#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1o3e s VAL 17 N 0.00 3.98 -0.90 1.39 1.01 0.11 -3.88 120.40 122.10 1o3e s VAL 17 Ca 0.00 -0.34 0.00 0.00 0.00 0.00 0.00 61.98 61.64 1o3e s VAL 17 Cb 0.00 -2.71 0.00 0.00 0.00 0.00 0.00 36.38 33.67 1o3e s VAL 17 CO 0.00 0.53 0.00 0.61 0.00 0.00 0.00 175.10 176.24 1o3e n GLY 18 N 3.04 0.71 0.00 4.51 0.00 -1.23 -1.77 105.19 110.45 1o3e n GLY 18 Ca -0.18 -0.58 0.00 0.00 0.00 0.00 0.00 46.02 45.26 1o3e n GLY 18 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1o3e n GLY 19 N -1.57 2.73 3.27 -0.02 0.00 -1.26 -4.85 105.19 103.48 1o3e n GLY 19 Ca -0.10 -2.09 -0.15 0.00 0.00 0.00 0.00 46.02 43.69 1o3e n GLY 19 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1o3e s TYR 20 N 1.28 1.35 -0.09 1.61 1.13 0.46 -4.91 117.35 118.17 1o3e s TYR 20 Ca 0.00 -1.03 -0.30 0.00 -1.41 0.00 0.00 57.07 54.34 1o3e s TYR 20 Cb 0.00 -0.77 -0.04 0.00 -1.10 0.00 0.00 41.96 40.05 1o3e s TYR 20 CO 0.00 -0.20 1.47 0.99 -2.51 0.00 0.00 175.55 175.30 1o3e s THR 21 N -3.63 3.86 0.19 -3.49 2.01 -1.26 -0.20 115.64 113.11 1o3e s THR 21 Ca 0.27 1.07 -0.13 0.00 0.31 0.00 0.00 61.69 63.22 1o3e s THR 21 Cb 0.06 -3.69 0.09 0.00 0.01 0.00 0.00 72.50 68.97 1o3e s THR 21 CO 0.07 -0.08 1.83 0.00 -0.69 0.00 0.00 174.62 175.74 1o3e n GLY 23 N -1.26 3.05 3.66 0.00 0.00 -1.26 -4.81 105.19 104.57 1o3e n GLY 23 Ca 0.05 -1.50 -0.48 0.00 0.00 0.00 0.00 46.02 44.08 1o3e n GLY 23 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1o3e n ALA 24 N 0.80 0.79 -2.25 4.61 0.00 -1.26 -2.61 120.51 120.59 1o3e n ALA 24 Ca 0.00 0.42 -0.17 0.00 0.00 0.00 0.00 53.44 53.69 1o3e n ALA 24 Cb 0.00 -2.33 -0.02 0.00 0.00 0.00 0.00 19.45 17.10 1o3e n ALA 24 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1o3e n ASN 25 N 4.04 -4.88 -0.11 0.00 4.13 -1.26 -4.86 115.26 112.31 1o3e n ASN 25 Ca 0.19 0.15 0.14 0.00 1.68 0.00 0.00 54.58 56.73 1o3e n ASN 25 Cb 0.26 -4.15 0.53 0.00 -1.54 0.00 0.00 39.78 34.88 1o3e n ASN 25 CO 0.00 0.00 0.00 0.35 0.28 0.00 0.00 177.26 177.89 1o3e n THR 26 N -3.42 0.00 -3.47 3.41 -2.24 -1.07 -4.06 114.28 103.42 1o3e n THR 26 Ca -0.19 -0.06 -0.27 0.00 -2.27 0.00 0.00 64.05 61.26 1o3e n THR 26 Cb 0.63 -0.01 -0.09 0.00 -2.10 0.00 0.00 70.33 68.76 1o3e n THR 26 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 1o3e n VAL 27 N -1.03 0.81 0.35 2.28 0.31 -1.26 -4.97 118.33 114.82 1o3e n VAL 27 Ca 0.12 -4.53 0.11 0.00 -0.01 0.00 0.00 64.34 60.03 1o3e n VAL 27 Cb 0.30 -2.01 0.48 0.00 -0.91 0.00 0.00 33.84 31.70 1o3e n VAL 27 CO 0.00 0.00 0.00 -0.81 -1.32 0.00 0.00 176.83 174.70 1o3e n PRO 28 N 1.60 0.16 0.00 5.55 -0.04 -1.26 -2.09 135.00 138.92 1o3e n PRO 28 Ca 0.25 0.45 0.13 0.00 -0.04 0.00 0.00 63.50 64.29 1o3e n PRO 28 Cb 0.44 -1.84 0.26 0.00 -0.04 0.00 0.00 33.50 32.32 1o3e n PRO 28 CO 0.00 0.00 0.00 2.48 -0.04 0.00 0.00 175.50 177.94 1o3e n TYR 29 N -2.15 0.00 -2.49 0.54 4.11 -1.19 -2.31 117.16 113.67 1o3e n TYR 29 Ca 0.02 0.00 -0.42 0.00 -0.00 0.00 0.00 57.90 57.50 1o3e n TYR 29 Cb 0.18 -0.03 -0.03 0.00 -0.00 0.00 0.00 39.34 39.46 1o3e n TYR 29 CO 0.00 0.00 0.00 -1.14 -0.00 0.00 0.00 176.86 175.72 1o3e s GLN 30 N -2.24 4.51 0.23 -3.48 2.00 -0.89 -0.77 119.66 119.03 1o3e s GLN 30 Ca 0.28 1.71 0.08 0.00 -2.00 0.00 0.00 55.36 55.43 1o3e s GLN 30 Cb 0.20 -3.33 -0.05 0.00 0.80 0.00 0.00 33.01 30.63 1o3e s GLN 30 CO 0.43 -0.09 -0.13 0.14 -0.50 0.00 0.00 175.29 175.14 1o3e s VAL 31 N 0.48 1.78 -0.08 1.34 -7.23 -0.64 -4.46 120.40 111.58 1o3e s VAL 31 Ca 0.54 -2.21 0.03 0.00 -1.81 0.00 0.00 61.98 58.53 1o3e s VAL 31 Cb -0.29 -2.17 -0.02 0.00 0.56 0.00 0.00 36.38 34.47 1o3e s VAL 31 CO 0.32 -0.50 -0.18 -0.55 -0.31 0.00 0.00 175.10 173.87 1o3e s SER 32 N -3.37 3.63 -0.22 4.85 0.15 -0.47 -2.28 113.70 116.00 1o3e s SER 32 Ca 0.25 -0.37 -0.10 0.00 0.70 0.00 0.00 55.95 56.43 1o3e s SER 32 Cb -0.00 -1.11 -0.05 0.00 -1.71 0.00 0.00 66.02 63.15 1o3e s SER 32 CO 0.09 0.24 0.14 -0.76 1.20 0.00 0.00 173.24 174.15 1o3e s LEU 33 N -0.14 4.17 -0.02 3.45 1.43 0.31 -0.79 118.68 127.09 1o3e s LEU 33 Ca -0.03 0.18 0.04 0.00 -1.03 0.00 0.00 54.13 53.30 1o3e s LEU 33 Cb -0.14 -2.09 -0.01 0.00 0.03 0.00 0.00 46.19 43.98 1o3e s LEU 33 CO 0.04 0.14 -0.16 0.21 0.23 0.00 0.00 176.35 176.81 1o3e s ASN 34 N 0.63 1.91 -0.29 2.29 3.84 0.10 -2.01 114.94 121.41 1o3e s ASN 34 Ca 0.08 -0.30 0.20 0.00 0.21 0.00 0.00 52.86 53.04 1o3e s ASN 34 Cb -0.12 -0.36 0.48 0.00 -0.55 0.00 0.00 41.25 40.70 1o3e s ASN 34 CO 0.01 0.17 1.05 -1.54 -2.79 0.00 0.00 177.10 173.99 1o3e n SER 37 N 2.92 1.76 0.00 -4.21 3.41 -1.26 -1.24 113.62 115.00 1o3e n SER 37 Ca -0.16 -2.43 0.00 0.00 -0.26 0.00 0.00 58.87 56.02 1o3e n SER 37 Cb 0.54 -0.49 0.00 0.00 -0.26 0.00 0.00 64.21 63.99 1o3e n SER 37 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1o3e n GLY 38 N -0.38 0.47 3.60 5.00 0.00 -1.26 -5.00 105.19 107.63 1o3e n GLY 38 Ca 0.10 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.08 1o3e n GLY 38 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1o3e s TYR 39 N -2.00 -0.20 -0.11 1.61 1.13 -1.26 -5.13 117.35 111.39 1o3e s TYR 39 Ca 0.00 0.05 -0.26 0.00 -1.41 0.00 0.00 57.07 55.45 1o3e s TYR 39 Cb 0.00 0.56 -0.02 0.00 -1.10 0.00 0.00 41.96 41.40 1o3e s TYR 39 CO 0.00 -0.49 0.83 -1.58 -2.51 0.00 0.00 175.55 171.80 1o3e s HIS 40 N -2.89 3.51 0.00 -3.49 5.65 -1.26 -4.29 115.29 112.51 1o3e s HIS 40 Ca 0.09 1.35 0.00 0.00 0.25 0.00 0.00 55.06 56.75 1o3e s HIS 40 Cb -0.00 -2.98 0.00 0.00 -1.18 0.00 0.00 32.58 28.42 1o3e s HIS 40 CO -0.05 -0.11 0.00 1.97 -0.65 0.00 0.00 174.74 175.91 1o3e n PHE 41 N 4.58 0.00 -3.65 3.88 -1.74 -0.85 -5.00 117.46 114.68 1o3e n PHE 41 Ca 0.03 0.00 -0.10 0.00 -0.56 0.00 0.00 57.45 56.82 1o3e n PHE 41 Cb 0.50 0.00 -0.03 0.00 1.52 0.00 0.00 39.48 41.47 1o3e n PHE 41 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 1o3e n GLY 43 N -0.36 2.24 3.80 0.00 0.00 -0.13 -0.53 105.19 110.21 1o3e n GLY 43 Ca -0.12 -2.23 -0.00 0.00 0.00 0.00 0.00 46.02 43.67 1o3e n GLY 43 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1o3e s GLY 44 N -4.02 -0.18 -0.03 -0.02 0.00 -0.97 -3.73 107.32 98.38 1o3e s GLY 44 Ca 0.42 0.17 0.04 0.00 0.00 0.00 0.00 44.72 45.34 1o3e s GLY 44 CO 0.26 2.09 -0.13 -0.56 0.00 0.00 0.00 173.10 174.76 1o3e s SER 45 N -3.29 1.67 -0.21 1.64 0.01 -0.29 -1.63 113.70 111.59 1o3e s SER 45 Ca 0.20 -0.26 -0.26 0.00 1.31 0.00 0.00 55.95 56.94 1o3e s SER 45 Cb 0.01 -0.36 -0.01 0.00 0.21 0.00 0.00 66.02 65.87 1o3e s SER 45 CO 0.00 0.13 0.86 -0.22 0.41 0.00 0.00 173.24 174.43 1o3e s LEU 46 N -0.05 4.13 0.00 2.44 2.96 0.05 -1.16 118.68 127.05 1o3e s LEU 46 Ca -0.00 1.15 0.13 0.00 -0.22 0.00 0.00 54.13 55.19 1o3e s LEU 46 Cb -0.08 -3.26 -0.10 0.00 0.50 0.00 0.00 46.19 43.24 1o3e s LEU 46 CO 0.01 -0.48 0.61 2.30 -1.32 0.00 0.00 176.35 177.46 1o3e n ILE 47 N 5.02 0.00 -3.83 6.68 -5.35 -0.62 -1.26 119.36 120.00 1o3e n ILE 47 Ca 0.06 -0.24 -0.05 0.00 -0.27 0.00 0.00 62.75 62.26 1o3e n ILE 47 Cb 0.48 1.04 0.02 0.00 -1.74 0.00 0.00 39.64 39.44 1o3e n ILE 47 CO 0.00 0.00 0.00 -0.46 -1.76 0.00 0.00 176.55 174.33 1o3e n ASN 48 N -1.00 -1.80 0.10 7.28 0.23 -1.21 -4.58 115.26 114.27 1o3e n ASN 48 Ca 0.03 -2.06 0.11 0.00 -0.53 0.00 0.00 54.58 52.13 1o3e n ASN 48 Cb 0.23 2.96 0.45 0.00 -2.08 0.00 0.00 39.78 41.33 1o3e n ASN 48 CO 0.00 0.00 0.00 -1.54 -0.93 0.00 0.00 177.26 174.79 1o3e n SER 49 N -1.33 0.51 0.00 0.53 3.41 -1.26 -3.57 113.62 111.91 1o3e n SER 49 Ca -0.04 0.62 0.00 0.00 -0.26 0.00 0.00 58.87 59.19 1o3e n SER 49 Cb 0.55 -0.73 0.00 0.00 -0.26 0.00 0.00 64.21 63.77 1o3e n SER 49 CO 0.00 0.00 0.00 1.67 -0.16 0.00 0.00 175.04 176.55 1o3e n GLN 50 N -2.06 -0.12 -4.39 4.33 7.27 -1.26 -0.77 117.38 120.39 1o3e n GLN 50 Ca 0.03 -0.61 -0.19 0.00 0.07 0.00 0.00 57.00 56.30 1o3e n GLN 50 Cb 0.24 -0.91 -0.14 0.00 2.41 0.00 0.00 30.24 31.83 1o3e n GLN 50 CO 0.00 0.00 0.00 -1.58 0.07 0.00 0.00 177.06 175.55 1o3e s TRP 51 N -0.18 1.03 0.09 3.69 0.52 -1.23 -0.47 118.94 122.40 1o3e s TRP 51 Ca 0.00 -0.27 0.09 0.00 0.02 0.00 0.00 56.10 55.93 1o3e s TRP 51 Cb 0.00 -0.64 -0.03 0.00 -1.15 0.00 0.00 33.47 31.65 1o3e s TRP 51 CO 0.00 -0.00 -0.22 0.08 0.02 0.00 0.00 176.95 176.83 1o3e s VAL 52 N -0.57 1.82 -0.07 4.03 1.01 -0.19 -1.59 120.40 124.85 1o3e s VAL 52 Ca 0.02 -1.50 0.05 0.00 0.00 0.00 0.00 61.98 60.55 1o3e s VAL 52 Cb -0.06 -1.62 -0.01 0.00 0.00 0.00 0.00 36.38 34.68 1o3e s VAL 52 CO 0.00 0.04 -0.22 -0.69 0.00 0.00 0.00 175.10 174.24 1o3e s VAL 53 N -1.05 2.32 0.00 2.92 1.01 -0.31 -0.38 120.40 124.91 1o3e s VAL 53 Ca 0.08 -0.97 0.00 0.00 0.00 0.00 0.00 61.98 61.10 1o3e s VAL 53 Cb -0.10 -1.87 0.00 0.00 0.00 0.00 0.00 36.38 34.41 1o3e s VAL 53 CO 0.04 0.57 0.00 -0.24 0.00 0.00 0.00 175.10 175.46 1o3e n SER 54 N 3.00 0.00 -4.90 3.32 2.88 -0.23 -1.14 113.62 116.54 1o3e n SER 54 Ca -0.18 -0.38 -0.34 0.00 -1.33 0.00 0.00 58.87 56.65 1o3e n SER 54 Cb 0.52 0.00 -0.05 0.00 -0.75 0.00 0.00 64.21 63.93 1o3e n SER 54 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1o3e s ALA 55 N -1.73 3.91 0.39 -1.46 0.00 -1.26 -1.12 121.76 120.49 1o3e s ALA 55 Ca 0.00 -0.69 0.06 0.00 0.00 0.00 0.00 51.96 51.34 1o3e s ALA 55 Cb 0.00 -1.96 0.78 0.00 0.00 0.00 0.00 23.12 21.94 1o3e s ALA 55 CO 0.00 0.71 2.00 0.00 0.00 0.00 0.00 175.76 178.46 1o3e h ALA 56 N 3.86 1.59 0.00 0.00 0.00 -1.68 -1.66 119.26 121.37 1o3e h ALA 56 Ca -0.49 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.33 1o3e h ALA 56 Cb 1.19 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.82 1o3e h ALA 56 CO 0.68 0.33 0.00 -2.39 0.00 0.00 0.00 179.25 177.87 1o3e n HIS 57 N -4.40 0.00 1.26 0.00 1.44 -1.26 -1.90 115.22 110.35 1o3e n HIS 57 Ca 0.02 0.00 0.13 0.00 -2.01 0.00 0.00 57.72 55.86 1o3e n HIS 57 Cb 0.13 -0.04 0.35 0.00 0.12 0.00 0.00 29.99 30.54 1o3e n HIS 57 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1o3e s TYR 59 N -1.97 2.70 0.10 0.00 6.14 -0.80 -4.99 117.35 118.53 1o3e s TYR 59 Ca 0.34 1.09 -0.26 0.00 0.64 0.00 0.00 57.07 58.88 1o3e s TYR 59 Cb 0.21 -3.98 0.09 0.00 0.42 0.00 0.00 41.96 38.69 1o3e s TYR 59 CO 0.32 -3.00 1.10 -1.59 0.64 0.00 0.00 175.55 173.02 1o3e s LYS 60 N -1.57 0.92 0.33 4.97 -2.85 -1.26 -5.15 119.74 115.13 1o3e s LYS 60 Ca 0.55 -0.53 0.07 0.00 -1.00 0.00 0.00 55.97 55.06 1o3e s LYS 60 Cb -0.46 0.30 -0.02 0.00 -2.06 0.00 0.00 37.83 35.59 1o3e s LYS 60 CO 0.57 -0.42 0.40 -1.54 0.10 0.00 0.00 175.35 174.46 1o3e s SER 61 N -3.08 5.76 -0.28 0.03 1.04 -1.26 -4.56 113.70 111.36 1o3e s SER 61 Ca 0.15 -0.27 -0.01 0.00 0.48 0.00 0.00 55.95 56.30 1o3e s SER 61 Cb 0.00 -1.18 0.00 0.00 0.10 0.00 0.00 66.02 64.94 1o3e s SER 61 CO 0.01 -0.38 0.24 0.61 0.98 0.00 0.00 173.24 174.69 1o3e n GLY 62 N -1.54 0.51 3.75 7.32 0.00 -1.26 -5.02 105.19 108.96 1o3e n GLY 62 Ca -0.01 -0.44 -0.37 0.00 0.00 0.00 0.00 46.02 45.21 1o3e n GLY 62 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1o3e s ILE 63 N -3.07 5.30 -0.13 -0.61 1.01 -1.26 -4.49 121.20 117.94 1o3e s ILE 63 Ca 0.08 0.54 0.02 0.00 0.00 0.00 0.00 60.65 61.29 1o3e s ILE 63 Cb -0.04 -3.62 -0.00 0.00 0.01 0.00 0.00 42.46 38.82 1o3e s ILE 63 CO 0.15 0.43 -0.19 -1.58 0.00 0.00 0.00 174.94 173.76 1o3e s GLN 64 N 0.15 3.16 -0.14 2.79 0.74 -0.38 -1.94 119.66 124.05 1o3e s GLN 64 Ca 0.17 -0.80 -0.16 0.00 0.05 0.00 0.00 55.36 54.62 1o3e s GLN 64 Cb -0.13 -2.49 -0.04 0.00 1.10 0.00 0.00 33.01 31.44 1o3e s GLN 64 CO 0.05 0.10 0.40 0.08 -0.55 0.00 0.00 175.29 175.37 1o3e s VAL 65 N 0.58 5.24 -0.25 1.34 1.01 0.12 -0.73 120.40 127.70 1o3e s VAL 65 Ca -0.11 0.79 -0.00 0.00 0.00 0.00 0.00 61.98 62.66 1o3e s VAL 65 Cb -0.16 -3.74 0.04 0.00 0.00 0.00 0.00 36.38 32.51 1o3e s VAL 65 CO 0.04 0.35 -0.08 -0.13 0.00 0.00 0.00 175.10 175.28 1o3e s ARG 65 N 0.58 2.67 0.26 2.72 0.52 0.03 -0.98 118.95 124.75 1o3e s ARG 65 Ca 0.22 -1.08 0.06 0.00 -0.52 0.00 0.00 55.73 54.41 1o3e s ARG 65 Cb -0.14 -2.95 -0.03 0.00 0.52 0.00 0.00 34.95 32.34 1o3e s ARG 65 CO 0.08 -0.45 0.32 -0.51 0.02 0.00 0.00 175.30 174.76 1o3e s LEU 66 N 1.27 4.11 -1.78 2.53 1.02 0.12 -1.37 118.68 124.58 1o3e s LEU 66 Ca -0.02 -0.07 0.00 0.00 0.02 0.00 0.00 54.13 54.06 1o3e s LEU 66 Cb -0.17 -2.67 0.00 0.00 0.02 0.00 0.00 46.19 43.36 1o3e s LEU 66 CO -0.05 -0.11 0.00 0.61 0.02 0.00 0.00 176.35 176.82 1o3e n GLY 69 N -1.36 0.22 3.89 -3.19 0.00 -1.26 -1.69 105.19 101.79 1o3e n GLY 69 Ca -0.07 -0.07 -0.30 0.00 0.00 0.00 0.00 46.02 45.58 1o3e n GLY 69 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1o3e s GLU 70 N -4.60 3.72 0.00 1.61 0.41 -1.26 -3.92 118.70 114.66 1o3e s GLU 70 Ca 0.00 0.21 0.00 0.00 -0.41 0.00 0.00 54.97 54.77 1o3e s GLU 70 Cb 0.00 -2.57 0.00 0.00 -1.78 0.00 0.00 34.13 29.78 1o3e s GLU 70 CO 0.00 0.16 0.00 -3.47 -0.49 0.00 0.00 175.26 171.46 1o3e n ASP 71 N -0.86 0.00 -4.62 -0.19 4.64 -1.26 -4.61 116.55 109.65 1o3e n ASP 71 Ca 0.00 0.00 -0.43 0.00 -1.38 0.00 0.00 54.79 52.98 1o3e n ASP 71 Cb 0.54 0.00 -0.02 0.00 -1.04 0.00 0.00 41.12 40.59 1o3e n ASP 71 CO 0.00 0.00 0.00 0.21 -0.82 0.00 0.00 177.20 176.59 1o3e s ASN 72 N 0.28 6.78 0.00 1.67 3.84 -1.26 -3.29 114.94 122.96 1o3e s ASN 72 Ca 0.00 0.76 0.27 0.00 0.21 0.00 0.00 52.86 54.10 1o3e s ASN 72 Cb 0.00 -2.53 1.46 0.00 -0.55 0.00 0.00 41.25 39.64 1o3e s ASN 72 CO 0.00 -0.99 1.95 2.30 -2.79 0.00 0.00 177.10 177.57 1o3e n ILE 73 N 6.20 0.09 0.69 -5.21 -5.35 -0.23 -3.16 119.36 112.39 1o3e n ILE 73 Ca 0.11 0.02 0.07 0.00 -0.27 0.00 0.00 62.75 62.69 1o3e n ILE 73 Cb 0.48 -0.58 -0.02 0.00 -1.74 0.00 0.00 39.64 37.78 1o3e n ILE 73 CO 0.00 0.00 0.00 0.59 -1.76 0.00 0.00 176.55 175.38 1o3e n ASN 74 N -1.20 1.39 -4.09 7.28 3.02 -1.26 -4.96 115.26 115.45 1o3e n ASN 74 Ca 0.15 -1.19 -0.26 0.00 -0.03 0.00 0.00 54.58 53.26 1o3e n ASN 74 Cb 0.18 0.59 -0.16 0.00 -0.61 0.00 0.00 39.78 39.78 1o3e n ASN 74 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1o3e s VAL 75 N -1.98 1.31 -0.41 2.41 1.01 -1.19 -5.10 120.40 116.46 1o3e s VAL 75 Ca 0.11 -0.62 -0.26 0.00 0.00 0.00 0.00 61.98 61.22 1o3e s VAL 75 Cb 0.12 -1.16 0.02 0.00 0.00 0.00 0.00 36.38 35.37 1o3e s VAL 75 CO 0.44 0.39 0.94 -0.69 0.00 0.00 0.00 175.10 176.18 1o3e s VAL 76 N 0.34 4.52 -0.56 2.92 1.01 -1.26 -4.69 120.40 122.68 1o3e s VAL 76 Ca -0.10 1.02 0.14 0.00 0.00 0.00 0.00 61.98 63.04 1o3e s VAL 76 Cb -0.14 -4.39 -0.16 0.00 0.00 0.00 0.00 36.38 31.70 1o3e s VAL 76 CO 0.03 -0.68 0.54 -0.62 0.00 0.00 0.00 175.10 174.38 1o3e n GLU 77 N 6.99 2.17 0.00 2.72 1.02 -1.26 -5.08 120.64 127.19 1o3e n GLU 77 Ca 0.07 -0.02 0.00 0.00 -0.02 0.00 0.00 57.16 57.19 1o3e n GLU 77 Cb 0.48 -1.18 0.00 0.00 -0.02 0.00 0.00 31.44 30.73 1o3e n GLU 77 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1o3e n GLY 78 N 1.38 2.80 1.59 0.62 0.00 -1.26 -5.00 105.19 105.32 1o3e n GLY 78 Ca 0.02 -1.83 0.00 0.00 0.00 0.00 0.00 46.02 44.21 1o3e n GLY 78 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1o3e n ASN 79 N 0.00 0.00 -4.78 1.61 3.02 -1.26 -4.95 115.26 108.89 1o3e n ASN 79 Ca 0.00 0.00 -0.36 0.00 -0.03 0.00 0.00 54.58 54.19 1o3e n ASN 79 Cb 0.00 0.00 -0.03 0.00 -0.61 0.00 0.00 39.78 39.14 1o3e n ASN 79 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 1o3e s GLU 80 N -0.47 3.96 -0.05 3.52 8.01 -1.25 -4.24 118.70 128.18 1o3e s GLU 80 Ca 0.00 1.51 -0.01 0.00 0.01 0.00 0.00 54.97 56.48 1o3e s GLU 80 Cb 0.00 -2.37 0.03 0.00 -4.31 0.00 0.00 34.13 27.48 1o3e s GLU 80 CO 0.00 -0.32 0.01 -0.65 0.01 0.00 0.00 175.26 174.31 1o3e s GLN 81 N -2.78 0.37 -0.26 1.61 -0.21 -0.68 -4.97 119.66 112.74 1o3e s GLN 81 Ca 0.62 0.14 -0.05 0.00 0.02 0.00 0.00 55.36 56.10 1o3e s GLN 81 Cb -0.21 -0.69 0.01 0.00 1.00 0.00 0.00 33.01 33.11 1o3e s GLN 81 CO 0.26 -0.23 0.01 -0.06 -2.12 0.00 0.00 175.29 173.15 1o3e s PHE 82 N 1.61 3.08 -0.01 0.91 0.08 -1.26 -0.70 117.98 121.68 1o3e s PHE 82 Ca -0.01 -1.11 0.04 0.00 0.12 0.00 0.00 56.93 55.96 1o3e s PHE 82 Cb -0.13 -2.16 -0.01 0.00 -0.57 0.00 0.00 43.02 40.15 1o3e s PHE 82 CO -0.03 -0.60 -0.12 0.42 -0.10 0.00 0.00 175.22 174.78 1o3e s ILE 83 N 1.45 0.99 0.47 0.64 1.01 -0.15 -4.97 121.20 120.64 1o3e s ILE 83 Ca 0.03 -0.53 -0.17 0.00 0.00 0.00 0.00 60.65 59.98 1o3e s ILE 83 Cb -0.16 -0.84 -0.08 0.00 0.01 0.00 0.00 42.46 41.39 1o3e s ILE 83 CO -0.01 0.28 0.94 -0.44 0.00 0.00 0.00 174.94 175.71 1o3e s SER 84 N -0.22 6.69 0.19 3.58 0.01 -1.26 0.10 113.70 122.79 1o3e s SER 84 Ca 0.03 1.53 -0.30 0.00 1.31 0.00 0.00 55.95 58.53 1o3e s SER 84 Cb -0.06 -2.49 -0.08 0.00 0.21 0.00 0.00 66.02 63.61 1o3e s SER 84 CO -0.00 -0.49 0.97 0.00 0.41 0.00 0.00 173.24 174.12 1o3e s ALA 85 N -2.46 3.31 -0.09 1.44 0.00 -0.82 -0.75 121.76 122.39 1o3e s ALA 85 Ca 0.58 0.63 -0.02 0.00 0.00 0.00 0.00 51.96 53.15 1o3e s ALA 85 Cb -0.10 -3.25 -0.26 0.00 0.00 0.00 0.00 23.12 19.51 1o3e s ALA 85 CO 0.26 0.07 0.48 0.66 0.00 0.00 0.00 175.76 177.23 1o3e h SER 86 N 4.77 0.33 -4.99 0.00 4.64 -0.32 -3.43 113.55 114.55 1o3e h SER 86 Ca -0.44 -0.71 -0.04 0.00 -0.47 0.00 0.00 61.79 60.12 1o3e h SER 86 Cb 1.21 -0.11 -0.16 0.00 -0.31 0.00 0.00 62.40 63.03 1o3e h SER 86 CO 0.70 1.64 0.20 -1.59 -0.87 0.00 0.00 176.83 176.91 1o3e s LYS 87 N -2.57 1.14 -0.05 4.77 -2.85 -1.21 -5.00 119.74 113.97 1o3e s LYS 87 Ca -0.17 -0.03 0.05 0.00 -1.00 0.00 0.00 55.97 54.82 1o3e s LYS 87 Cb 0.07 0.53 -0.00 0.00 -2.06 0.00 0.00 37.83 36.37 1o3e s LYS 87 CO 0.79 -0.42 -0.20 -1.12 0.10 0.00 0.00 175.35 174.51 1o3e s SER 88 N -1.81 2.48 -0.35 0.03 0.01 -1.26 -0.75 113.70 112.05 1o3e s SER 88 Ca -0.06 -0.41 0.01 0.00 1.31 0.00 0.00 55.95 56.79 1o3e s SER 88 Cb -0.00 -0.74 0.09 0.00 0.21 0.00 0.00 66.02 65.58 1o3e s SER 88 CO 0.01 0.17 0.09 -0.63 0.41 0.00 0.00 173.24 173.29 1o3e s ILE 89 N 0.03 2.74 0.31 1.44 1.01 0.81 -4.96 121.20 122.58 1o3e s ILE 89 Ca -0.05 -2.05 -0.27 0.00 0.00 0.00 0.00 60.65 58.27 1o3e s ILE 89 Cb -0.13 -2.87 -0.10 0.00 0.01 0.00 0.00 42.46 39.37 1o3e s ILE 89 CO 0.03 -0.52 0.96 -0.69 0.00 0.00 0.00 174.94 174.72 1o3e s VAL 90 N 1.05 4.09 0.25 2.92 1.01 -1.26 -1.54 120.40 126.92 1o3e s VAL 90 Ca 0.06 1.82 -0.31 0.00 0.00 0.00 0.00 61.98 63.55 1o3e s VAL 90 Cb -0.21 -4.05 -0.12 0.00 0.00 0.00 0.00 36.38 32.00 1o3e s VAL 90 CO -0.05 0.22 1.63 1.57 0.00 0.00 0.00 175.10 178.47 1o3e n HIS 91 N 0.75 2.72 0.21 5.22 -0.00 -0.94 -4.85 115.22 118.33 1o3e n HIS 91 Ca 0.01 0.19 0.13 0.00 0.46 0.00 0.00 57.72 58.51 1o3e n HIS 91 Cb 0.49 -2.61 0.72 0.00 -0.12 0.00 0.00 29.99 28.47 1o3e n HIS 91 CO 0.00 0.00 0.00 -1.35 0.46 0.00 0.00 176.34 175.45 1o3e h PRO 92 N 5.59 0.00 -0.61 1.57 0.11 -1.93 -1.42 132.00 135.30 1o3e h PRO 92 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 1o3e h PRO 92 Cb 1.22 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.33 1o3e h PRO 92 CO 0.86 0.00 0.00 0.43 -0.21 0.00 0.00 178.00 179.08 1o3e n SER 93 N -4.29 5.35 -4.75 -2.05 7.64 -1.26 -4.96 113.62 109.30 1o3e n SER 93 Ca -0.00 -2.79 -0.41 0.00 1.01 0.00 0.00 58.87 56.67 1o3e n SER 93 Cb 0.21 -0.66 -0.02 0.00 -1.01 0.00 0.00 64.21 62.73 1o3e n SER 93 CO 0.00 0.00 0.00 -0.47 -3.01 0.00 0.00 175.04 171.56 1o3e s TYR 94 N -2.51 2.94 -0.24 1.43 6.04 -0.54 -4.69 117.35 119.79 1o3e s TYR 94 Ca 0.52 0.96 0.01 0.00 0.04 0.00 0.00 57.07 58.60 1o3e s TYR 94 Cb 0.38 -3.89 0.04 0.00 -1.04 0.00 0.00 41.96 37.45 1o3e s TYR 94 CO 0.17 -2.93 -0.12 1.21 -1.54 0.00 0.00 175.55 172.35 1o3e s ASN 95 N 0.39 4.08 0.00 4.32 3.84 -0.88 -5.00 114.94 121.69 1o3e s ASN 95 Ca 0.60 -1.07 0.21 0.00 0.21 0.00 0.00 52.86 52.81 1o3e s ASN 95 Cb -0.44 -1.56 0.91 0.00 -0.55 0.00 0.00 41.25 39.61 1o3e s ASN 95 CO 0.45 -0.13 1.66 -1.54 -2.79 0.00 0.00 177.10 174.75 1o3e n SER 96 N 4.55 0.00 -0.02 -4.21 3.41 -1.26 -0.67 113.62 115.41 1o3e n SER 96 Ca -0.16 0.40 -0.12 0.00 -0.26 0.00 0.00 58.87 58.73 1o3e n SER 96 Cb 0.45 -0.46 -0.14 0.00 -0.26 0.00 0.00 64.21 63.80 1o3e n SER 96 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1o3e n ASN 97 N -1.46 1.16 -0.01 4.04 3.02 -1.26 -4.39 115.26 116.36 1o3e n ASN 97 Ca 0.06 0.32 0.08 0.00 -0.03 0.00 0.00 54.58 55.01 1o3e n ASN 97 Cb 0.23 -0.20 -0.13 0.00 -0.61 0.00 0.00 39.78 39.06 1o3e n ASN 97 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 1o3e n THR 98 N -3.14 0.04 -1.78 3.41 -2.24 -1.19 -4.97 114.28 104.41 1o3e n THR 98 Ca -0.22 -0.39 -0.09 0.00 -2.27 0.00 0.00 64.05 61.08 1o3e n THR 98 Cb 1.06 0.10 -0.02 0.00 -2.10 0.00 0.00 70.33 69.37 1o3e n THR 98 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1o3e n LEU 99 N -2.09 -1.08 -4.76 3.22 4.77 0.15 -5.00 117.00 112.22 1o3e n LEU 99 Ca -0.04 0.09 -0.40 0.00 -0.03 0.00 0.00 56.01 55.62 1o3e n LEU 99 Cb 0.45 -1.50 -0.04 0.00 -2.33 0.00 0.00 43.42 39.99 1o3e n LEU 99 CO 0.35 -0.24 0.79 0.21 -1.33 0.00 0.00 177.39 177.17 1o3e s ASN 100 N -2.73 7.27 -1.00 -1.43 2.47 -1.20 -3.04 114.94 115.27 1o3e s ASN 100 Ca 0.00 2.26 -0.03 0.00 0.42 0.00 0.00 52.86 55.51 1o3e s ASN 100 Cb 0.00 -2.63 0.00 0.00 -1.45 0.00 0.00 41.25 37.18 1o3e s ASN 100 CO 0.00 -0.15 0.85 0.59 -3.72 0.00 0.00 177.10 174.67 1o3e n ASN 101 N 1.26 -3.49 -4.21 -4.21 3.02 -1.26 -2.08 115.26 104.29 1o3e n ASN 101 Ca -0.01 -0.46 -0.43 0.00 -0.03 0.00 0.00 54.58 53.65 1o3e n ASN 101 Cb 0.45 -4.11 0.00 0.00 -0.61 0.00 0.00 39.78 35.50 1o3e n ASN 101 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 1o3e n ASP 102 N -2.41 4.69 -3.84 6.41 2.03 -1.17 -4.44 116.55 117.82 1o3e n ASP 102 Ca -0.13 -2.93 -0.12 0.00 0.52 0.00 0.00 54.79 52.13 1o3e n ASP 102 Cb 0.60 -1.65 -0.11 0.00 -0.72 0.00 0.00 41.12 39.23 1o3e n ASP 102 CO 0.00 0.00 0.00 -0.51 -1.92 0.00 0.00 177.20 174.77 1o3e s ILE 103 N 2.93 0.05 -0.02 5.18 2.07 -1.26 -3.83 121.20 126.32 1o3e s ILE 103 Ca 0.48 -0.39 -0.08 0.00 -1.41 0.00 0.00 60.65 59.24 1o3e s ILE 103 Cb 0.07 -0.36 0.01 0.00 0.13 0.00 0.00 42.46 42.30 1o3e s ILE 103 CO 0.01 -0.22 0.18 -0.32 -1.91 0.00 0.00 174.94 172.68 1o3e s MET 104 N -0.76 0.45 -0.03 3.50 -2.45 -0.27 -2.22 119.30 117.51 1o3e s MET 104 Ca -0.09 -0.20 0.04 0.00 -1.25 0.00 0.00 55.69 54.19 1o3e s MET 104 Cb -0.05 0.19 -0.03 0.00 1.25 0.00 0.00 34.83 36.20 1o3e s MET 104 CO 0.01 -0.10 -0.13 -0.51 1.05 0.00 0.00 175.02 175.34 1o3e s LEU 105 N -1.01 2.81 -0.08 4.11 1.43 -0.59 -1.07 118.68 124.28 1o3e s LEU 105 Ca -0.11 -0.20 0.03 0.00 -1.03 0.00 0.00 54.13 52.82 1o3e s LEU 105 Cb -0.06 -1.60 0.00 0.00 0.03 0.00 0.00 46.19 44.57 1o3e s LEU 105 CO 0.02 0.33 -0.19 -0.63 0.23 0.00 0.00 176.35 176.10 1o3e s ILE 106 N -0.80 1.66 -0.13 -0.59 1.01 0.49 -0.13 121.20 122.70 1o3e s ILE 106 Ca 0.13 -0.79 -0.07 0.00 0.00 0.00 0.00 60.65 59.91 1o3e s ILE 106 Cb -0.11 -1.46 -0.04 0.00 0.01 0.00 0.00 42.46 40.86 1o3e s ILE 106 CO 0.02 0.47 0.12 -0.75 0.00 0.00 0.00 174.94 174.80 1o3e s LYS 107 N 0.43 3.54 0.20 2.79 2.20 0.07 -1.02 119.74 127.95 1o3e s LYS 107 Ca -0.16 -0.18 -0.12 0.00 -0.36 0.00 0.00 55.97 55.15 1o3e s LYS 107 Cb -0.17 -3.19 -0.07 0.00 -1.51 0.00 0.00 37.83 32.89 1o3e s LYS 107 CO 0.06 0.67 0.57 -0.51 -0.36 0.00 0.00 175.35 175.78 1o3e s LEU 108 N -0.73 4.24 0.19 5.43 1.43 0.38 0.36 118.68 129.99 1o3e s LEU 108 Ca 0.13 1.03 -0.13 0.00 -1.03 0.00 0.00 54.13 54.13 1o3e s LEU 108 Cb -0.12 -3.52 0.10 0.00 0.03 0.00 0.00 46.19 42.68 1o3e s LEU 108 CO 0.03 -0.00 1.85 0.50 0.23 0.00 0.00 176.35 178.96 1o3e h LYS 109 N 3.00 0.82 -4.90 1.70 3.64 -1.21 -3.41 116.57 116.20 1o3e h LYS 109 Ca -0.48 -0.05 -0.29 0.00 -1.27 0.00 0.00 60.65 58.56 1o3e h LYS 109 Cb 1.18 -0.18 -0.15 0.00 -0.41 0.00 0.00 32.23 32.67 1o3e h LYS 109 CO 0.67 0.55 -0.70 -1.54 -2.27 0.00 0.00 179.45 176.15 1o3e s SER 110 N -5.77 1.53 0.55 4.20 1.04 -1.26 -4.99 113.70 109.00 1o3e s SER 110 Ca -0.13 -1.02 -0.18 0.00 0.48 0.00 0.00 55.95 55.10 1o3e s SER 110 Cb 0.13 0.03 -0.05 0.00 0.10 0.00 0.00 66.02 66.23 1o3e s SER 110 CO 0.76 -0.40 1.05 0.00 0.98 0.00 0.00 173.24 175.64 1o3e s ALA 111 N -3.45 2.78 0.45 5.32 0.00 -1.26 -4.85 121.76 120.75 1o3e s ALA 111 Ca 0.15 0.49 -0.08 0.00 0.00 0.00 0.00 51.96 52.53 1o3e s ALA 111 Cb 0.04 -3.25 -0.05 0.00 0.00 0.00 0.00 23.12 19.86 1o3e s ALA 111 CO -0.01 -0.63 0.79 0.00 0.00 0.00 0.00 175.76 175.91 1o3e s ALA 112 N -2.25 3.36 -0.31 0.00 0.00 0.05 -5.01 121.76 117.60 1o3e s ALA 112 Ca 0.65 -0.32 -0.19 0.00 0.00 0.00 0.00 51.96 52.10 1o3e s ALA 112 Cb -0.17 -2.68 -0.01 0.00 0.00 0.00 0.00 23.12 20.26 1o3e s ALA 112 CO 0.30 -0.20 0.55 -1.54 0.00 0.00 0.00 175.76 174.87 1o3e s SER 113 N -3.63 6.40 0.20 0.00 1.04 -1.26 -4.89 113.70 111.56 1o3e s SER 113 Ca 0.50 0.27 -0.15 0.00 0.48 0.00 0.00 55.95 57.04 1o3e s SER 113 Cb -0.10 -2.29 -0.08 0.00 0.10 0.00 0.00 66.02 63.65 1o3e s SER 113 CO 0.39 -0.43 0.62 -0.76 0.98 0.00 0.00 173.24 174.04 1o3e s LEU 114 N 2.45 4.29 0.00 2.42 1.43 -1.26 -4.77 118.68 123.23 1o3e s LEU 114 Ca 0.21 1.18 0.00 0.00 -1.03 0.00 0.00 54.13 54.49 1o3e s LEU 114 Cb -0.15 -3.49 0.00 0.00 0.03 0.00 0.00 46.19 42.57 1o3e s LEU 114 CO 0.12 0.03 0.00 -0.46 0.23 0.00 0.00 176.35 176.27 1o3e n ASN 115 N 0.55 0.00 0.19 2.29 0.23 0.58 -4.96 115.26 114.14 1o3e n ASN 115 Ca -0.03 0.00 0.09 0.00 -0.53 0.00 0.00 54.58 54.11 1o3e n ASN 115 Cb 0.52 0.00 0.16 0.00 -2.08 0.00 0.00 39.78 38.38 1o3e n ASN 115 CO 0.00 0.00 0.00 0.77 -0.93 0.00 0.00 177.26 177.10 1o3e h SER 116 N 0.00 0.00 0.68 0.53 4.64 -2.00 -3.27 113.55 114.13 1o3e h SER 116 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1o3e h SER 116 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1o3e h SER 116 CO 0.00 0.20 -1.28 0.54 -0.87 0.00 0.00 176.83 175.42 1o3e n ARG 117 N -3.16 0.59 -3.82 4.77 3.00 -1.26 -4.72 116.66 112.05 1o3e n ARG 117 Ca 0.03 0.02 -0.28 0.00 -0.01 0.00 0.00 57.85 57.61 1o3e n ARG 117 Cb 0.59 -1.72 -0.16 0.00 0.00 0.00 0.00 32.46 31.16 1o3e n ARG 117 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.63 177.71 1o3e s VAL 118 N -3.39 0.90 0.05 1.55 1.01 -1.23 -4.50 120.40 114.78 1o3e s VAL 118 Ca -0.02 -0.71 -0.03 0.00 0.00 0.00 0.00 61.98 61.22 1o3e s VAL 118 Cb 0.11 -1.26 -0.03 0.00 0.00 0.00 0.00 36.38 35.21 1o3e s VAL 118 CO 0.82 -0.09 0.02 0.00 0.00 0.00 0.00 175.10 175.86 1o3e s ALA 119 N 1.70 0.24 0.44 5.51 0.00 -0.98 -0.31 121.76 128.36 1o3e s ALA 119 Ca -0.02 -0.90 0.01 0.00 0.00 0.00 0.00 51.96 51.05 1o3e s ALA 119 Cb -0.17 0.27 -0.00 0.00 0.00 0.00 0.00 23.12 23.22 1o3e s ALA 119 CO -0.07 -0.34 0.65 -1.54 0.00 0.00 0.00 175.76 174.45 1o3e s SER 120 N -2.53 5.79 0.12 0.00 1.04 -1.26 -3.19 113.70 113.68 1o3e s SER 120 Ca 0.01 0.18 0.07 0.00 0.48 0.00 0.00 55.95 56.69 1o3e s SER 120 Cb 0.03 -1.41 -0.04 0.00 0.10 0.00 0.00 66.02 64.70 1o3e s SER 120 CO -0.08 -0.71 -0.08 -0.51 0.98 0.00 0.00 173.24 172.85 1o3e s ILE 121 N -2.52 3.43 0.37 -1.02 1.10 -0.39 -4.89 121.20 117.28 1o3e s ILE 121 Ca 0.49 -1.32 -0.18 0.00 -0.51 0.00 0.00 60.65 59.12 1o3e s ILE 121 Cb -0.10 -2.63 -0.10 0.00 0.15 0.00 0.00 42.46 39.78 1o3e s ILE 121 CO 0.37 0.06 0.84 -0.44 -2.11 0.00 0.00 174.94 173.65 1o3e s SER 122 N -2.39 6.88 0.40 4.50 0.01 -1.26 -4.57 113.70 117.27 1o3e s SER 122 Ca 0.23 1.48 -0.11 0.00 1.31 0.00 0.00 55.95 58.86 1o3e s SER 122 Cb -0.11 -2.45 -0.07 0.00 0.21 0.00 0.00 66.02 63.60 1o3e s SER 122 CO 0.15 -0.26 0.78 -0.76 0.41 0.00 0.00 173.24 173.55 1o3e s LEU 123 N -3.00 3.85 0.65 2.44 1.43 -1.26 -0.85 118.68 121.93 1o3e s LEU 123 Ca 0.57 1.17 -0.11 0.00 -1.03 0.00 0.00 54.13 54.73 1o3e s LEU 123 Cb -0.10 -4.05 -0.02 0.00 0.03 0.00 0.00 46.19 42.05 1o3e s LEU 123 CO 0.16 -0.39 1.05 -2.16 0.23 0.00 0.00 176.35 175.24 1o3e s PRO 124 N -3.76 3.32 -0.02 1.29 0.04 -1.26 -4.77 135.00 129.84 1o3e s PRO 124 Ca 0.52 0.68 0.16 0.00 0.04 0.00 0.00 61.00 62.40 1o3e s PRO 124 Cb -0.10 -2.05 -0.23 0.00 0.04 0.00 0.00 34.50 32.15 1o3e s PRO 124 CO 0.30 -0.76 0.37 0.25 0.04 0.00 0.00 177.00 177.20 1o3e n THR 125 N -2.86 0.00 -3.87 1.26 -2.24 -1.26 -4.96 114.28 100.35 1o3e n THR 125 Ca 0.06 -0.33 -0.09 0.00 -2.27 0.00 0.00 64.05 61.42 1o3e n THR 125 Cb 0.55 0.23 -0.07 0.00 -2.10 0.00 0.00 70.33 68.94 1o3e n THR 125 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1o3e s SER 127 N -3.65 0.08 0.67 3.42 1.04 -1.26 -5.14 113.70 108.86 1o3e s SER 127 Ca -0.05 -0.68 -0.11 0.00 0.48 0.00 0.00 55.95 55.60 1o3e s SER 127 Cb 0.10 0.37 -0.01 0.00 0.10 0.00 0.00 66.02 66.58 1o3e s SER 127 CO 0.65 -0.77 1.06 0.00 0.98 0.00 0.00 173.24 175.15 1o3e s ALA 129 N -3.21 3.68 0.27 0.00 0.00 -1.26 -5.09 121.76 116.16 1o3e s ALA 129 Ca 0.57 -0.81 0.02 0.00 0.00 0.00 0.00 51.96 51.74 1o3e s ALA 129 Cb -0.12 -2.16 -0.03 0.00 0.00 0.00 0.00 23.12 20.81 1o3e s ALA 129 CO 0.54 0.07 0.43 -1.54 0.00 0.00 0.00 175.76 175.26 1o3e s SER 130 N -3.76 6.32 0.61 0.00 1.04 -1.26 -5.03 113.70 111.62 1o3e s SER 130 Ca 0.41 0.26 -0.19 0.00 0.48 0.00 0.00 55.95 56.91 1o3e s SER 130 Cb -0.10 -1.95 -0.04 0.00 0.10 0.00 0.00 66.02 64.04 1o3e s SER 130 CO 0.34 -0.15 1.15 0.00 0.98 0.00 0.00 173.24 175.56 1o3e n ALA 132 N -1.43 0.76 0.00 5.32 0.00 -1.26 -1.79 120.51 122.10 1o3e n ALA 132 Ca -0.07 0.03 0.00 0.00 0.00 0.00 0.00 53.44 53.40 1o3e n ALA 132 Cb 0.56 -2.23 0.00 0.00 0.00 0.00 0.00 19.45 17.78 1o3e n ALA 132 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1o3e n GLY 133 N 1.07 3.14 3.75 0.00 0.00 0.55 -4.93 105.19 108.76 1o3e n GLY 133 Ca 0.14 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.74 1o3e n GLY 133 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1o3e n THR 134 N -1.30 1.23 -3.49 2.61 -1.04 -0.74 -4.62 114.28 106.92 1o3e n THR 134 Ca 0.00 -0.31 -0.37 0.00 -2.04 0.00 0.00 64.05 61.33 1o3e n THR 134 Cb 0.00 -1.95 -0.07 0.00 -1.82 0.00 0.00 70.33 66.50 1o3e n THR 134 CO 0.00 0.00 0.00 -1.58 -0.64 0.00 0.00 175.07 172.85 1o3e s GLN 135 N -0.84 4.17 0.24 -2.82 2.00 -1.26 -1.19 119.66 119.97 1o3e s GLN 135 Ca 0.62 0.23 0.03 0.00 -2.00 0.00 0.00 55.36 54.24 1o3e s GLN 135 Cb -0.50 -3.38 -0.05 0.00 0.80 0.00 0.00 33.01 29.88 1o3e s GLN 135 CO 0.52 0.33 0.01 0.00 -0.50 0.00 0.00 175.29 175.64 1o3e s LEU 137 N -3.32 2.56 -0.06 0.00 2.96 0.26 -0.80 118.68 120.28 1o3e s LEU 137 Ca 0.30 -0.45 0.04 0.00 -0.22 0.00 0.00 54.13 53.79 1o3e s LEU 137 Cb 0.06 -1.59 -0.02 0.00 0.50 0.00 0.00 46.19 45.13 1o3e s LEU 137 CO 0.10 0.07 -0.17 -0.63 -1.32 0.00 0.00 176.35 174.39 1o3e s ILE 138 N 0.93 2.80 0.09 6.68 1.01 -0.20 -1.49 121.20 131.02 1o3e s ILE 138 Ca -0.03 -0.81 -0.02 0.00 0.00 0.00 0.00 60.65 59.79 1o3e s ILE 138 Cb -0.15 -2.08 -0.04 0.00 0.01 0.00 0.00 42.46 40.20 1o3e s ILE 138 CO -0.01 0.58 0.04 -0.94 0.00 0.00 0.00 174.94 174.60 1o3e s SER 139 N -0.48 0.37 0.00 3.58 1.04 -1.23 -1.01 113.70 115.96 1o3e s SER 139 Ca 0.06 -1.08 0.00 0.00 0.48 0.00 0.00 55.95 55.41 1o3e s SER 139 Cb -0.12 0.26 0.00 0.00 0.10 0.00 0.00 66.02 66.27 1o3e s SER 139 CO 0.01 -0.68 0.00 0.61 0.98 0.00 0.00 173.24 174.16 1o3e n GLY 140 N -0.01 1.83 1.83 7.32 0.00 -0.48 -4.51 105.19 111.18 1o3e n GLY 140 Ca -0.10 -1.07 -0.12 0.00 0.00 0.00 0.00 46.02 44.74 1o3e n GLY 140 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1o3e n TRP 141 N -0.88 2.30 -2.02 1.61 8.01 -1.26 -2.25 117.44 122.95 1o3e n TRP 141 Ca 0.00 -1.53 -0.29 0.00 -1.31 0.00 0.00 57.50 54.37 1o3e n TRP 141 Cb 0.00 -0.73 0.15 0.00 -2.01 0.00 0.00 31.31 28.72 1o3e n TRP 141 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.69 176.88 1o3e s GLY 142 N -1.54 1.73 0.27 6.99 0.00 -1.25 -4.35 107.32 109.17 1o3e s GLY 142 Ca 0.53 -1.12 -0.29 0.00 0.00 0.00 0.00 44.72 43.84 1o3e s GLY 142 CO 0.09 -0.46 1.02 -2.01 0.00 0.00 0.00 173.10 171.74 1o3e n ASN 143 N -3.50 1.27 -0.69 1.64 5.15 0.16 -2.62 115.26 116.66 1o3e n ASN 143 Ca 0.13 1.17 0.08 0.00 -0.60 0.00 0.00 54.58 55.36 1o3e n ASN 143 Cb 0.60 -1.27 0.11 0.00 -0.53 0.00 0.00 39.78 38.68 1o3e n ASN 143 CO 0.00 0.00 0.00 0.35 1.40 0.00 0.00 177.26 179.01 1o3e n THR 144 N 0.40 0.30 -4.96 -0.44 -2.24 -0.65 -0.14 114.28 106.55 1o3e n THR 144 Ca 0.10 -0.65 -0.32 0.00 -2.27 0.00 0.00 64.05 60.92 1o3e n THR 144 Cb 0.31 1.08 -0.14 0.00 -2.10 0.00 0.00 70.33 69.48 1o3e n THR 144 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1o3e s LYS 145 N -1.20 2.28 -0.01 -0.78 1.02 -1.26 -4.44 119.74 115.36 1o3e s LYS 145 Ca 0.22 -0.83 0.09 0.00 0.02 0.00 0.00 55.97 55.47 1o3e s LYS 145 Cb 0.14 -2.23 -0.23 0.00 -0.52 0.00 0.00 37.83 34.98 1o3e s LYS 145 CO 0.20 0.59 0.81 0.66 -0.92 0.00 0.00 175.35 176.68 1o3e h SER 146 N 5.20 0.06 -3.44 2.83 4.64 -1.93 -3.39 113.55 117.52 1o3e h SER 146 Ca -0.46 -0.11 -0.63 0.00 -0.47 0.00 0.00 61.79 60.12 1o3e h SER 146 Cb 1.14 -0.02 -0.41 0.00 -0.31 0.00 0.00 62.40 62.80 1o3e h SER 146 CO 0.49 1.10 -0.54 -0.44 -0.87 0.00 0.00 176.83 176.56 1o3e s SER 147 N -6.38 4.83 0.00 4.97 0.01 -1.26 -4.52 113.70 111.35 1o3e s SER 147 Ca -0.05 -3.63 0.00 0.00 1.31 0.00 0.00 55.95 53.58 1o3e s SER 147 Cb 0.08 -1.67 0.00 0.00 0.21 0.00 0.00 66.02 64.64 1o3e s SER 147 CO 0.82 -0.13 0.00 0.61 0.41 0.00 0.00 173.24 174.95 1o3e n GLY 148 N 2.29 0.95 3.05 3.44 0.00 -1.26 -5.08 105.19 108.58 1o3e n GLY 148 Ca 0.16 -2.14 -0.28 0.00 0.00 0.00 0.00 46.02 43.76 1o3e n GLY 148 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1o3e s THR 149 N -1.00 1.43 -0.22 2.61 -4.23 -1.26 -4.53 115.64 108.44 1o3e s THR 149 Ca 0.00 -0.61 -0.04 0.00 -1.18 0.00 0.00 61.69 59.87 1o3e s THR 149 Cb 0.00 -1.31 0.10 0.00 1.34 0.00 0.00 72.50 72.62 1o3e s THR 149 CO 0.00 0.43 0.20 -0.55 -0.54 0.00 0.00 174.62 174.16 1o3e s SER 150 N 0.96 1.79 -0.15 3.99 0.15 -1.26 -4.98 113.70 114.20 1o3e s SER 150 Ca -0.07 -0.47 -0.09 0.00 0.70 0.00 0.00 55.95 56.01 1o3e s SER 150 Cb -0.15 0.23 -0.05 0.00 -1.71 0.00 0.00 66.02 64.35 1o3e s SER 150 CO -0.01 -0.35 0.17 -0.31 1.20 0.00 0.00 173.24 173.94 1o3e s TYR 151 N 2.28 3.52 0.70 3.44 1.51 -1.26 -1.64 117.35 125.90 1o3e s TYR 151 Ca 0.07 0.49 -0.09 0.00 -1.01 0.00 0.00 57.07 56.52 1o3e s TYR 151 Cb -0.16 -2.09 0.04 0.00 -0.11 0.00 0.00 41.96 39.64 1o3e s TYR 151 CO -0.17 0.50 1.05 -1.25 -1.11 0.00 0.00 175.55 174.57 1o3e s PRO 152 N -0.32 2.53 -0.19 -1.71 0.04 -1.26 -5.01 135.00 129.09 1o3e s PRO 152 Ca 0.13 0.12 -0.05 0.00 0.04 0.00 0.00 61.00 61.24 1o3e s PRO 152 Cb -0.12 -2.10 -0.22 0.00 0.04 0.00 0.00 34.50 32.11 1o3e s PRO 152 CO 0.02 -1.12 0.10 -0.25 0.04 0.00 0.00 177.00 175.78 1o3e n ASP 153 N -2.96 2.05 -4.92 6.66 8.00 -1.26 -4.90 116.55 119.22 1o3e n ASP 153 Ca 0.07 0.09 -0.20 0.00 0.71 0.00 0.00 54.79 55.46 1o3e n ASP 153 Cb 0.59 -0.70 -0.02 0.00 -0.02 0.00 0.00 41.12 40.97 1o3e n ASP 153 CO 0.00 0.00 0.00 0.68 -0.39 0.00 0.00 177.20 177.49 1o3e s VAL 154 N -2.53 4.00 0.21 2.53 -7.23 -1.26 -1.06 120.40 115.06 1o3e s VAL 154 Ca -0.28 -1.17 -0.30 0.00 -1.81 0.00 0.00 61.98 58.41 1o3e s VAL 154 Cb 0.08 -3.36 -0.09 0.00 0.56 0.00 0.00 36.38 33.56 1o3e s VAL 154 CO 0.68 -0.19 1.40 -0.22 -0.31 0.00 0.00 175.10 176.46 1o3e s LEU 155 N -4.06 4.39 0.09 1.32 2.96 -1.21 -4.82 118.68 117.35 1o3e s LEU 155 Ca 0.41 2.53 0.06 0.00 -0.22 0.00 0.00 54.13 56.91 1o3e s LEU 155 Cb -0.08 -3.61 -0.04 0.00 0.50 0.00 0.00 46.19 42.96 1o3e s LEU 155 CO 0.29 -0.64 -0.05 -0.54 -1.32 0.00 0.00 176.35 174.08 1o3e s LYS 156 N -0.00 2.37 0.12 1.98 -0.14 -0.96 -1.76 119.74 121.36 1o3e s LYS 156 Ca 0.60 -0.90 0.07 0.00 -1.36 0.00 0.00 55.97 54.38 1o3e s LYS 156 Cb -0.40 -2.44 -0.04 0.00 -1.68 0.00 0.00 37.83 33.28 1o3e s LYS 156 CO 0.39 0.53 -0.18 0.00 -0.76 0.00 0.00 175.35 175.34 1o3e s LEU 158 N -2.26 0.65 -0.18 0.00 2.96 -0.18 -0.40 118.68 119.27 1o3e s LEU 158 Ca 0.09 0.64 -0.08 0.00 -0.22 0.00 0.00 54.13 54.56 1o3e s LEU 158 Cb -0.07 1.05 -0.04 0.00 0.50 0.00 0.00 46.19 47.62 1o3e s LEU 158 CO 0.04 -0.13 0.07 -0.54 -1.32 0.00 0.00 176.35 174.48 1o3e s LYS 159 N 0.47 3.97 -0.03 1.98 -0.14 -1.26 -1.03 119.74 123.71 1o3e s LYS 159 Ca -0.03 -0.32 -0.11 0.00 -1.36 0.00 0.00 55.97 54.15 1o3e s LYS 159 Cb -0.04 -3.23 0.02 0.00 -1.68 0.00 0.00 37.83 32.90 1o3e s LYS 159 CO -0.02 0.30 0.24 0.00 -0.76 0.00 0.00 175.35 175.11 1o3e s ALA 160 N 0.30 -0.60 0.38 5.17 0.00 0.02 -4.95 121.76 122.08 1o3e s ALA 160 Ca 0.04 0.26 -0.04 0.00 0.00 0.00 0.00 51.96 52.22 1o3e s ALA 160 Cb -0.12 -0.03 -0.04 0.00 0.00 0.00 0.00 23.12 22.93 1o3e s ALA 160 CO -0.00 -0.21 0.66 -1.25 0.00 0.00 0.00 175.76 174.95 1o3e s PRO 161 N -1.02 3.59 0.11 0.00 0.04 -1.26 -0.69 135.00 135.76 1o3e s PRO 161 Ca -0.11 0.05 -0.27 0.00 0.04 0.00 0.00 61.00 60.72 1o3e s PRO 161 Cb -0.05 -2.53 -0.06 0.00 0.04 0.00 0.00 34.50 31.90 1o3e s PRO 161 CO 0.02 0.03 0.83 0.42 0.04 0.00 0.00 177.00 178.34 1o3e s ILE 162 N -2.39 4.53 0.50 0.56 1.01 -0.33 -1.52 121.20 123.57 1o3e s ILE 162 Ca 0.45 1.78 -0.00 0.00 0.00 0.00 0.00 60.65 62.89 1o3e s ILE 162 Cb -0.10 -4.18 0.01 0.00 0.01 0.00 0.00 42.46 38.19 1o3e s ILE 162 CO 0.36 0.40 0.73 -0.76 0.00 0.00 0.00 174.94 175.68 1o3e s LEU 163 N -0.41 3.47 0.71 2.97 1.43 -0.01 -0.33 118.68 126.51 1o3e s LEU 163 Ca 0.40 0.22 -0.11 0.00 -1.03 0.00 0.00 54.13 53.62 1o3e s LEU 163 Cb -0.22 -3.09 0.02 0.00 0.03 0.00 0.00 46.19 42.92 1o3e s LEU 163 CO 0.26 -0.90 1.07 -0.94 0.23 0.00 0.00 176.35 176.07 1o3e s SER 164 N -4.30 5.24 0.31 2.29 1.04 -1.26 -4.68 113.70 112.34 1o3e s SER 164 Ca 0.52 1.61 0.01 0.00 0.48 0.00 0.00 55.95 58.58 1o3e s SER 164 Cb -0.10 -2.47 0.50 0.00 0.10 0.00 0.00 66.02 64.05 1o3e s SER 164 CO 0.39 -1.53 1.86 -0.78 0.98 0.00 0.00 173.24 174.16 1o3e h ASP 165 N -0.78 0.67 -0.61 7.02 -0.00 -1.97 -2.01 116.42 118.74 1o3e h ASP 165 Ca -0.44 -0.11 -0.09 0.00 -0.00 0.00 0.00 57.03 56.39 1o3e h ASP 165 Cb 1.22 -0.17 -0.02 0.00 -0.00 0.00 0.00 39.33 40.35 1o3e h ASP 165 CO 0.56 0.66 0.02 0.28 -0.00 0.00 0.00 179.24 180.77 1o3e h SER 166 N 0.70 1.04 -0.31 2.28 0.02 -1.98 -0.64 113.55 114.66 1o3e h SER 166 Ca 0.16 -0.29 -0.14 0.00 -0.84 0.00 0.00 61.79 60.69 1o3e h SER 166 Cb 0.26 -0.28 -0.01 0.00 0.14 0.00 0.00 62.40 62.51 1o3e h SER 166 CO -0.00 1.08 -0.31 0.28 -1.14 0.00 0.00 176.83 176.74 1o3e h SER 167 N 0.98 0.87 0.17 3.07 0.02 -1.84 -0.17 113.55 116.66 1o3e h SER 167 Ca 0.18 -0.36 -0.01 0.00 -0.84 0.00 0.00 61.79 60.76 1o3e h SER 167 Cb 0.53 -0.24 0.00 0.00 0.14 0.00 0.00 62.40 62.83 1o3e h SER 167 CO 0.03 1.11 -0.08 0.00 -1.14 0.00 0.00 176.83 176.74 1o3e h LYS 169 N -0.37 0.21 0.00 0.00 1.57 -1.09 -1.10 116.57 115.79 1o3e h LYS 169 Ca -0.02 -0.06 -0.07 0.00 -1.87 0.00 0.00 60.65 58.63 1o3e h LYS 169 Cb 0.29 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.57 1o3e h LYS 169 CO 0.04 0.40 -0.33 1.03 -0.57 0.00 0.00 179.45 180.02 1o3e h SER 170 N 0.20 0.00 0.57 0.86 0.87 -0.83 -2.11 113.55 113.12 1o3e h SER 170 Ca 0.04 0.00 -0.28 0.00 -1.23 0.00 0.00 61.79 60.31 1o3e h SER 170 Cb 0.44 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 62.40 1o3e h SER 170 CO 0.03 0.33 -1.36 0.00 -0.53 0.00 0.00 176.83 175.29 1o3e h ALA 171 N 1.67 0.20 -2.20 6.23 0.00 -0.24 -3.38 119.26 121.55 1o3e h ALA 171 Ca -0.00 -1.00 -0.57 0.00 0.00 0.00 0.00 54.91 53.34 1o3e h ALA 171 Cb 0.89 0.13 -0.41 0.00 0.00 0.00 0.00 17.79 18.39 1o3e h ALA 171 CO 0.04 1.08 -0.76 0.66 0.00 0.00 0.00 179.25 180.27 1o3e n TYR 172 N -3.47 3.00 -1.63 0.00 4.01 -0.60 -4.97 117.16 113.51 1o3e n TYR 172 Ca -0.12 -3.97 -0.49 0.00 -0.16 0.00 0.00 57.90 53.17 1o3e n TYR 172 Cb 1.03 -0.48 -0.05 0.00 -0.31 0.00 0.00 39.34 39.53 1o3e n TYR 172 CO 0.00 0.00 0.00 -0.35 -0.46 0.00 0.00 176.86 176.05 1o3e n PRO 173 N 0.16 1.62 -0.96 -0.72 -0.04 -0.80 -1.68 135.00 132.59 1o3e n PRO 173 Ca 0.29 0.58 0.00 0.00 -0.04 0.00 0.00 63.50 64.33 1o3e n PRO 173 Cb 0.45 -2.26 0.00 0.00 -0.04 0.00 0.00 33.50 31.65 1o3e n PRO 173 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1o3e n GLY 174 N 2.76 0.36 0.00 0.55 0.00 -1.26 -4.86 105.19 102.74 1o3e n GLY 174 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.19 1o3e n GLY 174 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1o3e n GLN 175 N -1.52 0.12 -3.78 1.61 6.02 -0.68 -4.99 117.38 114.16 1o3e n GLN 175 Ca 0.00 -0.42 -0.36 0.00 -0.01 0.00 0.00 57.00 56.20 1o3e n GLN 175 Cb 0.16 -0.92 -0.10 0.00 1.02 0.00 0.00 30.24 30.39 1o3e n GLN 175 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 1o3e s ILE 176 N -0.14 4.96 0.53 5.09 -1.09 -1.25 -5.04 121.20 124.26 1o3e s ILE 176 Ca 0.00 0.04 0.08 0.00 -2.23 0.00 0.00 60.65 58.54 1o3e s ILE 176 Cb 0.00 -3.30 0.05 0.00 -1.58 0.00 0.00 42.46 37.63 1o3e s ILE 176 CO 0.00 0.37 0.64 0.42 -1.23 0.00 0.00 174.94 175.14 1o3e s THR 177 N 1.06 2.25 -1.52 2.92 -4.23 -1.26 -4.96 115.64 109.89 1o3e s THR 177 Ca 0.06 -1.13 0.16 0.00 -1.18 0.00 0.00 61.69 59.60 1o3e s THR 177 Cb -0.14 -2.37 0.30 0.00 1.34 0.00 0.00 72.50 71.63 1o3e s THR 177 CO 0.04 0.00 1.43 -1.54 -0.54 0.00 0.00 174.62 174.01 1o3e n SER 178 N -2.02 0.00 -1.83 3.99 3.41 -1.26 -2.44 113.62 113.47 1o3e n SER 178 Ca 0.10 -0.03 0.07 0.00 -0.26 0.00 0.00 58.87 58.75 1o3e n SER 178 Cb 0.62 -0.24 0.40 0.00 -0.26 0.00 0.00 64.21 64.73 1o3e n SER 178 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1o3e n ASN 179 N -1.24 5.61 -4.16 4.04 3.02 -1.26 -4.91 115.26 116.36 1o3e n ASN 179 Ca 0.08 -2.90 -0.12 0.00 -0.03 0.00 0.00 54.58 51.61 1o3e n ASN 179 Cb 0.11 -0.67 -0.10 0.00 -0.61 0.00 0.00 39.78 38.51 1o3e n ASN 179 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 1o3e s MET 180 N -2.71 0.81 0.05 3.52 -1.94 -1.02 -1.16 119.30 116.84 1o3e s MET 180 Ca 0.54 -1.23 -0.15 0.00 -1.71 0.00 0.00 55.69 53.14 1o3e s MET 180 Cb 0.41 -0.29 0.02 0.00 2.01 0.00 0.00 34.83 36.99 1o3e s MET 180 CO 0.16 0.01 0.34 -0.59 -0.01 0.00 0.00 175.02 174.93 1o3e s PHE 181 N -3.12 -0.15 0.07 -0.03 -0.71 -0.48 -4.79 117.98 108.76 1o3e s PHE 181 Ca 0.08 0.03 0.02 0.00 -1.04 0.00 0.00 56.93 56.03 1o3e s PHE 181 Cb 0.02 0.13 -0.04 0.00 -1.21 0.00 0.00 43.02 41.92 1o3e s PHE 181 CO -0.03 -0.53 0.09 0.00 -1.34 0.00 0.00 175.22 173.41 1o3e s ALA 183 N -1.37 -0.74 0.00 0.00 0.00 -0.93 -0.83 121.76 117.89 1o3e s ALA 183 Ca 0.29 0.65 0.00 0.00 0.00 0.00 0.00 51.96 52.90 1o3e s ALA 183 Cb -0.12 -0.30 0.00 0.00 0.00 0.00 0.00 23.12 22.70 1o3e s ALA 183 CO 0.21 -0.18 0.00 0.41 0.00 0.00 0.00 175.76 176.20 1o3e n GLY 184 N 2.35 0.80 2.91 0.00 0.00 -0.57 -2.81 105.19 107.86 1o3e n GLY 184 Ca -0.16 -1.71 -0.27 0.00 0.00 0.00 0.00 46.02 43.88 1o3e n GLY 184 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1o3e s TYR 184 N -3.47 1.48 0.16 1.61 2.02 -1.26 -4.39 117.35 113.50 1o3e s TYR 184 Ca 0.00 -0.73 0.34 0.00 -0.37 0.00 0.00 57.07 56.30 1o3e s TYR 184 Cb 0.00 -1.23 1.42 0.00 -0.40 0.00 0.00 41.96 41.75 1o3e s TYR 184 CO 0.00 -0.51 2.01 -0.07 -1.57 0.00 0.00 175.55 175.41 1o3e h LEU 185 N 8.14 0.00 -0.33 -1.29 3.38 -1.95 -2.12 115.31 121.14 1o3e h LEU 185 Ca -0.30 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.67 1o3e h LEU 185 Cb 1.13 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.88 1o3e h LEU 185 CO 0.41 0.02 0.00 -1.84 0.09 0.00 0.00 178.44 177.12 1o3e n GLU 186 N -3.13 0.22 0.00 1.13 0.00 -1.26 -0.34 120.64 117.26 1o3e n GLU 186 Ca 0.00 0.31 0.00 0.00 0.00 0.00 0.00 57.16 57.47 1o3e n GLU 186 Cb 0.29 -1.82 0.00 0.00 0.00 0.00 0.00 31.44 29.92 1o3e n GLU 186 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1o3e n GLY 187 N 0.67 -3.52 1.14 -1.84 0.00 -0.80 -4.53 105.19 96.32 1o3e n GLY 187 Ca 0.04 -1.88 0.00 0.00 0.00 0.00 0.00 46.02 44.18 1o3e n GLY 187 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1o3e n GLY 188 N -0.42 2.84 2.87 -0.02 0.00 -0.48 -4.92 105.19 105.06 1o3e n GLY 188 Ca 0.00 -0.02 -0.19 0.00 0.00 0.00 0.00 46.02 45.81 1o3e n GLY 188 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1o3e s LYS 188 N 0.00 0.66 0.04 1.61 1.02 -1.26 -3.56 119.74 118.26 1o3e s LYS 188 Ca 0.00 -0.04 -0.28 0.00 0.02 0.00 0.00 55.97 55.67 1o3e s LYS 188 Cb 0.00 -0.74 0.10 0.00 -0.52 0.00 0.00 37.83 36.67 1o3e s LYS 188 CO 0.00 -0.10 1.19 0.34 -0.92 0.00 0.00 175.35 175.86 1o3e s ASP 189 N 0.98 -0.05 0.59 2.83 3.68 -0.73 -4.29 116.67 119.68 1o3e s ASP 189 Ca -0.10 -0.28 0.01 0.00 2.13 0.00 0.00 52.55 54.31 1o3e s ASP 189 Cb -0.14 0.27 0.06 0.00 -1.45 0.00 0.00 42.92 41.65 1o3e s ASP 189 CO -0.01 -0.51 0.82 -0.94 0.13 0.00 0.00 175.17 174.67 1o3e s SER 190 N -3.23 5.06 0.22 -0.34 1.04 -1.26 -0.71 113.70 114.47 1o3e s SER 190 Ca 0.19 -0.14 -0.06 0.00 0.48 0.00 0.00 55.95 56.42 1o3e s SER 190 Cb 0.01 -0.62 0.02 0.00 0.10 0.00 0.00 66.02 65.54 1o3e s SER 190 CO -0.01 -1.32 0.41 0.00 0.98 0.00 0.00 173.24 173.30 1o3e n GLN 192 N -0.32 2.52 0.00 0.00 7.27 -1.26 -1.19 117.38 124.40 1o3e n GLN 192 Ca -0.03 0.90 0.00 0.00 0.07 0.00 0.00 57.00 57.93 1o3e n GLN 192 Cb 0.35 -2.66 0.00 0.00 2.41 0.00 0.00 30.24 30.33 1o3e n GLN 192 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1o3e n GLY 193 N 2.55 2.84 0.08 1.69 0.00 -1.26 -0.67 105.19 110.42 1o3e n GLY 193 Ca 0.11 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.24 1o3e n GLY 193 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1o3e n ASP 194 N 0.00 0.65 -4.49 1.61 8.00 -0.33 -3.92 116.55 118.07 1o3e n ASP 194 Ca 0.00 0.20 -0.47 0.00 0.71 0.00 0.00 54.79 55.22 1o3e n ASP 194 Cb 0.00 0.78 -0.03 0.00 -0.02 0.00 0.00 41.12 41.85 1o3e n ASP 194 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 1o3e n SER 195 N -2.49 -0.07 0.00 -2.24 7.64 -1.26 -1.53 113.62 113.67 1o3e n SER 195 Ca -0.00 1.15 0.00 0.00 1.01 0.00 0.00 58.87 61.03 1o3e n SER 195 Cb 0.54 -1.09 0.00 0.00 -1.01 0.00 0.00 64.21 62.65 1o3e n SER 195 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1o3e n GLY 196 N 1.70 2.57 3.90 0.23 0.00 -0.15 -0.96 105.19 112.47 1o3e n GLY 196 Ca 0.15 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.87 1o3e n GLY 196 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1o3e s GLY 197 N -1.95 1.74 0.38 -0.02 0.00 -0.58 -3.31 107.32 103.58 1o3e s GLY 197 Ca 0.00 -1.10 -0.16 0.00 0.00 0.00 0.00 44.72 43.46 1o3e s GLY 197 CO 0.00 -0.36 0.82 2.56 0.00 0.00 0.00 173.10 176.12 1o3e s PRO 198 N -5.80 4.01 -0.24 2.90 0.04 -1.26 -1.22 135.00 133.43 1o3e s PRO 198 Ca 0.72 0.78 -0.02 0.00 0.04 0.00 0.00 61.00 62.52 1o3e s PRO 198 Cb -0.05 -2.33 0.07 0.00 0.04 0.00 0.00 34.50 32.23 1o3e s PRO 198 CO 0.53 0.03 0.05 0.08 0.04 0.00 0.00 177.00 177.73 1o3e s VAL 199 N -2.17 0.70 -0.12 -0.36 1.01 -0.85 -3.54 120.40 115.07 1o3e s VAL 199 Ca 0.56 -0.89 0.00 0.00 0.00 0.00 0.00 61.98 61.65 1o3e s VAL 199 Cb -0.10 -1.30 -0.02 0.00 0.00 0.00 0.00 36.38 34.96 1o3e s VAL 199 CO 0.20 -0.36 -0.12 -0.69 0.00 0.00 0.00 175.10 174.13 1o3e s VAL 200 N 1.75 3.18 -0.06 2.92 1.01 -0.56 -1.16 120.40 127.49 1o3e s VAL 200 Ca 0.02 -0.63 0.01 0.00 0.00 0.00 0.00 61.98 61.38 1o3e s VAL 200 Cb -0.17 -2.33 0.02 0.00 0.00 0.00 0.00 36.38 33.90 1o3e s VAL 200 CO -0.14 0.53 -0.06 0.00 0.00 0.00 0.00 175.10 175.43 1o3e n SER 202 N 4.21 -1.99 -0.49 0.00 7.64 -1.26 -1.36 113.62 120.36 1o3e n SER 202 Ca -0.21 -0.98 -0.06 0.00 1.01 0.00 0.00 58.87 58.63 1o3e n SER 202 Cb 0.51 -3.06 -0.03 0.00 -1.01 0.00 0.00 64.21 60.62 1o3e n SER 202 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1o3e n GLY 203 N -1.73 0.80 3.22 0.23 0.00 -1.26 -5.00 105.19 101.46 1o3e n GLY 203 Ca -0.12 -0.26 -0.23 0.00 0.00 0.00 0.00 46.02 45.41 1o3e n GLY 203 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1o3e s LYS 204 N -2.15 1.15 -0.56 1.61 -0.14 -0.47 -4.11 119.74 115.07 1o3e s LYS 204 Ca 0.00 -0.95 -0.28 0.00 -1.36 0.00 0.00 55.97 53.38 1o3e s LYS 204 Cb 0.00 -1.27 0.03 0.00 -1.68 0.00 0.00 37.83 34.91 1o3e s LYS 204 CO 0.00 0.31 1.15 -1.17 -0.76 0.00 0.00 175.35 174.88 1o3e s LEU 209 N -1.41 3.57 -0.13 3.17 2.96 -0.03 -1.05 118.68 125.76 1o3e s LEU 209 Ca 0.05 0.10 0.20 0.00 -0.22 0.00 0.00 54.13 54.25 1o3e s LEU 209 Cb -0.09 -3.18 -0.29 0.00 0.50 0.00 0.00 46.19 43.14 1o3e s LEU 209 CO 0.02 -1.41 0.24 0.00 -1.32 0.00 0.00 176.35 173.89 1o3e n GLN 210 N 8.20 0.69 -4.17 1.98 1.13 -0.31 -4.12 117.38 120.79 1o3e n GLN 210 Ca 0.08 -0.09 -0.12 0.00 -1.94 0.00 0.00 57.00 54.93 1o3e n GLN 210 Cb 0.49 -1.52 -0.09 0.00 0.11 0.00 0.00 30.24 29.23 1o3e n GLN 210 CO 0.00 0.00 0.00 0.20 -1.44 0.00 0.00 177.06 175.82 1o3e s GLY 211 N -5.06 1.32 -0.05 1.08 0.00 -0.87 -1.53 107.32 102.22 1o3e s GLY 211 Ca -0.09 -1.59 0.02 0.00 0.00 0.00 0.00 44.72 43.06 1o3e s GLY 211 CO 0.86 -1.30 -0.10 -0.42 0.00 0.00 0.00 173.10 172.14 1o3e s ILE 212 N -4.14 0.91 0.05 0.90 1.01 -1.07 -2.02 121.20 116.85 1o3e s ILE 212 Ca 0.37 -0.38 -0.30 0.00 0.00 0.00 0.00 60.65 60.33 1o3e s ILE 212 Cb 0.06 -0.84 -0.08 0.00 0.01 0.00 0.00 42.46 41.61 1o3e s ILE 212 CO 0.12 0.30 1.79 -0.69 0.00 0.00 0.00 174.94 176.45 1o3e s VAL 213 N 0.51 3.01 0.02 2.92 1.01 -0.36 -1.41 120.40 126.10 1o3e s VAL 213 Ca -0.09 0.28 -0.00 0.00 0.00 0.00 0.00 61.98 62.16 1o3e s VAL 213 Cb -0.13 -3.18 -0.00 0.00 0.00 0.00 0.00 36.38 33.07 1o3e s VAL 213 CO 0.02 -0.01 -0.01 -0.24 0.00 0.00 0.00 175.10 174.86 1o3e n SER 214 N 6.49 0.28 -2.56 3.32 2.88 -0.92 -0.98 113.62 122.11 1o3e n SER 214 Ca 0.18 0.04 -0.10 0.00 -1.33 0.00 0.00 58.87 57.65 1o3e n SER 214 Cb 0.40 -0.12 -0.01 0.00 -0.75 0.00 0.00 64.21 63.74 1o3e n SER 214 CO 0.00 0.00 0.00 -2.67 -1.23 0.00 0.00 175.04 171.14 1o3e n TRP 215 N -2.75 -1.59 0.00 0.66 4.27 -0.92 -4.90 117.44 112.21 1o3e n TRP 215 Ca -0.00 -1.77 0.00 0.00 -3.89 0.00 0.00 57.50 51.84 1o3e n TRP 215 Cb 0.01 0.57 0.00 0.00 -1.36 0.00 0.00 31.31 30.53 1o3e n TRP 215 CO 0.00 0.00 0.00 0.41 -2.29 0.00 0.00 177.69 175.81 1o3e n GLY 216 N -0.46 0.30 3.30 -1.67 0.00 -1.26 -0.74 105.19 104.66 1o3e n GLY 216 Ca -0.02 -0.83 -0.42 0.00 0.00 0.00 0.00 46.02 44.74 1o3e n GLY 216 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1o3e s SER 217 N 0.00 5.89 0.23 1.61 0.15 -1.26 -4.92 113.70 115.39 1o3e s SER 217 Ca 0.00 -1.58 0.00 0.00 0.70 0.00 0.00 55.95 55.07 1o3e s SER 217 Cb 0.00 -2.08 0.00 0.00 -1.71 0.00 0.00 66.02 62.23 1o3e s SER 217 CO 0.00 -0.65 0.00 0.61 1.20 0.00 0.00 173.24 174.40 1o3e n GLY 219 N 5.05 -0.41 2.96 9.45 0.00 -1.26 -4.61 105.19 116.37 1o3e n GLY 219 Ca -0.11 -1.08 -0.13 0.00 0.00 0.00 0.00 46.02 44.70 1o3e n GLY 219 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1o3e n ALA 221 N 3.75 -0.95 -2.28 0.00 0.00 -1.26 -4.60 120.51 115.16 1o3e n ALA 221 Ca -0.21 0.14 -0.28 0.00 0.00 0.00 0.00 53.44 53.08 1o3e n ALA 221 Cb 0.55 -2.68 -0.02 0.00 0.00 0.00 0.00 19.45 17.29 1o3e n ALA 221 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1o3e s GLN 221 N -5.64 3.64 0.32 0.00 -1.52 -1.26 -1.39 119.66 113.81 1o3e s GLN 221 Ca 0.26 0.26 -0.29 0.00 -1.95 0.00 0.00 55.36 53.63 1o3e s GLN 221 Cb -0.13 -2.43 -0.10 0.00 -0.22 0.00 0.00 33.01 30.13 1o3e s GLN 221 CO 0.32 -0.07 1.38 0.21 -0.25 0.00 0.00 175.29 176.87 1o3e s LYS 222 N -4.23 4.28 -1.34 2.91 2.20 -1.26 -2.72 119.74 119.58 1o3e s LYS 222 Ca 0.48 2.31 0.00 0.00 -0.36 0.00 0.00 55.97 58.40 1o3e s LYS 222 Cb -0.10 -3.06 0.00 0.00 -1.51 0.00 0.00 37.83 33.16 1o3e s LYS 222 CO 0.37 -0.32 0.00 0.09 -0.36 0.00 0.00 175.35 175.14 1o3e n ASN 223 N 1.15 -4.65 -3.40 1.43 5.03 0.54 -4.89 115.26 110.47 1o3e n ASN 223 Ca 0.02 0.31 -0.26 0.00 0.87 0.00 0.00 54.58 55.52 1o3e n ASN 223 Cb 0.41 -3.79 -0.08 0.00 -1.02 0.00 0.00 39.78 35.29 1o3e n ASN 223 CO 0.00 0.00 0.00 0.29 -1.83 0.00 0.00 177.26 175.72 1o3e n LYS 224 N -1.34 1.63 -0.76 3.52 4.76 -1.10 -4.80 118.16 120.06 1o3e n LYS 224 Ca -0.13 -4.03 -0.28 0.00 -2.87 0.00 0.00 58.31 51.00 1o3e n LYS 224 Cb 0.52 -1.85 0.23 0.00 -1.84 0.00 0.00 35.03 32.09 1o3e n LYS 224 CO 0.00 0.00 0.00 -1.25 -1.37 0.00 0.00 177.40 174.78 1o3e s PRO 225 N -1.70 -0.58 0.49 1.97 0.04 -1.26 -4.42 135.00 129.53 1o3e s PRO 225 Ca 0.36 0.69 -0.13 0.00 0.04 0.00 0.00 61.00 61.96 1o3e s PRO 225 Cb 0.12 -1.60 -0.06 0.00 0.04 0.00 0.00 34.50 33.00 1o3e s PRO 225 CO -0.08 -3.46 0.90 0.20 0.04 0.00 0.00 177.00 174.60 1o3e s GLY 226 N -2.84 1.92 -0.06 0.56 0.00 -1.13 -4.59 107.32 101.18 1o3e s GLY 226 Ca 0.67 -0.05 0.05 0.00 0.00 0.00 0.00 44.72 45.39 1o3e s GLY 226 CO 0.62 0.18 -0.21 0.14 0.00 0.00 0.00 173.10 173.84 1o3e s VAL 227 N -2.62 2.42 0.11 1.40 1.01 0.09 -2.18 120.40 120.62 1o3e s VAL 227 Ca 0.55 -0.94 0.07 0.00 0.00 0.00 0.00 61.98 61.66 1o3e s VAL 227 Cb -0.10 -1.91 -0.04 0.00 0.00 0.00 0.00 36.38 34.33 1o3e s VAL 227 CO 0.36 0.57 -0.18 -0.31 0.00 0.00 0.00 175.10 175.54 1o3e s TYR 228 N -0.30 1.61 0.09 5.22 2.02 -0.01 -2.15 117.35 123.82 1o3e s TYR 228 Ca 0.01 -0.46 -0.30 0.00 -0.37 0.00 0.00 57.07 55.95 1o3e s TYR 228 Cb -0.13 -0.86 -0.05 0.00 -0.40 0.00 0.00 41.96 40.52 1o3e s TYR 228 CO 0.02 0.18 1.03 0.99 -1.57 0.00 0.00 175.55 176.20 1o3e s THR 229 N -1.49 4.42 -0.91 -0.71 2.01 -0.50 -1.39 115.64 117.07 1o3e s THR 229 Ca 0.07 1.90 -0.22 0.00 0.31 0.00 0.00 61.69 63.74 1o3e s THR 229 Cb -0.08 -4.21 0.07 0.00 0.01 0.00 0.00 72.50 68.28 1o3e s THR 229 CO 0.04 0.24 1.28 -0.75 -0.69 0.00 0.00 174.62 174.74 1o3e s LYS 230 N 0.36 3.47 0.41 4.92 2.20 -0.31 -2.60 119.74 128.18 1o3e s LYS 230 Ca 0.50 -1.11 0.09 0.00 -0.36 0.00 0.00 55.97 55.09 1o3e s LYS 230 Cb -0.25 -4.92 0.88 0.00 -1.51 0.00 0.00 37.83 32.03 1o3e s LYS 230 CO 0.30 -2.04 2.01 0.28 -0.36 0.00 0.00 175.35 175.54 1o3e h VAL 231 N 6.33 1.02 -0.17 4.02 2.07 -1.58 -2.68 116.25 125.26 1o3e h VAL 231 Ca 0.05 -0.19 0.05 0.00 0.82 0.00 0.00 66.70 67.43 1o3e h VAL 231 Cb 1.03 0.41 -0.01 0.00 -1.52 0.00 0.00 31.29 31.20 1o3e h VAL 231 CO 1.29 0.10 0.29 0.00 0.02 0.00 0.00 177.57 179.28 1o3e n ASN 233 N -3.41 0.34 -0.31 0.00 3.02 -1.01 -3.84 115.26 110.05 1o3e n ASN 233 Ca 0.02 0.52 0.03 0.00 -0.03 0.00 0.00 54.58 55.11 1o3e n ASN 233 Cb 0.40 -0.60 0.06 0.00 -0.61 0.00 0.00 39.78 39.03 1o3e n ASN 233 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 1o3e n TYR 234 N -1.81 0.16 -0.20 3.10 4.01 0.36 -4.79 117.16 117.99 1o3e n TYR 234 Ca 0.06 -0.31 -0.03 0.00 -0.16 0.00 0.00 57.90 57.46 1o3e n TYR 234 Cb 0.38 -0.02 0.07 0.00 -0.31 0.00 0.00 39.34 39.45 1o3e n TYR 234 CO 0.00 0.00 0.00 0.28 -0.46 0.00 0.00 176.86 176.68 1o3e h VAL 235 N 1.13 0.98 -0.50 -0.72 2.07 -1.64 0.64 116.25 118.21 1o3e h VAL 235 Ca 0.00 -0.21 -0.08 0.00 0.82 0.00 0.00 66.70 67.24 1o3e h VAL 235 Cb 0.48 0.33 -0.02 0.00 -1.52 0.00 0.00 31.29 30.56 1o3e h VAL 235 CO 0.00 0.11 -0.00 0.77 0.02 0.00 0.00 177.57 178.47 1o3e h SER 236 N 0.60 0.80 -0.05 0.57 4.64 -1.88 -0.39 113.55 117.85 1o3e h SER 236 Ca 0.25 -0.20 -0.00 0.00 -0.47 0.00 0.00 61.79 61.37 1o3e h SER 236 Cb 0.13 -0.21 -0.00 0.00 -0.31 0.00 0.00 62.40 62.01 1o3e h SER 236 CO -0.16 0.87 0.02 -0.25 -0.87 0.00 0.00 176.83 176.44 1o3e h TRP 237 N 0.77 0.07 -0.04 4.77 7.01 -1.74 0.38 115.95 127.18 1o3e h TRP 237 Ca 0.15 -0.01 0.01 0.00 2.11 0.00 0.00 58.89 61.15 1o3e h TRP 237 Cb 0.47 -0.02 -0.01 0.00 -2.10 0.00 0.00 29.16 27.50 1o3e h TRP 237 CO 0.03 0.23 -0.01 0.82 -2.79 0.00 0.00 178.44 176.71 1o3e h ILE 238 N -0.10 0.96 -0.52 2.65 2.04 -0.65 0.51 117.51 122.40 1o3e h ILE 238 Ca 0.02 -0.00 0.03 0.00 1.00 0.00 0.00 64.86 65.91 1o3e h ILE 238 Cb 0.19 0.96 -0.04 0.00 -0.74 0.00 0.00 36.82 37.19 1o3e h ILE 238 CO -0.00 0.00 0.30 0.11 0.00 0.00 0.00 178.15 178.56 1o3e h LYS 239 N 0.00 0.56 -0.43 2.37 1.57 -0.91 -1.14 116.57 118.59 1o3e h LYS 239 Ca 0.02 -0.03 -0.14 0.00 -1.87 0.00 0.00 60.65 58.62 1o3e h LYS 239 Cb 0.03 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 32.20 1o3e h LYS 239 CO -0.04 0.37 -0.29 1.96 -0.57 0.00 0.00 179.45 180.89 1o3e h GLN 240 N 0.58 0.96 -0.45 3.15 4.20 -0.71 -1.47 115.11 121.37 1o3e h GLN 240 Ca 0.22 -0.45 -0.05 0.00 0.06 0.00 0.00 58.65 58.43 1o3e h GLN 240 Cb 0.07 -0.01 -0.02 0.00 0.30 0.00 0.00 27.48 27.82 1o3e h GLN 240 CO -0.12 1.12 0.10 1.15 -0.67 0.00 0.00 178.83 180.41 1o3e h THR 241 N 0.80 1.24 -0.53 -0.54 2.02 -0.65 -2.21 112.91 113.03 1o3e h THR 241 Ca 0.09 -0.83 -0.08 0.00 0.77 0.00 0.00 66.41 66.36 1o3e h THR 241 Cb 0.87 0.91 -0.02 0.00 -1.74 0.00 0.00 68.15 68.18 1o3e h THR 241 CO 0.08 0.29 0.04 0.40 0.37 0.00 0.00 175.52 176.70 1o3e h ILE 242 N 0.60 1.26 0.00 3.11 2.04 -1.17 -2.30 117.51 121.05 1o3e h ILE 242 Ca 0.14 -1.04 -0.02 0.00 1.00 0.00 0.00 64.86 64.94 1o3e h ILE 242 Cb 0.33 0.89 -0.00 0.00 -0.74 0.00 0.00 36.82 37.30 1o3e h ILE 242 CO 0.00 0.37 -0.10 0.00 0.00 0.00 0.00 178.15 178.43 1o3e h ALA 243 N 0.96 1.43 -0.48 1.87 0.00 -1.13 -2.63 119.26 119.29 1o3e h ALA 243 Ca 0.16 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.98 1o3e h ALA 243 Cb 0.48 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.25 1o3e h ALA 243 CO 0.02 0.12 0.00 0.43 0.00 0.00 0.00 179.25 179.82 1o3e n SER 244 N -3.83 3.47 0.00 0.00 7.64 -0.84 -5.09 113.62 114.98 1o3e n SER 244 Ca -0.02 -1.97 0.00 0.00 1.01 0.00 0.00 58.87 57.89 1o3e n SER 244 Cb 0.19 -0.31 0.00 0.00 -1.01 0.00 0.00 64.21 63.08 1o3e n SER 244 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62