#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dkp s SER 2 N 0.00 -0.59 0.56 1.61 0.01 -1.26 -5.17 113.70 108.86 2dkp s SER 2 Ca 0.00 1.15 0.02 0.00 1.31 0.00 0.00 55.95 58.43 2dkp s SER 2 Cb 0.00 1.38 0.04 0.00 0.21 0.00 0.00 66.02 67.66 2dkp s SER 2 CO 0.00 -0.22 0.78 -0.44 0.41 0.00 0.00 173.24 173.77 2dkp s SER 3 N 2.21 5.19 0.04 2.44 0.01 -1.26 -5.13 113.70 117.20 2dkp s SER 3 Ca -0.06 -0.11 0.00 0.00 1.31 0.00 0.00 55.95 57.09 2dkp s SER 3 Cb -0.10 -0.72 -0.00 0.00 0.21 0.00 0.00 66.02 65.41 2dkp s SER 3 CO -0.15 -1.20 0.01 0.61 0.41 0.00 0.00 173.24 172.92 2dkp n GLY 4 N -2.36 4.08 3.41 3.44 0.00 -1.26 -5.17 105.19 107.33 2dkp n GLY 4 Ca 0.09 -2.04 -0.14 0.00 0.00 0.00 0.00 46.02 43.93 2dkp n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dkp s SER 5 N -1.22 -0.52 -0.10 1.61 0.01 -1.26 -5.17 113.70 107.04 2dkp s SER 5 Ca 0.01 0.95 -0.32 0.00 1.31 0.00 0.00 55.95 57.90 2dkp s SER 5 Cb 0.00 0.97 0.12 0.00 0.21 0.00 0.00 66.02 67.32 2dkp s SER 5 CO 0.01 -0.23 1.06 -0.55 0.41 0.00 0.00 173.24 173.94 2dkp s SER 6 N 0.06 -0.24 0.00 2.44 0.15 -1.26 -5.19 113.70 109.67 2dkp s SER 6 Ca -0.02 -0.00 0.00 0.00 0.70 0.00 0.00 55.95 56.63 2dkp s SER 6 Cb -0.03 0.25 0.00 0.00 -1.71 0.00 0.00 66.02 64.53 2dkp s SER 6 CO 0.02 -0.41 0.00 0.61 1.20 0.00 0.00 173.24 174.66 2dkp n GLY 7 N -0.16 5.06 3.03 9.45 0.00 -1.26 -5.17 105.19 116.14 2dkp n GLY 7 Ca -0.04 -1.05 -0.13 0.00 0.00 0.00 0.00 46.02 44.80 2dkp n GLY 7 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2dkp s LYS 8 N 1.91 0.17 -0.13 1.61 2.20 -1.26 -5.12 119.74 119.11 2dkp s LYS 8 Ca 0.00 0.78 -0.29 0.00 -0.36 0.00 0.00 55.97 56.10 2dkp s LYS 8 Cb 0.00 0.01 -0.03 0.00 -1.51 0.00 0.00 37.83 36.30 2dkp s LYS 8 CO 0.00 -0.28 1.48 0.50 -0.36 0.00 0.00 175.35 176.69 2dkp s ARG 9 N 2.44 4.13 0.21 4.03 3.52 -1.26 -5.00 118.95 127.02 2dkp s ARG 9 Ca 0.01 1.86 0.02 0.00 -0.13 0.00 0.00 55.73 57.49 2dkp s ARG 9 Cb -0.12 -3.90 -0.05 0.00 -1.56 0.00 0.00 34.95 29.32 2dkp s ARG 9 CO -0.09 -0.88 0.02 -1.12 -0.81 0.00 0.00 175.30 172.43 2dkp s SER 10 N 2.93 1.42 -0.10 -2.12 0.01 -1.26 -5.09 113.70 109.49 2dkp s SER 10 Ca 0.65 -1.23 -0.08 0.00 1.31 0.00 0.00 55.95 56.60 2dkp s SER 10 Cb -0.27 0.09 -0.06 0.00 0.21 0.00 0.00 66.02 65.99 2dkp s SER 10 CO 0.23 -0.58 0.25 0.78 0.41 0.00 0.00 173.24 174.33 2dkp h ASN 11 N 2.55 -0.07 -2.84 2.44 2.35 -2.08 -3.47 115.58 114.46 2dkp h ASN 11 Ca -0.38 -0.17 -0.39 0.00 -0.55 0.00 0.00 56.30 54.82 2dkp h ASN 11 Cb 1.22 0.02 0.21 0.00 0.05 0.00 0.00 38.32 39.82 2dkp h ASN 11 CO 0.63 0.50 -0.22 -0.24 -1.65 0.00 0.00 177.43 176.45 2dkp n SER 12 N -4.81 -3.06 -4.58 5.81 2.88 -1.26 -5.01 113.62 103.59 2dkp n SER 12 Ca -0.03 -0.51 -0.34 0.00 -1.33 0.00 0.00 58.87 56.66 2dkp n SER 12 Cb 0.12 -1.07 -0.11 0.00 -0.75 0.00 0.00 64.21 62.40 2dkp n SER 12 CO 0.00 0.00 0.00 -0.63 -1.23 0.00 0.00 175.04 173.18 2dkp s ILE 13 N -2.22 3.74 -0.08 2.46 1.01 -1.26 -5.12 121.20 119.74 2dkp s ILE 13 Ca 0.64 -0.46 0.03 0.00 0.00 0.00 0.00 60.65 60.85 2dkp s ILE 13 Cb -0.17 -2.54 -0.02 0.00 0.01 0.00 0.00 42.46 39.74 2dkp s ILE 13 CO 0.59 0.59 -0.14 -0.75 0.00 0.00 0.00 174.94 175.22 2dkp s LYS 14 N -0.71 2.79 0.27 2.79 2.36 -1.26 -5.01 119.74 120.97 2dkp s LYS 14 Ca 0.11 -0.70 -0.10 0.00 -2.55 0.00 0.00 55.97 52.73 2dkp s LYS 14 Cb -0.11 -2.45 -0.07 0.00 -1.05 0.00 0.00 37.83 34.15 2dkp s LYS 14 CO 0.02 0.48 0.61 0.50 1.55 0.00 0.00 175.35 178.50 2dkp s ARG 15 N -0.35 3.81 -0.50 4.03 3.52 -1.26 -5.06 118.95 123.14 2dkp s ARG 15 Ca 0.03 0.33 -0.01 0.00 -0.13 0.00 0.00 55.73 55.95 2dkp s ARG 15 Cb -0.12 -2.58 0.13 0.00 -1.56 0.00 0.00 34.95 30.82 2dkp s ARG 15 CO 0.02 0.24 0.28 1.21 -0.81 0.00 0.00 175.30 176.24 2dkp s ASN 16 N -2.55 5.01 0.25 -2.12 2.47 -1.26 -4.98 114.94 111.76 2dkp s ASN 16 Ca 0.48 -2.54 -0.10 0.00 0.42 0.00 0.00 52.86 51.12 2dkp s ASN 16 Cb -0.11 -1.78 0.36 0.00 -1.45 0.00 0.00 41.25 38.28 2dkp s ASN 16 CO 0.23 -0.40 1.59 -0.65 -3.72 0.00 0.00 177.10 174.15 2dkp h PRO 17 N 7.32 0.00 -0.55 0.43 0.11 -2.02 0.35 132.00 137.65 2dkp h PRO 17 Ca -0.07 -0.00 0.11 0.00 0.11 0.00 0.00 66.00 66.15 2dkp h PRO 17 Cb 0.98 -0.00 -0.10 0.00 0.11 0.00 0.00 31.00 31.98 2dkp h PRO 17 CO 0.68 0.00 -0.13 -0.91 -0.21 0.00 0.00 178.00 177.43 2dkp h ASN 18 N 0.00 -0.49 0.00 -2.05 2.35 -2.06 -3.41 115.58 109.93 2dkp h ASN 18 Ca 0.40 0.16 -0.52 0.00 -0.55 0.00 0.00 56.30 55.80 2dkp h ASN 18 Cb 0.62 0.33 -0.07 0.00 0.05 0.00 0.00 38.32 39.25 2dkp h ASN 18 CO -0.84 -0.18 1.51 0.00 -1.65 0.00 0.00 177.43 176.28 2dkp n ALA 19 N -2.92 0.25 -1.42 -0.83 0.00 0.11 -4.64 120.51 111.07 2dkp n ALA 19 Ca 0.06 -0.15 -0.48 0.00 0.00 0.00 0.00 53.44 52.86 2dkp n ALA 19 Cb 0.29 -2.04 -0.11 0.00 0.00 0.00 0.00 19.45 17.59 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 7.56 0.32 -1.71 0.00 -0.02 -1.26 -4.58 135.00 135.31 2dkp n PRO 20 Ca 0.58 0.06 -0.43 0.00 -2.02 0.00 0.00 63.50 61.69 2dkp n PRO 20 Cb 0.01 -1.90 -0.03 0.00 -0.02 0.00 0.00 33.50 31.56 2dkp n PRO 20 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 2dkp n VAL 21 N 7.18 0.03 -0.03 -1.45 0.31 -1.26 -4.72 118.33 118.40 2dkp n VAL 21 Ca 0.55 -0.01 -0.13 0.00 -0.01 0.00 0.00 64.34 64.74 2dkp n VAL 21 Cb 0.10 -1.92 -0.11 0.00 -0.91 0.00 0.00 33.84 31.01 2dkp n VAL 21 CO 0.00 0.00 0.00 0.58 -1.32 0.00 0.00 176.83 176.09 2dkp h VAL 22 N 3.75 1.48 -1.25 2.52 2.07 -1.15 -3.48 116.25 120.20 2dkp h VAL 22 Ca -0.43 -1.43 0.15 0.00 0.82 0.00 0.00 66.70 65.81 2dkp h VAL 22 Cb 1.21 2.46 -0.31 0.00 -1.52 0.00 0.00 31.29 33.13 2dkp h VAL 22 CO 0.94 0.37 0.69 -0.60 0.02 0.00 0.00 177.57 178.99 2dkp s ARG 23 N -3.76 0.20 -0.09 1.57 3.52 -1.24 -5.04 118.95 114.11 2dkp s ARG 23 Ca -0.17 0.27 0.03 0.00 -0.13 0.00 0.00 55.73 55.74 2dkp s ARG 23 Cb 0.00 0.08 0.01 0.00 -1.56 0.00 0.00 34.95 33.48 2dkp s ARG 23 CO 0.68 -0.03 -0.18 -0.98 -0.81 0.00 0.00 175.30 173.98 2dkp s ARG 24 N 0.46 2.39 0.02 5.12 1.70 -1.26 -2.10 118.95 125.27 2dkp s ARG 24 Ca 0.01 -0.65 -0.28 0.00 -0.47 0.00 0.00 55.73 54.34 2dkp s ARG 24 Cb -0.04 -1.88 0.07 0.00 -0.57 0.00 0.00 34.95 32.53 2dkp s ARG 24 CO -0.12 0.08 0.67 0.20 -1.08 0.00 0.00 175.30 175.05 2dkp s GLY 25 N 0.56 -0.58 -0.49 3.88 0.00 -1.15 -5.01 107.32 104.53 2dkp s GLY 25 Ca -0.15 1.06 -0.26 0.00 0.00 0.00 0.00 44.72 45.37 2dkp s GLY 25 CO 0.05 0.69 2.31 -0.98 0.00 0.00 0.00 173.10 175.17 2dkp s TRP 26 N -2.06 1.17 -0.01 1.90 0.52 -1.26 -3.35 118.94 115.85 2dkp s TRP 26 Ca -0.07 1.38 -0.02 0.00 0.02 0.00 0.00 56.10 57.41 2dkp s TRP 26 Cb -0.00 -3.69 -0.04 0.00 -1.15 0.00 0.00 33.47 28.59 2dkp s TRP 26 CO 0.02 -2.61 0.17 -1.17 0.02 0.00 0.00 176.95 173.38 2dkp s LEU 27 N 11.43 4.32 -0.06 2.99 2.96 -1.13 -4.94 118.68 134.25 2dkp s LEU 27 Ca 0.93 0.33 -0.14 0.00 -0.22 0.00 0.00 54.13 55.03 2dkp s LEU 27 Cb -0.17 -2.57 -0.05 0.00 0.50 0.00 0.00 46.19 43.89 2dkp s LEU 27 CO 0.26 0.27 0.35 -0.31 -1.32 0.00 0.00 176.35 175.59 2dkp s TYR 28 N -1.31 3.63 0.14 5.38 2.02 -1.25 -3.60 117.35 122.37 2dkp s TYR 28 Ca 0.27 0.82 0.09 0.00 -0.37 0.00 0.00 57.07 57.88 2dkp s TYR 28 Cb -0.13 -2.27 -0.04 0.00 -0.40 0.00 0.00 41.96 39.13 2dkp s TYR 28 CO 0.18 0.53 -0.20 0.21 -1.57 0.00 0.00 175.55 174.70 2dkp s LYS 29 N -0.59 1.26 0.15 -0.62 2.20 -1.11 -3.36 119.74 117.68 2dkp s LYS 29 Ca 0.21 -1.33 0.05 0.00 -0.36 0.00 0.00 55.97 54.54 2dkp s LYS 29 Cb -0.15 -1.45 -0.04 0.00 -1.51 0.00 0.00 37.83 34.69 2dkp s LYS 29 CO 0.09 0.31 0.13 -1.14 -0.36 0.00 0.00 175.35 174.39 2dkp s GLN 30 N -2.42 2.91 0.63 4.03 0.74 -0.69 -0.30 119.66 124.56 2dkp s GLN 30 Ca 0.13 -0.84 -0.05 0.00 0.05 0.00 0.00 55.36 54.64 2dkp s GLN 30 Cb -0.08 -2.66 0.03 0.00 1.10 0.00 0.00 33.01 31.40 2dkp s GLN 30 CO 0.06 0.49 0.93 0.34 -0.55 0.00 0.00 175.29 176.56 2dkp s ASP 31 N -3.03 5.28 -0.37 6.67 2.15 -1.24 -4.67 116.67 121.46 2dkp s ASP 31 Ca 0.31 0.55 0.06 0.00 0.43 0.00 0.00 52.55 53.89 2dkp s ASP 31 Cb -0.10 -1.41 0.44 0.00 -0.30 0.00 0.00 42.92 41.55 2dkp s ASP 31 CO 0.23 -1.26 1.25 -1.20 -0.17 0.00 0.00 175.17 174.02 2dkp n SER 32 N -2.68 5.13 -3.62 -0.34 7.64 -1.26 -4.84 113.62 113.64 2dkp n SER 32 Ca 0.06 -3.75 -0.06 0.00 1.01 0.00 0.00 58.87 56.14 2dkp n SER 32 Cb 0.59 -0.44 -0.05 0.00 -1.01 0.00 0.00 64.21 63.30 2dkp n SER 32 CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 2dkp s THR 33 N -4.89 0.00 0.00 0.44 -1.32 -1.26 -5.12 115.64 103.49 2dkp s THR 33 Ca 0.51 0.00 0.00 0.00 -1.21 0.00 0.00 61.69 60.99 2dkp s THR 33 Cb 0.41 -1.00 0.00 0.00 -1.51 0.00 0.00 72.50 70.40 2dkp s THR 33 CO -0.04 0.00 0.00 0.61 -2.21 0.00 0.00 174.62 172.98 2dkp n GLY 34 N 0.86 3.34 3.73 6.08 0.00 -1.26 -4.52 105.19 113.42 2dkp n GLY 34 Ca -0.06 0.03 -0.41 0.00 0.00 0.00 0.00 46.02 45.58 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 4.38 -1.09 1.61 -1.94 -1.26 -4.95 119.30 116.05 2dkp s MET 35 Ca 0.00 2.04 -0.04 0.00 -1.71 0.00 0.00 55.69 55.98 2dkp s MET 35 Cb 0.00 -3.21 0.29 0.00 2.01 0.00 0.00 34.83 33.92 2dkp s MET 35 CO 0.00 -0.28 1.63 1.63 -0.01 0.00 0.00 175.02 177.98 2dkp n LYS 36 N 2.94 4.64 -2.67 2.03 4.01 -1.26 -4.68 118.16 123.16 2dkp n LYS 36 Ca 0.07 -4.46 -0.23 0.00 -0.51 0.00 0.00 58.31 53.19 2dkp n LYS 36 Cb 0.43 -2.54 0.10 0.00 -0.51 0.00 0.00 35.03 32.51 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 -2.90 3.00 -0.19 -0.35 1.43 -1.26 -4.86 118.68 113.54 2dkp s LEU 37 Ca 0.34 -0.47 -0.05 0.00 -1.03 0.00 0.00 54.13 52.92 2dkp s LEU 37 Cb 0.09 -1.88 -0.02 0.00 0.03 0.00 0.00 46.19 44.40 2dkp s LEU 37 CO 0.04 -1.78 -0.01 0.26 0.23 0.00 0.00 176.35 175.08 2dkp s TRP 38 N -3.06 3.02 0.42 0.29 0.52 -1.26 -3.60 118.94 115.27 2dkp s TRP 38 Ca 0.66 -0.50 0.03 0.00 0.02 0.00 0.00 56.10 56.30 2dkp s TRP 38 Cb -0.05 -2.06 0.00 0.00 -1.15 0.00 0.00 33.47 30.21 2dkp s TRP 38 CO 0.43 -0.25 0.61 0.15 0.02 0.00 0.00 176.95 177.92 2dkp s LYS 39 N 0.96 2.99 -0.15 4.98 3.01 0.58 -4.88 119.74 127.23 2dkp s LYS 39 Ca 0.01 -0.75 0.01 0.00 -1.01 0.00 0.00 55.97 54.22 2dkp s LYS 39 Cb -0.14 -2.65 -0.00 0.00 -1.01 0.00 0.00 37.83 34.03 2dkp s LYS 39 CO 0.01 -0.22 -0.17 0.21 0.51 0.00 0.00 175.35 175.69 2dkp s LYS 40 N -4.45 3.19 0.05 1.68 2.47 -1.26 -2.73 119.74 118.69 2dkp s LYS 40 Ca 0.49 -0.77 -0.23 0.00 -1.56 0.00 0.00 55.97 53.90 2dkp s LYS 40 Cb -0.10 -2.58 0.05 0.00 -1.46 0.00 0.00 37.83 33.74 2dkp s LYS 40 CO 0.35 0.03 0.53 0.50 0.16 0.00 0.00 175.35 176.93 2dkp s ARG 41 N 0.77 1.06 -0.15 4.03 6.06 -1.24 -5.06 118.95 124.42 2dkp s ARG 41 Ca -0.07 -0.24 -0.29 0.00 -2.50 0.00 0.00 55.73 52.64 2dkp s ARG 41 Cb -0.15 0.48 -0.00 0.00 0.06 0.00 0.00 34.95 35.33 2dkp s ARG 41 CO 0.00 -0.39 1.01 -0.46 -2.50 0.00 0.00 175.30 172.97 2dkp s TRP 42 N -2.51 3.45 0.33 5.12 -0.00 -1.25 -2.84 118.94 121.24 2dkp s TRP 42 Ca -0.05 1.54 0.09 0.00 -0.00 0.00 0.00 56.10 57.68 2dkp s TRP 42 Cb -0.01 -3.21 -0.05 0.00 -0.00 0.00 0.00 33.47 30.20 2dkp s TRP 42 CO -0.02 -0.32 0.00 -0.06 -0.00 0.00 0.00 176.95 176.55 2dkp s PHE 43 N 2.44 2.55 -0.17 5.86 0.40 -1.21 -2.30 117.98 125.55 2dkp s PHE 43 Ca 0.47 -0.40 -0.13 0.00 -0.60 0.00 0.00 56.93 56.26 2dkp s PHE 43 Cb -0.17 -1.43 0.05 0.00 0.51 0.00 0.00 43.02 41.98 2dkp s PHE 43 CO 0.14 0.50 0.44 0.08 0.70 0.00 0.00 175.22 177.08 2dkp s VAL 44 N -2.49 -0.01 -0.50 -0.44 1.01 0.83 -2.93 120.40 115.88 2dkp s VAL 44 Ca 0.34 0.03 -0.10 0.00 0.00 0.00 0.00 61.98 62.26 2dkp s VAL 44 Cb -0.01 -0.62 0.13 0.00 0.00 0.00 0.00 36.38 35.87 2dkp s VAL 44 CO 0.19 0.01 0.38 -0.22 0.00 0.00 0.00 175.10 175.46 2dkp s LEU 45 N 0.68 5.76 0.02 3.92 1.98 -0.89 -2.20 118.68 127.94 2dkp s LEU 45 Ca -0.04 -1.97 -0.04 0.00 -2.89 0.00 0.00 54.13 49.19 2dkp s LEU 45 Cb -0.05 -2.03 -0.01 0.00 0.66 0.00 0.00 46.19 44.76 2dkp s LEU 45 CO -0.05 -0.69 0.06 -0.55 -1.89 0.00 0.00 176.35 173.24 2dkp s SER 46 N 2.64 0.15 -1.50 3.68 0.15 -1.10 -0.55 113.70 117.17 2dkp s SER 46 Ca 0.06 -0.40 -0.13 0.00 0.70 0.00 0.00 55.95 56.19 2dkp s SER 46 Cb -0.26 0.17 0.09 0.00 -1.71 0.00 0.00 66.02 64.31 2dkp s SER 46 CO -0.01 -0.38 0.82 -0.67 1.20 0.00 0.00 173.24 174.21 2dkp n ASP 47 N 1.34 -4.51 -3.90 5.45 2.03 -1.26 -0.75 116.55 114.95 2dkp n ASP 47 Ca -0.22 -0.68 -0.31 0.00 0.52 0.00 0.00 54.79 54.10 2dkp n ASP 47 Cb 0.56 -3.64 -0.00 0.00 -0.72 0.00 0.00 41.12 37.32 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 -4.38 -1.94 -4.13 -2.67 4.77 -1.26 -4.93 117.00 102.45 2dkp n LEU 48 Ca 0.02 -0.77 -0.11 0.00 -0.03 0.00 0.00 56.01 55.13 2dkp n LEU 48 Cb 0.53 -2.26 -0.09 0.00 -2.33 0.00 0.00 43.42 39.28 2dkp n LEU 48 CO 0.69 0.31 -0.13 0.00 -1.33 0.00 0.00 177.39 176.94 2dkp s LEU 50 N -3.11 3.23 -0.04 0.00 1.43 -0.09 -2.71 118.68 117.40 2dkp s LEU 50 Ca 0.33 -0.09 -0.02 0.00 -1.03 0.00 0.00 54.13 53.31 2dkp s LEU 50 Cb 0.05 -1.76 0.02 0.00 0.03 0.00 0.00 46.19 44.53 2dkp s LEU 50 CO 0.10 0.23 0.09 -0.36 0.23 0.00 0.00 176.35 176.63 2dkp s PHE 51 N -0.00 -0.08 0.14 0.29 0.08 -0.93 -1.27 117.98 116.21 2dkp s PHE 51 Ca 0.00 0.27 0.03 0.00 0.12 0.00 0.00 56.93 57.35 2dkp s PHE 51 Cb -0.13 -0.05 -0.04 0.00 -0.57 0.00 0.00 43.02 42.22 2dkp s PHE 51 CO 0.03 -0.08 -0.06 1.52 -0.10 0.00 0.00 175.22 176.52 2dkp s TYR 52 N 0.54 1.16 0.06 0.36 -0.85 -1.25 -0.12 117.35 117.25 2dkp s TYR 52 Ca -0.04 -0.88 -0.05 0.00 -0.52 0.00 0.00 57.07 55.57 2dkp s TYR 52 Cb -0.06 -0.63 -0.02 0.00 0.38 0.00 0.00 41.96 41.63 2dkp s TYR 52 CO -0.02 -0.07 0.10 0.71 -1.52 0.00 0.00 175.55 174.75 2dkp s TYR 53 N -3.50 0.29 0.22 -3.49 1.51 -0.97 -2.92 117.35 108.48 2dkp s TYR 53 Ca 0.18 -0.73 -0.07 0.00 -1.01 0.00 0.00 57.07 55.44 2dkp s TYR 53 Cb 0.04 -0.19 0.36 0.00 -0.11 0.00 0.00 41.96 42.06 2dkp s TYR 53 CO 0.00 -0.45 1.23 0.54 -1.11 0.00 0.00 175.55 175.76 2dkp n ARG 54 N 0.17 -0.07 -4.14 -0.62 3.00 -1.26 -3.82 116.66 109.91 2dkp n ARG 54 Ca -0.15 1.23 -0.14 0.00 -0.01 0.00 0.00 57.85 58.77 2dkp n ARG 54 Cb 0.61 -1.83 -0.06 0.00 0.00 0.00 0.00 32.46 31.18 2dkp n ARG 54 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.63 177.12 2dkp s ASP 55 N -5.21 0.81 0.60 0.55 1.01 -1.26 -4.64 116.67 108.54 2dkp s ASP 55 Ca -0.12 -1.45 0.28 0.00 0.71 0.00 0.00 52.55 51.97 2dkp s ASP 55 Cb 0.21 0.58 1.47 0.00 1.01 0.00 0.00 42.92 46.19 2dkp s ASP 55 CO 0.61 -1.15 1.88 1.05 0.21 0.00 0.00 175.17 177.77 2dkp h GLU 56 N 2.22 0.00 -0.42 8.23 4.11 -1.94 -0.15 114.58 126.63 2dkp h GLU 56 Ca -0.29 0.00 0.12 0.00 0.07 0.00 0.00 59.36 59.27 2dkp h GLU 56 Cb 1.24 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.47 2dkp h GLU 56 CO 0.40 0.00 0.63 0.87 0.07 0.00 0.00 179.01 180.98 2dkp h LYS 57 N 0.00 0.00 -5.62 1.06 1.79 -1.95 -3.44 116.57 108.41 2dkp h LYS 57 Ca 0.18 0.00 -0.38 0.00 -2.18 0.00 0.00 60.65 58.28 2dkp h LYS 57 Cb 1.15 0.00 0.14 0.00 -1.58 0.00 0.00 32.23 31.93 2dkp h LYS 57 CO -0.00 0.00 -0.66 0.39 -1.08 0.00 0.00 179.45 178.10 2dkp n GLU 58 N -3.34 -7.52 -3.04 3.15 1.02 -0.07 -4.94 120.64 105.91 2dkp n GLU 58 Ca 0.08 0.79 -0.44 0.00 -0.02 0.00 0.00 57.16 57.58 2dkp n GLU 58 Cb 0.79 -5.74 -0.05 0.00 -0.02 0.00 0.00 31.44 26.43 2dkp n GLU 58 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 2dkp s GLU 59 N -6.17 3.10 0.41 3.49 0.41 -1.26 -4.86 118.70 113.82 2dkp s GLU 59 Ca 0.51 -1.03 0.00 0.00 -0.41 0.00 0.00 54.97 54.04 2dkp s GLU 59 Cb -0.22 -4.21 0.00 0.00 -1.78 0.00 0.00 34.13 27.92 2dkp s GLU 59 CO 0.70 -1.54 0.00 0.41 -0.49 0.00 0.00 175.26 174.34 2dkp n GLY 60 N 5.26 -4.77 3.72 -1.39 0.00 -1.26 -4.55 105.19 102.19 2dkp n GLY 60 Ca -0.07 -0.57 -0.40 0.00 0.00 0.00 0.00 46.02 44.98 2dkp n GLY 60 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2dkp s ILE 61 N -2.46 4.92 -0.85 -0.61 1.01 -1.26 -4.40 121.20 117.56 2dkp s ILE 61 Ca 0.00 1.61 0.26 0.00 0.00 0.00 0.00 60.65 62.52 2dkp s ILE 61 Cb 0.00 -4.11 0.12 0.00 0.01 0.00 0.00 42.46 38.48 2dkp s ILE 61 CO 0.00 0.27 1.57 0.18 0.00 0.00 0.00 174.94 176.96 2dkp n LEU 62 N 3.53 0.50 0.00 2.97 4.77 -1.15 -4.92 117.00 122.69 2dkp n LEU 62 Ca -0.00 0.29 0.00 0.00 -0.03 0.00 0.00 56.01 56.26 2dkp n LEU 62 Cb 0.51 -0.30 0.00 0.00 -2.33 0.00 0.00 43.42 41.30 2dkp n LEU 62 CO 0.48 -0.01 0.00 0.61 -1.33 0.00 0.00 177.39 177.14 2dkp n GLY 63 N 1.42 2.62 3.80 -0.72 0.00 -1.26 -5.10 105.19 105.95 2dkp n GLY 63 Ca 0.05 0.02 -0.29 0.00 0.00 0.00 0.00 46.02 45.79 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 5.66 -0.07 1.61 1.04 -1.26 -3.90 113.70 116.78 2dkp s SER 64 Ca 0.00 0.01 0.01 0.00 0.48 0.00 0.00 55.95 56.45 2dkp s SER 64 Cb 0.00 -1.55 0.02 0.00 0.10 0.00 0.00 66.02 64.59 2dkp s SER 64 CO 0.00 0.15 -0.09 -0.63 0.98 0.00 0.00 173.24 173.65 2dkp s ILE 65 N -1.49 0.92 -0.44 -1.02 1.01 -0.40 -5.02 121.20 114.76 2dkp s ILE 65 Ca 0.31 -0.32 -0.26 0.00 0.00 0.00 0.00 60.65 60.37 2dkp s ILE 65 Cb -0.12 -0.89 0.02 0.00 0.01 0.00 0.00 42.46 41.49 2dkp s ILE 65 CO 0.23 0.32 0.94 -0.76 0.00 0.00 0.00 174.94 175.67 2dkp s LEU 66 N 0.97 3.97 0.09 2.97 2.01 -1.26 -0.91 118.68 126.52 2dkp s LEU 66 Ca -0.09 0.24 -0.16 0.00 0.01 0.00 0.00 54.13 54.12 2dkp s LEU 66 Cb -0.15 -3.24 -0.09 0.00 0.01 0.00 0.00 46.19 42.73 2dkp s LEU 66 CO 0.00 -1.03 1.43 -0.07 1.01 0.00 0.00 176.35 177.70 2dkp h LEU 67 N 10.53 0.64 -1.75 1.79 3.38 -1.77 -3.03 115.31 125.10 2dkp h LEU 67 Ca -0.24 -0.44 0.24 0.00 0.09 0.00 0.00 57.88 57.53 2dkp h LEU 67 Cb 1.07 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 41.61 2dkp h LEU 67 CO 1.03 0.94 0.78 -0.65 0.09 0.00 0.00 178.44 180.63 2dkp h PRO 68 N 0.35 0.00 0.00 1.13 0.11 -0.97 0.96 132.00 133.58 2dkp h PRO 68 Ca 0.05 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 66.13 2dkp h PRO 68 Cb 0.73 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.83 2dkp h PRO 68 CO 0.05 0.00 -1.20 0.43 -0.21 0.00 0.00 178.00 177.07 2dkp n SER 69 N -3.72 0.76 -4.87 -2.05 7.64 -1.15 -4.66 113.62 105.57 2dkp n SER 69 Ca 0.17 0.30 -0.31 0.00 1.01 0.00 0.00 58.87 60.04 2dkp n SER 69 Cb 1.06 0.55 -0.04 0.00 -1.01 0.00 0.00 64.21 64.77 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 -3.29 3.43 -0.30 1.43 0.08 0.33 -4.38 117.98 115.29 2dkp s PHE 70 Ca -0.02 1.08 0.00 0.00 0.12 0.00 0.00 56.93 58.11 2dkp s PHE 70 Cb 0.10 -2.45 0.06 0.00 -0.57 0.00 0.00 43.02 40.16 2dkp s PHE 70 CO 0.81 -0.00 -0.02 -1.14 -0.10 0.00 0.00 175.22 174.76 2dkp s GLN 71 N -3.47 2.27 -0.23 0.44 0.74 0.24 -4.75 119.66 114.90 2dkp s GLN 71 Ca 0.52 -1.37 -0.29 0.00 0.05 0.00 0.00 55.36 54.27 2dkp s GLN 71 Cb -0.10 -3.11 0.01 0.00 1.10 0.00 0.00 33.01 30.91 2dkp s GLN 71 CO 0.26 -0.65 1.04 0.42 -0.55 0.00 0.00 175.29 175.80 2dkp s ILE 72 N 1.17 4.68 -0.16 -2.34 -1.09 -1.26 -1.28 121.20 120.93 2dkp s ILE 72 Ca -0.05 2.02 -0.11 0.00 -2.23 0.00 0.00 60.65 60.29 2dkp s ILE 72 Cb -0.20 -4.31 0.05 0.00 -1.58 0.00 0.00 42.46 36.42 2dkp s ILE 72 CO -0.03 -0.18 0.39 0.00 -1.23 0.00 0.00 174.94 173.89 2dkp s ALA 73 N 3.18 -0.97 0.26 9.38 0.00 -1.00 -5.03 121.76 127.57 2dkp s ALA 73 Ca 0.44 1.32 -0.30 0.00 0.00 0.00 0.00 51.96 53.42 2dkp s ALA 73 Cb -0.15 -0.79 -0.14 0.00 0.00 0.00 0.00 23.12 22.04 2dkp s ALA 73 CO 0.06 -0.23 1.12 1.28 0.00 0.00 0.00 175.76 177.99 2dkp n LEU 74 N 3.71 2.01 -4.09 0.00 7.99 -1.26 -3.19 117.00 122.16 2dkp n LEU 74 Ca -0.19 1.17 -0.32 0.00 -0.01 0.00 0.00 56.01 56.65 2dkp n LEU 74 Cb 0.56 -1.30 0.10 0.00 -0.11 0.00 0.00 43.42 42.67 2dkp n LEU 74 CO 0.11 -1.20 -1.18 0.18 -1.51 0.00 0.00 177.39 173.79 2dkp n LEU 75 N 1.52 -2.53 -3.78 2.23 4.77 -1.26 -4.87 117.00 113.08 2dkp n LEU 75 Ca 0.11 -0.09 -0.10 0.00 -0.03 0.00 0.00 56.01 55.90 2dkp n LEU 75 Cb 0.30 -0.70 -0.04 0.00 -2.33 0.00 0.00 43.42 40.64 2dkp n LEU 75 CO 0.61 -2.77 0.20 0.28 -1.33 0.00 0.00 177.39 174.39 2dkp s THR 76 N -2.10 0.04 0.19 -5.08 -1.32 -1.26 -5.05 115.64 101.06 2dkp s THR 76 Ca 0.42 -0.91 -0.25 0.00 -1.21 0.00 0.00 61.69 59.74 2dkp s THR 76 Cb -0.00 -1.62 0.07 0.00 -1.51 0.00 0.00 72.50 69.44 2dkp s THR 76 CO 0.59 -0.17 1.55 -1.28 -2.21 0.00 0.00 174.62 173.10 2dkp h SER 77 N 2.28 -1.75 -0.80 8.08 0.87 -1.97 0.36 113.55 120.62 2dkp h SER 77 Ca -0.30 0.30 0.27 0.00 -1.23 0.00 0.00 61.79 60.84 2dkp h SER 77 Cb 1.25 0.82 -0.15 0.00 -0.44 0.00 0.00 62.40 63.89 2dkp h SER 77 CO 0.40 -0.28 0.19 -0.62 -0.53 0.00 0.00 176.83 175.99 2dkp n GLU 78 N -5.37 -0.06 -1.70 2.24 4.71 -1.26 -4.28 120.64 114.92 2dkp n GLU 78 Ca 0.05 1.17 -0.42 0.00 -0.01 0.00 0.00 57.16 57.94 2dkp n GLU 78 Cb 0.33 -1.95 -0.03 0.00 -1.01 0.00 0.00 31.44 28.78 2dkp n GLU 78 CO 0.00 0.00 0.00 -0.25 0.09 0.00 0.00 177.13 176.97 2dkp n ASP 79 N -5.01 4.05 -1.47 1.62 8.00 0.13 -4.85 116.55 119.01 2dkp n ASP 79 Ca 0.24 1.02 -0.06 0.00 0.71 0.00 0.00 54.79 56.70 2dkp n ASP 79 Cb 0.80 -1.56 0.02 0.00 -0.02 0.00 0.00 41.12 40.36 2dkp n ASP 79 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 2dkp n HIS 80 N 4.97 0.60 -3.94 1.24 8.25 -1.26 -4.77 115.22 120.31 2dkp n HIS 80 Ca 0.17 -1.11 -0.35 0.00 -0.26 0.00 0.00 57.72 56.17 2dkp n HIS 80 Cb 0.36 -0.55 -0.14 0.00 1.12 0.00 0.00 29.99 30.78 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 -0.79 2.89 -0.46 1.59 1.01 -1.26 -4.97 121.20 119.22 2dkp s ILE 81 Ca 0.12 -1.26 0.04 0.00 0.00 0.00 0.00 60.65 59.55 2dkp s ILE 81 Cb 0.09 -2.59 0.34 0.00 0.01 0.00 0.00 42.46 40.31 2dkp s ILE 81 CO 0.01 0.01 1.21 0.59 0.00 0.00 0.00 174.94 176.77 2dkp n ASN 82 N 4.63 3.22 -4.21 3.58 4.13 -1.26 -4.89 115.26 120.45 2dkp n ASN 82 Ca -0.14 -2.55 -0.19 0.00 1.68 0.00 0.00 54.58 53.37 2dkp n ASN 82 Cb 0.45 -0.61 0.10 0.00 -1.54 0.00 0.00 39.78 38.17 2dkp n ASN 82 CO 0.00 0.00 0.00 0.54 0.28 0.00 0.00 177.26 178.08 2dkp n ARG 83 N 0.05 0.06 -3.74 3.52 5.12 -1.26 -5.14 116.66 115.27 2dkp n ARG 83 Ca 0.19 -2.36 -0.16 0.00 -1.93 0.00 0.00 57.85 53.58 2dkp n ARG 83 Cb 0.83 -0.53 -0.06 0.00 -1.16 0.00 0.00 32.46 31.54 2dkp n ARG 83 CO 0.00 0.00 0.00 1.63 -1.93 0.00 0.00 177.63 177.33 2dkp n LYS 84 N -2.54 0.43 -4.26 5.56 5.02 -1.26 -4.88 118.16 116.24 2dkp n LYS 84 Ca 0.14 -2.57 -0.33 0.00 -2.02 0.00 0.00 58.31 53.53 2dkp n LYS 84 Cb 0.51 1.85 -0.06 0.00 -0.02 0.00 0.00 35.03 37.30 2dkp n LYS 84 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 2dkp n TYR 85 N -0.56 -1.44 -3.82 2.13 4.02 -1.26 -4.78 117.16 111.46 2dkp n TYR 85 Ca 0.02 0.70 -0.09 0.00 -0.01 0.00 0.00 57.90 58.52 2dkp n TYR 85 Cb 0.46 -2.86 -0.07 0.00 -0.02 0.00 0.00 39.34 36.85 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 -3.82 -0.36 0.34 -0.72 0.00 -1.26 -1.63 121.76 114.31 2dkp s ALA 86 Ca 0.33 -0.45 0.06 0.00 0.00 0.00 0.00 51.96 51.89 2dkp s ALA 86 Cb -0.19 0.47 -0.03 0.00 0.00 0.00 0.00 23.12 23.37 2dkp s ALA 86 CO 0.96 -0.50 0.22 -0.59 0.00 0.00 0.00 175.76 175.86 2dkp s PHE 87 N -3.57 1.72 0.08 0.00 -0.71 0.61 -4.30 117.98 111.80 2dkp s PHE 87 Ca 0.03 -1.52 0.03 0.00 -1.04 0.00 0.00 56.93 54.42 2dkp s PHE 87 Cb 0.03 -0.84 -0.03 0.00 -1.21 0.00 0.00 43.02 40.97 2dkp s PHE 87 CO -0.10 -0.67 -0.09 -1.59 -1.34 0.00 0.00 175.22 171.43 2dkp s LYS 88 N -3.59 0.76 -0.13 1.99 -2.85 -1.19 -1.27 119.74 113.46 2dkp s LYS 88 Ca 0.35 -1.06 0.01 0.00 -1.00 0.00 0.00 55.97 54.27 2dkp s LYS 88 Cb 0.03 -0.46 0.02 0.00 -2.06 0.00 0.00 37.83 35.36 2dkp s LYS 88 CO 0.22 0.07 -0.15 0.00 0.10 0.00 0.00 175.35 175.59 2dkp s ALA 89 N -2.22 1.82 0.05 0.59 0.00 -0.47 -2.37 121.76 119.15 2dkp s ALA 89 Ca 0.02 -0.84 -0.13 0.00 0.00 0.00 0.00 51.96 51.00 2dkp s ALA 89 Cb -0.04 -0.96 -0.06 0.00 0.00 0.00 0.00 23.12 22.06 2dkp s ALA 89 CO -0.00 -0.23 0.43 0.00 0.00 0.00 0.00 175.76 175.96 2dkp s ALA 90 N 1.23 3.69 -0.00 0.00 0.00 -0.40 -0.35 121.76 125.93 2dkp s ALA 90 Ca -0.01 -0.26 0.01 0.00 0.00 0.00 0.00 51.96 51.70 2dkp s ALA 90 Cb -0.14 -2.37 -0.00 0.00 0.00 0.00 0.00 23.12 20.61 2dkp s ALA 90 CO -0.06 0.51 -0.03 -1.58 0.00 0.00 0.00 175.76 174.60 2dkp s HIS 91 N -1.26 0.24 -0.06 0.00 2.46 -1.24 0.80 115.29 116.21 2dkp s HIS 91 Ca 0.29 -0.04 -0.27 0.00 0.47 0.00 0.00 55.06 55.51 2dkp s HIS 91 Cb -0.15 -0.15 -0.22 0.00 -0.13 0.00 0.00 32.58 31.92 2dkp s HIS 91 CO 0.16 -0.00 1.08 -1.00 -2.47 0.00 0.00 174.74 172.51 2dkp h PRO 92 N 6.08 -0.01 -0.61 2.88 0.13 -1.92 -3.24 132.00 135.31 2dkp h PRO 92 Ca -0.26 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.87 2dkp h PRO 92 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 2dkp h PRO 92 CO 0.51 0.64 0.00 -1.71 -0.23 0.00 0.00 178.00 177.20 2dkp n ASN 93 N -4.78 2.88 -1.99 1.44 5.15 -1.26 -4.90 115.26 111.79 2dkp n ASN 93 Ca -0.09 -2.28 -0.07 0.00 -0.60 0.00 0.00 54.58 51.55 2dkp n ASN 93 Cb 0.33 -0.45 -0.01 0.00 -0.53 0.00 0.00 39.78 39.12 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 0.46 0.43 -2.28 1.20 2.81 -1.22 -5.18 117.12 113.34 2dkp n MET 94 Ca 0.14 -1.35 -0.17 0.00 -1.81 0.00 0.00 57.70 54.51 2dkp n MET 94 Cb 0.57 1.40 0.08 0.00 -0.71 0.00 0.00 33.22 34.56 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 -0.29 0.30 -3.14 0.03 0.00 -1.26 -4.33 116.66 107.97 2dkp n ARG 95 Ca -0.01 -2.23 -0.39 0.00 -0.00 0.00 0.00 57.85 55.21 2dkp n ARG 95 Cb 0.30 -0.39 -0.05 0.00 -0.00 0.00 0.00 32.46 32.32 2dkp n ARG 95 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.63 178.62 2dkp s THR 96 N -2.13 5.07 0.52 8.89 2.01 -1.26 -3.73 115.64 125.00 2dkp s THR 96 Ca 0.50 1.22 0.05 0.00 0.31 0.00 0.00 61.69 63.76 2dkp s THR 96 Cb -0.03 -3.95 0.04 0.00 0.01 0.00 0.00 72.50 68.57 2dkp s THR 96 CO 0.33 0.20 0.72 -0.31 -0.69 0.00 0.00 174.62 174.87 2dkp s TYR 97 N 1.28 2.53 -0.10 4.92 1.51 0.53 -4.88 117.35 123.13 2dkp s TYR 97 Ca 0.31 -0.28 -0.06 0.00 -1.01 0.00 0.00 57.07 56.03 2dkp s TYR 97 Cb -0.16 -2.57 0.04 0.00 -0.11 0.00 0.00 41.96 39.16 2dkp s TYR 97 CO 0.13 -0.82 0.24 0.71 -1.11 0.00 0.00 175.55 174.69 2dkp s TYR 98 N -2.63 -0.30 0.00 2.71 1.51 -1.26 -1.37 117.35 116.01 2dkp s TYR 98 Ca 0.58 0.72 0.01 0.00 -1.01 0.00 0.00 57.07 57.37 2dkp s TYR 98 Cb -0.09 0.06 -0.00 0.00 -0.11 0.00 0.00 41.96 41.81 2dkp s TYR 98 CO 0.37 -0.20 -0.03 -0.06 -1.11 0.00 0.00 175.55 174.53 2dkp s PHE 99 N 0.89 0.25 0.18 2.71 0.40 -0.40 -1.70 117.98 120.31 2dkp s PHE 99 Ca -0.06 -0.10 0.04 0.00 -0.60 0.00 0.00 56.93 56.20 2dkp s PHE 99 Cb -0.08 -0.16 -0.05 0.00 0.51 0.00 0.00 43.02 43.25 2dkp s PHE 99 CO -0.06 -0.02 -0.05 0.00 0.70 0.00 0.00 175.22 175.79 2dkp s THR 101 N -3.40 0.67 0.10 0.00 -4.23 -0.65 -3.81 115.64 104.32 2dkp s THR 101 Ca 0.22 -2.00 -0.12 0.00 -1.18 0.00 0.00 61.69 58.61 2dkp s THR 101 Cb 0.04 -2.39 -0.19 0.00 1.34 0.00 0.00 72.50 71.31 2dkp s THR 101 CO 0.04 0.00 1.27 -0.78 -0.54 0.00 0.00 174.62 174.61 2dkp h ASP 102 N 1.81 0.87 -5.38 3.99 1.82 -1.93 -3.47 116.42 114.13 2dkp h ASP 102 Ca -0.36 -0.63 -0.14 0.00 -0.39 0.00 0.00 57.03 55.51 2dkp h ASP 102 Cb 1.27 -0.26 -0.11 0.00 0.68 0.00 0.00 39.33 40.91 2dkp h ASP 102 CO 0.59 1.43 -0.27 0.28 -1.61 0.00 0.00 179.24 179.65 2dkp s THR 103 N -3.53 0.00 0.43 2.25 -1.32 -1.26 -5.03 115.64 107.17 2dkp s THR 103 Ca -0.09 -1.61 0.18 0.00 -1.21 0.00 0.00 61.69 58.96 2dkp s THR 103 Cb 0.08 -2.35 0.38 0.00 -1.51 0.00 0.00 72.50 69.10 2dkp s THR 103 CO 0.91 0.00 1.87 1.23 -2.21 0.00 0.00 174.62 176.42 2dkp h GLY 104 N 2.34 0.77 0.53 6.08 0.00 -1.93 -2.66 103.07 108.20 2dkp h GLY 104 Ca -0.29 -0.17 -0.03 0.00 0.00 0.00 0.00 47.33 46.84 2dkp h GLY 104 CO 0.41 0.01 -0.25 1.70 0.00 0.00 0.00 176.54 178.41 2dkp h LYS 105 N 0.38 -0.68 -0.00 4.80 3.11 -1.99 0.12 116.57 122.31 2dkp h LYS 105 Ca 0.44 0.05 0.00 0.00 -2.81 0.00 0.00 60.65 58.33 2dkp h LYS 105 Cb 1.12 0.15 -0.00 0.00 -1.00 0.00 0.00 32.23 32.51 2dkp h LYS 105 CO -0.15 -0.45 0.65 0.93 -2.81 0.00 0.00 179.45 177.62 2dkp h GLU 106 N -0.71 0.00 0.14 1.90 5.08 -1.89 0.69 114.58 119.79 2dkp h GLU 106 Ca -0.07 0.00 -0.36 0.00 -1.00 0.00 0.00 59.36 57.93 2dkp h GLU 106 Cb 0.54 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.78 2dkp h GLU 106 CO 0.12 0.00 -1.93 1.98 -1.00 0.00 0.00 179.01 178.18 2dkp h MET 107 N 0.00 0.29 -0.82 2.33 4.05 -1.19 -3.26 114.93 116.33 2dkp h MET 107 Ca 0.00 -0.50 0.01 0.00 -0.28 0.00 0.00 59.70 58.93 2dkp h MET 107 Cb 1.31 0.19 -0.04 0.00 -0.80 0.00 0.00 31.60 32.26 2dkp h MET 107 CO -0.00 1.23 0.54 1.05 0.23 0.00 0.00 176.91 179.97 2dkp h GLU 108 N 0.08 1.07 0.12 0.39 4.11 0.30 0.15 114.58 120.80 2dkp h GLU 108 Ca -0.40 -0.06 -0.01 0.00 0.07 0.00 0.00 59.36 58.96 2dkp h GLU 108 Cb 2.05 -0.24 0.00 0.00 0.50 0.00 0.00 28.75 31.06 2dkp h GLU 108 CO 0.11 0.71 -0.06 -0.07 0.07 0.00 0.00 179.01 179.77 2dkp h LEU 109 N 1.10 -0.13 -0.19 3.06 3.38 -1.55 -1.05 115.31 119.93 2dkp h LEU 109 Ca 0.30 -0.30 -0.00 0.00 0.09 0.00 0.00 57.88 57.97 2dkp h LEU 109 Cb -0.11 0.03 -0.01 0.00 0.09 0.00 0.00 40.66 40.66 2dkp h LEU 109 CO -0.07 0.24 0.11 -0.50 0.09 0.00 0.00 178.44 178.31 2dkp h TRP 110 N -0.52 0.25 0.73 1.13 -0.00 -1.55 -2.91 115.95 113.08 2dkp h TRP 110 Ca -0.02 -0.00 -0.03 0.00 -0.00 0.00 0.00 58.89 58.84 2dkp h TRP 110 Cb 0.42 -0.08 -0.01 0.00 -0.00 0.00 0.00 29.16 29.49 2dkp h TRP 110 CO 0.04 0.21 -0.47 0.52 -0.00 0.00 0.00 178.44 178.74 2dkp h MET 111 N 0.22 -1.10 -0.98 0.49 2.86 -0.75 0.38 114.93 116.05 2dkp h MET 111 Ca 0.07 0.07 0.37 0.00 -2.06 0.00 0.00 59.70 58.15 2dkp h MET 111 Cb 0.03 0.25 -0.18 0.00 0.06 0.00 0.00 31.60 31.76 2dkp h MET 111 CO -0.01 -0.73 0.38 1.63 1.06 0.00 0.00 176.91 179.24 2dkp n LYS 112 N -5.60 -0.06 -0.02 1.72 4.76 -0.40 -0.47 118.16 118.09 2dkp n LYS 112 Ca -0.14 1.39 -0.00 0.00 -2.87 0.00 0.00 58.31 56.69 2dkp n LYS 112 Cb 0.48 -2.41 -0.00 0.00 -1.84 0.00 0.00 35.03 31.26 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 1.97 -0.00 -0.83 7.82 0.00 -1.24 -3.16 119.26 123.81 2dkp h ALA 113 Ca 0.77 -0.00 0.09 0.00 0.00 0.00 0.00 54.91 55.77 2dkp h ALA 113 Cb 1.92 0.00 -0.11 0.00 0.00 0.00 0.00 17.79 19.60 2dkp h ALA 113 CO -0.81 -0.00 -0.44 -1.33 0.00 0.00 0.00 179.25 176.67 2dkp n MET 114 N -3.03 -0.31 -0.32 0.00 2.81 0.13 0.16 117.12 116.55 2dkp n MET 114 Ca -0.00 1.27 0.08 0.00 -1.81 0.00 0.00 57.70 57.24 2dkp n MET 114 Cb 0.00 -1.87 0.25 0.00 -0.71 0.00 0.00 33.22 30.89 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 0.66 -1.13 4.03 -0.00 -0.95 1.01 115.31 118.92 2dkp h LEU 115 Ca 0.18 0.09 -0.06 0.00 -0.00 0.00 0.00 57.88 58.09 2dkp h LEU 115 Cb 0.39 -0.03 -0.01 0.00 -0.00 0.00 0.00 40.66 41.01 2dkp h LEU 115 CO -0.80 0.28 -0.26 -0.78 -0.00 0.00 0.00 178.44 176.88 2dkp h ASP 116 N 0.72 0.00 -0.01 -0.43 1.82 0.15 0.17 116.42 118.85 2dkp h ASP 116 Ca 0.50 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 57.14 2dkp h ASP 116 Cb 0.68 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.69 2dkp h ASP 116 CO -0.35 0.26 -0.24 0.00 -1.61 0.00 0.00 179.24 177.31 2dkp n ALA 117 N -2.26 3.01 -0.07 -0.78 0.00 0.12 -4.36 120.51 116.17 2dkp n ALA 117 Ca -0.00 -0.64 -0.13 0.00 0.00 0.00 0.00 53.44 52.67 2dkp n ALA 117 Cb 0.44 -0.84 -0.06 0.00 0.00 0.00 0.00 19.45 18.98 2dkp n ALA 117 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2dkp n ALA 118 N 0.53 1.80 0.26 0.00 0.00 0.31 -0.46 120.51 122.96 2dkp n ALA 118 Ca 0.12 -0.62 0.13 0.00 0.00 0.00 0.00 53.44 53.07 2dkp n ALA 118 Cb 0.51 0.22 0.72 0.00 0.00 0.00 0.00 19.45 20.89 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 -0.21 0.00 -9.54 0.00 -0.00 -0.88 -3.39 115.31 101.29 2dkp h LEU 119 Ca -0.35 0.00 -0.53 0.00 -0.00 0.00 0.00 57.88 57.00 2dkp h LEU 119 Cb 1.44 0.00 0.01 0.00 -0.00 0.00 0.00 40.66 42.11 2dkp h LEU 119 CO -0.12 0.00 0.60 0.54 -0.00 0.00 0.00 178.44 179.46 2dkp s VAL 120 N -3.81 3.75 -0.87 0.15 0.11 -1.26 -4.98 120.40 113.49 2dkp s VAL 120 Ca -0.03 1.30 -0.15 0.00 -2.93 0.00 0.00 61.98 60.17 2dkp s VAL 120 Cb 0.08 -3.83 0.20 0.00 -1.53 0.00 0.00 36.38 31.29 2dkp s VAL 120 CO 0.24 0.12 0.88 -1.10 -3.33 0.00 0.00 175.10 171.91 2dkp s GLN 121 N 0.79 3.63 0.22 1.54 -1.52 -1.26 -4.60 119.66 118.46 2dkp s GLN 121 Ca 0.59 -2.31 -0.20 0.00 -1.95 0.00 0.00 55.36 51.48 2dkp s GLN 121 Cb -0.32 -4.56 0.04 0.00 -0.22 0.00 0.00 33.01 27.94 2dkp s GLN 121 CO 0.31 -1.42 0.61 -0.08 -0.25 0.00 0.00 175.29 174.47 2dkp s THR 122 N 0.77 0.01 -1.38 -0.19 -1.32 -1.26 -4.91 115.64 107.35 2dkp s THR 122 Ca 0.22 -0.65 -0.07 0.00 -1.21 0.00 0.00 61.69 59.99 2dkp s THR 122 Cb -0.09 -1.58 0.00 0.00 -1.51 0.00 0.00 72.50 69.33 2dkp s THR 122 CO -0.09 -0.04 0.39 -1.20 -2.21 0.00 0.00 174.62 171.48 2dkp n SER 123 N -0.40 -1.07 0.00 8.08 7.64 -1.26 -4.44 113.62 122.17 2dkp n SER 123 Ca -0.10 -1.11 0.00 0.00 1.01 0.00 0.00 58.87 58.68 2dkp n SER 123 Cb 0.62 -2.60 0.00 0.00 -1.01 0.00 0.00 64.21 61.22 2dkp n SER 123 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2dkp n GLY 124 N -2.10 -1.79 3.76 0.23 0.00 -1.26 -4.75 105.19 99.28 2dkp n GLY 124 Ca -0.27 0.61 -0.40 0.00 0.00 0.00 0.00 46.02 45.97 2dkp n GLY 124 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2dkp s PRO 125 N 0.00 4.69 -0.08 1.61 0.04 -1.26 -5.00 135.00 135.00 2dkp s PRO 125 Ca 0.00 1.73 -0.08 0.00 0.04 0.00 0.00 61.00 62.69 2dkp s PRO 125 Cb 0.00 -3.21 -0.03 0.00 0.04 0.00 0.00 34.50 31.30 2dkp s PRO 125 CO 0.00 0.28 -0.15 0.45 0.04 0.00 0.00 177.00 177.61 2dkp n SER 126 N 1.32 0.88 -3.90 6.66 2.88 -1.26 -4.53 113.62 115.67 2dkp n SER 126 Ca -0.01 0.15 -0.09 0.00 -1.33 0.00 0.00 58.87 57.58 2dkp n SER 126 Cb 0.45 -0.58 -0.06 0.00 -0.75 0.00 0.00 64.21 63.28 2dkp n SER 126 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2dkp s SER 127 N -4.93 -0.09 0.00 -3.46 0.15 -1.26 -5.10 113.70 99.02 2dkp s SER 127 Ca -0.13 -0.76 0.00 0.00 0.70 0.00 0.00 55.95 55.76 2dkp s SER 127 Cb 0.02 0.52 0.00 0.00 -1.71 0.00 0.00 66.02 64.84 2dkp s SER 127 CO 0.19 -1.00 0.00 0.61 1.20 0.00 0.00 173.24 174.24