#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 3.94 0.00 1.61 0.01 -1.26 -5.02 113.70 112.98 2kdx s SER 2 Ca 0.00 1.93 0.00 0.00 1.31 0.00 0.00 55.95 59.19 2kdx s SER 2 Cb 0.00 -2.52 0.00 0.00 0.21 0.00 0.00 66.02 63.71 2kdx s SER 2 CO 0.00 -2.41 0.00 0.80 0.41 0.00 0.00 173.24 172.04 2kdx n MET 3 N -3.77 3.23 -0.28 12.44 0.00 -1.26 -4.88 117.12 122.60 2kdx n MET 3 Ca 0.10 0.00 -0.03 0.00 -0.00 0.00 0.00 57.70 57.77 2kdx n MET 3 Cb 0.53 -0.48 0.09 0.00 0.00 0.00 0.00 33.22 33.36 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 0.92 0.00 1.12 -0.00 -2.02 -1.93 115.15 113.24 2kdx h HIS 4 Ca 0.00 0.02 0.00 0.00 -0.00 0.00 0.00 60.37 60.39 2kdx h HIS 4 Cb 0.00 -0.30 0.00 0.00 -0.00 0.00 0.00 27.41 27.11 2kdx h HIS 4 CO 0.00 0.53 0.00 1.05 -0.00 0.00 0.00 177.93 179.51 2kdx h GLU 5 N 0.95 0.00 -0.02 5.26 9.09 -2.04 -2.93 114.58 124.90 2kdx h GLU 5 Ca 0.31 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.72 2kdx h GLU 5 Cb 0.01 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.11 2kdx h GLU 5 CO -0.11 0.00 -0.28 0.66 0.05 0.00 0.00 179.01 179.33 2kdx n TYR 6 N -2.53 0.00 0.08 2.06 4.01 -0.73 -4.37 117.16 115.67 2kdx n TYR 6 Ca 0.01 0.00 -0.12 0.00 -0.16 0.00 0.00 57.90 57.63 2kdx n TYR 6 Cb 0.22 -0.04 -0.05 0.00 -0.31 0.00 0.00 39.34 39.16 2kdx n TYR 6 CO 0.00 0.00 0.00 0.66 -0.46 0.00 0.00 176.86 177.06 2kdx h SER 7 N 2.41 -0.79 -0.45 7.72 4.64 -1.46 -0.75 113.55 124.87 2kdx h SER 7 Ca 0.00 0.10 0.06 0.00 -0.47 0.00 0.00 61.79 61.48 2kdx h SER 7 Cb 0.69 0.31 -0.05 0.00 -0.31 0.00 0.00 62.40 63.04 2kdx h SER 7 CO 0.00 -0.35 0.15 1.62 -0.87 0.00 0.00 176.83 177.39 2kdx h VAL 8 N -0.44 0.85 0.44 0.95 3.04 -1.80 -1.68 116.25 117.61 2kdx h VAL 8 Ca 0.05 -0.11 -0.02 0.00 -1.01 0.00 0.00 66.70 65.61 2kdx h VAL 8 Cb 0.50 0.50 0.00 0.00 -2.01 0.00 0.00 31.29 30.29 2kdx h VAL 8 CO -0.21 0.06 -0.21 0.58 -1.01 0.00 0.00 177.57 176.78 2kdx h VAL 9 N 0.32 0.55 -0.61 1.51 2.07 -1.72 0.40 116.25 118.78 2kdx h VAL 9 Ca 0.21 -0.24 0.06 0.00 0.82 0.00 0.00 66.70 67.55 2kdx h VAL 9 Cb 0.21 0.67 -0.06 0.00 -1.52 0.00 0.00 31.29 30.59 2kdx h VAL 9 CO -0.22 0.04 0.31 -1.28 0.02 0.00 0.00 177.57 176.45 2kdx h SER 10 N -0.74 0.43 -0.33 0.57 0.87 -1.17 -2.07 113.55 111.12 2kdx h SER 10 Ca -0.06 0.04 -0.01 0.00 -1.23 0.00 0.00 61.79 60.53 2kdx h SER 10 Cb 0.52 -0.04 -0.02 0.00 -0.44 0.00 0.00 62.40 62.43 2kdx h SER 10 CO 0.10 0.28 0.17 -1.28 -0.53 0.00 0.00 176.83 175.57 2kdx h SER 11 N 0.58 0.41 0.24 6.23 0.87 -1.11 -1.16 113.55 119.61 2kdx h SER 11 Ca 0.28 -0.10 0.00 0.00 -1.23 0.00 0.00 61.79 60.75 2kdx h SER 11 Cb 0.21 -0.11 -0.02 0.00 -0.44 0.00 0.00 62.40 62.04 2kdx h SER 11 CO -0.20 0.39 -0.27 0.25 -0.53 0.00 0.00 176.83 176.48 2kdx h LEU 12 N 0.40 -0.72 -0.74 2.23 7.12 -0.73 -1.23 115.31 121.64 2kdx h LEU 12 Ca 0.11 0.07 -0.00 0.00 0.13 0.00 0.00 57.88 58.19 2kdx h LEU 12 Cb 0.08 0.25 -0.04 0.00 -0.53 0.00 0.00 40.66 40.42 2kdx h LEU 12 CO -0.02 -0.38 0.46 0.40 -0.13 0.00 0.00 178.44 178.77 2kdx h ILE 13 N -0.55 1.20 -0.52 4.05 2.04 -1.31 -0.39 117.51 122.03 2kdx h ILE 13 Ca -0.00 -0.43 0.01 0.00 1.00 0.00 0.00 64.86 65.44 2kdx h ILE 13 Cb 0.52 0.16 -0.03 0.00 -0.74 0.00 0.00 36.82 36.73 2kdx h ILE 13 CO -0.07 0.21 0.33 0.00 0.00 0.00 0.00 178.15 178.61 2kdx h ALA 14 N 1.25 0.66 -0.38 1.87 0.00 -1.04 -0.06 119.26 121.56 2kdx h ALA 14 Ca 0.27 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 55.13 2kdx h ALA 14 Cb -0.06 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.53 2kdx h ALA 14 CO -0.05 0.06 0.13 -0.07 0.00 0.00 0.00 179.25 179.32 2kdx h LEU 15 N 0.66 0.54 -0.16 0.00 3.38 -0.93 -1.54 115.31 117.26 2kdx h LEU 15 Ca 0.20 -0.19 0.05 0.00 0.09 0.00 0.00 57.88 58.02 2kdx h LEU 15 Cb -0.03 -0.14 -0.06 0.00 0.09 0.00 0.00 40.66 40.52 2kdx h LEU 15 CO -0.06 0.59 -0.21 0.00 0.09 0.00 0.00 178.44 178.84 2kdx h GLU 17 N -0.25 -0.64 -0.17 0.00 4.81 -0.95 -1.75 114.58 115.63 2kdx h GLU 17 Ca 0.11 0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.38 2kdx h GLU 17 Cb 0.42 0.14 -0.01 0.00 0.63 0.00 0.00 28.75 29.93 2kdx h GLU 17 CO -0.31 -0.42 0.12 1.49 -0.73 0.00 0.00 179.01 179.15 2kdx h GLU 18 N -0.66 0.23 -0.62 1.92 4.81 -1.10 -2.04 114.58 117.12 2kdx h GLU 18 Ca 0.02 -0.01 -0.06 0.00 -0.13 0.00 0.00 59.36 59.18 2kdx h GLU 18 Cb 0.70 -0.05 -0.03 0.00 0.63 0.00 0.00 28.75 30.00 2kdx h GLU 18 CO -0.30 0.15 0.13 0.45 -0.73 0.00 0.00 179.01 178.72 2kdx h HIS 19 N 0.24 1.02 -0.16 0.92 3.86 -1.08 -1.80 115.15 118.14 2kdx h HIS 19 Ca 0.06 -0.11 -0.03 0.00 -1.16 0.00 0.00 60.37 59.13 2kdx h HIS 19 Cb -0.03 -0.29 -0.01 0.00 1.06 0.00 0.00 27.41 28.15 2kdx h HIS 19 CO -0.07 0.85 -0.00 0.00 0.86 0.00 0.00 177.93 179.57 2kdx h ALA 20 N 1.21 0.22 -0.22 2.45 0.00 -1.08 -0.62 119.26 121.23 2kdx h ALA 20 Ca 0.20 -0.20 -0.05 0.00 0.00 0.00 0.00 54.91 54.85 2kdx h ALA 20 Cb 0.35 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 2kdx h ALA 20 CO 0.00 -0.07 -0.08 1.57 0.00 0.00 0.00 179.25 180.66 2kdx h LYS 21 N 0.03 0.34 -0.08 0.00 2.10 -1.36 0.10 116.57 117.70 2kdx h LYS 21 Ca 0.04 -0.08 -0.22 0.00 -2.00 0.00 0.00 60.65 58.39 2kdx h LYS 21 Cb 0.39 -0.05 0.01 0.00 -0.90 0.00 0.00 32.23 31.68 2kdx h LYS 21 CO 0.01 0.44 -0.85 -0.22 -2.00 0.00 0.00 179.45 176.84 2kdx h LYS 22 N 0.33 0.63 0.00 0.07 1.63 -1.17 -2.70 116.57 115.36 2kdx h LYS 22 Ca 0.07 -0.57 0.00 0.00 -0.85 0.00 0.00 60.65 59.30 2kdx h LYS 22 Cb 0.36 0.14 0.00 0.00 -0.60 0.00 0.00 32.23 32.13 2kdx h LYS 22 CO 0.02 1.18 0.00 -1.71 -3.45 0.00 0.00 179.45 175.49 2kdx n ASN 23 N -3.87 0.00 -2.34 4.20 5.15 -0.25 -4.93 115.26 113.22 2kdx n ASN 23 Ca -0.07 -0.64 -0.17 0.00 -0.60 0.00 0.00 54.58 53.10 2kdx n ASN 23 Cb 0.78 -0.12 -0.01 0.00 -0.53 0.00 0.00 39.78 39.90 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 -1.12 -1.87 0.13 1.20 6.02 -0.57 -4.90 117.38 116.26 2kdx n GLN 24 Ca 0.20 0.85 -0.21 0.00 -0.01 0.00 0.00 57.00 57.83 2kdx n GLN 24 Cb 0.16 -5.46 -0.15 0.00 1.02 0.00 0.00 30.24 25.82 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 0.95 -0.04 -0.38 -1.58 0.00 -1.12 -3.48 119.26 113.61 2kdx h ALA 25 Ca -0.40 -0.86 -0.08 0.00 0.00 0.00 0.00 54.91 53.56 2kdx h ALA 25 Cb 1.29 0.10 -0.03 0.00 0.00 0.00 0.00 17.79 19.14 2kdx h ALA 25 CO 0.48 0.82 -0.08 0.72 0.00 0.00 0.00 179.25 181.19 2kdx n HIS 26 N -3.64 -0.09 -3.91 0.00 8.25 -1.23 -4.90 115.22 109.70 2kdx n HIS 26 Ca -0.13 0.00 -0.08 0.00 -0.26 0.00 0.00 57.72 57.25 2kdx n HIS 26 Cb 1.06 -1.84 -0.02 0.00 1.12 0.00 0.00 29.99 30.30 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 -1.87 1.79 0.02 -0.41 -2.85 -1.26 -4.41 119.74 110.75 2kdx s LYS 27 Ca 0.00 -1.18 0.04 0.00 -1.00 0.00 0.00 55.97 53.82 2kdx s LYS 27 Cb 0.00 0.56 -0.02 0.00 -2.06 0.00 0.00 37.83 36.32 2kdx s LYS 27 CO 0.00 -0.80 -0.11 0.42 0.10 0.00 0.00 175.35 174.96 2kdx s ILE 28 N -3.65 0.88 -0.02 3.79 1.01 -1.21 -4.83 121.20 117.17 2kdx s ILE 28 Ca 0.16 -0.76 -0.00 0.00 0.00 0.00 0.00 60.65 60.05 2kdx s ILE 28 Cb -0.04 -0.79 -0.00 0.00 0.01 0.00 0.00 42.46 41.64 2kdx s ILE 28 CO 0.09 0.04 -0.01 -0.08 0.00 0.00 0.00 174.94 174.98 2kdx h GLU 29 N 5.29 0.00 -3.21 2.79 4.57 -1.11 -3.35 114.58 119.57 2kdx h GLU 29 Ca -0.35 0.00 -0.42 0.00 -1.18 0.00 0.00 59.36 57.41 2kdx h GLU 29 Cb 1.18 0.00 -0.40 0.00 -0.16 0.00 0.00 28.75 29.37 2kdx h GLU 29 CO 0.46 0.00 -0.75 1.03 -1.18 0.00 0.00 179.01 178.57 2kdx s ARG 30 N -1.12 0.03 0.17 1.92 0.52 -1.02 -1.91 118.95 117.55 2kdx s ARG 30 Ca -0.01 0.13 -0.31 0.00 -0.52 0.00 0.00 55.73 55.02 2kdx s ARG 30 Cb 0.00 -1.19 -0.10 0.00 0.52 0.00 0.00 34.95 34.19 2kdx s ARG 30 CO 0.01 -0.50 1.49 0.08 0.02 0.00 0.00 175.30 176.41 2kdx s VAL 31 N 2.14 2.80 -0.27 3.52 1.01 -0.41 -0.61 120.40 128.59 2kdx s VAL 31 Ca 0.03 0.60 -0.08 0.00 0.00 0.00 0.00 61.98 62.53 2kdx s VAL 31 Cb -0.14 -3.38 -0.02 0.00 0.00 0.00 0.00 36.38 32.83 2kdx s VAL 31 CO -0.06 0.06 0.10 -0.69 0.00 0.00 0.00 175.10 174.51 2kdx s VAL 32 N 0.86 4.44 -0.04 2.92 1.01 0.38 -0.26 120.40 129.72 2kdx s VAL 32 Ca 0.66 -0.21 0.01 0.00 0.00 0.00 0.00 61.98 62.44 2kdx s VAL 32 Cb -0.42 -3.13 0.02 0.00 0.00 0.00 0.00 36.38 32.86 2kdx s VAL 32 CO 0.34 0.27 -0.04 -0.69 0.00 0.00 0.00 175.10 174.97 2kdx s VAL 33 N 1.62 0.53 -0.08 2.92 1.01 -0.53 -0.88 120.40 124.99 2kdx s VAL 33 Ca 0.06 -0.12 -0.11 0.00 0.00 0.00 0.00 61.98 61.81 2kdx s VAL 33 Cb -0.16 -0.56 -0.05 0.00 0.00 0.00 0.00 36.38 35.62 2kdx s VAL 33 CO 0.05 0.22 0.25 -0.83 0.00 0.00 0.00 175.10 174.79 2kdx s GLY 34 N 0.90 2.28 -0.09 4.51 0.00 0.19 -0.57 107.32 114.53 2kdx s GLY 34 Ca -0.11 -0.47 0.01 0.00 0.00 0.00 0.00 44.72 44.15 2kdx s GLY 34 CO 0.00 -0.09 -0.12 -0.42 0.00 0.00 0.00 173.10 172.47 2kdx s ILE 35 N -0.84 1.24 0.42 0.90 1.01 -0.21 -0.98 121.20 122.73 2kdx s ILE 35 Ca 0.18 -0.49 -0.25 0.00 0.00 0.00 0.00 60.65 60.09 2kdx s ILE 35 Cb -0.14 -1.16 -0.08 0.00 0.01 0.00 0.00 42.46 41.09 2kdx s ILE 35 CO 0.07 0.39 1.24 -0.83 0.00 0.00 0.00 174.94 175.81 2kdx s GLY 36 N 1.05 2.89 0.05 6.18 0.00 -1.26 -1.06 107.32 115.16 2kdx s GLY 36 Ca -0.07 1.11 0.15 0.00 0.00 0.00 0.00 44.72 45.91 2kdx s GLY 36 CO -0.01 1.65 1.46 -1.84 0.00 0.00 0.00 173.10 174.36 2kdx n GLU 37 N -0.04 0.03 -0.07 2.90 0.28 -0.21 -1.47 120.64 122.06 2kdx n GLU 37 Ca 0.05 0.31 0.03 0.00 -0.16 0.00 0.00 57.16 57.39 2kdx n GLU 37 Cb 0.45 -1.57 0.07 0.00 1.43 0.00 0.00 31.44 31.82 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 -1.64 2.49 0.12 3.44 5.12 -1.26 -4.75 116.66 120.17 2kdx n ARG 38 Ca 0.03 -1.63 0.11 0.00 -1.93 0.00 0.00 57.85 54.43 2kdx n ARG 38 Cb 0.16 -1.12 0.47 0.00 -1.16 0.00 0.00 32.46 30.80 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 0.02 0.54 0.00 0.55 7.64 -0.54 -4.91 113.62 116.93 2kdx n SER 39 Ca 0.05 0.66 0.00 0.00 1.01 0.00 0.00 58.87 60.59 2kdx n SER 39 Cb 0.30 -0.76 0.00 0.00 -1.01 0.00 0.00 64.21 62.74 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 -1.73 0.00 -2.21 -0.43 0.00 -1.26 -4.92 120.51 109.96 2kdx n ALA 40 Ca 0.02 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 53.04 2kdx n ALA 40 Cb 0.18 -0.65 -0.03 0.00 0.00 0.00 0.00 19.45 18.95 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 -0.36 4.45 -0.27 0.00 -1.94 -1.26 -4.99 119.30 114.93 2kdx s MET 41 Ca 0.00 1.85 -0.29 0.00 -1.71 0.00 0.00 55.69 55.55 2kdx s MET 41 Cb 0.00 -3.28 -0.03 0.00 2.01 0.00 0.00 34.83 33.53 2kdx s MET 41 CO 0.00 -0.19 1.85 -0.51 -0.01 0.00 0.00 175.02 176.17 2kdx s ASP 42 N 0.59 5.93 0.30 3.03 1.01 -1.26 -4.90 116.67 121.36 2kdx s ASP 42 Ca 0.56 1.55 0.03 0.00 0.71 0.00 0.00 52.55 55.41 2kdx s ASP 42 Cb -0.32 -2.52 0.63 0.00 1.01 0.00 0.00 42.92 41.72 2kdx s ASP 42 CO 0.33 -1.64 1.82 0.07 0.21 0.00 0.00 175.17 175.97 2kdx h LYS 43 N 12.77 0.88 -0.78 8.23 2.10 -2.00 -1.11 116.57 136.65 2kdx h LYS 43 Ca -0.36 -0.05 -0.03 0.00 -2.00 0.00 0.00 60.65 58.21 2kdx h LYS 43 Cb 1.18 -0.20 -0.04 0.00 -0.90 0.00 0.00 32.23 32.28 2kdx h LYS 43 CO 1.01 0.58 0.39 1.03 -2.00 0.00 0.00 179.45 180.46 2kdx h SER 44 N 0.91 1.01 -0.47 7.07 0.87 -2.00 -2.67 113.55 118.27 2kdx h SER 44 Ca 0.51 -0.13 -0.05 0.00 -1.23 0.00 0.00 61.79 60.90 2kdx h SER 44 Cb 0.62 -0.26 -0.02 0.00 -0.44 0.00 0.00 62.40 62.30 2kdx h SER 44 CO -0.29 0.85 0.11 0.25 -0.53 0.00 0.00 176.83 177.23 2kdx h LEU 45 N 1.10 0.72 0.22 2.23 5.85 -1.63 -1.27 115.31 122.53 2kdx h LEU 45 Ca 0.27 -0.23 -0.00 0.00 0.84 0.00 0.00 57.88 58.76 2kdx h LEU 45 Cb 0.10 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 40.93 2kdx h LEU 45 CO -0.04 0.76 -0.17 0.15 -0.34 0.00 0.00 178.44 178.81 2kdx h PHE 46 N 0.64 -0.45 -0.50 1.25 3.57 -1.25 0.32 116.94 120.53 2kdx h PHE 46 Ca 0.15 -0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.64 2kdx h PHE 46 Cb 0.33 0.17 -0.02 0.00 2.79 0.00 0.00 35.95 39.21 2kdx h PHE 46 CO 0.02 -0.26 0.28 -0.24 -2.23 0.00 0.00 178.31 175.88 2kdx h VAL 47 N -0.40 1.17 -0.26 1.41 3.04 -1.49 -1.37 116.25 118.34 2kdx h VAL 47 Ca -0.01 -0.40 -0.02 0.00 -1.01 0.00 0.00 66.70 65.25 2kdx h VAL 47 Cb 0.36 0.53 -0.01 0.00 -2.01 0.00 0.00 31.29 30.15 2kdx h VAL 47 CO -0.01 0.17 0.06 -1.28 -1.01 0.00 0.00 177.57 175.51 2kdx h SER 48 N 0.66 0.33 -0.22 3.17 0.87 -1.10 -0.40 113.55 116.86 2kdx h SER 48 Ca 0.18 -0.04 -0.09 0.00 -1.23 0.00 0.00 61.79 60.61 2kdx h SER 48 Cb 0.03 -0.08 -0.00 0.00 -0.44 0.00 0.00 62.40 61.90 2kdx h SER 48 CO -0.03 0.34 -0.22 0.00 -0.53 0.00 0.00 176.83 176.39 2kdx h ALA 49 N 1.71 0.33 -0.37 6.23 0.00 -0.52 -0.44 119.26 126.20 2kdx h ALA 49 Ca 0.09 -0.37 0.08 0.00 0.00 0.00 0.00 54.91 54.71 2kdx h ALA 49 Cb 0.15 -0.07 -0.08 0.00 0.00 0.00 0.00 17.79 17.79 2kdx h ALA 49 CO -0.00 0.28 -0.13 0.35 0.00 0.00 0.00 179.25 179.75 2kdx h PHE 50 N 0.24 -0.31 0.00 0.00 3.57 -0.69 -2.29 116.94 117.45 2kdx h PHE 50 Ca 0.04 0.04 0.00 0.00 3.53 0.00 0.00 57.97 61.57 2kdx h PHE 50 Cb 0.78 0.20 0.00 0.00 2.79 0.00 0.00 35.95 39.71 2kdx h PHE 50 CO 0.08 -0.21 0.00 1.05 -2.23 0.00 0.00 178.31 177.00 2kdx h GLU 51 N -0.06 0.00 0.40 1.11 4.11 -1.01 -2.18 114.58 116.95 2kdx h GLU 51 Ca 0.18 0.00 -0.02 0.00 0.07 0.00 0.00 59.36 59.59 2kdx h GLU 51 Cb 0.34 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.59 2kdx h GLU 51 CO -0.41 0.00 -0.19 1.15 0.07 0.00 0.00 179.01 179.63 2kdx h THR 52 N 0.00 0.59 -0.21 -1.06 2.02 -0.78 -3.32 112.91 110.15 2kdx h THR 52 Ca 0.00 -0.35 0.00 0.00 0.77 0.00 0.00 66.41 66.83 2kdx h THR 52 Cb 0.69 0.76 0.00 0.00 -1.74 0.00 0.00 68.15 67.86 2kdx h THR 52 CO 0.00 0.06 0.00 0.49 0.37 0.00 0.00 175.52 176.44 2kdx n PHE 53 N -5.24 0.28 -0.21 3.16 3.72 -0.89 -4.28 117.46 114.00 2kdx n PHE 53 Ca -0.11 -0.14 0.29 0.00 -0.05 0.00 0.00 57.45 57.45 2kdx n PHE 53 Cb 0.27 0.00 0.71 0.00 -0.94 0.00 0.00 39.48 39.53 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 1.36 0.03 0.00 -1.08 0.11 -1.49 -2.36 114.38 110.95 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 0.31 -0.01 0.00 0.00 1.11 0.00 0.00 29.97 31.38 2kdx h ARG 54 CO 0.00 0.02 0.17 0.93 0.10 0.00 0.00 179.97 181.19 2kdx h GLU 55 N 0.03 0.00 0.00 0.08 5.08 -1.86 -1.38 114.58 116.53 2kdx h GLU 55 Ca 0.46 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.78 2kdx h GLU 55 Cb 1.77 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 31.02 2kdx h GLU 55 CO -0.02 0.00 -0.17 1.49 -1.00 0.00 0.00 179.01 179.31 2kdx h GLU 56 N 0.00 0.00 -2.48 2.33 4.57 -1.79 -3.45 114.58 113.76 2kdx h GLU 56 Ca 0.00 0.00 -0.08 0.00 -1.18 0.00 0.00 59.36 58.10 2kdx h GLU 56 Cb 0.34 0.00 -0.25 0.00 -0.16 0.00 0.00 28.75 28.68 2kdx h GLU 56 CO 0.00 0.17 -0.21 -1.12 -1.18 0.00 0.00 179.01 176.67 2kdx s SER 57 N -6.59 -0.63 0.50 1.04 0.01 -0.52 -5.04 113.70 102.47 2kdx s SER 57 Ca -0.03 1.05 0.18 0.00 1.31 0.00 0.00 55.95 58.46 2kdx s SER 57 Cb 0.14 0.94 1.23 0.00 0.21 0.00 0.00 66.02 68.54 2kdx s SER 57 CO 0.65 -0.20 2.06 -0.07 0.41 0.00 0.00 173.24 176.08 2kdx h LEU 58 N 7.01 0.11 -1.67 2.44 4.07 -1.88 -0.99 115.31 124.41 2kdx h LEU 58 Ca -0.35 0.00 -0.04 0.00 0.08 0.00 0.00 57.88 57.57 2kdx h LEU 58 Cb 1.19 -0.02 -0.01 0.00 1.08 0.00 0.00 40.66 42.91 2kdx h LEU 58 CO 0.26 0.07 -0.19 -0.37 -1.08 0.00 0.00 178.44 177.12 2kdx h VAL 59 N 0.12 0.88 0.08 1.22 -1.51 -1.92 -3.08 116.25 112.04 2kdx h VAL 59 Ca 0.14 -0.73 -0.32 0.00 -1.23 0.00 0.00 66.70 64.56 2kdx h VAL 59 Cb 0.42 1.43 -0.03 0.00 -2.13 0.00 0.00 31.29 30.98 2kdx h VAL 59 CO -0.02 0.19 -1.75 0.00 -1.23 0.00 0.00 177.57 174.76 2kdx h LYS 61 N 0.04 0.00 -0.03 0.00 1.57 -1.35 -2.70 116.57 114.11 2kdx h LYS 61 Ca -0.32 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.46 2kdx h LYS 61 Cb 2.02 0.00 0.00 0.00 0.08 0.00 0.00 32.23 34.33 2kdx h LYS 61 CO 0.11 0.00 0.00 -0.25 -0.57 0.00 0.00 179.45 178.74 2kdx n ASP 62 N -3.86 1.67 -4.93 0.86 8.00 -1.24 -5.06 116.55 111.99 2kdx n ASP 62 Ca 0.02 -1.36 -0.22 0.00 0.71 0.00 0.00 54.79 53.94 2kdx n ASP 62 Cb 0.35 -0.01 0.05 0.00 -0.02 0.00 0.00 41.12 41.49 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 -0.61 3.70 0.22 2.24 0.00 -1.02 -4.90 121.76 121.39 2kdx s ALA 63 Ca 0.09 -1.27 0.09 0.00 0.00 0.00 0.00 51.96 50.86 2kdx s ALA 63 Cb 0.06 -2.19 -0.05 0.00 0.00 0.00 0.00 23.12 20.94 2kdx s ALA 63 CO 0.09 -0.96 -0.17 0.42 0.00 0.00 0.00 175.76 175.14 2kdx s ILE 64 N -2.92 2.00 -0.33 0.00 1.01 -0.80 -5.03 121.20 115.13 2kdx s ILE 64 Ca 0.59 -2.20 0.03 0.00 0.00 0.00 0.00 60.65 59.07 2kdx s ILE 64 Cb -0.10 -2.08 0.09 0.00 0.01 0.00 0.00 42.46 40.38 2kdx s ILE 64 CO 0.40 -0.46 0.03 -0.22 0.00 0.00 0.00 174.94 174.70 2kdx s LEU 65 N -3.21 4.54 -0.75 2.97 0.20 -1.26 -1.28 118.68 119.89 2kdx s LEU 65 Ca 0.23 -1.98 -0.24 0.00 0.69 0.00 0.00 54.13 52.82 2kdx s LEU 65 Cb -0.03 -1.63 0.05 0.00 -0.43 0.00 0.00 46.19 44.15 2kdx s LEU 65 CO 0.09 -0.35 1.17 -0.62 -0.29 0.00 0.00 176.35 176.34 2kdx s ASP 66 N 1.02 6.22 0.11 3.68 -1.08 0.64 -4.98 116.67 122.28 2kdx s ASP 66 Ca 0.07 -0.84 -0.30 0.00 -0.52 0.00 0.00 52.55 50.96 2kdx s ASP 66 Cb -0.20 -2.50 -0.06 0.00 -1.46 0.00 0.00 42.92 38.71 2kdx s ASP 66 CO -0.07 -1.61 0.95 -0.63 0.52 0.00 0.00 175.17 174.32 2kdx s ILE 67 N 4.86 4.51 -0.08 4.11 1.01 -1.26 -1.45 121.20 132.89 2kdx s ILE 67 Ca 0.31 2.04 0.05 0.00 0.00 0.00 0.00 60.65 63.05 2kdx s ILE 67 Cb -0.10 -4.31 -0.01 0.00 0.01 0.00 0.00 42.46 38.05 2kdx s ILE 67 CO 0.09 0.32 -0.24 -0.69 0.00 0.00 0.00 174.94 174.43 2kdx s VAL 68 N -0.04 2.14 -0.39 2.92 1.01 0.27 -4.95 120.40 121.35 2kdx s VAL 68 Ca 0.46 -1.01 -0.29 0.00 0.00 0.00 0.00 61.98 61.14 2kdx s VAL 68 Cb -0.23 -1.80 0.01 0.00 0.00 0.00 0.00 36.38 34.35 2kdx s VAL 68 CO 0.29 0.56 1.44 -0.62 0.00 0.00 0.00 175.10 176.77 2kdx s ASP 69 N 0.11 6.33 -0.16 3.32 2.15 -1.26 -1.05 116.67 126.11 2kdx s ASP 69 Ca -0.11 0.91 -0.11 0.00 0.43 0.00 0.00 52.55 53.66 2kdx s ASP 69 Cb -0.16 -2.54 -0.05 0.00 -0.30 0.00 0.00 42.92 39.87 2kdx s ASP 69 CO 0.06 -1.42 0.22 -1.61 -0.17 0.00 0.00 175.17 172.25 2kdx s GLU 70 N 4.93 4.09 0.79 4.34 0.41 -0.22 -4.92 118.70 128.12 2kdx s GLU 70 Ca 0.63 -0.04 -0.12 0.00 -0.41 0.00 0.00 54.97 55.03 2kdx s GLU 70 Cb -0.15 -3.38 0.07 0.00 -1.78 0.00 0.00 34.13 28.89 2kdx s GLU 70 CO 0.32 0.37 1.16 0.15 -0.49 0.00 0.00 175.26 176.77 2kdx s LYS 71 N 0.12 2.11 -0.04 1.61 -0.14 -1.26 -1.04 119.74 121.10 2kdx s LYS 71 Ca 0.14 0.19 0.06 0.00 -1.36 0.00 0.00 55.97 55.00 2kdx s LYS 71 Cb -0.12 -1.96 -0.01 0.00 -1.68 0.00 0.00 37.83 34.05 2kdx s LYS 71 CO 0.02 -1.51 -0.24 0.08 -0.76 0.00 0.00 175.35 172.95 2kdx s VAL 72 N -3.52 1.90 -0.03 3.17 1.01 -1.26 -3.85 120.40 117.82 2kdx s VAL 72 Ca 0.61 -1.00 0.00 0.00 0.00 0.00 0.00 61.98 61.59 2kdx s VAL 72 Cb -0.11 -1.60 0.03 0.00 0.00 0.00 0.00 36.38 34.70 2kdx s VAL 72 CO 0.50 0.53 0.00 -0.70 0.00 0.00 0.00 175.10 175.44 2kdx s GLU 73 N -0.32 0.27 -0.43 2.72 2.12 -0.61 -4.47 118.70 117.98 2kdx s GLU 73 Ca 0.02 0.09 -0.09 0.00 0.36 0.00 0.00 54.97 55.35 2kdx s GLU 73 Cb -0.11 -0.48 0.08 0.00 0.26 0.00 0.00 34.13 33.88 2kdx s GLU 73 CO 0.01 -0.15 0.28 -0.51 -0.54 0.00 0.00 175.26 174.36 2kdx s LEU 74 N 1.08 5.26 0.42 2.70 1.43 0.35 -1.35 118.68 128.57 2kdx s LEU 74 Ca -0.09 -1.56 -0.21 0.00 -1.03 0.00 0.00 54.13 51.24 2kdx s LEU 74 Cb -0.13 -2.00 -0.11 0.00 0.03 0.00 0.00 46.19 43.98 2kdx s LEU 74 CO -0.02 -0.57 0.94 -1.83 0.23 0.00 0.00 176.35 175.10 2kdx s GLU 75 N 1.43 4.23 0.45 1.70 -1.05 -0.70 -1.55 118.70 123.20 2kdx s GLU 75 Ca 0.03 1.10 -0.20 0.00 -0.15 0.00 0.00 54.97 55.76 2kdx s GLU 75 Cb -0.24 -2.20 -0.10 0.00 -0.44 0.00 0.00 34.13 31.15 2kdx s GLU 75 CO 0.02 -0.02 0.97 0.00 0.95 0.00 0.00 175.26 177.18 2kdx h LYS 77 N 1.69 -1.25 -2.02 0.00 1.79 -1.93 -3.39 116.57 111.46 2kdx h LYS 77 Ca -0.49 0.08 -0.52 0.00 -2.18 0.00 0.00 60.65 57.55 2kdx h LYS 77 Cb 1.19 0.28 -0.41 0.00 -1.58 0.00 0.00 32.23 31.71 2kdx h LYS 77 CO 0.61 -0.83 -0.96 -3.47 -1.08 0.00 0.00 179.45 173.72 2kdx n ASP 78 N -5.66 2.48 0.00 0.86 2.03 -1.26 -5.05 116.55 109.95 2kdx n ASP 78 Ca -0.16 -3.29 0.00 0.00 0.52 0.00 0.00 54.79 51.86 2kdx n ASP 78 Cb 0.52 -0.58 0.00 0.00 -0.72 0.00 0.00 41.12 40.34 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 -4.15 0.00 3.41 -1.26 -5.05 113.62 106.57 2kdx n SER 80 Ca 0.00 -1.40 -0.16 0.00 -0.26 0.00 0.00 58.87 57.05 2kdx n SER 80 Cb 0.00 -0.08 -0.11 0.00 -0.26 0.00 0.00 64.21 63.76 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 1.05 0.03 7.33 5.65 -1.26 -5.10 115.29 122.98 2kdx s HIS 81 Ca 0.00 -0.55 0.00 0.00 0.25 0.00 0.00 55.06 54.76 2kdx s HIS 81 Cb 0.00 -0.59 -0.02 0.00 -1.18 0.00 0.00 32.58 30.79 2kdx s HIS 81 CO 0.00 0.01 -0.04 0.14 -0.65 0.00 0.00 174.74 174.20 2kdx s VAL 82 N -1.82 0.21 0.32 0.89 -7.23 -1.26 -2.77 120.40 108.74 2kdx s VAL 82 Ca -0.00 -1.03 0.02 0.00 -1.81 0.00 0.00 61.98 59.16 2kdx s VAL 82 Cb -0.07 -0.45 -0.02 0.00 0.56 0.00 0.00 36.38 36.41 2kdx s VAL 82 CO 0.01 -0.52 0.36 0.72 -0.31 0.00 0.00 175.10 175.36 2kdx s PHE 83 N -1.67 1.38 -0.02 2.82 -0.12 -0.60 -4.96 117.98 114.81 2kdx s PHE 83 Ca -0.13 -1.46 -0.08 0.00 -0.05 0.00 0.00 56.93 55.21 2kdx s PHE 83 Cb -0.08 -0.41 -0.05 0.00 -0.63 0.00 0.00 43.02 41.85 2kdx s PHE 83 CO -0.01 -0.98 0.27 -1.59 -0.05 0.00 0.00 175.22 172.86 2kdx s LYS 84 N -3.33 3.61 0.23 1.99 -2.85 -1.26 -0.50 119.74 117.63 2kdx s LYS 84 Ca 0.36 0.01 -0.31 0.00 -1.00 0.00 0.00 55.97 55.03 2kdx s LYS 84 Cb 0.01 -3.12 -0.11 0.00 -2.06 0.00 0.00 37.83 32.55 2kdx s LYS 84 CO 0.23 0.68 1.55 -1.25 0.10 0.00 0.00 175.35 176.66 2kdx s PRO 85 N -1.48 4.20 0.11 1.78 0.04 -1.26 -4.96 135.00 133.44 2kdx s PRO 85 Ca 0.24 2.42 0.01 0.00 0.04 0.00 0.00 61.00 63.72 2kdx s PRO 85 Cb -0.14 -3.10 -0.01 0.00 0.04 0.00 0.00 34.50 31.30 2kdx s PRO 85 CO 0.13 -0.57 0.05 0.09 0.04 0.00 0.00 177.00 176.74 2kdx n ASN 86 N 3.04 0.73 -4.74 6.66 5.03 -1.26 -5.15 115.26 119.58 2kdx n ASN 86 Ca 0.11 -1.63 -0.41 0.00 0.87 0.00 0.00 54.58 53.51 2kdx n ASN 86 Cb 0.38 0.34 0.00 0.00 -1.02 0.00 0.00 39.78 39.49 2kdx n ASN 86 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2kdx n ALA 87 N -2.41 1.79 0.03 5.41 0.00 -1.26 -4.83 120.51 119.24 2kdx n ALA 87 Ca -0.04 0.31 0.09 0.00 0.00 0.00 0.00 53.44 53.80 2kdx n ALA 87 Cb 0.18 -2.34 0.53 0.00 0.00 0.00 0.00 19.45 17.82 2kdx n ALA 87 CO 0.00 0.00 0.00 1.37 0.00 0.00 0.00 177.50 178.87 2kdx h LEU 88 N 2.54 0.27 -1.06 0.00 8.10 -2.01 -1.69 115.31 121.47 2kdx h LEU 88 Ca -0.49 -0.00 0.00 0.00 0.11 0.00 0.00 57.88 57.50 2kdx h LEU 88 Cb 1.27 -0.06 0.00 0.00 -0.44 0.00 0.00 40.66 41.43 2kdx h LEU 88 CO 0.62 0.18 0.00 -0.78 -4.11 0.00 0.00 178.44 174.35 2kdx h ASP 89 N 0.31 0.00 0.00 0.17 3.58 -2.05 -2.80 116.42 115.63 2kdx h ASP 89 Ca 0.17 0.00 -0.00 0.00 0.42 0.00 0.00 57.03 57.62 2kdx h ASP 89 Cb 0.27 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 41.32 2kdx h ASP 89 CO -0.04 0.00 -0.08 -1.22 -2.88 0.00 0.00 179.24 175.02 2kdx n TYR 90 N -2.37 0.00 1.11 0.28 4.01 -0.64 -4.87 117.16 114.68 2kdx n TYR 90 Ca 0.01 -0.88 0.11 0.00 -0.16 0.00 0.00 57.90 56.98 2kdx n TYR 90 Cb 0.18 -0.14 0.57 0.00 -0.31 0.00 0.00 39.34 39.65 2kdx n TYR 90 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2kdx n GLY 91 N -1.23 -0.92 3.73 2.72 0.00 -1.06 -4.88 105.19 103.54 2kdx n GLY 91 Ca 0.14 -0.11 -0.35 0.00 0.00 0.00 0.00 46.02 45.70 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 -2.43 2.34 0.43 1.61 -7.23 -1.26 -4.41 120.40 109.45 2kdx s VAL 92 Ca 0.24 0.18 -0.24 0.00 -1.81 0.00 0.00 61.98 60.34 2kdx s VAL 92 Cb 0.15 -2.83 -0.08 0.00 0.56 0.00 0.00 36.38 34.17 2kdx s VAL 92 CO 0.31 -0.08 1.19 0.00 -0.31 0.00 0.00 175.10 176.22 2kdx h GLU 94 N 2.36 1.02 0.13 0.00 4.39 -1.95 -3.27 114.58 117.26 2kdx h GLU 94 Ca -0.49 -0.28 -0.01 0.00 0.34 0.00 0.00 59.36 58.92 2kdx h GLU 94 Cb 1.24 -0.11 0.00 0.00 -0.10 0.00 0.00 28.75 29.78 2kdx h GLU 94 CO 0.61 0.96 -0.06 0.87 -1.16 0.00 0.00 179.01 180.23 2kdx h LYS 95 N 0.95 -0.17 -5.26 2.33 1.57 -1.98 -3.47 116.57 110.54 2kdx h LYS 95 Ca 0.18 0.01 -0.67 0.00 -1.87 0.00 0.00 60.65 58.30 2kdx h LYS 95 Cb 0.47 0.04 -0.33 0.00 0.08 0.00 0.00 32.23 32.50 2kdx h LYS 95 CO 0.02 0.23 -0.86 0.00 -0.57 0.00 0.00 179.45 178.27 2kdx n HIS 97 N 3.83 2.79 -3.90 0.00 8.25 -1.26 -2.83 115.22 122.10 2kdx n HIS 97 Ca -0.19 -3.05 -0.10 0.00 -0.26 0.00 0.00 57.72 54.12 2kdx n HIS 97 Cb 0.52 -2.49 -0.09 0.00 1.12 0.00 0.00 29.99 29.05 2kdx n HIS 97 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 2kdx s SER 98 N 2.44 0.13 -0.43 0.41 0.15 -1.26 -4.92 113.70 110.21 2kdx s SER 98 Ca 0.62 -0.49 0.04 0.00 0.70 0.00 0.00 55.95 56.82 2kdx s SER 98 Cb 0.17 0.26 0.59 0.00 -1.71 0.00 0.00 66.02 65.32 2kdx s SER 98 CO -0.07 -0.54 1.79 2.29 1.20 0.00 0.00 173.24 177.91 2kdx n LYS 99 N 0.66 2.25 0.00 5.44 2.85 -1.26 -1.04 118.16 127.06 2kdx n LYS 99 Ca -0.19 -3.14 0.06 0.00 -1.05 0.00 0.00 58.31 53.99 2kdx n LYS 99 Cb 0.59 -2.10 0.32 0.00 -0.65 0.00 0.00 35.03 33.18 2kdx n LYS 99 CO 0.00 0.00 0.00 0.27 -0.05 0.00 0.00 177.40 177.62 2kdx n ASN 100 N -1.10 0.00 -4.65 -5.58 6.94 -1.26 -4.92 115.26 104.69 2kdx n ASN 100 Ca 0.53 -0.24 -0.33 0.00 -0.02 0.00 0.00 54.58 54.52 2kdx n ASN 100 Cb 1.35 -0.06 0.14 0.00 -2.36 0.00 0.00 39.78 38.84 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 -1.06 1.11 -4.19 3.53 0.24 -1.26 -4.52 118.33 112.17 2kdx n VAL 101 Ca 0.08 -0.14 -0.17 0.00 -2.04 0.00 0.00 64.34 62.06 2kdx n VAL 101 Cb 0.05 -1.05 -0.11 0.00 -1.47 0.00 0.00 33.84 31.25 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 -2.32 1.13 -0.35 1.34 -0.00 -0.30 -4.97 121.20 115.72 2kdx s ILE 102 Ca 0.69 -1.49 -0.29 0.00 -0.00 0.00 0.00 60.65 59.57 2kdx s ILE 102 Cb -0.26 -1.25 -0.00 0.00 -0.00 0.00 0.00 42.46 40.94 2kdx s ILE 102 CO 0.55 -0.35 1.49 -0.63 -0.00 0.00 0.00 174.94 176.00 2kdx s ILE 103 N -1.76 3.85 -1.50 8.37 1.09 -1.26 -1.72 121.20 128.26 2kdx s ILE 103 Ca 0.02 0.90 0.18 0.00 -1.10 0.00 0.00 60.65 60.65 2kdx s ILE 103 Cb -0.07 -4.03 -0.04 0.00 -1.06 0.00 0.00 42.46 37.26 2kdx s ILE 103 CO 0.02 -0.58 0.90 1.07 -0.10 0.00 0.00 174.94 176.25 2kdx n THR 104 N 6.87 0.00 -3.64 2.92 5.66 -0.46 -4.88 114.28 120.75 2kdx n THR 104 Ca 0.18 -0.26 -0.08 0.00 -3.05 0.00 0.00 64.05 60.84 2kdx n THR 104 Cb 0.47 1.17 -0.07 0.00 -1.55 0.00 0.00 70.33 70.35 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 -2.22 0.69 0.00 1.09 2.00 -1.22 -4.98 119.66 115.02 2kdx s GLN 105 Ca 0.13 1.17 0.00 0.00 -2.00 0.00 0.00 55.36 54.67 2kdx s GLN 105 Cb 0.14 0.15 0.00 0.00 0.80 0.00 0.00 33.01 34.10 2kdx s GLN 105 CO 0.52 -0.15 0.00 0.41 -0.50 0.00 0.00 175.29 175.57 2kdx n GLY 106 N 4.18 0.79 0.23 2.59 0.00 -1.25 -1.57 105.19 110.15 2kdx n GLY 106 Ca -0.20 -0.19 -0.01 0.00 0.00 0.00 0.00 46.02 45.62 2kdx n GLY 106 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 2kdx h ASN 107 N 0.00 0.28 -5.15 1.61 4.21 -1.90 -3.40 115.58 111.23 2kdx h ASN 107 Ca 0.00 0.06 -0.01 0.00 1.21 0.00 0.00 56.30 57.56 2kdx h ASN 107 Cb 0.00 0.02 -0.07 0.00 -1.12 0.00 0.00 38.32 37.15 2kdx h ASN 107 CO 0.00 0.18 0.01 -1.83 -1.29 0.00 0.00 177.43 174.50 2kdx s GLU 108 N -6.10 1.65 0.96 0.81 -1.05 -1.26 -4.55 118.70 109.15 2kdx s GLU 108 Ca -0.13 -1.16 -0.12 0.00 -0.15 0.00 0.00 54.97 53.42 2kdx s GLU 108 Cb 0.16 0.52 0.17 0.00 -0.44 0.00 0.00 34.13 34.54 2kdx s GLU 108 CO 0.74 -0.71 1.09 0.00 0.95 0.00 0.00 175.26 177.32 2kdx s MET 109 N -3.96 0.71 -0.15 -4.83 0.23 -1.26 -4.38 119.30 105.67 2kdx s MET 109 Ca 0.18 0.95 -0.28 0.00 -1.03 0.00 0.00 55.69 55.51 2kdx s MET 109 Cb -0.03 -1.74 0.07 0.00 -1.53 0.00 0.00 34.83 31.61 2kdx s MET 109 CO 0.08 -2.65 0.69 -0.98 -2.03 0.00 0.00 175.02 170.13 2kdx s ARG 110 N -4.78 0.94 0.52 3.16 1.70 -0.15 -4.99 118.95 115.35 2kdx s ARG 110 Ca 0.65 0.60 -0.21 0.00 -0.47 0.00 0.00 55.73 56.31 2kdx s ARG 110 Cb -0.20 0.45 -0.06 0.00 -0.57 0.00 0.00 34.95 34.57 2kdx s ARG 110 CO 0.59 -0.22 1.17 -0.48 -1.08 0.00 0.00 175.30 175.28 2kdx s LEU 111 N -0.44 3.84 -0.05 -1.89 0.05 -1.26 -0.64 118.68 118.30 2kdx s LEU 111 Ca -0.06 2.30 -0.09 0.00 0.05 0.00 0.00 54.13 56.33 2kdx s LEU 111 Cb -0.02 -4.43 -0.03 0.00 -2.05 0.00 0.00 46.19 39.65 2kdx s LEU 111 CO 0.06 -1.19 -0.18 0.18 -0.55 0.00 0.00 176.35 174.66 2kdx n LEU 112 N -1.02 1.53 -3.99 1.48 4.32 -0.05 -4.82 117.00 114.45 2kdx n LEU 112 Ca 0.10 0.24 -0.11 0.00 -0.02 0.00 0.00 56.01 56.22 2kdx n LEU 112 Cb 0.49 -0.55 -0.03 0.00 -1.62 0.00 0.00 43.42 41.71 2kdx n LEU 112 CO 0.45 -0.50 0.25 -0.44 -1.22 0.00 0.00 177.39 175.93 2kdx s SER 113 N -5.93 0.34 0.41 -1.43 0.01 -1.03 -5.03 113.70 101.04 2kdx s SER 113 Ca -0.15 -1.19 0.07 0.00 1.31 0.00 0.00 55.95 55.99 2kdx s SER 113 Cb 0.02 0.68 -0.05 0.00 0.21 0.00 0.00 66.02 66.88 2kdx s SER 113 CO 0.23 -1.33 0.21 -0.76 0.41 0.00 0.00 173.24 171.99 2kdx s LEU 114 N -3.12 3.16 -0.03 2.44 1.43 -1.26 -0.47 118.68 120.84 2kdx s LEU 114 Ca 0.24 -1.02 0.01 0.00 -1.03 0.00 0.00 54.13 52.32 2kdx s LEU 114 Cb -0.02 -1.53 0.02 0.00 0.03 0.00 0.00 46.19 44.69 2kdx s LEU 114 CO 0.14 -0.55 -0.03 -0.70 0.23 0.00 0.00 176.35 175.44 2kdx s GLU 115 N -3.94 0.55 -0.06 1.70 2.12 0.22 -4.86 118.70 114.43 2kdx s GLU 115 Ca 0.42 -0.07 0.01 0.00 0.36 0.00 0.00 54.97 55.70 2kdx s GLU 115 Cb 0.03 -0.61 0.02 0.00 0.26 0.00 0.00 34.13 33.83 2kdx s GLU 115 CO 0.23 -0.05 -0.07 -1.64 -0.54 0.00 0.00 175.26 173.19 2kdx s MET 116 N 0.68 1.23 0.05 4.30 -1.94 -1.26 -0.51 119.30 121.85 2kdx s MET 116 Ca -0.08 -0.22 0.03 0.00 -1.71 0.00 0.00 55.69 53.70 2kdx s MET 116 Cb -0.11 -1.16 -0.03 0.00 2.01 0.00 0.00 34.83 35.54 2kdx s MET 116 CO -0.00 -0.08 -0.09 -0.51 -0.01 0.00 0.00 175.02 174.32 2kdx s LEU 117 N 1.02 2.26 -0.03 -0.03 1.43 -1.26 -4.90 118.68 117.17 2kdx s LEU 117 Ca -0.09 -0.57 -0.23 0.00 -1.03 0.00 0.00 54.13 52.22 2kdx s LEU 117 Cb -0.14 -0.22 -0.17 0.00 0.03 0.00 0.00 46.19 45.69 2kdx s LEU 117 CO -0.00 -0.19 1.04 0.00 0.23 0.00 0.00 176.35 177.43 2kdx h ALA 118 N 4.45 -0.25 0.00 4.21 0.00 -1.99 -3.45 119.26 122.23 2kdx h ALA 118 Ca -0.37 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.33 2kdx h ALA 118 Cb 1.20 0.10 0.00 0.00 0.00 0.00 0.00 17.79 19.09 2kdx h ALA 118 CO 0.41 -0.38 0.00 0.39 0.00 0.00 0.00 179.25 179.67