#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 2.21 0.18 1.61 0.15 -1.26 -5.04 113.70 111.55 2dkp s SER 2 Ca 0.00 -0.33 -0.24 0.00 0.70 0.00 0.00 55.95 56.08 2dkp s SER 2 Cb 0.00 -0.80 0.07 0.00 -1.71 0.00 0.00 66.02 63.59 2dkp s SER 2 CO 0.00 -0.14 1.57 -1.28 1.20 0.00 0.00 173.24 174.59 2dkp h SER 3 N 8.19 -1.36 -2.27 5.45 0.87 -2.12 -3.47 113.55 118.84 2dkp h SER 3 Ca -0.27 0.24 0.00 0.00 -1.23 0.00 0.00 61.79 60.52 2dkp h SER 3 Cb 1.13 0.64 0.00 0.00 -0.44 0.00 0.00 62.40 63.73 2dkp h SER 3 CO 0.39 -0.32 0.00 0.61 -0.53 0.00 0.00 176.83 176.97 2dkp n GLY 4 N -1.42 4.59 2.88 5.77 0.00 -1.26 -5.15 105.19 110.60 2dkp n GLY 4 Ca 0.03 -1.20 -0.13 0.00 0.00 0.00 0.00 46.02 44.72 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 0.14 0.12 1.61 0.15 -1.26 -5.16 113.70 109.30 2dkp s SER 5 Ca 0.00 -0.02 0.03 0.00 0.70 0.00 0.00 55.95 56.66 2dkp s SER 5 Cb 0.00 -0.03 -0.04 0.00 -1.71 0.00 0.00 66.02 64.24 2dkp s SER 5 CO 0.00 0.00 -0.08 -0.44 1.20 0.00 0.00 173.24 173.92 2dkp s SER 6 N 0.07 1.45 0.00 5.45 0.01 -1.26 -5.12 113.70 114.30 2dkp s SER 6 Ca -0.00 -1.01 0.00 0.00 1.31 0.00 0.00 55.95 56.25 2dkp s SER 6 Cb -0.02 0.04 0.00 0.00 0.21 0.00 0.00 66.02 66.26 2dkp s SER 6 CO -0.00 -0.40 0.00 0.61 0.41 0.00 0.00 173.24 173.86 2dkp n GLY 7 N -0.12 1.54 3.62 3.44 0.00 -1.26 -5.18 105.19 107.23 2dkp n GLY 7 Ca -0.11 -0.32 -0.26 0.00 0.00 0.00 0.00 46.02 45.32 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 1.93 1.99 -0.31 1.61 -0.14 -1.26 -5.10 119.74 118.46 2dkp s LYS 8 Ca 0.00 -1.94 -0.25 0.00 -1.36 0.00 0.00 55.97 52.42 2dkp s LYS 8 Cb 0.00 -1.78 0.01 0.00 -1.68 0.00 0.00 37.83 34.38 2dkp s LYS 8 CO 0.00 0.03 0.87 0.50 -0.76 0.00 0.00 175.35 176.00 2dkp s ARG 9 N -3.71 3.98 0.30 1.68 3.00 -1.26 -5.03 118.95 117.90 2dkp s ARG 9 Ca 0.35 0.71 0.07 0.00 -1.00 0.00 0.00 55.73 55.86 2dkp s ARG 9 Cb 0.05 -3.74 -0.03 0.00 0.00 0.00 0.00 34.95 31.23 2dkp s ARG 9 CO 0.19 -0.76 0.30 -1.54 0.00 0.00 0.00 175.30 173.49 2dkp s SER 10 N 1.64 5.54 -0.13 -2.12 1.04 -1.26 -5.08 113.70 113.33 2dkp s SER 10 Ca 0.36 -0.34 -0.13 0.00 0.48 0.00 0.00 55.95 56.32 2dkp s SER 10 Cb -0.13 -1.20 -0.04 0.00 0.10 0.00 0.00 66.02 64.74 2dkp s SER 10 CO 0.14 -0.26 -0.25 -3.20 0.98 0.00 0.00 173.24 170.65 2dkp n ASN 11 N -1.36 1.47 -3.56 7.02 5.15 -1.26 -5.01 115.26 117.70 2dkp n ASN 11 Ca -0.04 0.28 -0.30 0.00 -0.60 0.00 0.00 54.58 53.93 2dkp n ASN 11 Cb 0.59 -0.69 0.28 0.00 -0.53 0.00 0.00 39.78 39.43 2dkp n ASN 11 CO 0.00 0.00 0.00 -1.20 1.40 0.00 0.00 177.26 177.46 2dkp n SER 12 N -4.00 -3.59 -4.41 1.20 7.64 -1.26 -5.04 113.62 104.16 2dkp n SER 12 Ca -0.10 -0.69 -0.30 0.00 1.01 0.00 0.00 58.87 58.79 2dkp n SER 12 Cb 0.38 -1.06 -0.13 0.00 -1.01 0.00 0.00 64.21 62.39 2dkp n SER 12 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 2dkp s ILE 13 N -2.18 2.49 -0.10 0.44 1.01 -1.26 -5.13 121.20 116.47 2dkp s ILE 13 Ca 0.67 -1.42 0.04 0.00 0.00 0.00 0.00 60.65 59.93 2dkp s ILE 13 Cb -0.15 -2.05 0.00 0.00 0.01 0.00 0.00 42.46 40.27 2dkp s ILE 13 CO 0.58 0.26 -0.23 -0.75 0.00 0.00 0.00 174.94 174.80 2dkp s LYS 14 N -1.62 2.89 -0.46 2.79 2.36 -1.26 -5.00 119.74 119.44 2dkp s LYS 14 Ca 0.14 -0.82 -0.20 0.00 -2.55 0.00 0.00 55.97 52.54 2dkp s LYS 14 Cb -0.10 -2.20 0.03 0.00 -1.05 0.00 0.00 37.83 34.51 2dkp s LYS 14 CO 0.05 0.15 0.60 0.50 1.55 0.00 0.00 175.35 178.21 2dkp s ARG 15 N 0.40 3.19 -0.24 4.03 3.52 -1.26 -4.97 118.95 123.63 2dkp s ARG 15 Ca -0.18 -0.60 -0.29 0.00 -0.13 0.00 0.00 55.73 54.53 2dkp s ARG 15 Cb -0.18 -4.00 -0.06 0.00 -1.56 0.00 0.00 34.95 29.15 2dkp s ARG 15 CO 0.08 -1.05 2.22 -1.71 -0.81 0.00 0.00 175.30 174.03 2dkp n ASN 16 N 6.13 3.09 -0.12 -2.12 5.15 -1.26 -4.86 115.26 121.26 2dkp n ASN 16 Ca -0.04 0.24 -0.09 0.00 -0.60 0.00 0.00 54.58 54.09 2dkp n ASN 16 Cb 0.47 -1.51 -0.03 0.00 -0.53 0.00 0.00 39.78 38.18 2dkp n ASN 16 CO 0.00 0.00 0.00 -0.65 1.40 0.00 0.00 177.26 178.01 2dkp h PRO 17 N 14.62 -0.29 -0.97 1.20 0.11 -2.05 -0.28 132.00 144.35 2dkp h PRO 17 Ca -0.39 0.02 0.26 0.00 0.11 0.00 0.00 66.00 66.00 2dkp h PRO 17 Cb 1.25 0.07 -0.13 0.00 0.11 0.00 0.00 31.00 32.30 2dkp h PRO 17 CO 0.97 -0.19 0.50 -0.91 -0.21 0.00 0.00 178.00 178.16 2dkp h ASN 18 N -0.30 0.48 -0.84 -2.05 4.21 -2.05 -3.43 115.58 111.60 2dkp h ASN 18 Ca 0.15 0.16 -0.46 0.00 1.21 0.00 0.00 56.30 57.37 2dkp h ASN 18 Cb 0.57 0.11 0.09 0.00 -1.12 0.00 0.00 38.32 37.96 2dkp h ASN 18 CO -0.56 -0.02 -0.46 0.00 -1.29 0.00 0.00 177.43 175.11 2dkp n ALA 19 N -2.39 -2.37 -2.61 -0.83 0.00 -0.12 -4.81 120.51 107.38 2dkp n ALA 19 Ca 0.27 0.24 -0.43 0.00 0.00 0.00 0.00 53.44 53.51 2dkp n ALA 19 Cb 0.79 -1.09 -0.02 0.00 0.00 0.00 0.00 19.45 19.12 2dkp n ALA 19 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2dkp s PRO 20 N -0.70 4.26 -0.24 0.00 0.04 -1.26 -4.97 135.00 132.13 2dkp s PRO 20 Ca 0.44 1.42 -0.29 0.00 0.04 0.00 0.00 61.00 62.60 2dkp s PRO 20 Cb -0.58 -3.66 0.00 0.00 0.04 0.00 0.00 34.50 30.30 2dkp s PRO 20 CO 0.40 -0.64 1.13 0.08 0.04 0.00 0.00 177.00 178.01 2dkp s VAL 21 N 3.24 4.49 -0.03 -0.36 1.01 -1.26 -4.40 120.40 123.09 2dkp s VAL 21 Ca 0.46 1.78 -0.25 0.00 0.00 0.00 0.00 61.98 63.97 2dkp s VAL 21 Cb -0.16 -4.24 -0.19 0.00 0.00 0.00 0.00 36.38 31.79 2dkp s VAL 21 CO 0.08 -0.26 1.19 0.58 0.00 0.00 0.00 175.10 176.69 2dkp h VAL 22 N 5.57 1.23 -1.91 2.92 2.07 -1.08 -3.47 116.25 121.59 2dkp h VAL 22 Ca -0.22 -1.11 0.04 0.00 0.82 0.00 0.00 66.70 66.23 2dkp h VAL 22 Cb 1.07 1.94 -0.22 0.00 -1.52 0.00 0.00 31.29 32.57 2dkp h VAL 22 CO 0.99 0.27 0.10 -0.60 0.02 0.00 0.00 177.57 178.35 2dkp s ARG 23 N -4.13 0.65 -0.14 1.57 3.52 -1.22 -5.01 118.95 114.19 2dkp s ARG 23 Ca -0.15 1.11 -0.01 0.00 -0.13 0.00 0.00 55.73 56.55 2dkp s ARG 23 Cb 0.01 0.13 0.03 0.00 -1.56 0.00 0.00 34.95 33.57 2dkp s ARG 23 CO 0.63 -0.13 -0.06 -0.98 -0.81 0.00 0.00 175.30 173.94 2dkp s ARG 24 N 1.55 1.44 0.04 5.12 1.70 -1.26 -0.47 118.95 127.07 2dkp s ARG 24 Ca -0.10 -0.38 -0.25 0.00 -0.47 0.00 0.00 55.73 54.53 2dkp s ARG 24 Cb -0.05 -1.79 0.06 0.00 -0.57 0.00 0.00 34.95 32.60 2dkp s ARG 24 CO -0.18 -0.36 0.59 0.20 -1.08 0.00 0.00 175.30 174.47 2dkp s GLY 25 N 1.68 -0.52 -0.59 3.88 0.00 -1.08 -5.00 107.32 105.68 2dkp s GLY 25 Ca 0.03 0.80 -0.26 0.00 0.00 0.00 0.00 44.72 45.29 2dkp s GLY 25 CO -0.08 0.48 2.26 -0.98 0.00 0.00 0.00 173.10 174.78 2dkp s TRP 26 N -2.35 1.26 0.39 1.90 0.52 -1.26 -2.86 118.94 116.54 2dkp s TRP 26 Ca -0.06 1.41 0.01 0.00 0.02 0.00 0.00 56.10 57.48 2dkp s TRP 26 Cb -0.01 -3.70 -0.02 0.00 -1.15 0.00 0.00 33.47 28.60 2dkp s TRP 26 CO -0.01 -2.27 0.59 -1.17 0.02 0.00 0.00 176.95 174.12 2dkp s LEU 27 N 11.82 3.87 -0.22 2.99 2.96 -0.68 -4.83 118.68 134.59 2dkp s LEU 27 Ca 0.88 0.35 -0.04 0.00 -0.22 0.00 0.00 54.13 55.09 2dkp s LEU 27 Cb -0.15 -3.22 -0.02 0.00 0.50 0.00 0.00 46.19 43.31 2dkp s LEU 27 CO 0.20 -0.46 -0.02 -0.31 -1.32 0.00 0.00 176.35 174.44 2dkp s TYR 28 N -2.40 2.99 0.11 5.38 2.02 -1.26 -2.52 117.35 121.67 2dkp s TYR 28 Ca 0.44 -0.73 0.05 0.00 -0.37 0.00 0.00 57.07 56.45 2dkp s TYR 28 Cb -0.10 -2.11 -0.04 0.00 -0.40 0.00 0.00 41.96 39.32 2dkp s TYR 28 CO 0.36 -0.43 0.02 0.21 -1.57 0.00 0.00 175.55 174.15 2dkp s LYS 29 N 1.33 2.59 0.27 -0.62 2.20 -0.99 -3.30 119.74 121.21 2dkp s LYS 29 Ca 0.04 -0.88 0.08 0.00 -0.36 0.00 0.00 55.97 54.85 2dkp s LYS 29 Cb -0.14 -2.53 -0.04 0.00 -1.51 0.00 0.00 37.83 33.60 2dkp s LYS 29 CO -0.01 0.52 0.14 -1.14 -0.36 0.00 0.00 175.35 174.50 2dkp s GLN 30 N -2.54 2.71 -0.42 4.03 0.74 -0.58 -1.31 119.66 122.30 2dkp s GLN 30 Ca 0.27 -1.20 0.02 0.00 0.05 0.00 0.00 55.36 54.50 2dkp s GLN 30 Cb -0.11 -2.42 0.14 0.00 1.10 0.00 0.00 33.01 31.71 2dkp s GLN 30 CO 0.19 0.36 0.24 -0.51 -0.55 0.00 0.00 175.29 175.02 2dkp s ASP 31 N -3.80 3.37 0.21 6.67 1.11 -1.18 -4.60 116.67 118.44 2dkp s ASP 31 Ca 0.33 -2.54 -0.05 0.00 0.18 0.00 0.00 52.55 50.47 2dkp s ASP 31 Cb -0.07 -0.83 0.36 0.00 1.07 0.00 0.00 42.92 43.46 2dkp s ASP 31 CO 0.23 -0.27 1.16 -1.20 1.18 0.00 0.00 175.17 176.28 2dkp n SER 32 N 3.63 -0.25 -3.99 0.27 7.64 -1.26 -4.41 113.62 115.25 2dkp n SER 32 Ca 0.11 1.28 -0.57 0.00 1.01 0.00 0.00 58.87 60.70 2dkp n SER 32 Cb 0.36 -0.39 -0.09 0.00 -1.01 0.00 0.00 64.21 63.08 2dkp n SER 32 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 2dkp n THR 33 N -5.20 0.00 0.00 0.44 -2.24 -1.26 -4.08 114.28 101.95 2dkp n THR 33 Ca 0.12 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.90 2dkp n THR 33 Cb 0.39 -0.43 0.00 0.00 -2.10 0.00 0.00 70.33 68.19 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 3.72 2.93 3.73 3.38 0.00 -1.26 -4.66 105.19 113.02 2dkp n GLY 34 Ca 0.29 -0.10 -0.38 0.00 0.00 0.00 0.00 46.02 45.83 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 4.31 -1.16 1.61 -1.94 -1.26 -4.99 119.30 115.87 2dkp s MET 35 Ca 0.00 0.39 -0.22 0.00 -1.71 0.00 0.00 55.69 54.15 2dkp s MET 35 Cb 0.00 -3.42 -0.03 0.00 2.01 0.00 0.00 34.83 33.38 2dkp s MET 35 CO 0.00 0.20 1.86 0.15 -0.01 0.00 0.00 175.02 177.21 2dkp s LYS 36 N 0.51 2.94 0.41 2.03 3.01 -1.26 -4.72 119.74 122.66 2dkp s LYS 36 Ca 0.24 -1.24 0.07 0.00 -1.01 0.00 0.00 55.97 54.04 2dkp s LYS 36 Cb -0.15 -5.30 -0.04 0.00 -1.01 0.00 0.00 37.83 31.33 2dkp s LYS 36 CO 0.09 -3.36 0.25 -0.51 0.51 0.00 0.00 175.35 172.33 2dkp s LEU 37 N 8.83 3.22 0.32 3.17 1.43 -1.26 -4.93 118.68 129.46 2dkp s LEU 37 Ca 0.64 -0.95 0.07 0.00 -1.03 0.00 0.00 54.13 52.86 2dkp s LEU 37 Cb -0.00 -1.67 -0.02 0.00 0.03 0.00 0.00 46.19 44.52 2dkp s LEU 37 CO 0.08 -0.57 0.33 0.26 0.23 0.00 0.00 176.35 176.68 2dkp s TRP 38 N -2.55 3.01 -0.09 0.29 0.52 -1.26 -3.13 118.94 115.73 2dkp s TRP 38 Ca 0.43 -0.24 -0.09 0.00 0.02 0.00 0.00 56.10 56.22 2dkp s TRP 38 Cb 0.01 -1.79 0.03 0.00 -1.15 0.00 0.00 33.47 30.57 2dkp s TRP 38 CO 0.24 0.19 0.26 0.15 0.02 0.00 0.00 176.95 177.82 2dkp s LYS 39 N -4.02 0.32 -0.04 4.98 -0.14 -0.42 -4.94 119.74 115.48 2dkp s LYS 39 Ca 0.41 0.34 -0.26 0.00 -1.36 0.00 0.00 55.97 55.09 2dkp s LYS 39 Cb -0.07 0.16 -0.03 0.00 -1.68 0.00 0.00 37.83 36.20 2dkp s LYS 39 CO 0.28 -0.04 0.82 0.21 -0.76 0.00 0.00 175.35 175.85 2dkp s LYS 40 N 0.06 4.49 0.02 1.68 2.47 -1.26 -2.34 119.74 124.87 2dkp s LYS 40 Ca -0.01 1.11 -0.22 0.00 -1.56 0.00 0.00 55.97 55.29 2dkp s LYS 40 Cb -0.02 -3.45 0.05 0.00 -1.46 0.00 0.00 37.83 32.95 2dkp s LYS 40 CO 0.01 0.02 0.50 0.50 0.16 0.00 0.00 175.35 176.53 2dkp s ARG 41 N 0.88 0.97 -0.50 4.03 6.06 -1.05 -5.03 118.95 124.32 2dkp s ARG 41 Ca 0.44 -0.18 -0.26 0.00 -2.50 0.00 0.00 55.73 53.23 2dkp s ARG 41 Cb -0.19 0.44 0.03 0.00 0.06 0.00 0.00 34.95 35.29 2dkp s ARG 41 CO 0.22 -0.33 0.98 -0.46 -2.50 0.00 0.00 175.30 173.21 2dkp s TRP 42 N -2.12 2.84 0.32 5.12 -0.00 -1.25 -1.68 118.94 122.17 2dkp s TRP 42 Ca -0.07 0.30 0.07 0.00 -0.00 0.00 0.00 56.10 56.40 2dkp s TRP 42 Cb -0.01 -4.10 -0.02 0.00 -0.00 0.00 0.00 33.47 29.34 2dkp s TRP 42 CO 0.01 -1.24 0.39 -0.06 -0.00 0.00 0.00 176.95 176.05 2dkp s PHE 43 N 3.99 3.10 -0.24 5.86 0.40 -1.13 -2.64 117.98 127.33 2dkp s PHE 43 Ca 0.37 -0.21 -0.13 0.00 -0.60 0.00 0.00 56.93 56.36 2dkp s PHE 43 Cb -0.10 -1.85 0.08 0.00 0.51 0.00 0.00 43.02 41.65 2dkp s PHE 43 CO 0.25 0.13 0.57 0.08 0.70 0.00 0.00 175.22 176.95 2dkp s VAL 44 N -2.18 -0.10 -0.59 -0.44 1.01 -0.55 -2.65 120.40 114.90 2dkp s VAL 44 Ca 0.42 0.04 -0.16 0.00 0.00 0.00 0.00 61.98 62.28 2dkp s VAL 44 Cb -0.08 -0.84 0.14 0.00 0.00 0.00 0.00 36.38 35.60 2dkp s VAL 44 CO 0.29 0.02 0.55 -0.22 0.00 0.00 0.00 175.10 175.74 2dkp s LEU 45 N 1.67 6.22 0.06 3.92 1.98 0.38 -2.53 118.68 130.39 2dkp s LEU 45 Ca -0.09 -1.90 0.01 0.00 -2.89 0.00 0.00 54.13 49.26 2dkp s LEU 45 Cb -0.07 -2.22 -0.03 0.00 0.66 0.00 0.00 46.19 44.53 2dkp s LEU 45 CO -0.17 -0.83 -0.06 -0.94 -1.89 0.00 0.00 176.35 172.46 2dkp s SER 46 N 3.39 0.82 -1.57 3.68 1.04 -1.12 -0.35 113.70 119.59 2dkp s SER 46 Ca 0.06 -0.83 -0.02 0.00 0.48 0.00 0.00 55.95 55.64 2dkp s SER 46 Cb -0.27 0.10 0.02 0.00 0.10 0.00 0.00 66.02 65.98 2dkp s SER 46 CO 0.01 -0.41 0.10 -0.67 0.98 0.00 0.00 173.24 173.25 2dkp n ASP 47 N 0.57 0.56 -4.32 7.02 2.03 -1.26 0.12 116.55 121.27 2dkp n ASP 47 Ca -0.17 -1.25 -0.32 0.00 0.52 0.00 0.00 54.79 53.57 2dkp n ASP 47 Cb 0.59 -1.72 -0.09 0.00 -0.72 0.00 0.00 41.12 39.17 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 -4.53 -1.04 -3.99 -2.67 4.77 -1.26 -4.90 117.00 103.38 2dkp n LEU 48 Ca -0.28 -1.25 -0.09 0.00 -0.03 0.00 0.00 56.01 54.35 2dkp n LEU 48 Cb 0.67 -1.64 -0.05 0.00 -2.33 0.00 0.00 43.42 40.07 2dkp n LEU 48 CO 0.85 0.42 0.18 0.00 -1.33 0.00 0.00 177.39 177.51 2dkp s LEU 50 N -3.01 3.12 -0.03 0.00 1.43 0.36 -2.78 118.68 117.77 2dkp s LEU 50 Ca 0.22 -0.17 0.00 0.00 -1.03 0.00 0.00 54.13 53.16 2dkp s LEU 50 Cb -0.01 -1.74 0.03 0.00 0.03 0.00 0.00 46.19 44.50 2dkp s LEU 50 CO 0.08 0.18 0.00 -0.36 0.23 0.00 0.00 176.35 176.49 2dkp s PHE 51 N 0.27 0.31 0.23 0.29 0.08 -1.05 -0.63 117.98 117.49 2dkp s PHE 51 Ca -0.05 -0.00 0.07 0.00 0.12 0.00 0.00 56.93 57.07 2dkp s PHE 51 Cb -0.14 -0.41 -0.05 0.00 -0.57 0.00 0.00 43.02 41.85 2dkp s PHE 51 CO 0.04 -0.13 -0.10 1.52 -0.10 0.00 0.00 175.22 176.44 2dkp s TYR 52 N 1.02 1.78 0.01 0.36 -0.85 -1.25 -1.48 117.35 116.95 2dkp s TYR 52 Ca -0.10 -0.64 -0.11 0.00 -0.52 0.00 0.00 57.07 55.70 2dkp s TYR 52 Cb -0.14 -0.91 0.01 0.00 0.38 0.00 0.00 41.96 41.30 2dkp s TYR 52 CO -0.02 0.30 0.24 0.71 -1.52 0.00 0.00 175.55 175.26 2dkp s TYR 53 N -3.02 -0.05 0.29 -3.49 1.51 -1.08 -3.12 117.35 108.39 2dkp s TYR 53 Ca 0.25 -0.03 0.01 0.00 -1.01 0.00 0.00 57.07 56.30 2dkp s TYR 53 Cb 0.01 0.03 0.71 0.00 -0.11 0.00 0.00 41.96 42.60 2dkp s TYR 53 CO 0.09 -0.40 1.49 0.54 -1.11 0.00 0.00 175.55 176.15 2dkp n ARG 54 N 1.03 -0.08 -3.84 -0.62 1.74 -1.26 -3.94 116.66 109.69 2dkp n ARG 54 Ca -0.21 1.42 -0.15 0.00 -0.77 0.00 0.00 57.85 58.14 2dkp n ARG 54 Cb 0.57 -2.26 -0.05 0.00 -1.02 0.00 0.00 32.46 29.70 2dkp n ARG 54 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 2dkp n ASP 55 N -5.42 -0.83 0.12 0.55 8.00 -1.26 -4.73 116.55 112.98 2dkp n ASP 55 Ca 0.22 -2.81 0.10 0.00 0.71 0.00 0.00 54.79 53.01 2dkp n ASP 55 Cb 0.72 1.74 0.48 0.00 -0.02 0.00 0.00 41.12 44.04 2dkp n ASP 55 CO 0.00 0.00 0.00 -1.84 -0.39 0.00 0.00 177.20 174.97 2dkp n GLU 56 N -0.53 0.14 0.21 -1.24 0.00 -1.26 -2.09 120.64 115.88 2dkp n GLU 56 Ca 0.04 0.50 0.05 0.00 0.00 0.00 0.00 57.16 57.76 2dkp n GLU 56 Cb 0.52 -1.85 0.51 0.00 0.00 0.00 0.00 31.44 30.62 2dkp n GLU 56 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.13 178.00 2dkp h LYS 57 N 0.00 0.04 -5.94 3.44 1.79 -1.95 -3.46 116.57 110.49 2dkp h LYS 57 Ca 0.00 -0.01 -0.40 0.00 -2.18 0.00 0.00 60.65 58.06 2dkp h LYS 57 Cb 0.18 -0.01 0.09 0.00 -1.58 0.00 0.00 32.23 30.92 2dkp h LYS 57 CO 0.00 0.18 -0.75 0.39 -1.08 0.00 0.00 179.45 178.19 2dkp n GLU 58 N -4.36 -6.55 -0.12 3.15 1.02 -0.89 -4.90 120.64 107.99 2dkp n GLU 58 Ca -0.02 0.75 -0.09 0.00 -0.02 0.00 0.00 57.16 57.77 2dkp n GLU 58 Cb 0.22 -5.67 -0.01 0.00 -0.02 0.00 0.00 31.44 25.96 2dkp n GLU 58 CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 2dkp h GLU 59 N -2.22 0.56 -1.85 3.49 4.39 -1.90 -3.44 114.58 113.61 2dkp h GLU 59 Ca -0.58 -0.10 0.07 0.00 0.34 0.00 0.00 59.36 59.09 2dkp h GLU 59 Cb 1.36 -0.09 -0.21 0.00 -0.10 0.00 0.00 28.75 29.71 2dkp h GLU 59 CO 0.57 0.53 -0.17 0.20 -1.16 0.00 0.00 179.01 178.97 2dkp s GLY 60 N -2.89 -0.75 0.02 -3.84 0.00 -1.26 -5.13 107.32 93.47 2dkp s GLY 60 Ca -0.13 2.19 -0.35 0.00 0.00 0.00 0.00 44.72 46.43 2dkp s GLY 60 CO 0.75 3.08 1.67 1.39 0.00 0.00 0.00 173.10 179.99 2dkp n ILE 61 N 5.44 0.24 0.14 0.90 5.41 -1.26 -4.56 119.36 125.66 2dkp n ILE 61 Ca -0.10 -0.04 0.05 0.00 1.00 0.00 0.00 62.75 63.66 2dkp n ILE 61 Cb 0.49 -1.53 0.04 0.00 -0.71 0.00 0.00 39.64 37.94 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 7.03 0.00 0.00 1.39 3.38 -1.93 -3.48 115.31 121.69 2dkp h LEU 62 Ca -0.47 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.50 2dkp h LEU 62 Cb 1.28 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.03 2dkp h LEU 62 CO 0.90 0.37 0.00 0.61 0.09 0.00 0.00 178.44 180.41 2dkp n GLY 63 N 1.21 1.65 3.77 0.83 0.00 -1.26 -5.11 105.19 106.28 2dkp n GLY 63 Ca 0.01 -0.08 -0.29 0.00 0.00 0.00 0.00 46.02 45.66 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 5.47 -0.11 1.61 1.04 -1.26 -3.77 113.70 116.68 2dkp s SER 64 Ca 0.00 -0.06 0.01 0.00 0.48 0.00 0.00 55.95 56.38 2dkp s SER 64 Cb 0.00 -1.44 0.02 0.00 0.10 0.00 0.00 66.02 64.70 2dkp s SER 64 CO 0.00 0.15 -0.12 -0.63 0.98 0.00 0.00 173.24 173.62 2dkp s ILE 65 N -1.46 1.30 -0.47 -1.02 1.01 0.20 -5.00 121.20 115.76 2dkp s ILE 65 Ca 0.29 -0.50 -0.28 0.00 0.00 0.00 0.00 60.65 60.17 2dkp s ILE 65 Cb -0.12 -1.24 0.03 0.00 0.01 0.00 0.00 42.46 41.15 2dkp s ILE 65 CO 0.22 0.41 1.08 -0.76 0.00 0.00 0.00 174.94 175.88 2dkp s LEU 66 N 1.30 3.75 0.10 2.97 2.01 -1.26 -0.49 118.68 127.06 2dkp s LEU 66 Ca -0.01 0.37 -0.15 0.00 0.01 0.00 0.00 54.13 54.35 2dkp s LEU 66 Cb -0.14 -3.45 -0.09 0.00 0.01 0.00 0.00 46.19 42.53 2dkp s LEU 66 CO -0.05 -1.19 1.42 -0.07 1.01 0.00 0.00 176.35 177.46 2dkp h LEU 67 N 11.02 0.74 -1.66 1.79 3.38 -1.78 -3.06 115.31 125.76 2dkp h LEU 67 Ca -0.23 -0.47 0.20 0.00 0.09 0.00 0.00 57.88 57.46 2dkp h LEU 67 Cb 1.06 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 41.58 2dkp h LEU 67 CO 1.10 1.07 0.75 -0.65 0.09 0.00 0.00 178.44 180.80 2dkp h PRO 68 N 0.44 0.00 0.00 1.13 0.11 0.36 0.87 132.00 134.90 2dkp h PRO 68 Ca 0.04 0.00 -0.11 0.00 0.11 0.00 0.00 66.00 66.05 2dkp h PRO 68 Cb 0.86 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.95 2dkp h PRO 68 CO 0.07 0.00 -1.43 0.43 -0.21 0.00 0.00 178.00 176.86 2dkp n SER 69 N -3.56 0.68 -4.87 -2.05 7.64 -1.16 -4.70 113.62 105.61 2dkp n SER 69 Ca 0.14 0.29 -0.31 0.00 1.01 0.00 0.00 58.87 60.00 2dkp n SER 69 Cb 0.99 0.55 -0.02 0.00 -1.01 0.00 0.00 64.21 64.72 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 -3.11 3.50 -0.29 1.43 0.08 0.30 -4.59 117.98 115.30 2dkp s PHE 70 Ca -0.03 1.22 0.03 0.00 0.12 0.00 0.00 56.93 58.26 2dkp s PHE 70 Cb 0.09 -2.60 0.08 0.00 -0.57 0.00 0.00 43.02 40.02 2dkp s PHE 70 CO 0.82 -0.33 -0.04 -1.14 -0.10 0.00 0.00 175.22 174.43 2dkp s GLN 71 N -4.27 1.95 -0.31 0.44 0.74 -0.13 -4.76 119.66 113.32 2dkp s GLN 71 Ca 0.54 -1.56 -0.29 0.00 0.05 0.00 0.00 55.36 54.11 2dkp s GLN 71 Cb -0.10 -3.03 0.02 0.00 1.10 0.00 0.00 33.01 31.00 2dkp s GLN 71 CO 0.37 -0.72 1.06 0.42 -0.55 0.00 0.00 175.29 175.87 2dkp s ILE 72 N 1.03 4.53 -0.08 -2.34 -1.09 -1.26 -2.31 121.20 119.68 2dkp s ILE 72 Ca -0.01 1.74 -0.09 0.00 -2.23 0.00 0.00 60.65 60.06 2dkp s ILE 72 Cb -0.20 -4.40 0.02 0.00 -1.58 0.00 0.00 42.46 36.31 2dkp s ILE 72 CO -0.06 -0.45 0.25 0.00 -1.23 0.00 0.00 174.94 173.44 2dkp s ALA 73 N 3.59 -0.61 0.25 9.38 0.00 -1.02 -5.03 121.76 128.34 2dkp s ALA 73 Ca 0.45 0.60 -0.31 0.00 0.00 0.00 0.00 51.96 52.70 2dkp s ALA 73 Cb -0.12 -0.33 -0.12 0.00 0.00 0.00 0.00 23.12 22.54 2dkp s ALA 73 CO 0.15 -0.14 1.57 1.28 0.00 0.00 0.00 175.76 178.62 2dkp n LEU 74 N 2.68 3.86 -4.16 0.00 7.99 -1.26 -2.97 117.00 123.15 2dkp n LEU 74 Ca -0.14 1.13 -0.35 0.00 -0.01 0.00 0.00 56.01 56.63 2dkp n LEU 74 Cb 0.58 -1.53 0.09 0.00 -0.11 0.00 0.00 43.42 42.44 2dkp n LEU 74 CO 0.19 -0.05 -1.10 0.18 -1.51 0.00 0.00 177.39 175.10 2dkp n LEU 75 N 2.58 -3.00 -4.38 2.23 4.77 -1.26 -4.91 117.00 113.04 2dkp n LEU 75 Ca 0.11 0.08 -0.20 0.00 -0.03 0.00 0.00 56.01 55.97 2dkp n LEU 75 Cb 0.34 -0.83 -0.10 0.00 -2.33 0.00 0.00 43.42 40.50 2dkp n LEU 75 CO 0.64 -3.76 -0.44 0.28 -1.33 0.00 0.00 177.39 172.77 2dkp s THR 76 N -2.14 1.87 0.23 -5.08 -1.32 -1.26 -5.01 115.64 102.94 2dkp s THR 76 Ca 0.47 -2.24 0.01 0.00 -1.21 0.00 0.00 61.69 58.71 2dkp s THR 76 Cb -0.09 -2.12 0.33 0.00 -1.51 0.00 0.00 72.50 69.11 2dkp s THR 76 CO 0.70 -0.54 1.19 -1.54 -2.21 0.00 0.00 174.62 172.23 2dkp n SER 77 N -0.44 -0.11 -0.21 8.08 3.41 -1.26 0.11 113.62 123.20 2dkp n SER 77 Ca -0.07 1.30 -0.02 0.00 -0.26 0.00 0.00 58.87 59.81 2dkp n SER 77 Cb 0.60 -0.46 0.04 0.00 -0.26 0.00 0.00 64.21 64.13 2dkp n SER 77 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 2dkp h GLU 78 N 0.00 -0.07 -5.68 4.33 5.08 -2.03 -3.26 114.58 112.95 2dkp h GLU 78 Ca 0.45 0.01 -0.37 0.00 -1.00 0.00 0.00 59.36 58.45 2dkp h GLU 78 Cb 0.91 0.02 -0.05 0.00 0.50 0.00 0.00 28.75 30.13 2dkp h GLU 78 CO -0.73 -0.05 1.04 -0.51 -1.00 0.00 0.00 179.01 177.77 2dkp s ASP 79 N -5.20 5.37 -1.27 1.42 1.01 0.31 -4.88 116.67 113.43 2dkp s ASP 79 Ca -0.14 -1.25 -0.16 0.00 0.71 0.00 0.00 52.55 51.71 2dkp s ASP 79 Cb 0.18 -2.57 0.11 0.00 1.01 0.00 0.00 42.92 41.65 2dkp s ASP 79 CO 0.72 -2.62 1.64 1.41 0.21 0.00 0.00 175.17 176.53 2dkp n HIS 80 N 13.19 4.70 -4.03 4.23 8.25 -1.23 -4.68 115.22 135.65 2dkp n HIS 80 Ca 0.42 -3.05 -0.30 0.00 -0.26 0.00 0.00 57.72 54.53 2dkp n HIS 80 Cb 0.47 -2.44 -0.06 0.00 1.12 0.00 0.00 29.99 29.09 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 3.02 4.71 -0.05 1.59 1.01 -1.26 -5.04 121.20 125.17 2dkp s ILE 81 Ca 0.49 -0.74 -0.21 0.00 0.00 0.00 0.00 60.65 60.18 2dkp s ILE 81 Cb 0.02 -3.30 -0.31 0.00 0.01 0.00 0.00 42.46 38.88 2dkp s ILE 81 CO 0.04 0.09 0.86 0.78 0.00 0.00 0.00 174.94 176.71 2dkp h ASN 82 N 3.09 0.46 -2.97 3.58 -0.26 -2.02 -3.46 115.58 114.00 2dkp h ASN 82 Ca -0.47 -0.94 -0.58 0.00 -0.56 0.00 0.00 56.30 53.75 2dkp h ASN 82 Cb 1.17 -0.15 0.12 0.00 -1.06 0.00 0.00 38.32 38.40 2dkp h ASN 82 CO 0.67 1.42 0.27 0.54 -1.06 0.00 0.00 177.43 179.27 2dkp n ARG 83 N -4.11 1.60 -3.88 0.81 5.12 -1.26 -4.99 116.66 109.95 2dkp n ARG 83 Ca -0.15 0.57 -0.21 0.00 -1.93 0.00 0.00 57.85 56.13 2dkp n ARG 83 Cb 0.83 -2.08 -0.03 0.00 -1.16 0.00 0.00 32.46 30.03 2dkp n ARG 83 CO 0.00 0.00 0.00 0.15 -1.93 0.00 0.00 177.63 175.85 2dkp s LYS 84 N -1.84 3.14 -1.43 5.56 1.02 -1.26 -4.51 119.74 120.41 2dkp s LYS 84 Ca 0.59 -0.97 -0.11 0.00 0.02 0.00 0.00 55.97 55.51 2dkp s LYS 84 Cb -0.60 -2.73 0.04 0.00 -0.52 0.00 0.00 37.83 34.02 2dkp s LYS 84 CO 0.59 0.30 1.10 0.66 -0.92 0.00 0.00 175.35 177.09 2dkp n TYR 85 N -1.39 -2.66 -4.30 3.18 4.01 -1.26 -4.51 117.16 110.24 2dkp n TYR 85 Ca -0.06 0.97 -0.31 0.00 -0.16 0.00 0.00 57.90 58.34 2dkp n TYR 85 Cb 0.58 -4.62 -0.10 0.00 -0.31 0.00 0.00 39.34 34.89 2dkp n TYR 85 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2dkp s ALA 86 N -3.31 3.07 0.31 -0.72 0.00 -1.26 -4.02 121.76 115.83 2dkp s ALA 86 Ca 0.62 -1.12 0.03 0.00 0.00 0.00 0.00 51.96 51.48 2dkp s ALA 86 Cb -0.29 -1.07 -0.01 0.00 0.00 0.00 0.00 23.12 21.75 2dkp s ALA 86 CO 0.76 0.65 0.09 1.97 0.00 0.00 0.00 175.76 179.23 2dkp n PHE 87 N 1.01 0.23 -3.87 0.00 -1.74 -0.43 -4.15 117.46 108.51 2dkp n PHE 87 Ca -0.14 -1.93 -0.11 0.00 -0.56 0.00 0.00 57.45 54.72 2dkp n PHE 87 Cb 0.52 -0.04 -0.11 0.00 1.52 0.00 0.00 39.48 41.37 2dkp n PHE 87 CO 0.00 0.00 0.00 -1.59 -0.56 0.00 0.00 176.76 174.61 2dkp s LYS 88 N -3.19 0.38 -0.19 3.97 -2.85 -1.16 -2.17 119.74 114.53 2dkp s LYS 88 Ca 0.13 -0.26 0.01 0.00 -1.00 0.00 0.00 55.97 54.84 2dkp s LYS 88 Cb 0.01 0.16 0.02 0.00 -2.06 0.00 0.00 37.83 35.95 2dkp s LYS 88 CO 0.09 -0.08 -0.18 0.00 0.10 0.00 0.00 175.35 175.28 2dkp s ALA 89 N -0.99 2.38 0.12 0.59 0.00 0.77 -2.43 121.76 122.19 2dkp s ALA 89 Ca -0.11 -1.23 -0.11 0.00 0.00 0.00 0.00 51.96 50.51 2dkp s ALA 89 Cb -0.06 -1.24 -0.06 0.00 0.00 0.00 0.00 23.12 21.76 2dkp s ALA 89 CO 0.01 -0.38 0.47 0.00 0.00 0.00 0.00 175.76 175.86 2dkp s ALA 90 N 1.30 3.66 -0.00 0.00 0.00 -0.98 0.12 121.76 125.87 2dkp s ALA 90 Ca 0.05 -0.29 0.00 0.00 0.00 0.00 0.00 51.96 51.72 2dkp s ALA 90 Cb -0.13 -2.37 -0.00 0.00 0.00 0.00 0.00 23.12 20.61 2dkp s ALA 90 CO -0.12 0.52 -0.00 -1.58 0.00 0.00 0.00 175.76 174.58 2dkp s HIS 91 N -1.48 0.02 -0.05 0.00 2.46 -1.25 -0.96 115.29 114.04 2dkp s HIS 91 Ca 0.37 -0.01 -0.26 0.00 0.47 0.00 0.00 55.06 55.63 2dkp s HIS 91 Cb -0.14 -0.01 -0.22 0.00 -0.13 0.00 0.00 32.58 32.08 2dkp s HIS 91 CO 0.19 -0.00 1.10 -1.00 -2.47 0.00 0.00 174.74 172.56 2dkp h PRO 92 N 6.14 0.09 -0.37 2.88 0.13 -1.92 -3.23 132.00 135.71 2dkp h PRO 92 Ca -0.24 -0.08 0.00 0.00 -0.87 0.00 0.00 66.00 64.81 2dkp h PRO 92 Cb 1.21 0.02 0.00 0.00 0.13 0.00 0.00 31.00 32.36 2dkp h PRO 92 CO 0.51 0.75 0.00 0.09 -0.23 0.00 0.00 178.00 179.12 2dkp n ASN 93 N -4.67 1.98 -2.08 1.44 5.03 -1.26 -4.91 115.26 110.80 2dkp n ASN 93 Ca -0.09 -2.01 -0.08 0.00 0.87 0.00 0.00 54.58 53.27 2dkp n ASN 93 Cb 0.39 -0.25 -0.02 0.00 -1.02 0.00 0.00 39.78 38.88 2dkp n ASN 93 CO 0.00 0.00 0.00 0.23 -1.83 0.00 0.00 177.26 175.66 2dkp n MET 94 N 0.57 0.36 -2.69 3.52 2.81 -1.22 -5.18 117.12 115.29 2dkp n MET 94 Ca 0.12 -1.53 -0.23 0.00 -1.81 0.00 0.00 57.70 54.26 2dkp n MET 94 Cb 0.31 1.44 0.10 0.00 -0.71 0.00 0.00 33.22 34.37 2dkp n MET 94 CO 0.00 0.00 0.00 -0.98 1.51 0.00 0.00 175.97 176.50 2dkp s ARG 95 N -2.46 1.74 -0.23 0.03 1.70 -1.26 -4.30 118.95 114.18 2dkp s ARG 95 Ca 0.16 -1.27 -0.23 0.00 -0.47 0.00 0.00 55.73 53.93 2dkp s ARG 95 Cb -0.00 -2.39 -0.01 0.00 -0.57 0.00 0.00 34.95 31.97 2dkp s ARG 95 CO 0.12 -1.38 0.73 0.99 -1.08 0.00 0.00 175.30 174.68 2dkp s THR 96 N -3.06 4.92 0.34 4.99 2.01 -1.26 -3.75 115.64 119.83 2dkp s THR 96 Ca 0.66 1.37 -0.04 0.00 0.31 0.00 0.00 61.69 63.99 2dkp s THR 96 Cb -0.05 -4.03 -0.05 0.00 0.01 0.00 0.00 72.50 68.38 2dkp s THR 96 CO 0.44 0.01 0.60 -0.31 -0.69 0.00 0.00 174.62 174.67 2dkp s TYR 97 N 2.45 3.49 -0.08 4.92 1.51 0.12 -4.84 117.35 124.92 2dkp s TYR 97 Ca 0.31 0.63 -0.01 0.00 -1.01 0.00 0.00 57.07 57.00 2dkp s TYR 97 Cb -0.16 -2.11 0.03 0.00 -0.11 0.00 0.00 41.96 39.61 2dkp s TYR 97 CO 0.09 0.08 -0.02 0.71 -1.11 0.00 0.00 175.55 175.30 2dkp s TYR 98 N -2.25 0.88 0.13 2.71 1.51 -1.26 -0.17 117.35 118.91 2dkp s TYR 98 Ca 0.44 -0.31 0.10 0.00 -1.01 0.00 0.00 57.07 56.28 2dkp s TYR 98 Cb -0.10 -0.91 -0.04 0.00 -0.11 0.00 0.00 41.96 40.80 2dkp s TYR 98 CO 0.33 -0.37 -0.23 -0.06 -1.11 0.00 0.00 175.55 174.11 2dkp s PHE 99 N 1.86 2.04 0.12 2.71 0.40 -0.92 -1.52 117.98 122.67 2dkp s PHE 99 Ca 0.04 -0.40 -0.13 0.00 -0.60 0.00 0.00 56.93 55.84 2dkp s PHE 99 Cb -0.12 -1.09 0.02 0.00 0.51 0.00 0.00 43.02 42.34 2dkp s PHE 99 CO -0.06 0.31 0.32 0.00 0.70 0.00 0.00 175.22 176.49 2dkp n THR 101 N -0.17 0.00 0.05 0.00 -2.24 -1.26 -4.04 114.28 106.63 2dkp n THR 101 Ca -0.15 -1.88 -0.20 0.00 -2.27 0.00 0.00 64.05 59.55 2dkp n THR 101 Cb 0.63 0.53 -0.15 0.00 -2.10 0.00 0.00 70.33 69.25 2dkp n THR 101 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 2dkp h ASP 102 N 1.13 0.47 -3.92 3.42 3.32 -1.93 -3.46 116.42 115.45 2dkp h ASP 102 Ca -0.29 -0.96 -0.35 0.00 0.02 0.00 0.00 57.03 55.45 2dkp h ASP 102 Cb 0.98 -0.15 -0.14 0.00 0.22 0.00 0.00 39.33 40.23 2dkp h ASP 102 CO 0.47 1.39 -0.69 0.42 -1.72 0.00 0.00 179.24 179.11 2dkp s THR 103 N -2.43 1.12 0.41 0.35 -4.23 -1.26 -4.99 115.64 104.60 2dkp s THR 103 Ca -0.14 -2.05 0.17 0.00 -1.18 0.00 0.00 61.69 58.49 2dkp s THR 103 Cb 0.01 -2.06 0.38 0.00 1.34 0.00 0.00 72.50 72.17 2dkp s THR 103 CO 0.83 -0.56 1.82 1.23 -0.54 0.00 0.00 174.62 177.40 2dkp h GLY 104 N 2.65 1.02 0.52 3.99 0.00 -1.92 -2.52 103.07 106.81 2dkp h GLY 104 Ca -0.37 -0.20 -0.03 0.00 0.00 0.00 0.00 47.33 46.73 2dkp h GLY 104 CO 0.64 -0.05 -0.26 1.70 0.00 0.00 0.00 176.54 178.57 2dkp h LYS 105 N 0.42 -0.68 -0.15 4.80 1.63 -1.98 -0.81 116.57 119.80 2dkp h LYS 105 Ca 0.52 0.05 0.04 0.00 -0.85 0.00 0.00 60.65 60.41 2dkp h LYS 105 Cb 1.28 0.16 -0.01 0.00 -0.60 0.00 0.00 32.23 33.06 2dkp h LYS 105 CO -0.22 -0.46 0.72 0.93 -3.45 0.00 0.00 179.45 176.97 2dkp h GLU 106 N -0.71 0.00 0.09 1.90 5.08 -1.87 0.49 114.58 119.55 2dkp h GLU 106 Ca -0.07 0.00 -0.19 0.00 -1.00 0.00 0.00 59.36 58.10 2dkp h GLU 106 Cb 0.55 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.80 2dkp h GLU 106 CO 0.11 0.00 -0.94 1.98 -1.00 0.00 0.00 179.01 179.16 2dkp h MET 107 N 0.00 0.18 -0.39 2.33 4.05 -1.16 -3.18 114.93 116.77 2dkp h MET 107 Ca 0.07 -0.31 -0.01 0.00 -0.28 0.00 0.00 59.70 59.17 2dkp h MET 107 Cb 1.51 0.12 -0.02 0.00 -0.80 0.00 0.00 31.60 32.40 2dkp h MET 107 CO -0.00 1.15 0.19 1.05 0.23 0.00 0.00 176.91 179.53 2dkp h GLU 108 N -0.55 0.53 -0.48 0.39 4.11 0.14 0.23 114.58 118.95 2dkp h GLU 108 Ca -0.20 -0.06 -0.13 0.00 0.07 0.00 0.00 59.36 59.04 2dkp h GLU 108 Cb 1.52 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 30.65 2dkp h GLU 108 CO 0.04 0.42 -0.22 -0.07 0.07 0.00 0.00 179.01 179.25 2dkp h LEU 109 N 0.54 1.03 -0.04 3.06 3.38 -1.41 -0.97 115.31 120.89 2dkp h LEU 109 Ca 0.14 -0.40 -0.26 0.00 0.09 0.00 0.00 57.88 57.45 2dkp h LEU 109 Cb 0.06 -0.28 0.01 0.00 0.09 0.00 0.00 40.66 40.54 2dkp h LEU 109 CO -0.02 1.20 -1.06 -0.50 0.09 0.00 0.00 178.44 178.15 2dkp h TRP 110 N 0.86 0.83 0.60 1.13 -0.00 -1.39 -3.27 115.95 114.71 2dkp h TRP 110 Ca 0.11 -0.47 -0.03 0.00 -0.00 0.00 0.00 58.89 58.50 2dkp h TRP 110 Cb 0.80 -0.09 0.01 0.00 -0.00 0.00 0.00 29.16 29.88 2dkp h TRP 110 CO 0.05 1.31 -0.29 0.52 -0.00 0.00 0.00 178.44 180.04 2dkp h MET 111 N 0.29 -0.77 -1.02 0.49 2.86 -0.52 -0.05 114.93 116.20 2dkp h MET 111 Ca -0.12 0.05 0.41 0.00 -2.06 0.00 0.00 59.70 57.98 2dkp h MET 111 Cb 1.71 0.18 -0.16 0.00 0.06 0.00 0.00 31.60 33.38 2dkp h MET 111 CO 0.19 -0.52 0.58 1.63 1.06 0.00 0.00 176.91 179.86 2dkp n LYS 112 N -4.78 -0.05 0.02 1.72 4.76 -0.37 -0.35 118.16 119.10 2dkp n LYS 112 Ca -0.10 1.28 -0.02 0.00 -2.87 0.00 0.00 58.31 56.60 2dkp n LYS 112 Cb 0.32 -2.35 -0.01 0.00 -1.84 0.00 0.00 35.03 31.15 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 1.81 -0.18 -0.83 7.82 0.00 -1.58 -3.01 119.26 123.29 2dkp h ALA 113 Ca 0.81 -0.03 0.13 0.00 0.00 0.00 0.00 54.91 55.83 2dkp h ALA 113 Cb 2.25 0.05 -0.14 0.00 0.00 0.00 0.00 17.79 19.95 2dkp h ALA 113 CO -0.67 -0.17 -0.37 0.52 0.00 0.00 0.00 179.25 178.56 2dkp h MET 114 N -0.69 -0.06 -0.99 0.00 2.86 0.43 0.63 114.93 117.12 2dkp h MET 114 Ca -0.01 0.00 0.12 0.00 -2.06 0.00 0.00 59.70 57.75 2dkp h MET 114 Cb 0.10 0.01 -0.08 0.00 0.06 0.00 0.00 31.60 31.69 2dkp h MET 114 CO 0.02 -0.04 0.62 -0.07 1.06 0.00 0.00 176.91 178.50 2dkp h LEU 115 N -0.07 0.90 -1.77 1.22 -0.00 -0.85 0.53 115.31 115.28 2dkp h LEU 115 Ca 0.30 0.04 -0.03 0.00 -0.00 0.00 0.00 57.88 58.19 2dkp h LEU 115 Cb 0.58 -0.14 -0.00 0.00 -0.00 0.00 0.00 40.66 41.09 2dkp h LEU 115 CO -0.87 0.49 -0.16 -0.78 -0.00 0.00 0.00 178.44 177.12 2dkp h ASP 116 N 0.97 0.00 -0.02 -0.43 3.58 0.35 0.15 116.42 121.03 2dkp h ASP 116 Ca 0.48 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.93 2dkp h ASP 116 Cb 0.48 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.53 2dkp h ASP 116 CO -0.24 0.16 -0.25 0.00 -2.88 0.00 0.00 179.24 176.03 2dkp n ALA 117 N -2.34 3.02 -0.10 -0.78 0.00 0.48 -4.39 120.51 116.38 2dkp n ALA 117 Ca -0.02 -0.63 -0.13 0.00 0.00 0.00 0.00 53.44 52.66 2dkp n ALA 117 Cb 0.26 -0.71 -0.12 0.00 0.00 0.00 0.00 19.45 18.88 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 0.48 1.54 0.30 0.00 0.00 0.16 0.96 120.51 123.94 2dkp n ALA 118 Ca 0.10 -1.02 0.05 0.00 0.00 0.00 0.00 53.44 52.57 2dkp n ALA 118 Cb 0.47 -0.05 0.22 0.00 0.00 0.00 0.00 19.45 20.09 2dkp n ALA 118 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 177.50 178.97 2dkp n LEU 119 N -2.98 0.07 -4.71 0.00 -0.00 0.46 -4.53 117.00 105.30 2dkp n LEU 119 Ca -0.36 0.52 -0.41 0.00 -0.00 0.00 0.00 56.01 55.76 2dkp n LEU 119 Cb 0.97 -0.52 -0.04 0.00 -0.00 0.00 0.00 43.42 43.84 2dkp n LEU 119 CO 0.27 -0.39 0.58 0.54 -0.00 0.00 0.00 177.39 178.39 2dkp s VAL 120 N -3.04 4.93 -0.81 1.47 0.11 -1.26 -5.00 120.40 116.80 2dkp s VAL 120 Ca 0.04 1.82 0.02 0.00 -2.93 0.00 0.00 61.98 60.92 2dkp s VAL 120 Cb 0.06 -4.21 0.22 0.00 -1.53 0.00 0.00 36.38 30.93 2dkp s VAL 120 CO 0.18 0.18 0.78 0.00 -3.33 0.00 0.00 175.10 172.91 2dkp n GLN 121 N 3.95 2.61 -4.28 1.54 6.02 -1.26 -4.57 117.38 121.38 2dkp n GLN 121 Ca 0.03 -4.54 -0.31 0.00 -0.01 0.00 0.00 57.00 52.17 2dkp n GLN 121 Cb 0.51 -2.35 -0.16 0.00 1.02 0.00 0.00 30.24 29.25 2dkp n GLN 121 CO 0.00 0.00 0.00 -0.08 -1.01 0.00 0.00 177.06 175.97 2dkp s THR 122 N -1.84 1.79 0.33 5.09 -1.32 -1.26 -5.11 115.64 113.31 2dkp s THR 122 Ca 0.31 -0.79 -0.29 0.00 -1.21 0.00 0.00 61.69 59.71 2dkp s THR 122 Cb 0.01 -1.62 -0.10 0.00 -1.51 0.00 0.00 72.50 69.27 2dkp s THR 122 CO -0.08 0.50 1.29 -0.94 -2.21 0.00 0.00 174.62 173.17 2dkp s SER 123 N 1.18 6.79 0.32 8.08 1.04 -1.26 -4.79 113.70 125.06 2dkp s SER 123 Ca -0.00 2.66 0.00 0.00 0.48 0.00 0.00 55.95 59.09 2dkp s SER 123 Cb -0.14 -2.65 0.00 0.00 0.10 0.00 0.00 66.02 63.33 2dkp s SER 123 CO -0.07 -0.52 0.00 0.61 0.98 0.00 0.00 173.24 174.24 2dkp n GLY 124 N 0.82 -2.60 2.90 7.32 0.00 -1.26 -4.96 105.19 107.40 2dkp n GLY 124 Ca 0.00 -1.24 -0.23 0.00 0.00 0.00 0.00 46.02 44.55 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 -3.53 -1.47 0.36 1.61 -0.04 -1.26 -5.01 135.00 125.66 2dkp n PRO 125 Ca -0.03 -1.52 -0.16 0.00 -0.04 0.00 0.00 63.50 61.75 2dkp n PRO 125 Cb 0.40 -1.11 -0.08 0.00 -0.04 0.00 0.00 33.50 32.67 2dkp n PRO 125 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 2dkp h SER 126 N -1.63 -0.79 -4.18 3.54 0.87 -1.92 -3.44 113.55 105.99 2dkp h SER 126 Ca -0.33 0.00 -0.51 0.00 -1.23 0.00 0.00 61.79 59.72 2dkp h SER 126 Cb 0.93 0.21 0.11 0.00 -0.44 0.00 0.00 62.40 63.21 2dkp h SER 126 CO 0.23 -0.44 0.38 -0.94 -0.53 0.00 0.00 176.83 175.53 2dkp s SER 127 N -4.47 4.91 0.00 6.23 1.04 -1.26 -5.24 113.70 114.91 2dkp s SER 127 Ca -0.15 2.11 0.00 0.00 0.48 0.00 0.00 55.95 58.39 2dkp s SER 127 Cb 0.02 -2.56 0.00 0.00 0.10 0.00 0.00 66.02 63.57 2dkp s SER 127 CO 0.49 -1.77 0.00 0.61 0.98 0.00 0.00 173.24 173.55