#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k4j h SER 12 N 0.00 0.92 0.02 1.61 0.02 -2.02 -3.18 113.55 110.93 2k4j h SER 12 Ca 0.00 -0.36 -0.40 0.00 -0.84 0.00 0.00 61.79 60.20 2k4j h SER 12 Cb 0.00 -0.25 -0.06 0.00 0.14 0.00 0.00 62.40 62.23 2k4j h SER 12 CO 0.00 1.12 -2.27 1.21 -1.14 0.00 0.00 176.83 175.75 2k4j n GLU 13 N -4.10 0.63 -1.13 3.45 2.13 -1.26 -4.67 120.64 115.69 2k4j n GLU 13 Ca -0.00 0.27 -0.33 0.00 0.66 0.00 0.00 57.16 57.76 2k4j n GLU 13 Cb 0.47 -1.57 -0.02 0.00 0.27 0.00 0.00 31.44 30.58 2k4j n GLU 13 CO 0.00 0.00 0.00 0.39 -0.41 0.00 0.00 177.13 177.11 2k4j n GLU 14 N -3.87 2.94 -0.03 5.31 1.02 -1.24 -4.64 120.64 120.13 2k4j n GLU 14 Ca -0.46 -1.95 -0.16 0.00 -0.02 0.00 0.00 57.16 54.57 2k4j n GLU 14 Cb 0.91 -2.73 -0.08 0.00 -0.02 0.00 0.00 31.44 29.52 2k4j n GLU 14 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 2k4j h VAL 15 N 3.32 1.37 -0.37 2.62 2.07 -1.82 -1.40 116.25 122.04 2k4j h VAL 15 Ca 0.69 -1.82 0.00 0.00 0.82 0.00 0.00 66.70 66.39 2k4j h VAL 15 Cb 0.29 2.19 0.00 0.00 -1.52 0.00 0.00 31.29 32.25 2k4j h VAL 15 CO 1.69 0.55 0.00 -1.20 0.02 0.00 0.00 177.57 178.62 2k4j n SER 16 N -4.24 4.46 -4.30 0.57 7.64 -1.26 -4.71 113.62 111.78 2k4j n SER 16 Ca -0.08 -2.94 -0.17 0.00 1.01 0.00 0.00 58.87 56.69 2k4j n SER 16 Cb 0.60 -0.58 -0.10 0.00 -1.01 0.00 0.00 64.21 63.11 2k4j n SER 16 CO 0.00 0.00 0.00 -1.61 -3.01 0.00 0.00 175.04 170.42 2k4j s GLU 17 N -2.71 1.21 0.83 1.43 2.02 -1.25 -5.14 118.70 115.09 2k4j s GLU 17 Ca 0.46 -1.49 -0.10 0.00 0.02 0.00 0.00 54.97 53.86 2k4j s GLU 17 Cb 0.36 -0.97 0.09 0.00 0.10 0.00 0.00 34.13 33.71 2k4j s GLU 17 CO 0.12 0.16 1.11 -1.25 0.02 0.00 0.00 175.26 175.42 2k4j s PRO 18 N -3.46 1.74 0.27 0.39 0.04 -1.26 -4.76 135.00 127.96 2k4j s PRO 18 Ca 0.18 1.26 0.06 0.00 0.04 0.00 0.00 61.00 62.55 2k4j s PRO 18 Cb -0.01 -1.83 -0.03 0.00 0.04 0.00 0.00 34.50 32.67 2k4j s PRO 18 CO 0.05 -2.04 0.35 0.20 0.04 0.00 0.00 177.00 175.60 2k4j s GLY 19 N -3.15 1.39 -0.11 0.56 0.00 -0.37 -4.97 107.32 100.66 2k4j s GLY 19 Ca 0.63 -1.36 -0.17 0.00 0.00 0.00 0.00 44.72 43.82 2k4j s GLY 19 CO 0.57 -1.35 0.44 -0.35 0.00 0.00 0.00 173.10 172.41 2k4j s ASP 20 N -4.00 -0.41 -0.26 1.64 -1.08 -1.26 -0.27 116.67 111.02 2k4j s ASP 20 Ca 0.37 0.66 -0.06 0.00 -0.52 0.00 0.00 52.55 53.00 2k4j s ASP 20 Cb -0.09 0.71 0.14 0.00 -1.46 0.00 0.00 42.92 42.22 2k4j s ASP 20 CO 0.28 -0.29 0.53 0.00 0.52 0.00 0.00 175.17 176.21 2k4j s ALA 21 N -0.36 -1.70 0.00 3.66 0.00 -0.35 -5.00 121.76 118.01 2k4j s ALA 21 Ca -0.05 1.74 0.00 0.00 0.00 0.00 0.00 51.96 53.65 2k4j s ALA 21 Cb -0.03 -1.75 0.00 0.00 0.00 0.00 0.00 23.12 21.34 2k4j s ALA 21 CO 0.03 -1.05 0.00 0.09 0.00 0.00 0.00 175.76 174.82 2k4j n ASN 22 N 5.41 0.00 -0.24 0.00 3.02 -1.26 -1.57 115.26 120.62 2k4j n ASN 22 Ca -0.07 0.00 0.11 0.00 -0.03 0.00 0.00 54.58 54.60 2k4j n ASN 22 Cb 0.50 0.00 0.12 0.00 -0.61 0.00 0.00 39.78 39.78 2k4j n ASN 22 CO 0.00 0.00 0.00 -0.38 -2.62 0.00 0.00 177.26 174.26 2k4j n ILE 23 N 0.00 0.00 -4.36 2.41 2.08 -1.26 -4.97 119.36 113.25 2k4j n ILE 23 Ca 0.00 -0.13 -0.19 0.00 0.56 0.00 0.00 62.75 63.00 2k4j n ILE 23 Cb 0.00 0.81 -0.10 0.00 -0.75 0.00 0.00 39.64 39.59 2k4j n ILE 23 CO 0.00 0.00 0.00 0.72 0.56 0.00 0.00 176.55 177.83 2k4j s PHE 24 N -2.68 1.70 -0.04 1.39 -0.71 -0.61 -1.02 117.98 116.00 2k4j s PHE 24 Ca 0.17 -0.80 -0.03 0.00 -1.04 0.00 0.00 56.93 55.23 2k4j s PHE 24 Cb 0.18 -0.96 0.02 0.00 -1.21 0.00 0.00 43.02 41.05 2k4j s PHE 24 CO 0.64 0.12 0.10 0.50 -1.34 0.00 0.00 175.22 175.24 2k4j s ARG 25 N -3.79 0.08 -0.09 1.99 3.52 -0.42 -1.21 118.95 119.03 2k4j s ARG 25 Ca 0.27 0.23 0.04 0.00 -0.13 0.00 0.00 55.73 56.14 2k4j s ARG 25 Cb 0.04 -0.08 -0.01 0.00 -1.56 0.00 0.00 34.95 33.35 2k4j s ARG 25 CO 0.09 -0.09 -0.21 0.54 -0.81 0.00 0.00 175.30 174.82 2k4j s VAL 26 N 0.61 2.34 -0.37 7.11 0.11 0.63 -0.38 120.40 130.45 2k4j s VAL 26 Ca -0.05 -0.93 -0.08 0.00 -2.93 0.00 0.00 61.98 57.99 2k4j s VAL 26 Cb -0.06 -1.91 0.05 0.00 -1.53 0.00 0.00 36.38 32.93 2k4j s VAL 26 CO -0.03 0.56 0.17 -1.81 -3.33 0.00 0.00 175.10 170.66 2k4j s ASP 27 N 0.16 5.49 0.25 3.54 1.11 -0.53 -1.24 116.67 125.45 2k4j s ASP 27 Ca -0.12 -1.22 0.12 0.00 0.18 0.00 0.00 52.55 51.51 2k4j s ASP 27 Cb -0.16 -1.93 0.21 0.00 1.07 0.00 0.00 42.92 42.11 2k4j s ASP 27 CO 0.06 -0.40 1.52 0.11 1.18 0.00 0.00 175.17 177.64 2k4j h LYS 28 N 8.31 0.00 0.06 8.23 1.79 -1.93 -1.17 116.57 131.86 2k4j h LYS 28 Ca -0.23 0.00 -0.00 0.00 -2.18 0.00 0.00 60.65 58.23 2k4j h LYS 28 Cb 1.09 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.74 2k4j h LYS 28 CO 0.66 0.67 -0.03 -0.44 -1.08 0.00 0.00 179.45 179.23 2k4j h ASP 29 N 0.00 -0.07 0.89 0.86 3.32 -1.96 -3.28 116.42 116.18 2k4j h ASP 29 Ca -0.01 -0.35 -0.05 0.00 0.02 0.00 0.00 57.03 56.64 2k4j h ASP 29 Cb 1.30 0.02 -0.01 0.00 0.22 0.00 0.00 39.33 40.86 2k4j h ASP 29 CO 0.09 0.58 -0.23 0.28 -1.72 0.00 0.00 179.24 178.24 2k4j h SER 30 N -0.98 0.00 -3.80 6.45 0.02 -2.02 -3.48 113.55 109.74 2k4j h SER 30 Ca -0.01 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.94 2k4j h SER 30 Cb 0.42 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.96 2k4j h SER 30 CO 0.01 0.23 -0.16 -1.14 -1.14 0.00 0.00 176.83 174.63 2k4j n ARG 31 N -3.41 -0.81 -3.46 3.45 0.63 -0.63 -5.10 116.66 107.33 2k4j n ARG 31 Ca 0.00 1.05 -0.11 0.00 -0.92 0.00 0.00 57.85 57.88 2k4j n ARG 31 Cb 0.42 -2.97 -0.02 0.00 0.45 0.00 0.00 32.46 30.34 2k4j n ARG 31 CO 0.00 0.00 0.00 -1.83 -2.51 0.00 0.00 177.63 173.29 2k4j s GLU 32 N -1.66 1.06 -0.07 -0.14 -1.05 -0.54 -4.52 118.70 111.79 2k4j s GLU 32 Ca 0.08 -0.35 -0.03 0.00 -0.15 0.00 0.00 54.97 54.53 2k4j s GLU 32 Cb -0.02 0.49 0.04 0.00 -0.44 0.00 0.00 34.13 34.20 2k4j s GLU 32 CO 0.27 -0.46 0.13 0.54 0.95 0.00 0.00 175.26 176.70 2k4j s VAL 33 N -3.29 -0.17 -0.13 1.83 0.11 0.43 -1.46 120.40 117.73 2k4j s VAL 33 Ca 0.02 0.31 -0.07 0.00 -2.93 0.00 0.00 61.98 59.30 2k4j s VAL 33 Cb -0.01 -0.25 -0.04 0.00 -1.53 0.00 0.00 36.38 34.55 2k4j s VAL 33 CO -0.10 0.13 0.13 -0.31 -3.33 0.00 0.00 175.10 171.62 2k4j s TYR 34 N 1.87 3.54 0.23 1.54 1.51 0.49 -0.84 117.35 125.69 2k4j s TYR 34 Ca -0.01 0.47 -0.03 0.00 -1.01 0.00 0.00 57.07 56.49 2k4j s TYR 34 Cb -0.12 -1.96 -0.05 0.00 -0.11 0.00 0.00 41.96 39.72 2k4j s TYR 34 CO -0.05 0.66 0.45 1.41 -1.11 0.00 0.00 175.55 176.91 2k4j s MET 35 N -0.83 3.58 0.58 -0.62 -2.45 -0.25 -1.29 119.30 118.02 2k4j s MET 35 Ca 0.14 -0.16 0.28 0.00 -1.25 0.00 0.00 55.69 54.70 2k4j s MET 35 Cb -0.12 -2.76 1.52 0.00 1.25 0.00 0.00 34.83 34.72 2k4j s MET 35 CO 0.03 0.34 1.98 1.25 1.05 0.00 0.00 175.02 179.66 2k4j h HIS 36 N 2.00 0.00 0.00 4.11 2.76 -1.47 -0.96 115.15 121.59 2k4j h HIS 36 Ca -0.48 0.00 -0.24 0.00 -2.20 0.00 0.00 60.37 57.45 2k4j h HIS 36 Cb 1.19 0.00 -0.04 0.00 1.55 0.00 0.00 27.41 30.10 2k4j h HIS 36 CO 0.57 0.00 -1.61 0.39 -1.30 0.00 0.00 177.93 175.98 2k4j n GLU 37 N -3.86 0.63 -3.61 5.26 1.02 -1.26 -5.05 120.64 113.77 2k4j n GLU 37 Ca 0.07 0.25 -0.08 0.00 -0.02 0.00 0.00 57.16 57.37 2k4j n GLU 37 Cb 0.55 -1.79 -0.06 0.00 -0.02 0.00 0.00 31.44 30.13 2k4j n GLU 37 CO 0.00 0.00 0.00 -1.59 1.18 0.00 0.00 177.13 176.72 2k4j s LYS 38 N -2.74 0.46 0.45 3.49 -2.85 -0.36 -5.12 119.74 113.07 2k4j s LYS 38 Ca -0.04 0.24 -0.21 0.00 -1.00 0.00 0.00 55.97 54.95 2k4j s LYS 38 Cb 0.08 0.22 -0.10 0.00 -2.06 0.00 0.00 37.83 35.98 2k4j s LYS 38 CO 0.82 -0.12 1.00 -1.59 0.10 0.00 0.00 175.35 175.56 2k4j s LYS 39 N -0.66 4.05 0.03 1.78 -2.85 -1.26 -1.09 119.74 119.74 2k4j s LYS 39 Ca 0.02 1.27 0.03 0.00 -1.00 0.00 0.00 55.97 56.29 2k4j s LYS 39 Cb -0.02 -2.20 -0.02 0.00 -2.06 0.00 0.00 37.83 33.53 2k4j s LYS 39 CO -0.03 -0.21 -0.10 -0.51 0.10 0.00 0.00 175.35 174.60 2k4j s LEU 40 N -3.21 2.15 -0.05 2.77 1.43 -0.02 -4.87 118.68 116.88 2k4j s LEU 40 Ca 0.63 -0.39 0.19 0.00 -1.03 0.00 0.00 54.13 53.53 2k4j s LEU 40 Cb -0.14 -0.41 0.35 0.00 0.03 0.00 0.00 46.19 46.02 2k4j s LEU 40 CO 0.18 -0.02 1.15 0.47 0.23 0.00 0.00 176.35 178.36 2k4j n ASP 41 N 2.05 1.05 -2.66 2.29 8.00 -1.26 -0.43 116.55 125.58 2k4j n ASP 41 Ca -0.18 -2.43 -0.09 0.00 0.71 0.00 0.00 54.79 52.80 2k4j n ASP 41 Cb 0.55 -0.34 0.06 0.00 -0.02 0.00 0.00 41.12 41.38 2k4j n ASP 41 CO 0.00 0.00 0.00 -0.11 -0.39 0.00 0.00 177.20 176.70 2k4j n LEU 42 N 0.00 0.00 -4.94 0.64 7.94 -1.26 -4.83 117.00 114.55 2k4j n LEU 42 Ca 0.08 -0.52 -0.24 0.00 -1.11 0.00 0.00 56.01 54.22 2k4j n LEU 42 Cb 0.96 -0.30 0.01 0.00 0.53 0.00 0.00 43.42 44.62 2k4j n LEU 42 CO -0.03 -0.78 0.35 -0.89 -1.11 0.00 0.00 177.39 174.94 2k4j s THR 43 N -1.70 4.00 0.23 1.96 2.01 -1.26 -4.40 115.64 116.48 2k4j s THR 43 Ca 0.24 -0.33 -0.14 0.00 0.31 0.00 0.00 61.69 61.77 2k4j s THR 43 Cb -0.01 -3.51 0.28 0.00 0.01 0.00 0.00 72.50 69.27 2k4j s THR 43 CO 0.17 -0.41 1.59 -0.09 -0.69 0.00 0.00 174.62 175.19 2k4j h ARG 44 N 0.25 -0.04 -0.63 4.92 1.12 -1.99 0.96 114.38 118.98 2k4j h ARG 44 Ca -0.46 0.00 -0.01 0.00 -1.11 0.00 0.00 59.98 58.40 2k4j h ARG 44 Cb 1.25 0.01 -0.03 0.00 -0.01 0.00 0.00 29.97 31.19 2k4j h ARG 44 CO 0.58 -0.02 0.36 0.00 -3.11 0.00 0.00 179.97 177.78 2k4j h ALA 45 N 1.57 0.80 -0.17 2.80 0.00 -1.94 -0.30 119.26 122.02 2k4j h ALA 45 Ca 0.34 -0.09 -0.10 0.00 0.00 0.00 0.00 54.91 55.06 2k4j h ALA 45 Cb 0.57 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 2k4j h ALA 45 CO -0.80 0.30 -0.35 0.93 0.00 0.00 0.00 179.25 179.33 2k4j h GLU 46 N 0.85 0.35 0.12 0.00 3.07 -1.33 -1.42 114.58 116.23 2k4j h GLU 46 Ca 0.22 -0.15 0.00 0.00 -0.50 0.00 0.00 59.36 58.93 2k4j h GLU 46 Cb 0.01 -0.01 -0.01 0.00 -0.84 0.00 0.00 28.75 27.90 2k4j h GLU 46 CO -0.04 0.66 -0.12 -0.92 -1.40 0.00 0.00 179.01 177.20 2k4j h TYR 47 N 0.30 -0.30 -0.45 4.33 3.20 -0.65 -1.92 116.97 121.48 2k4j h TYR 47 Ca 0.04 0.00 0.08 0.00 3.14 0.00 0.00 58.73 61.98 2k4j h TYR 47 Cb 0.76 0.12 -0.07 0.00 1.54 0.00 0.00 36.73 39.08 2k4j h TYR 47 CO 0.02 -0.18 0.06 0.93 -1.64 0.00 0.00 178.16 177.35 2k4j h GLU 48 N -0.26 0.18 0.04 1.82 4.39 -0.14 0.13 114.58 120.75 2k4j h GLU 48 Ca 0.00 -0.01 -0.00 0.00 0.34 0.00 0.00 59.36 59.69 2k4j h GLU 48 Cb 0.25 -0.04 0.00 0.00 -0.10 0.00 0.00 28.75 28.86 2k4j h GLU 48 CO -0.03 0.12 -0.02 -0.84 -1.16 0.00 0.00 179.01 177.08 2k4j h ILE 49 N 0.18 1.16 -0.14 3.13 3.07 -1.30 -1.77 117.51 121.84 2k4j h ILE 49 Ca 0.23 -0.67 -0.18 0.00 1.55 0.00 0.00 64.86 65.79 2k4j h ILE 49 Cb 0.31 1.61 -0.00 0.00 -0.27 0.00 0.00 36.82 38.46 2k4j h ILE 49 CO -0.32 0.17 -0.64 0.25 -1.05 0.00 0.00 178.15 176.55 2k4j h LEU 50 N -0.36 0.60 -0.15 0.16 6.46 -1.18 0.32 115.31 121.16 2k4j h LEU 50 Ca -0.01 -0.35 0.04 0.00 -0.12 0.00 0.00 57.88 57.44 2k4j h LEU 50 Cb 0.32 -0.17 -0.07 0.00 -0.73 0.00 0.00 40.66 40.01 2k4j h LEU 50 CO 0.01 1.08 -0.44 -1.28 -0.62 0.00 0.00 178.44 177.19 2k4j h SER 51 N 0.38 -1.40 0.83 1.25 0.87 -1.04 -1.53 113.55 112.91 2k4j h SER 51 Ca -0.01 0.18 -0.04 0.00 -1.23 0.00 0.00 61.79 60.69 2k4j h SER 51 Cb 1.21 0.57 -0.01 0.00 -0.44 0.00 0.00 62.40 63.73 2k4j h SER 51 CO 0.12 -0.43 -0.18 0.25 -0.53 0.00 0.00 176.83 176.06 2k4j h LEU 52 N -0.49 0.00 -0.34 2.23 5.85 -1.00 -0.64 115.31 120.91 2k4j h LEU 52 Ca 0.07 0.00 -0.03 0.00 0.84 0.00 0.00 57.88 58.77 2k4j h LEU 52 Cb 0.63 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.65 2k4j h LEU 52 CO -0.42 0.18 0.11 0.25 -0.34 0.00 0.00 178.44 178.21 2k4j h LEU 53 N 0.00 0.50 -0.57 2.25 5.85 -0.64 0.53 115.31 123.24 2k4j h LEU 53 Ca -0.00 -0.20 -0.05 0.00 0.84 0.00 0.00 57.88 58.46 2k4j h LEU 53 Cb 0.64 -0.13 -0.02 0.00 0.37 0.00 0.00 40.66 41.51 2k4j h LEU 53 CO 0.02 0.57 0.15 0.40 -0.34 0.00 0.00 178.44 179.24 2k4j h ILE 54 N 0.40 1.25 -0.50 4.05 2.04 -0.84 -0.80 117.51 123.11 2k4j h ILE 54 Ca 0.11 -0.87 0.02 0.00 1.00 0.00 0.00 64.86 65.12 2k4j h ILE 54 Cb 0.25 0.72 -0.03 0.00 -0.74 0.00 0.00 36.82 37.02 2k4j h ILE 54 CO -0.00 0.32 0.30 0.28 0.00 0.00 0.00 178.15 179.06 2k4j h SER 55 N 0.82 0.50 0.48 1.72 0.02 -0.92 -3.21 113.55 112.96 2k4j h SER 55 Ca 0.18 0.00 -0.26 0.00 -0.84 0.00 0.00 61.79 60.87 2k4j h SER 55 Cb 0.33 -0.11 0.01 0.00 0.14 0.00 0.00 62.40 62.77 2k4j h SER 55 CO 0.00 0.36 -1.16 0.07 -1.14 0.00 0.00 176.83 174.96 2k4j h LYS 56 N 0.61 0.36 0.00 3.45 2.10 -0.87 -3.51 116.57 118.71 2k4j h LYS 56 Ca 0.20 -0.51 0.00 0.00 -2.00 0.00 0.00 60.65 58.33 2k4j h LYS 56 Cb 0.00 0.18 0.00 0.00 -0.90 0.00 0.00 32.23 31.51 2k4j h LYS 56 CO -0.08 1.21 0.00 1.17 -2.00 0.00 0.00 179.45 179.75 2k4j n LYS 57 N -3.63 0.00 -0.16 0.07 4.81 -0.31 -5.04 118.16 113.90 2k4j n LYS 57 Ca -0.09 0.00 -0.04 0.00 -0.87 0.00 0.00 58.31 57.32 2k4j n LYS 57 Cb 0.96 0.00 0.03 0.00 0.02 0.00 0.00 35.03 36.04 2k4j n LYS 57 CO 0.00 0.00 0.00 0.78 1.17 0.00 0.00 177.40 179.35 2k4j h GLY 58 N 0.00 0.24 0.00 3.14 0.00 -1.73 -3.44 103.07 101.28 2k4j h GLY 58 Ca 0.00 0.23 0.00 0.00 0.00 0.00 0.00 47.33 47.56 2k4j h GLY 58 CO 0.00 -0.21 0.00 2.98 0.00 0.00 0.00 176.54 179.31 2k4j n TYR 59 N -5.39 -0.96 -3.72 5.60 9.36 -0.92 -4.22 117.16 116.90 2k4j n TYR 59 Ca 0.04 0.00 -0.38 0.00 3.32 0.00 0.00 57.90 60.88 2k4j n TYR 59 Cb 0.30 0.19 -0.12 0.00 -0.63 0.00 0.00 39.34 39.08 2k4j n TYR 59 CO 0.00 0.00 0.00 0.08 0.22 0.00 0.00 176.86 177.16 2k4j s VAL 60 N 0.00 3.83 -0.48 2.97 1.01 -1.26 -1.14 120.40 125.33 2k4j s VAL 60 Ca 0.00 -1.30 -0.28 0.00 0.00 0.00 0.00 61.98 60.40 2k4j s VAL 60 Cb 0.00 -3.26 0.01 0.00 0.00 0.00 0.00 36.38 33.13 2k4j s VAL 60 CO 0.00 -0.31 1.49 0.12 0.00 0.00 0.00 175.10 176.40 2k4j s PHE 61 N 1.38 2.22 0.12 5.22 5.36 0.01 -4.72 117.98 127.58 2k4j s PHE 61 Ca 0.00 0.59 0.10 0.00 -0.96 0.00 0.00 56.93 56.67 2k4j s PHE 61 Cb -0.21 -4.31 -0.04 0.00 -0.34 0.00 0.00 43.02 38.12 2k4j s PHE 61 CO 0.02 -2.11 -0.25 -1.12 -1.46 0.00 0.00 175.22 170.29 2k4j s SER 62 N 4.73 3.09 0.35 6.13 0.01 -1.26 -1.31 113.70 125.44 2k4j s SER 62 Ca 0.60 -0.74 0.09 0.00 1.31 0.00 0.00 55.95 57.22 2k4j s SER 62 Cb -0.13 -0.20 0.83 0.00 0.21 0.00 0.00 66.02 66.73 2k4j s SER 62 CO 0.29 0.14 1.85 -0.09 0.41 0.00 0.00 173.24 175.84 2k4j h ARG 63 N 3.92 0.66 0.17 12.44 1.12 -1.87 0.12 114.38 130.94 2k4j h ARG 63 Ca -0.49 -0.04 -0.01 0.00 -1.11 0.00 0.00 59.98 58.33 2k4j h ARG 63 Cb 1.17 -0.15 0.00 0.00 -0.01 0.00 0.00 29.97 30.99 2k4j h ARG 63 CO 0.39 0.44 -0.08 1.49 -3.11 0.00 0.00 179.97 179.10 2k4j h GLU 64 N 0.68 -0.22 -0.85 0.20 4.81 -1.95 -0.68 114.58 116.58 2k4j h GLU 64 Ca 0.47 0.02 0.05 0.00 -0.13 0.00 0.00 59.36 59.76 2k4j h GLU 64 Cb 0.80 0.05 -0.06 0.00 0.63 0.00 0.00 28.75 30.17 2k4j h GLU 64 CO -0.23 0.07 0.54 1.03 -0.73 0.00 0.00 179.01 179.69 2k4j h SER 65 N -0.52 0.87 -0.19 1.04 0.87 -1.71 -0.50 113.55 113.42 2k4j h SER 65 Ca -0.02 0.01 0.04 0.00 -1.23 0.00 0.00 61.79 60.59 2k4j h SER 65 Cb 0.40 -0.18 -0.04 0.00 -0.44 0.00 0.00 62.40 62.13 2k4j h SER 65 CO 0.04 0.58 -0.09 0.40 -0.53 0.00 0.00 176.83 177.23 2k4j h ILE 66 N 1.01 0.72 0.00 2.23 1.08 -0.76 0.50 117.51 122.29 2k4j h ILE 66 Ca 0.35 0.00 -0.03 0.00 -0.39 0.00 0.00 64.86 64.80 2k4j h ILE 66 Cb 0.09 0.72 -0.00 0.00 -3.07 0.00 0.00 36.82 34.55 2k4j h ILE 66 CO -0.14 0.00 -0.13 0.00 -0.69 0.00 0.00 178.15 177.19 2k4j h ALA 67 N 1.11 1.54 0.00 1.87 0.00 -0.43 0.89 119.26 124.23 2k4j h ALA 67 Ca 0.10 -0.12 -0.14 0.00 0.00 0.00 0.00 54.91 54.76 2k4j h ALA 67 Cb 0.21 -0.02 0.01 0.00 0.00 0.00 0.00 17.79 18.00 2k4j h ALA 67 CO -0.23 0.16 -0.54 0.82 0.00 0.00 0.00 179.25 179.46 2k4j h ILE 68 N 0.00 1.45 0.03 0.00 1.08 -0.62 -3.25 117.51 116.21 2k4j h ILE 68 Ca -0.00 -2.07 -0.32 0.00 -0.39 0.00 0.00 64.86 62.08 2k4j h ILE 68 Cb 0.27 2.64 -0.04 0.00 -3.07 0.00 0.00 36.82 36.62 2k4j h ILE 68 CO 0.02 0.59 -1.89 1.21 -0.69 0.00 0.00 178.15 177.39 2k4j n GLU 69 N -4.27 0.67 -0.03 2.37 4.07 0.12 -4.58 120.64 118.99 2k4j n GLU 69 Ca -0.10 0.25 -0.04 0.00 -0.06 0.00 0.00 57.16 57.21 2k4j n GLU 69 Cb 0.65 -1.73 -0.04 0.00 -0.06 0.00 0.00 31.44 30.25 2k4j n GLU 69 CO 0.00 0.00 0.00 -1.13 -0.06 0.00 0.00 177.13 175.94 2k4j n SER 70 N -3.13 3.52 -2.86 4.31 3.41 0.24 -4.63 113.62 114.49 2k4j n SER 70 Ca -0.24 -0.02 -0.20 0.00 -0.26 0.00 0.00 58.87 58.15 2k4j n SER 70 Cb 1.06 0.33 0.04 0.00 -0.26 0.00 0.00 64.21 65.38 2k4j n SER 70 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 175.04 176.09 2k4j n GLU 71 N -2.42 -5.07 0.25 4.33 2.13 -0.93 -4.91 120.64 114.02 2k4j n GLU 71 Ca -0.11 0.81 0.10 0.00 0.66 0.00 0.00 57.16 58.62 2k4j n GLU 71 Cb 0.67 -5.51 0.66 0.00 0.27 0.00 0.00 31.44 27.53 2k4j n GLU 71 CO 0.00 0.00 0.00 0.66 -0.41 0.00 0.00 177.13 177.38 2k4j h SER 72 N -1.53 0.00 -3.43 4.31 4.64 -1.87 -3.40 113.55 112.27 2k4j h SER 72 Ca -0.49 0.00 -0.38 0.00 -0.47 0.00 0.00 61.79 60.46 2k4j h SER 72 Cb 1.33 0.00 -0.35 0.00 -0.31 0.00 0.00 62.40 63.07 2k4j h SER 72 CO 0.51 0.14 -0.76 -0.63 -0.87 0.00 0.00 176.83 175.22 2k4j s ILE 73 N -4.40 0.27 0.04 0.95 -1.09 -1.26 -5.09 121.20 110.62 2k4j s ILE 73 Ca -0.03 0.07 -0.25 0.00 -2.23 0.00 0.00 60.65 58.21 2k4j s ILE 73 Cb 0.14 -0.38 -0.17 0.00 -1.58 0.00 0.00 42.46 40.48 2k4j s ILE 73 CO 0.63 0.19 1.50 0.78 -1.23 0.00 0.00 174.94 176.80 2k4j h ASN 74 N 7.52 -0.11 -2.65 3.58 2.35 -1.96 -3.42 115.58 120.89 2k4j h ASN 74 Ca -0.35 -0.18 -0.56 0.00 -0.55 0.00 0.00 56.30 54.66 2k4j h ASN 74 Cb 1.14 0.03 -0.02 0.00 0.05 0.00 0.00 38.32 39.52 2k4j h ASN 74 CO 0.41 0.12 1.15 -2.16 -1.65 0.00 0.00 177.43 175.29 2k4j s PRO 75 N -5.31 3.86 0.40 0.81 0.04 -1.26 -4.90 135.00 128.64 2k4j s PRO 75 Ca -0.14 1.87 0.08 0.00 0.04 0.00 0.00 61.00 62.84 2k4j s PRO 75 Cb 0.04 -4.05 0.83 0.00 0.04 0.00 0.00 34.50 31.36 2k4j s PRO 75 CO 0.64 -1.22 2.00 1.05 0.04 0.00 0.00 177.00 179.51 2k4j h GLU 76 N 10.72 0.40 0.00 4.56 9.09 -1.91 -2.35 114.58 135.09 2k4j h GLU 76 Ca -0.36 -0.05 0.00 0.00 0.05 0.00 0.00 59.36 59.00 2k4j h GLU 76 Cb 1.17 -0.08 0.00 0.00 -1.65 0.00 0.00 28.75 28.19 2k4j h GLU 76 CO 0.98 0.36 0.00 0.43 0.05 0.00 0.00 179.01 180.84 2k4j n SER 77 N -4.39 0.00 -4.56 3.06 7.64 -1.26 -3.91 113.62 110.20 2k4j n SER 77 Ca 0.01 -0.21 -0.40 0.00 1.01 0.00 0.00 58.87 59.29 2k4j n SER 77 Cb 0.15 -0.26 -0.03 0.00 -1.01 0.00 0.00 64.21 63.06 2k4j n SER 77 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2k4j s SER 78 N -2.52 5.56 0.00 6.43 0.15 -0.89 -4.87 113.70 117.56 2k4j s SER 78 Ca 0.30 0.27 0.16 0.00 0.70 0.00 0.00 55.95 57.38 2k4j s SER 78 Cb 0.20 -2.54 0.75 0.00 -1.71 0.00 0.00 66.02 62.73 2k4j s SER 78 CO 0.45 -2.16 1.49 -0.46 1.20 0.00 0.00 173.24 173.75 2k4j n ASN 79 N 11.65 0.00 0.22 5.45 6.94 -1.26 -2.96 115.26 135.30 2k4j n ASN 79 Ca 0.17 0.27 0.09 0.00 -0.02 0.00 0.00 54.58 55.08 2k4j n ASN 79 Cb 0.51 -0.39 0.51 0.00 -2.36 0.00 0.00 39.78 38.05 2k4j n ASN 79 CO 0.00 0.00 0.00 0.50 -1.03 0.00 0.00 177.26 176.73 2k4j h LYS 80 N 0.00 0.00 0.45 -3.83 3.64 -1.98 0.65 116.57 115.50 2k4j h LYS 80 Ca 0.00 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.37 2k4j h LYS 80 Cb 0.21 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.01 2k4j h LYS 80 CO 0.00 0.24 -0.37 1.03 -2.27 0.00 0.00 179.45 178.08 2k4j h SER 81 N 0.00 -0.97 -0.28 4.20 0.87 -1.96 -0.88 113.55 114.53 2k4j h SER 81 Ca -0.00 0.07 0.01 0.00 -1.23 0.00 0.00 61.79 60.64 2k4j h SER 81 Cb 0.64 0.31 -0.01 0.00 -0.44 0.00 0.00 62.40 62.90 2k4j h SER 81 CO 0.03 -0.53 0.19 0.40 -0.53 0.00 0.00 176.83 176.39 2k4j h ILE 82 N -0.81 1.05 -0.45 2.23 5.03 -1.51 0.66 117.51 123.70 2k4j h ILE 82 Ca -0.04 -0.12 -0.04 0.00 -0.12 0.00 0.00 64.86 64.54 2k4j h ILE 82 Cb 0.70 0.67 -0.02 0.00 -3.03 0.00 0.00 36.82 35.15 2k4j h ILE 82 CO -0.01 0.06 0.12 -0.78 -0.68 0.00 0.00 178.15 176.86 2k4j h ASP 83 N 0.34 0.68 -0.08 1.72 3.58 -0.76 0.17 116.42 122.08 2k4j h ASP 83 Ca 0.11 -0.22 -0.00 0.00 0.42 0.00 0.00 57.03 57.33 2k4j h ASP 83 Cb 0.02 -0.18 -0.00 0.00 1.72 0.00 0.00 39.33 40.89 2k4j h ASP 83 CO -0.02 0.73 0.04 0.58 -2.88 0.00 0.00 179.24 177.69 2k4j h VAL 84 N 0.60 1.07 0.74 2.25 2.07 -0.19 -0.60 116.25 122.19 2k4j h VAL 84 Ca 0.14 -0.21 -0.04 0.00 0.82 0.00 0.00 66.70 67.42 2k4j h VAL 84 Cb 0.31 1.08 0.01 0.00 -1.52 0.00 0.00 31.29 31.16 2k4j h VAL 84 CO -0.00 0.06 -0.35 0.40 0.02 0.00 0.00 177.57 177.70 2k4j h ILE 85 N 0.04 0.00 -0.19 4.57 1.08 -0.67 -0.60 117.51 121.74 2k4j h ILE 85 Ca 0.03 -0.22 -0.12 0.00 -0.39 0.00 0.00 64.86 64.16 2k4j h ILE 85 Cb 0.07 0.00 -0.01 0.00 -3.07 0.00 0.00 36.82 33.81 2k4j h ILE 85 CO -0.00 0.00 -0.40 0.40 -0.69 0.00 0.00 178.15 177.45 2k4j h ILE 86 N -1.20 1.30 -0.16 -0.67 1.08 -0.80 0.47 117.51 117.53 2k4j h ILE 86 Ca -0.10 -1.55 -0.01 0.00 -0.39 0.00 0.00 64.86 62.81 2k4j h ILE 86 Cb 0.76 1.60 -0.01 0.00 -3.07 0.00 0.00 36.82 36.10 2k4j h ILE 86 CO 0.17 0.48 0.08 1.23 -0.69 0.00 0.00 178.15 179.41 2k4j h GLY 87 N 1.12 0.25 2.00 5.37 0.00 -1.10 0.16 103.07 110.88 2k4j h GLY 87 Ca 0.03 -0.13 -0.15 0.00 0.00 0.00 0.00 47.33 47.08 2k4j h GLY 87 CO 0.07 0.12 -0.73 3.21 0.00 0.00 0.00 176.54 179.21 2k4j h ARG 88 N 0.13 0.00 0.13 4.80 3.08 -0.99 -1.02 114.38 120.51 2k4j h ARG 88 Ca 0.05 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.11 2k4j h ARG 88 Cb 0.13 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.17 2k4j h ARG 88 CO -0.01 0.73 -0.11 1.25 -1.07 0.00 0.00 179.97 180.76 2k4j h LEU 89 N 0.00 -0.30 -0.74 3.04 6.46 -0.84 -0.32 115.31 122.61 2k4j h LEU 89 Ca -0.01 0.03 0.10 0.00 -0.12 0.00 0.00 57.88 57.88 2k4j h LEU 89 Cb 1.49 0.10 -0.08 0.00 -0.73 0.00 0.00 40.66 41.44 2k4j h LEU 89 CO 0.09 -0.18 0.36 0.03 -0.62 0.00 0.00 178.44 178.13 2k4j h ARG 90 N -0.26 0.58 -0.12 1.25 2.47 -0.86 -0.66 114.38 116.78 2k4j h ARG 90 Ca 0.00 -0.04 0.01 0.00 -1.26 0.00 0.00 59.98 58.70 2k4j h ARG 90 Cb 0.24 -0.13 -0.01 0.00 -1.65 0.00 0.00 29.97 28.42 2k4j h ARG 90 CO -0.02 0.39 0.04 0.77 0.56 0.00 0.00 179.97 181.70 2k4j h SER 91 N 0.60 0.03 -0.72 7.04 0.02 -0.89 0.31 113.55 119.95 2k4j h SER 91 Ca 0.37 0.01 -0.00 0.00 -0.84 0.00 0.00 61.79 61.34 2k4j h SER 91 Cb 0.43 0.01 -0.04 0.00 0.14 0.00 0.00 62.40 62.94 2k4j h SER 91 CO -0.29 0.04 0.45 0.11 -1.14 0.00 0.00 176.83 176.00 2k4j h LYS 92 N 0.09 0.97 0.00 3.45 1.79 -0.42 -1.53 116.57 120.92 2k4j h LYS 92 Ca 0.05 -0.08 0.00 0.00 -2.18 0.00 0.00 60.65 58.44 2k4j h LYS 92 Cb 0.03 -0.21 0.00 0.00 -1.58 0.00 0.00 32.23 30.48 2k4j h LYS 92 CO -0.06 0.67 -0.26 0.44 -1.08 0.00 0.00 179.45 179.16 2k4j n ILE 93 N -4.55 0.20 0.07 1.86 -6.64 -0.31 -1.47 119.36 108.52 2k4j n ILE 93 Ca 0.06 -0.12 -0.23 0.00 -1.77 0.00 0.00 62.75 60.70 2k4j n ILE 93 Cb 0.04 -0.25 -0.15 0.00 -1.44 0.00 0.00 39.64 37.85 2k4j n ILE 93 CO 0.00 0.00 0.00 -0.08 -1.77 0.00 0.00 176.55 174.70 2k4j h GLU 94 N 0.00 0.38 -0.21 6.28 4.81 -0.83 -3.39 114.58 121.63 2k4j h GLU 94 Ca 0.00 -0.66 -0.08 0.00 -0.13 0.00 0.00 59.36 58.50 2k4j h GLU 94 Cb 0.60 0.24 -0.00 0.00 0.63 0.00 0.00 28.75 30.22 2k4j h GLU 94 CO 0.00 1.31 -0.17 -0.22 -0.73 0.00 0.00 179.01 179.20 2k4j h LYS 95 N -0.05 0.48 -7.24 1.92 3.64 -1.25 -3.44 116.57 110.62 2k4j h LYS 95 Ca -0.28 -0.24 -0.49 0.00 -1.27 0.00 0.00 60.65 58.37 2k4j h LYS 95 Cb 1.97 0.00 0.03 0.00 -0.41 0.00 0.00 32.23 33.83 2k4j h LYS 95 CO 0.17 0.81 0.38 -0.80 -2.27 0.00 0.00 179.45 177.74 2k4j s ASN 96 N -6.25 6.46 0.48 4.20 0.01 -0.54 -5.00 114.94 114.30 2k4j s ASN 96 Ca -0.13 1.48 0.28 0.00 -0.71 0.00 0.00 52.86 53.78 2k4j s ASN 96 Cb 0.07 -2.48 0.99 0.00 0.41 0.00 0.00 41.25 40.24 2k4j s ASN 96 CO 0.78 -0.69 1.85 1.55 -1.51 0.00 0.00 177.10 179.07 2k4j h PRO 97 N 0.43 0.00 -6.23 -0.60 0.13 -1.86 -3.45 132.00 120.42 2k4j h PRO 97 Ca -0.46 0.00 -0.55 0.00 -0.87 0.00 0.00 66.00 64.12 2k4j h PRO 97 Cb 1.19 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.33 2k4j h PRO 97 CO 0.62 0.11 1.32 0.21 -0.23 0.00 0.00 178.00 180.02 2k4j s LYS 98 N -3.57 3.80 0.18 0.86 2.36 -1.26 -5.02 119.74 117.09 2k4j s LYS 98 Ca 0.02 2.39 0.03 0.00 -2.55 0.00 0.00 55.97 55.87 2k4j s LYS 98 Cb 0.09 -4.23 -0.03 0.00 -1.05 0.00 0.00 37.83 32.61 2k4j s LYS 98 CO 0.61 -1.34 0.30 1.14 1.55 0.00 0.00 175.35 177.61 2k4j s GLN 99 N 5.09 3.42 0.80 4.03 -2.07 -1.26 -4.66 119.66 125.00 2k4j s GLN 99 Ca 0.92 -0.67 -0.11 0.00 -1.82 0.00 0.00 55.36 53.68 2k4j s GLN 99 Cb -0.39 -2.92 0.07 0.00 -1.09 0.00 0.00 33.01 28.68 2k4j s GLN 99 CO 0.39 0.49 1.10 -1.25 -1.32 0.00 0.00 175.29 174.69 2k4j s PRO 100 N -3.49 2.00 0.00 9.60 0.04 -1.26 -4.94 135.00 136.95 2k4j s PRO 100 Ca 0.34 1.18 0.00 0.00 0.04 0.00 0.00 61.00 62.56 2k4j s PRO 100 Cb -0.10 -1.87 0.00 0.00 0.04 0.00 0.00 34.50 32.57 2k4j s PRO 100 CO 0.28 -1.83 0.00 0.00 0.04 0.00 0.00 177.00 175.50 2k4j n GLN 101 N -3.65 0.00 -0.52 4.56 10.64 -1.26 -4.95 117.38 122.19 2k4j n GLN 101 Ca 0.09 0.00 0.08 0.00 -1.83 0.00 0.00 57.00 55.34 2k4j n GLN 101 Cb 0.53 0.00 0.30 0.00 -0.86 0.00 0.00 30.24 30.21 2k4j n GLN 101 CO 0.00 0.00 0.00 0.66 -1.83 0.00 0.00 177.06 175.89 2k4j n TYR 102 N -1.47 1.22 -4.46 2.61 4.02 -1.26 -4.90 117.16 112.93 2k4j n TYR 102 Ca 0.00 -0.68 -0.34 0.00 -0.01 0.00 0.00 57.90 56.87 2k4j n TYR 102 Cb 0.00 -0.26 -0.11 0.00 -0.02 0.00 0.00 39.34 38.95 2k4j n TYR 102 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 176.86 176.27 2k4j s ILE 103 N -2.10 3.98 0.04 -0.72 1.09 -1.26 -4.21 121.20 118.02 2k4j s ILE 103 Ca 0.44 -0.35 0.08 0.00 -1.10 0.00 0.00 60.65 59.71 2k4j s ILE 103 Cb 0.31 -2.69 -0.03 0.00 -1.06 0.00 0.00 42.46 38.99 2k4j s ILE 103 CO 0.17 0.56 -0.23 -0.63 -0.10 0.00 0.00 174.94 174.72 2k4j s ILE 104 N -0.40 1.84 -0.01 2.92 1.01 0.01 -5.00 121.20 121.55 2k4j s ILE 104 Ca 0.07 -1.23 -0.09 0.00 0.00 0.00 0.00 60.65 59.40 2k4j s ILE 104 Cb -0.12 -1.58 -0.05 0.00 0.01 0.00 0.00 42.46 40.72 2k4j s ILE 104 CO 0.02 0.30 0.29 -0.94 0.00 0.00 0.00 174.94 174.61 2k4j s SER 105 N -1.11 6.56 -0.31 3.58 1.04 -1.26 -0.15 113.70 122.06 2k4j s SER 105 Ca 0.09 0.66 0.02 0.00 0.48 0.00 0.00 55.95 57.20 2k4j s SER 105 Cb -0.09 -2.13 0.09 0.00 0.10 0.00 0.00 66.02 63.99 2k4j s SER 105 CO 0.02 0.29 0.05 -0.69 0.98 0.00 0.00 173.24 173.88 2k4j s VAL 106 N -1.20 1.68 0.00 5.02 1.01 0.54 -4.86 120.40 122.59 2k4j s VAL 106 Ca 0.25 -1.83 0.00 0.00 0.00 0.00 0.00 61.98 60.40 2k4j s VAL 106 Cb -0.14 -2.19 0.00 0.00 0.00 0.00 0.00 36.38 34.05 2k4j s VAL 106 CO 0.13 -0.53 0.00 0.54 0.00 0.00 0.00 175.10 175.24 2k4j n ARG 107 N 4.52 -0.56 -1.05 2.72 1.74 -1.26 -1.25 116.66 121.52 2k4j n ARG 107 Ca -0.01 0.14 -0.02 0.00 -0.77 0.00 0.00 57.85 57.19 2k4j n ARG 107 Cb 0.42 -4.27 -0.01 0.00 -1.02 0.00 0.00 32.46 27.59 2k4j n ARG 107 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2k4j n GLY 108 N -1.24 0.52 0.74 -0.13 0.00 -1.26 -4.92 105.19 98.91 2k4j n GLY 108 Ca 0.00 -0.33 -0.09 0.00 0.00 0.00 0.00 46.02 45.60 2k4j n GLY 108 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2k4j n ILE 109 N -2.82 0.47 -4.39 -0.61 5.41 -0.38 -5.02 119.36 112.02 2k4j n ILE 109 Ca -0.02 -0.11 -0.25 0.00 1.00 0.00 0.00 62.75 63.37 2k4j n ILE 109 Cb 0.12 -1.62 -0.10 0.00 -0.71 0.00 0.00 39.64 37.33 2k4j n ILE 109 CO 0.00 0.00 0.00 -0.83 0.00 0.00 0.00 176.55 175.72 2k4j s GLY 110 N -5.14 1.76 -0.17 7.39 0.00 -0.68 -3.85 107.32 106.64 2k4j s GLY 110 Ca -0.12 -1.69 -0.01 0.00 0.00 0.00 0.00 44.72 42.91 2k4j s GLY 110 CO 0.15 -1.74 -0.03 -0.19 0.00 0.00 0.00 173.10 171.29 2k4j s TYR 111 N -2.07 1.57 0.08 1.90 1.51 -0.43 -0.34 117.35 119.57 2k4j s TYR 111 Ca 0.27 -1.04 -0.30 0.00 -1.01 0.00 0.00 57.07 54.98 2k4j s TYR 111 Cb -0.07 -1.25 -0.06 0.00 -0.11 0.00 0.00 41.96 40.47 2k4j s TYR 111 CO 0.14 -0.61 1.14 0.21 -1.11 0.00 0.00 175.55 175.32 2k4j s LYS 112 N 1.68 4.49 0.18 -0.62 2.20 0.79 -0.81 119.74 127.65 2k4j s LYS 112 Ca 0.00 1.69 -0.04 0.00 -0.36 0.00 0.00 55.97 57.26 2k4j s LYS 112 Cb -0.16 -3.35 -0.03 0.00 -1.51 0.00 0.00 37.83 32.78 2k4j s LYS 112 CO -0.07 -0.14 0.19 -1.17 -0.36 0.00 0.00 175.35 173.80 2k4j s LEU 113 N 0.70 1.16 0.06 5.43 0.20 -0.29 -0.81 118.68 125.13 2k4j s LEU 113 Ca 0.55 -1.17 -0.05 0.00 0.69 0.00 0.00 54.13 54.15 2k4j s LEU 113 Cb -0.28 0.71 -0.02 0.00 -0.43 0.00 0.00 46.19 46.18 2k4j s LEU 113 CO 0.30 -0.86 0.08 -1.83 -0.29 0.00 0.00 176.35 173.75 2k4j s GLU 114 N -4.07 0.67 0.00 1.98 -1.05 -1.26 -2.17 118.70 112.80 2k4j s GLU 114 Ca 0.28 -0.96 0.30 0.00 -0.15 0.00 0.00 54.97 54.45 2k4j s GLU 114 Cb 0.05 0.26 1.56 0.00 -0.44 0.00 0.00 34.13 35.56 2k4j s GLU 114 CO 0.07 -0.17 2.03 0.98 0.95 0.00 0.00 175.26 179.12