PRO 85 Cb -0.10 -4.21 0.00 0.00 0.04 0.00 0.00 34.50 30.23 2kdx s PRO 85 CO 0.04 -1.75 0.00 -1.71 0.04 0.00 0.00 177.00 173.61 2kdx n ASN 86 N 10.12 -1.03 -4.67 6.66 2.85 -1.26 -5.14 115.26 122.79 2kdx n ASN 86 Ca 0.24 0.47 -0.29 0.00 -0.11 0.00 0.00 54.58 54.89 2kdx n ASN 86 Cb 0.46 1.13 0.17 0.00 1.24 0.00 0.00 39.78 42.77 2kdx n ASN 86 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2kdx s ALA 87 N -2.00 1.04 0.01 5.20 0.00 -1.26 -5.05 121.76 119.69 2kdx s ALA 87 Ca 0.00 -0.13 0.00 0.00 0.00 0.00 0.00 51.96 51.83 2kdx s ALA 87 Cb 0.00 -3.19 0.00 0.00 0.00 0.00 0.00 23.12 19.93 2kdx s ALA 87 CO 0.00 -2.77 0.00 1.47 0.00 0.00 0.00 175.76 174.46 2kdx n LEU 88 N -4.16 0.03 0.27 0.00 -0.00 -1.26 -4.54 117.00 107.33 2kdx n LEU 88 Ca 0.06 0.02 0.14 0.00 -0.00 0.00 0.00 56.01 56.23 2kdx n LEU 88 Cb 0.55 0.00 0.75 0.00 -0.00 0.00 0.00 43.42 44.73 2kdx n LEU 88 CO 0.56 -0.51 0.98 -0.78 -0.00 0.00 0.00 177.39 177.64 2kdx h ASP 89 N 0.00 0.00 0.00 1.45 3.58 -2.05 -2.69 116.42 116.72 2kdx h ASP 89 Ca 0.00 0.00 -0.00 0.00 0.42 0.00 0.00 57.03 57.45 2kdx h ASP 89 Cb 0.00 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 41.04 2kdx h ASP 89 CO 0.00 0.10 -0.15 0.00 -2.88 0.00 0.00 179.24 176.31 2kdx n TYR 90 N -3.47 0.00 0.70 0.28 4.11 -1.26 -4.88 117.16 112.64 2kdx n TYR 90 Ca -0.01 -0.86 0.00 0.00 -0.00 0.00 0.00 57.90 57.03 2kdx n TYR 90 Cb 0.25 -0.14 0.00 0.00 -0.00 0.00 0.00 39.34 39.45 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 -1.13 1.13 3.68 -7.48 0.00 -1.02 -4.85 105.19 95.52 2kdx n GLY 91 Ca 0.13 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.86 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 -0.72 2.34 0.29 1.61 -7.23 -1.26 -4.78 120.40 110.65 2kdx s VAL 92 Ca 0.00 0.11 -0.30 0.00 -1.81 0.00 0.00 61.98 59.98 2kdx s VAL 92 Cb 0.00 -2.54 -0.11 0.00 0.56 0.00 0.00 36.38 34.29 2kdx s VAL 92 CO 0.00 -0.15 1.56 0.00 -0.31 0.00 0.00 175.10 176.21 2kdx h GLU 94 N 4.72 1.30 0.33 0.00 4.39 -1.94 -3.14 114.58 120.24 2kdx h GLU 94 Ca -0.47 -0.09 -0.02 0.00 0.34 0.00 0.00 59.36 59.12 2kdx h GLU 94 Cb 1.22 -0.29 0.00 0.00 -0.10 0.00 0.00 28.75 29.59 2kdx h GLU 94 CO 0.78 0.87 -0.16 0.87 -1.16 0.00 0.00 179.01 180.21 2kdx h LYS 95 N 1.33 -0.43 -4.71 2.33 1.57 -1.98 -3.45 116.57 111.23 2kdx h LYS 95 Ca 0.36 0.03 -0.68 0.00 -1.87 0.00 0.00 60.65 58.49 2kdx h LYS 95 Cb -0.13 0.10 -0.35 0.00 0.08 0.00 0.00 32.23 31.93 2kdx h LYS 95 CO -0.07 -0.28 -0.69 0.00 -0.57 0.00 0.00 179.45 177.84 2kdx n HIS 97 N 4.52 0.22 -3.91 0.00 1.44 -1.24 -3.41 115.22 112.83 2kdx n HIS 97 Ca -0.08 -0.69 -0.08 0.00 -2.01 0.00 0.00 57.72 54.86 2kdx n HIS 97 Cb 0.42 -0.81 -0.08 0.00 0.12 0.00 0.00 29.99 29.65 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 5.71 0.21 -0.20 4.39 0.01 -1.26 -4.94 113.70 117.62 2kdx s SER 98 Ca 0.35 -0.72 0.09 0.00 1.31 0.00 0.00 55.95 56.98 2kdx s SER 98 Cb 0.08 0.30 0.61 0.00 0.21 0.00 0.00 66.02 67.22 2kdx s SER 98 CO 0.15 -0.68 1.48 0.29 0.41 0.00 0.00 173.24 174.89 2kdx n LYS 99 N 0.04 3.69 0.00 12.44 5.02 -1.26 -1.32 118.16 136.77 2kdx n LYS 99 Ca -0.15 -2.38 0.05 0.00 -2.02 0.00 0.00 58.31 53.81 2kdx n LYS 99 Cb 0.62 -2.06 0.26 0.00 -0.02 0.00 0.00 35.03 33.83 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 0.31 0.00 -4.61 4.39 6.94 -1.26 -4.90 115.26 116.13 2kdx n ASN 100 Ca 0.24 0.08 -0.33 0.00 -0.02 0.00 0.00 54.58 54.55 2kdx n ASN 100 Cb 1.03 -0.25 0.13 0.00 -2.36 0.00 0.00 39.78 38.34 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 -1.25 1.06 -4.22 3.53 0.24 -1.26 -4.52 118.33 111.90 2kdx n VAL 101 Ca 0.05 -0.17 -0.17 0.00 -2.04 0.00 0.00 64.34 62.01 2kdx n VAL 101 Cb 0.07 -0.98 -0.11 0.00 -1.47 0.00 0.00 33.84 31.35 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 -2.30 1.23 -0.52 1.34 -0.00 -0.04 -4.98 121.20 115.94 2kdx s ILE 102 Ca 0.68 -1.66 -0.29 0.00 -0.00 0.00 0.00 60.65 59.38 2kdx s ILE 102 Cb -0.26 -1.45 0.03 0.00 -0.00 0.00 0.00 42.46 40.77 2kdx s ILE 102 CO 0.57 -0.43 1.19 -0.63 -0.00 0.00 0.00 174.94 175.64 2kdx s ILE 103 N -2.12 4.09 -1.94 8.37 1.09 -1.26 -1.52 121.20 127.90 2kdx s ILE 103 Ca 0.07 1.05 0.25 0.00 -1.10 0.00 0.00 60.65 60.92 2kdx s ILE 103 Cb -0.05 -4.62 0.19 0.00 -1.06 0.00 0.00 42.46 36.92 2kdx s ILE 103 CO 0.02 -1.13 1.41 1.07 -0.10 0.00 0.00 174.94 176.21 2kdx n THR 104 N 6.81 0.00 -3.65 2.92 5.66 -0.35 -4.71 114.28 120.96 2kdx n THR 104 Ca 0.11 -0.19 -0.06 0.00 -3.05 0.00 0.00 64.05 60.85 2kdx n THR 104 Cb 0.49 0.73 -0.07 0.00 -1.55 0.00 0.00 70.33 69.93 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 -2.44 0.60 -0.47 1.09 2.00 -1.24 -4.95 119.66 114.25 2kdx s GLN 105 Ca 0.23 1.19 0.00 0.00 -2.00 0.00 0.00 55.36 54.78 2kdx s GLN 105 Cb 0.19 0.27 0.00 0.00 0.80 0.00 0.00 33.01 34.27 2kdx s GLN 105 CO 0.52 -0.17 0.00 0.41 -0.50 0.00 0.00 175.29 175.55 2kdx n GLY 106 N 4.61 0.73 0.25 2.59 0.00 -1.25 -2.64 105.19 109.47 2kdx n GLY 106 Ca -0.18 -0.76 -0.01 0.00 0.00 0.00 0.00 46.02 45.06 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 0.46 -5.41 1.61 -1.24 -1.91 -3.32 115.58 105.76 2kdx h ASN 107 Ca -0.09 -0.11 -0.15 0.00 0.71 0.00 0.00 56.30 56.65 2kdx h ASN 107 Cb 0.31 -0.12 -0.11 0.00 0.73 0.00 0.00 38.32 39.13 2kdx h ASN 107 CO 0.13 0.61 -0.32 -1.83 -1.29 0.00 0.00 177.43 174.73 2kdx s GLU 108 N -4.74 1.45 0.88 6.67 -1.05 -1.26 -4.52 118.70 116.13 2kdx s GLU 108 Ca -0.07 -1.46 -0.12 0.00 -0.15 0.00 0.00 54.97 53.18 2kdx s GLU 108 Cb 0.15 0.39 0.12 0.00 -0.44 0.00 0.00 34.13 34.34 2kdx s GLU 108 CO 0.77 -0.56 1.10 0.00 0.95 0.00 0.00 175.26 177.52 2kdx s MET 109 N -3.97 1.40 0.16 -4.83 0.23 -1.26 -4.34 119.30 106.68 2kdx s MET 109 Ca 0.30 0.71 -0.18 0.00 -1.03 0.00 0.00 55.69 55.49 2kdx s MET 109 Cb 0.02 -1.83 0.04 0.00 -1.53 0.00 0.00 34.83 31.53 2kdx s MET 109 CO 0.12 -2.12 0.49 -0.98 -2.03 0.00 0.00 175.02 170.50 2kdx s ARG 110 N -5.02 1.23 0.70 3.16 1.70 -0.08 -5.01 118.95 115.64 2kdx s ARG 110 Ca 0.63 -0.71 -0.13 0.00 -0.47 0.00 0.00 55.73 55.05 2kdx s ARG 110 Cb -0.17 0.52 0.02 0.00 -0.57 0.00 0.00 34.95 34.75 2kdx s ARG 110 CO 0.56 -0.51 1.10 -0.48 -1.08 0.00 0.00 175.30 174.89 2kdx s LEU 111 N -2.82 3.25 0.01 -1.89 2.34 -1.26 -0.49 118.68 117.83 2kdx s LEU 111 Ca 0.05 1.92 -0.01 0.00 0.06 0.00 0.00 54.13 56.15 2kdx s LEU 111 Cb 0.00 -4.54 -0.00 0.00 -0.56 0.00 0.00 46.19 41.09 2kdx s LEU 111 CO -0.09 -1.77 -0.02 0.18 -1.06 0.00 0.00 176.35 173.59 2kdx n LEU 112 N -2.84 0.39 -3.86 1.48 4.77 -0.06 -4.66 117.00 112.22 2kdx n LEU 112 Ca 0.10 0.05 -0.08 0.00 -0.03 0.00 0.00 56.01 56.06 2kdx n LEU 112 Cb 0.52 -0.13 -0.01 0.00 -2.33 0.00 0.00 43.42 41.47 2kdx n LEU 112 CO 0.50 -0.19 0.46 -0.55 -1.33 0.00 0.00 177.39 176.28 2kdx s SER 113 N -5.37 -0.18 0.17 -1.43 0.15 -1.11 -5.03 113.70 100.91 2kdx s SER 113 Ca -0.02 -0.75 0.03 0.00 0.70 0.00 0.00 55.95 55.91 2kdx s SER 113 Cb 0.01 0.75 -0.05 0.00 -1.71 0.00 0.00 66.02 65.02 2kdx s SER 113 CO 0.02 -1.41 -0.02 -0.76 1.20 0.00 0.00 173.24 172.27 2kdx s LEU 114 N -2.96 2.24 0.01 3.45 1.02 -1.26 -0.97 118.68 120.21 2kdx s LEU 114 Ca 0.13 -1.14 -0.02 0.00 0.02 0.00 0.00 54.13 53.12 2kdx s LEU 114 Cb -0.05 -0.16 -0.01 0.00 0.02 0.00 0.00 46.19 45.99 2kdx s LEU 114 CO 0.08 -0.50 0.02 -0.70 0.02 0.00 0.00 176.35 175.26 2kdx s GLU 115 N -3.87 0.29 0.21 1.70 2.56 0.21 -4.99 118.70 114.82 2kdx s GLU 115 Ca 0.23 -0.44 0.06 0.00 0.00 0.00 0.00 54.97 54.82 2kdx s GLU 115 Cb 0.05 0.11 -0.05 0.00 2.00 0.00 0.00 34.13 36.24 2kdx s GLU 115 CO 0.04 -0.05 -0.10 -1.64 -0.56 0.00 0.00 175.26 172.94 2kdx s MET 116 N -1.15 1.32 -0.78 4.30 -1.94 -1.26 -0.71 119.30 119.07 2kdx s MET 116 Ca -0.13 -1.61 -0.18 0.00 -1.71 0.00 0.00 55.69 52.07 2kdx s MET 116 Cb -0.08 -0.96 -0.13 0.00 2.01 0.00 0.00 34.83 35.67 2kdx s MET 116 CO -0.00 0.10 1.95 -0.11 -0.01 0.00 0.00 175.02 176.94 2kdx n LEU 117 N -0.39 4.18 0.09 -0.03 0.00 -1.26 -4.73 117.00 114.87 2kdx n LEU 117 Ca -0.08 -2.84 -0.11 0.00 0.00 0.00 0.00 56.01 52.98 2kdx n LEU 117 Cb 0.61 -1.09 -0.07 0.00 0.00 0.00 0.00 43.42 42.87 2kdx n LEU 117 CO 0.35 -0.16 0.41 0.00 0.00 0.00 0.00 177.39 177.99 2kdx h ALA 118 N 7.54 -0.30 0.00 1.96 0.00 -2.01 -3.52 119.26 122.93 2kdx h ALA 118 Ca 0.43 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 55.13 2kdx h ALA 118 Cb 0.53 0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.44 2kdx h ALA 118 CO 1.82 -0.38 0.00 0.39 0.00 0.00 0.00 179.25 181.08