#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 2.75 -3.67 1.61 3.41 -1.26 -4.91 113.62 111.55 2dkp n SER 2 Ca 0.00 -0.04 -0.09 0.00 -0.26 0.00 0.00 58.87 58.48 2dkp n SER 2 Cb 0.00 -1.53 -0.10 0.00 -0.26 0.00 0.00 64.21 62.33 2dkp n SER 2 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 2dkp s SER 3 N 9.68 -0.52 0.16 4.04 0.01 -1.26 -5.17 113.70 120.65 2dkp s SER 3 Ca 1.02 1.04 0.10 0.00 1.31 0.00 0.00 55.95 59.42 2dkp s SER 3 Cb -0.35 1.12 -0.04 0.00 0.21 0.00 0.00 66.02 66.96 2dkp s SER 3 CO 0.33 -0.21 -0.21 -0.83 0.41 0.00 0.00 173.24 172.73 2dkp s GLY 4 N 1.91 1.68 0.16 3.44 0.00 -1.26 -5.14 107.32 108.12 2dkp s GLY 4 Ca -0.07 -1.52 -0.24 0.00 0.00 0.00 0.00 44.72 42.89 2dkp s GLY 4 CO -0.14 -1.53 0.76 -0.56 0.00 0.00 0.00 173.10 171.63 2dkp s SER 5 N -2.48 -0.36 -0.21 1.64 0.01 -1.26 -5.09 113.70 105.95 2dkp s SER 5 Ca 0.20 -0.27 -0.17 0.00 1.31 0.00 0.00 55.95 57.02 2dkp s SER 5 Cb -0.09 0.58 -0.08 0.00 0.21 0.00 0.00 66.02 66.64 2dkp s SER 5 CO 0.10 -1.01 -0.35 -1.20 0.41 0.00 0.00 173.24 171.20 2dkp n SER 6 N -0.40 1.94 0.00 2.44 7.64 -1.26 -5.10 113.62 118.88 2dkp n SER 6 Ca -0.09 0.34 0.00 0.00 1.01 0.00 0.00 58.87 60.12 2dkp n SER 6 Cb 0.62 -0.76 0.00 0.00 -1.01 0.00 0.00 64.21 63.05 2dkp n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2dkp n GLY 7 N 1.41 -1.74 3.26 0.23 0.00 -1.26 -5.13 105.19 101.95 2dkp n GLY 7 Ca -0.25 0.57 -0.27 0.00 0.00 0.00 0.00 46.02 46.07 2dkp n GLY 7 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2dkp s LYS 8 N 0.00 1.60 -0.63 1.61 0.00 -1.26 -4.76 119.74 116.30 2dkp s LYS 8 Ca 0.00 -0.90 -0.26 0.00 0.00 0.00 0.00 55.97 54.81 2dkp s LYS 8 Cb 0.00 -1.66 0.04 0.00 0.00 0.00 0.00 37.83 36.21 2dkp s LYS 8 CO 0.00 0.44 1.13 1.03 0.00 0.00 0.00 175.35 177.95 2dkp s ARG 9 N -0.90 3.33 -0.25 1.78 0.52 -1.26 -4.83 118.95 117.33 2dkp s ARG 9 Ca 0.08 -0.15 -0.07 0.00 -0.52 0.00 0.00 55.73 55.08 2dkp s ARG 9 Cb -0.09 -4.10 -0.16 0.00 0.52 0.00 0.00 34.95 31.12 2dkp s ARG 9 CO 0.01 -1.79 -0.17 -1.13 0.02 0.00 0.00 175.30 172.24 2dkp n SER 10 N 8.39 1.98 -4.81 0.23 3.41 -1.26 -4.98 113.62 116.57 2dkp n SER 10 Ca 0.04 0.14 -0.30 0.00 -0.26 0.00 0.00 58.87 58.49 2dkp n SER 10 Cb 0.48 -0.67 0.09 0.00 -0.26 0.00 0.00 64.21 63.85 2dkp n SER 10 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 175.04 175.08 2dkp s ASN 11 N -6.99 4.59 1.19 4.04 -0.87 -1.26 -5.05 114.94 110.59 2dkp s ASN 11 Ca -0.35 1.33 -0.18 0.00 -1.57 0.00 0.00 52.86 52.09 2dkp s ASN 11 Cb 0.11 -2.08 0.28 0.00 -0.02 0.00 0.00 41.25 39.54 2dkp s ASN 11 CO 0.57 -1.91 1.10 -0.44 -2.57 0.00 0.00 177.10 173.85 2dkp s SER 12 N -3.90 1.04 -0.04 -1.22 0.01 -1.26 -5.06 113.70 103.26 2dkp s SER 12 Ca 0.60 0.72 0.06 0.00 1.31 0.00 0.00 55.95 58.65 2dkp s SER 12 Cb -0.14 -1.04 -0.02 0.00 0.21 0.00 0.00 66.02 65.03 2dkp s SER 12 CO 0.54 -4.06 -0.23 -0.63 0.41 0.00 0.00 173.24 169.27 2dkp s ILE 13 N -2.96 2.27 -0.08 1.44 1.01 -1.26 -5.12 121.20 116.50 2dkp s ILE 13 Ca 0.70 -1.01 -0.21 0.00 0.00 0.00 0.00 60.65 60.14 2dkp s ILE 13 Cb -0.11 -1.82 -0.04 0.00 0.01 0.00 0.00 42.46 40.49 2dkp s ILE 13 CO 0.56 0.58 0.58 -0.75 0.00 0.00 0.00 174.94 175.91 2dkp s LYS 14 N -0.43 4.37 -0.09 2.79 2.36 -1.26 -4.89 119.74 122.60 2dkp s LYS 14 Ca 0.05 0.66 -0.15 0.00 -2.55 0.00 0.00 55.97 53.98 2dkp s LYS 14 Cb -0.12 -3.43 -0.05 0.00 -1.05 0.00 0.00 37.83 33.19 2dkp s LYS 14 CO 0.01 0.15 0.37 0.50 1.55 0.00 0.00 175.35 177.93 2dkp s ARG 15 N 0.58 4.10 -0.41 4.03 3.52 -1.26 -5.05 118.95 124.47 2dkp s ARG 15 Ca 0.31 0.27 -0.22 0.00 -0.13 0.00 0.00 55.73 55.97 2dkp s ARG 15 Cb -0.17 -3.34 0.02 0.00 -1.56 0.00 0.00 34.95 29.90 2dkp s ARG 15 CO 0.14 0.41 0.71 1.21 -0.81 0.00 0.00 175.30 176.96 2dkp s ASN 16 N -0.13 6.42 0.08 -2.12 2.47 -1.26 -4.97 114.94 115.43 2dkp s ASN 16 Ca 0.21 -0.02 -0.24 0.00 0.42 0.00 0.00 52.86 53.24 2dkp s ASN 16 Cb -0.15 -2.35 -0.09 0.00 -1.45 0.00 0.00 41.25 37.21 2dkp s ASN 16 CO 0.09 -0.76 1.39 -0.65 -3.72 0.00 0.00 177.10 173.44 2dkp h PRO 17 N 8.73 -0.37 -0.99 0.43 0.11 -2.04 -1.89 132.00 135.98 2dkp h PRO 17 Ca -0.25 0.02 0.23 0.00 0.11 0.00 0.00 66.00 66.11 2dkp h PRO 17 Cb 1.10 0.08 -0.19 0.00 0.11 0.00 0.00 31.00 32.10 2dkp h PRO 17 CO 0.90 -0.24 -0.14 -0.91 -0.21 0.00 0.00 178.00 177.39 2dkp h ASN 18 N -0.38 -0.76 0.00 -2.05 2.35 -2.06 -3.40 115.58 109.28 2dkp h ASN 18 Ca 0.03 0.29 -0.39 0.00 -0.55 0.00 0.00 56.30 55.68 2dkp h ASN 18 Cb 0.46 0.57 -0.06 0.00 0.05 0.00 0.00 38.32 39.35 2dkp h ASN 18 CO -0.33 -0.34 1.16 0.00 -1.65 0.00 0.00 177.43 176.27 2dkp n ALA 19 N -3.44 0.19 -1.68 -0.83 0.00 -0.71 -4.67 120.51 109.37 2dkp n ALA 19 Ca 0.19 -0.12 -0.59 0.00 0.00 0.00 0.00 53.44 52.92 2dkp n ALA 19 Cb 0.60 -1.56 -0.08 0.00 0.00 0.00 0.00 19.45 18.42 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 5.79 0.84 -2.61 0.00 -0.02 -1.26 -4.74 135.00 133.00 2dkp n PRO 20 Ca 0.44 0.30 -0.43 0.00 -2.02 0.00 0.00 63.50 61.80 2dkp n PRO 20 Cb 0.01 -1.93 -0.02 0.00 -0.02 0.00 0.00 33.50 31.54 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 2.52 4.61 0.01 -1.45 1.01 -1.26 -4.44 120.40 121.39 2dkp s VAL 21 Ca 0.96 1.91 -0.24 0.00 0.00 0.00 0.00 61.98 64.61 2dkp s VAL 21 Cb -1.15 -4.23 -0.18 0.00 0.00 0.00 0.00 36.38 30.83 2dkp s VAL 21 CO 0.64 -0.06 1.35 0.58 0.00 0.00 0.00 175.10 177.61 2dkp h VAL 22 N 5.22 1.33 -1.45 2.92 2.07 -0.77 -3.47 116.25 122.10 2dkp h VAL 22 Ca -0.28 -1.01 0.10 0.00 0.82 0.00 0.00 66.70 66.33 2dkp h VAL 22 Cb 1.12 1.93 -0.28 0.00 -1.52 0.00 0.00 31.29 32.54 2dkp h VAL 22 CO 0.91 0.27 0.58 -0.60 0.02 0.00 0.00 177.57 178.75 2dkp s ARG 23 N -4.55 0.38 -0.09 1.57 6.06 -1.19 -5.01 118.95 116.12 2dkp s ARG 23 Ca -0.15 0.43 0.00 0.00 -2.50 0.00 0.00 55.73 53.51 2dkp s ARG 23 Cb 0.03 0.18 0.02 0.00 0.06 0.00 0.00 34.95 35.25 2dkp s ARG 23 CO 0.69 -0.05 -0.07 -0.98 -2.50 0.00 0.00 175.30 172.39 2dkp s ARG 24 N 0.12 1.40 0.14 5.12 1.70 -1.26 -0.25 118.95 125.91 2dkp s ARG 24 Ca 0.04 -0.23 -0.18 0.00 -0.47 0.00 0.00 55.73 54.88 2dkp s ARG 24 Cb -0.05 -1.41 0.05 0.00 -0.57 0.00 0.00 34.95 32.97 2dkp s ARG 24 CO -0.09 -0.19 0.47 0.20 -1.08 0.00 0.00 175.30 174.62 2dkp s GLY 25 N 1.44 -0.39 -0.98 3.88 0.00 -0.38 -5.01 107.32 105.88 2dkp s GLY 25 Ca -0.01 0.13 -0.24 0.00 0.00 0.00 0.00 44.72 44.61 2dkp s GLY 25 CO -0.05 -0.15 1.77 -0.98 0.00 0.00 0.00 173.10 173.69 2dkp s TRP 26 N -3.79 2.11 0.37 1.90 0.52 -1.26 -1.99 118.94 116.79 2dkp s TRP 26 Ca 0.02 0.02 -0.10 0.00 0.02 0.00 0.00 56.10 56.06 2dkp s TRP 26 Cb 0.01 -4.30 -0.07 0.00 -1.15 0.00 0.00 33.47 27.96 2dkp s TRP 26 CO -0.12 -1.78 0.72 -1.17 0.02 0.00 0.00 176.95 174.62 2dkp s LEU 27 N 8.14 3.92 -0.20 2.99 2.96 -1.00 -4.82 118.68 130.66 2dkp s LEU 27 Ca 0.61 1.07 -0.10 0.00 -0.22 0.00 0.00 54.13 55.49 2dkp s LEU 27 Cb -0.04 -3.92 -0.05 0.00 0.50 0.00 0.00 46.19 42.68 2dkp s LEU 27 CO -0.03 -0.32 0.13 -0.31 -1.32 0.00 0.00 176.35 174.50 2dkp s TYR 28 N -2.24 3.38 -0.02 5.38 2.02 -1.26 -2.86 117.35 121.75 2dkp s TYR 28 Ca 0.50 0.29 0.07 0.00 -0.37 0.00 0.00 57.07 57.56 2dkp s TYR 28 Cb -0.10 -2.17 -0.02 0.00 -0.40 0.00 0.00 41.96 39.27 2dkp s TYR 28 CO 0.29 0.25 -0.23 0.21 -1.57 0.00 0.00 175.55 174.49 2dkp s LYS 29 N 0.46 1.90 0.66 -0.62 2.20 -0.70 -3.40 119.74 120.24 2dkp s LYS 29 Ca 0.07 -0.82 -0.11 0.00 -0.36 0.00 0.00 55.97 54.75 2dkp s LYS 29 Cb -0.11 -1.82 -0.01 0.00 -1.51 0.00 0.00 37.83 34.37 2dkp s LYS 29 CO -0.01 0.49 1.06 -1.14 -0.36 0.00 0.00 175.35 175.39 2dkp s GLN 30 N -0.51 3.22 0.00 4.03 0.74 -1.07 -0.34 119.66 125.73 2dkp s GLN 30 Ca 0.08 0.64 0.02 0.00 0.05 0.00 0.00 55.36 56.15 2dkp s GLN 30 Cb -0.09 -2.05 -0.01 0.00 1.10 0.00 0.00 33.01 31.97 2dkp s GLN 30 CO -0.01 -0.82 -0.06 -0.51 -0.55 0.00 0.00 175.29 173.35 2dkp s ASP 31 N -4.22 0.69 -0.06 6.67 1.11 -1.10 -4.80 116.67 114.96 2dkp s ASP 31 Ca 0.57 -0.15 -0.24 0.00 0.18 0.00 0.00 52.55 52.91 2dkp s ASP 31 Cb -0.11 -0.06 -0.27 0.00 1.07 0.00 0.00 42.92 43.55 2dkp s ASP 31 CO 0.53 0.04 0.94 0.28 1.18 0.00 0.00 175.17 178.14 2dkp h SER 32 N 5.85 0.30 -1.94 0.27 0.02 -1.93 -3.28 113.55 112.84 2dkp h SER 32 Ca -0.29 -0.88 -0.65 0.00 -0.84 0.00 0.00 61.79 59.13 2dkp h SER 32 Cb 1.19 -0.09 0.07 0.00 0.14 0.00 0.00 62.40 63.71 2dkp h SER 32 CO 0.49 1.15 0.32 0.35 -1.14 0.00 0.00 176.83 178.01 2dkp n THR 33 N -4.36 0.73 0.00 -2.27 -2.24 -1.26 -4.11 114.28 100.78 2dkp n THR 33 Ca -0.11 -0.18 0.00 0.00 -2.27 0.00 0.00 64.05 61.48 2dkp n THR 33 Cb 0.63 -0.88 0.00 0.00 -2.10 0.00 0.00 70.33 67.98 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 2.12 0.86 3.52 3.38 0.00 -1.26 -4.68 105.19 109.13 2dkp n GLY 34 Ca 0.15 0.42 -0.25 0.00 0.00 0.00 0.00 46.02 46.35 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 1.81 -0.26 1.61 -1.94 -1.26 -5.03 119.30 114.24 2dkp s MET 35 Ca 0.00 -1.80 -0.05 0.00 -1.71 0.00 0.00 55.69 52.14 2dkp s MET 35 Cb 0.00 -1.79 -0.08 0.00 2.01 0.00 0.00 34.83 34.97 2dkp s MET 35 CO 0.00 0.25 3.12 1.63 -0.01 0.00 0.00 175.02 180.01 2dkp n LYS 36 N -0.73 2.21 -2.09 2.03 4.76 -1.24 -4.48 118.16 118.62 2dkp n LYS 36 Ca -0.05 -1.74 -0.28 0.00 -2.87 0.00 0.00 58.31 53.37 2dkp n LYS 36 Cb 0.61 -2.06 0.05 0.00 -1.84 0.00 0.00 35.03 31.79 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 -1.23 2.90 -0.23 -0.35 1.43 -1.26 -4.70 118.68 115.25 2dkp s LEU 37 Ca 0.61 0.82 -0.13 0.00 -1.03 0.00 0.00 54.13 54.40 2dkp s LEU 37 Cb 0.35 -3.54 -0.04 0.00 0.03 0.00 0.00 46.19 42.98 2dkp s LEU 37 CO -0.12 -1.42 0.29 0.26 0.23 0.00 0.00 176.35 175.59 2dkp s TRP 38 N -3.28 3.33 -0.11 0.29 0.52 -1.26 -2.70 118.94 115.73 2dkp s TRP 38 Ca 0.58 0.41 -0.04 0.00 0.02 0.00 0.00 56.10 57.07 2dkp s TRP 38 Cb -0.11 -2.43 -0.04 0.00 -1.15 0.00 0.00 33.47 29.75 2dkp s TRP 38 CO 0.48 -0.02 0.06 0.15 0.02 0.00 0.00 176.95 177.64 2dkp s LYS 39 N 1.34 3.29 0.06 4.98 3.01 0.54 -4.87 119.74 128.09 2dkp s LYS 39 Ca 0.13 -0.30 -0.27 0.00 -1.01 0.00 0.00 55.97 54.52 2dkp s LYS 39 Cb -0.14 -2.99 -0.05 0.00 -1.01 0.00 0.00 37.83 33.63 2dkp s LYS 39 CO 0.07 0.66 0.84 0.21 0.51 0.00 0.00 175.35 177.64 2dkp s LYS 40 N -0.74 4.56 -0.04 1.68 2.20 -1.26 -1.73 119.74 124.41 2dkp s LYS 40 Ca 0.12 1.20 -0.28 0.00 -0.36 0.00 0.00 55.97 56.66 2dkp s LYS 40 Cb -0.12 -3.37 0.06 0.00 -1.51 0.00 0.00 37.83 32.89 2dkp s LYS 40 CO 0.03 0.25 0.60 0.50 -0.36 0.00 0.00 175.35 176.36 2dkp s ARG 41 N 0.01 0.97 -0.56 4.03 6.06 -1.14 -5.01 118.95 123.33 2dkp s ARG 41 Ca 0.42 0.17 -0.28 0.00 -2.50 0.00 0.00 55.73 53.54 2dkp s ARG 41 Cb -0.21 0.46 0.02 0.00 0.06 0.00 0.00 34.95 35.27 2dkp s ARG 41 CO 0.25 -0.30 1.38 -0.46 -2.50 0.00 0.00 175.30 173.67 2dkp s TRP 42 N -1.21 2.34 -0.10 5.12 -0.00 -1.26 -2.36 118.94 121.48 2dkp s TRP 42 Ca -0.11 0.47 -0.05 0.00 -0.00 0.00 0.00 56.10 56.41 2dkp s TRP 42 Cb -0.01 -4.41 -0.04 0.00 -0.00 0.00 0.00 33.47 29.01 2dkp s TRP 42 CO 0.09 -1.91 0.08 -0.06 -0.00 0.00 0.00 176.95 175.15 2dkp s PHE 43 N 5.84 3.41 -0.02 5.86 0.40 -0.84 -2.95 117.98 129.67 2dkp s PHE 43 Ca 0.51 0.38 0.03 0.00 -0.60 0.00 0.00 56.93 57.25 2dkp s PHE 43 Cb -0.10 -1.87 -0.00 0.00 0.51 0.00 0.00 43.02 41.56 2dkp s PHE 43 CO 0.25 0.62 -0.10 0.08 0.70 0.00 0.00 175.22 176.77 2dkp s VAL 44 N -0.99 0.87 -0.50 -0.44 1.01 0.72 -1.25 120.40 119.83 2dkp s VAL 44 Ca 0.15 -0.43 -0.11 0.00 0.00 0.00 0.00 61.98 61.58 2dkp s VAL 44 Cb -0.12 -0.76 0.12 0.00 0.00 0.00 0.00 36.38 35.63 2dkp s VAL 44 CO 0.04 0.26 0.40 -0.22 0.00 0.00 0.00 175.10 175.58 2dkp s LEU 45 N 0.03 5.87 0.04 3.92 1.98 0.65 -1.63 118.68 129.55 2dkp s LEU 45 Ca -0.01 -1.89 -0.03 0.00 -2.89 0.00 0.00 54.13 49.31 2dkp s LEU 45 Cb -0.07 -2.08 -0.02 0.00 0.66 0.00 0.00 46.19 44.68 2dkp s LEU 45 CO 0.00 -0.75 0.03 -0.94 -1.89 0.00 0.00 176.35 172.81 2dkp s SER 46 N 2.96 0.29 -1.32 3.68 1.04 -1.07 -0.01 113.70 119.26 2dkp s SER 46 Ca 0.05 -0.67 -0.14 0.00 0.48 0.00 0.00 55.95 55.67 2dkp s SER 46 Cb -0.27 0.19 0.01 0.00 0.10 0.00 0.00 66.02 66.05 2dkp s SER 46 CO 0.00 -0.49 0.49 -0.67 0.98 0.00 0.00 173.24 173.55 2dkp n ASP 47 N 0.73 -2.19 -3.91 7.02 2.03 -1.26 -0.27 116.55 118.70 2dkp n ASP 47 Ca -0.18 -1.14 -0.33 0.00 0.52 0.00 0.00 54.79 53.65 2dkp n ASP 47 Cb 0.59 -2.48 -0.06 0.00 -0.72 0.00 0.00 41.12 38.45 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 -4.56 -0.66 -4.11 -2.67 7.99 -1.26 -4.83 117.00 106.90 2dkp n LEU 48 Ca -0.21 -0.99 -0.15 0.00 -0.01 0.00 0.00 56.01 54.65 2dkp n LEU 48 Cb 0.64 -1.26 -0.05 0.00 -0.11 0.00 0.00 43.42 42.64 2dkp n LEU 48 CO 0.75 0.09 0.11 0.00 -1.51 0.00 0.00 177.39 176.84 2dkp s LEU 50 N -3.25 2.72 -0.04 0.00 1.43 0.16 -2.61 118.68 117.09 2dkp s LEU 50 Ca 0.31 -0.28 -0.00 0.00 -1.03 0.00 0.00 54.13 53.13 2dkp s LEU 50 Cb -0.00 -1.59 0.03 0.00 0.03 0.00 0.00 46.19 44.66 2dkp s LEU 50 CO 0.21 0.23 0.01 -0.36 0.23 0.00 0.00 176.35 176.67 2dkp s PHE 51 N -0.07 0.36 0.16 0.29 0.08 -0.64 -1.30 117.98 116.87 2dkp s PHE 51 Ca -0.02 -0.01 0.06 0.00 0.12 0.00 0.00 56.93 57.08 2dkp s PHE 51 Cb -0.14 -0.49 -0.04 0.00 -0.57 0.00 0.00 43.02 41.77 2dkp s PHE 51 CO 0.04 -0.17 -0.12 1.52 -0.10 0.00 0.00 175.22 176.38 2dkp s TYR 52 N 1.31 1.44 0.32 0.36 -0.85 -1.25 -0.20 117.35 118.48 2dkp s TYR 52 Ca -0.06 -0.66 0.07 0.00 -0.52 0.00 0.00 57.07 55.90 2dkp s TYR 52 Cb -0.13 -0.71 -0.03 0.00 0.38 0.00 0.00 41.96 41.47 2dkp s TYR 52 CO -0.02 0.19 0.27 0.71 -1.52 0.00 0.00 175.55 175.18 2dkp s TYR 53 N -3.00 1.72 0.16 -3.49 1.51 -1.15 -3.17 117.35 109.91 2dkp s TYR 53 Ca 0.17 -1.65 -0.17 0.00 -1.01 0.00 0.00 57.07 54.41 2dkp s TYR 53 Cb 0.00 -0.71 0.07 0.00 -0.11 0.00 0.00 41.96 41.21 2dkp s TYR 53 CO 0.03 -0.86 1.69 0.00 -1.11 0.00 0.00 175.55 175.31 2dkp h ARG 54 N 2.17 0.05 0.00 -0.62 3.08 -1.81 -3.37 114.38 113.88 2dkp h ARG 54 Ca -0.26 -0.00 -0.11 0.00 0.07 0.00 0.00 59.98 59.68 2dkp h ARG 54 Cb 1.23 -0.01 -0.02 0.00 0.08 0.00 0.00 29.97 31.25 2dkp h ARG 54 CO 0.37 0.03 0.02 -3.47 -1.07 0.00 0.00 179.97 175.86 2dkp n ASP 55 N -5.22 -1.14 -0.20 7.04 2.03 -1.26 -4.73 116.55 113.06 2dkp n ASP 55 Ca 0.01 -2.13 0.29 0.00 0.52 0.00 0.00 54.79 53.48 2dkp n ASP 55 Cb 0.19 2.00 0.71 0.00 -0.72 0.00 0.00 41.12 43.30 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 0.02 0.00 -0.67 -0.00 -1.95 0.12 114.58 112.10 2dkp h GLU 56 Ca -0.19 -0.00 0.00 0.00 -0.00 0.00 0.00 59.36 59.17 2dkp h GLU 56 Cb 0.78 -0.01 0.00 0.00 -0.00 0.00 0.00 28.75 29.52 2dkp h GLU 56 CO 0.25 0.02 0.53 0.87 -0.00 0.00 0.00 179.01 180.68 2dkp h LYS 57 N 0.03 0.00 -6.54 1.06 1.57 -1.98 -3.44 116.57 107.27 2dkp h LYS 57 Ca 0.45 0.00 -0.51 0.00 -1.87 0.00 0.00 60.65 58.72 2dkp h LYS 57 Cb 1.75 0.00 -0.06 0.00 0.08 0.00 0.00 32.23 34.00 2dkp h LYS 57 CO -0.02 0.00 -0.90 0.39 -0.57 0.00 0.00 179.45 178.35 2dkp n GLU 58 N -2.66 -2.93 -3.52 3.15 1.02 0.42 -4.92 120.64 111.19 2dkp n GLU 58 Ca -0.01 0.37 -0.42 0.00 -0.02 0.00 0.00 57.16 57.08 2dkp n GLU 58 Cb 0.56 -4.39 -0.09 0.00 -0.02 0.00 0.00 31.44 27.49 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 -6.61 2.75 0.24 3.49 2.02 -1.26 -4.91 118.70 114.42 2dkp s GLU 59 Ca 0.03 -1.42 0.00 0.00 0.02 0.00 0.00 54.97 53.61 2dkp s GLU 59 Cb -0.01 -3.91 0.00 0.00 0.10 0.00 0.00 34.13 30.31 2dkp s GLU 59 CO 0.90 -0.98 0.00 0.41 0.02 0.00 0.00 175.26 175.61 2dkp n GLY 60 N 5.02 -5.07 3.73 -1.39 0.00 -1.26 -4.59 105.19 101.63 2dkp n GLY 60 Ca -0.11 -0.36 -0.41 0.00 0.00 0.00 0.00 46.02 45.14 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 -0.99 4.28 -0.60 -0.61 1.01 -1.26 -4.37 121.20 118.66 2dkp s ILE 61 Ca 0.00 1.90 0.24 0.00 0.00 0.00 0.00 60.65 62.79 2dkp s ILE 61 Cb 0.00 -4.22 0.10 0.00 0.01 0.00 0.00 42.46 38.36 2dkp s ILE 61 CO 0.00 0.30 1.38 -0.07 0.00 0.00 0.00 174.94 176.55 2dkp h LEU 62 N 5.48 0.00 0.00 2.97 3.38 -1.89 -3.48 115.31 121.77 2dkp h LEU 62 Ca -0.43 -0.14 0.00 0.00 0.09 0.00 0.00 57.88 57.40 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 0.72 0.07 0.00 0.61 0.09 0.00 0.00 178.44 179.93 2dkp n GLY 63 N 1.30 2.17 3.78 0.83 0.00 -1.26 -5.12 105.19 106.90 2dkp n GLY 63 Ca 0.03 0.03 -0.33 0.00 0.00 0.00 0.00 46.02 45.76 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 5.67 -0.13 1.61 1.04 -1.26 -3.89 113.70 116.74 2dkp s SER 64 Ca 0.00 0.14 0.03 0.00 0.48 0.00 0.00 55.95 56.59 2dkp s SER 64 Cb 0.00 -1.62 0.01 0.00 0.10 0.00 0.00 66.02 64.50 2dkp s SER 64 CO 0.00 0.27 -0.21 -0.63 0.98 0.00 0.00 173.24 173.64 2dkp s ILE 65 N -1.21 1.98 -0.44 -1.02 1.01 -0.42 -4.99 121.20 116.11 2dkp s ILE 65 Ca 0.23 -0.94 -0.25 0.00 0.00 0.00 0.00 60.65 59.69 2dkp s ILE 65 Cb -0.12 -1.75 0.02 0.00 0.01 0.00 0.00 42.46 40.62 2dkp s ILE 65 CO 0.14 0.54 0.92 -0.76 0.00 0.00 0.00 174.94 175.78 2dkp s LEU 66 N 0.78 4.01 0.09 2.97 2.01 -1.26 -0.67 118.68 126.62 2dkp s LEU 66 Ca -0.08 0.19 -0.16 0.00 0.01 0.00 0.00 54.13 54.08 2dkp s LEU 66 Cb -0.16 -3.19 -0.08 0.00 0.01 0.00 0.00 46.19 42.77 2dkp s LEU 66 CO -0.01 -1.01 1.45 -0.07 1.01 0.00 0.00 176.35 177.73 2dkp h LEU 67 N 10.46 0.64 -1.76 1.79 3.38 -1.91 -3.01 115.31 124.89 2dkp h LEU 67 Ca -0.24 -0.42 0.24 0.00 0.09 0.00 0.00 57.88 57.56 2dkp h LEU 67 Cb 1.08 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 41.62 2dkp h LEU 67 CO 1.01 0.92 0.79 -0.65 0.09 0.00 0.00 178.44 180.60 2dkp h PRO 68 N 0.36 0.00 0.00 1.13 0.11 -1.76 0.82 132.00 132.66 2dkp h PRO 68 Ca 0.06 0.00 -0.11 0.00 0.11 0.00 0.00 66.00 66.06 2dkp h PRO 68 Cb 0.69 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.78 2dkp h PRO 68 CO 0.05 0.00 -1.33 0.45 -0.21 0.00 0.00 178.00 176.96 2dkp n SER 69 N -3.74 0.81 -4.88 -2.05 2.88 -1.15 -4.75 113.62 100.75 2dkp n SER 69 Ca 0.18 0.34 -0.30 0.00 -1.33 0.00 0.00 58.87 57.76 2dkp n SER 69 Cb 1.07 0.32 -0.00 0.00 -0.75 0.00 0.00 64.21 64.86 2dkp n SER 69 CO 0.00 0.00 0.00 -0.36 -1.23 0.00 0.00 175.04 173.45 2dkp s PHE 70 N -3.07 3.58 -0.27 0.66 0.08 0.29 -4.51 117.98 114.73 2dkp s PHE 70 Ca -0.02 1.12 0.02 0.00 0.12 0.00 0.00 56.93 58.17 2dkp s PHE 70 Cb 0.09 -2.56 0.07 0.00 -0.57 0.00 0.00 43.02 40.05 2dkp s PHE 70 CO 0.81 -0.47 -0.04 -1.14 -0.10 0.00 0.00 175.22 174.28 2dkp s GLN 71 N -4.82 1.76 -0.30 0.44 0.74 0.18 -4.75 119.66 112.90 2dkp s GLN 71 Ca 0.52 -1.33 -0.29 0.00 0.05 0.00 0.00 55.36 54.32 2dkp s GLN 71 Cb -0.11 -2.80 0.02 0.00 1.10 0.00 0.00 33.01 31.22 2dkp s GLN 71 CO 0.47 -0.69 1.07 0.42 -0.55 0.00 0.00 175.29 176.01 2dkp s ILE 72 N 1.19 4.55 -0.12 -2.34 -1.09 -1.26 -2.14 121.20 119.99 2dkp s ILE 72 Ca -0.02 1.80 -0.08 0.00 -2.23 0.00 0.00 60.65 60.11 2dkp s ILE 72 Cb -0.19 -4.39 0.04 0.00 -1.58 0.00 0.00 42.46 36.34 2dkp s ILE 72 CO -0.07 -0.41 0.30 0.00 -1.23 0.00 0.00 174.94 173.52 2dkp s ALA 73 N 3.55 -0.73 0.41 9.38 0.00 -1.05 -5.05 121.76 128.28 2dkp s ALA 73 Ca 0.45 1.00 -0.25 0.00 0.00 0.00 0.00 51.96 53.16 2dkp s ALA 73 Cb -0.13 -0.60 -0.11 0.00 0.00 0.00 0.00 23.12 22.28 2dkp s ALA 73 CO 0.13 -0.18 1.03 1.28 0.00 0.00 0.00 175.76 178.03 2dkp n LEU 74 N 3.57 2.68 -4.20 0.00 7.99 -1.26 -3.38 117.00 122.39 2dkp n LEU 74 Ca -0.19 1.05 -0.26 0.00 -0.01 0.00 0.00 56.01 56.60 2dkp n LEU 74 Cb 0.56 -1.36 0.23 0.00 -0.11 0.00 0.00 43.42 42.73 2dkp n LEU 74 CO 0.14 -1.41 0.12 0.18 -1.51 0.00 0.00 177.39 174.92 2dkp n LEU 75 N 0.53 -1.25 -3.55 2.23 4.77 -1.26 -4.89 117.00 113.58 2dkp n LEU 75 Ca 0.09 -0.49 -0.10 0.00 -0.03 0.00 0.00 56.01 55.48 2dkp n LEU 75 Cb 0.39 -0.96 -0.02 0.00 -2.33 0.00 0.00 43.42 40.50 2dkp n LEU 75 CO 0.57 -3.74 0.49 0.28 -1.33 0.00 0.00 177.39 173.66 2dkp s THR 76 N -2.16 0.00 0.22 -5.08 -1.32 -1.26 -5.03 115.64 101.00 2dkp s THR 76 Ca 0.56 -0.25 -0.03 0.00 -1.21 0.00 0.00 61.69 60.77 2dkp s THR 76 Cb -0.12 -1.27 0.33 0.00 -1.51 0.00 0.00 72.50 69.92 2dkp s THR 76 CO 0.52 0.00 1.15 -0.24 -2.21 0.00 0.00 174.62 173.84 2dkp n SER 77 N -0.38 -0.19 -0.32 8.08 2.88 -1.26 0.12 113.62 122.55 2dkp n SER 77 Ca -0.12 1.26 0.07 0.00 -1.33 0.00 0.00 58.87 58.75 2dkp n SER 77 Cb 0.63 -0.41 0.17 0.00 -0.75 0.00 0.00 64.21 63.84 2dkp n SER 77 CO 0.00 0.00 0.00 -0.33 -1.23 0.00 0.00 175.04 173.48 2dkp h GLU 78 N 0.00 0.01 -6.61 -1.46 4.39 -2.01 -3.40 114.58 105.50 2dkp h GLU 78 Ca 0.39 -0.00 -0.58 0.00 0.34 0.00 0.00 59.36 59.52 2dkp h GLU 78 Cb 0.70 -0.00 0.08 0.00 -0.10 0.00 0.00 28.75 29.42 2dkp h GLU 78 CO -0.73 0.01 0.66 -0.40 -1.16 0.00 0.00 179.01 177.39 2dkp n ASP 79 N -5.53 2.93 -1.78 1.42 5.68 0.33 -4.87 116.55 114.73 2dkp n ASP 79 Ca 0.16 1.14 -0.15 0.00 -0.50 0.00 0.00 54.79 55.44 2dkp n ASP 79 Cb 0.53 -1.45 0.12 0.00 -1.14 0.00 0.00 41.12 39.18 2dkp n ASP 79 CO 0.00 0.00 0.00 1.41 -1.33 0.00 0.00 177.20 177.28 2dkp n HIS 80 N 2.01 1.96 -4.00 2.11 8.25 -1.26 -4.83 115.22 119.46 2dkp n HIS 80 Ca 0.11 -1.35 -0.34 0.00 -0.26 0.00 0.00 57.72 55.89 2dkp n HIS 80 Cb 0.32 -0.69 -0.15 0.00 1.12 0.00 0.00 29.99 30.59 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 -2.12 2.72 -0.18 1.59 1.01 -1.26 -4.99 121.20 117.97 2dkp s ILE 81 Ca 0.37 -0.95 0.00 0.00 0.00 0.00 0.00 60.65 60.07 2dkp s ILE 81 Cb 0.31 -2.32 0.19 0.00 0.01 0.00 0.00 42.46 40.65 2dkp s ILE 81 CO 0.07 0.31 1.63 -3.20 0.00 0.00 0.00 174.94 173.74 2dkp n ASN 82 N 4.66 4.56 -4.95 3.58 5.15 -1.26 -4.89 115.26 122.12 2dkp n ASN 82 Ca -0.18 -2.68 -0.25 0.00 -0.60 0.00 0.00 54.58 50.87 2dkp n ASN 82 Cb 0.48 -0.83 -0.03 0.00 -0.53 0.00 0.00 39.78 38.88 2dkp n ASN 82 CO 0.00 0.00 0.00 -0.13 1.40 0.00 0.00 177.26 178.53 2dkp s ARG 83 N -1.16 3.45 0.48 1.20 1.81 -1.26 -5.12 118.95 118.34 2dkp s ARG 83 Ca 0.20 -0.62 0.04 0.00 -1.72 0.00 0.00 55.73 53.63 2dkp s ARG 83 Cb 0.16 -2.93 -0.02 0.00 -0.45 0.00 0.00 34.95 31.71 2dkp s ARG 83 CO 0.02 0.48 0.09 0.15 -0.68 0.00 0.00 175.30 175.37 2dkp s LYS 84 N -3.45 2.16 -1.19 3.54 1.02 -1.26 -4.70 119.74 115.86 2dkp s LYS 84 Ca 0.35 -2.20 -0.07 0.00 0.02 0.00 0.00 55.97 54.06 2dkp s LYS 84 Cb -0.10 -1.71 0.06 0.00 -0.52 0.00 0.00 37.83 35.55 2dkp s LYS 84 CO 0.29 -0.31 0.38 0.66 -0.92 0.00 0.00 175.35 175.45 2dkp n TYR 85 N -1.28 -1.72 -4.31 3.18 4.01 -1.26 -4.74 117.16 111.04 2dkp n TYR 85 Ca -0.11 0.36 -0.16 0.00 -0.16 0.00 0.00 57.90 57.83 2dkp n TYR 85 Cb 0.66 -2.83 -0.10 0.00 -0.31 0.00 0.00 39.34 36.76 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 -2.83 1.70 0.28 -0.72 0.00 -1.26 -3.02 121.76 115.91 2dkp s ALA 86 Ca 0.31 -1.72 0.04 0.00 0.00 0.00 0.00 51.96 50.59 2dkp s ALA 86 Cb -0.16 0.49 -0.02 0.00 0.00 0.00 0.00 23.12 23.43 2dkp s ALA 86 CO 0.38 -0.26 0.28 1.97 0.00 0.00 0.00 175.76 178.13 2dkp n PHE 87 N -0.37 -0.83 -3.93 0.00 -1.74 0.31 -4.37 117.46 106.52 2dkp n PHE 87 Ca -0.05 -2.22 -0.09 0.00 -0.56 0.00 0.00 57.45 54.52 2dkp n PHE 87 Cb 0.64 0.30 -0.10 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 -3.00 0.54 -0.12 3.97 -2.85 -1.22 -1.67 119.74 115.40 2dkp s LYS 88 Ca 0.31 -0.71 0.01 0.00 -1.00 0.00 0.00 55.97 54.58 2dkp s LYS 88 Cb 0.01 0.21 0.02 0.00 -2.06 0.00 0.00 37.83 36.01 2dkp s LYS 88 CO 0.22 -0.13 -0.13 0.00 0.10 0.00 0.00 175.35 175.41 2dkp s ALA 89 N -2.35 1.60 0.14 0.59 0.00 0.25 -2.53 121.76 119.45 2dkp s ALA 89 Ca -0.07 -0.70 -0.10 0.00 0.00 0.00 0.00 51.96 51.09 2dkp s ALA 89 Cb -0.03 -0.89 -0.06 0.00 0.00 0.00 0.00 23.12 22.14 2dkp s ALA 89 CO -0.03 -0.24 0.46 0.00 0.00 0.00 0.00 175.76 175.95 2dkp s ALA 90 N 1.30 3.67 -0.00 0.00 0.00 -0.91 0.11 121.76 125.93 2dkp s ALA 90 Ca -0.01 -0.34 0.00 0.00 0.00 0.00 0.00 51.96 51.61 2dkp s ALA 90 Cb -0.14 -2.33 -0.00 0.00 0.00 0.00 0.00 23.12 20.65 2dkp s ALA 90 CO -0.06 0.55 -0.01 -1.58 0.00 0.00 0.00 175.76 174.67 2dkp s HIS 91 N -1.56 0.08 -0.05 0.00 2.46 -1.23 -0.65 115.29 114.33 2dkp s HIS 91 Ca 0.39 -0.01 -0.26 0.00 0.47 0.00 0.00 55.06 55.65 2dkp s HIS 91 Cb -0.13 -0.05 -0.22 0.00 -0.13 0.00 0.00 32.58 32.05 2dkp s HIS 91 CO 0.20 -0.00 1.12 -1.00 -2.47 0.00 0.00 174.74 172.59 2dkp h PRO 92 N 6.15 0.06 -0.62 2.88 0.13 -1.91 -3.23 132.00 135.46 2dkp h PRO 92 Ca -0.25 -0.05 0.00 0.00 -0.87 0.00 0.00 66.00 64.83 2dkp h PRO 92 Cb 1.21 0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.35 2dkp h PRO 92 CO 0.51 0.70 0.00 -1.71 -0.23 0.00 0.00 178.00 177.27 2dkp n ASN 93 N -4.71 3.12 -1.99 1.44 5.15 -1.26 -4.91 115.26 112.10 2dkp n ASN 93 Ca -0.09 -2.31 -0.06 0.00 -0.60 0.00 0.00 54.58 51.52 2dkp n ASN 93 Cb 0.36 -0.47 -0.00 0.00 -0.53 0.00 0.00 39.78 39.13 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 0.52 0.46 -1.93 1.20 2.81 -1.22 -5.18 117.12 113.78 2dkp n MET 94 Ca 0.15 -1.32 -0.15 0.00 -1.81 0.00 0.00 57.70 54.57 2dkp n MET 94 Cb 0.61 1.41 0.08 0.00 -0.71 0.00 0.00 33.22 34.61 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 0.18 -3.22 0.03 1.85 -1.26 -4.29 116.66 109.66 2dkp n ARG 95 Ca -0.02 -1.81 -0.39 0.00 -1.00 0.00 0.00 57.85 54.63 2dkp n ARG 95 Cb 0.31 -0.42 -0.07 0.00 -1.05 0.00 0.00 32.46 31.23 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 -1.91 5.09 0.44 8.89 2.01 -1.26 -3.57 115.64 125.33 2dkp s THR 96 Ca 0.43 1.00 0.01 0.00 0.31 0.00 0.00 61.69 63.44 2dkp s THR 96 Cb -0.03 -3.86 -0.00 0.00 0.01 0.00 0.00 72.50 68.62 2dkp s THR 96 CO 0.29 0.17 0.66 -0.31 -0.69 0.00 0.00 174.62 174.73 2dkp s TYR 97 N 1.67 3.22 0.00 4.92 1.51 0.12 -4.88 117.35 123.91 2dkp s TYR 97 Ca 0.25 0.21 0.01 0.00 -1.01 0.00 0.00 57.07 56.53 2dkp s TYR 97 Cb -0.15 -2.29 -0.00 0.00 -0.11 0.00 0.00 41.96 39.40 2dkp s TYR 97 CO 0.10 -0.34 -0.03 0.71 -1.11 0.00 0.00 175.55 174.88 2dkp s TYR 98 N -2.53 0.24 -0.05 2.71 1.51 -1.26 -0.58 117.35 117.38 2dkp s TYR 98 Ca 0.48 -0.11 -0.04 0.00 -1.01 0.00 0.00 57.07 56.40 2dkp s TYR 98 Cb -0.10 -0.15 0.02 0.00 -0.11 0.00 0.00 41.96 41.61 2dkp s TYR 98 CO 0.38 -0.02 0.12 -0.06 -1.11 0.00 0.00 175.55 174.85 2dkp s PHE 99 N -0.25 -0.13 0.07 2.71 0.08 -0.67 -2.61 117.98 117.19 2dkp s PHE 99 Ca -0.01 0.34 0.00 0.00 0.12 0.00 0.00 56.93 57.39 2dkp s PHE 99 Cb -0.02 0.01 -0.04 0.00 -0.57 0.00 0.00 43.02 42.39 2dkp s PHE 99 CO -0.00 -0.09 -0.05 0.00 -0.10 0.00 0.00 175.22 174.98 2dkp s THR 101 N -3.57 0.46 0.06 0.00 -4.23 -1.17 -3.99 115.64 103.21 2dkp s THR 101 Ca 0.07 -2.00 -0.16 0.00 -1.18 0.00 0.00 61.69 58.42 2dkp s THR 101 Cb 0.05 -2.27 -0.16 0.00 1.34 0.00 0.00 72.50 71.46 2dkp s THR 101 CO -0.07 0.00 1.28 0.44 -0.54 0.00 0.00 174.62 175.73 2dkp h ASP 102 N 1.72 0.70 -5.72 3.99 5.19 -1.93 -3.47 116.42 116.90 2dkp h ASP 102 Ca -0.33 -0.61 -0.34 0.00 -0.62 0.00 0.00 57.03 55.14 2dkp h ASP 102 Cb 1.28 -0.20 -0.14 0.00 0.18 0.00 0.00 39.33 40.44 2dkp h ASP 102 CO 0.53 1.18 -0.57 0.42 -3.12 0.00 0.00 179.24 177.68 2dkp s THR 103 N -3.83 0.00 0.37 0.35 -4.23 -1.26 -5.04 115.64 101.99 2dkp s THR 103 Ca -0.12 -2.00 0.06 0.00 -1.18 0.00 0.00 61.69 58.45 2dkp s THR 103 Cb 0.07 -2.50 0.30 0.00 1.34 0.00 0.00 72.50 71.70 2dkp s THR 103 CO 0.84 0.00 1.96 1.23 -0.54 0.00 0.00 174.62 178.10 2dkp h GLY 104 N 2.42 0.95 0.50 3.99 0.00 -1.91 -2.90 103.07 106.12 2dkp h GLY 104 Ca -0.31 -0.30 -0.02 0.00 0.00 0.00 0.00 47.33 46.70 2dkp h GLY 104 CO 0.46 0.21 -0.26 1.70 0.00 0.00 0.00 176.54 178.65 2dkp h LYS 105 N 0.73 -0.67 0.00 4.80 3.11 -1.98 0.12 116.57 122.68 2dkp h LYS 105 Ca 0.32 0.05 0.00 0.00 -2.81 0.00 0.00 60.65 58.20 2dkp h LYS 105 Cb 0.30 0.15 0.00 0.00 -1.00 0.00 0.00 32.23 31.68 2dkp h LYS 105 CO -0.11 -0.45 0.60 0.93 -2.81 0.00 0.00 179.45 177.62 2dkp h GLU 106 N -0.70 0.00 0.08 1.90 4.39 -1.95 0.35 114.58 118.65 2dkp h GLU 106 Ca -0.07 0.00 -0.26 0.00 0.34 0.00 0.00 59.36 59.37 2dkp h GLU 106 Cb 0.54 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.18 2dkp h GLU 106 CO 0.10 0.00 -1.39 1.98 -1.16 0.00 0.00 179.01 178.54 2dkp h MET 107 N 0.00 0.17 -0.89 2.33 1.85 -1.17 -3.31 114.93 113.90 2dkp h MET 107 Ca 0.00 -0.28 0.03 0.00 -0.61 0.00 0.00 59.70 58.84 2dkp h MET 107 Cb 1.21 0.11 -0.05 0.00 0.43 0.00 0.00 31.60 33.29 2dkp h MET 107 CO 0.00 1.14 0.59 1.05 -0.40 0.00 0.00 176.91 179.28 2dkp h GLU 108 N -0.47 1.09 -0.50 0.39 4.11 0.24 0.18 114.58 119.61 2dkp h GLU 108 Ca -0.32 -0.07 -0.02 0.00 0.07 0.00 0.00 59.36 59.02 2dkp h GLU 108 Cb 1.64 -0.25 -0.02 0.00 0.50 0.00 0.00 28.75 30.62 2dkp h GLU 108 CO -0.01 0.72 0.22 -0.07 0.07 0.00 0.00 179.01 179.93 2dkp h LEU 109 N 1.12 0.63 0.00 3.06 3.38 -1.47 -0.08 115.31 121.96 2dkp h LEU 109 Ca 0.35 -0.06 -0.01 0.00 0.09 0.00 0.00 57.88 58.25 2dkp h LEU 109 Cb 0.01 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 40.60 2dkp h LEU 109 CO -0.10 0.56 -0.04 -0.50 0.09 0.00 0.00 178.44 178.45 2dkp h TRP 110 N 0.70 0.00 0.30 1.13 4.06 -1.38 -3.32 115.95 117.44 2dkp h TRP 110 Ca 0.17 0.00 -0.01 0.00 2.06 0.00 0.00 58.89 61.11 2dkp h TRP 110 Cb 0.11 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.26 2dkp h TRP 110 CO 0.01 0.77 -0.25 0.52 -3.56 0.00 0.00 178.44 175.93 2dkp h MET 111 N -1.00 -0.52 -0.80 0.49 2.86 -0.64 0.29 114.93 115.61 2dkp h MET 111 Ca -0.01 0.04 0.32 0.00 -2.06 0.00 0.00 59.70 57.98 2dkp h MET 111 Cb 0.77 0.12 -0.12 0.00 0.06 0.00 0.00 31.60 32.42 2dkp h MET 111 CO -0.01 -0.34 0.46 1.63 1.06 0.00 0.00 176.91 179.71 2dkp n LYS 112 N -3.87 -0.04 0.06 1.72 4.76 -0.05 0.19 118.16 120.93 2dkp n LYS 112 Ca -0.06 0.99 -0.21 0.00 -2.87 0.00 0.00 58.31 56.15 2dkp n LYS 112 Cb 0.24 -1.82 -0.15 0.00 -1.84 0.00 0.00 35.03 31.47 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 1.39 -0.04 0.38 7.82 0.00 -1.52 -3.21 119.26 124.10 2dkp h ALA 113 Ca 0.63 -0.82 -0.01 0.00 0.00 0.00 0.00 54.91 54.70 2dkp h ALA 113 Cb 1.75 0.21 -0.00 0.00 0.00 0.00 0.00 17.79 19.75 2dkp h ALA 113 CO -0.51 0.54 -0.23 0.52 0.00 0.00 0.00 179.25 179.58 2dkp h MET 114 N -0.27 -0.56 -0.78 0.00 2.86 0.58 -2.25 114.93 114.52 2dkp h MET 114 Ca -0.20 0.04 0.17 0.00 -2.06 0.00 0.00 59.70 57.65 2dkp h MET 114 Cb 1.76 0.13 -0.05 0.00 0.06 0.00 0.00 31.60 33.50 2dkp h MET 114 CO 0.15 -0.37 0.52 -0.07 1.06 0.00 0.00 176.91 178.20 2dkp h LEU 115 N -0.58 0.33 -1.13 1.22 -0.00 -0.61 0.26 115.31 114.80 2dkp h LEU 115 Ca -0.04 0.02 -0.04 0.00 -0.00 0.00 0.00 57.88 57.82 2dkp h LEU 115 Cb 0.47 -0.04 -0.02 0.00 -0.00 0.00 0.00 40.66 41.07 2dkp h LEU 115 CO 0.05 0.16 0.12 -0.78 -0.00 0.00 0.00 178.44 177.99 2dkp h ASP 116 N 0.35 0.68 0.00 -0.43 3.58 -1.41 -1.13 116.42 118.06 2dkp h ASP 116 Ca 0.39 -0.11 -0.09 0.00 0.42 0.00 0.00 57.03 57.63 2dkp h ASP 116 Cb 1.00 -0.18 -0.01 0.00 1.72 0.00 0.00 39.33 41.86 2dkp h ASP 116 CO -0.11 0.67 -0.53 0.00 -2.88 0.00 0.00 179.24 176.39 2dkp h ALA 117 N 1.42 0.11 -0.30 -0.78 0.00 -0.47 -3.38 119.26 115.86 2dkp h ALA 117 Ca 0.16 -0.77 0.07 0.00 0.00 0.00 0.00 54.91 54.37 2dkp h ALA 117 Cb 0.27 0.32 -0.07 0.00 0.00 0.00 0.00 17.79 18.30 2dkp h ALA 117 CO -0.00 0.30 -0.19 0.00 0.00 0.00 0.00 179.25 179.36 2dkp h ALA 118 N -0.28 0.01 -1.56 0.00 0.00 -0.65 -0.20 119.26 116.58 2dkp h ALA 118 Ca -0.14 0.10 0.49 0.00 0.00 0.00 0.00 54.91 55.36 2dkp h ALA 118 Cb 1.06 0.43 -0.11 0.00 0.00 0.00 0.00 17.79 19.17 2dkp h ALA 118 CO -0.09 -0.59 1.06 1.37 0.00 0.00 0.00 179.25 181.00 2dkp h LEU 119 N -0.16 0.14 -9.13 0.00 8.10 -1.38 -3.40 115.31 109.48 2dkp h LEU 119 Ca 0.16 0.09 -0.71 0.00 0.11 0.00 0.00 57.88 57.53 2dkp h LEU 119 Cb 0.40 0.09 0.07 0.00 -0.44 0.00 0.00 40.66 40.78 2dkp h LEU 119 CO -0.40 -0.14 0.05 0.52 -4.11 0.00 0.00 178.44 174.36 2dkp n VAL 120 N -4.43 0.64 -2.57 0.15 0.31 -0.09 -4.87 118.33 107.47 2dkp n VAL 120 Ca 0.40 -0.16 -0.38 0.00 -0.01 0.00 0.00 64.34 64.19 2dkp n VAL 120 Cb 1.67 -0.33 0.01 0.00 -0.91 0.00 0.00 33.84 34.28 2dkp n VAL 120 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2dkp n GLN 121 N 1.59 4.62 -1.56 5.55 3.00 -1.26 -4.74 117.38 124.58 2dkp n GLN 121 Ca 0.18 -4.52 -0.31 0.00 -0.01 0.00 0.00 57.00 52.33 2dkp n GLN 121 Cb 0.17 -2.39 0.06 0.00 0.00 0.00 0.00 30.24 28.08 2dkp n GLN 121 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.06 174.69 2dkp n THR 122 N -0.18 3.26 -4.32 5.09 5.66 -1.26 -4.98 114.28 117.55 2dkp n THR 122 Ca 0.45 -3.37 -0.17 0.00 -3.05 0.00 0.00 64.05 57.92 2dkp n THR 122 Cb 0.29 -1.15 -0.10 0.00 -1.55 0.00 0.00 70.33 67.82 2dkp n THR 122 CO 0.00 0.00 0.00 -0.55 -3.05 0.00 0.00 175.07 171.47 2dkp s SER 123 N -2.43 1.26 0.00 1.09 0.15 -1.26 -4.99 113.70 107.52 2dkp s SER 123 Ca 0.60 -1.45 0.00 0.00 0.70 0.00 0.00 55.95 55.80 2dkp s SER 123 Cb 0.48 0.26 0.00 0.00 -1.71 0.00 0.00 66.02 65.05 2dkp s SER 123 CO 0.01 -0.80 0.00 0.61 1.20 0.00 0.00 173.24 174.26 2dkp n GLY 124 N -0.50 -1.63 1.71 9.45 0.00 -1.26 -4.98 105.19 107.98 2dkp n GLY 124 Ca 0.00 0.63 -0.03 0.00 0.00 0.00 0.00 46.02 46.62 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 1.10 -0.32 1.61 -0.04 -1.26 -4.59 135.00 131.49 2dkp n PRO 125 Ca 0.00 -0.24 0.12 0.00 -0.04 0.00 0.00 63.50 63.35 2dkp n PRO 125 Cb 0.00 -1.31 0.26 0.00 -0.04 0.00 0.00 33.50 32.41 2dkp n PRO 125 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2dkp h SER 126 N 1.96 -0.44 -3.95 3.54 4.64 -1.94 -3.41 113.55 113.97 2dkp h SER 126 Ca 0.05 0.26 -0.13 0.00 -0.47 0.00 0.00 61.79 61.49 2dkp h SER 126 Cb 0.98 0.45 -0.24 0.00 -0.31 0.00 0.00 62.40 63.28 2dkp h SER 126 CO 0.07 -0.31 -0.29 -0.55 -0.87 0.00 0.00 176.83 174.89 2dkp s SER 127 N -5.06 -0.37 0.00 4.97 0.15 -1.26 -4.52 113.70 107.60 2dkp s SER 127 Ca -0.13 0.69 0.28 0.00 0.70 0.00 0.00 55.95 57.49 2dkp s SER 127 Cb 0.27 0.71 1.13 0.00 -1.71 0.00 0.00 66.02 66.42 2dkp s SER 127 CO 0.77 -0.15 1.79 0.61 1.20 0.00 0.00 173.24 177.46