#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 3.14 -0.02 1.61 1.04 -1.26 -5.17 113.70 113.03 2dkp s SER 2 Ca 0.00 -1.66 -0.24 0.00 0.48 0.00 0.00 55.95 54.53 2dkp s SER 2 Cb 0.00 0.49 0.05 0.00 0.10 0.00 0.00 66.02 66.66 2dkp s SER 2 CO 0.00 -0.90 0.52 -0.94 0.98 0.00 0.00 173.24 172.89 2dkp s SER 3 N -3.67 -0.45 0.00 7.02 1.04 -1.26 -5.17 113.70 111.21 2dkp s SER 3 Ca 0.20 0.40 0.00 0.00 0.48 0.00 0.00 55.95 57.03 2dkp s SER 3 Cb 0.02 0.45 0.00 0.00 0.10 0.00 0.00 66.02 66.59 2dkp s SER 3 CO 0.12 -0.56 0.00 0.61 0.98 0.00 0.00 173.24 174.39 2dkp n GLY 4 N 0.98 3.31 3.39 7.32 0.00 -1.26 -5.15 105.19 113.78 2dkp n GLY 4 Ca -0.20 -0.84 0.02 0.00 0.00 0.00 0.00 46.02 45.00 2dkp n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2dkp s SER 5 N 0.00 -0.80 0.05 1.61 0.15 -1.26 -5.07 113.70 108.38 2dkp s SER 5 Ca 0.00 0.91 -0.30 0.00 0.70 0.00 0.00 55.95 57.26 2dkp s SER 5 Cb 0.00 1.84 -0.18 0.00 -1.71 0.00 0.00 66.02 65.97 2dkp s SER 5 CO 0.00 -0.15 1.45 0.28 1.20 0.00 0.00 173.24 176.02 2dkp h SER 6 N 7.75 -0.71 0.00 5.45 0.02 -2.04 -3.49 113.55 120.53 2dkp h SER 6 Ca -0.17 -0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.77 2dkp h SER 6 Cb 1.13 0.18 0.00 0.00 0.14 0.00 0.00 62.40 63.85 2dkp h SER 6 CO 0.08 -0.43 0.00 0.61 -1.14 0.00 0.00 176.83 175.96 2dkp n GLY 7 N -1.10 3.37 3.63 -3.77 0.00 -1.26 -5.06 105.19 101.00 2dkp n GLY 7 Ca -0.13 -0.86 -0.43 0.00 0.00 0.00 0.00 46.02 44.61 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 -4.15 3.83 0.06 1.61 1.02 -1.26 -4.98 119.74 115.87 2dkp s LYS 8 Ca 0.00 1.40 -0.29 0.00 0.02 0.00 0.00 55.97 57.10 2dkp s LYS 8 Cb 0.00 -3.96 -0.05 0.00 -0.52 0.00 0.00 37.83 33.30 2dkp s LYS 8 CO 0.00 -1.24 0.91 1.03 -0.92 0.00 0.00 175.35 175.13 2dkp s ARG 9 N 4.46 4.61 -0.11 1.68 0.52 -1.26 -4.99 118.95 123.86 2dkp s ARG 9 Ca 0.63 1.33 -0.04 0.00 -0.52 0.00 0.00 55.73 57.13 2dkp s ARG 9 Cb -0.20 -3.40 -0.01 0.00 0.52 0.00 0.00 34.95 31.86 2dkp s ARG 9 CO 0.26 0.16 -0.08 0.77 0.02 0.00 0.00 175.30 176.43 2dkp h SER 10 N 5.96 0.00 -0.25 0.23 0.02 -2.01 -3.40 113.55 114.09 2dkp h SER 10 Ca -0.43 0.00 0.04 0.00 -0.84 0.00 0.00 61.79 60.57 2dkp h SER 10 Cb 1.21 0.00 -0.07 0.00 0.14 0.00 0.00 62.40 63.68 2dkp h SER 10 CO 0.73 0.56 -0.53 0.78 -1.14 0.00 0.00 176.83 177.22 2dkp h ASN 11 N -0.88 -1.72 -1.08 3.07 4.21 -2.05 -3.43 115.58 113.71 2dkp h ASN 11 Ca 0.00 0.22 -0.58 0.00 1.21 0.00 0.00 56.30 57.14 2dkp h ASN 11 Cb 0.24 0.69 -0.08 0.00 -1.12 0.00 0.00 38.32 38.06 2dkp h ASN 11 CO 0.00 -0.44 -0.43 -0.44 -1.29 0.00 0.00 177.43 174.83 2dkp s SER 12 N -4.94 4.49 -0.06 5.81 0.01 -1.26 -5.14 113.70 112.60 2dkp s SER 12 Ca -0.15 -1.20 -0.00 0.00 1.31 0.00 0.00 55.95 55.91 2dkp s SER 12 Cb 0.08 -0.05 -0.03 0.00 0.21 0.00 0.00 66.02 66.23 2dkp s SER 12 CO 0.62 -0.78 -0.01 -0.63 0.41 0.00 0.00 173.24 172.85 2dkp s ILE 13 N -2.69 4.16 -0.16 1.44 1.01 -1.26 -4.40 121.20 119.29 2dkp s ILE 13 Ca 0.34 -0.39 -0.04 0.00 0.00 0.00 0.00 60.65 60.56 2dkp s ILE 13 Cb 0.01 -2.77 -0.03 0.00 0.01 0.00 0.00 42.46 39.68 2dkp s ILE 13 CO 0.19 0.54 -0.02 -0.75 0.00 0.00 0.00 174.94 174.90 2dkp s LYS 14 N -1.06 3.70 0.48 2.79 2.47 -1.26 -4.97 119.74 121.89 2dkp s LYS 14 Ca 0.15 -0.50 -0.22 0.00 -1.56 0.00 0.00 55.97 53.83 2dkp s LYS 14 Cb -0.11 -2.96 -0.07 0.00 -1.46 0.00 0.00 37.83 33.23 2dkp s LYS 14 CO 0.04 0.23 1.20 0.50 0.16 0.00 0.00 175.35 177.48 2dkp s ARG 15 N 0.40 3.62 -0.04 4.03 3.52 -1.26 -5.04 118.95 124.18 2dkp s ARG 15 Ca -0.03 1.84 0.01 0.00 -0.13 0.00 0.00 55.73 57.42 2dkp s ARG 15 Cb -0.14 -2.35 -0.03 0.00 -1.56 0.00 0.00 34.95 30.87 2dkp s ARG 15 CO 0.03 -0.69 -0.04 1.21 -0.81 0.00 0.00 175.30 175.00 2dkp s ASN 16 N -1.32 4.88 -0.12 -2.12 2.47 -1.26 -5.04 114.94 112.43 2dkp s ASN 16 Ca 0.66 -0.00 -0.24 0.00 0.42 0.00 0.00 52.86 53.69 2dkp s ASN 16 Cb -0.30 -1.26 -0.21 0.00 -1.45 0.00 0.00 41.25 38.03 2dkp s ASN 16 CO 0.36 0.33 0.72 1.55 -3.72 0.00 0.00 177.10 176.35 2dkp h PRO 17 N 4.88 -0.02 -0.53 0.43 0.13 -2.02 -3.35 132.00 131.54 2dkp h PRO 17 Ca -0.49 0.00 0.10 0.00 -0.87 0.00 0.00 66.00 64.74 2dkp h PRO 17 Cb 1.18 0.00 -0.09 0.00 0.13 0.00 0.00 31.00 32.22 2dkp h PRO 17 CO 0.54 0.77 0.00 -0.91 -0.23 0.00 0.00 178.00 178.17 2dkp h ASN 18 N -0.94 -0.22 -0.66 1.44 4.21 -2.05 -3.40 115.58 113.95 2dkp h ASN 18 Ca -0.00 0.13 -0.60 0.00 1.21 0.00 0.00 56.30 57.03 2dkp h ASN 18 Cb 0.79 0.22 -0.04 0.00 -1.12 0.00 0.00 38.32 38.18 2dkp h ASN 18 CO 0.00 -0.08 1.54 0.00 -1.29 0.00 0.00 177.43 177.60 2dkp n ALA 19 N -2.70 0.65 -1.49 -0.83 0.00 -1.26 -4.82 120.51 110.06 2dkp n ALA 19 Ca 0.06 -0.24 -0.43 0.00 0.00 0.00 0.00 53.44 52.83 2dkp n ALA 19 Cb 0.29 -2.50 -0.00 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 0.71 -3.57 0.00 -0.02 -1.26 -4.74 135.00 134.43 2dkp n PRO 20 Ca 0.50 0.25 -0.37 0.00 -2.02 0.00 0.00 63.50 61.87 2dkp n PRO 20 Cb 0.18 -1.53 -0.09 0.00 -0.02 0.00 0.00 33.50 32.03 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 -1.29 5.31 0.03 -1.45 1.01 -1.26 -4.34 120.40 118.41 2dkp s VAL 21 Ca 0.62 0.33 -0.27 0.00 0.00 0.00 0.00 61.98 62.66 2dkp s VAL 21 Cb -0.67 -3.57 -0.17 0.00 0.00 0.00 0.00 36.38 31.97 2dkp s VAL 21 CO 0.58 0.30 1.41 0.58 0.00 0.00 0.00 175.10 177.97 2dkp h VAL 22 N 5.08 0.68 -2.00 2.92 2.07 -1.47 -3.48 116.25 120.05 2dkp h VAL 22 Ca -0.37 -0.38 0.07 0.00 0.82 0.00 0.00 66.70 66.84 2dkp h VAL 22 Cb 1.17 0.88 -0.19 0.00 -1.52 0.00 0.00 31.29 31.64 2dkp h VAL 22 CO 0.66 0.08 0.47 -0.60 0.02 0.00 0.00 177.57 178.19 2dkp s ARG 23 N -5.21 0.78 -0.13 1.57 6.06 -1.24 -5.03 118.95 115.75 2dkp s ARG 23 Ca -0.15 -0.07 -0.04 0.00 -2.50 0.00 0.00 55.73 52.98 2dkp s ARG 23 Cb 0.03 0.36 0.06 0.00 0.06 0.00 0.00 34.95 35.46 2dkp s ARG 23 CO 0.58 -0.30 0.13 -0.98 -2.50 0.00 0.00 175.30 172.24 2dkp s ARG 24 N -2.14 0.05 -0.02 5.12 1.70 -1.26 -1.02 118.95 121.38 2dkp s ARG 24 Ca 0.00 0.24 -0.21 0.00 -0.47 0.00 0.00 55.73 55.29 2dkp s ARG 24 Cb -0.01 -1.04 0.04 0.00 -0.57 0.00 0.00 34.95 33.38 2dkp s ARG 24 CO -0.03 -0.50 0.46 0.20 -1.08 0.00 0.00 175.30 174.34 2dkp s GLY 25 N 2.22 -0.32 -0.65 3.88 0.00 -0.88 -5.01 107.32 106.55 2dkp s GLY 25 Ca 0.04 0.69 -0.26 0.00 0.00 0.00 0.00 44.72 45.19 2dkp s GLY 25 CO -0.08 0.42 2.43 0.79 0.00 0.00 0.00 173.10 176.66 2dkp n TRP 26 N 1.06 1.22 -3.35 1.90 7.02 -1.26 -3.40 117.44 120.63 2dkp n TRP 26 Ca -0.20 0.08 -0.30 0.00 -1.02 0.00 0.00 57.50 56.06 2dkp n TRP 26 Cb 0.57 -2.53 -0.04 0.00 -2.42 0.00 0.00 31.31 26.89 2dkp n TRP 26 CO 0.00 0.00 0.00 -1.17 -2.02 0.00 0.00 177.69 174.50 2dkp s LEU 27 N 12.50 4.08 -0.33 -0.99 2.96 -1.06 -4.88 118.68 130.97 2dkp s LEU 27 Ca 1.00 0.78 -0.10 0.00 -0.22 0.00 0.00 54.13 55.59 2dkp s LEU 27 Cb -0.26 -3.58 0.00 0.00 0.50 0.00 0.00 46.19 42.86 2dkp s LEU 27 CO 0.22 -0.17 0.17 -0.31 -1.32 0.00 0.00 176.35 174.95 2dkp s TYR 28 N -2.02 3.20 0.13 5.38 2.02 -1.25 -3.35 117.35 121.46 2dkp s TYR 28 Ca 0.45 -0.69 0.02 0.00 -0.37 0.00 0.00 57.07 56.48 2dkp s TYR 28 Cb -0.11 -2.38 -0.04 0.00 -0.40 0.00 0.00 41.96 39.04 2dkp s TYR 28 CO 0.28 -0.51 0.26 0.21 -1.57 0.00 0.00 175.55 174.21 2dkp s LYS 29 N 1.59 3.41 0.43 -0.62 2.20 -1.12 -3.03 119.74 122.60 2dkp s LYS 29 Ca 0.04 -0.58 -0.02 0.00 -0.36 0.00 0.00 55.97 55.05 2dkp s LYS 29 Cb -0.18 -2.97 -0.03 0.00 -1.51 0.00 0.00 37.83 33.15 2dkp s LYS 29 CO 0.06 0.54 0.68 -1.14 -0.36 0.00 0.00 175.35 175.13 2dkp s GLN 30 N -3.08 3.41 -0.21 4.03 2.00 -0.46 -1.33 119.66 124.03 2dkp s GLN 30 Ca 0.34 -0.13 0.01 0.00 -2.00 0.00 0.00 55.36 53.59 2dkp s GLN 30 Cb -0.11 -2.51 0.03 0.00 0.80 0.00 0.00 33.01 31.22 2dkp s GLN 30 CO 0.28 -0.11 -0.16 0.16 -0.50 0.00 0.00 175.29 174.96 2dkp s ASP 31 N -4.11 3.56 -0.06 6.67 1.47 -1.10 -4.82 116.67 118.28 2dkp s ASP 31 Ca 0.45 -0.84 -0.03 0.00 1.18 0.00 0.00 52.55 53.31 2dkp s ASP 31 Cb -0.10 -1.52 -0.09 0.00 -0.34 0.00 0.00 42.92 40.87 2dkp s ASP 31 CO 0.40 -0.06 2.77 -1.20 0.68 0.00 0.00 175.17 177.77 2dkp n SER 32 N 4.58 5.48 -3.65 2.11 7.64 -1.26 -3.80 113.62 124.72 2dkp n SER 32 Ca -0.19 -2.56 -0.27 0.00 1.01 0.00 0.00 58.87 56.86 2dkp n SER 32 Cb 0.48 -1.26 -0.16 0.00 -1.01 0.00 0.00 64.21 62.26 2dkp n SER 32 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 2dkp s THR 33 N 0.07 0.20 0.00 0.44 -4.23 -1.26 -4.99 115.64 105.87 2dkp s THR 33 Ca 0.36 -0.49 0.00 0.00 -1.18 0.00 0.00 61.69 60.38 2dkp s THR 33 Cb 0.19 -0.88 0.00 0.00 1.34 0.00 0.00 72.50 73.15 2dkp s THR 33 CO -0.02 -0.36 0.00 0.61 -0.54 0.00 0.00 174.62 174.31 2dkp n GLY 34 N 5.16 1.99 3.09 3.99 0.00 -1.26 -4.70 105.19 113.46 2dkp n GLY 34 Ca -0.07 0.17 -0.26 0.00 0.00 0.00 0.00 46.02 45.86 2dkp n GLY 34 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2dkp s MET 35 N 0.00 1.98 -1.16 1.61 -2.45 -1.26 -5.06 119.30 112.97 2dkp s MET 35 Ca 0.00 -0.56 -0.23 0.00 -1.25 0.00 0.00 55.69 53.65 2dkp s MET 35 Cb 0.00 -1.62 -0.08 0.00 1.25 0.00 0.00 34.83 34.38 2dkp s MET 35 CO 0.00 0.12 1.93 0.15 1.05 0.00 0.00 175.02 178.27 2dkp s LYS 36 N 0.41 2.53 0.40 4.11 -0.14 -1.25 -4.63 119.74 121.17 2dkp s LYS 36 Ca -0.12 -1.09 0.06 0.00 -1.36 0.00 0.00 55.97 53.45 2dkp s LYS 36 Cb -0.15 -5.23 0.00 0.00 -1.68 0.00 0.00 37.83 30.77 2dkp s LYS 36 CO 0.04 -3.88 0.56 -0.51 -0.76 0.00 0.00 175.35 170.80 2dkp s LEU 37 N 10.77 3.77 -0.21 3.17 1.43 -1.26 -4.80 118.68 131.55 2dkp s LEU 37 Ca 0.68 -0.18 -0.09 0.00 -1.03 0.00 0.00 54.13 53.51 2dkp s LEU 37 Cb -0.01 -2.79 -0.05 0.00 0.03 0.00 0.00 46.19 43.37 2dkp s LEU 37 CO 0.12 -0.63 0.12 0.26 0.23 0.00 0.00 176.35 176.44 2dkp s TRP 38 N -2.33 3.33 0.07 0.29 0.52 -1.26 -2.70 118.94 116.85 2dkp s TRP 38 Ca 0.50 0.21 0.05 0.00 0.02 0.00 0.00 56.10 56.87 2dkp s TRP 38 Cb -0.10 -2.18 -0.04 0.00 -1.15 0.00 0.00 33.47 30.00 2dkp s TRP 38 CO 0.33 0.16 -0.03 0.15 0.02 0.00 0.00 176.95 177.59 2dkp s LYS 39 N 0.64 2.51 -0.27 4.98 3.01 -0.44 -4.94 119.74 125.24 2dkp s LYS 39 Ca 0.07 -0.83 -0.13 0.00 -1.01 0.00 0.00 55.97 54.07 2dkp s LYS 39 Cb -0.12 -2.51 -0.04 0.00 -1.01 0.00 0.00 37.83 34.14 2dkp s LYS 39 CO 0.01 0.55 0.29 0.21 0.51 0.00 0.00 175.35 176.93 2dkp s LYS 40 N -2.08 4.01 0.22 1.68 2.47 -1.26 -2.79 119.74 121.99 2dkp s LYS 40 Ca 0.23 -0.10 -0.16 0.00 -1.56 0.00 0.00 55.97 54.38 2dkp s LYS 40 Cb -0.11 -3.64 0.02 0.00 -1.46 0.00 0.00 37.83 32.63 2dkp s LYS 40 CO 0.15 -0.20 0.53 0.50 0.16 0.00 0.00 175.35 176.49 2dkp s ARG 41 N 1.82 1.47 -0.06 4.03 3.52 -1.21 -5.07 118.95 123.44 2dkp s ARG 41 Ca 0.12 -1.00 -0.26 0.00 -0.13 0.00 0.00 55.73 54.46 2dkp s ARG 41 Cb -0.16 0.51 -0.03 0.00 -1.56 0.00 0.00 34.95 33.72 2dkp s ARG 41 CO 0.10 -0.63 0.84 -0.46 -0.81 0.00 0.00 175.30 174.34 2dkp s TRP 42 N -3.92 3.58 -0.04 5.12 -0.00 -1.26 -2.55 118.94 119.88 2dkp s TRP 42 Ca 0.13 1.43 0.03 0.00 -0.00 0.00 0.00 56.10 57.70 2dkp s TRP 42 Cb -0.01 -2.97 0.00 0.00 -0.00 0.00 0.00 33.47 30.49 2dkp s TRP 42 CO 0.02 -0.02 -0.13 -0.06 -0.00 0.00 0.00 176.95 176.76 2dkp s PHE 43 N 1.15 1.37 -0.04 5.86 0.40 -1.22 -3.24 117.98 122.26 2dkp s PHE 43 Ca 0.43 -0.38 0.03 0.00 -0.60 0.00 0.00 56.93 56.42 2dkp s PHE 43 Cb -0.19 -0.94 0.00 0.00 0.51 0.00 0.00 43.02 42.40 2dkp s PHE 43 CO 0.21 -0.14 -0.13 0.08 0.70 0.00 0.00 175.22 175.93 2dkp s VAL 44 N 0.14 1.16 -0.54 -0.44 1.01 -0.34 -2.08 120.40 119.32 2dkp s VAL 44 Ca -0.04 -0.55 -0.14 0.00 0.00 0.00 0.00 61.98 61.25 2dkp s VAL 44 Cb -0.10 -1.01 0.13 0.00 0.00 0.00 0.00 36.38 35.39 2dkp s VAL 44 CO 0.01 0.35 0.47 -0.22 0.00 0.00 0.00 175.10 175.71 2dkp s LEU 45 N 0.22 6.08 0.06 3.92 1.98 -0.19 -2.39 118.68 128.35 2dkp s LEU 45 Ca -0.06 -1.88 0.00 0.00 -2.89 0.00 0.00 54.13 49.31 2dkp s LEU 45 Cb -0.11 -2.15 -0.03 0.00 0.66 0.00 0.00 46.19 44.55 2dkp s LEU 45 CO 0.02 -0.80 -0.05 -0.94 -1.89 0.00 0.00 176.35 172.70 2dkp s SER 46 N 3.24 0.70 -1.64 3.68 1.04 -1.11 -1.09 113.70 118.52 2dkp s SER 46 Ca 0.05 -0.85 -0.10 0.00 0.48 0.00 0.00 55.95 55.52 2dkp s SER 46 Cb -0.28 0.13 0.10 0.00 0.10 0.00 0.00 66.02 66.07 2dkp s SER 46 CO 0.01 -0.45 0.41 -0.67 0.98 0.00 0.00 173.24 173.52 2dkp n ASP 47 N 0.52 -0.95 -4.28 7.02 2.03 -1.26 0.22 116.55 119.84 2dkp n ASP 47 Ca -0.16 -1.16 -0.35 0.00 0.52 0.00 0.00 54.79 53.64 2dkp n ASP 47 Cb 0.59 -2.14 -0.06 0.00 -0.72 0.00 0.00 41.12 38.79 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 -4.37 -1.41 -4.02 -2.67 4.32 -1.26 -4.92 117.00 102.67 2dkp n LEU 48 Ca -0.12 -1.13 -0.10 0.00 -0.02 0.00 0.00 56.01 54.64 2dkp n LEU 48 Cb 0.59 -1.88 -0.08 0.00 -1.62 0.00 0.00 43.42 40.43 2dkp n LEU 48 CO 0.86 0.31 -0.08 0.00 -1.22 0.00 0.00 177.39 177.27 2dkp s LEU 50 N -3.00 3.34 -0.01 0.00 1.43 0.27 -2.76 118.68 117.95 2dkp s LEU 50 Ca 0.21 -0.15 0.05 0.00 -1.03 0.00 0.00 54.13 53.21 2dkp s LEU 50 Cb 0.04 -1.84 -0.01 0.00 0.03 0.00 0.00 46.19 44.41 2dkp s LEU 50 CO 0.02 0.09 -0.15 -0.36 0.23 0.00 0.00 176.35 176.18 2dkp s PHE 51 N 0.82 1.37 0.04 0.29 0.08 -1.01 -0.19 117.98 119.39 2dkp s PHE 51 Ca 0.01 -0.26 0.02 0.00 0.12 0.00 0.00 56.93 56.81 2dkp s PHE 51 Cb -0.14 -0.88 -0.02 0.00 -0.57 0.00 0.00 43.02 41.41 2dkp s PHE 51 CO 0.02 -0.02 -0.07 1.52 -0.10 0.00 0.00 175.22 176.57 2dkp s TYR 52 N -0.39 0.62 0.04 0.36 -0.85 -1.24 -1.19 117.35 114.70 2dkp s TYR 52 Ca 0.06 -0.51 0.02 0.00 -0.52 0.00 0.00 57.07 56.12 2dkp s TYR 52 Cb -0.06 -0.38 -0.02 0.00 0.38 0.00 0.00 41.96 41.88 2dkp s TYR 52 CO -0.00 -0.10 -0.07 0.71 -1.52 0.00 0.00 175.55 174.57 2dkp s TYR 53 N -1.40 0.60 0.29 -3.49 1.51 -1.20 -3.24 117.35 110.43 2dkp s TYR 53 Ca -0.11 -0.53 0.22 0.00 -1.01 0.00 0.00 57.07 55.64 2dkp s TYR 53 Cb -0.10 -0.37 0.99 0.00 -0.11 0.00 0.00 41.96 42.38 2dkp s TYR 53 CO 0.00 -0.11 1.04 0.54 -1.11 0.00 0.00 175.55 175.91 2dkp n ARG 54 N 1.40 -0.02 -3.87 -0.62 3.00 -1.26 -4.06 116.66 111.22 2dkp n ARG 54 Ca -0.22 0.83 -0.03 0.00 -0.01 0.00 0.00 57.85 58.42 2dkp n ARG 54 Cb 0.55 -1.64 0.01 0.00 0.00 0.00 0.00 32.46 31.38 2dkp n ARG 54 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.63 177.79 2dkp s ASP 55 N -4.37 -0.02 0.51 0.55 1.47 -1.26 -4.79 116.67 108.76 2dkp s ASP 55 Ca -0.05 -0.60 0.37 0.00 1.18 0.00 0.00 52.55 53.46 2dkp s ASP 55 Cb 0.21 0.46 1.53 0.00 -0.34 0.00 0.00 42.92 44.78 2dkp s ASP 55 CO 0.55 -0.91 1.69 1.05 0.68 0.00 0.00 175.17 178.22 2dkp h GLU 56 N 2.00 0.06 -1.69 2.11 4.11 -1.95 0.16 114.58 119.38 2dkp h GLU 56 Ca -0.27 -0.00 0.49 0.00 0.07 0.00 0.00 59.36 59.65 2dkp h GLU 56 Cb 1.22 -0.01 -0.07 0.00 0.50 0.00 0.00 28.75 30.38 2dkp h GLU 56 CO 0.34 0.04 1.32 0.87 0.07 0.00 0.00 179.01 181.65 2dkp h LYS 57 N 0.06 0.00 -5.75 1.06 1.57 -1.94 -3.44 116.57 108.13 2dkp h LYS 57 Ca 0.75 0.00 -0.38 0.00 -1.87 0.00 0.00 60.65 59.14 2dkp h LYS 57 Cb 2.73 0.00 0.14 0.00 0.08 0.00 0.00 32.23 35.18 2dkp h LYS 57 CO -0.14 0.00 -0.69 0.39 -0.57 0.00 0.00 179.45 178.44 2dkp n GLU 58 N -3.81 -7.66 -0.98 3.15 1.02 0.55 -5.00 120.64 107.91 2dkp n GLU 58 Ca 0.38 0.82 -0.19 0.00 -0.02 0.00 0.00 57.16 58.15 2dkp n GLU 58 Cb 1.83 -5.84 0.14 0.00 -0.02 0.00 0.00 31.44 27.55 2dkp n GLU 58 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 2dkp n GLU 59 N -4.80 -1.50 -1.05 3.49 1.02 -1.26 -4.77 120.64 111.76 2dkp n GLU 59 Ca -0.04 -1.23 -0.35 0.00 -0.02 0.00 0.00 57.16 55.51 2dkp n GLU 59 Cb 0.58 -0.95 -0.10 0.00 -0.02 0.00 0.00 31.44 30.94 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 -1.26 -0.28 3.47 0.62 0.00 -1.26 -4.69 105.19 101.79 2dkp n GLY 60 Ca 0.10 0.85 -0.54 0.00 0.00 0.00 0.00 46.02 46.44 2dkp n GLY 60 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2dkp n ILE 61 N 5.33 0.84 0.03 -0.61 5.41 -1.26 -4.82 119.36 124.28 2dkp n ILE 61 Ca 0.46 -0.21 -0.10 0.00 1.00 0.00 0.00 62.75 63.91 2dkp n ILE 61 Cb 0.00 -0.05 -0.13 0.00 -0.71 0.00 0.00 39.64 38.75 2dkp n ILE 61 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 176.55 176.48 2dkp h LEU 62 N 2.24 0.08 -7.00 1.39 3.38 -1.82 -3.49 115.31 110.09 2dkp h LEU 62 Ca -0.42 -0.11 0.22 0.00 0.09 0.00 0.00 57.88 57.67 2dkp h LEU 62 Cb 1.43 -0.02 -0.29 0.00 0.09 0.00 0.00 40.66 41.87 2dkp h LEU 62 CO 0.62 1.09 0.92 -0.83 0.09 0.00 0.00 178.44 180.33 2dkp s GLY 63 N -4.91 0.15 0.28 0.83 0.00 -1.26 -5.12 107.32 97.29 2dkp s GLY 63 Ca -0.03 3.00 0.08 0.00 0.00 0.00 0.00 44.72 47.76 2dkp s GLY 63 CO 0.83 1.34 0.19 -1.35 0.00 0.00 0.00 173.10 174.10 2dkp s SER 64 N -0.73 5.27 -0.06 1.64 1.04 -1.26 -3.69 113.70 115.91 2dkp s SER 64 Ca 0.08 -0.40 -0.01 0.00 0.48 0.00 0.00 55.95 56.10 2dkp s SER 64 Cb -0.02 -1.17 0.03 0.00 0.10 0.00 0.00 66.02 64.95 2dkp s SER 64 CO -0.10 -0.13 -0.01 -0.63 0.98 0.00 0.00 173.24 173.36 2dkp s ILE 65 N -2.22 0.39 -0.35 -1.02 1.01 0.74 -5.00 121.20 114.74 2dkp s ILE 65 Ca 0.35 0.06 -0.27 0.00 0.00 0.00 0.00 60.65 60.79 2dkp s ILE 65 Cb -0.07 -0.51 0.02 0.00 0.01 0.00 0.00 42.46 41.91 2dkp s ILE 65 CO 0.24 0.24 1.00 -0.76 0.00 0.00 0.00 174.94 175.67 2dkp s LEU 66 N 1.63 3.94 0.03 2.97 2.01 -1.26 -0.56 118.68 127.44 2dkp s LEU 66 Ca -0.00 0.79 -0.17 0.00 0.01 0.00 0.00 54.13 54.76 2dkp s LEU 66 Cb -0.13 -3.40 -0.26 0.00 0.01 0.00 0.00 46.19 42.42 2dkp s LEU 66 CO -0.04 -0.88 1.10 -0.07 1.01 0.00 0.00 176.35 177.48 2dkp h LEU 67 N 10.13 0.72 -1.56 1.79 3.38 -1.82 -3.23 115.31 124.73 2dkp h LEU 67 Ca -0.22 -0.79 0.16 0.00 0.09 0.00 0.00 57.88 57.12 2dkp h LEU 67 Cb 1.07 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 41.57 2dkp h LEU 67 CO 1.01 1.43 0.72 -0.65 0.09 0.00 0.00 178.44 181.04 2dkp h PRO 68 N 0.11 0.00 0.00 1.13 0.11 -1.23 0.94 132.00 133.05 2dkp h PRO 68 Ca -0.13 0.00 -0.07 0.00 0.11 0.00 0.00 66.00 65.91 2dkp h PRO 68 Cb 1.61 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.70 2dkp h PRO 68 CO 0.18 0.00 -1.54 -1.13 -0.21 0.00 0.00 178.00 175.30 2dkp n SER 69 N -3.38 0.50 -4.87 -2.05 3.41 -1.23 -4.80 113.62 101.20 2dkp n SER 69 Ca 0.11 0.20 -0.30 0.00 -0.26 0.00 0.00 58.87 58.62 2dkp n SER 69 Cb 0.92 0.94 -0.01 0.00 -0.26 0.00 0.00 64.21 65.79 2dkp n SER 69 CO 0.00 0.00 0.00 -0.36 -0.16 0.00 0.00 175.04 174.52 2dkp s PHE 70 N -3.24 3.54 -0.28 7.33 0.08 0.32 -4.48 117.98 121.26 2dkp s PHE 70 Ca -0.04 1.15 0.03 0.00 0.12 0.00 0.00 56.93 58.19 2dkp s PHE 70 Cb 0.10 -2.57 0.07 0.00 -0.57 0.00 0.00 43.02 40.06 2dkp s PHE 70 CO 0.84 -0.40 -0.04 -1.14 -0.10 0.00 0.00 175.22 174.37 2dkp s GLN 71 N -4.57 1.87 -0.25 0.44 0.74 0.59 -4.77 119.66 113.70 2dkp s GLN 71 Ca 0.53 -1.46 -0.29 0.00 0.05 0.00 0.00 55.36 54.19 2dkp s GLN 71 Cb -0.10 -2.92 0.01 0.00 1.10 0.00 0.00 33.01 31.09 2dkp s GLN 71 CO 0.42 -0.71 1.04 0.42 -0.55 0.00 0.00 175.29 175.92 2dkp s ILE 72 N 1.09 4.64 -0.13 -2.34 -1.09 -1.26 -1.85 121.20 120.26 2dkp s ILE 72 Ca -0.02 1.94 -0.09 0.00 -2.23 0.00 0.00 60.65 60.25 2dkp s ILE 72 Cb -0.19 -4.33 0.04 0.00 -1.58 0.00 0.00 42.46 36.40 2dkp s ILE 72 CO -0.07 -0.26 0.32 0.00 -1.23 0.00 0.00 174.94 173.71 2dkp s ALA 73 N 3.31 -0.80 0.44 9.38 0.00 -0.92 -5.02 121.76 128.15 2dkp s ALA 73 Ca 0.44 1.11 -0.21 0.00 0.00 0.00 0.00 51.96 53.30 2dkp s ALA 73 Cb -0.14 -0.67 -0.14 0.00 0.00 0.00 0.00 23.12 22.17 2dkp s ALA 73 CO 0.09 -0.20 0.30 1.28 0.00 0.00 0.00 175.76 177.23 2dkp n LEU 74 N 3.67 -1.38 -4.74 0.00 4.77 -1.26 -3.05 117.00 115.01 2dkp n LEU 74 Ca -0.19 0.83 -0.34 0.00 -0.03 0.00 0.00 56.01 56.28 2dkp n LEU 74 Cb 0.56 -1.01 0.08 0.00 -2.33 0.00 0.00 43.42 40.72 2dkp n LEU 74 CO 0.13 -3.59 0.78 -0.76 -1.33 0.00 0.00 177.39 172.62 2dkp s LEU 75 N 2.95 3.35 0.00 2.23 1.43 -1.26 -4.80 118.68 122.58 2dkp s LEU 75 Ca 0.62 2.22 0.03 0.00 -1.03 0.00 0.00 54.13 55.97 2dkp s LEU 75 Cb -0.59 -4.57 -0.01 0.00 0.03 0.00 0.00 46.19 41.04 2dkp s LEU 75 CO 0.60 -2.03 0.12 0.35 0.23 0.00 0.00 176.35 175.62 2dkp n THR 76 N -2.60 0.00 -0.17 5.49 -2.24 -1.26 -5.05 114.28 108.45 2dkp n THR 76 Ca 0.12 -2.24 -0.08 0.00 -2.27 0.00 0.00 64.05 59.57 2dkp n THR 76 Cb 0.51 0.76 0.01 0.00 -2.10 0.00 0.00 70.33 69.51 2dkp n THR 76 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 2dkp h SER 77 N 1.48 0.70 -0.80 3.42 0.02 -2.02 -2.84 113.55 113.51 2dkp h SER 77 Ca -0.31 -0.18 0.15 0.00 -0.84 0.00 0.00 61.79 60.61 2dkp h SER 77 Cb 1.15 -0.18 -0.10 0.00 0.14 0.00 0.00 62.40 63.42 2dkp h SER 77 CO 0.50 0.68 0.36 -0.33 -1.14 0.00 0.00 176.83 176.90 2dkp h GLU 78 N 0.67 0.50 -1.09 3.45 5.08 -2.03 0.15 114.58 121.30 2dkp h GLU 78 Ca 0.17 -0.03 0.32 0.00 -1.00 0.00 0.00 59.36 58.81 2dkp h GLU 78 Cb 0.21 -0.11 -0.04 0.00 0.50 0.00 0.00 28.75 29.30 2dkp h GLU 78 CO -0.01 0.33 0.93 -0.44 -1.00 0.00 0.00 179.01 178.82 2dkp h ASP 79 N 0.51 0.00 -2.26 1.42 5.19 -1.91 -3.44 116.42 115.93 2dkp h ASP 79 Ca 0.45 0.00 -0.40 0.00 -0.62 0.00 0.00 57.03 56.46 2dkp h ASP 79 Cb 0.68 0.00 -0.08 0.00 0.18 0.00 0.00 39.33 40.11 2dkp h ASP 79 CO -0.40 0.00 -0.45 1.41 -3.12 0.00 0.00 179.24 176.68 2dkp n HIS 80 N -3.82 -0.64 -0.14 4.55 8.25 0.53 -4.84 115.22 119.11 2dkp n HIS 80 Ca 0.24 0.00 -0.26 0.00 -0.26 0.00 0.00 57.72 57.44 2dkp n HIS 80 Cb 1.29 -3.62 -0.11 0.00 1.12 0.00 0.00 29.99 28.67 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 -3.25 1.50 -3.20 1.59 5.41 -1.26 -5.00 119.36 115.15 2dkp n ILE 81 Ca -0.22 -0.44 -0.23 0.00 1.00 0.00 0.00 62.75 62.85 2dkp n ILE 81 Cb 0.67 -1.72 0.03 0.00 -0.71 0.00 0.00 39.64 37.90 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 -3.91 -5.42 -4.41 4.38 2.85 -1.26 -4.96 115.26 102.53 2dkp n ASN 82 Ca -0.52 -0.36 -0.36 0.00 -0.11 0.00 0.00 54.58 53.24 2dkp n ASN 82 Cb 0.92 -4.38 -0.13 0.00 1.24 0.00 0.00 39.78 37.42 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 -5.88 3.55 1.13 1.20 6.06 -1.26 -5.10 118.95 118.65 2dkp s ARG 83 Ca 0.37 -0.54 -0.17 0.00 -2.50 0.00 0.00 55.73 52.89 2dkp s ARG 83 Cb -0.17 -3.25 0.25 0.00 0.06 0.00 0.00 34.95 31.84 2dkp s ARG 83 CO 0.46 -0.21 1.14 0.15 -2.50 0.00 0.00 175.30 174.34 2dkp s LYS 84 N 1.58 -0.61 -1.80 5.12 1.02 -1.26 -3.85 119.74 119.93 2dkp s LYS 84 Ca 0.06 -0.02 -0.20 0.00 0.02 0.00 0.00 55.97 55.83 2dkp s LYS 84 Cb -0.15 -1.66 0.19 0.00 -0.52 0.00 0.00 37.83 35.69 2dkp s LYS 84 CO 0.02 -3.32 0.59 0.66 -0.92 0.00 0.00 175.35 172.38 2dkp n TYR 85 N -4.49 -1.33 -3.97 3.18 4.02 -1.26 -4.80 117.16 108.51 2dkp n TYR 85 Ca 0.12 0.71 -0.08 0.00 -0.01 0.00 0.00 57.90 58.64 2dkp n TYR 85 Cb 0.59 -2.26 -0.08 0.00 -0.02 0.00 0.00 39.34 37.56 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 -3.39 0.14 0.28 -0.72 0.00 -1.25 -1.91 121.76 114.90 2dkp s ALA 86 Ca 0.71 -0.92 0.03 0.00 0.00 0.00 0.00 51.96 51.78 2dkp s ALA 86 Cb -0.41 0.53 -0.01 0.00 0.00 0.00 0.00 23.12 23.23 2dkp s ALA 86 CO 1.00 -0.49 0.30 1.97 0.00 0.00 0.00 175.76 178.54 2dkp n PHE 87 N -0.04 -0.92 -3.88 0.00 -1.74 0.39 -4.12 117.46 107.14 2dkp n PHE 87 Ca -0.13 -2.11 -0.11 0.00 -0.56 0.00 0.00 57.45 54.55 2dkp n PHE 87 Cb 0.62 0.33 -0.12 0.00 1.52 0.00 0.00 39.48 41.84 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 -2.89 0.26 -0.22 3.97 -2.85 -1.17 -1.63 119.74 115.20 2dkp s LYS 88 Ca 0.28 -0.20 -0.00 0.00 -1.00 0.00 0.00 55.97 55.05 2dkp s LYS 88 Cb 0.01 0.11 0.02 0.00 -2.06 0.00 0.00 37.83 35.91 2dkp s LYS 88 CO 0.20 -0.05 -0.12 0.00 0.10 0.00 0.00 175.35 175.48 2dkp s ALA 89 N -0.72 2.55 0.11 0.59 0.00 0.64 -2.17 121.76 122.76 2dkp s ALA 89 Ca -0.08 -1.36 -0.13 0.00 0.00 0.00 0.00 51.96 50.38 2dkp s ALA 89 Cb -0.05 -1.48 -0.06 0.00 0.00 0.00 0.00 23.12 21.53 2dkp s ALA 89 CO 0.00 -0.63 0.49 0.00 0.00 0.00 0.00 175.76 175.62 2dkp s ALA 90 N 1.30 3.64 -0.00 0.00 0.00 -0.77 0.53 121.76 126.46 2dkp s ALA 90 Ca 0.02 -0.21 0.03 0.00 0.00 0.00 0.00 51.96 51.80 2dkp s ALA 90 Cb -0.15 -2.43 -0.01 0.00 0.00 0.00 0.00 23.12 20.52 2dkp s ALA 90 CO -0.08 0.49 -0.11 -1.58 0.00 0.00 0.00 175.76 174.49 2dkp s HIS 91 N -1.38 0.95 0.01 0.00 2.46 -1.19 -0.30 115.29 115.83 2dkp s HIS 91 Ca 0.34 -0.20 -0.21 0.00 0.47 0.00 0.00 55.06 55.47 2dkp s HIS 91 Cb -0.15 -0.61 -0.20 0.00 -0.13 0.00 0.00 32.58 31.49 2dkp s HIS 91 CO 0.18 -0.01 1.17 -1.00 -2.47 0.00 0.00 174.74 172.61 2dkp h PRO 92 N 5.79 0.35 -0.63 2.88 0.13 -1.90 -3.25 132.00 135.36 2dkp h PRO 92 Ca -0.32 -0.29 0.00 0.00 -0.87 0.00 0.00 66.00 64.52 2dkp h PRO 92 Cb 1.17 0.06 0.00 0.00 0.13 0.00 0.00 31.00 32.37 2dkp h PRO 92 CO 0.49 0.94 0.00 0.09 -0.23 0.00 0.00 178.00 179.29 2dkp n ASN 93 N -4.40 3.55 -2.63 1.44 3.02 -1.26 -4.95 115.26 110.03 2dkp n ASN 93 Ca -0.09 -2.08 -0.12 0.00 -0.03 0.00 0.00 54.58 52.26 2dkp n ASN 93 Cb 0.52 -0.45 -0.03 0.00 -0.61 0.00 0.00 39.78 39.22 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 1.27 0.56 -1.39 3.52 2.81 -1.23 -5.18 117.12 117.48 2dkp n MET 94 Ca 0.21 -2.30 -0.17 0.00 -1.81 0.00 0.00 57.70 53.64 2dkp n MET 94 Cb 0.59 2.19 0.11 0.00 -0.71 0.00 0.00 33.22 35.39 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 -0.47 -0.45 -3.57 0.03 1.85 -1.26 -4.15 116.66 108.64 2dkp n ARG 95 Ca 0.01 -1.40 -0.38 0.00 -1.00 0.00 0.00 57.85 55.08 2dkp n ARG 95 Cb 0.48 -0.68 -0.11 0.00 -1.05 0.00 0.00 32.46 31.10 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 -2.43 5.29 0.63 8.89 2.01 -1.26 -3.18 115.64 125.59 2dkp s THR 96 Ca 0.44 0.19 -0.04 0.00 0.31 0.00 0.00 61.69 62.59 2dkp s THR 96 Cb -0.02 -3.56 0.04 0.00 0.01 0.00 0.00 72.50 68.97 2dkp s THR 96 CO 0.30 0.23 0.91 -0.31 -0.69 0.00 0.00 174.62 175.06 2dkp s TYR 97 N 1.79 3.00 -0.10 4.92 1.51 0.19 -4.85 117.35 123.80 2dkp s TYR 97 Ca 0.08 0.38 -0.05 0.00 -1.01 0.00 0.00 57.07 56.47 2dkp s TYR 97 Cb -0.16 -2.94 0.05 0.00 -0.11 0.00 0.00 41.96 38.80 2dkp s TYR 97 CO 0.11 -1.09 0.23 0.71 -1.11 0.00 0.00 175.55 174.40 2dkp s TYR 98 N -3.04 -0.32 0.12 2.71 1.51 -1.26 -0.26 117.35 116.82 2dkp s TYR 98 Ca 0.57 0.77 0.07 0.00 -1.01 0.00 0.00 57.07 57.48 2dkp s TYR 98 Cb -0.11 -0.01 -0.04 0.00 -0.11 0.00 0.00 41.96 41.70 2dkp s TYR 98 CO 0.43 -0.25 -0.17 -0.06 -1.11 0.00 0.00 175.55 174.38 2dkp s PHE 99 N 1.54 1.63 0.09 2.71 0.08 -0.65 -1.35 117.98 122.03 2dkp s PHE 99 Ca -0.06 -0.47 -0.09 0.00 0.12 0.00 0.00 56.93 56.42 2dkp s PHE 99 Cb -0.11 -0.86 0.00 0.00 -0.57 0.00 0.00 43.02 41.48 2dkp s PHE 99 CO -0.08 0.21 0.21 0.00 -0.10 0.00 0.00 175.22 175.46 2dkp n THR 101 N -0.07 0.00 -0.03 0.00 -2.24 -0.80 -3.84 114.28 107.30 2dkp n THR 101 Ca -0.15 -1.27 -0.22 0.00 -2.27 0.00 0.00 64.05 60.14 2dkp n THR 101 Cb 0.62 0.40 -0.13 0.00 -2.10 0.00 0.00 70.33 69.12 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 0.80 0.26 -3.75 3.42 5.19 -1.92 -3.47 116.42 116.94 2dkp h ASP 102 Ca -0.19 -0.77 -0.44 0.00 -0.62 0.00 0.00 57.03 55.01 2dkp h ASP 102 Cb 0.66 -0.08 -0.14 0.00 0.18 0.00 0.00 39.33 39.94 2dkp h ASP 102 CO 0.30 1.69 -0.59 0.42 -3.12 0.00 0.00 179.24 177.93 2dkp s THR 103 N -2.47 0.82 0.27 0.35 -4.23 -1.26 -5.04 115.64 104.08 2dkp s THR 103 Ca -0.24 -2.00 -0.00 0.00 -1.18 0.00 0.00 61.69 58.26 2dkp s THR 103 Cb 0.06 -2.65 0.27 0.00 1.34 0.00 0.00 72.50 71.52 2dkp s THR 103 CO 0.70 0.00 1.85 1.23 -0.54 0.00 0.00 174.62 177.86 2dkp h GLY 104 N 2.16 1.58 0.45 3.99 0.00 -1.95 -2.84 103.07 106.46 2dkp h GLY 104 Ca -0.39 -0.43 -0.01 0.00 0.00 0.00 0.00 47.33 46.50 2dkp h GLY 104 CO 0.63 0.22 -0.41 1.70 0.00 0.00 0.00 176.54 178.68 2dkp h LYS 105 N 1.04 -0.82 -0.03 4.80 1.63 -1.98 0.26 116.57 121.46 2dkp h LYS 105 Ca 0.47 0.06 0.01 0.00 -0.85 0.00 0.00 60.65 60.33 2dkp h LYS 105 Cb 0.37 0.19 -0.00 0.00 -0.60 0.00 0.00 32.23 32.19 2dkp h LYS 105 CO -0.23 -0.55 0.53 0.93 -3.45 0.00 0.00 179.45 176.68 2dkp h GLU 106 N -0.85 0.00 0.12 1.90 4.39 -1.93 0.46 114.58 118.67 2dkp h GLU 106 Ca -0.06 0.00 -0.35 0.00 0.34 0.00 0.00 59.36 59.29 2dkp h GLU 106 Cb 0.73 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 29.36 2dkp h GLU 106 CO -0.03 0.00 -1.91 1.98 -1.16 0.00 0.00 179.01 177.89 2dkp h MET 107 N 0.00 0.25 -0.23 2.33 4.05 -0.93 -3.27 114.93 117.14 2dkp h MET 107 Ca 0.02 -0.43 -0.12 0.00 -0.28 0.00 0.00 59.70 58.88 2dkp h MET 107 Cb 1.08 0.16 -0.01 0.00 -0.80 0.00 0.00 31.60 32.03 2dkp h MET 107 CO -0.00 1.14 -0.37 1.05 0.23 0.00 0.00 176.91 178.96 2dkp h GLU 108 N 0.07 0.50 -0.52 0.39 4.11 0.32 0.77 114.58 120.23 2dkp h GLU 108 Ca -0.39 -0.24 -0.11 0.00 0.07 0.00 0.00 59.36 58.69 2dkp h GLU 108 Cb 2.04 -0.00 -0.02 0.00 0.50 0.00 0.00 28.75 31.27 2dkp h GLU 108 CO 0.10 0.80 -0.11 -0.07 0.07 0.00 0.00 179.01 179.81 2dkp h LEU 109 N 0.42 0.99 0.00 3.06 3.38 -1.19 -0.33 115.31 121.65 2dkp h LEU 109 Ca 0.04 -0.35 -0.06 0.00 0.09 0.00 0.00 57.88 57.60 2dkp h LEU 109 Cb 0.85 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 41.33 2dkp h LEU 109 CO 0.07 1.11 -0.23 -0.50 0.09 0.00 0.00 178.44 178.98 2dkp h TRP 110 N 0.85 0.23 0.75 1.13 -0.00 -1.58 -3.28 115.95 114.04 2dkp h TRP 110 Ca 0.13 -0.13 -0.04 0.00 -0.00 0.00 0.00 58.89 58.86 2dkp h TRP 110 Cb 0.67 -0.03 0.01 0.00 -0.00 0.00 0.00 29.16 29.81 2dkp h TRP 110 CO 0.05 0.94 -0.36 0.52 -0.00 0.00 0.00 178.44 179.59 2dkp h MET 111 N -0.54 -0.97 -0.74 0.49 2.86 -0.88 0.22 114.93 115.37 2dkp h MET 111 Ca -0.03 0.07 0.26 0.00 -2.06 0.00 0.00 59.70 57.94 2dkp h MET 111 Cb 1.00 0.22 -0.14 0.00 0.06 0.00 0.00 31.60 32.75 2dkp h MET 111 CO 0.05 -0.64 0.23 1.63 1.06 0.00 0.00 176.91 179.23 2dkp n LYS 112 N -4.70 -0.05 -0.02 1.72 4.76 -0.14 -0.19 118.16 119.54 2dkp n LYS 112 Ca -0.12 1.06 -0.00 0.00 -2.87 0.00 0.00 58.31 56.37 2dkp n LYS 112 Cb 0.40 -1.80 -0.00 0.00 -1.84 0.00 0.00 35.03 31.78 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 1.48 -0.02 -0.95 7.82 0.00 -1.56 -3.20 119.26 122.82 2dkp h ALA 113 Ca 0.55 -0.00 0.13 0.00 0.00 0.00 0.00 54.91 55.59 2dkp h ALA 113 Cb 1.34 0.01 -0.14 0.00 0.00 0.00 0.00 17.79 19.00 2dkp h ALA 113 CO -0.62 -0.02 -0.42 -1.33 0.00 0.00 0.00 179.25 176.85 2dkp n MET 114 N -3.68 -0.28 -0.32 0.00 2.81 0.75 0.15 117.12 116.55 2dkp n MET 114 Ca -0.00 1.46 0.12 0.00 -1.81 0.00 0.00 57.70 57.47 2dkp n MET 114 Cb 0.01 -2.16 0.34 0.00 -0.71 0.00 0.00 33.22 30.70 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 0.73 -0.41 4.03 -0.00 -0.75 1.18 115.31 120.10 2dkp h LEU 115 Ca 0.28 0.07 -0.17 0.00 -0.00 0.00 0.00 57.88 58.06 2dkp h LEU 115 Cb 0.52 -0.07 -0.00 0.00 -0.00 0.00 0.00 40.66 41.10 2dkp h LEU 115 CO -0.93 0.32 -0.49 0.44 -0.00 0.00 0.00 178.44 177.78 2dkp h ASP 116 N 0.75 0.88 1.57 -0.43 5.19 0.13 0.14 116.42 124.65 2dkp h ASP 116 Ca 0.52 -0.44 0.00 0.00 -0.62 0.00 0.00 57.03 56.49 2dkp h ASP 116 Cb 0.82 -0.25 0.00 0.00 0.18 0.00 0.00 39.33 40.08 2dkp h ASP 116 CO -0.29 1.21 -0.13 0.00 -3.12 0.00 0.00 179.24 176.91 2dkp h ALA 117 N 0.81 0.92 0.07 3.45 0.00 0.13 -2.82 119.26 121.82 2dkp h ALA 117 Ca 0.03 0.00 -0.31 0.00 0.00 0.00 0.00 54.91 54.63 2dkp h ALA 117 Cb 1.07 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.83 2dkp h ALA 117 CO 0.11 0.00 -1.67 0.00 0.00 0.00 0.00 179.25 177.69 2dkp n ALA 118 N -1.93 0.84 0.23 0.00 0.00 0.39 -0.88 120.51 119.16 2dkp n ALA 118 Ca 0.04 -0.55 0.11 0.00 0.00 0.00 0.00 53.44 53.05 2dkp n ALA 118 Cb 0.48 -0.61 0.52 0.00 0.00 0.00 0.00 19.45 19.83 2dkp n ALA 118 CO 0.00 0.00 0.00 1.37 0.00 0.00 0.00 177.50 178.87 2dkp h LEU 119 N -0.44 0.00 -6.06 0.00 8.10 -0.83 -3.41 115.31 112.66 2dkp h LEU 119 Ca -0.40 0.00 -0.56 0.00 0.11 0.00 0.00 57.88 57.04 2dkp h LEU 119 Cb 1.69 0.00 0.02 0.00 -0.44 0.00 0.00 40.66 41.93 2dkp h LEU 119 CO -0.06 0.18 0.22 0.55 -4.11 0.00 0.00 178.44 175.23 2dkp n VAL 120 N -3.37 0.00 -1.46 0.15 3.14 -1.06 -4.79 118.33 110.93 2dkp n VAL 120 Ca 0.00 0.00 -0.32 0.00 -2.96 0.00 0.00 64.34 61.06 2dkp n VAL 120 Cb 0.39 -0.14 0.04 0.00 -1.06 0.00 0.00 33.84 33.06 2dkp n VAL 120 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 2dkp n GLN 121 N 1.73 2.50 0.00 1.45 6.02 -1.26 -4.34 117.38 123.48 2dkp n GLN 121 Ca 0.17 -2.89 0.11 0.00 -0.01 0.00 0.00 57.00 54.38 2dkp n GLN 121 Cb 0.01 -2.14 -0.01 0.00 1.02 0.00 0.00 30.24 29.12 2dkp n GLN 121 CO 0.00 0.00 0.00 -2.37 -1.01 0.00 0.00 177.06 173.68 2dkp n THR 122 N -0.26 0.01 -3.82 5.09 5.66 -1.26 -4.96 114.28 114.74 2dkp n THR 122 Ca 0.52 -0.03 -0.26 0.00 -3.05 0.00 0.00 64.05 61.23 2dkp n THR 122 Cb 0.50 0.71 -0.07 0.00 -1.55 0.00 0.00 70.33 69.92 2dkp n THR 122 CO 0.00 0.00 0.00 -0.24 -3.05 0.00 0.00 175.07 171.78 2dkp n SER 123 N -1.55 -0.03 0.00 1.09 2.88 -1.26 -4.82 113.62 109.92 2dkp n SER 123 Ca 0.04 -0.94 0.00 0.00 -1.33 0.00 0.00 58.87 56.64 2dkp n SER 123 Cb 0.35 -1.19 0.00 0.00 -0.75 0.00 0.00 64.21 62.62 2dkp n SER 123 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2dkp n GLY 124 N -1.73 -2.59 3.51 0.46 0.00 -1.26 -4.59 105.19 98.99 2dkp n GLY 124 Ca -0.13 0.49 -0.45 0.00 0.00 0.00 0.00 46.02 45.93 2dkp n GLY 124 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2dkp n PRO 125 N -0.65 0.81 -3.54 1.61 -0.02 -1.26 -4.96 135.00 126.98 2dkp n PRO 125 Ca 0.00 0.28 -0.35 0.00 -2.02 0.00 0.00 63.50 61.41 2dkp n PRO 125 Cb 0.00 -1.52 -0.06 0.00 -0.02 0.00 0.00 33.50 31.91 2dkp n PRO 125 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 2dkp s SER 126 N -0.75 6.69 -0.39 2.55 1.04 -1.26 -4.99 113.70 116.58 2dkp s SER 126 Ca 0.61 0.85 -0.31 0.00 0.48 0.00 0.00 55.95 57.58 2dkp s SER 126 Cb -0.77 -2.20 -0.09 0.00 0.10 0.00 0.00 66.02 63.06 2dkp s SER 126 CO 0.58 0.20 2.30 -1.54 0.98 0.00 0.00 173.24 175.76 2dkp n SER 127 N 1.10 2.37 0.00 7.02 3.41 -1.26 -5.25 113.62 121.01 2dkp n SER 127 Ca -0.09 0.11 0.00 0.00 -0.26 0.00 0.00 58.87 58.63 2dkp n SER 127 Cb 0.52 -1.40 0.00 0.00 -0.26 0.00 0.00 64.21 63.07 2dkp n SER 127 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49