#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 0.36 0.00 1.61 0.15 -1.26 -5.07 113.70 109.49 2kdx s SER 2 Ca 0.00 -1.37 0.00 0.00 0.70 0.00 0.00 55.95 55.28 2kdx s SER 2 Cb 0.00 0.45 0.00 0.00 -1.71 0.00 0.00 66.02 64.76 2kdx s SER 2 CO 0.00 -0.94 0.61 0.23 1.20 0.00 0.00 173.24 174.34 2kdx n MET 3 N -0.35 0.95 0.19 5.44 0.00 -1.26 -4.84 117.12 117.25 2kdx n MET 3 Ca 0.02 -0.79 0.14 0.00 0.00 0.00 0.00 57.70 57.07 2kdx n MET 3 Cb 0.65 -0.73 0.66 0.00 0.00 0.00 0.00 33.22 33.80 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 0.00 2.03 -0.00 -2.01 -0.97 115.15 114.20 2kdx h HIS 4 Ca 0.00 0.00 -0.22 0.00 -0.00 0.00 0.00 60.37 60.15 2kdx h HIS 4 Cb 0.65 0.00 -0.04 0.00 -0.00 0.00 0.00 27.41 28.02 2kdx h HIS 4 CO 0.00 0.00 -1.84 -0.85 -0.00 0.00 0.00 177.93 175.24 2kdx n GLU 5 N -2.45 0.65 0.00 5.26 0.00 -1.26 -4.56 120.64 118.28 2kdx n GLU 5 Ca -0.00 0.07 0.10 0.00 0.00 0.00 0.00 57.16 57.33 2kdx n GLU 5 Cb 0.12 -1.30 0.54 0.00 0.00 0.00 0.00 31.44 30.80 2kdx n GLU 5 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.13 177.79 2kdx n TYR 6 N -2.86 0.00 0.01 -1.84 4.01 -1.13 -3.93 117.16 111.43 2kdx n TYR 6 Ca -0.25 0.00 -0.10 0.00 -0.16 0.00 0.00 57.90 57.39 2kdx n TYR 6 Cb 0.80 -0.17 -0.04 0.00 -0.31 0.00 0.00 39.34 39.62 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 0.00 -0.83 -0.08 7.72 4.64 -1.42 -0.41 113.55 123.18 2kdx h SER 7 Ca 0.00 0.13 0.03 0.00 -0.47 0.00 0.00 61.79 61.47 2kdx h SER 7 Cb 0.11 0.36 -0.03 0.00 -0.31 0.00 0.00 62.40 62.53 2kdx h SER 7 CO 0.00 -0.32 -0.09 0.58 -0.87 0.00 0.00 176.83 176.13 2kdx h VAL 8 N -0.35 0.74 0.95 0.95 2.07 -1.88 -2.51 116.25 116.21 2kdx h VAL 8 Ca 0.09 0.00 -0.05 0.00 0.82 0.00 0.00 66.70 67.57 2kdx h VAL 8 Cb 0.49 0.74 0.01 0.00 -1.52 0.00 0.00 31.29 31.01 2kdx h VAL 8 CO -0.31 0.00 -0.47 0.58 0.02 0.00 0.00 177.57 177.40 2kdx h VAL 9 N -0.12 0.00 -1.00 2.57 2.07 -1.60 0.86 116.25 119.03 2kdx h VAL 9 Ca 0.06 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.65 2kdx h VAL 9 Cb 0.21 0.00 -0.07 0.00 -1.52 0.00 0.00 31.29 29.91 2kdx h VAL 9 CO -0.15 0.00 0.65 -1.28 0.02 0.00 0.00 177.57 176.80 2kdx h SER 10 N -1.29 1.03 -0.88 0.57 0.87 -1.22 -2.09 113.55 110.55 2kdx h SER 10 Ca -0.13 0.01 -0.00 0.00 -1.23 0.00 0.00 61.79 60.44 2kdx h SER 10 Cb 0.99 -0.21 -0.04 0.00 -0.44 0.00 0.00 62.40 62.70 2kdx h SER 10 CO 0.21 0.65 0.54 -1.28 -0.53 0.00 0.00 176.83 176.41 2kdx h SER 11 N 1.16 1.06 0.03 6.23 0.87 -1.12 -1.35 113.55 120.43 2kdx h SER 11 Ca 0.44 -0.06 0.02 0.00 -1.23 0.00 0.00 61.79 60.96 2kdx h SER 11 Cb 0.19 -0.27 -0.03 0.00 -0.44 0.00 0.00 62.40 61.85 2kdx h SER 11 CO -0.18 0.81 -0.14 0.25 -0.53 0.00 0.00 176.83 177.04 2kdx h LEU 12 N 1.22 -0.40 -0.10 2.23 7.12 -0.15 -0.02 115.31 125.20 2kdx h LEU 12 Ca 0.32 0.06 0.03 0.00 0.13 0.00 0.00 57.88 58.41 2kdx h LEU 12 Cb -0.06 0.16 -0.03 0.00 -0.53 0.00 0.00 40.66 40.21 2kdx h LEU 12 CO -0.06 -0.20 -0.07 0.40 -0.13 0.00 0.00 178.44 178.38 2kdx h ILE 13 N -0.25 0.78 -0.12 4.05 1.08 -1.11 -0.10 117.51 121.83 2kdx h ILE 13 Ca 0.04 0.00 0.01 0.00 -0.39 0.00 0.00 64.86 64.52 2kdx h ILE 13 Cb 0.29 0.78 -0.01 0.00 -3.07 0.00 0.00 36.82 34.81 2kdx h ILE 13 CO -0.12 0.00 0.06 0.00 -0.69 0.00 0.00 178.15 177.40 2kdx h ALA 14 N 1.00 0.14 -0.62 1.87 0.00 -1.11 -0.78 119.26 119.76 2kdx h ALA 14 Ca 0.07 0.00 -0.05 0.00 0.00 0.00 0.00 54.91 54.93 2kdx h ALA 14 Cb 0.18 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 17.92 2kdx h ALA 14 CO -0.15 -0.39 0.21 1.25 0.00 0.00 0.00 179.25 180.16 2kdx h LEU 15 N 0.13 0.89 -0.05 0.00 5.85 -0.90 -0.65 115.31 120.58 2kdx h LEU 15 Ca 0.05 -0.20 0.02 0.00 0.84 0.00 0.00 57.88 58.58 2kdx h LEU 15 Cb 0.01 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 40.79 2kdx h LEU 15 CO -0.03 0.85 -0.04 0.00 -0.34 0.00 0.00 178.44 178.88 2kdx h GLU 17 N -0.04 0.19 -0.36 0.00 4.22 -1.02 -1.83 114.58 115.74 2kdx h GLU 17 Ca 0.04 -0.01 0.02 0.00 0.08 0.00 0.00 59.36 59.48 2kdx h GLU 17 Cb 0.10 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.28 2kdx h GLU 17 CO -0.08 0.13 0.21 1.49 -2.18 0.00 0.00 179.01 178.57 2kdx h GLU 18 N 0.20 0.41 -0.78 1.92 4.81 -0.93 -1.86 114.58 118.36 2kdx h GLU 18 Ca 0.13 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.33 2kdx h GLU 18 Cb 0.11 -0.09 -0.04 0.00 0.63 0.00 0.00 28.75 29.36 2kdx h GLU 18 CO -0.15 0.27 0.48 0.45 -0.73 0.00 0.00 179.01 179.34 2kdx h HIS 19 N 0.42 1.01 -0.37 0.92 3.86 -1.06 -2.16 115.15 117.77 2kdx h HIS 19 Ca 0.14 0.01 -0.03 0.00 -1.16 0.00 0.00 60.37 59.33 2kdx h HIS 19 Cb 0.01 -0.33 -0.02 0.00 1.06 0.00 0.00 27.41 28.13 2kdx h HIS 19 CO -0.08 0.66 0.10 0.00 0.86 0.00 0.00 177.93 179.48 2kdx h ALA 20 N 1.26 0.49 -0.06 2.45 0.00 -0.83 -0.31 119.26 122.26 2kdx h ALA 20 Ca 0.28 -0.17 -0.08 0.00 0.00 0.00 0.00 54.91 54.94 2kdx h ALA 20 Cb -0.07 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 2kdx h ALA 20 CO -0.06 0.14 -0.33 1.57 0.00 0.00 0.00 179.25 180.58 2kdx h LYS 21 N 0.45 0.11 -0.15 0.00 2.10 -1.35 0.16 116.57 117.89 2kdx h LYS 21 Ca 0.12 -0.04 -0.15 0.00 -2.00 0.00 0.00 60.65 58.58 2kdx h LYS 21 Cb 0.28 -0.01 0.00 0.00 -0.90 0.00 0.00 32.23 31.61 2kdx h LYS 21 CO -0.00 0.43 -0.49 -0.22 -2.00 0.00 0.00 179.45 177.17 2kdx h LYS 22 N 0.10 0.60 -0.00 0.07 3.11 -1.02 -2.80 116.57 116.63 2kdx h LYS 22 Ca 0.01 -0.44 0.00 0.00 -2.81 0.00 0.00 60.65 57.41 2kdx h LYS 22 Cb 0.64 0.08 0.00 0.00 -1.00 0.00 0.00 32.23 31.94 2kdx h LYS 22 CO 0.05 1.06 -0.01 -1.71 -2.81 0.00 0.00 179.45 176.03 2kdx n ASN 23 N -4.20 0.14 -2.38 4.20 5.15 -0.16 -4.93 115.26 113.08 2kdx n ASN 23 Ca -0.07 -0.86 -0.17 0.00 -0.60 0.00 0.00 54.58 52.88 2kdx n ASN 23 Cb 0.59 -0.06 -0.01 0.00 -0.53 0.00 0.00 39.78 39.77 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 -0.96 -1.91 0.11 1.20 6.02 -0.56 -4.91 117.38 116.38 2kdx n GLN 24 Ca 0.21 0.83 -0.24 0.00 -0.01 0.00 0.00 57.00 57.80 2kdx n GLN 24 Cb 0.16 -5.46 -0.15 0.00 1.02 0.00 0.00 30.24 25.81 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 0.97 -0.10 0.00 -1.58 0.00 -1.02 -3.48 119.26 114.05 2kdx h ALA 25 Ca -0.40 -0.87 0.00 0.00 0.00 0.00 0.00 54.91 53.63 2kdx h ALA 25 Cb 1.29 0.21 0.00 0.00 0.00 0.00 0.00 17.79 19.29 2kdx h ALA 25 CO 0.48 0.68 0.00 0.72 0.00 0.00 0.00 179.25 181.12 2kdx n HIS 26 N -3.80 0.00 -4.02 0.00 8.25 -1.17 -4.88 115.22 109.61 2kdx n HIS 26 Ca -0.18 0.00 -0.08 0.00 -0.26 0.00 0.00 57.72 57.20 2kdx n HIS 26 Cb 1.04 -1.28 -0.09 0.00 1.12 0.00 0.00 29.99 30.77 2kdx n HIS 26 CO 0.00 0.00 0.00 0.15 0.64 0.00 0.00 176.34 177.13 2kdx s LYS 27 N -0.86 0.82 0.39 -0.41 1.02 -1.26 -4.44 119.74 114.99 2kdx s LYS 27 Ca 0.00 -1.19 0.08 0.00 0.02 0.00 0.00 55.97 54.88 2kdx s LYS 27 Cb 0.00 0.28 -0.05 0.00 -0.52 0.00 0.00 37.83 37.54 2kdx s LYS 27 CO 0.00 -0.23 0.17 0.42 -0.92 0.00 0.00 175.35 174.79 2kdx s ILE 28 N -3.94 2.57 0.04 2.17 -1.09 -1.16 -4.10 121.20 115.69 2kdx s ILE 28 Ca 0.11 -1.69 0.00 0.00 -2.23 0.00 0.00 60.65 56.84 2kdx s ILE 28 Cb 0.06 -2.97 0.00 0.00 -1.58 0.00 0.00 42.46 37.97 2kdx s ILE 28 CO -0.06 -0.07 0.00 1.21 -1.23 0.00 0.00 174.94 174.78 2kdx n GLU 29 N -1.21 0.00 -3.19 2.79 2.13 0.33 -4.51 120.64 116.98 2kdx n GLU 29 Ca -0.01 0.00 0.02 0.00 0.66 0.00 0.00 57.16 57.82 2kdx n GLU 29 Cb 0.63 -0.43 -0.02 0.00 0.27 0.00 0.00 31.44 31.89 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 -2.00 0.53 0.27 5.31 6.06 -0.29 -4.31 118.95 124.52 2kdx s ARG 30 Ca 0.00 0.87 -0.29 0.00 -2.50 0.00 0.00 55.73 53.80 2kdx s ARG 30 Cb 0.00 0.34 -0.09 0.00 0.06 0.00 0.00 34.95 35.26 2kdx s ARG 30 CO 0.00 -0.67 1.24 0.08 -2.50 0.00 0.00 175.30 173.44 2kdx s VAL 31 N 2.80 3.14 -0.09 7.11 1.01 0.09 -0.56 120.40 133.90 2kdx s VAL 31 Ca 0.18 1.07 0.01 0.00 0.00 0.00 0.00 61.98 63.24 2kdx s VAL 31 Cb -0.15 -3.68 0.02 0.00 0.00 0.00 0.00 36.38 32.57 2kdx s VAL 31 CO -0.21 0.22 -0.11 -0.69 0.00 0.00 0.00 175.10 174.32 2kdx s VAL 32 N -0.73 1.13 -0.02 2.92 1.01 0.29 -0.69 120.40 124.30 2kdx s VAL 32 Ca 0.50 -0.42 0.03 0.00 0.00 0.00 0.00 61.98 62.09 2kdx s VAL 32 Cb -0.36 -1.07 -0.00 0.00 0.00 0.00 0.00 36.38 34.95 2kdx s VAL 32 CO 0.44 0.37 -0.11 -0.69 0.00 0.00 0.00 175.10 175.11 2kdx s VAL 33 N 1.10 0.91 -0.42 2.92 1.01 -0.27 -0.86 120.40 124.79 2kdx s VAL 33 Ca -0.06 -0.45 -0.12 0.00 0.00 0.00 0.00 61.98 61.35 2kdx s VAL 33 Cb -0.14 -0.79 0.06 0.00 0.00 0.00 0.00 36.38 35.50 2kdx s VAL 33 CO -0.02 0.27 0.28 -0.83 0.00 0.00 0.00 175.10 174.80 2kdx s GLY 34 N 0.04 1.98 -0.16 4.51 0.00 0.39 -0.55 107.32 113.53 2kdx s GLY 34 Ca -0.01 -1.96 -0.03 0.00 0.00 0.00 0.00 44.72 42.71 2kdx s GLY 34 CO 0.00 0.94 -0.05 -0.42 0.00 0.00 0.00 173.10 173.58 2kdx s ILE 35 N 1.54 3.79 0.45 0.90 1.01 -0.59 -1.07 121.20 127.22 2kdx s ILE 35 Ca 0.03 -0.39 -0.24 0.00 0.00 0.00 0.00 60.65 60.04 2kdx s ILE 35 Cb -0.22 -2.66 -0.08 0.00 0.01 0.00 0.00 42.46 39.52 2kdx s ILE 35 CO 0.05 0.49 1.28 -0.83 0.00 0.00 0.00 174.94 175.94 2kdx s GLY 36 N 0.44 2.88 0.00 6.18 0.00 -1.26 -0.86 107.32 114.70 2kdx s GLY 36 Ca -0.04 1.19 0.13 0.00 0.00 0.00 0.00 44.72 46.00 2kdx s GLY 36 CO 0.03 1.73 1.41 -1.84 0.00 0.00 0.00 173.10 174.43 2kdx n GLU 37 N -0.25 0.04 -0.05 2.90 0.28 -0.07 -1.58 120.64 121.92 2kdx n GLU 37 Ca 0.06 0.25 0.02 0.00 -0.16 0.00 0.00 57.16 57.32 2kdx n GLU 37 Cb 0.45 -1.50 0.05 0.00 1.43 0.00 0.00 31.44 31.86 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 -1.45 2.92 0.00 3.44 5.12 -1.26 -4.75 116.66 120.67 2kdx n ARG 38 Ca 0.04 -1.68 0.06 0.00 -1.93 0.00 0.00 57.85 54.34 2kdx n ARG 38 Cb 0.15 -1.09 0.34 0.00 -1.16 0.00 0.00 32.46 30.69 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 -0.28 0.00 -1.88 0.55 7.64 -0.61 -4.90 113.62 114.14 2kdx n SER 39 Ca 0.04 0.00 -0.17 0.00 1.01 0.00 0.00 58.87 59.75 2kdx n SER 39 Cb 0.31 -0.23 -0.05 0.00 -1.01 0.00 0.00 64.21 63.23 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 -1.23 -0.44 -3.21 -0.43 0.00 -1.26 -4.98 120.51 108.96 2kdx n ALA 40 Ca 0.07 0.22 -0.32 0.00 0.00 0.00 0.00 53.44 53.41 2kdx n ALA 40 Cb 0.09 -1.82 -0.17 0.00 0.00 0.00 0.00 19.45 17.56 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 -4.12 3.08 -0.38 0.00 0.23 -1.26 -5.11 119.30 111.75 2kdx s MET 41 Ca 0.00 -0.86 -0.29 0.00 -1.03 0.00 0.00 55.69 53.51 2kdx s MET 41 Cb 0.00 -2.33 0.00 0.00 -1.53 0.00 0.00 34.83 30.97 2kdx s MET 41 CO 0.00 0.18 1.45 -0.51 -2.03 0.00 0.00 175.02 174.12 2kdx s ASP 42 N 0.34 6.33 0.54 -1.18 1.01 -1.26 -4.92 116.67 117.53 2kdx s ASP 42 Ca -0.18 0.98 0.25 0.00 0.71 0.00 0.00 52.55 54.31 2kdx s ASP 42 Cb -0.18 -2.54 1.41 0.00 1.01 0.00 0.00 42.92 42.62 2kdx s ASP 42 CO 0.09 -1.41 2.00 0.07 0.21 0.00 0.00 175.17 176.13 2kdx h LYS 43 N 10.76 0.00 -0.78 8.23 2.10 -2.00 -1.70 116.57 133.18 2kdx h LYS 43 Ca -0.28 0.00 0.02 0.00 -2.00 0.00 0.00 60.65 58.39 2kdx h LYS 43 Cb 1.11 0.00 -0.04 0.00 -0.90 0.00 0.00 32.23 32.40 2kdx h LYS 43 CO 1.07 0.00 0.51 1.03 -2.00 0.00 0.00 179.45 180.06 2kdx h SER 44 N 0.00 0.86 -0.28 7.07 0.87 -2.00 -2.03 113.55 118.04 2kdx h SER 44 Ca 0.24 -0.02 -0.05 0.00 -1.23 0.00 0.00 61.79 60.73 2kdx h SER 44 Cb 0.98 -0.21 -0.01 0.00 -0.44 0.00 0.00 62.40 62.72 2kdx h SER 44 CO -0.00 0.61 -0.04 -0.07 -0.53 0.00 0.00 176.83 176.80 2kdx h LEU 45 N 1.01 0.52 0.18 2.23 3.38 -1.72 -2.66 115.31 118.24 2kdx h LEU 45 Ca 0.30 -0.34 -0.01 0.00 0.09 0.00 0.00 57.88 57.92 2kdx h LEU 45 Cb -0.04 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 40.57 2kdx h LEU 45 CO -0.08 0.73 -0.08 0.15 0.09 0.00 0.00 178.44 179.25 2kdx h PHE 46 N 0.29 -0.22 -0.69 1.13 3.57 -1.40 -0.12 116.94 119.50 2kdx h PHE 46 Ca 0.07 -0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.56 2kdx h PHE 46 Cb 0.49 0.07 -0.03 0.00 2.79 0.00 0.00 35.95 39.27 2kdx h PHE 46 CO 0.04 -0.06 0.38 -0.24 -2.23 0.00 0.00 178.31 176.20 2kdx h VAL 47 N -0.33 1.22 -0.43 1.41 3.04 -1.51 -1.61 116.25 118.04 2kdx h VAL 47 Ca -0.02 -0.54 0.00 0.00 -1.01 0.00 0.00 66.70 65.12 2kdx h VAL 47 Cb 0.26 0.31 -0.02 0.00 -2.01 0.00 0.00 31.29 29.83 2kdx h VAL 47 CO 0.04 0.24 0.27 -1.28 -1.01 0.00 0.00 177.57 175.82 2kdx h SER 48 N 0.95 0.50 -0.07 3.17 0.87 -1.12 0.12 113.55 117.97 2kdx h SER 48 Ca 0.24 -0.02 -0.02 0.00 -1.23 0.00 0.00 61.79 60.76 2kdx h SER 48 Cb 0.04 -0.13 -0.00 0.00 -0.44 0.00 0.00 62.40 61.88 2kdx h SER 48 CO -0.04 0.38 -0.03 0.00 -0.53 0.00 0.00 176.83 176.61 2kdx h ALA 49 N 1.71 0.10 -0.51 6.23 0.00 -0.63 -2.40 119.26 123.75 2kdx h ALA 49 Ca 0.16 -0.24 0.08 0.00 0.00 0.00 0.00 54.91 54.90 2kdx h ALA 49 Cb -0.04 -0.02 -0.06 0.00 0.00 0.00 0.00 17.79 17.67 2kdx h ALA 49 CO -0.03 -0.15 0.16 0.35 0.00 0.00 0.00 179.25 179.58 2kdx h PHE 50 N -0.24 0.28 -0.83 0.00 3.57 -0.73 -1.25 116.94 117.74 2kdx h PHE 50 Ca 0.02 0.03 0.05 0.00 3.53 0.00 0.00 57.97 61.60 2kdx h PHE 50 Cb 0.48 -0.05 -0.06 0.00 2.79 0.00 0.00 35.95 39.11 2kdx h PHE 50 CO 0.07 0.07 0.52 0.93 -2.23 0.00 0.00 178.31 177.67 2kdx h GLU 51 N 0.33 0.93 0.29 1.11 4.39 -0.79 -2.45 114.58 118.39 2kdx h GLU 51 Ca 0.25 -0.06 -0.01 0.00 0.34 0.00 0.00 59.36 59.88 2kdx h GLU 51 Cb 0.29 -0.21 0.00 0.00 -0.10 0.00 0.00 28.75 28.74 2kdx h GLU 51 CO -0.27 0.61 -0.14 1.15 -1.16 0.00 0.00 179.01 179.20 2kdx h THR 52 N 0.96 0.74 0.00 1.13 2.02 -1.09 -3.32 112.91 113.35 2kdx h THR 52 Ca 0.36 -0.54 0.00 0.00 0.77 0.00 0.00 66.41 66.99 2kdx h THR 52 Cb 0.14 1.03 0.00 0.00 -1.74 0.00 0.00 68.15 67.57 2kdx h THR 52 CO -0.16 0.11 0.00 0.49 0.37 0.00 0.00 175.52 176.33 2kdx n PHE 53 N -5.13 0.00 -0.25 3.16 3.72 -0.50 -3.95 117.46 114.50 2kdx n PHE 53 Ca -0.10 0.00 0.26 0.00 -0.05 0.00 0.00 57.45 57.57 2kdx n PHE 53 Cb 0.25 -0.11 0.64 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 0.00 0.17 0.00 -1.08 0.11 -1.54 -1.44 114.38 110.60 2kdx h ARG 54 Ca 0.00 -0.01 0.00 0.00 0.10 0.00 0.00 59.98 60.07 2kdx h ARG 54 Cb 0.08 -0.04 0.00 0.00 1.11 0.00 0.00 29.97 31.12 2kdx h ARG 54 CO 0.00 0.11 0.00 0.93 0.10 0.00 0.00 179.97 181.11 2kdx h GLU 55 N 0.17 0.00 0.00 0.08 4.39 -1.87 -1.73 114.58 115.63 2kdx h GLU 55 Ca 0.49 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.19 2kdx h GLU 55 Cb 1.63 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 30.28 2kdx h GLU 55 CO -0.10 0.00 0.00 -1.91 -1.16 0.00 0.00 179.01 175.84 2kdx n GLU 56 N -2.82 0.03 -3.01 2.33 2.13 -0.54 -4.75 120.64 114.01 2kdx n GLU 56 Ca -0.00 0.34 -0.11 0.00 0.66 0.00 0.00 57.16 58.05 2kdx n GLU 56 Cb 0.18 -1.50 -0.03 0.00 0.27 0.00 0.00 31.44 30.37 2kdx n GLU 56 CO 0.00 0.00 0.00 -1.13 -0.41 0.00 0.00 177.13 175.59 2kdx n SER 57 N -1.44 1.37 -0.13 4.31 3.41 -0.65 -4.98 113.62 115.51 2kdx n SER 57 Ca 0.02 -1.90 -0.28 0.00 -0.26 0.00 0.00 58.87 56.45 2kdx n SER 57 Cb 0.07 0.37 -0.10 0.00 -0.26 0.00 0.00 64.21 64.28 2kdx n SER 57 CO 0.00 0.00 0.00 -0.11 -0.16 0.00 0.00 175.04 174.77 2kdx n LEU 58 N 0.00 2.01 0.26 1.04 0.00 -1.26 -4.77 117.00 114.28 2kdx n LEU 58 Ca -0.04 0.28 0.08 0.00 0.00 0.00 0.00 56.01 56.33 2kdx n LEU 58 Cb 0.25 -0.80 0.65 0.00 0.00 0.00 0.00 43.42 43.52 2kdx n LEU 58 CO 0.13 0.60 1.05 -0.37 0.00 0.00 0.00 177.39 178.80 2kdx h VAL 59 N -0.86 0.97 0.00 1.96 -1.51 -1.89 -2.28 116.25 112.64 2kdx h VAL 59 Ca -0.67 -0.11 0.00 0.00 -1.23 0.00 0.00 66.70 64.69 2kdx h VAL 59 Cb 1.63 1.06 0.00 0.00 -2.13 0.00 0.00 31.29 31.85 2kdx h VAL 59 CO -0.38 0.03 -0.14 0.00 -1.23 0.00 0.00 177.57 175.85 2kdx h LYS 61 N 0.00 0.88 -2.68 0.00 1.57 -1.56 -2.82 116.57 111.96 2kdx h LYS 61 Ca 0.00 -0.18 -0.80 0.00 -1.87 0.00 0.00 60.65 57.80 2kdx h LYS 61 Cb 0.68 -0.13 -0.25 0.00 0.08 0.00 0.00 32.23 32.60 2kdx h LYS 61 CO 0.00 0.78 1.12 -0.25 -0.57 0.00 0.00 179.45 180.53 2kdx n ASP 62 N -4.27 6.82 -3.87 0.86 8.00 -1.20 -4.97 116.55 117.92 2kdx n ASP 62 Ca 0.04 -3.48 -0.10 0.00 0.71 0.00 0.00 54.79 51.97 2kdx n ASP 62 Cb 0.22 -1.26 -0.09 0.00 -0.02 0.00 0.00 41.12 39.98 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 -3.01 -0.28 0.07 2.24 0.00 -1.07 -2.99 121.76 116.72 2kdx s ALA 63 Ca 0.37 -0.36 0.04 0.00 0.00 0.00 0.00 51.96 52.01 2kdx s ALA 63 Cb 0.12 0.28 -0.03 0.00 0.00 0.00 0.00 23.12 23.49 2kdx s ALA 63 CO -0.01 -0.36 -0.13 0.42 0.00 0.00 0.00 175.76 175.69 2kdx s ILE 64 N -2.64 0.99 -0.07 0.00 1.09 -1.26 -5.04 121.20 114.27 2kdx s ILE 64 Ca -0.05 -1.28 0.04 0.00 -1.10 0.00 0.00 60.65 58.27 2kdx s ILE 64 Cb -0.01 -0.99 0.00 0.00 -1.06 0.00 0.00 42.46 40.40 2kdx s ILE 64 CO -0.04 -0.28 -0.19 -0.22 -0.10 0.00 0.00 174.94 174.11 2kdx s LEU 65 N -1.75 1.93 -0.26 2.97 0.20 -1.26 -0.73 118.68 119.79 2kdx s LEU 65 Ca -0.03 -0.43 0.01 0.00 0.69 0.00 0.00 54.13 54.37 2kdx s LEU 65 Cb -0.10 -1.14 0.07 0.00 -0.43 0.00 0.00 46.19 44.59 2kdx s LEU 65 CO 0.02 0.14 -0.04 -0.62 -0.29 0.00 0.00 176.35 175.56 2kdx s ASP 66 N 0.25 4.10 -0.43 3.68 -1.08 0.13 -4.98 116.67 118.34 2kdx s ASP 66 Ca -0.11 -1.39 -0.23 0.00 -0.52 0.00 0.00 52.55 50.30 2kdx s ASP 66 Cb -0.15 -1.28 0.02 0.00 -1.46 0.00 0.00 42.92 40.05 2kdx s ASP 66 CO 0.05 -0.26 0.77 -0.63 0.52 0.00 0.00 175.17 175.62 2kdx s ILE 67 N 1.29 4.68 -0.01 4.11 1.09 -1.26 -1.12 121.20 129.99 2kdx s ILE 67 Ca -0.03 0.47 -0.30 0.00 -1.10 0.00 0.00 60.65 59.69 2kdx s ILE 67 Cb -0.19 -4.29 -0.03 0.00 -1.06 0.00 0.00 42.46 36.89 2kdx s ILE 67 CO -0.08 -0.66 1.01 -0.69 -0.10 0.00 0.00 174.94 174.43 2kdx s VAL 68 N 3.21 4.77 -0.67 2.92 1.01 0.28 -4.97 120.40 126.94 2kdx s VAL 68 Ca 0.29 1.99 -0.27 0.00 0.00 0.00 0.00 61.98 63.99 2kdx s VAL 68 Cb -0.12 -4.28 0.02 0.00 0.00 0.00 0.00 36.38 32.00 2kdx s VAL 68 CO 0.21 0.13 1.41 -1.81 0.00 0.00 0.00 175.10 175.04 2kdx s ASP 69 N 1.04 6.00 0.25 3.32 1.01 -1.26 -1.55 116.67 125.48 2kdx s ASP 69 Ca 0.52 -0.14 -0.26 0.00 0.71 0.00 0.00 52.55 53.38 2kdx s ASP 69 Cb -0.22 -2.55 -0.09 0.00 1.01 0.00 0.00 42.92 41.07 2kdx s ASP 69 CO 0.27 -1.90 0.88 -1.61 0.21 0.00 0.00 175.17 173.02 2kdx s GLU 70 N 5.90 4.63 0.79 8.23 0.41 -0.04 -4.82 118.70 133.80 2kdx s GLU 70 Ca 0.45 1.29 -0.11 0.00 -0.41 0.00 0.00 54.97 56.18 2kdx s GLU 70 Cb -0.09 -3.06 0.07 0.00 -1.78 0.00 0.00 34.13 29.26 2kdx s GLU 70 CO 0.18 0.43 1.09 0.15 -0.49 0.00 0.00 175.26 176.63 2kdx s LYS 71 N -1.57 2.11 -0.01 1.61 3.01 -1.26 -0.89 119.74 122.75 2kdx s LYS 71 Ca 0.43 0.82 0.05 0.00 -1.01 0.00 0.00 55.97 56.26 2kdx s LYS 71 Cb -0.22 -1.91 -0.01 0.00 -1.01 0.00 0.00 37.83 34.68 2kdx s LYS 71 CO 0.27 -1.65 -0.16 0.08 0.51 0.00 0.00 175.35 174.40 2kdx s VAL 72 N -3.05 1.23 -0.03 3.17 1.01 -1.26 -3.94 120.40 117.53 2kdx s VAL 72 Ca 0.61 -0.71 0.02 0.00 0.00 0.00 0.00 61.98 61.90 2kdx s VAL 72 Cb -0.15 -1.03 0.01 0.00 0.00 0.00 0.00 36.38 35.20 2kdx s VAL 72 CO 0.55 0.31 -0.07 -0.70 0.00 0.00 0.00 175.10 175.20 2kdx s GLU 73 N -0.46 0.82 -0.41 2.72 2.56 -0.53 -4.46 118.70 118.95 2kdx s GLU 73 Ca 0.06 -0.20 -0.05 0.00 0.00 0.00 0.00 54.97 54.77 2kdx s GLU 73 Cb -0.06 -0.79 0.10 0.00 2.00 0.00 0.00 34.13 35.37 2kdx s GLU 73 CO -0.00 0.03 0.21 -0.51 -0.56 0.00 0.00 175.26 174.43 2kdx s LEU 74 N 0.43 5.12 0.26 2.70 1.43 -0.29 -1.46 118.68 126.87 2kdx s LEU 74 Ca -0.06 -1.80 -0.15 0.00 -1.03 0.00 0.00 54.13 51.09 2kdx s LEU 74 Cb -0.10 -1.87 -0.08 0.00 0.03 0.00 0.00 46.19 44.16 2kdx s LEU 74 CO 0.00 -0.53 0.67 -0.70 0.23 0.00 0.00 176.35 176.02 2kdx s GLU 75 N 1.25 4.01 0.40 1.70 2.12 -0.43 -0.88 118.70 126.87 2kdx s GLU 75 Ca 0.05 0.60 -0.13 0.00 0.36 0.00 0.00 54.97 55.85 2kdx s GLU 75 Cb -0.23 -2.64 -0.07 0.00 0.26 0.00 0.00 34.13 31.44 2kdx s GLU 75 CO -0.02 0.29 0.80 0.00 -0.54 0.00 0.00 175.26 175.79 2kdx h LYS 77 N 1.48 -1.01 -2.01 0.00 1.79 -1.92 -3.40 116.57 111.51 2kdx h LYS 77 Ca -0.47 0.07 -0.53 0.00 -2.18 0.00 0.00 60.65 57.54 2kdx h LYS 77 Cb 1.18 0.23 -0.41 0.00 -1.58 0.00 0.00 32.23 31.65 2kdx h LYS 77 CO 0.64 -0.67 -0.93 -3.47 -1.08 0.00 0.00 179.45 173.94 2kdx n ASP 78 N -5.07 2.72 0.00 0.86 2.03 -1.26 -5.05 116.55 110.78 2kdx n ASP 78 Ca -0.13 -3.33 0.00 0.00 0.52 0.00 0.00 54.79 51.85 2kdx n ASP 78 Cb 0.41 -0.58 0.00 0.00 -0.72 0.00 0.00 41.12 40.24 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 0.09 -3.79 0.00 2.88 -1.26 -5.05 113.62 106.48 2kdx n SER 80 Ca 0.00 -2.09 -0.13 0.00 -1.33 0.00 0.00 58.87 55.32 2kdx n SER 80 Cb 0.00 0.06 -0.09 0.00 -0.75 0.00 0.00 64.21 63.43 2kdx n SER 80 CO 0.00 0.00 0.00 -2.28 -1.23 0.00 0.00 175.04 171.53 2kdx s HIS 81 N -1.47 -0.15 0.03 0.66 5.65 -1.26 -5.12 115.29 113.64 2kdx s HIS 81 Ca 0.18 0.26 -0.00 0.00 0.25 0.00 0.00 55.06 55.75 2kdx s HIS 81 Cb 0.34 0.06 -0.03 0.00 -1.18 0.00 0.00 32.58 31.77 2kdx s HIS 81 CO -0.08 -0.31 -0.03 0.14 -0.65 0.00 0.00 174.74 173.80 2kdx s VAL 82 N -1.05 0.17 0.33 0.89 -7.23 -1.26 -2.45 120.40 109.80 2kdx s VAL 82 Ca -0.11 -1.28 0.01 0.00 -1.81 0.00 0.00 61.98 58.79 2kdx s VAL 82 Cb -0.05 -0.77 -0.01 0.00 0.56 0.00 0.00 36.38 36.10 2kdx s VAL 82 CO 0.03 -0.70 0.38 0.72 -0.31 0.00 0.00 175.10 175.22 2kdx s PHE 83 N -2.44 1.33 -0.01 2.82 -0.12 -0.06 -4.97 117.98 114.54 2kdx s PHE 83 Ca -0.07 -1.43 -0.22 0.00 -0.05 0.00 0.00 56.93 55.16 2kdx s PHE 83 Cb -0.03 -0.35 -0.05 0.00 -0.63 0.00 0.00 43.02 41.96 2kdx s PHE 83 CO -0.04 -1.01 0.64 0.15 -0.05 0.00 0.00 175.22 174.90 2kdx s LYS 84 N -3.27 4.37 -0.06 1.99 3.01 -1.26 -1.14 119.74 123.38 2kdx s LYS 84 Ca 0.35 0.81 -0.30 0.00 -1.01 0.00 0.00 55.97 55.82 2kdx s LYS 84 Cb 0.01 -3.36 -0.06 0.00 -1.01 0.00 0.00 37.83 33.40 2kdx s LYS 84 CO 0.23 0.30 1.81 -1.25 0.51 0.00 0.00 175.35 176.95 2kdx s PRO 85 N 0.00 4.01 0.00 -1.68 0.04 -1.26 -4.79 135.00 131.32 2kdx s PRO 85 Ca 0.33 2.24 0.00 0.00 0.04 0.00 0.00 61.00 63.61 2kdx s PRO 85 Cb -0.18 -4.09 0.00 0.00 0.04 0.00 0.00 34.50 30.26 2kdx s PRO 85 CO 0.18 -1.07 0.00 -1.71 0.04 0.00 0.00 177.00 174.44 2kdx n ASN 86 N 7.91 0.00 -4.79 6.66 2.85 -1.26 -5.15 115.26 121.48 2kdx n ASN 86 Ca 0.20 0.00 -0.29 0.00 -0.11 0.00 0.00 54.58 54.38 2kdx n ASN 86 Cb 0.43 0.04 0.12 0.00 1.24 0.00 0.00 39.78 41.61 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 -1.79 1.92 0.05 5.20 0.00 -1.26 -5.06 121.76 120.81 2kdx s ALA 87 Ca 0.00 -0.44 0.00 0.00 0.00 0.00 0.00 51.96 51.52 2kdx s ALA 87 Cb 0.00 -3.05 0.00 0.00 0.00 0.00 0.00 23.12 20.07 2kdx s ALA 87 CO 0.00 -2.13 0.00 1.47 0.00 0.00 0.00 175.76 175.10 2kdx n LEU 88 N -3.67 0.08 0.26 0.00 -0.00 -1.26 -4.35 117.00 108.06 2kdx n LEU 88 Ca 0.07 0.08 0.11 0.00 -0.00 0.00 0.00 56.01 56.27 2kdx n LEU 88 Cb 0.58 0.02 0.70 0.00 -0.00 0.00 0.00 43.42 44.73 2kdx n LEU 88 CO 0.57 -0.56 0.98 -0.78 -0.00 0.00 0.00 177.39 177.60 2kdx h ASP 89 N 0.00 0.00 0.00 1.45 3.58 -2.05 -2.04 116.42 117.37 2kdx h ASP 89 Ca 0.00 0.00 -0.01 0.00 0.42 0.00 0.00 57.03 57.44 2kdx h ASP 89 Cb 0.00 0.00 -0.03 0.00 1.72 0.00 0.00 39.33 41.02 2kdx h ASP 89 CO 0.00 0.11 -0.32 0.00 -2.88 0.00 0.00 179.24 176.16 2kdx n TYR 90 N -3.88 0.00 0.26 0.28 4.11 -1.26 -4.87 117.16 111.80 2kdx n TYR 90 Ca -0.02 -1.04 -0.06 0.00 -0.00 0.00 0.00 57.90 56.78 2kdx n TYR 90 Cb 0.21 -0.18 0.04 0.00 -0.00 0.00 0.00 39.34 39.41 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 -1.02 2.72 3.73 -7.48 0.00 -0.77 -4.93 105.19 97.44 2kdx n GLY 91 Ca 0.15 -0.31 -0.31 0.00 0.00 0.00 0.00 46.02 45.55 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 -0.84 2.94 0.35 1.61 -7.23 -1.26 -4.66 120.40 111.31 2kdx s VAL 92 Ca 0.14 0.30 -0.28 0.00 -1.81 0.00 0.00 61.98 60.33 2kdx s VAL 92 Cb 0.11 -2.73 -0.10 0.00 0.56 0.00 0.00 36.38 34.22 2kdx s VAL 92 CO 0.02 -0.40 1.35 0.00 -0.31 0.00 0.00 175.10 175.76 2kdx h GLU 94 N 3.24 1.24 0.14 0.00 4.39 -1.96 -3.20 114.58 118.43 2kdx h GLU 94 Ca -0.49 -0.14 -0.01 0.00 0.34 0.00 0.00 59.36 59.06 2kdx h GLU 94 Cb 1.23 -0.25 0.00 0.00 -0.10 0.00 0.00 28.75 29.64 2kdx h GLU 94 CO 0.65 0.91 -0.07 0.87 -1.16 0.00 0.00 179.01 180.21 2kdx h LYS 95 N 1.25 -0.18 -4.85 2.33 1.57 -1.99 -3.45 116.57 111.24 2kdx h LYS 95 Ca 0.32 0.01 -0.68 0.00 -1.87 0.00 0.00 60.65 58.43 2kdx h LYS 95 Cb 0.02 0.04 -0.34 0.00 0.08 0.00 0.00 32.23 32.03 2kdx h LYS 95 CO -0.05 0.15 -0.75 0.00 -0.57 0.00 0.00 179.45 178.23 2kdx n HIS 97 N 4.57 0.49 -4.03 0.00 1.44 -1.25 -3.00 115.22 113.44 2kdx n HIS 97 Ca -0.15 -1.00 -0.08 0.00 -2.01 0.00 0.00 57.72 54.48 2kdx n HIS 97 Cb 0.44 -1.01 -0.10 0.00 0.12 0.00 0.00 29.99 29.44 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 3.90 0.36 -0.11 4.39 0.01 -1.26 -4.92 113.70 116.08 2kdx s SER 98 Ca 0.18 -0.76 0.06 0.00 1.31 0.00 0.00 55.95 56.74 2kdx s SER 98 Cb 0.06 0.16 0.35 0.00 0.21 0.00 0.00 66.02 66.80 2kdx s SER 98 CO -0.01 -0.48 1.06 0.29 0.41 0.00 0.00 173.24 174.52 2kdx n LYS 99 N 0.75 2.63 0.00 12.44 4.01 -1.26 -1.41 118.16 135.31 2kdx n LYS 99 Ca -0.18 -1.36 0.05 0.00 -0.51 0.00 0.00 58.31 56.31 2kdx n LYS 99 Cb 0.58 -1.82 0.27 0.00 -0.51 0.00 0.00 35.03 33.56 2kdx n LYS 99 CO 0.00 0.00 0.00 0.27 -1.11 0.00 0.00 177.40 176.56 2kdx n ASN 100 N 0.24 0.00 -4.60 4.39 6.94 -1.26 -4.89 115.26 116.07 2kdx n ASN 100 Ca 0.13 0.01 -0.34 0.00 -0.02 0.00 0.00 54.58 54.37 2kdx n ASN 100 Cb 0.68 -0.21 0.12 0.00 -2.36 0.00 0.00 39.78 38.02 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 -1.21 1.43 -4.24 3.53 0.24 -1.26 -4.50 118.33 112.33 2kdx n VAL 101 Ca 0.06 -0.22 -0.16 0.00 -2.04 0.00 0.00 64.34 61.98 2kdx n VAL 101 Cb 0.07 -1.00 -0.11 0.00 -1.47 0.00 0.00 33.84 31.33 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 -2.19 1.22 -0.36 1.34 -0.00 0.15 -4.97 121.20 116.40 2kdx s ILE 102 Ca 0.68 -1.82 -0.29 0.00 -0.00 0.00 0.00 60.65 59.22 2kdx s ILE 102 Cb -0.28 -1.61 0.01 0.00 -0.00 0.00 0.00 42.46 40.58 2kdx s ILE 102 CO 0.56 -0.55 1.29 -0.63 -0.00 0.00 0.00 174.94 175.61 2kdx s ILE 103 N -2.58 4.12 -0.80 8.37 1.09 -1.26 -1.32 121.20 128.82 2kdx s ILE 103 Ca 0.11 1.22 0.23 0.00 -1.10 0.00 0.00 60.65 61.11 2kdx s ILE 103 Cb -0.02 -4.25 -0.13 0.00 -1.06 0.00 0.00 42.46 37.00 2kdx s ILE 103 CO 0.02 -0.63 1.06 1.07 -0.10 0.00 0.00 174.94 176.37 2kdx n THR 104 N 6.50 0.07 -3.65 2.92 5.66 -0.53 -4.80 114.28 120.44 2kdx n THR 104 Ca 0.15 -0.12 -0.10 0.00 -3.05 0.00 0.00 64.05 60.93 2kdx n THR 104 Cb 0.47 0.45 -0.08 0.00 -1.55 0.00 0.00 70.33 69.63 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 -3.10 0.68 0.00 1.09 2.00 -1.25 -4.94 119.66 114.15 2kdx s GLN 105 Ca 0.06 1.03 0.00 0.00 -2.00 0.00 0.00 55.36 54.45 2kdx s GLN 105 Cb 0.16 0.21 0.00 0.00 0.80 0.00 0.00 33.01 34.18 2kdx s GLN 105 CO 0.80 -0.13 0.00 0.41 -0.50 0.00 0.00 175.29 175.87 2kdx n GLY 106 N 3.66 0.74 0.16 2.59 0.00 -1.25 -1.45 105.19 109.64 2kdx n GLY 106 Ca -0.18 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.74 2kdx n GLY 106 CO 0.00 0.00 0.00 3.45 0.00 0.00 0.00 173.32 176.77 2kdx h ASN 107 N 0.00 0.45 -4.71 1.61 7.08 -1.91 -3.35 115.58 114.76 2kdx h ASN 107 Ca 0.00 -0.22 -0.24 0.00 -3.08 0.00 0.00 56.30 52.76 2kdx h ASN 107 Cb 0.00 -0.12 -0.15 0.00 -2.08 0.00 0.00 38.32 35.97 2kdx h ASN 107 CO 0.00 0.55 -0.68 -1.83 -2.08 0.00 0.00 177.43 173.39 2kdx s GLU 108 N -5.35 0.95 0.73 4.14 -1.05 -1.26 -4.59 118.70 112.27 2kdx s GLU 108 Ca -0.13 -1.42 -0.11 0.00 -0.15 0.00 0.00 54.97 53.15 2kdx s GLU 108 Cb 0.09 -0.15 0.03 0.00 -0.44 0.00 0.00 34.13 33.66 2kdx s GLU 108 CO 0.74 -0.10 1.10 0.00 0.95 0.00 0.00 175.26 177.95 2kdx s MET 109 N -3.90 2.63 0.17 -4.83 0.23 -1.26 -4.59 119.30 107.74 2kdx s MET 109 Ca 0.18 0.51 -0.10 0.00 -1.03 0.00 0.00 55.69 55.25 2kdx s MET 109 Cb 0.06 -1.99 -0.00 0.00 -1.53 0.00 0.00 34.83 31.37 2kdx s MET 109 CO -0.01 -1.21 0.32 -0.98 -2.03 0.00 0.00 175.02 171.11 2kdx s ARG 110 N -5.30 1.20 0.60 3.16 1.70 -0.23 -5.02 118.95 115.06 2kdx s ARG 110 Ca 0.59 -1.13 -0.14 0.00 -0.47 0.00 0.00 55.73 54.58 2kdx s ARG 110 Cb -0.12 0.40 -0.04 0.00 -0.57 0.00 0.00 34.95 34.62 2kdx s ARG 110 CO 0.52 -0.45 1.03 -0.51 -1.08 0.00 0.00 175.30 174.82 2kdx s LEU 111 N -2.96 3.40 0.00 -1.89 1.02 -1.26 -0.46 118.68 116.53 2kdx s LEU 111 Ca 0.16 1.64 0.00 0.00 0.02 0.00 0.00 54.13 55.95 2kdx s LEU 111 Cb 0.03 -4.51 0.00 0.00 0.02 0.00 0.00 46.19 41.73 2kdx s LEU 111 CO -0.00 -1.03 0.00 0.18 0.02 0.00 0.00 176.35 175.52 2kdx n LEU 112 N -2.30 1.19 -3.85 1.79 4.77 -0.04 -4.68 117.00 113.88 2kdx n LEU 112 Ca 0.07 0.00 -0.08 0.00 -0.03 0.00 0.00 56.01 55.98 2kdx n LEU 112 Cb 0.53 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.60 2kdx n LEU 112 CO 0.51 0.16 0.42 -0.55 -1.33 0.00 0.00 177.39 176.60 2kdx s SER 113 N -4.49 -0.25 -0.30 -1.43 0.15 -0.78 -5.00 113.70 101.59 2kdx s SER 113 Ca 0.00 -0.61 -0.03 0.00 0.70 0.00 0.00 55.95 56.01 2kdx s SER 113 Cb 0.00 0.70 0.11 0.00 -1.71 0.00 0.00 66.02 65.11 2kdx s SER 113 CO 0.00 -1.29 0.14 -0.76 1.20 0.00 0.00 173.24 172.52 2kdx s LEU 114 N -2.92 0.93 0.10 3.45 1.02 -1.26 -0.55 118.68 119.45 2kdx s LEU 114 Ca 0.12 -1.48 -0.30 0.00 0.02 0.00 0.00 54.13 52.48 2kdx s LEU 114 Cb -0.05 -0.46 -0.06 0.00 0.02 0.00 0.00 46.19 45.64 2kdx s LEU 114 CO 0.06 -0.42 1.15 -1.61 0.02 0.00 0.00 176.35 175.55 2kdx s GLU 115 N 1.86 4.49 -0.05 1.70 2.02 0.28 -4.94 118.70 124.07 2kdx s GLU 115 Ca 0.10 1.73 -0.03 0.00 0.02 0.00 0.00 54.97 56.79 2kdx s GLU 115 Cb -0.17 -3.33 0.02 0.00 0.10 0.00 0.00 34.13 30.75 2kdx s GLU 115 CO -0.30 -0.13 0.12 0.00 0.02 0.00 0.00 175.26 174.97 2kdx s MET 116 N 0.56 0.11 -0.85 1.61 0.23 -1.26 -0.51 119.30 119.19 2kdx s MET 116 Ca 0.55 0.21 -0.25 0.00 -1.03 0.00 0.00 55.69 55.17 2kdx s MET 116 Cb -0.29 -0.02 -0.07 0.00 -1.53 0.00 0.00 34.83 32.93 2kdx s MET 116 CO 0.31 -0.06 2.07 -1.17 -2.03 0.00 0.00 175.02 174.14 2kdx s LEU 117 N 0.40 3.10 -0.26 0.18 0.20 -1.26 -4.84 118.68 116.21 2kdx s LEU 117 Ca -0.03 -0.40 -0.11 0.00 0.69 0.00 0.00 54.13 54.28 2kdx s LEU 117 Cb -0.04 -2.55 0.09 0.00 -0.43 0.00 0.00 46.19 43.26 2kdx s LEU 117 CO -0.02 -3.02 0.59 0.00 -0.29 0.00 0.00 176.35 173.61 2kdx s ALA 118 N 11.30 -1.68 0.00 5.97 0.00 -1.26 -4.92 121.76 131.17 2kdx s ALA 118 Ca 0.76 2.11 0.00 0.00 0.00 0.00 0.00 51.96 54.83 2kdx s ALA 118 Cb -0.09 -1.45 0.00 0.00 0.00 0.00 0.00 23.12 21.59 2kdx s ALA 118 CO 0.03 -0.60 0.01 -1.91 0.00 0.00 0.00 175.76 173.29