#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 7.13 -0.29 1.61 1.04 -1.26 -5.02 113.70 116.91 2k4j s SER 12 Ca 0.00 1.78 -0.14 0.00 0.48 0.00 0.00 55.95 58.07 2k4j s SER 12 Cb 0.00 -2.56 0.14 0.00 0.10 0.00 0.00 66.02 63.69 2k4j s SER 12 CO 0.00 -0.50 0.86 -0.70 0.98 0.00 0.00 173.24 173.88 2k4j s GLU 13 N 1.81 0.45 0.04 4.02 2.12 -1.26 -5.14 118.70 120.75 2k4j s GLU 13 Ca 0.55 0.96 -0.28 0.00 0.36 0.00 0.00 54.97 56.56 2k4j s GLU 13 Cb -0.24 0.39 0.09 0.00 0.26 0.00 0.00 34.13 34.63 2k4j s GLU 13 CO 0.23 -0.13 0.98 -2.00 -0.54 0.00 0.00 175.26 173.80 2k4j s GLU 14 N 2.11 0.89 0.47 4.30 2.12 -1.26 -5.06 118.70 122.27 2k4j s GLU 14 Ca -0.06 -0.42 0.20 0.00 0.36 0.00 0.00 54.97 55.04 2k4j s GLU 14 Cb -0.07 0.35 1.19 0.00 0.26 0.00 0.00 34.13 35.86 2k4j s GLU 14 CO -0.18 -0.40 1.95 0.28 -0.54 0.00 0.00 175.26 176.37 2k4j h VAL 15 N 2.00 0.77 -3.66 3.70 2.07 -2.08 -3.38 116.25 115.66 2k4j h VAL 15 Ca -0.23 -0.09 -0.24 0.00 0.82 0.00 0.00 66.70 66.96 2k4j h VAL 15 Cb 1.23 0.49 -0.29 0.00 -1.52 0.00 0.00 31.29 31.20 2k4j h VAL 15 CO 0.28 0.05 -0.71 -0.55 0.02 0.00 0.00 177.57 176.65 2k4j s SER 16 N -6.04 0.01 -0.02 0.57 0.15 -1.26 -5.17 113.70 101.94 2k4j s SER 16 Ca -0.07 0.03 -0.17 0.00 0.70 0.00 0.00 55.95 56.44 2k4j s SER 16 Cb 0.20 0.00 -0.05 0.00 -1.71 0.00 0.00 66.02 64.46 2k4j s SER 16 CO 0.75 -0.03 0.47 -0.70 1.20 0.00 0.00 173.24 174.93 2k4j s GLU 17 N 0.25 4.14 0.85 5.44 2.12 -1.26 -4.89 118.70 125.34 2k4j s GLU 17 Ca -0.02 0.50 -0.12 0.00 0.36 0.00 0.00 54.97 55.70 2k4j s GLU 17 Cb -0.03 -3.30 0.10 0.00 0.26 0.00 0.00 34.13 31.16 2k4j s GLU 17 CO -0.01 0.49 1.13 -1.25 -0.54 0.00 0.00 175.26 175.08 2k4j s PRO 18 N -0.48 1.67 0.30 4.30 0.04 -1.26 -4.65 135.00 134.92 2k4j s PRO 18 Ca 0.26 0.34 0.10 0.00 0.04 0.00 0.00 61.00 61.74 2k4j s PRO 18 Cb -0.17 -1.90 -0.06 0.00 0.04 0.00 0.00 34.50 32.42 2k4j s PRO 18 CO 0.14 -1.85 -0.14 0.20 0.04 0.00 0.00 177.00 175.40 2k4j s GLY 19 N -4.14 1.94 0.07 0.56 0.00 -0.37 -5.02 107.32 100.36 2k4j s GLY 19 Ca 0.62 -1.94 0.02 0.00 0.00 0.00 0.00 44.72 43.43 2k4j s GLY 19 CO 0.52 -1.95 -0.07 0.99 0.00 0.00 0.00 173.10 172.59 2k4j s ASP 20 N -3.52 1.04 -0.47 1.64 1.01 -1.26 -0.38 116.67 114.73 2k4j s ASP 20 Ca 0.30 -0.81 0.06 0.00 0.71 0.00 0.00 52.55 52.81 2k4j s ASP 20 Cb -0.01 0.07 0.28 0.00 1.01 0.00 0.00 42.92 44.28 2k4j s ASP 20 CO 0.14 -0.35 1.00 0.00 0.21 0.00 0.00 175.17 176.17 2k4j n ALA 21 N 0.61 -0.92 -0.92 5.23 0.00 -0.15 -4.93 120.51 119.43 2k4j n ALA 21 Ca -0.17 -1.53 0.00 0.00 0.00 0.00 0.00 53.44 51.74 2k4j n ALA 21 Cb 0.58 -1.23 0.00 0.00 0.00 0.00 0.00 19.45 18.81 2k4j n ALA 21 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2k4j n ASN 22 N 0.95 0.00 0.16 0.00 4.13 -1.26 -1.74 115.26 117.51 2k4j n ASN 22 Ca 0.08 0.00 0.07 0.00 1.68 0.00 0.00 54.58 56.41 2k4j n ASN 22 Cb 0.66 0.00 0.08 0.00 -1.54 0.00 0.00 39.78 38.98 2k4j n ASN 22 CO 0.00 0.00 0.00 0.40 0.28 0.00 0.00 177.26 177.94 2k4j h ILE 23 N 0.00 0.38 -2.26 2.41 2.04 -1.96 -3.47 117.51 114.65 2k4j h ILE 23 Ca 0.00 -1.56 -0.55 0.00 1.00 0.00 0.00 64.86 63.76 2k4j h ILE 23 Cb 0.00 2.12 -0.13 0.00 -0.74 0.00 0.00 36.82 38.07 2k4j h ILE 23 CO 0.00 0.22 -0.57 0.72 0.00 0.00 0.00 178.15 178.52 2k4j s PHE 24 N -3.11 1.98 0.06 1.37 -0.71 -0.71 -1.86 117.98 115.00 2k4j s PHE 24 Ca 0.04 -1.01 -0.05 0.00 -1.04 0.00 0.00 56.93 54.87 2k4j s PHE 24 Cb 0.07 -1.36 -0.02 0.00 -1.21 0.00 0.00 43.02 40.50 2k4j s PHE 24 CO 0.72 0.02 0.09 1.03 -1.34 0.00 0.00 175.22 175.74 2k4j s ARG 25 N -3.82 0.67 -0.04 1.99 0.52 0.07 -0.98 118.95 117.36 2k4j s ARG 25 Ca 0.28 -0.93 0.04 0.00 -0.52 0.00 0.00 55.73 54.61 2k4j s ARG 25 Cb 0.06 0.26 -0.00 0.00 0.52 0.00 0.00 34.95 35.79 2k4j s ARG 25 CO 0.14 -0.17 -0.17 0.54 0.02 0.00 0.00 175.30 175.65 2k4j s VAL 26 N -3.29 1.43 -0.28 3.52 0.11 0.48 -0.80 120.40 121.57 2k4j s VAL 26 Ca 0.01 -0.72 -0.06 0.00 -2.93 0.00 0.00 61.98 58.28 2k4j s VAL 26 Cb 0.03 -1.22 0.00 0.00 -1.53 0.00 0.00 36.38 33.66 2k4j s VAL 26 CO -0.08 0.41 0.05 -0.62 -3.33 0.00 0.00 175.10 171.53 2k4j s ASP 27 N 0.02 4.96 0.19 3.54 -1.08 -0.57 -1.23 116.67 122.49 2k4j s ASP 27 Ca -0.03 -0.62 0.24 0.00 -0.52 0.00 0.00 52.55 51.61 2k4j s ASP 27 Cb -0.11 -1.85 0.31 0.00 -1.46 0.00 0.00 42.92 39.81 2k4j s ASP 27 CO 0.02 -0.15 1.34 0.11 0.52 0.00 0.00 175.17 177.01 2k4j h LYS 28 N 8.20 0.00 0.01 4.34 6.56 -1.84 -0.61 116.57 133.23 2k4j h LYS 28 Ca -0.34 0.00 -0.00 0.00 -1.06 0.00 0.00 60.65 59.25 2k4j h LYS 28 Cb 1.13 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.79 2k4j h LYS 28 CO 0.60 0.00 -0.00 0.22 -2.06 0.00 0.00 179.45 178.20 2k4j h ASP 29 N 0.00 -0.01 0.63 0.86 3.58 -1.90 -3.34 116.42 116.24 2k4j h ASP 29 Ca 0.00 -0.82 0.00 0.00 0.42 0.00 0.00 57.03 56.63 2k4j h ASP 29 Cb 0.84 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.90 2k4j h ASP 29 CO 0.00 0.88 -0.82 -0.24 -2.88 0.00 0.00 179.24 176.18 2k4j n SER 30 N -4.66 0.64 -1.65 2.28 2.88 -1.26 -5.01 113.62 106.84 2k4j n SER 30 Ca -0.09 -0.06 -0.03 0.00 -1.33 0.00 0.00 58.87 57.35 2k4j n SER 30 Cb 0.40 0.48 0.02 0.00 -0.75 0.00 0.00 64.21 64.36 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 -2.00 -1.01 -4.49 -1.46 0.63 -0.83 -5.06 116.66 102.43 2k4j n ARG 31 Ca 0.03 0.18 -0.24 0.00 -0.92 0.00 0.00 57.85 56.89 2k4j n ARG 31 Cb 0.43 -2.88 -0.10 0.00 0.45 0.00 0.00 32.46 30.36 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 -3.88 1.71 -0.05 -0.14 2.02 -0.30 -4.51 118.70 113.55 2k4j s GLU 32 Ca 0.04 -1.84 0.02 0.00 0.02 0.00 0.00 54.97 53.20 2k4j s GLU 32 Cb -0.01 -1.63 0.02 0.00 0.10 0.00 0.00 34.13 32.61 2k4j s GLU 32 CO 0.15 0.20 -0.08 0.54 0.02 0.00 0.00 175.26 176.09 2k4j s VAL 33 N -2.64 0.77 -0.23 2.63 0.11 0.47 -1.51 120.40 120.00 2k4j s VAL 33 Ca 0.31 -0.27 -0.07 0.00 -2.93 0.00 0.00 61.98 59.02 2k4j s VAL 33 Cb -0.00 -0.74 -0.03 0.00 -1.53 0.00 0.00 36.38 34.07 2k4j s VAL 33 CO 0.15 0.27 0.05 -0.31 -3.33 0.00 0.00 175.10 171.94 2k4j s TYR 34 N 0.78 3.09 0.30 1.54 2.02 0.02 -1.15 117.35 123.95 2k4j s TYR 34 Ca -0.13 -0.37 -0.09 0.00 -0.37 0.00 0.00 57.07 56.11 2k4j s TYR 34 Cb -0.15 -2.18 -0.07 0.00 -0.40 0.00 0.00 41.96 39.16 2k4j s TYR 34 CO 0.02 -0.27 0.63 1.41 -1.57 0.00 0.00 175.55 175.77 2k4j s MET 35 N 1.33 3.77 0.59 -0.62 -2.45 -0.30 -0.75 119.30 120.87 2k4j s MET 35 Ca 0.05 0.30 0.29 0.00 -1.25 0.00 0.00 55.69 55.07 2k4j s MET 35 Cb -0.15 -2.55 1.48 0.00 1.25 0.00 0.00 34.83 34.86 2k4j s MET 35 CO 0.03 0.18 1.89 1.25 1.05 0.00 0.00 175.02 179.42 2k4j h HIS 36 N 1.93 0.00 0.12 4.11 2.76 -1.74 -0.78 115.15 121.55 2k4j h HIS 36 Ca -0.47 0.00 -0.31 0.00 -2.20 0.00 0.00 60.37 57.38 2k4j h HIS 36 Cb 1.18 0.00 -0.01 0.00 1.55 0.00 0.00 27.41 30.13 2k4j h HIS 36 CO 0.60 0.00 -1.60 0.93 -1.30 0.00 0.00 177.93 176.57 2k4j h GLU 37 N 0.00 0.26 -1.61 5.26 5.08 -1.94 -3.50 114.58 118.13 2k4j h GLU 37 Ca 0.21 -0.44 0.12 0.00 -1.00 0.00 0.00 59.36 58.24 2k4j h GLU 37 Cb 1.17 0.17 -0.22 0.00 0.50 0.00 0.00 28.75 30.36 2k4j h GLU 37 CO -0.00 1.12 0.61 -1.59 -1.00 0.00 0.00 179.01 178.15 2k4j s LYS 38 N -2.61 0.54 0.05 2.33 0.00 -0.30 -4.97 119.74 114.78 2k4j s LYS 38 Ca -0.10 0.03 -0.30 0.00 0.00 0.00 0.00 55.97 55.60 2k4j s LYS 38 Cb 0.07 0.25 -0.04 0.00 0.00 0.00 0.00 37.83 38.10 2k4j s LYS 38 CO 0.85 -0.19 0.96 0.15 0.00 0.00 0.00 175.35 177.12 2k4j s LYS 39 N -1.55 4.62 0.02 1.78 -0.14 -1.26 -1.15 119.74 122.06 2k4j s LYS 39 Ca 0.02 1.42 0.02 0.00 -1.36 0.00 0.00 55.97 56.07 2k4j s LYS 39 Cb -0.01 -3.42 -0.01 0.00 -1.68 0.00 0.00 37.83 32.71 2k4j s LYS 39 CO -0.02 0.08 -0.07 -0.51 -0.76 0.00 0.00 175.35 174.07 2k4j s LEU 40 N 0.52 2.13 -0.38 3.17 1.43 -0.30 -4.92 118.68 120.33 2k4j s LEU 40 Ca 0.49 -0.32 0.10 0.00 -1.03 0.00 0.00 54.13 53.37 2k4j s LEU 40 Cb -0.22 -0.27 0.39 0.00 0.03 0.00 0.00 46.19 46.12 2k4j s LEU 40 CO 0.29 -0.05 1.41 -0.90 0.23 0.00 0.00 176.35 177.32 2k4j n ASP 41 N 2.23 -1.74 0.00 2.29 5.75 -1.26 -0.39 116.55 123.43 2k4j n ASP 41 Ca -0.17 -2.35 0.00 0.00 -0.01 0.00 0.00 54.79 52.25 2k4j n ASP 41 Cb 0.56 0.91 0.00 0.00 -1.03 0.00 0.00 41.12 41.56 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 -0.90 0.00 -4.02 -2.12 7.99 -1.26 -4.94 117.00 111.76 2k4j n LEU 42 Ca -0.08 0.00 -0.10 0.00 -0.01 0.00 0.00 56.01 55.82 2k4j n LEU 42 Cb 0.85 0.00 -0.07 0.00 -0.11 0.00 0.00 43.42 44.09 2k4j n LEU 42 CO -0.11 0.00 -0.02 -0.89 -1.51 0.00 0.00 177.39 174.87 2k4j s THR 43 N 0.00 0.04 0.29 -5.08 2.01 -1.26 -4.94 115.64 106.70 2k4j s THR 43 Ca 0.00 -1.51 0.03 0.00 0.31 0.00 0.00 61.69 60.52 2k4j s THR 43 Cb 0.00 -2.05 0.28 0.00 0.01 0.00 0.00 72.50 70.74 2k4j s THR 43 CO 0.00 -0.18 1.74 -0.09 -0.69 0.00 0.00 174.62 175.40 2k4j h ARG 44 N 2.49 0.55 0.09 4.92 2.43 -1.99 -0.27 114.38 122.61 2k4j h ARG 44 Ca -0.31 -0.03 -0.00 0.00 -0.81 0.00 0.00 59.98 58.82 2k4j h ARG 44 Cb 1.24 -0.12 0.00 0.00 -0.42 0.00 0.00 29.97 30.66 2k4j h ARG 44 CO 0.46 0.36 -0.04 0.00 -1.51 0.00 0.00 179.97 179.24 2k4j h ALA 45 N 1.65 -0.12 -0.82 2.80 0.00 -1.97 0.09 119.26 120.88 2k4j h ALA 45 Ca 0.54 -0.11 -0.02 0.00 0.00 0.00 0.00 54.91 55.32 2k4j h ALA 45 Cb 0.90 0.05 -0.04 0.00 0.00 0.00 0.00 17.79 18.70 2k4j h ALA 45 CO -0.44 -0.47 0.44 0.93 0.00 0.00 0.00 179.25 179.72 2k4j h GLU 46 N -0.32 1.15 0.02 0.00 3.07 -1.69 -1.53 114.58 115.29 2k4j h GLU 46 Ca -0.01 -0.14 0.03 0.00 -0.50 0.00 0.00 59.36 58.74 2k4j h GLU 46 Cb 0.27 -0.22 -0.05 0.00 -0.84 0.00 0.00 28.75 27.90 2k4j h GLU 46 CO 0.02 0.85 -0.34 -0.92 -1.40 0.00 0.00 179.01 177.23 2k4j h TYR 47 N 1.15 -0.93 -0.71 4.33 3.20 -1.06 -1.59 116.97 121.37 2k4j h TYR 47 Ca 0.29 0.03 0.12 0.00 3.14 0.00 0.00 58.73 62.31 2k4j h TYR 47 Cb 0.04 0.41 -0.09 0.00 1.54 0.00 0.00 36.73 38.63 2k4j h TYR 47 CO 0.01 -0.43 0.28 1.49 -1.64 0.00 0.00 178.16 177.87 2k4j h GLU 48 N -0.50 0.44 0.02 1.82 4.57 -0.02 0.62 114.58 121.52 2k4j h GLU 48 Ca 0.06 -0.03 -0.00 0.00 -1.18 0.00 0.00 59.36 58.21 2k4j h GLU 48 Cb 0.58 -0.10 0.00 0.00 -0.16 0.00 0.00 28.75 29.07 2k4j h GLU 48 CO -0.26 0.29 -0.01 0.82 -1.18 0.00 0.00 179.01 178.67 2k4j h ILE 49 N 0.45 1.14 -0.42 2.32 2.04 -1.17 -1.92 117.51 119.95 2k4j h ILE 49 Ca 0.37 -0.50 -0.14 0.00 1.00 0.00 0.00 64.86 65.60 2k4j h ILE 49 Cb 0.52 1.48 -0.01 0.00 -0.74 0.00 0.00 36.82 38.07 2k4j h ILE 49 CO -0.36 0.13 -0.28 0.25 0.00 0.00 0.00 178.15 177.89 2k4j h LEU 50 N -0.24 0.95 -0.35 1.44 6.46 -0.62 0.46 115.31 123.41 2k4j h LEU 50 Ca -0.00 -0.38 -0.02 0.00 -0.12 0.00 0.00 57.88 57.36 2k4j h LEU 50 Cb 0.23 -0.26 -0.02 0.00 -0.73 0.00 0.00 40.66 39.88 2k4j h LEU 50 CO 0.00 1.16 0.14 0.77 -0.62 0.00 0.00 178.44 179.89 2k4j h SER 51 N 0.77 0.48 -0.38 1.25 4.64 -0.96 -1.34 113.55 118.02 2k4j h SER 51 Ca 0.09 -0.16 -0.06 0.00 -0.47 0.00 0.00 61.79 61.18 2k4j h SER 51 Cb 0.84 -0.12 -0.02 0.00 -0.31 0.00 0.00 62.40 62.79 2k4j h SER 51 CO 0.07 0.51 0.02 0.25 -0.87 0.00 0.00 176.83 176.82 2k4j h LEU 52 N 0.42 0.70 -0.25 5.97 7.12 -1.17 -0.94 115.31 127.15 2k4j h LEU 52 Ca 0.12 -0.15 -0.00 0.00 0.13 0.00 0.00 57.88 57.97 2k4j h LEU 52 Cb 0.18 -0.19 -0.01 0.00 -0.53 0.00 0.00 40.66 40.11 2k4j h LEU 52 CO -0.01 0.76 0.16 0.25 -0.13 0.00 0.00 178.44 179.46 2k4j h LEU 53 N 0.70 0.30 -0.67 2.25 5.85 -0.72 0.80 115.31 123.82 2k4j h LEU 53 Ca 0.14 -0.05 -0.03 0.00 0.84 0.00 0.00 57.88 58.78 2k4j h LEU 53 Cb 0.40 -0.08 -0.03 0.00 0.37 0.00 0.00 40.66 41.32 2k4j h LEU 53 CO 0.01 0.26 0.29 0.40 -0.34 0.00 0.00 178.44 179.06 2k4j h ILE 54 N 0.32 1.24 -0.54 4.05 2.04 -1.04 0.62 117.51 124.19 2k4j h ILE 54 Ca 0.09 -0.71 -0.04 0.00 1.00 0.00 0.00 64.86 65.20 2k4j h ILE 54 Cb 0.01 0.45 -0.02 0.00 -0.74 0.00 0.00 36.82 36.52 2k4j h ILE 54 CO -0.02 0.29 0.18 -1.28 0.00 0.00 0.00 178.15 177.32 2k4j h SER 55 N 0.95 0.77 1.27 1.72 0.87 -0.87 -3.11 113.55 115.15 2k4j h SER 55 Ca 0.23 -0.20 0.00 0.00 -1.23 0.00 0.00 61.79 60.59 2k4j h SER 55 Cb 0.18 -0.20 0.00 0.00 -0.44 0.00 0.00 62.40 61.93 2k4j h SER 55 CO -0.02 0.76 -0.31 0.07 -0.53 0.00 0.00 176.83 176.80 2k4j h LYS 56 N 0.74 0.00 0.00 2.24 2.10 -0.77 -3.50 116.57 117.38 2k4j h LYS 56 Ca 0.18 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.83 2k4j h LYS 56 Cb 0.25 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.58 2k4j h LYS 56 CO -0.01 0.00 0.00 1.17 -2.00 0.00 0.00 179.45 178.61 2k4j n LYS 57 N -2.34 0.00 -0.27 0.07 4.81 0.20 -4.98 118.16 115.66 2k4j n LYS 57 Ca 0.04 0.00 -0.11 0.00 -0.87 0.00 0.00 58.31 57.37 2k4j n LYS 57 Cb 0.45 0.00 -0.08 0.00 0.02 0.00 0.00 35.03 35.43 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 -0.76 0.00 3.14 0.00 -1.77 -3.43 103.07 100.24 2k4j h GLY 58 Ca 0.00 0.70 0.00 0.00 0.00 0.00 0.00 47.33 48.03 2k4j h GLY 58 CO 0.00 -0.07 0.00 2.98 0.00 0.00 0.00 176.54 179.45 2k4j n TYR 59 N -5.35 0.00 -3.98 5.60 9.36 -0.90 -4.21 117.16 117.68 2k4j n TYR 59 Ca 0.00 0.00 -0.35 0.00 3.32 0.00 0.00 57.90 60.87 2k4j n TYR 59 Cb 0.32 0.09 -0.12 0.00 -0.63 0.00 0.00 39.34 39.00 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 4.30 -1.29 2.97 1.01 -1.26 -1.01 120.40 125.11 2k4j s VAL 60 Ca 0.00 -0.19 -0.18 0.00 0.00 0.00 0.00 61.98 61.60 2k4j s VAL 60 Cb 0.00 -2.96 0.04 0.00 0.00 0.00 0.00 36.38 33.46 2k4j s VAL 60 CO 0.00 0.41 1.82 0.33 0.00 0.00 0.00 175.10 177.66 2k4j n PHE 61 N 4.23 4.23 -3.15 5.22 -0.00 0.10 -4.84 117.46 123.25 2k4j n PHE 61 Ca -0.17 -2.64 -0.32 0.00 -0.00 0.00 0.00 57.45 54.32 2k4j n PHE 61 Cb 0.52 -2.61 -0.05 0.00 -0.00 0.00 0.00 39.48 37.33 2k4j n PHE 61 CO 0.00 0.00 0.00 -1.12 -0.00 0.00 0.00 176.76 175.64 2k4j s SER 62 N 4.44 6.70 0.32 -2.13 0.01 -1.26 -1.59 113.70 120.18 2k4j s SER 62 Ca 0.55 1.17 0.09 0.00 1.31 0.00 0.00 55.95 59.08 2k4j s SER 62 Cb 0.05 -2.33 0.85 0.00 0.21 0.00 0.00 66.02 64.79 2k4j s SER 62 CO 0.07 -0.21 1.75 0.08 0.41 0.00 0.00 173.24 175.33 2k4j h ARG 63 N 2.13 0.61 0.06 12.44 -0.00 -1.85 0.15 114.38 127.92 2k4j h ARG 63 Ca -0.48 -0.04 -0.28 0.00 -0.00 0.00 0.00 59.98 59.19 2k4j h ARG 63 Cb 1.18 -0.14 0.02 0.00 -0.00 0.00 0.00 29.97 31.03 2k4j h ARG 63 CO 0.66 0.41 -1.13 0.93 -0.00 0.00 0.00 179.97 180.83 2k4j h GLU 64 N 0.63 0.63 -0.91 0.08 5.08 -1.84 -1.46 114.58 116.80 2k4j h GLU 64 Ca 0.62 -0.76 0.02 0.00 -1.00 0.00 0.00 59.36 58.25 2k4j h GLU 64 Cb 1.13 0.23 -0.05 0.00 0.50 0.00 0.00 28.75 30.57 2k4j h GLU 64 CO -0.44 1.33 0.60 0.77 -1.00 0.00 0.00 179.01 180.27 2k4j h SER 65 N 0.32 1.02 -0.18 1.42 0.02 -1.70 -0.07 113.55 114.38 2k4j h SER 65 Ca -0.15 -0.02 0.04 0.00 -0.84 0.00 0.00 61.79 60.82 2k4j h SER 65 Cb 1.79 -0.24 -0.04 0.00 0.14 0.00 0.00 62.40 64.05 2k4j h SER 65 CO 0.22 0.72 -0.05 0.40 -1.14 0.00 0.00 176.83 176.97 2k4j h ILE 66 N 1.19 0.80 0.00 3.27 1.08 -0.74 0.95 117.51 124.07 2k4j h ILE 66 Ca 0.34 0.00 -0.01 0.00 -0.39 0.00 0.00 64.86 64.81 2k4j h ILE 66 Cb -0.08 0.80 -0.00 0.00 -3.07 0.00 0.00 36.82 34.47 2k4j h ILE 66 CO -0.09 0.00 -0.03 0.00 -0.69 0.00 0.00 178.15 177.34 2k4j h ALA 67 N 1.16 1.32 0.10 1.87 0.00 -0.65 -0.11 119.26 122.95 2k4j h ALA 67 Ca 0.09 -0.03 -0.32 0.00 0.00 0.00 0.00 54.91 54.65 2k4j h ALA 67 Cb 0.15 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 2k4j h ALA 67 CO -0.19 0.04 -1.75 0.82 0.00 0.00 0.00 179.25 178.17 2k4j h ILE 68 N 0.00 0.76 0.00 0.00 2.04 -0.45 -3.25 117.51 116.61 2k4j h ILE 68 Ca -0.00 -2.32 -0.06 0.00 1.00 0.00 0.00 64.86 63.48 2k4j h ILE 68 Cb 0.11 2.48 -0.01 0.00 -0.74 0.00 0.00 36.82 38.66 2k4j h ILE 68 CO 0.00 0.74 -1.82 -0.62 0.00 0.00 0.00 178.15 176.46 2k4j n GLU 69 N -3.76 0.65 -0.07 2.37 4.71 0.28 -4.37 120.64 120.44 2k4j n GLU 69 Ca -0.31 -0.08 -0.06 0.00 -0.01 0.00 0.00 57.16 56.70 2k4j n GLU 69 Cb 0.95 -1.60 -0.02 0.00 -1.01 0.00 0.00 31.44 29.76 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 -2.45 1.83 0.00 1.62 2.88 -0.07 -4.08 113.62 113.35 2k4j n SER 70 Ca -0.07 0.57 0.00 0.00 -1.33 0.00 0.00 58.87 58.03 2k4j n SER 70 Cb 0.66 -0.84 0.00 0.00 -0.75 0.00 0.00 64.21 63.28 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 -4.57 -1.08 0.00 -1.46 2.13 -1.15 -4.88 120.64 109.64 2k4j n GLU 71 Ca -0.09 0.27 0.00 0.00 0.66 0.00 0.00 57.16 58.00 2k4j n GLU 71 Cb 0.32 -4.25 0.00 0.00 0.27 0.00 0.00 31.44 27.78 2k4j n GLU 71 CO 0.00 0.00 0.00 0.43 -0.41 0.00 0.00 177.13 177.15 2k4j n SER 72 N -0.54 0.67 -3.84 4.31 7.64 -1.26 -4.80 113.62 115.79 2k4j n SER 72 Ca 0.00 -1.28 -0.14 0.00 1.01 0.00 0.00 58.87 58.45 2k4j n SER 72 Cb 0.27 -0.32 -0.15 0.00 -1.01 0.00 0.00 64.21 63.00 2k4j n SER 72 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 2k4j s ILE 73 N -0.97 0.08 -0.01 0.44 -1.09 -1.26 -5.10 121.20 113.28 2k4j s ILE 73 Ca 0.00 0.05 -0.24 0.00 -2.23 0.00 0.00 60.65 58.23 2k4j s ILE 73 Cb 0.00 -0.13 -0.17 0.00 -1.58 0.00 0.00 42.46 40.57 2k4j s ILE 73 CO 0.00 0.07 1.17 0.78 -1.23 0.00 0.00 174.94 175.74 2k4j h ASN 74 N 6.69 -0.21 -3.43 3.58 2.35 -2.02 -3.44 115.58 119.10 2k4j h ASN 74 Ca -0.35 -0.29 -0.52 0.00 -0.55 0.00 0.00 56.30 54.59 2k4j h ASN 74 Cb 1.17 0.05 0.02 0.00 0.05 0.00 0.00 38.32 39.61 2k4j h ASN 74 CO 0.49 0.22 0.56 -2.16 -1.65 0.00 0.00 177.43 174.89 2k4j s PRO 75 N -4.32 4.48 0.07 0.81 0.04 -1.26 -4.94 135.00 129.88 2k4j s PRO 75 Ca -0.14 1.87 0.21 0.00 0.04 0.00 0.00 61.00 62.97 2k4j s PRO 75 Cb 0.02 -3.25 0.85 0.00 0.04 0.00 0.00 34.50 32.15 2k4j s PRO 75 CO 0.56 -0.12 1.64 0.39 0.04 0.00 0.00 177.00 179.52 2k4j n GLU 76 N 2.72 0.06 0.18 4.56 1.02 -1.26 -1.46 120.64 126.47 2k4j n GLU 76 Ca 0.05 0.23 0.08 0.00 -0.02 0.00 0.00 57.16 57.49 2k4j n GLU 76 Cb 0.45 -1.60 0.13 0.00 -0.02 0.00 0.00 31.44 30.39 2k4j n GLU 76 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 2k4j h SER 77 N 0.00 0.00 -4.12 1.62 4.64 -1.92 -3.43 113.55 110.34 2k4j h SER 77 Ca 0.00 0.00 -0.31 0.00 -0.47 0.00 0.00 61.79 61.01 2k4j h SER 77 Cb 0.37 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.44 2k4j h SER 77 CO 0.00 0.24 -0.43 -1.20 -0.87 0.00 0.00 176.83 174.57 2k4j n SER 78 N -3.17 -4.39 -0.17 4.97 7.64 -0.53 -4.39 113.62 113.59 2k4j n SER 78 Ca 0.03 -0.00 0.10 0.00 1.01 0.00 0.00 58.87 60.01 2k4j n SER 78 Cb 0.62 -3.67 0.42 0.00 -1.01 0.00 0.00 64.21 60.57 2k4j n SER 78 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2k4j h ASN 79 N -0.35 0.54 1.17 6.43 -1.07 -1.90 0.01 115.58 120.41 2k4j h ASN 79 Ca -0.37 0.01 -0.14 0.00 0.07 0.00 0.00 56.30 55.87 2k4j h ASN 79 Cb 1.27 -0.10 -0.02 0.00 -2.07 0.00 0.00 38.32 37.40 2k4j h ASN 79 CO 0.44 0.32 -0.69 0.11 0.07 0.00 0.00 177.43 177.68 2k4j h LYS 80 N 0.60 0.00 0.87 4.14 6.56 -1.96 -3.11 116.57 123.66 2k4j h LYS 80 Ca 0.33 0.00 -0.04 0.00 -1.06 0.00 0.00 60.65 59.88 2k4j h LYS 80 Cb 0.50 0.00 0.01 0.00 -0.57 0.00 0.00 32.23 32.17 2k4j h LYS 80 CO -0.12 0.69 -0.42 1.03 -2.06 0.00 0.00 179.45 178.58 2k4j h SER 81 N 0.00 -0.98 -0.78 0.86 0.87 -1.41 -0.69 113.55 111.41 2k4j h SER 81 Ca -0.01 0.03 0.10 0.00 -1.23 0.00 0.00 61.79 60.68 2k4j h SER 81 Cb 1.46 0.25 -0.05 0.00 -0.44 0.00 0.00 62.40 63.62 2k4j h SER 81 CO 0.09 -0.66 0.51 0.16 -0.53 0.00 0.00 176.83 176.40 2k4j h ILE 82 N -1.25 0.93 -0.20 2.23 3.07 -1.43 0.18 117.51 121.05 2k4j h ILE 82 Ca -0.12 -0.24 -0.02 0.00 1.55 0.00 0.00 64.86 66.04 2k4j h ILE 82 Cb 0.90 0.18 -0.01 0.00 -0.27 0.00 0.00 36.82 37.62 2k4j h ILE 82 CO 0.20 0.13 0.06 -0.78 -1.05 0.00 0.00 178.15 176.70 2k4j h ASP 83 N 0.69 0.29 -0.30 2.16 3.58 -1.52 0.22 116.42 121.52 2k4j h ASP 83 Ca 0.37 -0.21 0.00 0.00 0.42 0.00 0.00 57.03 57.61 2k4j h ASP 83 Cb 0.49 -0.07 -0.02 0.00 1.72 0.00 0.00 39.33 41.45 2k4j h ASP 83 CO -0.14 0.42 0.20 0.58 -2.88 0.00 0.00 179.24 177.41 2k4j h VAL 84 N 0.14 1.07 0.69 2.25 2.07 0.05 -1.16 116.25 121.37 2k4j h VAL 84 Ca 0.06 -0.14 -0.03 0.00 0.82 0.00 0.00 66.70 67.41 2k4j h VAL 84 Cb 0.23 0.63 0.01 0.00 -1.52 0.00 0.00 31.29 30.64 2k4j h VAL 84 CO -0.00 0.07 -0.33 0.40 0.02 0.00 0.00 177.57 177.73 2k4j h ILE 85 N 0.40 0.23 -0.75 4.57 1.08 -0.57 -0.66 117.51 121.81 2k4j h ILE 85 Ca 0.11 -0.20 -0.03 0.00 -0.39 0.00 0.00 64.86 64.35 2k4j h ILE 85 Cb -0.04 0.28 -0.03 0.00 -3.07 0.00 0.00 36.82 33.96 2k4j h ILE 85 CO -0.03 0.02 0.35 0.40 -0.69 0.00 0.00 178.15 178.20 2k4j h ILE 86 N -1.08 1.24 -0.06 -0.67 1.08 -1.03 0.41 117.51 117.40 2k4j h ILE 86 Ca -0.09 -0.69 -0.00 0.00 -0.39 0.00 0.00 64.86 63.68 2k4j h ILE 86 Cb 0.74 0.32 -0.00 0.00 -3.07 0.00 0.00 36.82 34.80 2k4j h ILE 86 CO 0.15 0.29 0.04 1.23 -0.69 0.00 0.00 178.15 179.17 2k4j h GLY 87 N 1.05 0.09 1.59 5.37 0.00 -1.10 -0.79 103.07 109.28 2k4j h GLY 87 Ca 0.26 -0.04 -0.16 0.00 0.00 0.00 0.00 47.33 47.39 2k4j h GLY 87 CO -0.03 0.04 -0.99 3.21 0.00 0.00 0.00 176.54 178.77 2k4j h ARG 88 N 0.05 0.00 0.64 4.80 -0.00 -1.06 -1.31 114.38 117.50 2k4j h ARG 88 Ca 0.02 0.00 -0.03 0.00 -0.50 0.00 0.00 59.98 59.47 2k4j h ARG 88 Cb 0.04 0.00 0.01 0.00 0.00 0.00 0.00 29.97 30.01 2k4j h ARG 88 CO -0.00 0.52 -0.31 1.25 0.00 0.00 0.00 179.97 181.43 2k4j h LEU 89 N 0.00 -0.75 -0.64 3.04 6.46 -0.89 -0.52 115.31 122.01 2k4j h LEU 89 Ca -0.08 0.03 0.07 0.00 -0.12 0.00 0.00 57.88 57.78 2k4j h LEU 89 Cb 1.57 0.19 -0.06 0.00 -0.73 0.00 0.00 40.66 41.64 2k4j h LEU 89 CO 0.07 -0.53 0.32 0.03 -0.62 0.00 0.00 178.44 177.72 2k4j h ARG 90 N -0.87 0.57 -0.32 1.25 3.08 -1.18 -0.85 114.38 116.06 2k4j h ARG 90 Ca -0.09 -0.03 0.02 0.00 0.07 0.00 0.00 59.98 59.95 2k4j h ARG 90 Cb 0.67 -0.13 -0.03 0.00 0.08 0.00 0.00 29.97 30.56 2k4j h ARG 90 CO 0.14 0.38 0.15 1.03 -1.07 0.00 0.00 179.97 180.60 2k4j h SER 91 N 0.59 0.22 -0.50 7.04 0.87 -1.16 0.66 113.55 121.27 2k4j h SER 91 Ca 0.30 0.02 -0.10 0.00 -1.23 0.00 0.00 61.79 60.77 2k4j h SER 91 Cb 0.25 -0.02 -0.02 0.00 -0.44 0.00 0.00 62.40 62.17 2k4j h SER 91 CO -0.22 0.17 -0.08 0.11 -0.53 0.00 0.00 176.83 176.28 2k4j h LYS 92 N 0.32 0.97 -0.00 2.24 1.57 -0.43 -1.15 116.57 120.09 2k4j h LYS 92 Ca 0.14 -0.33 0.00 0.00 -1.87 0.00 0.00 60.65 58.58 2k4j h LYS 92 Cb 0.06 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 32.30 2k4j h LYS 92 CO -0.10 1.00 -0.04 0.44 -0.57 0.00 0.00 179.45 180.17 2k4j n ILE 93 N -4.16 0.00 0.08 1.86 -6.64 -0.38 -1.53 119.36 108.59 2k4j n ILE 93 Ca 0.02 -0.00 -0.22 0.00 -1.77 0.00 0.00 62.75 60.78 2k4j n ILE 93 Cb 0.38 -0.42 -0.15 0.00 -1.44 0.00 0.00 39.64 38.01 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 0.03 0.38 -0.03 6.28 4.81 -0.62 -3.40 114.58 122.03 2k4j h GLU 94 Ca 0.00 -0.65 -0.01 0.00 -0.13 0.00 0.00 59.36 58.58 2k4j h GLU 94 Cb 0.44 0.24 -0.00 0.00 0.63 0.00 0.00 28.75 30.06 2k4j h GLU 94 CO 0.00 1.28 -0.02 -0.22 -0.73 0.00 0.00 179.01 179.33 2k4j h LYS 95 N 0.10 0.06 -7.20 1.92 3.64 -1.10 -3.44 116.57 110.55 2k4j h LYS 95 Ca -0.31 -0.03 -0.49 0.00 -1.27 0.00 0.00 60.65 58.55 2k4j h LYS 95 Cb 2.09 -0.00 0.05 0.00 -0.41 0.00 0.00 32.23 33.96 2k4j h LYS 95 CO 0.18 0.47 0.38 -0.80 -2.27 0.00 0.00 179.45 177.41 2k4j s ASN 96 N -5.70 6.11 0.34 4.20 -0.87 -0.58 -5.00 114.94 113.43 2k4j s ASN 96 Ca -0.15 1.70 0.16 0.00 -1.57 0.00 0.00 52.86 53.00 2k4j s ASN 96 Cb 0.03 -2.52 0.56 0.00 -0.02 0.00 0.00 41.25 39.29 2k4j s ASN 96 CO 0.69 -0.94 1.68 1.55 -2.57 0.00 0.00 177.10 177.51 2k4j h PRO 97 N 0.56 0.00 -6.45 -0.60 0.13 -1.85 -3.44 132.00 120.35 2k4j h PRO 97 Ca -0.47 0.00 -0.53 0.00 -0.87 0.00 0.00 66.00 64.13 2k4j h PRO 97 Cb 1.21 0.00 0.02 0.00 0.13 0.00 0.00 31.00 32.35 2k4j h PRO 97 CO 0.59 0.46 0.94 0.21 -0.23 0.00 0.00 178.00 179.97 2k4j s LYS 98 N -3.58 4.22 0.04 0.86 2.47 -1.26 -5.01 119.74 117.48 2k4j s LYS 98 Ca -0.00 2.24 -0.02 0.00 -1.56 0.00 0.00 55.97 56.63 2k4j s LYS 98 Cb 0.11 -3.55 -0.02 0.00 -1.46 0.00 0.00 37.83 32.91 2k4j s LYS 98 CO 0.71 -0.68 0.01 1.14 0.16 0.00 0.00 175.35 176.70 2k4j s GLN 99 N 2.42 0.52 0.68 4.03 -2.07 -1.26 -4.62 119.66 119.36 2k4j s GLN 99 Ca 0.71 -0.89 -0.11 0.00 -1.82 0.00 0.00 55.36 53.25 2k4j s GLN 99 Cb -0.38 0.19 -0.00 0.00 -1.09 0.00 0.00 33.01 31.72 2k4j s GLN 99 CO 0.31 -0.11 1.07 -1.25 -1.32 0.00 0.00 175.29 173.99 2k4j s PRO 100 N -2.79 3.11 0.00 9.60 0.04 -1.26 -4.98 135.00 138.71 2k4j s PRO 100 Ca -0.03 0.59 0.00 0.00 0.04 0.00 0.00 61.00 61.60 2k4j s PRO 100 Cb -0.00 -2.04 0.00 0.00 0.04 0.00 0.00 34.50 32.50 2k4j s PRO 100 CO -0.06 -0.88 0.00 0.00 0.04 0.00 0.00 177.00 176.10 2k4j n GLN 101 N -2.93 0.00 0.00 4.56 10.64 -1.26 -4.95 117.38 123.44 2k4j n GLN 101 Ca 0.07 0.00 0.12 0.00 -1.83 0.00 0.00 57.00 55.36 2k4j n GLN 101 Cb 0.56 -0.18 0.20 0.00 -0.86 0.00 0.00 30.24 29.96 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 -0.63 0.00 -3.87 2.61 4.01 -1.26 -4.79 117.16 113.23 2k4j n TYR 102 Ca 0.00 0.00 -0.35 0.00 -0.16 0.00 0.00 57.90 57.39 2k4j n TYR 102 Cb 0.00 -0.03 -0.09 0.00 -0.31 0.00 0.00 39.34 38.92 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 -2.26 5.15 -0.08 -0.72 2.07 -1.26 -4.14 121.20 119.95 2k4j s ILE 103 Ca 0.26 0.09 0.01 0.00 -1.41 0.00 0.00 60.65 59.61 2k4j s ILE 103 Cb 0.19 -3.33 0.02 0.00 0.13 0.00 0.00 42.46 39.48 2k4j s ILE 103 CO 0.44 0.47 -0.11 -0.63 -1.91 0.00 0.00 174.94 173.20 2k4j s ILE 104 N 0.21 1.10 0.07 2.00 1.01 -0.15 -5.00 121.20 120.43 2k4j s ILE 104 Ca 0.07 -0.41 -0.22 0.00 0.00 0.00 0.00 60.65 60.09 2k4j s ILE 104 Cb -0.12 -1.05 -0.06 0.00 0.01 0.00 0.00 42.46 41.24 2k4j s ILE 104 CO -0.01 0.36 0.65 -0.55 0.00 0.00 0.00 174.94 175.39 2k4j s SER 105 N 1.07 7.13 -0.27 3.58 0.15 -1.26 -0.25 113.70 123.84 2k4j s SER 105 Ca -0.07 1.34 -0.00 0.00 0.70 0.00 0.00 55.95 57.92 2k4j s SER 105 Cb -0.15 -2.41 0.08 0.00 -1.71 0.00 0.00 66.02 61.84 2k4j s SER 105 CO -0.01 0.17 0.04 -0.69 1.20 0.00 0.00 173.24 173.95 2k4j s VAL 106 N -0.69 1.18 0.27 4.45 1.01 0.42 -4.95 120.40 122.09 2k4j s VAL 106 Ca 0.32 -1.33 -0.30 0.00 0.00 0.00 0.00 61.98 60.67 2k4j s VAL 106 Cb -0.20 -1.73 -0.11 0.00 0.00 0.00 0.00 36.38 34.34 2k4j s VAL 106 CO 0.21 -0.43 1.53 -0.13 0.00 0.00 0.00 175.10 176.27 2k4j s ARG 107 N 1.50 4.19 0.00 2.72 3.00 -1.26 -1.61 118.95 127.50 2k4j s ARG 107 Ca 0.04 2.44 0.00 0.00 0.00 0.00 0.00 55.73 58.21 2k4j s ARG 107 Cb -0.18 -3.07 0.00 0.00 0.00 0.00 0.00 34.95 31.70 2k4j s ARG 107 CO -0.15 -0.54 0.00 0.41 0.00 0.00 0.00 175.30 175.03 2k4j n GLY 108 N 2.29 1.18 1.49 -3.53 0.00 -1.26 -4.84 105.19 100.53 2k4j n GLY 108 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.10 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 0.65 -2.67 -0.61 5.41 -0.97 -5.06 119.36 114.11 2k4j n ILE 109 Ca 0.00 0.21 0.00 0.00 1.00 0.00 0.00 62.75 63.96 2k4j n ILE 109 Cb 0.00 -1.07 0.00 0.00 -0.71 0.00 0.00 39.64 37.86 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 2.57 -0.07 3.00 7.39 0.00 -0.63 -3.35 105.19 114.09 2k4j n GLY 110 Ca 0.00 -1.38 -0.31 0.00 0.00 0.00 0.00 46.02 44.33 2k4j n GLY 110 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2k4j s TYR 111 N -2.96 2.66 0.33 1.61 1.13 -0.62 -0.43 117.35 119.06 2k4j s TYR 111 Ca 0.00 -1.87 -0.29 0.00 -1.41 0.00 0.00 57.07 53.50 2k4j s TYR 111 Cb 0.00 -1.70 -0.10 0.00 -1.10 0.00 0.00 41.96 39.05 2k4j s TYR 111 CO 0.00 -0.80 1.36 0.21 -2.51 0.00 0.00 175.55 173.81 2k4j s LYS 112 N 1.31 4.30 0.18 -3.49 2.20 0.65 -0.72 119.74 124.17 2k4j s LYS 112 Ca -0.05 2.29 -0.11 0.00 -0.36 0.00 0.00 55.97 57.74 2k4j s LYS 112 Cb -0.18 -3.06 -0.00 0.00 -1.51 0.00 0.00 37.83 33.08 2k4j s LYS 112 CO -0.07 -0.28 0.36 -1.17 -0.36 0.00 0.00 175.35 173.83 2k4j s LEU 113 N -1.68 0.69 0.15 5.43 0.20 -0.18 -0.98 118.68 122.31 2k4j s LEU 113 Ca 0.51 -0.80 -0.19 0.00 0.69 0.00 0.00 54.13 54.34 2k4j s LEU 113 Cb -0.41 1.46 0.04 0.00 -0.43 0.00 0.00 46.19 46.85 2k4j s LEU 113 CO 0.54 -0.96 0.49 -1.83 -0.29 0.00 0.00 176.35 174.30 2k4j s GLU 114 N -3.96 1.21 0.00 1.98 -1.05 -1.26 -2.11 118.70 113.51 2k4j s GLU 114 Ca 0.16 -0.68 0.00 0.00 -0.15 0.00 0.00 54.97 54.31 2k4j s GLU 114 Cb 0.02 0.52 0.00 0.00 -0.44 0.00 0.00 34.13 34.23 2k4j s GLU 114 CO 0.01 -0.50 0.40 0.98 0.95 0.00 0.00 175.26 177.09