#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jbs s LEU 25 N 0.00 2.22 -0.04 2.89 1.43 -1.26 -5.08 118.68 118.85 2jbs s LEU 25 Ca 0.00 1.03 0.01 0.00 -1.03 0.00 0.00 54.13 54.14 2jbs s LEU 25 Cb 0.00 -3.45 0.02 0.00 0.03 0.00 0.00 46.19 42.79 2jbs s LEU 25 CO 0.00 -2.31 -0.04 -0.69 0.23 0.00 0.00 176.35 173.54 2jbs s VAL 26 N -3.28 0.47 -0.13 -1.59 1.01 -1.26 -5.06 120.40 110.55 2jbs s VAL 26 Ca 0.63 -0.09 0.19 0.00 0.00 0.00 0.00 61.98 62.71 2jbs s VAL 26 Cb -0.14 -0.50 -0.27 0.00 0.00 0.00 0.00 36.38 35.47 2jbs s VAL 26 CO 0.53 0.21 0.31 -1.22 0.00 0.00 0.00 175.10 174.93 2jbs n TYR 27 N 4.02 0.14 1.00 5.22 4.01 -1.26 -4.47 117.16 125.82 2jbs n TYR 27 Ca -0.26 0.05 0.11 0.00 -0.16 0.00 0.00 57.90 57.64 2jbs n TYR 27 Cb 0.51 -0.84 -0.03 0.00 -0.31 0.00 0.00 39.34 38.67 2jbs n TYR 27 CO 0.00 0.00 0.00 0.25 -0.46 0.00 0.00 176.86 176.65 2jbs n THR 28 N -2.60 0.00 -3.84 -0.72 -2.24 -1.26 -4.40 114.28 99.22 2jbs n THR 28 Ca -0.20 -0.20 -0.01 0.00 -2.27 0.00 0.00 64.05 61.36 2jbs n THR 28 Cb 0.92 1.20 0.01 0.00 -2.10 0.00 0.00 70.33 70.36 2jbs n THR 28 CO 0.00 0.00 0.00 -1.38 -0.57 0.00 0.00 175.07 173.12 2jbs s HIS 29 N -2.59 0.01 0.27 4.78 -3.43 -1.26 -4.93 115.29 108.13 2jbs s HIS 29 Ca 0.16 -0.28 -0.30 0.00 -0.80 0.00 0.00 55.06 53.84 2jbs s HIS 29 Cb 0.18 0.63 -0.11 0.00 -1.43 0.00 0.00 32.58 31.85 2jbs s HIS 29 CO 0.64 -0.66 1.56 0.00 -2.00 0.00 0.00 174.74 174.28 2jbs s ALA 30 N -2.38 3.73 0.04 -1.38 0.00 -1.26 -4.81 121.76 115.70 2jbs s ALA 30 Ca 0.20 1.49 -0.24 0.00 0.00 0.00 0.00 51.96 53.41 2jbs s ALA 30 Cb -0.01 -3.62 -0.06 0.00 0.00 0.00 0.00 23.12 19.43 2jbs s ALA 30 CO 0.02 -0.90 0.72 -1.14 0.00 0.00 0.00 175.76 174.47 2jbs s GLN 31 N -0.24 4.45 -0.28 0.00 0.74 -1.26 -5.02 119.66 118.04 2jbs s GLN 31 Ca 0.63 0.99 -0.29 0.00 0.05 0.00 0.00 55.36 56.75 2jbs s GLN 31 Cb -0.46 -3.35 -0.01 0.00 1.10 0.00 0.00 33.01 30.29 2jbs s GLN 31 CO 0.44 0.34 1.56 0.95 -0.55 0.00 0.00 175.29 178.03 2jbs s THR 32 N -0.21 3.77 -0.66 -0.34 -4.23 -1.26 -4.91 115.64 107.80 2jbs s THR 32 Ca 0.36 0.84 -0.26 0.00 -1.18 0.00 0.00 61.69 61.46 2jbs s THR 32 Cb -0.20 -3.86 -0.11 0.00 1.34 0.00 0.00 72.50 69.67 2jbs s THR 32 CO 0.22 -0.42 2.42 -2.65 -0.54 0.00 0.00 174.62 173.65 2jbs n PRO 33 N 7.80 0.75 -0.87 3.99 -0.02 -1.26 -4.78 135.00 140.61 2jbs n PRO 33 Ca 0.18 -0.44 -0.42 0.00 -2.02 0.00 0.00 63.50 60.81 2jbs n PRO 33 Cb 0.46 -3.49 -0.09 0.00 -0.02 0.00 0.00 33.50 30.36 2jbs n PRO 33 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 2jbs n ASP 34 N 17.08 1.66 -4.56 2.55 -0.08 -1.26 -4.77 116.55 127.17 2jbs n ASP 34 Ca 0.43 -2.57 -0.28 0.00 -1.51 0.00 0.00 54.79 50.86 2jbs n ASP 34 Cb 0.47 -0.85 0.23 0.00 2.34 0.00 0.00 41.12 43.31 2jbs n ASP 34 CO 0.00 0.00 0.00 -0.69 0.12 0.00 0.00 177.20 176.63 2jbs s VAL 35 N 7.07 2.04 0.45 5.18 1.01 -1.26 -5.06 120.40 129.82 2jbs s VAL 35 Ca 0.66 0.01 -0.20 0.00 0.00 0.00 0.00 61.98 62.44 2jbs s VAL 35 Cb 0.13 -2.22 -0.10 0.00 0.00 0.00 0.00 36.38 34.19 2jbs s VAL 35 CO 0.25 -0.02 0.97 -0.94 0.00 0.00 0.00 175.10 175.36 2jbs s SER 36 N -2.84 6.80 0.24 3.32 1.04 -1.26 -4.93 113.70 116.06 2jbs s SER 36 Ca 0.67 1.72 0.00 0.00 0.48 0.00 0.00 55.95 58.83 2jbs s SER 36 Cb -0.23 -2.54 0.00 0.00 0.10 0.00 0.00 66.02 63.35 2jbs s SER 36 CO 0.62 -0.46 0.00 0.61 0.98 0.00 0.00 173.24 175.00 2jbs n GLY 37 N -0.65 -1.50 3.39 7.32 0.00 -1.26 -4.84 105.19 107.65 2jbs n GLY 37 Ca 0.07 -1.28 -0.40 0.00 0.00 0.00 0.00 46.02 44.42 2jbs n GLY 37 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2jbs s VAL 38 N 0.00 4.56 0.75 1.61 1.01 -1.26 -5.07 120.40 122.00 2jbs s VAL 38 Ca 0.00 -0.75 -0.13 0.00 0.00 0.00 0.00 61.98 61.10 2jbs s VAL 38 Cb 0.00 -3.49 0.05 0.00 0.00 0.00 0.00 36.38 32.94 2jbs s VAL 38 CO 0.00 -0.16 1.13 -0.94 0.00 0.00 0.00 175.10 175.13 2jbs s SER 39 N 1.57 4.38 0.45 3.32 1.04 -1.26 -4.89 113.70 118.30 2jbs s SER 39 Ca 0.03 2.06 0.12 0.00 0.48 0.00 0.00 55.95 58.63 2jbs s SER 39 Cb -0.19 -2.55 1.03 0.00 0.10 0.00 0.00 66.02 64.41 2jbs s SER 39 CO 0.06 -2.13 2.05 -0.03 0.98 0.00 0.00 173.24 174.18 2jbs h MET 40 N -0.69 0.35 -0.11 4.02 1.85 -1.96 -2.61 114.93 115.78 2jbs h MET 40 Ca -0.45 -0.02 -0.17 0.00 -0.61 0.00 0.00 59.70 58.45 2jbs h MET 40 Cb 1.26 -0.08 -0.01 0.00 0.43 0.00 0.00 31.60 33.20 2jbs h MET 40 CO 0.50 0.23 -0.64 1.25 -0.40 0.00 0.00 176.91 177.85 2jbs h LEU 41 N 0.36 0.49 -0.30 3.39 5.85 -1.90 -0.01 115.31 123.18 2jbs h LEU 41 Ca 0.17 -0.29 -0.08 0.00 0.84 0.00 0.00 57.88 58.52 2jbs h LEU 41 Cb 0.21 -0.14 -0.01 0.00 0.37 0.00 0.00 40.66 41.09 2jbs h LEU 41 CO -0.04 1.00 -0.12 -0.33 -0.34 0.00 0.00 178.44 178.61 2jbs h GLU 42 N 0.31 0.62 -1.00 1.25 5.08 -1.86 -0.51 114.58 118.47 2jbs h GLU 42 Ca -0.01 -0.26 0.10 0.00 -1.00 0.00 0.00 59.36 58.19 2jbs h GLU 42 Cb 1.19 -0.02 -0.08 0.00 0.50 0.00 0.00 28.75 30.34 2jbs h GLU 42 CO 0.11 0.83 0.63 0.87 -1.00 0.00 0.00 179.01 180.46 2jbs h LYS 43 N 0.37 1.02 -0.13 2.33 1.57 -1.09 -0.69 116.57 119.95 2jbs h LYS 43 Ca 0.07 -0.06 -0.01 0.00 -1.87 0.00 0.00 60.65 58.78 2jbs h LYS 43 Cb 0.63 -0.23 -0.01 0.00 0.08 0.00 0.00 32.23 32.71 2jbs h LYS 43 CO 0.04 0.68 0.03 0.82 -0.57 0.00 0.00 179.45 180.45 2jbs h ILE 44 N 1.05 1.20 -0.36 1.86 1.08 -0.82 -3.20 117.51 118.32 2jbs h ILE 44 Ca 0.47 -0.62 0.05 0.00 -0.39 0.00 0.00 64.86 64.37 2jbs h ILE 44 Cb 0.37 1.37 -0.02 0.00 -3.07 0.00 0.00 36.82 35.47 2jbs h ILE 44 CO -0.22 0.18 0.24 1.56 -0.69 0.00 0.00 178.15 179.22 2jbs h GLN 45 N 0.00 0.27 -0.10 2.37 4.20 0.30 -1.13 115.11 121.02 2jbs h GLN 45 Ca 0.04 -0.02 -0.13 0.00 0.06 0.00 0.00 58.65 58.60 2jbs h GLN 45 Cb 0.25 -0.06 -0.01 0.00 0.30 0.00 0.00 27.48 27.96 2jbs h GLN 45 CO 0.00 0.18 -0.52 1.96 -0.67 0.00 0.00 178.83 179.78 2jbs h GLN 46 N 0.28 0.27 -0.02 1.46 4.20 -1.21 -3.15 115.11 116.95 2jbs h GLN 46 Ca 0.16 -0.16 0.00 0.00 0.06 0.00 0.00 58.65 58.70 2jbs h GLN 46 Cb 0.27 0.01 0.00 0.00 0.30 0.00 0.00 27.48 28.06 2jbs h GLN 46 CO -0.03 0.73 -0.09 0.44 -0.67 0.00 0.00 178.83 179.21 2jbs n ILE 47 N -3.94 0.00 -0.28 2.54 -5.35 -0.49 -4.41 119.36 107.44 2jbs n ILE 47 Ca -0.02 -0.27 -0.06 0.00 -0.27 0.00 0.00 62.75 62.13 2jbs n ILE 47 Cb 0.56 0.69 0.06 0.00 -1.74 0.00 0.00 39.64 39.21 2jbs n ILE 47 CO 0.00 0.00 0.00 0.25 -1.76 0.00 0.00 176.55 175.04 2jbs h LEU 48 N 2.51 1.06 -0.54 7.28 5.85 -1.34 -2.53 115.31 127.59 2jbs h LEU 48 Ca 0.00 -0.18 0.08 0.00 0.84 0.00 0.00 57.88 58.62 2jbs h LEU 48 Cb 0.60 -0.28 -0.07 0.00 0.37 0.00 0.00 40.66 41.29 2jbs h LEU 48 CO 0.00 0.96 0.18 -0.65 -0.34 0.00 0.00 178.44 178.59 2jbs h PRO 49 N 1.10 0.34 -0.21 5.25 0.11 -1.79 -0.53 132.00 136.27 2jbs h PRO 49 Ca 0.25 -0.02 0.01 0.00 0.11 0.00 0.00 66.00 66.35 2jbs h PRO 49 Cb 0.24 -0.08 -0.02 0.00 0.11 0.00 0.00 31.00 31.26 2jbs h PRO 49 CO -0.02 0.22 0.11 1.96 -0.21 0.00 0.00 178.00 180.07 2jbs h GLN 50 N 0.35 0.22 -0.33 1.05 4.20 -1.77 -1.42 115.11 117.41 2jbs h GLN 50 Ca 0.27 -0.01 0.06 0.00 0.06 0.00 0.00 58.65 59.03 2jbs h GLN 50 Cb 0.32 -0.05 -0.06 0.00 0.30 0.00 0.00 27.48 27.99 2jbs h GLN 50 CO -0.29 0.15 -0.05 0.82 -0.67 0.00 0.00 178.83 178.79 2jbs h ILE 51 N 0.23 0.70 -0.85 2.54 1.08 -1.21 -1.96 117.51 118.04 2jbs h ILE 51 Ca 0.08 -0.01 0.07 0.00 -0.39 0.00 0.00 64.86 64.61 2jbs h ILE 51 Cb 0.01 0.66 -0.06 0.00 -3.07 0.00 0.00 36.82 34.37 2jbs h ILE 51 CO -0.05 0.01 0.56 0.00 -0.69 0.00 0.00 178.15 177.97 2jbs h ALA 52 N 1.32 1.59 0.00 1.87 0.00 -0.72 -2.04 119.26 121.28 2jbs h ALA 52 Ca 0.16 -0.02 -0.05 0.00 0.00 0.00 0.00 54.91 55.00 2jbs h ALA 52 Cb 0.24 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 2jbs h ALA 52 CO -0.32 0.26 -0.26 0.87 0.00 0.00 0.00 179.25 179.81 2jbs h LYS 53 N 0.92 0.00 0.00 0.00 1.79 -0.53 -2.88 116.57 115.86 2jbs h LYS 53 Ca 0.37 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.84 2jbs h LYS 53 Cb 0.27 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.92 2jbs h LYS 53 CO -0.14 0.26 -0.50 0.09 -1.08 0.00 0.00 179.45 178.08 2jbs n ASN 54 N -3.24 0.63 -0.29 0.86 3.02 -0.85 -4.32 115.26 111.07 2jbs n ASN 54 Ca 0.02 0.13 0.10 0.00 -0.03 0.00 0.00 54.58 54.79 2jbs n ASN 54 Cb 0.56 0.04 0.23 0.00 -0.61 0.00 0.00 39.78 40.00 2jbs n ASN 54 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2jbs h ALA 55 N 2.63 1.03 -0.39 5.41 0.00 -1.16 0.39 119.26 127.16 2jbs h ALA 55 Ca 0.00 0.27 -0.10 0.00 0.00 0.00 0.00 54.91 55.07 2jbs h ALA 55 Cb 0.69 0.44 -0.01 0.00 0.00 0.00 0.00 17.79 18.91 2jbs h ALA 55 CO 0.00 -0.47 -0.16 1.49 0.00 0.00 0.00 179.25 180.10 2jbs h GLU 56 N 0.11 0.80 0.00 0.00 4.81 -1.78 -1.88 114.58 116.63 2jbs h GLU 56 Ca 0.50 -0.34 0.00 0.00 -0.13 0.00 0.00 59.36 59.39 2jbs h GLU 56 Cb 0.97 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 30.32 2jbs h GLU 56 CO -0.74 0.96 0.00 0.66 -0.73 0.00 0.00 179.01 179.17 2jbs h SER 57 N 0.61 0.00 -0.31 1.04 4.64 -1.59 -3.09 113.55 114.85 2jbs h SER 57 Ca 0.09 0.00 -0.15 0.00 -0.47 0.00 0.00 61.79 61.26 2jbs h SER 57 Cb 0.71 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.80 2jbs h SER 57 CO 0.05 0.00 -0.40 0.00 -0.87 0.00 0.00 176.83 175.62 2jbs h ALA 58 N 2.33 0.46 -0.61 5.18 0.00 0.03 -2.48 119.26 124.17 2jbs h ALA 58 Ca 0.00 -0.45 0.00 0.00 0.00 0.00 0.00 54.91 54.46 2jbs h ALA 58 Cb 0.80 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.47 2jbs h ALA 58 CO 0.00 0.57 0.39 1.49 0.00 0.00 0.00 179.25 181.70 2jbs h GLU 59 N 0.58 0.82 0.00 0.00 4.81 -1.27 -1.53 114.58 118.00 2jbs h GLU 59 Ca 0.04 -0.06 0.00 0.00 -0.13 0.00 0.00 59.36 59.20 2jbs h GLU 59 Cb 0.99 -0.18 0.00 0.00 0.63 0.00 0.00 28.75 30.19 2jbs h GLU 59 CO 0.09 0.57 0.00 1.96 -0.73 0.00 0.00 179.01 180.90 2jbs h GLN 60 N 0.83 0.00 0.00 1.92 4.20 -1.57 -3.07 115.11 117.42 2jbs h GLN 60 Ca 0.22 0.00 -0.04 0.00 0.06 0.00 0.00 58.65 58.90 2jbs h GLN 60 Cb -0.06 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.72 2jbs h GLN 60 CO -0.04 0.00 -0.74 1.25 -0.67 0.00 0.00 178.83 178.63 2jbs h LEU 61 N 0.00 0.00 1.64 1.46 5.85 -0.81 -3.48 115.31 119.97 2jbs h LEU 61 Ca 0.00 0.00 -0.35 0.00 0.84 0.00 0.00 57.88 58.37 2jbs h LEU 61 Cb 0.55 0.00 -0.08 0.00 0.37 0.00 0.00 40.66 41.50 2jbs h LEU 61 CO 0.00 0.14 -0.38 0.54 -0.34 0.00 0.00 178.44 178.39 2jbs n ARG 62 N -2.88 -1.30 -3.83 1.25 1.74 -0.86 -4.95 116.66 105.83 2jbs n ARG 62 Ca -0.00 0.98 -0.04 0.00 -0.77 0.00 0.00 57.85 58.03 2jbs n ARG 62 Cb 0.61 -5.34 0.01 0.00 -1.02 0.00 0.00 32.46 26.72 2jbs n ARG 62 CO 0.00 0.00 0.00 -0.98 -1.52 0.00 0.00 177.63 175.13 2jbs s ARG 63 N -4.16 1.35 -0.05 5.56 1.70 -1.24 -2.89 118.95 119.22 2jbs s ARG 63 Ca 0.00 -0.83 -0.30 0.00 -0.47 0.00 0.00 55.73 54.14 2jbs s ARG 63 Cb 0.00 0.40 -0.02 0.00 -0.57 0.00 0.00 34.95 34.76 2jbs s ARG 63 CO 0.00 -0.63 1.01 0.08 -1.08 0.00 0.00 175.30 174.69 2jbs s VAL 64 N -2.59 4.77 0.54 4.99 1.01 -0.72 -4.68 120.40 123.72 2jbs s VAL 64 Ca 0.18 2.01 -0.21 0.00 0.00 0.00 0.00 61.98 63.96 2jbs s VAL 64 Cb -0.02 -4.29 -0.05 0.00 0.00 0.00 0.00 36.38 32.02 2jbs s VAL 64 CO 0.05 0.07 1.24 -2.84 0.00 0.00 0.00 175.10 173.62 2jbs s PRO 65 N 1.57 3.25 0.41 2.72 0.02 -1.26 -4.85 135.00 136.86 2jbs s PRO 65 Ca 0.51 1.93 0.15 0.00 0.02 0.00 0.00 61.00 63.61 2jbs s PRO 65 Cb -0.20 -2.17 1.02 0.00 0.02 0.00 0.00 34.50 33.18 2jbs s PRO 65 CO 0.23 -1.01 1.89 -0.44 -0.33 0.00 0.00 177.00 177.34 2jbs h ASP 66 N 1.40 0.43 0.13 2.53 5.19 -2.01 -1.83 116.42 122.27 2jbs h ASP 66 Ca -0.50 0.03 0.01 0.00 -0.62 0.00 0.00 57.03 55.95 2jbs h ASP 66 Cb 1.28 -0.05 -0.03 0.00 0.18 0.00 0.00 39.33 40.71 2jbs h ASP 66 CO 0.57 0.21 -0.21 -0.08 -3.12 0.00 0.00 179.24 176.62 2jbs h GLU 67 N 0.46 -0.39 -0.85 3.56 4.81 -1.99 -1.65 114.58 118.52 2jbs h GLU 67 Ca 0.41 0.03 0.07 0.00 -0.13 0.00 0.00 59.36 59.73 2jbs h GLU 67 Cb 0.92 0.09 -0.06 0.00 0.63 0.00 0.00 28.75 30.32 2jbs h GLU 67 CO -0.15 -0.26 0.52 -0.91 -0.73 0.00 0.00 179.01 177.49 2jbs h ASN 68 N -0.40 0.82 -0.28 1.04 4.21 -1.69 0.17 115.58 119.44 2jbs h ASN 68 Ca 0.02 0.02 -0.02 0.00 1.21 0.00 0.00 56.30 57.54 2jbs h ASN 68 Cb 0.42 -0.15 -0.01 0.00 -1.12 0.00 0.00 38.32 37.45 2jbs h ASN 68 CO -0.10 0.52 0.12 0.40 -1.29 0.00 0.00 177.43 177.07 2jbs h ILE 69 N 0.95 1.17 -0.71 2.81 1.08 -1.45 -1.84 117.51 119.52 2jbs h ILE 69 Ca 0.38 -0.53 -0.01 0.00 -0.39 0.00 0.00 64.86 64.30 2jbs h ILE 69 Cb 0.20 1.00 -0.03 0.00 -3.07 0.00 0.00 36.82 34.91 2jbs h ILE 69 CO -0.18 0.18 0.39 0.50 -0.69 0.00 0.00 178.15 178.35 2jbs h LYS 70 N 0.31 0.99 -0.19 2.37 3.64 -0.26 0.28 116.57 123.71 2jbs h LYS 70 Ca 0.09 -0.12 -0.03 0.00 -1.27 0.00 0.00 60.65 59.33 2jbs h LYS 70 Cb 0.18 -0.19 -0.01 0.00 -0.41 0.00 0.00 32.23 31.79 2jbs h LYS 70 CO -0.01 0.74 0.00 -0.07 -2.27 0.00 0.00 179.45 177.84 2jbs h LEU 71 N 0.98 0.32 -0.49 5.20 3.38 -0.64 -1.53 115.31 122.53 2jbs h LEU 71 Ca 0.25 -0.31 -0.07 0.00 0.09 0.00 0.00 57.88 57.85 2jbs h LEU 71 Cb 0.04 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 40.68 2jbs h LEU 71 CO -0.04 0.55 0.04 -0.07 0.09 0.00 0.00 178.44 179.02 2jbs h LEU 72 N 0.09 0.81 -0.93 1.67 3.38 -1.15 -2.80 115.31 116.38 2jbs h LEU 72 Ca 0.05 -0.28 -0.06 0.00 0.09 0.00 0.00 57.88 57.68 2jbs h LEU 72 Cb 0.39 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.90 2jbs h LEU 72 CO 0.01 0.89 0.10 0.11 0.09 0.00 0.00 178.44 179.64 2jbs h LYS 73 N 0.70 0.89 -0.90 1.13 1.57 -0.96 -2.64 116.57 116.35 2jbs h LYS 73 Ca 0.14 -0.21 0.05 0.00 -1.87 0.00 0.00 60.65 58.77 2jbs h LYS 73 Cb 0.45 -0.12 -0.06 0.00 0.08 0.00 0.00 32.23 32.58 2jbs h LYS 73 CO 0.02 0.82 0.57 1.49 -0.57 0.00 0.00 179.45 181.78 2jbs h GLU 74 N 0.85 1.05 0.00 3.15 4.81 -1.04 0.15 114.58 123.54 2jbs h GLU 74 Ca 0.18 -0.06 0.00 0.00 -0.13 0.00 0.00 59.36 59.34 2jbs h GLU 74 Cb 0.36 -0.24 0.00 0.00 0.63 0.00 0.00 28.75 29.50 2jbs h GLU 74 CO 0.01 0.70 0.00 0.44 -0.73 0.00 0.00 179.01 179.42 2jbs n ILE 75 N -4.55 0.04 -0.72 2.32 -5.35 -1.08 -4.90 119.36 105.13 2jbs n ILE 75 Ca 0.12 0.01 0.00 0.00 -0.27 0.00 0.00 62.75 62.61 2jbs n ILE 75 Cb 0.13 -0.53 0.00 0.00 -1.74 0.00 0.00 39.64 37.50 2jbs n ILE 75 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2jbs n GLY 76 N 1.09 0.66 0.35 3.28 0.00 0.51 -4.95 105.19 106.13 2jbs n GLY 76 Ca 0.16 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.30 2jbs n GLY 76 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2jbs h LEU 77 N 0.00 0.36 0.00 0.99 5.85 -1.68 -0.90 115.31 119.93 2jbs h LEU 77 Ca 0.00 0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.73 2jbs h LEU 77 Cb 0.00 -0.07 0.00 0.00 0.37 0.00 0.00 40.66 40.96 2jbs h LEU 77 CO 0.00 0.22 0.00 0.00 -0.34 0.00 0.00 178.44 178.32 2jbs n HIS 78 N -4.47 0.00 -0.77 1.25 1.44 -1.26 -1.33 115.22 110.08 2jbs n HIS 78 Ca 0.10 0.00 0.08 0.00 -2.01 0.00 0.00 57.72 55.89 2jbs n HIS 78 Cb 0.37 -0.47 0.34 0.00 0.12 0.00 0.00 29.99 30.35 2jbs n HIS 78 CO 0.00 0.00 0.00 0.54 -2.81 0.00 0.00 176.34 174.07 2jbs n ARG 79 N -1.47 3.93 -0.20 -1.40 1.74 -0.34 -4.57 116.66 114.34 2jbs n ARG 79 Ca 0.02 -2.93 -0.00 0.00 -0.77 0.00 0.00 57.85 54.18 2jbs n ARG 79 Cb 0.09 -1.97 0.11 0.00 -1.02 0.00 0.00 32.46 29.67 2jbs n ARG 79 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2jbs h ALA 80 N 3.46 0.76 -0.19 7.54 0.00 -1.34 0.25 119.26 129.75 2jbs h ALA 80 Ca 0.00 0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.00 2jbs h ALA 80 Cb 1.59 0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.47 2jbs h ALA 80 CO 0.31 -0.22 0.00 1.19 0.00 0.00 0.00 179.25 180.52 2jbs n PHE 81 N -5.03 0.24 -2.03 0.00 3.72 -1.26 -0.23 117.46 112.88 2jbs n PHE 81 Ca 0.09 -0.28 -0.41 0.00 -0.05 0.00 0.00 57.45 56.80 2jbs n PHE 81 Cb 0.28 -0.02 -0.02 0.00 -0.94 0.00 0.00 39.48 38.79 2jbs n PHE 81 CO 0.00 0.00 0.00 -1.14 -0.05 0.00 0.00 176.76 175.57 2jbs s GLN 82 N -0.94 4.28 0.70 -1.08 0.74 -1.16 -4.09 119.66 118.11 2jbs s GLN 82 Ca 0.18 2.30 -0.16 0.00 0.05 0.00 0.00 55.36 57.72 2jbs s GLN 82 Cb 0.10 -3.08 0.01 0.00 1.10 0.00 0.00 33.01 31.15 2jbs s GLN 82 CO 0.14 -0.34 1.12 -2.30 -0.55 0.00 0.00 175.29 173.37 2jbs n PRO 83 N 1.47 0.69 -0.26 1.67 -0.02 -1.26 -3.65 135.00 133.64 2jbs n PRO 83 Ca 0.03 0.29 -0.07 0.00 -2.02 0.00 0.00 63.50 61.74 2jbs n PRO 83 Cb 0.41 -2.37 0.05 0.00 -0.02 0.00 0.00 33.50 31.57 2jbs n PRO 83 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 2jbs h LYS 84 N -0.05 1.12 -0.33 -0.52 1.57 -1.93 -1.52 116.57 114.91 2jbs h LYS 84 Ca -0.48 -0.25 0.09 0.00 -1.87 0.00 0.00 60.65 58.14 2jbs h LYS 84 Cb 1.33 -0.16 -0.01 0.00 0.08 0.00 0.00 32.23 33.47 2jbs h LYS 84 CO 0.49 0.97 0.37 -0.39 -0.57 0.00 0.00 179.45 180.32 2jbs h VAL 85 N 1.06 0.38 -0.11 0.50 -1.51 -1.90 0.38 116.25 115.05 2jbs h VAL 85 Ca 0.23 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.70 2jbs h VAL 85 Cb 0.33 0.70 0.00 0.00 -2.13 0.00 0.00 31.29 30.18 2jbs h VAL 85 CO -0.00 0.00 0.00 -1.22 -1.23 0.00 0.00 177.57 175.12 2jbs n TYR 86 N -3.69 0.11 0.00 5.19 4.01 -1.07 -4.93 117.16 116.79 2jbs n TYR 86 Ca 0.05 -0.06 0.00 0.00 -0.16 0.00 0.00 57.90 57.74 2jbs n TYR 86 Cb 0.53 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.56 2jbs n TYR 86 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2jbs n GLY 87 N 1.35 1.43 3.95 2.72 0.00 0.13 -4.92 105.19 109.84 2jbs n GLY 87 Ca 0.16 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.94 2jbs n GLY 87 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2jbs s GLY 88 N -2.00 1.74 -0.15 -0.02 0.00 -0.60 -4.97 107.32 101.32 2jbs s GLY 88 Ca 0.00 -1.07 -0.00 0.00 0.00 0.00 0.00 44.72 43.65 2jbs s GLY 88 CO 0.00 -0.71 0.24 1.04 0.00 0.00 0.00 173.10 173.67 2jbs n LEU 89 N -2.71 2.33 -3.29 0.66 4.77 0.07 -4.32 117.00 114.51 2jbs n LEU 89 Ca 0.08 0.14 -0.16 0.00 -0.03 0.00 0.00 56.01 56.04 2jbs n LEU 89 Cb 0.60 -0.80 0.08 0.00 -2.33 0.00 0.00 43.42 40.97 2jbs n LEU 89 CO 0.50 0.79 0.06 -0.62 -1.33 0.00 0.00 177.39 176.79 2jbs n GLU 90 N -3.32 -3.98 -1.98 3.23 1.02 -0.44 -4.95 120.64 110.23 2jbs n GLU 90 Ca -0.34 0.85 -0.35 0.00 -0.02 0.00 0.00 57.16 57.30 2jbs n GLU 90 Cb 1.04 -5.78 0.03 0.00 -0.02 0.00 0.00 31.44 26.72 2jbs n GLU 90 CO 0.00 0.00 0.00 -1.64 1.18 0.00 0.00 177.13 176.67 2jbs s MET 91 N -4.76 2.95 0.66 3.49 -1.94 0.68 -4.95 119.30 115.42 2jbs s MET 91 Ca 0.27 1.72 -0.15 0.00 -1.71 0.00 0.00 55.69 55.82 2jbs s MET 91 Cb -0.03 -1.94 -0.00 0.00 2.01 0.00 0.00 34.83 34.87 2jbs s MET 91 CO 0.72 -1.20 1.11 -1.54 -0.01 0.00 0.00 175.02 174.11 2jbs s SER 92 N -1.79 5.09 0.11 3.03 1.04 -1.26 -4.88 113.70 115.04 2jbs s SER 92 Ca 0.75 2.01 -0.23 0.00 0.48 0.00 0.00 55.95 58.96 2jbs s SER 92 Cb -0.28 -2.55 -0.08 0.00 0.10 0.00 0.00 66.02 63.21 2jbs s SER 92 CO 0.34 -1.64 1.70 0.25 0.98 0.00 0.00 173.24 174.86 2jbs h LEU 93 N 0.05 -0.28 -0.44 2.42 5.85 -1.95 -1.99 115.31 118.97 2jbs h LEU 93 Ca -0.47 0.05 0.09 0.00 0.84 0.00 0.00 57.88 58.39 2jbs h LEU 93 Cb 1.25 0.13 -0.09 0.00 0.37 0.00 0.00 40.66 42.32 2jbs h LEU 93 CO 0.54 -0.14 -0.17 -0.65 -0.34 0.00 0.00 178.44 177.69 2jbs h PRO 94 N -0.15 -0.07 -0.76 5.25 0.11 -1.93 0.12 132.00 134.56 2jbs h PRO 94 Ca 0.05 0.00 0.02 0.00 0.11 0.00 0.00 66.00 66.19 2jbs h PRO 94 Cb 0.21 0.02 -0.04 0.00 0.11 0.00 0.00 31.00 31.30 2jbs h PRO 94 CO -0.12 -0.05 0.50 -0.44 -0.21 0.00 0.00 178.00 177.69 2jbs h ASP 95 N -0.07 0.83 0.18 -2.05 5.19 -1.87 -1.17 116.42 117.46 2jbs h ASP 95 Ca 0.21 -0.01 -0.01 0.00 -0.62 0.00 0.00 57.03 56.60 2jbs h ASP 95 Cb 0.40 -0.20 0.00 0.00 0.18 0.00 0.00 39.33 39.71 2jbs h ASP 95 CO -0.49 0.58 -0.09 0.15 -3.12 0.00 0.00 179.24 176.27 2jbs h PHE 96 N 0.97 -0.23 -0.97 4.55 3.57 -0.46 -3.11 116.94 121.27 2jbs h PHE 96 Ca 0.30 -0.01 0.20 0.00 3.53 0.00 0.00 57.97 61.99 2jbs h PHE 96 Cb -0.01 0.08 -0.18 0.00 2.79 0.00 0.00 35.95 38.62 2jbs h PHE 96 CO -0.00 0.14 -0.22 0.00 -2.23 0.00 0.00 178.31 175.99 2jbs n ALA 97 N -2.63 0.25 0.29 2.41 0.00 0.30 -0.08 120.51 121.05 2jbs n ALA 97 Ca -0.07 1.06 0.17 0.00 0.00 0.00 0.00 53.44 54.60 2jbs n ALA 97 Cb 0.23 -0.65 0.88 0.00 0.00 0.00 0.00 19.45 19.92 2jbs n ALA 97 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.50 176.59 2jbs h ASN 98 N 0.00 0.00 -0.07 0.00 2.35 -1.27 -0.35 115.58 116.24 2jbs h ASN 98 Ca 0.47 0.00 -0.23 0.00 -0.55 0.00 0.00 56.30 55.99 2jbs h ASN 98 Cb 0.74 0.00 0.02 0.00 0.05 0.00 0.00 38.32 39.13 2jbs h ASN 98 CO -0.99 0.05 -0.87 0.00 -1.65 0.00 0.00 177.43 173.97 2jbs h ILE 100 N 0.40 1.26 -0.03 0.00 1.08 -0.77 0.35 117.51 119.81 2jbs h ILE 100 Ca -0.09 -1.19 0.00 0.00 -0.39 0.00 0.00 64.86 63.19 2jbs h ILE 100 Cb 1.52 0.89 -0.00 0.00 -3.07 0.00 0.00 36.82 36.15 2jbs h ILE 100 CO 0.17 0.42 0.02 0.58 -0.69 0.00 0.00 178.15 178.66 2jbs h VAL 101 N 0.91 1.02 -0.30 1.67 2.07 -1.17 0.15 116.25 120.61 2jbs h VAL 101 Ca 0.15 -0.06 -0.01 0.00 0.82 0.00 0.00 66.70 67.60 2jbs h VAL 101 Cb 0.60 1.01 -0.01 0.00 -1.52 0.00 0.00 31.29 31.37 2jbs h VAL 101 CO 0.04 0.02 0.16 0.74 0.02 0.00 0.00 177.57 178.55 2jbs h THR 102 N 0.02 1.13 -0.84 2.57 2.02 -1.32 -2.54 112.91 113.95 2jbs h THR 102 Ca 0.01 -0.35 0.06 0.00 0.77 0.00 0.00 66.41 66.90 2jbs h THR 102 Cb 0.02 0.82 -0.06 0.00 -1.74 0.00 0.00 68.15 67.19 2jbs h THR 102 CO -0.00 0.13 0.52 0.25 0.37 0.00 0.00 175.52 176.79 2jbs h LEU 103 N 0.36 0.82 -1.86 2.58 5.85 -0.67 -2.34 115.31 120.06 2jbs h LEU 103 Ca 0.10 0.01 -0.03 0.00 0.84 0.00 0.00 57.88 58.81 2jbs h LEU 103 Cb 0.07 -0.16 -0.00 0.00 0.37 0.00 0.00 40.66 40.94 2jbs h LEU 103 CO -0.02 0.53 -0.14 0.00 -0.34 0.00 0.00 178.44 178.48 2jbs h ALA 104 N 1.39 1.45 0.00 1.25 0.00 -0.28 -0.63 119.26 122.45 2jbs h ALA 104 Ca 0.36 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 55.13 2jbs h ALA 104 Cb 0.15 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 17.92 2jbs h ALA 104 CO -0.17 0.17 -0.07 0.78 0.00 0.00 0.00 179.25 179.97 2jbs h GLY 105 N 0.67 0.00 0.05 0.00 0.00 -1.22 -2.98 103.07 99.59 2jbs h GLY 105 Ca -0.00 0.00 -0.40 0.00 0.00 0.00 0.00 47.33 46.93 2jbs h GLY 105 CO 0.02 0.00 -2.43 0.00 0.00 0.00 0.00 176.54 174.12 2jbs n ALA 106 N -2.32 1.35 -3.32 3.60 0.00 -0.28 -4.91 120.51 114.63 2jbs n ALA 106 Ca -0.02 -1.06 -0.09 0.00 0.00 0.00 0.00 53.44 52.27 2jbs n ALA 106 Cb 0.16 -0.12 -0.07 0.00 0.00 0.00 0.00 19.45 19.43 2jbs n ALA 106 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2jbs h ALA 108 N 8.17 -0.18 -0.83 0.00 0.00 -1.77 -0.42 119.26 124.23 2jbs h ALA 108 Ca -0.13 0.03 0.09 0.00 0.00 0.00 0.00 54.91 54.89 2jbs h ALA 108 Cb 1.13 0.35 -0.07 0.00 0.00 0.00 0.00 17.79 19.21 2jbs h ALA 108 CO 0.27 -0.66 0.49 0.78 0.00 0.00 0.00 179.25 180.13 2jbs h GLY 109 N -0.27 1.28 0.88 0.00 0.00 -1.89 0.31 103.07 103.39 2jbs h GLY 109 Ca 0.08 -0.33 -0.03 0.00 0.00 0.00 0.00 47.33 47.05 2jbs h GLY 109 CO -0.23 0.16 -0.29 -0.84 0.00 0.00 0.00 176.54 175.34 2jbs h THR 110 N 0.84 0.35 -0.70 4.70 2.02 -1.64 -1.53 112.91 116.94 2jbs h THR 110 Ca 0.39 -0.18 0.14 0.00 0.77 0.00 0.00 66.41 67.53 2jbs h THR 110 Cb 0.31 0.41 -0.10 0.00 -1.74 0.00 0.00 68.15 67.04 2jbs h THR 110 CO -0.23 0.02 0.20 0.00 0.37 0.00 0.00 175.52 175.89 2jbs h ALA 111 N -0.63 0.92 0.61 6.16 0.00 -0.38 0.24 119.26 126.17 2jbs h ALA 111 Ca -0.08 0.14 -0.03 0.00 0.00 0.00 0.00 54.91 54.94 2jbs h ALA 111 Cb 0.67 0.17 0.01 0.00 0.00 0.00 0.00 17.79 18.63 2jbs h ALA 111 CO 0.14 -0.29 -0.29 2.35 0.00 0.00 0.00 179.25 181.16 2jbs h TRP 112 N 0.32 -0.76 -0.12 0.00 2.91 -0.41 0.13 115.95 118.02 2jbs h TRP 112 Ca 0.39 -0.02 0.02 0.00 1.13 0.00 0.00 58.89 60.41 2jbs h TRP 112 Cb 0.61 0.25 -0.02 0.00 -0.51 0.00 0.00 29.16 29.49 2jbs h TRP 112 CO -0.23 -0.43 -0.02 0.00 -1.03 0.00 0.00 178.44 176.73 2jbs h ALA 113 N -0.63 0.09 -0.36 2.65 0.00 -0.93 -2.16 119.26 117.93 2jbs h ALA 113 Ca -0.08 0.04 -0.10 0.00 0.00 0.00 0.00 54.91 54.77 2jbs h ALA 113 Cb 0.67 0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.52 2jbs h ALA 113 CO 0.14 -0.47 -0.20 0.35 0.00 0.00 0.00 179.25 179.06 2jbs h PHE 114 N 0.02 0.76 -0.44 0.00 3.57 -0.53 -1.55 116.94 118.76 2jbs h PHE 114 Ca 0.06 -0.16 0.06 0.00 3.53 0.00 0.00 57.97 61.46 2jbs h PHE 114 Cb 0.08 -0.19 -0.05 0.00 2.79 0.00 0.00 35.95 38.58 2jbs h PHE 114 CO -0.15 0.83 0.15 1.03 -2.23 0.00 0.00 178.31 177.93 2jbs h SER 115 N 0.60 0.14 0.00 0.41 0.87 -0.36 -1.34 113.55 113.88 2jbs h SER 115 Ca 0.09 0.06 -0.00 0.00 -1.23 0.00 0.00 61.79 60.71 2jbs h SER 115 Cb 0.67 0.05 0.00 0.00 -0.44 0.00 0.00 62.40 62.68 2jbs h SER 115 CO 0.05 0.11 -0.00 -0.07 -0.53 0.00 0.00 176.83 176.39 2jbs h LEU 116 N 0.31 -0.00 -1.35 2.23 3.38 -0.68 -0.15 115.31 119.06 2jbs h LEU 116 Ca 0.21 -0.04 0.20 0.00 0.09 0.00 0.00 57.88 58.34 2jbs h LEU 116 Cb 0.22 0.00 -0.08 0.00 0.09 0.00 0.00 40.66 40.89 2jbs h LEU 116 CO -0.22 0.03 0.61 -0.07 0.09 0.00 0.00 178.44 178.88 2jbs h LEU 117 N -0.04 0.53 0.12 1.67 3.38 -0.99 -1.21 115.31 118.77 2jbs h LEU 117 Ca -0.00 0.06 -0.01 0.00 0.09 0.00 0.00 57.88 58.02 2jbs h LEU 117 Cb 0.04 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 40.75 2jbs h LEU 117 CO 0.00 0.21 -0.06 0.00 0.09 0.00 0.00 178.44 178.68 2jbs h THR 119 N -0.67 0.00 -0.17 0.00 1.35 -0.25 -2.40 112.91 110.78 2jbs h THR 119 Ca -0.02 -0.32 -0.07 0.00 -0.55 0.00 0.00 66.41 65.46 2jbs h THR 119 Cb 0.51 1.14 -0.01 0.00 -1.73 0.00 0.00 68.15 68.06 2jbs h THR 119 CO 0.03 0.00 -0.20 0.45 -0.25 0.00 0.00 175.52 175.55 2jbs h HIS 120 N 0.00 0.31 -0.63 4.73 -0.00 -1.36 -2.90 115.15 115.29 2jbs h HIS 120 Ca 0.00 -0.05 -0.00 0.00 -0.00 0.00 0.00 60.37 60.32 2jbs h HIS 120 Cb 0.48 -0.08 -0.03 0.00 -0.00 0.00 0.00 27.41 27.77 2jbs h HIS 120 CO 0.00 0.48 0.38 0.77 -0.00 0.00 0.00 177.93 179.56 2jbs h SER 121 N 0.27 0.75 -0.27 2.45 0.02 -1.59 -0.67 113.55 114.51 2jbs h SER 121 Ca 0.05 -0.04 0.02 0.00 -0.84 0.00 0.00 61.79 60.98 2jbs h SER 121 Cb 0.51 -0.19 -0.01 0.00 0.14 0.00 0.00 62.40 62.85 2jbs h SER 121 CO 0.03 0.58 0.18 -0.74 -1.14 0.00 0.00 176.83 175.75 2jbs h HIS 122 N 0.87 0.26 0.00 3.45 6.17 -1.66 -0.09 115.15 124.15 2jbs h HIS 122 Ca 0.23 0.01 -0.03 0.00 0.71 0.00 0.00 60.37 61.29 2jbs h HIS 122 Cb -0.03 -0.09 -0.00 0.00 2.52 0.00 0.00 27.41 29.81 2jbs h HIS 122 CO 0.00 0.15 -0.16 0.37 0.71 0.00 0.00 177.93 179.00 2jbs h GLN 123 N 0.27 0.00 -0.97 5.26 4.15 -1.42 -3.29 115.11 119.11 2jbs h GLN 123 Ca 0.11 0.00 0.31 0.00 0.77 0.00 0.00 58.65 59.84 2jbs h GLN 123 Cb 0.11 0.00 -0.15 0.00 0.21 0.00 0.00 27.48 27.65 2jbs h GLN 123 CO -0.02 0.89 0.46 0.82 -1.93 0.00 0.00 178.83 179.05 2jbs h ILE 124 N -1.00 0.26 0.00 2.39 2.04 -0.86 0.39 117.51 120.73 2jbs h ILE 124 Ca -0.04 -0.09 0.00 0.00 1.00 0.00 0.00 64.86 65.73 2jbs h ILE 124 Cb 0.94 -0.01 0.00 0.00 -0.74 0.00 0.00 36.82 37.00 2jbs h ILE 124 CO -0.03 0.05 0.00 0.00 0.00 0.00 0.00 178.15 178.17 2jbs n ALA 125 N -2.43 1.40 0.59 1.87 0.00 -0.07 -0.54 120.51 121.32 2jbs n ALA 125 Ca 0.29 -0.02 0.07 0.00 0.00 0.00 0.00 53.44 53.79 2jbs n ALA 125 Cb 0.93 -1.05 0.05 0.00 0.00 0.00 0.00 19.45 19.38 2jbs n ALA 125 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 2jbs n MET 126 N -1.23 1.01 -2.03 0.00 2.81 0.14 -4.78 117.12 113.03 2jbs n MET 126 Ca 0.02 -1.29 -0.28 0.00 -1.81 0.00 0.00 57.70 54.33 2jbs n MET 126 Cb 0.02 -1.26 0.19 0.00 -0.71 0.00 0.00 33.22 31.46 2jbs n MET 126 CO 0.00 0.00 0.00 1.19 1.51 0.00 0.00 175.97 178.67 2jbs n PHE 127 N 0.72 -3.80 -1.46 2.03 3.01 0.30 -0.85 117.46 117.41 2jbs n PHE 127 Ca 0.08 -1.29 -0.36 0.00 1.01 0.00 0.00 57.45 56.89 2jbs n PHE 127 Cb 0.35 -0.98 0.09 0.00 -0.01 0.00 0.00 39.48 38.93 2jbs n PHE 127 CO 0.00 0.00 0.00 -1.13 1.01 0.00 0.00 176.76 176.64 2jbs n SER 128 N -3.69 1.29 -0.02 4.37 3.41 -1.26 -2.99 113.62 114.73 2jbs n SER 128 Ca 0.17 0.72 0.09 0.00 -0.26 0.00 0.00 58.87 59.58 2jbs n SER 128 Cb 0.58 -1.49 0.48 0.00 -0.26 0.00 0.00 64.21 63.52 2jbs n SER 128 CO 0.00 0.00 0.00 0.50 -0.16 0.00 0.00 175.04 175.38 2jbs h LYS 129 N -0.06 0.42 -0.72 4.33 3.64 -1.95 -2.25 116.57 119.97 2jbs h LYS 129 Ca -0.49 -0.02 -0.05 0.00 -1.27 0.00 0.00 60.65 58.82 2jbs h LYS 129 Cb 1.33 -0.09 -0.03 0.00 -0.41 0.00 0.00 32.23 33.02 2jbs h LYS 129 CO 0.49 0.27 0.27 1.96 -2.27 0.00 0.00 179.45 180.18 2jbs h GLN 130 N 0.43 1.08 -0.08 1.90 7.50 -1.94 -0.75 115.11 123.24 2jbs h GLN 130 Ca 0.20 -0.20 -0.03 0.00 0.50 0.00 0.00 58.65 59.13 2jbs h GLN 130 Cb 0.27 -0.17 -0.00 0.00 0.05 0.00 0.00 27.48 27.62 2jbs h GLN 130 CO -0.05 0.89 -0.06 1.25 -1.50 0.00 0.00 178.83 179.36 2jbs h LEU 131 N 1.05 0.19 -0.95 1.46 5.85 -1.70 -1.11 115.31 120.12 2jbs h LEU 131 Ca 0.24 -0.46 0.04 0.00 0.84 0.00 0.00 57.88 58.54 2jbs h LEU 131 Cb 0.23 -0.05 -0.06 0.00 0.37 0.00 0.00 40.66 41.15 2jbs h LEU 131 CO -0.02 0.61 0.62 1.56 -0.34 0.00 0.00 178.44 180.87 2jbs h GLN 132 N -0.22 1.16 -0.90 1.25 4.20 -1.35 -0.67 115.11 118.58 2jbs h GLN 132 Ca 0.01 -0.07 0.02 0.00 0.06 0.00 0.00 58.65 58.67 2jbs h GLN 132 Cb 0.55 -0.26 -0.05 0.00 0.30 0.00 0.00 27.48 28.02 2jbs h GLN 132 CO 0.02 0.77 0.59 -0.44 -0.67 0.00 0.00 178.83 179.09 2jbs h ASP 133 N 1.19 1.00 -0.05 1.46 5.19 -1.03 -0.70 116.42 123.48 2jbs h ASP 133 Ca 0.38 -0.02 -0.01 0.00 -0.62 0.00 0.00 57.03 56.76 2jbs h ASP 133 Cb 0.01 -0.24 -0.00 0.00 0.18 0.00 0.00 39.33 39.27 2jbs h ASP 133 CO -0.12 0.71 0.00 -0.08 -3.12 0.00 0.00 179.24 176.63 2jbs h GLU 134 N 1.18 0.09 -0.02 3.56 4.81 -0.14 -2.45 114.58 121.61 2jbs h GLU 134 Ca 0.34 -0.03 -0.00 0.00 -0.13 0.00 0.00 59.36 59.54 2jbs h GLU 134 Cb -0.08 -0.01 -0.00 0.00 0.63 0.00 0.00 28.75 29.29 2jbs h GLU 134 CO -0.09 0.36 -0.00 0.82 -0.73 0.00 0.00 179.01 179.37 2jbs h ILE 135 N -0.19 1.25 0.00 2.32 2.04 -1.07 -3.37 117.51 118.49 2jbs h ILE 135 Ca 0.01 -0.74 -0.37 0.00 1.00 0.00 0.00 64.86 64.76 2jbs h ILE 135 Cb 0.31 1.72 -0.07 0.00 -0.74 0.00 0.00 36.82 38.04 2jbs h ILE 135 CO 0.00 0.20 -2.41 0.79 0.00 0.00 0.00 178.15 176.73 2jbs n TRP 136 N -4.92 0.00 -0.29 1.37 8.01 -0.28 -2.74 117.44 118.60 2jbs n TRP 136 Ca -0.08 0.00 0.08 0.00 -1.31 0.00 0.00 57.50 56.20 2jbs n TRP 136 Cb 0.18 -0.96 0.31 0.00 -2.01 0.00 0.00 31.31 28.83 2jbs n TRP 136 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 177.69 176.61 2jbs h LEU 137 N 0.00 0.78 0.62 -0.99 3.38 -1.58 -2.00 115.31 115.51 2jbs h LEU 137 Ca -0.55 0.03 -0.03 0.00 0.09 0.00 0.00 57.88 57.41 2jbs h LEU 137 Cb 1.91 -0.13 0.01 0.00 0.09 0.00 0.00 40.66 42.54 2jbs h LEU 137 CO -0.07 0.44 -0.30 0.50 0.09 0.00 0.00 178.44 179.10 2jbs h LYS 138 N 0.85 -0.80 -3.09 1.13 3.64 -1.72 -3.43 116.57 113.14 2jbs h LYS 138 Ca 0.43 0.05 -0.46 0.00 -1.27 0.00 0.00 60.65 59.40 2jbs h LYS 138 Cb 0.48 0.18 -0.41 0.00 -0.41 0.00 0.00 32.23 32.07 2jbs h LYS 138 CO -0.19 -0.48 -0.75 0.34 -2.27 0.00 0.00 179.45 176.10 2jbs s ASP 139 N -4.57 2.34 0.19 4.20 2.15 -1.02 -5.03 116.67 114.92 2jbs s ASP 139 Ca -0.15 -0.60 0.23 0.00 0.43 0.00 0.00 52.55 52.46 2jbs s ASP 139 Cb 0.02 -0.26 0.91 0.00 -0.30 0.00 0.00 42.92 43.29 2jbs s ASP 139 CO 0.51 -0.34 1.70 -2.65 -0.17 0.00 0.00 175.17 174.22 2jbs n PRO 140 N 5.27 0.17 -0.03 4.34 -0.02 -0.78 -2.34 135.00 141.60 2jbs n PRO 140 Ca -0.07 0.32 0.12 0.00 -2.02 0.00 0.00 63.50 61.86 2jbs n PRO 140 Cb 0.49 -1.78 0.24 0.00 -0.02 0.00 0.00 33.50 32.43 2jbs n PRO 140 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 2jbs n ASP 141 N -2.09 2.60 -4.76 2.55 8.00 -1.26 -4.99 116.55 116.59 2jbs n ASP 141 Ca 0.03 -1.85 -0.39 0.00 0.71 0.00 0.00 54.79 53.29 2jbs n ASP 141 Cb 0.27 -0.04 0.01 0.00 -0.02 0.00 0.00 41.12 41.34 2jbs n ASP 141 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2jbs s ALA 142 N -1.92 3.18 0.21 2.24 0.00 -0.99 -5.04 121.76 119.43 2jbs s ALA 142 Ca 0.32 1.30 0.01 0.00 0.00 0.00 0.00 51.96 53.59 2jbs s ALA 142 Cb 0.20 -3.52 -0.05 0.00 0.00 0.00 0.00 23.12 19.75 2jbs s ALA 142 CO 0.31 -1.00 0.06 0.95 0.00 0.00 0.00 175.76 176.08 2jbs s THR 143 N -1.27 0.50 -0.00 0.00 -4.23 -1.26 -5.01 115.64 104.36 2jbs s THR 143 Ca 0.60 -1.99 0.06 0.00 -1.18 0.00 0.00 61.69 59.19 2jbs s THR 143 Cb -0.39 -2.39 -0.02 0.00 1.34 0.00 0.00 72.50 71.04 2jbs s THR 143 CO 0.50 -0.21 -0.18 0.00 -0.54 0.00 0.00 174.62 174.19 2jbs s ALA 144 N -3.79 1.54 0.69 3.99 0.00 -1.26 -1.30 121.76 121.64 2jbs s ALA 144 Ca 0.32 -0.83 0.04 0.00 0.00 0.00 0.00 51.96 51.49 2jbs s ALA 144 Cb 0.07 -0.37 0.13 0.00 0.00 0.00 0.00 23.12 22.95 2jbs s ALA 144 CO 0.09 0.37 0.95 -1.54 0.00 0.00 0.00 175.76 175.63 2jbs s SER 145 N -0.56 4.49 0.26 0.00 1.04 -0.21 -4.35 113.70 114.37 2jbs s SER 145 Ca 0.07 -0.65 -0.02 0.00 0.48 0.00 0.00 55.95 55.83 2jbs s SER 145 Cb -0.07 0.30 -0.02 0.00 0.10 0.00 0.00 66.02 66.33 2jbs s SER 145 CO -0.00 -1.78 0.28 -0.94 0.98 0.00 0.00 173.24 171.78 2jbs s SER 146 N -4.77 0.51 -0.30 7.02 1.04 -1.26 -0.71 113.70 115.23 2jbs s SER 146 Ca 0.66 -1.38 0.05 0.00 0.48 0.00 0.00 55.95 55.76 2jbs s SER 146 Cb -0.04 0.50 0.20 0.00 0.10 0.00 0.00 66.02 66.77 2jbs s SER 146 CO 0.43 -1.02 0.63 -0.55 0.98 0.00 0.00 173.24 173.71 2jbs s SER 147 N -3.18 -1.54 0.02 7.02 0.15 -0.69 -4.12 113.70 111.36 2jbs s SER 147 Ca 0.35 0.11 0.22 0.00 0.70 0.00 0.00 55.95 57.33 2jbs s SER 147 Cb 0.03 1.98 -0.24 0.00 -1.71 0.00 0.00 66.02 66.07 2jbs s SER 147 CO 0.16 -0.27 0.62 2.30 1.20 0.00 0.00 173.24 177.24 2jbs n ILE 148 N 5.32 0.25 -1.65 6.45 -5.35 -1.26 -1.71 119.36 121.41 2jbs n ILE 148 Ca 0.06 -0.53 -0.43 0.00 -0.27 0.00 0.00 62.75 61.57 2jbs n ILE 148 Cb 0.55 -0.13 -0.03 0.00 -1.74 0.00 0.00 39.64 38.29 2jbs n ILE 148 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2jbs n ALA 149 N -2.26 1.54 -0.97 -1.28 0.00 -1.26 -4.10 120.51 112.17 2jbs n ALA 149 Ca -0.04 0.14 -0.30 0.00 0.00 0.00 0.00 53.44 53.23 2jbs n ALA 149 Cb 0.60 -2.71 -0.03 0.00 0.00 0.00 0.00 19.45 17.31 2jbs n ALA 149 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2jbs n PRO 150 N 7.66 2.21 0.20 0.00 -0.04 -1.26 -4.67 135.00 139.10 2jbs n PRO 150 Ca 0.22 -1.72 0.09 0.00 -0.04 0.00 0.00 63.50 62.05 2jbs n PRO 150 Cb 0.40 -2.66 0.20 0.00 -0.04 0.00 0.00 33.50 31.41 2jbs n PRO 150 CO 0.00 0.00 0.00 0.74 -0.04 0.00 0.00 175.50 176.20 2jbs h PHE 151 N 6.49 0.00 -3.97 0.54 0.04 -1.90 -3.43 116.94 114.71 2jbs h PHE 151 Ca 0.53 0.00 -0.53 0.00 2.80 0.00 0.00 57.97 60.77 2jbs h PHE 151 Cb 0.32 0.00 0.10 0.00 2.20 0.00 0.00 35.95 38.57 2jbs h PHE 151 CO 1.75 0.20 0.65 0.20 -0.60 0.00 0.00 178.31 180.51 2jbs s GLY 152 N -4.30 2.92 0.03 -1.45 0.00 -1.26 -4.94 107.32 98.32 2jbs s GLY 152 Ca 0.05 1.33 -0.24 0.00 0.00 0.00 0.00 44.72 45.85 2jbs s GLY 152 CO 0.68 1.92 0.73 0.54 0.00 0.00 0.00 173.10 176.97 2jbs s LYS 153 N -2.35 4.46 -0.12 2.90 1.02 0.06 -4.72 119.74 120.97 2jbs s LYS 153 Ca 0.59 0.99 0.00 0.00 0.02 0.00 0.00 55.97 57.57 2jbs s LYS 153 Cb -0.40 -3.36 0.02 0.00 -0.52 0.00 0.00 37.83 33.56 2jbs s LYS 153 CO 0.52 0.29 -0.11 0.54 -0.92 0.00 0.00 175.35 175.66 2jbs s VAL 154 N -0.03 1.31 -0.22 3.17 0.11 -1.26 -1.86 120.40 121.62 2jbs s VAL 154 Ca 0.37 -0.48 -0.09 0.00 -2.93 0.00 0.00 61.98 58.85 2jbs s VAL 154 Cb -0.20 -1.26 -0.05 0.00 -1.53 0.00 0.00 36.38 33.35 2jbs s VAL 154 CO 0.22 0.41 0.12 -0.70 -3.33 0.00 0.00 175.10 171.82 2jbs s GLU 155 N 1.48 4.04 -0.61 1.54 2.12 -0.73 -4.99 118.70 121.55 2jbs s GLU 155 Ca 0.03 -0.30 -0.28 0.00 0.36 0.00 0.00 54.97 54.78 2jbs s GLU 155 Cb -0.13 -3.41 0.03 0.00 0.26 0.00 0.00 34.13 30.88 2jbs s GLU 155 CO -0.08 0.15 1.27 -1.21 -0.54 0.00 0.00 175.26 174.85 2jbs s GLU 156 N 0.77 3.38 0.47 4.30 0.41 -1.26 -1.43 118.70 125.34 2jbs s GLU 156 Ca 0.06 0.20 0.05 0.00 -0.41 0.00 0.00 54.97 54.88 2jbs s GLU 156 Cb -0.13 -4.08 0.02 0.00 -1.78 0.00 0.00 34.13 28.16 2jbs s GLU 156 CO 0.02 -1.86 0.65 0.14 -0.49 0.00 0.00 175.26 173.72 2jbs s VAL 157 N 5.44 2.91 -0.02 2.63 -7.23 -0.91 -4.99 120.40 118.22 2jbs s VAL 157 Ca 0.44 -0.87 -0.26 0.00 -1.81 0.00 0.00 61.98 59.47 2jbs s VAL 157 Cb -0.08 -3.01 -0.04 0.00 0.56 0.00 0.00 36.38 33.81 2jbs s VAL 157 CO 0.23 -0.01 0.83 -1.83 -0.31 0.00 0.00 175.10 174.01 2jbs s GLU 158 N -4.50 4.50 0.00 4.82 -1.05 -1.26 -3.12 118.70 118.09 2jbs s GLU 158 Ca 0.56 1.14 0.00 0.00 -0.15 0.00 0.00 54.97 56.51 2jbs s GLU 158 Cb -0.10 -3.44 0.00 0.00 -0.44 0.00 0.00 34.13 30.15 2jbs s GLU 158 CO 0.35 0.04 0.00 0.41 0.95 0.00 0.00 175.26 177.01 2jbs n GLY 159 N 2.93 0.21 0.00 -3.83 0.00 -1.26 -4.96 105.19 98.28 2jbs n GLY 159 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.04 2jbs n GLY 159 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jbs n GLY 160 N -1.80 -0.41 3.17 -0.02 0.00 -1.18 -1.34 105.19 103.61 2jbs n GLY 160 Ca 0.00 -0.69 -0.13 0.00 0.00 0.00 0.00 46.02 45.20 2jbs n GLY 160 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2jbs s ILE 161 N -4.00 0.88 -0.19 -0.61 -4.36 -0.60 -2.13 121.20 110.19 2jbs s ILE 161 Ca 0.00 -1.69 -0.07 0.00 -0.26 0.00 0.00 60.65 58.63 2jbs s ILE 161 Cb 0.00 -1.41 -0.04 0.00 1.25 0.00 0.00 42.46 42.26 2jbs s ILE 161 CO 0.00 -0.62 0.05 -0.63 0.24 0.00 0.00 174.94 173.98 2jbs s ILE 162 N -2.67 4.63 -0.03 8.37 1.01 -0.51 0.08 121.20 132.08 2jbs s ILE 162 Ca 0.06 -0.09 0.06 0.00 0.00 0.00 0.00 60.65 60.68 2jbs s ILE 162 Cb -0.01 -3.09 -0.02 0.00 0.01 0.00 0.00 42.46 39.34 2jbs s ILE 162 CO -0.01 0.45 -0.19 -0.22 0.00 0.00 0.00 174.94 174.97 2jbs s LEU 163 N 0.53 2.44 0.01 2.97 2.96 0.57 -1.78 118.68 126.38 2jbs s LEU 163 Ca 0.02 -0.32 0.02 0.00 -0.22 0.00 0.00 54.13 53.63 2jbs s LEU 163 Cb -0.13 -1.46 -0.01 0.00 0.50 0.00 0.00 46.19 45.09 2jbs s LEU 163 CO 0.01 0.33 -0.07 0.20 -1.32 0.00 0.00 176.35 175.50 2jbs s ASN 164 N -0.72 0.81 0.00 3.68 -0.87 -0.78 -2.00 114.94 115.07 2jbs s ASN 164 Ca 0.11 -0.28 0.00 0.00 -1.57 0.00 0.00 52.86 51.12 2jbs s ASN 164 Cb -0.10 -0.04 0.00 0.00 -0.02 0.00 0.00 41.25 41.09 2jbs s ASN 164 CO 0.00 -0.03 0.00 0.61 -2.57 0.00 0.00 177.10 175.12 2jbs n GLY 165 N 2.36 3.39 3.59 0.66 0.00 -0.91 -0.76 105.19 113.51 2jbs n GLY 165 Ca -0.17 -0.70 -0.40 0.00 0.00 0.00 0.00 46.02 44.75 2jbs n GLY 165 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2jbs s ASP 166 N 0.00 6.30 -0.45 1.61 1.01 -1.26 -1.38 116.67 122.50 2jbs s ASP 166 Ca 0.00 0.20 -0.07 0.00 0.71 0.00 0.00 52.55 53.39 2jbs s ASP 166 Cb 0.00 -2.24 0.11 0.00 1.01 0.00 0.00 42.92 41.80 2jbs s ASP 166 CO 0.00 -0.30 0.29 -0.31 0.21 0.00 0.00 175.17 175.07 2jbs s TYR 167 N 2.19 3.46 0.85 4.23 2.02 0.17 -4.89 117.35 125.38 2jbs s TYR 167 Ca 0.17 -2.00 -0.11 0.00 -0.37 0.00 0.00 57.07 54.75 2jbs s TYR 167 Cb -0.16 -3.34 0.10 0.00 -0.40 0.00 0.00 41.96 38.16 2jbs s TYR 167 CO 0.11 -0.97 1.09 0.20 -1.57 0.00 0.00 175.55 174.41 2jbs s GLY 168 N 2.35 1.62 -0.71 0.71 0.00 -1.26 -0.49 107.32 109.54 2jbs s GLY 168 Ca 0.06 -0.08 -0.01 0.00 0.00 0.00 0.00 44.72 44.69 2jbs s GLY 168 CO -0.01 0.38 0.66 0.79 0.00 0.00 0.00 173.10 174.91 2jbs n TRP 169 N -3.70 -2.45 -3.74 1.90 7.02 -1.22 -4.71 117.44 110.54 2jbs n TRP 169 Ca 0.07 0.91 -0.34 0.00 -1.02 0.00 0.00 57.50 57.13 2jbs n TRP 169 Cb 0.55 -3.80 -0.09 0.00 -2.42 0.00 0.00 31.31 25.55 2jbs n TRP 169 CO 0.00 0.00 0.00 0.45 -2.02 0.00 0.00 177.69 176.12 2jbs s SER 170 N -3.00 5.49 0.11 -0.99 0.15 0.46 -4.65 113.70 111.28 2jbs s SER 170 Ca 0.11 -3.63 -0.36 0.00 0.70 0.00 0.00 55.95 52.78 2jbs s SER 170 Cb -0.01 -1.81 -0.16 0.00 -1.71 0.00 0.00 66.02 62.33 2jbs s SER 170 CO 0.64 -0.18 1.41 -1.20 1.20 0.00 0.00 173.24 175.11 2jbs n SER 171 N 2.40 2.09 -0.02 5.45 7.64 -1.26 -1.69 113.62 128.24 2jbs n SER 171 Ca 0.19 1.11 -0.00 0.00 1.01 0.00 0.00 58.87 61.17 2jbs n SER 171 Cb 0.36 -1.27 -0.00 0.00 -1.01 0.00 0.00 64.21 62.30 2jbs n SER 171 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2jbs n GLY 172 N 2.78 0.37 0.30 0.23 0.00 -0.51 -4.53 105.19 103.83 2jbs n GLY 172 Ca 0.18 -0.03 0.17 0.00 0.00 0.00 0.00 46.02 46.34 2jbs n GLY 172 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jbs h ASP 174 N 0.00 0.00 -0.61 0.00 3.32 -1.84 -3.19 116.42 114.10 2jbs h ASP 174 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2jbs h ASP 174 Cb 0.19 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.74 2jbs h ASP 174 CO 0.01 0.24 0.00 1.41 -1.72 0.00 0.00 179.24 179.18 2jbs n HIS 175 N -3.93 0.81 -4.02 4.55 8.25 0.21 -4.99 115.22 116.10 2jbs n HIS 175 Ca -0.02 -0.50 -0.29 0.00 -0.26 0.00 0.00 57.72 56.66 2jbs n HIS 175 Cb 0.32 -0.01 -0.05 0.00 1.12 0.00 0.00 29.99 31.37 2jbs n HIS 175 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2jbs s ALA 176 N -1.00 3.70 -0.37 -1.41 0.00 -1.16 -4.82 121.76 116.69 2jbs s ALA 176 Ca 0.41 -1.03 0.22 0.00 0.00 0.00 0.00 51.96 51.56 2jbs s ALA 176 Cb 0.21 -1.53 -0.19 0.00 0.00 0.00 0.00 23.12 21.61 2jbs s ALA 176 CO 0.28 0.68 0.75 0.39 0.00 0.00 0.00 175.76 177.85 2jbs n GLU 177 N 0.10 0.44 -4.04 0.00 4.71 -0.42 -4.87 120.64 116.57 2jbs n GLU 177 Ca -0.08 -0.08 -0.08 0.00 -0.01 0.00 0.00 57.16 56.92 2jbs n GLU 177 Cb 0.53 -1.57 -0.10 0.00 -1.01 0.00 0.00 31.44 29.29 2jbs n GLU 177 CO 0.00 0.00 0.00 0.71 0.09 0.00 0.00 177.13 177.93 2jbs s TYR 178 N -3.33 0.43 -0.02 -0.32 2.02 -1.04 -0.80 117.35 114.29 2jbs s TYR 178 Ca -0.01 -0.91 0.06 0.00 -0.37 0.00 0.00 57.07 55.84 2jbs s TYR 178 Cb 0.14 -0.31 -0.01 0.00 -0.40 0.00 0.00 41.96 41.37 2jbs s TYR 178 CO 0.86 -0.37 -0.20 0.00 -1.57 0.00 0.00 175.55 174.27 2jbs s ALA 179 N -3.49 1.65 -0.04 3.71 0.00 -0.22 -1.04 121.76 122.33 2jbs s ALA 179 Ca 0.03 -0.85 -0.13 0.00 0.00 0.00 0.00 51.96 51.01 2jbs s ALA 179 Cb 0.05 -0.43 -0.05 0.00 0.00 0.00 0.00 23.12 22.69 2jbs s ALA 179 CO -0.09 0.40 0.34 0.42 0.00 0.00 0.00 175.76 176.84 2jbs s ILE 180 N -0.45 5.16 -0.09 0.00 1.01 0.11 -0.84 121.20 126.10 2jbs s ILE 180 Ca 0.07 0.68 -0.04 0.00 0.00 0.00 0.00 60.65 61.36 2jbs s ILE 180 Cb -0.08 -3.64 0.05 0.00 0.01 0.00 0.00 42.46 38.80 2jbs s ILE 180 CO -0.01 0.57 0.21 -0.69 0.00 0.00 0.00 174.94 175.03 2jbs s VAL 181 N -0.94 -0.12 0.12 2.92 1.01 -0.33 -1.70 120.40 121.36 2jbs s VAL 181 Ca 0.21 0.20 -0.03 0.00 0.00 0.00 0.00 61.98 62.36 2jbs s VAL 181 Cb -0.15 -0.34 -0.05 0.00 0.00 0.00 0.00 36.38 35.84 2jbs s VAL 181 CO 0.11 0.08 0.32 -0.83 0.00 0.00 0.00 175.10 174.78 2jbs s GLY 182 N 1.50 2.21 0.13 4.51 0.00 -0.69 -0.81 107.32 114.17 2jbs s GLY 182 Ca -0.07 -0.66 -0.25 0.00 0.00 0.00 0.00 44.72 43.74 2jbs s GLY 182 CO -0.08 -0.61 0.84 -0.11 0.00 0.00 0.00 173.10 173.15 2jbs s PHE 183 N -1.61 -0.26 -0.14 1.90 -0.12 0.35 -4.18 117.98 113.91 2jbs s PHE 183 Ca 0.39 -0.01 -0.04 0.00 -0.05 0.00 0.00 56.93 57.22 2jbs s PHE 183 Cb -0.12 0.61 -0.03 0.00 -0.63 0.00 0.00 43.02 42.84 2jbs s PHE 183 CO 0.26 -0.82 -0.00 -0.80 -0.05 0.00 0.00 175.22 173.80 2jbs s ASN 184 N -2.78 5.13 0.42 1.98 0.02 -1.26 -0.48 114.94 117.97 2jbs s ASN 184 Ca 0.08 0.00 0.07 0.00 -1.02 0.00 0.00 52.86 52.00 2jbs s ASN 184 Cb -0.02 -1.73 -0.04 0.00 0.02 0.00 0.00 41.25 39.48 2jbs s ASN 184 CO -0.02 0.23 0.21 -0.13 0.02 0.00 0.00 177.10 177.41 2jbs s ARG 185 N -0.02 2.26 0.02 -0.60 0.52 0.76 -4.83 118.95 117.06 2jbs s ARG 185 Ca 0.03 -1.84 0.04 0.00 -0.52 0.00 0.00 55.73 53.44 2jbs s ARG 185 Cb -0.13 -2.01 -0.02 0.00 0.52 0.00 0.00 34.95 33.31 2jbs s ARG 185 CO 0.02 -0.16 -0.12 -0.06 0.02 0.00 0.00 175.30 175.00 2jbs s PHE 186 N -2.61 1.05 1.13 -0.53 2.99 -1.26 0.13 117.98 118.89 2jbs s PHE 186 Ca 0.40 -0.29 -0.16 0.00 0.00 0.00 0.00 56.93 56.88 2jbs s PHE 186 Cb 0.03 -0.64 0.25 0.00 0.00 0.00 0.00 43.02 42.66 2jbs s PHE 186 CO 0.22 0.00 1.09 -0.51 -0.00 0.00 0.00 175.22 176.03 2jbs s ASP 187 N -0.80 1.52 0.12 1.36 1.01 -0.67 -4.80 116.67 114.40 2jbs s ASP 187 Ca 0.02 0.93 -0.27 0.00 0.71 0.00 0.00 52.55 53.93 2jbs s ASP 187 Cb -0.06 -1.40 -0.07 0.00 1.01 0.00 0.00 42.92 42.40 2jbs s ASP 187 CO 0.00 -3.79 1.63 0.00 0.21 0.00 0.00 175.17 173.23 2jbs h ALA 188 N -2.35 -0.41 -1.48 5.23 0.00 -2.01 -2.00 119.26 116.24 2jbs h ALA 188 Ca -0.50 -0.02 0.43 0.00 0.00 0.00 0.00 54.91 54.81 2jbs h ALA 188 Cb 1.32 0.46 -0.06 0.00 0.00 0.00 0.00 17.79 19.51 2jbs h ALA 188 CO 0.45 -0.79 1.13 0.22 0.00 0.00 0.00 179.25 180.26 2jbs h ASP 189 N -0.44 0.00 -3.38 0.00 3.58 -2.06 -3.45 116.42 110.67 2jbs h ASP 189 Ca 0.05 0.00 -0.09 0.00 0.42 0.00 0.00 57.03 57.41 2jbs h ASP 189 Cb 0.50 0.00 0.06 0.00 1.72 0.00 0.00 39.33 41.61 2jbs h ASP 189 CO -0.20 0.00 -0.25 0.61 -2.88 0.00 0.00 179.24 176.52 2jbs n GLY 190 N -1.82 0.23 3.62 -0.78 0.00 -0.75 -5.08 105.19 100.60 2jbs n GLY 190 Ca 0.33 -0.18 -0.25 0.00 0.00 0.00 0.00 46.02 45.91 2jbs n GLY 190 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2jbs s ASN 191 N -3.30 4.47 0.04 1.61 0.01 -1.26 -4.70 114.94 111.81 2jbs s ASN 191 Ca 0.06 -0.56 -0.31 0.00 -0.71 0.00 0.00 52.86 51.34 2jbs s ASN 191 Cb -0.01 -0.83 -0.07 0.00 0.41 0.00 0.00 41.25 40.75 2jbs s ASN 191 CO 0.23 0.07 1.53 -0.54 -1.51 0.00 0.00 177.10 176.87 2jbs s LYS 192 N -3.13 4.24 -0.35 -0.60 1.02 -1.26 -1.67 119.74 117.99 2jbs s LYS 192 Ca 0.28 2.16 -0.01 0.00 0.02 0.00 0.00 55.97 58.41 2jbs s LYS 192 Cb -0.08 -3.56 0.09 0.00 -0.52 0.00 0.00 37.83 33.76 2jbs s LYS 192 CO 0.17 -0.65 0.09 0.42 -0.92 0.00 0.00 175.35 174.47 2jbs s ILE 193 N 2.42 2.96 -0.16 2.17 -1.09 0.35 -4.94 121.20 122.91 2jbs s ILE 193 Ca 0.69 -1.86 -0.29 0.00 -2.23 0.00 0.00 60.65 56.96 2jbs s ILE 193 Cb -0.36 -2.93 -0.01 0.00 -1.58 0.00 0.00 42.46 37.58 2jbs s ILE 193 CO 0.30 -0.44 1.26 -0.47 -1.23 0.00 0.00 174.94 174.35 2jbs s TYR 194 N 1.14 2.87 0.14 3.97 5.04 -1.26 -0.17 117.35 129.07 2jbs s TYR 194 Ca 0.03 1.02 0.05 0.00 -2.44 0.00 0.00 57.07 55.73 2jbs s TYR 194 Cb -0.21 -3.50 -0.04 0.00 0.35 0.00 0.00 41.96 38.56 2jbs s TYR 194 CO -0.04 -1.68 -0.11 -1.12 -1.34 0.00 0.00 175.55 171.26 2jbs s SER 195 N 1.95 1.87 0.08 4.32 0.01 0.37 -0.80 113.70 121.49 2jbs s SER 195 Ca 0.55 -0.95 0.08 0.00 1.31 0.00 0.00 55.95 56.94 2jbs s SER 195 Cb -0.22 -0.03 -0.04 0.00 0.21 0.00 0.00 66.02 65.94 2jbs s SER 195 CO 0.15 -0.27 -0.19 -0.36 0.41 0.00 0.00 173.24 172.98 2jbs s PHE 196 N -2.94 2.52 -0.02 2.43 0.08 -0.40 -0.50 117.98 119.15 2jbs s PHE 196 Ca 0.14 -0.28 0.04 0.00 0.12 0.00 0.00 56.93 56.96 2jbs s PHE 196 Cb 0.00 -1.40 -0.01 0.00 -0.57 0.00 0.00 43.02 41.05 2jbs s PHE 196 CO 0.02 0.30 -0.14 0.20 -0.10 0.00 0.00 175.22 175.50 2jbs s GLY 197 N -1.75 0.69 -0.15 4.36 0.00 0.01 -2.05 107.32 108.43 2jbs s GLY 197 Ca 0.16 -0.57 -0.15 0.00 0.00 0.00 0.00 44.72 44.16 2jbs s GLY 197 CO 0.07 -0.41 0.33 0.14 0.00 0.00 0.00 173.10 173.24 2jbs s VAL 198 N -0.18 5.28 0.00 1.40 1.01 -0.66 -1.18 120.40 126.06 2jbs s VAL 198 Ca 0.03 0.64 0.02 0.00 0.00 0.00 0.00 61.98 62.66 2jbs s VAL 198 Cb -0.07 -3.67 -0.01 0.00 0.00 0.00 0.00 36.38 32.63 2jbs s VAL 198 CO 0.00 0.38 -0.08 0.27 0.00 0.00 0.00 175.10 175.67 2jbs s ILE 199 N 0.47 0.60 0.47 2.22 -4.36 -0.02 -4.92 121.20 115.66 2jbs s ILE 199 Ca 0.19 -0.45 -0.22 0.00 -0.26 0.00 0.00 60.65 59.90 2jbs s ILE 199 Cb -0.13 -0.53 -0.07 0.00 1.25 0.00 0.00 42.46 42.97 2jbs s ILE 199 CO 0.05 0.09 1.14 -2.16 0.24 0.00 0.00 174.94 174.30 2jbs s PRO 200 N -0.40 3.75 0.56 0.37 0.04 -1.26 -1.06 135.00 137.00 2jbs s PRO 200 Ca 0.01 1.71 0.36 0.00 0.04 0.00 0.00 61.00 63.12 2jbs s PRO 200 Cb -0.04 -2.35 1.47 0.00 0.04 0.00 0.00 34.50 33.62 2jbs s PRO 200 CO -0.00 -0.55 1.72 -0.09 0.04 0.00 0.00 177.00 178.12 2jbs h ARG 201 N 1.96 0.00 0.00 4.56 9.65 -1.30 0.19 114.38 129.44 2jbs h ARG 201 Ca -0.49 0.00 -0.03 0.00 -1.10 0.00 0.00 59.98 58.36 2jbs h ARG 201 Cb 1.24 0.00 -0.00 0.00 -1.39 0.00 0.00 29.97 29.82 2jbs h ARG 201 CO 0.60 0.00 -0.12 0.66 2.80 0.00 0.00 179.97 183.91 2jbs h SER 202 N 0.00 0.00 -0.04 -3.80 4.64 -1.91 -3.20 113.55 109.24 2jbs h SER 202 Ca 0.53 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.85 2jbs h SER 202 Cb 2.34 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 64.43 2jbs h SER 202 CO -0.01 0.12 0.00 0.47 -0.87 0.00 0.00 176.83 176.55 2jbs n ASP 203 N -3.28 0.57 -3.67 4.97 8.00 0.68 -4.86 116.55 118.95 2jbs n ASP 203 Ca 0.00 -1.40 -0.14 0.00 0.71 0.00 0.00 54.79 53.96 2jbs n ASP 203 Cb 0.36 -0.02 -0.07 0.00 -0.02 0.00 0.00 41.12 41.37 2jbs n ASP 203 CO 0.00 0.00 0.00 -0.72 -0.39 0.00 0.00 177.20 176.09 2jbs s TYR 204 N -1.95 -0.33 -0.14 1.24 -0.85 -1.21 -4.55 117.35 109.56 2jbs s TYR 204 Ca 0.35 0.48 -0.09 0.00 -0.52 0.00 0.00 57.07 57.28 2jbs s TYR 204 Cb 0.17 0.21 -0.05 0.00 0.38 0.00 0.00 41.96 42.67 2jbs s TYR 204 CO 0.28 -0.50 0.18 -2.00 -1.52 0.00 0.00 175.55 171.99 2jbs s GLU 205 N -1.60 3.83 -0.35 -3.49 2.12 -0.93 -4.91 118.70 113.37 2jbs s GLU 205 Ca -0.11 -0.09 -0.26 0.00 0.36 0.00 0.00 54.97 54.87 2jbs s GLU 205 Cb -0.03 -3.30 0.01 0.00 0.26 0.00 0.00 34.13 31.08 2jbs s GLU 205 CO 0.04 0.54 0.92 0.42 -0.54 0.00 0.00 175.26 176.64 2jbs s ILE 206 N -0.38 4.62 -0.19 -3.70 1.01 -1.26 -0.16 121.20 121.14 2jbs s ILE 206 Ca 0.13 1.27 -0.14 0.00 0.00 0.00 0.00 60.65 61.91 2jbs s ILE 206 Cb -0.12 -4.31 -0.04 0.00 0.01 0.00 0.00 42.46 38.00 2jbs s ILE 206 CO 0.03 -0.47 0.31 -0.69 0.00 0.00 0.00 174.94 174.12 2jbs s VAL 207 N 3.39 5.27 -1.02 2.92 1.01 0.26 -4.98 120.40 127.24 2jbs s VAL 207 Ca 0.38 0.55 -0.14 0.00 0.00 0.00 0.00 61.98 62.77 2jbs s VAL 207 Cb -0.12 -3.65 0.20 0.00 0.00 0.00 0.00 36.38 32.80 2jbs s VAL 207 CO 0.17 0.32 1.12 -0.62 0.00 0.00 0.00 175.10 176.09 2jbs s ASP 208 N 0.81 6.94 -0.13 3.32 2.15 -1.26 -1.77 116.67 126.73 2jbs s ASP 208 Ca 0.16 -2.80 0.18 0.00 0.43 0.00 0.00 52.55 50.52 2jbs s ASP 208 Cb -0.14 -2.31 0.31 0.00 -0.30 0.00 0.00 42.92 40.48 2jbs s ASP 208 CO 0.06 -0.69 1.17 -0.46 -0.17 0.00 0.00 175.17 175.08 2jbs n ASN 209 N 4.81 2.48 -4.48 -0.34 0.23 -1.26 -4.94 115.26 111.77 2jbs n ASN 209 Ca 0.25 -3.06 -0.44 0.00 -0.53 0.00 0.00 54.58 50.80 2jbs n ASN 209 Cb 0.45 -0.43 -0.01 0.00 -2.08 0.00 0.00 39.78 37.71 2jbs n ASN 209 CO 0.00 0.00 0.00 0.86 -0.93 0.00 0.00 177.26 177.19 2jbs s TRP 210 N -2.83 3.28 -0.43 -2.53 -0.11 -1.26 -4.89 118.94 110.17 2jbs s TRP 210 Ca 0.32 -1.84 -0.00 0.00 1.22 0.00 0.00 56.10 55.80 2jbs s TRP 210 Cb 0.28 -4.38 0.12 0.00 -1.50 0.00 0.00 33.47 27.98 2jbs s TRP 210 CO 0.03 -1.49 0.20 0.71 -4.62 0.00 0.00 176.95 171.78 2jbs s TYR 211 N 2.32 3.58 0.50 5.86 2.02 -1.26 -5.00 117.35 125.38 2jbs s TYR 211 Ca 0.42 -2.71 0.03 0.00 -0.37 0.00 0.00 57.07 54.44 2jbs s TYR 211 Cb -0.02 -3.09 -0.01 0.00 -0.40 0.00 0.00 41.96 38.43 2jbs s TYR 211 CO -0.02 -0.92 0.13 0.00 -1.57 0.00 0.00 175.55 173.17 2jbs s ALA 212 N 0.76 4.07 -0.79 3.71 0.00 -1.26 -5.06 121.76 123.18 2jbs s ALA 212 Ca 0.11 -0.96 0.07 0.00 0.00 0.00 0.00 51.96 51.19 2jbs s ALA 212 Cb -0.22 -0.21 0.13 0.00 0.00 0.00 0.00 23.12 22.82 2jbs s ALA 212 CO -0.05 -0.16 0.95 1.04 0.00 0.00 0.00 175.76 177.55 2jbs n GLN 213 N -1.37 1.46 -3.72 0.00 1.13 -1.26 -4.92 117.38 108.69 2jbs n GLN 213 Ca -0.11 -1.41 -0.12 0.00 -1.94 0.00 0.00 57.00 53.43 2jbs n GLN 213 Cb 0.66 -1.16 -0.07 0.00 0.11 0.00 0.00 30.24 29.78 2jbs n GLN 213 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2jbs s ALA 214 N -0.81 -0.76 -1.58 -1.58 0.00 -1.26 -4.83 121.76 110.94 2jbs s ALA 214 Ca 0.12 0.03 -0.11 0.00 0.00 0.00 0.00 51.96 52.01 2jbs s ALA 214 Cb 0.07 0.38 0.09 0.00 0.00 0.00 0.00 23.12 23.67 2jbs s ALA 214 CO 0.10 -0.46 0.65 -0.89 0.00 0.00 0.00 175.76 175.17 2jbs n ILE 215 N 0.43 -1.86 -0.26 0.00 5.41 -1.26 -4.83 119.36 116.99 2jbs n ILE 215 Ca -0.18 -0.20 0.05 0.00 1.00 0.00 0.00 62.75 63.42 2jbs n ILE 215 Cb 0.60 -2.12 0.28 0.00 -0.71 0.00 0.00 39.64 37.69 2jbs n ILE 215 CO 0.00 0.00 0.00 0.11 0.00 0.00 0.00 176.55 176.66 2jbs h LYS 216 N -1.68 0.91 0.00 0.38 1.57 -1.90 -2.85 116.57 112.99 2jbs h LYS 216 Ca -0.61 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.12 2jbs h LYS 216 Cb 1.38 -0.20 0.00 0.00 0.08 0.00 0.00 32.23 33.49 2jbs h LYS 216 CO 0.71 0.60 0.00 -1.13 -0.57 0.00 0.00 179.45 179.06 2jbs n SER 217 N -4.48 0.00 0.11 0.86 3.41 -1.26 -3.50 113.62 108.75 2jbs n SER 217 Ca 0.12 -0.81 0.13 0.00 -0.26 0.00 0.00 58.87 58.05 2jbs n SER 217 Cb 0.20 0.00 0.43 0.00 -0.26 0.00 0.00 64.21 64.58 2jbs n SER 217 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2jbs n SER 218 N -0.94 0.76 -3.72 4.04 3.41 -1.08 -1.75 113.62 114.35 2jbs n SER 218 Ca 0.15 0.59 -0.24 0.00 -0.26 0.00 0.00 58.87 59.11 2jbs n SER 218 Cb 0.07 -0.79 0.05 0.00 -0.26 0.00 0.00 64.21 63.28 2jbs n SER 218 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2jbs n GLY 219 N 1.11 -0.41 2.22 5.00 0.00 -1.14 -1.42 105.19 110.55 2jbs n GLY 219 Ca 0.05 0.17 -0.20 0.00 0.00 0.00 0.00 46.02 46.04 2jbs n GLY 219 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2jbs n SER 220 N -2.98 5.76 -4.62 1.61 7.64 -1.26 -3.69 113.62 116.07 2jbs n SER 220 Ca -0.13 -2.40 -0.28 0.00 1.01 0.00 0.00 58.87 57.07 2jbs n SER 220 Cb 0.60 -1.29 0.20 0.00 -1.01 0.00 0.00 64.21 62.71 2jbs n SER 220 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 2jbs s LYS 221 N 1.87 0.01 -0.13 1.43 3.01 -1.25 -3.55 119.74 121.14 2jbs s LYS 221 Ca 0.58 0.53 -0.04 0.00 -1.01 0.00 0.00 55.97 56.03 2jbs s LYS 221 Cb 0.22 -1.69 -0.03 0.00 -1.01 0.00 0.00 37.83 35.32 2jbs s LYS 221 CO -0.02 -3.02 0.00 1.41 0.51 0.00 0.00 175.35 174.23 2jbs s MET 222 N -4.87 3.40 0.01 1.68 -2.45 -0.73 -0.40 119.30 115.94 2jbs s MET 222 Ca 0.66 -0.43 -0.25 0.00 -1.25 0.00 0.00 55.69 54.42 2jbs s MET 222 Cb -0.20 -2.92 -0.05 0.00 1.25 0.00 0.00 34.83 32.92 2jbs s MET 222 CO 0.59 0.48 0.78 -0.51 1.05 0.00 0.00 175.02 177.41 2jbs s LEU 223 N -0.26 4.40 -0.16 4.11 1.43 0.36 -0.58 118.68 127.99 2jbs s LEU 223 Ca 0.06 1.41 -0.03 0.00 -1.03 0.00 0.00 54.13 54.53 2jbs s LEU 223 Cb -0.12 -3.24 -0.02 0.00 0.03 0.00 0.00 46.19 42.84 2jbs s LEU 223 CO 0.02 -0.06 -0.05 -0.75 0.23 0.00 0.00 176.35 175.74 2jbs s LYS 224 N 0.32 3.60 -0.22 1.70 2.20 0.78 0.43 119.74 128.55 2jbs s LYS 224 Ca 0.40 -0.55 0.01 0.00 -0.36 0.00 0.00 55.97 55.47 2jbs s LYS 224 Cb -0.20 -2.88 0.03 0.00 -1.51 0.00 0.00 37.83 33.28 2jbs s LYS 224 CO 0.22 0.20 -0.14 -0.51 -0.36 0.00 0.00 175.35 174.77 2jbs s LEU 225 N 0.45 2.79 -0.26 5.43 1.02 -0.48 -2.20 118.68 125.43 2jbs s LEU 225 Ca -0.05 -0.94 -0.01 0.00 0.02 0.00 0.00 54.13 53.16 2jbs s LEU 225 Cb -0.15 -1.55 0.04 0.00 0.02 0.00 0.00 46.19 44.56 2jbs s LEU 225 CO 0.03 -0.09 -0.06 -0.69 0.02 0.00 0.00 176.35 175.56 2jbs s VAL 226 N 1.24 2.72 -1.64 -1.59 1.01 -1.26 -2.15 120.40 118.73 2jbs s VAL 226 Ca -0.01 -1.28 -0.12 0.00 0.00 0.00 0.00 61.98 60.58 2jbs s VAL 226 Cb -0.16 -2.48 0.11 0.00 0.00 0.00 0.00 36.38 33.85 2jbs s VAL 226 CO -0.08 0.06 0.56 0.59 0.00 0.00 0.00 175.10 176.23 2jbs n ASN 227 N 4.60 -1.75 -4.68 3.32 5.03 -1.22 -4.88 115.26 115.67 2jbs n ASN 227 Ca -0.15 -1.08 -0.42 0.00 0.87 0.00 0.00 54.58 53.79 2jbs n ASN 227 Cb 0.45 -2.50 -0.03 0.00 -1.02 0.00 0.00 39.78 36.68 2jbs n ASN 227 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 2jbs s VAL 228 N -3.61 4.03 -0.04 2.41 1.01 -0.85 -4.82 120.40 118.54 2jbs s VAL 228 Ca 0.47 1.37 -0.22 0.00 0.00 0.00 0.00 61.98 63.59 2jbs s VAL 228 Cb -0.26 -3.88 -0.04 0.00 0.00 0.00 0.00 36.38 32.20 2jbs s VAL 228 CO 0.94 -0.02 0.65 0.12 0.00 0.00 0.00 175.10 176.79 2jbs s PHE 229 N 2.50 3.62 -0.20 5.22 2.19 -1.26 -0.32 117.98 129.73 2jbs s PHE 229 Ca 0.59 1.22 0.01 0.00 0.33 0.00 0.00 56.93 59.08 2jbs s PHE 229 Cb -0.27 -2.71 0.04 0.00 -1.31 0.00 0.00 43.02 38.76 2jbs s PHE 229 CO 0.23 0.20 -0.14 0.42 1.83 0.00 0.00 175.22 177.77 2jbs s ILE 230 N 0.36 1.86 0.45 3.12 1.01 0.11 -4.99 121.20 123.13 2jbs s ILE 230 Ca 0.34 -1.08 -0.23 0.00 0.00 0.00 0.00 60.65 59.68 2jbs s ILE 230 Cb -0.18 -1.85 -0.08 0.00 0.01 0.00 0.00 42.46 40.36 2jbs s ILE 230 CO 0.17 0.26 1.16 -2.16 0.00 0.00 0.00 174.94 174.38 2jbs s PRO 231 N 1.31 3.82 0.56 2.79 0.04 -1.26 -1.55 135.00 140.70 2jbs s PRO 231 Ca -0.00 1.77 0.44 0.00 0.04 0.00 0.00 61.00 63.25 2jbs s PRO 231 Cb -0.16 -2.45 1.64 0.00 0.04 0.00 0.00 34.50 33.58 2jbs s PRO 231 CO -0.09 -0.50 1.65 1.49 0.04 0.00 0.00 177.00 179.59 2jbs h GLU 232 N 2.14 0.00 -0.00 4.56 4.57 -1.58 -0.20 114.58 124.07 2jbs h GLU 232 Ca -0.49 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 57.69 2jbs h GLU 232 Cb 1.24 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.83 2jbs h GLU 232 CO 0.61 0.00 -0.13 2.48 -1.18 0.00 0.00 179.01 180.78 2jbs n TYR 233 N -4.00 0.00 -0.81 0.92 0.18 -1.26 -2.77 117.16 109.42 2jbs n TYR 233 Ca 0.36 0.00 0.08 0.00 1.88 0.00 0.00 57.90 60.22 2jbs n TYR 233 Cb 1.70 -0.38 0.31 0.00 -0.38 0.00 0.00 39.34 40.59 2jbs n TYR 233 CO 0.00 0.00 0.00 0.54 -2.08 0.00 0.00 176.86 175.32 2jbs n ARG 234 N -1.41 3.66 -3.91 -3.48 1.74 -0.09 -4.40 116.66 108.77 2jbs n ARG 234 Ca 0.08 -2.87 -0.28 0.00 -0.77 0.00 0.00 57.85 54.02 2jbs n ARG 234 Cb 0.32 -1.92 -0.17 0.00 -1.02 0.00 0.00 32.46 29.68 2jbs n ARG 234 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 2jbs s ILE 235 N -2.42 1.11 0.03 0.55 1.01 -1.11 -1.66 121.20 118.71 2jbs s ILE 235 Ca 0.46 -0.44 0.07 0.00 0.00 0.00 0.00 60.65 60.74 2jbs s ILE 235 Cb 0.34 -1.17 -0.03 0.00 0.01 0.00 0.00 42.46 41.61 2jbs s ILE 235 CO 0.15 0.29 -0.20 -0.44 0.00 0.00 0.00 174.94 174.74 2jbs s SER 236 N 1.66 3.66 0.22 3.58 0.01 -0.87 -4.97 113.70 116.98 2jbs s SER 236 Ca 0.03 -0.44 -0.30 0.00 1.31 0.00 0.00 55.95 56.55 2jbs s SER 236 Cb -0.14 -0.55 -0.09 0.00 0.21 0.00 0.00 66.02 65.45 2jbs s SER 236 CO -0.08 0.27 1.37 -0.54 0.41 0.00 0.00 173.24 174.66 2jbs s LYS 237 N -1.31 4.34 0.15 12.44 1.02 -1.26 -1.27 119.74 133.84 2jbs s LYS 237 Ca 0.14 2.16 -0.17 0.00 0.02 0.00 0.00 55.97 58.11 2jbs s LYS 237 Cb -0.10 -3.16 0.01 0.00 -0.52 0.00 0.00 37.83 34.05 2jbs s LYS 237 CO 0.04 -0.33 1.79 0.00 -0.92 0.00 0.00 175.35 175.93 2jbs h ALA 238 N 5.31 0.42 -0.89 5.17 0.00 -1.32 -2.61 119.26 125.34 2jbs h ALA 238 Ca -0.45 -0.01 0.08 0.00 0.00 0.00 0.00 54.91 54.53 2jbs h ALA 238 Cb 1.22 -0.09 -0.07 0.00 0.00 0.00 0.00 17.79 18.85 2jbs h ALA 238 CO 0.78 -0.16 0.55 -0.22 0.00 0.00 0.00 179.25 180.20 2jbs h LYS 239 N 0.40 0.94 -0.64 0.00 3.64 -1.93 0.13 116.57 119.10 2jbs h LYS 239 Ca 0.13 -0.06 0.05 0.00 -1.27 0.00 0.00 60.65 59.51 2jbs h LYS 239 Cb 0.00 -0.21 -0.04 0.00 -0.41 0.00 0.00 32.23 31.57 2jbs h LYS 239 CO -0.06 0.63 0.42 -0.44 -2.27 0.00 0.00 179.45 177.73 2jbs h ASP 240 N 0.97 0.59 0.70 4.20 5.19 -1.84 -1.50 116.42 124.73 2jbs h ASP 240 Ca 0.40 -0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.81 2jbs h ASP 240 Cb 0.25 -0.13 0.00 0.00 0.18 0.00 0.00 39.33 39.63 2jbs h ASP 240 CO -0.20 0.39 -0.35 0.23 -3.12 0.00 0.00 179.24 176.20 2jbs n MET 241 N -4.47 0.03 0.14 3.56 2.81 -0.09 -0.41 117.12 118.69 2jbs n MET 241 Ca 0.09 0.01 0.09 0.00 -1.81 0.00 0.00 57.70 56.08 2jbs n MET 241 Cb 0.20 -1.52 0.05 0.00 -0.71 0.00 0.00 33.22 31.24 2jbs n MET 241 CO 0.00 0.00 0.00 0.52 1.51 0.00 0.00 175.97 178.00 2jbs h MET 242 N 0.00 0.00 0.00 0.03 2.86 -0.21 -1.49 114.93 116.13 2jbs h MET 242 Ca 0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 2jbs h MET 242 Cb 0.52 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.18 2jbs h MET 242 CO 0.00 0.12 -0.05 0.39 1.06 0.00 0.00 176.91 178.43 2jbs n GLU 243 N -2.94 1.72 -3.52 1.72 1.02 -0.91 -4.23 120.64 113.50 2jbs n GLU 243 Ca 0.00 -1.78 -0.22 0.00 -0.02 0.00 0.00 57.16 55.14 2jbs n GLU 243 Cb 0.61 -1.10 0.03 0.00 -0.02 0.00 0.00 31.44 30.96 2jbs n GLU 243 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2jbs n GLY 244 N -0.78 -1.12 0.00 0.62 0.00 -1.07 -4.94 105.19 97.91 2jbs n GLY 244 Ca 0.06 0.50 0.00 0.00 0.00 0.00 0.00 46.02 46.58 2jbs n GLY 244 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2jbs n LYS 245 N -3.35 -0.04 -1.51 1.61 5.02 0.45 -4.95 118.16 115.40 2jbs n LYS 245 Ca -0.11 -0.18 -0.30 0.00 -2.02 0.00 0.00 58.31 55.70 2jbs n LYS 245 Cb 0.59 -0.57 0.08 0.00 -0.02 0.00 0.00 35.03 35.11 2jbs n LYS 245 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 2jbs s SER 246 N -0.03 4.75 0.66 4.39 1.04 -1.00 -4.91 113.70 118.61 2jbs s SER 246 Ca 0.00 1.48 0.28 0.00 0.48 0.00 0.00 55.95 58.20 2jbs s SER 246 Cb 0.00 -2.27 1.53 0.00 0.10 0.00 0.00 66.02 65.39 2jbs s SER 246 CO 0.00 -1.83 1.87 0.00 0.98 0.00 0.00 173.24 174.26 2jbs h ALA 247 N -0.99 1.45 -0.07 5.32 0.00 -1.86 -1.06 119.26 122.05 2jbs h ALA 247 Ca -0.46 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.45 2jbs h ALA 247 Cb 1.24 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.04 2jbs h ALA 247 CO 0.57 -0.40 0.00 0.41 0.00 0.00 0.00 179.25 179.83 2jbs n GLY 248 N -1.26 0.82 3.74 0.00 0.00 -0.03 -4.56 105.19 103.90 2jbs n GLY 248 Ca -0.01 -0.63 -0.42 0.00 0.00 0.00 0.00 46.02 44.97 2jbs n GLY 248 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2jbs s PHE 249 N -1.94 3.00 0.00 1.61 5.36 -0.40 -2.47 117.98 123.13 2jbs s PHE 249 Ca 0.32 0.88 0.00 0.00 -0.96 0.00 0.00 56.93 57.17 2jbs s PHE 249 Cb 0.20 -3.88 0.00 0.00 -0.34 0.00 0.00 43.02 39.00 2jbs s PHE 249 CO 0.31 -3.00 0.00 0.41 -1.46 0.00 0.00 175.22 171.48 2jbs n GLY 250 N 2.63 1.25 0.28 13.12 0.00 -1.26 -4.95 105.19 116.26 2jbs n GLY 250 Ca 0.09 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.15 2jbs n GLY 250 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2jbs h LEU 251 N 0.00 0.36 -6.37 0.99 3.38 -1.86 -3.33 115.31 108.48 2jbs h LEU 251 Ca 0.00 -0.03 -0.60 0.00 0.09 0.00 0.00 57.88 57.35 2jbs h LEU 251 Cb 0.00 -0.09 -0.41 0.00 0.09 0.00 0.00 40.66 40.25 2jbs h LEU 251 CO 0.00 0.33 -0.71 -1.22 0.09 0.00 0.00 178.44 176.92 2jbs n TYR 252 N -4.42 2.45 0.30 1.13 4.01 -1.26 -4.95 117.16 114.43 2jbs n TYR 252 Ca 0.01 -4.01 0.09 0.00 -0.16 0.00 0.00 57.90 53.82 2jbs n TYR 252 Cb 0.13 -0.47 0.39 0.00 -0.31 0.00 0.00 39.34 39.08 2jbs n TYR 252 CO 0.00 0.00 0.00 -2.30 -0.46 0.00 0.00 176.86 174.10 2jbs n PRO 253 N 1.36 0.10 0.00 -0.72 -0.02 -1.25 -0.87 135.00 133.60 2jbs n PRO 253 Ca 0.26 0.44 0.08 0.00 -2.02 0.00 0.00 63.50 62.27 2jbs n PRO 253 Cb 0.42 -1.74 0.04 0.00 -0.02 0.00 0.00 33.50 32.21 2jbs n PRO 253 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 2jbs n ASP 254 N -1.94 2.13 -4.76 2.55 8.00 -1.26 -5.00 116.55 116.26 2jbs n ASP 254 Ca 0.01 -1.57 -0.39 0.00 0.71 0.00 0.00 54.79 53.56 2jbs n ASP 254 Cb 0.13 0.17 -0.06 0.00 -0.02 0.00 0.00 41.12 41.35 2jbs n ASP 254 CO 0.00 0.00 0.00 -0.55 -0.39 0.00 0.00 177.20 176.26 2jbs s SER 255 N -1.60 7.43 0.00 -2.24 0.15 -0.05 -4.96 113.70 112.43 2jbs s SER 255 Ca 0.18 1.95 0.19 0.00 0.70 0.00 0.00 55.95 58.97 2jbs s SER 255 Cb 0.14 -2.60 0.61 0.00 -1.71 0.00 0.00 66.02 62.46 2jbs s SER 255 CO 0.29 -0.00 1.47 0.29 1.20 0.00 0.00 173.24 176.48 2jbs n LYS 256 N 1.01 1.91 0.00 5.44 5.02 -1.26 -4.44 118.16 125.83 2jbs n LYS 256 Ca 0.00 -1.38 0.00 0.00 -2.02 0.00 0.00 58.31 54.91 2jbs n LYS 256 Cb 0.48 -1.40 0.00 0.00 -0.02 0.00 0.00 35.03 34.09 2jbs n LYS 256 CO 0.00 0.00 0.00 0.44 -0.52 0.00 0.00 177.40 177.32 2jbs n ILE 257 N 0.60 0.00 0.33 -0.18 -5.35 -1.26 -3.27 119.36 110.23 2jbs n ILE 257 Ca 0.16 -0.12 0.11 0.00 -0.27 0.00 0.00 62.75 62.63 2jbs n ILE 257 Cb 0.38 1.12 -0.14 0.00 -1.74 0.00 0.00 39.64 39.26 2jbs n ILE 257 CO 0.00 0.00 0.00 0.49 -1.76 0.00 0.00 176.55 175.28 2jbs n PHE 258 N -0.20 0.04 -2.01 4.28 3.72 -1.26 -4.56 117.46 117.46 2jbs n PHE 258 Ca 0.00 0.01 -0.42 0.00 -0.05 0.00 0.00 57.45 56.99 2jbs n PHE 258 Cb 0.03 -0.36 0.00 0.00 -0.94 0.00 0.00 39.48 38.21 2jbs n PHE 258 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 2jbs n TYR 259 N -2.03 3.28 -3.62 1.38 4.01 -1.26 -4.88 117.16 114.04 2jbs n TYR 259 Ca -0.01 -2.89 -0.07 0.00 -0.16 0.00 0.00 57.90 54.76 2jbs n TYR 259 Cb 0.49 -2.28 -0.06 0.00 -0.31 0.00 0.00 39.34 37.18 2jbs n TYR 259 CO 0.00 0.00 0.00 -0.08 -0.46 0.00 0.00 176.86 176.32 2jbs s THR 260 N 1.92 0.00 0.42 -0.72 -1.32 -1.26 -4.16 115.64 110.51 2jbs s THR 260 Ca 0.44 0.00 -0.26 0.00 -1.21 0.00 0.00 61.69 60.65 2jbs s THR 260 Cb 0.12 -1.00 -0.09 0.00 -1.51 0.00 0.00 72.50 70.02 2jbs s THR 260 CO -0.05 0.00 1.41 -2.84 -2.21 0.00 0.00 174.62 170.94 2jbs s PRO 261 N -0.38 3.87 0.39 7.08 0.02 -1.26 -4.88 135.00 139.84 2jbs s PRO 261 Ca 0.03 2.40 0.09 0.00 0.02 0.00 0.00 61.00 63.55 2jbs s PRO 261 Cb -0.03 -2.77 0.80 0.00 0.02 0.00 0.00 34.50 32.52 2jbs s PRO 261 CO -0.06 -0.66 1.93 0.10 -0.33 0.00 0.00 177.00 177.98 2jbs h TYR 262 N 2.60 0.26 -0.11 6.54 -0.00 -1.55 -3.35 116.97 121.36 2jbs h TYR 262 Ca -0.51 -0.03 -0.04 0.00 0.00 0.00 0.00 58.73 58.16 2jbs h TYR 262 Cb 1.25 -0.08 -0.00 0.00 0.00 0.00 0.00 36.73 37.91 2jbs h TYR 262 CO 0.52 0.36 -0.10 -0.09 -0.00 0.00 0.00 178.16 178.84 2jbs h ARG 263 N 0.24 0.26 -0.33 0.10 2.43 -1.90 -2.73 114.38 112.46 2jbs h ARG 263 Ca 0.05 -0.14 0.10 0.00 -0.81 0.00 0.00 59.98 59.18 2jbs h ARG 263 Cb 0.34 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.88 2jbs h ARG 263 CO 0.02 0.67 0.31 -1.35 -1.51 0.00 0.00 179.97 178.11 2jbs h PRO 264 N -0.13 0.00 0.02 0.20 0.11 -1.95 -1.20 132.00 129.05 2jbs h PRO 264 Ca 0.02 0.00 -0.06 0.00 0.11 0.00 0.00 66.00 66.07 2jbs h PRO 264 Cb 0.62 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.72 2jbs h PRO 264 CO 0.03 0.00 -0.29 1.88 -0.21 0.00 0.00 178.00 179.40 2jbs h TYR 265 N 0.00 0.06 -0.90 0.65 -1.99 -1.72 -3.05 116.97 110.02 2jbs h TYR 265 Ca 0.16 -0.04 0.05 0.00 2.00 0.00 0.00 58.73 60.89 2jbs h TYR 265 Cb 0.78 -0.00 -0.06 0.00 2.00 0.00 0.00 36.73 39.45 2jbs h TYR 265 CO 0.00 1.11 0.58 0.35 -0.00 0.00 0.00 178.16 180.20 2jbs h PHE 266 N -0.92 1.07 -0.20 4.88 3.57 -1.12 -1.41 116.94 122.81 2jbs h PHE 266 Ca -0.07 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.46 2jbs h PHE 266 Cb 1.12 -0.35 0.00 0.00 2.79 0.00 0.00 35.95 39.51 2jbs h PHE 266 CO 0.24 0.58 0.00 0.00 -2.23 0.00 0.00 178.31 176.90 2jbs n ALA 267 N -2.35 2.50 0.36 2.41 0.00 -0.50 -4.14 120.51 118.79 2jbs n ALA 267 Ca 0.13 -0.46 0.14 0.00 0.00 0.00 0.00 53.44 53.24 2jbs n ALA 267 Cb 0.14 -1.06 0.49 0.00 0.00 0.00 0.00 19.45 19.02 2jbs n ALA 267 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2jbs h SER 268 N 1.68 0.00 0.91 0.00 4.64 -1.13 -3.25 113.55 116.41 2jbs h SER 268 Ca 0.00 0.00 -0.15 0.00 -0.47 0.00 0.00 61.79 61.17 2jbs h SER 268 Cb 0.38 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.44 2jbs h SER 268 CO 0.00 0.00 -0.74 1.23 -0.87 0.00 0.00 176.83 176.45 2jbs h GLY 269 N 2.86 0.00 0.33 -0.77 0.00 -1.76 -3.26 103.07 100.47 2jbs h GLY 269 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.31 2jbs h GLY 269 CO 0.00 0.00 -0.16 0.74 0.00 0.00 0.00 176.54 177.12 2jbs h PHE 270 N 0.00 -0.41 -1.18 5.60 0.04 -1.88 0.74 116.94 119.84 2jbs h PHE 270 Ca -0.01 -0.01 0.34 0.00 2.80 0.00 0.00 57.97 61.09 2jbs h PHE 270 Cb 1.39 0.14 -0.09 0.00 2.20 0.00 0.00 35.95 39.58 2jbs h PHE 270 CO 0.00 -0.26 0.78 0.66 -0.60 0.00 0.00 178.31 178.90 2jbs h SER 271 N -0.46 0.29 0.94 2.17 4.64 -1.80 -0.11 113.55 119.22 2jbs h SER 271 Ca -0.05 0.08 -0.05 0.00 -0.47 0.00 0.00 61.79 61.31 2jbs h SER 271 Cb 0.34 0.04 0.01 0.00 -0.31 0.00 0.00 62.40 62.48 2jbs h SER 271 CO 0.07 -0.01 -0.45 0.00 -0.87 0.00 0.00 176.83 175.57 2jbs h ALA 272 N 1.55 -1.30 -0.49 5.18 0.00 -1.50 0.43 119.26 123.13 2jbs h ALA 272 Ca 0.67 -0.28 0.09 0.00 0.00 0.00 0.00 54.91 55.39 2jbs h ALA 272 Cb 2.04 0.49 -0.08 0.00 0.00 0.00 0.00 17.79 20.24 2jbs h ALA 272 CO -0.27 -1.21 0.01 0.28 0.00 0.00 0.00 179.25 178.07 2jbs h VAL 273 N -1.30 0.63 -0.74 0.00 2.07 -0.07 0.33 116.25 117.16 2jbs h VAL 273 Ca -0.13 -0.04 0.08 0.00 0.82 0.00 0.00 66.70 67.43 2jbs h VAL 273 Cb 0.97 0.49 -0.07 0.00 -1.52 0.00 0.00 31.29 31.16 2jbs h VAL 273 CO 0.21 0.02 0.41 -1.28 0.02 0.00 0.00 177.57 176.95 2jbs h SER 274 N 0.13 0.58 -0.48 0.57 0.87 -0.95 -0.63 113.55 113.64 2jbs h SER 274 Ca 0.25 0.04 -0.06 0.00 -1.23 0.00 0.00 61.79 60.79 2jbs h SER 274 Cb 0.37 -0.07 -0.02 0.00 -0.44 0.00 0.00 62.40 62.24 2jbs h SER 274 CO -0.40 0.35 0.06 0.25 -0.53 0.00 0.00 176.83 176.55 2jbs h LEU 275 N 0.71 0.78 -0.76 2.23 5.85 0.30 -2.54 115.31 121.88 2jbs h LEU 275 Ca 0.35 -0.27 0.09 0.00 0.84 0.00 0.00 57.88 58.89 2jbs h LEU 275 Cb 0.30 -0.21 -0.07 0.00 0.37 0.00 0.00 40.66 41.05 2jbs h LEU 275 CO -0.23 0.86 0.41 1.23 -0.34 0.00 0.00 178.44 180.37 2jbs h GLY 276 N 0.67 1.17 0.92 3.75 0.00 -0.04 -1.65 103.07 107.90 2jbs h GLY 276 Ca 0.14 -0.27 -0.05 0.00 0.00 0.00 0.00 47.33 47.15 2jbs h GLY 276 CO 0.01 0.10 0.03 -2.22 0.00 0.00 0.00 176.54 174.46 2jbs h ILE 277 N 0.70 1.25 -0.40 2.60 2.04 -0.93 -2.71 117.51 120.05 2jbs h ILE 277 Ca 0.37 -0.91 -0.00 0.00 1.00 0.00 0.00 64.86 65.32 2jbs h ILE 277 Cb 0.36 1.12 -0.02 0.00 -0.74 0.00 0.00 36.82 37.54 2jbs h ILE 277 CO -0.25 0.31 0.23 0.00 0.00 0.00 0.00 178.15 178.44 2jbs h ALA 278 N 0.89 0.51 -0.27 1.87 0.00 -1.02 -0.27 119.26 120.98 2jbs h ALA 278 Ca 0.11 -0.07 -0.06 0.00 0.00 0.00 0.00 54.91 54.89 2jbs h ALA 278 Cb 0.40 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.02 2jbs h ALA 278 CO 0.01 0.02 -0.10 0.93 0.00 0.00 0.00 179.25 180.11 2jbs h GLU 279 N 0.53 0.45 -0.26 0.00 5.08 -1.27 -2.41 114.58 116.70 2jbs h GLU 279 Ca 0.14 -0.12 -0.16 0.00 -1.00 0.00 0.00 59.36 58.22 2jbs h GLU 279 Cb 0.02 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.22 2jbs h GLU 279 CO -0.03 0.56 -0.48 -0.09 -1.00 0.00 0.00 179.01 177.98 2jbs h ARG 280 N 0.42 0.78 -0.34 2.33 9.65 -1.20 -2.79 114.38 123.23 2jbs h ARG 280 Ca 0.08 -0.49 0.07 0.00 -1.10 0.00 0.00 59.98 58.54 2jbs h ARG 280 Cb 0.44 0.06 -0.07 0.00 -1.39 0.00 0.00 29.97 29.01 2jbs h ARG 280 CO 0.02 1.12 -0.12 1.98 2.80 0.00 0.00 179.97 185.77 2jbs h MET 281 N 0.52 -0.05 -0.59 0.20 4.05 -0.65 0.51 114.93 118.93 2jbs h MET 281 Ca 0.01 0.00 0.03 0.00 -0.28 0.00 0.00 59.70 59.47 2jbs h MET 281 Cb 1.08 0.01 -0.04 0.00 -0.80 0.00 0.00 31.60 31.85 2jbs h MET 281 CO 0.11 -0.03 0.35 0.82 0.23 0.00 0.00 176.91 178.38 2jbs h ILE 282 N -0.05 1.04 -0.57 1.77 2.04 -1.43 0.71 117.51 121.02 2jbs h ILE 282 Ca 0.17 -0.23 -0.04 0.00 1.00 0.00 0.00 64.86 65.76 2jbs h ILE 282 Cb 0.31 0.31 -0.02 0.00 -0.74 0.00 0.00 36.82 36.67 2jbs h ILE 282 CO -0.38 0.12 0.20 -0.33 0.00 0.00 0.00 178.15 177.76 2jbs h GLU 283 N 0.67 0.87 -0.26 2.37 4.39 -1.08 -1.38 114.58 120.18 2jbs h GLU 283 Ca 0.24 -0.18 -0.08 0.00 0.34 0.00 0.00 59.36 59.68 2jbs h GLU 283 Cb 0.06 -0.13 -0.01 0.00 -0.10 0.00 0.00 28.75 28.57 2jbs h GLU 283 CO -0.12 0.78 -0.17 0.00 -1.16 0.00 0.00 179.01 178.33 2jbs h ALA 284 N 1.06 0.36 -0.03 3.43 0.00 0.11 -1.88 119.26 122.31 2jbs h ALA 284 Ca 0.19 -0.34 0.01 0.00 0.00 0.00 0.00 54.91 54.77 2jbs h ALA 284 Cb 0.25 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 2jbs h ALA 284 CO -0.01 0.28 -0.05 0.35 0.00 0.00 0.00 179.25 179.82 2jbs h PHE 285 N 0.29 -0.12 -0.99 0.00 3.57 0.38 -2.07 116.94 118.00 2jbs h PHE 285 Ca 0.05 0.01 0.11 0.00 3.53 0.00 0.00 57.97 61.67 2jbs h PHE 285 Cb 0.70 0.06 -0.08 0.00 2.79 0.00 0.00 35.95 39.42 2jbs h PHE 285 CO 0.07 -0.08 0.63 0.87 -2.23 0.00 0.00 178.31 177.57 2jbs h LYS 286 N -0.07 0.96 0.10 1.11 1.57 -1.08 0.37 116.57 119.52 2jbs h LYS 286 Ca 0.03 -0.06 -0.00 0.00 -1.87 0.00 0.00 60.65 58.75 2jbs h LYS 286 Cb 0.12 -0.22 0.00 0.00 0.08 0.00 0.00 32.23 32.21 2jbs h LYS 286 CO -0.08 0.64 -0.05 0.93 -0.57 0.00 0.00 179.45 180.32 2jbs h GLU 287 N 0.99 -0.12 0.00 3.15 5.08 -0.86 -2.71 114.58 120.11 2jbs h GLU 287 Ca 0.48 0.01 -0.02 0.00 -1.00 0.00 0.00 59.36 58.82 2jbs h GLU 287 Cb 0.46 0.03 -0.00 0.00 0.50 0.00 0.00 28.75 29.74 2jbs h GLU 287 CO -0.24 0.15 -0.12 0.87 -1.00 0.00 0.00 179.01 178.67 2jbs h LYS 288 N -0.39 0.00 -0.21 2.33 6.56 -1.03 -3.22 116.57 120.61 2jbs h LYS 288 Ca -0.01 0.00 -0.15 0.00 -1.06 0.00 0.00 60.65 59.43 2jbs h LYS 288 Cb 0.33 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 31.99 2jbs h LYS 288 CO 0.02 0.12 -0.44 0.37 -2.06 0.00 0.00 179.45 177.46 2jbs h GLN 289 N 0.00 0.67 -0.81 3.15 5.75 0.06 -3.34 115.11 120.59 2jbs h GLN 289 Ca -0.00 -0.44 0.13 0.00 -0.15 0.00 0.00 58.65 58.20 2jbs h GLN 289 Cb 0.53 0.06 -0.14 0.00 1.07 0.00 0.00 27.48 29.00 2jbs h GLN 289 CO 0.02 1.06 -0.29 0.54 -2.65 0.00 0.00 178.83 177.50 2jbs n ARG 290 N -4.20 -0.16 -0.00 1.69 1.74 -1.13 -2.31 116.66 112.29 2jbs n ARG 290 Ca -0.06 1.25 0.09 0.00 -0.77 0.00 0.00 57.85 58.36 2jbs n ARG 290 Cb 0.56 -1.86 -0.11 0.00 -1.02 0.00 0.00 32.46 30.03 2jbs n ARG 290 CO 0.00 0.00 0.00 0.27 -1.52 0.00 0.00 177.63 176.38 2jbs n ASN 291 N -5.22 0.84 -4.58 0.55 0.23 -1.26 -4.11 115.26 101.70 2jbs n ASN 291 Ca 0.09 -0.82 -0.62 0.00 -0.53 0.00 0.00 54.58 52.71 2jbs n ASN 291 Cb 0.34 1.10 -0.09 0.00 -2.08 0.00 0.00 39.78 39.06 2jbs n ASN 291 CO 0.00 0.00 0.00 -1.14 -0.93 0.00 0.00 177.26 175.19 2jbs n ARG 292 N -1.51 0.05 -4.75 -3.83 3.00 -0.98 -4.79 116.66 103.85 2jbs n ARG 292 Ca 0.03 0.02 -0.32 0.00 -0.00 0.00 0.00 57.85 57.58 2jbs n ARG 292 Cb 0.30 -1.53 -0.13 0.00 0.00 0.00 0.00 32.46 31.11 2jbs n ARG 292 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.63 177.77 2jbs s VAL 293 N 1.00 2.97 0.12 5.15 -7.23 -1.26 -0.67 120.40 120.47 2jbs s VAL 293 Ca 0.95 -0.95 -0.33 0.00 -1.81 0.00 0.00 61.98 59.84 2jbs s VAL 293 Cb -1.33 -2.21 -0.13 0.00 0.56 0.00 0.00 36.38 33.27 2jbs s VAL 293 CO 0.65 0.45 1.69 0.54 -0.31 0.00 0.00 175.10 178.12 2jbs n ARG 294 N 1.88 2.34 -0.23 4.82 5.12 0.32 -4.81 116.66 126.10 2jbs n ARG 294 Ca -0.16 0.85 0.01 0.00 -1.93 0.00 0.00 57.85 56.62 2jbs n ARG 294 Cb 0.52 -2.66 0.25 0.00 -1.16 0.00 0.00 32.46 29.41 2jbs n ARG 294 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 2jbs h ALA 295 N 7.02 1.48 0.00 7.54 0.00 -1.97 -1.44 119.26 131.89 2jbs h ALA 295 Ca -0.45 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.40 2jbs h ALA 295 Cb 1.24 -0.30 -0.00 0.00 0.00 0.00 0.00 17.79 18.74 2jbs h ALA 295 CO 0.92 0.47 -0.33 1.88 0.00 0.00 0.00 179.25 182.19 2jbs h TYR 296 N 1.01 0.00 -0.00 0.00 0.05 -1.99 -3.39 116.97 112.65 2jbs h TYR 296 Ca 0.29 0.00 0.00 0.00 0.05 0.00 0.00 58.73 59.07 2jbs h TYR 296 Cb -0.07 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.67 2jbs h TYR 296 CO -0.00 0.06 -0.31 0.25 -1.05 0.00 0.00 178.16 177.11 2jbs n THR 297 N -4.67 0.00 -2.93 -2.88 -2.24 -1.26 -4.96 114.28 95.34 2jbs n THR 297 Ca -0.05 -0.00 -0.12 0.00 -2.27 0.00 0.00 64.05 61.61 2jbs n THR 297 Cb 0.18 -0.03 0.03 0.00 -2.10 0.00 0.00 70.33 68.42 2jbs n THR 297 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2jbs n GLY 298 N 1.50 0.16 3.55 3.38 0.00 -0.54 -5.01 105.19 108.22 2jbs n GLY 298 Ca 0.06 -0.24 -0.34 0.00 0.00 0.00 0.00 46.02 45.50 2jbs n GLY 298 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jbs s ALA 299 N -3.07 3.04 -0.02 4.61 0.00 -1.22 -4.79 121.76 120.32 2jbs s ALA 299 Ca 0.25 -0.83 -0.30 0.00 0.00 0.00 0.00 51.96 51.08 2jbs s ALA 299 Cb -0.11 -1.47 -0.08 0.00 0.00 0.00 0.00 23.12 21.46 2jbs s ALA 299 CO 0.31 0.35 1.92 1.21 0.00 0.00 0.00 175.76 179.55 2jbs s ASN 300 N -0.10 6.39 -0.00 0.00 3.84 -1.26 -0.52 114.94 123.29 2jbs s ASN 300 Ca 0.02 2.47 0.00 0.00 0.21 0.00 0.00 52.86 55.56 2jbs s ASN 300 Cb -0.13 -2.53 0.00 0.00 -0.55 0.00 0.00 41.25 38.04 2jbs s ASN 300 CO 0.03 -1.13 0.58 0.55 -2.79 0.00 0.00 177.10 174.34 2jbs n VAL 301 N 5.79 0.11 0.19 -5.21 3.14 0.15 -4.82 118.33 117.68 2jbs n VAL 301 Ca 0.20 -0.11 0.05 0.00 -2.96 0.00 0.00 64.34 61.52 2jbs n VAL 301 Cb 0.42 0.91 0.38 0.00 -1.06 0.00 0.00 33.84 34.49 2jbs n VAL 301 CO 0.00 0.00 0.00 1.23 -6.46 0.00 0.00 176.83 171.60 2jbs h GLY 302 N 0.00 0.00 -2.45 7.55 0.00 -1.68 -3.01 103.07 103.48 2jbs h GLY 302 Ca 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 47.33 47.27 2jbs h GLY 302 CO 0.00 0.00 0.04 1.04 0.00 0.00 0.00 176.54 177.62 2jbs n LEU 303 N -3.70 4.73 -4.77 3.11 4.77 -1.26 -4.64 117.00 115.23 2jbs n LEU 303 Ca -0.01 -3.11 -0.38 0.00 -0.03 0.00 0.00 56.01 52.48 2jbs n LEU 303 Cb 0.46 -0.62 -0.03 0.00 -2.33 0.00 0.00 43.42 40.90 2jbs n LEU 303 CO 0.37 0.74 0.82 0.00 -1.33 0.00 0.00 177.39 177.99 2jbs s ALA 304 N -2.89 3.17 0.25 -1.18 0.00 -1.14 -4.86 121.76 115.11 2jbs s ALA 304 Ca 0.48 0.92 -0.03 0.00 0.00 0.00 0.00 51.96 53.32 2jbs s ALA 304 Cb 0.38 -3.36 0.51 0.00 0.00 0.00 0.00 23.12 20.66 2jbs s ALA 304 CO 0.10 -0.44 1.68 1.15 0.00 0.00 0.00 175.76 178.25 2jbs h THR 305 N 2.37 0.48 -0.06 0.00 2.02 -1.95 -1.99 112.91 113.79 2jbs h THR 305 Ca -0.48 -0.09 0.01 0.00 0.77 0.00 0.00 66.41 66.62 2jbs h THR 305 Cb 1.23 0.19 -0.01 0.00 -1.74 0.00 0.00 68.15 67.81 2jbs h THR 305 CO 0.63 0.05 -0.03 -0.65 0.37 0.00 0.00 175.52 175.89 2jbs h PRO 306 N 0.28 -0.02 -0.44 6.66 0.11 -1.98 -0.29 132.00 136.32 2jbs h PRO 306 Ca 0.44 0.00 0.08 0.00 0.11 0.00 0.00 66.00 66.64 2jbs h PRO 306 Cb 0.78 0.00 -0.07 0.00 0.11 0.00 0.00 31.00 31.82 2jbs h PRO 306 CO -0.53 -0.01 -0.03 0.00 -0.21 0.00 0.00 178.00 177.21 2jbs h ALA 307 N 1.04 0.38 -0.38 -0.75 0.00 -1.74 -1.78 119.26 116.02 2jbs h ALA 307 Ca 0.03 0.14 0.06 0.00 0.00 0.00 0.00 54.91 55.14 2jbs h ALA 307 Cb 0.07 0.25 -0.05 0.00 0.00 0.00 0.00 17.79 18.06 2jbs h ALA 307 CO -0.07 -0.41 0.09 -0.07 0.00 0.00 0.00 179.25 178.78 2jbs h LEU 308 N 0.08 0.04 -1.25 0.00 3.38 -1.13 -0.29 115.31 116.12 2jbs h LEU 308 Ca 0.22 0.06 -0.05 0.00 0.09 0.00 0.00 57.88 58.20 2jbs h LEU 308 Cb 0.32 0.08 -0.02 0.00 0.09 0.00 0.00 40.66 41.13 2jbs h LEU 308 CO -0.39 0.06 -0.03 0.24 0.09 0.00 0.00 178.44 178.41 2jbs h MET 309 N 0.22 0.48 -0.17 1.13 2.86 -0.27 0.13 114.93 119.31 2jbs h MET 309 Ca 0.18 -0.10 -0.06 0.00 -2.06 0.00 0.00 59.70 57.65 2jbs h MET 309 Cb 0.21 -0.07 -0.00 0.00 0.06 0.00 0.00 31.60 31.79 2jbs h MET 309 CO -0.23 0.53 -0.14 0.00 1.06 0.00 0.00 176.91 178.12 2jbs h ARG 310 N 0.46 0.40 -0.24 1.72 3.08 -0.92 -1.26 114.38 117.63 2jbs h ARG 310 Ca 0.10 -0.20 0.06 0.00 0.07 0.00 0.00 59.98 60.00 2jbs h ARG 310 Cb 0.34 0.00 -0.06 0.00 0.08 0.00 0.00 29.97 30.34 2jbs h ARG 310 CO 0.01 0.75 -0.12 0.82 -1.07 0.00 0.00 179.97 180.36 2jbs h ILE 311 N 0.06 0.62 -0.11 2.04 2.04 -0.30 -0.63 117.51 121.24 2jbs h ILE 311 Ca 0.03 0.00 0.04 0.00 1.00 0.00 0.00 64.86 65.94 2jbs h ILE 311 Cb 0.66 0.62 -0.06 0.00 -0.74 0.00 0.00 36.82 37.31 2jbs h ILE 311 CO 0.04 0.00 -0.27 0.00 0.00 0.00 0.00 178.15 177.91 2jbs h ALA 312 N 1.10 -0.30 -0.01 1.87 0.00 -0.74 -1.01 119.26 120.17 2jbs h ALA 312 Ca 0.13 0.03 -0.18 0.00 0.00 0.00 0.00 54.91 54.89 2jbs h ALA 312 Cb 0.29 0.52 -0.02 0.00 0.00 0.00 0.00 17.79 18.58 2jbs h ALA 312 CO -0.30 -0.75 -0.80 1.49 0.00 0.00 0.00 179.25 178.89 2jbs h GLU 313 N -0.36 0.11 -0.39 0.00 4.81 -0.86 0.19 114.58 118.08 2jbs h GLU 313 Ca 0.09 -0.12 -0.14 0.00 -0.13 0.00 0.00 59.36 59.07 2jbs h GLU 313 Cb 0.50 0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.90 2jbs h GLU 313 CO -0.31 0.85 -0.30 0.77 -0.73 0.00 0.00 179.01 179.29 2jbs h SER 314 N 0.07 0.88 0.14 1.04 0.02 -1.12 0.25 113.55 114.83 2jbs h SER 314 Ca -0.02 -0.36 0.00 0.00 -0.84 0.00 0.00 61.79 60.57 2jbs h SER 314 Cb 1.40 -0.24 -0.01 0.00 0.14 0.00 0.00 62.40 63.69 2jbs h SER 314 CO 0.11 1.11 -0.14 0.74 -1.14 0.00 0.00 176.83 177.51 2jbs h THR 315 N 0.71 0.68 -0.27 -2.27 2.02 -0.12 -0.63 112.91 113.04 2jbs h THR 315 Ca 0.08 0.00 0.05 0.00 0.77 0.00 0.00 66.41 67.31 2jbs h THR 315 Cb 0.85 0.68 -0.05 0.00 -1.74 0.00 0.00 68.15 67.89 2jbs h THR 315 CO 0.07 0.00 -0.04 0.45 0.37 0.00 0.00 175.52 176.38 2jbs h HIS 316 N -0.31 -0.08 -0.29 3.16 -0.00 -0.45 -0.87 115.15 116.31 2jbs h HIS 316 Ca 0.00 0.02 0.04 0.00 -0.00 0.00 0.00 60.37 60.44 2jbs h HIS 316 Cb 0.30 0.08 -0.04 0.00 -0.00 0.00 0.00 27.41 27.75 2jbs h HIS 316 CO -0.13 -0.08 0.05 0.37 -0.00 0.00 0.00 177.93 178.14 2jbs h GLN 317 N 0.04 0.15 -0.02 2.45 4.15 0.05 0.86 115.11 122.78 2jbs h GLN 317 Ca 0.13 -0.01 -0.18 0.00 0.77 0.00 0.00 58.65 59.36 2jbs h GLN 317 Cb 0.18 -0.03 -0.01 0.00 0.21 0.00 0.00 27.48 27.83 2jbs h GLN 317 CO -0.25 0.10 -0.78 -0.39 -1.93 0.00 0.00 178.83 175.58 2jbs h VAL 318 N 0.16 1.47 -0.70 2.39 -1.51 -0.78 -0.42 116.25 116.86 2jbs h VAL 318 Ca 0.14 -2.43 0.04 0.00 -1.23 0.00 0.00 66.70 63.22 2jbs h VAL 318 Cb 0.15 2.32 -0.05 0.00 -2.13 0.00 0.00 31.29 31.58 2jbs h VAL 318 CO -0.18 0.71 0.42 0.00 -1.23 0.00 0.00 177.57 177.28 2jbs h ALA 319 N 1.08 0.92 -0.52 5.19 0.00 -0.57 0.55 119.26 125.91 2jbs h ALA 319 Ca -0.03 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 2jbs h ALA 319 Cb 1.36 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.93 2jbs h ALA 319 CO 0.12 0.16 0.29 0.00 0.00 0.00 0.00 179.25 179.81 2jbs h ALA 320 N 1.32 0.67 0.05 0.00 0.00 -0.21 0.51 119.26 121.60 2jbs h ALA 320 Ca 0.29 -0.09 0.02 0.00 0.00 0.00 0.00 54.91 55.13 2jbs h ALA 320 Cb 0.08 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 2jbs h ALA 320 CO -0.13 0.18 -0.15 0.00 0.00 0.00 0.00 179.25 179.15 2jbs h ALA 321 N 1.12 -0.22 -0.86 0.00 0.00 -0.27 -2.13 119.26 116.92 2jbs h ALA 321 Ca 0.18 -0.01 0.13 0.00 0.00 0.00 0.00 54.91 55.21 2jbs h ALA 321 Cb 0.05 0.24 -0.09 0.00 0.00 0.00 0.00 17.79 17.99 2jbs h ALA 321 CO -0.03 -0.66 0.47 -0.09 0.00 0.00 0.00 179.25 178.95 2jbs h ARG 322 N -0.27 0.70 -0.94 0.00 2.43 0.34 0.07 114.38 116.71 2jbs h ARG 322 Ca 0.03 -0.04 0.02 0.00 -0.81 0.00 0.00 59.98 59.18 2jbs h ARG 322 Cb 0.31 -0.16 -0.05 0.00 -0.42 0.00 0.00 29.97 29.65 2jbs h ARG 322 CO -0.10 0.46 0.62 0.00 -1.51 0.00 0.00 179.97 179.44 2jbs h ALA 323 N 1.52 1.36 -0.11 2.80 0.00 -0.39 0.23 119.26 124.67 2jbs h ALA 323 Ca 0.44 -0.06 -0.23 0.00 0.00 0.00 0.00 54.91 55.06 2jbs h ALA 323 Cb 0.53 -0.36 0.01 0.00 0.00 0.00 0.00 17.79 17.97 2jbs h ALA 323 CO -0.31 0.58 -0.84 1.25 0.00 0.00 0.00 179.25 179.93 2jbs h LEU 324 N 1.24 0.93 -0.45 0.00 5.85 -0.41 -0.36 115.31 122.12 2jbs h LEU 324 Ca 0.36 -0.66 -0.15 0.00 0.84 0.00 0.00 57.88 58.27 2jbs h LEU 324 Cb -0.08 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 40.66 2jbs h LEU 324 CO -0.09 1.45 -0.31 -0.07 -0.34 0.00 0.00 178.44 179.07 2jbs h LEU 325 N 0.48 1.00 -0.77 2.25 3.38 -0.98 -0.08 115.31 120.59 2jbs h LEU 325 Ca -0.07 -0.42 -0.05 0.00 0.09 0.00 0.00 57.88 57.43 2jbs h LEU 325 Cb 1.48 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 41.92 2jbs h LEU 325 CO 0.17 1.22 0.30 -0.33 0.09 0.00 0.00 178.44 179.89 2jbs h GLU 326 N 0.80 1.16 -0.36 1.13 5.08 -0.35 0.26 114.58 122.31 2jbs h GLU 326 Ca 0.08 -0.22 -0.06 0.00 -1.00 0.00 0.00 59.36 58.17 2jbs h GLU 326 Cb 0.90 -0.19 -0.01 0.00 0.50 0.00 0.00 28.75 29.95 2jbs h GLU 326 CO 0.08 0.95 0.00 -0.22 -1.00 0.00 0.00 179.01 178.82 2jbs h LYS 327 N 1.12 0.63 -0.54 2.33 3.64 -0.95 -1.02 116.57 121.79 2jbs h LYS 327 Ca 0.26 -0.20 -0.01 0.00 -1.27 0.00 0.00 60.65 59.43 2jbs h LYS 327 Cb 0.23 -0.06 -0.03 0.00 -0.41 0.00 0.00 32.23 31.96 2jbs h LYS 327 CO -0.02 0.74 0.28 1.15 -2.27 0.00 0.00 179.45 179.33 2jbs h THR 328 N 0.44 1.19 -0.40 1.00 2.02 -0.59 -2.22 112.91 114.36 2jbs h THR 328 Ca 0.10 -0.50 -0.02 0.00 0.77 0.00 0.00 66.41 66.76 2jbs h THR 328 Cb 0.45 0.54 -0.02 0.00 -1.74 0.00 0.00 68.15 67.38 2jbs h THR 328 CO 0.02 0.21 0.17 -0.50 0.37 0.00 0.00 175.52 175.79 2jbs h TRP 329 N 0.72 0.59 -0.99 3.16 6.55 -0.36 -1.87 115.95 123.74 2jbs h TRP 329 Ca 0.19 -0.04 0.17 0.00 0.95 0.00 0.00 58.89 60.16 2jbs h TRP 329 Cb 0.08 -0.18 -0.10 0.00 -0.86 0.00 0.00 29.16 28.10 2jbs h TRP 329 CO -0.01 0.51 0.62 1.49 -1.05 0.00 0.00 178.44 179.99 2jbs h GLU 330 N 0.50 0.77 -0.58 0.49 4.57 -0.95 0.71 114.58 120.09 2jbs h GLU 330 Ca 0.13 -0.05 -0.09 0.00 -1.18 0.00 0.00 59.36 58.17 2jbs h GLU 330 Cb 0.16 -0.17 -0.02 0.00 -0.16 0.00 0.00 28.75 28.55 2jbs h GLU 330 CO -0.01 0.51 -0.00 0.22 -1.18 0.00 0.00 179.01 178.54 2jbs h ASP 331 N 0.79 0.99 -0.47 1.04 3.58 -0.74 0.65 116.42 122.26 2jbs h ASP 331 Ca 0.54 -0.28 -0.02 0.00 0.42 0.00 0.00 57.03 57.70 2jbs h ASP 331 Cb 0.81 -0.27 -0.02 0.00 1.72 0.00 0.00 39.33 41.57 2jbs h ASP 331 CO -0.33 1.05 0.22 0.45 -2.88 0.00 0.00 179.24 177.75 2jbs h HIS 332 N 0.93 0.69 0.58 0.28 3.86 -0.54 -2.06 115.15 118.89 2jbs h HIS 332 Ca 0.17 -0.04 -0.03 0.00 -1.16 0.00 0.00 60.37 59.31 2jbs h HIS 332 Cb 0.54 -0.21 0.01 0.00 1.06 0.00 0.00 27.41 28.81 2jbs h HIS 332 CO 0.04 0.55 -0.28 -0.09 0.86 0.00 0.00 177.93 179.01 2jbs h ARG 333 N 0.62 -0.75 -0.72 2.45 2.43 -0.16 -1.44 114.38 116.80 2jbs h ARG 333 Ca 0.16 0.05 0.15 0.00 -0.81 0.00 0.00 59.98 59.54 2jbs h ARG 333 Cb 0.13 0.17 -0.13 0.00 -0.42 0.00 0.00 29.97 29.72 2jbs h ARG 333 CO -0.02 -0.45 -0.11 0.82 -1.51 0.00 0.00 179.97 178.70 2jbs h ILE 334 N -0.94 0.31 0.10 1.20 2.04 -0.93 0.21 117.51 119.50 2jbs h ILE 334 Ca -0.08 -0.01 -0.00 0.00 1.00 0.00 0.00 64.86 65.77 2jbs h ILE 334 Cb 0.65 0.27 -0.00 0.00 -0.74 0.00 0.00 36.82 37.00 2jbs h ILE 334 CO 0.13 0.01 -0.06 0.45 0.00 0.00 0.00 178.15 178.67 2jbs h HIS 335 N 0.04 -0.16 -0.22 1.37 3.86 -1.25 -2.38 115.15 116.40 2jbs h HIS 335 Ca 0.37 -0.00 0.06 0.00 -1.16 0.00 0.00 60.37 59.63 2jbs h HIS 335 Cb 0.60 0.06 -0.06 0.00 1.06 0.00 0.00 27.41 29.07 2jbs h HIS 335 CO -0.51 -0.10 -0.17 0.78 0.86 0.00 0.00 177.93 178.79 2jbs h GLY 336 N -0.16 -0.03 -0.49 2.45 0.00 -0.26 -1.63 103.07 102.96 2jbs h GLY 336 Ca -0.01 0.21 0.12 0.00 0.00 0.00 0.00 47.33 47.65 2jbs h GLY 336 CO 0.00 -0.17 -0.32 1.41 0.00 0.00 0.00 176.54 177.46 2jbs h LEU 337 N -0.17 -1.13 -0.11 3.11 3.38 -0.44 -1.47 115.31 118.48 2jbs h LEU 337 Ca 0.13 0.24 0.00 0.00 0.09 0.00 0.00 57.88 58.33 2jbs h LEU 337 Cb 0.36 0.58 0.00 0.00 0.09 0.00 0.00 40.66 41.69 2jbs h LEU 337 CO -0.32 -0.30 0.00 0.59 0.09 0.00 0.00 178.44 178.50 2jbs n ASN 338 N -5.45 0.17 -3.44 -0.43 3.02 -0.69 -4.86 115.26 103.58 2jbs n ASN 338 Ca 0.06 -1.61 -0.25 0.00 -0.03 0.00 0.00 54.58 52.74 2jbs n ASN 338 Cb 0.36 -0.01 0.02 0.00 -0.61 0.00 0.00 39.78 39.54 2jbs n ASN 338 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 2jbs n HIS 339 N -0.60 -2.02 -3.98 3.10 8.25 -0.55 -4.94 115.22 114.48 2jbs n HIS 339 Ca 0.10 0.63 -0.35 0.00 -0.26 0.00 0.00 57.72 57.84 2jbs n HIS 339 Cb 0.07 -3.72 -0.14 0.00 1.12 0.00 0.00 29.99 27.32 2jbs n HIS 339 CO 0.00 0.00 0.00 -1.14 0.64 0.00 0.00 176.34 175.84 2jbs s GLN 340 N -6.11 3.45 0.19 -0.41 0.74 -0.75 -4.97 119.66 111.80 2jbs s GLN 340 Ca 0.46 -0.59 -0.30 0.00 0.05 0.00 0.00 55.36 54.98 2jbs s GLN 340 Cb -0.23 -3.03 -0.08 0.00 1.10 0.00 0.00 33.01 30.77 2jbs s GLN 340 CO 0.56 -0.13 1.03 0.71 -0.55 0.00 0.00 175.29 176.92 2jbs s TYR 341 N 1.33 3.73 0.68 1.67 1.51 -1.26 -4.55 117.35 120.46 2jbs s TYR 341 Ca 0.04 1.73 -0.12 0.00 -1.01 0.00 0.00 57.07 57.71 2jbs s TYR 341 Cb -0.14 -3.16 0.00 0.00 -0.11 0.00 0.00 41.96 38.55 2jbs s TYR 341 CO -0.01 -0.18 1.06 -1.25 -1.11 0.00 0.00 175.55 174.07 2jbs s PRO 342 N -0.63 2.96 0.78 -1.71 0.04 -1.26 -5.07 135.00 130.12 2jbs s PRO 342 Ca 0.46 1.05 -0.07 0.00 0.04 0.00 0.00 61.00 62.47 2jbs s PRO 342 Cb -0.28 -1.99 0.12 0.00 0.04 0.00 0.00 34.50 32.39 2jbs s PRO 342 CO 0.34 -1.08 1.10 0.54 0.04 0.00 0.00 177.00 177.93 2jbs s ASN 343 N -3.48 4.17 0.20 6.66 4.22 -1.26 -4.84 114.94 120.62 2jbs s ASN 343 Ca 0.60 0.14 -0.17 0.00 -2.14 0.00 0.00 52.86 51.29 2jbs s ASN 343 Cb -0.15 -0.53 0.20 0.00 1.28 0.00 0.00 41.25 42.04 2jbs s ASN 343 CO 0.50 -2.01 1.60 0.11 -2.04 0.00 0.00 177.10 175.26 2jbs h LYS 344 N -0.88 -0.08 0.65 3.55 1.79 -1.98 -0.32 116.57 119.30 2jbs h LYS 344 Ca -0.42 0.01 -0.03 0.00 -2.18 0.00 0.00 60.65 58.03 2jbs h LYS 344 Cb 1.28 0.02 0.01 0.00 -1.58 0.00 0.00 32.23 31.95 2jbs h LYS 344 CO 0.47 -0.06 -0.31 1.49 -1.08 0.00 0.00 179.45 179.96 2jbs h GLU 345 N -0.09 -0.84 -0.89 3.15 4.81 -1.95 0.21 114.58 118.98 2jbs h GLU 345 Ca 0.28 0.06 0.09 0.00 -0.13 0.00 0.00 59.36 59.66 2jbs h GLU 345 Cb 0.53 0.19 -0.06 0.00 0.63 0.00 0.00 28.75 30.04 2jbs h GLU 345 CO -0.69 -0.52 0.57 0.00 -0.73 0.00 0.00 179.01 177.63 2jbs h THR 346 N -1.04 0.99 -0.76 0.32 1.03 -1.90 -1.04 112.91 110.53 2jbs h THR 346 Ca -0.09 -0.31 0.01 0.00 -0.01 0.00 0.00 66.41 66.00 2jbs h THR 346 Cb 0.71 0.00 -0.04 0.00 -1.07 0.00 0.00 68.15 67.75 2jbs h THR 346 CO 0.15 0.17 0.50 0.25 -0.01 0.00 0.00 175.52 176.57 2jbs h LEU 347 N 0.91 0.88 -0.96 0.00 5.85 -0.63 0.22 115.31 121.59 2jbs h LEU 347 Ca 0.40 -0.03 0.01 0.00 0.84 0.00 0.00 57.88 59.11 2jbs h LEU 347 Cb 0.35 -0.22 -0.05 0.00 0.37 0.00 0.00 40.66 41.11 2jbs h LEU 347 CO -0.17 0.64 0.63 0.00 -0.34 0.00 0.00 178.44 179.21 2jbs h ALA 348 N 1.27 1.22 -0.35 1.25 0.00 0.30 -0.45 119.26 122.50 2jbs h ALA 348 Ca 0.28 -0.06 -0.14 0.00 0.00 0.00 0.00 54.91 54.98 2jbs h ALA 348 Cb -0.11 -0.38 -0.01 0.00 0.00 0.00 0.00 17.79 17.29 2jbs h ALA 348 CO -0.06 0.59 -0.35 0.74 0.00 0.00 0.00 179.25 180.17 2jbs h PHE 349 N 1.28 0.96 -0.04 0.00 -1.00 -0.36 -1.67 116.94 116.12 2jbs h PHE 349 Ca 0.36 -0.27 -0.10 0.00 2.81 0.00 0.00 57.97 60.77 2jbs h PHE 349 Cb -0.13 -0.21 -0.01 0.00 3.61 0.00 0.00 35.95 39.21 2jbs h PHE 349 CO -0.00 1.04 -0.44 -1.49 -1.61 0.00 0.00 178.31 175.81 2jbs h TRP 350 N 0.67 0.10 -0.03 -0.55 4.06 -0.35 0.67 115.95 120.54 2jbs h TRP 350 Ca 0.06 -0.03 -0.14 0.00 2.06 0.00 0.00 58.89 60.84 2jbs h TRP 350 Cb 0.91 -0.02 -0.02 0.00 -1.00 0.00 0.00 29.16 29.03 2jbs h TRP 350 CO 0.05 0.51 -0.65 -0.09 -3.56 0.00 0.00 178.44 174.70 2jbs h ARG 351 N 0.07 0.11 0.00 0.49 9.65 -0.73 -3.41 114.38 120.56 2jbs h ARG 351 Ca 0.00 -0.08 -0.09 0.00 -1.10 0.00 0.00 59.98 58.72 2jbs h ARG 351 Cb 0.80 0.01 -0.02 0.00 -1.39 0.00 0.00 29.97 29.38 2jbs h ARG 351 CO 0.06 0.72 -1.32 0.25 2.80 0.00 0.00 179.97 182.48 2jbs n THR 352 N -3.80 0.32 -0.33 0.20 -2.24 -0.66 -4.62 114.28 103.15 2jbs n THR 352 Ca -0.02 -0.19 0.24 0.00 -2.27 0.00 0.00 64.05 61.81 2jbs n THR 352 Cb 0.64 -0.86 0.52 0.00 -2.10 0.00 0.00 70.33 68.54 2jbs n THR 352 CO 0.00 0.00 0.00 0.78 -0.57 0.00 0.00 175.07 175.28 2jbs h ASN 353 N 0.00 0.42 -0.20 3.42 -0.26 -1.09 0.53 115.58 118.40 2jbs h ASN 353 Ca -0.13 0.08 -0.04 0.00 -0.56 0.00 0.00 56.30 55.66 2jbs h ASN 353 Cb 1.28 0.02 -0.02 0.00 -1.06 0.00 0.00 38.32 38.54 2jbs h ASN 353 CO 0.00 0.07 0.01 0.06 -1.06 0.00 0.00 177.43 176.52 2jbs h GLN 354 N 0.36 0.45 -0.07 0.81 -0.00 -1.81 0.10 115.11 114.96 2jbs h GLN 354 Ca 0.60 -0.08 -0.17 0.00 -0.00 0.00 0.00 58.65 59.00 2jbs h GLN 354 Cb 1.57 -0.07 -0.01 0.00 -0.00 0.00 0.00 27.48 28.97 2jbs h GLN 354 CO -0.29 0.47 -0.68 0.00 -0.00 0.00 0.00 178.83 178.32 2jbs h ALA 355 N 1.59 0.71 -0.06 0.06 0.00 -0.22 -0.37 119.26 120.97 2jbs h ALA 355 Ca 0.10 -0.59 -0.18 0.00 0.00 0.00 0.00 54.91 54.24 2jbs h ALA 355 Cb 0.27 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 2jbs h ALA 355 CO 0.01 0.77 -0.74 -0.92 0.00 0.00 0.00 179.25 178.36 2jbs h TYR 356 N 0.21 0.46 -0.10 0.00 3.20 -0.75 -1.96 116.97 118.03 2jbs h TYR 356 Ca -0.02 -0.21 -0.01 0.00 3.14 0.00 0.00 58.73 61.64 2jbs h TYR 356 Cb 1.23 -0.07 -0.00 0.00 1.54 0.00 0.00 36.73 39.43 2jbs h TYR 356 CO 0.03 0.95 0.03 0.00 -1.64 0.00 0.00 178.16 177.53 2jbs h ALA 357 N 0.99 0.13 -0.68 1.82 0.00 -0.50 -1.63 119.26 119.38 2jbs h ALA 357 Ca -0.03 -0.13 0.13 0.00 0.00 0.00 0.00 54.91 54.88 2jbs h ALA 357 Cb 1.31 -0.04 -0.09 0.00 0.00 0.00 0.00 17.79 18.97 2jbs h ALA 357 CO 0.12 -0.24 0.22 0.28 0.00 0.00 0.00 179.25 179.63 2jbs h VAL 358 N -0.03 0.65 -0.18 0.00 2.07 -1.01 -0.21 116.25 117.54 2jbs h VAL 358 Ca 0.03 -0.12 -0.00 0.00 0.82 0.00 0.00 66.70 67.43 2jbs h VAL 358 Cb 0.24 0.26 -0.01 0.00 -1.52 0.00 0.00 31.29 30.26 2jbs h VAL 358 CO -0.00 0.07 0.11 0.50 0.02 0.00 0.00 177.57 178.26 2jbs h LYS 359 N 0.36 0.24 -0.77 1.57 3.64 -0.98 -1.47 116.57 119.15 2jbs h LYS 359 Ca 0.37 -0.02 -0.03 0.00 -1.27 0.00 0.00 60.65 59.70 2jbs h LYS 359 Cb 0.54 -0.05 -0.04 0.00 -0.41 0.00 0.00 32.23 32.28 2jbs h LYS 359 CO -0.40 0.20 0.38 0.52 -2.27 0.00 0.00 179.45 177.88 2jbs h MET 360 N 0.21 1.10 -0.67 1.90 2.86 -0.75 -1.55 114.93 118.04 2jbs h MET 360 Ca 0.06 -0.15 -0.02 0.00 -2.06 0.00 0.00 59.70 57.53 2jbs h MET 360 Cb 0.02 -0.20 -0.03 0.00 0.06 0.00 0.00 31.60 31.44 2jbs h MET 360 CO -0.01 0.84 0.33 0.00 1.06 0.00 0.00 176.91 179.12 2jbs h ILE 362 N 0.94 1.31 -0.80 0.00 2.04 -0.84 -1.10 117.51 119.07 2jbs h ILE 362 Ca 0.23 -2.07 0.06 0.00 1.00 0.00 0.00 64.86 64.08 2jbs h ILE 362 Cb 0.09 2.07 -0.06 0.00 -0.74 0.00 0.00 36.82 38.18 2jbs h ILE 362 CO -0.03 0.64 0.48 -0.33 0.00 0.00 0.00 178.15 178.91 2jbs h GLU 363 N 0.43 0.84 -0.43 2.37 5.08 -0.78 0.31 114.58 122.41 2jbs h GLU 363 Ca -0.05 -0.05 -0.14 0.00 -1.00 0.00 0.00 59.36 58.12 2jbs h GLU 363 Cb 1.41 -0.19 -0.01 0.00 0.50 0.00 0.00 28.75 30.46 2jbs h GLU 363 CO 0.15 0.56 -0.28 0.00 -1.00 0.00 0.00 179.01 178.44 2jbs h ALA 364 N 1.39 0.68 -0.28 3.43 0.00 -0.73 -0.32 119.26 123.43 2jbs h ALA 364 Ca 0.36 -0.41 -0.00 0.00 0.00 0.00 0.00 54.91 54.85 2jbs h ALA 364 Cb 0.20 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 2jbs h ALA 364 CO -0.18 0.67 0.17 0.28 0.00 0.00 0.00 179.25 180.18 2jbs h VAL 365 N 0.79 1.10 -0.80 0.00 2.07 -0.93 -3.07 116.25 115.41 2jbs h VAL 365 Ca 0.09 -0.25 -0.01 0.00 0.82 0.00 0.00 66.70 67.35 2jbs h VAL 365 Cb 0.86 0.77 -0.04 0.00 -1.52 0.00 0.00 31.29 31.36 2jbs h VAL 365 CO 0.08 0.10 0.46 0.44 0.02 0.00 0.00 177.57 178.67 2jbs h ASP 366 N 0.35 0.99 -0.07 0.57 5.19 -0.71 0.21 116.42 122.95 2jbs h ASP 366 Ca 0.10 -0.09 -0.00 0.00 -0.62 0.00 0.00 57.03 56.42 2jbs h ASP 366 Cb 0.02 -0.25 -0.00 0.00 0.18 0.00 0.00 39.33 39.28 2jbs h ASP 366 CO -0.02 0.79 0.04 -0.09 -3.12 0.00 0.00 179.24 176.83 2jbs h ARG 367 N 1.11 0.11 0.08 3.56 2.43 -1.04 -1.59 114.38 119.03 2jbs h ARG 367 Ca 0.28 -0.01 -0.24 0.00 -0.81 0.00 0.00 59.98 59.21 2jbs h ARG 367 Cb 0.00 -0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 29.52 2jbs h ARG 367 CO -0.05 0.09 -1.23 -0.07 -1.51 0.00 0.00 179.97 177.20 2jbs h LEU 368 N 0.11 0.25 -2.20 3.80 3.38 -1.26 -3.34 115.31 116.04 2jbs h LEU 368 Ca 0.03 -0.80 0.06 0.00 0.09 0.00 0.00 57.88 57.26 2jbs h LEU 368 Cb 0.01 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 40.67 2jbs h LEU 368 CO -0.00 1.52 0.20 -0.03 0.09 0.00 0.00 178.44 180.22 2jbs h MET 369 N -0.53 0.00 0.00 1.13 4.05 -0.48 -0.24 114.93 118.86 2jbs h MET 369 Ca -0.28 0.00 0.00 0.00 -0.28 0.00 0.00 59.70 59.14 2jbs h MET 369 Cb 1.58 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 32.38 2jbs h MET 369 CO -0.01 0.00 0.00 0.00 0.23 0.00 0.00 176.91 177.13 2jbs n ALA 370 N -2.36 2.28 -0.06 0.39 0.00 -0.61 -2.51 120.51 117.64 2jbs n ALA 370 Ca 0.02 -0.07 0.07 0.00 0.00 0.00 0.00 53.44 53.46 2jbs n ALA 370 Cb 0.33 -1.46 0.16 0.00 0.00 0.00 0.00 19.45 18.48 2jbs n ALA 370 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2jbs n ALA 371 N -1.62 2.26 0.17 0.00 0.00 -0.12 -4.66 120.51 116.55 2jbs n ALA 371 Ca 0.06 -1.06 0.06 0.00 0.00 0.00 0.00 53.44 52.50 2jbs n ALA 371 Cb 0.37 -0.51 0.12 0.00 0.00 0.00 0.00 19.45 19.43 2jbs n ALA 371 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2jbs h ALA 372 N 2.47 0.81 -0.64 0.00 0.00 -1.28 -3.50 119.26 117.12 2jbs h ALA 372 Ca 0.00 -0.30 0.07 0.00 0.00 0.00 0.00 54.91 54.68 2jbs h ALA 372 Cb 0.73 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.44 2jbs h ALA 372 CO 0.00 0.41 -0.19 0.41 0.00 0.00 0.00 179.25 179.88 2jbs n GLY 373 N 1.05 -2.29 0.35 0.00 0.00 -1.26 -4.24 105.19 98.79 2jbs n GLY 373 Ca 0.02 -1.41 0.09 0.00 0.00 0.00 0.00 46.02 44.73 2jbs n GLY 373 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jbs h ALA 374 N -0.26 1.88 0.00 4.61 0.00 -1.96 -2.39 119.26 121.13 2jbs h ALA 374 Ca -0.02 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 2jbs h ALA 374 Cb 0.26 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 17.92 2jbs h ALA 374 CO 0.01 0.01 -0.04 1.15 0.00 0.00 0.00 179.25 180.38 2jbs h THR 375 N 0.53 0.70 0.00 0.00 2.02 -2.01 -1.82 112.91 112.34 2jbs h THR 375 Ca 0.27 -0.16 0.00 0.00 0.77 0.00 0.00 66.41 67.29 2jbs h THR 375 Cb 0.37 1.10 0.00 0.00 -1.74 0.00 0.00 68.15 67.88 2jbs h THR 375 CO -0.08 0.04 0.00 -1.20 0.37 0.00 0.00 175.52 174.65 2jbs n SER 376 N -4.02 0.00 -0.80 4.18 7.64 -0.90 -2.53 113.62 117.19 2jbs n SER 376 Ca -0.03 0.20 0.09 0.00 1.01 0.00 0.00 58.87 60.14 2jbs n SER 376 Cb 0.13 -0.36 0.12 0.00 -1.01 0.00 0.00 64.21 63.09 2jbs n SER 376 CO 0.00 0.00 0.00 0.49 -3.01 0.00 0.00 175.04 172.52 2jbs n PHE 377 N -1.36 0.20 -2.22 1.43 3.72 -0.68 -2.62 117.46 115.93 2jbs n PHE 377 Ca 0.07 -0.13 -0.35 0.00 -0.05 0.00 0.00 57.45 56.99 2jbs n PHE 377 Cb 0.17 -0.00 0.01 0.00 -0.94 0.00 0.00 39.48 38.71 2jbs n PHE 377 CO 0.00 0.00 0.00 -1.64 -0.05 0.00 0.00 176.76 175.07 2jbs s MET 378 N -1.37 3.31 0.37 -1.08 -1.94 -1.05 -4.96 119.30 112.58 2jbs s MET 378 Ca 0.25 1.58 0.07 0.00 -1.71 0.00 0.00 55.69 55.88 2jbs s MET 378 Cb 0.16 -2.00 0.78 0.00 2.01 0.00 0.00 34.83 35.78 2jbs s MET 378 CO 0.23 -0.87 1.96 -0.44 -0.01 0.00 0.00 175.02 175.89 2jbs h ASP 379 N 1.08 0.63 0.00 3.03 3.32 -1.93 -2.40 116.42 120.16 2jbs h ASP 379 Ca -0.50 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.56 2jbs h ASP 379 Cb 1.26 -0.13 0.00 0.00 0.22 0.00 0.00 39.33 40.68 2jbs h ASP 379 CO 0.57 0.40 0.00 -0.46 -1.72 0.00 0.00 179.24 178.03 2jbs n ASN 380 N -4.48 0.00 -4.56 6.45 6.94 -1.26 -4.79 115.26 113.56 2jbs n ASN 380 Ca 0.10 -1.72 -0.34 0.00 -0.02 0.00 0.00 54.58 52.60 2jbs n ASN 380 Cb 0.24 0.00 -0.11 0.00 -2.36 0.00 0.00 39.78 37.55 2jbs n ASN 380 CO 0.00 0.00 0.00 -0.55 -1.03 0.00 0.00 177.26 175.68 2jbs s SER 381 N -1.20 4.70 0.35 0.53 0.15 -0.90 -5.02 113.70 112.32 2jbs s SER 381 Ca 0.05 -0.04 0.12 0.00 0.70 0.00 0.00 55.95 56.78 2jbs s SER 381 Cb 0.02 -1.35 0.65 0.00 -1.71 0.00 0.00 66.02 63.63 2jbs s SER 381 CO 0.04 0.31 1.78 -0.08 1.20 0.00 0.00 173.24 176.50 2jbs h GLU 382 N 5.62 0.00 -0.17 5.44 4.81 -1.87 -3.31 114.58 125.09 2jbs h GLU 382 Ca -0.44 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 58.79 2jbs h GLU 382 Cb 1.18 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.55 2jbs h GLU 382 CO 0.55 0.42 0.10 -0.07 -0.73 0.00 0.00 179.01 179.28 2jbs h LEU 383 N 0.00 0.21 -1.01 1.64 3.38 -1.94 -1.65 115.31 115.95 2jbs h LEU 383 Ca -0.00 -0.08 0.20 0.00 0.09 0.00 0.00 57.88 58.09 2jbs h LEU 383 Cb 0.75 -0.05 -0.11 0.00 0.09 0.00 0.00 40.66 41.33 2jbs h LEU 383 CO 0.05 0.23 0.61 -0.61 0.09 0.00 0.00 178.44 178.81 2jbs h GLN 384 N 0.18 0.73 -0.14 1.13 -0.00 -1.59 0.29 115.11 115.71 2jbs h GLN 384 Ca 0.06 -0.04 -0.17 0.00 -0.00 0.00 0.00 58.65 58.49 2jbs h GLN 384 Cb 0.06 -0.16 -0.00 0.00 0.00 0.00 0.00 27.48 27.37 2jbs h GLN 384 CO -0.01 0.48 -0.64 -0.09 0.00 0.00 0.00 178.83 178.57 2jbs h ARG 385 N 0.75 0.51 -0.37 1.69 2.43 -1.49 -2.05 114.38 115.85 2jbs h ARG 385 Ca 0.59 -0.36 -0.16 0.00 -0.81 0.00 0.00 59.98 59.23 2jbs h ARG 385 Cb 0.93 0.06 -0.00 0.00 -0.42 0.00 0.00 29.97 30.54 2jbs h ARG 385 CO -0.39 0.98 -0.41 -0.07 -1.51 0.00 0.00 179.97 178.57 2jbs h LEU 386 N 0.37 0.99 -0.36 3.80 3.38 -0.19 -1.20 115.31 122.10 2jbs h LEU 386 Ca -0.01 -0.48 -0.03 0.00 0.09 0.00 0.00 57.88 57.45 2jbs h LEU 386 Cb 1.20 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 41.65 2jbs h LEU 386 CO 0.12 1.27 0.12 0.15 0.09 0.00 0.00 178.44 180.18 2jbs h PHE 387 N 0.74 0.57 0.36 1.13 3.57 -0.53 0.92 116.94 123.70 2jbs h PHE 387 Ca 0.05 -0.06 -0.02 0.00 3.53 0.00 0.00 57.97 61.48 2jbs h PHE 387 Cb 1.01 -0.17 0.00 0.00 2.79 0.00 0.00 35.95 39.58 2jbs h PHE 387 CO 0.07 0.55 -0.17 0.00 -2.23 0.00 0.00 178.31 176.52 2jbs h ARG 388 N 0.43 -0.47 -0.84 1.11 3.08 -1.26 -2.82 114.38 113.62 2jbs h ARG 388 Ca 0.12 0.03 0.04 0.00 0.07 0.00 0.00 59.98 60.24 2jbs h ARG 388 Cb 0.24 0.11 -0.05 0.00 0.08 0.00 0.00 29.97 30.35 2jbs h ARG 388 CO -0.00 -0.24 0.55 -0.44 -1.07 0.00 0.00 179.97 178.77 2jbs h ASP 389 N -0.61 0.89 -0.26 7.04 5.19 -1.12 -1.12 116.42 126.42 2jbs h ASP 389 Ca -0.05 -0.01 0.02 0.00 -0.62 0.00 0.00 57.03 56.37 2jbs h ASP 389 Cb 0.45 -0.20 -0.02 0.00 0.18 0.00 0.00 39.33 39.73 2jbs h ASP 389 CO 0.08 0.61 0.13 0.00 -3.12 0.00 0.00 179.24 176.94 2jbs h ALA 390 N 1.51 0.32 -0.32 3.45 0.00 -0.79 -2.47 119.26 120.97 2jbs h ALA 390 Ca 0.33 0.01 -0.06 0.00 0.00 0.00 0.00 54.91 55.20 2jbs h ALA 390 Cb 0.05 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 2jbs h ALA 390 CO -0.10 -0.26 -0.04 0.45 0.00 0.00 0.00 179.25 179.29 2jbs h HIS 391 N 0.28 0.54 -0.25 0.00 3.86 -1.09 -2.14 115.15 116.35 2jbs h HIS 391 Ca 0.11 -0.06 -0.03 0.00 -1.16 0.00 0.00 60.37 59.23 2jbs h HIS 391 Cb 0.03 -0.15 -0.01 0.00 1.06 0.00 0.00 27.41 28.33 2jbs h HIS 391 CO -0.10 0.56 0.02 1.98 0.86 0.00 0.00 177.93 181.25 2jbs h MET 392 N 0.49 0.36 0.00 2.45 -1.53 -0.79 -2.51 114.93 113.40 2jbs h MET 392 Ca 0.10 -0.06 -0.04 0.00 -3.44 0.00 0.00 59.70 56.26 2jbs h MET 392 Cb 0.38 -0.06 -0.01 0.00 -0.55 0.00 0.00 31.60 31.37 2jbs h MET 392 CO 0.02 0.37 -0.21 1.79 0.14 0.00 0.00 176.91 179.02 2jbs h THR 393 N 0.35 0.72 -0.11 -0.77 1.35 -1.05 -0.12 112.91 113.28 2jbs h THR 393 Ca 0.08 -0.88 0.00 0.00 -0.55 0.00 0.00 66.41 65.06 2jbs h THR 393 Cb 0.21 1.55 0.00 0.00 -1.73 0.00 0.00 68.15 68.18 2jbs h THR 393 CO 0.00 0.21 0.00 0.61 -0.25 0.00 0.00 175.52 176.09 2jbs n GLY 394 N -0.38 -0.13 0.64 5.82 0.00 -0.95 -4.01 105.19 106.18 2jbs n GLY 394 Ca -0.01 -0.32 0.10 0.00 0.00 0.00 0.00 46.02 45.79 2jbs n GLY 394 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jbs n ALA 395 N -0.04 2.93 -1.61 4.61 0.00 -0.06 -4.33 120.51 122.01 2jbs n ALA 395 Ca 0.15 -0.63 -0.32 0.00 0.00 0.00 0.00 53.44 52.64 2jbs n ALA 395 Cb 0.24 -0.70 0.03 0.00 0.00 0.00 0.00 19.45 19.01 2jbs n ALA 395 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 2jbs s HIS 396 N -1.99 2.96 0.45 0.00 2.46 -1.25 -4.91 115.29 113.01 2jbs s HIS 396 Ca 0.20 1.50 0.19 0.00 0.47 0.00 0.00 55.06 57.42 2jbs s HIS 396 Cb 0.17 -3.00 1.17 0.00 -0.13 0.00 0.00 32.58 30.79 2jbs s HIS 396 CO 0.38 -1.22 2.03 0.00 -2.47 0.00 0.00 174.74 173.46 2jbs h ALA 397 N 0.10 1.59 0.00 1.58 0.00 -1.95 -2.40 119.26 118.19 2jbs h ALA 397 Ca -0.46 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.31 2jbs h ALA 397 Cb 1.22 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.99 2jbs h ALA 397 CO 0.57 0.19 -0.67 -0.92 0.00 0.00 0.00 179.25 178.42 2jbs h TYR 398 N 0.00 0.00 -0.01 0.00 3.20 -1.96 -3.27 116.97 114.92 2jbs h TYR 398 Ca -0.00 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.87 2jbs h TYR 398 Cb 0.30 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.57 2jbs h TYR 398 CO 0.00 0.00 -0.53 0.25 -1.64 0.00 0.00 178.16 176.24 2jbs n THR 399 N -2.80 0.00 -1.59 1.81 -2.24 -0.99 -4.85 114.28 103.62 2jbs n THR 399 Ca 0.01 -0.23 -0.45 0.00 -2.27 0.00 0.00 64.05 61.11 2jbs n THR 399 Cb 0.54 1.22 -0.04 0.00 -2.10 0.00 0.00 70.33 69.95 2jbs n THR 399 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 2jbs n ASP 400 N -0.21 3.22 0.01 3.42 -0.08 -0.94 -4.81 116.55 117.17 2jbs n ASP 400 Ca 0.08 0.48 -0.07 0.00 -1.51 0.00 0.00 54.79 53.77 2jbs n ASP 400 Cb 0.44 -1.47 0.11 0.00 2.34 0.00 0.00 41.12 42.55 2jbs n ASP 400 CO 0.00 0.00 0.00 0.22 0.12 0.00 0.00 177.20 177.54 2jbs h TYR 401 N 12.93 0.60 -0.67 -0.67 3.20 -1.88 -2.47 116.97 128.01 2jbs h TYR 401 Ca -0.41 -0.18 0.13 0.00 3.14 0.00 0.00 58.73 61.40 2jbs h TYR 401 Cb 1.26 -0.13 -0.09 0.00 1.54 0.00 0.00 36.73 39.32 2jbs h TYR 401 CO 0.94 0.85 0.20 -0.44 -1.64 0.00 0.00 178.16 178.07 2jbs h ASP 402 N 0.41 0.12 -0.46 -2.11 3.32 -2.00 0.29 116.42 116.00 2jbs h ASP 402 Ca 0.03 0.11 -0.07 0.00 0.02 0.00 0.00 57.03 57.12 2jbs h ASP 402 Cb 0.93 0.12 -0.02 0.00 0.22 0.00 0.00 39.33 40.59 2jbs h ASP 402 CO 0.08 0.05 0.02 0.58 -1.72 0.00 0.00 179.24 178.26 2jbs h VAL 403 N 0.34 1.26 -0.63 -1.35 2.07 -1.94 -2.89 116.25 113.11 2jbs h VAL 403 Ca 0.36 -1.00 -0.06 0.00 0.82 0.00 0.00 66.70 66.81 2jbs h VAL 403 Cb 0.54 1.01 -0.03 0.00 -1.52 0.00 0.00 31.29 31.29 2jbs h VAL 403 CO -0.40 0.35 0.15 0.00 0.02 0.00 0.00 177.57 177.69 2jbs h ALA 405 N 1.05 1.54 -0.14 0.00 0.00 -0.39 -1.05 119.26 120.26 2jbs h ALA 405 Ca 0.20 -0.11 -0.13 0.00 0.00 0.00 0.00 54.91 54.87 2jbs h ALA 405 Cb 0.36 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 2jbs h ALA 405 CO 0.00 0.36 -0.46 1.96 0.00 0.00 0.00 179.25 181.11 2jbs h GLN 406 N 0.57 0.36 0.62 0.00 4.20 -1.25 -0.31 115.11 119.30 2jbs h GLN 406 Ca 0.14 -0.19 -0.03 0.00 0.06 0.00 0.00 58.65 58.63 2jbs h GLN 406 Cb 0.10 0.01 0.01 0.00 0.30 0.00 0.00 27.48 27.90 2jbs h GLN 406 CO -0.02 0.75 -0.30 0.82 -0.67 0.00 0.00 178.83 179.42 2jbs h ILE 407 N 0.29 0.03 -0.39 2.54 2.04 -0.31 -1.98 117.51 119.73 2jbs h ILE 407 Ca 0.02 -0.39 0.07 0.00 1.00 0.00 0.00 64.86 65.55 2jbs h ILE 407 Cb 0.93 0.04 -0.06 0.00 -0.74 0.00 0.00 36.82 36.99 2jbs h ILE 407 CO 0.08 0.01 0.04 0.25 0.00 0.00 0.00 178.15 178.52 2jbs h LEU 408 N -1.21 -0.07 -0.25 1.44 5.85 -1.29 -2.25 115.31 117.53 2jbs h LEU 408 Ca -0.08 0.08 0.06 0.00 0.84 0.00 0.00 57.88 58.77 2jbs h LEU 408 Cb 0.64 0.12 -0.06 0.00 0.37 0.00 0.00 40.66 41.73 2jbs h LEU 408 CO 0.14 -0.00 -0.16 1.23 -0.34 0.00 0.00 178.44 179.31 2jbs h GLY 409 N 0.15 0.02 0.78 3.75 0.00 -1.05 -0.51 103.07 106.21 2jbs h GLY 409 Ca 0.19 0.19 0.06 0.00 0.00 0.00 0.00 47.33 47.77 2jbs h GLY 409 CO -0.28 -0.16 0.65 3.21 0.00 0.00 0.00 176.54 179.96 2jbs h ARG 410 N -0.14 1.18 -0.30 4.80 3.08 -1.09 -1.85 114.38 120.05 2jbs h ARG 410 Ca 0.14 -0.07 -0.03 0.00 0.07 0.00 0.00 59.98 60.09 2jbs h ARG 410 Cb 0.34 -0.27 -0.01 0.00 0.08 0.00 0.00 29.97 30.12 2jbs h ARG 410 CO -0.33 0.78 0.09 1.49 -1.07 0.00 0.00 179.97 180.93 2jbs h GLU 411 N 1.21 0.47 -0.43 0.04 4.57 -0.72 0.46 114.58 120.19 2jbs h GLU 411 Ca 0.42 -0.11 -0.04 0.00 -1.18 0.00 0.00 59.36 58.46 2jbs h GLU 411 Cb 0.11 -0.07 -0.02 0.00 -0.16 0.00 0.00 28.75 28.62 2jbs h GLU 411 CO -0.16 0.53 0.10 -0.07 -1.18 0.00 0.00 179.01 178.23 2jbs h LEU 412 N 0.33 0.59 -0.59 1.64 3.38 -0.63 -1.05 115.31 118.97 2jbs h LEU 412 Ca 0.10 -0.09 0.00 0.00 0.09 0.00 0.00 57.88 57.98 2jbs h LEU 412 Cb 0.26 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 40.86 2jbs h LEU 412 CO -0.00 0.59 0.00 0.23 0.09 0.00 0.00 178.44 179.35 2jbs n MET 413 N -4.31 1.40 -2.76 1.13 2.81 -0.74 -4.91 117.12 109.73 2jbs n MET 413 Ca 0.03 -0.59 -0.09 0.00 -1.81 0.00 0.00 57.70 55.24 2jbs n MET 413 Cb 0.20 -1.42 0.02 0.00 -0.71 0.00 0.00 33.22 31.32 2jbs n MET 413 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2jbs n GLY 414 N 1.04 0.27 3.90 3.03 0.00 -0.40 -5.03 105.19 108.01 2jbs n GLY 414 Ca 0.18 -0.35 -0.31 0.00 0.00 0.00 0.00 46.02 45.54 2jbs n GLY 414 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2jbs s MET 415 N -5.27 3.58 0.37 1.61 -1.94 0.16 -5.01 119.30 112.79 2jbs s MET 415 Ca 0.18 -0.17 -0.27 0.00 -1.71 0.00 0.00 55.69 53.73 2jbs s MET 415 Cb -0.08 -2.87 -0.12 0.00 2.01 0.00 0.00 34.83 33.77 2jbs s MET 415 CO 0.23 0.48 1.18 0.39 -0.01 0.00 0.00 175.02 177.28 2jbs n GLU 416 N 0.02 1.78 -1.57 2.03 -0.58 -1.26 -4.46 120.64 116.60 2jbs n GLU 416 Ca -0.03 0.63 -0.34 0.00 -0.42 0.00 0.00 57.16 57.00 2jbs n GLU 416 Cb 0.52 -2.20 0.08 0.00 -0.57 0.00 0.00 31.44 29.27 2jbs n GLU 416 CO 0.00 0.00 0.00 -2.14 -0.48 0.00 0.00 177.13 174.51 2jbs s PRO 417 N -1.93 2.36 -0.39 3.49 0.02 -1.26 -4.96 135.00 132.33 2jbs s PRO 417 Ca 0.59 1.74 -0.23 0.00 0.02 0.00 0.00 61.00 63.12 2jbs s PRO 417 Cb -0.57 -1.86 0.01 0.00 0.02 0.00 0.00 34.50 32.10 2jbs s PRO 417 CO 0.60 -1.66 0.79 0.34 -0.33 0.00 0.00 177.00 176.73 2jbs s ASP 418 N -2.01 6.51 0.00 2.53 -1.08 -1.26 -4.92 116.67 116.44 2jbs s ASP 418 Ca 0.74 0.22 0.14 0.00 -0.52 0.00 0.00 52.55 53.14 2jbs s ASP 418 Cb -0.29 -2.39 0.77 0.00 -1.46 0.00 0.00 42.92 39.55 2jbs s ASP 418 CO 0.43 -0.79 1.33 -0.81 0.52 0.00 0.00 175.17 175.85 2jbs n PRO 419 N 6.52 0.31 0.24 4.34 -0.04 -1.26 -2.10 135.00 143.01 2jbs n PRO 419 Ca 0.03 0.09 0.15 0.00 -0.04 0.00 0.00 63.50 63.73 2jbs n PRO 419 Cb 0.48 -1.50 0.55 0.00 -0.04 0.00 0.00 33.50 32.99 2jbs n PRO 419 CO 0.00 0.00 0.00 1.15 -0.04 0.00 0.00 175.50 176.61 2jbs h THR 420 N 0.00 0.00 -4.21 0.52 2.02 -2.04 -3.45 112.91 105.75 2jbs h THR 420 Ca 0.00 -0.55 -0.16 0.00 0.77 0.00 0.00 66.41 66.46 2jbs h THR 420 Cb 0.07 1.51 -0.13 0.00 -1.74 0.00 0.00 68.15 67.87 2jbs h THR 420 CO 0.00 0.00 -0.45 0.00 0.37 0.00 0.00 175.52 175.44 2jbs s MET 421 N -3.50 1.24 0.00 6.66 0.23 -0.89 -5.23 119.30 117.81 2jbs s MET 421 Ca 0.03 -1.43 0.00 0.00 -1.03 0.00 0.00 55.69 53.26 2jbs s MET 421 Cb 0.08 0.33 0.00 0.00 -1.53 0.00 0.00 34.83 33.72 2jbs s MET 421 CO 0.55 -0.44 0.00 1.55 -2.03 0.00 0.00 175.02 174.64