#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2j2f n PHE 18 N 0.00 -1.76 -3.85 0.54 0.99 -1.26 -4.95 117.46 107.17 2j2f n PHE 18 Ca 0.00 0.48 -0.36 0.00 -0.00 0.00 0.00 57.45 57.57 2j2f n PHE 18 Cb 0.00 -2.82 -0.13 0.00 -1.00 0.00 0.00 39.48 35.53 2j2f n PHE 18 CO 0.00 0.00 0.00 1.41 -0.00 0.00 0.00 176.76 178.17 2j2f s MET 19 N -6.07 2.50 0.58 -1.08 1.75 -1.26 -5.11 119.30 110.61 2j2f s MET 19 Ca 0.42 -1.23 -0.18 0.00 -1.25 0.00 0.00 55.69 53.45 2j2f s MET 19 Cb -0.22 -3.29 -0.04 0.00 2.84 0.00 0.00 34.83 34.12 2j2f s MET 19 CO 0.52 -0.64 1.12 -2.14 -0.65 0.00 0.00 175.02 173.23 2j2f s PRO 20 N 1.31 3.21 0.77 4.11 0.02 -1.26 -5.00 135.00 138.15 2j2f s PRO 20 Ca -0.04 1.52 -0.13 0.00 0.02 0.00 0.00 61.00 62.37 2j2f s PRO 20 Cb -0.20 -1.99 0.06 0.00 0.02 0.00 0.00 34.50 32.39 2j2f s PRO 20 CO 0.00 -0.95 1.15 -2.14 -0.33 0.00 0.00 177.00 174.74 2j2f s PRO 21 N -3.56 2.04 0.25 5.54 0.02 -1.26 -5.04 135.00 132.99 2j2f s PRO 21 Ca 0.70 1.52 0.07 0.00 0.02 0.00 0.00 61.00 63.31 2j2f s PRO 21 Cb -0.22 -1.85 -0.05 0.00 0.02 0.00 0.00 34.50 32.40 2j2f s PRO 21 CO 0.31 -1.86 -0.08 1.03 -0.33 0.00 0.00 177.00 176.07 2j2f s ARG 22 N -4.31 1.45 0.09 5.54 0.52 -1.26 -4.91 118.95 116.08 2j2f s ARG 22 Ca 0.69 -1.70 -0.31 0.00 -0.52 0.00 0.00 55.73 53.88 2j2f s ARG 22 Cb -0.24 -1.09 -0.09 0.00 0.52 0.00 0.00 34.95 34.06 2j2f s ARG 22 CO 0.49 0.08 1.62 -1.21 0.02 0.00 0.00 175.30 176.31 2j2f s GLU 23 N -3.71 4.21 0.00 3.54 0.41 -1.26 -4.91 118.70 116.98 2j2f s GLU 23 Ca 0.27 2.33 0.26 0.00 -0.41 0.00 0.00 54.97 57.42 2j2f s GLU 23 Cb 0.02 -3.49 0.70 0.00 -1.78 0.00 0.00 34.13 29.59 2j2f s GLU 23 CO 0.10 -0.70 1.54 1.33 -0.49 0.00 0.00 175.26 177.04 2j2f n VAL 24 N 4.53 0.00 -4.20 2.63 0.24 -1.26 -4.91 118.33 115.36 2j2f n VAL 24 Ca 0.15 -0.21 -0.33 0.00 -2.04 0.00 0.00 64.34 61.92 2j2f n VAL 24 Cb 0.40 0.62 -0.08 0.00 -1.47 0.00 0.00 33.84 33.31 2j2f n VAL 24 CO 0.00 0.00 0.00 -1.00 -2.14 0.00 0.00 176.83 173.69 2j2f s HIS 25 N -2.31 3.16 0.28 6.34 3.76 -1.26 -5.09 115.29 120.18 2j2f s HIS 25 Ca 0.28 0.13 -0.30 0.00 -0.15 0.00 0.00 55.06 55.02 2j2f s HIS 25 Cb 0.20 -1.69 -0.13 0.00 1.11 0.00 0.00 32.58 32.06 2j2f s HIS 25 CO 0.45 0.50 1.29 1.33 -0.85 0.00 0.00 174.74 177.46 2j2f n VAL 26 N 1.27 1.47 -2.61 -0.90 0.24 -1.26 -4.93 118.33 111.60 2j2f n VAL 26 Ca -0.14 -0.37 -0.43 0.00 -2.04 0.00 0.00 64.34 61.37 2j2f n VAL 26 Cb 0.53 -1.39 -0.02 0.00 -1.47 0.00 0.00 33.84 31.48 2j2f n VAL 26 CO 0.00 0.00 0.00 -1.58 -2.14 0.00 0.00 176.83 173.11 2j2f s GLN 27 N -1.09 4.06 -0.28 7.34 0.74 -1.26 -5.02 119.66 124.15 2j2f s GLN 27 Ca 0.63 1.13 -0.02 0.00 0.05 0.00 0.00 55.36 57.14 2j2f s GLN 27 Cb -0.64 -3.75 0.04 0.00 1.10 0.00 0.00 33.01 29.75 2j2f s GLN 27 CO 0.56 -0.91 -0.01 0.08 -0.55 0.00 0.00 175.29 174.45 2j2f s VAL 28 N 3.71 3.04 0.10 1.34 1.01 -1.26 -5.11 120.40 123.23 2j2f s VAL 28 Ca 0.47 -1.18 0.03 0.00 0.00 0.00 0.00 61.98 61.30 2j2f s VAL 28 Cb -0.13 -2.66 -0.04 0.00 0.00 0.00 0.00 36.38 33.55 2j2f s VAL 28 CO 0.16 0.02 0.10 0.42 0.00 0.00 0.00 175.10 175.80 2j2f s THR 29 N 1.30 4.59 -1.26 3.92 -4.23 -1.26 -4.00 115.64 114.70 2j2f s THR 29 Ca -0.02 -0.80 -0.12 0.00 -1.18 0.00 0.00 61.69 59.56 2j2f s THR 29 Cb -0.18 -3.24 -0.00 0.00 1.34 0.00 0.00 72.50 70.42 2j2f s THR 29 CO -0.02 0.08 0.62 1.41 -0.54 0.00 0.00 174.62 176.17 2j2f n HIS 30 N 0.28 -1.77 0.07 3.99 8.25 -0.39 -4.91 115.22 120.75 2j2f n HIS 30 Ca -0.08 0.57 -0.16 0.00 -0.26 0.00 0.00 57.72 57.79 2j2f n HIS 30 Cb 0.52 -3.58 -0.08 0.00 1.12 0.00 0.00 29.99 27.98 2j2f n HIS 30 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 2j2f h SER 31 N -1.91 0.61 -3.30 0.41 4.64 -1.70 -3.45 113.55 108.84 2j2f h SER 31 Ca -0.65 -0.52 -0.53 0.00 -0.47 0.00 0.00 61.79 59.61 2j2f h SER 31 Cb 1.37 -0.19 0.09 0.00 -0.31 0.00 0.00 62.40 63.36 2j2f h SER 31 CO 0.55 1.34 0.88 0.80 -0.87 0.00 0.00 176.83 179.53 2j2f n MET 32 N -3.73 2.72 -1.72 4.77 0.00 -1.26 -4.93 117.12 112.95 2j2f n MET 32 Ca -0.08 0.97 -0.42 0.00 0.00 0.00 0.00 57.70 58.16 2j2f n MET 32 Cb 0.89 -2.75 -0.02 0.00 0.00 0.00 0.00 33.22 31.33 2j2f n MET 32 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 175.97 173.67 2j2f n PRO 33 N 2.12 2.66 0.30 2.12 -0.02 -1.26 -4.88 135.00 136.03 2j2f n PRO 33 Ca 0.08 0.95 0.16 0.00 -2.02 0.00 0.00 63.50 62.67 2j2f n PRO 33 Cb 0.37 -2.76 0.94 0.00 -0.02 0.00 0.00 33.50 32.03 2j2f n PRO 33 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 2j2f h PRO 34 N 5.72 0.00 0.00 0.52 0.11 -1.93 -1.01 132.00 135.41 2j2f h PRO 34 Ca -0.45 0.00 -0.08 0.00 0.11 0.00 0.00 66.00 65.58 2j2f h PRO 34 Cb 1.22 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.32 2j2f h PRO 34 CO 0.87 0.00 -0.38 -0.56 -0.21 0.00 0.00 178.00 177.72 2j2f h GLN 35 N 0.00 0.00 0.00 1.05 -0.00 -2.03 -2.97 115.11 111.16 2j2f h GLN 35 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.65 2j2f h GLN 35 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 27.48 2j2f h GLN 35 CO 0.00 0.38 0.00 1.63 -0.00 0.00 0.00 178.83 180.84 2j2f n LYS 36 N -4.05 0.22 0.08 0.06 5.02 -0.38 -2.11 118.16 116.99 2j2f n LYS 36 Ca -0.02 0.13 0.04 0.00 -2.02 0.00 0.00 58.31 56.45 2j2f n LYS 36 Cb 0.42 -1.50 0.46 0.00 -0.02 0.00 0.00 35.03 34.39 2j2f n LYS 36 CO 0.00 0.00 0.00 0.82 -0.52 0.00 0.00 177.40 177.70 2j2f h ILE 37 N 0.00 1.09 -0.34 -0.18 2.04 -1.67 -2.44 117.51 116.01 2j2f h ILE 37 Ca 0.00 -0.25 -0.08 0.00 1.00 0.00 0.00 64.86 65.52 2j2f h ILE 37 Cb 0.16 0.73 -0.02 0.00 -0.74 0.00 0.00 36.82 36.96 2j2f h ILE 37 CO 0.00 0.10 -0.14 -0.33 0.00 0.00 0.00 178.15 177.78 2j2f h GLU 38 N 0.38 0.60 -0.92 2.37 4.39 -1.66 -2.84 114.58 116.90 2j2f h GLU 38 Ca 0.10 -0.19 0.21 0.00 0.34 0.00 0.00 59.36 59.81 2j2f h GLU 38 Cb 0.03 -0.05 -0.12 0.00 -0.10 0.00 0.00 28.75 28.51 2j2f h GLU 38 CO -0.02 0.73 0.47 0.82 -1.16 0.00 0.00 179.01 179.85 2j2f h ILE 39 N 0.55 0.56 -0.03 3.13 2.04 -1.63 -0.16 117.51 121.98 2j2f h ILE 39 Ca 0.09 -0.18 -0.26 0.00 1.00 0.00 0.00 64.86 65.52 2j2f h ILE 39 Cb 0.56 -0.00 0.02 0.00 -0.74 0.00 0.00 36.82 36.66 2j2f h ILE 39 CO 0.04 0.09 -0.99 -0.26 0.00 0.00 0.00 178.15 177.03 2j2f h PHE 40 N 0.52 1.05 -0.97 1.37 0.04 -1.61 -1.99 116.94 115.34 2j2f h PHE 40 Ca 0.56 -0.55 0.11 0.00 2.80 0.00 0.00 57.97 60.89 2j2f h PHE 40 Cb 1.00 -0.13 -0.08 0.00 2.20 0.00 0.00 35.95 38.94 2j2f h PHE 40 CO -0.09 1.39 0.60 0.87 -0.60 0.00 0.00 178.31 180.48 2j2f h LYS 41 N 0.42 0.94 -0.28 1.51 1.79 -1.17 -1.57 116.57 118.22 2j2f h LYS 41 Ca -0.11 -0.06 -0.07 0.00 -2.18 0.00 0.00 60.65 58.23 2j2f h LYS 41 Cb 1.64 -0.21 -0.02 0.00 -1.58 0.00 0.00 32.23 32.06 2j2f h LYS 41 CO 0.20 0.62 -0.14 0.77 -1.08 0.00 0.00 179.45 179.82 2j2f h SER 42 N 0.96 0.47 -0.08 0.86 0.02 -0.93 -3.00 113.55 111.85 2j2f h SER 42 Ca 0.47 -0.12 0.00 0.00 -0.84 0.00 0.00 61.79 61.30 2j2f h SER 42 Cb 0.44 -0.12 0.00 0.00 0.14 0.00 0.00 62.40 62.86 2j2f h SER 42 CO -0.26 0.64 0.00 0.18 -1.14 0.00 0.00 176.83 176.25 2j2f n LEU 43 N -4.20 0.81 0.04 5.07 4.77 -0.61 -4.35 117.00 118.52 2j2f n LEU 43 Ca 0.00 -0.34 -0.09 0.00 -0.03 0.00 0.00 56.01 55.56 2j2f n LEU 43 Cb 0.33 -0.05 -0.06 0.00 -2.33 0.00 0.00 43.42 41.31 2j2f n LEU 43 CO 0.40 0.17 0.51 -0.78 -1.33 0.00 0.00 177.39 176.36 2j2f h ASP 44 N 1.06 -0.92 -0.75 -1.43 1.82 -1.35 0.38 116.42 115.23 2j2f h ASP 44 Ca 0.00 0.10 0.17 0.00 -0.39 0.00 0.00 57.03 56.91 2j2f h ASP 44 Cb 0.23 0.35 -0.13 0.00 0.68 0.00 0.00 39.33 40.46 2j2f h ASP 44 CO 0.00 -0.30 0.06 0.78 -1.61 0.00 0.00 179.24 178.17 2j2f h ASN 45 N -0.38 -0.25 -0.40 2.28 2.35 -1.85 -0.58 115.58 116.75 2j2f h ASN 45 Ca 0.00 0.18 0.04 0.00 -0.55 0.00 0.00 56.30 55.97 2j2f h ASN 45 Cb 0.41 0.31 -0.04 0.00 0.05 0.00 0.00 38.32 39.05 2j2f h ASN 45 CO -0.19 -0.15 0.19 -0.25 -1.65 0.00 0.00 177.43 175.38 2j2f h TRP 46 N 0.14 0.34 -0.82 1.19 7.01 -1.52 -1.50 115.95 120.79 2j2f h TRP 46 Ca 0.42 0.02 0.04 0.00 2.11 0.00 0.00 58.89 61.47 2j2f h TRP 46 Cb 0.74 -0.09 -0.05 0.00 -2.10 0.00 0.00 29.16 27.66 2j2f h TRP 46 CO -0.38 0.17 0.52 0.00 -2.79 0.00 0.00 178.44 175.96 2j2f h ALA 47 N 1.22 1.09 0.00 2.65 0.00 0.65 0.44 119.26 125.31 2j2f h ALA 47 Ca 0.18 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.06 2j2f h ALA 47 Cb 0.10 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 17.63 2j2f h ALA 47 CO -0.14 0.32 0.00 -1.91 0.00 0.00 0.00 179.25 177.52 2j2f n GLU 48 N -4.60 0.37 0.00 0.00 2.13 -0.32 -0.92 120.64 117.31 2j2f n GLU 48 Ca 0.10 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.92 2j2f n GLU 48 Cb 0.11 -1.17 0.00 0.00 0.27 0.00 0.00 31.44 30.65 2j2f n GLU 48 CO 0.00 0.00 0.00 0.39 -0.41 0.00 0.00 177.13 177.11 2j2f n GLU 49 N -0.67 5.21 -0.00 5.31 1.02 -0.56 -4.74 120.64 126.20 2j2f n GLU 49 Ca 0.03 0.00 0.04 0.00 -0.02 0.00 0.00 57.16 57.21 2j2f n GLU 49 Cb 0.01 -0.56 -0.05 0.00 -0.02 0.00 0.00 31.44 30.83 2j2f n GLU 49 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 2j2f n ASN 50 N -0.18 1.93 0.01 1.62 3.02 0.04 -4.66 115.26 117.04 2j2f n ASN 50 Ca 0.00 -0.31 -0.01 0.00 -0.03 0.00 0.00 54.58 54.23 2j2f n ASN 50 Cb 0.00 1.19 -0.00 0.00 -0.61 0.00 0.00 39.78 40.36 2j2f n ASN 50 CO 0.00 0.00 0.00 -0.38 -2.62 0.00 0.00 177.26 174.26 2j2f n ILE 51 N -1.50 0.85 -0.03 2.41 2.08 -0.09 -4.66 119.36 118.42 2j2f n ILE 51 Ca -0.00 0.27 0.24 0.00 0.56 0.00 0.00 62.75 63.82 2j2f n ILE 51 Cb 0.16 -1.55 0.69 0.00 -0.75 0.00 0.00 39.64 38.20 2j2f n ILE 51 CO 0.00 0.00 0.00 -0.07 0.56 0.00 0.00 176.55 177.04 2j2f h LEU 52 N -0.16 0.00 -1.29 1.39 3.38 -1.67 0.41 115.31 117.38 2j2f h LEU 52 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2j2f h LEU 52 Cb 0.16 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.91 2j2f h LEU 52 CO 0.00 0.00 0.00 1.33 0.09 0.00 0.00 178.44 179.86 2j2f n VAL 53 N -3.74 1.09 1.29 1.22 0.24 -1.26 -2.24 118.33 114.94 2j2f n VAL 53 Ca 0.13 0.69 0.13 0.00 -2.04 0.00 0.00 64.34 63.25 2j2f n VAL 53 Cb 0.87 -1.69 0.37 0.00 -1.47 0.00 0.00 33.84 31.92 2j2f n VAL 53 CO 0.00 0.00 0.00 1.41 -2.14 0.00 0.00 176.83 176.10 2j2f n HIS 54 N -2.20 0.02 -3.16 6.34 8.25 0.14 -4.84 115.22 119.77 2j2f n HIS 54 Ca -0.01 -0.01 -0.39 0.00 -0.26 0.00 0.00 57.72 57.05 2j2f n HIS 54 Cb 0.04 0.00 -0.05 0.00 1.12 0.00 0.00 29.99 31.10 2j2f n HIS 54 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 2j2f s LEU 55 N -1.97 4.29 -0.18 2.41 1.43 -0.95 -4.78 118.68 118.93 2j2f s LEU 55 Ca 0.34 1.01 -0.29 0.00 -1.03 0.00 0.00 54.13 54.17 2j2f s LEU 55 Cb 0.21 -2.91 -0.00 0.00 0.03 0.00 0.00 46.19 43.52 2j2f s LEU 55 CO 0.32 -0.08 1.01 -0.75 0.23 0.00 0.00 176.35 177.08 2j2f s LYS 56 N 0.79 4.32 0.36 1.70 2.47 -1.26 -5.00 119.74 123.11 2j2f s LYS 56 Ca 0.32 1.34 -0.28 0.00 -1.56 0.00 0.00 55.97 55.79 2j2f s LYS 56 Cb -0.16 -3.60 -0.12 0.00 -1.46 0.00 0.00 37.83 32.49 2j2f s LYS 56 CO 0.14 -0.49 1.40 -0.35 0.16 0.00 0.00 175.35 176.21 2j2f n PRO 57 N 5.74 2.41 -0.20 4.03 -0.04 -1.26 -4.78 135.00 140.90 2j2f n PRO 57 Ca 0.10 0.85 -0.11 0.00 -0.04 0.00 0.00 63.50 64.30 2j2f n PRO 57 Cb 0.47 -2.51 -0.07 0.00 -0.04 0.00 0.00 33.50 31.36 2j2f n PRO 57 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 2j2f h VAL 58 N 2.77 0.04 -1.03 0.52 2.07 -1.96 -0.44 116.25 118.22 2j2f h VAL 58 Ca -0.48 0.00 0.30 0.00 0.82 0.00 0.00 66.70 67.34 2j2f h VAL 58 Cb 1.26 0.04 -0.04 0.00 -1.52 0.00 0.00 31.29 31.03 2j2f h VAL 58 CO 0.64 0.00 0.77 -0.33 0.02 0.00 0.00 177.57 178.67 2j2f h GLU 59 N -0.27 0.00 -0.11 1.57 4.39 -2.01 0.15 114.58 118.29 2j2f h GLU 59 Ca 0.14 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.84 2j2f h GLU 59 Cb 0.56 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.21 2j2f h GLU 59 CO -0.68 0.00 0.00 1.63 -1.16 0.00 0.00 179.01 178.80 2j2f n LYS 60 N -4.14 2.12 -3.05 2.33 5.02 -0.19 -4.97 118.16 115.27 2j2f n LYS 60 Ca 0.22 -1.65 -0.32 0.00 -2.02 0.00 0.00 58.31 54.55 2j2f n LYS 60 Cb 1.12 -1.47 -0.05 0.00 -0.02 0.00 0.00 35.03 34.61 2j2f n LYS 60 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2j2f s TRP 62 N -2.10 2.57 0.10 0.00 1.48 -1.26 -5.05 118.94 114.68 2j2f s TRP 62 Ca 0.53 1.35 0.03 0.00 -1.06 0.00 0.00 56.10 56.95 2j2f s TRP 62 Cb -0.10 -3.09 -0.04 0.00 -1.16 0.00 0.00 33.47 29.08 2j2f s TRP 62 CO 0.22 -1.97 -0.09 -0.65 -4.06 0.00 0.00 176.95 170.40 2j2f s GLN 63 N -4.97 0.82 0.32 3.25 -1.52 -1.26 -5.04 119.66 111.26 2j2f s GLN 63 Ca 0.62 -1.19 0.10 0.00 -1.95 0.00 0.00 55.36 52.94 2j2f s GLN 63 Cb -0.17 -0.40 0.92 0.00 -0.22 0.00 0.00 33.01 33.14 2j2f s GLN 63 CO 0.56 0.04 1.72 -1.35 -0.25 0.00 0.00 175.29 176.01 2j2f h PRO 64 N 3.41 0.53 -0.03 2.91 0.11 -1.97 -0.75 132.00 136.21 2j2f h PRO 64 Ca -0.36 -0.03 0.01 0.00 0.11 0.00 0.00 66.00 65.72 2j2f h PRO 64 Cb 1.18 -0.12 -0.00 0.00 0.11 0.00 0.00 31.00 32.17 2j2f h PRO 64 CO 0.56 0.35 0.03 0.37 -0.21 0.00 0.00 178.00 179.10 2j2f h GLN 65 N 0.55 0.00 -0.31 1.05 5.75 -1.96 -1.14 115.11 119.04 2j2f h GLN 65 Ca 0.66 0.00 0.09 0.00 -0.15 0.00 0.00 58.65 59.25 2j2f h GLN 65 Cb 1.29 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 29.83 2j2f h GLN 65 CO -0.49 0.00 0.30 -0.44 -2.65 0.00 0.00 178.83 175.55 2j2f h ASP 66 N 0.00 0.00 0.00 -0.69 3.32 -1.54 -2.90 116.42 114.61 2j2f h ASP 66 Ca 0.01 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.06 2j2f h ASP 66 Cb 0.07 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.62 2j2f h ASP 66 CO -0.00 0.00 -0.00 0.49 -1.72 0.00 0.00 179.24 178.01 2j2f n PHE 67 N -3.91 0.00 -4.40 4.55 3.72 -0.43 -5.02 117.46 111.96 2j2f n PHE 67 Ca 0.05 -0.55 -0.26 0.00 -0.05 0.00 0.00 57.45 56.64 2j2f n PHE 67 Cb 0.46 -0.06 -0.10 0.00 -0.94 0.00 0.00 39.48 38.83 2j2f n PHE 67 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 176.76 176.20 2j2f s LEU 68 N -1.21 2.67 0.35 4.37 1.43 -1.10 -5.02 118.68 120.18 2j2f s LEU 68 Ca 0.04 -0.83 -0.26 0.00 -1.03 0.00 0.00 54.13 52.05 2j2f s LEU 68 Cb 0.03 -1.31 -0.13 0.00 0.03 0.00 0.00 46.19 44.82 2j2f s LEU 68 CO 0.00 0.08 0.96 -2.65 0.23 0.00 0.00 176.35 174.97 2j2f n PRO 69 N -0.17 1.26 -3.08 1.29 -0.02 -1.26 -4.89 135.00 128.14 2j2f n PRO 69 Ca -0.09 0.45 -0.42 0.00 -2.02 0.00 0.00 63.50 61.42 2j2f n PRO 69 Cb 0.57 -1.88 -0.06 0.00 -0.02 0.00 0.00 33.50 32.11 2j2f n PRO 69 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 2j2f s ASP 70 N -0.67 6.43 0.00 2.55 -1.08 -1.26 -4.91 116.67 117.72 2j2f s ASP 70 Ca 0.61 0.09 0.27 0.00 -0.52 0.00 0.00 52.55 53.00 2j2f s ASP 70 Cb -0.63 -2.34 1.23 0.00 -1.46 0.00 0.00 42.92 39.72 2j2f s ASP 70 CO 0.59 -0.66 1.90 -0.81 0.52 0.00 0.00 175.17 176.70 2j2f n PRO 71 N 6.18 0.11 -0.96 4.34 -0.04 -1.26 -2.42 135.00 140.94 2j2f n PRO 71 Ca -0.00 0.03 0.01 0.00 -0.04 0.00 0.00 63.50 63.49 2j2f n PRO 71 Cb 0.48 -1.50 0.36 0.00 -0.04 0.00 0.00 33.50 32.80 2j2f n PRO 71 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2j2f n ALA 72 N -1.44 4.22 -2.41 0.55 0.00 -1.26 -4.94 120.51 115.22 2j2f n ALA 72 Ca 0.08 -2.14 -0.28 0.00 0.00 0.00 0.00 53.44 51.10 2j2f n ALA 72 Cb 0.29 -1.18 -0.12 0.00 0.00 0.00 0.00 19.45 18.44 2j2f n ALA 72 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2j2f s SER 73 N -0.93 3.30 0.38 0.00 0.15 -1.02 -4.99 113.70 110.60 2j2f s SER 73 Ca 0.55 -0.79 0.28 0.00 0.70 0.00 0.00 55.95 56.69 2j2f s SER 73 Cb 0.43 -0.23 1.18 0.00 -1.71 0.00 0.00 66.02 65.69 2j2f s SER 73 CO 0.15 0.15 1.83 0.44 1.20 0.00 0.00 173.24 177.01 2j2f h ASP 74 N 3.62 0.00 0.24 5.45 3.32 -1.92 -1.57 116.42 125.55 2j2f h ASP 74 Ca -0.49 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.56 2j2f h ASP 74 Cb 1.19 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.74 2j2f h ASP 74 CO 0.43 0.00 -0.02 0.61 -1.72 0.00 0.00 179.24 178.54 2j2f n GLY 75 N -0.05 -1.00 0.27 2.75 0.00 -1.26 -4.38 105.19 101.52 2j2f n GLY 75 Ca 0.01 -0.21 -0.09 0.00 0.00 0.00 0.00 46.02 45.73 2j2f n GLY 75 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 2j2f h PHE 76 N 0.27 -0.62 0.21 1.61 3.57 -1.42 -0.12 116.94 120.45 2j2f h PHE 76 Ca 0.00 0.03 0.01 0.00 3.53 0.00 0.00 57.97 61.54 2j2f h PHE 76 Cb 0.19 0.30 -0.03 0.00 2.79 0.00 0.00 35.95 39.19 2j2f h PHE 76 CO 0.00 -0.31 -0.33 -0.44 -2.23 0.00 0.00 178.31 175.00 2j2f h ASP 77 N -0.27 -0.93 0.25 0.41 3.32 -1.84 0.13 116.42 117.50 2j2f h ASP 77 Ca 0.12 0.10 -0.03 0.00 0.02 0.00 0.00 57.03 57.24 2j2f h ASP 77 Cb 0.45 0.34 -0.00 0.00 0.22 0.00 0.00 39.33 40.33 2j2f h ASP 77 CO -0.34 -0.44 -0.13 1.05 -1.72 0.00 0.00 179.24 177.67 2j2f h GLU 78 N -0.61 0.00 -0.05 3.56 4.11 -1.82 -0.39 114.58 119.38 2j2f h GLU 78 Ca 0.01 0.00 -0.13 0.00 0.07 0.00 0.00 59.36 59.31 2j2f h GLU 78 Cb 0.60 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.86 2j2f h GLU 78 CO -0.14 0.13 -0.49 1.96 0.07 0.00 0.00 179.01 180.54 2j2f h GLN 79 N 0.00 0.42 -0.88 1.06 4.20 -0.05 -0.73 115.11 119.14 2j2f h GLN 79 Ca -0.00 -0.39 0.00 0.00 0.06 0.00 0.00 58.65 58.33 2j2f h GLN 79 Cb 0.28 0.09 -0.04 0.00 0.30 0.00 0.00 27.48 28.11 2j2f h GLN 79 CO 0.02 1.03 0.56 0.28 -0.67 0.00 0.00 178.83 180.05 2j2f h VAL 80 N -0.05 1.23 -0.17 -0.54 2.07 -0.14 -1.40 116.25 117.26 2j2f h VAL 80 Ca -0.05 -0.46 -0.02 0.00 0.82 0.00 0.00 66.70 67.00 2j2f h VAL 80 Cb 1.16 -0.04 -0.01 0.00 -1.52 0.00 0.00 31.29 30.89 2j2f h VAL 80 CO 0.10 0.23 0.04 -0.09 0.02 0.00 0.00 177.57 177.87 2j2f h ARG 81 N 1.20 0.28 -0.81 1.57 2.43 -0.97 -1.69 114.38 116.37 2j2f h ARG 81 Ca 0.32 -0.07 -0.02 0.00 -0.81 0.00 0.00 59.98 59.40 2j2f h ARG 81 Cb -0.10 -0.04 -0.04 0.00 -0.42 0.00 0.00 29.97 29.38 2j2f h ARG 81 CO -0.07 0.42 0.41 0.93 -1.51 0.00 0.00 179.97 180.16 2j2f h GLU 82 N 0.08 1.15 -0.60 0.20 5.08 -0.96 -0.63 114.58 118.90 2j2f h GLU 82 Ca 0.05 -0.16 0.11 0.00 -1.00 0.00 0.00 59.36 58.36 2j2f h GLU 82 Cb 0.27 -0.21 -0.08 0.00 0.50 0.00 0.00 28.75 29.23 2j2f h GLU 82 CO 0.00 0.88 0.17 1.25 -1.00 0.00 0.00 179.01 180.31 2j2f h LEU 83 N 1.14 0.09 -0.43 1.33 6.46 -1.02 -0.62 115.31 122.26 2j2f h LEU 83 Ca 0.28 0.10 -0.18 0.00 -0.12 0.00 0.00 57.88 57.96 2j2f h LEU 83 Cb 0.08 0.12 -0.01 0.00 -0.73 0.00 0.00 40.66 40.12 2j2f h LEU 83 CO -0.04 0.06 -0.72 0.03 -0.62 0.00 0.00 178.44 177.15 2j2f h ARG 84 N 0.32 0.37 -0.43 1.25 3.08 -0.70 -2.36 114.38 115.90 2j2f h ARG 84 Ca 0.31 -0.30 -0.08 0.00 0.07 0.00 0.00 59.98 59.98 2j2f h ARG 84 Cb 0.44 0.06 -0.01 0.00 0.08 0.00 0.00 29.97 30.54 2j2f h ARG 84 CO -0.36 0.94 -0.06 0.93 -1.07 0.00 0.00 179.97 180.34 2j2f h GLU 85 N 0.25 0.79 -0.51 0.04 5.08 -0.65 -2.67 114.58 116.91 2j2f h GLU 85 Ca -0.03 -0.28 -0.01 0.00 -1.00 0.00 0.00 59.36 58.04 2j2f h GLU 85 Cb 1.29 -0.06 -0.03 0.00 0.50 0.00 0.00 28.75 30.46 2j2f h GLU 85 CO 0.12 0.89 0.29 0.00 -1.00 0.00 0.00 179.01 179.31 2j2f h ARG 86 N 0.62 0.69 0.00 2.33 3.08 -1.01 -2.91 114.38 117.18 2j2f h ARG 86 Ca 0.11 -0.06 -0.09 0.00 0.07 0.00 0.00 59.98 60.01 2j2f h ARG 86 Cb 0.58 -0.14 -0.01 0.00 0.08 0.00 0.00 29.97 30.47 2j2f h ARG 86 CO 0.03 0.50 -0.45 0.00 -1.07 0.00 0.00 179.97 178.99 2j2f h ALA 87 N 1.62 1.10 -0.44 0.04 0.00 -1.11 -2.19 119.26 118.28 2j2f h ALA 87 Ca 0.18 -0.41 -0.01 0.00 0.00 0.00 0.00 54.91 54.68 2j2f h ALA 87 Cb 0.00 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 2j2f h ALA 87 CO -0.03 0.56 0.24 0.87 0.00 0.00 0.00 179.25 180.89 2j2f h LYS 88 N 0.00 0.60 -0.00 0.00 1.57 -1.27 -2.45 116.57 115.02 2j2f h LYS 88 Ca -0.00 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 58.72 2j2f h LYS 88 Cb 0.88 -0.13 0.00 0.00 0.08 0.00 0.00 32.23 33.06 2j2f h LYS 88 CO 0.06 0.45 -0.01 0.39 -0.57 0.00 0.00 179.45 179.76 2j2f n GLU 89 N -4.42 0.58 -3.32 3.15 -0.58 -0.83 -4.70 120.64 110.52 2j2f n GLU 89 Ca 0.03 -0.03 -0.40 0.00 -0.42 0.00 0.00 57.16 56.35 2j2f n GLU 89 Cb 0.10 -1.50 -0.08 0.00 -0.57 0.00 0.00 31.44 29.38 2j2f n GLU 89 CO 0.00 0.00 0.00 0.42 -0.48 0.00 0.00 177.13 177.07 2j2f s ILE 90 N -2.44 5.12 0.80 -3.67 1.01 -0.92 -4.93 121.20 116.17 2j2f s ILE 90 Ca 0.33 0.64 -0.11 0.00 0.00 0.00 0.00 60.65 61.51 2j2f s ILE 90 Cb 0.21 -3.77 0.08 0.00 0.01 0.00 0.00 42.46 38.98 2j2f s ILE 90 CO 0.44 0.09 1.11 -2.16 0.00 0.00 0.00 174.94 174.42 2j2f s PRO 91 N 2.18 1.94 0.22 2.79 0.04 -1.26 -4.86 135.00 136.05 2j2f s PRO 91 Ca 0.17 1.32 -0.09 0.00 0.04 0.00 0.00 61.00 62.45 2j2f s PRO 91 Cb -0.16 -1.85 0.24 0.00 0.04 0.00 0.00 34.50 32.77 2j2f s PRO 91 CO 0.10 -1.90 1.84 -0.44 0.04 0.00 0.00 177.00 176.64 2j2f h ASP 92 N -1.22 0.73 -0.95 6.66 3.32 -1.95 -2.73 116.42 120.28 2j2f h ASP 92 Ca -0.44 0.01 0.12 0.00 0.02 0.00 0.00 57.03 56.74 2j2f h ASP 92 Cb 1.25 -0.15 -0.14 0.00 0.22 0.00 0.00 39.33 40.52 2j2f h ASP 92 CO 0.49 0.49 -0.46 0.47 -1.72 0.00 0.00 179.24 178.51 2j2f n ASP 93 N -4.67 -0.80 -0.21 6.45 10.43 -1.26 -0.95 116.55 125.55 2j2f n ASP 93 Ca 0.09 1.68 -0.08 0.00 2.57 0.00 0.00 54.79 59.04 2j2f n ASP 93 Cb 0.12 -0.31 0.02 0.00 1.84 0.00 0.00 41.12 42.80 2j2f n ASP 93 CO 0.00 0.00 0.00 0.22 -1.07 0.00 0.00 177.20 176.35 2j2f h TYR 94 N 0.00 0.97 -0.74 1.24 5.03 -1.86 -2.16 116.97 119.44 2j2f h TYR 94 Ca 0.25 -0.11 0.05 0.00 2.58 0.00 0.00 58.73 61.49 2j2f h TYR 94 Cb 0.49 -0.27 -0.04 0.00 1.55 0.00 0.00 36.73 38.45 2j2f h TYR 94 CO -0.90 0.82 0.49 0.74 -1.32 0.00 0.00 178.16 177.99 2j2f h PHE 95 N 0.83 0.84 -0.08 -3.82 0.04 -0.92 -0.30 116.94 113.54 2j2f h PHE 95 Ca 0.18 0.02 0.02 0.00 2.80 0.00 0.00 57.97 61.00 2j2f h PHE 95 Cb 0.34 -0.28 -0.03 0.00 2.20 0.00 0.00 35.95 38.18 2j2f h PHE 95 CO 0.02 0.47 -0.08 0.28 -0.60 0.00 0.00 178.31 178.40 2j2f h VAL 96 N 0.85 0.78 0.39 -0.55 2.07 -0.38 0.22 116.25 119.63 2j2f h VAL 96 Ca 0.31 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.81 2j2f h VAL 96 Cb 0.14 0.78 0.00 0.00 -1.52 0.00 0.00 31.29 30.69 2j2f h VAL 96 CO -0.10 0.00 -0.19 0.58 0.02 0.00 0.00 177.57 177.89 2j2f h VAL 97 N -0.10 0.61 -0.94 2.57 2.07 -1.27 -1.15 116.25 118.04 2j2f h VAL 97 Ca 0.06 -0.22 0.13 0.00 0.82 0.00 0.00 66.70 67.49 2j2f h VAL 97 Cb 0.18 0.72 -0.08 0.00 -1.52 0.00 0.00 31.29 30.60 2j2f h VAL 97 CO -0.14 0.04 0.60 0.25 0.02 0.00 0.00 177.57 178.35 2j2f h LEU 98 N -0.65 0.79 -0.22 2.57 5.85 -0.92 0.15 115.31 122.88 2j2f h LEU 98 Ca -0.05 0.04 -0.02 0.00 0.84 0.00 0.00 57.88 58.69 2j2f h LEU 98 Cb 0.48 -0.11 -0.01 0.00 0.37 0.00 0.00 40.66 41.38 2j2f h LEU 98 CO 0.09 0.41 0.06 0.58 -0.34 0.00 0.00 178.44 179.24 2j2f h VAL 99 N 0.84 1.20 -0.70 1.05 2.07 -0.28 -1.36 116.25 119.08 2j2f h VAL 99 Ca 0.47 -0.63 0.07 0.00 0.82 0.00 0.00 66.70 67.43 2j2f h VAL 99 Cb 0.60 1.21 -0.06 0.00 -1.52 0.00 0.00 31.29 31.52 2j2f h VAL 99 CO -0.23 0.20 0.37 1.23 0.02 0.00 0.00 177.57 179.16 2j2f h GLY 100 N 0.17 1.03 0.97 2.17 0.00 0.09 0.20 103.07 107.71 2j2f h GLY 100 Ca 0.07 -0.25 0.01 0.00 0.00 0.00 0.00 47.33 47.16 2j2f h GLY 100 CO -0.00 0.12 0.18 -0.55 0.00 0.00 0.00 176.54 176.29 2j2f h ASP 101 N 0.67 0.30 -0.47 0.19 3.32 -0.88 -1.22 116.42 118.33 2j2f h ASP 101 Ca 0.32 -0.00 -0.03 0.00 0.02 0.00 0.00 57.03 57.34 2j2f h ASP 101 Cb 0.26 -0.07 -0.02 0.00 0.22 0.00 0.00 39.33 39.72 2j2f h ASP 101 CO -0.22 0.22 0.17 -0.03 -1.72 0.00 0.00 179.24 177.66 2j2f h MET 102 N 0.37 0.71 -0.69 3.56 4.05 -0.32 -1.63 114.93 120.98 2j2f h MET 102 Ca 0.11 -0.14 -0.00 0.00 -0.28 0.00 0.00 59.70 59.39 2j2f h MET 102 Cb -0.02 -0.11 -0.03 0.00 -0.80 0.00 0.00 31.60 30.63 2j2f h MET 102 CO -0.04 0.66 0.41 0.82 0.23 0.00 0.00 176.91 179.00 2j2f h ILE 103 N 0.62 1.20 -0.13 1.77 2.04 -0.46 0.95 117.51 123.49 2j2f h ILE 103 Ca 0.15 -0.43 0.04 0.00 1.00 0.00 0.00 64.86 65.62 2j2f h ILE 103 Cb 0.23 0.25 -0.05 0.00 -0.74 0.00 0.00 36.82 36.50 2j2f h ILE 103 CO -0.01 0.20 -0.17 0.74 0.00 0.00 0.00 178.15 178.91 2j2f h THR 104 N 0.93 0.55 -0.91 -0.27 2.02 -0.89 -1.83 112.91 112.52 2j2f h THR 104 Ca 0.25 0.00 0.07 0.00 0.77 0.00 0.00 66.41 67.50 2j2f h THR 104 Cb -0.03 0.55 -0.07 0.00 -1.74 0.00 0.00 68.15 66.87 2j2f h THR 104 CO -0.05 0.00 0.57 -0.33 0.37 0.00 0.00 175.52 176.09 2j2f h GLU 105 N -0.21 0.99 0.00 6.66 4.39 -0.41 -2.57 114.58 123.43 2j2f h GLU 105 Ca 0.10 -0.06 0.00 0.00 0.34 0.00 0.00 59.36 59.74 2j2f h GLU 105 Cb 0.35 -0.22 0.00 0.00 -0.10 0.00 0.00 28.75 28.78 2j2f h GLU 105 CO -0.26 0.65 0.00 0.93 -1.16 0.00 0.00 179.01 179.18 2j2f h GLU 106 N 1.02 0.00 -0.97 2.33 4.39 0.01 -2.41 114.58 118.95 2j2f h GLU 106 Ca 0.41 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 60.10 2j2f h GLU 106 Cb 0.22 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 28.87 2j2f h GLU 106 CO -0.19 0.00 0.01 0.00 -1.16 0.00 0.00 179.01 177.67 2j2f n ALA 107 N -1.95 2.63 -0.33 3.43 0.00 -0.97 -4.56 120.51 118.76 2j2f n ALA 107 Ca 0.00 -0.16 0.11 0.00 0.00 0.00 0.00 53.44 53.39 2j2f n ALA 107 Cb 0.22 -1.01 0.23 0.00 0.00 0.00 0.00 19.45 18.89 2j2f n ALA 107 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 2j2f h LEU 108 N 0.41 -0.56 -1.13 0.00 5.85 -1.61 -1.79 115.31 116.49 2j2f h LEU 108 Ca 0.01 0.27 0.13 0.00 0.84 0.00 0.00 57.88 59.13 2j2f h LEU 108 Cb 0.69 0.49 -0.08 0.00 0.37 0.00 0.00 40.66 42.13 2j2f h LEU 108 CO 0.05 -0.32 0.60 -0.65 -0.34 0.00 0.00 178.44 177.78 2j2f h PRO 109 N 0.02 0.83 -0.96 5.25 0.11 -1.90 0.41 132.00 135.76 2j2f h PRO 109 Ca 0.54 -0.05 0.17 0.00 0.11 0.00 0.00 66.00 66.77 2j2f h PRO 109 Cb 1.03 -0.19 -0.10 0.00 0.11 0.00 0.00 31.00 31.86 2j2f h PRO 109 CO -0.90 0.55 0.57 1.15 -0.21 0.00 0.00 178.00 179.15 2j2f h THR 110 N 0.86 0.74 0.00 -1.15 2.02 -1.70 -1.70 112.91 111.98 2j2f h THR 110 Ca 0.48 -0.26 -0.14 0.00 0.77 0.00 0.00 66.41 67.25 2j2f h THR 110 Cb 0.59 -0.08 -0.02 0.00 -1.74 0.00 0.00 68.15 66.90 2j2f h THR 110 CO -0.24 0.14 -0.69 1.88 0.37 0.00 0.00 175.52 176.98 2j2f h TYR 111 N 0.76 0.00 -0.20 3.16 0.05 -0.28 -0.15 116.97 120.31 2j2f h TYR 111 Ca 0.54 0.00 -0.16 0.00 0.05 0.00 0.00 58.73 59.16 2j2f h TYR 111 Cb 0.77 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.50 2j2f h TYR 111 CO -0.03 0.69 -0.52 0.37 -1.05 0.00 0.00 178.16 177.62 2j2f h GLN 112 N 0.00 0.58 -0.76 4.88 4.15 -1.00 -2.49 115.11 120.47 2j2f h GLN 112 Ca -0.01 -0.35 -0.04 0.00 0.77 0.00 0.00 58.65 59.02 2j2f h GLN 112 Cb 1.30 0.03 -0.03 0.00 0.21 0.00 0.00 27.48 28.99 2j2f h GLN 112 CO 0.09 0.96 0.34 1.15 -1.93 0.00 0.00 178.83 179.43 2j2f h THR 113 N 0.45 1.25 -0.95 2.39 2.02 -0.78 -1.16 112.91 116.13 2j2f h THR 113 Ca 0.02 -0.74 0.06 0.00 0.77 0.00 0.00 66.41 66.52 2j2f h THR 113 Cb 1.06 0.30 -0.06 0.00 -1.74 0.00 0.00 68.15 67.71 2j2f h THR 113 CO 0.10 0.31 0.60 0.24 0.37 0.00 0.00 175.52 177.14 2j2f h MET 114 N 1.10 1.07 -0.03 6.66 2.86 -0.61 -0.66 114.93 125.31 2j2f h MET 114 Ca 0.26 -0.06 -0.21 0.00 -2.06 0.00 0.00 59.70 57.63 2j2f h MET 114 Cb 0.16 -0.24 -0.00 0.00 0.06 0.00 0.00 31.60 31.58 2j2f h MET 114 CO -0.03 0.71 -0.86 -0.07 1.06 0.00 0.00 176.91 177.72 2j2f h LEU 115 N 1.10 0.52 0.00 1.22 3.38 -1.22 -3.10 115.31 117.21 2j2f h LEU 115 Ca 0.41 -0.39 0.00 0.00 0.09 0.00 0.00 57.88 57.99 2j2f h LEU 115 Cb 0.16 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 40.75 2j2f h LEU 115 CO -0.17 1.17 0.00 0.59 0.09 0.00 0.00 178.44 180.12 2j2f n ASN 116 N -3.78 0.00 0.01 -0.43 3.02 -0.38 -2.44 115.26 111.26 2j2f n ASN 116 Ca -0.06 -1.32 0.11 0.00 -0.03 0.00 0.00 54.58 53.29 2j2f n ASN 116 Cb 0.79 0.00 -0.05 0.00 -0.61 0.00 0.00 39.78 39.91 2j2f n ASN 116 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 2j2f n THR 117 N -0.69 0.06 -2.47 3.41 -2.24 -0.48 -4.72 114.28 107.15 2j2f n THR 117 Ca 0.07 -0.18 -0.42 0.00 -2.27 0.00 0.00 64.05 61.26 2j2f n THR 117 Cb 0.03 0.48 -0.03 0.00 -2.10 0.00 0.00 70.33 68.71 2j2f n THR 117 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 2j2f s LEU 118 N -3.60 4.39 0.11 3.22 1.43 -1.02 -4.42 118.68 118.79 2j2f s LEU 118 Ca 0.04 1.99 -0.27 0.00 -1.03 0.00 0.00 54.13 54.86 2j2f s LEU 118 Cb 0.15 -3.58 -0.08 0.00 0.03 0.00 0.00 46.19 42.70 2j2f s LEU 118 CO 0.84 -0.40 1.64 0.44 0.23 0.00 0.00 176.35 179.09 2j2f h ASP 119 N 6.49 -0.73 -0.41 2.29 3.32 -0.73 -1.63 116.42 125.02 2j2f h ASP 119 Ca -0.42 0.09 0.00 0.00 0.02 0.00 0.00 57.03 56.72 2j2f h ASP 119 Cb 1.21 0.28 0.00 0.00 0.22 0.00 0.00 39.33 41.04 2j2f h ASP 119 CO 0.79 -0.35 0.00 0.61 -1.72 0.00 0.00 179.24 178.57 2j2f n GLY 120 N -1.38 1.09 0.00 2.75 0.00 -1.26 -4.29 105.19 102.10 2j2f n GLY 120 Ca -0.07 -0.51 0.00 0.00 0.00 0.00 0.00 46.02 45.44 2j2f n GLY 120 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2j2f n VAL 121 N 0.83 0.00 -1.61 1.61 0.24 -1.09 -4.51 118.33 113.80 2j2f n VAL 121 Ca 0.16 -0.17 -0.36 0.00 -2.04 0.00 0.00 64.34 61.93 2j2f n VAL 121 Cb 0.40 0.93 0.08 0.00 -1.47 0.00 0.00 33.84 33.78 2j2f n VAL 121 CO 0.00 0.00 0.00 -2.11 -2.14 0.00 0.00 176.83 172.58 2j2f n ARG 122 N -0.39 0.94 -2.80 7.34 1.85 -0.63 -4.17 116.66 118.80 2j2f n ARG 122 Ca 0.00 0.38 -0.43 0.00 -1.00 0.00 0.00 57.85 56.80 2j2f n ARG 122 Cb 0.00 -2.51 -0.04 0.00 -1.05 0.00 0.00 32.46 28.86 2j2f n ARG 122 CO 0.00 0.00 0.00 0.34 -0.01 0.00 0.00 177.63 177.96 2j2f s ASP 123 N -1.51 6.56 0.01 2.89 -1.08 -1.26 -4.77 116.67 117.51 2j2f s ASP 123 Ca 0.81 0.28 0.26 0.00 -0.52 0.00 0.00 52.55 53.38 2j2f s ASP 123 Cb -0.36 -2.46 1.08 0.00 -1.46 0.00 0.00 42.92 39.71 2j2f s ASP 123 CO 0.42 -1.00 1.81 -0.62 0.52 0.00 0.00 175.17 176.30 2j2f n GLU 124 N 7.09 0.01 0.00 4.34 -0.58 -1.26 -4.14 120.64 126.10 2j2f n GLU 124 Ca 0.07 0.07 0.00 0.00 -0.42 0.00 0.00 57.16 56.88 2j2f n GLU 124 Cb 0.48 -1.52 0.00 0.00 -0.57 0.00 0.00 31.44 29.84 2j2f n GLU 124 CO 0.00 0.00 0.00 0.25 -0.48 0.00 0.00 177.13 176.90 2j2f n THR 125 N -1.54 0.00 0.00 2.62 -2.24 -1.26 -5.01 114.28 106.85 2j2f n THR 125 Ca 0.06 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.84 2j2f n THR 125 Cb 0.30 -0.61 0.00 0.00 -2.10 0.00 0.00 70.33 67.93 2j2f n THR 125 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2j2f n GLY 126 N 2.12 0.62 2.11 3.38 0.00 -1.26 -4.92 105.19 107.24 2j2f n GLY 126 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.00 2j2f n GLY 126 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2j2f n ALA 127 N -1.20 3.00 -2.13 4.61 0.00 -1.26 -5.11 120.51 118.42 2j2f n ALA 127 Ca 0.00 -1.45 -0.42 0.00 0.00 0.00 0.00 53.44 51.57 2j2f n ALA 127 Cb 0.00 -0.69 -0.03 0.00 0.00 0.00 0.00 19.45 18.73 2j2f n ALA 127 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2j2f s SER 128 N -1.75 6.83 0.00 0.00 0.15 -1.26 -4.89 113.70 112.77 2j2f s SER 128 Ca 0.14 2.36 0.08 0.00 0.70 0.00 0.00 55.95 59.22 2j2f s SER 128 Cb 0.30 -2.59 0.43 0.00 -1.71 0.00 0.00 66.02 62.45 2j2f s SER 128 CO -0.08 -0.64 0.98 -2.65 1.20 0.00 0.00 173.24 172.05 2j2f n PRO 129 N 3.66 0.20 -1.34 5.44 -0.02 -1.26 -4.16 135.00 137.52 2j2f n PRO 129 Ca 0.10 0.07 -0.33 0.00 -2.02 0.00 0.00 63.50 61.33 2j2f n PRO 129 Cb 0.42 -1.50 0.09 0.00 -0.02 0.00 0.00 33.50 32.50 2j2f n PRO 129 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 2j2f s THR 130 N -2.18 2.75 0.31 3.45 -4.23 -1.26 -4.84 115.64 109.64 2j2f s THR 130 Ca 0.10 0.31 0.01 0.00 -1.18 0.00 0.00 61.69 60.93 2j2f s THR 130 Cb 0.05 -2.74 0.18 0.00 1.34 0.00 0.00 72.50 71.33 2j2f s THR 130 CO 0.10 -0.26 1.88 0.28 -0.54 0.00 0.00 174.62 176.08 2j2f h SER 131 N -0.70 0.70 -0.09 3.99 0.02 -1.88 -1.08 113.55 114.52 2j2f h SER 131 Ca -0.46 -0.10 -0.01 0.00 -0.84 0.00 0.00 61.79 60.38 2j2f h SER 131 Cb 1.26 -0.18 -0.00 0.00 0.14 0.00 0.00 62.40 63.62 2j2f h SER 131 CO 0.50 0.66 0.00 -0.50 -1.14 0.00 0.00 176.83 176.36 2j2f h TRP 132 N 0.75 0.17 -0.23 3.45 4.06 -1.91 -0.44 115.95 121.81 2j2f h TRP 132 Ca 0.17 -0.03 -0.10 0.00 2.06 0.00 0.00 58.89 61.00 2j2f h TRP 132 Cb 0.21 -0.04 -0.01 0.00 -1.00 0.00 0.00 29.16 28.31 2j2f h TRP 132 CO 0.01 0.40 -0.29 0.00 -3.56 0.00 0.00 178.44 175.00 2j2f h ALA 133 N 0.75 1.08 -0.21 1.49 0.00 -1.69 -2.13 119.26 118.55 2j2f h ALA 133 Ca 0.03 -0.36 -0.01 0.00 0.00 0.00 0.00 54.91 54.57 2j2f h ALA 133 Cb 0.33 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 2j2f h ALA 133 CO 0.00 0.57 0.10 0.82 0.00 0.00 0.00 179.25 180.74 2j2f h ILE 134 N 0.39 1.13 -0.37 0.00 2.04 -0.91 -2.01 117.51 117.78 2j2f h ILE 134 Ca 0.05 -0.38 0.07 0.00 1.00 0.00 0.00 64.86 65.60 2j2f h ILE 134 Cb 0.71 1.00 -0.06 0.00 -0.74 0.00 0.00 36.82 37.73 2j2f h ILE 134 CO 0.05 0.13 -0.04 -0.25 0.00 0.00 0.00 178.15 178.05 2j2f h TRP 135 N 0.21 -0.09 -0.59 1.37 2.91 -0.88 -1.78 115.95 117.10 2j2f h TRP 135 Ca 0.07 0.03 -0.02 0.00 1.13 0.00 0.00 58.89 60.10 2j2f h TRP 135 Cb 0.12 0.10 -0.03 0.00 -0.51 0.00 0.00 29.16 28.84 2j2f h TRP 135 CO -0.03 -0.11 0.26 1.15 -1.03 0.00 0.00 178.44 178.69 2j2f h THR 136 N 0.06 1.20 -0.02 2.65 2.02 -1.14 0.30 112.91 117.98 2j2f h THR 136 Ca 0.18 -0.58 -0.25 0.00 0.77 0.00 0.00 66.41 66.52 2j2f h THR 136 Cb 0.26 0.47 0.02 0.00 -1.74 0.00 0.00 68.15 67.16 2j2f h THR 136 CO -0.34 0.24 -1.00 0.03 0.37 0.00 0.00 175.52 174.83 2j2f h ARG 137 N 0.83 0.66 0.00 6.66 3.08 -1.15 -1.88 114.38 122.59 2j2f h ARG 137 Ca 0.20 -0.69 -0.22 0.00 0.07 0.00 0.00 59.98 59.35 2j2f h ARG 137 Cb 0.11 0.19 -0.00 0.00 0.08 0.00 0.00 29.97 30.35 2j2f h ARG 137 CO -0.02 1.28 -0.92 0.00 -1.07 0.00 0.00 179.97 179.23 2j2f h ALA 138 N 0.48 0.41 -0.26 0.04 0.00 -0.84 -0.65 119.26 118.45 2j2f h ALA 138 Ca -0.11 -0.72 -0.03 0.00 0.00 0.00 0.00 54.91 54.06 2j2f h ALA 138 Cb 1.64 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 19.38 2j2f h ALA 138 CO 0.19 0.85 0.06 2.35 0.00 0.00 0.00 179.25 182.71 2j2f h TRP 139 N 0.19 0.44 -0.14 0.00 7.01 -0.47 -0.90 115.95 122.07 2j2f h TRP 139 Ca -0.07 -0.05 0.04 0.00 2.11 0.00 0.00 58.89 60.92 2j2f h TRP 139 Cb 1.56 -0.12 -0.04 0.00 -2.10 0.00 0.00 29.16 28.45 2j2f h TRP 139 CO 0.05 0.50 -0.11 1.15 -2.79 0.00 0.00 178.44 177.24 2j2f h THR 140 N 0.25 0.69 -0.94 2.65 2.02 -1.23 -0.78 112.91 115.57 2j2f h THR 140 Ca 0.08 0.00 0.18 0.00 0.77 0.00 0.00 66.41 67.44 2j2f h THR 140 Cb 0.28 0.69 -0.08 0.00 -1.74 0.00 0.00 68.15 67.30 2j2f h THR 140 CO 0.00 0.00 0.60 0.00 0.37 0.00 0.00 175.52 176.49 2j2f h ALA 141 N 0.98 1.94 -0.24 6.16 0.00 -0.89 -0.77 119.26 126.43 2j2f h ALA 141 Ca 0.09 0.03 -0.15 0.00 0.00 0.00 0.00 54.91 54.88 2j2f h ALA 141 Cb 0.25 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.96 2j2f h ALA 141 CO -0.21 -0.23 -0.45 0.93 0.00 0.00 0.00 179.25 179.29 2j2f h GLU 142 N 0.61 0.73 -0.82 0.00 5.08 -0.14 -3.26 114.58 116.78 2j2f h GLU 142 Ca 0.50 -0.46 -0.02 0.00 -1.00 0.00 0.00 59.36 58.37 2j2f h GLU 142 Cb 0.96 0.05 -0.04 0.00 0.50 0.00 0.00 28.75 30.22 2j2f h GLU 142 CO -0.25 1.09 0.42 0.93 -1.00 0.00 0.00 179.01 180.20 2j2f h GLU 143 N 0.46 1.16 -0.97 2.33 4.39 -0.06 -3.05 114.58 118.84 2j2f h GLU 143 Ca 0.01 -0.15 0.21 0.00 0.34 0.00 0.00 59.36 59.78 2j2f h GLU 143 Cb 1.05 -0.22 -0.08 0.00 -0.10 0.00 0.00 28.75 29.40 2j2f h GLU 143 CO 0.10 0.87 0.62 -0.97 -1.16 0.00 0.00 179.01 178.47 2j2f h ASN 144 N 1.16 0.53 0.72 1.42 -1.24 -1.23 0.18 115.58 117.11 2j2f h ASN 144 Ca 0.29 0.07 -0.05 0.00 0.71 0.00 0.00 56.30 57.31 2j2f h ASN 144 Cb 0.07 -0.03 -0.01 0.00 0.73 0.00 0.00 38.32 39.09 2j2f h ASN 144 CO -0.04 0.18 -0.22 0.03 -1.29 0.00 0.00 177.43 176.09 2j2f h ARG 145 N 0.51 0.00 -0.04 6.67 3.08 -1.67 -2.95 114.38 119.98 2j2f h ARG 145 Ca 0.53 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.58 2j2f h ARG 145 Cb 1.17 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 31.22 2j2f h ARG 145 CO -0.26 0.22 0.02 0.45 -1.07 0.00 0.00 179.97 179.33 2j2f h HIS 146 N 0.00 0.06 -0.24 3.04 3.86 -0.77 -1.34 115.15 119.75 2j2f h HIS 146 Ca -0.00 -0.01 -0.00 0.00 -1.16 0.00 0.00 60.37 59.20 2j2f h HIS 146 Cb 0.64 -0.02 -0.01 0.00 1.06 0.00 0.00 27.41 29.08 2j2f h HIS 146 CO 0.00 0.21 0.14 0.78 0.86 0.00 0.00 177.93 179.92 2j2f h GLY 147 N -0.10 0.36 0.59 2.45 0.00 -1.58 -2.34 103.07 102.44 2j2f h GLY 147 Ca 0.01 -0.16 0.09 0.00 0.00 0.00 0.00 47.33 47.28 2j2f h GLY 147 CO -0.00 0.15 0.55 -0.55 0.00 0.00 0.00 176.54 176.69 2j2f h ASP 148 N 0.29 0.82 0.01 0.19 5.19 -1.47 0.19 116.42 121.64 2j2f h ASP 148 Ca 0.09 0.04 -0.00 0.00 -0.62 0.00 0.00 57.03 56.53 2j2f h ASP 148 Cb 0.04 -0.13 0.00 0.00 0.18 0.00 0.00 39.33 39.42 2j2f h ASP 148 CO -0.02 0.48 -0.00 0.25 -3.12 0.00 0.00 179.24 176.83 2j2f h LEU 149 N 0.93 -0.01 -1.22 1.55 5.85 -1.09 -2.62 115.31 118.70 2j2f h LEU 149 Ca 0.42 -0.71 -0.01 0.00 0.84 0.00 0.00 57.88 58.43 2j2f h LEU 149 Cb 0.32 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 41.32 2j2f h LEU 149 CO -0.22 0.71 0.41 -0.07 -0.34 0.00 0.00 178.44 178.92 2j2f h LEU 150 N -0.74 0.83 0.58 2.25 3.38 -1.27 -1.39 115.31 118.95 2j2f h LEU 150 Ca -0.00 -0.05 -0.02 0.00 0.09 0.00 0.00 57.88 57.90 2j2f h LEU 150 Cb 0.71 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.25 2j2f h LEU 150 CO 0.00 0.65 -0.38 -1.13 0.09 0.00 0.00 178.44 177.67 2j2f h ASN 151 N 0.96 -0.98 -0.24 -0.43 -0.73 -0.64 -1.05 115.58 112.46 2j2f h ASN 151 Ca 0.25 0.06 -0.04 0.00 1.87 0.00 0.00 56.30 58.44 2j2f h ASN 151 Cb -0.02 0.30 -0.02 0.00 0.27 0.00 0.00 38.32 38.85 2j2f h ASN 151 CO -0.05 -0.58 0.03 0.11 -0.37 0.00 0.00 177.43 176.57 2j2f h LYS 152 N -0.92 0.51 -0.37 6.67 6.56 -1.26 0.18 116.57 127.93 2j2f h LYS 152 Ca -0.07 -0.10 -0.02 0.00 -1.06 0.00 0.00 60.65 59.40 2j2f h LYS 152 Cb 0.76 -0.08 -0.02 0.00 -0.57 0.00 0.00 32.23 32.32 2j2f h LYS 152 CO 0.05 0.52 0.15 -0.92 -2.06 0.00 0.00 179.45 177.18 2j2f h TYR 153 N 0.49 0.57 -0.35 -1.35 3.20 -1.13 -0.87 116.97 117.54 2j2f h TYR 153 Ca 0.11 -0.04 -0.11 0.00 3.14 0.00 0.00 58.73 61.83 2j2f h TYR 153 Cb 0.28 -0.17 -0.01 0.00 1.54 0.00 0.00 36.73 38.36 2j2f h TYR 153 CO 0.01 0.52 -0.23 -0.07 -1.64 0.00 0.00 178.16 176.75 2j2f h LEU 154 N 0.46 0.70 0.05 2.82 3.38 -0.05 -1.50 115.31 121.17 2j2f h LEU 154 Ca 0.12 -0.25 -0.00 0.00 0.09 0.00 0.00 57.88 57.85 2j2f h LEU 154 Cb 0.19 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 40.75 2j2f h LEU 154 CO -0.01 0.91 -0.03 0.22 0.09 0.00 0.00 178.44 179.63 2j2f h TYR 155 N 0.60 -0.07 0.00 1.13 3.20 -0.57 -2.84 116.97 118.43 2j2f h TYR 155 Ca 0.08 -0.00 -0.03 0.00 3.14 0.00 0.00 58.73 61.92 2j2f h TYR 155 Cb 0.72 0.02 -0.00 0.00 1.54 0.00 0.00 36.73 39.00 2j2f h TYR 155 CO 0.03 0.01 -0.16 -0.07 -1.64 0.00 0.00 178.16 176.33 2j2f h LEU 156 N -0.13 0.00 -1.28 2.82 3.38 -0.89 -3.23 115.31 115.98 2j2f h LEU 156 Ca -0.01 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.92 2j2f h LEU 156 Cb 0.11 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.84 2j2f h LEU 156 CO 0.01 0.16 0.06 0.77 0.09 0.00 0.00 178.44 179.53 2j2f h SER 157 N 0.00 0.50 -0.33 -0.43 4.64 -1.02 -3.44 113.55 113.48 2j2f h SER 157 Ca -0.00 -0.08 -0.14 0.00 -0.47 0.00 0.00 61.79 61.10 2j2f h SER 157 Cb 0.69 -0.13 -0.06 0.00 -0.31 0.00 0.00 62.40 62.59 2j2f h SER 157 CO 0.02 0.53 -0.13 0.61 -0.87 0.00 0.00 176.83 176.99 2j2f n GLY 158 N -0.99 0.82 0.00 -0.77 0.00 -1.22 -4.75 105.19 98.28 2j2f n GLY 158 Ca 0.02 -0.20 0.10 0.00 0.00 0.00 0.00 46.02 45.94 2j2f n GLY 158 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2j2f n ARG 159 N -1.56 0.02 -4.23 1.61 5.12 -1.26 -4.99 116.66 111.37 2j2f n ARG 159 Ca -0.07 -0.00 -0.13 0.00 -1.93 0.00 0.00 57.85 55.72 2j2f n ARG 159 Cb 0.38 -1.50 -0.10 0.00 -1.16 0.00 0.00 32.46 30.08 2j2f n ARG 159 CO 0.00 0.00 0.00 0.14 -1.93 0.00 0.00 177.63 175.84 2j2f s VAL 160 N -3.01 0.89 -0.81 1.55 -7.23 -1.26 -4.80 120.40 105.72 2j2f s VAL 160 Ca 0.08 -2.00 -0.17 0.00 -1.81 0.00 0.00 61.98 58.08 2j2f s VAL 160 Cb 0.16 -1.90 0.16 0.00 0.56 0.00 0.00 36.38 35.36 2j2f s VAL 160 CO 0.86 -0.69 0.88 -0.62 -0.31 0.00 0.00 175.10 175.22 2j2f s ASP 161 N -3.14 6.59 0.61 4.85 -1.08 0.94 -4.91 116.67 120.53 2j2f s ASP 161 Ca 0.18 -2.19 0.30 0.00 -0.52 0.00 0.00 52.55 50.33 2j2f s ASP 161 Cb 0.04 -2.30 1.69 0.00 -1.46 0.00 0.00 42.92 40.90 2j2f s ASP 161 CO 0.00 -0.87 2.06 0.24 0.52 0.00 0.00 175.17 177.12 2j2f h MET 162 N 8.47 0.00 0.07 4.34 2.86 -1.94 -2.04 114.93 126.70 2j2f h MET 162 Ca 0.03 0.00 -0.28 0.00 -2.06 0.00 0.00 59.70 57.40 2j2f h MET 162 Cb 1.05 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.69 2j2f h MET 162 CO 0.96 0.00 -1.41 -0.09 1.06 0.00 0.00 176.91 177.43 2j2f h ARG 163 N 0.00 0.16 0.00 1.72 2.43 -1.96 0.12 114.38 116.85 2j2f h ARG 163 Ca 0.09 -0.27 -0.08 0.00 -0.81 0.00 0.00 59.98 58.91 2j2f h ARG 163 Cb 0.60 0.10 -0.01 0.00 -0.42 0.00 0.00 29.97 30.24 2j2f h ARG 163 CO -0.00 1.00 -0.38 1.96 -1.51 0.00 0.00 179.97 181.04 2j2f h GLN 164 N 0.04 0.00 0.06 0.20 1.08 -1.68 -2.03 115.11 112.78 2j2f h GLN 164 Ca -0.19 0.00 -0.09 0.00 -1.45 0.00 0.00 58.65 56.93 2j2f h GLN 164 Cb 1.95 0.00 0.01 0.00 -0.05 0.00 0.00 27.48 29.39 2j2f h GLN 164 CO 0.15 0.38 -0.40 0.82 -0.95 0.00 0.00 178.83 178.83 2j2f h ILE 165 N 0.00 1.65 -0.76 2.54 2.04 -1.23 -1.41 117.51 120.34 2j2f h ILE 165 Ca -0.00 -2.43 0.06 0.00 1.00 0.00 0.00 64.86 63.49 2j2f h ILE 165 Cb 0.94 3.29 -0.05 0.00 -0.74 0.00 0.00 36.82 40.26 2j2f h ILE 165 CO 0.05 0.65 0.50 -0.33 0.00 0.00 0.00 178.15 179.03 2j2f h GLU 166 N -0.71 0.80 -0.40 2.37 5.08 -0.79 -0.69 114.58 120.25 2j2f h GLU 166 Ca -0.07 -0.05 -0.15 0.00 -1.00 0.00 0.00 59.36 58.09 2j2f h GLU 166 Cb 1.30 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 30.36 2j2f h GLU 166 CO 0.06 0.53 -0.34 -0.22 -1.00 0.00 0.00 179.01 178.05 2j2f h LYS 167 N 0.83 0.92 -0.48 2.33 3.64 -1.32 -1.79 116.57 120.69 2j2f h LYS 167 Ca 0.33 -0.45 0.00 0.00 -1.27 0.00 0.00 60.65 59.26 2j2f h LYS 167 Cb 0.23 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.02 2j2f h LYS 167 CO -0.11 1.11 0.32 1.15 -2.27 0.00 0.00 179.45 179.64 2j2f h THR 168 N 0.76 1.13 -0.42 1.00 2.02 -0.57 -2.19 112.91 114.65 2j2f h THR 168 Ca 0.07 -0.25 0.01 0.00 0.77 0.00 0.00 66.41 67.01 2j2f h THR 168 Cb 0.92 0.43 -0.02 0.00 -1.74 0.00 0.00 68.15 67.73 2j2f h THR 168 CO 0.09 0.13 0.27 0.40 0.37 0.00 0.00 175.52 176.78 2j2f h ILE 169 N 0.65 1.10 -0.24 3.11 2.04 -0.89 -0.38 117.51 122.90 2j2f h ILE 169 Ca 0.18 -0.19 -0.00 0.00 1.00 0.00 0.00 64.86 65.84 2j2f h ILE 169 Cb -0.06 0.49 -0.01 0.00 -0.74 0.00 0.00 36.82 36.50 2j2f h ILE 169 CO -0.04 0.10 0.13 -0.61 0.00 0.00 0.00 178.15 177.73 2j2f h GLN 170 N 0.56 0.32 -0.19 2.37 4.15 -1.09 -1.28 115.11 119.93 2j2f h GLN 170 Ca 0.16 -0.02 -0.09 0.00 0.77 0.00 0.00 58.65 59.46 2j2f h GLN 170 Cb -0.05 -0.07 -0.00 0.00 0.21 0.00 0.00 27.48 27.57 2j2f h GLN 170 CO -0.04 0.24 -0.23 1.88 -1.93 0.00 0.00 178.83 178.75 2j2f h TYR 171 N 0.32 0.61 -0.45 3.99 0.05 -0.73 -2.73 116.97 118.03 2j2f h TYR 171 Ca 0.09 -0.19 -0.00 0.00 0.05 0.00 0.00 58.73 58.67 2j2f h TYR 171 Cb 0.01 -0.12 -0.02 0.00 1.01 0.00 0.00 36.73 37.61 2j2f h TYR 171 CO 0.00 0.88 0.27 1.25 -1.05 0.00 0.00 178.16 179.51 2j2f h LEU 172 N 0.17 0.54 -0.73 3.88 5.85 0.02 -0.02 115.31 125.01 2j2f h LEU 172 Ca 0.03 -0.06 -0.08 0.00 0.84 0.00 0.00 57.88 58.61 2j2f h LEU 172 Cb 0.79 -0.14 -0.03 0.00 0.37 0.00 0.00 40.66 41.66 2j2f h LEU 172 CO 0.06 0.43 0.09 0.40 -0.34 0.00 0.00 178.44 179.08 2j2f h ILE 173 N 0.59 1.26 -0.64 4.05 2.04 -1.44 0.15 117.51 123.52 2j2f h ILE 173 Ca 0.16 -1.04 -0.00 0.00 1.00 0.00 0.00 64.86 64.98 2j2f h ILE 173 Cb -0.00 0.66 -0.03 0.00 -0.74 0.00 0.00 36.82 36.71 2j2f h ILE 173 CO -0.03 0.39 0.38 1.23 0.00 0.00 0.00 178.15 180.12 2j2f h GLY 174 N 1.04 0.93 1.29 5.37 0.00 -1.10 -2.77 103.07 107.83 2j2f h GLY 174 Ca 0.20 -0.38 -0.33 0.00 0.00 0.00 0.00 47.33 46.82 2j2f h GLY 174 CO 0.01 0.37 -1.47 1.76 0.00 0.00 0.00 176.54 177.21 2j2f h SER 175 N 0.88 0.70 0.00 0.19 0.02 -0.74 -3.50 113.55 111.11 2j2f h SER 175 Ca 0.23 -0.80 0.00 0.00 -0.84 0.00 0.00 61.79 60.39 2j2f h SER 175 Cb -0.03 -0.23 0.00 0.00 0.14 0.00 0.00 62.40 62.28 2j2f h SER 175 CO -0.04 1.63 0.00 0.61 -1.14 0.00 0.00 176.83 177.89 2j2f n GLY 176 N 1.69 0.77 3.42 -3.77 0.00 0.52 -4.92 105.19 102.91 2j2f n GLY 176 Ca -0.16 -0.75 -0.14 0.00 0.00 0.00 0.00 46.02 44.97 2j2f n GLY 176 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2j2f s MET 177 N 0.00 1.12 -0.35 1.61 0.00 -1.26 -4.79 119.30 115.63 2j2f s MET 177 Ca 0.00 -0.24 0.01 0.00 0.00 0.00 0.00 55.69 55.47 2j2f s MET 177 Cb 0.00 0.52 0.11 0.00 0.00 0.00 0.00 34.83 35.45 2j2f s MET 177 CO 0.00 -0.43 0.11 0.34 0.00 0.00 0.00 175.02 175.04 2j2f s ASP 178 N -2.11 4.25 0.00 1.11 2.15 -1.26 -4.98 116.67 115.83 2j2f s ASP 178 Ca -0.04 -2.00 0.21 0.00 0.43 0.00 0.00 52.55 51.16 2j2f s ASP 178 Cb -0.00 -1.18 1.26 0.00 -0.30 0.00 0.00 42.92 42.70 2j2f s ASP 178 CO -0.04 -0.38 1.67 -0.81 -0.17 0.00 0.00 175.17 175.44 2j2f n PRO 179 N 4.41 0.63 -3.26 4.34 -0.04 -1.26 -4.85 135.00 134.96 2j2f n PRO 179 Ca 0.02 0.01 -0.17 0.00 -0.04 0.00 0.00 63.50 63.32 2j2f n PRO 179 Cb 0.41 -1.50 0.06 0.00 -0.04 0.00 0.00 33.50 32.43 2j2f n PRO 179 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2j2f n ARG 180 N -1.04 -5.79 0.03 0.54 1.74 -1.26 -4.84 116.66 106.04 2j2f n ARG 180 Ca 0.15 0.64 0.12 0.00 -0.77 0.00 0.00 57.85 58.00 2j2f n ARG 180 Cb 0.09 -5.09 0.26 0.00 -1.02 0.00 0.00 32.46 26.69 2j2f n ARG 180 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 2j2f n THR 181 N -4.09 0.20 -2.40 0.55 -2.24 -1.26 -4.96 114.28 100.08 2j2f n THR 181 Ca -0.07 -0.15 -0.15 0.00 -2.27 0.00 0.00 64.05 61.41 2j2f n THR 181 Cb 0.57 -0.06 -0.01 0.00 -2.10 0.00 0.00 70.33 68.73 2j2f n THR 181 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2j2f n GLU 182 N -1.84 -2.01 -1.06 -0.78 1.02 -1.26 -0.53 120.64 114.18 2j2f n GLU 182 Ca 0.05 0.75 -0.02 0.00 -0.02 0.00 0.00 57.16 57.92 2j2f n GLU 182 Cb 0.39 -5.37 -0.01 0.00 -0.02 0.00 0.00 31.44 26.43 2j2f n GLU 182 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 2j2f n ASN 183 N -1.85 -4.63 -4.61 1.62 4.13 -1.26 -1.26 115.26 107.41 2j2f n ASN 183 Ca -0.18 0.05 -0.40 0.00 1.68 0.00 0.00 54.58 55.73 2j2f n ASN 183 Cb 0.64 -2.32 -0.07 0.00 -1.54 0.00 0.00 39.78 36.48 2j2f n ASN 183 CO 0.00 0.00 0.00 -0.55 0.28 0.00 0.00 177.26 176.99 2j2f s SER 184 N -2.16 6.44 0.53 6.41 0.15 0.31 0.05 113.70 125.42 2j2f s SER 184 Ca 0.00 0.43 0.28 0.00 0.70 0.00 0.00 55.95 57.36 2j2f s SER 184 Cb 0.00 -2.29 1.42 0.00 -1.71 0.00 0.00 66.02 63.44 2j2f s SER 184 CO 0.00 -0.36 1.95 -0.65 1.20 0.00 0.00 173.24 175.38 2j2f h PRO 185 N 8.11 0.01 0.47 5.44 0.11 -1.91 0.38 132.00 144.62 2j2f h PRO 185 Ca -0.28 -0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.80 2j2f h PRO 185 Cb 1.13 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.24 2j2f h PRO 185 CO 0.74 0.01 -0.22 1.88 -0.21 0.00 0.00 178.00 180.20 2j2f h TYR 186 N 0.01 -0.58 -0.22 0.65 -1.99 -1.92 -1.70 116.97 111.21 2j2f h TYR 186 Ca 0.33 -0.01 -0.03 0.00 2.00 0.00 0.00 58.73 61.01 2j2f h TYR 186 Cb 1.31 0.19 -0.01 0.00 2.00 0.00 0.00 36.73 40.22 2j2f h TYR 186 CO -0.00 -0.30 0.01 -0.07 -0.00 0.00 0.00 178.16 177.79 2j2f h LEU 187 N -0.75 0.38 -0.32 3.88 3.38 -1.64 -2.37 115.31 117.88 2j2f h LEU 187 Ca -0.06 -0.30 0.07 0.00 0.09 0.00 0.00 57.88 57.68 2j2f h LEU 187 Cb 0.54 -0.10 -0.08 0.00 0.09 0.00 0.00 40.66 41.10 2j2f h LEU 187 CO 0.11 0.59 -0.32 1.23 0.09 0.00 0.00 178.44 180.13 2j2f h GLY 188 N 0.16 -0.31 2.00 0.83 0.00 -0.25 0.12 103.07 105.63 2j2f h GLY 188 Ca 0.06 0.41 -0.11 0.00 0.00 0.00 0.00 47.33 47.69 2j2f h GLY 188 CO 0.01 -0.21 -0.52 0.74 0.00 0.00 0.00 176.54 176.56 2j2f h PHE 189 N -0.29 0.00 0.39 5.60 0.04 -1.29 0.21 116.94 121.59 2j2f h PHE 189 Ca 0.15 0.00 -0.02 0.00 2.80 0.00 0.00 57.97 60.90 2j2f h PHE 189 Cb 0.54 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.69 2j2f h PHE 189 CO -0.50 0.52 -0.19 0.82 -0.60 0.00 0.00 178.31 178.36 2j2f h ILE 190 N 0.00 0.62 0.06 -0.55 1.08 -1.01 -1.01 117.51 116.69 2j2f h ILE 190 Ca -0.01 -0.13 0.02 0.00 -0.39 0.00 0.00 64.86 64.35 2j2f h ILE 190 Cb 1.08 0.69 -0.05 0.00 -3.07 0.00 0.00 36.82 35.47 2j2f h ILE 190 CO 0.07 0.03 -0.52 0.22 -0.69 0.00 0.00 178.15 177.25 2j2f h TYR 191 N -0.60 -1.51 0.00 1.37 3.20 -0.21 -1.23 116.97 117.99 2j2f h TYR 191 Ca -0.05 0.04 -0.03 0.00 3.14 0.00 0.00 58.73 61.83 2j2f h TYR 191 Cb 0.44 0.65 -0.00 0.00 1.54 0.00 0.00 36.73 39.36 2j2f h TYR 191 CO -0.03 -0.58 -0.14 1.79 -1.64 0.00 0.00 178.16 177.56 2j2f h THR 192 N -0.71 0.55 0.09 1.81 1.35 -1.03 -0.69 112.91 114.29 2j2f h THR 192 Ca 0.01 -0.64 -0.00 0.00 -0.55 0.00 0.00 66.41 65.22 2j2f h THR 192 Cb 0.74 1.43 0.00 0.00 -1.73 0.00 0.00 68.15 68.58 2j2f h THR 192 CO -0.32 0.14 -0.05 0.28 -0.25 0.00 0.00 175.52 175.32 2j2f h SER 193 N 0.00 -0.11 0.17 5.36 0.02 -0.29 -1.92 113.55 116.78 2j2f h SER 193 Ca -0.00 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 60.94 2j2f h SER 193 Cb 0.41 0.03 0.00 0.00 0.14 0.00 0.00 62.40 62.99 2j2f h SER 193 CO 0.02 -0.08 -0.08 0.15 -1.14 0.00 0.00 176.83 175.70 2j2f h PHE 194 N -0.13 -0.21 -0.24 3.45 3.04 -0.09 -3.02 116.94 119.74 2j2f h PHE 194 Ca -0.01 -0.01 0.04 0.00 3.98 0.00 0.00 57.97 61.97 2j2f h PHE 194 Cb 0.10 0.07 -0.04 0.00 2.56 0.00 0.00 35.95 38.64 2j2f h PHE 194 CO -0.07 -0.08 0.02 1.96 -2.02 0.00 0.00 178.31 178.11 2j2f h GLN 195 N -0.29 0.09 -0.99 1.11 1.08 -1.19 -1.85 115.11 113.07 2j2f h GLN 195 Ca -0.02 -0.01 0.13 0.00 -1.45 0.00 0.00 58.65 57.30 2j2f h GLN 195 Cb 0.23 -0.02 -0.09 0.00 -0.05 0.00 0.00 27.48 27.55 2j2f h GLN 195 CO 0.04 0.06 0.62 0.93 -0.95 0.00 0.00 178.83 179.53 2j2f h GLU 196 N 0.10 0.92 -0.37 1.46 4.39 -1.37 0.18 114.58 119.89 2j2f h GLU 196 Ca 0.11 -0.06 -0.12 0.00 0.34 0.00 0.00 59.36 59.63 2j2f h GLU 196 Cb 0.14 -0.21 -0.01 0.00 -0.10 0.00 0.00 28.75 28.57 2j2f h GLU 196 CO -0.18 0.61 -0.25 -0.09 -1.16 0.00 0.00 179.01 177.94 2j2f h ARG 197 N 0.94 0.82 -0.02 2.33 2.43 -1.32 0.17 114.38 119.73 2j2f h ARG 197 Ca 0.51 -0.39 0.02 0.00 -0.81 0.00 0.00 59.98 59.31 2j2f h ARG 197 Cb 0.56 -0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 30.08 2j2f h ARG 197 CO -0.29 1.03 -0.10 0.00 -1.51 0.00 0.00 179.97 179.09 2j2f h ALA 198 N 0.78 -0.10 -0.76 2.80 0.00 -0.34 0.10 119.26 121.74 2j2f h ALA 198 Ca 0.07 0.01 0.12 0.00 0.00 0.00 0.00 54.91 55.11 2j2f h ALA 198 Cb 0.82 0.19 -0.08 0.00 0.00 0.00 0.00 17.79 18.72 2j2f h ALA 198 CO 0.07 -0.59 0.36 -0.44 0.00 0.00 0.00 179.25 178.65 2j2f h ASP 199 N -0.17 0.44 -0.12 0.00 3.32 -0.63 0.61 116.42 119.88 2j2f h ASP 199 Ca 0.05 0.08 -0.01 0.00 0.02 0.00 0.00 57.03 57.16 2j2f h ASP 199 Cb 0.23 0.01 -0.01 0.00 0.22 0.00 0.00 39.33 39.78 2j2f h ASP 199 CO -0.12 0.22 0.05 0.15 -1.72 0.00 0.00 179.24 177.82 2j2f h PHE 200 N 0.58 0.24 0.11 4.55 3.57 -0.04 -1.22 116.94 124.73 2j2f h PHE 200 Ca 0.39 -0.00 -0.17 0.00 3.53 0.00 0.00 57.97 61.71 2j2f h PHE 200 Cb 0.49 -0.08 0.02 0.00 2.79 0.00 0.00 35.95 39.17 2j2f h PHE 200 CO -0.12 0.22 -0.74 0.82 -2.23 0.00 0.00 178.31 176.26 2j2f h ILE 201 N 0.25 1.50 -0.13 1.41 2.04 0.84 -1.68 117.51 121.74 2j2f h ILE 201 Ca 0.06 -2.43 -0.01 0.00 1.00 0.00 0.00 64.86 63.49 2j2f h ILE 201 Cb 0.10 3.08 -0.01 0.00 -0.74 0.00 0.00 36.82 39.25 2j2f h ILE 201 CO -0.00 0.69 0.05 0.28 0.00 0.00 0.00 178.15 179.17 2j2f h SER 202 N -0.33 0.19 0.12 1.72 0.02 -0.90 0.23 113.55 114.59 2j2f h SER 202 Ca -0.12 -0.17 -0.01 0.00 -0.84 0.00 0.00 61.79 60.65 2j2f h SER 202 Cb 1.55 -0.05 0.00 0.00 0.14 0.00 0.00 62.40 64.04 2j2f h SER 202 CO 0.14 0.31 -0.06 0.45 -1.14 0.00 0.00 176.83 176.53 2j2f h HIS 203 N 0.05 -0.15 -0.94 3.45 3.86 -1.36 -0.72 115.15 119.35 2j2f h HIS 203 Ca 0.04 -0.00 0.26 0.00 -1.16 0.00 0.00 60.37 59.51 2j2f h HIS 203 Cb 0.18 0.05 -0.17 0.00 1.06 0.00 0.00 27.41 28.53 2j2f h HIS 203 CO -0.01 0.26 0.10 0.78 0.86 0.00 0.00 177.93 179.91 2j2f h GLY 204 N -0.61 1.28 0.62 2.45 0.00 -1.24 0.21 103.07 105.78 2j2f h GLY 204 Ca -0.02 0.10 -0.01 0.00 0.00 0.00 0.00 47.33 47.40 2j2f h GLY 204 CO 0.03 -0.47 -0.02 3.43 0.00 0.00 0.00 176.54 179.50 2j2f h ASN 205 N 0.06 0.09 0.00 0.19 2.35 -0.36 -2.05 115.58 115.86 2j2f h ASN 205 Ca 0.58 -0.43 -0.00 0.00 -0.55 0.00 0.00 56.30 55.90 2j2f h ASN 205 Cb 1.20 -0.02 -0.00 0.00 0.05 0.00 0.00 38.32 39.55 2j2f h ASN 205 CO -0.83 0.49 -0.00 0.71 -1.65 0.00 0.00 177.43 176.15 2j2f h THR 206 N -0.32 0.97 0.75 2.81 1.35 -0.41 0.30 112.91 118.37 2j2f h THR 206 Ca 0.01 -0.00 -0.04 0.00 -0.55 0.00 0.00 66.41 65.83 2j2f h THR 206 Cb 0.46 1.00 0.01 0.00 -1.73 0.00 0.00 68.15 67.89 2j2f h THR 206 CO 0.01 0.00 -0.36 0.00 -0.25 0.00 0.00 175.52 174.92 2j2f h ALA 207 N 2.00 -1.01 -0.69 6.62 0.00 -0.36 0.11 119.26 125.93 2j2f h ALA 207 Ca -0.00 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.68 2j2f h ALA 207 Cb 0.00 0.39 -0.03 0.00 0.00 0.00 0.00 17.79 18.15 2j2f h ALA 207 CO 0.00 -0.98 0.44 0.00 0.00 0.00 0.00 179.25 178.71 2j2f h ARG 208 N -1.20 0.92 -0.55 0.00 3.08 -1.05 -1.64 114.38 113.95 2j2f h ARG 208 Ca -0.10 -0.07 -0.07 0.00 0.07 0.00 0.00 59.98 59.81 2j2f h ARG 208 Cb 0.79 -0.20 -0.02 0.00 0.08 0.00 0.00 29.97 30.62 2j2f h ARG 208 CO 0.17 0.63 0.06 1.96 -1.07 0.00 0.00 179.97 181.72 2j2f h GLN 209 N 0.94 0.90 -0.54 0.04 4.20 -0.97 -1.51 115.11 118.16 2j2f h GLN 209 Ca 0.25 -0.23 0.14 0.00 0.06 0.00 0.00 58.65 58.88 2j2f h GLN 209 Cb -0.08 -0.11 -0.02 0.00 0.30 0.00 0.00 27.48 27.57 2j2f h GLN 209 CO -0.05 0.85 0.38 0.00 -0.67 0.00 0.00 178.83 179.34 2j2f h ALA 210 N 1.22 2.41 -0.11 3.87 0.00 0.16 0.25 119.26 127.05 2j2f h ALA 210 Ca 0.17 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 55.04 2j2f h ALA 210 Cb 0.42 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.22 2j2f h ALA 210 CO 0.01 -0.56 -0.03 -0.22 0.00 0.00 0.00 179.25 178.46 2j2f h LYS 211 N 0.07 0.22 0.04 0.00 3.64 -0.71 -2.09 116.57 117.74 2j2f h LYS 211 Ca 0.26 -0.08 -0.00 0.00 -1.27 0.00 0.00 60.65 59.55 2j2f h LYS 211 Cb 0.92 -0.01 -0.00 0.00 -0.41 0.00 0.00 32.23 32.73 2j2f h LYS 211 CO -0.02 0.52 -0.05 0.93 -2.27 0.00 0.00 179.45 178.56 2j2f h GLU 212 N -0.10 -0.09 0.00 1.90 4.39 -0.34 0.68 114.58 121.02 2j2f h GLU 212 Ca 0.03 0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.73 2j2f h GLU 212 Cb 0.44 0.02 0.00 0.00 -0.10 0.00 0.00 28.75 29.11 2j2f h GLU 212 CO 0.01 -0.06 0.33 0.72 -1.16 0.00 0.00 179.01 178.85 2j2f n HIS 213 N -2.64 0.00 -0.59 4.33 8.25 -0.98 -4.64 115.22 118.94 2j2f n HIS 213 Ca -0.01 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.45 2j2f n HIS 213 Cb 0.05 -0.01 0.00 0.00 1.12 0.00 0.00 29.99 31.15 2j2f n HIS 213 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2j2f n GLY 214 N -0.84 0.75 2.98 -1.41 0.00 0.23 -4.66 105.19 102.24 2j2f n GLY 214 Ca 0.00 -0.55 -0.31 0.00 0.00 0.00 0.00 46.02 45.16 2j2f n GLY 214 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2j2f s ASP 215 N -2.52 4.87 0.21 1.61 -1.08 -0.79 -4.97 116.67 114.01 2j2f s ASP 215 Ca 0.00 -3.40 -0.12 0.00 -0.52 0.00 0.00 52.55 48.52 2j2f s ASP 215 Cb 0.00 -1.71 0.27 0.00 -1.46 0.00 0.00 42.92 40.02 2j2f s ASP 215 CO 0.00 -0.19 1.67 0.16 0.52 0.00 0.00 175.17 177.32 2j2f h ILE 216 N 4.87 0.51 -0.62 4.11 3.07 -1.85 -2.09 117.51 125.51 2j2f h ILE 216 Ca 0.04 -0.04 0.03 0.00 1.55 0.00 0.00 64.86 66.44 2j2f h ILE 216 Cb 0.84 0.39 -0.04 0.00 -0.27 0.00 0.00 36.82 37.74 2j2f h ILE 216 CO 0.73 0.02 0.38 0.11 -1.05 0.00 0.00 178.15 178.33 2j2f h LYS 217 N 0.11 0.72 -0.33 0.16 1.57 -1.94 0.13 116.57 117.00 2j2f h LYS 217 Ca 0.30 -0.04 0.02 0.00 -1.87 0.00 0.00 60.65 59.06 2j2f h LYS 217 Cb 0.48 -0.16 -0.02 0.00 0.08 0.00 0.00 32.23 32.61 2j2f h LYS 217 CO -0.51 0.48 0.22 1.25 -0.57 0.00 0.00 179.45 180.32 2j2f h LEU 218 N 0.74 0.32 -0.03 2.94 5.85 -1.82 -0.61 115.31 122.70 2j2f h LEU 218 Ca 0.25 -0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.96 2j2f h LEU 218 Cb 0.02 -0.08 -0.00 0.00 0.37 0.00 0.00 40.66 40.98 2j2f h LEU 218 CO -0.10 0.22 -0.01 0.00 -0.34 0.00 0.00 178.44 178.21 2j2f h ALA 219 N 1.81 0.04 -0.93 1.25 0.00 -0.16 -1.78 119.26 119.48 2j2f h ALA 219 Ca 0.13 -0.21 0.14 0.00 0.00 0.00 0.00 54.91 54.97 2j2f h ALA 219 Cb 0.06 -0.01 -0.08 0.00 0.00 0.00 0.00 17.79 17.77 2j2f h ALA 219 CO -0.03 -0.25 0.59 1.96 0.00 0.00 0.00 179.25 181.53 2j2f h GLN 220 N -0.34 0.77 0.44 0.00 4.20 -0.50 0.39 115.11 120.07 2j2f h GLN 220 Ca 0.01 -0.05 -0.02 0.00 0.06 0.00 0.00 58.65 58.65 2j2f h GLN 220 Cb 0.42 -0.17 0.00 0.00 0.30 0.00 0.00 27.48 28.03 2j2f h GLN 220 CO 0.00 0.51 -0.21 0.82 -0.67 0.00 0.00 178.83 179.28 2j2f h ILE 221 N 0.79 0.55 -0.58 2.54 2.04 -0.89 -0.23 117.51 121.73 2j2f h ILE 221 Ca 0.47 -0.27 -0.10 0.00 1.00 0.00 0.00 64.86 65.96 2j2f h ILE 221 Cb 0.65 0.68 -0.02 0.00 -0.74 0.00 0.00 36.82 37.39 2j2f h ILE 221 CO -0.23 0.05 -0.02 0.00 0.00 0.00 0.00 178.15 177.94 2j2f h GLY 223 N 0.99 0.52 1.42 0.00 0.00 -0.21 -0.37 103.07 105.41 2j2f h GLY 223 Ca 0.16 -0.16 -0.03 0.00 0.00 0.00 0.00 47.33 47.30 2j2f h GLY 223 CO 0.03 0.14 0.19 -0.84 0.00 0.00 0.00 176.54 176.06 2j2f h THR 224 N 0.44 1.19 -0.35 4.70 2.02 -0.77 -0.93 112.91 119.22 2j2f h THR 224 Ca 0.15 -0.63 -0.03 0.00 0.77 0.00 0.00 66.41 66.67 2j2f h THR 224 Cb 0.00 0.61 -0.01 0.00 -1.74 0.00 0.00 68.15 67.01 2j2f h THR 224 CO -0.07 0.24 0.11 0.40 0.37 0.00 0.00 175.52 176.57 2j2f h ILE 225 N 0.73 1.21 -0.89 3.11 2.04 -1.03 -2.97 117.51 119.71 2j2f h ILE 225 Ca 0.17 -0.69 0.10 0.00 1.00 0.00 0.00 64.86 65.44 2j2f h ILE 225 Cb 0.18 1.00 -0.07 0.00 -0.74 0.00 0.00 36.82 37.18 2j2f h ILE 225 CO -0.01 0.24 0.54 0.00 0.00 0.00 0.00 178.15 178.91 2j2f h ALA 226 N 0.95 1.29 -0.05 1.87 0.00 -0.33 -2.33 119.26 120.65 2j2f h ALA 226 Ca 0.11 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.04 2j2f h ALA 226 Cb 0.26 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.87 2j2f h ALA 226 CO -0.00 0.18 0.01 0.00 0.00 0.00 0.00 179.25 179.44 2j2f h ALA 227 N 1.47 0.06 -1.01 0.00 0.00 -1.10 -0.76 119.26 117.92 2j2f h ALA 227 Ca 0.43 -0.13 0.28 0.00 0.00 0.00 0.00 54.91 55.49 2j2f h ALA 227 Cb 0.36 -0.02 -0.13 0.00 0.00 0.00 0.00 17.79 18.00 2j2f h ALA 227 CO -0.24 -0.31 0.59 -0.44 0.00 0.00 0.00 179.25 178.85 2j2f h ASP 228 N -0.15 0.60 -0.51 0.00 5.19 -1.28 -1.58 116.42 118.70 2j2f h ASP 228 Ca 0.01 0.16 -0.11 0.00 -0.62 0.00 0.00 57.03 56.47 2j2f h ASP 228 Cb 0.24 0.07 -0.02 0.00 0.18 0.00 0.00 39.33 39.81 2j2f h ASP 228 CO 0.00 0.01 -0.10 -0.33 -3.12 0.00 0.00 179.24 175.70 2j2f h GLU 229 N 0.47 0.97 -0.28 3.56 4.39 -0.67 -2.45 114.58 120.57 2j2f h GLU 229 Ca 0.68 -0.36 0.04 0.00 0.34 0.00 0.00 59.36 60.06 2j2f h GLU 229 Cb 1.42 -0.06 -0.04 0.00 -0.10 0.00 0.00 28.75 29.97 2j2f h GLU 229 CO -0.52 1.03 0.03 -0.22 -1.16 0.00 0.00 179.01 178.17 2j2f h LYS 230 N 0.83 0.12 -0.88 2.33 1.63 -0.42 0.37 116.57 120.54 2j2f h LYS 230 Ca 0.13 -0.01 0.04 0.00 -0.85 0.00 0.00 60.65 59.97 2j2f h LYS 230 Cb 0.66 -0.03 -0.06 0.00 -0.60 0.00 0.00 32.23 32.21 2j2f h LYS 230 CO 0.05 0.08 0.56 0.00 -3.45 0.00 0.00 179.45 176.69 2j2f h ARG 231 N 0.12 1.04 -0.47 1.90 3.08 -1.42 0.30 114.38 118.93 2j2f h ARG 231 Ca 0.13 -0.06 -0.07 0.00 0.07 0.00 0.00 59.98 60.05 2j2f h ARG 231 Cb 0.16 -0.23 -0.02 0.00 0.08 0.00 0.00 29.97 29.96 2j2f h ARG 231 CO -0.20 0.69 0.03 0.45 -1.07 0.00 0.00 179.97 179.87 2j2f h HIS 232 N 1.07 0.88 -0.17 3.04 3.86 -0.88 -1.23 115.15 121.71 2j2f h HIS 232 Ca 0.36 -0.14 0.01 0.00 -1.16 0.00 0.00 60.37 59.44 2j2f h HIS 232 Cb 0.06 -0.23 -0.01 0.00 1.06 0.00 0.00 27.41 28.29 2j2f h HIS 232 CO -0.02 0.83 0.10 1.49 0.86 0.00 0.00 177.93 181.19 2j2f h GLU 233 N 0.67 0.20 -0.31 2.45 4.81 0.01 -0.44 114.58 121.97 2j2f h GLU 233 Ca 0.14 -0.01 0.07 0.00 -0.13 0.00 0.00 59.36 59.42 2j2f h GLU 233 Cb 0.46 -0.05 -0.07 0.00 0.63 0.00 0.00 28.75 29.73 2j2f h GLU 233 CO 0.02 0.13 -0.13 1.15 -0.73 0.00 0.00 179.01 179.45 2j2f h THR 234 N 0.21 0.58 -0.08 0.32 2.02 -0.25 0.55 112.91 116.26 2j2f h THR 234 Ca 0.07 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.25 2j2f h THR 234 Cb -0.01 0.58 -0.00 0.00 -1.74 0.00 0.00 68.15 66.98 2j2f h THR 234 CO -0.03 0.00 0.05 0.00 0.37 0.00 0.00 175.52 175.91 2j2f h ALA 235 N 1.19 0.10 -0.19 6.16 0.00 -0.63 -2.26 119.26 123.63 2j2f h ALA 235 Ca 0.16 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 55.02 2j2f h ALA 235 Cb 0.31 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 2j2f h ALA 235 CO -0.36 -0.41 -0.06 1.88 0.00 0.00 0.00 179.25 180.31 2j2f h TYR 236 N 0.10 0.30 -0.07 0.00 0.05 -0.87 -2.90 116.97 113.58 2j2f h TYR 236 Ca 0.03 -0.02 -0.16 0.00 0.05 0.00 0.00 58.73 58.62 2j2f h TYR 236 Cb -0.01 -0.09 -0.01 0.00 1.01 0.00 0.00 36.73 37.63 2j2f h TYR 236 CO -0.07 0.36 -0.65 1.79 -1.05 0.00 0.00 178.16 178.53 2j2f h THR 237 N 0.28 1.39 0.00 -2.88 1.35 -0.65 -2.82 112.91 109.59 2j2f h THR 237 Ca 0.06 -2.07 -0.04 0.00 -0.55 0.00 0.00 66.41 63.81 2j2f h THR 237 Cb 0.29 2.05 -0.01 0.00 -1.73 0.00 0.00 68.15 68.76 2j2f h THR 237 CO 0.01 0.61 -0.20 0.11 -0.25 0.00 0.00 175.52 175.80 2j2f h LYS 238 N 0.21 0.00 -0.01 4.72 1.79 -1.21 -0.23 116.57 121.83 2j2f h LYS 238 Ca -0.01 0.00 -0.01 0.00 -2.18 0.00 0.00 60.65 58.44 2j2f h LYS 238 Cb 1.18 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.84 2j2f h LYS 238 CO 0.10 0.20 -0.05 0.82 -1.08 0.00 0.00 179.45 179.45 2j2f h ILE 239 N 0.00 1.50 -0.60 1.86 2.04 -1.45 -2.39 117.51 118.47 2j2f h ILE 239 Ca -0.00 -1.55 -0.03 0.00 1.00 0.00 0.00 64.86 64.28 2j2f h ILE 239 Cb 0.52 2.51 -0.03 0.00 -0.74 0.00 0.00 36.82 39.08 2j2f h ILE 239 CO 0.03 0.41 0.26 0.58 0.00 0.00 0.00 178.15 179.43 2j2f h VAL 240 N -0.56 1.22 -0.55 1.67 2.07 -1.31 0.87 116.25 119.65 2j2f h VAL 240 Ca -0.00 -0.67 0.11 0.00 0.82 0.00 0.00 66.70 66.96 2j2f h VAL 240 Cb 0.70 0.54 -0.10 0.00 -1.52 0.00 0.00 31.29 30.91 2j2f h VAL 240 CO 0.01 0.26 -0.05 -0.08 0.02 0.00 0.00 177.57 177.73 2j2f h GLU 241 N 0.83 0.07 -0.63 1.57 4.81 -1.12 0.28 114.58 120.38 2j2f h GLU 241 Ca 0.20 -0.00 -0.05 0.00 -0.13 0.00 0.00 59.36 59.38 2j2f h GLU 241 Cb 0.17 -0.01 -0.03 0.00 0.63 0.00 0.00 28.75 29.50 2j2f h GLU 241 CO -0.02 0.04 0.21 -0.22 -0.73 0.00 0.00 179.01 178.29 2j2f h LYS 242 N 0.07 0.95 -0.18 1.92 1.63 -0.85 -1.19 116.57 118.92 2j2f h LYS 242 Ca 0.28 -0.18 -0.13 0.00 -0.85 0.00 0.00 60.65 59.77 2j2f h LYS 242 Cb 0.44 -0.15 -0.01 0.00 -0.60 0.00 0.00 32.23 31.91 2j2f h LYS 242 CO -0.51 0.81 -0.44 -0.07 -3.45 0.00 0.00 179.45 175.79 2j2f h LEU 243 N 0.93 0.48 -1.06 5.20 3.38 0.58 -1.34 115.31 123.46 2j2f h LEU 243 Ca 0.21 -0.22 -0.06 0.00 0.09 0.00 0.00 57.88 57.90 2j2f h LEU 243 Cb 0.25 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 40.85 2j2f h LEU 243 CO -0.01 0.86 -0.00 -0.26 0.09 0.00 0.00 178.44 179.12 2j2f h PHE 244 N 0.36 0.69 -0.20 1.13 0.04 0.04 0.49 116.94 119.50 2j2f h PHE 244 Ca 0.03 -0.08 -0.08 0.00 2.80 0.00 0.00 57.97 60.63 2j2f h PHE 244 Cb 0.93 -0.20 -0.00 0.00 2.20 0.00 0.00 35.95 38.88 2j2f h PHE 244 CO 0.03 0.66 -0.19 1.49 -0.60 0.00 0.00 178.31 179.70 2j2f h GLU 245 N 0.63 0.47 0.13 1.51 4.81 -0.95 -2.17 114.58 119.01 2j2f h GLU 245 Ca 0.13 -0.25 -0.26 0.00 -0.13 0.00 0.00 59.36 58.85 2j2f h GLU 245 Cb 0.39 0.01 0.03 0.00 0.63 0.00 0.00 28.75 29.81 2j2f h GLU 245 CO 0.01 0.82 -1.10 0.82 -0.73 0.00 0.00 179.01 178.84 2j2f h ILE 246 N 0.14 1.35 -2.10 2.32 2.04 -1.13 -3.42 117.51 116.73 2j2f h ILE 246 Ca 0.03 -2.45 -0.57 0.00 1.00 0.00 0.00 64.86 62.87 2j2f h ILE 246 Cb 0.73 2.84 -0.39 0.00 -0.74 0.00 0.00 36.82 39.26 2j2f h ILE 246 CO 0.05 0.73 -1.07 -0.67 0.00 0.00 0.00 178.15 177.19 2j2f n ASP 247 N -3.92 0.06 0.28 1.72 2.03 0.17 -4.98 116.55 111.92 2j2f n ASP 247 Ca -0.14 -2.62 0.16 0.00 0.52 0.00 0.00 54.79 52.71 2j2f n ASP 247 Cb 0.93 -0.62 0.91 0.00 -0.72 0.00 0.00 41.12 41.62 2j2f n ASP 247 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 2j2f h PRO 248 N 4.42 0.00 0.13 -0.67 0.13 -1.49 -1.94 132.00 132.59 2j2f h PRO 248 Ca 0.12 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.25 2j2f h PRO 248 Cb 0.88 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.02 2j2f h PRO 248 CO 0.44 0.00 -0.06 -0.44 -0.23 0.00 0.00 178.00 177.71 2j2f h ASP 249 N 0.00 -0.15 -0.79 1.44 5.19 -1.91 -1.81 116.42 118.38 2j2f h ASP 249 Ca 0.02 -0.35 0.03 0.00 -0.62 0.00 0.00 57.03 56.11 2j2f h ASP 249 Cb 0.11 0.04 -0.05 0.00 0.18 0.00 0.00 39.33 39.62 2j2f h ASP 249 CO -0.00 0.44 0.51 1.23 -3.12 0.00 0.00 179.24 178.30 2j2f h GLY 250 N -0.93 1.15 0.75 2.75 0.00 -1.90 -1.88 103.07 103.00 2j2f h GLY 250 Ca -0.02 -0.39 -0.02 0.00 0.00 0.00 0.00 47.33 46.91 2j2f h GLY 250 CO 0.03 0.33 -0.01 -0.84 0.00 0.00 0.00 176.54 176.05 2j2f h THR 251 N 0.99 1.26 -0.95 4.70 2.02 -1.48 -0.23 112.91 119.23 2j2f h THR 251 Ca 0.32 -0.85 0.07 0.00 0.77 0.00 0.00 66.41 66.71 2j2f h THR 251 Cb 0.00 1.62 -0.07 0.00 -1.74 0.00 0.00 68.15 67.97 2j2f h THR 251 CO -0.11 0.24 0.60 0.58 0.37 0.00 0.00 175.52 177.21 2j2f h VAL 252 N -0.09 1.06 -0.45 3.16 2.07 -1.26 0.86 116.25 121.59 2j2f h VAL 252 Ca 0.03 -0.37 -0.12 0.00 0.82 0.00 0.00 66.70 67.05 2j2f h VAL 252 Cb 0.38 -0.13 -0.01 0.00 -1.52 0.00 0.00 31.29 30.01 2j2f h VAL 252 CO 0.01 0.20 -0.19 -0.07 0.02 0.00 0.00 177.57 177.54 2j2f h LEU 253 N 1.09 0.95 -0.63 2.57 3.38 -1.22 -2.46 115.31 118.99 2j2f h LEU 253 Ca 0.41 -0.39 -0.02 0.00 0.09 0.00 0.00 57.88 57.97 2j2f h LEU 253 Cb 0.18 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.65 2j2f h LEU 253 CO -0.18 1.13 0.30 0.00 0.09 0.00 0.00 178.44 179.78 2j2f h ALA 254 N 0.85 0.82 -0.16 1.53 0.00 -0.50 -1.25 119.26 120.54 2j2f h ALA 254 Ca 0.10 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.87 2j2f h ALA 254 Cb 0.76 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.29 2j2f h ALA 254 CO 0.06 0.39 0.11 0.35 0.00 0.00 0.00 179.25 180.15 2j2f h PHE 255 N 0.87 0.21 -0.63 0.00 3.57 -0.69 -2.17 116.94 118.09 2j2f h PHE 255 Ca 0.22 0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.70 2j2f h PHE 255 Cb 0.13 -0.07 -0.03 0.00 2.79 0.00 0.00 35.95 38.77 2j2f h PHE 255 CO 0.00 0.14 0.34 0.00 -2.23 0.00 0.00 178.31 176.56 2j2f h ALA 256 N 1.05 0.81 -0.41 2.41 0.00 -1.32 -2.99 119.26 118.81 2j2f h ALA 256 Ca 0.06 -0.11 0.05 0.00 0.00 0.00 0.00 54.91 54.91 2j2f h ALA 256 Cb -0.01 -0.25 -0.05 0.00 0.00 0.00 0.00 17.79 17.48 2j2f h ALA 256 CO -0.01 0.34 0.14 0.22 0.00 0.00 0.00 179.25 179.94 2j2f h ASP 257 N 0.87 0.14 -0.76 0.00 3.58 -0.84 -1.92 116.42 117.49 2j2f h ASP 257 Ca 0.22 0.05 0.04 0.00 0.42 0.00 0.00 57.03 57.76 2j2f h ASP 257 Cb 0.06 0.04 -0.05 0.00 1.72 0.00 0.00 39.33 41.10 2j2f h ASP 257 CO -0.03 0.12 0.47 0.24 -2.88 0.00 0.00 179.24 177.16 2j2f h MET 258 N 0.30 0.88 -0.28 0.28 2.86 -1.34 -2.68 114.93 114.96 2j2f h MET 258 Ca 0.19 -0.05 -0.13 0.00 -2.06 0.00 0.00 59.70 57.65 2j2f h MET 258 Cb 0.18 -0.20 -0.00 0.00 0.06 0.00 0.00 31.60 31.64 2j2f h MET 258 CO -0.20 0.58 -0.34 0.52 1.06 0.00 0.00 176.91 178.53 2j2f h MET 259 N 0.91 0.72 -0.18 1.72 2.86 -1.27 -0.42 114.93 119.27 2j2f h MET 259 Ca 0.31 -0.40 0.03 0.00 -2.06 0.00 0.00 59.70 57.58 2j2f h MET 259 Cb 0.05 0.03 -0.03 0.00 0.06 0.00 0.00 31.60 31.71 2j2f h MET 259 CO -0.13 1.02 0.00 0.00 1.06 0.00 0.00 176.91 178.87 2j2f h ARG 260 N 0.46 0.06 -0.08 1.72 3.08 -1.34 0.59 114.38 118.87 2j2f h ARG 260 Ca 0.04 -0.00 0.02 0.00 0.07 0.00 0.00 59.98 60.11 2j2f h ARG 260 Cb 0.92 -0.01 -0.00 0.00 0.08 0.00 0.00 29.97 30.96 2j2f h ARG 260 CO 0.08 0.04 0.09 0.87 -1.07 0.00 0.00 179.97 179.98 2j2f h LYS 261 N 0.07 0.00 -1.55 0.04 1.57 -1.43 -3.49 116.57 111.79 2j2f h LYS 261 Ca 0.08 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.86 2j2f h LYS 261 Cb 0.10 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.41 2j2f h LYS 261 CO -0.14 0.00 -0.38 1.63 -0.57 0.00 0.00 179.45 179.99 2j2f n LYS 262 N -3.92 -1.87 -2.56 3.15 5.02 0.20 -4.83 118.16 113.34 2j2f n LYS 262 Ca -0.01 1.41 -0.42 0.00 -2.02 0.00 0.00 58.31 57.27 2j2f n LYS 262 Cb 0.19 -1.61 -0.02 0.00 -0.02 0.00 0.00 35.03 33.56 2j2f n LYS 262 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 2j2f s ILE 263 N -2.97 3.97 0.17 -0.18 -1.09 -1.25 -4.85 121.20 115.00 2j2f s ILE 263 Ca 0.00 0.84 -0.27 0.00 -2.23 0.00 0.00 60.65 58.99 2j2f s ILE 263 Cb 0.00 -4.73 -0.08 0.00 -1.58 0.00 0.00 42.46 36.07 2j2f s ILE 263 CO 0.00 -1.38 0.84 -0.94 -1.23 0.00 0.00 174.94 172.22 2j2f s SER 264 N 3.14 7.45 0.41 3.58 1.04 -1.26 -5.04 113.70 123.01 2j2f s SER 264 Ca 0.43 1.72 -0.24 0.00 0.48 0.00 0.00 55.95 58.33 2j2f s SER 264 Cb -0.08 -2.53 -0.08 0.00 0.10 0.00 0.00 66.02 63.43 2j2f s SER 264 CO 0.24 0.15 1.11 -0.04 0.98 0.00 0.00 173.24 175.69 2j2f s MET 265 N -0.93 4.06 0.57 4.02 1.00 -1.26 -4.91 119.30 121.85 2j2f s MET 265 Ca 0.38 1.68 0.28 0.00 0.00 0.00 0.00 55.69 58.03 2j2f s MET 265 Cb -0.24 -2.58 1.49 0.00 0.00 0.00 0.00 34.83 33.51 2j2f s MET 265 CO 0.28 -0.27 1.98 -1.35 0.00 0.00 0.00 175.02 175.66 2j2f h PRO 266 N 2.50 0.00 -0.95 2.03 0.11 -1.99 -1.90 132.00 131.79 2j2f h PRO 266 Ca -0.49 0.00 -0.62 0.00 0.11 0.00 0.00 66.00 65.00 2j2f h PRO 266 Cb 1.23 0.00 -0.36 0.00 0.11 0.00 0.00 31.00 31.98 2j2f h PRO 266 CO 0.62 0.00 0.07 0.00 -0.21 0.00 0.00 178.00 178.48 2j2f n ALA 267 N -2.46 5.71 0.66 -0.75 0.00 -1.26 -4.66 120.51 117.75 2j2f n ALA 267 Ca 0.07 -3.68 0.13 0.00 0.00 0.00 0.00 53.44 49.97 2j2f n ALA 267 Cb 0.57 -1.09 0.39 0.00 0.00 0.00 0.00 19.45 19.32 2j2f n ALA 267 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 177.50 175.11 2j2f n HIS 268 N -0.79 0.79 0.69 0.00 1.44 -0.72 -2.85 115.22 113.78 2j2f n HIS 268 Ca 0.53 0.23 0.05 0.00 -2.01 0.00 0.00 57.72 56.52 2j2f n HIS 268 Cb 0.78 -0.85 0.17 0.00 0.12 0.00 0.00 29.99 30.21 2j2f n HIS 268 CO 0.00 0.00 0.00 1.28 -2.81 0.00 0.00 176.34 174.81 2j2f n LEU 269 N -2.16 2.22 -3.63 2.39 4.77 -1.26 -4.68 117.00 114.64 2j2f n LEU 269 Ca 0.05 -1.11 -0.49 0.00 -0.03 0.00 0.00 56.01 54.43 2j2f n LEU 269 Cb 0.42 -0.31 -0.07 0.00 -2.33 0.00 0.00 43.42 41.14 2j2f n LEU 269 CO 0.31 0.48 0.57 0.80 -1.33 0.00 0.00 177.39 178.22 2j2f n MET 270 N 0.53 0.00 -3.70 3.23 1.56 -1.13 -4.44 117.12 113.17 2j2f n MET 270 Ca 0.13 0.00 -0.11 0.00 -0.27 0.00 0.00 57.70 57.45 2j2f n MET 270 Cb 0.38 -1.19 -0.10 0.00 2.15 0.00 0.00 33.22 34.46 2j2f n MET 270 CO 0.00 0.00 0.00 -0.47 -0.73 0.00 0.00 175.97 174.77 2j2f s TYR 271 N 0.59 -0.61 -0.48 1.12 5.04 -1.26 -4.31 117.35 117.43 2j2f s TYR 271 Ca 0.75 1.34 0.05 0.00 -2.44 0.00 0.00 57.07 56.77 2j2f s TYR 271 Cb -1.06 0.27 0.13 0.00 0.35 0.00 0.00 41.96 41.65 2j2f s TYR 271 CO 0.50 -0.33 1.04 -0.40 -1.34 0.00 0.00 175.55 175.03 2j2f n ASP 272 N 3.82 2.27 0.00 4.32 5.75 -1.26 -4.19 116.55 127.25 2j2f n ASP 272 Ca -0.20 -1.86 0.00 0.00 -0.01 0.00 0.00 54.79 52.72 2j2f n ASP 272 Cb 0.56 -0.09 0.00 0.00 -1.03 0.00 0.00 41.12 40.56 2j2f n ASP 272 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2j2f n GLY 273 N 0.04 0.89 0.82 6.12 0.00 -1.26 -4.80 105.19 107.00 2j2f n GLY 273 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.07 2j2f n GLY 273 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2j2f n ARG 274 N -2.00 0.00 -3.53 1.61 1.74 -1.26 -4.74 116.66 108.48 2j2f n ARG 274 Ca 0.00 0.00 -0.37 0.00 -0.77 0.00 0.00 57.85 56.71 2j2f n ARG 274 Cb 0.00 -0.53 -0.09 0.00 -1.02 0.00 0.00 32.46 30.82 2j2f n ARG 274 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 2j2f s ASP 275 N -4.50 6.25 0.00 0.55 -1.08 -1.26 -4.95 116.67 111.68 2j2f s ASP 275 Ca 0.00 0.28 0.27 0.00 -0.52 0.00 0.00 52.55 52.59 2j2f s ASP 275 Cb 0.00 -2.16 0.95 0.00 -1.46 0.00 0.00 42.92 40.25 2j2f s ASP 275 CO 0.00 -0.01 1.72 0.47 0.52 0.00 0.00 175.17 177.87 2j2f n ASP 276 N 4.44 0.24 -2.40 -0.34 8.00 -1.26 -3.90 116.55 121.33 2j2f n ASP 276 Ca -0.12 0.10 -0.22 0.00 0.71 0.00 0.00 54.79 55.26 2j2f n ASP 276 Cb 0.52 -0.16 0.01 0.00 -0.02 0.00 0.00 41.12 41.47 2j2f n ASP 276 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 2j2f n ASN 277 N -1.45 4.14 -0.19 -2.24 4.13 -1.26 -4.89 115.26 113.50 2j2f n ASN 277 Ca 0.07 -3.48 -0.08 0.00 1.68 0.00 0.00 54.58 52.77 2j2f n ASN 277 Cb 0.33 -0.44 0.02 0.00 -1.54 0.00 0.00 39.78 38.15 2j2f n ASN 277 CO 0.00 0.00 0.00 0.25 0.28 0.00 0.00 177.26 177.79 2j2f h LEU 278 N 2.53 0.74 -0.04 3.41 5.85 -1.75 -1.10 115.31 124.94 2j2f h LEU 278 Ca 0.24 -0.16 -0.00 0.00 0.84 0.00 0.00 57.88 58.79 2j2f h LEU 278 Cb 1.15 -0.19 -0.00 0.00 0.37 0.00 0.00 40.66 41.98 2j2f h LEU 278 CO 0.74 0.70 0.01 0.15 -0.34 0.00 0.00 178.44 179.70 2j2f h PHE 279 N 0.73 0.06 -0.66 1.25 3.57 -1.83 0.14 116.94 120.20 2j2f h PHE 279 Ca 0.18 -0.01 0.10 0.00 3.53 0.00 0.00 57.97 61.77 2j2f h PHE 279 Cb 0.19 -0.02 -0.08 0.00 2.79 0.00 0.00 35.95 38.83 2j2f h PHE 279 CO 0.01 0.27 0.27 -0.44 -2.23 0.00 0.00 178.31 176.18 2j2f h ASP 280 N -0.16 0.30 0.04 0.41 3.32 -1.87 -0.04 116.42 118.42 2j2f h ASP 280 Ca 0.01 0.08 -0.00 0.00 0.02 0.00 0.00 57.03 57.14 2j2f h ASP 280 Cb 0.23 0.04 0.00 0.00 0.22 0.00 0.00 39.33 39.83 2j2f h ASP 280 CO 0.00 0.17 -0.02 0.45 -1.72 0.00 0.00 179.24 178.12 2j2f h HIS 281 N 0.47 -0.05 -0.51 4.55 3.86 -0.94 -0.21 115.15 122.33 2j2f h HIS 281 Ca 0.33 -0.00 0.10 0.00 -1.16 0.00 0.00 60.37 59.64 2j2f h HIS 281 Cb 0.41 0.02 -0.08 0.00 1.06 0.00 0.00 27.41 28.81 2j2f h HIS 281 CO -0.15 0.18 -0.01 0.35 0.86 0.00 0.00 177.93 179.16 2j2f h PHE 282 N -0.27 -0.05 -0.55 2.45 3.57 -0.51 -2.56 116.94 119.02 2j2f h PHE 282 Ca -0.01 0.04 -0.01 0.00 3.53 0.00 0.00 57.97 61.52 2j2f h PHE 282 Cb 0.25 0.10 -0.03 0.00 2.79 0.00 0.00 35.95 39.06 2j2f h PHE 282 CO -0.00 -0.12 0.29 0.77 -2.23 0.00 0.00 178.31 177.02 2j2f h SER 283 N 0.11 0.70 -0.33 0.41 0.02 -0.91 -2.12 113.55 111.41 2j2f h SER 283 Ca 0.26 -0.10 0.07 0.00 -0.84 0.00 0.00 61.79 61.18 2j2f h SER 283 Cb 0.39 -0.18 -0.07 0.00 0.14 0.00 0.00 62.40 62.68 2j2f h SER 283 CO -0.43 0.60 -0.16 0.00 -1.14 0.00 0.00 176.83 175.70 2j2f h ALA 284 N 1.13 0.10 -0.77 3.77 0.00 -0.65 0.54 119.26 123.39 2j2f h ALA 284 Ca 0.19 0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.23 2j2f h ALA 284 Cb 0.07 0.39 -0.04 0.00 0.00 0.00 0.00 17.79 18.20 2j2f h ALA 284 CO -0.03 -0.54 0.49 0.28 0.00 0.00 0.00 179.25 179.45 2j2f h VAL 285 N -0.10 1.21 -0.46 0.00 2.07 -1.24 0.21 116.25 117.94 2j2f h VAL 285 Ca 0.17 -0.42 -0.02 0.00 0.82 0.00 0.00 66.70 67.25 2j2f h VAL 285 Cb 0.36 0.11 -0.02 0.00 -1.52 0.00 0.00 31.29 30.22 2j2f h VAL 285 CO -0.40 0.21 0.21 0.00 0.02 0.00 0.00 177.57 177.60 2j2f h ALA 286 N 1.26 0.59 0.32 1.67 0.00 -0.64 0.91 119.26 123.37 2j2f h ALA 286 Ca 0.28 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 55.05 2j2f h ALA 286 Cb -0.08 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.52 2j2f h ALA 286 CO -0.06 0.17 -0.29 0.37 0.00 0.00 0.00 179.25 179.45 2j2f h GLN 287 N 0.60 -0.57 -0.94 0.00 5.75 0.50 -0.52 115.11 119.92 2j2f h GLN 287 Ca 0.16 0.04 0.20 0.00 -0.15 0.00 0.00 58.65 58.89 2j2f h GLN 287 Cb 0.15 0.13 -0.08 0.00 1.07 0.00 0.00 27.48 28.75 2j2f h GLN 287 CO -0.02 -0.38 0.61 -0.09 -2.65 0.00 0.00 178.83 176.30 2j2f h ARG 288 N -0.60 0.53 0.00 1.69 2.43 -0.36 0.39 114.38 118.45 2j2f h ARG 288 Ca -0.04 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.10 2j2f h ARG 288 Cb 0.51 -0.12 0.00 0.00 -0.42 0.00 0.00 29.97 29.94 2j2f h ARG 288 CO -0.02 0.35 0.00 1.28 -1.51 0.00 0.00 179.97 180.07 2j2f n LEU 289 N -4.59 0.14 -1.15 3.80 4.32 0.29 -4.91 117.00 114.90 2j2f n LEU 289 Ca 0.21 0.52 -0.09 0.00 -0.02 0.00 0.00 56.01 56.62 2j2f n LEU 289 Cb 0.65 -0.47 0.00 0.00 -1.62 0.00 0.00 43.42 41.98 2j2f n LEU 289 CO 0.28 -0.07 -0.06 0.61 -1.22 0.00 0.00 177.39 176.92 2j2f n GLY 290 N 1.25 0.09 0.10 -0.72 0.00 0.14 -4.96 105.19 101.09 2j2f n GLY 290 Ca 0.06 -0.48 -0.20 0.00 0.00 0.00 0.00 46.02 45.41 2j2f n GLY 290 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2j2f h VAL 291 N -0.24 1.20 -2.28 1.61 2.07 -1.29 -3.46 116.25 113.85 2j2f h VAL 291 Ca -0.21 -2.32 -0.13 0.00 0.82 0.00 0.00 66.70 64.86 2j2f h VAL 291 Cb 1.15 2.74 -0.29 0.00 -1.52 0.00 0.00 31.29 33.37 2j2f h VAL 291 CO 0.24 0.55 -0.44 -0.47 0.02 0.00 0.00 177.57 177.47 2j2f s TYR 292 N -2.37 -0.77 0.32 1.57 5.04 -1.15 -3.99 117.35 116.00 2j2f s TYR 292 Ca -0.22 1.16 0.09 0.00 -2.44 0.00 0.00 57.07 55.66 2j2f s TYR 292 Cb 0.03 0.14 -0.05 0.00 0.35 0.00 0.00 41.96 42.43 2j2f s TYR 292 CO 0.69 -0.57 0.05 0.95 -1.34 0.00 0.00 175.55 175.33 2j2f s THR 293 N 2.56 2.98 0.55 4.34 -4.23 -1.26 -3.04 115.64 117.54 2j2f s THR 293 Ca 0.05 -1.87 0.28 0.00 -1.18 0.00 0.00 61.69 58.97 2j2f s THR 293 Cb -0.14 -2.86 0.41 0.00 1.34 0.00 0.00 72.50 71.25 2j2f s THR 293 CO -0.14 -0.24 1.97 0.00 -0.54 0.00 0.00 174.62 175.66 2j2f h ALA 294 N 1.74 2.42 -0.19 3.99 0.00 -1.95 -0.63 119.26 124.65 2j2f h ALA 294 Ca -0.43 -0.02 -0.20 0.00 0.00 0.00 0.00 54.91 54.26 2j2f h ALA 294 Cb 1.25 0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.08 2j2f h ALA 294 CO 0.64 -0.71 -0.67 0.87 0.00 0.00 0.00 179.25 179.38 2j2f h LYS 295 N 0.00 0.73 -0.62 0.00 1.57 -1.95 -3.15 116.57 113.15 2j2f h LYS 295 Ca 0.26 -0.53 0.01 0.00 -1.87 0.00 0.00 60.65 58.52 2j2f h LYS 295 Cb 1.12 0.09 -0.03 0.00 0.08 0.00 0.00 32.23 33.49 2j2f h LYS 295 CO -0.00 1.15 0.40 -0.44 -0.57 0.00 0.00 179.45 179.99 2j2f h ASP 296 N 0.53 0.67 -0.93 0.86 3.32 -1.50 -0.71 116.42 118.66 2j2f h ASP 296 Ca -0.02 -0.01 0.22 0.00 0.02 0.00 0.00 57.03 57.24 2j2f h ASP 296 Cb 1.27 -0.16 -0.12 0.00 0.22 0.00 0.00 39.33 40.54 2j2f h ASP 296 CO 0.14 0.48 0.47 0.22 -1.72 0.00 0.00 179.24 178.83 2j2f h TYR 297 N 0.80 0.80 -0.16 4.55 5.03 -1.49 -0.77 116.97 125.72 2j2f h TYR 297 Ca 0.24 0.04 -0.09 0.00 2.58 0.00 0.00 58.73 61.49 2j2f h TYR 297 Cb -0.05 -0.21 -0.00 0.00 1.55 0.00 0.00 36.73 38.02 2j2f h TYR 297 CO -0.04 0.03 -0.27 0.00 -1.32 0.00 0.00 178.16 176.57 2j2f h ALA 298 N 1.69 0.25 -0.88 1.82 0.00 -1.15 -2.78 119.26 118.22 2j2f h ALA 298 Ca 0.57 -0.39 -0.02 0.00 0.00 0.00 0.00 54.91 55.07 2j2f h ALA 298 Cb 1.05 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 18.75 2j2f h ALA 298 CO -0.48 0.25 0.46 -0.44 0.00 0.00 0.00 179.25 179.04 2j2f h ASP 299 N 0.11 1.12 -0.06 0.00 5.19 -0.19 0.39 116.42 122.98 2j2f h ASP 299 Ca 0.01 -0.11 0.02 0.00 -0.62 0.00 0.00 57.03 56.33 2j2f h ASP 299 Cb 0.85 -0.29 -0.02 0.00 0.18 0.00 0.00 39.33 40.04 2j2f h ASP 299 CO 0.06 0.92 -0.08 0.40 -3.12 0.00 0.00 179.24 177.42 2j2f h ILE 300 N 1.24 0.78 -0.01 0.35 2.04 -1.22 0.28 117.51 120.98 2j2f h ILE 300 Ca 0.31 0.00 0.03 0.00 1.00 0.00 0.00 64.86 66.19 2j2f h ILE 300 Cb 0.06 0.78 -0.03 0.00 -0.74 0.00 0.00 36.82 36.89 2j2f h ILE 300 CO -0.05 0.00 -0.15 0.25 0.00 0.00 0.00 178.15 178.21 2j2f h LEU 301 N -0.11 -0.43 -0.59 1.44 5.85 -1.10 -1.08 115.31 119.28 2j2f h LEU 301 Ca 0.05 0.07 0.03 0.00 0.84 0.00 0.00 57.88 58.86 2j2f h LEU 301 Cb 0.18 0.19 -0.04 0.00 0.37 0.00 0.00 40.66 41.36 2j2f h LEU 301 CO -0.12 -0.20 0.36 -0.08 -0.34 0.00 0.00 178.44 178.06 2j2f h GLU 302 N -0.24 0.69 -0.10 1.25 4.81 -0.78 -1.03 114.58 119.19 2j2f h GLU 302 Ca 0.05 -0.04 0.04 0.00 -0.13 0.00 0.00 59.36 59.28 2j2f h GLU 302 Cb 0.31 -0.16 -0.04 0.00 0.63 0.00 0.00 28.75 29.49 2j2f h GLU 302 CO -0.15 0.46 -0.13 0.35 -0.73 0.00 0.00 179.01 178.80 2j2f h PHE 303 N 0.72 -0.34 -0.70 0.92 3.57 -0.14 -1.83 116.94 119.13 2j2f h PHE 303 Ca 0.24 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.75 2j2f h PHE 303 Cb 0.02 0.17 -0.03 0.00 2.79 0.00 0.00 35.95 38.89 2j2f h PHE 303 CO -0.06 -0.20 0.40 -0.07 -2.23 0.00 0.00 178.31 176.16 2j2f h LEU 304 N -0.18 0.85 -0.73 0.59 3.38 -0.87 0.81 115.31 119.17 2j2f h LEU 304 Ca 0.08 -0.06 0.03 0.00 0.09 0.00 0.00 57.88 58.02 2j2f h LEU 304 Cb 0.29 -0.21 -0.04 0.00 0.09 0.00 0.00 40.66 40.78 2j2f h LEU 304 CO -0.20 0.67 0.46 0.58 0.09 0.00 0.00 178.44 180.04 2j2f h VAL 305 N 0.97 1.11 0.02 1.22 2.07 -0.97 -0.67 116.25 120.00 2j2f h VAL 305 Ca 0.25 -0.31 -0.27 0.00 0.82 0.00 0.00 66.70 67.19 2j2f h VAL 305 Cb -0.01 0.12 0.02 0.00 -1.52 0.00 0.00 31.29 29.91 2j2f h VAL 305 CO -0.04 0.17 -1.07 1.23 0.02 0.00 0.00 177.57 177.87 2j2f h GLY 306 N 0.91 0.76 1.85 2.17 0.00 -0.42 -2.20 103.07 106.14 2j2f h GLY 306 Ca 0.29 -1.37 -0.08 0.00 0.00 0.00 0.00 47.33 46.17 2j2f h GLY 306 CO -0.10 1.21 -0.33 -0.09 0.00 0.00 0.00 176.54 177.23 2j2f h ARG 307 N 0.37 0.18 -0.02 4.80 1.12 0.74 -2.74 114.38 118.83 2j2f h ARG 307 Ca -0.14 -0.07 0.00 0.00 -1.11 0.00 0.00 59.98 58.67 2j2f h ARG 307 Cb 1.73 -0.01 0.00 0.00 -0.01 0.00 0.00 29.97 31.68 2j2f h ARG 307 CO 0.21 0.49 -0.15 0.91 -3.11 0.00 0.00 179.97 178.32 2j2f n TRP 308 N -4.11 0.00 -3.66 2.20 8.01 -0.27 -4.97 117.44 114.64 2j2f n TRP 308 Ca -0.01 0.00 -0.25 0.00 -1.31 0.00 0.00 57.50 55.93 2j2f n TRP 308 Cb 0.40 -0.02 0.07 0.00 -2.01 0.00 0.00 31.31 29.76 2j2f n TRP 308 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.69 178.31 2j2f n LYS 309 N 0.50 -7.30 -0.24 -0.99 4.76 -1.03 -4.91 118.16 108.95 2j2f n LYS 309 Ca 0.14 0.78 -0.00 0.00 -2.87 0.00 0.00 58.31 56.35 2j2f n LYS 309 Cb 0.48 -5.79 0.12 0.00 -1.84 0.00 0.00 35.03 28.01 2j2f n LYS 309 CO 0.00 0.00 0.00 0.28 -1.37 0.00 0.00 177.40 176.31 2j2f h VAL 310 N -2.51 0.90 -0.39 -0.18 2.07 -1.69 -2.30 116.25 112.16 2j2f h VAL 310 Ca -0.57 -0.22 -0.04 0.00 0.82 0.00 0.00 66.70 66.68 2j2f h VAL 310 Cb 1.37 0.21 -0.02 0.00 -1.52 0.00 0.00 31.29 31.33 2j2f h VAL 310 CO 0.58 0.12 0.07 -2.24 0.02 0.00 0.00 177.57 176.11 2j2f h ASP 311 N 0.64 0.55 -0.02 0.57 2.03 -1.91 -2.52 116.42 115.75 2j2f h ASP 311 Ca 0.33 -0.09 0.00 0.00 -0.73 0.00 0.00 57.03 56.54 2j2f h ASP 311 Cb 0.28 -0.14 0.00 0.00 -0.83 0.00 0.00 39.33 38.64 2j2f h ASP 311 CO -0.23 0.57 0.00 0.29 -1.03 0.00 0.00 179.24 178.85 2j2f n LYS 312 N -4.30 1.11 -2.49 4.15 5.02 -0.87 -4.86 118.16 115.91 2j2f n LYS 312 Ca 0.02 -0.17 -0.41 0.00 -2.02 0.00 0.00 58.31 55.74 2j2f n LYS 312 Cb 0.21 -1.36 -0.04 0.00 -0.02 0.00 0.00 35.03 33.83 2j2f n LYS 312 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2j2f s LEU 313 N -1.69 4.50 0.14 -0.35 1.43 -0.95 -5.05 118.68 116.70 2j2f s LEU 313 Ca 0.33 2.14 0.02 0.00 -1.03 0.00 0.00 54.13 55.59 2j2f s LEU 313 Cb 0.16 -3.61 -0.04 0.00 0.03 0.00 0.00 46.19 42.72 2j2f s LEU 313 CO 0.26 -0.21 -0.02 0.42 0.23 0.00 0.00 176.35 177.02 2j2f s THR 314 N -0.44 0.63 -0.62 5.49 -4.23 -1.26 -4.90 115.64 110.31 2j2f s THR 314 Ca 0.49 -1.95 -0.01 0.00 -1.18 0.00 0.00 61.69 59.03 2j2f s THR 314 Cb -0.30 -1.92 0.00 0.00 1.34 0.00 0.00 72.50 71.62 2j2f s THR 314 CO 0.36 -0.65 0.52 0.61 -0.54 0.00 0.00 174.62 174.93 2j2f n GLY 315 N -0.14 0.06 3.72 3.99 0.00 -1.26 -5.05 105.19 106.50 2j2f n GLY 315 Ca -0.09 -0.19 -0.31 0.00 0.00 0.00 0.00 46.02 45.43 2j2f n GLY 315 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2j2f s LEU 316 N -4.22 3.62 0.78 0.99 1.43 -1.26 -4.96 118.68 115.06 2j2f s LEU 316 Ca 0.04 -0.07 -0.12 0.00 -1.03 0.00 0.00 54.13 52.96 2j2f s LEU 316 Cb -0.02 -2.27 0.06 0.00 0.03 0.00 0.00 46.19 44.00 2j2f s LEU 316 CO 0.37 0.20 1.13 -0.94 0.23 0.00 0.00 176.35 177.34 2j2f s SER 317 N -2.16 4.17 0.55 2.29 1.04 -1.26 -4.56 113.70 113.77 2j2f s SER 317 Ca 0.26 2.05 0.41 0.00 0.48 0.00 0.00 55.95 59.15 2j2f s SER 317 Cb -0.12 -2.55 1.62 0.00 0.10 0.00 0.00 66.02 65.07 2j2f s SER 317 CO 0.18 -2.26 1.73 0.00 0.98 0.00 0.00 173.24 173.86 2j2f h ALA 318 N -0.92 3.38 0.16 5.32 0.00 -1.99 1.35 119.26 126.56 2j2f h ALA 318 Ca -0.45 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.40 2j2f h ALA 318 Cb 1.26 0.11 0.00 0.00 0.00 0.00 0.00 17.79 19.16 2j2f h ALA 318 CO 0.49 -1.79 -0.08 1.49 0.00 0.00 0.00 179.25 179.36 2j2f h GLU 319 N 0.00 -0.21 -0.98 0.00 4.57 -2.01 -2.93 114.58 113.03 2j2f h GLU 319 Ca 0.69 0.01 0.07 0.00 -1.18 0.00 0.00 59.36 58.95 2j2f h GLU 319 Cb 2.77 0.05 -0.07 0.00 -0.16 0.00 0.00 28.75 31.34 2j2f h GLU 319 CO -0.01 0.17 0.63 0.78 -1.18 0.00 0.00 179.01 179.40 2j2f h GLY 320 N -0.64 1.49 0.96 1.92 0.00 0.13 -2.53 103.07 104.41 2j2f h GLY 320 Ca -0.02 -0.46 -0.08 0.00 0.00 0.00 0.00 47.33 46.77 2j2f h GLY 320 CO 0.04 0.31 -0.06 1.46 0.00 0.00 0.00 176.54 178.29 2j2f h GLN 321 N 1.13 0.74 -0.73 4.80 4.20 -0.63 0.18 115.11 124.81 2j2f h GLN 321 Ca 0.43 -0.26 -0.00 0.00 0.06 0.00 0.00 58.65 58.87 2j2f h GLN 321 Cb 0.19 -0.05 -0.04 0.00 0.30 0.00 0.00 27.48 27.88 2j2f h GLN 321 CO -0.18 0.86 0.44 0.87 -0.67 0.00 0.00 178.83 180.15 2j2f h LYS 322 N 0.56 0.99 0.20 1.46 1.57 -1.39 -1.39 116.57 118.55 2j2f h LYS 322 Ca 0.11 -0.09 -0.01 0.00 -1.87 0.00 0.00 60.65 58.79 2j2f h LYS 322 Cb 0.56 -0.21 0.00 0.00 0.08 0.00 0.00 32.23 32.67 2j2f h LYS 322 CO 0.03 0.69 -0.09 0.00 -0.57 0.00 0.00 179.45 179.51 2j2f h ALA 323 N 1.23 -0.26 -0.71 3.86 0.00 -1.29 -1.49 119.26 120.61 2j2f h ALA 323 Ca 0.26 -0.11 0.08 0.00 0.00 0.00 0.00 54.91 55.15 2j2f h ALA 323 Cb -0.04 0.10 -0.07 0.00 0.00 0.00 0.00 17.79 17.78 2j2f h ALA 323 CO -0.05 -0.58 0.36 0.37 0.00 0.00 0.00 179.25 179.35 2j2f h GLN 324 N -0.40 0.61 -0.10 0.00 4.15 -0.48 -1.19 115.11 117.71 2j2f h GLN 324 Ca -0.03 -0.04 -0.02 0.00 0.77 0.00 0.00 58.65 59.34 2j2f h GLN 324 Cb 0.30 -0.14 -0.00 0.00 0.21 0.00 0.00 27.48 27.85 2j2f h GLN 324 CO 0.04 0.41 -0.02 0.22 -1.93 0.00 0.00 178.83 177.55 2j2f h ASP 325 N 0.63 0.18 -0.61 -0.69 3.58 -1.23 -2.15 116.42 116.13 2j2f h ASP 325 Ca 0.34 -0.35 0.11 0.00 0.42 0.00 0.00 57.03 57.55 2j2f h ASP 325 Cb 0.32 -0.05 -0.09 0.00 1.72 0.00 0.00 39.33 41.24 2j2f h ASP 325 CO -0.25 0.49 0.15 0.22 -2.88 0.00 0.00 179.24 176.98 2j2f h TYR 326 N -0.13 0.24 -0.43 0.28 3.20 -0.77 -1.77 116.97 117.61 2j2f h TYR 326 Ca 0.03 0.04 -0.10 0.00 3.14 0.00 0.00 58.73 61.83 2j2f h TYR 326 Cb 0.41 -0.01 -0.01 0.00 1.54 0.00 0.00 36.73 38.65 2j2f h TYR 326 CO 0.05 -0.01 -0.11 0.28 -1.64 0.00 0.00 178.16 176.72 2j2f h VAL 327 N 0.29 1.27 0.00 1.81 2.07 -1.17 -2.47 116.25 118.05 2j2f h VAL 327 Ca 0.32 -1.22 -0.02 0.00 0.82 0.00 0.00 66.70 66.60 2j2f h VAL 327 Cb 0.48 1.18 -0.00 0.00 -1.52 0.00 0.00 31.29 31.43 2j2f h VAL 327 CO -0.40 0.41 -0.12 0.00 0.02 0.00 0.00 177.57 177.49 2j2f n ARG 329 N -3.31 2.30 0.10 0.00 1.74 -0.71 -4.61 116.66 112.18 2j2f n ARG 329 Ca -0.00 -1.85 -0.20 0.00 -0.77 0.00 0.00 57.85 55.03 2j2f n ARG 329 Cb 0.34 -1.26 -0.15 0.00 -1.02 0.00 0.00 32.46 30.37 2j2f n ARG 329 CO 0.00 0.00 0.00 1.25 -1.52 0.00 0.00 177.63 177.36 2j2f h LEU 330 N 2.12 0.58 0.15 0.55 5.85 -1.42 -3.33 115.31 119.81 2j2f h LEU 330 Ca 0.00 -0.70 0.02 0.00 0.84 0.00 0.00 57.88 58.03 2j2f h LEU 330 Cb 0.67 -0.19 -0.03 0.00 0.37 0.00 0.00 40.66 41.48 2j2f h LEU 330 CO 0.00 1.57 -0.30 -0.65 -0.34 0.00 0.00 178.44 178.72 2j2f h PRO 331 N 0.10 -0.52 -0.51 5.25 0.11 -1.82 0.58 132.00 135.20 2j2f h PRO 331 Ca -0.24 0.04 -0.03 0.00 0.11 0.00 0.00 66.00 65.87 2j2f h PRO 331 Cb 2.07 0.12 -0.02 0.00 0.11 0.00 0.00 31.00 33.27 2j2f h PRO 331 CO 0.21 -0.35 0.20 -1.35 -0.21 0.00 0.00 178.00 176.50 2j2f h PRO 332 N -0.54 0.74 -0.20 1.05 0.11 -1.90 0.26 132.00 131.53 2j2f h PRO 332 Ca 0.02 -0.11 0.02 0.00 0.11 0.00 0.00 66.00 66.05 2j2f h PRO 332 Cb 0.56 -0.13 -0.02 0.00 0.11 0.00 0.00 31.00 31.51 2j2f h PRO 332 CO -0.16 0.61 0.04 -0.09 -0.21 0.00 0.00 178.00 178.20 2j2f h ARG 333 N 0.73 0.12 -0.50 1.05 2.43 -1.60 -1.33 114.38 115.28 2j2f h ARG 333 Ca 0.18 -0.01 -0.05 0.00 -0.81 0.00 0.00 59.98 59.29 2j2f h ARG 333 Cb 0.16 -0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 29.65 2j2f h ARG 333 CO -0.02 0.08 0.11 0.82 -1.51 0.00 0.00 179.97 179.45 2j2f h ILE 334 N 0.13 1.22 0.00 1.20 2.04 -0.52 -2.82 117.51 118.75 2j2f h ILE 334 Ca 0.09 -0.81 0.00 0.00 1.00 0.00 0.00 64.86 65.14 2j2f h ILE 334 Cb 0.08 0.72 0.00 0.00 -0.74 0.00 0.00 36.82 36.88 2j2f h ILE 334 CO -0.11 0.30 0.00 -1.14 0.00 0.00 0.00 178.15 177.19 2j2f n ARG 335 N -4.28 0.00 -0.38 2.37 3.00 0.89 -1.87 116.66 116.39 2j2f n ARG 335 Ca 0.03 0.09 -0.05 0.00 -0.00 0.00 0.00 57.85 57.93 2j2f n ARG 335 Cb 0.23 -1.03 -0.02 0.00 0.00 0.00 0.00 32.46 31.63 2j2f n ARG 335 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.63 180.52 2j2f n ARG 336 N -0.67 -0.31 0.00 -0.14 1.85 -0.55 -0.99 116.66 115.85 2j2f n ARG 336 Ca 0.00 1.46 0.00 0.00 -1.00 0.00 0.00 57.85 58.31 2j2f n ARG 336 Cb 0.00 -2.15 0.00 0.00 -1.05 0.00 0.00 32.46 29.26 2j2f n ARG 336 CO 0.00 0.00 0.00 -0.11 -0.01 0.00 0.00 177.63 177.51 2j2f n LEU 337 N -5.31 0.00 -1.21 2.89 7.94 -1.06 -1.90 117.00 118.34 2j2f n LEU 337 Ca 0.06 0.82 -0.01 0.00 -1.11 0.00 0.00 56.01 55.77 2j2f n LEU 337 Cb 0.32 -0.32 0.00 0.00 0.53 0.00 0.00 43.42 43.96 2j2f n LEU 337 CO -0.14 -0.32 0.70 -0.62 -1.11 0.00 0.00 177.39 175.90 2j2f n GLU 338 N -1.90 1.03 -0.04 1.96 1.02 -0.78 -3.70 120.64 118.23 2j2f n GLU 338 Ca 0.00 -0.08 -0.03 0.00 -0.02 0.00 0.00 57.16 57.03 2j2f n GLU 338 Cb 0.00 -1.03 -0.01 0.00 -0.02 0.00 0.00 31.44 30.38 2j2f n GLU 338 CO 0.00 0.00 0.00 -1.91 1.18 0.00 0.00 177.13 176.40 2j2f n GLU 339 N 0.82 0.23 -1.49 3.49 2.13 -0.16 -4.58 120.64 121.08 2j2f n GLU 339 Ca 0.01 0.22 -0.13 0.00 0.66 0.00 0.00 57.16 57.92 2j2f n GLU 339 Cb 0.52 -1.04 -0.10 0.00 0.27 0.00 0.00 31.44 31.09 2j2f n GLU 339 CO 0.00 0.00 0.00 2.89 -0.41 0.00 0.00 177.13 179.61 2j2f n ARG 340 N -3.38 0.25 -1.97 5.31 1.85 -1.23 -4.83 116.66 112.66 2j2f n ARG 340 Ca -0.05 -0.96 -0.41 0.00 -1.00 0.00 0.00 57.85 55.44 2j2f n ARG 340 Cb 0.19 -3.12 -0.01 0.00 -1.05 0.00 0.00 32.46 28.47 2j2f n ARG 340 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 2j2f n ALA 341 N 15.84 6.40 -0.02 2.89 0.00 -1.26 -4.70 120.51 139.66 2j2f n ALA 341 Ca 0.42 -4.06 -0.01 0.00 0.00 0.00 0.00 53.44 49.79 2j2f n ALA 341 Cb 0.42 -2.98 -0.00 0.00 0.00 0.00 0.00 19.45 16.88 2j2f n ALA 341 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 2j2f h GLN 342 N 5.11 0.00 0.00 0.00 1.08 -1.99 -3.29 115.11 116.02 2j2f h GLN 342 Ca 0.63 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.83 2j2f h GLN 342 Cb 0.42 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.85 2j2f h GLN 342 CO 1.60 0.00 0.00 0.41 -0.95 0.00 0.00 178.83 179.89 2j2f n GLY 343 N 1.80 -0.90 0.00 3.46 0.00 -1.26 -3.87 105.19 104.42 2j2f n GLY 343 Ca -0.01 -0.12 0.00 0.00 0.00 0.00 0.00 46.02 45.88 2j2f n GLY 343 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2j2f n ARG 344 N -0.83 3.52 -0.11 1.61 0.00 -1.26 -4.71 116.66 114.88 2j2f n ARG 344 Ca 0.14 0.00 -0.23 0.00 -0.00 0.00 0.00 57.85 57.76 2j2f n ARG 344 Cb 0.07 -0.46 -0.11 0.00 0.00 0.00 0.00 32.46 31.95 2j2f n ARG 344 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2j2f n ALA 345 N -0.36 0.86 0.16 5.13 0.00 -1.24 -4.17 120.51 120.89 2j2f n ALA 345 Ca 0.00 -0.60 -0.07 0.00 0.00 0.00 0.00 53.44 52.77 2j2f n ALA 345 Cb 0.00 -0.44 -0.03 0.00 0.00 0.00 0.00 19.45 18.98 2j2f n ALA 345 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 2j2f h LYS 346 N -0.98 -0.44 -1.05 0.00 1.57 -1.74 -3.31 116.57 110.61 2j2f h LYS 346 Ca -0.42 0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.39 2j2f h LYS 346 Cb 1.37 0.10 0.00 0.00 0.08 0.00 0.00 32.23 33.78 2j2f h LYS 346 CO -0.25 -0.29 0.00 0.39 -0.57 0.00 0.00 179.45 178.73 2j2f n GLU 347 N -4.47 0.83 -2.09 3.15 1.02 -1.26 -4.91 120.64 112.92 2j2f n GLU 347 Ca -0.06 0.00 -0.42 0.00 -0.02 0.00 0.00 57.16 56.66 2j2f n GLU 347 Cb 0.18 -1.20 -0.03 0.00 -0.02 0.00 0.00 31.44 30.37 2j2f n GLU 347 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2j2f s ALA 348 N -0.23 3.65 0.85 0.62 0.00 -1.25 -4.93 121.76 120.46 2j2f s ALA 348 Ca 0.00 1.15 -0.12 0.00 0.00 0.00 0.00 51.96 53.00 2j2f s ALA 348 Cb 0.00 -3.59 0.10 0.00 0.00 0.00 0.00 23.12 19.63 2j2f s ALA 348 CO 0.00 -0.77 1.11 -1.25 0.00 0.00 0.00 175.76 174.85 2j2f s PRO 349 N 1.53 1.68 0.05 0.00 0.04 -1.26 -4.62 135.00 132.42 2j2f s PRO 349 Ca 0.67 0.51 -0.19 0.00 0.04 0.00 0.00 61.00 62.03 2j2f s PRO 349 Cb -0.38 -1.88 -0.06 0.00 0.04 0.00 0.00 34.50 32.21 2j2f s PRO 349 CO 0.30 -1.87 0.56 0.99 0.04 0.00 0.00 177.00 177.02 2j2f s THR 350 N -3.19 4.80 -0.00 1.26 2.01 -1.26 -1.62 115.64 117.63 2j2f s THR 350 Ca 0.62 1.19 0.00 0.00 0.31 0.00 0.00 61.69 63.81 2j2f s THR 350 Cb -0.15 -3.89 0.00 0.00 0.01 0.00 0.00 72.50 68.48 2j2f s THR 350 CO 0.54 0.53 0.00 -0.32 -0.69 0.00 0.00 174.62 174.68 2j2f s MET 351 N -0.92 0.02 0.26 4.92 0.00 -0.14 -4.92 119.30 118.52 2j2f s MET 351 Ca 0.29 0.01 -0.30 0.00 0.00 0.00 0.00 55.69 55.69 2j2f s MET 351 Cb -0.19 -0.06 -0.09 0.00 0.00 0.00 0.00 34.83 34.49 2j2f s MET 351 CO 0.18 -0.01 1.00 -1.25 0.00 0.00 0.00 175.02 174.94 2j2f s PRO 352 N 0.12 4.76 -0.11 4.11 0.04 -1.26 -0.96 135.00 141.69 2j2f s PRO 352 Ca -0.01 1.60 0.03 0.00 0.04 0.00 0.00 61.00 62.66 2j2f s PRO 352 Cb -0.02 -3.22 0.01 0.00 0.04 0.00 0.00 34.50 31.31 2j2f s PRO 352 CO -0.00 0.39 -0.21 -0.06 0.04 0.00 0.00 177.00 177.16 2j2f s PHE 353 N -1.20 2.45 0.44 0.56 0.40 -0.82 -4.95 117.98 114.87 2j2f s PHE 353 Ca 0.43 -1.10 0.40 0.00 -0.60 0.00 0.00 56.93 56.06 2j2f s PHE 353 Cb -0.28 -1.67 2.04 0.00 0.51 0.00 0.00 43.02 43.63 2j2f s PHE 353 CO 0.35 -0.48 2.22 0.66 0.70 0.00 0.00 175.22 178.67 2j2f h SER 354 N 7.03 0.00 0.50 1.36 4.64 -1.93 -1.20 113.55 123.95 2j2f h SER 354 Ca -0.26 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.06 2j2f h SER 354 Cb 1.21 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.30 2j2f h SER 354 CO 0.50 0.00 0.00 -0.50 -0.87 0.00 0.00 176.83 175.96 2j2f h TRP 355 N 0.00 0.00 -0.84 4.77 6.55 -1.90 -2.94 115.95 121.59 2j2f h TRP 355 Ca 0.00 0.00 -0.47 0.00 0.95 0.00 0.00 58.89 59.37 2j2f h TRP 355 Cb 0.17 0.00 -0.42 0.00 -0.86 0.00 0.00 29.16 28.05 2j2f h TRP 355 CO 0.00 0.00 -0.90 0.44 -1.05 0.00 0.00 178.44 176.93 2j2f n ILE 356 N -2.87 2.08 -3.92 1.49 -5.35 -0.56 -0.04 119.36 110.20 2j2f n ILE 356 Ca -0.01 -3.96 -0.30 0.00 -0.27 0.00 0.00 62.75 58.21 2j2f n ILE 356 Cb 0.18 -0.45 0.03 0.00 -1.74 0.00 0.00 39.64 37.65 2j2f n ILE 356 CO 0.00 0.00 0.00 0.49 -1.76 0.00 0.00 176.55 175.28 2j2f n PHE 357 N -0.59 -2.32 -1.30 4.28 3.72 -1.11 -1.16 117.46 118.99 2j2f n PHE 357 Ca 0.32 0.91 -0.10 0.00 -0.05 0.00 0.00 57.45 58.52 2j2f n PHE 357 Cb 0.86 -3.99 -0.04 0.00 -0.94 0.00 0.00 39.48 35.37 2j2f n PHE 357 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 176.76 176.46 2j2f n ASP 358 N -2.84 -5.27 -4.71 4.37 8.00 -0.58 -4.98 116.55 110.54 2j2f n ASP 358 Ca 0.04 0.26 -0.32 0.00 0.71 0.00 0.00 54.79 55.48 2j2f n ASP 358 Cb 0.52 -3.69 0.13 0.00 -0.02 0.00 0.00 41.12 38.06 2j2f n ASP 358 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 2j2f s ARG 359 N -2.75 1.65 -0.02 -1.24 0.52 -0.31 -4.48 118.95 112.32 2j2f s ARG 359 Ca 0.00 1.54 0.03 0.00 -0.52 0.00 0.00 55.73 56.78 2j2f s ARG 359 Cb 0.00 -1.80 -0.03 0.00 0.52 0.00 0.00 34.95 33.64 2j2f s ARG 359 CO 0.00 -2.16 -0.10 -0.65 0.02 0.00 0.00 175.30 172.41 2j2f s GLN 360 N -4.45 2.50 0.14 3.54 -0.21 -1.26 -1.94 119.66 117.97 2j2f s GLN 360 Ca 0.68 -0.73 0.04 0.00 0.02 0.00 0.00 55.36 55.38 2j2f s GLN 360 Cb -0.24 -2.44 -0.04 0.00 1.00 0.00 0.00 33.01 31.29 2j2f s GLN 360 CO 0.53 0.61 -0.10 0.14 -2.12 0.00 0.00 175.29 174.35 2j2f s VAL 361 N -0.89 1.12 -0.08 1.09 -7.23 -0.14 -4.86 120.40 109.41 2j2f s VAL 361 Ca 0.15 -2.00 -0.30 0.00 -1.81 0.00 0.00 61.98 58.02 2j2f s VAL 361 Cb -0.11 -1.78 -0.03 0.00 0.56 0.00 0.00 36.38 35.02 2j2f s VAL 361 CO 0.05 -0.73 1.21 -0.75 -0.31 0.00 0.00 175.10 174.56 2j2f s LYS 362 N -3.63 4.33 0.00 4.82 2.20 -1.26 -0.97 119.74 125.22 2j2f s LYS 362 Ca 0.15 1.66 0.28 0.00 -0.36 0.00 0.00 55.97 57.70 2j2f s LYS 362 Cb 0.02 -3.60 1.69 0.00 -1.51 0.00 0.00 37.83 34.43 2j2f s LYS 362 CO 0.00 -0.50 2.03 1.28 -0.36 0.00 0.00 175.35 177.80