#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k4j s SER 12 N 0.00 -0.41 0.16 1.61 1.04 -1.26 -5.06 113.70 109.78 2k4j s SER 12 Ca 0.00 0.09 0.21 0.00 0.48 0.00 0.00 55.95 56.74 2k4j s SER 12 Cb 0.00 0.41 -0.05 0.00 0.10 0.00 0.00 66.02 66.48 2k4j s SER 12 CO 0.00 -0.63 0.96 -0.62 0.98 0.00 0.00 173.24 173.93 2k4j n GLU 13 N -0.07 0.61 -1.57 4.02 -0.58 -1.26 -4.98 120.64 116.81 2k4j n GLU 13 Ca -0.11 0.12 -0.29 0.00 -0.42 0.00 0.00 57.16 56.46 2k4j n GLU 13 Cb 0.61 -1.80 0.16 0.00 -0.57 0.00 0.00 31.44 29.85 2k4j n GLU 13 CO 0.00 0.00 0.00 -1.21 -0.48 0.00 0.00 177.13 175.44 2k4j s GLU 14 N -3.30 0.62 0.00 3.49 8.01 -1.26 -5.12 118.70 121.14 2k4j s GLU 14 Ca -0.02 0.03 0.00 0.00 0.01 0.00 0.00 54.97 55.00 2k4j s GLU 14 Cb 0.10 -1.80 0.00 0.00 -4.31 0.00 0.00 34.13 28.11 2k4j s GLU 14 CO 0.80 -2.50 0.00 1.33 0.01 0.00 0.00 175.26 174.90 2k4j n VAL 15 N -3.93 0.00 -0.77 2.63 0.24 -1.26 -4.86 118.33 110.38 2k4j n VAL 15 Ca 0.10 0.00 -0.21 0.00 -2.04 0.00 0.00 64.34 62.19 2k4j n VAL 15 Cb 0.59 0.00 -0.03 0.00 -1.47 0.00 0.00 33.84 32.93 2k4j n VAL 15 CO 0.00 0.00 0.00 -1.54 -2.14 0.00 0.00 176.83 173.15 2k4j n SER 16 N 0.00 5.02 -4.75 -1.34 3.41 -1.26 -4.96 113.62 109.74 2k4j n SER 16 Ca 0.00 -2.31 -0.38 0.00 -0.26 0.00 0.00 58.87 55.92 2k4j n SER 16 Cb 0.00 -1.10 0.04 0.00 -0.26 0.00 0.00 64.21 62.88 2k4j n SER 16 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 2k4j s GLU 17 N 3.00 3.14 0.86 4.33 0.41 -1.26 -4.37 118.70 124.80 2k4j s GLU 17 Ca 0.43 2.14 -0.11 0.00 -0.41 0.00 0.00 54.97 57.01 2k4j s GLU 17 Cb 0.13 -2.21 0.11 0.00 -1.78 0.00 0.00 34.13 30.37 2k4j s GLU 17 CO -0.03 -1.16 1.09 -1.25 -0.49 0.00 0.00 175.26 173.42 2k4j s PRO 18 N -2.96 1.56 0.21 0.39 0.04 -1.26 -4.65 135.00 128.33 2k4j s PRO 18 Ca 0.72 0.82 0.08 0.00 0.04 0.00 0.00 61.00 62.66 2k4j s PRO 18 Cb -0.38 -1.84 -0.04 0.00 0.04 0.00 0.00 34.50 32.27 2k4j s PRO 18 CO 0.44 -2.03 0.05 0.20 0.04 0.00 0.00 177.00 175.70 2k4j s GLY 19 N -3.53 1.65 -0.02 0.56 0.00 -0.50 -4.98 107.32 100.50 2k4j s GLY 19 Ca 0.63 -1.44 -0.04 0.00 0.00 0.00 0.00 44.72 43.86 2k4j s GLY 19 CO 0.56 -1.47 0.10 0.99 0.00 0.00 0.00 173.10 173.28 2k4j s ASP 20 N -3.31 -0.03 -0.45 1.64 1.11 -1.26 -0.18 116.67 114.19 2k4j s ASP 20 Ca 0.30 0.01 0.05 0.00 0.18 0.00 0.00 52.55 53.08 2k4j s ASP 20 Cb -0.08 0.21 0.19 0.00 1.07 0.00 0.00 42.92 44.30 2k4j s ASP 20 CO 0.20 -0.17 0.76 0.00 1.18 0.00 0.00 175.17 177.14 2k4j s ALA 21 N -0.55 -2.61 0.00 5.23 0.00 -0.37 -4.98 121.76 118.47 2k4j s ALA 21 Ca -0.06 0.03 0.00 0.00 0.00 0.00 0.00 51.96 51.92 2k4j s ALA 21 Cb -0.04 -2.78 0.00 0.00 0.00 0.00 0.00 23.12 20.31 2k4j s ALA 21 CO 0.00 -2.28 0.00 0.09 0.00 0.00 0.00 175.76 173.57 2k4j n ASN 22 N 3.47 0.00 0.01 0.00 3.02 -1.26 -1.61 115.26 118.89 2k4j n ASN 22 Ca 0.14 0.00 0.13 0.00 -0.03 0.00 0.00 54.58 54.82 2k4j n ASN 22 Cb 0.58 0.00 0.44 0.00 -0.61 0.00 0.00 39.78 40.19 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 0.05 -4.33 2.41 2.08 -1.26 -4.88 119.36 113.44 2k4j n ILE 23 Ca 0.00 -0.03 -0.17 0.00 0.56 0.00 0.00 62.75 63.11 2k4j n ILE 23 Cb 0.00 -0.19 -0.10 0.00 -0.75 0.00 0.00 39.64 38.59 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 -3.01 1.57 -0.10 1.39 -0.71 -0.63 -1.03 117.98 115.45 2k4j s PHE 24 Ca 0.12 -0.77 -0.08 0.00 -1.04 0.00 0.00 56.93 55.16 2k4j s PHE 24 Cb 0.18 -0.84 0.03 0.00 -1.21 0.00 0.00 43.02 41.18 2k4j s PHE 24 CO 0.61 0.12 0.26 0.50 -1.34 0.00 0.00 175.22 175.37 2k4j s ARG 25 N -3.77 0.27 -0.14 1.99 3.52 -0.43 -1.24 118.95 119.15 2k4j s ARG 25 Ca 0.24 0.43 -0.00 0.00 -0.13 0.00 0.00 55.73 56.26 2k4j s ARG 25 Cb 0.03 0.05 -0.01 0.00 -1.56 0.00 0.00 34.95 33.46 2k4j s ARG 25 CO 0.06 -0.08 -0.13 0.08 -0.81 0.00 0.00 175.30 174.42 2k4j s VAL 26 N 0.57 3.00 -0.33 7.11 1.01 0.75 -0.43 120.40 132.09 2k4j s VAL 26 Ca -0.04 -0.67 -0.12 0.00 0.00 0.00 0.00 61.98 61.16 2k4j s VAL 26 Cb -0.05 -2.27 -0.02 0.00 0.00 0.00 0.00 36.38 34.04 2k4j s VAL 26 CO -0.03 0.51 0.22 -0.62 0.00 0.00 0.00 175.10 175.18 2k4j s ASP 27 N 0.55 5.94 0.09 3.32 -1.08 -0.55 -1.41 116.67 123.53 2k4j s ASP 27 Ca -0.08 -0.41 0.13 0.00 -0.52 0.00 0.00 52.55 51.67 2k4j s ASP 27 Cb -0.16 -2.10 -0.14 0.00 -1.46 0.00 0.00 42.92 39.06 2k4j s ASP 27 CO 0.04 -0.21 1.03 0.50 0.52 0.00 0.00 175.17 177.05 2k4j h LYS 28 N 8.45 0.00 -0.04 4.34 3.64 -1.83 -0.87 116.57 130.26 2k4j h LYS 28 Ca -0.32 0.00 -0.07 0.00 -1.27 0.00 0.00 60.65 58.99 2k4j h LYS 28 Cb 1.16 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.98 2k4j h LYS 28 CO 0.62 0.57 -0.27 -0.44 -2.27 0.00 0.00 179.45 177.67 2k4j h ASP 29 N 0.00 0.30 0.33 4.20 3.32 -1.92 -3.31 116.42 119.34 2k4j h ASP 29 Ca -0.12 -0.69 0.00 0.00 0.02 0.00 0.00 57.03 56.24 2k4j h ASP 29 Cb 1.71 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 41.17 2k4j h ASP 29 CO 0.08 0.94 -0.80 -0.24 -1.72 0.00 0.00 179.24 177.51 2k4j n SER 30 N -4.49 0.68 -2.18 6.45 2.88 -1.26 -5.02 113.62 110.68 2k4j n SER 30 Ca -0.09 -0.46 -0.05 0.00 -1.33 0.00 0.00 58.87 56.94 2k4j n SER 30 Cb 0.49 0.63 0.02 0.00 -0.75 0.00 0.00 64.21 64.60 2k4j n SER 30 CO 0.00 0.00 0.00 -1.14 -1.23 0.00 0.00 175.04 172.67 2k4j n ARG 31 N -1.63 -0.84 -4.26 -1.46 0.63 -0.82 -5.08 116.66 103.21 2k4j n ARG 31 Ca 0.04 0.43 -0.14 0.00 -0.92 0.00 0.00 57.85 57.26 2k4j n ARG 31 Cb 0.36 -3.21 -0.10 0.00 0.45 0.00 0.00 32.46 29.96 2k4j n ARG 31 CO 0.00 0.00 0.00 -1.21 -2.51 0.00 0.00 177.63 173.91 2k4j s GLU 32 N -3.47 1.27 -0.07 -0.14 2.02 -0.39 -4.63 118.70 113.29 2k4j s GLU 32 Ca 0.15 -1.67 -0.04 0.00 0.02 0.00 0.00 54.97 53.44 2k4j s GLU 32 Cb -0.02 -0.05 0.03 0.00 0.10 0.00 0.00 34.13 34.20 2k4j s GLU 32 CO 0.29 -0.31 0.17 0.54 0.02 0.00 0.00 175.26 175.97 2k4j s VAL 33 N -3.90 -0.04 -0.13 2.63 0.11 -0.00 -1.49 120.40 117.59 2k4j s VAL 33 Ca 0.36 0.13 -0.05 0.00 -2.93 0.00 0.00 61.98 59.49 2k4j s VAL 33 Cb 0.07 -0.26 -0.04 0.00 -1.53 0.00 0.00 36.38 34.62 2k4j s VAL 33 CO 0.11 0.05 0.04 -0.31 -3.33 0.00 0.00 175.10 171.67 2k4j s TYR 34 N 0.94 3.27 0.15 1.54 2.02 0.43 -1.62 117.35 124.07 2k4j s TYR 34 Ca -0.07 0.19 0.01 0.00 -0.37 0.00 0.00 57.07 56.83 2k4j s TYR 34 Cb -0.09 -1.92 -0.04 0.00 -0.40 0.00 0.00 41.96 39.52 2k4j s TYR 34 CO -0.05 0.40 0.30 1.41 -1.57 0.00 0.00 175.55 176.04 2k4j s MET 35 N -0.46 3.46 0.58 -0.62 1.75 0.14 -1.31 119.30 122.84 2k4j s MET 35 Ca 0.09 -0.49 0.29 0.00 -1.25 0.00 0.00 55.69 54.33 2k4j s MET 35 Cb -0.12 -2.94 1.47 0.00 2.84 0.00 0.00 34.83 36.07 2k4j s MET 35 CO 0.02 0.51 1.89 1.25 -0.65 0.00 0.00 175.02 178.04 2k4j h HIS 36 N 2.29 0.00 0.00 4.11 2.76 -1.45 -1.00 115.15 121.86 2k4j h HIS 36 Ca -0.48 0.00 -0.05 0.00 -2.20 0.00 0.00 60.37 57.64 2k4j h HIS 36 Cb 1.19 0.00 -0.01 0.00 1.55 0.00 0.00 27.41 30.14 2k4j h HIS 36 CO 0.55 0.00 -1.82 0.39 -1.30 0.00 0.00 177.93 175.76 2k4j n GLU 37 N -3.80 0.65 -3.57 5.26 -0.58 -1.26 -5.07 120.64 112.27 2k4j n GLU 37 Ca 0.10 -0.09 -0.11 0.00 -0.42 0.00 0.00 57.16 56.63 2k4j n GLU 37 Cb 0.71 -1.60 -0.05 0.00 -0.57 0.00 0.00 31.44 29.93 2k4j n GLU 37 CO 0.00 0.00 0.00 -1.59 -0.48 0.00 0.00 177.13 175.06 2k4j s LYS 38 N -3.33 0.65 -0.15 3.49 -2.85 -0.38 -5.11 119.74 112.06 2k4j s LYS 38 Ca -0.06 0.18 -0.06 0.00 -1.00 0.00 0.00 55.97 55.02 2k4j s LYS 38 Cb 0.12 0.31 -0.04 0.00 -2.06 0.00 0.00 37.83 36.16 2k4j s LYS 38 CO 0.87 -0.20 0.07 0.21 0.10 0.00 0.00 175.35 176.40 2k4j s LYS 39 N -1.07 3.68 0.08 1.78 2.20 -1.26 -0.68 119.74 124.47 2k4j s LYS 39 Ca -0.03 -0.30 0.01 0.00 -0.36 0.00 0.00 55.97 55.29 2k4j s LYS 39 Cb -0.01 -3.14 -0.04 0.00 -1.51 0.00 0.00 37.83 33.13 2k4j s LYS 39 CO 0.02 0.47 -0.06 -0.48 -0.36 0.00 0.00 175.35 174.95 2k4j s LEU 40 N -0.19 2.49 -0.28 5.43 0.05 -0.64 -4.99 118.68 120.56 2k4j s LEU 40 Ca 0.08 -0.98 0.21 0.00 0.05 0.00 0.00 54.13 53.49 2k4j s LEU 40 Cb -0.12 0.00 0.49 0.00 -2.05 0.00 0.00 46.19 44.51 2k4j s LEU 40 CO 0.01 -0.49 1.15 -0.90 -0.55 0.00 0.00 176.35 175.57 2k4j n ASP 41 N 0.08 1.12 -2.77 1.48 5.75 -1.26 -0.82 116.55 120.13 2k4j n ASP 41 Ca -0.13 -2.12 -0.10 0.00 -0.01 0.00 0.00 54.79 52.42 2k4j n ASP 41 Cb 0.61 -0.31 0.08 0.00 -1.03 0.00 0.00 41.12 40.46 2k4j n ASP 41 CO 0.00 0.00 0.00 -0.11 -0.11 0.00 0.00 177.20 176.98 2k4j n LEU 42 N -0.67 0.00 -4.89 -2.12 7.94 -1.26 -4.90 117.00 111.11 2k4j n LEU 42 Ca 0.04 -0.46 -0.29 0.00 -1.11 0.00 0.00 56.01 54.19 2k4j n LEU 42 Cb 0.81 -0.35 -0.00 0.00 0.53 0.00 0.00 43.42 44.41 2k4j n LEU 42 CO 0.06 -1.13 0.54 -0.89 -1.11 0.00 0.00 177.39 174.86 2k4j s THR 43 N -1.85 4.82 0.28 1.96 2.01 -1.26 -4.64 115.64 116.97 2k4j s THR 43 Ca 0.26 0.49 0.03 0.00 0.31 0.00 0.00 61.69 62.77 2k4j s THR 43 Cb -0.02 -3.86 0.28 0.00 0.01 0.00 0.00 72.50 68.92 2k4j s THR 43 CO 0.19 -0.93 1.71 -0.09 -0.69 0.00 0.00 174.62 174.81 2k4j h ARG 44 N 0.12 0.43 -0.50 4.92 1.12 -1.97 0.13 114.38 118.63 2k4j h ARG 44 Ca -0.46 -0.03 -0.09 0.00 -1.11 0.00 0.00 59.98 58.29 2k4j h ARG 44 Cb 1.20 -0.10 -0.02 0.00 -0.01 0.00 0.00 29.97 31.04 2k4j h ARG 44 CO 0.62 0.28 -0.05 0.00 -3.11 0.00 0.00 179.97 177.71 2k4j h ALA 45 N 1.68 0.67 -0.49 2.80 0.00 -1.93 -1.06 119.26 120.94 2k4j h ALA 45 Ca 0.54 -0.31 -0.11 0.00 0.00 0.00 0.00 54.91 55.03 2k4j h ALA 45 Cb 0.98 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.57 2k4j h ALA 45 CO -0.50 0.53 -0.12 0.93 0.00 0.00 0.00 179.25 180.09 2k4j h GLU 46 N 0.77 0.91 -0.01 0.00 3.07 -1.20 -1.51 114.58 116.61 2k4j h GLU 46 Ca 0.13 -0.33 0.03 0.00 -0.50 0.00 0.00 59.36 58.70 2k4j h GLU 46 Cb 0.59 -0.06 -0.04 0.00 -0.84 0.00 0.00 28.75 28.39 2k4j h GLU 46 CO 0.04 0.98 -0.25 -0.92 -1.40 0.00 0.00 179.01 177.45 2k4j h TYR 47 N 0.81 -0.67 -0.65 4.33 3.20 -0.91 -1.63 116.97 121.46 2k4j h TYR 47 Ca 0.13 0.02 0.12 0.00 3.14 0.00 0.00 58.73 62.14 2k4j h TYR 47 Cb 0.65 0.30 -0.09 0.00 1.54 0.00 0.00 36.73 39.13 2k4j h TYR 47 CO 0.04 -0.34 0.18 1.49 -1.64 0.00 0.00 178.16 177.89 2k4j h GLU 48 N -0.38 0.31 0.09 1.82 4.57 -0.36 0.30 114.58 120.93 2k4j h GLU 48 Ca 0.06 -0.02 -0.00 0.00 -1.18 0.00 0.00 59.36 58.22 2k4j h GLU 48 Cb 0.47 -0.07 0.00 0.00 -0.16 0.00 0.00 28.75 28.99 2k4j h GLU 48 CO -0.23 0.20 -0.04 0.82 -1.18 0.00 0.00 179.01 178.58 2k4j h ILE 49 N 0.32 1.03 -0.12 2.32 2.04 -1.19 -1.87 117.51 120.04 2k4j h ILE 49 Ca 0.34 -0.44 -0.17 0.00 1.00 0.00 0.00 64.86 65.59 2k4j h ILE 49 Cb 0.51 1.31 -0.01 0.00 -0.74 0.00 0.00 36.82 37.90 2k4j h ILE 49 CO -0.40 0.11 -0.64 0.25 0.00 0.00 0.00 178.15 177.47 2k4j h LEU 50 N -0.33 0.52 -0.34 1.44 6.46 -0.67 0.21 115.31 122.60 2k4j h LEU 50 Ca -0.01 -0.31 -0.02 0.00 -0.12 0.00 0.00 57.88 57.42 2k4j h LEU 50 Cb 0.28 -0.15 -0.02 0.00 -0.73 0.00 0.00 40.66 40.04 2k4j h LEU 50 CO 0.02 1.03 0.15 0.77 -0.62 0.00 0.00 178.44 179.78 2k4j h SER 51 N 0.33 0.45 -0.82 1.25 4.64 -1.04 -1.51 113.55 116.85 2k4j h SER 51 Ca -0.01 -0.15 -0.03 0.00 -0.47 0.00 0.00 61.79 61.13 2k4j h SER 51 Cb 1.19 -0.12 -0.04 0.00 -0.31 0.00 0.00 62.40 63.13 2k4j h SER 51 CO 0.11 0.48 0.41 0.25 -0.87 0.00 0.00 176.83 177.21 2k4j h LEU 52 N 0.40 1.06 -0.27 5.97 7.12 -1.07 -1.18 115.31 127.33 2k4j h LEU 52 Ca 0.11 -0.13 0.04 0.00 0.13 0.00 0.00 57.88 58.04 2k4j h LEU 52 Cb 0.16 -0.27 -0.04 0.00 -0.53 0.00 0.00 40.66 39.98 2k4j h LEU 52 CO -0.01 0.88 0.04 0.25 -0.13 0.00 0.00 178.44 179.47 2k4j h LEU 53 N 1.15 -0.02 -0.87 2.25 5.85 -0.45 0.20 115.31 123.42 2k4j h LEU 53 Ca 0.28 0.05 -0.01 0.00 0.84 0.00 0.00 57.88 59.04 2k4j h LEU 53 Cb 0.10 0.07 -0.04 0.00 0.37 0.00 0.00 40.66 41.16 2k4j h LEU 53 CO -0.04 0.02 0.50 0.40 -0.34 0.00 0.00 178.44 178.99 2k4j h ILE 54 N 0.13 1.25 -0.44 4.05 2.04 -1.06 0.21 117.51 123.69 2k4j h ILE 54 Ca 0.13 -0.57 -0.03 0.00 1.00 0.00 0.00 64.86 65.38 2k4j h ILE 54 Cb 0.14 0.05 -0.02 0.00 -0.74 0.00 0.00 36.82 36.25 2k4j h ILE 54 CO -0.18 0.27 0.15 -1.28 0.00 0.00 0.00 178.15 177.10 2k4j h SER 55 N 1.20 0.63 0.89 1.72 0.87 -0.25 -3.12 113.55 115.48 2k4j h SER 55 Ca 0.31 -0.20 0.00 0.00 -1.23 0.00 0.00 61.79 60.67 2k4j h SER 55 Cb -0.01 -0.16 0.00 0.00 -0.44 0.00 0.00 62.40 61.78 2k4j h SER 55 CO -0.05 0.66 -0.19 2.29 -0.53 0.00 0.00 176.83 179.00 2k4j n LYS 56 N -4.57 0.05 0.00 2.24 2.85 0.61 -5.04 118.16 114.29 2k4j n LYS 56 Ca 0.00 0.03 0.00 0.00 -1.05 0.00 0.00 58.31 57.29 2k4j n LYS 56 Cb 0.18 -1.54 0.00 0.00 -0.65 0.00 0.00 35.03 33.01 2k4j n LYS 56 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 177.40 178.98 2k4j n LYS 57 N -1.62 0.00 0.06 -1.58 5.02 0.05 -4.97 118.16 115.14 2k4j n LYS 57 Ca 0.06 0.00 -0.12 0.00 -2.02 0.00 0.00 58.31 56.23 2k4j n LYS 57 Cb 0.35 0.00 -0.06 0.00 -0.02 0.00 0.00 35.03 35.31 2k4j n LYS 57 CO 0.00 0.00 0.00 0.78 -0.52 0.00 0.00 177.40 177.66 2k4j h GLY 58 N 0.00 -0.62 0.00 0.72 0.00 -1.75 -3.43 103.07 97.98 2k4j h GLY 58 Ca 0.00 0.43 0.00 0.00 0.00 0.00 0.00 47.33 47.76 2k4j h GLY 58 CO 0.00 -0.24 0.00 2.98 0.00 0.00 0.00 176.54 179.28 2k4j n TYR 59 N -5.43 -0.22 -4.53 5.60 9.36 -0.85 -4.23 117.16 116.85 2k4j n TYR 59 Ca -0.05 0.00 -0.33 0.00 3.32 0.00 0.00 57.90 60.83 2k4j n TYR 59 Cb 0.34 0.12 -0.14 0.00 -0.63 0.00 0.00 39.34 39.03 2k4j n TYR 59 CO 0.00 0.00 0.00 0.54 0.22 0.00 0.00 176.86 177.62 2k4j s VAL 60 N 0.00 3.20 -0.46 2.97 0.11 -1.26 -1.22 120.40 123.74 2k4j s VAL 60 Ca 0.00 -0.60 -0.14 0.00 -2.93 0.00 0.00 61.98 58.31 2k4j s VAL 60 Cb 0.00 -2.37 0.07 0.00 -1.53 0.00 0.00 36.38 32.54 2k4j s VAL 60 CO 0.00 0.50 0.37 0.12 -3.33 0.00 0.00 175.10 172.76 2k4j s PHE 61 N 0.60 3.26 0.12 1.54 5.36 0.38 -4.93 117.98 124.31 2k4j s PHE 61 Ca -0.06 -0.99 0.03 0.00 -0.96 0.00 0.00 56.93 54.96 2k4j s PHE 61 Cb -0.15 -3.08 -0.04 0.00 -0.34 0.00 0.00 43.02 39.40 2k4j s PHE 61 CO 0.03 -0.79 -0.09 -1.12 -1.46 0.00 0.00 175.22 171.79 2k4j s SER 62 N 2.45 1.52 0.24 6.13 0.01 -1.26 -1.61 113.70 121.18 2k4j s SER 62 Ca 0.04 -0.97 -0.15 0.00 1.31 0.00 0.00 55.95 56.17 2k4j s SER 62 Cb -0.24 0.03 0.29 0.00 0.21 0.00 0.00 66.02 66.31 2k4j s SER 62 CO 0.06 -0.36 1.56 0.03 0.41 0.00 0.00 173.24 174.94 2k4j h ARG 63 N 2.98 -0.01 0.43 12.44 3.08 -1.90 0.16 114.38 131.57 2k4j h ARG 63 Ca -0.36 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 59.67 2k4j h ARG 63 Cb 1.18 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.24 2k4j h ARG 63 CO 0.62 -0.00 -0.20 1.49 -1.07 0.00 0.00 179.97 180.80 2k4j h GLU 64 N -0.01 -0.55 -0.93 0.04 4.81 -1.87 -1.46 114.58 114.61 2k4j h GLU 64 Ca 0.37 0.04 0.06 0.00 -0.13 0.00 0.00 59.36 59.70 2k4j h GLU 64 Cb 0.62 0.13 -0.06 0.00 0.63 0.00 0.00 28.75 30.07 2k4j h GLU 64 CO -0.99 -0.26 0.59 0.77 -0.73 0.00 0.00 179.01 178.40 2k4j h SER 65 N -0.81 0.94 0.09 1.04 0.02 -1.80 -0.11 113.55 112.93 2k4j h SER 65 Ca -0.06 0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.91 2k4j h SER 65 Cb 0.54 -0.19 -0.01 0.00 0.14 0.00 0.00 62.40 62.89 2k4j h SER 65 CO 0.10 0.60 -0.09 0.40 -1.14 0.00 0.00 176.83 176.69 2k4j h ILE 66 N 1.08 0.78 0.00 3.27 1.08 -0.69 -0.64 117.51 122.38 2k4j h ILE 66 Ca 0.40 0.00 -0.01 0.00 -0.39 0.00 0.00 64.86 64.86 2k4j h ILE 66 Cb 0.17 0.78 -0.00 0.00 -3.07 0.00 0.00 36.82 34.70 2k4j h ILE 66 CO -0.17 0.00 -0.06 0.00 -0.69 0.00 0.00 178.15 177.22 2k4j h ALA 67 N 0.69 1.23 0.07 1.87 0.00 -0.63 0.11 119.26 122.60 2k4j h ALA 67 Ca 0.01 -0.06 -0.12 0.00 0.00 0.00 0.00 54.91 54.74 2k4j h ALA 67 Cb 0.20 -0.01 0.01 0.00 0.00 0.00 0.00 17.79 18.00 2k4j h ALA 67 CO -0.03 0.08 -0.50 0.82 0.00 0.00 0.00 179.25 179.62 2k4j h ILE 68 N 0.00 1.58 0.01 0.00 2.04 -0.70 -3.22 117.51 117.22 2k4j h ILE 68 Ca -0.00 -2.36 -0.34 0.00 1.00 0.00 0.00 64.86 63.17 2k4j h ILE 68 Cb 0.24 3.13 -0.06 0.00 -0.74 0.00 0.00 36.82 39.39 2k4j h ILE 68 CO 0.01 0.65 -2.08 -0.62 0.00 0.00 0.00 178.15 176.11 2k4j n GLU 69 N -4.31 0.67 -0.07 2.37 4.71 -0.28 -4.48 120.64 119.25 2k4j n GLU 69 Ca -0.12 0.15 -0.07 0.00 -0.01 0.00 0.00 57.16 57.11 2k4j n GLU 69 Cb 0.67 -1.65 -0.04 0.00 -1.01 0.00 0.00 31.44 29.41 2k4j n GLU 69 CO 0.00 0.00 0.00 1.03 0.09 0.00 0.00 177.13 178.25 2k4j h SER 70 N 0.00 0.00 -0.77 1.62 0.87 -1.02 -3.39 113.55 110.86 2k4j h SER 70 Ca -0.43 -0.22 -0.33 0.00 -1.23 0.00 0.00 61.79 59.58 2k4j h SER 70 Cb 2.12 0.00 -0.13 0.00 -0.44 0.00 0.00 62.40 63.95 2k4j h SER 70 CO 0.05 0.82 -0.30 1.21 -0.53 0.00 0.00 176.83 178.08 2k4j n GLU 71 N -4.64 -1.43 0.25 2.24 2.13 -1.18 -4.88 120.64 113.13 2k4j n GLU 71 Ca -0.09 1.06 0.14 0.00 0.66 0.00 0.00 57.16 58.93 2k4j n GLU 71 Cb 0.27 -5.39 0.59 0.00 0.27 0.00 0.00 31.44 27.18 2k4j n GLU 71 CO 0.00 0.00 0.00 1.03 -0.41 0.00 0.00 177.13 177.75 2k4j h SER 72 N 0.00 0.00 -4.04 4.31 0.87 -1.89 -3.43 113.55 109.38 2k4j h SER 72 Ca -0.33 0.00 -0.69 0.00 -1.23 0.00 0.00 61.79 59.54 2k4j h SER 72 Cb 1.20 0.00 -0.27 0.00 -0.44 0.00 0.00 62.40 62.89 2k4j h SER 72 CO 0.48 0.09 -0.82 -0.63 -0.53 0.00 0.00 176.83 175.43 2k4j s ILE 73 N -3.68 2.62 0.03 2.23 -1.09 -1.26 -5.09 121.20 114.96 2k4j s ILE 73 Ca 0.01 -0.87 -0.25 0.00 -2.23 0.00 0.00 60.65 57.30 2k4j s ILE 73 Cb 0.10 -2.00 -0.17 0.00 -1.58 0.00 0.00 42.46 38.80 2k4j s ILE 73 CO 0.58 0.57 1.44 0.78 -1.23 0.00 0.00 174.94 177.09 2k4j h ASN 74 N 5.74 -0.16 -3.93 3.58 4.21 -2.00 -3.45 115.58 119.58 2k4j h ASN 74 Ca -0.39 -0.20 -0.52 0.00 1.21 0.00 0.00 56.30 56.40 2k4j h ASN 74 Cb 1.16 0.04 0.07 0.00 -1.12 0.00 0.00 38.32 38.47 2k4j h ASN 74 CO 0.50 0.11 0.57 -2.16 -1.29 0.00 0.00 177.43 175.16 2k4j s PRO 75 N -5.16 4.10 0.22 0.81 0.04 -1.26 -4.93 135.00 128.82 2k4j s PRO 75 Ca -0.15 2.04 0.21 0.00 0.04 0.00 0.00 61.00 63.15 2k4j s PRO 75 Cb 0.03 -2.81 0.92 0.00 0.04 0.00 0.00 34.50 32.68 2k4j s PRO 75 CO 0.63 -0.34 1.65 -0.85 0.04 0.00 0.00 177.00 178.13 2k4j n GLU 76 N 0.29 0.15 0.09 4.56 0.28 -1.26 -1.23 120.64 123.52 2k4j n GLU 76 Ca 0.03 0.42 0.12 0.00 -0.16 0.00 0.00 57.16 57.57 2k4j n GLU 76 Cb 0.44 -1.81 0.13 0.00 1.43 0.00 0.00 31.44 31.63 2k4j n GLU 76 CO 0.00 0.00 0.00 0.66 -0.16 0.00 0.00 177.13 177.63 2k4j h SER 77 N 0.00 0.00 -5.25 -1.84 4.64 -1.92 -3.41 113.55 105.78 2k4j h SER 77 Ca 0.00 -0.13 -0.17 0.00 -0.47 0.00 0.00 61.79 61.02 2k4j h SER 77 Cb 0.30 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 62.32 2k4j h SER 77 CO 0.00 0.06 -0.26 -1.54 -0.87 0.00 0.00 176.83 174.22 2k4j n SER 78 N -2.36 0.09 -0.21 4.97 3.41 -0.37 -4.81 113.62 114.34 2k4j n SER 78 Ca 0.02 -0.35 0.00 0.00 -0.26 0.00 0.00 58.87 58.29 2k4j n SER 78 Cb 0.48 -0.44 0.12 0.00 -0.26 0.00 0.00 64.21 64.11 2k4j n SER 78 CO 0.00 0.00 0.00 -1.13 -0.16 0.00 0.00 175.04 173.75 2k4j h ASN 79 N 0.12 0.29 1.22 4.04 -0.73 -1.95 0.82 115.58 119.40 2k4j h ASN 79 Ca -0.18 0.07 -0.06 0.00 1.87 0.00 0.00 56.30 58.01 2k4j h ASN 79 Cb 0.38 0.04 -0.01 0.00 0.27 0.00 0.00 38.32 39.00 2k4j h ASN 79 CO 0.21 0.17 -0.28 0.11 -0.37 0.00 0.00 177.43 177.26 2k4j h LYS 80 N 0.46 0.00 0.60 6.67 6.56 -1.99 -1.53 116.57 127.35 2k4j h LYS 80 Ca 0.32 0.00 -0.03 0.00 -1.06 0.00 0.00 60.65 59.88 2k4j h LYS 80 Cb 0.38 0.00 0.01 0.00 -0.57 0.00 0.00 32.23 32.04 2k4j h LYS 80 CO -0.30 0.28 -0.29 1.03 -2.06 0.00 0.00 179.45 178.11 2k4j h SER 81 N 0.00 -0.69 -0.41 0.86 0.87 -1.26 -1.29 113.55 111.63 2k4j h SER 81 Ca -0.00 -0.01 0.01 0.00 -1.23 0.00 0.00 61.79 60.55 2k4j h SER 81 Cb 0.97 0.18 -0.02 0.00 -0.44 0.00 0.00 62.40 63.09 2k4j h SER 81 CO 0.04 -0.42 0.27 0.40 -0.53 0.00 0.00 176.83 176.59 2k4j h ILE 82 N -0.91 1.10 -0.42 2.23 5.03 -1.07 0.22 117.51 123.68 2k4j h ILE 82 Ca -0.08 -0.19 -0.01 0.00 -0.12 0.00 0.00 64.86 64.46 2k4j h ILE 82 Cb 0.66 0.50 -0.02 0.00 -3.03 0.00 0.00 36.82 34.93 2k4j h ILE 82 CO 0.14 0.10 0.24 -0.78 -0.68 0.00 0.00 178.15 177.16 2k4j h ASP 83 N 0.55 0.52 -0.71 1.72 3.58 -1.26 0.37 116.42 121.19 2k4j h ASP 83 Ca 0.15 -0.08 -0.04 0.00 0.42 0.00 0.00 57.03 57.48 2k4j h ASP 83 Cb -0.05 -0.13 -0.03 0.00 1.72 0.00 0.00 39.33 40.84 2k4j h ASP 83 CO -0.03 0.45 0.29 0.58 -2.88 0.00 0.00 179.24 177.64 2k4j h VAL 84 N 0.55 1.25 0.16 2.25 2.07 0.10 -0.90 116.25 121.73 2k4j h VAL 84 Ca 0.15 -0.77 -0.01 0.00 0.82 0.00 0.00 66.70 66.89 2k4j h VAL 84 Cb 0.04 0.43 0.00 0.00 -1.52 0.00 0.00 31.29 30.24 2k4j h VAL 84 CO -0.03 0.31 -0.08 0.40 0.02 0.00 0.00 177.57 178.19 2k4j h ILE 85 N 1.01 0.94 -0.03 4.57 1.08 -0.26 0.11 117.51 124.92 2k4j h ILE 85 Ca 0.24 -0.99 -0.00 0.00 -0.39 0.00 0.00 64.86 63.71 2k4j h ILE 85 Cb 0.21 1.49 -0.00 0.00 -3.07 0.00 0.00 36.82 35.45 2k4j h ILE 85 CO -0.02 0.21 0.02 0.40 -0.69 0.00 0.00 178.15 178.07 2k4j h ILE 86 N -0.74 1.09 -0.21 -0.67 2.04 -1.04 -1.48 117.51 116.49 2k4j h ILE 86 Ca -0.02 -0.26 -0.01 0.00 1.00 0.00 0.00 64.86 65.57 2k4j h ILE 86 Cb 0.52 1.20 -0.01 0.00 -0.74 0.00 0.00 36.82 37.79 2k4j h ILE 86 CO 0.04 0.07 0.08 1.23 0.00 0.00 0.00 178.15 179.57 2k4j h GLY 87 N -0.05 0.33 1.83 5.37 0.00 -1.16 -0.62 103.07 108.78 2k4j h GLY 87 Ca 0.01 -0.18 -0.18 0.00 0.00 0.00 0.00 47.33 46.98 2k4j h GLY 87 CO -0.00 0.17 -0.93 -0.09 0.00 0.00 0.00 176.54 175.68 2k4j h ARG 88 N 0.18 0.00 0.29 4.80 2.43 -0.82 0.50 114.38 121.77 2k4j h ARG 88 Ca 0.07 0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.23 2k4j h ARG 88 Cb 0.17 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.72 2k4j h ARG 88 CO -0.01 0.74 -0.14 1.25 -1.51 0.00 0.00 179.97 180.31 2k4j h LEU 89 N 0.00 -0.33 -0.44 3.80 6.46 -1.27 -0.85 115.31 122.68 2k4j h LEU 89 Ca -0.04 -0.04 0.08 0.00 -0.12 0.00 0.00 57.88 57.76 2k4j h LEU 89 Cb 1.65 0.08 -0.07 0.00 -0.73 0.00 0.00 40.66 41.59 2k4j h LEU 89 CO 0.10 -0.17 -0.02 -0.09 -0.62 0.00 0.00 178.44 177.64 2k4j h ARG 90 N -0.46 0.08 0.05 1.25 2.43 -1.00 -0.49 114.38 116.24 2k4j h ARG 90 Ca -0.04 -0.01 0.02 0.00 -0.81 0.00 0.00 59.98 59.15 2k4j h ARG 90 Cb 0.35 -0.02 -0.03 0.00 -0.42 0.00 0.00 29.97 29.85 2k4j h ARG 90 CO 0.06 0.06 -0.21 0.77 -1.51 0.00 0.00 179.97 179.14 2k4j h SER 91 N 0.09 -0.61 0.06 -3.80 0.02 -0.88 0.39 113.55 108.81 2k4j h SER 91 Ca 0.22 0.08 -0.04 0.00 -0.84 0.00 0.00 61.79 61.21 2k4j h SER 91 Cb 0.33 0.24 -0.01 0.00 0.14 0.00 0.00 62.40 63.10 2k4j h SER 91 CO -0.39 -0.29 -0.12 0.11 -1.14 0.00 0.00 176.83 175.00 2k4j h LYS 92 N -0.37 0.15 0.00 3.45 1.57 -0.43 -0.36 116.57 120.58 2k4j h LYS 92 Ca 0.04 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.79 2k4j h LYS 92 Cb 0.42 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.71 2k4j h LYS 92 CO -0.16 0.28 -0.39 0.44 -0.57 0.00 0.00 179.45 179.05 2k4j n ILE 93 N -4.32 0.26 0.10 1.86 -6.64 -0.26 -1.52 119.36 108.83 2k4j n ILE 93 Ca -0.01 -0.17 -0.20 0.00 -1.77 0.00 0.00 62.75 60.60 2k4j n ILE 93 Cb 0.24 -0.17 -0.15 0.00 -1.44 0.00 0.00 39.64 38.12 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 0.37 -0.16 6.28 4.81 -0.41 -3.38 114.58 122.09 2k4j h GLU 94 Ca 0.00 -0.63 -0.05 0.00 -0.13 0.00 0.00 59.36 58.55 2k4j h GLU 94 Cb 0.65 0.23 -0.00 0.00 0.63 0.00 0.00 28.75 30.26 2k4j h GLU 94 CO 0.00 1.27 -0.11 0.87 -0.73 0.00 0.00 179.01 180.31 2k4j h LYS 95 N 0.10 0.36 -7.35 1.92 1.79 -1.07 -3.45 116.57 108.88 2k4j h LYS 95 Ca -0.24 -0.17 -0.51 0.00 -2.18 0.00 0.00 60.65 57.54 2k4j h LYS 95 Cb 2.07 -0.00 0.07 0.00 -1.58 0.00 0.00 32.23 32.79 2k4j h LYS 95 CO 0.21 0.71 0.40 -0.80 -1.08 0.00 0.00 179.45 178.89 2k4j s ASN 96 N -6.07 5.97 0.47 0.86 0.01 -0.58 -5.00 114.94 110.60 2k4j s ASN 96 Ca -0.14 1.49 0.30 0.00 -0.71 0.00 0.00 52.86 53.80 2k4j s ASN 96 Cb 0.06 -2.48 1.08 0.00 0.41 0.00 0.00 41.25 40.31 2k4j s ASN 96 CO 0.75 -1.04 1.86 1.55 -1.51 0.00 0.00 177.10 178.70 2k4j h PRO 97 N -0.40 0.00 -6.20 -0.60 0.13 -1.87 -3.45 132.00 119.61 2k4j h PRO 97 Ca -0.44 0.00 -0.56 0.00 -0.87 0.00 0.00 66.00 64.13 2k4j h PRO 97 Cb 1.20 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.33 2k4j h PRO 97 CO 0.60 0.00 1.33 0.21 -0.23 0.00 0.00 178.00 179.91 2k4j s LYS 98 N -3.49 3.70 0.23 0.86 2.36 -1.26 -5.02 119.74 117.12 2k4j s LYS 98 Ca 0.03 2.29 0.04 0.00 -2.55 0.00 0.00 55.97 55.78 2k4j s LYS 98 Cb 0.08 -4.24 -0.03 0.00 -1.05 0.00 0.00 37.83 32.60 2k4j s LYS 98 CO 0.55 -1.46 0.36 1.14 1.55 0.00 0.00 175.35 177.49 2k4j s GLN 99 N 5.25 3.44 0.74 4.03 -2.07 -1.26 -4.73 119.66 125.06 2k4j s GLN 99 Ca 0.92 -0.72 -0.11 0.00 -1.82 0.00 0.00 55.36 53.63 2k4j s GLN 99 Cb -0.37 -2.89 0.04 0.00 -1.09 0.00 0.00 33.01 28.70 2k4j s GLN 99 CO 0.38 0.43 1.07 -1.25 -1.32 0.00 0.00 175.29 174.60 2k4j s PRO 100 N -3.90 2.56 0.00 9.60 0.04 -1.26 -4.96 135.00 137.08 2k4j s PRO 100 Ca 0.34 0.89 0.00 0.00 0.04 0.00 0.00 61.00 62.28 2k4j s PRO 100 Cb -0.09 -1.95 0.00 0.00 0.04 0.00 0.00 34.50 32.50 2k4j s PRO 100 CO 0.29 -1.35 0.00 0.00 0.04 0.00 0.00 177.00 175.98 2k4j n GLN 101 N -3.29 0.00 -0.89 4.56 10.64 -1.26 -4.89 117.38 122.25 2k4j n GLN 101 Ca 0.08 0.00 -0.00 0.00 -1.83 0.00 0.00 57.00 55.24 2k4j n GLN 101 Cb 0.54 -0.00 0.32 0.00 -0.86 0.00 0.00 30.24 30.24 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 -1.07 2.11 -4.60 2.61 4.01 -1.26 -4.86 117.16 114.10 2k4j n TYR 102 Ca 0.00 -0.91 -0.25 0.00 -0.16 0.00 0.00 57.90 56.58 2k4j n TYR 102 Cb 0.00 -0.57 -0.17 0.00 -0.31 0.00 0.00 39.34 38.29 2k4j n TYR 102 CO 0.00 0.00 0.00 0.42 -0.46 0.00 0.00 176.86 176.82 2k4j s ILE 103 N -2.69 1.16 -0.01 -0.72 1.01 -1.26 -3.49 121.20 115.20 2k4j s ILE 103 Ca 0.50 -0.49 0.06 0.00 0.00 0.00 0.00 60.65 60.72 2k4j s ILE 103 Cb 0.39 -1.06 -0.02 0.00 0.01 0.00 0.00 42.46 41.78 2k4j s ILE 103 CO 0.13 0.36 -0.21 -0.63 0.00 0.00 0.00 174.94 174.60 2k4j s ILE 104 N 0.66 1.63 0.07 2.92 1.01 -0.01 -4.94 121.20 122.54 2k4j s ILE 104 Ca -0.15 -0.89 -0.26 0.00 0.00 0.00 0.00 60.65 59.35 2k4j s ILE 104 Cb -0.16 -1.35 -0.06 0.00 0.01 0.00 0.00 42.46 40.90 2k4j s ILE 104 CO 0.04 0.45 0.82 -0.94 0.00 0.00 0.00 174.94 175.31 2k4j s SER 105 N -0.50 7.31 -0.47 3.58 1.04 -1.26 -0.43 113.70 122.97 2k4j s SER 105 Ca 0.08 1.56 0.06 0.00 0.48 0.00 0.00 55.95 58.13 2k4j s SER 105 Cb -0.08 -2.50 0.22 0.00 0.10 0.00 0.00 66.02 63.76 2k4j s SER 105 CO -0.01 0.01 0.50 0.52 0.98 0.00 0.00 173.24 175.25 2k4j n VAL 106 N 2.69 -0.15 -1.66 5.02 0.31 0.15 -4.90 118.33 119.79 2k4j n VAL 106 Ca -0.01 -4.12 -0.47 0.00 -0.01 0.00 0.00 64.34 59.73 2k4j n VAL 106 Cb 0.50 -1.92 -0.04 0.00 -0.91 0.00 0.00 33.84 31.47 2k4j n VAL 106 CO 0.00 0.00 0.00 -1.14 -1.32 0.00 0.00 176.83 174.37 2k4j n ARG 107 N 1.78 2.04 0.00 5.55 0.63 -1.26 -1.25 116.66 124.14 2k4j n ARG 107 Ca 0.25 0.74 0.00 0.00 -0.92 0.00 0.00 57.85 57.92 2k4j n ARG 107 Cb 0.48 -2.50 0.00 0.00 0.45 0.00 0.00 32.46 30.89 2k4j n ARG 107 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2k4j n GLY 108 N 3.48 2.60 0.17 5.14 0.00 -1.26 -4.82 105.19 110.51 2k4j n GLY 108 Ca 0.18 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.16 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 -2.00 0.28 0.00 -0.61 5.41 -0.50 -5.06 119.36 116.87 2k4j n ILE 109 Ca 0.00 -0.10 0.00 0.00 1.00 0.00 0.00 62.75 63.65 2k4j n ILE 109 Cb 0.00 -0.83 0.00 0.00 -0.71 0.00 0.00 39.64 38.10 2k4j n ILE 109 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2k4j n GLY 110 N 3.16 0.37 3.36 7.39 0.00 -0.38 -4.40 105.19 114.68 2k4j n GLY 110 Ca -0.09 -1.30 -0.32 0.00 0.00 0.00 0.00 46.02 44.30 2k4j n GLY 110 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2k4j s TYR 111 N -4.00 2.66 0.02 1.61 1.51 -0.63 -0.68 117.35 117.85 2k4j s TYR 111 Ca 0.00 -0.55 -0.26 0.00 -1.01 0.00 0.00 57.07 55.26 2k4j s TYR 111 Cb 0.00 -1.71 -0.05 0.00 -0.11 0.00 0.00 41.96 40.10 2k4j s TYR 111 CO 0.00 -0.11 0.79 0.21 -1.11 0.00 0.00 175.55 175.33 2k4j s LYS 112 N -0.11 4.51 0.20 -0.62 2.20 0.43 -0.47 119.74 125.88 2k4j s LYS 112 Ca -0.03 1.09 0.05 0.00 -0.36 0.00 0.00 55.97 56.72 2k4j s LYS 112 Cb -0.14 -3.39 -0.05 0.00 -1.51 0.00 0.00 37.83 32.74 2k4j s LYS 112 CO 0.04 0.19 -0.06 -1.17 -0.36 0.00 0.00 175.35 173.99 2k4j s LEU 113 N 0.25 2.38 0.00 5.43 0.20 -0.36 -0.83 118.68 125.76 2k4j s LEU 113 Ca 0.40 -1.12 -0.05 0.00 0.69 0.00 0.00 54.13 54.06 2k4j s LEU 113 Cb -0.20 -0.37 -0.00 0.00 -0.43 0.00 0.00 46.19 45.19 2k4j s LEU 113 CO 0.23 -0.40 0.08 -0.70 -0.29 0.00 0.00 176.35 175.28 2k4j s GLU 114 N -3.79 0.40 0.00 1.98 2.56 -1.23 -2.01 118.70 116.61 2k4j s GLU 114 Ca 0.23 -0.41 0.31 0.00 0.00 0.00 0.00 54.97 55.11 2k4j s GLU 114 Cb 0.04 0.16 1.80 0.00 2.00 0.00 0.00 34.13 38.13 2k4j s GLU 114 CO 0.06 -0.09 2.17 0.98 -0.56 0.00 0.00 175.26 177.82