#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dkp n SER 2 N 0.00 -1.24 -4.96 1.61 2.88 -1.26 -4.90 113.62 105.75 2dkp n SER 2 Ca 0.00 -1.21 -0.20 0.00 -1.33 0.00 0.00 58.87 56.13 2dkp n SER 2 Cb 0.00 -1.54 0.00 0.00 -0.75 0.00 0.00 64.21 61.92 2dkp n SER 2 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 2dkp s SER 3 N -3.40 5.26 0.00 -3.46 0.01 -1.26 -5.12 113.70 105.73 2dkp s SER 3 Ca 0.65 -0.69 0.00 0.00 1.31 0.00 0.00 55.95 57.23 2dkp s SER 3 Cb -0.38 -0.35 0.00 0.00 0.21 0.00 0.00 66.02 65.50 2dkp s SER 3 CO 0.99 -0.87 0.00 0.61 0.41 0.00 0.00 173.24 174.38 2dkp n GLY 4 N -1.82 1.51 3.02 3.44 0.00 -1.26 -5.17 105.19 104.90 2dkp n GLY 4 Ca 0.07 0.45 -0.13 0.00 0.00 0.00 0.00 46.02 46.41 2dkp n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2dkp s SER 5 N 0.00 -0.17 -0.03 1.61 1.04 -1.26 -5.05 113.70 109.83 2dkp s SER 5 Ca 0.00 0.35 -0.13 0.00 0.48 0.00 0.00 55.95 56.66 2dkp s SER 5 Cb 0.00 0.32 0.02 0.00 0.10 0.00 0.00 66.02 66.46 2dkp s SER 5 CO 0.00 -0.09 0.28 -0.94 0.98 0.00 0.00 173.24 173.47 2dkp s SER 6 N 0.48 -0.18 0.00 7.02 1.04 -1.26 -5.10 113.70 115.70 2dkp s SER 6 Ca -0.03 0.15 0.00 0.00 0.48 0.00 0.00 55.95 56.55 2dkp s SER 6 Cb -0.05 0.36 0.00 0.00 0.10 0.00 0.00 66.02 66.44 2dkp s SER 6 CO -0.02 -0.36 0.00 0.61 0.98 0.00 0.00 173.24 174.45 2dkp n GLY 7 N 1.66 0.77 3.52 7.32 0.00 -1.26 -4.93 105.19 112.27 2dkp n GLY 7 Ca -0.20 -1.52 -0.13 0.00 0.00 0.00 0.00 46.02 44.17 2dkp n GLY 7 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2dkp s LYS 8 N 0.15 1.82 0.09 1.61 -0.14 -1.26 -4.93 119.74 117.08 2dkp s LYS 8 Ca 0.00 -1.62 -0.31 0.00 -1.36 0.00 0.00 55.97 52.68 2dkp s LYS 8 Cb 0.00 0.45 -0.13 0.00 -1.68 0.00 0.00 37.83 36.47 2dkp s LYS 8 CO 0.00 -0.76 1.61 -0.09 -0.76 0.00 0.00 175.35 175.36 2dkp h ARG 9 N 2.16 -0.71 -7.05 1.68 2.43 -2.00 -3.43 114.38 107.47 2dkp h ARG 9 Ca -0.28 0.05 -0.55 0.00 -0.81 0.00 0.00 59.98 58.39 2dkp h ARG 9 Cb 1.24 0.16 0.13 0.00 -0.42 0.00 0.00 29.97 31.09 2dkp h ARG 9 CO 0.39 -0.48 0.60 -1.12 -1.51 0.00 0.00 179.97 177.85 2dkp s SER 10 N -4.58 5.31 0.15 -3.80 0.01 -1.26 -4.92 113.70 104.61 2dkp s SER 10 Ca -0.17 2.74 -0.25 0.00 1.31 0.00 0.00 55.95 59.58 2dkp s SER 10 Cb 0.06 -2.63 0.01 0.00 0.21 0.00 0.00 66.02 63.67 2dkp s SER 10 CO 0.63 -1.54 1.60 -1.13 0.41 0.00 0.00 173.24 173.21 2dkp h ASN 11 N 1.48 -1.07 -2.73 2.44 -1.24 -1.97 -3.42 115.58 109.06 2dkp h ASN 11 Ca -0.51 0.17 -0.43 0.00 0.71 0.00 0.00 56.30 56.24 2dkp h ASN 11 Cb 1.30 0.47 0.22 0.00 0.73 0.00 0.00 38.32 41.05 2dkp h ASN 11 CO 0.57 -0.34 -0.47 -1.20 -1.29 0.00 0.00 177.43 174.70 2dkp n SER 12 N -5.41 -2.30 -4.80 1.15 7.64 -1.26 -4.59 113.62 104.05 2dkp n SER 12 Ca -0.01 -0.24 -0.32 0.00 1.01 0.00 0.00 58.87 59.31 2dkp n SER 12 Cb 0.33 -1.09 -0.06 0.00 -1.01 0.00 0.00 64.21 62.37 2dkp n SER 12 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 2dkp s ILE 13 N -2.29 4.78 -0.14 0.44 1.01 -1.26 -4.63 121.20 119.11 2dkp s ILE 13 Ca 0.63 -0.49 -0.04 0.00 0.00 0.00 0.00 60.65 60.75 2dkp s ILE 13 Cb -0.19 -3.23 -0.03 0.00 0.01 0.00 0.00 42.46 39.02 2dkp s ILE 13 CO 0.64 0.26 -0.01 -0.75 0.00 0.00 0.00 174.94 175.09 2dkp s LYS 14 N -2.01 3.49 0.57 2.79 2.47 -1.26 -4.98 119.74 120.81 2dkp s LYS 14 Ca 0.26 -0.46 -0.07 0.00 -1.56 0.00 0.00 55.97 54.15 2dkp s LYS 14 Cb -0.12 -2.92 -0.01 0.00 -1.46 0.00 0.00 37.83 33.32 2dkp s LYS 14 CO 0.18 0.40 0.89 0.50 0.16 0.00 0.00 175.35 177.48 2dkp s ARG 15 N -0.05 3.20 -0.38 4.03 3.52 -1.26 -5.03 118.95 122.99 2dkp s ARG 15 Ca 0.03 0.18 0.03 0.00 -0.13 0.00 0.00 55.73 55.84 2dkp s ARG 15 Cb -0.13 -2.27 0.11 0.00 -1.56 0.00 0.00 34.95 31.10 2dkp s ARG 15 CO 0.02 -0.54 0.11 1.21 -0.81 0.00 0.00 175.30 175.29 2dkp s ASN 16 N -4.23 4.47 0.18 -2.12 2.47 -1.26 -5.01 114.94 109.45 2dkp s ASN 16 Ca 0.52 -2.27 -0.25 0.00 0.42 0.00 0.00 52.86 51.28 2dkp s ASN 16 Cb -0.11 -1.46 0.06 0.00 -1.45 0.00 0.00 41.25 38.30 2dkp s ASN 16 CO 0.47 -0.35 1.56 -0.65 -3.72 0.00 0.00 177.10 174.40 2dkp h PRO 17 N 7.41 -0.12 -0.89 0.43 0.11 -2.03 -0.39 132.00 136.52 2dkp h PRO 17 Ca -0.06 0.01 0.16 0.00 0.11 0.00 0.00 66.00 66.22 2dkp h PRO 17 Cb 0.99 0.03 -0.16 0.00 0.11 0.00 0.00 31.00 31.96 2dkp h PRO 17 CO 0.54 -0.08 -0.29 -0.91 -0.21 0.00 0.00 178.00 177.05 2dkp h ASN 18 N -0.13 -1.07 0.00 -2.05 2.35 -2.06 -3.39 115.58 109.23 2dkp h ASN 18 Ca 0.21 0.28 -0.50 0.00 -0.55 0.00 0.00 56.30 55.74 2dkp h ASN 18 Cb 0.54 0.63 -0.07 0.00 0.05 0.00 0.00 38.32 39.47 2dkp h ASN 18 CO -0.82 -0.30 1.48 0.00 -1.65 0.00 0.00 177.43 176.14 2dkp n ALA 19 N -3.44 0.24 -1.59 -0.83 0.00 -0.16 -4.71 120.51 110.03 2dkp n ALA 19 Ca 0.11 -0.15 -0.57 0.00 0.00 0.00 0.00 53.44 52.84 2dkp n ALA 19 Cb 0.43 -1.98 -0.07 0.00 0.00 0.00 0.00 19.45 17.82 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 7.36 0.66 -2.78 0.00 -0.02 -1.26 -4.44 135.00 134.52 2dkp n PRO 20 Ca 0.56 0.24 -0.41 0.00 -2.02 0.00 0.00 63.50 61.87 2dkp n PRO 20 Cb 0.01 -1.83 -0.03 0.00 -0.02 0.00 0.00 33.50 31.63 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 0.94 4.87 -0.08 -1.45 1.01 -1.26 -4.19 120.40 120.25 2dkp s VAL 21 Ca 0.90 1.93 -0.24 0.00 0.00 0.00 0.00 61.98 64.58 2dkp s VAL 21 Cb -1.12 -4.26 -0.20 0.00 0.00 0.00 0.00 36.38 30.80 2dkp s VAL 21 CO 0.56 0.19 0.90 0.58 0.00 0.00 0.00 175.10 177.33 2dkp h VAL 22 N 4.72 1.27 -1.39 2.92 2.07 -0.91 -3.48 116.25 121.45 2dkp h VAL 22 Ca -0.41 -1.54 0.14 0.00 0.82 0.00 0.00 66.70 65.70 2dkp h VAL 22 Cb 1.21 2.22 -0.29 0.00 -1.52 0.00 0.00 31.29 32.92 2dkp h VAL 22 CO 0.75 0.36 0.52 -0.60 0.02 0.00 0.00 177.57 178.61 2dkp s ARG 23 N -3.13 0.28 -0.12 1.57 3.52 -1.21 -5.04 118.95 114.82 2dkp s ARG 23 Ca -0.15 0.46 0.03 0.00 -0.13 0.00 0.00 55.73 55.94 2dkp s ARG 23 Cb -0.00 0.07 0.01 0.00 -1.56 0.00 0.00 34.95 33.46 2dkp s ARG 23 CO 0.58 -0.06 -0.20 -0.98 -0.81 0.00 0.00 175.30 173.83 2dkp s ARG 24 N 1.10 2.69 0.09 5.12 1.70 -1.26 -2.10 118.95 126.30 2dkp s ARG 24 Ca -0.07 -0.74 -0.18 0.00 -0.47 0.00 0.00 55.73 54.27 2dkp s ARG 24 Cb -0.03 -2.17 0.04 0.00 -0.57 0.00 0.00 34.95 32.21 2dkp s ARG 24 CO -0.13 0.01 0.45 0.20 -1.08 0.00 0.00 175.30 174.75 2dkp s GLY 25 N 0.77 -0.34 -0.98 3.88 0.00 -0.91 -5.01 107.32 104.74 2dkp s GLY 25 Ca -0.10 0.22 -0.24 0.00 0.00 0.00 0.00 44.72 44.60 2dkp s GLY 25 CO 0.01 -0.05 2.03 -0.98 0.00 0.00 0.00 173.10 174.10 2dkp s TRP 26 N -3.18 1.70 0.42 1.90 0.52 -1.26 -2.69 118.94 116.34 2dkp s TRP 26 Ca -0.01 0.93 -0.09 0.00 0.02 0.00 0.00 56.10 56.96 2dkp s TRP 26 Cb 0.00 -3.88 -0.05 0.00 -1.15 0.00 0.00 33.47 28.39 2dkp s TRP 26 CO -0.08 -1.48 0.77 -1.17 0.02 0.00 0.00 176.95 175.01 2dkp s LEU 27 N 11.64 3.77 0.02 2.99 2.96 -0.94 -4.79 118.68 134.33 2dkp s LEU 27 Ca 0.74 1.06 -0.15 0.00 -0.22 0.00 0.00 54.13 55.56 2dkp s LEU 27 Cb -0.06 -3.96 -0.06 0.00 0.50 0.00 0.00 46.19 42.61 2dkp s LEU 27 CO 0.06 -0.45 0.43 -0.31 -1.32 0.00 0.00 176.35 174.76 2dkp s TYR 28 N -2.48 3.72 -0.10 5.38 2.02 -1.26 -2.35 117.35 122.30 2dkp s TYR 28 Ca 0.50 1.01 0.04 0.00 -0.37 0.00 0.00 57.07 58.25 2dkp s TYR 28 Cb -0.10 -2.31 -0.00 0.00 -0.40 0.00 0.00 41.96 39.15 2dkp s TYR 28 CO 0.36 0.62 -0.24 0.21 -1.57 0.00 0.00 175.55 174.92 2dkp s LYS 29 N -1.20 2.99 0.24 -0.62 2.47 0.52 -4.16 119.74 119.98 2dkp s LYS 29 Ca 0.26 -0.88 -0.22 0.00 -1.56 0.00 0.00 55.97 53.57 2dkp s LYS 29 Cb -0.17 -2.29 -0.09 0.00 -1.46 0.00 0.00 37.83 33.83 2dkp s LYS 29 CO 0.15 0.20 0.78 -1.14 0.16 0.00 0.00 175.35 175.50 2dkp s GLN 30 N 0.28 4.36 -0.05 4.03 2.00 -1.06 -0.91 119.66 128.32 2dkp s GLN 30 Ca -0.17 1.01 0.04 0.00 -2.00 0.00 0.00 55.36 54.23 2dkp s GLN 30 Cb -0.17 -2.91 -0.02 0.00 0.80 0.00 0.00 33.01 30.70 2dkp s GLN 30 CO 0.08 0.39 -0.16 0.34 -0.50 0.00 0.00 175.29 175.45 2dkp s ASP 31 N -1.58 3.89 0.10 6.67 -1.08 -1.13 -4.76 116.67 118.78 2dkp s ASP 31 Ca 0.44 -0.24 -0.11 0.00 -0.52 0.00 0.00 52.55 52.11 2dkp s ASP 31 Cb -0.18 -0.85 -0.18 0.00 -1.46 0.00 0.00 42.92 40.25 2dkp s ASP 31 CO 0.22 0.33 1.24 0.28 0.52 0.00 0.00 175.17 177.76 2dkp h SER 32 N 5.48 0.80 -2.35 -0.34 0.02 -1.92 -3.39 113.55 111.85 2dkp h SER 32 Ca -0.44 -0.63 -0.61 0.00 -0.84 0.00 0.00 61.79 59.27 2dkp h SER 32 Cb 1.15 -0.24 0.12 0.00 0.14 0.00 0.00 62.40 63.57 2dkp h SER 32 CO 0.50 1.43 -0.01 0.35 -1.14 0.00 0.00 176.83 177.96 2dkp n THR 33 N -3.83 2.02 -1.12 -2.27 -2.24 -1.26 -4.61 114.28 100.97 2dkp n THR 33 Ca -0.09 -0.50 0.00 0.00 -2.27 0.00 0.00 64.05 61.19 2dkp n THR 33 Cb 0.85 -0.84 0.00 0.00 -2.10 0.00 0.00 70.33 68.24 2dkp n THR 33 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2dkp n GLY 34 N 1.37 1.92 3.69 3.38 0.00 -1.26 -4.60 105.19 109.69 2dkp n GLY 34 Ca 0.11 -0.25 -0.29 0.00 0.00 0.00 0.00 46.02 45.59 2dkp n GLY 34 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2dkp s MET 35 N 0.00 0.20 -1.31 1.61 -1.94 -1.26 -4.92 119.30 111.67 2dkp s MET 35 Ca 0.00 0.32 -0.10 0.00 -1.71 0.00 0.00 55.69 54.20 2dkp s MET 35 Cb 0.00 -1.73 0.14 0.00 2.01 0.00 0.00 34.83 35.26 2dkp s MET 35 CO 0.00 -2.84 1.93 1.63 -0.01 0.00 0.00 175.02 175.73 2dkp n LYS 36 N -4.22 3.48 -2.62 2.03 4.76 -1.26 -4.74 118.16 115.58 2dkp n LYS 36 Ca 0.07 -3.36 -0.28 0.00 -2.87 0.00 0.00 58.31 51.87 2dkp n LYS 36 Cb 0.58 -3.00 -0.00 0.00 -1.84 0.00 0.00 35.03 30.77 2dkp n LYS 36 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 2dkp s LEU 37 N 0.34 3.63 -0.04 -0.35 1.43 -1.26 -4.90 118.68 117.53 2dkp s LEU 37 Ca 0.41 0.98 -0.02 0.00 -1.03 0.00 0.00 54.13 54.48 2dkp s LEU 37 Cb 0.10 -3.93 -0.04 0.00 0.03 0.00 0.00 46.19 42.35 2dkp s LEU 37 CO -0.01 -0.57 0.06 0.26 0.23 0.00 0.00 176.35 176.32 2dkp s TRP 38 N -2.72 3.28 -0.03 0.29 0.52 -1.26 -2.84 118.94 116.18 2dkp s TRP 38 Ca 0.48 0.24 0.06 0.00 0.02 0.00 0.00 56.10 56.90 2dkp s TRP 38 Cb -0.10 -1.77 -0.01 0.00 -1.15 0.00 0.00 33.47 30.43 2dkp s TRP 38 CO 0.44 0.55 -0.22 0.15 0.02 0.00 0.00 176.95 177.88 2dkp s LYS 39 N -1.40 2.04 -0.30 4.98 -0.14 -0.08 -4.92 119.74 119.91 2dkp s LYS 39 Ca 0.19 -0.80 -0.22 0.00 -1.36 0.00 0.00 55.97 53.78 2dkp s LYS 39 Cb -0.12 -1.85 -0.01 0.00 -1.68 0.00 0.00 37.83 34.17 2dkp s LYS 39 CO 0.09 0.41 0.69 0.21 -0.76 0.00 0.00 175.35 176.00 2dkp s LYS 40 N -0.32 3.93 0.22 1.68 2.47 -1.26 -0.35 119.74 126.11 2dkp s LYS 40 Ca 0.03 0.43 0.00 0.00 -1.56 0.00 0.00 55.97 54.87 2dkp s LYS 40 Cb -0.11 -3.72 -0.05 0.00 -1.46 0.00 0.00 37.83 32.49 2dkp s LYS 40 CO 0.01 -0.61 0.11 1.03 0.16 0.00 0.00 175.35 176.05 2dkp s ARG 41 N 2.74 1.28 -0.32 4.03 1.81 -0.99 -5.01 118.95 122.49 2dkp s ARG 41 Ca 0.28 -1.68 -0.16 0.00 -1.72 0.00 0.00 55.73 52.45 2dkp s ARG 41 Cb -0.15 0.01 -0.02 0.00 -0.45 0.00 0.00 34.95 34.35 2dkp s ARG 41 CO 0.12 -0.33 0.43 -0.46 -0.68 0.00 0.00 175.30 174.38 2dkp s TRP 42 N -3.95 3.21 0.07 -0.53 -0.00 -1.26 -2.21 118.94 114.27 2dkp s TRP 42 Ca 0.37 0.19 0.06 0.00 -0.00 0.00 0.00 56.10 56.72 2dkp s TRP 42 Cb 0.07 -2.74 -0.04 0.00 -0.00 0.00 0.00 33.47 30.76 2dkp s TRP 42 CO 0.12 -0.41 -0.07 -0.06 -0.00 0.00 0.00 176.95 176.52 2dkp s PHE 43 N 2.19 2.82 -0.10 5.86 0.08 -1.10 -2.65 117.98 125.08 2dkp s PHE 43 Ca 0.16 -0.10 -0.03 0.00 0.12 0.00 0.00 56.93 57.07 2dkp s PHE 43 Cb -0.16 -1.50 0.04 0.00 -0.57 0.00 0.00 43.02 40.83 2dkp s PHE 43 CO 0.12 0.41 0.06 0.08 -0.10 0.00 0.00 175.22 175.79 2dkp s VAL 44 N -1.16 0.05 -0.63 -0.44 1.01 -0.33 -2.13 120.40 116.77 2dkp s VAL 44 Ca 0.21 0.08 -0.21 0.00 0.00 0.00 0.00 61.98 62.06 2dkp s VAL 44 Cb -0.11 -0.45 0.08 0.00 0.00 0.00 0.00 36.38 35.90 2dkp s VAL 44 CO 0.13 0.01 0.86 -0.22 0.00 0.00 0.00 175.10 175.88 2dkp s LEU 45 N 2.09 4.73 0.04 3.92 1.98 -0.89 -2.75 118.68 127.80 2dkp s LEU 45 Ca 0.03 -1.11 -0.12 0.00 -2.89 0.00 0.00 54.13 50.04 2dkp s LEU 45 Cb -0.14 -2.40 0.01 0.00 0.66 0.00 0.00 46.19 44.33 2dkp s LEU 45 CO -0.06 -1.31 0.27 -0.55 -1.89 0.00 0.00 176.35 172.81 2dkp s SER 46 N 3.60 -0.08 -1.43 3.68 0.15 -1.13 -0.18 113.70 118.31 2dkp s SER 46 Ca 0.19 -0.21 -0.07 0.00 0.70 0.00 0.00 55.95 56.55 2dkp s SER 46 Cb -0.19 0.33 0.04 0.00 -1.71 0.00 0.00 66.02 64.49 2dkp s SER 46 CO 0.09 -0.57 0.82 -0.67 1.20 0.00 0.00 173.24 174.10 2dkp n ASP 47 N 0.71 -2.88 -4.43 5.45 2.03 -1.26 -1.38 116.55 114.78 2dkp n ASP 47 Ca -0.19 -0.82 -0.39 0.00 0.52 0.00 0.00 54.79 53.91 2dkp n ASP 47 Cb 0.59 -3.88 -0.07 0.00 -0.72 0.00 0.00 41.12 37.04 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 -4.49 -1.05 -4.01 -2.67 4.77 -1.26 -4.88 117.00 103.41 2dkp n LEU 48 Ca -0.13 -1.21 -0.11 0.00 -0.03 0.00 0.00 56.01 54.54 2dkp n LEU 48 Cb 0.60 -1.70 -0.04 0.00 -2.33 0.00 0.00 43.42 39.95 2dkp n LEU 48 CO 0.73 0.21 0.19 0.00 -1.33 0.00 0.00 177.39 177.19 2dkp s LEU 50 N -3.09 2.90 -0.13 0.00 1.43 0.14 -2.82 118.68 117.11 2dkp s LEU 50 Ca 0.24 -0.16 -0.05 0.00 -1.03 0.00 0.00 54.13 53.13 2dkp s LEU 50 Cb -0.01 -1.62 0.06 0.00 0.03 0.00 0.00 46.19 44.65 2dkp s LEU 50 CO 0.12 0.30 0.29 -0.36 0.23 0.00 0.00 176.35 176.93 2dkp s PHE 51 N -0.47 -0.46 0.18 0.29 0.08 -1.11 -1.28 117.98 115.20 2dkp s PHE 51 Ca 0.06 1.02 0.10 0.00 0.12 0.00 0.00 56.93 58.24 2dkp s PHE 51 Cb -0.12 0.03 -0.04 0.00 -0.57 0.00 0.00 43.02 42.32 2dkp s PHE 51 CO 0.02 -0.35 -0.23 1.52 -0.10 0.00 0.00 175.22 176.09 2dkp s TYR 52 N 2.18 2.14 0.34 0.36 -0.85 -1.25 -1.19 117.35 119.07 2dkp s TYR 52 Ca -0.02 -0.39 0.03 0.00 -0.52 0.00 0.00 57.07 56.18 2dkp s TYR 52 Cb -0.12 -1.08 -0.04 0.00 0.38 0.00 0.00 41.96 41.11 2dkp s TYR 52 CO -0.09 0.42 0.13 0.71 -1.52 0.00 0.00 175.55 175.20 2dkp s TYR 53 N -1.69 1.71 0.19 -3.49 1.51 -1.08 -2.90 117.35 111.61 2dkp s TYR 53 Ca 0.18 -1.27 -0.12 0.00 -1.01 0.00 0.00 57.07 54.85 2dkp s TYR 53 Cb -0.08 -1.02 0.19 0.00 -0.11 0.00 0.00 41.96 40.95 2dkp s TYR 53 CO 0.08 -0.36 1.75 0.00 -1.11 0.00 0.00 175.55 175.91 2dkp h ARG 54 N 2.07 0.37 0.00 -0.62 3.08 -1.84 -3.35 114.38 114.09 2dkp h ARG 54 Ca -0.35 -0.02 -0.10 0.00 0.07 0.00 0.00 59.98 59.58 2dkp h ARG 54 Cb 1.26 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 31.21 2dkp h ARG 54 CO 0.56 0.25 0.11 -3.47 -1.07 0.00 0.00 179.97 176.35 2dkp n ASP 55 N -4.99 -1.63 0.15 7.04 2.03 -1.26 -4.74 116.55 113.15 2dkp n ASP 55 Ca 0.06 -2.40 0.18 0.00 0.52 0.00 0.00 54.79 53.15 2dkp n ASP 55 Cb 0.21 2.80 0.68 0.00 -0.72 0.00 0.00 41.12 44.09 2dkp n ASP 55 CO 0.00 0.00 0.00 1.05 -1.92 0.00 0.00 177.20 176.33 2dkp h GLU 56 N 0.00 0.00 -0.35 -0.67 4.11 -1.97 0.20 114.58 115.90 2dkp h GLU 56 Ca -0.26 0.00 0.10 0.00 0.07 0.00 0.00 59.36 59.27 2dkp h GLU 56 Cb 1.01 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.24 2dkp h GLU 56 CO 0.34 0.00 0.30 0.87 0.07 0.00 0.00 179.01 180.58 2dkp h LYS 57 N 0.00 0.00 -6.03 1.06 1.79 -1.97 -3.46 116.57 107.96 2dkp h LYS 57 Ca 0.16 0.00 -0.41 0.00 -2.18 0.00 0.00 60.65 58.22 2dkp h LYS 57 Cb 1.23 0.00 0.07 0.00 -1.58 0.00 0.00 32.23 31.95 2dkp h LYS 57 CO -0.00 0.00 -0.82 0.39 -1.08 0.00 0.00 179.45 177.94 2dkp n GLU 58 N -4.14 -5.20 -3.26 3.15 1.02 0.72 -4.93 120.64 107.99 2dkp n GLU 58 Ca 0.06 0.65 -0.46 0.00 -0.02 0.00 0.00 57.16 57.39 2dkp n GLU 58 Cb 0.47 -5.29 -0.04 0.00 -0.02 0.00 0.00 31.44 26.56 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 -5.91 3.24 0.13 3.49 2.02 -1.26 -4.86 118.70 115.55 2dkp s GLU 59 Ca 0.02 -1.91 0.00 0.00 0.02 0.00 0.00 54.97 53.10 2dkp s GLU 59 Cb -0.01 -4.37 0.00 0.00 0.10 0.00 0.00 34.13 29.85 2dkp s GLU 59 CO 0.80 -1.37 0.00 0.41 0.02 0.00 0.00 175.26 175.12 2dkp n GLY 60 N 4.83 -4.54 3.72 -1.39 0.00 -1.26 -4.72 105.19 101.83 2dkp n GLY 60 Ca -0.02 -0.51 -0.42 0.00 0.00 0.00 0.00 46.02 45.07 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 -0.50 3.62 -0.06 -0.61 1.01 -1.26 -4.52 121.20 118.88 2dkp s ILE 61 Ca 0.00 1.20 0.12 0.00 0.00 0.00 0.00 60.65 61.97 2dkp s ILE 61 Cb 0.00 -3.77 -0.03 0.00 0.01 0.00 0.00 42.46 38.67 2dkp s ILE 61 CO 0.00 0.11 1.38 -0.07 0.00 0.00 0.00 174.94 176.36 2dkp h LEU 62 N 6.49 0.00 0.00 2.97 3.38 -1.88 -3.47 115.31 122.80 2dkp h LEU 62 Ca -0.42 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.55 2dkp h LEU 62 Cb 1.21 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.96 2dkp h LEU 62 CO 0.82 0.67 0.00 0.61 0.09 0.00 0.00 178.44 180.63 2dkp n GLY 63 N 1.27 1.08 3.91 0.83 0.00 -1.26 -5.11 105.19 105.91 2dkp n GLY 63 Ca 0.01 0.34 -0.30 0.00 0.00 0.00 0.00 46.02 46.07 2dkp n GLY 63 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2dkp s SER 64 N 0.00 6.45 -0.06 1.61 1.04 -1.26 -3.89 113.70 117.58 2dkp s SER 64 Ca 0.00 0.53 0.01 0.00 0.48 0.00 0.00 55.95 56.97 2dkp s SER 64 Cb 0.00 -2.06 0.02 0.00 0.10 0.00 0.00 66.02 64.08 2dkp s SER 64 CO 0.00 0.00 -0.08 -0.63 0.98 0.00 0.00 173.24 173.51 2dkp s ILE 65 N -1.76 0.86 -0.41 -1.02 1.01 -0.41 -5.02 121.20 114.46 2dkp s ILE 65 Ca 0.40 -0.29 -0.23 0.00 0.00 0.00 0.00 60.65 60.53 2dkp s ILE 65 Cb -0.12 -0.84 0.02 0.00 0.01 0.00 0.00 42.46 41.53 2dkp s ILE 65 CO 0.27 0.30 0.80 -0.76 0.00 0.00 0.00 174.94 175.55 2dkp s LEU 66 N 0.96 4.16 0.08 2.97 2.01 -1.26 -0.68 118.68 126.92 2dkp s LEU 66 Ca -0.10 0.16 -0.16 0.00 0.01 0.00 0.00 54.13 54.05 2dkp s LEU 66 Cb -0.15 -3.02 -0.12 0.00 0.01 0.00 0.00 46.19 42.91 2dkp s LEU 66 CO 0.00 -0.83 1.35 -0.07 1.01 0.00 0.00 176.35 177.81 2dkp h LEU 67 N 9.97 0.73 -1.49 1.79 3.38 -1.82 -3.10 115.31 124.77 2dkp h LEU 67 Ca -0.25 -0.54 0.13 0.00 0.09 0.00 0.00 57.88 57.31 2dkp h LEU 67 Cb 1.09 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 41.61 2dkp h LEU 67 CO 0.94 1.13 0.70 -0.65 0.09 0.00 0.00 178.44 180.66 2dkp h PRO 68 N 0.36 0.00 0.00 1.13 0.11 -1.43 0.72 132.00 132.88 2dkp h PRO 68 Ca 0.01 0.00 -0.23 0.00 0.11 0.00 0.00 66.00 65.89 2dkp h PRO 68 Cb 1.00 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 32.07 2dkp h PRO 68 CO 0.09 0.00 -1.76 0.43 -0.21 0.00 0.00 178.00 176.55 2dkp n SER 69 N -3.26 0.60 -4.84 -2.05 7.64 -1.18 -4.75 113.62 105.78 2dkp n SER 69 Ca 0.09 0.27 -0.29 0.00 1.01 0.00 0.00 58.87 59.95 2dkp n SER 69 Cb 0.86 0.45 0.10 0.00 -1.01 0.00 0.00 64.21 64.61 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 -2.79 2.82 -0.23 1.43 0.08 0.25 -4.51 117.98 115.04 2dkp s PHE 70 Ca -0.05 0.89 -0.01 0.00 0.12 0.00 0.00 56.93 57.88 2dkp s PHE 70 Cb 0.08 -3.34 0.07 0.00 -0.57 0.00 0.00 43.02 39.26 2dkp s PHE 70 CO 0.83 -1.91 0.01 -1.14 -0.10 0.00 0.00 175.22 172.91 2dkp s GLN 71 N -5.37 1.05 -0.38 0.44 0.74 0.27 -4.84 119.66 111.58 2dkp s GLN 71 Ca 0.62 -0.75 -0.29 0.00 0.05 0.00 0.00 55.36 54.99 2dkp s GLN 71 Cb -0.13 -2.30 0.02 0.00 1.10 0.00 0.00 33.01 31.70 2dkp s GLN 71 CO 0.52 -0.67 1.10 0.42 -0.55 0.00 0.00 175.29 176.10 2dkp s ILE 72 N 1.63 4.40 -0.11 -2.34 -1.09 -1.26 -2.14 121.20 120.29 2dkp s ILE 72 Ca -0.01 1.55 -0.08 0.00 -2.23 0.00 0.00 60.65 59.88 2dkp s ILE 72 Cb -0.18 -4.48 0.04 0.00 -1.58 0.00 0.00 42.46 36.25 2dkp s ILE 72 CO -0.09 -0.67 0.27 0.00 -1.23 0.00 0.00 174.94 173.22 2dkp s ALA 73 N 3.94 -0.66 0.58 9.38 0.00 -1.10 -5.05 121.76 128.84 2dkp s ALA 73 Ca 0.46 0.90 -0.18 0.00 0.00 0.00 0.00 51.96 53.14 2dkp s ALA 73 Cb -0.10 -0.55 -0.08 0.00 0.00 0.00 0.00 23.12 22.39 2dkp s ALA 73 CO 0.21 -0.16 0.59 1.28 0.00 0.00 0.00 175.76 177.68 2dkp n LEU 74 N 3.48 1.22 -4.54 0.00 4.77 -1.26 -3.24 117.00 117.43 2dkp n LEU 74 Ca -0.18 0.74 -0.28 0.00 -0.03 0.00 0.00 56.01 56.26 2dkp n LEU 74 Cb 0.56 -1.20 0.23 0.00 -2.33 0.00 0.00 43.42 40.68 2dkp n LEU 74 CO 0.16 -2.88 0.55 -0.76 -1.33 0.00 0.00 177.39 173.12 2dkp s LEU 75 N 0.32 1.00 0.19 2.23 1.43 -1.26 -4.83 118.68 117.75 2dkp s LEU 75 Ca 0.70 1.41 -0.14 0.00 -1.03 0.00 0.00 54.13 55.06 2dkp s LEU 75 Cb -0.44 -3.38 0.01 0.00 0.03 0.00 0.00 46.19 42.42 2dkp s LEU 75 CO 0.53 -3.95 0.44 0.28 0.23 0.00 0.00 176.35 173.88 2dkp s THR 76 N -2.60 0.04 0.31 5.49 -1.32 -1.26 -5.02 115.64 111.27 2dkp s THR 76 Ca 0.68 -1.01 0.14 0.00 -1.21 0.00 0.00 61.69 60.28 2dkp s THR 76 Cb -0.23 -1.69 0.32 0.00 -1.51 0.00 0.00 72.50 69.39 2dkp s THR 76 CO 0.63 -0.18 1.35 -1.20 -2.21 0.00 0.00 174.62 173.01 2dkp n SER 77 N -0.30 0.20 -0.19 8.08 7.64 -1.26 0.35 113.62 128.15 2dkp n SER 77 Ca -0.09 1.43 -0.07 0.00 1.01 0.00 0.00 58.87 61.16 2dkp n SER 77 Cb 0.63 -0.66 -0.01 0.00 -1.01 0.00 0.00 64.21 63.16 2dkp n SER 77 CO 0.00 0.00 0.00 -0.08 -3.01 0.00 0.00 175.04 171.95 2dkp h GLU 78 N 0.00 -0.20 -6.34 1.43 4.22 -2.02 -3.39 114.58 108.29 2dkp h GLU 78 Ca 0.68 0.01 -0.53 0.00 0.08 0.00 0.00 59.36 59.60 2dkp h GLU 78 Cb 1.72 0.05 0.02 0.00 0.50 0.00 0.00 28.75 31.03 2dkp h GLU 78 CO -0.70 -0.13 1.22 -0.51 -2.18 0.00 0.00 179.01 176.71 2dkp s ASP 79 N -5.15 6.47 -0.11 1.04 1.01 0.16 -4.85 116.67 115.23 2dkp s ASP 79 Ca -0.14 2.62 -0.02 0.00 0.71 0.00 0.00 52.55 55.71 2dkp s ASP 79 Cb 0.14 -2.53 0.00 0.00 1.01 0.00 0.00 42.92 41.55 2dkp s ASP 79 CO 0.68 -1.04 2.39 1.41 0.21 0.00 0.00 175.17 178.82 2dkp n HIS 80 N 7.51 0.50 -4.04 4.23 8.25 -1.26 -4.81 115.22 125.60 2dkp n HIS 80 Ca 0.20 -1.41 -0.35 0.00 -0.26 0.00 0.00 57.72 55.90 2dkp n HIS 80 Cb 0.41 -0.90 -0.14 0.00 1.12 0.00 0.00 29.99 30.49 2dkp n HIS 80 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 2dkp s ILE 81 N -0.55 3.54 -0.50 1.59 1.01 -1.26 -4.99 121.20 120.04 2dkp s ILE 81 Ca 0.26 -0.45 -0.01 0.00 0.00 0.00 0.00 60.65 60.44 2dkp s ILE 81 Cb 0.15 -2.60 0.33 0.00 0.01 0.00 0.00 42.46 40.36 2dkp s ILE 81 CO -0.02 0.43 2.03 0.59 0.00 0.00 0.00 174.94 177.97 2dkp n ASN 82 N 4.51 7.12 -5.02 3.58 4.13 -1.26 -4.94 115.26 123.38 2dkp n ASN 82 Ca -0.18 -3.44 -0.19 0.00 1.68 0.00 0.00 54.58 52.46 2dkp n ASN 82 Cb 0.51 -1.02 0.03 0.00 -1.54 0.00 0.00 39.78 37.77 2dkp n ASN 82 CO 0.00 0.00 0.00 -0.13 0.28 0.00 0.00 177.26 177.41 2dkp s ARG 83 N -2.85 2.55 0.12 3.52 1.81 -1.26 -5.14 118.95 117.69 2dkp s ARG 83 Ca 0.48 -1.47 0.05 0.00 -1.72 0.00 0.00 55.73 53.08 2dkp s ARG 83 Cb 0.38 -2.68 -0.04 0.00 -0.45 0.00 0.00 34.95 32.17 2dkp s ARG 83 CO -0.01 -0.57 -0.12 -1.59 -0.68 0.00 0.00 175.30 172.33 2dkp s LYS 84 N -4.50 0.97 -1.46 3.54 -2.85 -1.26 -4.79 119.74 109.39 2dkp s LYS 84 Ca 0.58 -1.24 -0.09 0.00 -1.00 0.00 0.00 55.97 54.21 2dkp s LYS 84 Cb -0.07 -0.73 0.05 0.00 -2.06 0.00 0.00 37.83 35.01 2dkp s LYS 84 CO 0.35 0.13 0.77 0.66 0.10 0.00 0.00 175.35 177.36 2dkp n TYR 85 N 0.43 -2.15 -4.36 1.78 4.01 -1.26 -4.64 117.16 110.96 2dkp n TYR 85 Ca -0.15 0.69 -0.21 0.00 -0.16 0.00 0.00 57.90 58.08 2dkp n TYR 85 Cb 0.58 -4.02 -0.10 0.00 -0.31 0.00 0.00 39.34 35.48 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 -3.17 2.14 0.31 -0.72 0.00 -1.26 -3.51 121.76 115.54 2dkp s ALA 86 Ca 0.48 -1.64 0.04 0.00 0.00 0.00 0.00 51.96 50.84 2dkp s ALA 86 Cb -0.23 -0.15 -0.02 0.00 0.00 0.00 0.00 23.12 22.72 2dkp s ALA 86 CO 0.59 0.16 0.15 1.97 0.00 0.00 0.00 175.76 178.64 2dkp n PHE 87 N -0.18 -0.14 -3.81 0.00 -1.74 0.04 -4.33 117.46 107.30 2dkp n PHE 87 Ca -0.09 -2.14 -0.13 0.00 -0.56 0.00 0.00 57.45 54.53 2dkp n PHE 87 Cb 0.59 0.08 -0.13 0.00 1.52 0.00 0.00 39.48 41.54 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 -3.19 0.18 -0.20 3.97 -2.85 -1.20 -2.00 119.74 114.45 2dkp s LYS 88 Ca 0.22 0.25 -0.03 0.00 -1.00 0.00 0.00 55.97 55.41 2dkp s LYS 88 Cb 0.01 0.06 -0.01 0.00 -2.06 0.00 0.00 37.83 35.83 2dkp s LYS 88 CO 0.15 -0.04 -0.06 0.00 0.10 0.00 0.00 175.35 175.50 2dkp s ALA 89 N 0.24 2.79 0.09 0.59 0.00 0.18 -2.70 121.76 122.95 2dkp s ALA 89 Ca -0.01 -1.08 -0.09 0.00 0.00 0.00 0.00 51.96 50.77 2dkp s ALA 89 Cb -0.02 -1.60 -0.06 0.00 0.00 0.00 0.00 23.12 21.44 2dkp s ALA 89 CO -0.01 -0.25 0.40 0.00 0.00 0.00 0.00 175.76 175.91 2dkp s ALA 90 N 1.16 3.73 -0.00 0.00 0.00 -0.91 0.49 121.76 126.23 2dkp s ALA 90 Ca 0.02 -0.40 0.02 0.00 0.00 0.00 0.00 51.96 51.60 2dkp s ALA 90 Cb -0.14 -2.25 -0.01 0.00 0.00 0.00 0.00 23.12 20.72 2dkp s ALA 90 CO -0.01 0.58 -0.06 -1.58 0.00 0.00 0.00 175.76 174.68 2dkp s HIS 91 N -1.45 0.57 -0.07 0.00 2.46 -1.23 -0.56 115.29 115.02 2dkp s HIS 91 Ca 0.34 -0.13 -0.27 0.00 0.47 0.00 0.00 55.06 55.48 2dkp s HIS 91 Cb -0.14 -0.37 -0.23 0.00 -0.13 0.00 0.00 32.58 31.72 2dkp s HIS 91 CO 0.19 -0.01 1.05 -1.00 -2.47 0.00 0.00 174.74 172.50 2dkp h PRO 92 N 5.91 0.04 -0.48 2.88 0.13 -1.91 -3.26 132.00 135.32 2dkp h PRO 92 Ca -0.29 -0.04 0.00 0.00 -0.87 0.00 0.00 66.00 64.80 2dkp h PRO 92 Cb 1.19 0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.33 2dkp h PRO 92 CO 0.50 0.75 0.00 0.09 -0.23 0.00 0.00 178.00 179.11 2dkp n ASN 93 N -4.70 2.50 -2.14 1.44 3.02 -1.26 -4.91 115.26 109.21 2dkp n ASN 93 Ca -0.09 -2.09 -0.08 0.00 -0.03 0.00 0.00 54.58 52.28 2dkp n ASN 93 Cb 0.38 -0.34 -0.02 0.00 -0.61 0.00 0.00 39.78 39.19 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 0.66 0.39 -2.23 3.52 2.81 -1.23 -5.18 117.12 115.87 2dkp n MET 94 Ca 0.14 -1.60 -0.22 0.00 -1.81 0.00 0.00 57.70 54.21 2dkp n MET 94 Cb 0.43 1.53 0.12 0.00 -0.71 0.00 0.00 33.22 34.59 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 -0.33 -0.26 -3.12 0.03 1.85 -1.26 -4.30 116.66 109.27 2dkp n ARG 95 Ca 0.01 -2.31 -0.41 0.00 -1.00 0.00 0.00 57.85 54.13 2dkp n ARG 95 Cb 0.33 -0.72 -0.06 0.00 -1.05 0.00 0.00 32.46 30.96 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 -2.91 4.96 0.53 8.89 2.01 -1.26 -3.49 115.64 124.37 2dkp s THR 96 Ca 0.61 0.97 -0.05 0.00 0.31 0.00 0.00 61.69 63.53 2dkp s THR 96 Cb -0.03 -3.96 -0.01 0.00 0.01 0.00 0.00 72.50 68.51 2dkp s THR 96 CO 0.41 -0.06 0.82 -0.31 -0.69 0.00 0.00 174.62 174.79 2dkp s TYR 97 N 2.55 3.36 -0.03 4.92 1.51 0.18 -4.89 117.35 124.96 2dkp s TYR 97 Ca 0.25 0.63 0.00 0.00 -1.01 0.00 0.00 57.07 56.95 2dkp s TYR 97 Cb -0.15 -2.51 0.03 0.00 -0.11 0.00 0.00 41.96 39.22 2dkp s TYR 97 CO 0.10 -0.55 0.01 0.71 -1.11 0.00 0.00 175.55 174.71 2dkp s TYR 98 N -2.83 0.24 -0.03 2.71 1.51 -1.26 -0.65 117.35 117.05 2dkp s TYR 98 Ca 0.51 0.04 0.04 0.00 -1.01 0.00 0.00 57.07 56.64 2dkp s TYR 98 Cb -0.10 -0.37 -0.00 0.00 -0.11 0.00 0.00 41.96 41.37 2dkp s TYR 98 CO 0.44 -0.12 -0.13 -0.06 -1.11 0.00 0.00 175.55 174.56 2dkp s PHE 99 N 1.08 1.31 0.14 2.71 0.08 -0.85 -2.55 117.98 119.91 2dkp s PHE 99 Ca -0.09 -0.33 0.02 0.00 0.12 0.00 0.00 56.93 56.65 2dkp s PHE 99 Cb -0.13 -0.89 -0.04 0.00 -0.57 0.00 0.00 43.02 41.38 2dkp s PHE 99 CO -0.02 -0.10 -0.04 0.00 -0.10 0.00 0.00 175.22 174.96 2dkp n THR 101 N -0.17 0.00 -0.10 0.00 -2.24 -1.23 -4.04 114.28 106.51 2dkp n THR 101 Ca -0.09 -1.38 -0.13 0.00 -2.27 0.00 0.00 64.05 60.18 2dkp n THR 101 Cb 0.62 0.61 -0.04 0.00 -2.10 0.00 0.00 70.33 69.42 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 1.07 0.75 -5.17 3.42 3.32 -1.89 -3.47 116.42 114.44 2dkp h ASP 102 Ca -0.15 -0.45 -0.06 0.00 0.02 0.00 0.00 57.03 56.39 2dkp h ASP 102 Cb 0.69 -0.21 -0.05 0.00 0.22 0.00 0.00 39.33 39.98 2dkp h ASP 102 CO 0.23 1.04 0.06 0.28 -1.72 0.00 0.00 179.24 179.13 2dkp s THR 103 N -4.45 0.00 0.26 0.35 -1.32 -1.26 -5.00 115.64 104.22 2dkp s THR 103 Ca -0.12 -1.23 -0.06 0.00 -1.21 0.00 0.00 61.69 59.06 2dkp s THR 103 Cb 0.09 -2.45 0.33 0.00 -1.51 0.00 0.00 72.50 68.96 2dkp s THR 103 CO 0.83 0.00 1.61 1.23 -2.21 0.00 0.00 174.62 176.07 2dkp h GLY 104 N 2.09 0.86 0.14 6.08 0.00 -1.92 -1.83 103.07 108.48 2dkp h GLY 104 Ca -0.27 0.16 0.00 0.00 0.00 0.00 0.00 47.33 47.23 2dkp h GLY 104 CO 0.35 -0.34 -0.28 1.70 0.00 0.00 0.00 176.54 177.97 2dkp h LYS 105 N 0.06 -0.44 0.00 4.80 3.11 -1.96 0.47 116.57 122.60 2dkp h LYS 105 Ca 0.45 0.03 0.00 0.00 -2.81 0.00 0.00 60.65 58.32 2dkp h LYS 105 Cb 0.80 0.10 0.00 0.00 -1.00 0.00 0.00 32.23 32.12 2dkp h LYS 105 CO -0.77 -0.29 0.47 0.93 -2.81 0.00 0.00 179.45 176.97 2dkp h GLU 106 N -0.45 0.00 0.10 1.90 4.39 -1.77 0.28 114.58 119.03 2dkp h GLU 106 Ca -0.01 0.00 -0.33 0.00 0.34 0.00 0.00 59.36 59.35 2dkp h GLU 106 Cb 0.43 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 29.06 2dkp h GLU 106 CO -0.11 0.00 -1.80 1.98 -1.16 0.00 0.00 179.01 177.92 2dkp h MET 107 N 0.00 0.21 -0.51 2.33 1.85 -0.14 -3.35 114.93 115.32 2dkp h MET 107 Ca 0.00 -0.35 0.02 0.00 -0.61 0.00 0.00 59.70 58.75 2dkp h MET 107 Cb 0.93 0.13 -0.03 0.00 0.43 0.00 0.00 31.60 33.06 2dkp h MET 107 CO 0.00 1.17 0.32 1.05 -0.40 0.00 0.00 176.91 179.05 2dkp h GLU 108 N -0.20 0.63 -0.86 0.39 4.11 0.35 0.19 114.58 119.19 2dkp h GLU 108 Ca -0.40 -0.04 0.12 0.00 0.07 0.00 0.00 59.36 59.11 2dkp h GLU 108 Cb 1.85 -0.14 -0.06 0.00 0.50 0.00 0.00 28.75 30.90 2dkp h GLU 108 CO 0.02 0.42 0.56 -0.07 0.07 0.00 0.00 179.01 180.00 2dkp h LEU 109 N 0.65 0.67 0.00 3.06 3.38 -1.54 0.84 115.31 122.38 2dkp h LEU 109 Ca 0.20 0.03 -0.00 0.00 0.09 0.00 0.00 57.88 58.20 2dkp h LEU 109 Cb -0.02 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 40.62 2dkp h LEU 109 CO -0.07 0.37 -0.00 -0.50 0.09 0.00 0.00 178.44 178.32 2dkp h TRP 110 N 0.72 -0.01 0.19 1.13 4.06 -1.50 -3.32 115.95 117.22 2dkp h TRP 110 Ca 0.42 -0.00 -0.00 0.00 2.06 0.00 0.00 58.89 61.36 2dkp h TRP 110 Cb 0.59 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.74 2dkp h TRP 110 CO -0.00 0.82 -0.25 0.52 -3.56 0.00 0.00 178.44 175.97 2dkp h MET 111 N -0.98 -0.44 -0.74 0.49 2.86 -0.32 0.22 114.93 116.02 2dkp h MET 111 Ca -0.00 0.03 0.30 0.00 -2.06 0.00 0.00 59.70 57.97 2dkp h MET 111 Cb 0.83 0.10 -0.13 0.00 0.06 0.00 0.00 31.60 32.46 2dkp h MET 111 CO 0.00 -0.29 0.41 1.63 1.06 0.00 0.00 176.91 179.72 2dkp n LYS 112 N -3.85 -0.04 -0.03 1.72 4.76 0.26 -0.19 118.16 120.78 2dkp n LYS 112 Ca -0.05 0.98 -0.00 0.00 -2.87 0.00 0.00 58.31 56.36 2dkp n LYS 112 Cb 0.22 -1.77 -0.00 0.00 -1.84 0.00 0.00 35.03 31.63 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 1.40 -0.03 -0.77 7.82 0.00 -1.47 -3.17 119.26 123.04 2dkp h ALA 113 Ca 0.61 -0.01 0.14 0.00 0.00 0.00 0.00 54.91 55.66 2dkp h ALA 113 Cb 1.65 0.01 -0.14 0.00 0.00 0.00 0.00 17.79 19.31 2dkp h ALA 113 CO -0.53 -0.03 -0.27 0.52 0.00 0.00 0.00 179.25 178.94 2dkp h MET 114 N -0.93 -0.05 -0.87 0.00 2.86 0.23 0.61 114.93 116.79 2dkp h MET 114 Ca -0.00 0.00 0.11 0.00 -2.06 0.00 0.00 59.70 57.75 2dkp h MET 114 Cb 0.02 0.01 -0.06 0.00 0.06 0.00 0.00 31.60 31.63 2dkp h MET 114 CO 0.00 -0.03 0.56 -0.07 1.06 0.00 0.00 176.91 178.43 2dkp h LEU 115 N -0.05 0.72 -1.61 1.22 -0.00 -0.74 1.05 115.31 115.90 2dkp h LEU 115 Ca 0.34 0.03 -0.04 0.00 -0.00 0.00 0.00 57.88 58.21 2dkp h LEU 115 Cb 0.58 -0.12 -0.01 0.00 -0.00 0.00 0.00 40.66 41.12 2dkp h LEU 115 CO -0.81 0.40 -0.18 0.44 -0.00 0.00 0.00 178.44 178.30 2dkp h ASP 116 N 0.78 0.00 0.00 -0.43 5.19 0.23 0.28 116.42 122.47 2dkp h ASP 116 Ca 0.41 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.82 2dkp h ASP 116 Cb 0.52 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.03 2dkp h ASP 116 CO -0.18 0.18 -1.85 0.00 -3.12 0.00 0.00 179.24 174.27 2dkp n ALA 117 N -2.28 3.02 -0.09 3.45 0.00 0.58 -4.43 120.51 120.76 2dkp n ALA 117 Ca -0.01 -0.51 -0.22 0.00 0.00 0.00 0.00 53.44 52.70 2dkp n ALA 117 Cb 0.31 -0.73 -0.12 0.00 0.00 0.00 0.00 19.45 18.91 2dkp n ALA 117 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2dkp h ALA 118 N 2.06 0.27 0.00 0.00 0.00 0.13 -1.31 119.26 120.41 2dkp h ALA 118 Ca 0.00 -1.21 0.00 0.00 0.00 0.00 0.00 54.91 53.70 2dkp h ALA 118 Cb 0.91 0.72 0.00 0.00 0.00 0.00 0.00 17.79 19.42 2dkp h ALA 118 CO 0.00 0.75 0.44 1.37 0.00 0.00 0.00 179.25 181.81 2dkp h LEU 119 N -0.88 0.00 -9.19 0.00 -0.00 -0.66 -3.39 115.31 101.19 2dkp h LEU 119 Ca -0.35 0.00 -0.71 0.00 -0.00 0.00 0.00 57.88 56.83 2dkp h LEU 119 Cb 1.38 0.00 0.02 0.00 -0.00 0.00 0.00 40.66 42.06 2dkp h LEU 119 CO -0.17 0.00 0.88 0.52 -0.00 0.00 0.00 178.44 179.67 2dkp n VAL 120 N -2.46 0.31 -2.77 0.15 0.31 -1.26 -4.87 118.33 107.74 2dkp n VAL 120 Ca -0.01 -0.06 -0.41 0.00 -0.01 0.00 0.00 64.34 63.85 2dkp n VAL 120 Cb 0.46 -1.30 0.02 0.00 -0.91 0.00 0.00 33.84 32.10 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 5.22 5.09 -4.52 5.55 6.02 -1.26 -4.84 117.38 128.64 2dkp n GLN 121 Ca 0.25 -4.64 -0.33 0.00 -0.01 0.00 0.00 57.00 52.27 2dkp n GLN 121 Cb 0.17 -2.48 -0.14 0.00 1.02 0.00 0.00 30.24 28.81 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 -3.82 3.16 0.06 5.09 -1.32 -1.26 -5.11 115.64 112.43 2dkp s THR 122 Ca 0.36 -0.61 -0.04 0.00 -1.21 0.00 0.00 61.69 60.19 2dkp s THR 122 Cb 0.14 -2.36 -0.02 0.00 -1.51 0.00 0.00 72.50 68.75 2dkp s THR 122 CO -0.05 0.50 0.06 -0.44 -2.21 0.00 0.00 174.62 172.48 2dkp s SER 123 N 0.64 0.32 0.00 8.08 0.01 -1.26 -4.99 113.70 116.50 2dkp s SER 123 Ca -0.06 -0.81 0.00 0.00 1.31 0.00 0.00 55.95 56.39 2dkp s SER 123 Cb -0.15 0.25 0.00 0.00 0.21 0.00 0.00 66.02 66.33 2dkp s SER 123 CO 0.03 -0.63 0.00 0.61 0.41 0.00 0.00 173.24 173.66 2dkp n GLY 124 N 0.16 -0.16 1.94 3.44 0.00 -1.26 -4.94 105.19 104.37 2dkp n GLY 124 Ca -0.15 -0.90 -0.06 0.00 0.00 0.00 0.00 46.02 44.91 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 0.00 1.22 -2.80 1.61 -0.04 -1.26 -4.81 135.00 128.92 2dkp n PRO 125 Ca 0.00 -0.47 -0.43 0.00 -0.04 0.00 0.00 63.50 62.56 2dkp n PRO 125 Cb 0.00 -1.60 -0.03 0.00 -0.04 0.00 0.00 33.50 31.83 2dkp n PRO 125 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2dkp s SER 126 N 2.16 6.38 0.21 3.54 0.15 -1.26 -5.00 113.70 119.88 2dkp s SER 126 Ca 0.32 -1.37 0.10 0.00 0.70 0.00 0.00 55.95 55.70 2dkp s SER 126 Cb 0.15 -2.45 -0.05 0.00 -1.71 0.00 0.00 66.02 61.97 2dkp s SER 126 CO 0.00 -1.36 -0.20 -0.94 1.20 0.00 0.00 173.24 171.93 2dkp s SER 127 N 3.88 3.16 0.00 5.45 1.04 -1.26 -5.14 113.70 120.83 2dkp s SER 127 Ca 0.31 -0.92 0.00 0.00 0.48 0.00 0.00 55.95 55.82 2dkp s SER 127 Cb -0.09 -0.22 0.00 0.00 0.10 0.00 0.00 66.02 65.80 2dkp s SER 127 CO 0.01 0.03 0.00 0.61 0.98 0.00 0.00 173.24 174.86