#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1trm s VAL 17 N 0.00 5.24 -0.68 1.39 1.01 0.21 -4.00 120.40 123.58 1trm s VAL 17 Ca 0.00 0.75 0.00 0.00 0.00 0.00 0.00 61.98 62.73 1trm s VAL 17 Cb 0.00 -3.72 0.00 0.00 0.00 0.00 0.00 36.38 32.66 1trm s VAL 17 CO 0.00 0.37 0.00 0.61 0.00 0.00 0.00 175.10 176.08 1trm n GLY 18 N 3.23 0.86 0.00 4.51 0.00 -1.25 -1.26 105.19 111.29 1trm n GLY 18 Ca -0.10 -0.60 0.00 0.00 0.00 0.00 0.00 46.02 45.32 1trm n GLY 18 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1trm n GLY 19 N -2.00 1.98 3.27 -0.02 0.00 -1.26 -4.89 105.19 102.28 1trm n GLY 19 Ca -0.06 -1.83 -0.11 0.00 0.00 0.00 0.00 46.02 44.01 1trm n GLY 19 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1trm s TYR 20 N 3.85 0.96 -0.07 1.61 -0.85 0.85 -4.93 117.35 118.77 1trm s TYR 20 Ca 0.00 -1.22 -0.30 0.00 -0.52 0.00 0.00 57.07 55.03 1trm s TYR 20 Cb 0.00 -0.40 -0.03 0.00 0.38 0.00 0.00 41.96 41.91 1trm s TYR 20 CO 0.00 -0.70 1.23 0.99 -1.52 0.00 0.00 175.55 175.55 1trm s THR 21 N -4.12 4.22 0.46 -3.49 2.01 -1.26 0.14 115.64 113.61 1trm s THR 21 Ca 0.34 1.53 -0.24 0.00 0.31 0.00 0.00 61.69 63.63 1trm s THR 21 Cb 0.06 -3.99 -0.07 0.00 0.01 0.00 0.00 72.50 68.51 1trm s THR 21 CO 0.10 -0.03 1.25 0.00 -0.69 0.00 0.00 174.62 175.25 1trm s GLN 23 N -2.61 4.33 0.03 0.00 0.74 -1.26 -4.85 119.66 116.04 1trm s GLN 23 Ca 0.63 2.22 -0.38 0.00 0.05 0.00 0.00 55.36 57.89 1trm s GLN 23 Cb -0.34 -3.10 -0.17 0.00 1.10 0.00 0.00 33.01 30.50 1trm s GLN 23 CO 0.42 -0.27 1.35 -0.85 -0.55 0.00 0.00 175.29 175.39 1trm n GLU 24 N 1.55 0.99 -2.24 1.67 0.28 -1.26 -1.20 120.64 120.42 1trm n GLU 24 Ca 0.03 0.36 -0.17 0.00 -0.16 0.00 0.00 57.16 57.21 1trm n GLU 24 Cb 0.41 -1.98 -0.02 0.00 1.43 0.00 0.00 31.44 31.28 1trm n GLU 24 CO 0.00 0.00 0.00 0.09 -0.16 0.00 0.00 177.13 177.06 1trm n ASN 25 N 2.71 -4.98 -0.43 -1.84 3.02 -1.26 -4.87 115.26 107.60 1trm n ASN 25 Ca 0.20 0.14 0.13 0.00 -0.03 0.00 0.00 54.58 55.02 1trm n ASN 25 Cb 0.17 -4.23 0.40 0.00 -0.61 0.00 0.00 39.78 35.51 1trm n ASN 25 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 1trm n SER 26 N -1.74 1.48 -3.26 6.41 3.41 -0.34 -4.22 113.62 115.36 1trm n SER 26 Ca -0.20 -1.31 -0.25 0.00 -0.26 0.00 0.00 58.87 56.85 1trm n SER 26 Cb 0.64 0.08 -0.07 0.00 -0.26 0.00 0.00 64.21 64.60 1trm n SER 26 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 1trm n VAL 27 N -0.05 0.45 0.04 -3.33 0.31 -1.26 -4.97 118.33 109.51 1trm n VAL 27 Ca 0.15 -4.49 0.22 0.00 -0.01 0.00 0.00 64.34 60.21 1trm n VAL 27 Cb 0.38 -1.88 0.73 0.00 -0.91 0.00 0.00 33.84 32.16 1trm n VAL 27 CO 0.00 0.00 0.00 1.55 -1.32 0.00 0.00 176.83 177.06 1trm h PRO 28 N 3.96 0.00 -0.01 5.55 0.13 -1.80 -0.04 132.00 139.79 1trm h PRO 28 Ca 0.12 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.25 1trm h PRO 28 Cb 0.80 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.93 1trm h PRO 28 CO 0.60 0.00 -0.08 2.48 -0.23 0.00 0.00 178.00 180.77 1trm n TYR 29 N -3.84 0.00 -2.68 1.56 0.18 -1.18 -3.08 117.16 108.11 1trm n TYR 29 Ca 0.10 0.00 -0.40 0.00 1.88 0.00 0.00 57.90 59.47 1trm n TYR 29 Cb 0.69 -0.06 -0.05 0.00 -0.38 0.00 0.00 39.34 39.54 1trm n TYR 29 CO 0.00 0.00 0.00 -1.14 -2.08 0.00 0.00 176.86 173.64 1trm s GLN 30 N -2.20 4.75 0.21 -3.48 2.00 -0.03 -1.81 119.66 119.10 1trm s GLN 30 Ca 0.34 1.55 0.09 0.00 -2.00 0.00 0.00 55.36 55.34 1trm s GLN 30 Cb 0.21 -3.30 -0.05 0.00 0.80 0.00 0.00 33.01 30.67 1trm s GLN 30 CO 0.41 0.33 -0.16 0.14 -0.50 0.00 0.00 175.29 175.51 1trm s VAL 31 N -0.71 1.89 -0.17 1.34 -7.23 -0.88 -4.43 120.40 110.22 1trm s VAL 31 Ca 0.44 -2.19 -0.03 0.00 -1.81 0.00 0.00 61.98 58.39 1trm s VAL 31 Cb -0.26 -2.05 -0.02 0.00 0.56 0.00 0.00 36.38 34.61 1trm s VAL 31 CO 0.33 -0.50 -0.05 -0.55 -0.31 0.00 0.00 175.10 174.02 1trm s SER 32 N -3.21 4.57 -0.37 4.85 0.15 -0.88 -2.14 113.70 116.67 1trm s SER 32 Ca 0.22 -0.22 -0.23 0.00 0.70 0.00 0.00 55.95 56.42 1trm s SER 32 Cb -0.03 -1.75 0.01 0.00 -1.71 0.00 0.00 66.02 62.55 1trm s SER 32 CO 0.08 0.12 0.79 -0.76 1.20 0.00 0.00 173.24 174.68 1trm s LEU 33 N 0.62 4.13 -0.17 3.45 1.43 0.10 -1.28 118.68 126.97 1trm s LEU 33 Ca -0.03 0.33 -0.07 0.00 -1.03 0.00 0.00 54.13 53.33 1trm s LEU 33 Cb -0.15 -3.03 -0.04 0.00 0.03 0.00 0.00 46.19 43.00 1trm s LEU 33 CO 0.03 -0.76 0.06 0.21 0.23 0.00 0.00 176.35 176.12 1trm s ASN 34 N 1.87 5.65 -0.03 2.29 2.47 0.49 -1.71 114.94 125.97 1trm s ASN 34 Ca 0.32 0.12 0.18 0.00 0.42 0.00 0.00 52.86 53.90 1trm s ASN 34 Cb -0.13 -1.92 0.33 0.00 -1.45 0.00 0.00 41.25 38.08 1trm s ASN 34 CO 0.18 0.21 1.14 -0.24 -3.72 0.00 0.00 177.10 174.67 1trm n SER 37 N 3.26 0.95 0.00 -4.21 2.88 -1.26 -0.16 113.62 115.07 1trm n SER 37 Ca -0.17 -2.31 0.00 0.00 -1.33 0.00 0.00 58.87 55.06 1trm n SER 37 Cb 0.53 -0.32 0.00 0.00 -0.75 0.00 0.00 64.21 63.67 1trm n SER 37 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1trm n GLY 38 N 0.09 1.24 3.52 0.46 0.00 -1.26 -5.02 105.19 104.22 1trm n GLY 38 Ca 0.07 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.99 1trm n GLY 38 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1trm s TYR 39 N -1.16 -0.42 0.28 1.61 1.13 -1.26 -5.15 117.35 112.39 1trm s TYR 39 Ca 0.00 0.18 -0.30 0.00 -1.41 0.00 0.00 57.07 55.54 1trm s TYR 39 Cb 0.00 0.58 -0.12 0.00 -1.10 0.00 0.00 41.96 41.32 1trm s TYR 39 CO 0.00 -0.83 1.52 1.58 -2.51 0.00 0.00 175.55 175.30 1trm n HIS 40 N -0.37 2.61 0.00 -3.49 -0.00 -1.26 -4.57 115.22 108.14 1trm n HIS 40 Ca -0.13 0.33 0.00 0.00 -0.00 0.00 0.00 57.72 57.93 1trm n HIS 40 Cb 0.63 -2.54 0.00 0.00 -0.00 0.00 0.00 29.99 28.08 1trm n HIS 40 CO 0.00 0.00 0.00 1.97 -0.00 0.00 0.00 176.34 178.31 1trm n PHE 41 N 1.89 0.00 -3.56 1.57 1.16 -0.70 -4.97 117.46 112.85 1trm n PHE 41 Ca 0.09 0.00 -0.08 0.00 -1.87 0.00 0.00 57.45 55.59 1trm n PHE 41 Cb 0.35 0.00 -0.02 0.00 -1.61 0.00 0.00 39.48 38.20 1trm n PHE 41 CO 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 176.76 174.89 1trm s GLY 43 N -2.68 2.61 0.00 0.00 0.00 0.24 0.02 107.32 107.52 1trm s GLY 43 Ca 0.06 -1.46 0.00 0.00 0.00 0.00 0.00 44.72 43.32 1trm s GLY 43 CO -0.07 -2.05 0.00 0.61 0.00 0.00 0.00 173.10 171.59 1trm n GLY 44 N -1.27 2.30 3.18 0.20 0.00 -0.91 -3.33 105.19 105.36 1trm n GLY 44 Ca -0.08 -1.01 -0.13 0.00 0.00 0.00 0.00 46.02 44.80 1trm n GLY 44 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1trm s SER 45 N -0.51 -0.26 -0.48 1.61 1.04 0.13 -2.07 113.70 113.17 1trm s SER 45 Ca 0.00 0.43 -0.28 0.00 0.48 0.00 0.00 55.95 56.58 1trm s SER 45 Cb 0.00 0.51 -0.01 0.00 0.10 0.00 0.00 66.02 66.62 1trm s SER 45 CO 0.00 -0.19 1.69 -0.22 0.98 0.00 0.00 173.24 175.50 1trm s LEU 46 N -0.25 3.43 0.04 2.42 2.96 -0.75 0.68 118.68 127.21 1trm s LEU 46 Ca -0.04 0.73 0.20 0.00 -0.22 0.00 0.00 54.13 54.80 1trm s LEU 46 Cb -0.03 -3.11 -0.17 0.00 0.50 0.00 0.00 46.19 43.38 1trm s LEU 46 CO 0.01 -1.89 0.70 2.30 -1.32 0.00 0.00 176.35 176.15 1trm n ILE 47 N 7.20 0.80 -2.95 6.68 -5.35 -0.76 -1.06 119.36 123.91 1trm n ILE 47 Ca 0.19 -0.63 0.00 0.00 -0.27 0.00 0.00 62.75 62.04 1trm n ILE 47 Cb 0.49 -0.43 0.00 0.00 -1.74 0.00 0.00 39.64 37.96 1trm n ILE 47 CO 0.00 0.00 0.00 -0.46 -1.76 0.00 0.00 176.55 174.33 1trm n ASN 48 N -2.67 0.00 0.00 7.28 2.04 -1.21 -4.65 115.26 116.06 1trm n ASN 48 Ca -0.09 -0.91 0.13 0.00 -0.44 0.00 0.00 54.58 53.27 1trm n ASN 48 Cb 0.75 0.00 0.75 0.00 -2.53 0.00 0.00 39.78 38.74 1trm n ASN 48 CO 0.00 0.00 0.00 -0.90 -0.44 0.00 0.00 177.26 175.92 1trm n ASP 49 N -0.98 0.00 0.00 0.53 5.68 -1.26 -3.70 116.55 116.82 1trm n ASP 49 Ca 0.00 -0.70 0.00 0.00 -0.50 0.00 0.00 54.79 53.59 1trm n ASP 49 Cb 0.00 -0.04 0.00 0.00 -1.14 0.00 0.00 41.12 39.94 1trm n ASP 49 CO 0.00 0.00 0.00 1.67 -1.33 0.00 0.00 177.20 177.54 1trm n GLN 50 N -1.04 0.00 -4.38 0.11 7.27 -1.26 -0.30 117.38 117.77 1trm n GLN 50 Ca 0.18 -0.12 -0.21 0.00 0.07 0.00 0.00 57.00 56.93 1trm n GLN 50 Cb 0.11 -0.46 -0.16 0.00 2.41 0.00 0.00 30.24 32.14 1trm n GLN 50 CO 0.00 0.00 0.00 -1.58 0.07 0.00 0.00 177.06 175.55 1trm s TRP 51 N 0.00 0.98 -0.01 3.69 0.52 -1.24 0.39 118.94 123.26 1trm s TRP 51 Ca 0.00 -0.27 0.08 0.00 0.02 0.00 0.00 56.10 55.93 1trm s TRP 51 Cb 0.00 -0.72 -0.02 0.00 -1.15 0.00 0.00 33.47 31.58 1trm s TRP 51 CO 0.00 -0.14 -0.24 0.08 0.02 0.00 0.00 176.95 176.67 1trm s VAL 52 N 0.37 2.22 -0.06 4.03 1.01 0.94 -1.84 120.40 127.07 1trm s VAL 52 Ca -0.06 -1.11 -0.00 0.00 0.00 0.00 0.00 61.98 60.81 1trm s VAL 52 Cb -0.10 -1.80 -0.03 0.00 0.00 0.00 0.00 36.38 34.44 1trm s VAL 52 CO 0.01 0.54 -0.02 0.54 0.00 0.00 0.00 175.10 176.17 1trm s VAL 53 N -0.67 4.11 0.00 2.92 0.11 0.21 -0.63 120.40 126.45 1trm s VAL 53 Ca 0.11 -0.40 0.00 0.00 -2.93 0.00 0.00 61.98 58.76 1trm s VAL 53 Cb -0.10 -2.74 0.00 0.00 -1.53 0.00 0.00 36.38 32.01 1trm s VAL 53 CO -0.00 0.55 0.00 -0.24 -3.33 0.00 0.00 175.10 172.08 1trm n SER 54 N 1.97 0.95 -4.20 3.54 2.88 -0.65 0.20 113.62 118.31 1trm n SER 54 Ca -0.17 0.00 -0.27 0.00 -1.33 0.00 0.00 58.87 57.10 1trm n SER 54 Cb 0.53 0.00 -0.16 0.00 -0.75 0.00 0.00 64.21 63.83 1trm n SER 54 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1trm s ALA 55 N -1.42 1.68 0.43 -1.46 0.00 -1.26 -1.27 121.76 118.46 1trm s ALA 55 Ca 0.00 -0.84 0.17 0.00 0.00 0.00 0.00 51.96 51.29 1trm s ALA 55 Cb 0.00 -0.47 1.09 0.00 0.00 0.00 0.00 23.12 23.74 1trm s ALA 55 CO 0.00 0.38 1.90 0.00 0.00 0.00 0.00 175.76 178.04 1trm h ALA 56 N 5.82 2.19 0.00 0.00 0.00 -1.73 0.70 119.26 126.24 1trm h ALA 56 Ca -0.37 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.55 1trm h ALA 56 Cb 1.15 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.90 1trm h ALA 56 CO 0.48 -0.42 0.00 1.12 0.00 0.00 0.00 179.25 180.43 1trm h HIS 57 N 0.38 0.00 -0.37 0.00 2.07 -1.91 -1.55 115.15 113.76 1trm h HIS 57 Ca 0.40 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.92 1trm h HIS 57 Cb 0.99 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.97 1trm h HIS 57 CO -0.00 0.00 0.00 0.00 -3.07 0.00 0.00 177.93 174.86 1trm n TYR 59 N 0.58 2.69 -3.71 0.00 4.19 -0.59 -4.99 117.16 115.33 1trm n TYR 59 Ca 0.12 0.31 -0.13 0.00 3.31 0.00 0.00 57.90 61.52 1trm n TYR 59 Cb 0.31 -2.56 -0.10 0.00 0.49 0.00 0.00 39.34 37.49 1trm n TYR 59 CO 0.00 0.00 0.00 0.15 0.91 0.00 0.00 176.86 177.92 1trm s LYS 60 N -0.61 0.53 0.35 2.98 1.02 -1.26 -5.07 119.74 117.67 1trm s LYS 60 Ca 0.64 0.70 0.25 0.00 0.02 0.00 0.00 55.97 57.58 1trm s LYS 60 Cb -0.53 0.21 1.25 0.00 -0.52 0.00 0.00 37.83 38.24 1trm s LYS 60 CO 0.50 -0.08 1.76 0.66 -0.92 0.00 0.00 175.35 177.27 1trm h SER 61 N 5.75 0.00 -3.15 2.83 4.64 -2.01 -3.39 113.55 118.23 1trm h SER 61 Ca -0.29 0.00 -0.42 0.00 -0.47 0.00 0.00 61.79 60.61 1trm h SER 61 Cb 1.18 0.00 -0.40 0.00 -0.31 0.00 0.00 62.40 62.87 1trm h SER 61 CO 0.22 0.00 -0.75 -0.13 -0.87 0.00 0.00 176.83 175.31 1trm s ARG 62 N -3.54 0.01 -0.01 4.77 1.81 -1.26 -5.05 118.95 115.67 1trm s ARG 62 Ca -0.00 0.10 0.05 0.00 -1.72 0.00 0.00 55.73 54.15 1trm s ARG 62 Cb 0.08 -1.32 -0.01 0.00 -0.45 0.00 0.00 34.95 33.24 1trm s ARG 62 CO 0.29 -0.54 -0.16 0.42 -0.68 0.00 0.00 175.30 174.64 1trm s ILE 63 N 2.15 1.25 -0.12 1.52 1.01 -1.26 -4.76 121.20 120.99 1trm s ILE 63 Ca 0.03 -0.67 -0.01 0.00 0.00 0.00 0.00 60.65 60.01 1trm s ILE 63 Cb -0.14 -1.04 -0.02 0.00 0.01 0.00 0.00 42.46 41.26 1trm s ILE 63 CO -0.07 0.35 -0.09 -1.58 0.00 0.00 0.00 174.94 173.55 1trm s GLN 64 N -0.34 3.25 -0.07 2.79 0.74 0.77 -0.25 119.66 126.54 1trm s GLN 64 Ca 0.05 -0.62 -0.06 0.00 0.05 0.00 0.00 55.36 54.79 1trm s GLN 64 Cb -0.06 -2.67 -0.04 0.00 1.10 0.00 0.00 33.01 31.33 1trm s GLN 64 CO -0.00 0.35 0.18 0.08 -0.55 0.00 0.00 175.29 175.34 1trm s VAL 65 N 0.01 5.45 -0.11 1.34 1.01 0.39 0.19 120.40 128.67 1trm s VAL 65 Ca -0.02 0.13 0.01 0.00 0.00 0.00 0.00 61.98 62.09 1trm s VAL 65 Cb -0.14 -3.47 0.02 0.00 0.00 0.00 0.00 36.38 32.79 1trm s VAL 65 CO 0.04 0.51 -0.12 -0.13 0.00 0.00 0.00 175.10 175.39 1trm s ARG 65 N -1.36 1.97 0.20 2.72 0.52 -0.40 -1.17 118.95 121.43 1trm s ARG 65 Ca 0.20 -0.45 0.10 0.00 -0.52 0.00 0.00 55.73 55.06 1trm s ARG 65 Cb -0.12 -1.79 -0.04 0.00 0.52 0.00 0.00 34.95 33.51 1trm s ARG 65 CO 0.10 -0.16 -0.19 -0.51 0.02 0.00 0.00 175.30 174.56 1trm s LEU 66 N 1.28 2.49 -0.73 2.53 1.02 -0.36 -2.06 118.68 122.85 1trm s LEU 66 Ca -0.01 -0.92 0.00 0.00 0.02 0.00 0.00 54.13 53.22 1trm s LEU 66 Cb -0.14 -0.93 0.00 0.00 0.02 0.00 0.00 46.19 45.14 1trm s LEU 66 CO -0.05 -0.01 0.00 0.61 0.02 0.00 0.00 176.35 176.92 1trm n GLY 69 N -0.00 0.64 3.89 -3.19 0.00 -1.25 -1.70 105.19 103.58 1trm n GLY 69 Ca -0.11 -0.67 -0.29 0.00 0.00 0.00 0.00 46.02 44.96 1trm n GLY 69 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1trm s GLU 70 N -3.24 3.61 0.07 1.61 0.41 -1.26 -4.16 118.70 115.74 1trm s GLU 70 Ca 0.00 0.41 0.00 0.00 -0.41 0.00 0.00 54.97 54.97 1trm s GLU 70 Cb 0.00 -2.29 0.00 0.00 -1.78 0.00 0.00 34.13 30.06 1trm s GLU 70 CO 0.00 -0.27 0.00 1.58 -0.49 0.00 0.00 175.26 176.08 1trm n HIS 71 N -2.19 -0.58 -3.04 1.61 -0.00 -1.26 -4.73 115.22 105.01 1trm n HIS 71 Ca 0.02 0.10 -0.43 0.00 -0.00 0.00 0.00 57.72 57.42 1trm n HIS 71 Cb 0.55 0.42 -0.06 0.00 -0.00 0.00 0.00 29.99 30.90 1trm n HIS 71 CO 0.00 0.00 0.00 1.21 -0.00 0.00 0.00 176.34 177.55 1trm s ASN 72 N -4.47 6.31 0.58 0.26 3.04 -1.26 -2.85 114.94 116.56 1trm s ASN 72 Ca 0.00 -0.46 0.38 0.00 0.04 0.00 0.00 52.86 52.82 1trm s ASN 72 Cb 0.00 -2.35 1.78 0.00 -1.54 0.00 0.00 41.25 39.15 1trm s ASN 72 CO 0.00 -0.92 2.13 -0.29 -3.04 0.00 0.00 177.10 174.98 1trm h ILE 73 N 5.92 0.00 -0.02 -5.21 2.10 -1.12 -3.19 117.51 115.99 1trm h ILE 73 Ca -0.26 -0.29 0.00 0.00 1.08 0.00 0.00 64.86 65.39 1trm h ILE 73 Cb 1.09 1.27 0.00 0.00 -1.09 0.00 0.00 36.82 38.09 1trm h ILE 73 CO 0.96 0.00 -0.17 0.59 -1.08 0.00 0.00 178.15 178.45 1trm n ASN 74 N -3.04 2.00 -4.03 2.19 3.02 -1.26 -4.92 115.26 109.21 1trm n ASN 74 Ca -0.01 -1.50 -0.25 0.00 -0.03 0.00 0.00 54.58 52.79 1trm n ASN 74 Cb 0.20 0.24 -0.17 0.00 -0.61 0.00 0.00 39.78 39.45 1trm n ASN 74 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1trm s VAL 75 N -1.64 1.22 -0.15 2.41 1.01 -1.21 -5.11 120.40 116.93 1trm s VAL 75 Ca 0.16 -0.52 -0.29 0.00 0.00 0.00 0.00 61.98 61.34 1trm s VAL 75 Cb 0.13 -1.11 -0.05 0.00 0.00 0.00 0.00 36.38 35.35 1trm s VAL 75 CO 0.31 0.38 1.96 -0.76 0.00 0.00 0.00 175.10 176.98 1trm s LEU 76 N 0.71 3.85 0.00 3.92 1.43 -1.26 -4.71 118.68 122.62 1trm s LEU 76 Ca -0.14 2.00 0.18 0.00 -1.03 0.00 0.00 54.13 55.15 1trm s LEU 76 Cb -0.16 -3.52 -0.17 0.00 0.03 0.00 0.00 46.19 42.37 1trm s LEU 76 CO 0.03 -1.50 0.80 -0.62 0.23 0.00 0.00 176.35 175.29 1trm n GLU 77 N 8.09 1.11 -0.03 1.70 1.02 -1.26 -5.02 120.64 126.25 1trm n GLU 77 Ca 0.24 -0.14 0.00 0.00 -0.02 0.00 0.00 57.16 57.23 1trm n GLU 77 Cb 0.44 -1.35 0.00 0.00 -0.02 0.00 0.00 31.44 30.51 1trm n GLU 77 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1trm n GLY 78 N 1.40 0.34 0.08 0.62 0.00 -1.26 -4.95 105.19 101.43 1trm n GLY 78 Ca 0.04 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.10 1trm n GLY 78 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1trm n ASN 79 N 0.00 0.68 -4.78 1.61 3.02 -1.26 -5.03 115.26 109.50 1trm n ASN 79 Ca 0.00 -0.84 -0.34 0.00 -0.03 0.00 0.00 54.58 53.37 1trm n ASN 79 Cb 0.00 0.78 0.00 0.00 -0.61 0.00 0.00 39.78 39.95 1trm n ASN 79 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 1trm s GLU 80 N -1.53 3.37 -0.09 3.52 8.01 -1.26 -4.56 118.70 126.16 1trm s GLU 80 Ca 0.05 1.51 0.01 0.00 0.01 0.00 0.00 54.97 56.56 1trm s GLU 80 Cb 0.06 -2.02 0.02 0.00 -4.31 0.00 0.00 34.13 27.88 1trm s GLU 80 CO 0.28 -0.81 -0.13 -0.65 0.01 0.00 0.00 175.26 173.96 1trm s GLN 81 N -3.42 1.90 -0.27 1.61 -0.21 -0.69 -4.98 119.66 113.60 1trm s GLN 81 Ca 0.70 -0.45 -0.08 0.00 0.02 0.00 0.00 55.36 55.56 1trm s GLN 81 Cb -0.22 -1.66 -0.01 0.00 1.00 0.00 0.00 33.01 32.12 1trm s GLN 81 CO 0.28 -0.07 0.09 -0.06 -2.12 0.00 0.00 175.29 173.40 1trm s PHE 82 N 1.02 3.12 -0.01 0.91 2.99 -1.26 -1.22 117.98 123.52 1trm s PHE 82 Ca -0.07 -0.60 -0.00 0.00 0.00 0.00 0.00 56.93 56.26 1trm s PHE 82 Cb -0.15 -2.27 0.01 0.00 0.00 0.00 0.00 43.02 40.62 1trm s PHE 82 CO -0.01 -0.44 0.02 0.08 -0.00 0.00 0.00 175.22 174.87 1trm s VAL 83 N 1.58 -0.02 0.54 -0.44 1.01 -0.32 -4.98 120.40 117.77 1trm s VAL 83 Ca 0.05 0.07 -0.18 0.00 0.00 0.00 0.00 61.98 61.92 1trm s VAL 83 Cb -0.16 -0.05 -0.06 0.00 0.00 0.00 0.00 36.38 36.11 1trm s VAL 83 CO 0.04 0.03 1.07 0.20 0.00 0.00 0.00 175.10 176.43 1trm s ASN 84 N 0.38 5.98 0.17 3.32 0.01 -1.26 -0.46 114.94 123.07 1trm s ASN 84 Ca -0.03 1.95 -0.30 0.00 -0.71 0.00 0.00 52.86 53.77 1trm s ASN 84 Cb -0.04 -2.56 -0.08 0.00 0.41 0.00 0.00 41.25 38.98 1trm s ASN 84 CO -0.01 -1.03 1.23 0.00 -1.51 0.00 0.00 177.10 175.78 1trm s ALA 85 N -2.09 3.45 -0.20 0.60 0.00 0.65 -0.27 121.76 123.90 1trm s ALA 85 Ca 0.67 0.97 0.16 0.00 0.00 0.00 0.00 51.96 53.76 1trm s ALA 85 Cb -0.18 -3.44 -0.23 0.00 0.00 0.00 0.00 23.12 19.27 1trm s ALA 85 CO 0.27 -0.42 0.03 0.00 0.00 0.00 0.00 175.76 175.65 1trm n ALA 86 N 2.79 1.51 -3.04 0.00 0.00 0.50 -4.72 120.51 117.55 1trm n ALA 86 Ca 0.06 -1.27 -0.12 0.00 0.00 0.00 0.00 53.44 52.11 1trm n ALA 86 Cb 0.44 -0.16 -0.12 0.00 0.00 0.00 0.00 19.45 19.62 1trm n ALA 86 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1trm s LYS 87 N -2.48 0.23 -0.22 0.00 1.02 -0.91 -4.99 119.74 112.39 1trm s LYS 87 Ca -0.12 0.06 -0.02 0.00 0.02 0.00 0.00 55.97 55.90 1trm s LYS 87 Cb 0.06 0.11 0.07 0.00 -0.52 0.00 0.00 37.83 37.54 1trm s LYS 87 CO 0.78 -0.04 0.04 0.42 -0.92 0.00 0.00 175.35 175.63 1trm s ILE 88 N -0.26 0.64 -0.33 2.17 1.01 -1.26 -1.19 121.20 121.98 1trm s ILE 88 Ca -0.03 -0.75 0.03 0.00 0.00 0.00 0.00 60.65 59.89 1trm s ILE 88 Cb -0.03 -1.19 0.09 0.00 0.01 0.00 0.00 42.46 41.34 1trm s ILE 88 CO 0.00 -0.29 0.03 -0.63 0.00 0.00 0.00 174.94 174.06 1trm s ILE 89 N 1.79 2.37 0.42 2.92 1.01 0.21 -5.00 121.20 124.92 1trm s ILE 89 Ca 0.01 -2.17 -0.22 0.00 0.00 0.00 0.00 60.65 58.27 1trm s ILE 89 Cb -0.17 -2.67 -0.10 0.00 0.01 0.00 0.00 42.46 39.53 1trm s ILE 89 CO -0.11 -0.49 0.98 -0.54 0.00 0.00 0.00 174.94 174.78 1trm s LYS 90 N 0.97 4.17 0.25 2.79 1.02 -1.26 -1.20 119.74 126.48 1trm s LYS 90 Ca 0.07 1.26 -0.31 0.00 0.02 0.00 0.00 55.97 57.00 1trm s LYS 90 Cb -0.20 -2.29 -0.12 0.00 -0.52 0.00 0.00 37.83 34.70 1trm s LYS 90 CO -0.07 -0.09 1.63 1.58 -0.92 0.00 0.00 175.35 177.48 1trm n HIS 91 N -0.47 2.72 -0.24 3.18 -0.00 -1.03 -4.84 115.22 114.54 1trm n HIS 91 Ca 0.07 0.19 0.23 0.00 -0.00 0.00 0.00 57.72 58.21 1trm n HIS 91 Cb 0.53 -2.61 0.59 0.00 -0.00 0.00 0.00 29.99 28.49 1trm n HIS 91 CO 0.00 0.00 0.00 -1.35 -0.00 0.00 0.00 176.34 174.99 1trm h PRO 92 N 5.57 0.25 -0.63 1.57 0.11 -1.93 -1.06 132.00 135.87 1trm h PRO 92 Ca -0.45 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.64 1trm h PRO 92 Cb 1.22 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.28 1trm h PRO 92 CO 0.86 0.17 0.00 0.09 -0.21 0.00 0.00 178.00 178.90 1trm n ASN 93 N -4.44 4.03 -4.64 -2.05 4.13 -1.26 -4.95 115.26 106.08 1trm n ASN 93 Ca 0.20 -2.39 -0.48 0.00 1.68 0.00 0.00 54.58 53.59 1trm n ASN 93 Cb 0.84 -0.53 -0.05 0.00 -1.54 0.00 0.00 39.78 38.50 1trm n ASN 93 CO 0.00 0.00 0.00 0.33 0.28 0.00 0.00 177.26 177.87 1trm n PHE 94 N 0.85 2.02 -3.93 3.10 -0.00 -0.41 -4.63 117.46 114.46 1trm n PHE 94 Ca 0.21 0.40 -0.29 0.00 -0.00 0.00 0.00 57.45 57.77 1trm n PHE 94 Cb 0.77 -2.47 -0.16 0.00 -0.00 0.00 0.00 39.48 37.62 1trm n PHE 94 CO 0.00 0.00 0.00 0.34 -0.00 0.00 0.00 176.76 177.10 1trm s ASP 95 N 0.70 3.11 0.30 -2.13 2.15 -1.06 -4.99 116.67 114.75 1trm s ASP 95 Ca 0.79 -0.78 -0.01 0.00 0.43 0.00 0.00 52.55 52.97 1trm s ASP 95 Cb -0.76 -1.04 0.45 0.00 -0.30 0.00 0.00 42.92 41.28 1trm s ASP 95 CO 0.42 -0.18 1.94 0.08 -0.17 0.00 0.00 175.17 177.26 1trm h ARG 96 N 8.06 0.99 0.26 4.34 0.11 -1.93 0.71 114.38 126.93 1trm h ARG 96 Ca -0.25 -0.09 -0.01 0.00 0.10 0.00 0.00 59.98 59.73 1trm h ARG 96 Cb 1.10 -0.21 0.00 0.00 1.11 0.00 0.00 29.97 31.98 1trm h ARG 96 CO 0.43 0.71 -0.13 -0.22 0.10 0.00 0.00 179.97 180.86 1trm h LYS 97 N 1.01 -0.34 0.00 0.08 3.64 -1.98 -3.33 116.57 115.65 1trm h LYS 97 Ca 0.26 0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.66 1trm h LYS 97 Cb -0.02 0.08 0.00 0.00 -0.41 0.00 0.00 32.23 31.88 1trm h LYS 97 CO -0.05 -0.01 -0.46 0.25 -2.27 0.00 0.00 179.45 176.92 1trm n THR 98 N -5.02 0.26 -1.34 1.00 -2.24 -1.21 -4.95 114.28 100.78 1trm n THR 98 Ca -0.08 -0.18 -0.12 0.00 -2.27 0.00 0.00 64.05 61.40 1trm n THR 98 Cb 0.25 -0.13 -0.05 0.00 -2.10 0.00 0.00 70.33 68.30 1trm n THR 98 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1trm n LEU 99 N -1.92 -0.73 -4.78 3.22 4.77 0.25 -4.99 117.00 112.82 1trm n LEU 99 Ca 0.04 0.29 -0.36 0.00 -0.03 0.00 0.00 56.01 55.95 1trm n LEU 99 Cb 0.40 -2.06 -0.02 0.00 -2.33 0.00 0.00 43.42 39.41 1trm n LEU 99 CO 0.34 -0.73 0.79 0.21 -1.33 0.00 0.00 177.39 176.67 1trm s ASN 100 N -2.70 6.26 -1.33 -1.43 2.47 -1.19 -2.90 114.94 114.11 1trm s ASN 100 Ca 0.00 2.19 -0.06 0.00 0.42 0.00 0.00 52.86 55.41 1trm s ASN 100 Cb 0.00 -2.59 0.02 0.00 -1.45 0.00 0.00 41.25 37.23 1trm s ASN 100 CO 0.00 -0.85 1.04 0.59 -3.72 0.00 0.00 177.10 174.17 1trm n ASN 101 N -0.55 -4.23 -4.57 -4.21 5.03 -1.26 -2.55 115.26 102.91 1trm n ASN 101 Ca 0.08 -0.63 -0.42 0.00 0.87 0.00 0.00 54.58 54.47 1trm n ASN 101 Cb 0.49 -4.78 -0.01 0.00 -1.02 0.00 0.00 39.78 34.46 1trm n ASN 101 CO 0.00 0.00 0.00 0.21 -1.83 0.00 0.00 177.26 175.64 1trm s ASN 102 N -3.75 6.70 0.02 6.41 2.47 -1.14 -4.26 114.94 121.39 1trm s ASN 102 Ca 0.35 -2.05 -0.12 0.00 0.42 0.00 0.00 52.86 51.47 1trm s ASN 102 Cb -0.16 -2.57 0.01 0.00 -1.45 0.00 0.00 41.25 37.08 1trm s ASN 102 CO 0.75 -1.30 0.26 -0.51 -3.72 0.00 0.00 177.10 172.59 1trm s ILE 103 N 4.44 0.08 0.10 -5.21 2.07 -1.26 -4.21 121.20 117.20 1trm s ILE 103 Ca 0.50 -0.68 -0.17 0.00 -1.41 0.00 0.00 60.65 58.89 1trm s ILE 103 Cb 0.02 -0.78 0.04 0.00 0.13 0.00 0.00 42.46 41.86 1trm s ILE 103 CO 0.00 -0.37 0.42 -0.32 -1.91 0.00 0.00 174.94 172.76 1trm s MET 104 N -2.08 1.03 0.02 3.50 -2.45 -0.40 -2.47 119.30 116.45 1trm s MET 104 Ca -0.09 -0.56 0.08 0.00 -1.25 0.00 0.00 55.69 53.88 1trm s MET 104 Cb -0.03 0.46 -0.02 0.00 1.25 0.00 0.00 34.83 36.48 1trm s MET 104 CO -0.01 -0.39 -0.24 -0.51 1.05 0.00 0.00 175.02 174.92 1trm s LEU 105 N -2.49 2.12 -0.10 4.11 1.43 -0.34 -1.63 118.68 121.77 1trm s LEU 105 Ca -0.00 -0.51 0.01 0.00 -1.03 0.00 0.00 54.13 52.60 1trm s LEU 105 Cb 0.01 -1.20 0.02 0.00 0.03 0.00 0.00 46.19 45.05 1trm s LEU 105 CO -0.08 0.25 -0.13 -0.63 0.23 0.00 0.00 176.35 175.99 1trm s ILE 106 N -0.70 1.32 -0.29 -0.59 1.01 0.20 -0.62 121.20 121.52 1trm s ILE 106 Ca 0.10 -0.52 -0.11 0.00 0.00 0.00 0.00 60.65 60.12 1trm s ILE 106 Cb -0.09 -1.23 -0.04 0.00 0.01 0.00 0.00 42.46 41.10 1trm s ILE 106 CO 0.01 0.41 0.19 -0.75 0.00 0.00 0.00 174.94 174.80 1trm s LYS 107 N 1.15 3.88 0.43 2.79 2.20 -0.33 -0.04 119.74 129.81 1trm s LYS 107 Ca -0.04 -0.37 -0.24 0.00 -0.36 0.00 0.00 55.97 54.96 1trm s LYS 107 Cb -0.14 -3.67 -0.08 0.00 -1.51 0.00 0.00 37.83 32.42 1trm s LYS 107 CO -0.03 -0.22 1.15 -0.51 -0.36 0.00 0.00 175.35 175.38 1trm s LEU 108 N 1.75 4.08 0.46 5.43 1.02 0.16 0.19 118.68 131.78 1trm s LEU 108 Ca 0.07 2.28 0.22 0.00 0.02 0.00 0.00 54.13 56.72 1trm s LEU 108 Cb -0.16 -4.17 1.23 0.00 0.02 0.00 0.00 46.19 43.11 1trm s LEU 108 CO 0.11 -0.79 1.88 -1.28 0.02 0.00 0.00 176.35 176.29 1trm h SER 109 N 2.27 0.25 -5.19 2.29 0.87 -0.92 -3.42 113.55 109.70 1trm h SER 109 Ca -0.49 0.02 -0.09 0.00 -1.23 0.00 0.00 61.79 60.01 1trm h SER 109 Cb 1.24 -0.02 -0.13 0.00 -0.44 0.00 0.00 62.40 63.05 1trm h SER 109 CO 0.61 0.10 -0.30 -0.94 -0.53 0.00 0.00 176.83 175.77 1trm s SER 110 N -5.72 0.04 0.29 6.23 1.04 -1.26 -5.00 113.70 109.31 1trm s SER 110 Ca -0.07 -0.70 -0.29 0.00 0.48 0.00 0.00 55.95 55.37 1trm s SER 110 Cb 0.22 0.40 -0.10 0.00 0.10 0.00 0.00 66.02 66.64 1trm s SER 110 CO 0.77 -0.82 1.30 -2.16 0.98 0.00 0.00 173.24 173.31 1trm s PRO 111 N -3.90 4.38 0.82 4.02 0.05 -1.26 -4.82 135.00 134.30 1trm s PRO 111 Ca 0.10 2.15 -0.12 0.00 0.05 0.00 0.00 61.00 63.18 1trm s PRO 111 Cb 0.04 -3.11 0.18 0.00 0.05 0.00 0.00 34.50 31.66 1trm s PRO 111 CO -0.06 -0.18 1.12 1.33 0.05 0.00 0.00 177.00 179.25 1trm n VAL 112 N 1.37 0.00 -3.61 -0.36 0.24 0.58 -5.00 118.33 111.55 1trm n VAL 112 Ca 0.02 -0.98 -0.38 0.00 -2.04 0.00 0.00 64.34 60.96 1trm n VAL 112 Cb 0.42 -1.44 -0.11 0.00 -1.47 0.00 0.00 33.84 31.24 1trm n VAL 112 CO 0.00 0.00 0.00 -0.75 -2.14 0.00 0.00 176.83 173.94 1trm s LYS 113 N -5.41 3.83 -0.15 7.34 2.36 -1.26 -4.97 119.74 121.49 1trm s LYS 113 Ca 0.65 -0.39 -0.27 0.00 -2.55 0.00 0.00 55.97 53.41 1trm s LYS 113 Cb -0.02 -3.62 -0.01 0.00 -1.05 0.00 0.00 37.83 33.13 1trm s LYS 113 CO 0.45 -0.22 0.91 -0.51 1.55 0.00 0.00 175.35 177.53 1trm s LEU 114 N 1.73 4.20 0.00 5.43 1.43 -1.26 -4.70 118.68 125.50 1trm s LEU 114 Ca 0.07 1.32 -0.00 0.00 -1.03 0.00 0.00 54.13 54.49 1trm s LEU 114 Cb -0.16 -3.37 0.00 0.00 0.03 0.00 0.00 46.19 42.69 1trm s LEU 114 CO 0.10 -0.44 0.08 -0.46 0.23 0.00 0.00 176.35 175.86 1trm n ASN 115 N 5.23 -0.21 0.31 2.29 2.04 -0.15 -4.98 115.26 119.79 1trm n ASN 115 Ca 0.07 -1.31 0.19 0.00 -0.44 0.00 0.00 54.58 53.09 1trm n ASN 115 Cb 0.49 0.40 0.97 0.00 -2.53 0.00 0.00 39.78 39.11 1trm n ASN 115 CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 1trm h ALA 116 N 1.50 1.05 0.00 -2.53 0.00 -1.99 -2.88 119.26 114.43 1trm h ALA 116 Ca -0.04 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.85 1trm h ALA 116 Cb 0.19 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.98 1trm h ALA 116 CO 0.06 0.02 -1.51 2.89 0.00 0.00 0.00 179.25 180.71 1trm n ARG 117 N -3.18 0.78 -3.82 0.00 1.85 -1.26 -4.81 116.66 106.22 1trm n ARG 117 Ca -0.02 -0.11 -0.29 0.00 -1.00 0.00 0.00 57.85 56.42 1trm n ARG 117 Cb 0.17 -1.38 -0.16 0.00 -1.05 0.00 0.00 32.46 30.05 1trm n ARG 117 CO 0.00 0.00 0.00 0.08 -0.01 0.00 0.00 177.63 177.70 1trm s VAL 118 N -3.03 1.09 -0.01 8.89 1.01 -1.09 -3.84 120.40 123.42 1trm s VAL 118 Ca -0.03 -1.20 -0.08 0.00 0.00 0.00 0.00 61.98 60.67 1trm s VAL 118 Cb 0.12 -1.62 0.01 0.00 0.00 0.00 0.00 36.38 34.88 1trm s VAL 118 CO 0.71 -0.38 0.17 0.00 0.00 0.00 0.00 175.10 175.60 1trm s ALA 119 N 1.56 -0.41 0.93 5.51 0.00 -1.18 -0.97 121.76 127.20 1trm s ALA 119 Ca 0.02 0.04 -0.12 0.00 0.00 0.00 0.00 51.96 51.91 1trm s ALA 119 Cb -0.18 0.03 0.15 0.00 0.00 0.00 0.00 23.12 23.12 1trm s ALA 119 CO -0.14 -0.19 1.09 0.99 0.00 0.00 0.00 175.76 177.51 1trm s THR 120 N -1.12 2.51 -0.08 0.00 2.01 -1.26 -3.13 115.64 114.57 1trm s THR 120 Ca -0.12 0.17 0.04 0.00 0.31 0.00 0.00 61.69 62.08 1trm s THR 120 Cb -0.06 -2.55 -0.01 0.00 0.01 0.00 0.00 72.50 69.88 1trm s THR 120 CO 0.02 -0.22 -0.20 0.54 -0.69 0.00 0.00 174.62 174.07 1trm s VAL 121 N -2.85 2.51 0.94 3.82 0.11 -0.22 -4.78 120.40 119.94 1trm s VAL 121 Ca 0.64 -0.89 -0.12 0.00 -2.93 0.00 0.00 61.98 58.69 1trm s VAL 121 Cb -0.19 -1.97 0.15 0.00 -1.53 0.00 0.00 36.38 32.84 1trm s VAL 121 CO 0.58 0.56 1.09 0.00 -3.33 0.00 0.00 175.10 174.00 1trm s ALA 122 N -0.07 1.25 0.15 1.54 0.00 -1.26 -4.61 121.76 118.77 1trm s ALA 122 Ca -0.05 -0.05 0.04 0.00 0.00 0.00 0.00 51.96 51.90 1trm s ALA 122 Cb -0.14 -3.21 -0.04 0.00 0.00 0.00 0.00 23.12 19.73 1trm s ALA 122 CO 0.04 -2.60 0.18 -0.51 0.00 0.00 0.00 175.76 172.87 1trm s LEU 123 N -6.39 3.98 0.55 0.00 1.43 -1.26 -1.74 118.68 115.25 1trm s LEU 123 Ca 0.64 -0.02 -0.21 0.00 -1.03 0.00 0.00 54.13 53.51 1trm s LEU 123 Cb -0.19 -2.58 -0.05 0.00 0.03 0.00 0.00 46.19 43.40 1trm s LEU 123 CO 0.58 0.07 1.30 -2.84 0.23 0.00 0.00 176.35 175.69 1trm s PRO 124 N -3.09 3.16 0.02 1.29 0.01 -1.26 -4.77 135.00 130.37 1trm s PRO 124 Ca 0.32 2.08 0.25 0.00 0.01 0.00 0.00 61.00 63.66 1trm s PRO 124 Cb -0.11 -2.19 0.50 0.00 0.01 0.00 0.00 34.50 32.71 1trm s PRO 124 CO 0.25 -1.12 1.41 0.43 0.01 0.00 0.00 177.00 177.98 1trm n SER 125 N -1.10 0.51 -2.59 2.53 7.64 -1.26 -5.04 113.62 114.31 1trm n SER 125 Ca 0.11 -0.13 -0.02 0.00 1.01 0.00 0.00 58.87 59.84 1trm n SER 125 Cb 0.47 0.21 0.01 0.00 -1.01 0.00 0.00 64.21 63.88 1trm n SER 125 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 1trm n SER 127 N -1.64 -1.17 -4.88 6.43 3.41 -1.26 -5.13 113.62 109.38 1trm n SER 127 Ca 0.05 -1.60 -0.34 0.00 -0.26 0.00 0.00 58.87 56.72 1trm n SER 127 Cb 0.36 1.91 -0.05 0.00 -0.26 0.00 0.00 64.21 66.16 1trm n SER 127 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1trm s ALA 129 N -1.45 3.46 0.72 0.00 0.00 -1.26 -5.03 121.76 118.21 1trm s ALA 129 Ca 0.34 1.03 -0.11 0.00 0.00 0.00 0.00 51.96 53.22 1trm s ALA 129 Cb -0.13 -3.42 0.03 0.00 0.00 0.00 0.00 23.12 19.60 1trm s ALA 129 CO 0.19 -0.41 1.10 -1.25 0.00 0.00 0.00 175.76 175.39 1trm s PRO 130 N -0.79 2.59 0.56 0.00 0.04 -1.26 -4.94 135.00 131.19 1trm s PRO 130 Ca 0.51 0.28 -0.20 0.00 0.04 0.00 0.00 61.00 61.63 1trm s PRO 130 Cb -0.35 -2.03 -0.05 0.00 0.04 0.00 0.00 34.50 32.11 1trm s PRO 130 CO 0.41 -1.17 1.14 0.00 0.04 0.00 0.00 177.00 177.43 1trm n ALA 132 N -3.05 0.78 0.00 8.56 0.00 -1.26 -1.43 120.51 124.11 1trm n ALA 132 Ca 0.07 0.08 0.00 0.00 0.00 0.00 0.00 53.44 53.59 1trm n ALA 132 Cb 0.58 -2.22 0.00 0.00 0.00 0.00 0.00 19.45 17.82 1trm n ALA 132 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1trm n GLY 133 N 1.05 3.19 3.71 0.00 0.00 0.46 -4.95 105.19 108.65 1trm n GLY 133 Ca 0.12 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.74 1trm n GLY 133 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1trm n THR 134 N -1.74 2.91 -3.04 2.61 -1.04 -0.52 -4.70 114.28 108.76 1trm n THR 134 Ca 0.00 -0.50 -0.41 0.00 -2.04 0.00 0.00 64.05 61.10 1trm n THR 134 Cb 0.00 -1.61 -0.06 0.00 -1.82 0.00 0.00 70.33 66.85 1trm n THR 134 CO 0.00 0.00 0.00 -1.10 -0.64 0.00 0.00 175.07 173.33 1trm s GLN 135 N -2.41 4.14 0.22 -2.82 -1.52 -1.26 -1.04 119.66 114.97 1trm s GLN 135 Ca 0.64 0.68 0.10 0.00 -1.95 0.00 0.00 55.36 54.83 1trm s GLN 135 Cb -0.47 -3.64 -0.05 0.00 -0.22 0.00 0.00 33.01 28.63 1trm s GLN 135 CO 0.56 -0.43 -0.20 0.00 -0.25 0.00 0.00 175.29 174.97 1trm s LEU 137 N -3.08 3.88 -0.04 0.00 2.96 0.14 -1.74 118.68 120.80 1trm s LEU 137 Ca 0.23 0.05 0.06 0.00 -0.22 0.00 0.00 54.13 54.25 1trm s LEU 137 Cb -0.05 -2.01 -0.02 0.00 0.50 0.00 0.00 46.19 44.60 1trm s LEU 137 CO 0.11 0.10 -0.19 -0.63 -1.32 0.00 0.00 176.35 174.42 1trm s ILE 138 N 0.80 2.61 0.08 6.68 1.01 0.26 -1.23 121.20 131.41 1trm s ILE 138 Ca 0.05 -0.90 -0.05 0.00 0.00 0.00 0.00 60.65 59.75 1trm s ILE 138 Cb -0.13 -1.98 -0.02 0.00 0.01 0.00 0.00 42.46 40.34 1trm s ILE 138 CO 0.02 0.59 0.10 -0.94 0.00 0.00 0.00 174.94 174.71 1trm s SER 139 N -0.67 0.27 0.00 3.58 1.04 -1.20 -0.58 113.70 116.13 1trm s SER 139 Ca 0.11 -0.82 0.00 0.00 0.48 0.00 0.00 55.95 55.72 1trm s SER 139 Cb -0.10 0.29 0.00 0.00 0.10 0.00 0.00 66.02 66.31 1trm s SER 139 CO -0.00 -0.69 0.00 0.61 0.98 0.00 0.00 173.24 174.14 1trm n GLY 140 N -0.00 0.30 1.81 7.32 0.00 -0.90 -4.40 105.19 109.32 1trm n GLY 140 Ca -0.14 -1.02 -0.14 0.00 0.00 0.00 0.00 46.02 44.72 1trm n GLY 140 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1trm n TRP 141 N -0.44 1.93 -2.37 1.61 8.01 -1.26 -1.43 117.44 123.50 1trm n TRP 141 Ca 0.00 -2.01 -0.26 0.00 -1.31 0.00 0.00 57.50 53.93 1trm n TRP 141 Cb 0.00 -0.30 0.13 0.00 -2.01 0.00 0.00 31.31 29.13 1trm n TRP 141 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.69 176.88 1trm s GLY 142 N -3.50 1.77 0.31 6.99 0.00 -1.23 -4.58 107.32 107.08 1trm s GLY 142 Ca 0.45 -1.55 -0.29 0.00 0.00 0.00 0.00 44.72 43.32 1trm s GLY 142 CO 0.00 -0.92 1.40 -2.01 0.00 0.00 0.00 173.10 171.58 1trm n ASN 143 N -3.15 3.08 -1.11 1.64 5.15 -0.20 -3.45 115.26 117.22 1trm n ASN 143 Ca 0.15 1.18 0.10 0.00 -0.60 0.00 0.00 54.58 55.41 1trm n ASN 143 Cb 0.60 -1.50 0.25 0.00 -0.53 0.00 0.00 39.78 38.60 1trm n ASN 143 CO 0.00 0.00 0.00 0.35 1.40 0.00 0.00 177.26 179.01 1trm n THR 144 N 1.16 0.84 -4.21 -0.44 -2.24 -1.04 -0.32 114.28 108.02 1trm n THR 144 Ca 0.07 -0.92 -0.18 0.00 -2.27 0.00 0.00 64.05 60.75 1trm n THR 144 Cb 0.35 0.65 -0.12 0.00 -2.10 0.00 0.00 70.33 69.11 1trm n THR 144 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 1trm s LEU 145 N -1.11 2.24 0.19 3.22 1.43 -1.26 -4.19 118.68 119.20 1trm s LEU 145 Ca 0.39 -0.56 -0.04 0.00 -1.03 0.00 0.00 54.13 52.89 1trm s LEU 145 Cb 0.21 -0.51 0.12 0.00 0.03 0.00 0.00 46.19 46.04 1trm s LEU 145 CO 0.28 -0.05 1.54 -1.28 0.23 0.00 0.00 176.35 177.07 1trm h SER 146 N 4.52 0.71 -3.43 2.29 0.87 -1.94 -3.43 113.55 113.13 1trm h SER 146 Ca -0.39 -0.33 -0.30 0.00 -1.23 0.00 0.00 61.79 59.53 1trm h SER 146 Cb 1.19 -0.20 -0.35 0.00 -0.44 0.00 0.00 62.40 62.60 1trm h SER 146 CO 0.41 1.05 -0.70 -0.55 -0.53 0.00 0.00 176.83 176.51 1trm s SER 147 N -6.87 0.30 0.00 6.23 0.15 -1.26 -4.59 113.70 107.67 1trm s SER 147 Ca -0.08 0.11 0.00 0.00 0.70 0.00 0.00 55.95 56.68 1trm s SER 147 Cb 0.12 -0.02 0.00 0.00 -1.71 0.00 0.00 66.02 64.41 1trm s SER 147 CO 0.84 -0.17 0.00 0.61 1.20 0.00 0.00 173.24 175.73 1trm n GLY 148 N 4.50 -2.40 3.30 9.45 0.00 -1.26 -5.00 105.19 113.78 1trm n GLY 148 Ca -0.21 -2.00 -0.32 0.00 0.00 0.00 0.00 46.02 43.49 1trm n GLY 148 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1trm s VAL 149 N -0.28 2.34 -0.33 1.61 1.01 -1.26 -4.69 120.40 118.80 1trm s VAL 149 Ca 0.00 -0.95 0.06 0.00 0.00 0.00 0.00 61.98 61.09 1trm s VAL 149 Cb 0.00 -1.89 0.19 0.00 0.00 0.00 0.00 36.38 34.68 1trm s VAL 149 CO 0.00 0.56 0.63 0.21 0.00 0.00 0.00 175.10 176.50 1trm s ASN 150 N -0.04 -1.54 -0.21 3.32 2.47 -1.26 -5.02 114.94 112.66 1trm s ASN 150 Ca -0.06 -0.15 -0.15 0.00 0.42 0.00 0.00 52.86 52.92 1trm s ASN 150 Cb -0.15 1.96 -0.04 0.00 -1.45 0.00 0.00 41.25 41.57 1trm s ASN 150 CO 0.05 -0.24 0.38 -1.61 -3.72 0.00 0.00 177.10 171.95 1trm s GLU 151 N 2.49 4.15 0.79 0.43 2.02 -1.26 -2.48 118.70 124.85 1trm s GLU 151 Ca 0.13 0.15 -0.12 0.00 0.02 0.00 0.00 54.97 55.15 1trm s GLU 151 Cb -0.07 -3.54 0.07 0.00 0.10 0.00 0.00 34.13 30.68 1trm s GLU 151 CO -0.19 -0.05 1.10 -1.25 0.02 0.00 0.00 175.26 174.89 1trm s PRO 152 N 1.34 2.11 -0.22 0.39 0.04 -1.26 -5.01 135.00 132.39 1trm s PRO 152 Ca 0.18 0.59 0.11 0.00 0.04 0.00 0.00 61.00 61.92 1trm s PRO 152 Cb -0.15 -1.93 -0.22 0.00 0.04 0.00 0.00 34.50 32.25 1trm s PRO 152 CO 0.08 -1.59 -0.03 -0.25 0.04 0.00 0.00 177.00 175.25 1trm n ASP 153 N -3.40 0.85 -4.88 6.66 8.00 -1.26 -4.88 116.55 117.63 1trm n ASP 153 Ca 0.07 -0.04 -0.33 0.00 0.71 0.00 0.00 54.79 55.19 1trm n ASP 153 Cb 0.57 0.38 -0.05 0.00 -0.02 0.00 0.00 41.12 42.00 1trm n ASP 153 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1trm s LEU 154 N -5.94 4.31 0.09 0.64 1.43 -1.26 -0.48 118.68 117.46 1trm s LEU 154 Ca -0.20 0.71 -0.31 0.00 -1.03 0.00 0.00 54.13 53.30 1trm s LEU 154 Cb 0.07 -3.13 -0.07 0.00 0.03 0.00 0.00 46.19 43.09 1trm s LEU 154 CO 0.74 0.12 1.38 -0.22 0.23 0.00 0.00 176.35 178.60 1trm s LEU 155 N -2.24 4.36 0.14 1.79 2.96 -1.13 -4.88 118.68 119.68 1trm s LEU 155 Ca 0.37 2.27 -0.04 0.00 -0.22 0.00 0.00 54.13 56.51 1trm s LEU 155 Cb -0.13 -3.58 -0.05 0.00 0.50 0.00 0.00 46.19 42.93 1trm s LEU 155 CO 0.20 -0.66 0.36 -1.10 -1.32 0.00 0.00 176.35 173.84 1trm s GLN 156 N 1.37 3.59 0.09 1.98 -1.52 -0.52 -0.37 119.66 124.28 1trm s GLN 156 Ca 0.64 -0.15 0.09 0.00 -1.95 0.00 0.00 55.36 53.99 1trm s GLN 156 Cb -0.35 -2.87 -0.03 0.00 -0.22 0.00 0.00 33.01 29.53 1trm s GLN 156 CO 0.30 0.48 -0.22 0.00 -0.25 0.00 0.00 175.29 175.59 1trm s LEU 158 N -1.75 -0.44 -0.24 0.00 2.96 0.25 -0.10 118.68 119.35 1trm s LEU 158 Ca 0.08 0.56 -0.18 0.00 -0.22 0.00 0.00 54.13 54.38 1trm s LEU 158 Cb -0.10 0.93 -0.03 0.00 0.50 0.00 0.00 46.19 47.49 1trm s LEU 158 CO 0.04 -0.26 0.51 -1.81 -1.32 0.00 0.00 176.35 173.52 1trm s ASP 159 N 2.49 6.47 0.00 3.68 -0.00 -1.26 -0.58 116.67 127.47 1trm s ASP 159 Ca 0.03 0.56 -0.20 0.00 -0.00 0.00 0.00 52.55 52.94 1trm s ASP 159 Cb -0.13 -2.28 0.04 0.00 -0.00 0.00 0.00 42.92 40.55 1trm s ASP 159 CO -0.11 -0.25 0.45 0.00 -0.00 0.00 0.00 175.17 175.25 1trm s ALA 160 N 2.10 -1.13 0.18 5.23 0.00 -0.71 -4.99 121.76 122.44 1trm s ALA 160 Ca 0.22 0.57 0.08 0.00 0.00 0.00 0.00 51.96 52.83 1trm s ALA 160 Cb -0.16 0.17 -0.04 0.00 0.00 0.00 0.00 23.12 23.10 1trm s ALA 160 CO 0.09 -0.37 -0.01 -1.25 0.00 0.00 0.00 175.76 174.22 1trm s PRO 161 N -1.76 2.36 0.42 0.00 0.04 -1.26 0.39 135.00 135.20 1trm s PRO 161 Ca -0.10 -1.14 -0.24 0.00 0.04 0.00 0.00 61.00 59.56 1trm s PRO 161 Cb -0.02 -2.32 -0.08 0.00 0.04 0.00 0.00 34.50 32.11 1trm s PRO 161 CO 0.03 0.45 1.17 -0.51 0.04 0.00 0.00 177.00 178.18 1trm s LEU 162 N -2.98 4.12 0.15 -3.56 1.02 -0.21 -1.84 118.68 115.38 1trm s LEU 162 Ca 0.27 2.33 0.03 0.00 0.02 0.00 0.00 54.13 56.79 1trm s LEU 162 Cb -0.09 -4.11 -0.04 0.00 0.02 0.00 0.00 46.19 41.97 1trm s LEU 162 CO 0.18 -0.77 0.24 -0.76 0.02 0.00 0.00 176.35 175.26 1trm s LEU 163 N -2.71 4.17 0.50 1.79 1.43 -0.53 -0.40 118.68 122.93 1trm s LEU 163 Ca 0.60 0.08 -0.24 0.00 -1.03 0.00 0.00 54.13 53.54 1trm s LEU 163 Cb -0.30 -2.75 -0.07 0.00 0.03 0.00 0.00 46.19 43.10 1trm s LEU 163 CO 0.37 0.06 1.40 -2.84 0.23 0.00 0.00 176.35 175.57 1trm s PRO 164 N -3.20 3.41 0.30 1.29 0.02 -1.26 -4.63 135.00 130.92 1trm s PRO 164 Ca 0.33 2.35 0.05 0.00 0.02 0.00 0.00 61.00 63.76 1trm s PRO 164 Cb -0.11 -2.46 0.72 0.00 0.02 0.00 0.00 34.50 32.67 1trm s PRO 164 CO 0.27 -1.01 1.79 0.37 -0.33 0.00 0.00 177.00 178.08 1trm h GLN 165 N 1.89 0.77 -0.73 5.54 5.75 -1.97 -1.24 115.11 125.12 1trm h GLN 165 Ca -0.51 -0.05 0.16 0.00 -0.15 0.00 0.00 58.65 58.10 1trm h GLN 165 Cb 1.28 -0.17 -0.11 0.00 1.07 0.00 0.00 27.48 29.55 1trm h GLN 165 CO 0.59 0.51 0.20 0.00 -2.65 0.00 0.00 178.83 177.48 1trm h ALA 166 N 1.63 0.96 -0.33 3.38 0.00 -1.99 0.43 119.26 123.35 1trm h ALA 166 Ca 0.57 0.16 -0.18 0.00 0.00 0.00 0.00 54.91 55.46 1trm h ALA 166 Cb 0.84 0.20 -0.00 0.00 0.00 0.00 0.00 17.79 18.84 1trm h ALA 166 CO -0.36 -0.32 -0.49 -0.44 0.00 0.00 0.00 179.25 177.65 1trm h ASP 167 N 0.30 0.99 0.32 0.00 3.45 -1.82 -1.38 116.42 118.27 1trm h ASP 167 Ca 0.41 -0.51 -0.02 0.00 0.43 0.00 0.00 57.03 57.35 1trm h ASP 167 Cb 0.69 -0.28 0.00 0.00 -0.56 0.00 0.00 39.33 39.18 1trm h ASP 167 CO -0.49 1.31 -0.15 0.00 -1.57 0.00 0.00 179.24 178.34 1trm h GLU 169 N -0.64 0.31 -0.04 0.00 5.08 -0.27 -2.15 114.58 116.86 1trm h GLU 169 Ca -0.04 -0.03 -0.16 0.00 -1.00 0.00 0.00 59.36 58.13 1trm h GLU 169 Cb 0.46 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.62 1trm h GLU 169 CO 0.07 0.24 -0.68 0.00 -1.00 0.00 0.00 179.01 177.64 1trm h ALA 170 N 1.82 0.78 -0.72 3.43 0.00 -1.15 -2.88 119.26 120.53 1trm h ALA 170 Ca 0.08 -0.60 -0.05 0.00 0.00 0.00 0.00 54.91 54.34 1trm h ALA 170 Cb 0.02 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.69 1trm h ALA 170 CO -0.01 0.79 0.24 0.77 0.00 0.00 0.00 179.25 181.04 1trm h SER 171 N 0.13 1.04 -2.22 0.00 0.02 -0.96 -3.35 113.55 108.21 1trm h SER 171 Ca -0.02 -0.20 -0.57 0.00 -0.84 0.00 0.00 61.79 60.16 1trm h SER 171 Cb 1.22 -0.27 -0.42 0.00 0.14 0.00 0.00 62.40 63.07 1trm h SER 171 CO 0.10 0.96 -0.75 -1.22 -1.14 0.00 0.00 176.83 174.79 1trm n TYR 172 N -4.29 3.19 -0.84 3.45 4.02 -1.02 -4.97 117.16 116.70 1trm n TYR 172 Ca 0.06 -3.98 -0.29 0.00 -0.01 0.00 0.00 57.90 53.68 1trm n TYR 172 Cb 0.22 -0.48 -0.08 0.00 -0.02 0.00 0.00 39.34 38.97 1trm n TYR 172 CO 0.00 0.00 0.00 -0.35 -1.01 0.00 0.00 176.86 175.50 1trm n PRO 173 N 0.05 0.00 -1.02 -0.72 -0.04 -1.10 0.63 135.00 132.79 1trm n PRO 173 Ca 0.29 0.00 -0.01 0.00 -0.04 0.00 0.00 63.50 63.75 1trm n PRO 173 Cb 0.44 -0.90 -0.00 0.00 -0.04 0.00 0.00 33.50 33.00 1trm n PRO 173 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1trm n GLY 174 N 4.16 0.40 1.02 0.55 0.00 -1.26 -4.88 105.19 105.19 1trm n GLY 174 Ca 0.37 -0.09 0.12 0.00 0.00 0.00 0.00 46.02 46.42 1trm n GLY 174 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1trm n LYS 175 N -1.81 2.35 -5.08 1.61 2.85 0.20 -4.98 118.16 113.31 1trm n LYS 175 Ca -0.01 -2.05 -0.29 0.00 -1.05 0.00 0.00 58.31 54.91 1trm n LYS 175 Cb 0.17 -1.47 -0.16 0.00 -0.65 0.00 0.00 35.03 32.92 1trm n LYS 175 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 177.40 177.77 1trm s ILE 176 N -1.76 1.76 0.56 0.58 -1.09 -1.25 -5.06 121.20 114.94 1trm s ILE 176 Ca 0.32 -0.92 0.04 0.00 -2.23 0.00 0.00 60.65 57.87 1trm s ILE 176 Cb 0.21 -1.49 0.04 0.00 -1.58 0.00 0.00 42.46 39.64 1trm s ILE 176 CO 0.30 0.50 0.37 0.42 -1.23 0.00 0.00 174.94 175.29 1trm s THR 177 N -0.18 1.46 -0.73 2.92 -4.23 -1.26 -5.00 115.64 108.62 1trm s THR 177 Ca -0.01 -1.56 0.21 0.00 -1.18 0.00 0.00 61.69 59.15 1trm s THR 177 Cb -0.12 -2.02 0.20 0.00 1.34 0.00 0.00 72.50 71.90 1trm s THR 177 CO 0.02 0.00 1.63 -0.90 -0.54 0.00 0.00 174.62 174.83 1trm n ASP 178 N -1.75 0.38 -0.83 3.99 3.85 -1.26 -2.94 116.55 117.99 1trm n ASP 178 Ca -0.05 0.58 0.07 0.00 -0.71 0.00 0.00 54.79 54.69 1trm n ASP 178 Cb 0.65 -0.67 0.20 0.00 -1.35 0.00 0.00 41.12 39.95 1trm n ASP 178 CO 0.00 0.00 0.00 -0.46 -1.01 0.00 0.00 177.20 175.73 1trm n ASN 179 N -1.91 3.29 -4.50 -1.12 6.94 -1.26 -4.92 115.26 111.78 1trm n ASN 179 Ca 0.03 -2.12 -0.30 0.00 -0.02 0.00 0.00 54.58 52.17 1trm n ASN 179 Cb 0.23 -0.32 -0.11 0.00 -2.36 0.00 0.00 39.78 37.21 1trm n ASN 179 CO 0.00 0.00 0.00 -0.04 -1.03 0.00 0.00 177.26 176.19 1trm s MET 180 N -1.22 2.04 0.00 -3.83 -1.94 -1.15 -0.09 119.30 113.11 1trm s MET 180 Ca 0.31 -1.03 0.00 0.00 -1.71 0.00 0.00 55.69 53.26 1trm s MET 180 Cb 0.17 -2.22 -0.00 0.00 2.01 0.00 0.00 34.83 34.79 1trm s MET 180 CO 0.18 0.52 -0.01 0.54 -0.01 0.00 0.00 175.02 176.24 1trm s VAL 181 N -1.06 0.09 -0.06 -6.03 0.11 0.21 -4.73 120.40 108.94 1trm s VAL 181 Ca 0.17 -0.16 -0.10 0.00 -2.93 0.00 0.00 61.98 58.97 1trm s VAL 181 Cb -0.11 -0.11 -0.05 0.00 -1.53 0.00 0.00 36.38 34.59 1trm s VAL 181 CO 0.09 -0.04 0.27 0.00 -3.33 0.00 0.00 175.10 172.08 1trm s VAL 183 N -1.08 0.27 -5.00 0.00 1.01 -0.33 -1.45 120.40 113.81 1trm s VAL 183 Ca 0.20 -0.03 0.00 0.00 0.00 0.00 0.00 61.98 62.15 1trm s VAL 183 Cb -0.14 -0.30 0.00 0.00 0.00 0.00 0.00 36.38 35.94 1trm s VAL 183 CO 0.09 0.13 0.00 0.61 0.00 0.00 0.00 175.10 175.93 1trm n GLY 184 N 3.70 0.45 2.91 4.51 0.00 -0.77 -2.14 105.19 113.85 1trm n GLY 184 Ca -0.22 -1.43 -0.18 0.00 0.00 0.00 0.00 46.02 44.18 1trm n GLY 184 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1trm s PHE 184 N -3.82 0.63 0.10 1.61 0.40 -1.26 -4.32 117.98 111.31 1trm s PHE 184 Ca 0.00 -0.14 0.23 0.00 -0.60 0.00 0.00 56.93 56.41 1trm s PHE 184 Cb 0.00 -0.53 0.80 0.00 0.51 0.00 0.00 43.02 43.81 1trm s PHE 184 CO 0.00 -0.12 1.78 -0.07 0.70 0.00 0.00 175.22 177.51 1trm h LEU 185 N 6.78 0.00 -1.36 -0.37 -0.00 -1.96 -3.11 115.31 115.28 1trm h LEU 185 Ca -0.36 0.00 -0.04 0.00 -0.00 0.00 0.00 57.88 57.48 1trm h LEU 185 Cb 1.16 0.00 -0.01 0.00 -0.00 0.00 0.00 40.66 41.82 1trm h LEU 185 CO 0.48 0.26 -0.18 1.05 -0.00 0.00 0.00 178.44 180.06 1trm h GLU 186 N 0.00 0.00 0.00 1.13 9.09 -1.95 1.21 114.58 124.07 1trm h GLU 186 Ca -0.00 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.41 1trm h GLU 186 Cb 0.83 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.93 1trm h GLU 186 CO 0.03 0.18 0.00 0.41 0.05 0.00 0.00 179.01 179.68 1trm n GLY 187 N -0.07 -2.38 3.11 1.06 0.00 -1.18 -4.20 105.19 101.54 1trm n GLY 187 Ca -0.00 -1.79 0.00 0.00 0.00 0.00 0.00 46.02 44.23 1trm n GLY 187 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1trm n GLY 188 N -0.15 2.99 2.73 -0.02 0.00 0.18 -4.91 105.19 106.00 1trm n GLY 188 Ca 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.77 1trm n GLY 188 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1trm s LYS 188 N -0.17 0.49 0.29 1.61 1.02 -1.26 -3.79 119.74 117.93 1trm s LYS 188 Ca 0.00 -0.10 -0.19 0.00 0.02 0.00 0.00 55.97 55.69 1trm s LYS 188 Cb 0.00 -1.51 0.06 0.00 -0.52 0.00 0.00 37.83 35.86 1trm s LYS 188 CO 0.00 -0.49 0.86 0.34 -0.92 0.00 0.00 175.35 175.14 1trm s ASP 189 N 1.97 -0.07 0.45 2.83 3.68 -0.39 -4.37 116.67 120.77 1trm s ASP 189 Ca 0.02 -0.84 -0.01 0.00 2.13 0.00 0.00 52.55 53.86 1trm s ASP 189 Cb -0.15 0.70 -0.01 0.00 -1.45 0.00 0.00 42.92 42.01 1trm s ASP 189 CO -0.07 -1.36 0.68 -0.94 0.13 0.00 0.00 175.17 173.61 1trm s SER 190 N -3.11 5.92 0.36 -0.34 1.04 -1.26 0.68 113.70 116.99 1trm s SER 190 Ca 0.16 0.39 -0.06 0.00 0.48 0.00 0.00 55.95 56.92 1trm s SER 190 Cb -0.04 -1.68 0.02 0.00 0.10 0.00 0.00 66.02 64.42 1trm s SER 190 CO 0.08 -0.65 0.57 0.00 0.98 0.00 0.00 173.24 174.21 1trm n GLN 192 N -0.56 1.70 0.00 0.00 3.00 -1.26 -0.29 117.38 119.96 1trm n GLN 192 Ca -0.02 0.60 0.00 0.00 -0.01 0.00 0.00 57.00 57.57 1trm n GLN 192 Cb 0.61 -2.09 0.00 0.00 0.00 0.00 0.00 30.24 28.76 1trm n GLN 192 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1trm n GLY 193 N 1.25 1.33 0.05 1.08 0.00 -1.26 -1.03 105.19 106.60 1trm n GLY 193 Ca 0.09 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.20 1trm n GLY 193 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1trm n ASP 194 N 0.00 0.25 -4.51 1.61 10.43 0.60 -3.48 116.55 121.45 1trm n ASP 194 Ca 0.00 0.10 -0.53 0.00 2.57 0.00 0.00 54.79 56.93 1trm n ASP 194 Cb 0.00 1.46 -0.06 0.00 1.84 0.00 0.00 41.12 44.36 1trm n ASP 194 CO 0.00 0.00 0.00 -1.20 -1.07 0.00 0.00 177.20 174.93 1trm n SER 195 N -2.43 0.28 0.00 -2.24 7.64 -1.25 -1.08 113.62 114.55 1trm n SER 195 Ca -0.05 1.14 0.00 0.00 1.01 0.00 0.00 58.87 60.97 1trm n SER 195 Cb 0.62 -1.03 0.00 0.00 -1.01 0.00 0.00 64.21 62.79 1trm n SER 195 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1trm n GLY 196 N 1.85 1.00 3.94 0.23 0.00 -0.80 -0.59 105.19 110.81 1trm n GLY 196 Ca 0.18 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.92 1trm n GLY 196 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1trm s GLY 197 N -2.00 1.76 0.22 -0.02 0.00 -0.24 -3.38 107.32 103.66 1trm s GLY 197 Ca 0.00 -1.27 -0.12 0.00 0.00 0.00 0.00 44.72 43.33 1trm s GLY 197 CO 0.00 -0.60 0.58 2.56 0.00 0.00 0.00 173.10 175.64 1trm s PRO 198 N -5.64 3.88 -0.27 2.90 0.04 -1.26 -0.93 135.00 133.72 1trm s PRO 198 Ca 0.70 0.39 -0.01 0.00 0.04 0.00 0.00 61.00 62.12 1trm s PRO 198 Cb -0.05 -2.69 0.04 0.00 0.04 0.00 0.00 34.50 31.84 1trm s PRO 198 CO 0.50 0.34 -0.06 0.08 0.04 0.00 0.00 177.00 177.90 1trm s VAL 199 N -1.75 2.75 -0.14 -0.36 1.01 -0.80 -3.25 120.40 117.85 1trm s VAL 199 Ca 0.46 -1.26 0.01 0.00 0.00 0.00 0.00 61.98 61.19 1trm s VAL 199 Cb -0.12 -2.49 0.00 0.00 0.00 0.00 0.00 36.38 33.77 1trm s VAL 199 CO 0.20 0.07 -0.18 -0.69 0.00 0.00 0.00 175.10 174.50 1trm s VAL 200 N 1.26 2.44 -0.22 2.92 1.01 -0.37 -1.05 120.40 126.38 1trm s VAL 200 Ca -0.03 -0.85 0.02 0.00 0.00 0.00 0.00 61.98 61.11 1trm s VAL 200 Cb -0.18 -2.00 0.05 0.00 0.00 0.00 0.00 36.38 34.24 1trm s VAL 200 CO -0.04 0.53 -0.11 0.00 0.00 0.00 0.00 175.10 175.48 1trm n ASN 202 N 4.58 -6.08 -0.82 0.00 3.02 -1.26 -2.71 115.26 111.99 1trm n ASN 202 Ca -0.15 -0.37 -0.06 0.00 -0.03 0.00 0.00 54.58 53.97 1trm n ASN 202 Cb 0.45 -2.97 -0.03 0.00 -0.61 0.00 0.00 39.78 36.62 1trm n ASN 202 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1trm n GLY 203 N -1.13 0.61 3.08 7.41 0.00 -1.26 -4.93 105.19 108.98 1trm n GLY 203 Ca -0.13 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.68 1trm n GLY 203 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1trm s GLU 204 N -2.17 0.98 -0.72 1.61 2.02 -1.10 -4.05 118.70 115.27 1trm s GLU 204 Ca 0.00 -0.47 -0.26 0.00 0.02 0.00 0.00 54.97 54.26 1trm s GLU 204 Cb 0.00 -0.95 -0.01 0.00 0.10 0.00 0.00 34.13 33.26 1trm s GLU 204 CO 0.00 0.26 1.76 -1.17 0.02 0.00 0.00 175.26 176.13 1trm s LEU 209 N -0.39 3.25 0.05 1.80 2.96 -0.71 -0.11 118.68 125.53 1trm s LEU 209 Ca 0.04 -0.13 0.22 0.00 -0.22 0.00 0.00 54.13 54.05 1trm s LEU 209 Cb -0.05 -2.54 -0.22 0.00 0.50 0.00 0.00 46.19 43.88 1trm s LEU 209 CO -0.00 -2.32 0.67 0.00 -1.32 0.00 0.00 176.35 173.38 1trm n GLN 210 N 9.13 0.64 -4.06 1.98 1.13 -0.22 -4.19 117.38 121.79 1trm n GLN 210 Ca 0.23 -0.07 -0.10 0.00 -1.94 0.00 0.00 57.00 55.11 1trm n GLN 210 Cb 0.50 -1.63 -0.07 0.00 0.11 0.00 0.00 30.24 29.15 1trm n GLN 210 CO 0.00 0.00 0.00 0.20 -1.44 0.00 0.00 177.06 175.82 1trm s GLY 211 N -4.50 0.82 -0.04 1.08 0.00 -0.93 -3.05 107.32 100.70 1trm s GLY 211 Ca -0.05 -1.14 -0.01 0.00 0.00 0.00 0.00 44.72 43.52 1trm s GLY 211 CO 0.86 -0.89 0.03 -0.42 0.00 0.00 0.00 173.10 172.69 1trm s ILE 212 N -4.06 0.01 -0.10 0.90 1.01 -1.04 -1.90 121.20 116.02 1trm s ILE 212 Ca 0.27 0.27 -0.34 0.00 0.00 0.00 0.00 60.65 60.86 1trm s ILE 212 Cb 0.02 -0.20 -0.11 0.00 0.01 0.00 0.00 42.46 42.18 1trm s ILE 212 CO 0.09 0.16 1.91 0.52 0.00 0.00 0.00 174.94 177.62 1trm n VAL 213 N 4.75 0.58 0.00 2.92 0.31 -0.10 -1.77 118.33 125.02 1trm n VAL 213 Ca -0.15 -0.12 -0.00 0.00 -0.01 0.00 0.00 64.34 64.05 1trm n VAL 213 Cb 0.50 -1.91 -0.00 0.00 -0.91 0.00 0.00 33.84 31.52 1trm n VAL 213 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 1trm n SER 214 N 6.96 0.26 -2.60 4.52 2.88 -1.09 -1.91 113.62 122.64 1trm n SER 214 Ca 0.23 0.04 -0.12 0.00 -1.33 0.00 0.00 58.87 57.69 1trm n SER 214 Cb 0.30 -0.19 -0.03 0.00 -0.75 0.00 0.00 64.21 63.54 1trm n SER 214 CO 0.00 0.00 0.00 -2.67 -1.23 0.00 0.00 175.04 171.14 1trm n TRP 215 N -2.74 -1.21 0.00 0.66 4.27 -0.54 -4.95 117.44 112.93 1trm n TRP 215 Ca -0.01 -1.89 0.00 0.00 -3.89 0.00 0.00 57.50 51.71 1trm n TRP 215 Cb 0.03 0.43 0.00 0.00 -1.36 0.00 0.00 31.31 30.40 1trm n TRP 215 CO 0.00 0.00 0.00 0.41 -2.29 0.00 0.00 177.69 175.81 1trm n GLY 216 N -0.46 2.04 3.54 -1.67 0.00 -1.26 -1.21 105.19 106.17 1trm n GLY 216 Ca 0.01 -0.88 -0.40 0.00 0.00 0.00 0.00 46.02 44.75 1trm n GLY 216 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1trm s TYR 217 N -2.00 3.23 0.00 1.61 5.04 -1.26 -4.93 117.35 119.03 1trm s TYR 217 Ca 0.00 -0.12 0.00 0.00 -2.44 0.00 0.00 57.07 54.51 1trm s TYR 217 Cb 0.00 -2.48 0.00 0.00 0.35 0.00 0.00 41.96 39.83 1trm s TYR 217 CO 0.00 -0.33 0.00 0.41 -1.34 0.00 0.00 175.55 174.29 1trm n GLY 219 N 5.07 -0.30 2.80 8.97 0.00 -1.26 -4.65 105.19 115.83 1trm n GLY 219 Ca -0.12 -1.05 -0.17 0.00 0.00 0.00 0.00 46.02 44.68 1trm n GLY 219 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1trm n ALA 221 N 4.97 -0.70 -2.32 0.00 0.00 -1.26 -4.45 120.51 116.74 1trm n ALA 221 Ca -0.11 0.20 -0.30 0.00 0.00 0.00 0.00 53.44 53.23 1trm n ALA 221 Cb 0.50 -2.64 -0.03 0.00 0.00 0.00 0.00 19.45 17.28 1trm n ALA 221 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1trm s LEU 221 N -6.13 3.93 0.29 0.00 1.43 -1.26 -0.65 118.68 116.29 1trm s LEU 221 Ca 0.08 0.96 -0.30 0.00 -1.03 0.00 0.00 54.13 53.84 1trm s LEU 221 Cb -0.04 -3.82 -0.12 0.00 0.03 0.00 0.00 46.19 42.25 1trm s LEU 221 CO 0.10 -0.31 1.49 -2.65 0.23 0.00 0.00 176.35 175.21 1trm n PRO 222 N -1.13 2.43 -1.31 1.29 -0.02 -1.26 -2.25 135.00 132.75 1trm n PRO 222 Ca 0.01 0.86 -0.11 0.00 -2.02 0.00 0.00 63.50 62.24 1trm n PRO 222 Cb 0.54 -2.58 -0.05 0.00 -0.02 0.00 0.00 33.50 31.40 1trm n PRO 222 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 1trm n ASP 223 N 1.81 -4.91 -3.21 2.55 9.92 0.42 -4.88 116.55 118.24 1trm n ASP 223 Ca 0.08 0.26 -0.23 0.00 -0.53 0.00 0.00 54.79 54.37 1trm n ASP 223 Cb 0.35 -3.35 -0.06 0.00 -0.64 0.00 0.00 41.12 37.42 1trm n ASP 223 CO 0.00 0.00 0.00 0.59 0.13 0.00 0.00 177.20 177.92 1trm n ASN 224 N -0.51 0.95 -4.62 -2.24 3.02 -0.95 -4.77 115.26 106.12 1trm n ASN 224 Ca -0.11 -2.90 -0.30 0.00 -0.03 0.00 0.00 54.58 51.25 1trm n ASN 224 Cb 0.45 -0.64 0.19 0.00 -0.61 0.00 0.00 39.78 39.17 1trm n ASN 224 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 1trm s PRO 225 N -1.71 0.45 0.41 3.52 0.04 -1.26 -4.31 135.00 132.13 1trm s PRO 225 Ca 0.37 1.11 -0.25 0.00 0.04 0.00 0.00 61.00 62.27 1trm s PRO 225 Cb 0.21 -1.69 -0.08 0.00 0.04 0.00 0.00 34.50 32.97 1trm s PRO 225 CO -0.09 -2.88 1.15 0.20 0.04 0.00 0.00 177.00 175.42 1trm s GLY 226 N -2.84 2.84 -0.18 0.56 0.00 -0.91 -4.71 107.32 102.09 1trm s GLY 226 Ca 0.66 0.92 -0.05 0.00 0.00 0.00 0.00 44.72 46.26 1trm s GLY 226 CO 0.60 1.42 -0.01 0.54 0.00 0.00 0.00 173.10 175.64 1trm s VAL 227 N -1.46 4.00 0.06 1.40 0.11 -0.35 -1.19 120.40 122.97 1trm s VAL 227 Ca 0.58 -0.31 0.09 0.00 -2.93 0.00 0.00 61.98 59.41 1trm s VAL 227 Cb -0.29 -2.78 -0.03 0.00 -1.53 0.00 0.00 36.38 31.75 1trm s VAL 227 CO 0.36 0.46 -0.25 -0.31 -3.33 0.00 0.00 175.10 172.04 1trm s TYR 228 N 0.62 2.15 0.18 1.54 2.02 0.20 -1.46 117.35 122.60 1trm s TYR 228 Ca -0.01 -0.40 -0.32 0.00 -0.37 0.00 0.00 57.07 55.97 1trm s TYR 228 Cb -0.14 -1.26 -0.11 0.00 -0.40 0.00 0.00 41.96 40.05 1trm s TYR 228 CO 0.02 0.16 1.64 0.99 -1.57 0.00 0.00 175.55 176.79 1trm s THR 229 N -0.87 2.36 -0.73 -0.71 2.01 -0.73 -0.62 115.64 116.36 1trm s THR 229 Ca 0.11 0.25 -0.16 0.00 0.31 0.00 0.00 61.69 62.20 1trm s THR 229 Cb -0.10 -3.16 0.17 0.00 0.01 0.00 0.00 72.50 69.42 1trm s THR 229 CO 0.03 0.02 0.71 -0.75 -0.69 0.00 0.00 174.62 173.94 1trm s LYS 230 N 1.20 3.36 0.34 4.92 2.20 0.87 -2.50 119.74 130.13 1trm s LYS 230 Ca 0.72 -2.06 0.12 0.00 -0.36 0.00 0.00 55.97 54.40 1trm s LYS 230 Cb -0.46 -4.41 0.96 0.00 -1.51 0.00 0.00 37.83 32.40 1trm s LYS 230 CO 0.32 -1.37 1.74 0.28 -0.36 0.00 0.00 175.35 175.95 1trm h VAL 231 N 5.32 0.52 0.00 4.02 2.07 -1.84 0.37 116.25 126.71 1trm h VAL 231 Ca -0.05 -0.18 -0.00 0.00 0.82 0.00 0.00 66.70 67.29 1trm h VAL 231 Cb 1.06 -0.04 -0.00 0.00 -1.52 0.00 0.00 31.29 30.79 1trm h VAL 231 CO 0.91 0.09 -0.01 0.00 0.02 0.00 0.00 177.57 178.58 1trm n ASN 233 N -3.18 0.56 -0.28 0.00 4.13 0.12 -4.16 115.26 112.44 1trm n ASN 233 Ca -0.02 -1.21 0.02 0.00 1.68 0.00 0.00 54.58 55.05 1trm n ASN 233 Cb 0.14 -0.00 0.03 0.00 -1.54 0.00 0.00 39.78 38.41 1trm n ASN 233 CO 0.00 0.00 0.00 -1.22 0.28 0.00 0.00 177.26 176.32 1trm n TYR 234 N -0.55 0.00 0.11 3.10 4.01 0.45 -4.86 117.16 119.42 1trm n TYR 234 Ca 0.22 -0.24 0.01 0.00 -0.16 0.00 0.00 57.90 57.72 1trm n TYR 234 Cb 0.20 -0.06 0.33 0.00 -0.31 0.00 0.00 39.34 39.50 1trm n TYR 234 CO 0.00 0.00 0.00 0.28 -0.46 0.00 0.00 176.86 176.68 1trm h VAL 235 N 4.32 1.22 0.01 -0.72 2.07 -1.71 -2.64 116.25 118.80 1trm h VAL 235 Ca 0.00 -1.04 -0.26 0.00 0.82 0.00 0.00 66.70 66.23 1trm h VAL 235 Cb 1.18 1.37 0.02 0.00 -1.52 0.00 0.00 31.29 32.33 1trm h VAL 235 CO 0.00 0.32 -1.04 -0.78 0.02 0.00 0.00 177.57 176.09 1trm h ASP 236 N 0.22 0.79 0.30 0.57 -0.00 -1.92 -2.82 116.42 113.55 1trm h ASP 236 Ca 0.04 -0.64 -0.01 0.00 -0.00 0.00 0.00 57.03 56.41 1trm h ASP 236 Cb 0.52 -0.24 0.00 0.00 -0.00 0.00 0.00 39.33 39.61 1trm h ASP 236 CO 0.04 1.44 -0.15 -0.25 -0.00 0.00 0.00 179.24 180.32 1trm h TRP 237 N 0.33 -0.38 0.00 0.28 7.01 -1.92 -2.67 115.95 118.59 1trm h TRP 237 Ca -0.12 -0.01 0.00 0.00 2.11 0.00 0.00 58.89 60.87 1trm h TRP 237 Cb 1.69 0.12 0.00 0.00 -2.10 0.00 0.00 29.16 28.87 1trm h TRP 237 CO 0.09 -0.23 0.00 -0.89 -2.79 0.00 0.00 178.44 174.62 1trm n ILE 238 N -3.41 0.00 -0.35 2.65 5.41 -1.00 0.15 119.36 122.81 1trm n ILE 238 Ca -0.05 1.39 0.15 0.00 1.00 0.00 0.00 62.75 65.24 1trm n ILE 238 Cb 0.16 -1.89 0.30 0.00 -0.71 0.00 0.00 39.64 37.50 1trm n ILE 238 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1trm n GLN 239 N -2.59 -0.08 0.11 0.38 6.02 -1.07 0.21 117.38 120.37 1trm n GLN 239 Ca 0.00 1.50 -0.13 0.00 -0.01 0.00 0.00 57.00 58.35 1trm n GLN 239 Cb 0.00 -2.38 -0.08 0.00 1.02 0.00 0.00 30.24 28.80 1trm n GLN 239 CO 0.00 0.00 0.00 0.22 -1.01 0.00 0.00 177.06 176.27 1trm h ASP 240 N 0.00 -0.18 -0.54 1.08 3.58 -0.85 0.24 116.42 119.75 1trm h ASP 240 Ca 0.61 -0.03 0.01 0.00 0.42 0.00 0.00 57.03 58.03 1trm h ASP 240 Cb 1.26 0.05 -0.03 0.00 1.72 0.00 0.00 39.33 42.33 1trm h ASP 240 CO -0.94 -0.09 0.35 0.74 -2.88 0.00 0.00 179.24 176.43 1trm h THR 241 N -0.26 1.13 -0.14 2.25 2.02 0.40 -2.07 112.91 116.24 1trm h THR 241 Ca -0.02 -0.25 -0.20 0.00 0.77 0.00 0.00 66.41 66.71 1trm h THR 241 Cb 0.20 0.35 0.00 0.00 -1.74 0.00 0.00 68.15 66.97 1trm h THR 241 CO 0.04 0.13 -0.74 0.40 0.37 0.00 0.00 175.52 175.72 1trm h ILE 242 N 0.72 1.31 0.00 3.11 5.03 -0.86 -2.34 117.51 124.49 1trm h ILE 242 Ca 0.20 -2.01 -0.08 0.00 -0.12 0.00 0.00 64.86 62.86 1trm h ILE 242 Cb -0.08 1.99 -0.01 0.00 -3.03 0.00 0.00 36.82 35.70 1trm h ILE 242 CO -0.05 0.62 -0.37 0.00 -0.68 0.00 0.00 178.15 177.68 1trm h ALA 243 N 0.72 1.14 -0.00 1.87 0.00 -0.20 -3.07 119.26 119.72 1trm h ALA 243 Ca -0.04 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.54 1trm h ALA 243 Cb 1.34 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.07 1trm h ALA 243 CO 0.14 0.46 -0.45 0.00 0.00 0.00 0.00 179.25 179.40 1trm n ALA 244 N -2.35 3.44 -0.52 0.00 0.00 -0.81 -5.09 120.51 115.18 1trm n ALA 244 Ca -0.01 -0.34 0.00 0.00 0.00 0.00 0.00 53.44 53.09 1trm n ALA 244 Cb 0.45 -1.14 0.00 0.00 0.00 0.00 0.00 19.45 18.76 1trm n ALA 244 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59