#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 4.68 -0.00 1.61 0.15 -1.26 -5.11 113.70 113.77 2k4j s SER 12 Ca 0.00 1.16 -0.28 0.00 0.70 0.00 0.00 55.95 57.52 2k4j s SER 12 Cb 0.00 -1.87 0.10 0.00 -1.71 0.00 0.00 66.02 62.54 2k4j s SER 12 CO 0.00 -1.83 0.87 -0.70 1.20 0.00 0.00 173.24 172.77 2k4j s GLU 13 N -5.28 0.85 -1.21 5.44 -6.30 -1.26 -5.07 118.70 105.88 2k4j s GLU 13 Ca 0.60 -0.28 -0.09 0.00 -2.50 0.00 0.00 54.97 52.70 2k4j s GLU 13 Cb -0.13 0.39 -0.07 0.00 0.00 0.00 0.00 34.13 34.32 2k4j s GLU 13 CO 0.53 -0.36 2.41 0.39 0.02 0.00 0.00 175.26 178.25 2k4j n GLU 14 N -0.17 2.68 -0.94 4.30 1.02 -1.26 -4.92 120.64 121.36 2k4j n GLU 14 Ca -0.10 -1.86 -0.23 0.00 -0.02 0.00 0.00 57.16 54.96 2k4j n GLU 14 Cb 0.62 -2.69 0.18 0.00 -0.02 0.00 0.00 31.44 29.53 2k4j n GLU 14 CO 0.00 0.00 0.00 1.33 1.18 0.00 0.00 177.13 179.64 2k4j n VAL 15 N 4.22 0.00 -1.66 2.62 0.24 -1.26 -4.97 118.33 117.52 2k4j n VAL 15 Ca 0.58 -0.45 -0.49 0.00 -2.04 0.00 0.00 64.34 61.94 2k4j n VAL 15 Cb 0.21 -1.27 -0.05 0.00 -1.47 0.00 0.00 33.84 31.26 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 -4.27 2.79 -4.73 -1.34 3.41 -1.26 -4.93 113.62 103.29 2k4j n SER 16 Ca 0.12 1.06 -0.41 0.00 -0.26 0.00 0.00 58.87 59.37 2k4j n SER 16 Cb 0.45 -1.32 -0.03 0.00 -0.26 0.00 0.00 64.21 63.04 2k4j n SER 16 CO 0.00 0.00 0.00 -0.70 -0.16 0.00 0.00 175.04 174.18 2k4j s GLU 17 N 2.00 4.49 0.85 4.33 2.56 -1.26 -4.50 118.70 127.17 2k4j s GLU 17 Ca 0.86 1.81 -0.11 0.00 0.00 0.00 0.00 54.97 57.53 2k4j s GLU 17 Cb -0.79 -3.28 0.10 0.00 2.00 0.00 0.00 34.13 32.16 2k4j s GLU 17 CO 0.47 -0.11 1.10 -1.25 -0.56 0.00 0.00 175.26 174.90 2k4j s PRO 18 N 0.17 1.61 0.28 4.30 0.04 -1.26 -4.78 135.00 135.36 2k4j s PRO 18 Ca 0.54 1.10 0.02 0.00 0.04 0.00 0.00 61.00 62.70 2k4j s PRO 18 Cb -0.31 -1.83 -0.06 0.00 0.04 0.00 0.00 34.50 32.35 2k4j s PRO 18 CO 0.34 -2.08 0.08 0.20 0.04 0.00 0.00 177.00 175.58 2k4j s GLY 19 N -3.26 1.84 -0.06 0.56 0.00 -0.56 -4.99 107.32 100.86 2k4j s GLY 19 Ca 0.63 -1.93 -0.04 0.00 0.00 0.00 0.00 44.72 43.37 2k4j s GLY 19 CO 0.57 -1.67 0.14 -0.35 0.00 0.00 0.00 173.10 171.79 2k4j s ASP 20 N -3.37 -0.14 -0.17 1.64 -1.08 -1.26 -0.07 116.67 112.22 2k4j s ASP 20 Ca 0.37 0.29 -0.07 0.00 -0.52 0.00 0.00 52.55 52.62 2k4j s ASP 20 Cb 0.08 0.27 0.07 0.00 -1.46 0.00 0.00 42.92 41.88 2k4j s ASP 20 CO 0.14 -0.07 0.37 0.00 0.52 0.00 0.00 175.17 176.13 2k4j s ALA 21 N 0.30 -0.95 0.00 3.66 0.00 -0.17 -4.98 121.76 119.61 2k4j s ALA 21 Ca -0.02 1.35 0.00 0.00 0.00 0.00 0.00 51.96 53.29 2k4j s ALA 21 Cb -0.03 -1.10 0.00 0.00 0.00 0.00 0.00 23.12 21.99 2k4j s ALA 21 CO -0.01 -0.56 0.00 0.09 0.00 0.00 0.00 175.76 175.28 2k4j n ASN 22 N 5.00 0.00 -0.01 0.00 4.13 -1.26 -1.59 115.26 121.53 2k4j n ASN 22 Ca -0.13 0.00 0.02 0.00 1.68 0.00 0.00 54.58 56.15 2k4j n ASN 22 Cb 0.51 0.00 -0.02 0.00 -1.54 0.00 0.00 39.78 38.73 2k4j n ASN 22 CO 0.00 0.00 0.00 -0.38 0.28 0.00 0.00 177.26 177.16 2k4j n ILE 23 N 0.00 0.00 -4.58 2.41 5.41 -1.26 -5.04 119.36 116.30 2k4j n ILE 23 Ca 0.00 -0.39 -0.26 0.00 1.00 0.00 0.00 62.75 63.09 2k4j n ILE 23 Cb 0.00 1.00 -0.14 0.00 -0.71 0.00 0.00 39.64 39.80 2k4j n ILE 23 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 176.55 177.27 2k4j s PHE 24 N -1.41 1.93 -0.24 1.39 -0.12 -0.62 -1.62 117.98 117.29 2k4j s PHE 24 Ca 0.02 -0.39 -0.05 0.00 -0.05 0.00 0.00 56.93 56.45 2k4j s PHE 24 Cb 0.04 -1.12 -0.02 0.00 -0.63 0.00 0.00 43.02 41.29 2k4j s PHE 24 CO 0.19 0.14 0.01 0.50 -0.05 0.00 0.00 175.22 176.01 2k4j s ARG 25 N -1.43 3.48 -0.24 1.99 3.52 0.04 -1.00 118.95 125.31 2k4j s ARG 25 Ca 0.08 -0.57 -0.25 0.00 -0.13 0.00 0.00 55.73 54.86 2k4j s ARG 25 Cb -0.09 -3.16 -0.00 0.00 -1.56 0.00 0.00 34.95 30.14 2k4j s ARG 25 CO 0.03 -0.20 0.84 0.54 -0.81 0.00 0.00 175.30 175.70 2k4j s VAL 26 N 1.54 4.82 -0.41 7.11 0.11 0.90 -0.85 120.40 133.62 2k4j s VAL 26 Ca 0.06 1.59 -0.18 0.00 -2.93 0.00 0.00 61.98 60.52 2k4j s VAL 26 Cb -0.15 -4.13 0.02 0.00 -1.53 0.00 0.00 36.38 30.59 2k4j s VAL 26 CO -0.00 -0.09 0.51 -0.62 -3.33 0.00 0.00 175.10 171.57 2k4j s ASP 27 N 1.34 6.25 0.07 3.54 2.15 -0.36 -1.49 116.67 128.17 2k4j s ASP 27 Ca 0.35 -0.44 0.25 0.00 0.43 0.00 0.00 52.55 53.14 2k4j s ASP 27 Cb -0.15 -2.26 0.47 0.00 -0.30 0.00 0.00 42.92 40.68 2k4j s ASP 27 CO 0.07 -0.61 1.40 0.29 -0.17 0.00 0.00 175.17 176.16 2k4j n LYS 28 N 5.81 0.18 0.05 4.34 5.02 -1.26 -0.95 118.16 131.35 2k4j n LYS 28 Ca -0.05 0.05 -0.10 0.00 -2.02 0.00 0.00 58.31 56.19 2k4j n LYS 28 Cb 0.48 -1.62 -0.07 0.00 -0.02 0.00 0.00 35.03 33.80 2k4j n LYS 28 CO 0.00 0.00 0.00 0.22 -0.52 0.00 0.00 177.40 177.10 2k4j h ASP 29 N 0.00 -0.19 0.45 4.39 3.58 -1.93 -3.36 116.42 119.36 2k4j h ASP 29 Ca 0.00 -0.33 0.00 0.00 0.42 0.00 0.00 57.03 57.12 2k4j h ASP 29 Cb 0.65 0.05 0.00 0.00 1.72 0.00 0.00 39.33 41.75 2k4j h ASP 29 CO 0.00 0.37 -0.90 -0.24 -2.88 0.00 0.00 179.24 175.59 2k4j n SER 30 N -4.92 0.63 -1.72 2.28 2.88 -1.26 -5.02 113.62 106.49 2k4j n SER 30 Ca -0.07 -0.25 -0.01 0.00 -1.33 0.00 0.00 58.87 57.20 2k4j n SER 30 Cb 0.25 0.67 0.01 0.00 -0.75 0.00 0.00 64.21 64.39 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 -1.86 -0.26 -4.24 -1.46 0.63 -0.60 -5.09 116.66 103.78 2k4j n ARG 31 Ca 0.03 0.27 -0.13 0.00 -0.92 0.00 0.00 57.85 57.09 2k4j n ARG 31 Cb 0.41 -2.07 -0.10 0.00 0.45 0.00 0.00 32.46 31.15 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 -3.13 1.24 -0.09 -0.14 2.02 -0.12 -4.60 118.70 113.88 2k4j s GLU 32 Ca 0.04 -1.65 0.00 0.00 0.02 0.00 0.00 54.97 53.38 2k4j s GLU 32 Cb -0.01 0.07 0.02 0.00 0.10 0.00 0.00 34.13 34.31 2k4j s GLU 32 CO 0.10 -0.34 -0.08 0.14 0.02 0.00 0.00 175.26 175.10 2k4j s VAL 33 N -4.00 0.94 -0.44 2.63 -7.23 0.42 -1.23 120.40 111.50 2k4j s VAL 33 Ca 0.37 -0.29 -0.20 0.00 -1.81 0.00 0.00 61.98 60.05 2k4j s VAL 33 Cb 0.07 -0.94 0.02 0.00 0.56 0.00 0.00 36.38 36.10 2k4j s VAL 33 CO 0.11 0.34 0.62 -0.31 -0.31 0.00 0.00 175.10 175.55 2k4j s TYR 34 N 1.34 3.08 0.49 2.82 1.51 -0.03 -1.09 117.35 125.47 2k4j s TYR 34 Ca -0.03 -0.11 -0.16 0.00 -1.01 0.00 0.00 57.07 55.77 2k4j s TYR 34 Cb -0.14 -3.29 -0.08 0.00 -0.11 0.00 0.00 41.96 38.34 2k4j s TYR 34 CO -0.04 -0.85 0.95 1.41 -1.11 0.00 0.00 175.55 175.92 2k4j s MET 35 N 2.73 3.95 0.67 -0.62 1.75 -0.31 -0.78 119.30 126.69 2k4j s MET 35 Ca 0.21 0.90 0.35 0.00 -1.25 0.00 0.00 55.69 55.91 2k4j s MET 35 Cb -0.15 -2.17 1.92 0.00 2.84 0.00 0.00 34.83 37.27 2k4j s MET 35 CO 0.18 -0.22 2.08 1.25 -0.65 0.00 0.00 175.02 177.66 2k4j h HIS 36 N 1.03 0.00 0.00 4.11 2.76 -1.72 -0.79 115.15 120.54 2k4j h HIS 36 Ca -0.47 0.00 -0.30 0.00 -2.20 0.00 0.00 60.37 57.40 2k4j h HIS 36 Cb 1.18 0.00 -0.05 0.00 1.55 0.00 0.00 27.41 30.09 2k4j h HIS 36 CO 0.63 0.00 -1.81 0.39 -1.30 0.00 0.00 177.93 175.84 2k4j n GLU 37 N -2.96 0.64 -3.63 5.26 4.71 -1.26 -5.07 120.64 118.34 2k4j n GLU 37 Ca -0.02 0.24 -0.03 0.00 -0.01 0.00 0.00 57.16 57.34 2k4j n GLU 37 Cb 0.27 -1.75 -0.03 0.00 -1.01 0.00 0.00 31.44 28.93 2k4j n GLU 37 CO 0.00 0.00 0.00 -1.59 0.09 0.00 0.00 177.13 175.63 2k4j s LYS 38 N -2.60 0.15 0.29 3.49 0.00 -0.30 -5.08 119.74 115.69 2k4j s LYS 38 Ca -0.05 -0.04 -0.29 0.00 0.00 0.00 0.00 55.97 55.59 2k4j s LYS 38 Cb 0.08 0.07 -0.10 0.00 0.00 0.00 0.00 37.83 37.88 2k4j s LYS 38 CO 0.83 -0.06 1.12 -1.59 0.00 0.00 0.00 175.35 175.65 2k4j s LYS 39 N -1.93 4.58 -0.00 1.78 -2.85 -1.26 -1.16 119.74 118.89 2k4j s LYS 39 Ca 0.10 1.84 -0.02 0.00 -1.00 0.00 0.00 55.97 56.89 2k4j s LYS 39 Cb -0.01 -3.14 -0.00 0.00 -2.06 0.00 0.00 37.83 32.62 2k4j s LYS 39 CO -0.04 0.14 0.03 -0.51 0.10 0.00 0.00 175.35 175.07 2k4j s LEU 40 N -1.56 1.93 -0.46 2.77 1.43 -0.25 -4.92 118.68 117.62 2k4j s LEU 40 Ca 0.46 -0.14 0.05 0.00 -1.03 0.00 0.00 54.13 53.48 2k4j s LEU 40 Cb -0.32 0.20 0.28 0.00 0.03 0.00 0.00 46.19 46.38 2k4j s LEU 40 CO 0.42 -0.15 1.04 -0.90 0.23 0.00 0.00 176.35 176.99 2k4j n ASP 41 N 2.39 -2.47 0.00 2.29 5.75 -1.26 -0.44 116.55 122.81 2k4j n ASP 41 Ca -0.17 -3.34 0.00 0.00 -0.01 0.00 0.00 54.79 51.26 2k4j n ASP 41 Cb 0.58 1.79 0.00 0.00 -1.03 0.00 0.00 41.12 42.46 2k4j n ASP 41 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 2k4j n LEU 42 N 0.97 0.00 -4.15 -2.12 7.99 -1.26 -5.00 117.00 113.43 2k4j n LEU 42 Ca 0.06 0.00 -0.13 0.00 -0.01 0.00 0.00 56.01 55.93 2k4j n LEU 42 Cb 0.67 0.00 -0.07 0.00 -0.11 0.00 0.00 43.42 43.91 2k4j n LEU 42 CO 0.02 0.00 -0.05 0.42 -1.51 0.00 0.00 177.39 176.27 2k4j s THR 43 N 0.00 0.00 0.26 -5.08 -4.23 -1.26 -5.01 115.64 100.32 2k4j s THR 43 Ca 0.00 -1.80 -0.01 0.00 -1.18 0.00 0.00 61.69 58.70 2k4j s THR 43 Cb 0.00 -2.47 0.24 0.00 1.34 0.00 0.00 72.50 71.62 2k4j s THR 43 CO 0.00 0.00 1.79 0.03 -0.54 0.00 0.00 174.62 175.90 2k4j h ARG 44 N 2.35 0.74 -0.05 3.99 3.08 -1.99 -0.42 114.38 122.08 2k4j h ARG 44 Ca -0.30 -0.04 -0.03 0.00 0.07 0.00 0.00 59.98 59.68 2k4j h ARG 44 Cb 1.24 -0.17 -0.00 0.00 0.08 0.00 0.00 29.97 31.13 2k4j h ARG 44 CO 0.43 0.49 -0.07 0.00 -1.07 0.00 0.00 179.97 179.76 2k4j h ALA 45 N 1.52 0.08 -0.08 0.04 0.00 -1.96 -1.07 119.26 117.80 2k4j h ALA 45 Ca 0.45 -0.29 -0.16 0.00 0.00 0.00 0.00 54.91 54.92 2k4j h ALA 45 Cb 0.54 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 2k4j h ALA 45 CO -0.30 -0.10 -0.64 0.93 0.00 0.00 0.00 179.25 179.13 2k4j h GLU 46 N -0.33 0.29 -0.44 0.00 3.07 -1.93 -1.03 114.58 114.22 2k4j h GLU 46 Ca 0.01 -0.21 0.09 0.00 -0.50 0.00 0.00 59.36 58.74 2k4j h GLU 46 Cb 0.60 0.04 -0.10 0.00 -0.84 0.00 0.00 28.75 28.45 2k4j h GLU 46 CO 0.02 0.83 -0.31 -0.92 -1.40 0.00 0.00 179.01 177.22 2k4j h TYR 47 N 0.21 -0.86 -0.96 4.33 3.20 -1.12 0.13 116.97 121.89 2k4j h TYR 47 Ca -0.01 0.06 0.11 0.00 3.14 0.00 0.00 58.73 62.03 2k4j h TYR 47 Cb 1.16 0.44 -0.08 0.00 1.54 0.00 0.00 36.73 39.79 2k4j h TYR 47 CO 0.03 -0.37 0.60 1.49 -1.64 0.00 0.00 178.16 178.26 2k4j h GLU 48 N -0.22 0.92 0.11 1.82 4.57 0.08 -0.84 114.58 121.03 2k4j h GLU 48 Ca 0.19 -0.06 -0.27 0.00 -1.18 0.00 0.00 59.36 58.05 2k4j h GLU 48 Cb 0.53 -0.21 0.00 0.00 -0.16 0.00 0.00 28.75 28.91 2k4j h GLU 48 CO -0.56 0.61 -1.21 0.82 -1.18 0.00 0.00 179.01 177.49 2k4j h ILE 49 N 0.95 1.52 -0.35 2.32 1.08 -0.94 -0.99 117.51 121.10 2k4j h ILE 49 Ca 0.47 -3.07 0.01 0.00 -0.39 0.00 0.00 64.86 61.89 2k4j h ILE 49 Cb 0.46 2.92 -0.02 0.00 -3.07 0.00 0.00 36.82 37.10 2k4j h ILE 49 CO -0.26 0.89 0.21 -0.07 -0.69 0.00 0.00 178.15 178.23 2k4j h LEU 50 N 0.07 0.34 -0.14 1.44 3.38 -0.69 0.22 115.31 119.93 2k4j h LEU 50 Ca -0.12 0.00 0.04 0.00 0.09 0.00 0.00 57.88 57.89 2k4j h LEU 50 Cb 1.94 -0.07 -0.05 0.00 0.09 0.00 0.00 40.66 42.57 2k4j h LEU 50 CO 0.20 0.25 -0.15 0.28 0.09 0.00 0.00 178.44 179.10 2k4j h SER 51 N 0.42 -0.48 -0.72 -0.43 0.02 -1.15 0.18 113.55 111.40 2k4j h SER 51 Ca 0.13 0.09 0.06 0.00 -0.84 0.00 0.00 61.79 61.24 2k4j h SER 51 Cb -0.01 0.23 -0.06 0.00 0.14 0.00 0.00 62.40 62.70 2k4j h SER 51 CO -0.06 -0.20 0.41 0.25 -1.14 0.00 0.00 176.83 176.10 2k4j h LEU 52 N -0.18 0.61 0.11 5.07 5.85 -0.91 -1.05 115.31 124.81 2k4j h LEU 52 Ca 0.10 0.03 -0.01 0.00 0.84 0.00 0.00 57.88 58.84 2k4j h LEU 52 Cb 0.33 -0.09 0.00 0.00 0.37 0.00 0.00 40.66 41.27 2k4j h LEU 52 CO -0.25 0.39 -0.05 0.25 -0.34 0.00 0.00 178.44 178.43 2k4j h LEU 53 N 0.74 -0.12 -0.80 2.25 5.85 -0.11 -0.98 115.31 122.14 2k4j h LEU 53 Ca 0.32 -0.40 0.06 0.00 0.84 0.00 0.00 57.88 58.70 2k4j h LEU 53 Cb 0.21 0.03 -0.06 0.00 0.37 0.00 0.00 40.66 41.21 2k4j h LEU 53 CO -0.19 0.37 0.49 0.40 -0.34 0.00 0.00 178.44 179.17 2k4j h ILE 54 N -0.66 1.02 -0.38 4.05 2.04 -0.65 -0.11 117.51 122.82 2k4j h ILE 54 Ca -0.01 -0.31 -0.15 0.00 1.00 0.00 0.00 64.86 65.39 2k4j h ILE 54 Cb 0.52 0.05 -0.01 0.00 -0.74 0.00 0.00 36.82 36.64 2k4j h ILE 54 CO 0.02 0.16 -0.37 0.28 0.00 0.00 0.00 178.15 178.25 2k4j h SER 55 N 0.89 0.94 0.88 1.72 0.02 -1.15 -3.29 113.55 113.56 2k4j h SER 55 Ca 0.35 -0.42 -0.23 0.00 -0.84 0.00 0.00 61.79 60.65 2k4j h SER 55 Cb 0.17 -0.26 -0.03 0.00 0.14 0.00 0.00 62.40 62.42 2k4j h SER 55 CO -0.17 1.20 -1.14 0.07 -1.14 0.00 0.00 176.83 175.65 2k4j h LYS 56 N 0.73 0.02 0.00 3.45 2.10 -1.03 -3.50 116.57 118.34 2k4j h LYS 56 Ca 0.06 -0.04 0.00 0.00 -2.00 0.00 0.00 60.65 58.68 2k4j h LYS 56 Cb 0.94 0.01 0.00 0.00 -0.90 0.00 0.00 32.23 32.29 2k4j h LYS 56 CO 0.09 0.94 0.00 0.36 -2.00 0.00 0.00 179.45 178.83 2k4j n LYS 57 N -3.31 0.00 0.05 0.07 2.85 -0.07 -5.04 118.16 112.70 2k4j n LYS 57 Ca -0.04 0.00 -0.11 0.00 -1.05 0.00 0.00 58.31 57.11 2k4j n LYS 57 Cb 0.96 0.00 -0.05 0.00 -0.65 0.00 0.00 35.03 35.30 2k4j n LYS 57 CO 0.00 0.00 0.00 0.78 -0.05 0.00 0.00 177.40 178.13 2k4j h GLY 58 N 0.00 -0.46 0.00 2.58 0.00 -1.76 -3.43 103.07 100.01 2k4j h GLY 58 Ca 0.00 0.36 0.00 0.00 0.00 0.00 0.00 47.33 47.69 2k4j h GLY 58 CO 0.00 -0.22 0.00 2.98 0.00 0.00 0.00 176.54 179.30 2k4j n TYR 59 N -5.40 0.00 -4.00 5.60 9.36 -0.88 -4.13 117.16 117.72 2k4j n TYR 59 Ca -0.04 0.00 -0.34 0.00 3.32 0.00 0.00 57.90 60.83 2k4j n TYR 59 Cb 0.31 0.05 -0.15 0.00 -0.63 0.00 0.00 39.34 38.92 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 2.78 -0.10 2.97 1.01 -1.26 -1.13 120.40 124.66 2k4j s VAL 60 Ca 0.00 -0.79 -0.32 0.00 0.00 0.00 0.00 61.98 60.87 2k4j s VAL 60 Cb 0.00 -2.28 -0.10 0.00 0.00 0.00 0.00 36.38 34.00 2k4j s VAL 60 CO 0.00 0.41 1.99 0.49 0.00 0.00 0.00 175.10 177.98 2k4j n PHE 61 N 4.70 2.26 -5.18 5.22 3.72 0.49 -4.78 117.46 123.88 2k4j n PHE 61 Ca -0.19 -0.09 -0.32 0.00 -0.05 0.00 0.00 57.45 56.80 2k4j n PHE 61 Cb 0.50 -2.70 -0.16 0.00 -0.94 0.00 0.00 39.48 36.18 2k4j n PHE 61 CO 0.00 0.00 0.00 -1.12 -0.05 0.00 0.00 176.76 175.59 2k4j s SER 62 N 5.14 3.24 0.23 4.37 0.01 -1.26 -1.68 113.70 123.74 2k4j s SER 62 Ca 0.95 -0.48 -0.07 0.00 1.31 0.00 0.00 55.95 57.66 2k4j s SER 62 Cb -0.59 -1.02 0.30 0.00 0.21 0.00 0.00 66.02 64.92 2k4j s SER 62 CO 0.47 0.23 1.83 0.08 0.41 0.00 0.00 173.24 176.25 2k4j h ARG 63 N 6.19 0.79 -0.57 12.44 0.11 -1.88 -1.10 114.38 130.36 2k4j h ARG 63 Ca -0.30 -0.05 -0.01 0.00 0.10 0.00 0.00 59.98 59.72 2k4j h ARG 63 Cb 1.19 -0.18 -0.03 0.00 1.11 0.00 0.00 29.97 32.06 2k4j h ARG 63 CO 0.48 0.52 0.32 0.93 0.10 0.00 0.00 179.97 182.32 2k4j h GLU 64 N 0.81 0.79 -0.64 0.08 5.08 -1.83 0.68 114.58 119.56 2k4j h GLU 64 Ca 0.34 -0.09 -0.06 0.00 -1.00 0.00 0.00 59.36 58.55 2k4j h GLU 64 Cb 0.20 -0.16 -0.03 0.00 0.50 0.00 0.00 28.75 29.27 2k4j h GLU 64 CO -0.19 0.60 0.14 0.77 -1.00 0.00 0.00 179.01 179.34 2k4j h SER 65 N 0.77 0.96 -0.57 1.42 0.02 -1.75 -0.31 113.55 114.09 2k4j h SER 65 Ca 0.20 -0.20 -0.02 0.00 -0.84 0.00 0.00 61.79 60.94 2k4j h SER 65 Cb 0.03 -0.25 -0.03 0.00 0.14 0.00 0.00 62.40 62.29 2k4j h SER 65 CO -0.03 0.93 0.29 0.40 -1.14 0.00 0.00 176.83 177.28 2k4j h ILE 66 N 0.97 1.20 0.00 3.27 2.04 -0.90 -1.53 117.51 122.56 2k4j h ILE 66 Ca 0.20 -0.55 -0.03 0.00 1.00 0.00 0.00 64.86 65.48 2k4j h ILE 66 Cb 0.36 0.51 -0.00 0.00 -0.74 0.00 0.00 36.82 36.95 2k4j h ILE 66 CO 0.00 0.23 -0.13 0.00 0.00 0.00 0.00 178.15 178.25 2k4j h ALA 67 N 1.12 1.31 0.12 1.87 0.00 -0.41 0.24 119.26 123.51 2k4j h ALA 67 Ca 0.20 -0.12 -0.16 0.00 0.00 0.00 0.00 54.91 54.83 2k4j h ALA 67 Cb 0.10 -0.02 0.02 0.00 0.00 0.00 0.00 17.79 17.88 2k4j h ALA 67 CO -0.03 0.17 -0.68 0.82 0.00 0.00 0.00 179.25 179.53 2k4j h ILE 68 N 0.00 1.56 0.00 0.00 2.04 -0.61 -3.33 117.51 117.18 2k4j h ILE 68 Ca -0.00 -2.51 -0.15 0.00 1.00 0.00 0.00 64.86 63.20 2k4j h ILE 68 Cb 0.35 3.24 -0.03 0.00 -0.74 0.00 0.00 36.82 39.64 2k4j h ILE 68 CO 0.02 0.70 -2.06 -0.62 0.00 0.00 0.00 178.15 176.19 2k4j n GLU 69 N -4.20 0.79 -0.13 2.37 4.71 -0.62 -4.70 120.64 118.86 2k4j n GLU 69 Ca -0.13 -0.10 -0.28 0.00 -0.01 0.00 0.00 57.16 56.64 2k4j n GLU 69 Cb 0.77 -1.47 -0.10 0.00 -1.01 0.00 0.00 31.44 29.63 2k4j n GLU 69 CO 0.00 0.00 0.00 0.45 0.09 0.00 0.00 177.13 177.67 2k4j n SER 70 N -2.41 1.94 0.00 1.62 2.88 0.79 -4.88 113.62 113.56 2k4j n SER 70 Ca -0.15 0.34 0.00 0.00 -1.33 0.00 0.00 58.87 57.72 2k4j n SER 70 Cb 0.78 -0.84 0.00 0.00 -0.75 0.00 0.00 64.21 63.40 2k4j n SER 70 CO 0.00 0.00 0.00 1.21 -1.23 0.00 0.00 175.04 175.02 2k4j n GLU 71 N -4.24 0.00 0.00 -1.46 2.13 -0.90 -4.82 120.64 111.34 2k4j n GLU 71 Ca -0.49 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.33 2k4j n GLU 71 Cb 0.85 -2.68 0.00 0.00 0.27 0.00 0.00 31.44 29.88 2k4j n GLU 71 CO 0.00 0.00 0.00 -1.13 -0.41 0.00 0.00 177.13 175.59 2k4j n SER 72 N 0.00 1.45 -3.91 4.31 3.41 -1.26 -4.73 113.62 112.89 2k4j n SER 72 Ca 0.00 -1.06 -0.18 0.00 -0.26 0.00 0.00 58.87 57.36 2k4j n SER 72 Cb 0.00 -0.27 -0.16 0.00 -0.26 0.00 0.00 64.21 63.53 2k4j n SER 72 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 2k4j s ILE 73 N 0.27 0.47 0.02 -1.33 -1.09 -1.26 -5.10 121.20 113.18 2k4j s ILE 73 Ca 0.00 -0.14 -0.25 0.00 -2.23 0.00 0.00 60.65 58.03 2k4j s ILE 73 Cb 0.00 -0.48 -0.17 0.00 -1.58 0.00 0.00 42.46 40.23 2k4j s ILE 73 CO 0.00 0.19 1.33 0.78 -1.23 0.00 0.00 174.94 176.01 2k4j h ASN 74 N 6.82 -0.25 -3.54 3.58 4.21 -2.02 -3.43 115.58 120.94 2k4j h ASN 74 Ca -0.36 -0.20 -0.52 0.00 1.21 0.00 0.00 56.30 56.43 2k4j h ASN 74 Cb 1.16 0.06 0.01 0.00 -1.12 0.00 0.00 38.32 38.43 2k4j h ASN 74 CO 0.48 0.08 0.50 -2.16 -1.29 0.00 0.00 177.43 175.04 2k4j s PRO 75 N -4.86 4.57 0.44 0.81 0.04 -1.26 -4.96 135.00 129.78 2k4j s PRO 75 Ca -0.15 1.75 0.28 0.00 0.04 0.00 0.00 61.00 62.93 2k4j s PRO 75 Cb 0.03 -3.27 0.93 0.00 0.04 0.00 0.00 34.50 32.22 2k4j s PRO 75 CO 0.59 0.03 1.81 1.05 0.04 0.00 0.00 177.00 180.52 2k4j h GLU 76 N 5.16 0.00 -0.15 4.56 4.11 -1.98 -2.61 114.58 123.68 2k4j h GLU 76 Ca -0.44 0.00 -0.18 0.00 0.07 0.00 0.00 59.36 58.80 2k4j h GLU 76 Cb 1.21 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.46 2k4j h GLU 76 CO 0.73 0.00 -0.65 1.03 0.07 0.00 0.00 179.01 180.18 2k4j h SER 77 N 0.00 0.66 -1.42 3.06 0.87 -1.93 -3.43 113.55 111.36 2k4j h SER 77 Ca 0.00 -0.39 -0.37 0.00 -1.23 0.00 0.00 61.79 59.79 2k4j h SER 77 Cb 0.68 -0.19 -0.11 0.00 -0.44 0.00 0.00 62.40 62.34 2k4j h SER 77 CO 0.00 1.14 -0.38 -1.54 -0.53 0.00 0.00 176.83 175.52 2k4j n SER 78 N -3.92 -5.26 -0.26 6.23 3.41 -0.98 -4.36 113.62 108.48 2k4j n SER 78 Ca -0.04 0.31 0.16 0.00 -0.26 0.00 0.00 58.87 59.04 2k4j n SER 78 Cb 0.67 -4.36 0.45 0.00 -0.26 0.00 0.00 64.21 60.71 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 0.00 0.52 0.66 4.04 -0.73 -1.93 0.22 115.58 118.36 2k4j h ASN 79 Ca -0.40 0.05 -0.10 0.00 1.87 0.00 0.00 56.30 57.72 2k4j h ASN 79 Cb 1.24 -0.05 -0.01 0.00 0.27 0.00 0.00 38.32 39.77 2k4j h ASN 79 CO 0.54 0.22 -0.50 0.11 -0.37 0.00 0.00 177.43 177.44 2k4j h LYS 80 N 0.53 0.00 0.66 6.67 6.56 -1.98 -1.68 116.57 127.33 2k4j h LYS 80 Ca 0.47 0.00 -0.03 0.00 -1.06 0.00 0.00 60.65 60.03 2k4j h LYS 80 Cb 1.01 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.67 2k4j h LYS 80 CO -0.21 0.50 -0.36 1.03 -2.06 0.00 0.00 179.45 178.35 2k4j h SER 81 N 0.00 -0.88 -0.15 0.86 0.87 -0.98 -1.18 113.55 112.09 2k4j h SER 81 Ca -0.00 0.04 -0.03 0.00 -1.23 0.00 0.00 61.79 60.56 2k4j h SER 81 Cb 0.96 0.24 -0.01 0.00 -0.44 0.00 0.00 62.40 63.15 2k4j h SER 81 CO 0.06 -0.58 0.01 -0.29 -0.53 0.00 0.00 176.83 175.51 2k4j h ILE 82 N -0.94 1.15 -0.29 2.23 2.10 -1.33 0.20 117.51 120.62 2k4j h ILE 82 Ca -0.09 -0.56 0.01 0.00 1.08 0.00 0.00 64.86 65.30 2k4j h ILE 82 Cb 0.74 0.95 -0.02 0.00 -1.09 0.00 0.00 36.82 37.40 2k4j h ILE 82 CO 0.12 0.19 0.17 -0.78 -1.08 0.00 0.00 178.15 176.77 2k4j h ASP 83 N 0.35 0.27 -0.48 2.19 3.58 -1.36 0.34 116.42 121.32 2k4j h ASP 83 Ca 0.08 0.00 -0.01 0.00 0.42 0.00 0.00 57.03 57.53 2k4j h ASP 83 Cb 0.22 -0.06 -0.02 0.00 1.72 0.00 0.00 39.33 41.19 2k4j h ASP 83 CO 0.00 0.20 0.28 0.58 -2.88 0.00 0.00 179.24 177.42 2k4j h VAL 84 N 0.35 1.16 0.39 2.25 2.07 0.20 -0.96 116.25 121.70 2k4j h VAL 84 Ca 0.11 -0.37 -0.02 0.00 0.82 0.00 0.00 66.70 67.24 2k4j h VAL 84 Cb -0.00 0.53 0.00 0.00 -1.52 0.00 0.00 31.29 30.30 2k4j h VAL 84 CO -0.05 0.16 -0.19 0.40 0.02 0.00 0.00 177.57 177.91 2k4j h ILE 85 N 0.64 0.62 0.02 4.57 1.08 -0.26 1.00 117.51 125.17 2k4j h ILE 85 Ca 0.17 -0.29 -0.21 0.00 -0.39 0.00 0.00 64.86 64.14 2k4j h ILE 85 Cb 0.01 0.77 -0.01 0.00 -3.07 0.00 0.00 36.82 34.52 2k4j h ILE 85 CO -0.03 0.06 -0.93 0.40 -0.69 0.00 0.00 178.15 176.95 2k4j h ILE 86 N -0.69 1.50 -0.70 -0.67 1.08 -1.04 0.91 117.51 117.90 2k4j h ILE 86 Ca -0.05 -2.69 -0.07 0.00 -0.39 0.00 0.00 64.86 61.65 2k4j h ILE 86 Cb 0.49 2.54 -0.03 0.00 -3.07 0.00 0.00 36.82 36.75 2k4j h ILE 86 CO 0.09 0.79 0.15 1.23 -0.69 0.00 0.00 178.15 179.71 2k4j h GLY 87 N 1.81 1.22 1.96 5.37 0.00 -1.15 0.29 103.07 112.57 2k4j h GLY 87 Ca -0.06 -0.79 -0.12 0.00 0.00 0.00 0.00 47.33 46.37 2k4j h GLY 87 CO 0.15 0.73 -0.58 -0.09 0.00 0.00 0.00 176.54 176.74 2k4j h ARG 88 N 1.07 0.00 -0.12 4.80 2.43 -0.77 -0.93 114.38 120.85 2k4j h ARG 88 Ca 0.22 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.39 2k4j h ARG 88 Cb 0.41 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.95 2k4j h ARG 88 CO 0.01 0.55 0.08 1.25 -1.51 0.00 0.00 179.97 180.34 2k4j h LEU 89 N 0.00 0.14 -0.60 3.80 6.46 -0.60 0.52 115.31 125.03 2k4j h LEU 89 Ca -0.01 -0.02 0.07 0.00 -0.12 0.00 0.00 57.88 57.80 2k4j h LEU 89 Cb 1.43 -0.04 -0.06 0.00 -0.73 0.00 0.00 40.66 41.27 2k4j h LEU 89 CO 0.07 0.12 0.28 -0.09 -0.62 0.00 0.00 178.44 178.20 2k4j h ARG 90 N 0.16 0.51 -0.46 1.25 1.12 -0.81 -0.10 114.38 116.04 2k4j h ARG 90 Ca 0.05 -0.03 0.06 0.00 -1.11 0.00 0.00 59.98 58.94 2k4j h ARG 90 Cb -0.00 -0.11 -0.05 0.00 -0.01 0.00 0.00 29.97 29.79 2k4j h ARG 90 CO -0.01 0.33 0.16 1.03 -3.11 0.00 0.00 179.97 178.38 2k4j h SER 91 N 0.52 0.17 -0.60 -3.80 0.87 -0.87 0.31 113.55 110.15 2k4j h SER 91 Ca 0.28 0.05 -0.00 0.00 -1.23 0.00 0.00 61.79 60.89 2k4j h SER 91 Cb 0.26 0.03 -0.03 0.00 -0.44 0.00 0.00 62.40 62.22 2k4j h SER 91 CO -0.23 0.13 0.37 0.11 -0.53 0.00 0.00 176.83 176.69 2k4j h LYS 92 N 0.34 0.81 0.00 2.24 6.56 0.08 -0.77 116.57 125.82 2k4j h LYS 92 Ca 0.21 -0.07 -0.05 0.00 -1.06 0.00 0.00 60.65 59.69 2k4j h LYS 92 Cb 0.21 -0.17 -0.01 0.00 -0.57 0.00 0.00 32.23 31.69 2k4j h LYS 92 CO -0.22 0.57 -0.21 -0.84 -2.06 0.00 0.00 179.45 176.69 2k4j h ILE 93 N 0.81 0.49 0.03 1.86 -0.00 -0.68 -1.40 117.51 118.62 2k4j h ILE 93 Ca 0.22 -1.16 -0.26 0.00 -0.00 0.00 0.00 64.86 63.65 2k4j h ILE 93 Cb -0.04 1.82 0.02 0.00 -0.00 0.00 0.00 36.82 38.63 2k4j h ILE 93 CO -0.04 0.21 -1.07 -0.08 -0.00 0.00 0.00 178.15 177.17 2k4j h GLU 94 N 0.00 0.58 -0.04 0.16 4.81 -0.72 -3.36 114.58 116.02 2k4j h GLU 94 Ca -0.00 -0.67 -0.11 0.00 -0.13 0.00 0.00 59.36 58.45 2k4j h GLU 94 Cb 0.81 0.20 0.01 0.00 0.63 0.00 0.00 28.75 30.39 2k4j h GLU 94 CO 0.03 1.27 -0.39 -0.22 -0.73 0.00 0.00 179.01 178.97 2k4j h LYS 95 N 0.31 0.33 -7.25 1.92 1.63 -1.04 -3.47 116.57 109.00 2k4j h LYS 95 Ca -0.13 -0.30 -0.49 0.00 -0.85 0.00 0.00 60.65 58.87 2k4j h LYS 95 Cb 1.72 0.07 0.06 0.00 -0.60 0.00 0.00 32.23 33.49 2k4j h LYS 95 CO 0.20 0.97 0.31 -0.80 -3.45 0.00 0.00 179.45 176.68 2k4j s ASN 96 N -6.48 5.90 0.49 4.20 0.01 -0.54 -5.00 114.94 113.52 2k4j s ASN 96 Ca -0.14 1.10 0.28 0.00 -0.71 0.00 0.00 52.86 53.39 2k4j s ASN 96 Cb 0.03 -2.13 1.09 0.00 0.41 0.00 0.00 41.25 40.66 2k4j s ASN 96 CO 0.78 -0.97 1.89 1.55 -1.51 0.00 0.00 177.10 178.84 2k4j h PRO 97 N -0.27 0.00 -6.53 -0.60 0.13 -1.89 -3.46 132.00 119.38 2k4j h PRO 97 Ca -0.45 0.00 -0.60 0.00 -0.87 0.00 0.00 66.00 64.08 2k4j h PRO 97 Cb 1.22 0.00 0.09 0.00 0.13 0.00 0.00 31.00 32.44 2k4j h PRO 97 CO 0.62 0.12 0.49 1.17 -0.23 0.00 0.00 178.00 180.17 2k4j n LYS 98 N -3.26 1.79 -4.45 0.86 0.00 -1.26 -5.04 118.16 106.80 2k4j n LYS 98 Ca 0.00 0.64 -0.23 0.00 0.00 0.00 0.00 58.31 58.72 2k4j n LYS 98 Cb 0.38 -2.23 -0.10 0.00 0.00 0.00 0.00 35.03 33.08 2k4j n LYS 98 CO 0.00 0.00 0.00 1.14 0.00 0.00 0.00 177.40 178.54 2k4j s GLN 99 N -0.60 1.61 0.46 1.64 -2.07 -1.26 -4.67 119.66 114.77 2k4j s GLN 99 Ca 0.68 -1.76 -0.09 0.00 -1.82 0.00 0.00 55.36 52.37 2k4j s GLN 99 Cb -0.69 -1.56 -0.05 0.00 -1.09 0.00 0.00 33.01 29.61 2k4j s GLN 99 CO 0.52 0.24 0.81 -1.25 -1.32 0.00 0.00 175.29 174.30 2k4j s PRO 100 N -3.57 3.69 0.00 9.60 0.04 -1.26 -4.95 135.00 138.55 2k4j s PRO 100 Ca 0.29 0.43 0.00 0.00 0.04 0.00 0.00 61.00 61.76 2k4j s PRO 100 Cb -0.02 -2.34 0.00 0.00 0.04 0.00 0.00 34.50 32.18 2k4j s PRO 100 CO 0.13 -0.16 0.00 0.00 0.04 0.00 0.00 177.00 177.01 2k4j n GLN 101 N -1.78 0.00 -0.26 4.56 10.64 -1.26 -4.96 117.38 124.32 2k4j n GLN 101 Ca 0.02 0.00 0.08 0.00 -1.83 0.00 0.00 57.00 55.27 2k4j n GLN 101 Cb 0.54 0.00 0.22 0.00 -0.86 0.00 0.00 30.24 30.15 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 -0.93 0.69 -5.16 2.61 4.01 -1.26 -4.81 117.16 112.30 2k4j n TYR 102 Ca 0.00 -0.34 -0.32 0.00 -0.16 0.00 0.00 57.90 57.08 2k4j n TYR 102 Cb 0.00 -0.01 -0.16 0.00 -0.31 0.00 0.00 39.34 38.86 2k4j n TYR 102 CO 0.00 0.00 0.00 -1.50 -0.46 0.00 0.00 176.86 174.90 2k4j s ILE 103 N -1.34 2.25 0.05 -0.72 2.07 -1.26 -3.41 121.20 118.83 2k4j s ILE 103 Ca 0.34 -0.98 0.06 0.00 -1.41 0.00 0.00 60.65 58.66 2k4j s ILE 103 Cb 0.18 -1.85 -0.02 0.00 0.13 0.00 0.00 42.46 40.89 2k4j s ILE 103 CO 0.23 0.56 -0.17 -0.63 -1.91 0.00 0.00 174.94 173.02 2k4j s ILE 104 N 0.05 1.34 -0.09 2.00 -1.09 -0.04 -5.00 121.20 118.36 2k4j s ILE 104 Ca -0.09 -1.12 -0.18 0.00 -2.23 0.00 0.00 60.65 57.03 2k4j s ILE 104 Cb -0.15 -1.20 -0.05 0.00 -1.58 0.00 0.00 42.46 39.48 2k4j s ILE 104 CO 0.06 0.05 0.48 -0.44 -1.23 0.00 0.00 174.94 173.86 2k4j s SER 105 N -1.24 6.73 -0.39 3.58 0.01 -1.26 -0.17 113.70 120.95 2k4j s SER 105 Ca 0.04 0.86 -0.02 0.00 1.31 0.00 0.00 55.95 58.14 2k4j s SER 105 Cb -0.08 -2.29 0.10 0.00 0.21 0.00 0.00 66.02 63.96 2k4j s SER 105 CO 0.02 0.06 0.17 -0.69 0.41 0.00 0.00 173.24 173.20 2k4j s VAL 106 N 0.31 3.17 0.00 3.43 1.01 0.46 -4.77 120.40 124.01 2k4j s VAL 106 Ca 0.26 -2.01 0.00 0.00 0.00 0.00 0.00 61.98 60.23 2k4j s VAL 106 Cb -0.16 -3.15 0.00 0.00 0.00 0.00 0.00 36.38 33.07 2k4j s VAL 106 CO 0.11 -0.62 0.00 -1.14 0.00 0.00 0.00 175.10 173.45 2k4j n ARG 107 N 4.57 0.00 -1.14 2.72 3.00 -1.26 -1.54 116.66 123.00 2k4j n ARG 107 Ca -0.03 0.00 -0.02 0.00 -0.00 0.00 0.00 57.85 57.80 2k4j n ARG 107 Cb 0.42 -3.53 -0.01 0.00 0.00 0.00 0.00 32.46 29.34 2k4j n ARG 107 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2k4j n GLY 108 N -2.00 0.55 1.17 5.14 0.00 -1.26 -4.93 105.19 103.85 2k4j n GLY 108 Ca 0.00 -0.96 0.00 0.00 0.00 0.00 0.00 46.02 45.06 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 -3.00 0.00 -4.47 -0.61 5.41 -0.59 -5.02 119.36 111.07 2k4j n ILE 109 Ca -0.02 0.00 -0.25 0.00 1.00 0.00 0.00 62.75 63.47 2k4j n ILE 109 Cb 0.11 -1.28 -0.10 0.00 -0.71 0.00 0.00 39.64 37.66 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 -4.98 2.08 -0.16 7.39 0.00 -0.68 -4.46 107.32 106.51 2k4j s GLY 110 Ca 0.00 -2.00 -0.02 0.00 0.00 0.00 0.00 44.72 42.70 2k4j s GLY 110 CO 0.00 -1.98 0.02 -0.19 0.00 0.00 0.00 173.10 170.95 2k4j s TYR 111 N -2.55 1.00 0.01 1.90 1.51 -0.68 -0.40 117.35 118.13 2k4j s TYR 111 Ca 0.32 -0.70 -0.30 0.00 -1.01 0.00 0.00 57.07 55.38 2k4j s TYR 111 Cb -0.00 -1.00 -0.05 0.00 -0.11 0.00 0.00 41.96 40.80 2k4j s TYR 111 CO 0.17 -0.54 1.24 0.21 -1.11 0.00 0.00 175.55 175.52 2k4j s LYS 112 N 1.87 4.37 0.24 -0.62 2.36 0.76 -0.38 119.74 128.33 2k4j s LYS 112 Ca 0.01 1.78 0.08 0.00 -2.55 0.00 0.00 55.97 55.29 2k4j s LYS 112 Cb -0.16 -3.46 -0.05 0.00 -1.05 0.00 0.00 37.83 33.11 2k4j s LYS 112 CO -0.07 -0.39 -0.14 -1.17 1.55 0.00 0.00 175.35 175.13 2k4j s LEU 113 N 1.75 2.55 0.05 5.43 1.98 -0.29 -0.86 118.68 129.29 2k4j s LEU 113 Ca 0.59 -1.06 -0.08 0.00 -2.89 0.00 0.00 54.13 50.69 2k4j s LEU 113 Cb -0.28 -0.75 -0.00 0.00 0.66 0.00 0.00 46.19 45.81 2k4j s LEU 113 CO 0.26 -0.17 0.15 -1.83 -1.89 0.00 0.00 176.35 172.87 2k4j s GLU 114 N -3.64 0.69 0.00 1.98 -1.05 -1.22 -2.06 118.70 113.40 2k4j s GLU 114 Ca 0.25 -0.78 0.27 0.00 -0.15 0.00 0.00 54.97 54.56 2k4j s GLU 114 Cb -0.01 0.28 1.61 0.00 -0.44 0.00 0.00 34.13 35.58 2k4j s GLU 114 CO 0.10 -0.20 1.96 0.98 0.95 0.00 0.00 175.26 179.05