#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 2.18 -0.13 1.96 1.01 -1.26 -4.05 121.20 120.91 3cjp s ILE 4 Ca 0.00 -0.91 0.01 0.00 0.00 0.00 0.00 60.65 59.75 3cjp s ILE 4 Cb 0.00 -1.91 0.02 0.00 0.01 0.00 0.00 42.46 40.58 3cjp s ILE 4 CO 0.00 0.53 -0.15 -0.63 0.00 0.00 0.00 174.94 174.69 3cjp s ILE 5 N 1.11 1.56 -0.50 2.92 1.01 0.43 -0.94 121.20 126.79 3cjp s ILE 5 Ca 0.00 -0.66 -0.29 0.00 0.00 0.00 0.00 60.65 59.71 3cjp s ILE 5 Cb -0.14 -1.44 0.02 0.00 0.01 0.00 0.00 42.46 40.91 3cjp s ILE 5 CO -0.08 0.46 1.24 -0.62 0.00 0.00 0.00 174.94 175.94 3cjp s ASP 6 N 1.21 6.46 0.00 3.58 -1.08 -0.54 -4.57 116.67 121.73 3cjp s ASP 6 Ca -0.01 0.41 0.23 0.00 -0.52 0.00 0.00 52.55 52.66 3cjp s ASP 6 Cb -0.14 -2.55 1.34 0.00 -1.46 0.00 0.00 42.92 40.11 3cjp s ASP 6 CO -0.06 -1.41 1.77 0.61 0.52 0.00 0.00 175.17 176.60 3cjp n GLY 7 N 5.01 -0.82 3.15 2.66 0.00 0.19 -1.06 105.19 114.31 3cjp n GLY 7 Ca 0.12 -0.14 0.05 0.00 0.00 0.00 0.00 46.02 46.05 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 -2.16 -1.08 -0.01 1.61 5.65 -1.25 -4.66 115.29 113.39 3cjp s HIS 8 Ca 0.32 0.78 -0.01 0.00 0.25 0.00 0.00 55.06 56.39 3cjp s HIS 8 Cb 0.16 0.24 0.00 0.00 -1.18 0.00 0.00 32.58 31.80 3cjp s HIS 8 CO 0.29 -0.62 0.03 0.99 -0.65 0.00 0.00 174.74 174.79 3cjp s THR 9 N 2.90 0.01 0.39 0.89 2.01 -0.96 -0.03 115.64 120.85 3cjp s THR 9 Ca 0.16 -0.07 -0.18 0.00 0.31 0.00 0.00 61.69 61.91 3cjp s THR 9 Cb -0.08 -0.08 -0.10 0.00 0.01 0.00 0.00 72.50 72.26 3cjp s THR 9 CO -0.21 -0.04 0.86 -1.00 -0.69 0.00 0.00 174.62 173.53 3cjp s HIS 10 N -0.10 3.35 0.13 4.92 3.76 0.21 -0.18 115.29 127.39 3cjp s HIS 10 Ca -0.01 1.41 -0.35 0.00 -0.15 0.00 0.00 55.06 55.96 3cjp s HIS 10 Cb -0.01 -2.70 -0.15 0.00 1.11 0.00 0.00 32.58 30.83 3cjp s HIS 10 CO 0.00 -0.05 1.39 0.28 -0.85 0.00 0.00 174.74 175.52 3cjp n VAL 11 N -0.64 0.19 -4.77 -0.90 0.31 -0.55 -4.62 118.33 107.35 3cjp n VAL 11 Ca 0.05 -0.05 -0.33 0.00 -0.01 0.00 0.00 64.34 64.01 3cjp n VAL 11 Cb 0.54 -1.09 -0.14 0.00 -0.91 0.00 0.00 33.84 32.24 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 0.48 3.15 0.04 2.52 -1.09 -1.26 -4.93 121.20 120.11 3cjp s ILE 12 Ca 0.80 -0.64 0.08 0.00 -2.23 0.00 0.00 60.65 58.65 3cjp s ILE 12 Cb -0.83 -2.31 -0.03 0.00 -1.58 0.00 0.00 42.46 37.71 3cjp s ILE 12 CO 0.45 0.54 -0.20 -0.76 -1.23 0.00 0.00 174.94 173.74 3cjp s LEU 13 N 0.07 2.50 0.48 2.97 1.43 -1.26 -3.40 118.68 121.47 3cjp s LEU 13 Ca -0.05 -0.47 -0.24 0.00 -1.03 0.00 0.00 54.13 52.34 3cjp s LEU 13 Cb -0.14 -1.46 -0.07 0.00 0.03 0.00 0.00 46.19 44.55 3cjp s LEU 13 CO 0.04 0.26 1.40 -2.16 0.23 0.00 0.00 176.35 176.11 3cjp s PRO 14 N -1.39 3.52 0.30 1.29 0.04 -1.26 -4.68 135.00 132.82 3cjp s PRO 14 Ca 0.14 2.34 -0.01 0.00 0.04 0.00 0.00 61.00 63.51 3cjp s PRO 14 Cb -0.10 -2.53 0.48 0.00 0.04 0.00 0.00 34.50 32.39 3cjp s PRO 14 CO 0.04 -0.92 1.94 0.28 0.04 0.00 0.00 177.00 178.39 3cjp h VAL 15 N 2.02 1.15 -0.15 -0.36 2.07 -2.01 -2.53 116.25 116.45 3cjp h VAL 15 Ca -0.51 -0.37 -0.06 0.00 0.82 0.00 0.00 66.70 66.58 3cjp h VAL 15 Cb 1.28 -0.03 -0.01 0.00 -1.52 0.00 0.00 31.29 31.01 3cjp h VAL 15 CO 0.60 0.20 -0.17 -0.33 0.02 0.00 0.00 177.57 177.89 3cjp h GLU 16 N 1.08 0.24 -0.82 1.57 3.07 -1.97 -1.20 114.58 116.55 3cjp h GLU 16 Ca 0.34 -0.06 -0.01 0.00 -0.50 0.00 0.00 59.36 59.12 3cjp h GLU 16 Cb 0.02 -0.03 -0.04 0.00 -0.84 0.00 0.00 28.75 27.86 3cjp h GLU 16 CO -0.10 0.42 0.47 -0.22 -1.40 0.00 0.00 179.01 178.17 3cjp h LYS 17 N 0.23 1.14 -0.34 2.33 3.64 -1.83 -0.95 116.57 120.78 3cjp h LYS 17 Ca 0.04 -0.12 -0.15 0.00 -1.27 0.00 0.00 60.65 59.15 3cjp h LYS 17 Cb 0.44 -0.23 -0.01 0.00 -0.41 0.00 0.00 32.23 32.02 3cjp h LYS 17 CO 0.03 0.83 -0.40 1.25 -2.27 0.00 0.00 179.45 178.89 3cjp h HIS 18 N 1.14 1.00 -0.68 1.91 2.76 -1.25 -1.76 115.15 118.27 3cjp h HIS 18 Ca 0.29 -0.30 -0.08 0.00 -2.20 0.00 0.00 60.37 58.09 3cjp h HIS 18 Cb 0.01 -0.21 -0.03 0.00 1.55 0.00 0.00 27.41 28.73 3cjp h HIS 18 CO 0.00 1.09 0.13 0.82 -1.30 0.00 0.00 177.93 178.67 3cjp h ILE 19 N 0.68 1.26 -0.79 6.26 1.08 -1.18 -0.34 117.51 124.49 3cjp h ILE 19 Ca 0.05 -1.01 -0.04 0.00 -0.39 0.00 0.00 64.86 63.47 3cjp h ILE 19 Cb 0.97 0.60 -0.04 0.00 -3.07 0.00 0.00 36.82 35.28 3cjp h ILE 19 CO 0.09 0.38 0.34 0.50 -0.69 0.00 0.00 178.15 178.77 3cjp h LYS 20 N 1.04 1.16 -0.57 2.37 3.64 -1.03 0.18 116.57 123.35 3cjp h LYS 20 Ca 0.21 -0.19 -0.08 0.00 -1.27 0.00 0.00 60.65 59.32 3cjp h LYS 20 Cb 0.42 -0.20 -0.02 0.00 -0.41 0.00 0.00 32.23 32.02 3cjp h LYS 20 CO 0.01 0.92 0.06 0.82 -2.27 0.00 0.00 179.45 178.99 3cjp h ILE 21 N 1.14 1.26 -0.00 2.00 2.04 -0.46 -0.25 117.51 123.24 3cjp h ILE 21 Ca 0.27 -1.03 -0.00 0.00 1.00 0.00 0.00 64.86 65.10 3cjp h ILE 21 Cb 0.18 0.81 -0.00 0.00 -0.74 0.00 0.00 36.82 37.07 3cjp h ILE 21 CO -0.03 0.37 0.00 0.24 0.00 0.00 0.00 178.15 178.74 3cjp h MET 22 N 0.86 0.00 -0.28 2.37 2.86 -0.94 -1.70 114.93 118.10 3cjp h MET 22 Ca 0.17 -0.00 0.06 0.00 -2.06 0.00 0.00 59.70 57.87 3cjp h MET 22 Cb 0.46 -0.00 -0.06 0.00 0.06 0.00 0.00 31.60 32.06 3cjp h MET 22 CO 0.02 0.07 -0.11 -0.44 1.06 0.00 0.00 176.91 177.51 3cjp h ASP 23 N -0.07 -0.38 0.41 1.22 3.32 -0.33 -1.27 116.42 119.31 3cjp h ASP 23 Ca 0.00 0.10 -0.03 0.00 0.02 0.00 0.00 57.03 57.12 3cjp h ASP 23 Cb 0.07 0.22 -0.00 0.00 0.22 0.00 0.00 39.33 39.84 3cjp h ASP 23 CO -0.00 -0.14 -0.16 -0.33 -1.72 0.00 0.00 179.24 176.89 3cjp h GLU 24 N -0.06 0.00 -0.01 3.56 5.08 -0.98 -2.78 114.58 119.38 3cjp h GLU 24 Ca 0.14 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.50 3cjp h GLU 24 Cb 0.28 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.53 3cjp h GLU 24 CO -0.32 0.16 -0.23 0.00 -1.00 0.00 0.00 179.01 177.62 3cjp n ALA 25 N -2.31 3.03 -2.28 3.43 0.00 -0.65 -4.94 120.51 116.79 3cjp n ALA 25 Ca -0.02 -0.52 -0.06 0.00 0.00 0.00 0.00 53.44 52.84 3cjp n ALA 25 Cb 0.27 -0.99 0.00 0.00 0.00 0.00 0.00 19.45 18.73 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 1.33 0.23 3.64 0.00 0.00 -0.83 -5.00 105.19 104.56 3cjp n GLY 26 Ca 0.13 -0.59 -0.36 0.00 0.00 0.00 0.00 46.02 45.20 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 -2.48 5.23 -0.06 1.61 1.01 -0.55 -4.49 120.40 120.68 3cjp s VAL 27 Ca 0.04 0.13 -0.23 0.00 0.00 0.00 0.00 61.98 61.92 3cjp s VAL 27 Cb -0.02 -3.43 -0.29 0.00 0.00 0.00 0.00 36.38 32.64 3cjp s VAL 27 CO 0.05 0.36 0.90 0.44 0.00 0.00 0.00 175.10 176.85 3cjp h ASP 28 N 7.48 0.37 -5.12 3.32 5.19 -1.35 -3.40 116.42 122.90 3cjp h ASP 28 Ca -0.38 -0.93 -0.10 0.00 -0.62 0.00 0.00 57.03 55.00 3cjp h ASP 28 Cb 1.17 -0.12 -0.16 0.00 0.18 0.00 0.00 39.33 40.40 3cjp h ASP 28 CO 0.66 1.28 -0.41 -0.54 -3.12 0.00 0.00 179.24 177.11 3cjp s LYS 29 N -2.51 0.75 -0.01 3.56 1.02 -1.23 -4.56 119.74 116.76 3cjp s LYS 29 Ca -0.15 -0.83 0.04 0.00 0.02 0.00 0.00 55.97 55.05 3cjp s LYS 29 Cb 0.00 0.31 -0.01 0.00 -0.52 0.00 0.00 37.83 37.61 3cjp s LYS 29 CO 0.80 -0.22 -0.14 0.99 -0.92 0.00 0.00 175.35 175.85 3cjp s THR 30 N -3.28 1.12 -0.46 2.17 2.01 0.07 -1.46 115.64 115.80 3cjp s THR 30 Ca 0.01 -0.60 -0.23 0.00 0.31 0.00 0.00 61.69 61.17 3cjp s THR 30 Cb 0.02 -0.94 0.03 0.00 0.01 0.00 0.00 72.50 71.63 3cjp s THR 30 CO -0.08 0.32 0.80 -0.63 -0.69 0.00 0.00 174.62 174.34 3cjp s ILE 31 N -0.29 4.63 0.09 1.82 -1.09 -0.23 -1.93 121.20 124.20 3cjp s ILE 31 Ca 0.05 0.43 -0.15 0.00 -2.23 0.00 0.00 60.65 58.75 3cjp s ILE 31 Cb -0.06 -4.34 -0.06 0.00 -1.58 0.00 0.00 42.46 36.42 3cjp s ILE 31 CO -0.00 -0.74 0.51 -0.76 -1.23 0.00 0.00 174.94 172.71 3cjp s LEU 32 N 3.34 4.41 -0.05 2.97 1.43 0.11 -2.27 118.68 128.62 3cjp s LEU 32 Ca 0.30 1.06 0.05 0.00 -1.03 0.00 0.00 54.13 54.51 3cjp s LEU 32 Cb -0.12 -3.01 -0.02 0.00 0.03 0.00 0.00 46.19 43.06 3cjp s LEU 32 CO 0.23 0.19 -0.18 -0.36 0.23 0.00 0.00 176.35 176.46 3cjp s PHE 33 N -1.30 2.60 0.91 0.29 0.40 0.75 -1.07 117.98 120.56 3cjp s PHE 33 Ca 0.32 -0.30 -0.11 0.00 -0.60 0.00 0.00 56.93 56.25 3cjp s PHE 33 Cb -0.16 -1.61 0.14 0.00 0.51 0.00 0.00 43.02 41.90 3cjp s PHE 33 CO 0.18 0.08 1.11 -1.54 0.70 0.00 0.00 175.22 175.75 3cjp s SER 34 N -0.59 3.08 -0.19 1.36 1.04 -1.23 -1.49 113.70 115.69 3cjp s SER 34 Ca 0.08 1.93 -0.25 0.00 0.48 0.00 0.00 55.95 58.20 3cjp s SER 34 Cb -0.11 -2.48 0.06 0.00 0.10 0.00 0.00 66.02 63.60 3cjp s SER 34 CO 0.01 -2.96 0.65 0.28 0.98 0.00 0.00 173.24 172.20 3cjp s THR 35 N -2.72 0.00 -1.64 2.02 -1.32 -1.26 -4.71 115.64 106.01 3cjp s THR 35 Ca 0.65 -0.02 0.28 0.00 -1.21 0.00 0.00 61.69 61.39 3cjp s THR 35 Cb -0.21 -0.92 0.38 0.00 -1.51 0.00 0.00 72.50 70.23 3cjp s THR 35 CO 0.58 -0.01 1.75 -1.54 -2.21 0.00 0.00 174.62 173.19 3cjp n SER 36 N 2.19 0.63 -3.87 8.08 3.41 -1.26 -4.74 113.62 118.06 3cjp n SER 36 Ca -0.16 -0.63 -0.15 0.00 -0.26 0.00 0.00 58.87 57.67 3cjp n SER 36 Cb 0.56 -0.01 -0.15 0.00 -0.26 0.00 0.00 64.21 64.35 3cjp n SER 36 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 3cjp s ILE 37 N -2.51 0.17 -0.57 -1.33 1.01 -1.26 -5.08 121.20 111.63 3cjp s ILE 37 Ca 0.26 -0.02 0.06 0.00 0.00 0.00 0.00 60.65 60.95 3cjp s ILE 37 Cb 0.20 -0.20 0.21 0.00 0.01 0.00 0.00 42.46 42.68 3cjp s ILE 37 CO 0.50 0.09 0.56 1.41 0.00 0.00 0.00 174.94 177.50 3cjp n HIS 38 N 3.47 1.94 0.26 3.97 8.25 -1.26 -4.93 115.22 126.92 3cjp n HIS 38 Ca -0.18 -3.93 0.10 0.00 -0.26 0.00 0.00 57.72 53.44 3cjp n HIS 38 Cb 0.56 -0.40 0.70 0.00 1.12 0.00 0.00 29.99 31.97 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 4.72 0.00 0.00 -0.41 0.13 -1.94 -1.84 132.00 132.66 3cjp h PRO 39 Ca 0.17 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.30 3cjp h PRO 39 Cb 0.77 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.90 3cjp h PRO 39 CO 0.65 0.06 0.00 -0.85 -0.23 0.00 0.00 178.00 177.63 3cjp n GLU 40 N -4.17 0.06 0.00 0.86 0.00 -1.26 -2.05 120.64 114.08 3cjp n GLU 40 Ca -0.03 0.44 0.06 0.00 0.00 0.00 0.00 57.16 57.64 3cjp n GLU 40 Cb 0.14 -1.66 0.05 0.00 0.00 0.00 0.00 31.44 29.98 3cjp n GLU 40 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.13 177.38 3cjp n THR 41 N -1.78 0.00 -1.86 3.84 -2.24 -0.69 -4.98 114.28 106.56 3cjp n THR 41 Ca 0.01 -0.49 -0.42 0.00 -2.27 0.00 0.00 64.05 60.88 3cjp n THR 41 Cb 0.10 1.25 -0.03 0.00 -2.10 0.00 0.00 70.33 69.55 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 -1.06 3.78 0.04 6.98 0.00 -0.87 -4.98 121.76 125.65 3cjp s ALA 42 Ca 0.14 1.37 -0.26 0.00 0.00 0.00 0.00 51.96 53.21 3cjp s ALA 42 Cb 0.10 -3.68 -0.05 0.00 0.00 0.00 0.00 23.12 19.50 3cjp s ALA 42 CO 0.16 -0.97 0.83 0.54 0.00 0.00 0.00 175.76 176.32 3cjp s VAL 43 N 1.83 4.73 0.36 0.00 0.11 -1.26 -4.81 120.40 121.35 3cjp s VAL 43 Ca 0.74 1.76 0.00 0.00 -2.93 0.00 0.00 61.98 61.54 3cjp s VAL 43 Cb -0.44 -4.18 0.00 0.00 -1.53 0.00 0.00 36.38 30.23 3cjp s VAL 43 CO 0.32 0.32 0.00 -0.46 -3.33 0.00 0.00 175.10 171.95 3cjp n ASN 44 N 3.05 -4.85 -0.27 3.54 0.23 -1.26 -4.25 115.26 111.45 3cjp n ASN 44 Ca -0.00 1.02 -0.06 0.00 -0.53 0.00 0.00 54.58 55.01 3cjp n ASN 44 Cb 0.50 -2.71 0.06 0.00 -2.08 0.00 0.00 39.78 35.55 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 -0.24 1.01 -0.46 -4.53 -0.00 -2.00 -2.15 115.31 106.94 3cjp h LEU 45 Ca -0.04 -0.15 0.07 0.00 -0.00 0.00 0.00 57.88 57.76 3cjp h LEU 45 Cb 0.66 -0.26 -0.06 0.00 -0.00 0.00 0.00 40.66 41.00 3cjp h LEU 45 CO 0.02 0.88 0.10 -0.09 -0.00 0.00 0.00 178.44 179.35 3cjp h ARG 46 N 1.07 0.24 -0.57 1.13 2.43 -2.00 -0.92 114.38 115.76 3cjp h ARG 46 Ca 0.26 -0.01 -0.04 0.00 -0.81 0.00 0.00 59.98 59.37 3cjp h ARG 46 Cb 0.16 -0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 29.63 3cjp h ARG 46 CO -0.03 0.16 0.19 -0.44 -1.51 0.00 0.00 179.97 178.34 3cjp h ASP 47 N 0.24 0.82 -0.37 -3.80 3.45 -1.65 -0.71 116.42 114.40 3cjp h ASP 47 Ca 0.23 -0.20 0.07 0.00 0.43 0.00 0.00 57.03 57.55 3cjp h ASP 47 Cb 0.28 -0.21 -0.06 0.00 -0.56 0.00 0.00 39.33 38.78 3cjp h ASP 47 CO -0.28 0.80 0.01 0.58 -1.57 0.00 0.00 179.24 178.77 3cjp h VAL 48 N 0.79 0.74 -0.60 -1.35 2.07 -0.83 -1.35 116.25 115.71 3cjp h VAL 48 Ca 0.18 -0.04 -0.01 0.00 0.82 0.00 0.00 66.70 67.65 3cjp h VAL 48 Cb 0.26 0.61 -0.03 0.00 -1.52 0.00 0.00 31.29 30.62 3cjp h VAL 48 CO -0.01 0.02 0.33 0.11 0.02 0.00 0.00 177.57 178.04 3cjp h LYS 49 N 0.11 0.84 -0.49 1.57 1.57 -0.91 0.30 116.57 119.56 3cjp h LYS 49 Ca 0.18 -0.10 0.08 0.00 -1.87 0.00 0.00 60.65 58.94 3cjp h LYS 49 Cb 0.25 -0.16 -0.07 0.00 0.08 0.00 0.00 32.23 32.32 3cjp h LYS 49 CO -0.29 0.64 0.10 -0.22 -0.57 0.00 0.00 179.45 179.10 3cjp h LYS 50 N 0.81 0.23 -0.37 3.15 3.64 -0.86 0.32 116.57 123.50 3cjp h LYS 50 Ca 0.21 -0.01 -0.07 0.00 -1.27 0.00 0.00 60.65 59.51 3cjp h LYS 50 Cb 0.05 -0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 31.80 3cjp h LYS 50 CO -0.03 0.15 -0.04 0.93 -2.27 0.00 0.00 179.45 178.19 3cjp h GLU 51 N 0.24 0.67 -0.43 1.90 4.39 -0.66 -1.77 114.58 118.92 3cjp h GLU 51 Ca 0.25 -0.23 -0.09 0.00 0.34 0.00 0.00 59.36 59.62 3cjp h GLU 51 Cb 0.33 -0.05 -0.02 0.00 -0.10 0.00 0.00 28.75 28.91 3cjp h GLU 51 CO -0.32 0.80 -0.10 0.52 -1.16 0.00 0.00 179.01 178.75 3cjp h MET 52 N 0.48 0.77 -0.89 2.33 2.86 -0.05 -1.79 114.93 118.64 3cjp h MET 52 Ca 0.10 -0.25 -0.01 0.00 -2.06 0.00 0.00 59.70 57.48 3cjp h MET 52 Cb 0.52 -0.07 -0.04 0.00 0.06 0.00 0.00 31.60 32.07 3cjp h MET 52 CO 0.03 0.84 0.52 -0.22 1.06 0.00 0.00 176.91 179.14 3cjp h LYS 53 N 0.70 1.21 -0.50 1.72 3.64 -0.20 -0.07 116.57 123.06 3cjp h LYS 53 Ca 0.12 -0.12 -0.07 0.00 -1.27 0.00 0.00 60.65 59.31 3cjp h LYS 53 Cb 0.57 -0.25 -0.02 0.00 -0.41 0.00 0.00 32.23 32.12 3cjp h LYS 53 CO 0.04 0.86 0.03 0.87 -2.27 0.00 0.00 179.45 178.97 3cjp h LYS 54 N 1.22 0.83 -0.29 1.90 1.57 -1.02 -2.69 116.57 118.09 3cjp h LYS 54 Ca 0.32 -0.21 -0.11 0.00 -1.87 0.00 0.00 60.65 58.77 3cjp h LYS 54 Cb -0.03 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.17 3cjp h LYS 54 CO -0.06 0.81 -0.27 -0.07 -0.57 0.00 0.00 179.45 179.29 3cjp h LEU 55 N 0.77 0.59 -0.78 2.94 3.38 -0.86 -2.01 115.31 119.35 3cjp h LEU 55 Ca 0.15 -0.21 0.09 0.00 0.09 0.00 0.00 57.88 58.00 3cjp h LEU 55 Cb 0.43 -0.16 -0.07 0.00 0.09 0.00 0.00 40.66 40.95 3cjp h LEU 55 CO 0.02 0.84 0.43 0.78 0.09 0.00 0.00 178.44 180.60 3cjp h ASN 56 N 0.50 0.61 -0.40 -0.43 2.35 -0.77 0.74 115.58 118.19 3cjp h ASN 56 Ca 0.07 0.05 -0.03 0.00 -0.55 0.00 0.00 56.30 55.83 3cjp h ASN 56 Cb 0.73 -0.07 -0.02 0.00 0.05 0.00 0.00 38.32 39.02 3cjp h ASN 56 CO 0.06 0.36 0.12 0.44 -1.65 0.00 0.00 177.43 176.75 3cjp h ASP 57 N 0.74 0.59 0.55 5.81 3.45 -1.11 -1.19 116.42 125.26 3cjp h ASP 57 Ca 0.37 -0.21 -0.02 0.00 0.43 0.00 0.00 57.03 57.60 3cjp h ASP 57 Cb 0.34 -0.16 -0.00 0.00 -0.56 0.00 0.00 39.33 38.95 3cjp h ASP 57 CO -0.24 0.65 -0.31 0.58 -1.57 0.00 0.00 179.24 178.35 3cjp h VAL 58 N 0.51 0.37 -0.17 -1.35 2.07 -0.96 -1.28 116.25 115.44 3cjp h VAL 58 Ca 0.13 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.67 3cjp h VAL 58 Cb 0.28 0.37 -0.01 0.00 -1.52 0.00 0.00 31.29 30.41 3cjp h VAL 58 CO -0.00 0.00 0.11 0.58 0.02 0.00 0.00 177.57 178.28 3cjp h VAL 59 N -0.80 0.98 0.00 2.57 2.07 -0.83 0.27 116.25 120.50 3cjp h VAL 59 Ca -0.07 -0.04 0.00 0.00 0.82 0.00 0.00 66.70 67.41 3cjp h VAL 59 Cb 0.64 0.86 0.00 0.00 -1.52 0.00 0.00 31.29 31.27 3cjp h VAL 59 CO 0.09 0.02 0.00 0.59 0.02 0.00 0.00 177.57 178.29 3cjp n ASN 60 N -4.51 0.11 0.00 0.57 3.02 -0.46 -4.49 115.26 109.51 3cjp n ASN 60 Ca 0.00 0.51 0.00 0.00 -0.03 0.00 0.00 54.58 55.07 3cjp n ASN 60 Cb 0.17 -0.54 0.00 0.00 -0.61 0.00 0.00 39.78 38.79 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 1.12 0.68 0.07 7.41 0.00 0.95 -4.45 105.19 110.96 3cjp n GLY 61 Ca 0.06 -0.39 0.12 0.00 0.00 0.00 0.00 46.02 45.81 3cjp n GLY 61 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3cjp n LYS 62 N -2.56 0.15 -0.31 1.61 5.02 -0.55 -3.58 118.16 117.94 3cjp n LYS 62 Ca 0.00 0.22 0.07 0.00 -2.02 0.00 0.00 58.31 56.58 3cjp n LYS 62 Cb 0.00 -1.71 0.21 0.00 -0.02 0.00 0.00 35.03 33.51 3cjp n LYS 62 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 3cjp n THR 63 N -1.97 1.58 0.03 -0.18 -2.24 -1.26 -4.85 114.28 105.40 3cjp n THR 63 Ca 0.05 -1.38 -0.04 0.00 -2.27 0.00 0.00 64.05 60.40 3cjp n THR 63 Cb 0.32 0.16 0.17 0.00 -2.10 0.00 0.00 70.33 68.88 3cjp n THR 63 CO 0.00 0.00 0.00 0.78 -0.57 0.00 0.00 175.07 175.28 3cjp h ASN 64 N 2.00 0.45 0.55 3.42 2.35 -1.87 -2.33 115.58 120.15 3cjp h ASN 64 Ca 0.00 -0.18 0.00 0.00 -0.55 0.00 0.00 56.30 55.57 3cjp h ASN 64 Cb 1.06 -0.12 0.00 0.00 0.05 0.00 0.00 38.32 39.31 3cjp h ASN 64 CO 0.11 0.78 -0.05 -1.54 -1.65 0.00 0.00 177.43 175.08 3cjp n SER 65 N -4.05 0.15 -4.73 5.81 3.41 -1.20 -1.39 113.62 111.62 3cjp n SER 65 Ca -0.01 -0.21 -0.41 0.00 -0.26 0.00 0.00 58.87 57.98 3cjp n SER 65 Cb 0.48 -0.23 -0.03 0.00 -0.26 0.00 0.00 64.21 64.17 3cjp n SER 65 CO 0.00 0.00 0.00 -0.04 -0.16 0.00 0.00 175.04 174.84 3cjp s MET 66 N -2.60 4.43 -0.18 4.33 -1.94 -0.88 -4.88 119.30 117.58 3cjp s MET 66 Ca 0.27 1.96 -0.16 0.00 -1.71 0.00 0.00 55.69 56.04 3cjp s MET 66 Cb 0.20 -3.23 -0.06 0.00 2.01 0.00 0.00 34.83 33.75 3cjp s MET 66 CO 0.48 -0.20 -0.32 -0.89 -0.01 0.00 0.00 175.02 174.08 3cjp n ILE 67 N 2.77 1.49 -0.34 2.53 5.41 -1.26 -4.39 119.36 125.57 3cjp n ILE 67 Ca 0.06 0.12 0.15 0.00 1.00 0.00 0.00 62.75 64.08 3cjp n ILE 67 Cb 0.44 -2.33 0.36 0.00 -0.71 0.00 0.00 39.64 37.40 3cjp n ILE 67 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 176.55 176.99 3cjp h ASP 68 N -1.00 0.71 -0.11 4.38 3.45 -1.99 -0.98 116.42 120.89 3cjp h ASP 68 Ca -0.04 0.09 -0.18 0.00 0.43 0.00 0.00 57.03 57.33 3cjp h ASP 68 Cb 0.96 -0.04 -0.00 0.00 -0.56 0.00 0.00 39.33 39.69 3cjp h ASP 68 CO -0.03 0.24 -0.58 0.58 -1.57 0.00 0.00 179.24 177.89 3cjp h VAL 69 N 0.69 1.30 -0.34 -1.35 2.07 -2.00 -0.56 116.25 116.05 3cjp h VAL 69 Ca 0.57 -1.80 -0.10 0.00 0.82 0.00 0.00 66.70 66.19 3cjp h VAL 69 Cb 0.99 1.74 -0.01 0.00 -1.52 0.00 0.00 31.29 32.49 3cjp h VAL 69 CO -0.35 0.57 -0.21 0.03 0.02 0.00 0.00 177.57 177.63 3cjp h ARG 70 N 0.53 0.65 -0.37 1.57 3.08 -1.49 -1.57 114.38 116.79 3cjp h ARG 70 Ca 0.00 -0.24 -0.08 0.00 0.07 0.00 0.00 59.98 59.73 3cjp h ARG 70 Cb 1.16 -0.04 -0.01 0.00 0.08 0.00 0.00 29.97 31.15 3cjp h ARG 70 CO 0.12 0.81 -0.09 0.00 -1.07 0.00 0.00 179.97 179.74 3cjp h ARG 71 N 0.58 0.72 -0.37 0.04 3.08 -1.06 -1.29 114.38 116.08 3cjp h ARG 71 Ca 0.09 -0.28 -0.01 0.00 0.07 0.00 0.00 59.98 59.85 3cjp h ARG 71 Cb 0.67 -0.04 -0.02 0.00 0.08 0.00 0.00 29.97 30.66 3cjp h ARG 71 CO 0.05 0.87 0.20 -0.97 -1.07 0.00 0.00 179.97 179.05 3cjp h ASN 72 N 0.51 0.47 -0.23 7.04 -1.24 -0.99 -1.70 115.58 119.44 3cjp h ASN 72 Ca 0.09 -0.10 -0.01 0.00 0.71 0.00 0.00 56.30 57.00 3cjp h ASN 72 Cb 0.61 -0.12 -0.01 0.00 0.73 0.00 0.00 38.32 39.53 3cjp h ASN 72 CO 0.04 0.43 0.13 0.77 -1.29 0.00 0.00 177.43 177.50 3cjp h SER 73 N 0.47 0.30 -0.49 1.15 4.64 -1.27 -0.62 113.55 117.73 3cjp h SER 73 Ca 0.13 -0.02 -0.08 0.00 -0.47 0.00 0.00 61.79 61.35 3cjp h SER 73 Cb 0.07 -0.08 -0.02 0.00 -0.31 0.00 0.00 62.40 62.07 3cjp h SER 73 CO -0.02 0.26 -0.01 0.40 -0.87 0.00 0.00 176.83 176.59 3cjp h ILE 74 N 0.35 1.26 -0.50 0.95 2.04 -0.90 -0.93 117.51 119.78 3cjp h ILE 74 Ca 0.09 -1.09 0.03 0.00 1.00 0.00 0.00 64.86 64.89 3cjp h ILE 74 Cb 0.03 0.99 -0.04 0.00 -0.74 0.00 0.00 36.82 37.07 3cjp h ILE 74 CO -0.01 0.38 0.28 0.11 0.00 0.00 0.00 178.15 178.91 3cjp h LYS 75 N 0.73 0.54 -0.15 2.37 1.57 -0.59 0.19 116.57 121.23 3cjp h LYS 75 Ca 0.14 -0.03 0.04 0.00 -1.87 0.00 0.00 60.65 58.92 3cjp h LYS 75 Cb 0.53 -0.12 -0.04 0.00 0.08 0.00 0.00 32.23 32.68 3cjp h LYS 75 CO 0.03 0.36 -0.07 1.49 -0.57 0.00 0.00 179.45 180.68 3cjp h GLU 76 N 0.56 -0.06 -0.22 3.15 4.81 -1.07 -1.73 114.58 120.02 3cjp h GLU 76 Ca 0.21 0.00 0.03 0.00 -0.13 0.00 0.00 59.36 59.47 3cjp h GLU 76 Cb 0.05 0.01 -0.03 0.00 0.63 0.00 0.00 28.75 29.42 3cjp h GLU 76 CO -0.11 -0.04 0.04 1.25 -0.73 0.00 0.00 179.01 179.42 3cjp h LEU 77 N -0.06 -0.00 -1.05 1.64 5.85 -0.28 -0.40 115.31 121.01 3cjp h LEU 77 Ca 0.08 0.04 -0.05 0.00 0.84 0.00 0.00 57.88 58.79 3cjp h LEU 77 Cb 0.18 0.05 -0.02 0.00 0.37 0.00 0.00 40.66 41.24 3cjp h LEU 77 CO -0.19 0.03 0.08 0.71 -0.34 0.00 0.00 178.44 178.73 3cjp h THR 78 N 0.12 1.22 -0.31 1.05 1.35 -0.53 -0.79 112.91 115.02 3cjp h THR 78 Ca 0.10 -0.84 -0.12 0.00 -0.55 0.00 0.00 66.41 65.00 3cjp h THR 78 Cb 0.10 0.77 -0.01 0.00 -1.73 0.00 0.00 68.15 67.28 3cjp h THR 78 CO -0.14 0.30 -0.29 0.78 -0.25 0.00 0.00 175.52 175.93 3cjp h ASN 79 N 0.72 0.66 -0.13 5.36 2.35 -0.94 -1.66 115.58 121.95 3cjp h ASN 79 Ca 0.16 -0.25 -0.03 0.00 -0.55 0.00 0.00 56.30 55.62 3cjp h ASN 79 Cb 0.33 -0.18 -0.00 0.00 0.05 0.00 0.00 38.32 38.51 3cjp h ASN 79 CO 0.00 0.91 -0.05 0.58 -1.65 0.00 0.00 177.43 177.23 3cjp h VAL 80 N 0.56 1.30 -0.76 2.81 2.07 -0.53 -3.14 116.25 118.56 3cjp h VAL 80 Ca 0.07 -1.03 0.01 0.00 0.82 0.00 0.00 66.70 66.57 3cjp h VAL 80 Cb 0.77 1.71 -0.04 0.00 -1.52 0.00 0.00 31.29 32.22 3cjp h VAL 80 CO 0.06 0.30 0.50 0.40 0.02 0.00 0.00 177.57 178.85 3cjp h ILE 81 N -0.06 1.18 -0.10 4.57 2.04 -1.14 -2.30 117.51 121.70 3cjp h ILE 81 Ca 0.03 -0.35 -0.04 0.00 1.00 0.00 0.00 64.86 65.50 3cjp h ILE 81 Cb 0.49 0.08 -0.01 0.00 -0.74 0.00 0.00 36.82 36.64 3cjp h ILE 81 CO 0.02 0.18 -0.13 -0.61 0.00 0.00 0.00 178.15 177.61 3cjp h GLN 82 N 1.01 0.15 -0.29 2.37 4.15 -1.29 -0.64 115.11 120.57 3cjp h GLN 82 Ca 0.28 -0.03 -0.16 0.00 0.77 0.00 0.00 58.65 59.51 3cjp h GLN 82 Cb -0.09 -0.02 -0.01 0.00 0.21 0.00 0.00 27.48 27.57 3cjp h GLN 82 CO -0.06 0.29 -0.45 0.00 -1.93 0.00 0.00 178.83 176.67 3cjp h ALA 83 N 1.73 0.65 -2.09 3.38 0.00 -1.37 -3.37 119.26 118.18 3cjp h ALA 83 Ca 0.03 -0.47 -0.55 0.00 0.00 0.00 0.00 54.91 53.91 3cjp h ALA 83 Cb 0.32 -0.10 -0.40 0.00 0.00 0.00 0.00 17.79 17.61 3cjp h ALA 83 CO 0.02 0.67 -0.94 0.66 0.00 0.00 0.00 179.25 179.66 3cjp n TYR 84 N -4.02 1.42 0.36 0.00 4.02 -0.63 -4.94 117.16 113.37 3cjp n TYR 84 Ca -0.03 -3.84 0.14 0.00 -0.01 0.00 0.00 57.90 54.17 3cjp n TYR 84 Cb 0.57 -0.44 0.56 0.00 -0.02 0.00 0.00 39.34 40.00 3cjp n TYR 84 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 176.86 174.85 3cjp h PRO 85 N 3.61 0.00 0.00 -0.72 0.13 -1.33 -0.77 132.00 132.92 3cjp h PRO 85 Ca 0.12 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.25 3cjp h PRO 85 Cb 0.79 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.92 3cjp h PRO 85 CO 0.62 0.00 -0.11 0.66 -0.23 0.00 0.00 178.00 178.93 3cjp h SER 86 N 0.00 0.00 0.00 1.44 4.64 -1.92 -3.37 113.55 114.34 3cjp h SER 86 Ca 0.00 -0.02 -0.02 0.00 -0.47 0.00 0.00 61.79 61.28 3cjp h SER 86 Cb 0.46 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.54 3cjp h SER 86 CO 0.00 0.01 -1.76 0.54 -0.87 0.00 0.00 176.83 174.75 3cjp n ARG 87 N -2.56 0.56 -4.69 4.77 5.12 -0.52 -4.81 116.66 114.53 3cjp n ARG 87 Ca 0.05 -0.14 -0.25 0.00 -1.93 0.00 0.00 57.85 55.58 3cjp n ARG 87 Cb 0.47 -1.39 -0.14 0.00 -1.16 0.00 0.00 32.46 30.24 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 -3.08 1.65 0.12 -1.55 2.02 -0.41 -0.76 117.35 115.34 3cjp s TYR 88 Ca -0.06 -0.34 0.05 0.00 -0.37 0.00 0.00 57.07 56.35 3cjp s TYR 88 Cb 0.10 -1.01 -0.04 0.00 -0.40 0.00 0.00 41.96 40.61 3cjp s TYR 88 CO 0.67 0.04 -0.12 0.14 -1.57 0.00 0.00 175.55 174.71 3cjp s VAL 89 N -0.66 1.19 0.04 0.71 -7.23 -0.81 -4.75 120.40 108.89 3cjp s VAL 89 Ca 0.06 -1.81 0.03 0.00 -1.81 0.00 0.00 61.98 58.46 3cjp s VAL 89 Cb -0.08 -1.59 -0.02 0.00 0.56 0.00 0.00 36.38 35.25 3cjp s VAL 89 CO 0.01 -0.55 -0.10 -0.83 -0.31 0.00 0.00 175.10 173.31 3cjp s GLY 90 N -2.68 0.62 -0.02 2.32 0.00 -1.26 0.07 107.32 106.37 3cjp s GLY 90 Ca 0.10 -0.76 0.03 0.00 0.00 0.00 0.00 44.72 44.10 3cjp s GLY 90 CO 0.02 -0.77 -0.10 -1.36 0.00 0.00 0.00 173.10 170.88 3cjp s PHE 91 N -1.05 2.80 0.03 1.90 0.40 -0.23 -0.58 117.98 121.24 3cjp s PHE 91 Ca -0.04 -0.09 0.07 0.00 -0.60 0.00 0.00 56.93 56.27 3cjp s PHE 91 Cb -0.08 -1.61 -0.03 0.00 0.51 0.00 0.00 43.02 41.80 3cjp s PHE 91 CO 0.01 0.30 -0.18 0.20 0.70 0.00 0.00 175.22 176.24 3cjp s GLY 92 N -1.11 1.54 0.30 4.36 0.00 -0.78 -3.58 107.32 108.06 3cjp s GLY 92 Ca 0.14 -1.17 -0.13 0.00 0.00 0.00 0.00 44.72 43.56 3cjp s GLY 92 CO 0.04 -1.05 0.69 0.21 0.00 0.00 0.00 173.10 172.99 3cjp s ASN 93 N -1.31 6.71 -0.05 1.64 2.47 -0.88 -1.32 114.94 122.21 3cjp s ASN 93 Ca 0.14 1.17 0.03 0.00 0.42 0.00 0.00 52.86 54.61 3cjp s ASN 93 Cb -0.10 -2.33 0.01 0.00 -1.45 0.00 0.00 41.25 37.38 3cjp s ASN 93 CO 0.04 -0.18 -0.11 -0.69 -3.72 0.00 0.00 177.10 172.44 3cjp s VAL 94 N -1.97 1.02 0.33 -5.21 1.01 -1.26 -4.89 120.40 109.43 3cjp s VAL 94 Ca 0.52 -0.45 -0.29 0.00 0.00 0.00 0.00 61.98 61.77 3cjp s VAL 94 Cb -0.10 -0.93 -0.11 0.00 0.00 0.00 0.00 36.38 35.24 3cjp s VAL 94 CO 0.19 0.32 1.49 -2.84 0.00 0.00 0.00 175.10 174.26 3cjp s PRO 95 N 0.47 4.17 -0.17 2.72 0.02 -1.26 -4.98 135.00 135.96 3cjp s PRO 95 Ca -0.10 2.49 -0.09 0.00 0.02 0.00 0.00 61.00 63.33 3cjp s PRO 95 Cb -0.13 -3.02 -0.05 0.00 0.02 0.00 0.00 34.50 31.32 3cjp s PRO 95 CO 0.02 -0.50 0.11 0.08 -0.33 0.00 0.00 177.00 176.39 3cjp s VAL 96 N -0.62 5.28 0.00 3.83 1.01 -0.48 -4.44 120.40 124.98 3cjp s VAL 96 Ca 0.56 0.14 0.00 0.00 0.00 0.00 0.00 61.98 62.68 3cjp s VAL 96 Cb -0.45 -3.37 0.00 0.00 0.00 0.00 0.00 36.38 32.56 3cjp s VAL 96 CO 0.54 0.49 0.00 0.61 0.00 0.00 0.00 175.10 176.74 3cjp n GLY 97 N 3.11 1.32 4.02 4.51 0.00 -1.26 -3.24 105.19 113.65 3cjp n GLY 97 Ca -0.17 -0.08 -0.19 0.00 0.00 0.00 0.00 46.02 45.58 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 0.00 3.36 0.78 0.99 1.43 -1.26 -4.97 118.68 119.01 3cjp s LEU 98 Ca 0.00 -0.60 -0.11 0.00 -1.03 0.00 0.00 54.13 52.39 3cjp s LEU 98 Cb 0.00 -2.16 0.06 0.00 0.03 0.00 0.00 46.19 44.12 3cjp s LEU 98 CO 0.00 -1.08 1.08 -0.94 0.23 0.00 0.00 176.35 175.64 3cjp s SER 99 N -4.51 4.53 0.34 2.29 1.04 -1.26 -4.83 113.70 111.29 3cjp s SER 99 Ca 0.59 1.56 0.03 0.00 0.48 0.00 0.00 55.95 58.60 3cjp s SER 99 Cb -0.08 -2.31 0.59 0.00 0.10 0.00 0.00 66.02 64.32 3cjp s SER 99 CO 0.36 -1.98 1.93 -0.08 0.98 0.00 0.00 173.24 174.45 3cjp h GLU 100 N -1.09 0.70 0.05 4.02 4.81 -1.98 0.70 114.58 121.79 3cjp h GLU 100 Ca -0.46 -0.10 -0.00 0.00 -0.13 0.00 0.00 59.36 58.67 3cjp h GLU 100 Cb 1.25 -0.13 0.00 0.00 0.63 0.00 0.00 28.75 30.50 3cjp h GLU 100 CO 0.56 0.58 -0.02 -0.91 -0.73 0.00 0.00 179.01 178.48 3cjp h ASN 101 N 0.70 -0.06 0.42 1.04 2.35 -2.00 -2.22 115.58 115.82 3cjp h ASN 101 Ca 0.17 -0.26 -0.11 0.00 -0.55 0.00 0.00 56.30 55.55 3cjp h ASN 101 Cb 0.14 0.01 -0.01 0.00 0.05 0.00 0.00 38.32 38.51 3cjp h ASN 101 CO -0.02 0.23 -0.49 0.44 -1.65 0.00 0.00 177.43 175.94 3cjp h ASP 102 N -0.34 0.10 -0.34 5.81 3.32 -1.90 -1.93 116.42 121.13 3cjp h ASP 102 Ca -0.01 -0.05 -0.10 0.00 0.02 0.00 0.00 57.03 56.89 3cjp h ASP 102 Cb 0.31 -0.03 -0.01 0.00 0.22 0.00 0.00 39.33 39.82 3cjp h ASP 102 CO 0.01 0.58 -0.19 0.71 -1.72 0.00 0.00 179.24 178.63 3cjp h THR 103 N 0.07 1.29 -0.24 0.35 1.35 -0.89 -1.99 112.91 112.85 3cjp h THR 103 Ca 0.00 -1.32 -0.02 0.00 -0.55 0.00 0.00 66.41 64.52 3cjp h THR 103 Cb 0.90 1.40 -0.01 0.00 -1.73 0.00 0.00 68.15 68.71 3cjp h THR 103 CO 0.07 0.43 0.07 0.78 -0.25 0.00 0.00 175.52 176.62 3cjp h ASN 104 N 0.52 0.36 -0.47 5.36 2.35 -1.09 -0.32 115.58 122.28 3cjp h ASN 104 Ca 0.07 -0.22 -0.04 0.00 -0.55 0.00 0.00 56.30 55.57 3cjp h ASN 104 Cb 0.74 -0.09 -0.02 0.00 0.05 0.00 0.00 38.32 39.00 3cjp h ASN 104 CO 0.06 0.48 0.14 0.77 -1.65 0.00 0.00 177.43 177.23 3cjp h SER 105 N 0.22 0.69 -0.35 5.81 4.64 -1.43 0.11 113.55 123.24 3cjp h SER 105 Ca 0.08 -0.21 0.07 0.00 -0.47 0.00 0.00 61.79 61.25 3cjp h SER 105 Cb 0.26 -0.18 -0.06 0.00 -0.31 0.00 0.00 62.40 62.10 3cjp h SER 105 CO -0.00 0.72 -0.04 0.22 -0.87 0.00 0.00 176.83 176.86 3cjp h TYR 106 N 0.63 -0.10 -0.46 4.77 5.03 -1.19 0.12 116.97 125.77 3cjp h TYR 106 Ca 0.15 0.03 -0.03 0.00 2.58 0.00 0.00 58.73 61.46 3cjp h TYR 106 Cb 0.28 0.10 -0.02 0.00 1.55 0.00 0.00 36.73 38.63 3cjp h TYR 106 CO 0.01 -0.11 0.18 0.82 -1.32 0.00 0.00 178.16 177.75 3cjp h ILE 107 N 0.05 1.21 -0.07 1.81 2.04 -0.76 -0.64 117.51 121.14 3cjp h ILE 107 Ca 0.17 -0.64 0.03 0.00 1.00 0.00 0.00 64.86 65.41 3cjp h ILE 107 Cb 0.25 0.77 -0.03 0.00 -0.74 0.00 0.00 36.82 37.07 3cjp h ILE 107 CO -0.32 0.24 -0.08 -0.08 0.00 0.00 0.00 178.15 177.91 3cjp h GLU 108 N 0.60 -0.10 -0.14 2.37 4.57 -0.53 0.40 114.58 121.76 3cjp h GLU 108 Ca 0.15 0.01 -0.10 0.00 -1.18 0.00 0.00 59.36 58.24 3cjp h GLU 108 Cb 0.20 0.02 0.00 0.00 -0.16 0.00 0.00 28.75 28.81 3cjp h GLU 108 CO -0.01 -0.07 -0.31 1.49 -1.18 0.00 0.00 179.01 178.93 3cjp h GLU 109 N -0.11 0.45 0.00 1.92 4.81 -0.61 -1.05 114.58 120.00 3cjp h GLU 109 Ca 0.06 -0.31 -0.14 0.00 -0.13 0.00 0.00 59.36 58.85 3cjp h GLU 109 Cb 0.19 0.04 -0.03 0.00 0.63 0.00 0.00 28.75 29.59 3cjp h GLU 109 CO -0.14 0.92 -1.98 0.09 -0.73 0.00 0.00 179.01 177.16 3cjp n ASN 110 N -4.38 0.17 -0.02 1.04 3.02 -0.26 -4.09 115.26 110.73 3cjp n ASN 110 Ca -0.07 0.07 -0.03 0.00 -0.03 0.00 0.00 54.58 54.52 3cjp n ASN 110 Cb 0.48 1.35 -0.01 0.00 -0.61 0.00 0.00 39.78 41.00 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 -2.52 0.54 0.11 2.41 2.08 0.03 -4.43 119.36 117.58 3cjp n ILE 111 Ca -0.14 0.33 -0.13 0.00 0.56 0.00 0.00 62.75 63.38 3cjp n ILE 111 Cb 0.79 -1.71 -0.06 0.00 -0.75 0.00 0.00 39.64 37.91 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 -0.30 0.70 0.00 1.39 2.07 -1.30 -2.20 116.25 116.61 3cjp h VAL 112 Ca 0.00 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.52 3cjp h VAL 112 Cb 0.30 0.70 0.00 0.00 -1.52 0.00 0.00 31.29 30.77 3cjp h VAL 112 CO 0.00 0.00 0.00 0.78 0.02 0.00 0.00 177.57 178.37 3cjp h ASN 113 N -0.29 0.00 -0.17 0.57 2.35 -1.33 -0.45 115.58 116.26 3cjp h ASN 113 Ca 0.01 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.76 3cjp h ASN 113 Cb 0.28 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.65 3cjp h ASN 113 CO -0.04 0.00 0.00 0.59 -1.65 0.00 0.00 177.43 176.33 3cjp n ASN 114 N -2.49 3.17 -3.18 5.81 3.02 -0.90 -4.98 115.26 115.72 3cjp n ASN 114 Ca -0.00 -1.99 -0.23 0.00 -0.03 0.00 0.00 54.58 52.33 3cjp n ASN 114 Cb 0.13 -0.10 0.02 0.00 -0.61 0.00 0.00 39.78 39.23 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 1.40 -4.43 -2.00 3.52 5.02 -0.18 -4.98 118.16 116.50 3cjp n LYS 115 Ca 0.16 0.74 -0.33 0.00 -2.02 0.00 0.00 58.31 56.86 3cjp n LYS 115 Cb 0.60 -5.55 0.02 0.00 -0.02 0.00 0.00 35.03 30.08 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 -6.64 3.48 0.00 -0.35 1.43 -1.01 -4.91 118.68 110.69 3cjp s LEU 116 Ca 0.35 1.84 0.23 0.00 -1.03 0.00 0.00 54.13 55.53 3cjp s LEU 116 Cb -0.17 -4.54 0.07 0.00 0.03 0.00 0.00 46.19 41.59 3cjp s LEU 116 CO 0.44 -1.23 1.15 1.33 0.23 0.00 0.00 176.35 178.26 3cjp n VAL 117 N -2.09 0.00 -3.83 -1.59 0.24 0.25 -4.80 118.33 106.50 3cjp n VAL 117 Ca 0.09 -0.32 -0.03 0.00 -2.04 0.00 0.00 64.34 62.05 3cjp n VAL 117 Cb 0.53 1.29 0.01 0.00 -1.47 0.00 0.00 33.84 34.19 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 -2.36 -0.02 -0.12 7.63 0.00 -1.23 -4.29 107.32 106.93 3cjp s GLY 118 Ca 0.21 -0.14 0.02 0.00 0.00 0.00 0.00 44.72 44.82 3cjp s GLY 118 CO 0.50 1.66 -0.19 -0.42 0.00 0.00 0.00 173.10 174.65 3cjp s ILE 119 N -2.49 2.45 0.00 0.90 1.01 -0.08 -1.87 121.20 121.12 3cjp s ILE 119 Ca 0.19 -0.87 0.00 0.00 0.00 0.00 0.00 60.65 59.96 3cjp s ILE 119 Cb -0.02 -1.98 0.00 0.00 0.01 0.00 0.00 42.46 40.47 3cjp s ILE 119 CO 0.04 0.54 0.00 0.61 0.00 0.00 0.00 174.94 176.13 3cjp n GLY 120 N 3.61 0.80 3.59 6.18 0.00 -0.43 -0.76 105.19 118.17 3cjp n GLY 120 Ca -0.19 -1.50 -0.42 0.00 0.00 0.00 0.00 46.02 43.91 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 -1.74 3.77 0.38 1.61 2.12 -1.26 -2.07 118.70 121.50 3cjp s GLU 121 Ca 0.00 0.40 -0.27 0.00 0.36 0.00 0.00 54.97 55.46 3cjp s GLU 121 Cb 0.00 -3.82 -0.09 0.00 0.26 0.00 0.00 34.13 30.48 3cjp s GLU 121 CO 0.00 -0.91 1.26 -0.51 -0.54 0.00 0.00 175.26 174.55 3cjp s LEU 122 N 3.28 4.29 -0.53 2.70 1.43 -0.15 -4.83 118.68 124.87 3cjp s LEU 122 Ca 0.34 2.56 0.06 0.00 -1.03 0.00 0.00 54.13 56.07 3cjp s LEU 122 Cb -0.13 -3.84 0.22 0.00 0.03 0.00 0.00 46.19 42.47 3cjp s LEU 122 CO 0.18 -0.68 0.56 0.35 0.23 0.00 0.00 176.35 177.00 3cjp n THR 123 N 0.37 0.60 -2.05 5.49 -2.24 -1.26 -0.45 114.28 114.73 3cjp n THR 123 Ca 0.02 -4.45 -0.34 0.00 -2.27 0.00 0.00 64.05 57.01 3cjp n THR 123 Cb 0.44 -1.99 0.02 0.00 -2.10 0.00 0.00 70.33 66.70 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 -1.45 3.11 0.40 -0.78 0.04 -1.26 -4.13 135.00 130.94 3cjp s PRO 124 Ca 0.35 1.54 -0.23 0.00 0.04 0.00 0.00 61.00 62.69 3cjp s PRO 124 Cb 0.11 -1.98 -0.09 0.00 0.04 0.00 0.00 34.50 32.58 3cjp s PRO 124 CO -0.10 -1.03 1.02 0.00 0.04 0.00 0.00 177.00 176.93 3cjp s ALA 125 N -1.98 3.07 0.21 8.56 0.00 -1.26 -4.65 121.76 125.70 3cjp s ALA 125 Ca 0.71 0.62 -0.32 0.00 0.00 0.00 0.00 51.96 52.96 3cjp s ALA 125 Cb -0.23 -3.24 -0.14 0.00 0.00 0.00 0.00 23.12 19.52 3cjp s ALA 125 CO 0.33 -0.12 1.44 0.45 0.00 0.00 0.00 175.76 177.86 3cjp n SER 126 N -0.18 2.73 0.00 0.00 2.88 -1.26 -1.03 113.62 116.76 3cjp n SER 126 Ca 0.05 1.13 0.00 0.00 -1.33 0.00 0.00 58.87 58.72 3cjp n SER 126 Cb 0.51 -1.41 0.00 0.00 -0.75 0.00 0.00 64.21 62.56 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 2.50 2.84 1.49 0.46 0.00 -1.26 -4.92 105.19 106.29 3cjp n GLY 127 Ca 0.13 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.10 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 2.63 -0.04 1.61 1.13 -0.19 -4.60 117.38 115.92 3cjp n GLN 128 Ca 0.00 -3.06 -0.01 0.00 -1.94 0.00 0.00 57.00 51.99 3cjp n GLN 128 Cb 0.00 -1.99 0.26 0.00 0.11 0.00 0.00 30.24 28.62 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 1.61 1.21 0.00 5.09 1.08 -1.92 -2.63 117.51 121.95 3cjp h ILE 129 Ca 0.25 -0.84 -0.01 0.00 -0.39 0.00 0.00 64.86 63.88 3cjp h ILE 129 Cb 1.99 0.91 -0.00 0.00 -3.07 0.00 0.00 36.82 36.64 3cjp h ILE 129 CO 0.56 0.29 -0.02 0.11 -0.69 0.00 0.00 178.15 178.40 3cjp h LYS 130 N 0.58 0.00 0.00 2.37 1.57 -1.93 -1.39 116.57 117.77 3cjp h LYS 130 Ca 0.12 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.90 3cjp h LYS 130 Cb 0.35 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.66 3cjp h LYS 130 CO 0.01 0.02 0.00 -1.13 -0.57 0.00 0.00 179.45 177.78 3cjp n SER 131 N -3.21 0.00 -0.15 0.86 3.41 -0.99 -2.44 113.62 111.09 3cjp n SER 131 Ca -0.02 0.40 0.14 0.00 -0.26 0.00 0.00 58.87 59.13 3cjp n SER 131 Cb 0.18 -0.44 0.57 0.00 -0.26 0.00 0.00 64.21 64.26 3cjp n SER 131 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3cjp n LEU 132 N -1.44 0.61 -0.15 1.04 4.77 -0.52 -4.37 117.00 116.93 3cjp n LEU 132 Ca 0.04 -0.06 -0.03 0.00 -0.03 0.00 0.00 56.01 55.92 3cjp n LEU 132 Cb 0.13 -0.16 0.06 0.00 -2.33 0.00 0.00 43.42 41.12 3cjp n LEU 132 CO 0.11 0.11 0.93 0.50 -1.33 0.00 0.00 177.39 177.71 3cjp h LYS 133 N 0.75 0.27 0.00 3.23 3.64 -1.69 -1.59 116.57 121.19 3cjp h LYS 133 Ca 0.00 -0.02 -0.02 0.00 -1.27 0.00 0.00 60.65 59.34 3cjp h LYS 133 Cb 0.38 -0.06 -0.00 0.00 -0.41 0.00 0.00 32.23 32.14 3cjp h LYS 133 CO 0.00 0.18 -0.10 -1.35 -2.27 0.00 0.00 179.45 175.91 3cjp h PRO 134 N 0.28 0.00 -0.32 1.90 0.11 -1.87 0.12 132.00 132.23 3cjp h PRO 134 Ca 0.24 0.00 -0.18 0.00 0.11 0.00 0.00 66.00 66.17 3cjp h PRO 134 Cb 0.29 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.39 3cjp h PRO 134 CO -0.28 0.10 -0.49 0.82 -0.21 0.00 0.00 178.00 177.94 3cjp h ILE 135 N 0.00 1.28 -0.56 4.15 2.04 -1.61 -1.96 117.51 120.84 3cjp h ILE 135 Ca -0.00 -1.67 -0.03 0.00 1.00 0.00 0.00 64.86 64.15 3cjp h ILE 135 Cb 0.21 1.55 -0.02 0.00 -0.74 0.00 0.00 36.82 37.82 3cjp h ILE 135 CO 0.01 0.55 0.23 -0.26 0.00 0.00 0.00 178.15 178.68 3cjp h PHE 136 N 0.69 0.86 -0.06 1.37 -1.00 -0.97 -2.78 116.94 115.04 3cjp h PHE 136 Ca 0.03 -0.06 0.03 0.00 2.81 0.00 0.00 57.97 60.78 3cjp h PHE 136 Cb 1.09 -0.26 -0.04 0.00 3.61 0.00 0.00 35.95 40.36 3cjp h PHE 136 CO 0.07 0.69 -0.14 0.87 -1.61 0.00 0.00 178.31 178.19 3cjp h LYS 137 N 0.77 -0.20 -0.56 1.51 1.57 -0.70 0.31 116.57 119.28 3cjp h LYS 137 Ca 0.19 0.01 0.07 0.00 -1.87 0.00 0.00 60.65 59.05 3cjp h LYS 137 Cb 0.20 0.05 -0.06 0.00 0.08 0.00 0.00 32.23 32.49 3cjp h LYS 137 CO -0.02 -0.13 0.23 -0.92 -0.57 0.00 0.00 179.45 178.04 3cjp h TYR 138 N -0.21 0.42 -0.23 -1.35 3.20 -1.29 -2.46 116.97 115.05 3cjp h TYR 138 Ca 0.07 0.03 -0.05 0.00 3.14 0.00 0.00 58.73 61.91 3cjp h TYR 138 Cb 0.30 -0.10 -0.01 0.00 1.54 0.00 0.00 36.73 38.46 3cjp h TYR 138 CO -0.23 0.15 -0.07 1.03 -1.64 0.00 0.00 178.16 177.40 3cjp h SER 139 N 0.44 0.46 -0.99 -2.11 0.87 -1.18 -0.56 113.55 110.48 3cjp h SER 139 Ca 0.27 -0.38 0.36 0.00 -1.23 0.00 0.00 61.79 60.81 3cjp h SER 139 Cb 0.27 -0.13 -0.17 0.00 -0.44 0.00 0.00 62.40 61.93 3cjp h SER 139 CO -0.24 0.73 0.42 -0.03 -0.53 0.00 0.00 176.83 177.19 3cjp h MET 140 N 0.18 0.07 0.00 2.24 1.85 0.08 -2.57 114.93 116.78 3cjp h MET 140 Ca 0.06 -0.00 0.00 0.00 -0.61 0.00 0.00 59.70 59.14 3cjp h MET 140 Cb 0.54 -0.02 0.00 0.00 0.43 0.00 0.00 31.60 32.56 3cjp h MET 140 CO 0.03 0.05 0.00 -0.25 -0.40 0.00 0.00 176.91 176.33 3cjp n ASP 141 N -5.27 0.00 -4.22 1.39 8.00 -1.07 -4.74 116.55 110.64 3cjp n ASP 141 Ca 0.33 0.01 -0.43 0.00 0.71 0.00 0.00 54.79 55.41 3cjp n ASP 141 Cb 1.09 -0.02 0.00 0.00 -0.02 0.00 0.00 41.12 42.18 3cjp n ASP 141 CO 0.00 0.00 0.00 -0.24 -0.39 0.00 0.00 177.20 176.57 3cjp n SER 142 N -0.76 4.98 0.00 -2.24 2.88 -0.24 -4.27 113.62 113.97 3cjp n SER 142 Ca 0.00 -2.99 0.00 0.00 -1.33 0.00 0.00 58.87 54.55 3cjp n SER 142 Cb 0.00 -1.58 0.00 0.00 -0.75 0.00 0.00 64.21 61.88 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 3.93 0.83 4.24 0.46 0.00 -1.26 -4.58 105.19 108.82 3cjp n GLY 143 Ca 0.42 -0.01 -0.35 0.00 0.00 0.00 0.00 46.02 46.08 3cjp n GLY 143 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3cjp n SER 144 N 0.02 -0.29 -4.68 1.61 7.64 -0.97 -4.89 113.62 112.05 3cjp n SER 144 Ca 0.00 -1.27 -0.45 0.00 1.01 0.00 0.00 58.87 58.16 3cjp n SER 144 Cb 0.00 -1.56 -0.04 0.00 -1.01 0.00 0.00 64.21 61.60 3cjp n SER 144 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 3cjp n LEU 145 N -4.67 3.38 -4.77 -3.43 7.99 -1.26 -4.60 117.00 109.64 3cjp n LEU 145 Ca -0.27 1.07 -0.40 0.00 -0.01 0.00 0.00 56.01 56.39 3cjp n LEU 145 Cb 0.65 -1.46 0.01 0.00 -0.11 0.00 0.00 43.42 42.51 3cjp n LEU 145 CO 0.81 -0.14 1.07 -2.84 -1.51 0.00 0.00 177.39 174.78 3cjp s PRO 146 N 1.27 3.90 -0.19 3.23 0.02 -1.26 -4.64 135.00 137.33 3cjp s PRO 146 Ca 0.79 2.42 -0.05 0.00 0.02 0.00 0.00 61.00 64.18 3cjp s PRO 146 Cb -0.63 -2.79 -0.03 0.00 0.02 0.00 0.00 34.50 31.07 3cjp s PRO 146 CO 0.37 -0.65 -0.00 0.42 -0.33 0.00 0.00 177.00 176.82 3cjp s ILE 147 N -1.18 4.05 -0.23 2.83 1.01 -0.41 -0.91 121.20 126.36 3cjp s ILE 147 Ca 0.57 -0.29 -0.05 0.00 0.00 0.00 0.00 60.65 60.88 3cjp s ILE 147 Cb -0.44 -2.82 -0.02 0.00 0.01 0.00 0.00 42.46 39.20 3cjp s ILE 147 CO 0.57 0.45 0.01 0.86 0.00 0.00 0.00 174.94 176.83 3cjp s TRP 148 N 0.76 3.02 -0.17 3.97 -0.00 0.06 -0.79 118.94 125.78 3cjp s TRP 148 Ca 0.00 -0.64 0.01 0.00 -0.00 0.00 0.00 56.10 55.47 3cjp s TRP 148 Cb -0.14 -2.16 0.02 0.00 -0.00 0.00 0.00 33.47 31.19 3cjp s TRP 148 CO 0.02 -0.42 -0.18 0.42 -0.00 0.00 0.00 176.95 176.79 3cjp s ILE 149 N 1.46 1.87 0.05 5.86 1.01 -0.64 -0.98 121.20 129.83 3cjp s ILE 149 Ca 0.05 -0.82 -0.34 0.00 0.00 0.00 0.00 60.65 59.54 3cjp s ILE 149 Cb -0.15 -1.71 -0.13 0.00 0.01 0.00 0.00 42.46 40.48 3cjp s ILE 149 CO 0.00 0.51 1.69 1.57 0.00 0.00 0.00 174.94 178.71 3cjp n HIS 150 N 4.68 2.25 -1.61 3.97 -0.00 0.40 -0.52 115.22 124.39 3cjp n HIS 150 Ca -0.19 0.19 0.02 0.00 -0.00 0.00 0.00 57.72 57.73 3cjp n HIS 150 Cb 0.50 -2.58 0.03 0.00 -0.00 0.00 0.00 29.99 27.94 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 4.70 1.92 -1.31 1.57 0.00 -1.14 -4.74 120.51 121.52 3cjp n ALA 151 Ca 0.20 -1.26 -0.08 0.00 0.00 0.00 0.00 53.44 52.30 3cjp n ALA 151 Cb 0.28 -0.39 0.07 0.00 0.00 0.00 0.00 19.45 19.41 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 -0.30 -3.96 -1.49 0.00 7.35 -1.25 -3.45 117.46 114.35 3cjp n PHE 152 Ca 0.03 -0.42 -0.46 0.00 -0.76 0.00 0.00 57.45 55.84 3cjp n PHE 152 Cb 0.65 -0.37 -0.02 0.00 0.35 0.00 0.00 39.48 40.08 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 -3.33 0.00 -0.43 -2.13 5.03 -1.26 -1.88 115.26 111.27 3cjp n ASN 153 Ca 0.06 1.15 0.11 0.00 0.87 0.00 0.00 54.58 56.77 3cjp n ASN 153 Cb 0.21 -1.12 0.45 0.00 -1.02 0.00 0.00 39.78 38.30 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 0.86 1.57 -2.01 3.52 -0.04 -1.26 -4.90 135.00 132.73 3cjp n PRO 154 Ca 0.14 -0.85 -0.41 0.00 -0.04 0.00 0.00 63.50 62.34 3cjp n PRO 154 Cb 0.29 -1.40 -0.02 0.00 -0.04 0.00 0.00 33.50 32.33 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 -1.66 4.39 0.52 1.53 1.43 -0.79 -4.67 118.68 119.43 3cjp s LEU 155 Ca 0.33 2.71 0.05 0.00 -1.03 0.00 0.00 54.13 56.18 3cjp s LEU 155 Cb 0.17 -3.63 0.02 0.00 0.03 0.00 0.00 46.19 42.78 3cjp s LEU 155 CO 0.27 -0.69 0.29 0.68 0.23 0.00 0.00 176.35 177.13 3cjp s VAL 156 N -0.26 1.64 0.22 -1.59 -7.23 -1.26 -4.87 120.40 107.04 3cjp s VAL 156 Ca 0.57 -1.62 -0.10 0.00 -1.81 0.00 0.00 61.98 59.03 3cjp s VAL 156 Cb -0.42 -2.26 0.21 0.00 0.56 0.00 0.00 36.38 34.47 3cjp s VAL 156 CO 0.46 0.00 1.66 0.25 -0.31 0.00 0.00 175.10 177.16 3cjp h LEU 157 N 0.95 -0.27 -1.47 1.32 5.85 -1.95 -1.36 115.31 118.38 3cjp h LEU 157 Ca -0.39 0.16 -0.00 0.00 0.84 0.00 0.00 57.88 58.48 3cjp h LEU 157 Cb 1.30 0.27 -0.02 0.00 0.37 0.00 0.00 40.66 42.58 3cjp h LEU 157 CO 0.62 -0.12 0.27 -0.61 -0.34 0.00 0.00 178.44 178.27 3cjp h GLN 158 N 0.12 0.63 -0.77 1.25 5.75 -1.99 -1.49 115.11 118.61 3cjp h GLN 158 Ca 0.33 -0.05 -0.03 0.00 -0.15 0.00 0.00 58.65 58.76 3cjp h GLN 158 Cb 0.55 -0.13 -0.04 0.00 1.07 0.00 0.00 27.48 28.93 3cjp h GLN 158 CO -0.54 0.45 0.37 -0.44 -2.65 0.00 0.00 178.83 176.02 3cjp h ASP 159 N 0.64 1.01 -0.22 -0.69 3.32 -1.65 -0.34 116.42 118.49 3cjp h ASP 159 Ca 0.17 -0.13 -0.00 0.00 0.02 0.00 0.00 57.03 57.08 3cjp h ASP 159 Cb -0.01 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.27 3cjp h ASP 159 CO -0.03 0.85 0.12 0.40 -1.72 0.00 0.00 179.24 178.86 3cjp h ILE 160 N 1.08 1.11 -0.80 0.35 1.08 -0.93 -0.76 117.51 118.64 3cjp h ILE 160 Ca 0.27 -0.28 0.07 0.00 -0.39 0.00 0.00 64.86 64.53 3cjp h ILE 160 Cb 0.11 0.90 -0.06 0.00 -3.07 0.00 0.00 36.82 34.70 3cjp h ILE 160 CO -0.03 0.10 0.48 0.11 -0.69 0.00 0.00 178.15 178.11 3cjp h LYS 161 N 0.25 0.83 -0.48 2.37 1.57 -1.08 -1.10 116.57 118.93 3cjp h LYS 161 Ca 0.08 -0.05 -0.11 0.00 -1.87 0.00 0.00 60.65 58.70 3cjp h LYS 161 Cb 0.06 -0.19 -0.02 0.00 0.08 0.00 0.00 32.23 32.16 3cjp h LYS 161 CO -0.01 0.55 -0.13 0.93 -0.57 0.00 0.00 179.45 180.21 3cjp h GLU 162 N 0.85 0.90 -0.10 3.15 5.08 -0.74 -1.86 114.58 121.86 3cjp h GLU 162 Ca 0.36 -0.33 0.02 0.00 -1.00 0.00 0.00 59.36 58.42 3cjp h GLU 162 Cb 0.22 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.39 3cjp h GLU 162 CO -0.19 0.97 -0.04 0.82 -1.00 0.00 0.00 179.01 179.57 3cjp h ILE 163 N 0.80 0.86 -0.57 3.13 2.04 -0.69 -2.43 117.51 120.65 3cjp h ILE 163 Ca 0.13 0.00 0.11 0.00 1.00 0.00 0.00 64.86 66.10 3cjp h ILE 163 Cb 0.66 0.86 -0.11 0.00 -0.74 0.00 0.00 36.82 37.49 3cjp h ILE 163 CO 0.05 0.00 -0.24 0.00 0.00 0.00 0.00 178.15 177.96 3cjp h ALA 164 N 1.07 0.18 -0.82 1.87 0.00 -1.02 -1.26 119.26 119.29 3cjp h ALA 164 Ca 0.05 0.20 0.06 0.00 0.00 0.00 0.00 54.91 55.23 3cjp h ALA 164 Cb 0.11 0.60 -0.05 0.00 0.00 0.00 0.00 17.79 18.45 3cjp h ALA 164 CO -0.12 -0.55 0.53 0.93 0.00 0.00 0.00 179.25 180.05 3cjp h GLU 165 N -0.09 0.87 -0.48 0.00 4.39 -1.05 -1.72 114.58 116.50 3cjp h GLU 165 Ca 0.26 -0.05 -0.09 0.00 0.34 0.00 0.00 59.36 59.82 3cjp h GLU 165 Cb 0.50 -0.20 -0.02 0.00 -0.10 0.00 0.00 28.75 28.94 3cjp h GLU 165 CO -0.64 0.57 -0.05 -0.07 -1.16 0.00 0.00 179.01 177.67 3cjp h LEU 166 N 0.89 0.88 -0.56 1.33 3.38 -0.84 -1.32 115.31 119.07 3cjp h LEU 166 Ca 0.35 -0.33 0.11 0.00 0.09 0.00 0.00 57.88 58.10 3cjp h LEU 166 Cb 0.23 -0.24 -0.10 0.00 0.09 0.00 0.00 40.66 40.64 3cjp h LEU 166 CO -0.13 1.01 -0.08 0.00 0.09 0.00 0.00 178.44 179.33 3cjp h LYS 168 N 0.05 1.07 0.00 0.00 1.57 -1.05 -2.69 116.57 115.51 3cjp h LYS 168 Ca 0.28 -0.26 -0.02 0.00 -1.87 0.00 0.00 60.65 58.78 3cjp h LYS 168 Cb 0.44 -0.14 -0.00 0.00 0.08 0.00 0.00 32.23 32.61 3cjp h LYS 168 CO -0.54 0.96 -0.10 0.00 -0.57 0.00 0.00 179.45 179.20 3cjp h ALA 169 N 1.14 0.97 -2.12 3.86 0.00 -0.81 -3.31 119.26 118.98 3cjp h ALA 169 Ca 0.21 -0.09 -0.56 0.00 0.00 0.00 0.00 54.91 54.46 3cjp h ALA 169 Cb 0.38 -0.02 -0.41 0.00 0.00 0.00 0.00 17.79 17.75 3cjp h ALA 169 CO 0.00 0.13 -0.87 1.19 0.00 0.00 0.00 179.25 179.71 3cjp n PHE 170 N -3.17 1.94 0.31 0.00 3.01 0.06 -4.98 117.46 114.63 3cjp n PHE 170 Ca 0.02 -3.89 0.20 0.00 1.01 0.00 0.00 57.45 54.79 3cjp n PHE 170 Cb 0.46 -0.46 1.05 0.00 -0.01 0.00 0.00 39.48 40.51 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 3.64 0.00 -0.00 -1.08 0.13 -1.59 -1.49 132.00 131.61 3cjp h PRO 171 Ca 0.13 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.26 3cjp h PRO 171 Cb 0.75 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.88 3cjp h PRO 171 CO 0.66 0.00 -0.20 1.63 -0.23 0.00 0.00 178.00 179.86 3cjp n LYS 172 N -2.98 0.56 -3.61 0.86 5.02 -1.26 -4.66 118.16 112.09 3cjp n LYS 172 Ca -0.02 -0.24 -0.39 0.00 -2.02 0.00 0.00 58.31 55.63 3cjp n LYS 172 Cb 0.12 -1.49 -0.11 0.00 -0.02 0.00 0.00 35.03 33.52 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 -2.61 4.92 0.30 -0.18 1.01 -0.56 -4.85 120.40 118.41 3cjp s VAL 173 Ca 0.24 -0.27 -0.29 0.00 0.00 0.00 0.00 61.98 61.65 3cjp s VAL 173 Cb 0.19 -3.49 -0.10 0.00 0.00 0.00 0.00 36.38 32.99 3cjp s VAL 173 CO 0.53 0.07 1.25 -2.84 0.00 0.00 0.00 175.10 174.11 3cjp s PRO 174 N 1.67 4.44 -0.06 2.72 0.02 -1.26 -4.87 135.00 137.66 3cjp s PRO 174 Ca 0.05 2.08 0.04 0.00 0.02 0.00 0.00 61.00 63.19 3cjp s PRO 174 Cb -0.17 -3.12 0.00 0.00 0.02 0.00 0.00 34.50 31.23 3cjp s PRO 174 CO 0.08 -0.09 -0.17 0.08 -0.33 0.00 0.00 177.00 176.58 3cjp s VAL 175 N -0.95 1.42 -0.24 3.83 1.01 -0.13 -1.29 120.40 124.05 3cjp s VAL 175 Ca 0.49 -0.69 -0.05 0.00 0.00 0.00 0.00 61.98 61.73 3cjp s VAL 175 Cb -0.37 -1.24 -0.01 0.00 0.00 0.00 0.00 36.38 34.76 3cjp s VAL 175 CO 0.47 0.41 0.02 -0.63 0.00 0.00 0.00 175.10 175.37 3cjp s ILE 176 N 0.25 3.76 -0.54 2.22 1.01 0.03 -0.83 121.20 127.10 3cjp s ILE 176 Ca -0.09 -0.44 -0.26 0.00 0.00 0.00 0.00 60.65 59.86 3cjp s ILE 176 Cb -0.13 -2.78 0.03 0.00 0.01 0.00 0.00 42.46 39.59 3cjp s ILE 176 CO 0.03 0.33 1.03 -0.22 0.00 0.00 0.00 174.94 176.11 3cjp s LEU 177 N 1.52 3.86 -0.09 2.97 2.96 -0.17 -1.63 118.68 128.10 3cjp s LEU 177 Ca 0.05 -0.10 -0.38 0.00 -0.22 0.00 0.00 54.13 53.48 3cjp s LEU 177 Cb -0.15 -3.03 -0.16 0.00 0.50 0.00 0.00 46.19 43.35 3cjp s LEU 177 CO -0.00 -1.28 1.56 0.61 -1.32 0.00 0.00 176.35 175.91 3cjp n GLY 178 N 5.06 0.70 2.30 7.98 0.00 0.33 -0.77 105.19 120.79 3cjp n GLY 178 Ca 0.05 0.82 -0.12 0.00 0.00 0.00 0.00 46.02 46.77 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 4.03 -0.17 -1.61 1.61 8.25 -1.15 -2.40 115.22 123.79 3cjp n HIS 179 Ca 0.22 0.00 -0.20 0.00 -0.26 0.00 0.00 57.72 57.49 3cjp n HIS 179 Cb 0.17 -2.30 -0.08 0.00 1.12 0.00 0.00 29.99 28.90 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 -2.49 -1.37 -0.99 -0.41 0.00 -0.23 -1.72 117.12 109.90 3cjp n MET 180 Ca -0.12 1.18 0.00 0.00 0.00 0.00 0.00 57.70 58.75 3cjp n MET 180 Cb 0.45 -5.52 0.00 0.00 0.00 0.00 0.00 33.22 28.15 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 -0.60 0.49 7.00 3.03 0.00 -1.01 -3.59 105.19 110.51 3cjp n GLY 181 Ca -0.20 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.82 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 -2.50 2.74 0.00 -0.02 0.00 -0.70 -0.99 105.19 103.72 3cjp n GLY 182 Ca 0.00 -0.29 0.05 0.00 0.00 0.00 0.00 46.02 45.78 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 4.80 0.00 -1.93 1.61 7.64 -1.26 -1.98 113.62 122.50 3cjp n SER 183 Ca 0.00 0.42 0.00 0.00 1.01 0.00 0.00 58.87 60.30 3cjp n SER 183 Cb 0.00 -0.45 0.35 0.00 -1.01 0.00 0.00 64.21 63.10 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 -1.45 5.22 -0.07 6.43 3.02 -0.16 -4.65 115.26 123.60 3cjp n ASN 184 Ca 0.03 -3.05 0.10 0.00 -0.03 0.00 0.00 54.58 51.63 3cjp n ASN 184 Cb 0.12 -0.71 0.47 0.00 -0.61 0.00 0.00 39.78 39.05 3cjp n ASN 184 CO 0.00 0.00 0.00 4.11 -2.62 0.00 0.00 177.26 178.75 3cjp h TRP 185 N 3.26 0.48 -0.26 3.10 5.08 -1.45 -1.39 115.95 124.78 3cjp h TRP 185 Ca 0.13 0.01 0.02 0.00 1.08 0.00 0.00 58.89 60.14 3cjp h TRP 185 Cb 2.14 -0.16 -0.02 0.00 -3.00 0.00 0.00 29.16 28.11 3cjp h TRP 185 CO 1.17 0.25 0.11 0.52 -1.28 0.00 0.00 178.44 179.22 3cjp h MET 186 N 0.47 0.24 -0.30 0.12 2.86 -1.87 0.32 114.93 116.77 3cjp h MET 186 Ca 0.25 -0.01 -0.12 0.00 -2.06 0.00 0.00 59.70 57.75 3cjp h MET 186 Cb 0.38 -0.05 -0.00 0.00 0.06 0.00 0.00 31.60 31.98 3cjp h MET 186 CO -0.07 0.16 -0.30 1.15 1.06 0.00 0.00 176.91 178.91 3cjp h THR 187 N 0.25 1.30 -0.57 2.22 2.02 -1.86 -2.60 112.91 113.67 3cjp h THR 187 Ca 0.11 -1.47 0.09 0.00 0.77 0.00 0.00 66.41 65.91 3cjp h THR 187 Cb 0.05 1.55 -0.07 0.00 -1.74 0.00 0.00 68.15 67.94 3cjp h THR 187 CO -0.09 0.47 0.20 0.00 0.37 0.00 0.00 175.52 176.47 3cjp h ALA 188 N 0.71 0.71 -0.39 6.16 0.00 -1.09 -0.91 119.26 124.45 3cjp h ALA 188 Ca 0.05 0.08 -0.13 0.00 0.00 0.00 0.00 54.91 54.91 3cjp h ALA 188 Cb 0.87 0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.71 3cjp h ALA 188 CO 0.07 -0.21 -0.29 -0.24 0.00 0.00 0.00 179.25 178.58 3cjp h VAL 189 N 0.37 1.28 -0.70 0.00 3.04 -0.35 -1.17 116.25 118.72 3cjp h VAL 189 Ca 0.28 -1.44 0.06 0.00 -1.01 0.00 0.00 66.70 64.59 3cjp h VAL 189 Cb 0.34 1.28 -0.06 0.00 -2.01 0.00 0.00 31.29 30.85 3cjp h VAL 189 CO -0.30 0.48 0.40 -0.33 -1.01 0.00 0.00 177.57 176.81 3cjp h GLU 190 N 0.71 0.71 -0.23 4.17 5.08 -1.16 -1.72 114.58 122.13 3cjp h GLU 190 Ca 0.08 -0.04 -0.19 0.00 -1.00 0.00 0.00 59.36 58.21 3cjp h GLU 190 Cb 0.84 -0.16 0.00 0.00 0.50 0.00 0.00 28.75 29.93 3cjp h GLU 190 CO 0.07 0.47 -0.61 -0.07 -1.00 0.00 0.00 179.01 177.87 3cjp h LEU 191 N 0.73 0.89 -0.79 1.33 3.38 -0.90 -1.99 115.31 117.96 3cjp h LEU 191 Ca 0.31 -0.51 -0.13 0.00 0.09 0.00 0.00 57.88 57.65 3cjp h LEU 191 Cb 0.18 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.66 3cjp h LEU 191 CO -0.18 1.29 -0.54 0.00 0.09 0.00 0.00 178.44 179.10 3cjp h ALA 192 N 0.72 0.98 -0.50 1.53 0.00 -1.13 0.16 119.26 121.02 3cjp h ALA 192 Ca -0.00 -0.50 0.00 0.00 0.00 0.00 0.00 54.91 54.41 3cjp h ALA 192 Cb 1.21 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.89 3cjp h ALA 192 CO 0.13 0.68 0.33 -0.22 0.00 0.00 0.00 179.25 180.17 3cjp h LYS 193 N 0.14 0.66 0.03 0.00 3.64 -1.19 -3.30 116.57 116.54 3cjp h LYS 193 Ca 0.00 -0.04 -0.16 0.00 -1.27 0.00 0.00 60.65 59.18 3cjp h LYS 193 Cb 1.00 -0.15 0.01 0.00 -0.41 0.00 0.00 32.23 32.68 3cjp h LYS 193 CO 0.08 0.44 -0.65 1.49 -2.27 0.00 0.00 179.45 178.54 3cjp h GLU 194 N 0.67 0.38 -4.92 1.90 4.81 -0.81 -3.45 114.58 113.16 3cjp h GLU 194 Ca 0.18 -0.45 -0.66 0.00 -0.13 0.00 0.00 59.36 58.30 3cjp h GLU 194 Cb -0.07 0.14 -0.17 0.00 0.63 0.00 0.00 28.75 29.27 3cjp h GLU 194 CO -0.04 1.13 -0.33 0.42 -0.73 0.00 0.00 179.01 179.46 3cjp s ILE 195 N -3.04 5.20 0.30 2.32 1.01 0.52 -4.98 121.20 122.54 3cjp s ILE 195 Ca -0.13 0.06 0.05 0.00 0.00 0.00 0.00 60.65 60.63 3cjp s ILE 195 Cb 0.03 -3.77 0.31 0.00 0.01 0.00 0.00 42.46 39.04 3cjp s ILE 195 CO 0.82 -0.03 1.66 -0.61 0.00 0.00 0.00 174.94 176.78 3cjp h GLN 196 N 8.44 0.27 -0.48 2.79 4.15 -1.87 -2.60 115.11 125.79 3cjp h GLN 196 Ca -0.31 -0.02 0.00 0.00 0.77 0.00 0.00 58.65 59.10 3cjp h GLN 196 Cb 1.15 -0.06 0.00 0.00 0.21 0.00 0.00 27.48 28.78 3cjp h GLN 196 CO 0.67 0.18 0.00 0.27 -1.93 0.00 0.00 178.83 178.02 3cjp n ASN 197 N -5.15 3.62 -4.69 -0.69 6.94 -1.26 -4.88 115.26 109.14 3cjp n ASN 197 Ca 0.24 -2.00 -0.36 0.00 -0.02 0.00 0.00 54.58 52.44 3cjp n ASN 197 Cb 0.75 -0.32 -0.08 0.00 -2.36 0.00 0.00 39.78 37.77 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 -1.35 4.16 0.38 -4.53 2.96 -0.98 -0.95 118.68 118.37 3cjp s LEU 198 Ca 0.42 0.27 0.07 0.00 -0.22 0.00 0.00 54.13 54.66 3cjp s LEU 198 Cb 0.24 -2.21 -0.07 0.00 0.50 0.00 0.00 46.19 44.64 3cjp s LEU 198 CO 0.32 0.07 -0.00 -0.31 -1.32 0.00 0.00 176.35 175.11 3cjp s TYR 199 N 0.86 2.40 -0.08 5.38 1.51 -0.01 -4.72 117.35 122.68 3cjp s TYR 199 Ca 0.11 -0.68 0.04 0.00 -1.01 0.00 0.00 57.07 55.52 3cjp s TYR 199 Cb -0.13 -1.62 0.00 0.00 -0.11 0.00 0.00 41.96 40.10 3cjp s TYR 199 CO 0.03 0.40 -0.20 -0.51 -1.11 0.00 0.00 175.55 174.17 3cjp s LEU 200 N -3.65 1.93 0.20 -1.29 1.43 -0.21 -1.00 118.68 116.09 3cjp s LEU 200 Ca 0.35 -0.44 -0.21 0.00 -1.03 0.00 0.00 54.13 52.80 3cjp s LEU 200 Cb 0.08 -1.16 -0.08 0.00 0.03 0.00 0.00 46.19 45.06 3cjp s LEU 200 CO 0.17 0.13 0.72 -0.62 0.23 0.00 0.00 176.35 176.98 3cjp s ASP 201 N 0.32 7.12 0.10 2.29 2.15 0.05 -0.13 116.67 128.58 3cjp s ASP 201 Ca -0.13 1.44 0.25 0.00 0.43 0.00 0.00 52.55 54.53 3cjp s ASP 201 Cb -0.16 -2.43 0.44 0.00 -0.30 0.00 0.00 42.92 40.47 3cjp s ASP 201 CO 0.06 0.09 1.39 0.35 -0.17 0.00 0.00 175.17 176.89 3cjp n THR 202 N 0.98 0.31 -1.70 1.71 -2.24 -0.84 -1.06 114.28 111.44 3cjp n THR 202 Ca -0.04 -0.23 -0.38 0.00 -2.27 0.00 0.00 64.05 61.14 3cjp n THR 202 Cb 0.51 -0.13 0.05 0.00 -2.10 0.00 0.00 70.33 68.66 3cjp n THR 202 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 3cjp n SER 203 N -2.01 1.97 -2.38 3.42 3.41 -1.18 -3.07 113.62 113.77 3cjp n SER 203 Ca 0.04 0.90 -0.18 0.00 -0.26 0.00 0.00 58.87 59.36 3cjp n SER 203 Cb 0.42 -1.51 0.02 0.00 -0.26 0.00 0.00 64.21 62.88 3cjp n SER 203 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3cjp n ALA 204 N -1.42 -0.72 -1.76 7.33 0.00 -1.26 -4.04 120.51 118.64 3cjp n ALA 204 Ca 0.13 0.21 -0.38 0.00 0.00 0.00 0.00 53.44 53.40 3cjp n ALA 204 Cb 0.46 -2.92 0.02 0.00 0.00 0.00 0.00 19.45 17.01 3cjp n ALA 204 CO 0.00 0.00 0.00 1.52 0.00 0.00 0.00 177.50 179.02 3cjp s TYR 205 N -3.01 2.51 -0.64 0.00 1.13 -1.17 -4.94 117.35 111.22 3cjp s TYR 205 Ca 0.18 1.42 0.14 0.00 -1.41 0.00 0.00 57.07 57.41 3cjp s TYR 205 Cb -0.08 -3.66 -0.16 0.00 -1.10 0.00 0.00 41.96 36.96 3cjp s TYR 205 CO 0.22 -2.40 0.59 1.97 -2.51 0.00 0.00 175.55 173.43 3cjp n PHE 206 N -0.76 0.00 -3.80 -3.49 1.16 -1.26 -4.95 117.46 104.36 3cjp n PHE 206 Ca 0.09 0.00 -0.20 0.00 -1.87 0.00 0.00 57.45 55.47 3cjp n PHE 206 Cb 0.46 -0.02 -0.17 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 -2.42 1.07 0.47 5.98 0.15 -1.26 -5.02 113.70 112.66 3cjp s SER 207 Ca 0.05 -0.02 0.22 0.00 0.70 0.00 0.00 55.95 56.90 3cjp s SER 207 Cb 0.11 -0.28 1.17 0.00 -1.71 0.00 0.00 66.02 65.31 3cjp s SER 207 CO 0.59 -0.18 1.98 0.71 1.20 0.00 0.00 173.24 177.55 3cjp h THR 208 N 6.33 0.82 -0.24 6.45 1.35 -1.99 -1.60 112.91 124.03 3cjp h THR 208 Ca -0.25 -0.76 -0.16 0.00 -0.55 0.00 0.00 66.41 64.70 3cjp h THR 208 Cb 1.13 1.45 0.00 0.00 -1.73 0.00 0.00 68.15 69.00 3cjp h THR 208 CO 0.30 0.19 -0.46 0.15 -0.25 0.00 0.00 175.52 175.45 3cjp h PHE 209 N 0.00 0.92 -0.50 4.73 3.57 -1.99 -0.28 116.94 123.39 3cjp h PHE 209 Ca -0.00 -0.33 -0.01 0.00 3.53 0.00 0.00 57.97 61.16 3cjp h PHE 209 Cb 0.44 -0.17 -0.02 0.00 2.79 0.00 0.00 35.95 38.98 3cjp h PHE 209 CO 0.00 1.12 0.28 0.28 -2.23 0.00 0.00 178.31 177.76 3cjp h VAL 210 N 0.46 1.17 -0.53 1.41 2.07 -1.93 -0.81 116.25 118.08 3cjp h VAL 210 Ca 0.01 -0.41 0.05 0.00 0.82 0.00 0.00 66.70 67.17 3cjp h VAL 210 Cb 1.07 0.53 -0.05 0.00 -1.52 0.00 0.00 31.29 31.32 3cjp h VAL 210 CO 0.10 0.18 0.25 0.25 0.02 0.00 0.00 177.57 178.37 3cjp h LEU 211 N 0.67 0.33 -0.28 2.57 5.85 -1.23 -0.37 115.31 122.86 3cjp h LEU 211 Ca 0.18 0.04 0.01 0.00 0.84 0.00 0.00 57.88 58.95 3cjp h LEU 211 Cb 0.03 -0.02 -0.02 0.00 0.37 0.00 0.00 40.66 41.02 3cjp h LEU 211 CO -0.03 0.23 0.16 0.50 -0.34 0.00 0.00 178.44 178.95 3cjp h LYS 212 N 0.48 0.31 0.21 1.25 3.64 -0.76 -0.99 116.57 120.71 3cjp h LYS 212 Ca 0.24 -0.02 -0.01 0.00 -1.27 0.00 0.00 60.65 59.59 3cjp h LYS 212 Cb 0.18 -0.07 0.00 0.00 -0.41 0.00 0.00 32.23 31.93 3cjp h LYS 212 CO -0.19 0.21 -0.10 0.82 -2.27 0.00 0.00 179.45 177.92 3cjp h ILE 213 N 0.32 0.83 0.12 2.00 2.04 -0.64 -2.45 117.51 119.73 3cjp h ILE 213 Ca 0.11 -0.19 -0.01 0.00 1.00 0.00 0.00 64.86 65.77 3cjp h ILE 213 Cb 0.01 0.94 0.00 0.00 -0.74 0.00 0.00 36.82 37.03 3cjp h ILE 213 CO -0.06 0.04 -0.06 0.58 0.00 0.00 0.00 178.15 178.66 3cjp h VAL 214 N -0.38 0.97 -0.10 1.67 2.07 -1.05 -1.13 116.25 118.30 3cjp h VAL 214 Ca -0.03 -0.34 -0.08 0.00 0.82 0.00 0.00 66.70 67.07 3cjp h VAL 214 Cb 0.29 1.18 -0.01 0.00 -1.52 0.00 0.00 31.29 31.23 3cjp h VAL 214 CO 0.05 0.08 -0.32 0.16 0.02 0.00 0.00 177.57 177.56 3cjp h ILE 215 N -0.31 1.26 0.00 4.57 3.07 -1.23 -0.80 117.51 124.07 3cjp h ILE 215 Ca -0.02 -1.25 -0.11 0.00 1.55 0.00 0.00 64.86 65.04 3cjp h ILE 215 Cb 0.26 1.54 -0.02 0.00 -0.27 0.00 0.00 36.82 38.33 3cjp h ILE 215 CO 0.03 0.37 -0.52 0.78 -1.05 0.00 0.00 178.15 177.76 3cjp h ASN 216 N 0.17 0.00 0.35 2.16 2.35 -1.43 -2.29 115.58 116.89 3cjp h ASN 216 Ca 0.02 0.00 -0.23 0.00 -0.55 0.00 0.00 56.30 55.54 3cjp h ASN 216 Cb 0.65 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.02 3cjp h ASN 216 CO 0.05 0.52 -0.98 -0.08 -1.65 0.00 0.00 177.43 175.28 3cjp h GLU 217 N 0.00 0.41 -2.16 0.81 4.81 -0.85 -3.39 114.58 114.21 3cjp h GLU 217 Ca -0.01 -0.46 -0.55 0.00 -0.13 0.00 0.00 59.36 58.21 3cjp h GLU 217 Cb 1.40 0.14 -0.41 0.00 0.63 0.00 0.00 28.75 30.50 3cjp h GLU 217 CO 0.07 1.13 -0.85 1.28 -0.73 0.00 0.00 179.01 179.90 3cjp n LEU 218 N -3.73 2.91 0.28 1.64 4.77 -0.34 -4.96 117.00 117.58 3cjp n LEU 218 Ca -0.07 -5.37 0.16 0.00 -0.03 0.00 0.00 56.01 50.70 3cjp n LEU 218 Cb 0.86 -0.06 0.83 0.00 -2.33 0.00 0.00 43.42 42.72 3cjp n LEU 218 CO 0.52 2.29 1.03 1.55 -1.33 0.00 0.00 177.39 181.44 3cjp h PRO 219 N 3.17 0.00 -0.03 3.23 0.13 -1.61 -2.23 132.00 134.66 3cjp h PRO 219 Ca 0.12 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.25 3cjp h PRO 219 Cb 0.70 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.83 3cjp h PRO 219 CO 0.69 0.06 -0.02 1.28 -0.23 0.00 0.00 178.00 179.78 3cjp n LEU 220 N -3.34 2.94 -0.02 1.56 4.77 -1.26 -4.16 117.00 117.49 3cjp n LEU 220 Ca -0.01 -0.99 0.01 0.00 -0.03 0.00 0.00 56.01 54.99 3cjp n LEU 220 Cb 0.22 0.00 0.01 0.00 -2.33 0.00 0.00 43.42 41.32 3cjp n LEU 220 CO 0.27 0.49 0.42 0.29 -1.33 0.00 0.00 177.39 177.53 3cjp n LYS 221 N 1.27 1.86 -3.74 3.23 5.02 -0.87 -4.91 118.16 120.03 3cjp n LYS 221 Ca 0.14 -1.25 -0.36 0.00 -2.02 0.00 0.00 58.31 54.82 3cjp n LYS 221 Cb 0.59 -0.86 -0.07 0.00 -0.02 0.00 0.00 35.03 34.66 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 -0.10 2.34 0.30 0.00 1.01 0.82 -4.41 121.20 121.15 3cjp s ILE 223 Ca 0.12 -0.98 -0.29 0.00 0.00 0.00 0.00 60.65 59.50 3cjp s ILE 223 Cb -0.12 -2.07 -0.11 0.00 0.01 0.00 0.00 42.46 40.17 3cjp s ILE 223 CO 0.01 0.41 1.50 0.12 0.00 0.00 0.00 174.94 176.99 3cjp s PHE 224 N 1.30 2.82 0.14 3.97 5.36 -0.13 -1.99 117.98 129.44 3cjp s PHE 224 Ca 0.03 0.99 -0.19 0.00 -0.96 0.00 0.00 56.93 56.80 3cjp s PHE 224 Cb -0.14 -3.95 0.05 0.00 -0.34 0.00 0.00 43.02 38.63 3cjp s PHE 224 CO -0.10 -3.04 0.49 0.20 -1.46 0.00 0.00 175.22 171.31 3cjp s GLY 225 N 0.23 -0.43 -0.04 13.12 0.00 -1.26 0.54 107.32 119.47 3cjp s GLY 225 Ca 0.59 0.20 0.10 0.00 0.00 0.00 0.00 44.72 45.60 3cjp s GLY 225 CO 0.50 -0.09 0.15 -1.30 0.00 0.00 0.00 173.10 172.36 3cjp n THR 226 N -0.30 0.25 -3.54 0.90 -2.24 -1.15 -3.13 114.28 105.06 3cjp n THR 226 Ca -0.16 -0.30 -0.24 0.00 -2.27 0.00 0.00 64.05 61.07 3cjp n THR 226 Cb 0.64 -0.12 0.07 0.00 -2.10 0.00 0.00 70.33 68.83 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 -2.05 -6.35 -4.62 3.42 2.03 0.95 -3.34 116.55 106.59 3cjp n ASP 227 Ca -0.07 -0.52 -0.42 0.00 0.52 0.00 0.00 54.79 54.30 3cjp n ASP 227 Cb 0.48 -5.01 0.01 0.00 -0.72 0.00 0.00 41.12 35.87 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 -4.91 1.43 -0.09 -0.67 2.81 -1.26 -0.05 117.12 114.38 3cjp n MET 228 Ca -0.00 0.51 0.05 0.00 -1.81 0.00 0.00 57.70 56.45 3cjp n MET 228 Cb 0.57 -2.06 0.18 0.00 -0.71 0.00 0.00 33.22 31.19 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 0.22 1.48 0.18 0.03 -0.04 -1.26 -0.62 135.00 135.00 3cjp n PRO 229 Ca 0.09 -0.74 0.11 0.00 -0.04 0.00 0.00 63.50 62.91 3cjp n PRO 229 Cb 0.38 -1.21 0.11 0.00 -0.04 0.00 0.00 33.50 32.74 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 1.27 0.00 -2.67 0.54 0.04 -0.76 -3.46 116.94 111.90 3cjp h PHE 230 Ca 0.00 0.00 -0.49 0.00 2.80 0.00 0.00 57.97 60.28 3cjp h PHE 230 Cb 0.29 0.00 -0.14 0.00 2.20 0.00 0.00 35.95 38.30 3cjp h PHE 230 CO 0.12 0.06 -0.66 0.20 -0.60 0.00 0.00 178.31 177.43 3cjp s GLY 231 N -4.28 1.87 -0.18 -1.45 0.00 -1.03 -5.04 107.32 97.20 3cjp s GLY 231 Ca 0.05 -1.93 -0.04 0.00 0.00 0.00 0.00 44.72 42.80 3cjp s GLY 231 CO 0.71 -1.84 -0.04 -0.35 0.00 0.00 0.00 173.10 171.58 3cjp s ASP 232 N -3.45 4.62 0.08 1.64 -1.08 -1.26 -4.14 116.67 113.09 3cjp s ASP 232 Ca 0.30 -0.22 -0.29 0.00 -0.52 0.00 0.00 52.55 51.82 3cjp s ASP 232 Cb 0.05 -1.77 -0.16 0.00 -1.46 0.00 0.00 42.92 39.57 3cjp s ASP 232 CO 0.12 0.10 1.67 0.25 0.52 0.00 0.00 175.17 177.83 3cjp h LEU 233 N 7.21 -0.50 -0.87 -1.34 5.85 -1.97 -1.04 115.31 122.66 3cjp h LEU 233 Ca -0.34 0.02 -0.05 0.00 0.84 0.00 0.00 57.88 58.35 3cjp h LEU 233 Cb 1.18 0.14 -0.03 0.00 0.37 0.00 0.00 40.66 42.32 3cjp h LEU 233 CO 0.61 -0.34 0.22 -0.61 -0.34 0.00 0.00 178.44 177.98 3cjp h GLN 234 N -0.55 1.06 -0.61 1.25 5.75 -1.94 -1.32 115.11 118.74 3cjp h GLN 234 Ca -0.05 -0.21 -0.07 0.00 -0.15 0.00 0.00 58.65 58.17 3cjp h GLN 234 Cb 0.43 -0.16 -0.02 0.00 1.07 0.00 0.00 27.48 28.80 3cjp h GLN 234 CO 0.07 0.90 0.10 -0.07 -2.65 0.00 0.00 178.83 177.18 3cjp h LEU 235 N 1.02 0.97 -0.28 -2.39 3.38 -1.98 -1.55 115.31 114.49 3cjp h LEU 235 Ca 0.23 -0.26 -0.15 0.00 0.09 0.00 0.00 57.88 57.79 3cjp h LEU 235 Cb 0.28 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 40.77 3cjp h LEU 235 CO -0.01 0.98 -0.40 0.28 0.09 0.00 0.00 178.44 179.38 3cjp h SER 236 N 0.92 0.83 -0.09 -0.43 0.02 -0.95 -1.86 113.55 112.00 3cjp h SER 236 Ca 0.19 -0.51 0.02 0.00 -0.84 0.00 0.00 61.79 60.64 3cjp h SER 236 Cb 0.42 -0.24 -0.02 0.00 0.14 0.00 0.00 62.40 62.71 3cjp h SER 236 CO 0.01 1.18 -0.01 0.40 -1.14 0.00 0.00 176.83 177.27 3cjp h ILE 237 N 0.51 0.92 -1.00 3.27 2.04 -1.21 -1.82 117.51 120.22 3cjp h ILE 237 Ca 0.03 -0.00 0.14 0.00 1.00 0.00 0.00 64.86 66.03 3cjp h ILE 237 Cb 1.00 0.91 -0.09 0.00 -0.74 0.00 0.00 36.82 37.90 3cjp h ILE 237 CO 0.09 0.00 0.62 -0.08 0.00 0.00 0.00 178.15 178.79 3cjp h GLU 238 N 0.01 0.89 -0.18 2.37 4.81 -1.18 -2.10 114.58 119.21 3cjp h GLU 238 Ca 0.04 -0.05 -0.03 0.00 -0.13 0.00 0.00 59.36 59.19 3cjp h GLU 238 Cb 0.06 -0.20 -0.01 0.00 0.63 0.00 0.00 28.75 29.23 3cjp h GLU 238 CO -0.08 0.59 0.00 0.00 -0.73 0.00 0.00 179.01 178.79 3cjp h ALA 239 N 1.58 0.24 -0.46 2.92 0.00 -0.89 -1.01 119.26 121.64 3cjp h ALA 239 Ca 0.53 -0.20 0.09 0.00 0.00 0.00 0.00 54.91 55.33 3cjp h ALA 239 Cb 0.63 -0.07 -0.08 0.00 0.00 0.00 0.00 17.79 18.28 3cjp h ALA 239 CO -0.31 -0.05 -0.06 0.82 0.00 0.00 0.00 179.25 179.65 3cjp h ILE 240 N 0.07 0.59 -0.28 0.00 1.08 -1.01 -0.29 117.51 117.66 3cjp h ILE 240 Ca 0.05 -0.02 -0.14 0.00 -0.39 0.00 0.00 64.86 64.36 3cjp h ILE 240 Cb 0.38 0.53 -0.01 0.00 -3.07 0.00 0.00 36.82 34.65 3cjp h ILE 240 CO 0.01 0.01 -0.39 0.11 -0.69 0.00 0.00 178.15 177.20 3cjp h LYS 241 N 0.05 0.67 -0.17 2.37 1.57 -1.20 0.01 116.57 119.86 3cjp h LYS 241 Ca 0.23 -0.34 -0.16 0.00 -1.87 0.00 0.00 60.65 58.51 3cjp h LYS 241 Cb 0.34 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.65 3cjp h LYS 241 CO -0.43 0.94 -0.55 -0.22 -0.57 0.00 0.00 179.45 178.62 3cjp h LYS 242 N 0.55 0.52 0.00 3.15 3.64 -1.03 -3.21 116.57 120.19 3cjp h LYS 242 Ca 0.05 -0.33 0.00 0.00 -1.27 0.00 0.00 60.65 59.10 3cjp h LYS 242 Cb 0.91 0.04 0.00 0.00 -0.41 0.00 0.00 32.23 32.77 3cjp h LYS 242 CO 0.08 0.94 -0.40 0.52 -2.27 0.00 0.00 179.45 178.32 3cjp h MET 243 N 0.40 0.00 -6.85 1.90 2.86 -0.89 -3.46 114.93 108.89 3cjp h MET 243 Ca 0.01 0.00 -0.52 0.00 -2.06 0.00 0.00 59.70 57.12 3cjp h MET 243 Cb 1.09 0.00 0.07 0.00 0.06 0.00 0.00 31.60 32.81 3cjp h MET 243 CO 0.10 0.00 0.67 -1.12 1.06 0.00 0.00 176.91 177.62 3cjp s SER 244 N -5.66 6.72 0.49 1.22 0.01 -0.02 -4.75 113.70 111.71 3cjp s SER 244 Ca 0.05 2.70 0.28 0.00 1.31 0.00 0.00 55.95 60.29 3cjp s SER 244 Cb 0.08 -2.64 1.11 0.00 0.21 0.00 0.00 66.02 64.77 3cjp s SER 244 CO 0.71 -0.59 1.90 0.78 0.41 0.00 0.00 173.24 176.45 3cjp h ASN 245 N 3.72 0.00 -5.07 2.44 2.35 -1.90 -3.46 115.58 113.67 3cjp h ASN 245 Ca -0.48 0.00 0.02 0.00 -0.55 0.00 0.00 56.30 55.29 3cjp h ASN 245 Cb 1.23 0.00 -0.05 0.00 0.05 0.00 0.00 38.32 39.54 3cjp h ASN 245 CO 0.68 0.12 0.15 1.51 -1.65 0.00 0.00 177.43 178.23 3cjp s ASP 246 N -5.97 -0.16 0.41 5.81 1.47 -1.26 -5.06 116.67 111.91 3cjp s ASP 246 Ca 0.01 -0.77 0.20 0.00 1.18 0.00 0.00 52.55 53.17 3cjp s ASP 246 Cb 0.10 0.71 0.89 0.00 -0.34 0.00 0.00 42.92 44.28 3cjp s ASP 246 CO 0.60 -1.34 1.84 0.77 0.68 0.00 0.00 175.17 177.71 3cjp h SER 247 N 2.06 0.00 0.23 2.11 4.64 -1.96 -2.52 113.55 118.12 3cjp h SER 247 Ca -0.22 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.09 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 0.28 0.30 -0.14 0.22 -0.87 0.00 0.00 176.83 176.62 3cjp h TYR 248 N 0.00 -0.36 -0.31 4.77 3.20 -1.98 0.01 116.97 122.30 3cjp h TYR 248 Ca -0.00 -0.00 0.06 0.00 3.14 0.00 0.00 58.73 61.92 3cjp h TYR 248 Cb 0.71 0.13 -0.05 0.00 1.54 0.00 0.00 36.73 39.06 3cjp h TYR 248 CO 0.00 -0.22 -0.02 0.28 -1.64 0.00 0.00 178.16 176.56 3cjp h VAL 249 N -0.36 0.75 -0.34 1.81 2.07 -1.89 0.35 116.25 118.65 3cjp h VAL 249 Ca -0.02 -0.02 0.05 0.00 0.82 0.00 0.00 66.70 67.52 3cjp h VAL 249 Cb 0.30 0.68 -0.04 0.00 -1.52 0.00 0.00 31.29 30.71 3cjp h VAL 249 CO 0.03 0.01 0.09 0.00 0.02 0.00 0.00 177.57 177.71 3cjp h ALA 250 N 1.28 0.37 -0.07 1.67 0.00 -1.37 -0.02 119.26 121.12 3cjp h ALA 250 Ca 0.15 0.06 -0.15 0.00 0.00 0.00 0.00 54.91 54.97 3cjp h ALA 250 Cb 0.21 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 3cjp h ALA 250 CO -0.27 -0.32 -0.62 -0.91 0.00 0.00 0.00 179.25 177.14 3cjp h ASN 251 N 0.21 0.29 -0.01 0.00 2.35 -0.65 0.35 115.58 118.12 3cjp h ASN 251 Ca 0.16 -0.17 -0.00 0.00 -0.55 0.00 0.00 56.30 55.74 3cjp h ASN 251 Cb 0.16 -0.08 -0.00 0.00 0.05 0.00 0.00 38.32 38.45 3cjp h ASN 251 CO -0.19 0.83 0.00 0.00 -1.65 0.00 0.00 177.43 176.42 3cjp h ALA 252 N 1.17 0.01 -0.37 -0.83 0.00 -0.61 -2.16 119.26 116.48 3cjp h ALA 252 Ca -0.01 -0.11 -0.11 0.00 0.00 0.00 0.00 54.91 54.68 3cjp h ALA 252 Cb 1.13 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.90 3cjp h ALA 252 CO 0.10 -0.38 -0.24 0.28 0.00 0.00 0.00 179.25 179.01 3cjp h VAL 253 N -0.20 1.27 0.00 0.00 2.07 -0.88 -0.71 116.25 117.80 3cjp h VAL 253 Ca 0.00 -1.35 0.00 0.00 0.82 0.00 0.00 66.70 66.17 3cjp h VAL 253 Cb 0.21 1.25 0.00 0.00 -1.52 0.00 0.00 31.29 31.23 3cjp h VAL 253 CO -0.00 0.45 0.00 -0.07 0.02 0.00 0.00 177.57 177.97 3cjp h LEU 254 N 0.64 0.00 0.00 2.57 3.38 -0.96 -0.32 115.31 120.62 3cjp h LEU 254 Ca 0.09 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.06 3cjp h LEU 254 Cb 0.74 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.49 3cjp h LEU 254 CO 0.06 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.20 3cjp n GLY 255 N 0.64 0.00 0.25 0.83 0.00 -1.04 -0.43 105.19 105.45 3cjp n GLY 255 Ca 0.04 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.03 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 0.52 -0.16 1.61 3.45 -1.20 -0.93 116.42 119.71 3cjp h ASP 256 Ca 0.00 -0.14 -0.01 0.00 0.43 0.00 0.00 57.03 57.31 3cjp h ASP 256 Cb 0.00 -0.14 -0.01 0.00 -0.56 0.00 0.00 39.33 38.62 3cjp h ASP 256 CO 0.00 0.69 0.06 0.78 -1.57 0.00 0.00 179.24 179.19 3cjp h ASN 257 N 0.49 0.23 0.28 6.45 2.35 -1.38 -1.63 115.58 122.36 3cjp h ASN 257 Ca 0.09 -0.19 -0.17 0.00 -0.55 0.00 0.00 56.30 55.48 3cjp h ASN 257 Cb 0.53 -0.06 -0.01 0.00 0.05 0.00 0.00 38.32 38.83 3cjp h ASN 257 CO 0.03 0.36 -0.68 -0.29 -1.65 0.00 0.00 177.43 175.20 3cjp h ILE 258 N 0.09 1.38 -0.86 2.81 6.09 -1.78 0.01 117.51 125.25 3cjp h ILE 258 Ca 0.05 -2.08 0.07 0.00 -1.37 0.00 0.00 64.86 61.53 3cjp h ILE 258 Cb 0.20 2.06 -0.06 0.00 0.47 0.00 0.00 36.82 39.49 3cjp h ILE 258 CO -0.00 0.62 0.53 0.28 -3.07 0.00 0.00 178.15 176.51 3cjp h SER 259 N 0.26 0.81 -0.16 2.19 0.02 -1.11 0.47 113.55 116.03 3cjp h SER 259 Ca -0.02 0.02 -0.02 0.00 -0.84 0.00 0.00 61.79 60.93 3cjp h SER 259 Cb 1.23 -0.14 -0.01 0.00 0.14 0.00 0.00 62.40 63.63 3cjp h SER 259 CO 0.11 0.50 0.02 -0.09 -1.14 0.00 0.00 176.83 176.24 3cjp h ARG 260 N 0.94 0.27 -0.41 3.45 2.43 -1.12 0.49 114.38 120.43 3cjp h ARG 260 Ca 0.39 -0.08 -0.06 0.00 -0.81 0.00 0.00 59.98 59.42 3cjp h ARG 260 Cb 0.23 -0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 29.73 3cjp h ARG 260 CO -0.19 0.46 0.04 1.25 -1.51 0.00 0.00 179.97 180.02 3cjp h LEU 261 N 0.05 0.68 -0.72 3.80 5.85 -0.52 -2.93 115.31 121.52 3cjp h LEU 261 Ca 0.05 -0.28 0.00 0.00 0.84 0.00 0.00 57.88 58.49 3cjp h LEU 261 Cb 0.32 -0.18 0.00 0.00 0.37 0.00 0.00 40.66 41.17 3cjp h LEU 261 CO 0.00 0.79 -0.24 0.18 -0.34 0.00 0.00 178.44 178.83 3cjp n LEU 262 N -4.48 1.36 -3.48 2.25 4.77 0.12 -4.96 117.00 112.58 3cjp n LEU 262 Ca -0.00 -0.42 -0.18 0.00 -0.03 0.00 0.00 56.01 55.38 3cjp n LEU 262 Cb 0.26 -0.08 0.08 0.00 -2.33 0.00 0.00 43.42 41.35 3cjp n LEU 262 CO 0.40 0.25 0.08 0.59 -1.33 0.00 0.00 177.39 177.38 3cjp n ASN 263 N -0.32 -1.94 0.00 -1.43 5.03 -0.36 -5.05 115.26 111.19 3cjp n ASN 263 Ca 0.13 -0.65 0.09 0.00 0.87 0.00 0.00 54.58 55.02 3cjp n ASN 263 Cb 0.38 -4.95 0.56 0.00 -1.02 0.00 0.00 39.78 34.75 3cjp n ASN 263 CO 0.00 0.00 0.00 -0.38 -1.83 0.00 0.00 177.26 175.05