#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dkp s SER 2 N 0.00 -0.37 0.57 1.61 1.04 -1.26 -5.18 113.70 110.11 2dkp s SER 2 Ca 0.00 0.38 0.02 0.00 0.48 0.00 0.00 55.95 56.83 2dkp s SER 2 Cb 0.00 0.45 0.05 0.00 0.10 0.00 0.00 66.02 66.62 2dkp s SER 2 CO 0.00 -0.47 0.79 -0.44 0.98 0.00 0.00 173.24 174.10 2dkp s SER 3 N -1.12 5.14 0.00 7.02 0.01 -1.26 -5.06 113.70 118.44 2dkp s SER 3 Ca -0.11 -0.15 0.00 0.00 1.31 0.00 0.00 55.95 56.99 2dkp s SER 3 Cb -0.03 -0.65 0.00 0.00 0.21 0.00 0.00 66.02 65.55 2dkp s SER 3 CO 0.06 -1.24 0.00 0.61 0.41 0.00 0.00 173.24 173.08 2dkp n GLY 4 N -2.38 3.11 3.28 3.44 0.00 -1.26 -5.03 105.19 106.36 2dkp n GLY 4 Ca 0.10 -1.89 -0.37 0.00 0.00 0.00 0.00 46.02 43.85 2dkp n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dkp s SER 5 N 0.00 5.23 -0.19 1.61 0.01 -1.26 -5.05 113.70 114.04 2dkp s SER 5 Ca 0.00 -1.03 -0.30 0.00 1.31 0.00 0.00 55.95 55.93 2dkp s SER 5 Cb 0.00 -1.86 0.15 0.00 0.21 0.00 0.00 66.02 64.52 2dkp s SER 5 CO 0.00 -0.29 1.12 -0.94 0.41 0.00 0.00 173.24 173.54 2dkp s SER 6 N 1.42 -0.25 -0.83 2.44 1.04 -1.26 -5.06 113.70 111.20 2dkp s SER 6 Ca -0.01 0.24 -0.02 0.00 0.48 0.00 0.00 55.95 56.64 2dkp s SER 6 Cb -0.19 0.21 0.29 0.00 0.10 0.00 0.00 66.02 66.43 2dkp s SER 6 CO 0.02 -0.25 2.13 0.61 0.98 0.00 0.00 173.24 176.73 2dkp n GLY 7 N 0.56 5.42 3.33 7.32 0.00 -1.26 -4.87 105.19 115.69 2dkp n GLY 7 Ca -0.06 -2.38 -0.08 0.00 0.00 0.00 0.00 46.02 43.50 2dkp n GLY 7 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2dkp s LYS 8 N -3.62 0.37 0.51 1.61 2.20 -1.26 -5.02 119.74 114.53 2dkp s LYS 8 Ca 0.51 1.08 0.27 0.00 -0.36 0.00 0.00 55.97 57.47 2dkp s LYS 8 Cb 0.38 0.38 1.34 0.00 -1.51 0.00 0.00 37.83 38.42 2dkp s LYS 8 CO -0.33 -0.23 2.02 0.07 -0.36 0.00 0.00 175.35 176.51 2dkp h ARG 9 N 8.04 0.00 -4.07 4.03 -0.00 -2.06 -3.36 114.38 116.97 2dkp h ARG 9 Ca -0.18 0.00 -0.73 0.00 -0.00 0.00 0.00 59.98 59.08 2dkp h ARG 9 Cb 1.12 0.00 -0.31 0.00 -0.00 0.00 0.00 29.97 30.78 2dkp h ARG 9 CO 0.13 0.14 -0.32 -1.12 -0.00 0.00 0.00 179.97 178.80 2dkp s SER 10 N -6.13 5.71 -0.19 0.08 0.01 -1.26 -4.91 113.70 107.02 2dkp s SER 10 Ca -0.02 -2.28 -0.23 0.00 1.31 0.00 0.00 55.95 54.74 2dkp s SER 10 Cb 0.12 -1.99 -0.20 0.00 0.21 0.00 0.00 66.02 64.16 2dkp s SER 10 CO 0.59 -0.58 0.34 -0.55 0.41 0.00 0.00 173.24 173.45 2dkp h ASN 11 N 7.97 0.00 -5.53 2.44 -1.07 -2.03 -3.50 115.58 113.84 2dkp h ASN 11 Ca -0.11 -0.61 0.22 0.00 0.07 0.00 0.00 56.30 55.87 2dkp h ASN 11 Cb 1.04 0.00 -0.05 0.00 -2.07 0.00 0.00 38.32 37.23 2dkp h ASN 11 CO 0.80 1.31 0.67 -0.94 0.07 0.00 0.00 177.43 179.34 2dkp s SER 12 N -6.62 -0.02 -0.11 6.14 1.04 -1.26 -5.16 113.70 107.71 2dkp s SER 12 Ca -0.25 -0.49 -0.02 0.00 0.48 0.00 0.00 55.95 55.67 2dkp s SER 12 Cb 0.03 0.39 -0.03 0.00 0.10 0.00 0.00 66.02 66.51 2dkp s SER 12 CO 0.59 -0.76 -0.04 -0.63 0.98 0.00 0.00 173.24 173.38 2dkp s ILE 13 N -2.28 3.90 -0.02 -1.02 1.01 -1.26 -5.11 121.20 116.42 2dkp s ILE 13 Ca 0.22 -0.38 0.02 0.00 0.00 0.00 0.00 60.65 60.50 2dkp s ILE 13 Cb -0.01 -2.65 0.00 0.00 0.01 0.00 0.00 42.46 39.81 2dkp s ILE 13 CO 0.03 0.56 -0.07 -0.75 0.00 0.00 0.00 174.94 174.70 2dkp s LYS 14 N -0.32 0.71 -0.50 2.79 2.36 -1.26 -4.98 119.74 118.55 2dkp s LYS 14 Ca 0.05 -0.23 -0.28 0.00 -2.55 0.00 0.00 55.97 52.97 2dkp s LYS 14 Cb -0.12 -0.69 0.00 0.00 -1.05 0.00 0.00 37.83 35.97 2dkp s LYS 14 CO 0.02 0.09 1.54 0.50 1.55 0.00 0.00 175.35 179.05 2dkp s ARG 15 N 0.16 3.27 0.46 4.03 3.52 -1.26 -4.97 118.95 124.15 2dkp s ARG 15 Ca -0.02 0.74 -0.25 0.00 -0.13 0.00 0.00 55.73 56.07 2dkp s ARG 15 Cb -0.07 -4.15 -0.08 0.00 -1.56 0.00 0.00 34.95 29.09 2dkp s ARG 15 CO -0.00 -1.96 1.42 1.21 -0.81 0.00 0.00 175.30 175.16 2dkp s ASN 16 N 5.13 5.83 -0.10 -2.12 2.47 -1.26 -4.96 114.94 119.93 2dkp s ASN 16 Ca 0.61 2.91 -0.26 0.00 0.42 0.00 0.00 52.86 56.54 2dkp s ASN 16 Cb -0.13 -2.65 -0.26 0.00 -1.45 0.00 0.00 41.25 36.75 2dkp s ASN 16 CO 0.27 -1.21 0.87 1.55 -3.72 0.00 0.00 177.10 174.87 2dkp h PRO 17 N 2.26 0.10 -0.57 0.43 0.13 -2.04 -3.30 132.00 129.01 2dkp h PRO 17 Ca -0.51 -0.15 0.11 0.00 -0.87 0.00 0.00 66.00 64.58 2dkp h PRO 17 Cb 1.27 0.05 -0.03 0.00 0.13 0.00 0.00 31.00 32.42 2dkp h PRO 17 CO 0.61 1.02 0.39 -0.91 -0.23 0.00 0.00 178.00 178.88 2dkp h ASN 18 N -0.73 0.27 -3.60 1.44 -0.26 -2.04 -3.43 115.58 107.23 2dkp h ASN 18 Ca -0.04 0.01 -0.56 0.00 -0.56 0.00 0.00 56.30 55.15 2dkp h ASN 18 Cb 1.12 -0.05 0.11 0.00 -1.06 0.00 0.00 38.32 38.45 2dkp h ASN 18 CO 0.04 0.16 0.60 0.00 -1.06 0.00 0.00 177.43 177.17 2dkp n ALA 19 N -2.55 1.67 -2.67 -0.83 0.00 -1.25 -4.94 120.51 109.94 2dkp n ALA 19 Ca 0.10 0.32 -0.42 0.00 0.00 0.00 0.00 53.44 53.44 2dkp n ALA 19 Cb 0.43 -2.32 -0.03 0.00 0.00 0.00 0.00 19.45 17.54 2dkp n ALA 19 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2dkp s PRO 20 N -2.07 4.47 -0.08 0.00 0.04 -1.26 -4.98 135.00 131.11 2dkp s PRO 20 Ca 0.57 1.43 -0.29 0.00 0.04 0.00 0.00 61.00 62.75 2dkp s PRO 20 Cb -0.52 -3.51 -0.02 0.00 0.04 0.00 0.00 34.50 30.50 2dkp s PRO 20 CO 0.61 -0.23 0.95 0.08 0.04 0.00 0.00 177.00 178.46 2dkp s VAL 21 N 1.63 4.84 -0.02 -0.36 1.01 -1.26 -4.23 120.40 122.01 2dkp s VAL 21 Ca 0.50 1.94 -0.19 0.00 0.00 0.00 0.00 61.98 64.24 2dkp s VAL 21 Cb -0.20 -4.27 -0.10 0.00 0.00 0.00 0.00 36.38 31.81 2dkp s VAL 21 CO 0.22 0.07 0.79 0.58 0.00 0.00 0.00 175.10 176.76 2dkp h VAL 22 N 5.00 0.00 -1.95 2.92 2.07 -0.66 -3.48 116.25 120.15 2dkp h VAL 22 Ca -0.34 -0.49 -0.02 0.00 0.82 0.00 0.00 66.70 66.67 2dkp h VAL 22 Cb 1.17 0.00 -0.22 0.00 -1.52 0.00 0.00 31.29 30.72 2dkp h VAL 22 CO 0.82 0.00 0.14 -0.60 0.02 0.00 0.00 177.57 177.95 2dkp s ARG 23 N -3.77 0.77 -0.11 1.57 3.52 -1.13 -5.02 118.95 114.79 2dkp s ARG 23 Ca -0.10 1.00 0.01 0.00 -0.13 0.00 0.00 55.73 56.51 2dkp s ARG 23 Cb 0.01 0.33 0.02 0.00 -1.56 0.00 0.00 34.95 33.75 2dkp s ARG 23 CO 0.30 -0.11 -0.13 -0.98 -0.81 0.00 0.00 175.30 173.57 2dkp s ARG 24 N 0.64 2.00 0.22 5.12 1.70 -1.26 -0.73 118.95 126.64 2dkp s ARG 24 Ca -0.02 -0.47 -0.22 0.00 -0.47 0.00 0.00 55.73 54.55 2dkp s ARG 24 Cb -0.05 -1.77 0.05 0.00 -0.57 0.00 0.00 34.95 32.60 2dkp s ARG 24 CO -0.04 -0.11 0.68 0.20 -1.08 0.00 0.00 175.30 174.94 2dkp s GLY 25 N 1.15 -0.34 -0.85 3.88 0.00 -0.63 -5.02 107.32 105.51 2dkp s GLY 25 Ca -0.04 0.09 -0.25 0.00 0.00 0.00 0.00 44.72 44.51 2dkp s GLY 25 CO -0.03 0.03 1.50 -0.98 0.00 0.00 0.00 173.10 173.62 2dkp s TRP 26 N -3.81 2.23 0.04 1.90 0.52 -1.26 -1.81 118.94 116.74 2dkp s TRP 26 Ca 0.06 -0.14 -0.09 0.00 0.02 0.00 0.00 56.10 55.95 2dkp s TRP 26 Cb -0.04 -4.51 -0.05 0.00 -1.15 0.00 0.00 33.47 27.72 2dkp s TRP 26 CO -0.02 -2.02 0.35 -1.17 0.02 0.00 0.00 176.95 174.10 2dkp s LEU 27 N 6.46 4.37 -0.06 2.99 2.96 -0.83 -4.85 118.68 129.72 2dkp s LEU 27 Ca 0.48 0.72 -0.19 0.00 -0.22 0.00 0.00 54.13 54.92 2dkp s LEU 27 Cb -0.06 -2.80 -0.05 0.00 0.50 0.00 0.00 46.19 43.79 2dkp s LEU 27 CO 0.05 0.23 0.52 -0.31 -1.32 0.00 0.00 176.35 175.52 2dkp s TYR 28 N -1.31 3.60 0.05 5.38 2.02 -1.26 -3.12 117.35 122.71 2dkp s TYR 28 Ca 0.29 1.03 0.07 0.00 -0.37 0.00 0.00 57.07 58.10 2dkp s TYR 28 Cb -0.14 -2.55 -0.03 0.00 -0.40 0.00 0.00 41.96 38.84 2dkp s TYR 28 CO 0.16 0.29 -0.20 0.21 -1.57 0.00 0.00 175.55 174.44 2dkp s LYS 29 N 0.14 1.33 -0.14 -0.62 2.20 -0.98 -3.64 119.74 118.02 2dkp s LYS 29 Ca 0.28 -0.96 -0.28 0.00 -0.36 0.00 0.00 55.97 54.65 2dkp s LYS 29 Cb -0.17 -1.45 -0.01 0.00 -1.51 0.00 0.00 37.83 34.69 2dkp s LYS 29 CO 0.14 0.37 0.95 -1.14 -0.36 0.00 0.00 175.35 175.31 2dkp s GLN 30 N -1.26 4.36 1.32 4.03 0.74 -1.04 -1.73 119.66 126.07 2dkp s GLN 30 Ca 0.07 1.27 -0.18 0.00 0.05 0.00 0.00 55.36 56.57 2dkp s GLN 30 Cb -0.09 -3.57 0.34 0.00 1.10 0.00 0.00 33.01 30.79 2dkp s GLN 30 CO 0.02 -0.37 0.96 -0.51 -0.55 0.00 0.00 175.29 174.85 2dkp s ASP 31 N 1.13 -0.25 -0.29 6.67 1.01 -1.16 -4.80 116.67 118.97 2dkp s ASP 31 Ca 0.44 1.22 0.13 0.00 0.71 0.00 0.00 52.55 55.05 2dkp s ASP 31 Cb -0.17 -1.84 0.47 0.00 1.01 0.00 0.00 42.92 42.39 2dkp s ASP 31 CO 0.14 -4.92 1.14 -1.54 0.21 0.00 0.00 175.17 170.21 2dkp n SER 32 N -5.37 3.60 -3.75 0.27 3.41 -1.26 -4.83 113.62 105.70 2dkp n SER 32 Ca 0.07 -3.12 -0.12 0.00 -0.26 0.00 0.00 58.87 55.44 2dkp n SER 32 Cb 0.57 -0.41 -0.11 0.00 -0.26 0.00 0.00 64.21 64.00 2dkp n SER 32 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 2dkp s THR 33 N -4.34 -0.01 0.00 6.66 -4.23 -1.26 -5.08 115.64 107.38 2dkp s THR 33 Ca 0.41 0.04 0.00 0.00 -1.18 0.00 0.00 61.69 60.96 2dkp s THR 33 Cb 0.38 -0.46 0.00 0.00 1.34 0.00 0.00 72.50 73.76 2dkp s THR 33 CO -0.01 0.02 0.00 0.61 -0.54 0.00 0.00 174.62 174.70 2dkp n GLY 34 N 3.33 1.75 3.77 3.99 0.00 -1.26 -4.36 105.19 112.41 2dkp n GLY 34 Ca -0.17 0.63 -0.39 0.00 0.00 0.00 0.00 46.02 46.09 2dkp n GLY 34 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 2dkp s MET 35 N 0.00 4.42 -0.83 1.61 0.00 -1.26 -5.00 119.30 118.24 2dkp s MET 35 Ca 0.00 1.82 -0.06 0.00 0.00 0.00 0.00 55.69 57.45 2dkp s MET 35 Cb 0.00 -2.98 0.21 0.00 0.00 0.00 0.00 34.83 32.07 2dkp s MET 35 CO 0.00 0.01 0.73 0.15 0.00 0.00 0.00 175.02 175.90 2dkp s LYS 36 N -1.81 3.28 0.50 3.16 3.01 -1.26 -4.77 119.74 121.84 2dkp s LYS 36 Ca 0.49 -2.88 0.05 0.00 -1.01 0.00 0.00 55.97 52.62 2dkp s LYS 36 Cb -0.31 -4.08 0.05 0.00 -1.01 0.00 0.00 37.83 32.48 2dkp s LYS 36 CO 0.40 -1.24 0.42 1.28 0.51 0.00 0.00 175.35 176.72 2dkp n LEU 37 N 3.07 0.00 -4.56 3.17 4.77 -1.26 -4.88 117.00 117.31 2dkp n LEU 37 Ca 0.16 -2.55 -0.40 0.00 -0.03 0.00 0.00 56.01 53.20 2dkp n LEU 37 Cb 0.40 -0.09 -0.10 0.00 -2.33 0.00 0.00 43.42 41.30 2dkp n LEU 37 CO 0.36 -0.58 -0.04 0.26 -1.33 0.00 0.00 177.39 176.06 2dkp s TRP 38 N -2.44 3.22 0.05 -1.77 0.52 -1.26 -3.00 118.94 114.26 2dkp s TRP 38 Ca 0.32 0.02 -0.00 0.00 0.02 0.00 0.00 56.10 56.46 2dkp s TRP 38 Cb -0.03 -2.55 -0.04 0.00 -1.15 0.00 0.00 33.47 29.71 2dkp s TRP 38 CO 0.20 -0.33 0.19 0.15 0.02 0.00 0.00 176.95 177.18 2dkp s LYS 39 N 1.90 3.37 -0.28 4.98 -0.14 -0.71 -4.89 119.74 123.97 2dkp s LYS 39 Ca 0.10 -0.45 -0.19 0.00 -1.36 0.00 0.00 55.97 54.07 2dkp s LYS 39 Cb -0.17 -3.01 -0.02 0.00 -1.68 0.00 0.00 37.83 32.96 2dkp s LYS 39 CO 0.11 0.62 0.58 0.21 -0.76 0.00 0.00 175.35 176.11 2dkp s LYS 40 N -2.38 3.97 0.04 1.68 2.47 -1.26 -2.33 119.74 121.94 2dkp s LYS 40 Ca 0.33 0.32 -0.04 0.00 -1.56 0.00 0.00 55.97 55.01 2dkp s LYS 40 Cb -0.13 -3.69 -0.02 0.00 -1.46 0.00 0.00 37.83 32.53 2dkp s LYS 40 CO 0.25 -0.47 0.06 1.03 0.16 0.00 0.00 175.35 176.38 2dkp s ARG 41 N 2.47 0.58 -0.38 4.03 1.81 -1.18 -5.04 118.95 121.24 2dkp s ARG 41 Ca 0.23 -0.84 -0.25 0.00 -1.72 0.00 0.00 55.73 53.15 2dkp s ARG 41 Cb -0.15 0.22 0.01 0.00 -0.45 0.00 0.00 34.95 34.58 2dkp s ARG 41 CO 0.10 -0.14 0.87 -0.46 -0.68 0.00 0.00 175.30 174.99 2dkp s TRP 42 N -2.83 3.07 -0.00 -0.53 -0.00 -1.26 -1.97 118.94 115.43 2dkp s TRP 42 Ca -0.03 0.63 0.03 0.00 -0.00 0.00 0.00 56.10 56.74 2dkp s TRP 42 Cb 0.00 -3.59 -0.03 0.00 -0.00 0.00 0.00 33.47 29.85 2dkp s TRP 42 CO -0.06 -0.82 -0.09 -0.06 -0.00 0.00 0.00 176.95 175.92 2dkp s PHE 43 N 3.36 2.84 -0.03 5.86 0.08 -0.75 -2.64 117.98 126.70 2dkp s PHE 43 Ca 0.35 -0.07 0.02 0.00 0.12 0.00 0.00 56.93 57.36 2dkp s PHE 43 Cb -0.12 -1.60 0.01 0.00 -0.57 0.00 0.00 43.02 40.73 2dkp s PHE 43 CO 0.19 0.34 -0.08 0.08 -0.10 0.00 0.00 175.22 175.65 2dkp s VAL 44 N -0.95 0.73 -0.48 -0.44 1.01 0.84 -1.60 120.40 119.50 2dkp s VAL 44 Ca 0.16 -0.32 -0.08 0.00 0.00 0.00 0.00 61.98 61.74 2dkp s VAL 44 Cb -0.11 -0.66 0.12 0.00 0.00 0.00 0.00 36.38 35.73 2dkp s VAL 44 CO 0.06 0.24 0.35 -0.22 0.00 0.00 0.00 175.10 175.53 2dkp s LEU 45 N 0.28 5.67 -0.02 3.92 1.98 0.09 -1.74 118.68 128.86 2dkp s LEU 45 Ca -0.04 -1.99 -0.04 0.00 -2.89 0.00 0.00 54.13 49.17 2dkp s LEU 45 Cb -0.09 -1.99 0.00 0.00 0.66 0.00 0.00 46.19 44.77 2dkp s LEU 45 CO 0.00 -0.66 0.09 -0.55 -1.89 0.00 0.00 176.35 173.34 2dkp s SER 46 N 2.49 -0.01 -1.36 3.68 0.15 -1.06 0.17 113.70 117.76 2dkp s SER 46 Ca 0.07 -0.02 -0.08 0.00 0.70 0.00 0.00 55.95 56.62 2dkp s SER 46 Cb -0.25 0.19 0.02 0.00 -1.71 0.00 0.00 66.02 64.27 2dkp s SER 46 CO -0.01 -0.17 1.07 -0.67 1.20 0.00 0.00 173.24 174.66 2dkp n ASP 47 N 2.36 -4.82 -4.18 5.45 2.03 -1.26 -2.03 116.55 114.10 2dkp n ASP 47 Ca -0.17 -0.63 -0.33 0.00 0.52 0.00 0.00 54.79 54.18 2dkp n ASP 47 Cb 0.58 -4.74 -0.04 0.00 -0.72 0.00 0.00 41.12 36.20 2dkp n ASP 47 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 2dkp n LEU 48 N -4.72 -1.71 -3.76 -2.67 4.77 -1.26 -4.93 117.00 102.72 2dkp n LEU 48 Ca -0.07 -1.06 -0.10 0.00 -0.03 0.00 0.00 56.01 54.75 2dkp n LEU 48 Cb 0.58 -2.03 -0.05 0.00 -2.33 0.00 0.00 43.42 39.59 2dkp n LEU 48 CO 0.67 0.34 0.10 0.00 -1.33 0.00 0.00 177.39 177.17 2dkp s LEU 50 N -2.86 4.03 -0.08 0.00 1.43 -0.27 -2.58 118.68 118.36 2dkp s LEU 50 Ca 0.07 0.23 -0.03 0.00 -1.03 0.00 0.00 54.13 53.37 2dkp s LEU 50 Cb 0.02 -2.00 0.04 0.00 0.03 0.00 0.00 46.19 44.28 2dkp s LEU 50 CO -0.08 0.27 0.16 -0.36 0.23 0.00 0.00 176.35 176.57 2dkp s PHE 51 N -0.20 -0.18 0.29 0.29 0.08 -0.71 -1.44 117.98 116.11 2dkp s PHE 51 Ca 0.09 0.57 0.07 0.00 0.12 0.00 0.00 56.93 57.78 2dkp s PHE 51 Cb -0.12 -0.16 -0.06 0.00 -0.57 0.00 0.00 43.02 42.12 2dkp s PHE 51 CO 0.01 -0.22 -0.07 1.52 -0.10 0.00 0.00 175.22 176.36 2dkp s TYR 52 N 1.72 2.05 0.32 0.36 -0.85 -1.25 -0.11 117.35 119.59 2dkp s TYR 52 Ca -0.03 -0.65 0.06 0.00 -0.52 0.00 0.00 57.07 55.93 2dkp s TYR 52 Cb -0.12 -1.17 -0.03 0.00 0.38 0.00 0.00 41.96 41.02 2dkp s TYR 52 CO -0.06 0.35 0.28 0.71 -1.52 0.00 0.00 175.55 175.31 2dkp s TYR 53 N -2.92 1.68 0.17 -3.49 1.51 -1.08 -2.96 117.35 110.25 2dkp s TYR 53 Ca 0.30 -1.63 -0.15 0.00 -1.01 0.00 0.00 57.07 54.59 2dkp s TYR 53 Cb 0.03 -0.67 0.09 0.00 -0.11 0.00 0.00 41.96 41.30 2dkp s TYR 53 CO 0.13 -0.87 1.77 0.00 -1.11 0.00 0.00 175.55 175.47 2dkp h ARG 54 N 2.17 0.39 0.00 -0.62 3.08 -1.81 -3.37 114.38 114.22 2dkp h ARG 54 Ca -0.26 -0.02 -0.22 0.00 0.07 0.00 0.00 59.98 59.55 2dkp h ARG 54 Cb 1.23 -0.09 -0.05 0.00 0.08 0.00 0.00 29.97 31.15 2dkp h ARG 54 CO 0.38 0.26 -0.04 -0.25 -1.07 0.00 0.00 179.97 179.25 2dkp n ASP 55 N -4.94 -1.65 0.25 7.04 9.92 -1.26 -4.77 116.55 121.15 2dkp n ASP 55 Ca 0.03 -2.87 0.12 0.00 -0.53 0.00 0.00 54.79 51.54 2dkp n ASP 55 Cb 0.12 2.96 0.65 0.00 -0.64 0.00 0.00 41.12 44.21 2dkp n ASP 55 CO 0.00 0.00 0.00 1.05 0.13 0.00 0.00 177.20 178.38 2dkp h GLU 56 N 0.00 0.00 -0.18 -1.24 9.09 -1.96 -0.30 114.58 120.00 2dkp h GLU 56 Ca -0.30 0.00 0.05 0.00 0.05 0.00 0.00 59.36 59.17 2dkp h GLU 56 Cb 1.23 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 28.33 2dkp h GLU 56 CO 0.39 0.00 0.21 0.87 0.05 0.00 0.00 179.01 180.54 2dkp h LYS 57 N 0.00 0.00 -5.81 1.06 1.79 -1.97 -3.45 116.57 108.18 2dkp h LYS 57 Ca 0.00 0.00 -0.39 0.00 -2.18 0.00 0.00 60.65 58.08 2dkp h LYS 57 Cb 0.52 0.00 0.14 0.00 -1.58 0.00 0.00 32.23 31.31 2dkp h LYS 57 CO 0.00 0.00 -0.68 0.39 -1.08 0.00 0.00 179.45 178.08 2dkp n GLU 58 N -3.75 -7.90 -3.12 3.15 1.02 -0.12 -4.94 120.64 104.98 2dkp n GLU 58 Ca 0.02 0.83 -0.45 0.00 -0.02 0.00 0.00 57.16 57.53 2dkp n GLU 58 Cb 0.33 -5.87 -0.04 0.00 -0.02 0.00 0.00 31.44 25.84 2dkp n GLU 58 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 2dkp s GLU 59 N -6.27 3.11 0.36 3.49 2.02 -1.26 -4.88 118.70 115.27 2dkp s GLU 59 Ca 0.56 -1.43 0.00 0.00 0.02 0.00 0.00 54.97 54.12 2dkp s GLU 59 Cb -0.25 -4.32 0.00 0.00 0.10 0.00 0.00 34.13 29.66 2dkp s GLU 59 CO 0.73 -1.54 0.00 0.41 0.02 0.00 0.00 175.26 174.88 2dkp n GLY 60 N 5.21 -4.52 3.66 -1.39 0.00 -1.26 -4.58 105.19 102.31 2dkp n GLY 60 Ca -0.06 -0.66 -0.41 0.00 0.00 0.00 0.00 46.02 44.89 2dkp n GLY 60 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2dkp s ILE 61 N -2.44 4.95 0.25 -0.61 1.01 -1.26 -4.33 121.20 118.77 2dkp s ILE 61 Ca 0.00 1.36 0.01 0.00 0.00 0.00 0.00 60.65 62.02 2dkp s ILE 61 Cb 0.00 -4.02 0.02 0.00 0.01 0.00 0.00 42.46 38.47 2dkp s ILE 61 CO 0.00 0.05 1.64 -0.07 0.00 0.00 0.00 174.94 176.56 2dkp h LEU 62 N 8.46 0.52 -7.00 2.97 3.38 -1.87 -3.46 115.31 118.32 2dkp h LEU 62 Ca -0.29 -0.21 0.06 0.00 0.09 0.00 0.00 57.88 57.53 2dkp h LEU 62 Cb 1.13 -0.15 -0.26 0.00 0.09 0.00 0.00 40.66 41.48 2dkp h LEU 62 CO 0.81 0.84 0.47 -0.83 0.09 0.00 0.00 178.44 179.81 2dkp s GLY 63 N -4.05 -0.17 0.08 0.83 0.00 -1.26 -5.12 107.32 97.63 2dkp s GLY 63 Ca -0.07 2.58 0.03 0.00 0.00 0.00 0.00 44.72 47.26 2dkp s GLY 63 CO 0.81 1.71 0.10 -1.35 0.00 0.00 0.00 173.10 174.37 2dkp s SER 64 N 0.02 5.62 -0.10 1.64 1.04 -1.26 -3.76 113.70 116.90 2dkp s SER 64 Ca 0.02 0.01 0.00 0.00 0.48 0.00 0.00 55.95 56.47 2dkp s SER 64 Cb -0.04 -1.53 0.02 0.00 0.10 0.00 0.00 66.02 64.57 2dkp s SER 64 CO -0.05 0.17 -0.08 -0.63 0.98 0.00 0.00 173.24 173.63 2dkp s ILE 65 N -1.42 1.01 -0.42 -1.02 1.01 -0.52 -5.03 121.20 114.81 2dkp s ILE 65 Ca 0.30 -0.31 -0.28 0.00 0.00 0.00 0.00 60.65 60.36 2dkp s ILE 65 Cb -0.12 -1.01 0.02 0.00 0.01 0.00 0.00 42.46 41.36 2dkp s ILE 65 CO 0.23 0.36 1.06 -0.76 0.00 0.00 0.00 174.94 175.82 2dkp s LEU 66 N 1.50 3.81 0.09 2.97 2.01 -1.26 -1.11 118.68 126.69 2dkp s LEU 66 Ca 0.01 0.55 -0.16 0.00 0.01 0.00 0.00 54.13 54.54 2dkp s LEU 66 Cb -0.13 -3.45 -0.09 0.00 0.01 0.00 0.00 46.19 42.54 2dkp s LEU 66 CO -0.06 -1.08 1.44 -0.07 1.01 0.00 0.00 176.35 177.59 2dkp h LEU 67 N 10.70 0.62 -1.51 1.79 3.38 -1.90 -3.00 115.31 125.39 2dkp h LEU 67 Ca -0.23 -0.43 0.13 0.00 0.09 0.00 0.00 57.88 57.45 2dkp h LEU 67 Cb 1.07 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 41.63 2dkp h LEU 67 CO 1.07 0.91 0.70 -0.65 0.09 0.00 0.00 178.44 180.56 2dkp h PRO 68 N 0.33 0.00 0.00 1.13 0.11 -1.78 0.82 132.00 132.60 2dkp h PRO 68 Ca 0.06 0.00 -0.18 0.00 0.11 0.00 0.00 66.00 65.99 2dkp h PRO 68 Cb 0.69 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 31.77 2dkp h PRO 68 CO 0.05 0.00 -1.62 0.45 -0.21 0.00 0.00 178.00 176.67 2dkp n SER 69 N -3.28 0.64 -4.89 -2.05 2.88 -1.14 -4.82 113.62 100.96 2dkp n SER 69 Ca 0.09 0.28 -0.29 0.00 -1.33 0.00 0.00 58.87 57.62 2dkp n SER 69 Cb 0.87 0.48 0.02 0.00 -0.75 0.00 0.00 64.21 64.84 2dkp n SER 69 CO 0.00 0.00 0.00 -0.36 -1.23 0.00 0.00 175.04 173.45 2dkp s PHE 70 N -2.93 3.46 -0.24 0.66 0.08 0.28 -4.54 117.98 114.76 2dkp s PHE 70 Ca -0.05 0.99 0.00 0.00 0.12 0.00 0.00 56.93 58.00 2dkp s PHE 70 Cb 0.09 -2.72 0.06 0.00 -0.57 0.00 0.00 43.02 39.88 2dkp s PHE 70 CO 0.82 -0.76 -0.04 -1.14 -0.10 0.00 0.00 175.22 174.01 2dkp s GLN 71 N -5.09 1.52 -0.29 0.44 0.74 -0.09 -4.76 119.66 112.13 2dkp s GLN 71 Ca 0.54 -0.97 -0.29 0.00 0.05 0.00 0.00 55.36 54.69 2dkp s GLN 71 Cb -0.11 -2.55 0.01 0.00 1.10 0.00 0.00 33.01 31.47 2dkp s GLN 71 CO 0.50 -0.62 1.05 0.42 -0.55 0.00 0.00 175.29 176.09 2dkp s ILE 72 N 1.43 4.58 -0.09 -2.34 -1.09 -1.26 -2.03 121.20 120.39 2dkp s ILE 72 Ca -0.05 1.83 -0.08 0.00 -2.23 0.00 0.00 60.65 60.12 2dkp s ILE 72 Cb -0.19 -4.37 0.03 0.00 -1.58 0.00 0.00 42.46 36.35 2dkp s ILE 72 CO -0.07 -0.36 0.25 0.00 -1.23 0.00 0.00 174.94 173.53 2dkp s ALA 73 N 3.47 -0.61 0.32 9.38 0.00 -1.07 -5.05 121.76 128.21 2dkp s ALA 73 Ca 0.45 0.73 -0.29 0.00 0.00 0.00 0.00 51.96 52.85 2dkp s ALA 73 Cb -0.13 -0.43 -0.12 0.00 0.00 0.00 0.00 23.12 22.44 2dkp s ALA 73 CO 0.12 -0.13 1.48 1.28 0.00 0.00 0.00 175.76 178.51 2dkp n LEU 74 N 3.10 4.13 -4.38 0.00 7.99 -1.26 -3.18 117.00 123.40 2dkp n LEU 74 Ca -0.14 1.18 -0.35 0.00 -0.01 0.00 0.00 56.01 56.68 2dkp n LEU 74 Cb 0.58 -1.56 0.08 0.00 -0.11 0.00 0.00 43.42 42.41 2dkp n LEU 74 CO 0.18 -0.06 -0.19 0.18 -1.51 0.00 0.00 177.39 175.98 2dkp n LEU 75 N 1.44 -0.59 -4.36 2.23 4.77 -1.26 -4.92 117.00 114.32 2dkp n LEU 75 Ca 0.06 0.46 -0.24 0.00 -0.03 0.00 0.00 56.01 56.27 2dkp n LEU 75 Cb 0.36 -1.14 -0.12 0.00 -2.33 0.00 0.00 43.42 40.20 2dkp n LEU 75 CO 0.63 -3.73 -0.51 0.28 -1.33 0.00 0.00 177.39 172.74 2dkp s THR 76 N -2.08 2.02 0.22 -5.08 -1.32 -1.26 -5.02 115.64 103.12 2dkp s THR 76 Ca 0.59 -1.93 -0.03 0.00 -1.21 0.00 0.00 61.69 59.12 2dkp s THR 76 Cb -0.29 -1.93 0.33 0.00 -1.51 0.00 0.00 72.50 69.10 2dkp s THR 76 CO 0.64 -0.21 1.17 -0.24 -2.21 0.00 0.00 174.62 173.77 2dkp n SER 77 N 0.36 -0.19 -0.34 8.08 2.88 -1.26 0.52 113.62 123.67 2dkp n SER 77 Ca -0.14 1.28 -0.04 0.00 -1.33 0.00 0.00 58.87 58.64 2dkp n SER 77 Cb 0.56 -0.42 0.00 0.00 -0.75 0.00 0.00 64.21 63.60 2dkp n SER 77 CO 0.00 0.00 0.00 -0.08 -1.23 0.00 0.00 175.04 173.73 2dkp h GLU 78 N 0.00 -0.05 -4.53 -1.46 4.81 -2.01 -3.41 114.58 107.92 2dkp h GLU 78 Ca 0.40 0.00 -0.57 0.00 -0.13 0.00 0.00 59.36 59.06 2dkp h GLU 78 Cb 0.72 0.01 0.05 0.00 0.63 0.00 0.00 28.75 30.16 2dkp h GLU 78 CO -0.74 -0.04 -0.07 -0.40 -0.73 0.00 0.00 179.01 177.04 2dkp n ASP 79 N -5.42 -0.24 -2.06 1.04 5.68 0.18 -4.80 116.55 110.93 2dkp n ASP 79 Ca 0.07 0.87 -0.23 0.00 -0.50 0.00 0.00 54.79 55.00 2dkp n ASP 79 Cb 0.37 -0.70 0.11 0.00 -1.14 0.00 0.00 41.12 39.75 2dkp n ASP 79 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2dkp n HIS 80 N 0.85 2.50 -4.75 2.11 -0.00 -1.26 -4.91 115.22 109.74 2dkp n HIS 80 Ca 0.15 -2.06 -0.33 0.00 -0.00 0.00 0.00 57.72 55.47 2dkp n HIS 80 Cb 0.09 -1.02 -0.13 0.00 -0.00 0.00 0.00 29.99 28.94 2dkp n HIS 80 CO 0.00 0.00 0.00 0.42 -0.00 0.00 0.00 176.34 176.76 2dkp s ILE 81 N -3.18 3.32 -0.53 0.61 1.01 -1.26 -5.02 121.20 116.14 2dkp s ILE 81 Ca 0.48 -0.61 0.02 0.00 0.00 0.00 0.00 60.65 60.54 2dkp s ILE 81 Cb 0.39 -2.35 0.44 0.00 0.01 0.00 0.00 42.46 40.95 2dkp s ILE 81 CO 0.04 0.57 1.63 -3.20 0.00 0.00 0.00 174.94 173.98 2dkp n ASN 82 N 2.58 6.35 -5.02 3.58 2.85 -1.26 -5.01 115.26 119.34 2dkp n ASN 82 Ca -0.18 -3.77 -0.21 0.00 -0.11 0.00 0.00 54.58 50.31 2dkp n ASN 82 Cb 0.53 -0.70 0.06 0.00 1.24 0.00 0.00 39.78 40.90 2dkp n ASN 82 CO 0.00 0.00 0.00 -0.13 -2.11 0.00 0.00 177.26 175.02 2dkp s ARG 83 N -3.75 2.24 0.16 1.20 3.00 -1.26 -5.14 118.95 115.41 2dkp s ARG 83 Ca 0.56 -1.76 0.07 0.00 0.00 0.00 0.00 55.73 54.61 2dkp s ARG 83 Cb 0.45 -2.54 -0.04 0.00 0.00 0.00 0.00 34.95 32.82 2dkp s ARG 83 CO -0.06 -0.89 -0.15 0.15 0.00 0.00 0.00 175.30 174.35 2dkp s LYS 84 N -4.64 1.19 -1.65 3.54 1.02 -1.26 -4.78 119.74 113.16 2dkp s LYS 84 Ca 0.57 -1.43 -0.14 0.00 0.02 0.00 0.00 55.97 54.99 2dkp s LYS 84 Cb -0.05 -1.03 0.12 0.00 -0.52 0.00 0.00 37.83 36.35 2dkp s LYS 84 CO 0.36 0.18 0.69 0.66 -0.92 0.00 0.00 175.35 176.32 2dkp n TYR 85 N 0.06 -1.70 -4.79 3.18 4.01 -1.26 -4.53 117.16 112.13 2dkp n TYR 85 Ca -0.12 0.78 -0.30 0.00 -0.16 0.00 0.00 57.90 58.10 2dkp n TYR 85 Cb 0.59 -3.08 -0.14 0.00 -0.31 0.00 0.00 39.34 36.40 2dkp n TYR 85 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2dkp s ALA 86 N -3.46 2.35 0.43 -0.72 0.00 -1.26 -3.41 121.76 115.68 2dkp s ALA 86 Ca 0.57 -1.28 0.03 0.00 0.00 0.00 0.00 51.96 51.29 2dkp s ALA 86 Cb -0.31 -0.52 -0.01 0.00 0.00 0.00 0.00 23.12 22.27 2dkp s ALA 86 CO 0.93 0.54 0.12 1.97 0.00 0.00 0.00 175.76 179.32 2dkp n PHE 87 N 1.61 0.30 -3.86 0.00 -1.74 0.26 -4.17 117.46 109.87 2dkp n PHE 87 Ca -0.17 -2.61 -0.11 0.00 -0.56 0.00 0.00 57.45 53.99 2dkp n PHE 87 Cb 0.52 -0.06 -0.11 0.00 1.52 0.00 0.00 39.48 41.36 2dkp n PHE 87 CO 0.00 0.00 0.00 -1.59 -0.56 0.00 0.00 176.76 174.61 2dkp s LYS 88 N -3.60 0.40 -0.13 3.97 -2.85 -1.19 -1.64 119.74 114.69 2dkp s LYS 88 Ca 0.18 -0.23 0.01 0.00 -1.00 0.00 0.00 55.97 54.93 2dkp s LYS 88 Cb 0.01 0.17 -0.01 0.00 -2.06 0.00 0.00 37.83 35.94 2dkp s LYS 88 CO 0.12 -0.09 -0.17 0.00 0.10 0.00 0.00 175.35 175.32 2dkp s ALA 89 N -0.98 2.46 -0.04 0.59 0.00 -0.13 -2.58 121.76 121.08 2dkp s ALA 89 Ca -0.11 -0.95 -0.09 0.00 0.00 0.00 0.00 51.96 50.81 2dkp s ALA 89 Cb -0.06 -1.10 -0.05 0.00 0.00 0.00 0.00 23.12 21.91 2dkp s ALA 89 CO 0.01 0.18 0.25 0.00 0.00 0.00 0.00 175.76 176.20 2dkp s ALA 90 N 0.48 3.83 -0.00 0.00 0.00 -0.86 -0.01 121.76 125.19 2dkp s ALA 90 Ca -0.12 -0.52 0.02 0.00 0.00 0.00 0.00 51.96 51.34 2dkp s ALA 90 Cb -0.16 -2.10 -0.00 0.00 0.00 0.00 0.00 23.12 20.85 2dkp s ALA 90 CO 0.05 0.60 -0.05 -1.58 0.00 0.00 0.00 175.76 174.78 2dkp s HIS 91 N -1.15 0.49 -0.06 0.00 2.46 -1.24 -0.91 115.29 114.89 2dkp s HIS 91 Ca 0.22 -0.10 -0.26 0.00 0.47 0.00 0.00 55.06 55.39 2dkp s HIS 91 Cb -0.14 -0.32 -0.22 0.00 -0.13 0.00 0.00 32.58 31.78 2dkp s HIS 91 CO 0.11 -0.01 1.07 -1.00 -2.47 0.00 0.00 174.74 172.44 2dkp h PRO 92 N 5.98 0.09 -0.39 2.88 0.13 -1.91 -3.25 132.00 135.53 2dkp h PRO 92 Ca -0.28 -0.08 0.00 0.00 -0.87 0.00 0.00 66.00 64.77 2dkp h PRO 92 Cb 1.19 0.02 0.00 0.00 0.13 0.00 0.00 31.00 32.34 2dkp h PRO 92 CO 0.50 0.78 0.00 0.09 -0.23 0.00 0.00 178.00 179.14 2dkp n ASN 93 N -4.65 2.06 -2.28 1.44 3.02 -1.26 -4.91 115.26 108.68 2dkp n ASN 93 Ca -0.09 -2.01 -0.09 0.00 -0.03 0.00 0.00 54.58 52.35 2dkp n ASN 93 Cb 0.40 -0.26 -0.02 0.00 -0.61 0.00 0.00 39.78 39.29 2dkp n ASN 93 CO 0.00 0.00 0.00 0.23 -2.62 0.00 0.00 177.26 174.87 2dkp n MET 94 N 0.60 0.45 -2.07 3.52 2.81 -1.23 -5.18 117.12 116.02 2dkp n MET 94 Ca 0.13 -1.80 -0.17 0.00 -1.81 0.00 0.00 57.70 54.04 2dkp n MET 94 Cb 0.33 1.73 0.09 0.00 -0.71 0.00 0.00 33.22 34.66 2dkp n MET 94 CO 0.00 0.00 0.00 2.89 1.51 0.00 0.00 175.97 180.37 2dkp n ARG 95 N -0.37 0.10 -3.15 0.03 1.85 -1.26 -4.26 116.66 109.59 2dkp n ARG 95 Ca 0.00 -2.02 -0.39 0.00 -1.00 0.00 0.00 57.85 54.44 2dkp n ARG 95 Cb 0.38 -0.48 -0.06 0.00 -1.05 0.00 0.00 32.46 31.25 2dkp n ARG 95 CO 0.00 0.00 0.00 0.99 -0.01 0.00 0.00 177.63 178.61 2dkp s THR 96 N -2.20 5.07 0.41 8.89 2.01 -1.26 -3.67 115.64 124.89 2dkp s THR 96 Ca 0.49 1.19 0.00 0.00 0.31 0.00 0.00 61.69 63.68 2dkp s THR 96 Cb -0.03 -3.93 -0.02 0.00 0.01 0.00 0.00 72.50 68.53 2dkp s THR 96 CO 0.32 0.20 0.62 -0.31 -0.69 0.00 0.00 174.62 174.77 2dkp s TYR 97 N 1.29 3.35 -0.06 4.92 1.51 0.98 -4.88 117.35 124.47 2dkp s TYR 97 Ca 0.30 0.30 0.00 0.00 -1.01 0.00 0.00 57.07 56.66 2dkp s TYR 97 Cb -0.16 -2.14 0.02 0.00 -0.11 0.00 0.00 41.96 39.57 2dkp s TYR 97 CO 0.12 -0.16 -0.03 0.71 -1.11 0.00 0.00 175.55 175.08 2dkp s TYR 98 N -2.46 0.77 -0.03 2.71 1.51 -1.26 -0.96 117.35 117.64 2dkp s TYR 98 Ca 0.45 -0.23 0.04 0.00 -1.01 0.00 0.00 57.07 56.31 2dkp s TYR 98 Cb -0.10 -0.74 -0.00 0.00 -0.11 0.00 0.00 41.96 41.01 2dkp s TYR 98 CO 0.37 -0.25 -0.13 -0.06 -1.11 0.00 0.00 175.55 174.38 2dkp s PHE 99 N 1.25 1.27 0.13 2.71 0.08 -0.65 -2.49 117.98 120.27 2dkp s PHE 99 Ca -0.06 -0.31 0.01 0.00 0.12 0.00 0.00 56.93 56.69 2dkp s PHE 99 Cb -0.14 -0.86 -0.04 0.00 -0.57 0.00 0.00 43.02 41.41 2dkp s PHE 99 CO -0.02 -0.10 -0.01 0.00 -0.10 0.00 0.00 175.22 174.99 2dkp s THR 101 N -3.76 0.74 0.05 0.00 -4.23 -1.22 -4.04 115.64 103.19 2dkp s THR 101 Ca 0.18 -2.00 -0.12 0.00 -1.18 0.00 0.00 61.69 58.57 2dkp s THR 101 Cb 0.06 -2.43 -0.33 0.00 1.34 0.00 0.00 72.50 71.14 2dkp s THR 101 CO -0.01 0.00 1.06 0.44 -0.54 0.00 0.00 174.62 175.57 2dkp h ASP 102 N 1.84 0.71 -4.57 3.99 3.32 -1.92 -3.47 116.42 116.31 2dkp h ASP 102 Ca -0.37 -0.75 -0.26 0.00 0.02 0.00 0.00 57.03 55.67 2dkp h ASP 102 Cb 1.27 -0.23 -0.15 0.00 0.22 0.00 0.00 39.33 40.44 2dkp h ASP 102 CO 0.60 1.59 -0.68 0.42 -1.72 0.00 0.00 179.24 179.45 2dkp s THR 103 N -2.64 0.67 0.54 0.35 -4.23 -1.26 -5.03 115.64 104.04 2dkp s THR 103 Ca -0.07 -1.96 0.26 0.00 -1.18 0.00 0.00 61.69 58.74 2dkp s THR 103 Cb 0.05 -1.94 0.41 0.00 1.34 0.00 0.00 72.50 72.36 2dkp s THR 103 CO 0.93 -0.64 1.98 1.23 -0.54 0.00 0.00 174.62 177.58 2dkp h GLY 104 N 2.81 0.00 0.39 3.99 0.00 -1.92 -2.75 103.07 105.59 2dkp h GLY 104 Ca -0.36 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 46.95 2dkp h GLY 104 CO 0.63 0.00 -0.19 1.70 0.00 0.00 0.00 176.54 178.68 2dkp h LYS 105 N 0.00 -0.51 -0.52 4.80 3.11 -1.99 -1.27 116.57 120.19 2dkp h LYS 105 Ca 0.27 0.03 0.15 0.00 -2.81 0.00 0.00 60.65 58.29 2dkp h LYS 105 Cb 1.10 0.12 -0.02 0.00 -1.00 0.00 0.00 32.23 32.43 2dkp h LYS 105 CO -0.00 -0.34 0.96 0.93 -2.81 0.00 0.00 179.45 178.18 2dkp h GLU 106 N -0.71 0.00 0.08 1.90 5.08 -1.91 0.74 114.58 119.76 2dkp h GLU 106 Ca -0.05 0.00 -0.23 0.00 -1.00 0.00 0.00 59.36 58.07 2dkp h GLU 106 Cb 0.41 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.65 2dkp h GLU 106 CO 0.09 0.00 -1.19 1.98 -1.00 0.00 0.00 179.01 178.89 2dkp h MET 107 N 0.00 0.17 -0.79 2.33 4.05 -1.38 -3.18 114.93 116.13 2dkp h MET 107 Ca 0.24 -0.29 0.10 0.00 -0.28 0.00 0.00 59.70 59.48 2dkp h MET 107 Cb 2.15 0.11 -0.05 0.00 -0.80 0.00 0.00 31.60 33.01 2dkp h MET 107 CO -0.00 1.14 0.51 1.05 0.23 0.00 0.00 176.91 179.84 2dkp h GLU 108 N -0.52 0.69 -0.05 0.39 4.11 0.17 0.11 114.58 119.48 2dkp h GLU 108 Ca -0.27 -0.04 -0.02 0.00 0.07 0.00 0.00 59.36 59.10 2dkp h GLU 108 Cb 1.58 -0.16 -0.00 0.00 0.50 0.00 0.00 28.75 30.67 2dkp h GLU 108 CO 0.00 0.46 -0.04 -0.07 0.07 0.00 0.00 179.01 179.43 2dkp h LEU 109 N 0.71 0.12 0.06 3.06 3.38 -1.47 -1.48 115.31 119.69 2dkp h LEU 109 Ca 0.36 -0.47 -0.00 0.00 0.09 0.00 0.00 57.88 57.86 2dkp h LEU 109 Cb 0.45 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.17 2dkp h LEU 109 CO -0.14 0.57 -0.03 -0.50 0.09 0.00 0.00 178.44 178.43 2dkp h TRP 110 N -0.32 -0.07 0.55 1.13 -0.00 -1.39 -2.88 115.95 112.96 2dkp h TRP 110 Ca 0.01 -0.00 -0.02 0.00 -0.00 0.00 0.00 58.89 58.87 2dkp h TRP 110 Cb 0.53 0.02 -0.00 0.00 -0.00 0.00 0.00 29.16 29.71 2dkp h TRP 110 CO 0.09 0.01 -0.34 0.52 -0.00 0.00 0.00 178.44 178.72 2dkp h MET 111 N -0.14 -0.80 -0.80 0.49 2.86 -0.88 0.20 114.93 115.87 2dkp h MET 111 Ca -0.01 0.05 0.29 0.00 -2.06 0.00 0.00 59.70 57.97 2dkp h MET 111 Cb 0.12 0.18 -0.15 0.00 0.06 0.00 0.00 31.60 31.81 2dkp h MET 111 CO 0.01 -0.53 0.26 1.63 1.06 0.00 0.00 176.91 179.34 2dkp n LYS 112 N -4.49 -0.05 0.03 1.72 4.76 -0.56 -0.12 118.16 119.45 2dkp n LYS 112 Ca -0.10 1.14 -0.02 0.00 -2.87 0.00 0.00 58.31 56.45 2dkp n LYS 112 Cb 0.35 -1.94 -0.01 0.00 -1.84 0.00 0.00 35.03 31.58 2dkp n LYS 112 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2dkp h ALA 113 N 1.59 -0.20 -0.88 7.82 0.00 -1.25 -3.11 119.26 123.23 2dkp h ALA 113 Ca 0.60 -0.03 0.13 0.00 0.00 0.00 0.00 54.91 55.60 2dkp h ALA 113 Cb 1.46 0.06 -0.14 0.00 0.00 0.00 0.00 17.79 19.17 2dkp h ALA 113 CO -0.67 -0.19 -0.40 0.52 0.00 0.00 0.00 179.25 178.51 2dkp h MET 114 N -0.76 -0.05 -0.95 0.00 2.86 0.12 0.77 114.93 116.90 2dkp h MET 114 Ca -0.02 0.00 0.16 0.00 -2.06 0.00 0.00 59.70 57.79 2dkp h MET 114 Cb 0.12 0.01 -0.08 0.00 0.06 0.00 0.00 31.60 31.71 2dkp h MET 114 CO 0.03 -0.03 0.60 -0.07 1.06 0.00 0.00 176.91 178.50 2dkp h LEU 115 N -0.05 0.72 -1.97 1.22 -0.00 -0.68 0.33 115.31 114.88 2dkp h LEU 115 Ca 0.29 0.06 -0.01 0.00 -0.00 0.00 0.00 57.88 58.22 2dkp h LEU 115 Cb 0.57 -0.08 -0.00 0.00 -0.00 0.00 0.00 40.66 41.15 2dkp h LEU 115 CO -0.90 0.33 -0.03 -0.78 -0.00 0.00 0.00 178.44 177.06 2dkp h ASP 116 N 0.74 0.00 0.05 -0.43 3.58 0.61 0.73 116.42 121.71 2dkp h ASP 116 Ca 0.50 0.00 -0.27 0.00 0.42 0.00 0.00 57.03 57.69 2dkp h ASP 116 Cb 0.79 0.00 -0.03 0.00 1.72 0.00 0.00 39.33 41.81 2dkp h ASP 116 CO -0.27 0.03 -1.44 0.00 -2.88 0.00 0.00 179.24 174.69 2dkp h ALA 117 N 1.97 0.29 -0.39 -0.78 0.00 0.02 -3.38 119.26 116.99 2dkp h ALA 117 Ca -0.00 -1.23 0.02 0.00 0.00 0.00 0.00 54.91 53.70 2dkp h ALA 117 Cb 0.06 0.69 -0.03 0.00 0.00 0.00 0.00 17.79 18.52 2dkp h ALA 117 CO 0.00 0.86 0.22 0.00 0.00 0.00 0.00 179.25 180.33 2dkp h ALA 118 N -0.29 0.49 -0.91 0.00 0.00 -0.47 -1.56 119.26 116.52 2dkp h ALA 118 Ca -0.36 0.00 0.26 0.00 0.00 0.00 0.00 54.91 54.82 2dkp h ALA 118 Cb 1.54 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 19.20 2dkp h ALA 118 CO -0.10 -0.13 0.77 1.37 0.00 0.00 0.00 179.25 181.16 2dkp h LEU 119 N 0.44 0.00 -9.39 0.00 8.10 -1.04 -3.41 115.31 110.00 2dkp h LEU 119 Ca 0.16 0.00 -0.63 0.00 0.11 0.00 0.00 57.88 57.52 2dkp h LEU 119 Cb 0.03 0.00 0.09 0.00 -0.44 0.00 0.00 40.66 40.34 2dkp h LEU 119 CO -0.09 0.00 0.24 0.52 -4.11 0.00 0.00 178.44 175.00 2dkp n VAL 120 N -3.90 1.26 -3.61 0.15 0.31 -0.59 -4.92 118.33 107.03 2dkp n VAL 120 Ca 0.19 -0.32 -0.37 0.00 -0.01 0.00 0.00 64.34 63.84 2dkp n VAL 120 Cb 1.08 -0.93 -0.06 0.00 -0.91 0.00 0.00 33.84 33.02 2dkp n VAL 120 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2dkp n GLN 121 N 1.45 2.74 -4.35 5.55 6.02 -1.26 -4.83 117.38 122.69 2dkp n GLN 121 Ca 0.13 -4.48 -0.26 0.00 -0.01 0.00 0.00 57.00 52.38 2dkp n GLN 121 Cb 0.27 -2.42 -0.13 0.00 1.02 0.00 0.00 30.24 28.98 2dkp n GLN 121 CO 0.00 0.00 0.00 -0.08 -1.01 0.00 0.00 177.06 175.97 2dkp s THR 122 N -1.40 1.95 0.26 5.09 -1.32 -1.26 -5.12 115.64 113.83 2dkp s THR 122 Ca 0.28 -1.62 -0.30 0.00 -1.21 0.00 0.00 61.69 58.84 2dkp s THR 122 Cb -0.07 -1.74 -0.09 0.00 -1.51 0.00 0.00 72.50 69.08 2dkp s THR 122 CO -0.12 0.01 1.04 -0.44 -2.21 0.00 0.00 174.62 172.90 2dkp s SER 123 N -1.95 7.41 0.00 8.08 0.01 -1.26 -4.95 113.70 121.04 2dkp s SER 123 Ca 0.10 2.15 0.00 0.00 1.31 0.00 0.00 55.95 59.50 2dkp s SER 123 Cb -0.10 -2.62 0.00 0.00 0.21 0.00 0.00 66.02 63.51 2dkp s SER 123 CO 0.05 -0.03 0.00 0.61 0.41 0.00 0.00 173.24 174.28 2dkp n GLY 124 N 1.33 0.08 0.69 3.44 0.00 -1.26 -4.78 105.19 104.69 2dkp n GLY 124 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.01 2dkp n GLY 124 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2dkp n PRO 125 N -2.01 0.99 -3.06 1.61 -0.04 -1.26 -4.78 135.00 126.46 2dkp n PRO 125 Ca 0.00 0.00 -0.16 0.00 -0.04 0.00 0.00 63.50 63.30 2dkp n PRO 125 Cb 0.00 -1.31 0.04 0.00 -0.04 0.00 0.00 33.50 32.19 2dkp n PRO 125 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2dkp n SER 126 N 0.20 -4.93 -4.82 3.54 2.88 -1.26 -5.00 113.62 104.22 2dkp n SER 126 Ca 0.00 -0.30 -0.32 0.00 -1.33 0.00 0.00 58.87 56.92 2dkp n SER 126 Cb 0.34 -3.64 0.01 0.00 -0.75 0.00 0.00 64.21 60.17 2dkp n SER 126 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 2dkp s SER 127 N -3.04 5.95 0.00 -3.46 1.04 -1.26 -5.18 113.70 107.75 2dkp s SER 127 Ca 0.32 1.66 0.00 0.00 0.48 0.00 0.00 55.95 58.41 2dkp s SER 127 Cb -0.14 -2.51 0.00 0.00 0.10 0.00 0.00 66.02 63.47 2dkp s SER 127 CO 0.40 -1.05 0.00 0.61 0.98 0.00 0.00 173.24 174.18