#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 4.78 0.52 1.61 1.04 -1.26 -5.14 113.70 115.26 2dkp s SER 2 Ca 0.00 -0.43 0.01 0.00 0.48 0.00 0.00 55.95 56.01 2dkp s SER 2 Cb 0.00 -1.01 0.02 0.00 0.10 0.00 0.00 66.02 65.13 2dkp s SER 2 CO 0.00 0.07 0.75 -0.44 0.98 0.00 0.00 173.24 174.59 2dkp s SER 3 N -3.12 5.41 0.24 7.02 0.01 -1.26 -5.07 113.70 116.92 2dkp s SER 3 Ca 0.28 0.04 -0.28 0.00 1.31 0.00 0.00 55.95 57.30 2dkp s SER 3 Cb -0.09 -1.01 -0.09 0.00 0.21 0.00 0.00 66.02 65.04 2dkp s SER 3 CO 0.19 -1.04 0.90 -0.83 0.41 0.00 0.00 173.24 172.88 2dkp s GLY 4 N -4.38 3.03 0.17 3.44 0.00 -1.26 -4.96 107.32 103.36 2dkp s GLY 4 Ca 0.55 0.55 -0.24 0.00 0.00 0.00 0.00 44.72 45.58 2dkp s GLY 4 CO 0.38 1.08 0.44 -1.26 0.00 0.00 0.00 173.10 173.74 2dkp n SER 5 N 1.36 -1.10 -3.85 1.64 2.88 -1.26 -4.96 113.62 108.33 2dkp n SER 5 Ca -0.02 0.96 -0.23 0.00 -1.33 0.00 0.00 58.87 58.25 2dkp n SER 5 Cb 0.48 -0.81 -0.17 0.00 -0.75 0.00 0.00 64.21 62.96 2dkp n SER 5 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 2dkp s SER 6 N -0.86 1.54 -0.01 -3.46 1.04 -1.26 -5.14 113.70 105.56 2dkp s SER 6 Ca 0.55 -0.16 0.01 0.00 0.48 0.00 0.00 55.95 56.83 2dkp s SER 6 Cb -0.79 -0.56 0.01 0.00 0.10 0.00 0.00 66.02 64.78 2dkp s SER 6 CO 0.48 -0.12 -0.03 -0.83 0.98 0.00 0.00 173.24 173.72 2dkp s GLY 7 N 1.52 0.20 -0.13 7.32 0.00 -1.26 -5.07 107.32 109.91 2dkp s GLY 7 Ca -0.01 -0.07 -0.07 0.00 0.00 0.00 0.00 44.72 44.57 2dkp s GLY 7 CO -0.04 0.07 -0.14 1.70 0.00 0.00 0.00 173.10 174.69 2dkp h LYS 8 N 6.39 0.00 -5.81 2.90 1.63 -2.05 -3.42 116.57 116.21 2dkp h LYS 8 Ca -0.31 0.00 -0.45 0.00 -0.85 0.00 0.00 60.65 59.04 2dkp h LYS 8 Cb 1.18 0.00 -0.07 0.00 -0.60 0.00 0.00 32.23 32.74 2dkp h LYS 8 CO 0.50 0.00 1.25 1.03 -3.45 0.00 0.00 179.45 178.78 2dkp s ARG 9 N -2.08 3.07 -0.23 1.90 0.52 -1.26 -4.94 118.95 115.93 2dkp s ARG 9 Ca -0.11 -0.96 -0.11 0.00 -0.52 0.00 0.00 55.73 54.03 2dkp s ARG 9 Cb 0.02 -5.26 -0.05 0.00 0.52 0.00 0.00 34.95 30.18 2dkp s ARG 9 CO 0.17 -2.97 0.18 -1.54 0.02 0.00 0.00 175.30 171.16 2dkp s SER 10 N 6.25 6.15 0.14 0.23 1.04 -1.26 -4.99 113.70 121.26 2dkp s SER 10 Ca 0.60 0.16 -0.20 0.00 0.48 0.00 0.00 55.95 56.99 2dkp s SER 10 Cb -0.02 -2.11 0.01 0.00 0.10 0.00 0.00 66.02 63.99 2dkp s SER 10 CO 0.00 0.07 1.68 0.78 0.98 0.00 0.00 173.24 176.75 2dkp h ASN 11 N 7.40 -0.35 -4.47 7.02 4.21 -2.00 -3.42 115.58 123.98 2dkp h ASN 11 Ca -0.38 0.09 -0.49 0.00 1.21 0.00 0.00 56.30 56.72 2dkp h ASN 11 Cb 1.17 0.20 0.08 0.00 -1.12 0.00 0.00 38.32 38.64 2dkp h ASN 11 CO 0.67 -0.14 0.41 -0.94 -1.29 0.00 0.00 177.43 176.15 2dkp s SER 12 N -5.15 5.45 -0.07 5.81 1.04 -1.26 -5.08 113.70 114.44 2dkp s SER 12 Ca -0.14 1.15 0.02 0.00 0.48 0.00 0.00 55.95 57.46 2dkp s SER 12 Cb 0.11 -1.96 -0.03 0.00 0.10 0.00 0.00 66.02 64.25 2dkp s SER 12 CO 0.69 -1.34 -0.11 -0.63 0.98 0.00 0.00 173.24 172.83 2dkp s ILE 13 N -3.34 3.35 -0.03 -1.02 1.01 -1.26 -5.12 121.20 114.78 2dkp s ILE 13 Ca 0.58 -0.60 0.07 0.00 0.00 0.00 0.00 60.65 60.70 2dkp s ILE 13 Cb -0.11 -2.35 -0.02 0.00 0.01 0.00 0.00 42.46 39.99 2dkp s ILE 13 CO 0.52 0.58 -0.25 -0.75 0.00 0.00 0.00 174.94 175.04 2dkp s LYS 14 N -0.56 2.25 0.53 2.79 2.36 -1.26 -5.04 119.74 120.82 2dkp s LYS 14 Ca 0.08 -0.91 -0.22 0.00 -2.55 0.00 0.00 55.97 52.37 2dkp s LYS 14 Cb -0.12 -2.10 -0.05 0.00 -1.05 0.00 0.00 37.83 34.51 2dkp s LYS 14 CO 0.02 0.52 1.31 0.50 1.55 0.00 0.00 175.35 179.25 2dkp s ARG 15 N -0.50 3.29 -0.57 4.03 3.52 -1.26 -4.99 118.95 122.46 2dkp s ARG 15 Ca 0.07 2.12 -0.04 0.00 -0.13 0.00 0.00 55.73 57.75 2dkp s ARG 15 Cb -0.11 -2.29 0.15 0.00 -1.56 0.00 0.00 34.95 31.14 2dkp s ARG 15 CO 0.00 -1.04 0.40 1.21 -0.81 0.00 0.00 175.30 175.06 2dkp s ASN 16 N -1.06 5.37 0.24 -2.12 2.47 -1.26 -4.97 114.94 113.62 2dkp s ASN 16 Ca 0.70 -2.57 -0.09 0.00 0.42 0.00 0.00 52.86 51.31 2dkp s ASN 16 Cb -0.37 -1.88 0.38 0.00 -1.45 0.00 0.00 41.25 37.93 2dkp s ASN 16 CO 0.44 -0.45 1.61 -0.65 -3.72 0.00 0.00 177.10 174.33 2dkp h PRO 17 N 7.43 0.03 -0.45 0.43 0.11 -2.04 0.04 132.00 137.55 2dkp h PRO 17 Ca -0.05 -0.00 0.09 0.00 0.11 0.00 0.00 66.00 66.15 2dkp h PRO 17 Cb 0.99 -0.01 -0.08 0.00 0.11 0.00 0.00 31.00 32.01 2dkp h PRO 17 CO 0.73 0.02 -0.09 -0.91 -0.21 0.00 0.00 178.00 177.53 2dkp h ASN 18 N 0.03 -0.37 -0.33 -2.05 2.35 -2.04 -3.40 115.58 109.76 2dkp h ASN 18 Ca 0.40 0.13 -0.57 0.00 -0.55 0.00 0.00 56.30 55.70 2dkp h ASN 18 Cb 0.65 0.26 -0.06 0.00 0.05 0.00 0.00 38.32 39.23 2dkp h ASN 18 CO -0.78 -0.13 1.61 0.00 -1.65 0.00 0.00 177.43 176.48 2dkp n ALA 19 N -2.75 0.43 -1.57 -0.83 0.00 0.00 -4.73 120.51 111.07 2dkp n ALA 19 Ca 0.04 -0.23 -0.58 0.00 0.00 0.00 0.00 53.44 52.66 2dkp n ALA 19 Cb 0.24 -2.38 -0.08 0.00 0.00 0.00 0.00 19.45 17.23 2dkp n ALA 19 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 2dkp n PRO 20 N 8.31 0.78 -2.30 0.00 -0.02 -1.26 -4.72 135.00 135.78 2dkp n PRO 20 Ca 0.57 0.26 -0.42 0.00 -2.02 0.00 0.00 63.50 61.89 2dkp n PRO 20 Cb 0.10 -2.01 -0.03 0.00 -0.02 0.00 0.00 33.50 31.55 2dkp n PRO 20 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2dkp s VAL 21 N 4.87 3.63 -0.03 -1.45 1.01 -1.26 -4.62 120.40 122.55 2dkp s VAL 21 Ca 1.06 1.21 -0.21 0.00 0.00 0.00 0.00 61.98 64.04 2dkp s VAL 21 Cb -1.15 -3.77 -0.14 0.00 0.00 0.00 0.00 36.38 31.31 2dkp s VAL 21 CO 0.64 0.12 0.92 0.58 0.00 0.00 0.00 175.10 177.35 2dkp h VAL 22 N 4.24 0.56 -1.68 2.92 2.07 -1.35 -3.48 116.25 119.53 2dkp h VAL 22 Ca -0.42 -0.82 0.07 0.00 0.82 0.00 0.00 66.70 66.35 2dkp h VAL 22 Cb 1.21 0.89 -0.25 0.00 -1.52 0.00 0.00 31.29 31.62 2dkp h VAL 22 CO 0.82 0.13 0.30 -0.60 0.02 0.00 0.00 177.57 178.24 2dkp s ARG 23 N -3.79 0.51 -0.13 1.57 3.52 -1.24 -5.05 118.95 114.34 2dkp s ARG 23 Ca -0.12 0.79 0.02 0.00 -0.13 0.00 0.00 55.73 56.29 2dkp s ARG 23 Cb 0.01 0.14 0.01 0.00 -1.56 0.00 0.00 34.95 33.56 2dkp s ARG 23 CO 0.43 -0.09 -0.18 -0.98 -0.81 0.00 0.00 175.30 173.67 2dkp s ARG 24 N 1.13 2.56 0.19 5.12 1.70 -1.26 -2.54 118.95 125.85 2dkp s ARG 24 Ca -0.06 -0.68 -0.21 0.00 -0.47 0.00 0.00 55.73 54.30 2dkp s ARG 24 Cb -0.04 -2.14 0.05 0.00 -0.57 0.00 0.00 34.95 32.25 2dkp s ARG 24 CO -0.13 -0.06 0.60 0.20 -1.08 0.00 0.00 175.30 174.82 2dkp s GLY 25 N 0.97 -0.38 -0.58 3.88 0.00 -1.11 -5.03 107.32 105.07 2dkp s GLY 25 Ca -0.05 0.15 -0.27 0.00 0.00 0.00 0.00 44.72 44.55 2dkp s GLY 25 CO -0.03 0.00 1.88 -0.98 0.00 0.00 0.00 173.10 173.97 2dkp s TRP 26 N -3.81 1.65 0.08 1.90 0.52 -1.26 -2.91 118.94 115.11 2dkp s TRP 26 Ca 0.05 0.82 0.02 0.00 0.02 0.00 0.00 56.10 57.01 2dkp s TRP 26 Cb -0.02 -4.07 -0.04 0.00 -1.15 0.00 0.00 33.47 28.19 2dkp s TRP 26 CO -0.07 -2.36 0.14 -1.17 0.02 0.00 0.00 176.95 173.52 2dkp s LEU 27 N 9.06 4.04 0.08 2.99 2.96 -1.01 -4.91 118.68 131.89 2dkp s LEU 27 Ca 0.70 0.09 -0.03 0.00 -0.22 0.00 0.00 54.13 54.67 2dkp s LEU 27 Cb -0.14 -2.68 -0.05 0.00 0.50 0.00 0.00 46.19 43.83 2dkp s LEU 27 CO 0.22 0.16 0.28 -0.31 -1.32 0.00 0.00 176.35 175.37 2dkp s TYR 28 N -1.48 3.51 0.13 5.38 2.02 -1.25 -2.82 117.35 122.84 2dkp s TYR 28 Ca 0.32 0.42 -0.12 0.00 -0.37 0.00 0.00 57.07 57.32 2dkp s TYR 28 Cb -0.12 -1.89 0.01 0.00 -0.40 0.00 0.00 41.96 39.56 2dkp s TYR 28 CO 0.25 0.54 0.31 0.21 -1.57 0.00 0.00 175.55 175.28 2dkp s LYS 29 N -2.42 1.06 0.61 -0.62 2.20 -1.06 -3.73 119.74 115.78 2dkp s LYS 29 Ca 0.36 -0.96 -0.04 0.00 -0.36 0.00 0.00 55.97 54.97 2dkp s LYS 29 Cb -0.13 0.40 0.03 0.00 -1.51 0.00 0.00 37.83 36.63 2dkp s LYS 29 CO 0.24 -0.39 0.90 -1.14 -0.36 0.00 0.00 175.35 174.60 2dkp s GLN 30 N -3.88 2.60 -0.13 4.03 0.74 -1.12 -0.42 119.66 121.47 2dkp s GLN 30 Ca 0.09 -0.29 -0.03 0.00 0.05 0.00 0.00 55.36 55.18 2dkp s GLN 30 Cb 0.03 -2.30 -0.03 0.00 1.10 0.00 0.00 33.01 31.81 2dkp s GLN 30 CO -0.07 -0.86 -0.04 0.34 -0.55 0.00 0.00 175.29 174.12 2dkp s ASP 31 N -4.40 4.82 0.06 6.67 -1.08 -1.23 -4.88 116.67 116.64 2dkp s ASP 31 Ca 0.56 -0.08 -0.26 0.00 -0.52 0.00 0.00 52.55 52.25 2dkp s ASP 31 Cb -0.11 -1.65 -0.12 0.00 -1.46 0.00 0.00 42.92 39.58 2dkp s ASP 31 CO 0.43 0.22 1.40 0.77 0.52 0.00 0.00 175.17 178.52 2dkp h SER 32 N 6.30 -1.04 -1.88 -0.34 4.64 -1.97 -3.43 113.55 115.83 2dkp h SER 32 Ca -0.36 0.09 -0.44 0.00 -0.47 0.00 0.00 61.79 60.61 2dkp h SER 32 Cb 1.19 0.35 0.04 0.00 -0.31 0.00 0.00 62.40 63.67 2dkp h SER 32 CO 0.60 -0.47 -0.11 0.28 -0.87 0.00 0.00 176.83 176.27 2dkp s THR 33 N -5.04 2.66 0.40 2.95 -1.32 -1.26 -4.98 115.64 109.05 2dkp s THR 33 Ca -0.13 -0.82 0.00 0.00 -1.21 0.00 0.00 61.69 59.54 2dkp s THR 33 Cb 0.03 -2.84 0.00 0.00 -1.51 0.00 0.00 72.50 68.18 2dkp s THR 33 CO 0.43 0.00 0.00 0.61 -2.21 0.00 0.00 174.62 173.45 2dkp n GLY 34 N -2.21 -2.18 2.45 6.08 0.00 -1.26 -4.72 105.19 103.35 2dkp n GLY 34 Ca 0.10 -0.99 -0.38 0.00 0.00 0.00 0.00 46.02 44.74 2dkp n GLY 34 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 173.32 174.47 2dkp n MET 35 N -4.04 0.00 -2.70 1.61 -0.00 -1.26 -4.78 117.12 105.95 2dkp n MET 35 Ca -0.02 0.00 -0.43 0.00 -0.00 0.00 0.00 57.70 57.24 2dkp n MET 35 Cb 0.66 -0.91 0.00 0.00 -0.00 0.00 0.00 33.22 32.98 2dkp n MET 35 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 175.97 177.60 2dkp n LYS 36 N 0.91 3.44 -4.00 3.17 4.01 -1.26 -4.62 118.16 119.82 2dkp n LYS 36 Ca 0.14 -3.69 -0.22 0.00 -0.51 0.00 0.00 58.31 54.02 2dkp n LYS 36 Cb 0.11 -3.03 -0.05 0.00 -0.51 0.00 0.00 35.03 31.55 2dkp n LYS 36 CO 0.00 0.00 0.00 -0.51 -1.11 0.00 0.00 177.40 175.78 2dkp s LEU 37 N 1.10 3.38 -0.53 -0.35 1.43 -1.26 -4.85 118.68 117.60 2dkp s LEU 37 Ca 0.42 -0.67 -0.25 0.00 -1.03 0.00 0.00 54.13 52.60 2dkp s LEU 37 Cb 0.02 -1.91 0.04 0.00 0.03 0.00 0.00 46.19 44.37 2dkp s LEU 37 CO 0.01 -0.32 0.96 0.26 0.23 0.00 0.00 176.35 177.49 2dkp s TRP 38 N -2.38 2.81 -0.11 0.29 0.52 -1.26 -3.57 118.94 115.24 2dkp s TRP 38 Ca 0.39 0.15 -0.13 0.00 0.02 0.00 0.00 56.10 56.53 2dkp s TRP 38 Cb -0.04 -4.09 -0.05 0.00 -1.15 0.00 0.00 33.47 28.14 2dkp s TRP 38 CO 0.24 -1.30 0.30 0.15 0.02 0.00 0.00 176.95 176.36 2dkp s LYS 39 N 4.00 4.04 0.19 4.98 -0.14 0.43 -4.81 119.74 128.44 2dkp s LYS 39 Ca 0.34 0.15 -0.30 0.00 -1.36 0.00 0.00 55.97 54.80 2dkp s LYS 39 Cb -0.11 -3.34 -0.08 0.00 -1.68 0.00 0.00 37.83 32.62 2dkp s LYS 39 CO 0.22 0.44 1.03 0.21 -0.76 0.00 0.00 175.35 176.49 2dkp s LYS 40 N -0.16 4.68 -0.01 1.68 2.20 -1.26 -2.58 119.74 124.30 2dkp s LYS 40 Ca 0.18 1.62 -0.28 0.00 -0.36 0.00 0.00 55.97 57.14 2dkp s LYS 40 Cb -0.14 -3.29 0.06 0.00 -1.51 0.00 0.00 37.83 32.96 2dkp s LYS 40 CO 0.06 0.22 0.62 0.50 -0.36 0.00 0.00 175.35 176.40 2dkp s ARG 41 N -0.61 1.06 -0.24 4.03 6.06 -1.13 -5.03 118.95 123.10 2dkp s ARG 41 Ca 0.46 0.07 -0.29 0.00 -2.50 0.00 0.00 55.73 53.47 2dkp s ARG 41 Cb -0.28 0.50 -0.00 0.00 0.06 0.00 0.00 34.95 35.23 2dkp s ARG 41 CO 0.34 -0.36 1.20 -0.46 -2.50 0.00 0.00 175.30 173.52 2dkp s TRP 42 N -1.70 2.95 0.22 5.12 -0.00 -1.26 -2.41 118.94 121.86 2dkp s TRP 42 Ca -0.09 1.09 0.09 0.00 -0.00 0.00 0.00 56.10 57.20 2dkp s TRP 42 Cb -0.01 -3.59 -0.04 0.00 -0.00 0.00 0.00 33.47 29.83 2dkp s TRP 42 CO 0.05 -1.31 -0.06 -0.06 -0.00 0.00 0.00 176.95 175.56 2dkp s PHE 43 N 3.69 2.64 -0.13 5.86 0.40 -1.14 -2.54 117.98 126.76 2dkp s PHE 43 Ca 0.51 -0.23 -0.07 0.00 -0.60 0.00 0.00 56.93 56.55 2dkp s PHE 43 Cb -0.18 -1.23 0.05 0.00 0.51 0.00 0.00 43.02 42.17 2dkp s PHE 43 CO 0.15 0.57 0.30 0.08 0.70 0.00 0.00 175.22 177.02 2dkp s VAL 44 N -2.01 -0.03 -0.46 -0.44 1.01 -0.04 -2.73 120.40 115.70 2dkp s VAL 44 Ca 0.28 0.12 -0.11 0.00 0.00 0.00 0.00 61.98 62.26 2dkp s VAL 44 Cb -0.08 -0.45 0.09 0.00 0.00 0.00 0.00 36.38 35.94 2dkp s VAL 44 CO 0.17 0.05 0.34 -0.22 0.00 0.00 0.00 175.10 175.44 2dkp s LEU 45 N 1.20 5.51 -0.04 3.92 1.98 -1.05 -1.88 118.68 128.32 2dkp s LEU 45 Ca -0.08 -1.59 -0.13 0.00 -2.89 0.00 0.00 54.13 49.43 2dkp s LEU 45 Cb -0.09 -2.06 0.02 0.00 0.66 0.00 0.00 46.19 44.72 2dkp s LEU 45 CO -0.09 -0.64 0.29 -0.55 -1.89 0.00 0.00 176.35 173.48 2dkp s SER 46 N 2.53 -0.20 -1.56 3.68 0.15 -1.06 -0.89 113.70 116.36 2dkp s SER 46 Ca 0.04 0.18 -0.03 0.00 0.70 0.00 0.00 55.95 56.83 2dkp s SER 46 Cb -0.25 0.37 0.01 0.00 -1.71 0.00 0.00 66.02 64.45 2dkp s SER 46 CO 0.03 -0.37 0.32 -0.67 1.20 0.00 0.00 173.24 173.75 2dkp n ASP 47 N 1.65 -5.58 -2.98 5.45 2.03 -1.26 -1.29 116.55 114.57 2dkp n ASP 47 Ca -0.20 -0.15 -0.21 0.00 0.52 0.00 0.00 54.79 54.76 2dkp n ASP 47 Cb 0.56 -4.58 0.01 0.00 -0.72 0.00 0.00 41.12 36.39 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 -3.51 -1.98 -3.95 -2.67 4.77 -1.26 -4.96 117.00 103.44 2dkp n LEU 48 Ca -0.16 -0.22 -0.09 0.00 -0.03 0.00 0.00 56.01 55.51 2dkp n LEU 48 Cb 0.64 -2.55 -0.10 0.00 -2.33 0.00 0.00 43.42 39.07 2dkp n LEU 48 CO 0.38 0.11 -0.27 0.00 -1.33 0.00 0.00 177.39 176.27 2dkp s LEU 50 N -1.78 4.25 -0.08 0.00 1.43 -0.46 -2.55 118.68 119.49 2dkp s LEU 50 Ca -0.10 0.60 0.00 0.00 -1.03 0.00 0.00 54.13 53.60 2dkp s LEU 50 Cb -0.05 -2.48 0.02 0.00 0.03 0.00 0.00 46.19 43.71 2dkp s LEU 50 CO -0.02 0.06 -0.07 -0.36 0.23 0.00 0.00 176.35 176.19 2dkp s PHE 51 N 0.57 1.17 0.12 0.29 0.08 -0.79 -1.21 117.98 118.21 2dkp s PHE 51 Ca 0.19 -0.46 0.08 0.00 0.12 0.00 0.00 56.93 56.86 2dkp s PHE 51 Cb -0.14 -0.98 -0.04 0.00 -0.57 0.00 0.00 43.02 41.30 2dkp s PHE 51 CO 0.06 -0.34 -0.19 1.52 -0.10 0.00 0.00 175.22 176.16 2dkp s TYR 52 N 1.28 1.74 0.20 0.36 -0.85 -1.25 -0.86 117.35 117.96 2dkp s TYR 52 Ca -0.04 -0.44 0.03 0.00 -0.52 0.00 0.00 57.07 56.09 2dkp s TYR 52 Cb -0.14 -0.93 -0.01 0.00 0.38 0.00 0.00 41.96 41.26 2dkp s TYR 52 CO -0.03 0.23 0.10 0.66 -1.52 0.00 0.00 175.55 174.99 2dkp n TYR 53 N 0.85 -0.07 -0.12 -3.49 4.02 -1.05 -2.71 117.16 114.57 2dkp n TYR 53 Ca -0.18 -1.38 -0.10 0.00 -0.01 0.00 0.00 57.90 56.23 2dkp n TYR 53 Cb 0.55 0.04 -0.02 0.00 -0.02 0.00 0.00 39.34 39.89 2dkp n TYR 53 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2dkp h ARG 54 N 0.00 0.60 0.00 -0.72 3.08 -1.91 -3.36 114.38 112.07 2dkp h ARG 54 Ca -0.15 -0.17 -0.22 0.00 0.07 0.00 0.00 59.98 59.51 2dkp h ARG 54 Cb 0.63 -0.07 -0.05 0.00 0.08 0.00 0.00 29.97 30.56 2dkp h ARG 54 CO 0.24 0.68 -0.10 -0.25 -1.07 0.00 0.00 179.97 179.46 2dkp n ASP 55 N -4.55 -1.16 0.08 7.04 9.92 -1.26 -4.70 116.55 121.92 2dkp n ASP 55 Ca -0.01 -2.54 0.05 0.00 -0.53 0.00 0.00 54.79 51.76 2dkp n ASP 55 Cb 0.24 2.14 0.29 0.00 -0.64 0.00 0.00 41.12 43.14 2dkp n ASP 55 CO 0.00 0.00 0.00 -1.84 0.13 0.00 0.00 177.20 175.49 2dkp n GLU 56 N -0.47 0.07 0.16 -1.24 0.28 -1.26 -0.97 120.64 117.21 2dkp n GLU 56 Ca 0.00 0.56 0.13 0.00 -0.16 0.00 0.00 57.16 57.69 2dkp n GLU 56 Cb 0.48 -1.72 0.51 0.00 1.43 0.00 0.00 31.44 32.14 2dkp n GLU 56 CO 0.00 0.00 0.00 0.87 -0.16 0.00 0.00 177.13 177.84 2dkp h LYS 57 N 0.00 0.00 -6.58 3.44 1.57 -1.98 -3.46 116.57 109.56 2dkp h LYS 57 Ca 0.00 0.00 -0.45 0.00 -1.87 0.00 0.00 60.65 58.33 2dkp h LYS 57 Cb 0.01 0.00 -0.14 0.00 0.08 0.00 0.00 32.23 32.18 2dkp h LYS 57 CO 0.00 0.00 -0.71 -0.85 -0.57 0.00 0.00 179.45 177.32 2dkp n GLU 58 N -2.43 -0.90 -0.54 3.15 -0.00 -0.14 -4.75 120.64 115.03 2dkp n GLU 58 Ca 0.02 0.05 -0.05 0.00 -0.00 0.00 0.00 57.16 57.18 2dkp n GLU 58 Cb 0.28 -2.50 0.14 0.00 -0.00 0.00 0.00 31.44 29.35 2dkp n GLU 58 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.13 177.52 2dkp n GLU 59 N -3.65 2.18 0.00 3.44 1.02 -1.26 -4.80 120.64 117.56 2dkp n GLU 59 Ca -0.22 -1.51 0.00 0.00 -0.02 0.00 0.00 57.16 55.41 2dkp n GLU 59 Cb 0.50 -1.71 0.00 0.00 -0.02 0.00 0.00 31.44 30.21 2dkp n GLU 59 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2dkp n GLY 60 N -0.05 2.99 3.76 0.62 0.00 -1.26 -5.09 105.19 106.17 2dkp n GLY 60 Ca 0.23 -0.13 -0.41 0.00 0.00 0.00 0.00 46.02 45.71 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 0.00 2.85 -0.13 -0.61 1.01 -1.26 -4.29 121.20 118.77 2dkp s ILE 61 Ca 0.00 0.82 0.19 0.00 0.00 0.00 0.00 60.65 61.66 2dkp s ILE 61 Cb 0.00 -3.52 -0.20 0.00 0.01 0.00 0.00 42.46 38.75 2dkp s ILE 61 CO 0.00 0.18 0.60 0.18 0.00 0.00 0.00 174.94 175.90 2dkp n LEU 62 N 1.17 0.43 -3.65 2.97 4.77 -1.10 -4.98 117.00 116.61 2dkp n LEU 62 Ca 0.01 0.18 0.01 0.00 -0.03 0.00 0.00 56.01 56.19 2dkp n LEU 62 Cb 0.42 0.12 -0.06 0.00 -2.33 0.00 0.00 43.42 41.57 2dkp n LEU 62 CO 0.59 0.13 1.03 -0.83 -1.33 0.00 0.00 177.39 176.98 2dkp s GLY 63 N -4.81 0.57 0.09 -0.72 0.00 -1.26 -5.12 107.32 96.08 2dkp s GLY 63 Ca -0.06 3.77 -0.06 0.00 0.00 0.00 0.00 44.72 48.37 2dkp s GLY 63 CO 0.84 2.60 0.34 -1.35 0.00 0.00 0.00 173.10 175.53 2dkp s SER 64 N 0.84 6.51 -0.12 1.64 1.04 -1.26 -3.93 113.70 118.42 2dkp s SER 64 Ca -0.05 0.60 0.02 0.00 0.48 0.00 0.00 55.95 57.00 2dkp s SER 64 Cb -0.03 -2.10 0.01 0.00 0.10 0.00 0.00 66.02 64.01 2dkp s SER 64 CO -0.11 0.13 -0.17 -0.63 0.98 0.00 0.00 173.24 173.45 2dkp s ILE 65 N -1.51 1.64 -0.49 -1.02 1.01 -0.35 -5.03 121.20 115.45 2dkp s ILE 65 Ca 0.36 -0.72 -0.26 0.00 0.00 0.00 0.00 60.65 60.02 2dkp s ILE 65 Cb -0.13 -1.49 0.03 0.00 0.01 0.00 0.00 42.46 40.88 2dkp s ILE 65 CO 0.21 0.47 1.01 -0.76 0.00 0.00 0.00 174.94 175.87 2dkp s LEU 66 N 1.02 3.87 0.11 2.97 2.01 -1.26 -1.35 118.68 126.05 2dkp s LEU 66 Ca -0.05 0.13 -0.16 0.00 0.01 0.00 0.00 54.13 54.06 2dkp s LEU 66 Cb -0.15 -3.22 -0.05 0.00 0.01 0.00 0.00 46.19 42.78 2dkp s LEU 66 CO -0.03 -1.17 1.53 -0.07 1.01 0.00 0.00 176.35 177.62 2dkp h LEU 67 N 10.93 0.62 -1.64 1.79 3.38 -1.90 -2.89 115.31 125.61 2dkp h LEU 67 Ca -0.24 -0.33 0.19 0.00 0.09 0.00 0.00 57.88 57.58 2dkp h LEU 67 Cb 1.07 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 41.63 2dkp h LEU 67 CO 1.08 0.81 0.74 -0.65 0.09 0.00 0.00 178.44 180.51 2dkp h PRO 68 N 0.42 0.00 0.00 1.13 0.11 -1.76 0.80 132.00 132.71 2dkp h PRO 68 Ca 0.09 0.00 -0.15 0.00 0.11 0.00 0.00 66.00 66.05 2dkp h PRO 68 Cb 0.51 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 31.60 2dkp h PRO 68 CO 0.02 0.00 -1.51 0.43 -0.21 0.00 0.00 178.00 176.73 2dkp n SER 69 N -3.52 0.69 -4.89 -2.05 7.64 -1.10 -4.75 113.62 105.64 2dkp n SER 69 Ca 0.13 0.30 -0.30 0.00 1.01 0.00 0.00 58.87 60.02 2dkp n SER 69 Cb 0.97 0.46 0.04 0.00 -1.01 0.00 0.00 64.21 64.67 2dkp n SER 69 CO 0.00 0.00 0.00 -0.36 -3.01 0.00 0.00 175.04 171.67 2dkp s PHE 70 N -3.00 3.35 -0.24 1.43 0.08 0.28 -4.31 117.98 115.57 2dkp s PHE 70 Ca -0.04 1.01 -0.00 0.00 0.12 0.00 0.00 56.93 58.02 2dkp s PHE 70 Cb 0.09 -2.97 0.07 0.00 -0.57 0.00 0.00 43.02 39.64 2dkp s PHE 70 CO 0.82 -1.06 -0.01 -1.14 -0.10 0.00 0.00 175.22 173.73 2dkp s GLN 71 N -5.27 1.31 -0.52 0.44 0.74 0.35 -4.79 119.66 111.92 2dkp s GLN 71 Ca 0.57 -0.93 -0.28 0.00 0.05 0.00 0.00 55.36 54.77 2dkp s GLN 71 Cb -0.11 -2.46 0.03 0.00 1.10 0.00 0.00 33.01 31.58 2dkp s GLN 71 CO 0.51 -0.67 1.14 0.42 -0.55 0.00 0.00 175.29 176.14 2dkp s ILE 72 N 1.49 4.16 -0.04 -2.34 -1.09 -1.26 -2.05 121.20 120.07 2dkp s ILE 72 Ca -0.02 1.04 -0.03 0.00 -2.23 0.00 0.00 60.65 59.41 2dkp s ILE 72 Cb -0.18 -4.64 0.02 0.00 -1.58 0.00 0.00 42.46 36.08 2dkp s ILE 72 CO -0.09 -1.12 0.09 0.00 -1.23 0.00 0.00 174.94 172.59 2dkp s ALA 73 N 4.57 -0.19 0.62 9.38 0.00 -1.11 -5.03 121.76 129.99 2dkp s ALA 73 Ca 0.45 0.36 -0.17 0.00 0.00 0.00 0.00 51.96 52.60 2dkp s ALA 73 Cb -0.08 -0.23 -0.07 0.00 0.00 0.00 0.00 23.12 22.74 2dkp s ALA 73 CO 0.29 -0.08 0.51 1.28 0.00 0.00 0.00 175.76 177.75 2dkp n LEU 74 N 3.47 0.69 -4.49 0.00 4.77 -1.26 -3.10 117.00 117.08 2dkp n LEU 74 Ca -0.18 0.69 -0.29 0.00 -0.03 0.00 0.00 56.01 56.20 2dkp n LEU 74 Cb 0.56 -1.18 0.25 0.00 -2.33 0.00 0.00 43.42 40.72 2dkp n LEU 74 CO 0.22 -3.12 0.53 -0.76 -1.33 0.00 0.00 177.39 172.93 2dkp s LEU 75 N 0.59 0.28 0.25 2.23 1.43 -1.26 -4.81 118.68 117.39 2dkp s LEU 75 Ca 0.67 1.02 -0.15 0.00 -1.03 0.00 0.00 54.13 54.64 2dkp s LEU 75 Cb -0.41 -2.76 0.00 0.00 0.03 0.00 0.00 46.19 43.05 2dkp s LEU 75 CO 0.56 -4.40 0.54 0.28 0.23 0.00 0.00 176.35 173.56 2dkp s THR 76 N -2.62 0.00 0.23 5.49 -1.32 -1.26 -5.04 115.64 111.11 2dkp s THR 76 Ca 0.69 -1.27 -0.15 0.00 -1.21 0.00 0.00 61.69 59.75 2dkp s THR 76 Cb -0.16 -2.11 0.27 0.00 -1.51 0.00 0.00 72.50 68.99 2dkp s THR 76 CO 0.59 -0.01 1.58 -1.28 -2.21 0.00 0.00 174.62 173.29 2dkp h SER 77 N 2.18 -1.07 -0.91 8.08 0.87 -2.05 0.14 113.55 120.79 2dkp h SER 77 Ca -0.24 0.27 0.19 0.00 -1.23 0.00 0.00 61.79 60.78 2dkp h SER 77 Cb 1.25 0.61 -0.17 0.00 -0.44 0.00 0.00 62.40 63.65 2dkp h SER 77 CO 0.32 -0.29 -0.19 1.21 -0.53 0.00 0.00 176.83 177.35 2dkp n GLU 78 N -5.50 -0.08 -2.01 2.24 0.00 -1.26 -3.95 120.64 110.08 2dkp n GLU 78 Ca 0.10 1.41 -0.42 0.00 0.00 0.00 0.00 57.16 58.24 2dkp n GLU 78 Cb 0.41 -2.12 -0.03 0.00 0.00 0.00 0.00 31.44 29.69 2dkp n GLU 78 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.13 176.62 2dkp s ASP 79 N -5.20 5.83 -0.04 4.31 1.01 0.49 -4.86 116.67 118.21 2dkp s ASP 79 Ca -0.13 1.17 -0.04 0.00 0.71 0.00 0.00 52.55 54.26 2dkp s ASP 79 Cb 0.25 -2.53 -0.14 0.00 1.01 0.00 0.00 42.92 41.51 2dkp s ASP 79 CO 0.71 -1.78 2.96 1.41 0.21 0.00 0.00 175.17 178.68 2dkp n HIS 80 N 10.55 0.16 -0.11 4.23 8.25 -1.25 -4.13 115.22 132.92 2dkp n HIS 80 Ca 0.22 -1.38 -0.18 0.00 -0.26 0.00 0.00 57.72 56.13 2dkp n HIS 80 Cb 0.47 -1.19 -0.06 0.00 1.12 0.00 0.00 29.99 30.33 2dkp n HIS 80 CO 0.00 0.00 0.00 -0.89 0.64 0.00 0.00 176.34 176.09 2dkp n ILE 81 N 1.98 1.51 -1.81 1.59 5.41 -1.26 -5.01 119.36 121.77 2dkp n ILE 81 Ca 0.28 -0.07 -0.10 0.00 1.00 0.00 0.00 62.75 63.86 2dkp n ILE 81 Cb 0.74 -2.15 -0.02 0.00 -0.71 0.00 0.00 39.64 37.50 2dkp n ILE 81 CO 0.00 0.00 0.00 -3.20 0.00 0.00 0.00 176.55 173.35 2dkp n ASN 82 N -4.39 -3.70 -4.75 4.38 2.85 -1.26 -5.00 115.26 103.39 2dkp n ASN 82 Ca -0.31 0.10 -0.39 0.00 -0.11 0.00 0.00 54.58 53.87 2dkp n ASN 82 Cb 0.66 -2.59 -0.05 0.00 1.24 0.00 0.00 39.78 39.03 2dkp n ASN 82 CO 0.00 0.00 0.00 -0.60 -2.11 0.00 0.00 177.26 174.55 2dkp s ARG 83 N -3.80 4.34 0.71 1.20 6.06 -1.26 -5.07 118.95 121.13 2dkp s ARG 83 Ca 0.00 0.73 -0.11 0.00 -2.50 0.00 0.00 55.73 53.85 2dkp s ARG 83 Cb 0.00 -3.37 0.01 0.00 0.06 0.00 0.00 34.95 31.65 2dkp s ARG 83 CO 0.00 0.29 1.07 0.15 -2.50 0.00 0.00 175.30 174.31 2dkp s LYS 84 N 0.06 2.84 -1.04 5.12 -0.14 -1.26 -3.97 119.74 121.36 2dkp s LYS 84 Ca 0.32 0.77 -0.08 0.00 -1.36 0.00 0.00 55.97 55.61 2dkp s LYS 84 Cb -0.18 -1.99 0.01 0.00 -1.68 0.00 0.00 37.83 33.99 2dkp s LYS 84 CO 0.17 -1.12 0.15 0.66 -0.76 0.00 0.00 175.35 174.45 2dkp n TYR 85 N -3.12 -0.93 -4.13 3.18 4.02 -1.26 -4.67 117.16 110.26 2dkp n TYR 85 Ca 0.07 0.31 -0.16 0.00 -0.01 0.00 0.00 57.90 58.11 2dkp n TYR 85 Cb 0.55 -2.01 -0.12 0.00 -0.02 0.00 0.00 39.34 37.74 2dkp n TYR 85 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2dkp s ALA 86 N -3.98 0.95 0.27 -0.72 0.00 -1.25 -3.15 121.76 113.87 2dkp s ALA 86 Ca 0.11 -0.92 0.02 0.00 0.00 0.00 0.00 51.96 51.17 2dkp s ALA 86 Cb -0.06 -0.04 -0.05 0.00 0.00 0.00 0.00 23.12 22.97 2dkp s ALA 86 CO 0.72 0.09 0.08 -0.59 0.00 0.00 0.00 175.76 176.06 2dkp s PHE 87 N -1.37 1.63 -0.01 0.00 -0.71 -0.45 -4.16 117.98 112.91 2dkp s PHE 87 Ca -0.05 -1.12 0.03 0.00 -1.04 0.00 0.00 56.93 54.75 2dkp s PHE 87 Cb -0.10 -0.98 -0.00 0.00 -1.21 0.00 0.00 43.02 40.73 2dkp s PHE 87 CO 0.01 -0.25 -0.10 -1.59 -1.34 0.00 0.00 175.22 171.96 2dkp s LYS 88 N -4.00 0.86 -0.24 1.99 -2.85 -1.18 -0.91 119.74 113.41 2dkp s LYS 88 Ca 0.37 -0.34 -0.06 0.00 -1.00 0.00 0.00 55.97 54.94 2dkp s LYS 88 Cb 0.08 -0.82 -0.02 0.00 -2.06 0.00 0.00 37.83 35.01 2dkp s LYS 88 CO 0.14 0.18 0.04 0.00 0.10 0.00 0.00 175.35 175.81 2dkp s ALA 89 N -0.10 3.09 -0.13 0.59 0.00 -0.38 -2.76 121.76 122.08 2dkp s ALA 89 Ca 0.02 -1.10 -0.15 0.00 0.00 0.00 0.00 51.96 50.72 2dkp s ALA 89 Cb -0.05 -1.97 -0.05 0.00 0.00 0.00 0.00 23.12 21.05 2dkp s ALA 89 CO -0.00 -0.41 0.34 0.00 0.00 0.00 0.00 175.76 175.69 2dkp s ALA 90 N 1.47 3.59 -0.01 0.00 0.00 -0.87 0.38 121.76 126.32 2dkp s ALA 90 Ca 0.05 -0.37 0.07 0.00 0.00 0.00 0.00 51.96 51.71 2dkp s ALA 90 Cb -0.15 -2.43 -0.02 0.00 0.00 0.00 0.00 23.12 20.52 2dkp s ALA 90 CO 0.02 0.14 -0.22 -1.58 0.00 0.00 0.00 175.76 174.13 2dkp s HIS 91 N 0.24 1.97 -0.08 0.00 2.46 -1.22 -0.49 115.29 118.17 2dkp s HIS 91 Ca 0.20 -0.37 -0.27 0.00 0.47 0.00 0.00 55.06 55.09 2dkp s HIS 91 Cb -0.14 -1.26 -0.22 0.00 -0.13 0.00 0.00 32.58 30.83 2dkp s HIS 91 CO 0.07 -0.02 1.01 -1.00 -2.47 0.00 0.00 174.74 172.33 2dkp h PRO 92 N 5.53 -0.01 -0.35 2.88 0.13 -1.90 -3.26 132.00 135.01 2dkp h PRO 92 Ca -0.40 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.73 2dkp h PRO 92 Cb 1.14 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.27 2dkp h PRO 92 CO 0.47 0.69 0.00 -1.71 -0.23 0.00 0.00 178.00 177.22 2dkp n ASN 93 N -4.75 1.89 -2.58 1.44 5.15 -1.26 -4.90 115.26 110.24 2dkp n ASN 93 Ca -0.09 -2.00 -0.12 0.00 -0.60 0.00 0.00 54.58 51.77 2dkp n ASN 93 Cb 0.35 -0.24 -0.03 0.00 -0.53 0.00 0.00 39.78 39.33 2dkp n ASN 93 CO 0.00 0.00 0.00 0.23 1.40 0.00 0.00 177.26 178.89 2dkp n MET 94 N 0.53 0.51 -1.83 1.20 2.81 -1.23 -5.18 117.12 113.93 2dkp n MET 94 Ca 0.12 -2.24 -0.20 0.00 -1.81 0.00 0.00 57.70 53.56 2dkp n MET 94 Cb 0.30 2.10 0.12 0.00 -0.71 0.00 0.00 33.22 35.03 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 -0.46 -0.43 -3.18 0.03 1.85 -1.26 -4.26 116.66 108.95 2dkp n ARG 95 Ca 0.01 -1.88 -0.40 0.00 -1.00 0.00 0.00 57.85 54.59 2dkp n ARG 95 Cb 0.46 -0.76 -0.07 0.00 -1.05 0.00 0.00 32.46 31.04 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 -2.76 5.03 0.68 8.89 2.01 -1.26 -3.41 115.64 124.82 2dkp s THR 96 Ca 0.55 1.00 -0.04 0.00 0.31 0.00 0.00 61.69 63.50 2dkp s THR 96 Cb -0.02 -3.88 0.07 0.00 0.01 0.00 0.00 72.50 68.68 2dkp s THR 96 CO 0.37 0.07 0.97 -0.31 -0.69 0.00 0.00 174.62 175.03 2dkp s TYR 97 N 2.34 2.66 -0.06 4.92 1.51 0.16 -4.88 117.35 124.00 2dkp s TYR 97 Ca 0.24 0.23 -0.06 0.00 -1.01 0.00 0.00 57.07 56.46 2dkp s TYR 97 Cb -0.16 -3.11 0.02 0.00 -0.11 0.00 0.00 41.96 38.60 2dkp s TYR 97 CO 0.09 -1.38 0.17 0.71 -1.11 0.00 0.00 175.55 174.03 2dkp s TYR 98 N -3.14 -0.18 0.07 2.71 1.51 -1.26 -1.24 117.35 115.81 2dkp s TYR 98 Ca 0.61 0.44 0.00 0.00 -1.01 0.00 0.00 57.07 57.11 2dkp s TYR 98 Cb -0.10 0.06 -0.04 0.00 -0.11 0.00 0.00 41.96 41.77 2dkp s TYR 98 CO 0.43 -0.10 -0.04 -0.06 -1.11 0.00 0.00 175.55 174.67 2dkp s PHE 99 N 0.02 0.66 0.12 2.71 0.08 -0.09 -2.78 117.98 118.70 2dkp s PHE 99 Ca -0.01 -1.00 -0.25 0.00 0.12 0.00 0.00 56.93 55.80 2dkp s PHE 99 Cb -0.02 -0.44 0.07 0.00 -0.57 0.00 0.00 43.02 42.07 2dkp s PHE 99 CO 0.00 -0.29 0.72 0.00 -0.10 0.00 0.00 175.22 175.55 2dkp n THR 101 N -0.35 0.00 0.03 0.00 -2.24 -1.19 -3.94 114.28 106.59 2dkp n THR 101 Ca -0.13 -2.08 -0.19 0.00 -2.27 0.00 0.00 64.05 59.38 2dkp n THR 101 Cb 0.63 0.86 -0.12 0.00 -2.10 0.00 0.00 70.33 69.60 2dkp n THR 101 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 2dkp h ASP 102 N 1.54 0.61 -4.30 3.42 3.32 -1.93 -3.47 116.42 115.62 2dkp h ASP 102 Ca -0.25 -0.80 -0.47 0.00 0.02 0.00 0.00 57.03 55.53 2dkp h ASP 102 Cb 1.05 -0.19 -0.14 0.00 0.22 0.00 0.00 39.33 40.27 2dkp h ASP 102 CO 0.39 1.35 -0.54 0.42 -1.72 0.00 0.00 179.24 179.13 2dkp s THR 103 N -3.04 0.42 0.21 0.35 -4.23 -1.26 -5.04 115.64 103.05 2dkp s THR 103 Ca -0.12 -2.00 -0.09 0.00 -1.18 0.00 0.00 61.69 58.29 2dkp s THR 103 Cb 0.04 -2.48 0.16 0.00 1.34 0.00 0.00 72.50 71.56 2dkp s THR 103 CO 0.85 0.00 1.84 1.23 -0.54 0.00 0.00 174.62 178.00 2dkp h GLY 104 N 2.07 1.16 0.27 3.99 0.00 -1.93 -3.01 103.07 105.62 2dkp h GLY 104 Ca -0.34 -0.51 -0.01 0.00 0.00 0.00 0.00 47.33 46.48 2dkp h GLY 104 CO 0.53 0.49 -0.29 1.70 0.00 0.00 0.00 176.54 178.97 2dkp h LYS 105 N 1.08 -0.54 -0.04 4.80 3.11 -1.99 0.26 116.57 123.25 2dkp h LYS 105 Ca 0.28 0.04 0.01 0.00 -2.81 0.00 0.00 60.65 58.17 2dkp h LYS 105 Cb 0.01 0.12 -0.00 0.00 -1.00 0.00 0.00 32.23 31.36 2dkp h LYS 105 CO -0.05 -0.36 0.63 0.93 -2.81 0.00 0.00 179.45 177.80 2dkp h GLU 106 N -0.56 0.00 0.03 1.90 5.08 -1.97 0.22 114.58 119.27 2dkp h GLU 106 Ca -0.03 0.00 -0.20 0.00 -1.00 0.00 0.00 59.36 58.12 2dkp h GLU 106 Cb 0.49 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.72 2dkp h GLU 106 CO -0.05 0.00 -1.09 1.98 -1.00 0.00 0.00 179.01 178.85 2dkp h MET 107 N 0.00 0.06 -0.97 2.33 4.05 -0.99 -3.30 114.93 116.10 2dkp h MET 107 Ca 0.02 -0.10 0.10 0.00 -0.28 0.00 0.00 59.70 59.44 2dkp h MET 107 Cb 1.29 0.04 -0.07 0.00 -0.80 0.00 0.00 31.60 32.05 2dkp h MET 107 CO -0.00 1.05 0.62 1.05 0.23 0.00 0.00 176.91 179.86 2dkp h GLU 108 N -0.82 0.98 -0.22 0.39 4.11 0.27 0.94 114.58 120.23 2dkp h GLU 108 Ca -0.28 -0.06 0.00 0.00 0.07 0.00 0.00 59.36 59.09 2dkp h GLU 108 Cb 1.37 -0.22 -0.01 0.00 0.50 0.00 0.00 28.75 30.39 2dkp h GLU 108 CO -0.11 0.65 0.15 -0.07 0.07 0.00 0.00 179.01 179.70 2dkp h LEU 109 N 1.01 0.26 -0.18 3.06 3.38 -1.45 0.20 115.31 121.59 2dkp h LEU 109 Ca 0.45 -0.02 -0.04 0.00 0.09 0.00 0.00 57.88 58.37 2dkp h LEU 109 Cb 0.38 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.06 2dkp h LEU 109 CO -0.21 0.20 -0.04 -0.50 0.09 0.00 0.00 178.44 177.98 2dkp h TRP 110 N 0.30 0.38 0.73 1.13 4.06 -1.44 -3.12 115.95 117.98 2dkp h TRP 110 Ca 0.08 -0.08 -0.04 0.00 2.06 0.00 0.00 58.89 60.92 2dkp h TRP 110 Cb -0.02 -0.09 0.01 0.00 -1.00 0.00 0.00 29.16 28.05 2dkp h TRP 110 CO -0.06 0.59 -0.36 0.52 -3.56 0.00 0.00 178.44 175.58 2dkp h MET 111 N 0.05 -0.95 -0.80 0.49 2.86 -0.71 0.27 114.93 116.14 2dkp h MET 111 Ca 0.05 0.06 0.27 0.00 -2.06 0.00 0.00 59.70 58.02 2dkp h MET 111 Cb 0.47 0.22 -0.15 0.00 0.06 0.00 0.00 31.60 32.20 2dkp h MET 111 CO 0.02 -0.63 0.20 1.63 1.06 0.00 0.00 176.91 179.18 2dkp n LYS 112 N -4.67 -0.06 0.01 1.72 4.76 0.68 -0.42 118.16 120.18 2dkp n LYS 112 Ca -0.12 1.15 -0.01 0.00 -2.87 0.00 0.00 58.31 56.46 2dkp n LYS 112 Cb 0.39 -1.94 -0.01 0.00 -1.84 0.00 0.00 35.03 31.64 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 1.60 -0.13 -0.86 7.82 0.00 -1.44 -3.14 119.26 123.10 2dkp h ALA 113 Ca 0.57 -0.02 0.14 0.00 0.00 0.00 0.00 54.91 55.60 2dkp h ALA 113 Cb 1.35 0.03 -0.14 0.00 0.00 0.00 0.00 17.79 19.03 2dkp h ALA 113 CO -0.69 -0.13 -0.33 -1.33 0.00 0.00 0.00 179.25 176.77 2dkp n MET 114 N -3.72 -0.19 -0.05 0.00 2.81 0.92 0.53 117.12 117.41 2dkp n MET 114 Ca -0.01 1.33 -0.07 0.00 -1.81 0.00 0.00 57.70 57.13 2dkp n MET 114 Cb 0.04 -1.97 -0.01 0.00 -0.71 0.00 0.00 33.22 30.56 2dkp n MET 114 CO 0.00 0.00 0.00 -0.07 1.51 0.00 0.00 175.97 177.41 2dkp h LEU 115 N 0.00 -0.43 -1.84 4.03 -0.00 -0.89 0.27 115.31 116.45 2dkp h LEU 115 Ca 0.31 0.10 0.30 0.00 -0.00 0.00 0.00 57.88 58.59 2dkp h LEU 115 Cb 0.52 0.23 -0.06 0.00 -0.00 0.00 0.00 40.66 41.36 2dkp h LEU 115 CO -0.86 -0.16 0.75 -0.78 -0.00 0.00 0.00 178.44 177.39 2dkp h ASP 116 N -0.10 0.11 0.08 -0.43 1.82 0.14 0.31 116.42 118.34 2dkp h ASP 116 Ca 0.13 0.02 -0.23 0.00 -0.39 0.00 0.00 57.03 56.56 2dkp h ASP 116 Cb 0.30 0.00 -0.01 0.00 0.68 0.00 0.00 39.33 40.30 2dkp h ASP 116 CO -0.31 0.02 -1.20 0.00 -1.61 0.00 0.00 179.24 176.14 2dkp h ALA 117 N 1.50 0.17 0.38 -0.78 0.00 -0.36 -3.38 119.26 116.79 2dkp h ALA 117 Ca 0.53 -1.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.39 2dkp h ALA 117 Cb 1.93 0.47 -0.00 0.00 0.00 0.00 0.00 17.79 20.19 2dkp h ALA 117 CO -0.08 0.70 -0.22 0.00 0.00 0.00 0.00 179.25 179.65 2dkp h ALA 118 N -0.13 -0.56 -1.31 0.00 0.00 0.93 -2.07 119.26 116.12 2dkp h ALA 118 Ca -0.27 -0.11 0.38 0.00 0.00 0.00 0.00 54.91 54.90 2dkp h ALA 118 Cb 1.57 0.26 -0.05 0.00 0.00 0.00 0.00 17.79 19.56 2dkp h ALA 118 CO -0.01 -0.82 1.28 1.47 0.00 0.00 0.00 179.25 181.17 2dkp n LEU 119 N -5.35 0.00 -4.57 0.00 -0.00 0.94 -4.40 117.00 103.63 2dkp n LEU 119 Ca -0.10 0.82 -0.46 0.00 -0.00 0.00 0.00 56.01 56.27 2dkp n LEU 119 Cb 0.25 -0.33 -0.02 0.00 -0.00 0.00 0.00 43.42 43.32 2dkp n LEU 119 CO 0.35 -0.82 0.56 0.52 -0.00 0.00 0.00 177.39 177.99 2dkp n VAL 120 N -3.43 1.66 -3.61 1.47 0.31 -0.78 -4.93 118.33 109.02 2dkp n VAL 120 Ca 0.30 -0.42 -0.40 0.00 -0.01 0.00 0.00 64.34 63.81 2dkp n VAL 120 Cb 1.67 -0.86 -0.09 0.00 -0.91 0.00 0.00 33.84 33.65 2dkp n VAL 120 CO 0.00 0.00 0.00 -1.10 -1.32 0.00 0.00 176.83 174.41 2dkp s GLN 121 N -1.15 2.45 0.20 5.55 1.11 -1.26 -4.82 119.66 121.74 2dkp s GLN 121 Ca 0.63 -1.92 -0.19 0.00 0.01 0.00 0.00 55.36 53.89 2dkp s GLN 121 Cb -0.77 -3.86 0.03 0.00 -1.01 0.00 0.00 33.01 27.41 2dkp s GLN 121 CO 0.57 -1.17 0.57 -0.08 0.01 0.00 0.00 175.29 175.19 2dkp s THR 122 N 1.05 0.02 -1.55 -0.19 -1.32 -1.26 -4.93 115.64 107.46 2dkp s THR 122 Ca 0.09 -0.67 -0.19 0.00 -1.21 0.00 0.00 61.69 59.70 2dkp s THR 122 Cb -0.24 -1.53 0.19 0.00 -1.51 0.00 0.00 72.50 69.41 2dkp s THR 122 CO -0.02 -0.08 0.50 -1.20 -2.21 0.00 0.00 174.62 171.61 2dkp n SER 123 N -0.37 -1.75 -3.91 8.08 7.64 -1.26 -4.85 113.62 117.20 2dkp n SER 123 Ca -0.10 -0.93 -0.11 0.00 1.01 0.00 0.00 58.87 58.75 2dkp n SER 123 Cb 0.62 -1.55 -0.12 0.00 -1.01 0.00 0.00 64.21 62.16 2dkp n SER 123 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2dkp s GLY 124 N -3.02 0.10 0.19 0.23 0.00 -1.26 -5.04 107.32 98.52 2dkp s GLY 124 Ca 0.68 -0.24 -0.20 0.00 0.00 0.00 0.00 44.72 44.97 2dkp s GLY 124 CO 0.84 -0.30 1.59 -2.55 0.00 0.00 0.00 173.10 172.68 2dkp h PRO 125 N 5.15 -0.14 -3.67 2.90 0.11 -2.03 -3.46 132.00 130.86 2dkp h PRO 125 Ca -0.29 0.01 -0.28 0.00 0.11 0.00 0.00 66.00 65.55 2dkp h PRO 125 Cb 1.21 0.03 0.06 0.00 0.11 0.00 0.00 31.00 32.41 2dkp h PRO 125 CO 0.44 -0.09 -0.44 0.45 -0.21 0.00 0.00 178.00 178.14 2dkp n SER 126 N -5.44 -4.88 -4.53 -2.05 2.88 -1.26 -4.83 113.62 93.51 2dkp n SER 126 Ca 0.05 -0.26 -0.32 0.00 -1.33 0.00 0.00 58.87 57.00 2dkp n SER 126 Cb 0.35 -3.64 -0.10 0.00 -0.75 0.00 0.00 64.21 60.08 2dkp n SER 126 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 2dkp n SER 127 N -1.38 1.20 0.00 -3.46 3.41 -1.26 -5.25 113.62 106.88 2dkp n SER 127 Ca -0.05 -0.46 0.00 0.00 -0.26 0.00 0.00 58.87 58.10 2dkp n SER 127 Cb 0.57 -1.28 0.00 0.00 -0.26 0.00 0.00 64.21 63.24 2dkp n SER 127 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49