#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3cjp s ILE 4 N 0.00 5.01 -0.11 -0.08 1.01 -1.26 -3.93 121.20 121.85 3cjp s ILE 4 Ca 0.00 1.32 0.02 0.00 0.00 0.00 0.00 60.65 61.99 3cjp s ILE 4 Cb 0.00 -3.99 0.01 0.00 0.01 0.00 0.00 42.46 38.49 3cjp s ILE 4 CO 0.00 0.15 -0.17 -0.63 0.00 0.00 0.00 174.94 174.29 3cjp s ILE 5 N 1.58 1.59 -0.40 2.92 1.01 -0.05 -0.77 121.20 127.09 3cjp s ILE 5 Ca 0.32 -0.71 -0.29 0.00 0.00 0.00 0.00 60.65 59.97 3cjp s ILE 5 Cb -0.16 -1.44 0.02 0.00 0.01 0.00 0.00 42.46 40.89 3cjp s ILE 5 CO 0.13 0.46 1.26 -0.62 0.00 0.00 0.00 174.94 176.16 3cjp s ASP 6 N 0.83 6.58 0.03 3.58 -1.08 -0.08 -4.55 116.67 121.98 3cjp s ASP 6 Ca -0.09 0.81 0.25 0.00 -0.52 0.00 0.00 52.55 53.00 3cjp s ASP 6 Cb -0.16 -2.54 1.05 0.00 -1.46 0.00 0.00 42.92 39.81 3cjp s ASP 6 CO 0.01 -1.23 1.80 0.61 0.52 0.00 0.00 175.17 176.87 3cjp n GLY 7 N 4.70 -1.40 3.15 2.66 0.00 0.80 -0.53 105.19 114.57 3cjp n GLY 7 Ca 0.14 -0.07 0.04 0.00 0.00 0.00 0.00 46.02 46.13 3cjp n GLY 7 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 3cjp s HIS 8 N -3.02 -1.68 -0.01 1.61 5.65 -1.25 -4.62 115.29 111.95 3cjp s HIS 8 Ca 0.12 1.44 -0.02 0.00 0.25 0.00 0.00 55.06 56.85 3cjp s HIS 8 Cb 0.16 0.46 0.00 0.00 -1.18 0.00 0.00 32.58 32.02 3cjp s HIS 8 CO 0.47 -0.95 0.04 0.99 -0.65 0.00 0.00 174.74 174.65 3cjp s THR 9 N 2.85 0.01 0.39 0.89 2.01 -0.96 0.78 115.64 121.61 3cjp s THR 9 Ca 0.16 -0.07 -0.17 0.00 0.31 0.00 0.00 61.69 61.93 3cjp s THR 9 Cb -0.13 -0.09 -0.09 0.00 0.01 0.00 0.00 72.50 72.20 3cjp s THR 9 CO -0.23 -0.04 0.84 -1.00 -0.69 0.00 0.00 174.62 173.50 3cjp s HIS 10 N -0.10 3.37 -0.14 4.92 3.76 0.39 -0.36 115.29 127.14 3cjp s HIS 10 Ca -0.01 1.35 -0.38 0.00 -0.15 0.00 0.00 55.06 55.87 3cjp s HIS 10 Cb -0.01 -2.66 -0.15 0.00 1.11 0.00 0.00 32.58 30.87 3cjp s HIS 10 CO 0.00 -0.06 1.64 0.28 -0.85 0.00 0.00 174.74 175.76 3cjp n VAL 11 N -0.73 0.24 -3.92 -0.90 0.31 -0.35 -4.59 118.33 108.39 3cjp n VAL 11 Ca 0.05 -0.04 -0.35 0.00 -0.01 0.00 0.00 64.34 63.99 3cjp n VAL 11 Cb 0.54 -1.20 -0.09 0.00 -0.91 0.00 0.00 33.84 32.17 3cjp n VAL 11 CO 0.00 0.00 0.00 -0.63 -1.32 0.00 0.00 176.83 174.88 3cjp s ILE 12 N 2.66 5.01 -0.02 2.52 -1.09 -1.26 -4.90 121.20 124.11 3cjp s ILE 12 Ca 0.93 0.04 0.05 0.00 -2.23 0.00 0.00 60.65 59.44 3cjp s ILE 12 Cb -0.98 -3.26 -0.03 0.00 -1.58 0.00 0.00 42.46 36.62 3cjp s ILE 12 CO 0.58 0.47 -0.17 -0.76 -1.23 0.00 0.00 174.94 173.83 3cjp s LEU 13 N 0.24 2.60 0.51 2.97 1.43 -1.26 -3.43 118.68 121.74 3cjp s LEU 13 Ca 0.06 -0.29 -0.20 0.00 -1.03 0.00 0.00 54.13 52.66 3cjp s LEU 13 Cb -0.12 -1.52 -0.07 0.00 0.03 0.00 0.00 46.19 44.51 3cjp s LEU 13 CO -0.00 0.32 1.10 -2.84 0.23 0.00 0.00 176.35 175.15 3cjp s PRO 14 N -0.90 3.57 0.17 1.29 0.02 -1.26 -4.61 135.00 133.28 3cjp s PRO 14 Ca 0.12 1.53 -0.12 0.00 0.02 0.00 0.00 61.00 62.56 3cjp s PRO 14 Cb -0.10 -2.09 0.06 0.00 0.02 0.00 0.00 34.50 32.38 3cjp s PRO 14 CO 0.02 -0.65 1.67 0.28 -0.33 0.00 0.00 177.00 177.99 3cjp h VAL 15 N 1.42 1.25 -0.73 3.83 2.07 -2.01 -2.35 116.25 119.72 3cjp h VAL 15 Ca -0.50 -0.91 0.09 0.00 0.82 0.00 0.00 66.70 66.20 3cjp h VAL 15 Cb 1.24 0.75 -0.05 0.00 -1.52 0.00 0.00 31.29 31.71 3cjp h VAL 15 CO 0.58 0.34 0.48 -0.33 0.02 0.00 0.00 177.57 178.66 3cjp h GLU 16 N 0.82 0.64 -0.79 1.57 3.07 -1.99 0.46 114.58 118.37 3cjp h GLU 16 Ca 0.18 -0.04 0.07 0.00 -0.50 0.00 0.00 59.36 59.07 3cjp h GLU 16 Cb 0.36 -0.14 -0.06 0.00 -0.84 0.00 0.00 28.75 28.07 3cjp h GLU 16 CO 0.00 0.42 0.47 -0.22 -1.40 0.00 0.00 179.01 178.29 3cjp h LYS 17 N 0.66 0.82 -0.12 2.33 3.64 -1.80 -1.29 116.57 120.81 3cjp h LYS 17 Ca 0.33 -0.05 -0.22 0.00 -1.27 0.00 0.00 60.65 59.44 3cjp h LYS 17 Cb 0.42 -0.19 0.01 0.00 -0.41 0.00 0.00 32.23 32.07 3cjp h LYS 17 CO -0.12 0.54 -0.79 1.25 -2.27 0.00 0.00 179.45 178.06 3cjp h HIS 18 N 0.85 1.03 -0.83 1.91 2.76 -0.94 -2.15 115.15 117.78 3cjp h HIS 18 Ca 0.36 -0.48 0.00 0.00 -2.20 0.00 0.00 60.37 58.05 3cjp h HIS 18 Cb 0.21 -0.15 -0.04 0.00 1.55 0.00 0.00 27.41 28.98 3cjp h HIS 18 CO -0.05 1.31 0.53 0.82 -1.30 0.00 0.00 177.93 179.24 3cjp h ILE 19 N 0.47 1.22 -0.29 6.26 1.08 -1.03 -1.28 117.51 123.95 3cjp h ILE 19 Ca -0.06 -0.43 0.03 0.00 -0.39 0.00 0.00 64.86 64.00 3cjp h ILE 19 Cb 1.43 0.02 -0.03 0.00 -3.07 0.00 0.00 36.82 35.17 3cjp h ILE 19 CO 0.16 0.22 0.12 0.50 -0.69 0.00 0.00 178.15 178.46 3cjp h LYS 20 N 1.13 0.25 -0.92 2.37 1.63 -1.16 0.87 116.57 120.74 3cjp h LYS 20 Ca 0.30 -0.01 0.03 0.00 -0.85 0.00 0.00 60.65 60.12 3cjp h LYS 20 Cb -0.10 -0.06 -0.05 0.00 -0.60 0.00 0.00 32.23 31.42 3cjp h LYS 20 CO -0.06 0.16 0.60 0.82 -3.45 0.00 0.00 179.45 177.53 3cjp h ILE 21 N 0.26 1.16 -0.01 2.00 2.04 -0.86 0.17 117.51 122.27 3cjp h ILE 21 Ca 0.12 -0.40 -0.00 0.00 1.00 0.00 0.00 64.86 65.58 3cjp h ILE 21 Cb 0.07 -0.10 -0.00 0.00 -0.74 0.00 0.00 36.82 36.05 3cjp h ILE 21 CO -0.11 0.21 0.00 0.24 0.00 0.00 0.00 178.15 178.49 3cjp h MET 22 N 1.16 0.01 -0.02 2.37 2.86 -0.84 -1.93 114.93 118.54 3cjp h MET 22 Ca 0.36 -0.00 0.03 0.00 -2.06 0.00 0.00 59.70 58.04 3cjp h MET 22 Cb 0.01 -0.00 -0.05 0.00 0.06 0.00 0.00 31.60 31.61 3cjp h MET 22 CO -0.11 0.28 -0.33 -0.44 1.06 0.00 0.00 176.91 177.37 3cjp h ASP 23 N -0.26 -1.00 0.03 1.22 3.32 -0.35 0.10 116.42 119.48 3cjp h ASP 23 Ca 0.00 0.13 -0.00 0.00 0.02 0.00 0.00 57.03 57.18 3cjp h ASP 23 Cb 0.27 0.40 -0.00 0.00 0.22 0.00 0.00 39.33 40.23 3cjp h ASP 23 CO 0.00 -0.39 -0.01 -0.33 -1.72 0.00 0.00 179.24 176.79 3cjp h GLU 24 N -0.48 0.00 -0.02 3.56 5.08 -0.56 -2.42 114.58 119.74 3cjp h GLU 24 Ca 0.06 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.42 3cjp h GLU 24 Cb 0.57 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.82 3cjp h GLU 24 CO -0.28 0.01 -0.09 0.00 -1.00 0.00 0.00 179.01 177.64 3cjp n ALA 25 N -2.34 2.72 -2.82 3.43 0.00 -0.74 -4.95 120.51 115.81 3cjp n ALA 25 Ca -0.03 -0.58 -0.13 0.00 0.00 0.00 0.00 53.44 52.70 3cjp n ALA 25 Cb 0.10 -0.95 0.03 0.00 0.00 0.00 0.00 19.45 18.63 3cjp n ALA 25 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3cjp n GLY 26 N 1.31 0.04 3.67 0.00 0.00 -0.62 -5.01 105.19 104.57 3cjp n GLY 26 Ca 0.15 -0.23 -0.35 0.00 0.00 0.00 0.00 46.02 45.59 3cjp n GLY 26 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3cjp s VAL 27 N -2.98 5.04 -0.08 1.61 1.01 0.25 -4.59 120.40 120.67 3cjp s VAL 27 Ca 0.22 0.06 -0.18 0.00 0.00 0.00 0.00 61.98 62.08 3cjp s VAL 27 Cb -0.10 -3.28 -0.29 0.00 0.00 0.00 0.00 36.38 32.71 3cjp s VAL 27 CO 0.27 0.45 0.70 0.44 0.00 0.00 0.00 175.10 176.96 3cjp h ASP 28 N 6.66 0.43 -5.16 3.32 5.19 -1.25 -3.40 116.42 122.21 3cjp h ASP 28 Ca -0.39 -0.89 -0.10 0.00 -0.62 0.00 0.00 57.03 55.03 3cjp h ASP 28 Cb 1.16 -0.14 -0.15 0.00 0.18 0.00 0.00 39.33 40.38 3cjp h ASP 28 CO 0.73 1.54 -0.45 -0.54 -3.12 0.00 0.00 179.24 177.40 3cjp s LYS 29 N -2.46 0.76 -0.03 3.56 1.02 -1.19 -4.62 119.74 116.77 3cjp s LYS 29 Ca -0.17 -0.96 0.03 0.00 0.02 0.00 0.00 55.97 54.89 3cjp s LYS 29 Cb 0.03 0.30 0.00 0.00 -0.52 0.00 0.00 37.83 37.64 3cjp s LYS 29 CO 0.80 -0.22 -0.11 0.99 -0.92 0.00 0.00 175.35 175.89 3cjp s THR 30 N -3.63 0.94 -0.38 2.17 2.01 0.02 -0.90 115.64 115.87 3cjp s THR 30 Ca 0.03 -0.45 -0.28 0.00 0.31 0.00 0.00 61.69 61.31 3cjp s THR 30 Cb 0.04 -0.83 0.02 0.00 0.01 0.00 0.00 72.50 71.75 3cjp s THR 30 CO -0.10 0.28 1.02 -0.63 -0.69 0.00 0.00 174.62 174.51 3cjp s ILE 31 N 0.12 4.48 -0.08 1.82 -1.09 0.31 -2.34 121.20 124.41 3cjp s ILE 31 Ca -0.03 1.37 -0.04 0.00 -2.23 0.00 0.00 60.65 59.72 3cjp s ILE 31 Cb -0.09 -4.42 -0.04 0.00 -1.58 0.00 0.00 42.46 36.33 3cjp s ILE 31 CO 0.01 -0.62 0.10 -0.22 -1.23 0.00 0.00 174.94 172.97 3cjp s LEU 32 N 3.75 4.09 0.05 2.97 2.96 -0.10 -2.27 118.68 130.12 3cjp s LEU 32 Ca 0.43 0.32 0.09 0.00 -0.22 0.00 0.00 54.13 54.74 3cjp s LEU 32 Cb -0.11 -2.08 -0.03 0.00 0.50 0.00 0.00 46.19 44.48 3cjp s LEU 32 CO 0.20 0.37 -0.24 -0.36 -1.32 0.00 0.00 176.35 175.00 3cjp s PHE 33 N -1.04 2.14 0.75 5.38 0.40 0.52 -1.44 117.98 124.68 3cjp s PHE 33 Ca 0.17 -0.40 -0.12 0.00 -0.60 0.00 0.00 56.93 55.98 3cjp s PHE 33 Cb -0.12 -1.27 0.05 0.00 0.51 0.00 0.00 43.02 42.18 3cjp s PHE 33 CO 0.06 0.12 1.12 -1.54 0.70 0.00 0.00 175.22 175.68 3cjp s SER 34 N -1.26 4.49 -0.07 1.36 1.04 -1.24 -1.21 113.70 116.80 3cjp s SER 34 Ca 0.10 1.98 -0.11 0.00 0.48 0.00 0.00 55.95 58.40 3cjp s SER 34 Cb -0.10 -2.54 0.02 0.00 0.10 0.00 0.00 66.02 63.50 3cjp s SER 34 CO 0.02 -2.04 0.27 0.28 0.98 0.00 0.00 173.24 172.75 3cjp s THR 35 N -2.59 0.02 -0.42 2.02 -1.32 -1.26 -4.71 115.64 107.39 3cjp s THR 35 Ca 0.65 -0.19 0.23 0.00 -1.21 0.00 0.00 61.69 61.17 3cjp s THR 35 Cb -0.20 -0.45 0.05 0.00 -1.51 0.00 0.00 72.50 70.38 3cjp s THR 35 CO 0.50 -0.11 1.20 0.28 -2.21 0.00 0.00 174.62 174.29 3cjp h SER 36 N 5.10 0.00 -4.31 8.08 0.02 -1.94 -3.44 113.55 117.05 3cjp h SER 36 Ca -0.27 -0.09 -0.54 0.00 -0.84 0.00 0.00 61.79 60.05 3cjp h SER 36 Cb 1.19 0.00 -0.29 0.00 0.14 0.00 0.00 62.40 63.44 3cjp h SER 36 CO 0.35 0.04 -0.83 0.27 -1.14 0.00 0.00 176.83 175.53 3cjp s ILE 37 N -3.27 1.35 -0.65 3.27 -0.00 -1.26 -5.08 121.20 115.56 3cjp s ILE 37 Ca 0.03 -0.74 0.06 0.00 -0.00 0.00 0.00 60.65 59.99 3cjp s ILE 37 Cb 0.11 -1.13 0.22 0.00 -0.00 0.00 0.00 42.46 41.66 3cjp s ILE 37 CO 0.75 0.37 0.64 1.41 -0.00 0.00 0.00 174.94 178.11 3cjp n HIS 38 N 2.63 3.24 0.30 1.37 8.25 -1.26 -4.92 115.22 124.83 3cjp n HIS 38 Ca -0.15 -4.17 0.17 0.00 -0.26 0.00 0.00 57.72 53.31 3cjp n HIS 38 Cb 0.54 -0.55 0.77 0.00 1.12 0.00 0.00 29.99 31.87 3cjp n HIS 38 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 3cjp h PRO 39 N 4.64 0.00 0.00 -0.41 0.13 -1.94 -1.67 132.00 132.75 3cjp h PRO 39 Ca 0.18 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.31 3cjp h PRO 39 Cb 0.71 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.84 3cjp h PRO 39 CO 0.77 0.00 0.00 1.05 -0.23 0.00 0.00 178.00 179.59 3cjp h GLU 40 N 0.00 0.00 -0.01 0.86 9.09 -1.92 -3.06 114.58 119.54 3cjp h GLU 40 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.41 3cjp h GLU 40 Cb 0.27 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.37 3cjp h GLU 40 CO 0.00 0.00 -0.39 0.25 0.05 0.00 0.00 179.01 178.92 3cjp n THR 41 N -2.53 0.00 -2.27 -1.06 -2.24 -0.63 -4.88 114.28 100.66 3cjp n THR 41 Ca 0.02 -0.31 -0.43 0.00 -2.27 0.00 0.00 64.05 61.07 3cjp n THR 41 Cb 0.31 1.22 -0.02 0.00 -2.10 0.00 0.00 70.33 69.74 3cjp n THR 41 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3cjp s ALA 42 N -2.12 3.49 0.23 6.98 0.00 -1.16 -5.02 121.76 124.16 3cjp s ALA 42 Ca 0.15 0.47 -0.08 0.00 0.00 0.00 0.00 51.96 52.50 3cjp s ALA 42 Cb 0.15 -3.74 -0.06 0.00 0.00 0.00 0.00 23.12 19.47 3cjp s ALA 42 CO 0.47 -1.55 0.52 0.14 0.00 0.00 0.00 175.76 175.34 3cjp s VAL 43 N 4.24 4.99 0.39 0.00 -7.23 -1.26 -4.77 120.40 116.76 3cjp s VAL 43 Ca 0.63 0.29 0.00 0.00 -1.81 0.00 0.00 61.98 61.09 3cjp s VAL 43 Cb -0.23 -3.65 0.00 0.00 0.56 0.00 0.00 36.38 33.06 3cjp s VAL 43 CO 0.23 -0.12 0.00 -0.46 -0.31 0.00 0.00 175.10 174.44 3cjp n ASN 44 N -0.31 -5.80 0.03 4.85 0.23 -1.26 -4.63 115.26 108.37 3cjp n ASN 44 Ca -0.01 1.15 -0.09 0.00 -0.53 0.00 0.00 54.58 55.11 3cjp n ASN 44 Cb 0.53 -3.04 0.05 0.00 -2.08 0.00 0.00 39.78 35.24 3cjp n ASN 44 CO 0.00 0.00 0.00 -0.07 -0.93 0.00 0.00 177.26 176.26 3cjp h LEU 45 N 0.37 0.53 -0.70 -4.53 -0.00 -2.00 -3.02 115.31 105.97 3cjp h LEU 45 Ca 0.00 -0.31 0.00 0.00 -0.00 0.00 0.00 57.88 57.58 3cjp h LEU 45 Cb 0.48 -0.15 -0.03 0.00 -0.00 0.00 0.00 40.66 40.95 3cjp h LEU 45 CO 0.00 1.02 0.45 -0.09 -0.00 0.00 0.00 178.44 179.83 3cjp h ARG 46 N 0.34 0.92 -0.28 1.13 2.43 -2.00 -1.50 114.38 115.42 3cjp h ARG 46 Ca -0.01 -0.06 -0.08 0.00 -0.81 0.00 0.00 59.98 59.01 3cjp h ARG 46 Cb 1.18 -0.21 -0.01 0.00 -0.42 0.00 0.00 29.97 30.52 3cjp h ARG 46 CO 0.11 0.62 -0.16 -0.44 -1.51 0.00 0.00 179.97 178.59 3cjp h ASP 47 N 0.94 0.62 -0.33 -3.80 3.32 -1.81 -1.26 116.42 114.10 3cjp h ASP 47 Ca 0.25 -0.42 0.07 0.00 0.02 0.00 0.00 57.03 56.96 3cjp h ASP 47 Cb -0.10 -0.17 -0.07 0.00 0.22 0.00 0.00 39.33 39.21 3cjp h ASP 47 CO -0.05 0.90 -0.13 0.58 -1.72 0.00 0.00 179.24 178.82 3cjp h VAL 48 N 0.34 0.57 -0.82 -1.35 2.07 -1.39 -0.89 116.25 114.78 3cjp h VAL 48 Ca 0.06 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.60 3cjp h VAL 48 Cb 0.68 0.57 -0.05 0.00 -1.52 0.00 0.00 31.29 30.98 3cjp h VAL 48 CO 0.04 0.00 0.53 0.11 0.02 0.00 0.00 177.57 178.28 3cjp h LYS 49 N -0.06 1.04 -0.69 1.57 1.57 -1.16 0.73 116.57 119.56 3cjp h LYS 49 Ca 0.17 -0.06 0.02 0.00 -1.87 0.00 0.00 60.65 58.90 3cjp h LYS 49 Cb 0.32 -0.23 -0.04 0.00 0.08 0.00 0.00 32.23 32.36 3cjp h LYS 49 CO -0.38 0.69 0.45 -0.22 -0.57 0.00 0.00 179.45 179.42 3cjp h LYS 50 N 1.07 0.88 -0.04 3.15 3.64 -0.61 -0.54 116.57 124.11 3cjp h LYS 50 Ca 0.31 -0.05 -0.01 0.00 -1.27 0.00 0.00 60.65 59.63 3cjp h LYS 50 Cb -0.06 -0.20 -0.00 0.00 -0.41 0.00 0.00 32.23 31.56 3cjp h LYS 50 CO -0.09 0.58 -0.02 0.93 -2.27 0.00 0.00 179.45 178.58 3cjp h GLU 51 N 0.90 0.09 -0.76 1.90 4.39 -0.61 -2.38 114.58 118.10 3cjp h GLU 51 Ca 0.26 -0.04 0.08 0.00 0.34 0.00 0.00 59.36 60.01 3cjp h GLU 51 Cb -0.06 -0.00 -0.05 0.00 -0.10 0.00 0.00 28.75 28.54 3cjp h GLU 51 CO -0.08 0.47 0.50 0.52 -1.16 0.00 0.00 179.01 179.26 3cjp h MET 52 N -0.30 0.72 0.04 2.33 2.86 -0.67 0.26 114.93 120.17 3cjp h MET 52 Ca 0.01 -0.04 -0.00 0.00 -2.06 0.00 0.00 59.70 57.60 3cjp h MET 52 Cb 0.44 -0.16 0.00 0.00 0.06 0.00 0.00 31.60 31.94 3cjp h MET 52 CO 0.01 0.48 -0.02 -0.22 1.06 0.00 0.00 176.91 178.21 3cjp h LYS 53 N 0.74 -0.06 -0.69 1.72 1.63 -1.09 0.72 116.57 119.55 3cjp h LYS 53 Ca 0.34 0.00 0.14 0.00 -0.85 0.00 0.00 60.65 60.28 3cjp h LYS 53 Cb 0.36 0.01 -0.10 0.00 -0.60 0.00 0.00 32.23 31.91 3cjp h LYS 53 CO -0.12 0.26 0.18 0.87 -3.45 0.00 0.00 179.45 177.19 3cjp h LYS 54 N -0.38 0.29 -0.03 1.90 1.57 -0.81 -1.89 116.57 117.22 3cjp h LYS 54 Ca -0.01 -0.02 0.01 0.00 -1.87 0.00 0.00 60.65 58.76 3cjp h LYS 54 Cb 0.35 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.58 3cjp h LYS 54 CO 0.01 0.19 -0.01 1.25 -0.57 0.00 0.00 179.45 180.32 3cjp h LEU 55 N 0.30 -0.02 -1.48 2.94 5.85 -0.37 -2.64 115.31 119.89 3cjp h LEU 55 Ca 0.38 0.01 0.14 0.00 0.84 0.00 0.00 57.88 59.24 3cjp h LEU 55 Cb 0.60 0.02 -0.06 0.00 0.37 0.00 0.00 40.66 41.59 3cjp h LEU 55 CO -0.45 -0.01 0.52 0.78 -0.34 0.00 0.00 178.44 178.94 3cjp h ASN 56 N 0.00 0.49 0.90 1.25 -0.26 -0.04 0.89 115.58 118.81 3cjp h ASN 56 Ca 0.01 0.03 0.00 0.00 -0.56 0.00 0.00 56.30 55.78 3cjp h ASN 56 Cb 0.02 -0.07 0.00 0.00 -1.06 0.00 0.00 38.32 37.21 3cjp h ASN 56 CO -0.03 0.26 -0.50 -0.90 -1.06 0.00 0.00 177.43 175.20 3cjp n ASP 57 N -4.50 0.65 0.25 5.81 5.68 -1.04 -2.18 116.55 121.22 3cjp n ASP 57 Ca 0.15 0.15 -0.14 0.00 -0.50 0.00 0.00 54.79 54.45 3cjp n ASP 57 Cb 0.48 0.02 -0.07 0.00 -1.14 0.00 0.00 41.12 40.42 3cjp n ASP 57 CO 0.00 0.00 0.00 0.58 -1.33 0.00 0.00 177.20 176.45 3cjp h VAL 58 N 0.00 0.36 0.00 2.12 2.07 -0.51 0.55 116.25 120.84 3cjp h VAL 58 Ca 0.00 -0.47 -0.01 0.00 0.82 0.00 0.00 66.70 67.05 3cjp h VAL 58 Cb 0.70 0.51 -0.00 0.00 -1.52 0.00 0.00 31.29 30.98 3cjp h VAL 58 CO 0.00 0.06 -0.03 0.58 0.02 0.00 0.00 177.57 178.20 3cjp h VAL 59 N -0.99 0.76 0.00 2.57 2.07 -1.27 0.24 116.25 119.62 3cjp h VAL 59 Ca -0.07 -0.10 0.00 0.00 0.82 0.00 0.00 66.70 67.35 3cjp h VAL 59 Cb 0.59 1.06 0.00 0.00 -1.52 0.00 0.00 31.29 31.42 3cjp h VAL 59 CO 0.11 0.03 -0.01 0.59 0.02 0.00 0.00 177.57 178.30 3cjp n ASN 60 N -4.13 0.24 0.00 0.57 3.02 -0.93 -4.50 115.26 109.54 3cjp n ASN 60 Ca -0.03 0.50 0.00 0.00 -0.03 0.00 0.00 54.58 55.03 3cjp n ASN 60 Cb 0.11 -0.56 0.00 0.00 -0.61 0.00 0.00 39.78 38.72 3cjp n ASN 60 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3cjp n GLY 61 N 1.45 1.05 0.12 7.41 0.00 0.83 -4.35 105.19 111.70 3cjp n GLY 61 Ca 0.07 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.13 3cjp n GLY 61 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3cjp h LYS 62 N 2.23 0.00 -0.02 1.61 1.57 -1.03 -3.30 116.57 117.62 3cjp h LYS 62 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3cjp h LYS 62 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.31 3cjp h LYS 62 CO 0.00 0.27 0.00 2.41 -0.57 0.00 0.00 179.45 181.56 3cjp n THR 63 N -2.97 0.00 0.00 -0.16 -1.04 -1.25 -4.60 114.28 104.27 3cjp n THR 63 Ca -0.03 -0.25 0.00 0.00 -2.04 0.00 0.00 64.05 61.73 3cjp n THR 63 Cb 0.72 0.48 0.00 0.00 -1.82 0.00 0.00 70.33 69.72 3cjp n THR 63 CO 0.00 0.00 0.00 0.59 -0.64 0.00 0.00 175.07 175.02 3cjp n ASN 64 N 0.16 0.00 -3.17 8.00 3.02 -1.24 -1.57 115.26 120.46 3cjp n ASN 64 Ca 0.19 0.10 -0.21 0.00 -0.03 0.00 0.00 54.58 54.63 3cjp n ASN 64 Cb 0.35 -0.10 -0.05 0.00 -0.61 0.00 0.00 39.78 39.37 3cjp n ASN 64 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 3cjp n SER 65 N -1.08 0.30 -3.01 6.41 7.64 -1.26 -3.09 113.62 119.53 3cjp n SER 65 Ca 0.00 -2.83 -0.24 0.00 1.01 0.00 0.00 58.87 56.80 3cjp n SER 65 Cb 0.01 -0.54 -0.04 0.00 -1.01 0.00 0.00 64.21 62.63 3cjp n SER 65 CO 0.00 0.00 0.00 0.23 -3.01 0.00 0.00 175.04 172.26 3cjp n MET 66 N 1.00 2.58 -0.26 1.43 2.81 -0.61 -5.00 117.12 119.06 3cjp n MET 66 Ca 0.22 -4.43 0.08 0.00 -1.81 0.00 0.00 57.70 51.75 3cjp n MET 66 Cb 0.58 -2.08 0.21 0.00 -0.71 0.00 0.00 33.22 31.22 3cjp n MET 66 CO 0.00 0.00 0.00 0.82 1.51 0.00 0.00 175.97 178.30 3cjp h ILE 67 N 2.40 0.47 -0.22 2.02 2.04 -1.92 -2.21 117.51 120.09 3cjp h ILE 67 Ca 0.12 -0.09 0.03 0.00 1.00 0.00 0.00 64.86 65.92 3cjp h ILE 67 Cb 0.64 0.18 -0.06 0.00 -0.74 0.00 0.00 36.82 36.83 3cjp h ILE 67 CO 0.73 0.05 -0.49 0.44 0.00 0.00 0.00 178.15 178.87 3cjp h ASP 68 N 0.27 -1.59 -1.00 1.72 3.45 -1.99 0.41 116.42 117.68 3cjp h ASP 68 Ca 0.45 0.20 0.13 0.00 0.43 0.00 0.00 57.03 58.24 3cjp h ASP 68 Cb 0.81 0.63 -0.09 0.00 -0.56 0.00 0.00 39.33 40.13 3cjp h ASP 68 CO -0.55 -0.40 0.63 0.58 -1.57 0.00 0.00 179.24 177.93 3cjp h VAL 69 N -0.46 0.89 0.01 -1.35 2.07 -1.85 -1.10 116.25 114.47 3cjp h VAL 69 Ca 0.04 -0.33 -0.21 0.00 0.82 0.00 0.00 66.70 67.03 3cjp h VAL 69 Cb 0.58 -0.15 -0.01 0.00 -1.52 0.00 0.00 31.29 30.19 3cjp h VAL 69 CO -0.45 0.18 -0.92 0.03 0.02 0.00 0.00 177.57 176.43 3cjp h ARG 70 N 0.96 0.20 -0.76 1.57 3.08 -1.10 -1.59 114.38 116.73 3cjp h ARG 70 Ca 0.50 -0.23 0.00 0.00 0.07 0.00 0.00 59.98 60.33 3cjp h ARG 70 Cb 0.54 0.07 -0.04 0.00 0.08 0.00 0.00 29.97 30.63 3cjp h ARG 70 CO -0.27 0.99 0.49 0.00 -1.07 0.00 0.00 179.97 180.10 3cjp h ARG 71 N 0.10 1.02 -0.77 0.04 3.08 0.57 -2.62 114.38 115.80 3cjp h ARG 71 Ca -0.05 -0.07 -0.03 0.00 0.07 0.00 0.00 59.98 59.89 3cjp h ARG 71 Cb 1.57 -0.22 -0.03 0.00 0.08 0.00 0.00 29.97 31.36 3cjp h ARG 71 CO 0.14 0.69 0.35 -0.97 -1.07 0.00 0.00 179.97 179.11 3cjp h ASN 72 N 1.04 1.02 -0.46 7.04 -1.24 -0.95 -2.27 115.58 119.75 3cjp h ASN 72 Ca 0.28 -0.15 -0.03 0.00 0.71 0.00 0.00 56.30 57.11 3cjp h ASN 72 Cb -0.09 -0.26 -0.02 0.00 0.73 0.00 0.00 38.32 38.67 3cjp h ASN 72 CO -0.06 0.89 0.19 0.28 -1.29 0.00 0.00 177.43 177.44 3cjp h SER 73 N 1.09 0.68 -0.18 1.15 0.02 -1.14 -0.53 113.55 114.64 3cjp h SER 73 Ca 0.26 -0.08 -0.17 0.00 -0.84 0.00 0.00 61.79 60.96 3cjp h SER 73 Cb 0.15 -0.17 0.01 0.00 0.14 0.00 0.00 62.40 62.52 3cjp h SER 73 CO -0.03 0.62 -0.55 0.40 -1.14 0.00 0.00 176.83 176.13 3cjp h ILE 74 N 0.73 1.32 -0.38 3.27 2.04 -1.27 -1.36 117.51 121.86 3cjp h ILE 74 Ca 0.18 -1.79 0.05 0.00 1.00 0.00 0.00 64.86 64.29 3cjp h ILE 74 Cb 0.16 1.95 -0.04 0.00 -0.74 0.00 0.00 36.82 38.15 3cjp h ILE 74 CO -0.01 0.56 0.13 0.11 0.00 0.00 0.00 178.15 178.93 3cjp h LYS 75 N 0.37 0.27 -0.41 2.37 1.57 -1.07 0.12 116.57 119.79 3cjp h LYS 75 Ca -0.02 -0.02 0.07 0.00 -1.87 0.00 0.00 60.65 58.81 3cjp h LYS 75 Cb 1.17 -0.06 -0.06 0.00 0.08 0.00 0.00 32.23 33.36 3cjp h LYS 75 CO 0.12 0.18 0.04 1.49 -0.57 0.00 0.00 179.45 180.71 3cjp h GLU 76 N 0.28 0.15 -0.49 3.15 4.81 -1.02 -1.69 114.58 119.77 3cjp h GLU 76 Ca 0.17 -0.01 -0.05 0.00 -0.13 0.00 0.00 59.36 59.34 3cjp h GLU 76 Cb 0.16 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.48 3cjp h GLU 76 CO -0.18 0.10 0.10 1.25 -0.73 0.00 0.00 179.01 179.55 3cjp h LEU 77 N 0.16 0.76 -0.63 1.64 5.85 -0.59 -1.19 115.31 121.31 3cjp h LEU 77 Ca 0.20 -0.24 -0.05 0.00 0.84 0.00 0.00 57.88 58.63 3cjp h LEU 77 Cb 0.27 -0.20 -0.03 0.00 0.37 0.00 0.00 40.66 41.07 3cjp h LEU 77 CO -0.30 0.81 0.21 0.71 -0.34 0.00 0.00 178.44 179.54 3cjp h THR 78 N 0.68 1.24 -0.71 1.05 1.35 -0.58 -1.27 112.91 114.67 3cjp h THR 78 Ca 0.15 -0.81 -0.02 0.00 -0.55 0.00 0.00 66.41 65.19 3cjp h THR 78 Cb 0.36 0.58 -0.03 0.00 -1.73 0.00 0.00 68.15 67.33 3cjp h THR 78 CO 0.01 0.31 0.36 0.78 -0.25 0.00 0.00 175.52 176.73 3cjp h ASN 79 N 0.89 0.90 -0.24 5.36 2.35 -1.04 -1.73 115.58 122.07 3cjp h ASN 79 Ca 0.20 -0.08 -0.07 0.00 -0.55 0.00 0.00 56.30 55.80 3cjp h ASN 79 Cb 0.26 -0.23 -0.01 0.00 0.05 0.00 0.00 38.32 38.40 3cjp h ASN 79 CO -0.01 0.74 -0.13 0.58 -1.65 0.00 0.00 177.43 176.96 3cjp h VAL 80 N 1.00 1.30 -0.92 2.81 2.07 -0.89 -2.96 116.25 118.67 3cjp h VAL 80 Ca 0.25 -1.22 0.08 0.00 0.82 0.00 0.00 66.70 66.62 3cjp h VAL 80 Cb 0.07 1.58 -0.07 0.00 -1.52 0.00 0.00 31.29 31.35 3cjp h VAL 80 CO -0.04 0.38 0.58 0.40 0.02 0.00 0.00 177.57 178.91 3cjp h ILE 81 N 0.23 1.02 -0.01 4.57 2.04 -1.14 -1.68 117.51 122.55 3cjp h ILE 81 Ca 0.05 -0.35 -0.02 0.00 1.00 0.00 0.00 64.86 65.55 3cjp h ILE 81 Cb 0.64 -0.09 -0.00 0.00 -0.74 0.00 0.00 36.82 36.63 3cjp h ILE 81 CO 0.04 0.19 -0.07 -0.61 0.00 0.00 0.00 178.15 177.70 3cjp h GLN 82 N 1.02 0.02 -0.07 2.37 4.15 -1.21 -1.03 115.11 120.36 3cjp h GLN 82 Ca 0.41 -0.00 -0.16 0.00 0.77 0.00 0.00 58.65 59.67 3cjp h GLN 82 Cb 0.24 -0.00 -0.01 0.00 0.21 0.00 0.00 27.48 27.92 3cjp h GLN 82 CO -0.20 0.09 -0.64 0.00 -1.93 0.00 0.00 178.83 176.15 3cjp h ALA 83 N 1.91 0.76 -2.04 3.38 0.00 -1.14 -3.36 119.26 118.78 3cjp h ALA 83 Ca 0.00 -0.57 -0.51 0.00 0.00 0.00 0.00 54.91 53.83 3cjp h ALA 83 Cb 0.13 -0.08 -0.40 0.00 0.00 0.00 0.00 17.79 17.44 3cjp h ALA 83 CO 0.01 0.75 -1.09 0.66 0.00 0.00 0.00 179.25 179.57 3cjp n TYR 84 N -3.85 0.65 0.29 0.00 4.02 -1.00 -4.97 117.16 112.29 3cjp n TYR 84 Ca -0.03 -3.80 0.11 0.00 -0.01 0.00 0.00 57.90 54.17 3cjp n TYR 84 Cb 0.65 -0.42 0.51 0.00 -0.02 0.00 0.00 39.34 40.06 3cjp n TYR 84 CO 0.00 0.00 0.00 -0.35 -1.01 0.00 0.00 176.86 175.50 3cjp n PRO 85 N 0.47 0.16 0.00 -0.72 -0.04 -0.42 -0.53 135.00 133.92 3cjp n PRO 85 Ca 0.25 0.51 0.13 0.00 -0.04 0.00 0.00 63.50 64.35 3cjp n PRO 85 Cb 0.59 -1.89 0.38 0.00 -0.04 0.00 0.00 33.50 32.54 3cjp n PRO 85 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 3cjp n SER 86 N -2.21 0.47 -0.00 3.54 3.41 -1.26 -4.24 113.62 113.33 3cjp n SER 86 Ca 0.01 -0.23 0.04 0.00 -0.26 0.00 0.00 58.87 58.43 3cjp n SER 86 Cb 0.14 0.06 -0.06 0.00 -0.26 0.00 0.00 64.21 64.08 3cjp n SER 86 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 3cjp n ARG 87 N -1.33 0.29 -4.37 4.33 5.12 0.31 -4.84 116.66 116.17 3cjp n ARG 87 Ca 0.08 -0.07 -0.19 0.00 -1.93 0.00 0.00 57.85 55.74 3cjp n ARG 87 Cb 0.33 -1.19 -0.15 0.00 -1.16 0.00 0.00 32.46 30.30 3cjp n ARG 87 CO 0.00 0.00 0.00 0.71 -1.93 0.00 0.00 177.63 176.41 3cjp s TYR 88 N -2.54 0.85 0.08 -1.55 2.02 -0.83 -0.80 117.35 114.58 3cjp s TYR 88 Ca -0.03 -0.17 0.06 0.00 -0.37 0.00 0.00 57.07 56.56 3cjp s TYR 88 Cb 0.05 -0.57 -0.03 0.00 -0.40 0.00 0.00 41.96 41.01 3cjp s TYR 88 CO 0.32 -0.04 -0.16 0.14 -1.57 0.00 0.00 175.55 174.24 3cjp s VAL 89 N -0.09 1.32 0.11 0.71 -7.23 -0.99 -4.72 120.40 109.51 3cjp s VAL 89 Ca 0.02 -1.38 0.10 0.00 -1.81 0.00 0.00 61.98 58.91 3cjp s VAL 89 Cb -0.05 -1.24 -0.04 0.00 0.56 0.00 0.00 36.38 35.62 3cjp s VAL 89 CO -0.00 -0.16 -0.26 -0.83 -0.31 0.00 0.00 175.10 173.53 3cjp s GLY 90 N -1.78 1.50 -0.08 2.32 0.00 -1.26 -0.93 107.32 107.09 3cjp s GLY 90 Ca 0.01 -1.40 -0.00 0.00 0.00 0.00 0.00 44.72 43.33 3cjp s GLY 90 CO 0.03 -1.37 -0.06 -1.36 0.00 0.00 0.00 173.10 170.35 3cjp s PHE 91 N -1.02 2.98 -0.02 1.90 0.40 -0.52 -1.04 117.98 120.66 3cjp s PHE 91 Ca 0.13 0.01 0.05 0.00 -0.60 0.00 0.00 56.93 56.51 3cjp s PHE 91 Cb -0.10 -1.75 -0.03 0.00 0.51 0.00 0.00 43.02 41.65 3cjp s PHE 91 CO 0.05 0.31 -0.15 0.20 0.70 0.00 0.00 175.22 176.33 3cjp s GLY 92 N -0.68 1.56 0.46 4.36 0.00 -0.62 -3.72 107.32 108.68 3cjp s GLY 92 Ca 0.10 -1.05 -0.20 0.00 0.00 0.00 0.00 44.72 43.58 3cjp s GLY 92 CO 0.02 -0.87 0.97 0.21 0.00 0.00 0.00 173.10 173.42 3cjp s ASN 93 N -1.01 6.76 -0.06 1.64 2.47 -0.59 -0.99 114.94 123.17 3cjp s ASN 93 Ca 0.13 1.68 0.01 0.00 0.42 0.00 0.00 52.86 55.10 3cjp s ASN 93 Cb -0.11 -2.53 0.02 0.00 -1.45 0.00 0.00 41.25 37.18 3cjp s ASN 93 CO 0.03 -0.49 -0.06 -0.69 -3.72 0.00 0.00 177.10 172.16 3cjp s VAL 94 N -2.29 0.71 0.30 -5.21 1.01 -1.26 -4.88 120.40 108.77 3cjp s VAL 94 Ca 0.62 -0.21 -0.30 0.00 0.00 0.00 0.00 61.98 62.09 3cjp s VAL 94 Cb -0.10 -0.71 -0.12 0.00 0.00 0.00 0.00 36.38 35.44 3cjp s VAL 94 CO 0.20 0.27 1.44 -2.65 0.00 0.00 0.00 175.10 174.36 3cjp n PRO 95 N 4.10 2.33 -0.03 2.72 -0.02 -1.26 -4.90 135.00 137.94 3cjp n PRO 95 Ca -0.23 0.82 -0.13 0.00 -2.02 0.00 0.00 63.50 61.94 3cjp n PRO 95 Cb 0.51 -2.51 -0.10 0.00 -0.02 0.00 0.00 33.50 31.38 3cjp n PRO 95 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 3cjp h VAL 96 N 3.00 1.45 -1.00 -1.45 2.07 -1.93 -3.37 116.25 115.02 3cjp h VAL 96 Ca -0.46 -1.40 -0.53 0.00 0.82 0.00 0.00 66.70 65.12 3cjp h VAL 96 Cb 1.26 2.32 -0.31 0.00 -1.52 0.00 0.00 31.29 33.04 3cjp h VAL 96 CO 0.72 0.38 0.67 0.61 0.02 0.00 0.00 177.57 179.97 3cjp n GLY 97 N 0.47 4.59 3.91 2.17 0.00 -1.26 -4.50 105.19 110.57 3cjp n GLY 97 Ca -0.08 -1.17 -0.27 0.00 0.00 0.00 0.00 46.02 44.49 3cjp n GLY 97 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3cjp s LEU 98 N -3.33 3.11 0.90 0.99 1.43 -1.26 -5.07 118.68 115.46 3cjp s LEU 98 Ca 0.57 0.79 -0.11 0.00 -1.03 0.00 0.00 54.13 54.36 3cjp s LEU 98 Cb 0.48 -3.59 0.13 0.00 0.03 0.00 0.00 46.19 43.24 3cjp s LEU 98 CO 0.10 -1.18 1.10 -0.94 0.23 0.00 0.00 176.35 175.66 3cjp s SER 99 N -4.34 3.32 0.23 2.29 1.04 -1.26 -4.80 113.70 110.19 3cjp s SER 99 Ca 0.55 1.80 -0.07 0.00 0.48 0.00 0.00 55.95 58.71 3cjp s SER 99 Cb -0.11 -2.41 0.26 0.00 0.10 0.00 0.00 66.02 63.87 3cjp s SER 99 CO 0.47 -2.78 1.88 -0.08 0.98 0.00 0.00 173.24 173.71 3cjp h GLU 100 N -1.65 1.06 -0.28 4.02 4.81 -1.97 -0.83 114.58 119.74 3cjp h GLU 100 Ca -0.47 -0.06 -0.09 0.00 -0.13 0.00 0.00 59.36 58.61 3cjp h GLU 100 Cb 1.27 -0.24 -0.01 0.00 0.63 0.00 0.00 28.75 30.40 3cjp h GLU 100 CO 0.49 0.70 -0.17 -0.91 -0.73 0.00 0.00 179.01 178.39 3cjp h ASN 101 N 1.09 0.64 0.97 1.04 2.35 -2.00 -2.28 115.58 117.39 3cjp h ASN 101 Ca 0.34 -0.43 0.00 0.00 -0.55 0.00 0.00 56.30 55.67 3cjp h ASN 101 Cb -0.00 -0.18 0.00 0.00 0.05 0.00 0.00 38.32 38.19 3cjp h ASN 101 CO -0.11 0.93 0.00 0.44 -1.65 0.00 0.00 177.43 177.04 3cjp h ASP 102 N 0.35 0.00 0.03 5.81 5.19 -1.88 -2.77 116.42 123.16 3cjp h ASP 102 Ca 0.06 0.00 -0.08 0.00 -0.62 0.00 0.00 57.03 56.39 3cjp h ASP 102 Cb 0.71 0.00 -0.00 0.00 0.18 0.00 0.00 39.33 40.21 3cjp h ASP 102 CO 0.05 0.00 -0.41 0.74 -3.12 0.00 0.00 179.24 176.50 3cjp h THR 103 N 0.00 1.58 0.00 0.35 2.02 -1.01 -3.06 112.91 112.79 3cjp h THR 103 Ca 0.00 -2.36 -0.05 0.00 0.77 0.00 0.00 66.41 64.77 3cjp h THR 103 Cb 0.49 3.16 -0.01 0.00 -1.74 0.00 0.00 68.15 70.05 3cjp h THR 103 CO 0.00 0.59 -0.22 0.78 0.37 0.00 0.00 175.52 177.05 3cjp h ASN 104 N -0.84 0.00 0.06 4.18 2.35 -1.37 -0.90 115.58 119.05 3cjp h ASN 104 Ca -0.09 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 55.65 3cjp h ASN 104 Cb 1.21 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.58 3cjp h ASN 104 CO 0.00 0.22 -0.03 0.28 -1.65 0.00 0.00 177.43 176.25 3cjp h SER 105 N 0.00 -0.07 -0.39 5.81 0.02 -1.62 -2.18 113.55 115.12 3cjp h SER 105 Ca -0.00 -0.53 0.04 0.00 -0.84 0.00 0.00 61.79 60.47 3cjp h SER 105 Cb 0.51 0.02 -0.04 0.00 0.14 0.00 0.00 62.40 63.03 3cjp h SER 105 CO 0.03 0.53 0.15 0.22 -1.14 0.00 0.00 176.83 176.61 3cjp h TYR 106 N -0.70 0.26 -0.60 3.45 5.03 -1.39 -2.53 116.97 120.50 3cjp h TYR 106 Ca -0.01 0.02 -0.03 0.00 2.58 0.00 0.00 58.73 61.29 3cjp h TYR 106 Cb 0.59 -0.06 -0.03 0.00 1.55 0.00 0.00 36.73 38.78 3cjp h TYR 106 CO 0.12 0.11 0.24 0.82 -1.32 0.00 0.00 178.16 178.14 3cjp h ILE 107 N 0.31 1.23 0.35 1.81 2.04 -1.21 -0.42 117.51 121.62 3cjp h ILE 107 Ca 0.18 -0.70 -0.02 0.00 1.00 0.00 0.00 64.86 65.32 3cjp h ILE 107 Cb 0.15 0.57 0.00 0.00 -0.74 0.00 0.00 36.82 36.80 3cjp h ILE 107 CO -0.17 0.27 -0.17 -0.08 0.00 0.00 0.00 178.15 178.00 3cjp h GLU 108 N 0.83 -0.45 0.13 2.37 4.57 -1.21 0.12 114.58 120.94 3cjp h GLU 108 Ca 0.20 0.03 -0.01 0.00 -1.18 0.00 0.00 59.36 58.40 3cjp h GLU 108 Cb 0.19 0.10 0.00 0.00 -0.16 0.00 0.00 28.75 28.89 3cjp h GLU 108 CO -0.02 -0.26 -0.06 1.49 -1.18 0.00 0.00 179.01 178.98 3cjp h GLU 109 N -0.54 -0.17 0.00 1.92 4.81 -1.44 -1.83 114.58 117.33 3cjp h GLU 109 Ca -0.05 0.01 -0.32 0.00 -0.13 0.00 0.00 59.36 58.87 3cjp h GLU 109 Cb 0.40 0.04 -0.06 0.00 0.63 0.00 0.00 28.75 29.76 3cjp h GLU 109 CO 0.08 -0.09 -2.07 0.09 -0.73 0.00 0.00 179.01 176.29 3cjp n ASN 110 N -5.15 0.39 -0.06 1.04 3.02 -0.17 -3.95 115.26 110.37 3cjp n ASN 110 Ca -0.08 0.18 -0.06 0.00 -0.03 0.00 0.00 54.58 54.59 3cjp n ASN 110 Cb 0.11 0.55 -0.02 0.00 -0.61 0.00 0.00 39.78 39.81 3cjp n ASN 110 CO 0.00 0.00 0.00 -0.38 -2.62 0.00 0.00 177.26 174.26 3cjp n ILE 111 N -2.87 0.96 -0.05 2.41 2.08 0.37 -4.21 119.36 118.05 3cjp n ILE 111 Ca -0.25 0.27 -0.11 0.00 0.56 0.00 0.00 62.75 63.22 3cjp n ILE 111 Cb 1.10 -2.05 -0.05 0.00 -0.75 0.00 0.00 39.64 37.89 3cjp n ILE 111 CO 0.00 0.00 0.00 0.58 0.56 0.00 0.00 176.55 177.69 3cjp h VAL 112 N -0.64 1.14 -0.01 1.39 2.07 -1.45 -2.24 116.25 116.51 3cjp h VAL 112 Ca 0.00 -0.41 -0.03 0.00 0.82 0.00 0.00 66.70 67.08 3cjp h VAL 112 Cb 0.62 1.09 -0.00 0.00 -1.52 0.00 0.00 31.29 31.48 3cjp h VAL 112 CO 0.00 0.13 -0.13 0.78 0.02 0.00 0.00 177.57 178.37 3cjp h ASN 113 N 0.15 0.02 -0.33 0.57 2.35 -1.45 -2.19 115.58 114.69 3cjp h ASN 113 Ca 0.06 -0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.81 3cjp h ASN 113 Cb 0.14 -0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.51 3cjp h ASN 113 CO -0.01 0.15 0.00 0.59 -1.65 0.00 0.00 177.43 176.51 3cjp n ASN 114 N -4.37 1.83 -2.96 5.81 3.02 -1.06 -4.93 115.26 112.60 3cjp n ASN 114 Ca -0.02 -1.98 -0.20 0.00 -0.03 0.00 0.00 54.58 52.35 3cjp n ASN 114 Cb 0.21 -0.22 0.01 0.00 -0.61 0.00 0.00 39.78 39.16 3cjp n ASN 114 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 3cjp n LYS 115 N 0.49 -3.43 -2.68 3.52 5.02 -0.83 -4.97 118.16 115.28 3cjp n LYS 115 Ca 0.12 0.68 -0.33 0.00 -2.02 0.00 0.00 58.31 56.75 3cjp n LYS 115 Cb 0.29 -5.41 -0.05 0.00 -0.02 0.00 0.00 35.03 29.84 3cjp n LYS 115 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 3cjp s LEU 116 N -6.30 3.89 0.00 -0.35 1.43 -0.87 -4.89 118.68 111.59 3cjp s LEU 116 Ca 0.24 1.80 0.24 0.00 -1.03 0.00 0.00 54.13 55.38 3cjp s LEU 116 Cb -0.12 -4.55 0.42 0.00 0.03 0.00 0.00 46.19 41.98 3cjp s LEU 116 CO 0.30 -0.57 1.39 1.33 0.23 0.00 0.00 176.35 179.04 3cjp n VAL 117 N -0.83 0.28 -3.71 -1.59 0.24 -0.20 -4.77 118.33 107.74 3cjp n VAL 117 Ca 0.08 -0.59 -0.04 0.00 -2.04 0.00 0.00 64.34 61.75 3cjp n VAL 117 Cb 0.53 1.05 -0.01 0.00 -1.47 0.00 0.00 33.84 33.94 3cjp n VAL 117 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 3cjp s GLY 118 N -1.70 -0.27 -0.18 7.63 0.00 -1.24 -4.25 107.32 107.32 3cjp s GLY 118 Ca 0.35 0.27 -0.02 0.00 0.00 0.00 0.00 44.72 45.31 3cjp s GLY 118 CO 0.31 0.05 -0.08 -0.42 0.00 0.00 0.00 173.10 172.96 3cjp s ILE 119 N -3.23 3.31 0.00 0.90 1.01 0.48 -1.58 121.20 122.08 3cjp s ILE 119 Ca 0.11 -0.54 0.00 0.00 0.00 0.00 0.00 60.65 60.22 3cjp s ILE 119 Cb -0.01 -2.46 0.00 0.00 0.01 0.00 0.00 42.46 40.00 3cjp s ILE 119 CO 0.00 0.47 0.00 0.61 0.00 0.00 0.00 174.94 176.03 3cjp n GLY 120 N 4.18 0.50 3.59 6.18 0.00 -0.16 -0.57 105.19 118.91 3cjp n GLY 120 Ca -0.18 -1.16 -0.42 0.00 0.00 0.00 0.00 46.02 44.26 3cjp n GLY 120 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3cjp s GLU 121 N -2.00 3.77 0.32 1.61 2.12 -1.26 -1.53 118.70 121.72 3cjp s GLU 121 Ca 0.00 0.25 -0.29 0.00 0.36 0.00 0.00 54.97 55.29 3cjp s GLU 121 Cb 0.00 -3.79 -0.10 0.00 0.26 0.00 0.00 34.13 30.50 3cjp s GLU 121 CO 0.00 -0.75 1.24 -0.51 -0.54 0.00 0.00 175.26 174.70 3cjp s LEU 122 N 2.87 4.46 -0.54 2.70 1.43 0.10 -4.79 118.68 124.92 3cjp s LEU 122 Ca 0.28 2.55 0.07 0.00 -1.03 0.00 0.00 54.13 56.00 3cjp s LEU 122 Cb -0.14 -3.65 0.26 0.00 0.03 0.00 0.00 46.19 42.68 3cjp s LEU 122 CO 0.15 -0.42 0.67 0.35 0.23 0.00 0.00 176.35 177.33 3cjp n THR 123 N 0.90 1.17 -2.17 5.49 -2.24 -1.26 -0.01 114.28 116.16 3cjp n THR 123 Ca -0.00 -4.76 -0.37 0.00 -2.27 0.00 0.00 64.05 56.65 3cjp n THR 123 Cb 0.43 -1.97 0.00 0.00 -2.10 0.00 0.00 70.33 66.69 3cjp n THR 123 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 3cjp s PRO 124 N -2.03 3.54 0.60 -0.78 0.04 -1.26 -4.09 135.00 131.02 3cjp s PRO 124 Ca 0.38 1.82 -0.15 0.00 0.04 0.00 0.00 61.00 63.10 3cjp s PRO 124 Cb 0.17 -2.28 -0.03 0.00 0.04 0.00 0.00 34.50 32.39 3cjp s PRO 124 CO -0.05 -0.75 1.05 0.00 0.04 0.00 0.00 177.00 177.29 3cjp s ALA 125 N -1.55 2.76 0.22 8.56 0.00 -1.26 -4.69 121.76 125.81 3cjp s ALA 125 Ca 0.67 0.32 -0.32 0.00 0.00 0.00 0.00 51.96 52.64 3cjp s ALA 125 Cb -0.30 -3.21 -0.14 0.00 0.00 0.00 0.00 23.12 19.47 3cjp s ALA 125 CO 0.35 -0.83 1.39 0.45 0.00 0.00 0.00 175.76 177.11 3cjp n SER 126 N -2.19 2.57 0.00 0.00 2.88 -1.26 -1.52 113.62 114.11 3cjp n SER 126 Ca 0.08 1.14 0.00 0.00 -1.33 0.00 0.00 58.87 58.76 3cjp n SER 126 Cb 0.53 -1.40 0.00 0.00 -0.75 0.00 0.00 64.21 62.59 3cjp n SER 126 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3cjp n GLY 127 N 2.23 1.21 0.87 0.46 0.00 -1.26 -4.92 105.19 103.79 3cjp n GLY 127 Ca 0.13 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.23 3cjp n GLY 127 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3cjp n GLN 128 N -2.00 2.80 -0.10 1.61 1.13 -0.57 -4.67 117.38 115.58 3cjp n GLN 128 Ca 0.00 -2.85 -0.00 0.00 -1.94 0.00 0.00 57.00 52.21 3cjp n GLN 128 Cb 0.00 -1.83 0.28 0.00 0.11 0.00 0.00 30.24 28.79 3cjp n GLN 128 CO 0.00 0.00 0.00 0.82 -1.44 0.00 0.00 177.06 176.44 3cjp h ILE 129 N 1.69 1.19 0.00 5.09 1.08 -1.92 -2.06 117.51 122.58 3cjp h ILE 129 Ca 0.01 -0.57 -0.01 0.00 -0.39 0.00 0.00 64.86 63.90 3cjp h ILE 129 Cb 1.44 0.55 -0.00 0.00 -3.07 0.00 0.00 36.82 35.74 3cjp h ILE 129 CO 0.22 0.23 -0.06 0.11 -0.69 0.00 0.00 178.15 177.96 3cjp h LYS 130 N 0.74 0.00 0.00 2.37 1.57 -1.93 -1.57 116.57 117.74 3cjp h LYS 130 Ca 0.18 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.96 3cjp h LYS 130 Cb 0.13 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.44 3cjp h LYS 130 CO -0.02 0.06 0.00 0.66 -0.57 0.00 0.00 179.45 179.58 3cjp h SER 131 N 0.00 0.00 0.73 0.86 4.64 -1.72 -2.11 113.55 115.96 3cjp h SER 131 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3cjp h SER 131 Cb 0.13 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.22 3cjp h SER 131 CO 0.01 0.00 0.00 0.18 -0.87 0.00 0.00 176.83 176.15 3cjp n LEU 132 N -2.37 0.08 -0.18 5.97 4.77 -0.59 -4.25 117.00 120.42 3cjp n LEU 132 Ca -0.01 0.51 -0.01 0.00 -0.03 0.00 0.00 56.01 56.48 3cjp n LEU 132 Cb 0.10 -0.50 0.09 0.00 -2.33 0.00 0.00 43.42 40.78 3cjp n LEU 132 CO 0.14 -0.18 0.89 0.50 -1.33 0.00 0.00 177.39 177.41 3cjp h LYS 133 N 0.00 0.20 -0.99 3.23 3.64 -1.58 -1.05 116.57 120.02 3cjp h LYS 133 Ca 0.00 -0.01 0.19 0.00 -1.27 0.00 0.00 60.65 59.56 3cjp h LYS 133 Cb 0.37 -0.05 -0.10 0.00 -0.41 0.00 0.00 32.23 32.05 3cjp h LYS 133 CO 0.00 0.13 0.61 -1.35 -2.27 0.00 0.00 179.45 176.58 3cjp h PRO 134 N 0.21 0.69 -0.30 1.90 0.11 -1.86 0.40 132.00 133.15 3cjp h PRO 134 Ca 0.29 -0.04 -0.06 0.00 0.11 0.00 0.00 66.00 66.29 3cjp h PRO 134 Cb 0.42 -0.16 -0.01 0.00 0.11 0.00 0.00 31.00 31.37 3cjp h PRO 134 CO -0.40 0.46 -0.06 0.82 -0.21 0.00 0.00 178.00 178.61 3cjp h ILE 135 N 0.71 1.28 -0.82 4.15 2.04 -1.50 0.27 117.51 123.65 3cjp h ILE 135 Ca 0.55 -1.08 0.02 0.00 1.00 0.00 0.00 64.86 65.35 3cjp h ILE 135 Cb 0.93 1.37 -0.04 0.00 -0.74 0.00 0.00 36.82 38.33 3cjp h ILE 135 CO -0.33 0.35 0.54 -0.26 0.00 0.00 0.00 178.15 178.44 3cjp h PHE 136 N 0.35 1.01 -0.19 1.37 -1.00 -1.13 -0.98 116.94 116.36 3cjp h PHE 136 Ca 0.08 0.02 0.01 0.00 2.81 0.00 0.00 57.97 60.89 3cjp h PHE 136 Cb 0.54 -0.34 -0.01 0.00 3.61 0.00 0.00 35.95 39.75 3cjp h PHE 136 CO 0.05 0.62 0.11 0.87 -1.61 0.00 0.00 178.31 178.35 3cjp h LYS 137 N 1.08 0.23 -0.29 1.51 1.57 -0.62 -1.54 116.57 118.50 3cjp h LYS 137 Ca 0.31 -0.01 -0.04 0.00 -1.87 0.00 0.00 60.65 59.03 3cjp h LYS 137 Cb -0.08 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.17 3cjp h LYS 137 CO -0.08 0.15 0.01 -0.92 -0.57 0.00 0.00 179.45 178.04 3cjp h TYR 138 N 0.23 0.55 -0.67 -1.35 3.20 -0.68 -2.58 116.97 115.67 3cjp h TYR 138 Ca 0.08 -0.09 0.07 0.00 3.14 0.00 0.00 58.73 61.93 3cjp h TYR 138 Cb -0.01 -0.15 -0.04 0.00 1.54 0.00 0.00 36.73 38.08 3cjp h TYR 138 CO -0.08 0.64 0.44 1.03 -1.64 0.00 0.00 178.16 178.56 3cjp h SER 139 N 0.31 0.57 0.42 -2.11 0.87 -1.09 0.17 113.55 112.68 3cjp h SER 139 Ca 0.08 0.01 -0.06 0.00 -1.23 0.00 0.00 61.79 60.59 3cjp h SER 139 Cb 0.41 -0.12 -0.01 0.00 -0.44 0.00 0.00 62.40 62.25 3cjp h SER 139 CO 0.01 0.36 -0.30 -0.03 -0.53 0.00 0.00 176.83 176.34 3cjp h MET 140 N 0.64 0.00 0.00 2.24 1.85 -0.93 -0.22 114.93 118.51 3cjp h MET 140 Ca 0.30 0.00 -0.25 0.00 -0.61 0.00 0.00 59.70 59.14 3cjp h MET 140 Cb 0.33 0.00 -0.04 0.00 0.43 0.00 0.00 31.60 32.32 3cjp h MET 140 CO -0.10 0.30 -1.79 -0.40 -0.40 0.00 0.00 176.91 174.52 3cjp n ASP 141 N -3.95 0.59 -2.43 1.39 5.68 0.02 -4.66 116.55 113.20 3cjp n ASP 141 Ca -0.02 0.27 0.00 0.00 -0.50 0.00 0.00 54.79 54.54 3cjp n ASP 141 Cb 0.37 0.43 0.00 0.00 -1.14 0.00 0.00 41.12 40.77 3cjp n ASP 141 CO 0.00 0.00 0.00 -0.24 -1.33 0.00 0.00 177.20 175.63 3cjp n SER 142 N -2.86 0.00 -1.22 -1.12 2.88 0.37 -4.90 113.62 106.77 3cjp n SER 142 Ca -0.17 0.00 -0.04 0.00 -1.33 0.00 0.00 58.87 57.33 3cjp n SER 142 Cb 0.97 0.00 0.03 0.00 -0.75 0.00 0.00 64.21 64.46 3cjp n SER 142 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3cjp n GLY 143 N 5.00 2.43 3.94 0.46 0.00 -1.25 -4.77 105.19 111.01 3cjp n GLY 143 Ca 0.00 -0.18 -0.39 0.00 0.00 0.00 0.00 46.02 45.45 3cjp n GLY 143 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3cjp n SER 144 N 0.28 -4.53 -4.72 1.61 3.41 -0.10 -4.91 113.62 104.65 3cjp n SER 144 Ca 0.10 -1.16 -0.42 0.00 -0.26 0.00 0.00 58.87 57.12 3cjp n SER 144 Cb 0.68 -1.91 -0.03 0.00 -0.26 0.00 0.00 64.21 62.69 3cjp n SER 144 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 3cjp s LEU 145 N -6.63 4.37 0.53 1.04 2.01 -1.24 -4.59 118.68 114.17 3cjp s LEU 145 Ca 0.35 2.64 -0.21 0.00 0.01 0.00 0.00 54.13 56.91 3cjp s LEU 145 Cb -0.18 -3.59 -0.06 0.00 0.01 0.00 0.00 46.19 42.36 3cjp s LEU 145 CO 0.94 -0.84 1.18 -2.65 1.01 0.00 0.00 176.35 175.98 3cjp n PRO 146 N 4.08 1.41 -4.90 1.29 -0.02 -1.26 -4.61 135.00 130.99 3cjp n PRO 146 Ca 0.14 0.52 -0.33 0.00 -2.02 0.00 0.00 63.50 61.82 3cjp n PRO 146 Cb 0.38 -2.35 -0.15 0.00 -0.02 0.00 0.00 33.50 31.36 3cjp n PRO 146 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 3cjp s ILE 147 N -1.35 2.79 -0.19 4.25 1.01 -0.00 -0.39 121.20 127.32 3cjp s ILE 147 Ca 0.71 -0.76 0.00 0.00 0.00 0.00 0.00 60.65 60.60 3cjp s ILE 147 Cb -0.45 -2.14 0.02 0.00 0.01 0.00 0.00 42.46 39.90 3cjp s ILE 147 CO 0.50 0.54 -0.17 0.86 0.00 0.00 0.00 174.94 176.67 3cjp s TRP 148 N 0.29 2.82 -0.12 3.97 -0.00 0.26 -0.56 118.94 125.60 3cjp s TRP 148 Ca -0.12 -1.52 0.03 0.00 -0.00 0.00 0.00 56.10 54.49 3cjp s TRP 148 Cb -0.16 -1.96 0.01 0.00 -0.00 0.00 0.00 33.47 31.36 3cjp s TRP 148 CO 0.06 -0.76 -0.21 0.42 -0.00 0.00 0.00 176.95 176.46 3cjp s ILE 149 N 1.32 1.93 0.05 5.86 1.01 -0.53 -0.72 121.20 130.12 3cjp s ILE 149 Ca 0.05 -0.91 -0.32 0.00 0.00 0.00 0.00 60.65 59.47 3cjp s ILE 149 Cb -0.13 -1.70 -0.11 0.00 0.01 0.00 0.00 42.46 40.52 3cjp s ILE 149 CO -0.11 0.53 1.85 1.57 0.00 0.00 0.00 174.94 178.78 3cjp n HIS 150 N 3.95 2.47 -1.22 3.97 -0.00 0.99 -0.70 115.22 124.68 3cjp n HIS 150 Ca -0.20 -0.11 0.02 0.00 -0.00 0.00 0.00 57.72 57.44 3cjp n HIS 150 Cb 0.52 -2.71 0.03 0.00 -0.00 0.00 0.00 29.99 27.84 3cjp n HIS 150 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 3cjp n ALA 151 N 6.11 1.83 -1.47 1.57 0.00 -1.17 -4.77 120.51 122.62 3cjp n ALA 151 Ca 0.20 -1.29 -0.11 0.00 0.00 0.00 0.00 53.44 52.24 3cjp n ALA 151 Cb 0.35 -0.27 0.11 0.00 0.00 0.00 0.00 19.45 19.63 3cjp n ALA 151 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 3cjp n PHE 152 N -0.44 -3.99 -1.47 0.00 7.35 -1.25 -3.42 117.46 114.25 3cjp n PHE 152 Ca 0.04 -0.61 -0.46 0.00 -0.76 0.00 0.00 57.45 55.66 3cjp n PHE 152 Cb 0.57 -0.53 -0.02 0.00 0.35 0.00 0.00 39.48 39.84 3cjp n PHE 152 CO 0.00 0.00 0.00 0.09 -0.76 0.00 0.00 176.76 176.09 3cjp n ASN 153 N -3.45 -0.39 -1.06 -2.13 5.03 -1.26 -1.78 115.26 110.21 3cjp n ASN 153 Ca 0.09 1.11 0.09 0.00 0.87 0.00 0.00 54.58 56.74 3cjp n ASN 153 Cb 0.30 -1.08 0.25 0.00 -1.02 0.00 0.00 39.78 38.23 3cjp n ASN 153 CO 0.00 0.00 0.00 -0.81 -1.83 0.00 0.00 177.26 174.62 3cjp n PRO 154 N 0.88 2.34 -1.79 3.52 -0.04 -1.26 -4.90 135.00 133.75 3cjp n PRO 154 Ca 0.14 -2.07 -0.41 0.00 -0.04 0.00 0.00 63.50 61.12 3cjp n PRO 154 Cb 0.29 -1.45 -0.02 0.00 -0.04 0.00 0.00 33.50 32.29 3cjp n PRO 154 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 3cjp s LEU 155 N -1.00 4.35 0.52 1.53 1.43 -0.74 -4.59 118.68 120.18 3cjp s LEU 155 Ca 0.38 2.94 0.06 0.00 -1.03 0.00 0.00 54.13 56.49 3cjp s LEU 155 Cb 0.20 -3.63 0.03 0.00 0.03 0.00 0.00 46.19 42.82 3cjp s LEU 155 CO 0.26 -0.91 0.44 0.68 0.23 0.00 0.00 176.35 177.06 3cjp s VAL 156 N 0.03 1.92 0.26 -1.59 -7.23 -1.26 -4.84 120.40 107.68 3cjp s VAL 156 Ca 0.63 -1.41 -0.03 0.00 -1.81 0.00 0.00 61.98 59.37 3cjp s VAL 156 Cb -0.48 -2.32 0.25 0.00 0.56 0.00 0.00 36.38 34.39 3cjp s VAL 156 CO 0.47 0.00 1.68 0.25 -0.31 0.00 0.00 175.10 177.20 3cjp h LEU 157 N 0.75 0.07 -0.83 1.32 5.85 -1.95 -2.23 115.31 118.28 3cjp h LEU 157 Ca -0.37 0.15 -0.03 0.00 0.84 0.00 0.00 57.88 58.48 3cjp h LEU 157 Cb 1.29 0.19 -0.04 0.00 0.37 0.00 0.00 40.66 42.48 3cjp h LEU 157 CO 0.55 -0.04 0.41 -0.61 -0.34 0.00 0.00 178.44 178.41 3cjp h GLN 158 N 0.29 1.19 -0.93 1.25 5.75 -1.99 -0.82 115.11 119.86 3cjp h GLN 158 Ca 0.46 -0.17 0.03 0.00 -0.15 0.00 0.00 58.65 58.82 3cjp h GLN 158 Cb 0.81 -0.22 -0.05 0.00 1.07 0.00 0.00 27.48 29.10 3cjp h GLN 158 CO -0.53 0.91 0.61 -0.44 -2.65 0.00 0.00 178.83 176.73 3cjp h ASP 159 N 1.18 1.03 -0.01 -0.69 3.32 -1.81 -0.43 116.42 119.01 3cjp h ASP 159 Ca 0.29 -0.02 -0.00 0.00 0.02 0.00 0.00 57.03 57.32 3cjp h ASP 159 Cb 0.10 -0.24 -0.00 0.00 0.22 0.00 0.00 39.33 39.41 3cjp h ASP 159 CO -0.04 0.72 0.00 0.40 -1.72 0.00 0.00 179.24 178.60 3cjp h ILE 160 N 1.20 1.16 -0.91 0.35 1.08 -0.97 -0.75 117.51 118.67 3cjp h ILE 160 Ca 0.36 -0.48 0.14 0.00 -0.39 0.00 0.00 64.86 64.49 3cjp h ILE 160 Cb -0.04 1.47 -0.07 0.00 -3.07 0.00 0.00 36.82 35.11 3cjp h ILE 160 CO -0.10 0.12 0.58 0.11 -0.69 0.00 0.00 178.15 178.18 3cjp h LYS 161 N -0.19 0.74 -0.11 2.37 1.57 -0.85 -1.92 116.57 118.18 3cjp h LYS 161 Ca 0.00 -0.04 -0.17 0.00 -1.87 0.00 0.00 60.65 58.57 3cjp h LYS 161 Cb 0.20 -0.17 -0.01 0.00 0.08 0.00 0.00 32.23 32.34 3cjp h LYS 161 CO -0.00 0.49 -0.65 0.93 -0.57 0.00 0.00 179.45 179.65 3cjp h GLU 162 N 0.76 0.43 -0.33 3.15 5.08 -0.74 -2.35 114.58 120.59 3cjp h GLU 162 Ca 0.46 -0.31 0.00 0.00 -1.00 0.00 0.00 59.36 58.51 3cjp h GLU 162 Cb 0.66 0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.95 3cjp h GLU 162 CO -0.22 0.94 0.21 0.82 -1.00 0.00 0.00 179.01 179.76 3cjp h ILE 163 N 0.31 1.08 -0.62 3.13 2.04 -0.56 -2.12 117.51 120.77 3cjp h ILE 163 Ca -0.01 -0.15 0.09 0.00 1.00 0.00 0.00 64.86 65.78 3cjp h ILE 163 Cb 1.20 0.60 -0.07 0.00 -0.74 0.00 0.00 36.82 37.81 3cjp h ILE 163 CO 0.11 0.08 0.26 0.00 0.00 0.00 0.00 178.15 178.60 3cjp h ALA 164 N 1.12 0.82 -0.90 1.87 0.00 -1.16 -0.30 119.26 120.70 3cjp h ALA 164 Ca 0.12 0.07 0.07 0.00 0.00 0.00 0.00 54.91 55.17 3cjp h ALA 164 Cb -0.05 0.02 -0.07 0.00 0.00 0.00 0.00 17.79 17.70 3cjp h ALA 164 CO -0.03 -0.15 0.57 0.93 0.00 0.00 0.00 179.25 180.56 3cjp h GLU 165 N 0.45 0.99 -0.68 0.00 4.39 -1.13 -1.04 114.58 117.56 3cjp h GLU 165 Ca 0.31 -0.06 -0.04 0.00 0.34 0.00 0.00 59.36 59.91 3cjp h GLU 165 Cb 0.36 -0.22 -0.03 0.00 -0.10 0.00 0.00 28.75 28.76 3cjp h GLU 165 CO -0.29 0.65 0.26 -0.07 -1.16 0.00 0.00 179.01 178.40 3cjp h LEU 166 N 1.02 0.93 -0.35 1.33 3.38 -0.45 -0.72 115.31 120.45 3cjp h LEU 166 Ca 0.40 -0.14 0.01 0.00 0.09 0.00 0.00 57.88 58.24 3cjp h LEU 166 Cb 0.20 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.69 3cjp h LEU 166 CO -0.18 0.84 0.22 0.00 0.09 0.00 0.00 178.44 179.41 3cjp h LYS 168 N 0.46 0.54 0.00 0.00 1.57 -0.65 -2.12 116.57 116.37 3cjp h LYS 168 Ca 0.13 -0.13 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3cjp h LYS 168 Cb -0.03 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 32.21 3cjp h LYS 168 CO -0.04 0.60 0.00 0.00 -0.57 0.00 0.00 179.45 179.44 3cjp h ALA 169 N 1.44 1.00 -2.08 3.86 0.00 -0.81 -3.33 119.26 119.34 3cjp h ALA 169 Ca 0.10 0.00 -0.55 0.00 0.00 0.00 0.00 54.91 54.46 3cjp h ALA 169 Cb 0.41 0.00 -0.40 0.00 0.00 0.00 0.00 17.79 17.80 3cjp h ALA 169 CO 0.02 0.00 -0.97 1.19 0.00 0.00 0.00 179.25 179.49 3cjp n PHE 170 N -2.86 1.25 0.31 0.00 3.01 -0.75 -4.98 117.46 113.43 3cjp n PHE 170 Ca 0.02 -3.82 0.17 0.00 1.01 0.00 0.00 57.45 54.83 3cjp n PHE 170 Cb 0.33 -0.43 1.01 0.00 -0.01 0.00 0.00 39.48 40.38 3cjp n PHE 170 CO 0.00 0.00 0.00 -1.00 1.01 0.00 0.00 176.76 176.77 3cjp h PRO 171 N 3.56 0.00 0.00 -1.08 0.13 -1.61 -1.53 132.00 131.47 3cjp h PRO 171 Ca 0.11 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.24 3cjp h PRO 171 Cb 0.81 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.94 3cjp h PRO 171 CO 0.60 0.00 -0.20 1.63 -0.23 0.00 0.00 178.00 179.80 3cjp n LYS 172 N -3.63 0.06 -2.99 0.86 5.02 -1.26 -4.60 118.16 111.61 3cjp n LYS 172 Ca -0.03 0.03 -0.43 0.00 -2.02 0.00 0.00 58.31 55.87 3cjp n LYS 172 Cb 0.08 -1.55 -0.06 0.00 -0.02 0.00 0.00 35.03 33.48 3cjp n LYS 172 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 3cjp s VAL 173 N -3.03 4.73 0.35 -0.18 1.01 -0.58 -4.88 120.40 117.83 3cjp s VAL 173 Ca 0.12 0.59 -0.27 0.00 0.00 0.00 0.00 61.98 62.42 3cjp s VAL 173 Cb 0.17 -4.24 -0.09 0.00 0.00 0.00 0.00 36.38 32.22 3cjp s VAL 173 CO 0.60 -0.55 1.22 -2.84 0.00 0.00 0.00 175.10 173.54 3cjp s PRO 174 N 3.10 4.26 -0.06 2.72 0.02 -1.26 -4.87 135.00 138.91 3cjp s PRO 174 Ca 0.29 2.01 0.02 0.00 0.02 0.00 0.00 61.00 63.35 3cjp s PRO 174 Cb -0.13 -2.92 0.01 0.00 0.02 0.00 0.00 34.50 31.48 3cjp s PRO 174 CO 0.19 -0.20 -0.12 0.08 -0.33 0.00 0.00 177.00 176.62 3cjp s VAL 175 N -1.25 1.14 -0.22 3.83 1.01 -0.31 -0.82 120.40 123.79 3cjp s VAL 175 Ca 0.52 -0.49 -0.04 0.00 0.00 0.00 0.00 61.98 61.97 3cjp s VAL 175 Cb -0.35 -1.04 -0.01 0.00 0.00 0.00 0.00 36.38 34.98 3cjp s VAL 175 CO 0.46 0.36 -0.04 -0.63 0.00 0.00 0.00 175.10 175.24 3cjp s ILE 176 N 0.61 3.38 -0.50 2.22 1.01 0.27 -0.61 121.20 127.59 3cjp s ILE 176 Ca -0.14 -0.51 -0.24 0.00 0.00 0.00 0.00 60.65 59.77 3cjp s ILE 176 Cb -0.15 -2.55 0.04 0.00 0.01 0.00 0.00 42.46 39.80 3cjp s ILE 176 CO 0.04 0.41 0.86 -0.22 0.00 0.00 0.00 174.94 176.02 3cjp s LEU 177 N 1.48 4.21 0.17 2.97 2.96 0.45 -1.46 118.68 129.47 3cjp s LEU 177 Ca 0.06 -0.26 -0.33 0.00 -0.22 0.00 0.00 54.13 53.37 3cjp s LEU 177 Cb -0.14 -2.89 -0.14 0.00 0.50 0.00 0.00 46.19 43.52 3cjp s LEU 177 CO -0.03 -1.07 1.58 0.61 -1.32 0.00 0.00 176.35 176.12 3cjp n GLY 178 N 5.05 1.14 2.37 7.98 0.00 0.12 -0.73 105.19 121.14 3cjp n GLY 178 Ca 0.02 0.64 -0.15 0.00 0.00 0.00 0.00 46.02 46.53 3cjp n GLY 178 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 3cjp n HIS 179 N 3.35 -0.28 -1.41 1.61 8.25 -1.15 -2.30 115.22 123.28 3cjp n HIS 179 Ca 0.16 0.00 -0.14 0.00 -0.26 0.00 0.00 57.72 57.48 3cjp n HIS 179 Cb 0.30 -2.81 -0.06 0.00 1.12 0.00 0.00 29.99 28.53 3cjp n HIS 179 CO 0.00 0.00 0.00 -1.33 0.64 0.00 0.00 176.34 175.65 3cjp n MET 180 N -2.51 -1.34 -1.14 -0.41 0.00 -0.09 -1.52 117.12 110.10 3cjp n MET 180 Ca -0.16 0.98 -0.05 0.00 0.00 0.00 0.00 57.70 58.48 3cjp n MET 180 Cb 0.54 -5.25 -0.02 0.00 0.00 0.00 0.00 33.22 28.50 3cjp n MET 180 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 3cjp n GLY 181 N -0.52 0.74 7.00 3.03 0.00 -0.97 -3.67 105.19 110.80 3cjp n GLY 181 Ca -0.14 -0.53 0.00 0.00 0.00 0.00 0.00 46.02 45.35 3cjp n GLY 181 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3cjp n GLY 182 N -2.03 3.26 0.00 -0.02 0.00 -0.58 -1.28 105.19 104.54 3cjp n GLY 182 Ca -0.05 -0.16 0.08 0.00 0.00 0.00 0.00 46.02 45.88 3cjp n GLY 182 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3cjp n SER 183 N 5.23 0.00 -1.61 1.61 7.64 -1.26 -2.36 113.62 122.87 3cjp n SER 183 Ca 0.00 0.45 0.04 0.00 1.01 0.00 0.00 58.87 60.38 3cjp n SER 183 Cb 0.00 -0.48 0.31 0.00 -1.01 0.00 0.00 64.21 63.03 3cjp n SER 183 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 3cjp n ASN 184 N -1.48 4.65 0.26 6.43 4.13 -0.40 -4.62 115.26 124.23 3cjp n ASN 184 Ca 0.04 -2.75 0.09 0.00 1.68 0.00 0.00 54.58 53.64 3cjp n ASN 184 Cb 0.18 -0.65 0.67 0.00 -1.54 0.00 0.00 39.78 38.44 3cjp n ASN 184 CO 0.00 0.00 0.00 4.11 0.28 0.00 0.00 177.26 181.65 3cjp h TRP 185 N 3.00 0.00 -0.20 3.10 5.08 -1.54 -1.61 115.95 123.77 3cjp h TRP 185 Ca 0.02 0.00 -0.02 0.00 1.08 0.00 0.00 58.89 59.98 3cjp h TRP 185 Cb 1.70 0.00 -0.01 0.00 -3.00 0.00 0.00 29.16 27.85 3cjp h TRP 185 CO 0.88 0.00 0.06 0.52 -1.28 0.00 0.00 178.44 178.62 3cjp h MET 186 N 0.00 0.32 -0.27 0.12 2.86 -1.87 -0.31 114.93 115.78 3cjp h MET 186 Ca -0.00 -0.07 -0.06 0.00 -2.06 0.00 0.00 59.70 57.51 3cjp h MET 186 Cb 0.01 -0.04 -0.01 0.00 0.06 0.00 0.00 31.60 31.61 3cjp h MET 186 CO 0.00 0.42 -0.06 1.15 1.06 0.00 0.00 176.91 179.48 3cjp h THR 187 N 0.15 1.28 -0.69 2.22 2.02 -1.83 -2.80 112.91 113.26 3cjp h THR 187 Ca 0.06 -1.08 0.12 0.00 0.77 0.00 0.00 66.41 66.29 3cjp h THR 187 Cb 0.24 1.44 -0.09 0.00 -1.74 0.00 0.00 68.15 68.00 3cjp h THR 187 CO -0.00 0.34 0.24 0.00 0.37 0.00 0.00 175.52 176.47 3cjp h ALA 188 N 0.77 0.92 -0.08 6.16 0.00 -1.22 -0.71 119.26 125.10 3cjp h ALA 188 Ca 0.07 0.11 -0.18 0.00 0.00 0.00 0.00 54.91 54.91 3cjp h ALA 188 Cb 0.54 0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.42 3cjp h ALA 188 CO 0.03 -0.23 -0.71 -0.24 0.00 0.00 0.00 179.25 178.10 3cjp h VAL 189 N 0.39 1.38 -0.63 0.00 3.04 -1.04 -0.68 116.25 118.72 3cjp h VAL 189 Ca 0.37 -2.11 0.00 0.00 -1.01 0.00 0.00 66.70 63.95 3cjp h VAL 189 Cb 0.54 2.08 -0.03 0.00 -2.01 0.00 0.00 31.29 31.87 3cjp h VAL 189 CO -0.38 0.63 0.40 -0.33 -1.01 0.00 0.00 177.57 176.88 3cjp h GLU 190 N 0.27 0.84 -0.38 4.17 5.08 -1.12 -1.73 114.58 121.71 3cjp h GLU 190 Ca -0.03 -0.06 -0.06 0.00 -1.00 0.00 0.00 59.36 58.22 3cjp h GLU 190 Cb 1.27 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 30.33 3cjp h GLU 190 CO 0.12 0.57 0.02 -0.07 -1.00 0.00 0.00 179.01 178.65 3cjp h LEU 191 N 0.85 0.64 -1.11 1.33 3.38 -0.91 -2.55 115.31 116.95 3cjp h LEU 191 Ca 0.23 -0.29 -0.09 0.00 0.09 0.00 0.00 57.88 57.81 3cjp h LEU 191 Cb -0.07 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.50 3cjp h LEU 191 CO -0.05 0.78 -0.37 0.00 0.09 0.00 0.00 178.44 178.90 3cjp h ALA 192 N 0.89 1.25 -0.51 1.53 0.00 -1.07 0.12 119.26 121.47 3cjp h ALA 192 Ca 0.11 -0.36 -0.05 0.00 0.00 0.00 0.00 54.91 54.61 3cjp h ALA 192 Cb 0.44 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.13 3cjp h ALA 192 CO 0.02 0.52 0.14 -0.22 0.00 0.00 0.00 179.25 179.71 3cjp h LYS 193 N 0.13 0.81 0.00 0.00 3.64 -1.17 -3.29 116.57 116.69 3cjp h LYS 193 Ca 0.01 -0.19 -0.17 0.00 -1.27 0.00 0.00 60.65 59.04 3cjp h LYS 193 Cb 0.71 -0.11 -0.03 0.00 -0.41 0.00 0.00 32.23 32.40 3cjp h LYS 193 CO 0.05 0.77 -0.97 1.49 -2.27 0.00 0.00 179.45 178.52 3cjp h GLU 194 N 0.71 0.00 -4.81 1.90 4.81 -1.02 -3.45 114.58 112.73 3cjp h GLU 194 Ca 0.16 0.00 -0.68 0.00 -0.13 0.00 0.00 59.36 58.72 3cjp h GLU 194 Cb 0.31 0.00 -0.27 0.00 0.63 0.00 0.00 28.75 29.43 3cjp h GLU 194 CO -0.00 0.60 -0.63 0.42 -0.73 0.00 0.00 179.01 178.67 3cjp s ILE 195 N -2.84 3.85 0.31 2.32 1.01 0.39 -5.01 121.20 121.23 3cjp s ILE 195 Ca 0.01 -0.75 0.04 0.00 0.00 0.00 0.00 60.65 59.95 3cjp s ILE 195 Cb 0.09 -2.99 0.37 0.00 0.01 0.00 0.00 42.46 39.93 3cjp s ILE 195 CO 0.79 0.08 1.60 -0.61 0.00 0.00 0.00 174.94 176.80 3cjp h GLN 196 N 8.21 0.07 -0.26 2.79 4.15 -1.87 -2.69 115.11 125.52 3cjp h GLN 196 Ca -0.31 -0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.10 3cjp h GLN 196 Cb 1.12 -0.02 0.00 0.00 0.21 0.00 0.00 27.48 28.80 3cjp h GLN 196 CO 0.60 0.05 0.00 0.27 -1.93 0.00 0.00 178.83 177.82 3cjp n ASN 197 N -5.37 2.91 -4.59 -0.69 6.94 -1.26 -4.89 115.26 108.31 3cjp n ASN 197 Ca 0.24 -1.91 -0.37 0.00 -0.02 0.00 0.00 54.58 52.52 3cjp n ASN 197 Cb 0.79 -0.16 -0.11 0.00 -2.36 0.00 0.00 39.78 37.95 3cjp n ASN 197 CO 0.00 0.00 0.00 -0.22 -1.03 0.00 0.00 177.26 176.01 3cjp s LEU 198 N -1.63 3.93 0.34 -4.53 2.96 -1.02 -1.16 118.68 117.58 3cjp s LEU 198 Ca 0.35 -0.00 0.09 0.00 -0.22 0.00 0.00 54.13 54.35 3cjp s LEU 198 Cb 0.21 -2.07 -0.05 0.00 0.50 0.00 0.00 46.19 44.78 3cjp s LEU 198 CO 0.30 0.01 0.04 -0.31 -1.32 0.00 0.00 176.35 175.07 3cjp s TYR 199 N 1.40 2.58 -0.13 5.38 1.51 0.22 -4.72 117.35 123.60 3cjp s TYR 199 Ca 0.07 -0.42 0.03 0.00 -1.01 0.00 0.00 57.07 55.73 3cjp s TYR 199 Cb -0.15 -1.52 0.00 0.00 -0.11 0.00 0.00 41.96 40.19 3cjp s TYR 199 CO 0.07 0.45 -0.21 -0.51 -1.11 0.00 0.00 175.55 174.24 3cjp s LEU 200 N -3.74 2.18 0.22 -1.29 1.43 -0.58 -0.41 118.68 116.49 3cjp s LEU 200 Ca 0.35 -0.56 -0.30 0.00 -1.03 0.00 0.00 54.13 52.60 3cjp s LEU 200 Cb -0.01 -1.46 -0.08 0.00 0.03 0.00 0.00 46.19 44.67 3cjp s LEU 200 CO 0.20 0.12 0.97 -0.62 0.23 0.00 0.00 176.35 177.24 3cjp s ASP 201 N 0.61 7.57 0.00 2.29 2.15 0.10 -0.58 116.67 128.80 3cjp s ASP 201 Ca -0.12 1.96 0.26 0.00 0.43 0.00 0.00 52.55 55.09 3cjp s ASP 201 Cb -0.16 -2.61 0.72 0.00 -0.30 0.00 0.00 42.92 40.56 3cjp s ASP 201 CO 0.03 0.08 1.56 0.35 -0.17 0.00 0.00 175.17 177.02 3cjp n THR 202 N 1.71 0.00 -1.88 1.71 -2.24 -0.71 -0.91 114.28 111.96 3cjp n THR 202 Ca -0.01 -0.00 -0.37 0.00 -2.27 0.00 0.00 64.05 61.39 3cjp n THR 202 Cb 0.47 0.03 0.04 0.00 -2.10 0.00 0.00 70.33 68.77 3cjp n THR 202 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 3cjp s SER 203 N -3.01 5.25 -1.55 3.42 1.04 -1.22 -3.03 113.70 114.59 3cjp s SER 203 Ca 0.12 2.61 -0.05 0.00 0.48 0.00 0.00 55.95 59.11 3cjp s SER 203 Cb 0.18 -2.62 0.01 0.00 0.10 0.00 0.00 66.02 63.69 3cjp s SER 203 CO 0.65 -1.57 0.62 0.00 0.98 0.00 0.00 173.24 173.92 3cjp n ALA 204 N -1.22 -0.99 -1.73 5.32 0.00 -1.26 -3.90 120.51 116.74 3cjp n ALA 204 Ca 0.12 0.29 -0.40 0.00 0.00 0.00 0.00 53.44 53.44 3cjp n ALA 204 Cb 0.47 -3.91 0.02 0.00 0.00 0.00 0.00 19.45 16.04 3cjp n ALA 204 CO 0.00 0.00 0.00 2.48 0.00 0.00 0.00 177.50 179.98 3cjp n TYR 205 N -4.51 2.28 0.54 0.00 4.11 -1.17 -4.95 117.16 113.47 3cjp n TYR 205 Ca -0.11 0.46 0.06 0.00 -0.00 0.00 0.00 57.90 58.31 3cjp n TYR 205 Cb 0.62 -2.39 0.00 0.00 -0.00 0.00 0.00 39.34 37.57 3cjp n TYR 205 CO 0.00 0.00 0.00 1.97 -0.00 0.00 0.00 176.86 178.83 3cjp n PHE 206 N -0.50 0.00 -3.73 -3.48 1.16 -1.26 -4.98 117.46 104.67 3cjp n PHE 206 Ca 0.07 0.00 -0.14 0.00 -1.87 0.00 0.00 57.45 55.51 3cjp n PHE 206 Cb 0.42 0.00 -0.15 0.00 -1.61 0.00 0.00 39.48 38.14 3cjp n PHE 206 CO 0.00 0.00 0.00 0.45 -1.87 0.00 0.00 176.76 175.34 3cjp s SER 207 N -1.53 0.07 0.29 5.98 0.15 -1.26 -5.04 113.70 112.36 3cjp s SER 207 Ca 0.10 0.31 0.11 0.00 0.70 0.00 0.00 55.95 57.17 3cjp s SER 207 Cb 0.10 0.21 0.43 0.00 -1.71 0.00 0.00 66.02 65.04 3cjp s SER 207 CO 0.30 -0.17 1.66 0.71 1.20 0.00 0.00 173.24 176.94 3cjp h THR 208 N 6.14 1.41 -0.33 6.45 1.35 -1.98 -1.75 112.91 124.18 3cjp h THR 208 Ca -0.37 -1.94 -0.01 0.00 -0.55 0.00 0.00 66.41 63.54 3cjp h THR 208 Cb 1.13 2.04 -0.02 0.00 -1.73 0.00 0.00 68.15 69.58 3cjp h THR 208 CO 0.36 0.55 0.16 0.15 -0.25 0.00 0.00 175.52 176.50 3cjp h PHE 209 N 0.01 0.48 -0.19 4.73 3.57 -1.99 0.23 116.94 123.79 3cjp h PHE 209 Ca -0.01 -0.02 0.02 0.00 3.53 0.00 0.00 57.97 61.49 3cjp h PHE 209 Cb 1.00 -0.15 -0.02 0.00 2.79 0.00 0.00 35.95 39.57 3cjp h PHE 209 CO 0.00 0.42 0.05 0.28 -2.23 0.00 0.00 178.31 176.84 3cjp h VAL 210 N 0.40 0.94 -0.42 1.41 2.07 -1.95 -1.39 116.25 117.31 3cjp h VAL 210 Ca 0.11 -0.05 0.08 0.00 0.82 0.00 0.00 66.70 67.67 3cjp h VAL 210 Cb 0.12 0.79 -0.07 0.00 -1.52 0.00 0.00 31.29 30.61 3cjp h VAL 210 CO -0.01 0.03 -0.01 0.25 0.02 0.00 0.00 177.57 177.84 3cjp h LEU 211 N 0.14 -0.19 -0.18 2.57 5.85 -0.93 -0.21 115.31 122.35 3cjp h LEU 211 Ca 0.08 0.10 0.05 0.00 0.84 0.00 0.00 57.88 58.95 3cjp h LEU 211 Cb 0.06 0.18 -0.05 0.00 0.37 0.00 0.00 40.66 41.22 3cjp h LEU 211 CO -0.10 -0.06 -0.15 0.50 -0.34 0.00 0.00 178.44 178.29 3cjp h LYS 212 N 0.10 -0.16 0.38 1.25 3.64 -0.35 -1.08 116.57 120.36 3cjp h LYS 212 Ca 0.21 0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.59 3cjp h LYS 212 Cb 0.30 0.04 -0.00 0.00 -0.41 0.00 0.00 32.23 32.16 3cjp h LYS 212 CO -0.36 -0.11 -0.23 0.82 -2.27 0.00 0.00 179.45 177.31 3cjp h ILE 213 N -0.16 0.51 0.17 2.00 2.04 -0.49 -2.55 117.51 119.02 3cjp h ILE 213 Ca 0.11 0.00 0.01 0.00 1.00 0.00 0.00 64.86 65.98 3cjp h ILE 213 Cb 0.33 0.51 -0.03 0.00 -0.74 0.00 0.00 36.82 36.90 3cjp h ILE 213 CO -0.28 0.00 -0.26 0.58 0.00 0.00 0.00 178.15 178.19 3cjp h VAL 214 N -0.59 0.43 -0.07 1.67 2.07 -0.95 -0.93 116.25 117.88 3cjp h VAL 214 Ca -0.04 0.00 -0.05 0.00 0.82 0.00 0.00 66.70 67.42 3cjp h VAL 214 Cb 0.48 0.43 -0.01 0.00 -1.52 0.00 0.00 31.29 30.68 3cjp h VAL 214 CO 0.04 0.00 -0.21 0.16 0.02 0.00 0.00 177.57 177.58 3cjp h ILE 215 N -0.50 1.19 0.00 4.57 3.07 -1.25 -0.83 117.51 123.75 3cjp h ILE 215 Ca 0.02 -0.87 -0.06 0.00 1.55 0.00 0.00 64.86 65.50 3cjp h ILE 215 Cb 0.50 1.38 -0.01 0.00 -0.27 0.00 0.00 36.82 38.42 3cjp h ILE 215 CO -0.11 0.26 -0.62 0.78 -1.05 0.00 0.00 178.15 177.40 3cjp h ASN 216 N 0.10 0.00 0.31 2.16 2.35 -1.41 -2.38 115.58 116.72 3cjp h ASN 216 Ca 0.02 0.00 -0.27 0.00 -0.55 0.00 0.00 56.30 55.50 3cjp h ASN 216 Cb 0.44 0.00 0.01 0.00 0.05 0.00 0.00 38.32 38.82 3cjp h ASN 216 CO 0.03 0.23 -1.13 -0.08 -1.65 0.00 0.00 177.43 174.84 3cjp h GLU 217 N 0.00 0.47 -2.18 0.81 4.81 -0.80 -3.39 114.58 114.29 3cjp h GLU 217 Ca -0.03 -0.61 -0.57 0.00 -0.13 0.00 0.00 59.36 58.03 3cjp h GLU 217 Cb 1.20 0.20 -0.41 0.00 0.63 0.00 0.00 28.75 30.37 3cjp h GLU 217 CO 0.03 1.24 -0.78 -0.11 -0.73 0.00 0.00 179.01 178.66 3cjp n LEU 218 N -3.72 3.23 0.25 1.64 7.94 -0.35 -4.95 117.00 121.05 3cjp n LEU 218 Ca -0.10 -5.41 0.12 0.00 -1.11 0.00 0.00 56.01 49.51 3cjp n LEU 218 Cb 0.93 -0.23 0.66 0.00 0.53 0.00 0.00 43.42 45.32 3cjp n LEU 218 CO 0.55 2.25 0.93 1.55 -1.11 0.00 0.00 177.39 181.56 3cjp h PRO 219 N 3.34 0.00 -0.01 1.96 0.13 -1.64 -2.57 132.00 133.21 3cjp h PRO 219 Ca 0.13 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.26 3cjp h PRO 219 Cb 0.66 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.79 3cjp h PRO 219 CO 0.73 0.14 -0.54 1.28 -0.23 0.00 0.00 178.00 179.39 3cjp n LEU 220 N -3.55 1.63 0.00 1.56 4.77 -1.26 -4.18 117.00 115.97 3cjp n LEU 220 Ca -0.01 -0.60 0.00 0.00 -0.03 0.00 0.00 56.01 55.37 3cjp n LEU 220 Cb 0.29 -0.03 0.00 0.00 -2.33 0.00 0.00 43.42 41.35 3cjp n LEU 220 CO 0.31 0.32 0.46 0.29 -1.33 0.00 0.00 177.39 177.43 3cjp n LYS 221 N -0.44 2.48 -3.85 3.23 5.02 -0.99 -4.89 118.16 118.71 3cjp n LYS 221 Ca 0.09 -1.34 -0.35 0.00 -2.02 0.00 0.00 58.31 54.68 3cjp n LYS 221 Cb 0.42 -0.94 -0.08 0.00 -0.02 0.00 0.00 35.03 34.41 3cjp n LYS 221 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3cjp s ILE 223 N -0.06 2.72 0.22 0.00 1.01 0.25 -4.36 121.20 120.98 3cjp s ILE 223 Ca 0.09 -1.03 -0.32 0.00 0.00 0.00 0.00 60.65 59.40 3cjp s ILE 223 Cb -0.12 -2.36 -0.12 0.00 0.01 0.00 0.00 42.46 39.88 3cjp s ILE 223 CO 0.00 0.25 1.68 0.33 0.00 0.00 0.00 174.94 177.20 3cjp n PHE 224 N 4.65 2.71 -3.85 3.97 7.35 0.24 -1.75 117.46 130.78 3cjp n PHE 224 Ca -0.17 0.11 -0.10 0.00 -0.76 0.00 0.00 57.45 56.53 3cjp n PHE 224 Cb 0.47 -2.64 -0.08 0.00 0.35 0.00 0.00 39.48 37.58 3cjp n PHE 224 CO 0.00 0.00 0.00 0.20 -0.76 0.00 0.00 176.76 176.20 3cjp s GLY 225 N 1.01 0.05 -0.08 7.13 0.00 -1.26 -0.14 107.32 114.03 3cjp s GLY 225 Ca 0.74 -0.36 0.17 0.00 0.00 0.00 0.00 44.72 45.27 3cjp s GLY 225 CO 0.36 -0.53 0.28 -1.30 0.00 0.00 0.00 173.10 171.91 3cjp n THR 226 N 0.55 0.41 -3.43 0.90 -2.24 -1.17 -3.42 114.28 105.88 3cjp n THR 226 Ca -0.18 -0.52 -0.23 0.00 -2.27 0.00 0.00 64.05 60.85 3cjp n THR 226 Cb 0.60 -0.14 0.07 0.00 -2.10 0.00 0.00 70.33 68.75 3cjp n THR 226 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 3cjp n ASP 227 N -2.31 -6.15 -4.69 3.42 2.03 0.23 -3.42 116.55 105.66 3cjp n ASP 227 Ca -0.12 -0.46 -0.40 0.00 0.52 0.00 0.00 54.79 54.33 3cjp n ASP 227 Cb 0.68 -4.81 0.02 0.00 -0.72 0.00 0.00 41.12 36.29 3cjp n ASP 227 CO 0.00 0.00 0.00 0.23 -1.92 0.00 0.00 177.20 175.51 3cjp n MET 228 N -4.61 1.70 -0.04 -0.67 2.81 -1.26 0.10 117.12 115.14 3cjp n MET 228 Ca -0.02 0.62 0.04 0.00 -1.81 0.00 0.00 57.70 56.53 3cjp n MET 228 Cb 0.57 -2.38 0.17 0.00 -0.71 0.00 0.00 33.22 30.87 3cjp n MET 228 CO 0.00 0.00 0.00 -0.35 1.51 0.00 0.00 175.97 177.13 3cjp n PRO 229 N -0.35 1.23 0.14 0.03 -0.04 -1.26 -0.46 135.00 134.29 3cjp n PRO 229 Ca 0.09 -0.36 0.10 0.00 -0.04 0.00 0.00 63.50 63.28 3cjp n PRO 229 Cb 0.42 -1.15 0.06 0.00 -0.04 0.00 0.00 33.50 32.79 3cjp n PRO 229 CO 0.00 0.00 0.00 0.74 -0.04 0.00 0.00 175.50 176.20 3cjp h PHE 230 N 0.62 0.00 -2.31 0.54 0.04 -0.63 -3.46 116.94 111.73 3cjp h PHE 230 Ca 0.00 0.00 -0.55 0.00 2.80 0.00 0.00 57.97 60.22 3cjp h PHE 230 Cb 0.14 0.00 -0.13 0.00 2.20 0.00 0.00 35.95 38.16 3cjp h PHE 230 CO 0.06 0.11 -0.54 0.20 -0.60 0.00 0.00 178.31 177.53 3cjp s GLY 231 N -4.36 2.52 -0.17 -1.45 0.00 -1.08 -5.06 107.32 97.72 3cjp s GLY 231 Ca 0.03 -1.37 0.01 0.00 0.00 0.00 0.00 44.72 43.38 3cjp s GLY 231 CO 0.74 -1.89 -0.18 -0.35 0.00 0.00 0.00 173.10 171.42 3cjp s ASP 232 N -3.62 3.03 0.12 1.64 -1.08 -1.26 -4.29 116.67 111.21 3cjp s ASP 232 Ca 0.25 -0.62 -0.28 0.00 -0.52 0.00 0.00 52.55 51.38 3cjp s ASP 232 Cb 0.04 -1.40 -0.07 0.00 -1.46 0.00 0.00 42.92 40.03 3cjp s ASP 232 CO 0.13 -0.02 1.61 0.25 0.52 0.00 0.00 175.17 177.66 3cjp h LEU 233 N 7.97 -1.01 -0.58 -1.34 5.85 -1.97 -0.14 115.31 124.09 3cjp h LEU 233 Ca -0.43 0.12 -0.01 0.00 0.84 0.00 0.00 57.88 58.40 3cjp h LEU 233 Cb 1.14 0.39 -0.03 0.00 0.37 0.00 0.00 40.66 42.53 3cjp h LEU 233 CO 0.61 -0.41 0.33 -0.61 -0.34 0.00 0.00 178.44 178.01 3cjp h GLN 234 N -0.53 0.80 -0.31 1.25 -0.00 -1.95 -1.07 115.11 113.30 3cjp h GLN 234 Ca 0.04 -0.09 -0.00 0.00 -0.00 0.00 0.00 58.65 58.60 3cjp h GLN 234 Cb 0.59 -0.16 -0.01 0.00 0.00 0.00 0.00 27.48 27.90 3cjp h GLN 234 CO -0.24 0.61 0.18 -0.07 0.00 0.00 0.00 178.83 179.31 3cjp h LEU 235 N 0.78 0.37 -0.25 -2.39 3.38 -1.90 -1.95 115.31 113.35 3cjp h LEU 235 Ca 0.21 -0.06 -0.05 0.00 0.09 0.00 0.00 57.88 58.07 3cjp h LEU 235 Cb 0.03 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 40.68 3cjp h LEU 235 CO -0.03 0.33 -0.02 0.28 0.09 0.00 0.00 178.44 179.08 3cjp h SER 236 N 0.39 0.45 -0.52 -0.43 0.02 -0.78 -2.11 113.55 110.57 3cjp h SER 236 Ca 0.11 -0.33 0.10 0.00 -0.84 0.00 0.00 61.79 60.82 3cjp h SER 236 Cb 0.02 -0.12 -0.08 0.00 0.14 0.00 0.00 62.40 62.36 3cjp h SER 236 CO -0.02 0.68 0.08 0.40 -1.14 0.00 0.00 176.83 176.82 3cjp h ILE 237 N 0.22 0.67 -0.82 3.27 2.04 -1.14 -2.10 117.51 119.65 3cjp h ILE 237 Ca 0.07 -0.07 0.10 0.00 1.00 0.00 0.00 64.86 65.96 3cjp h ILE 237 Cb 0.46 0.44 -0.07 0.00 -0.74 0.00 0.00 36.82 36.91 3cjp h ILE 237 CO 0.02 0.04 0.47 -0.08 0.00 0.00 0.00 178.15 178.59 3cjp h GLU 238 N 0.20 0.76 -0.21 2.37 4.81 -0.97 -1.59 114.58 119.94 3cjp h GLU 238 Ca 0.27 -0.05 -0.03 0.00 -0.13 0.00 0.00 59.36 59.42 3cjp h GLU 238 Cb 0.38 -0.17 -0.01 0.00 0.63 0.00 0.00 28.75 29.58 3cjp h GLU 238 CO -0.37 0.50 0.03 0.00 -0.73 0.00 0.00 179.01 178.43 3cjp h ALA 239 N 1.46 0.28 -0.48 2.92 0.00 -0.92 -0.28 119.26 122.24 3cjp h ALA 239 Ca 0.40 -0.18 0.07 0.00 0.00 0.00 0.00 54.91 55.19 3cjp h ALA 239 Cb 0.38 -0.08 -0.06 0.00 0.00 0.00 0.00 17.79 18.03 3cjp h ALA 239 CO -0.25 -0.03 0.16 0.82 0.00 0.00 0.00 179.25 179.94 3cjp h ILE 240 N 0.15 0.82 -0.22 0.00 1.08 -1.05 0.21 117.51 118.49 3cjp h ILE 240 Ca 0.06 -0.11 -0.12 0.00 -0.39 0.00 0.00 64.86 64.30 3cjp h ILE 240 Cb 0.34 0.46 -0.01 0.00 -3.07 0.00 0.00 36.82 34.54 3cjp h ILE 240 CO 0.01 0.06 -0.38 0.11 -0.69 0.00 0.00 178.15 177.26 3cjp h LYS 241 N 0.32 0.48 -0.12 2.37 1.57 -1.05 0.06 116.57 120.21 3cjp h LYS 241 Ca 0.23 -0.23 -0.23 0.00 -1.87 0.00 0.00 60.65 58.55 3cjp h LYS 241 Cb 0.26 -0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.57 3cjp h LYS 241 CO -0.25 0.79 -0.83 -0.22 -0.57 0.00 0.00 179.45 178.37 3cjp h LYS 242 N 0.41 0.73 0.00 3.15 3.64 -0.42 -3.25 116.57 120.83 3cjp h LYS 242 Ca 0.04 -0.64 -0.03 0.00 -1.27 0.00 0.00 60.65 58.76 3cjp h LYS 242 Cb 0.84 0.14 -0.00 0.00 -0.41 0.00 0.00 32.23 32.80 3cjp h LYS 242 CO 0.07 1.24 -0.12 0.52 -2.27 0.00 0.00 179.45 178.89 3cjp h MET 243 N 0.49 0.00 -6.82 1.90 2.86 -0.46 -3.46 114.93 109.43 3cjp h MET 243 Ca -0.07 0.00 -0.53 0.00 -2.06 0.00 0.00 59.70 57.05 3cjp h MET 243 Cb 1.46 0.00 0.07 0.00 0.06 0.00 0.00 31.60 33.18 3cjp h MET 243 CO 0.17 0.12 0.73 -1.12 1.06 0.00 0.00 176.91 177.86 3cjp s SER 244 N -6.25 6.64 0.34 1.22 0.01 -0.01 -4.71 113.70 110.95 3cjp s SER 244 Ca 0.06 2.73 0.27 0.00 1.31 0.00 0.00 55.95 60.32 3cjp s SER 244 Cb 0.06 -2.64 0.93 0.00 0.21 0.00 0.00 66.02 64.58 3cjp s SER 244 CO 0.68 -0.67 1.78 0.78 0.41 0.00 0.00 173.24 176.21 3cjp h ASN 245 N 4.21 0.00 -5.01 2.44 2.35 -1.90 -3.46 115.58 114.21 3cjp h ASN 245 Ca -0.48 0.00 0.06 0.00 -0.55 0.00 0.00 56.30 55.33 3cjp h ASN 245 Cb 1.22 0.00 -0.04 0.00 0.05 0.00 0.00 38.32 39.55 3cjp h ASN 245 CO 0.72 0.00 0.25 1.51 -1.65 0.00 0.00 177.43 178.25 3cjp s ASP 246 N -4.97 -0.22 0.41 5.81 1.47 -1.26 -5.06 116.67 112.86 3cjp s ASP 246 Ca 0.06 -0.69 0.22 0.00 1.18 0.00 0.00 52.55 53.32 3cjp s ASP 246 Cb 0.09 0.74 0.78 0.00 -0.34 0.00 0.00 42.92 44.19 3cjp s ASP 246 CO 0.52 -1.39 1.77 0.77 0.68 0.00 0.00 175.17 177.52 3cjp h SER 247 N 2.00 0.00 0.16 2.11 4.64 -1.97 -2.37 113.55 118.12 3cjp h SER 247 Ca -0.21 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.10 3cjp h SER 247 Cb 1.25 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.34 3cjp h SER 247 CO 0.26 0.27 -0.08 0.22 -0.87 0.00 0.00 176.83 176.63 3cjp h TYR 248 N 0.00 -0.20 -0.16 4.77 3.20 -1.98 0.12 116.97 122.72 3cjp h TYR 248 Ca -0.00 -0.00 0.04 0.00 3.14 0.00 0.00 58.73 61.91 3cjp h TYR 248 Cb 0.84 0.07 -0.05 0.00 1.54 0.00 0.00 36.73 39.13 3cjp h TYR 248 CO 0.00 -0.08 -0.13 0.28 -1.64 0.00 0.00 178.16 176.59 3cjp h VAL 249 N -0.26 0.63 -0.56 1.81 2.07 -1.89 0.27 116.25 118.32 3cjp h VAL 249 Ca -0.02 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.53 3cjp h VAL 249 Cb 0.20 0.63 -0.04 0.00 -1.52 0.00 0.00 31.29 30.56 3cjp h VAL 249 CO 0.04 0.00 0.33 0.00 0.02 0.00 0.00 177.57 177.95 3cjp h ALA 250 N 0.96 0.73 -0.06 1.67 0.00 -1.39 -0.13 119.26 121.05 3cjp h ALA 250 Ca 0.10 -0.00 -0.13 0.00 0.00 0.00 0.00 54.91 54.88 3cjp h ALA 250 Cb 0.29 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 3cjp h ALA 250 CO -0.25 0.02 -0.56 -0.91 0.00 0.00 0.00 179.25 177.56 3cjp h ASN 251 N 0.63 0.19 0.29 0.00 2.35 -0.37 -1.23 115.58 117.44 3cjp h ASN 251 Ca 0.24 -0.10 -0.01 0.00 -0.55 0.00 0.00 56.30 55.87 3cjp h ASN 251 Cb 0.07 -0.05 0.00 0.00 0.05 0.00 0.00 38.32 38.39 3cjp h ASN 251 CO -0.12 0.71 -0.14 0.00 -1.65 0.00 0.00 177.43 176.23 3cjp h ALA 252 N 1.30 -0.39 -0.79 -0.83 0.00 -0.55 -2.83 119.26 115.17 3cjp h ALA 252 Ca -0.00 -0.18 -0.00 0.00 0.00 0.00 0.00 54.91 54.73 3cjp h ALA 252 Cb 1.02 0.15 -0.04 0.00 0.00 0.00 0.00 17.79 18.92 3cjp h ALA 252 CO 0.08 -0.56 0.47 0.28 0.00 0.00 0.00 179.25 179.53 3cjp h VAL 253 N -0.70 1.22 0.00 0.00 2.07 -0.98 -1.14 116.25 116.71 3cjp h VAL 253 Ca -0.04 -0.48 0.00 0.00 0.82 0.00 0.00 66.70 67.00 3cjp h VAL 253 Cb 0.48 0.11 0.00 0.00 -1.52 0.00 0.00 31.29 30.36 3cjp h VAL 253 CO 0.07 0.23 0.00 -0.07 0.02 0.00 0.00 177.57 177.81 3cjp h LEU 254 N 1.08 0.00 0.00 2.57 3.38 -1.29 0.71 115.31 121.75 3cjp h LEU 254 Ca 0.28 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.25 3cjp h LEU 254 Cb -0.05 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.70 3cjp h LEU 254 CO -0.05 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.09 3cjp n GLY 255 N 0.48 0.00 0.32 0.83 0.00 -1.10 -0.87 105.19 104.85 3cjp n GLY 255 Ca 0.02 -0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.98 3cjp n GLY 255 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3cjp h ASP 256 N 0.00 1.02 0.06 1.61 5.19 -1.27 -0.49 116.42 122.54 3cjp h ASP 256 Ca 0.00 -0.15 0.01 0.00 -0.62 0.00 0.00 57.03 56.26 3cjp h ASP 256 Cb 0.00 -0.26 -0.01 0.00 0.18 0.00 0.00 39.33 39.23 3cjp h ASP 256 CO 0.00 0.89 -0.09 0.78 -3.12 0.00 0.00 179.24 177.69 3cjp h ASN 257 N 1.08 -0.25 0.30 6.45 2.35 -1.47 -1.03 115.58 122.99 3cjp h ASN 257 Ca 0.26 0.03 -0.14 0.00 -0.55 0.00 0.00 56.30 55.89 3cjp h ASN 257 Cb 0.16 0.10 -0.01 0.00 0.05 0.00 0.00 38.32 38.62 3cjp h ASN 257 CO -0.03 -0.14 -0.57 -0.29 -1.65 0.00 0.00 177.43 174.75 3cjp h ILE 258 N -0.19 1.37 -0.75 2.81 6.09 -1.77 -1.20 117.51 123.86 3cjp h ILE 258 Ca 0.01 -1.90 0.07 0.00 -1.37 0.00 0.00 64.86 61.68 3cjp h ILE 258 Cb 0.20 1.93 -0.06 0.00 0.47 0.00 0.00 36.82 39.36 3cjp h ILE 258 CO -0.05 0.57 0.43 0.28 -3.07 0.00 0.00 178.15 176.30 3cjp h SER 259 N 0.22 0.62 0.09 2.19 0.02 -0.95 0.85 113.55 116.59 3cjp h SER 259 Ca -0.00 0.04 -0.00 0.00 -0.84 0.00 0.00 61.79 60.98 3cjp h SER 259 Cb 1.07 -0.08 0.00 0.00 0.14 0.00 0.00 62.40 63.53 3cjp h SER 259 CO 0.09 0.38 -0.04 -0.09 -1.14 0.00 0.00 176.83 176.03 3cjp h ARG 260 N 0.75 -0.11 -0.49 3.45 2.43 -0.96 0.64 114.38 120.09 3cjp h ARG 260 Ca 0.35 0.01 -0.09 0.00 -0.81 0.00 0.00 59.98 59.43 3cjp h ARG 260 Cb 0.26 0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 29.82 3cjp h ARG 260 CO -0.21 0.17 -0.05 1.25 -1.51 0.00 0.00 179.97 179.62 3cjp h LEU 261 N -0.39 0.89 -0.14 3.80 5.85 -0.99 -2.86 115.31 121.47 3cjp h LEU 261 Ca -0.01 -0.33 0.00 0.00 0.84 0.00 0.00 57.88 58.38 3cjp h LEU 261 Cb 0.33 -0.24 0.00 0.00 0.37 0.00 0.00 40.66 41.12 3cjp h LEU 261 CO 0.02 1.01 -0.39 0.18 -0.34 0.00 0.00 178.44 178.92 3cjp n LEU 262 N -4.28 0.61 -3.39 2.25 4.77 0.27 -4.98 117.00 112.26 3cjp n LEU 262 Ca 0.01 -0.04 -0.17 0.00 -0.03 0.00 0.00 56.01 55.77 3cjp n LEU 262 Cb 0.35 -0.23 0.08 0.00 -2.33 0.00 0.00 43.42 41.29 3cjp n LEU 262 CO 0.43 0.13 0.06 0.59 -1.33 0.00 0.00 177.39 177.28 3cjp n ASN 263 N -1.26 -3.85 -0.33 -1.43 5.03 -0.32 -5.05 115.26 108.05 3cjp n ASN 263 Ca 0.08 -0.68 0.15 0.00 0.87 0.00 0.00 54.58 54.99 3cjp n ASN 263 Cb 0.34 -5.03 0.66 0.00 -1.02 0.00 0.00 39.78 34.72 3cjp n ASN 263 CO 0.00 0.00 0.00 -0.38 -1.83 0.00 0.00 177.26 175.05