#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 0.10 0.84 1.61 0.01 -1.26 -5.17 113.70 109.83 2k4j s SER 12 Ca 0.00 -0.95 -0.11 0.00 1.31 0.00 0.00 55.95 56.21 2k4j s SER 12 Cb 0.00 0.41 0.10 0.00 0.21 0.00 0.00 66.02 66.74 2k4j s SER 12 CO 0.00 -0.86 1.11 -1.83 0.41 0.00 0.00 173.24 172.07 2k4j s GLU 13 N -3.99 1.65 0.33 12.44 1.03 -1.26 -5.09 118.70 123.82 2k4j s GLU 13 Ca 0.19 1.25 -0.04 0.00 0.03 0.00 0.00 54.97 56.40 2k4j s GLU 13 Cb 0.04 -1.82 0.00 0.00 -0.80 0.00 0.00 34.13 31.55 2k4j s GLU 13 CO 0.01 -2.10 0.48 -1.21 -1.33 0.00 0.00 175.26 171.11 2k4j s GLU 14 N -4.81 1.88 0.46 -4.83 0.41 -1.26 -5.18 118.70 105.37 2k4j s GLU 14 Ca 0.63 -1.69 -0.09 0.00 -0.41 0.00 0.00 54.97 53.42 2k4j s GLU 14 Cb -0.19 0.45 -0.05 0.00 -1.78 0.00 0.00 34.13 32.56 2k4j s GLU 14 CO 0.57 -0.78 0.82 0.14 -0.49 0.00 0.00 175.26 175.52 2k4j s VAL 15 N -3.14 4.80 -1.12 2.63 -7.23 -1.26 -4.55 120.40 110.53 2k4j s VAL 15 Ca 0.29 0.55 -0.04 0.00 -1.81 0.00 0.00 61.98 60.97 2k4j s VAL 15 Cb -0.01 -3.79 0.00 0.00 0.56 0.00 0.00 36.38 33.15 2k4j s VAL 15 CO 0.18 -0.71 0.49 -0.24 -0.31 0.00 0.00 175.10 174.52 2k4j n SER 16 N -1.79 -4.94 -4.75 4.85 2.88 -1.26 -4.98 113.62 103.63 2k4j n SER 16 Ca 0.02 -0.23 -0.36 0.00 -1.33 0.00 0.00 58.87 56.98 2k4j n SER 16 Cb 0.54 -3.76 0.03 0.00 -0.75 0.00 0.00 64.21 60.27 2k4j n SER 16 CO 0.00 0.00 0.00 -1.61 -1.23 0.00 0.00 175.04 172.20 2k4j s GLU 17 N -5.44 3.01 0.77 -1.46 2.02 -1.26 -4.73 118.70 111.61 2k4j s GLU 17 Ca 0.24 1.82 -0.11 0.00 0.02 0.00 0.00 54.97 56.95 2k4j s GLU 17 Cb -0.11 -1.94 0.06 0.00 0.10 0.00 0.00 34.13 32.24 2k4j s GLU 17 CO 0.30 -1.18 1.10 -1.25 0.02 0.00 0.00 175.26 174.25 2k4j s PRO 18 N -3.31 2.20 0.33 0.39 0.04 -1.26 -4.79 135.00 128.59 2k4j s PRO 18 Ca 0.77 1.22 0.08 0.00 0.04 0.00 0.00 61.00 63.11 2k4j s PRO 18 Cb -0.30 -1.89 -0.03 0.00 0.04 0.00 0.00 34.50 32.32 2k4j s PRO 18 CO 0.33 -1.70 0.21 0.20 0.04 0.00 0.00 177.00 176.08 2k4j s GLY 19 N -3.26 1.81 0.20 0.56 0.00 -0.06 -5.01 107.32 101.56 2k4j s GLY 19 Ca 0.62 -1.71 0.08 0.00 0.00 0.00 0.00 44.72 43.72 2k4j s GLY 19 CO 0.55 -1.65 -0.16 0.99 0.00 0.00 0.00 173.10 172.83 2k4j s ASP 20 N -3.91 2.71 -0.48 1.64 1.11 -1.26 -0.59 116.67 115.89 2k4j s ASP 20 Ca 0.39 -0.98 0.06 0.00 0.18 0.00 0.00 52.55 52.19 2k4j s ASP 20 Cb -0.05 -0.16 0.23 0.00 1.07 0.00 0.00 42.92 44.02 2k4j s ASP 20 CO 0.24 -0.12 0.81 0.00 1.18 0.00 0.00 175.17 177.29 2k4j n ALA 21 N -0.25 -0.87 -0.97 5.23 0.00 0.03 -4.89 120.51 118.78 2k4j n ALA 21 Ca -0.09 -1.66 0.00 0.00 0.00 0.00 0.00 53.44 51.70 2k4j n ALA 21 Cb 0.60 -1.28 0.00 0.00 0.00 0.00 0.00 19.45 18.77 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 1.81 0.00 0.10 0.00 3.02 -1.26 -1.71 115.26 117.22 2k4j n ASN 22 Ca 0.12 0.00 0.13 0.00 -0.03 0.00 0.00 54.58 54.80 2k4j n ASN 22 Cb 0.60 0.00 0.37 0.00 -0.61 0.00 0.00 39.78 40.15 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 0.58 -4.21 2.41 5.41 -1.26 -4.92 119.36 117.37 2k4j n ILE 23 Ca 0.00 -0.29 -0.12 0.00 1.00 0.00 0.00 62.75 63.34 2k4j n ILE 23 Cb 0.00 -0.53 -0.10 0.00 -0.71 0.00 0.00 39.64 38.30 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 -3.11 1.13 0.08 1.39 -0.71 -0.70 -0.96 117.98 115.11 2k4j s PHE 24 Ca 0.10 -1.17 0.05 0.00 -1.04 0.00 0.00 56.93 54.87 2k4j s PHE 24 Cb 0.12 -0.63 -0.03 0.00 -1.21 0.00 0.00 43.02 41.27 2k4j s PHE 24 CO 0.61 -0.40 -0.13 1.03 -1.34 0.00 0.00 175.22 175.00 2k4j s ARG 25 N -4.01 0.82 -0.08 1.99 3.00 0.11 -0.79 118.95 119.98 2k4j s ARG 25 Ca 0.28 -1.01 0.04 0.00 0.00 0.00 0.00 55.73 55.04 2k4j s ARG 25 Cb 0.07 -0.71 0.00 0.00 0.00 0.00 0.00 34.95 34.31 2k4j s ARG 25 CO 0.06 0.15 -0.21 0.54 0.00 0.00 0.00 175.30 175.83 2k4j s VAL 26 N -1.65 1.82 -0.25 3.52 0.11 0.24 -1.20 120.40 122.99 2k4j s VAL 26 Ca 0.00 -0.90 -0.09 0.00 -2.93 0.00 0.00 61.98 58.07 2k4j s VAL 26 Cb -0.08 -1.58 -0.04 0.00 -1.53 0.00 0.00 36.38 33.16 2k4j s VAL 26 CO 0.02 0.51 0.11 -0.62 -3.33 0.00 0.00 175.10 171.79 2k4j s ASP 27 N 0.28 5.56 0.24 3.54 -1.08 -0.49 -0.89 116.67 123.84 2k4j s ASP 27 Ca -0.14 -0.07 0.24 0.00 -0.52 0.00 0.00 52.55 52.06 2k4j s ASP 27 Cb -0.16 -2.00 0.44 0.00 -1.46 0.00 0.00 42.92 39.73 2k4j s ASP 27 CO 0.06 0.01 1.50 0.07 0.52 0.00 0.00 175.17 177.33 2k4j h LYS 28 N 7.95 0.00 0.03 4.34 2.10 -1.86 -1.43 116.57 127.69 2k4j h LYS 28 Ca -0.37 0.00 -0.36 0.00 -2.00 0.00 0.00 60.65 57.92 2k4j h LYS 28 Cb 1.18 0.00 -0.05 0.00 -0.90 0.00 0.00 32.23 32.46 2k4j h LYS 28 CO 0.60 0.00 -2.01 -3.47 -2.00 0.00 0.00 179.45 172.56 2k4j n ASP 29 N -2.49 1.97 0.00 7.07 2.03 -1.26 -4.11 116.55 119.76 2k4j n ASP 29 Ca 0.04 0.25 0.14 0.00 0.52 0.00 0.00 54.79 55.73 2k4j n ASP 29 Cb 0.48 -0.80 0.57 0.00 -0.72 0.00 0.00 41.12 40.64 2k4j n ASP 29 CO 0.00 0.00 0.00 -1.20 -1.92 0.00 0.00 177.20 174.08 2k4j n SER 30 N -3.94 0.07 -3.46 1.67 7.64 -1.26 -4.98 113.62 109.36 2k4j n SER 30 Ca -0.41 0.39 -0.18 0.00 1.01 0.00 0.00 58.87 59.68 2k4j n SER 30 Cb 0.88 -0.39 0.07 0.00 -1.01 0.00 0.00 64.21 63.76 2k4j n SER 30 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 2k4j n ARG 31 N -1.50 -4.92 -4.21 1.43 1.74 -0.69 -5.02 116.66 103.50 2k4j n ARG 31 Ca 0.07 0.79 -0.13 0.00 -0.77 0.00 0.00 57.85 57.80 2k4j n ARG 31 Cb 0.34 -5.62 -0.10 0.00 -1.02 0.00 0.00 32.46 26.05 2k4j n ARG 31 CO 0.00 0.00 0.00 -1.83 -1.52 0.00 0.00 177.63 174.28 2k4j s GLU 32 N -5.29 0.95 -0.05 5.56 -1.05 -0.62 -4.48 118.70 113.71 2k4j s GLU 32 Ca 0.14 -1.36 -0.01 0.00 -0.15 0.00 0.00 54.97 53.59 2k4j s GLU 32 Cb -0.02 -0.47 0.03 0.00 -0.44 0.00 0.00 34.13 33.22 2k4j s GLU 32 CO 0.76 0.05 0.01 0.54 0.95 0.00 0.00 175.26 177.56 2k4j s VAL 33 N -3.26 0.26 -0.25 1.83 0.11 0.13 -1.39 120.40 117.84 2k4j s VAL 33 Ca 0.13 0.15 -0.03 0.00 -2.93 0.00 0.00 61.98 59.30 2k4j s VAL 33 Cb 0.02 -0.41 0.02 0.00 -1.53 0.00 0.00 36.38 34.48 2k4j s VAL 33 CO -0.01 0.22 -0.04 -0.31 -3.33 0.00 0.00 175.10 171.63 2k4j s TYR 34 N 1.70 3.06 0.53 1.54 1.51 -0.34 -0.74 117.35 124.61 2k4j s TYR 34 Ca 0.00 -1.37 -0.15 0.00 -1.01 0.00 0.00 57.07 54.55 2k4j s TYR 34 Cb -0.13 -2.09 -0.07 0.00 -0.11 0.00 0.00 41.96 39.56 2k4j s TYR 34 CO -0.04 -0.68 0.98 -1.64 -1.11 0.00 0.00 175.55 173.07 2k4j s MET 35 N 1.38 3.85 0.60 -0.62 -1.94 -0.03 -0.72 119.30 121.82 2k4j s MET 35 Ca 0.02 0.87 0.29 0.00 -1.71 0.00 0.00 55.69 55.16 2k4j s MET 35 Cb -0.16 -2.14 1.51 0.00 2.01 0.00 0.00 34.83 36.05 2k4j s MET 35 CO -0.03 -0.33 1.92 1.25 -0.01 0.00 0.00 175.02 177.82 2k4j h HIS 36 N 0.63 0.00 0.00 -0.03 2.76 -1.43 -0.43 115.15 116.65 2k4j h HIS 36 Ca -0.46 0.00 -0.20 0.00 -2.20 0.00 0.00 60.37 57.50 2k4j h HIS 36 Cb 1.19 0.00 0.02 0.00 1.55 0.00 0.00 27.41 30.16 2k4j h HIS 36 CO 0.64 0.00 -0.80 0.93 -1.30 0.00 0.00 177.93 177.40 2k4j h GLU 37 N 0.00 0.54 0.00 5.26 4.39 -1.93 -3.51 114.58 119.33 2k4j h GLU 37 Ca 0.18 -0.58 0.00 0.00 0.34 0.00 0.00 59.36 59.29 2k4j h GLU 37 Cb 1.03 0.17 0.00 0.00 -0.10 0.00 0.00 28.75 29.85 2k4j h GLU 37 CO -0.00 1.21 0.00 1.63 -1.16 0.00 0.00 179.01 180.68 2k4j n LYS 38 N -4.06 0.00 -2.67 2.33 5.02 -0.17 -5.13 118.16 113.48 2k4j n LYS 38 Ca -0.11 0.00 -0.33 0.00 -2.02 0.00 0.00 58.31 55.86 2k4j n LYS 38 Cb 0.77 0.00 -0.06 0.00 -0.02 0.00 0.00 35.03 35.72 2k4j n LYS 38 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 2k4j s LYS 39 N -2.00 4.11 0.08 1.97 1.02 -1.26 -0.85 119.74 122.82 2k4j s LYS 39 Ca 0.00 1.04 -0.06 0.00 0.02 0.00 0.00 55.97 56.97 2k4j s LYS 39 Cb 0.00 -2.17 -0.01 0.00 -0.52 0.00 0.00 37.83 35.12 2k4j s LYS 39 CO 0.00 -0.11 0.12 -0.51 -0.92 0.00 0.00 175.35 173.93 2k4j s LEU 40 N -3.51 1.75 -0.39 3.17 1.43 0.08 -4.89 118.68 116.32 2k4j s LEU 40 Ca 0.60 -0.78 0.10 0.00 -1.03 0.00 0.00 54.13 53.03 2k4j s LEU 40 Cb -0.09 0.76 0.40 0.00 0.03 0.00 0.00 46.19 47.29 2k4j s LEU 40 CO 0.20 -0.69 1.28 -0.67 0.23 0.00 0.00 176.35 176.70 2k4j n ASP 41 N -0.01 -1.42 -0.09 2.29 2.03 -1.26 -0.69 116.55 117.39 2k4j n ASP 41 Ca -0.14 -2.57 0.00 0.00 0.52 0.00 0.00 54.79 52.60 2k4j n ASP 41 Cb 0.62 0.83 0.00 0.00 -0.72 0.00 0.00 41.12 41.85 2k4j n ASP 41 CO 0.00 0.00 0.00 -0.11 -1.92 0.00 0.00 177.20 175.17 2k4j n LEU 42 N -0.46 0.00 -4.98 -2.67 7.94 -1.26 -4.97 117.00 110.60 2k4j n LEU 42 Ca -0.00 0.00 -0.21 0.00 -1.11 0.00 0.00 56.01 54.69 2k4j n LEU 42 Cb 0.84 0.00 0.04 0.00 0.53 0.00 0.00 43.42 44.83 2k4j n LEU 42 CO -0.02 0.00 0.36 0.42 -1.11 0.00 0.00 177.39 177.04 2k4j s THR 43 N 2.04 2.61 0.26 1.96 -4.23 -1.26 -4.82 115.64 112.19 2k4j s THR 43 Ca 0.00 -0.71 -0.02 0.00 -1.18 0.00 0.00 61.69 59.78 2k4j s THR 43 Cb 0.00 -2.90 0.25 0.00 1.34 0.00 0.00 72.50 71.19 2k4j s THR 43 CO 0.00 0.00 1.84 -0.09 -0.54 0.00 0.00 174.62 175.83 2k4j h ARG 44 N 0.06 0.95 -0.13 3.99 9.65 -1.99 0.42 114.38 127.33 2k4j h ARG 44 Ca -0.40 -0.06 -0.13 0.00 -1.10 0.00 0.00 59.98 58.29 2k4j h ARG 44 Cb 1.29 -0.21 0.00 0.00 -1.39 0.00 0.00 29.97 29.66 2k4j h ARG 44 CO 0.49 0.63 -0.42 0.00 2.80 0.00 0.00 179.97 183.47 2k4j h ALA 45 N 1.47 0.23 -0.75 2.80 0.00 -1.95 -1.36 119.26 119.70 2k4j h ALA 45 Ca 0.43 -0.47 -0.05 0.00 0.00 0.00 0.00 54.91 54.83 2k4j h ALA 45 Cb 0.32 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.06 2k4j h ALA 45 CO -0.22 0.35 0.28 0.93 0.00 0.00 0.00 179.25 180.58 2k4j h GLU 46 N 0.13 1.12 -0.28 0.00 3.07 -1.91 -1.48 114.58 115.24 2k4j h GLU 46 Ca -0.02 -0.21 0.05 0.00 -0.50 0.00 0.00 59.36 58.69 2k4j h GLU 46 Cb 1.05 -0.18 -0.05 0.00 -0.84 0.00 0.00 28.75 28.73 2k4j h GLU 46 CO 0.09 0.92 -0.02 -0.92 -1.40 0.00 0.00 179.01 177.68 2k4j h TYR 47 N 1.09 -0.06 -0.40 4.33 3.20 -0.89 -1.00 116.97 123.24 2k4j h TYR 47 Ca 0.25 0.02 0.07 0.00 3.14 0.00 0.00 58.73 62.21 2k4j h TYR 47 Cb 0.24 0.07 -0.07 0.00 1.54 0.00 0.00 36.73 38.51 2k4j h TYR 47 CO 0.02 -0.07 -0.01 1.49 -1.64 0.00 0.00 178.16 177.95 2k4j h GLU 48 N 0.05 0.09 0.04 1.82 4.81 -0.25 -0.02 114.58 121.11 2k4j h GLU 48 Ca 0.14 -0.01 -0.00 0.00 -0.13 0.00 0.00 59.36 59.36 2k4j h GLU 48 Cb 0.19 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 29.55 2k4j h GLU 48 CO -0.25 0.06 -0.02 0.82 -0.73 0.00 0.00 179.01 178.89 2k4j h ILE 49 N 0.09 1.07 -0.11 2.32 2.04 -1.15 -2.11 117.51 119.66 2k4j h ILE 49 Ca 0.20 -0.35 -0.22 0.00 1.00 0.00 0.00 64.86 65.49 2k4j h ILE 49 Cb 0.28 1.31 0.01 0.00 -0.74 0.00 0.00 36.82 37.68 2k4j h ILE 49 CO -0.34 0.09 -0.81 0.25 0.00 0.00 0.00 178.15 177.34 2k4j h LEU 50 N -0.20 0.84 -0.33 1.44 6.46 -0.91 0.24 115.31 122.85 2k4j h LEU 50 Ca -0.01 -0.57 0.05 0.00 -0.12 0.00 0.00 57.88 57.23 2k4j h LEU 50 Cb 0.18 -0.25 -0.04 0.00 -0.73 0.00 0.00 40.66 39.82 2k4j h LEU 50 CO 0.01 1.36 0.07 0.77 -0.62 0.00 0.00 178.44 180.03 2k4j h SER 51 N 0.46 0.02 0.22 1.25 4.64 -1.09 -1.47 113.55 117.59 2k4j h SER 51 Ca -0.06 0.05 -0.06 0.00 -0.47 0.00 0.00 61.79 61.25 2k4j h SER 51 Cb 1.43 0.07 -0.01 0.00 -0.31 0.00 0.00 62.40 63.58 2k4j h SER 51 CO 0.16 0.05 -0.27 0.25 -0.87 0.00 0.00 176.83 176.15 2k4j h LEU 52 N 0.19 0.09 -0.01 5.97 6.46 -1.04 -1.59 115.31 125.38 2k4j h LEU 52 Ca 0.16 -0.02 -0.00 0.00 -0.12 0.00 0.00 57.88 57.89 2k4j h LEU 52 Cb 0.17 -0.02 -0.00 0.00 -0.73 0.00 0.00 40.66 40.07 2k4j h LEU 52 CO -0.20 0.36 0.00 0.25 -0.62 0.00 0.00 178.44 178.24 2k4j h LEU 53 N 0.08 0.01 -0.78 2.25 5.85 -0.06 0.12 115.31 122.78 2k4j h LEU 53 Ca 0.01 -0.09 -0.09 0.00 0.84 0.00 0.00 57.88 58.56 2k4j h LEU 53 Cb 0.52 -0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.53 2k4j h LEU 53 CO 0.04 0.09 -0.02 0.40 -0.34 0.00 0.00 178.44 178.61 2k4j h ILE 54 N -0.07 1.26 -0.35 4.05 1.08 -1.16 -0.10 117.51 122.22 2k4j h ILE 54 Ca 0.00 -1.10 -0.00 0.00 -0.39 0.00 0.00 64.86 63.38 2k4j h ILE 54 Cb 0.08 0.87 -0.02 0.00 -3.07 0.00 0.00 36.82 34.68 2k4j h ILE 54 CO -0.00 0.39 0.21 -1.28 -0.69 0.00 0.00 178.15 176.78 2k4j h SER 55 N 0.83 0.42 1.07 1.72 0.87 -1.01 -3.20 113.55 114.25 2k4j h SER 55 Ca 0.15 -0.05 0.00 0.00 -1.23 0.00 0.00 61.79 60.66 2k4j h SER 55 Cb 0.52 -0.11 0.00 0.00 -0.44 0.00 0.00 62.40 62.37 2k4j h SER 55 CO 0.03 0.35 -0.42 2.29 -0.53 0.00 0.00 176.83 178.55 2k4j n LYS 56 N -4.81 0.28 0.00 2.24 2.85 0.39 -5.04 118.16 114.08 2k4j n LYS 56 Ca -0.01 0.13 0.00 0.00 -1.05 0.00 0.00 58.31 57.38 2k4j n LYS 56 Cb 0.05 -1.73 0.00 0.00 -0.65 0.00 0.00 35.03 32.71 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 -2.16 0.00 -0.01 -1.58 4.76 -0.06 -5.02 118.16 114.09 2k4j n LYS 57 Ca 0.04 0.00 -0.03 0.00 -2.87 0.00 0.00 58.31 55.45 2k4j n LYS 57 Cb 0.44 0.00 -0.02 0.00 -1.84 0.00 0.00 35.03 33.61 2k4j n LYS 57 CO 0.00 0.00 0.00 0.78 -1.37 0.00 0.00 177.40 176.81 2k4j h GLY 58 N 0.00 -1.55 0.00 0.72 0.00 -1.73 -3.43 103.07 97.07 2k4j h GLY 58 Ca 0.00 0.71 0.00 0.00 0.00 0.00 0.00 47.33 48.04 2k4j h GLY 58 CO 0.00 -0.54 0.00 2.98 0.00 0.00 0.00 176.54 178.98 2k4j n TYR 59 N -3.19 -1.67 -3.23 5.60 9.36 -0.56 -4.47 117.16 119.00 2k4j n TYR 59 Ca -0.01 0.00 -0.41 0.00 3.32 0.00 0.00 57.90 60.80 2k4j n TYR 59 Cb 0.08 0.25 -0.08 0.00 -0.63 0.00 0.00 39.34 38.96 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 5.02 -0.70 2.97 1.01 -1.26 -1.25 120.40 126.18 2k4j s VAL 60 Ca 0.00 0.48 -0.24 0.00 0.00 0.00 0.00 61.98 62.22 2k4j s VAL 60 Cb 0.00 -3.94 0.05 0.00 0.00 0.00 0.00 36.38 32.49 2k4j s VAL 60 CO 0.00 -0.16 1.11 0.12 0.00 0.00 0.00 175.10 176.17 2k4j s PHE 61 N 2.41 2.51 0.21 5.22 5.36 0.27 -4.81 117.98 129.14 2k4j s PHE 61 Ca 0.20 -0.35 0.10 0.00 -0.96 0.00 0.00 56.93 55.92 2k4j s PHE 61 Cb -0.15 -4.44 -0.04 0.00 -0.34 0.00 0.00 43.02 38.04 2k4j s PHE 61 CO 0.13 -1.84 -0.16 -1.12 -1.46 0.00 0.00 175.22 170.77 2k4j s SER 62 N 3.72 3.87 0.33 6.13 0.01 -1.26 -1.58 113.70 124.93 2k4j s SER 62 Ca 0.28 -0.76 0.11 0.00 1.31 0.00 0.00 55.95 56.89 2k4j s SER 62 Cb -0.13 -0.49 0.89 0.00 0.21 0.00 0.00 66.02 66.51 2k4j s SER 62 CO 0.12 0.09 1.75 0.08 0.41 0.00 0.00 173.24 175.69 2k4j h ARG 63 N 2.85 0.57 0.42 12.44 0.11 -1.88 0.16 114.38 129.06 2k4j h ARG 63 Ca -0.45 -0.03 -0.02 0.00 0.10 0.00 0.00 59.98 59.57 2k4j h ARG 63 Cb 1.22 -0.13 0.00 0.00 1.11 0.00 0.00 29.97 32.17 2k4j h ARG 63 CO 0.53 0.38 -0.20 1.49 0.10 0.00 0.00 179.97 182.27 2k4j h GLU 64 N 0.59 -0.54 -0.96 0.08 4.81 -1.78 -1.34 114.58 115.44 2k4j h GLU 64 Ca 0.61 0.04 0.08 0.00 -0.13 0.00 0.00 59.36 59.96 2k4j h GLU 64 Cb 1.19 0.12 -0.07 0.00 0.63 0.00 0.00 28.75 30.62 2k4j h GLU 64 CO -0.41 -0.24 0.61 0.77 -0.73 0.00 0.00 179.01 179.02 2k4j h SER 65 N -0.83 0.94 -0.14 1.04 0.02 -1.69 -0.37 113.55 112.52 2k4j h SER 65 Ca -0.06 0.03 0.04 0.00 -0.84 0.00 0.00 61.79 60.95 2k4j h SER 65 Cb 0.55 -0.17 -0.04 0.00 0.14 0.00 0.00 62.40 62.88 2k4j h SER 65 CO 0.09 0.57 -0.08 0.40 -1.14 0.00 0.00 176.83 176.67 2k4j h ILE 66 N 1.06 0.75 0.00 3.27 1.08 -0.73 -0.77 117.51 122.16 2k4j h ILE 66 Ca 0.44 0.00 -0.03 0.00 -0.39 0.00 0.00 64.86 64.88 2k4j h ILE 66 Cb 0.28 0.75 -0.00 0.00 -3.07 0.00 0.00 36.82 34.77 2k4j h ILE 66 CO -0.21 0.00 -0.14 0.00 -0.69 0.00 0.00 178.15 177.11 2k4j h ALA 67 N 1.04 1.43 0.03 1.87 0.00 -0.35 0.12 119.26 123.40 2k4j h ALA 67 Ca 0.08 -0.13 -0.21 0.00 0.00 0.00 0.00 54.91 54.66 2k4j h ALA 67 Cb 0.20 -0.02 0.02 0.00 0.00 0.00 0.00 17.79 17.98 2k4j h ALA 67 CO -0.19 0.18 -0.83 0.82 0.00 0.00 0.00 179.25 179.23 2k4j h ILE 68 N 0.00 1.37 0.00 0.00 2.04 -0.60 -3.15 117.51 117.17 2k4j h ILE 68 Ca -0.00 -2.22 -0.19 0.00 1.00 0.00 0.00 64.86 63.45 2k4j h ILE 68 Cb 0.32 2.61 -0.04 0.00 -0.74 0.00 0.00 36.82 38.97 2k4j h ILE 68 CO 0.02 0.66 -2.08 -0.62 0.00 0.00 0.00 178.15 176.13 2k4j n GLU 69 N -4.05 0.88 -0.08 2.37 4.71 -0.34 -4.54 120.64 119.58 2k4j n GLU 69 Ca -0.11 -0.08 -0.13 0.00 -0.01 0.00 0.00 57.16 56.83 2k4j n GLU 69 Cb 0.79 -1.46 -0.07 0.00 -1.01 0.00 0.00 31.44 29.69 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 -0.52 1.62 0.87 -1.00 -3.38 113.55 111.14 2k4j h SER 70 Ca -0.28 -0.33 -0.23 0.00 -1.23 0.00 0.00 61.79 59.72 2k4j h SER 70 Cb 1.59 0.00 -0.09 0.00 -0.44 0.00 0.00 62.40 63.46 2k4j h SER 70 CO 0.02 1.10 -0.20 1.21 -0.53 0.00 0.00 176.83 178.42 2k4j n GLU 71 N -4.54 -1.38 0.20 2.24 2.13 -1.17 -4.89 120.64 113.23 2k4j n GLU 71 Ca -0.19 0.86 0.06 0.00 0.66 0.00 0.00 57.16 58.55 2k4j n GLU 71 Cb 0.46 -5.10 0.42 0.00 0.27 0.00 0.00 31.44 27.49 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 -3.12 4.31 0.87 -1.88 -3.41 113.55 110.32 2k4j h SER 72 Ca -0.23 0.00 -0.62 0.00 -1.23 0.00 0.00 61.79 59.71 2k4j h SER 72 Cb 1.03 0.00 -0.11 0.00 -0.44 0.00 0.00 62.40 62.87 2k4j h SER 72 CO 0.33 0.33 -0.50 -0.63 -0.53 0.00 0.00 176.83 175.83 2k4j s ILE 73 N -3.92 5.32 0.01 2.23 -1.09 -1.26 -5.06 121.20 117.43 2k4j s ILE 73 Ca -0.02 0.15 -0.25 0.00 -2.23 0.00 0.00 60.65 58.31 2k4j s ILE 73 Cb 0.13 -3.39 -0.18 0.00 -1.58 0.00 0.00 42.46 37.43 2k4j s ILE 73 CO 0.68 0.49 1.32 0.78 -1.23 0.00 0.00 174.94 176.98 2k4j h ASN 74 N 6.22 -0.17 -3.60 3.58 4.21 -1.99 -3.44 115.58 120.39 2k4j h ASN 74 Ca -0.44 -0.26 -0.52 0.00 1.21 0.00 0.00 56.30 56.29 2k4j h ASN 74 Cb 1.17 0.04 0.04 0.00 -1.12 0.00 0.00 38.32 38.46 2k4j h ASN 74 CO 0.70 0.18 0.61 -2.16 -1.29 0.00 0.00 177.43 175.48 2k4j s PRO 75 N -4.74 4.43 0.51 0.81 0.04 -1.26 -4.94 135.00 129.84 2k4j s PRO 75 Ca -0.15 2.05 0.30 0.00 0.04 0.00 0.00 61.00 63.25 2k4j s PRO 75 Cb 0.03 -3.16 1.17 0.00 0.04 0.00 0.00 34.50 32.58 2k4j s PRO 75 CO 0.61 -0.15 1.92 1.49 0.04 0.00 0.00 177.00 180.91 2k4j h GLU 76 N 4.52 0.00 -0.33 4.56 4.81 -1.95 -2.89 114.58 123.31 2k4j h GLU 76 Ca -0.46 0.00 -0.13 0.00 -0.13 0.00 0.00 59.36 58.64 2k4j h GLU 76 Cb 1.22 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.59 2k4j h GLU 76 CO 0.72 0.07 -0.31 0.77 -0.73 0.00 0.00 179.01 179.54 2k4j h SER 77 N 0.00 0.73 -2.03 1.04 0.02 -1.92 -3.38 113.55 108.01 2k4j h SER 77 Ca -0.00 -0.29 -0.36 0.00 -0.84 0.00 0.00 61.79 60.30 2k4j h SER 77 Cb 0.61 -0.20 -0.09 0.00 0.14 0.00 0.00 62.40 62.85 2k4j h SER 77 CO 0.01 0.98 -0.38 -0.24 -1.14 0.00 0.00 176.83 176.06 2k4j n SER 78 N -4.08 -4.92 -0.08 3.07 2.88 -1.09 -4.47 113.62 104.93 2k4j n SER 78 Ca -0.01 0.28 0.03 0.00 -1.33 0.00 0.00 58.87 57.84 2k4j n SER 78 Cb 0.47 -4.29 0.36 0.00 -0.75 0.00 0.00 64.21 60.00 2k4j n SER 78 CO 0.00 0.00 0.00 -1.13 -1.23 0.00 0.00 175.04 172.68 2k4j h ASN 79 N 0.00 0.62 0.47 -3.46 -1.24 -1.89 -0.76 115.58 109.32 2k4j h ASN 79 Ca -0.39 -0.02 -0.06 0.00 0.71 0.00 0.00 56.30 56.54 2k4j h ASN 79 Cb 1.23 -0.15 -0.01 0.00 0.73 0.00 0.00 38.32 40.11 2k4j h ASN 79 CO 0.52 0.45 -0.30 0.11 -1.29 0.00 0.00 177.43 176.92 2k4j h LYS 80 N 0.73 0.00 0.50 6.67 6.56 -1.98 0.92 116.57 129.97 2k4j h LYS 80 Ca 0.20 0.00 -0.02 0.00 -1.06 0.00 0.00 60.65 59.76 2k4j h LYS 80 Cb -0.08 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 31.58 2k4j h LYS 80 CO -0.04 0.30 -0.24 1.03 -2.06 0.00 0.00 179.45 178.44 2k4j h SER 81 N 0.00 -0.57 -0.78 0.86 0.87 -1.55 -1.33 113.55 111.05 2k4j h SER 81 Ca -0.00 -0.02 0.13 0.00 -1.23 0.00 0.00 61.79 60.66 2k4j h SER 81 Cb 0.62 0.15 -0.05 0.00 -0.44 0.00 0.00 62.40 62.68 2k4j h SER 81 CO 0.04 -0.34 0.51 0.40 -0.53 0.00 0.00 176.83 176.91 2k4j h ILE 82 N -0.76 0.86 -0.32 2.23 1.08 -0.91 0.39 117.51 120.07 2k4j h ILE 82 Ca -0.07 -0.19 -0.04 0.00 -0.39 0.00 0.00 64.86 64.17 2k4j h ILE 82 Cb 0.56 0.24 -0.01 0.00 -3.07 0.00 0.00 36.82 34.54 2k4j h ILE 82 CO 0.11 0.10 0.04 0.44 -0.69 0.00 0.00 178.15 178.16 2k4j h ASP 83 N 0.56 0.52 -0.06 1.72 3.32 -0.68 0.13 116.42 121.93 2k4j h ASP 83 Ca 0.38 -0.27 0.02 0.00 0.02 0.00 0.00 57.03 57.18 2k4j h ASP 83 Cb 0.68 -0.14 -0.02 0.00 0.22 0.00 0.00 39.33 40.06 2k4j h ASP 83 CO -0.14 0.66 -0.07 0.58 -1.72 0.00 0.00 179.24 178.56 2k4j h VAL 84 N 0.37 0.81 0.43 -1.35 2.07 -0.31 -1.22 116.25 117.04 2k4j h VAL 84 Ca 0.10 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.60 2k4j h VAL 84 Cb 0.37 0.81 0.00 0.00 -1.52 0.00 0.00 31.29 30.95 2k4j h VAL 84 CO 0.01 0.00 -0.21 0.40 0.02 0.00 0.00 177.57 177.79 2k4j h ILE 85 N -0.08 0.43 -0.43 4.57 2.04 -0.72 -0.49 117.51 122.83 2k4j h ILE 85 Ca 0.05 -0.53 -0.09 0.00 1.00 0.00 0.00 64.86 65.29 2k4j h ILE 85 Cb 0.15 0.63 -0.02 0.00 -0.74 0.00 0.00 36.82 36.85 2k4j h ILE 85 CO -0.12 0.07 -0.09 0.40 0.00 0.00 0.00 178.15 178.42 2k4j h ILE 86 N -0.94 1.25 -0.04 -0.67 1.08 -0.86 0.73 117.51 118.06 2k4j h ILE 86 Ca -0.06 -1.12 -0.00 0.00 -0.39 0.00 0.00 64.86 63.29 2k4j h ILE 86 Cb 0.57 1.01 -0.00 0.00 -3.07 0.00 0.00 36.82 35.33 2k4j h ILE 86 CO 0.10 0.38 0.03 1.23 -0.69 0.00 0.00 178.15 179.20 2k4j h GLY 87 N 0.97 0.06 1.56 5.37 0.00 -1.16 -0.88 103.07 108.99 2k4j h GLY 87 Ca 0.12 -0.03 -0.09 0.00 0.00 0.00 0.00 47.33 47.33 2k4j h GLY 87 CO 0.03 0.03 -0.77 3.21 0.00 0.00 0.00 176.54 179.04 2k4j h ARG 88 N 0.01 0.00 -0.10 4.80 -0.00 -0.98 -0.50 114.38 117.61 2k4j h ARG 88 Ca 0.02 0.00 -0.01 0.00 -0.50 0.00 0.00 59.98 59.49 2k4j h ARG 88 Cb 0.05 0.00 -0.00 0.00 0.00 0.00 0.00 29.97 30.01 2k4j h ARG 88 CO -0.00 0.29 0.02 1.25 0.00 0.00 0.00 179.97 181.53 2k4j h LEU 89 N 0.00 0.15 -0.78 3.04 6.46 -0.86 0.05 115.31 123.38 2k4j h LEU 89 Ca -0.05 -0.24 0.03 0.00 -0.12 0.00 0.00 57.88 57.51 2k4j h LEU 89 Cb 1.33 -0.04 -0.05 0.00 -0.73 0.00 0.00 40.66 41.17 2k4j h LEU 89 CO 0.04 0.35 0.49 0.03 -0.62 0.00 0.00 178.44 178.73 2k4j h ARG 90 N -0.05 0.93 -0.30 1.25 3.08 -1.16 -1.39 114.38 116.74 2k4j h ARG 90 Ca 0.03 -0.06 0.03 0.00 0.07 0.00 0.00 59.98 60.05 2k4j h ARG 90 Cb 0.26 -0.21 -0.03 0.00 0.08 0.00 0.00 29.97 30.07 2k4j h ARG 90 CO 0.00 0.62 0.12 1.03 -1.07 0.00 0.00 179.97 180.67 2k4j h SER 91 N 0.96 0.15 0.04 7.04 0.87 -0.94 0.81 113.55 122.48 2k4j h SER 91 Ca 0.31 0.03 0.03 0.00 -1.23 0.00 0.00 61.79 60.93 2k4j h SER 91 Cb 0.02 0.00 -0.04 0.00 -0.44 0.00 0.00 62.40 61.95 2k4j h SER 91 CO -0.12 0.12 -0.24 0.11 -0.53 0.00 0.00 176.83 176.18 2k4j h LYS 92 N 0.27 -0.38 -0.00 2.24 1.79 -0.62 -1.58 116.57 118.29 2k4j h LYS 92 Ca 0.13 0.03 0.00 0.00 -2.18 0.00 0.00 60.65 58.63 2k4j h LYS 92 Cb 0.08 0.09 0.00 0.00 -1.58 0.00 0.00 32.23 30.82 2k4j h LYS 92 CO -0.12 -0.26 -0.03 0.44 -1.08 0.00 0.00 179.45 178.41 2k4j n ILE 93 N -5.36 0.00 -0.05 1.86 -5.35 -0.56 -1.26 119.36 108.64 2k4j n ILE 93 Ca -0.05 -0.01 -0.18 0.00 -0.27 0.00 0.00 62.75 62.24 2k4j n ILE 93 Cb 0.28 -0.44 -0.13 0.00 -1.74 0.00 0.00 39.64 37.61 2k4j n ILE 93 CO 0.00 0.00 0.00 -0.08 -1.76 0.00 0.00 176.55 174.71 2k4j h GLU 94 N 0.06 0.08 0.22 6.28 4.81 -0.73 -3.42 114.58 121.88 2k4j h GLU 94 Ca 0.00 -0.14 -0.34 0.00 -0.13 0.00 0.00 59.36 58.75 2k4j h GLU 94 Cb 0.36 0.05 0.03 0.00 0.63 0.00 0.00 28.75 29.82 2k4j h GLU 94 CO 0.00 1.07 -1.58 0.87 -0.73 0.00 0.00 179.01 178.64 2k4j h LYS 95 N -0.79 0.47 -7.24 1.92 1.57 -1.17 -3.46 116.57 107.87 2k4j h LYS 95 Ca -0.17 -0.80 -0.49 0.00 -1.87 0.00 0.00 60.65 57.32 2k4j h LYS 95 Cb 1.31 0.30 0.06 0.00 0.08 0.00 0.00 32.23 33.97 2k4j h LYS 95 CO -0.03 1.38 0.38 -0.80 -0.57 0.00 0.00 179.45 179.82 2k4j s ASN 96 N -7.43 5.99 0.22 0.86 -0.87 -0.39 -4.98 114.94 108.34 2k4j s ASN 96 Ca -0.13 1.66 0.22 0.00 -1.57 0.00 0.00 52.86 53.05 2k4j s ASN 96 Cb 0.04 -2.51 0.93 0.00 -0.02 0.00 0.00 41.25 39.69 2k4j s ASN 96 CO 0.90 -1.03 1.67 -0.81 -2.57 0.00 0.00 177.10 175.27 2k4j n PRO 97 N -2.21 0.17 -1.71 -0.60 -0.04 -1.26 -4.74 135.00 124.60 2k4j n PRO 97 Ca 0.08 0.40 -0.42 0.00 -0.04 0.00 0.00 63.50 63.52 2k4j n PRO 97 Cb 0.53 -1.82 -0.03 0.00 -0.04 0.00 0.00 33.50 32.14 2k4j n PRO 97 CO 0.00 0.00 0.00 0.21 -0.04 0.00 0.00 175.50 175.67 2k4j s LYS 98 N -3.27 4.13 0.22 0.54 2.36 -1.26 -5.04 119.74 117.42 2k4j s LYS 98 Ca 0.05 2.62 0.09 0.00 -2.55 0.00 0.00 55.97 56.17 2k4j s LYS 98 Cb 0.09 -3.37 -0.04 0.00 -1.05 0.00 0.00 37.83 33.46 2k4j s LYS 98 CO 0.37 -0.81 -0.01 1.14 1.55 0.00 0.00 175.35 177.59 2k4j s GLN 99 N 2.08 2.31 0.68 4.03 -2.07 -1.26 -4.61 119.66 120.82 2k4j s GLN 99 Ca 0.79 -1.29 -0.10 0.00 -1.82 0.00 0.00 55.36 52.94 2k4j s GLN 99 Cb -0.48 -2.23 0.01 0.00 -1.09 0.00 0.00 33.01 29.22 2k4j s GLN 99 CO 0.35 0.40 1.05 -1.25 -1.32 0.00 0.00 175.29 174.52 2k4j s PRO 100 N -3.33 2.86 0.00 9.60 0.04 -1.26 -4.95 135.00 137.95 2k4j s PRO 100 Ca 0.29 0.33 0.00 0.00 0.04 0.00 0.00 61.00 61.66 2k4j s PRO 100 Cb -0.08 -2.09 0.00 0.00 0.04 0.00 0.00 34.50 32.38 2k4j s PRO 100 CO 0.19 -0.96 0.00 0.00 0.04 0.00 0.00 177.00 176.27 2k4j n GLN 101 N -2.90 0.00 0.00 4.56 10.64 -1.26 -4.98 117.38 123.44 2k4j n GLN 101 Ca 0.06 0.00 0.14 0.00 -1.83 0.00 0.00 57.00 55.37 2k4j n GLN 101 Cb 0.57 0.00 0.48 0.00 -0.86 0.00 0.00 30.24 30.44 2k4j n GLN 101 CO 0.00 0.00 0.00 2.48 -1.83 0.00 0.00 177.06 177.71 2k4j n TYR 102 N -0.76 0.00 -4.21 2.61 4.11 -1.26 -4.74 117.16 112.90 2k4j n TYR 102 Ca 0.00 0.00 -0.30 0.00 -0.00 0.00 0.00 57.90 57.60 2k4j n TYR 102 Cb 0.00 -0.00 -0.17 0.00 -0.00 0.00 0.00 39.34 39.17 2k4j n TYR 102 CO 0.00 0.00 0.00 0.42 -0.00 0.00 0.00 176.86 177.28 2k4j s ILE 103 N -2.00 1.60 0.08 -3.48 1.01 -1.26 -4.00 121.20 113.15 2k4j s ILE 103 Ca 0.37 -0.67 0.05 0.00 0.00 0.00 0.00 60.65 60.40 2k4j s ILE 103 Cb 0.21 -1.48 -0.04 0.00 0.01 0.00 0.00 42.46 41.16 2k4j s ILE 103 CO 0.33 0.46 -0.04 -0.63 0.00 0.00 0.00 174.94 175.07 2k4j s ILE 104 N 1.27 3.80 0.06 2.92 -1.09 0.18 -4.96 121.20 123.37 2k4j s ILE 104 Ca 0.00 -1.05 -0.16 0.00 -2.23 0.00 0.00 60.65 57.22 2k4j s ILE 104 Cb -0.14 -2.79 -0.06 0.00 -1.58 0.00 0.00 42.46 37.90 2k4j s ILE 104 CO -0.07 0.15 0.49 -0.94 -1.23 0.00 0.00 174.94 173.33 2k4j s SER 105 N -2.19 6.88 -0.31 3.58 1.04 -1.26 -0.27 113.70 121.16 2k4j s SER 105 Ca 0.24 1.06 0.01 0.00 0.48 0.00 0.00 55.95 57.74 2k4j s SER 105 Cb -0.11 -2.29 0.10 0.00 0.10 0.00 0.00 66.02 63.82 2k4j s SER 105 CO 0.16 0.25 0.07 -0.69 0.98 0.00 0.00 173.24 174.01 2k4j s VAL 106 N -1.19 1.31 0.00 5.02 1.01 0.60 -4.86 120.40 122.29 2k4j s VAL 106 Ca 0.29 -1.64 0.00 0.00 0.00 0.00 0.00 61.98 60.63 2k4j s VAL 106 Cb -0.17 -1.95 0.00 0.00 0.00 0.00 0.00 36.38 34.26 2k4j s VAL 106 CO 0.17 -0.61 0.00 0.54 0.00 0.00 0.00 175.10 175.20 2k4j n ARG 107 N 4.67 -1.20 -0.96 2.72 5.12 -1.26 -1.56 116.66 124.20 2k4j n ARG 107 Ca -0.01 0.30 0.00 0.00 -1.93 0.00 0.00 57.85 56.21 2k4j n ARG 107 Cb 0.42 -4.64 0.00 0.00 -1.16 0.00 0.00 32.46 27.08 2k4j n ARG 107 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2k4j n GLY 108 N -0.27 0.58 0.02 -0.13 0.00 -1.26 -4.87 105.19 99.26 2k4j n GLY 108 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.00 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 -2.45 0.21 -4.23 -0.61 5.41 -0.68 -4.91 119.36 112.10 2k4j n ILE 109 Ca 0.00 -0.08 -0.33 0.00 1.00 0.00 0.00 62.75 63.34 2k4j n ILE 109 Cb 0.05 -0.64 -0.08 0.00 -0.71 0.00 0.00 39.64 38.26 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 -4.32 1.92 -0.14 7.39 0.00 -0.60 -3.58 107.32 107.99 2k4j s GLY 110 Ca -0.05 -0.90 0.02 0.00 0.00 0.00 0.00 44.72 43.80 2k4j s GLY 110 CO 0.09 -0.75 -0.21 -0.19 0.00 0.00 0.00 173.10 172.04 2k4j s TYR 111 N -1.09 2.58 -0.21 1.90 1.51 -0.61 -0.29 117.35 121.14 2k4j s TYR 111 Ca 0.19 -1.32 -0.25 0.00 -1.01 0.00 0.00 57.07 54.68 2k4j s TYR 111 Cb -0.12 -1.77 -0.01 0.00 -0.11 0.00 0.00 41.96 39.96 2k4j s TYR 111 CO 0.10 -0.62 0.86 0.21 -1.11 0.00 0.00 175.55 174.99 2k4j s LYS 112 N 0.89 4.24 0.17 -0.62 2.20 0.62 -0.56 119.74 126.68 2k4j s LYS 112 Ca -0.06 1.02 0.09 0.00 -0.36 0.00 0.00 55.97 56.67 2k4j s LYS 112 Cb -0.15 -3.62 -0.04 0.00 -1.51 0.00 0.00 37.83 32.51 2k4j s LYS 112 CO -0.03 -0.46 -0.19 -1.17 -0.36 0.00 0.00 175.35 173.14 2k4j s LEU 113 N 2.62 2.44 0.00 5.43 0.20 -0.38 -0.65 118.68 128.35 2k4j s LEU 113 Ca 0.37 -0.87 -0.09 0.00 0.69 0.00 0.00 54.13 54.24 2k4j s LEU 113 Cb -0.16 -0.87 0.01 0.00 -0.43 0.00 0.00 46.19 44.74 2k4j s LEU 113 CO 0.09 -0.02 0.18 -1.83 -0.29 0.00 0.00 176.35 174.48 2k4j s GLU 114 N -2.80 0.53 0.00 1.98 -1.05 -1.26 -1.50 118.70 114.61 2k4j s GLU 114 Ca 0.17 -0.37 0.00 0.00 -0.15 0.00 0.00 54.97 54.62 2k4j s GLU 114 Cb -0.06 0.22 0.00 0.00 -0.44 0.00 0.00 34.13 33.85 2k4j s GLU 114 CO 0.07 -0.13 0.00 0.98 0.95 0.00 0.00 175.26 177.13