#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bzx s VAL 17 N 0.00 5.32 -0.47 1.39 1.01 0.47 -3.92 120.40 124.19 1bzx s VAL 17 Ca 0.00 0.15 0.00 0.00 0.00 0.00 0.00 61.98 62.13 1bzx s VAL 17 Cb 0.00 -3.37 0.00 0.00 0.00 0.00 0.00 36.38 33.01 1bzx s VAL 17 CO 0.00 0.53 0.00 0.61 0.00 0.00 0.00 175.10 176.24 1bzx n GLY 18 N 2.81 0.67 0.00 4.51 0.00 -1.24 -1.81 105.19 110.12 1bzx n GLY 18 Ca -0.18 -0.28 0.00 0.00 0.00 0.00 0.00 46.02 45.57 1bzx n GLY 18 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1bzx n GLY 19 N -1.46 1.64 3.13 -0.02 0.00 -1.26 -4.87 105.19 102.35 1bzx n GLY 19 Ca -0.04 -1.91 -0.09 0.00 0.00 0.00 0.00 46.02 43.97 1bzx n GLY 19 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1bzx s TYR 20 N 2.12 0.22 0.11 1.61 1.13 0.17 -4.92 117.35 117.78 1bzx s TYR 20 Ca 0.00 -0.56 -0.31 0.00 -1.41 0.00 0.00 57.07 54.79 1bzx s TYR 20 Cb 0.00 -0.15 -0.09 0.00 -1.10 0.00 0.00 41.96 40.63 1bzx s TYR 20 CO 0.00 -0.40 1.56 -2.00 -2.51 0.00 0.00 175.55 172.20 1bzx s GLU 21 N -2.97 4.23 0.66 -3.49 2.12 -1.26 0.11 118.70 118.09 1bzx s GLU 21 Ca -0.02 2.28 -0.16 0.00 0.36 0.00 0.00 54.97 57.43 1bzx s GLU 21 Cb 0.01 -3.37 -0.00 0.00 0.26 0.00 0.00 34.13 31.03 1bzx s GLU 21 CO -0.06 -0.63 1.15 0.00 -0.54 0.00 0.00 175.26 175.18 1bzx s LYS 23 N -3.85 4.33 0.03 0.00 2.20 -1.26 -4.85 119.74 116.33 1bzx s LYS 23 Ca 0.71 1.96 -0.39 0.00 -0.36 0.00 0.00 55.97 57.89 1bzx s LYS 23 Cb -0.24 -3.41 -0.19 0.00 -1.51 0.00 0.00 37.83 32.47 1bzx s LYS 23 CO 0.40 -0.46 1.06 -2.30 -0.36 0.00 0.00 175.35 173.69 1bzx n PRO 24 N 4.58 0.15 -1.01 4.03 -0.02 -1.26 -0.72 135.00 140.76 1bzx n PRO 24 Ca 0.12 0.05 -0.00 0.00 -2.02 0.00 0.00 63.50 61.65 1bzx n PRO 24 Cb 0.44 -1.53 -0.00 0.00 -0.02 0.00 0.00 33.50 32.38 1bzx n PRO 24 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1bzx n TYR 25 N 1.49 0.00 0.40 6.00 4.01 -1.26 -4.85 117.16 122.96 1bzx n TYR 25 Ca 0.20 0.00 0.13 0.00 -0.16 0.00 0.00 57.90 58.06 1bzx n TYR 25 Cb 0.11 -1.35 0.51 0.00 -0.31 0.00 0.00 39.34 38.29 1bzx n TYR 25 CO 0.00 0.00 0.00 0.66 -0.46 0.00 0.00 176.86 177.06 1bzx h SER 26 N 0.00 0.00 -2.18 7.72 4.64 -1.29 -3.22 113.55 119.22 1bzx h SER 26 Ca -0.01 0.00 -0.58 0.00 -0.47 0.00 0.00 61.79 60.73 1bzx h SER 26 Cb 0.67 0.00 -0.41 0.00 -0.31 0.00 0.00 62.40 62.34 1bzx h SER 26 CO 0.01 0.00 -0.73 0.00 -0.87 0.00 0.00 176.83 175.24 1bzx n GLN 27 N -2.38 2.37 0.25 4.77 1.13 -1.26 -4.94 117.38 117.33 1bzx n GLN 27 Ca 0.02 -4.43 0.17 0.00 -1.94 0.00 0.00 57.00 50.82 1bzx n GLN 27 Cb 0.27 -2.07 0.80 0.00 0.11 0.00 0.00 30.24 29.35 1bzx n GLN 27 CO 0.00 0.00 0.00 -1.35 -1.44 0.00 0.00 177.06 174.27 1bzx h PRO 28 N 3.69 0.00 0.00 -1.09 0.11 -1.80 0.89 132.00 133.81 1bzx h PRO 28 Ca 0.15 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.26 1bzx h PRO 28 Cb 0.67 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.78 1bzx h PRO 28 CO 0.75 0.00 -0.37 1.12 -0.21 0.00 0.00 178.00 179.29 1bzx h HIS 29 N 0.00 0.00 -2.54 0.65 2.07 -1.71 -2.96 115.15 110.67 1bzx h HIS 29 Ca 0.07 0.00 -0.53 0.00 -2.85 0.00 0.00 60.37 57.05 1bzx h HIS 29 Cb 0.79 0.00 0.02 0.00 2.57 0.00 0.00 27.41 30.79 1bzx h HIS 29 CO 0.00 0.00 1.12 -1.14 -3.07 0.00 0.00 177.93 174.84 1bzx s GLN 30 N -3.19 4.17 0.34 5.12 2.00 0.30 -0.99 119.66 127.41 1bzx s GLN 30 Ca 0.07 2.43 0.10 0.00 -2.00 0.00 0.00 55.36 55.95 1bzx s GLN 30 Cb 0.11 -3.88 -0.06 0.00 0.80 0.00 0.00 33.01 29.97 1bzx s GLN 30 CO 0.68 -0.85 -0.10 0.14 -0.50 0.00 0.00 175.29 174.66 1bzx s VAL 31 N 3.61 2.23 -0.14 1.34 -7.23 -0.64 -4.55 120.40 115.01 1bzx s VAL 31 Ca 0.80 -2.21 0.02 0.00 -1.81 0.00 0.00 61.98 58.78 1bzx s VAL 31 Cb -0.40 -2.62 0.01 0.00 0.56 0.00 0.00 36.38 33.93 1bzx s VAL 31 CO 0.35 -0.22 -0.22 -0.55 -0.31 0.00 0.00 175.10 174.16 1bzx s SER 32 N -3.60 3.15 -0.24 4.85 0.15 -0.79 -2.62 113.70 114.61 1bzx s SER 32 Ca 0.32 -0.59 -0.21 0.00 0.70 0.00 0.00 55.95 56.17 1bzx s SER 32 Cb 0.02 -1.45 -0.02 0.00 -1.71 0.00 0.00 66.02 62.86 1bzx s SER 32 CO 0.16 0.08 0.63 -0.76 1.20 0.00 0.00 173.24 174.56 1bzx s LEU 33 N 0.81 4.09 -0.02 3.45 1.43 -0.11 -1.14 118.68 127.18 1bzx s LEU 33 Ca -0.07 0.75 0.07 0.00 -1.03 0.00 0.00 54.13 53.86 1bzx s LEU 33 Cb -0.16 -2.87 -0.02 0.00 0.03 0.00 0.00 46.19 43.17 1bzx s LEU 33 CO -0.02 -0.34 -0.24 0.21 0.23 0.00 0.00 176.35 176.19 1bzx s ASN 34 N 1.38 3.24 -0.34 2.29 3.84 0.09 -1.96 114.94 123.49 1bzx s ASN 34 Ca 0.27 -0.43 0.15 0.00 0.21 0.00 0.00 52.86 53.07 1bzx s ASN 34 Cb -0.16 -0.43 0.44 0.00 -0.55 0.00 0.00 41.25 40.55 1bzx s ASN 34 CO 0.09 0.32 1.26 -0.24 -2.79 0.00 0.00 177.10 175.75 1bzx n SER 37 N 2.37 -0.32 0.00 -4.21 2.88 -1.26 -1.71 113.62 111.37 1bzx n SER 37 Ca -0.16 -2.37 0.00 0.00 -1.33 0.00 0.00 58.87 55.01 1bzx n SER 37 Cb 0.51 0.27 0.00 0.00 -0.75 0.00 0.00 64.21 64.25 1bzx n SER 37 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1bzx n GLY 38 N -0.73 1.44 3.64 0.46 0.00 -1.26 -5.02 105.19 103.72 1bzx n GLY 38 Ca -0.02 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 45.99 1bzx n GLY 38 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1bzx s TYR 39 N -1.50 -0.09 -0.06 1.61 1.13 -1.26 -5.13 117.35 112.05 1bzx s TYR 39 Ca 0.00 -0.05 -0.30 0.00 -1.41 0.00 0.00 57.07 55.32 1bzx s TYR 39 Cb 0.00 0.56 -0.05 0.00 -1.10 0.00 0.00 41.96 41.38 1bzx s TYR 39 CO 0.00 -0.40 1.44 -1.58 -2.51 0.00 0.00 175.55 172.51 1bzx s HIS 40 N -2.65 2.59 0.00 -3.49 5.65 -1.26 -4.35 115.29 111.78 1bzx s HIS 40 Ca 0.12 0.67 0.00 0.00 0.25 0.00 0.00 55.06 56.11 1bzx s HIS 40 Cb 0.02 -3.70 0.00 0.00 -1.18 0.00 0.00 32.58 27.72 1bzx s HIS 40 CO -0.03 -2.69 0.00 1.97 -0.65 0.00 0.00 174.74 173.34 1bzx n PHE 41 N 6.19 0.00 -3.94 3.88 -1.74 -0.83 -5.02 117.46 116.00 1bzx n PHE 41 Ca 0.15 0.00 -0.09 0.00 -0.56 0.00 0.00 57.45 56.95 1bzx n PHE 41 Cb 0.44 0.00 -0.04 0.00 1.52 0.00 0.00 39.48 41.39 1bzx n PHE 41 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 1bzx n GLY 43 N -0.39 2.79 3.71 0.00 0.00 0.92 -0.94 105.19 111.28 1bzx n GLY 43 Ca -0.03 -2.27 -0.01 0.00 0.00 0.00 0.00 46.02 43.71 1bzx n GLY 43 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1bzx s GLY 44 N -3.61 -0.29 -0.08 -0.02 0.00 -1.08 -3.84 107.32 98.40 1bzx s GLY 44 Ca 0.25 0.35 0.02 0.00 0.00 0.00 0.00 44.72 45.33 1bzx s GLY 44 CO 0.16 0.32 -0.12 -0.56 0.00 0.00 0.00 173.10 172.90 1bzx s SER 45 N -3.01 1.92 -0.36 1.64 0.01 0.80 -1.62 113.70 113.08 1bzx s SER 45 Ca 0.14 -0.32 -0.29 0.00 1.31 0.00 0.00 55.95 56.79 1bzx s SER 45 Cb 0.01 -0.86 0.02 0.00 0.21 0.00 0.00 66.02 65.40 1bzx s SER 45 CO -0.00 0.01 1.17 -0.22 0.41 0.00 0.00 173.24 174.61 1bzx s LEU 46 N 0.86 3.82 0.06 2.44 2.96 -0.16 0.10 118.68 128.75 1bzx s LEU 46 Ca -0.11 0.92 0.22 0.00 -0.22 0.00 0.00 54.13 54.95 1bzx s LEU 46 Cb -0.15 -3.54 -0.16 0.00 0.50 0.00 0.00 46.19 42.83 1bzx s LEU 46 CO 0.01 -1.07 0.77 1.33 -1.32 0.00 0.00 176.35 176.08 1bzx n VAL 47 N 6.29 0.22 -3.56 1.68 0.24 -0.48 -1.16 118.33 121.57 1bzx n VAL 47 Ca 0.13 -0.44 -0.07 0.00 -2.04 0.00 0.00 64.34 61.92 1bzx n VAL 47 Cb 0.47 -0.02 -0.02 0.00 -1.47 0.00 0.00 33.84 32.81 1bzx n VAL 47 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 1bzx s ASN 48 N -4.60 -0.29 0.65 -1.34 2.20 -1.18 -4.42 114.94 105.96 1bzx s ASN 48 Ca -0.03 -0.06 0.14 0.00 -0.94 0.00 0.00 52.86 51.97 1bzx s ASN 48 Cb 0.13 0.35 0.65 0.00 -2.00 0.00 0.00 41.25 40.38 1bzx s ASN 48 CO 0.85 -0.58 1.34 1.05 -2.94 0.00 0.00 177.10 176.82 1bzx h GLU 49 N 2.00 0.00 -0.00 3.55 4.11 -1.95 -1.38 114.58 120.92 1bzx h GLU 49 Ca -0.21 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.22 1bzx h GLU 49 Cb 1.23 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.48 1bzx h GLU 49 CO 0.29 0.00 -0.08 0.09 0.07 0.00 0.00 179.01 179.38 1bzx n ASN 50 N -2.80 0.45 -4.08 3.06 3.02 -1.26 0.05 115.26 113.70 1bzx n ASN 50 Ca 0.04 -0.73 -0.17 0.00 -0.03 0.00 0.00 54.58 53.70 1bzx n ASN 50 Cb 0.91 0.70 -0.13 0.00 -0.61 0.00 0.00 39.78 40.65 1bzx n ASN 50 CO 0.00 0.00 0.00 0.26 -2.62 0.00 0.00 177.26 174.90 1bzx s TRP 51 N -0.93 0.90 -0.02 3.10 0.52 -0.52 -0.90 118.94 121.08 1bzx s TRP 51 Ca 0.02 -0.37 0.04 0.00 0.02 0.00 0.00 56.10 55.81 1bzx s TRP 51 Cb 0.02 -0.53 -0.01 0.00 -1.15 0.00 0.00 33.47 31.80 1bzx s TRP 51 CO 0.08 -0.01 -0.14 0.08 0.02 0.00 0.00 176.95 176.98 1bzx s VAL 52 N -0.94 1.17 -0.15 4.03 1.01 -0.43 -1.39 120.40 123.70 1bzx s VAL 52 Ca -0.03 -0.61 -0.06 0.00 0.00 0.00 0.00 61.98 61.28 1bzx s VAL 52 Cb -0.08 -0.99 -0.04 0.00 0.00 0.00 0.00 36.38 35.27 1bzx s VAL 52 CO 0.01 0.34 0.07 -0.69 0.00 0.00 0.00 175.10 174.82 1bzx s VAL 53 N -0.15 4.86 0.00 2.92 1.01 0.12 -0.62 120.40 128.54 1bzx s VAL 53 Ca 0.02 -0.02 0.00 0.00 0.00 0.00 0.00 61.98 61.97 1bzx s VAL 53 Cb -0.08 -3.14 0.00 0.00 0.00 0.00 0.00 36.38 33.16 1bzx s VAL 53 CO 0.00 0.53 0.00 -0.24 0.00 0.00 0.00 175.10 175.39 1bzx n SER 54 N 2.87 0.00 -4.88 3.32 2.88 -0.46 -0.14 113.62 117.22 1bzx n SER 54 Ca -0.18 -0.58 -0.34 0.00 -1.33 0.00 0.00 58.87 56.44 1bzx n SER 54 Cb 0.53 0.00 -0.05 0.00 -0.75 0.00 0.00 64.21 63.94 1bzx n SER 54 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1bzx s ALA 55 N -1.79 3.79 0.47 -1.46 0.00 -1.26 -1.62 121.76 119.89 1bzx s ALA 55 Ca 0.00 -0.48 0.24 0.00 0.00 0.00 0.00 51.96 51.72 1bzx s ALA 55 Cb 0.00 -2.17 1.40 0.00 0.00 0.00 0.00 23.12 22.35 1bzx s ALA 55 CO 0.00 0.61 2.10 0.00 0.00 0.00 0.00 175.76 178.47 1bzx h ALA 56 N 3.77 1.50 0.00 0.00 0.00 -1.69 -1.47 119.26 121.38 1bzx h ALA 56 Ca -0.49 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.32 1bzx h ALA 56 Cb 1.19 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.97 1bzx h ALA 56 CO 0.67 0.13 0.00 -2.39 0.00 0.00 0.00 179.25 177.66 1bzx n HIS 57 N -3.94 0.00 -0.45 0.00 1.44 -1.26 -2.46 115.22 108.56 1bzx n HIS 57 Ca -0.02 0.00 0.11 0.00 -2.01 0.00 0.00 57.72 55.80 1bzx n HIS 57 Cb 0.20 -0.15 0.33 0.00 0.12 0.00 0.00 29.99 30.48 1bzx n HIS 57 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1bzx s TYR 59 N -1.28 2.56 -0.23 0.00 5.04 -1.03 -5.00 117.35 117.41 1bzx s TYR 59 Ca 0.49 1.28 -0.20 0.00 -2.44 0.00 0.00 57.07 56.20 1bzx s TYR 59 Cb 0.28 -3.88 0.06 0.00 0.35 0.00 0.00 41.96 38.77 1bzx s TYR 59 CO 0.30 -2.75 0.61 0.15 -1.34 0.00 0.00 175.55 172.52 1bzx s LYS 60 N -2.34 0.70 0.48 4.97 1.02 -1.26 -5.06 119.74 118.24 1bzx s LYS 60 Ca 0.59 0.90 0.19 0.00 0.02 0.00 0.00 55.97 57.67 1bzx s LYS 60 Cb -0.43 0.30 1.20 0.00 -0.52 0.00 0.00 37.83 38.38 1bzx s LYS 60 CO 0.56 -0.10 2.00 0.66 -0.92 0.00 0.00 175.35 177.54 1bzx h SER 61 N 5.53 0.19 -3.46 2.83 4.64 -1.95 -3.41 113.55 117.91 1bzx h SER 61 Ca -0.29 0.01 -0.25 0.00 -0.47 0.00 0.00 61.79 60.78 1bzx h SER 61 Cb 1.18 -0.03 -0.32 0.00 -0.31 0.00 0.00 62.40 62.91 1bzx h SER 61 CO 0.13 0.11 -0.62 0.00 -0.87 0.00 0.00 176.83 175.58 1bzx s ARG 62 N -5.22 0.07 0.04 4.77 1.70 -1.26 -4.65 118.95 114.41 1bzx s ARG 62 Ca -0.06 0.33 -0.01 0.00 -0.47 0.00 0.00 55.73 55.51 1bzx s ARG 62 Cb 0.20 -0.18 -0.03 0.00 -0.57 0.00 0.00 34.95 34.36 1bzx s ARG 62 CO 0.74 -0.16 -0.01 0.14 -1.08 0.00 0.00 175.30 174.93 1bzx s VAL 63 N 1.10 0.18 -0.17 4.99 -7.23 -1.26 -5.01 120.40 113.01 1bzx s VAL 63 Ca -0.09 -1.51 -0.06 0.00 -1.81 0.00 0.00 61.98 58.52 1bzx s VAL 63 Cb -0.11 -1.16 -0.03 0.00 0.56 0.00 0.00 36.38 35.64 1bzx s VAL 63 CO -0.05 -0.83 0.01 -0.70 -0.31 0.00 0.00 175.10 173.22 1bzx s GLU 64 N -3.21 3.83 -0.18 4.82 2.12 -0.69 -1.55 118.70 123.83 1bzx s GLU 64 Ca 0.00 -0.43 -0.11 0.00 0.36 0.00 0.00 54.97 54.79 1bzx s GLU 64 Cb 0.03 -3.07 -0.05 0.00 0.26 0.00 0.00 34.13 31.30 1bzx s GLU 64 CO -0.07 0.26 0.19 0.08 -0.54 0.00 0.00 175.26 175.18 1bzx s VAL 65 N 0.36 5.37 -0.23 3.70 1.01 0.74 -0.73 120.40 130.62 1bzx s VAL 65 Ca -0.00 0.32 -0.01 0.00 0.00 0.00 0.00 61.98 62.29 1bzx s VAL 65 Cb -0.13 -3.53 0.02 0.00 0.00 0.00 0.00 36.38 32.74 1bzx s VAL 65 CO 0.01 0.43 -0.08 -0.13 0.00 0.00 0.00 175.10 175.33 1bzx s ARG 66 N 0.34 2.94 0.37 2.72 0.52 -0.29 -0.83 118.95 124.72 1bzx s ARG 66 Ca 0.11 -0.90 0.08 0.00 -0.52 0.00 0.00 55.73 54.50 1bzx s ARG 66 Cb -0.12 -2.91 -0.03 0.00 0.52 0.00 0.00 34.95 32.41 1bzx s ARG 66 CO 0.00 -0.33 0.29 -0.51 0.02 0.00 0.00 175.30 174.77 1bzx s LEU 67 N 1.34 3.42 -1.46 2.53 1.02 -0.22 -1.89 118.68 123.43 1bzx s LEU 67 Ca 0.02 -0.68 0.00 0.00 0.02 0.00 0.00 54.13 53.49 1bzx s LEU 67 Cb -0.16 -2.01 0.00 0.00 0.02 0.00 0.00 46.19 44.04 1bzx s LEU 67 CO -0.06 -0.47 0.00 0.61 0.02 0.00 0.00 176.35 176.45 1bzx n GLY 69 N -1.39 -0.12 3.92 -3.19 0.00 -1.26 -1.57 105.19 101.58 1bzx n GLY 69 Ca -0.00 -0.19 -0.29 0.00 0.00 0.00 0.00 46.02 45.54 1bzx n GLY 69 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1bzx s GLU 70 N -4.68 3.54 0.12 1.61 0.41 -1.26 -3.45 118.70 114.98 1bzx s GLU 70 Ca 0.00 -0.27 0.00 0.00 -0.41 0.00 0.00 54.97 54.29 1bzx s GLU 70 Cb 0.00 -2.87 0.00 0.00 -1.78 0.00 0.00 34.13 29.48 1bzx s GLU 70 CO 0.00 0.45 0.00 1.58 -0.49 0.00 0.00 175.26 176.80 1bzx n HIS 71 N -0.30 -0.88 -3.43 1.61 -0.00 -1.26 -4.69 115.22 106.26 1bzx n HIS 71 Ca -0.04 0.16 -0.44 0.00 -0.00 0.00 0.00 57.72 57.40 1bzx n HIS 71 Cb 0.53 0.35 -0.08 0.00 -0.00 0.00 0.00 29.99 30.79 1bzx n HIS 71 CO 0.00 0.00 0.00 1.21 -0.00 0.00 0.00 176.34 177.55 1bzx s ASN 72 N -4.89 6.04 0.28 0.26 3.84 -1.25 -1.84 114.94 117.37 1bzx s ASN 72 Ca 0.00 -1.41 0.20 0.00 0.21 0.00 0.00 52.86 51.85 1bzx s ASN 72 Cb 0.00 -2.14 1.03 0.00 -0.55 0.00 0.00 41.25 39.59 1bzx s ASN 72 CO 0.00 -0.64 1.60 2.30 -2.79 0.00 0.00 177.10 177.56 1bzx n ILE 73 N 5.14 1.11 -0.39 -5.21 -5.35 -0.58 -2.06 119.36 112.04 1bzx n ILE 73 Ca -0.12 0.65 0.11 0.00 -0.27 0.00 0.00 62.75 63.12 1bzx n ILE 73 Cb 0.43 -1.64 0.31 0.00 -1.74 0.00 0.00 39.64 37.00 1bzx n ILE 73 CO 0.00 0.00 0.00 0.29 -1.76 0.00 0.00 176.55 175.08 1bzx n LYS 74 N -2.17 2.87 -3.77 6.28 4.76 -1.26 -4.89 118.16 119.98 1bzx n LYS 74 Ca -0.01 -2.64 -0.15 0.00 -2.87 0.00 0.00 58.31 52.64 1bzx n LYS 74 Cb 0.05 -1.58 -0.16 0.00 -1.84 0.00 0.00 35.03 31.50 1bzx n LYS 74 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 1bzx s VAL 75 N -1.11 -0.06 -0.18 -0.18 1.01 -0.87 -5.11 120.40 113.90 1bzx s VAL 75 Ca 0.47 0.21 -0.29 0.00 0.00 0.00 0.00 61.98 62.37 1bzx s VAL 75 Cb 0.25 -0.11 -0.03 0.00 0.00 0.00 0.00 36.38 36.50 1bzx s VAL 75 CO 0.31 0.09 1.48 -0.89 0.00 0.00 0.00 175.10 176.08 1bzx s THR 76 N 1.09 3.90 -0.67 3.92 2.01 -1.26 -4.73 115.64 119.89 1bzx s THR 76 Ca -0.09 1.05 0.15 0.00 0.31 0.00 0.00 61.69 63.11 1bzx s THR 76 Cb -0.13 -3.79 -0.16 0.00 0.01 0.00 0.00 72.50 68.43 1bzx s THR 76 CO -0.04 -0.22 0.62 -0.62 -0.69 0.00 0.00 174.62 173.67 1bzx n GLU 77 N 7.19 2.02 0.00 4.92 1.02 -1.26 -4.99 120.64 129.53 1bzx n GLU 77 Ca 0.16 -0.01 0.00 0.00 -0.02 0.00 0.00 57.16 57.30 1bzx n GLU 77 Cb 0.45 -1.21 0.00 0.00 -0.02 0.00 0.00 31.44 30.66 1bzx n GLU 77 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1bzx n GLY 78 N 1.36 3.09 0.10 0.62 0.00 -1.26 -4.85 105.19 104.25 1bzx n GLY 78 Ca 0.03 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.17 1bzx n GLY 78 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1bzx n SER 79 N 0.17 0.80 -4.87 1.61 3.41 -1.26 -4.97 113.62 108.50 1bzx n SER 79 Ca 0.00 0.48 -0.30 0.00 -0.26 0.00 0.00 58.87 58.79 1bzx n SER 79 Cb 0.00 -0.60 -0.01 0.00 -0.26 0.00 0.00 64.21 63.34 1bzx n SER 79 CO 0.00 0.00 0.00 -1.83 -0.16 0.00 0.00 175.04 173.05 1bzx s GLU 80 N -3.12 3.71 -0.09 4.33 1.03 -1.22 -4.44 118.70 118.91 1bzx s GLU 80 Ca 0.10 0.65 -0.01 0.00 0.03 0.00 0.00 54.97 55.73 1bzx s GLU 80 Cb 0.12 -2.21 0.03 0.00 -0.80 0.00 0.00 34.13 31.28 1bzx s GLU 80 CO 0.62 -0.32 -0.00 -0.65 -1.33 0.00 0.00 175.26 173.58 1bzx s GLN 81 N -4.56 0.71 -0.46 -4.83 -0.21 -0.61 -4.96 119.66 104.74 1bzx s GLN 81 Ca 0.54 0.02 -0.14 0.00 0.02 0.00 0.00 55.36 55.79 1bzx s GLN 81 Cb -0.10 -1.15 0.07 0.00 1.00 0.00 0.00 33.01 32.82 1bzx s GLN 81 CO 0.42 -0.33 0.37 -0.06 -2.12 0.00 0.00 175.29 173.56 1bzx s PHE 82 N 1.93 3.26 -0.11 0.91 0.40 -1.26 -1.05 117.98 122.06 1bzx s PHE 82 Ca 0.04 -1.00 0.01 0.00 -0.60 0.00 0.00 56.93 55.39 1bzx s PHE 82 Cb -0.13 -3.09 -0.01 0.00 0.51 0.00 0.00 43.02 40.30 1bzx s PHE 82 CO -0.06 -0.79 -0.15 0.42 0.70 0.00 0.00 175.22 175.34 1bzx s ILE 83 N 1.61 2.87 0.60 0.64 1.01 -0.01 -4.93 121.20 122.98 1bzx s ILE 83 Ca 0.04 -0.74 -0.12 0.00 0.00 0.00 0.00 60.65 59.83 1bzx s ILE 83 Cb -0.24 -2.17 -0.05 0.00 0.01 0.00 0.00 42.46 40.01 1bzx s ILE 83 CO 0.06 0.54 1.02 -0.55 0.00 0.00 0.00 174.94 176.02 1bzx s SER 84 N 0.12 6.31 0.38 3.58 0.15 -1.26 -0.19 113.70 122.79 1bzx s SER 84 Ca -0.07 1.45 -0.07 0.00 0.70 0.00 0.00 55.95 57.96 1bzx s SER 84 Cb -0.15 -2.48 -0.05 0.00 -1.71 0.00 0.00 66.02 61.63 1bzx s SER 84 CO 0.05 -0.81 0.69 -0.94 1.20 0.00 0.00 173.24 173.43 1bzx s SER 85 N -3.96 6.43 -0.03 5.45 1.04 -0.60 -0.63 113.70 121.41 1bzx s SER 85 Ca 0.56 0.92 0.05 0.00 0.48 0.00 0.00 55.95 57.96 1bzx s SER 85 Cb -0.11 -2.23 -0.07 0.00 0.10 0.00 0.00 66.02 63.71 1bzx s SER 85 CO 0.49 -0.37 0.05 -1.54 0.98 0.00 0.00 173.24 172.86 1bzx n SER 86 N -1.41 3.78 -3.86 7.02 3.41 0.63 -4.55 113.62 118.64 1bzx n SER 86 Ca 0.00 0.00 -0.12 0.00 -0.26 0.00 0.00 58.87 58.50 1bzx n SER 86 Cb 0.54 0.85 -0.12 0.00 -0.26 0.00 0.00 64.21 65.23 1bzx n SER 86 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 1bzx s ARG 87 N -2.21 0.28 -0.24 4.33 0.52 -1.20 -4.99 118.95 115.45 1bzx s ARG 87 Ca -0.02 -0.10 -0.03 0.00 -0.52 0.00 0.00 55.73 55.05 1bzx s ARG 87 Cb 0.02 0.12 0.08 0.00 0.52 0.00 0.00 34.95 35.69 1bzx s ARG 87 CO 0.21 -0.05 0.09 0.08 0.02 0.00 0.00 175.30 175.65 1bzx s VAL 88 N -0.59 0.21 -0.27 3.52 1.01 -1.26 -0.07 120.40 122.95 1bzx s VAL 88 Ca -0.07 -0.66 -0.06 0.00 0.00 0.00 0.00 61.98 61.19 1bzx s VAL 88 Cb -0.04 -1.00 0.00 0.00 0.00 0.00 0.00 36.38 35.34 1bzx s VAL 88 CO 0.01 -0.49 0.05 -0.63 0.00 0.00 0.00 175.10 174.03 1bzx s ILE 89 N 1.98 3.84 0.38 2.22 1.09 0.98 -4.98 121.20 126.71 1bzx s ILE 89 Ca 0.05 -0.59 -0.16 0.00 -1.10 0.00 0.00 60.65 58.85 1bzx s ILE 89 Cb -0.16 -2.90 -0.09 0.00 -1.06 0.00 0.00 42.46 38.24 1bzx s ILE 89 CO -0.21 0.20 0.82 -0.13 -0.10 0.00 0.00 174.94 175.51 1bzx s ARG 90 N 1.50 4.03 0.32 2.79 0.52 -1.26 -0.19 118.95 126.66 1bzx s ARG 90 Ca 0.04 0.78 -0.29 0.00 -0.52 0.00 0.00 55.73 55.74 1bzx s ARG 90 Cb -0.16 -2.34 -0.12 0.00 0.52 0.00 0.00 34.95 32.86 1bzx s ARG 90 CO 0.01 0.05 1.54 1.58 0.02 0.00 0.00 175.30 178.50 1bzx n HIS 91 N -0.65 2.85 0.27 -0.53 -0.00 -0.22 -4.85 115.22 112.08 1bzx n HIS 91 Ca 0.05 0.34 0.10 0.00 -0.00 0.00 0.00 57.72 58.20 1bzx n HIS 91 Cb 0.54 -2.56 0.72 0.00 -0.00 0.00 0.00 29.99 28.68 1bzx n HIS 91 CO 0.00 0.00 0.00 -1.00 -0.00 0.00 0.00 176.34 175.34 1bzx h PRO 92 N 4.06 0.00 -0.65 1.57 0.13 -1.92 -2.67 132.00 132.51 1bzx h PRO 92 Ca -0.48 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 1bzx h PRO 92 Cb 1.24 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.37 1bzx h PRO 92 CO 0.73 0.02 0.00 0.09 -0.23 0.00 0.00 178.00 178.62 1bzx n ASN 93 N -4.26 4.90 -4.77 1.44 5.03 -1.26 -4.98 115.26 111.36 1bzx n ASN 93 Ca -0.03 -2.51 -0.40 0.00 0.87 0.00 0.00 54.58 52.51 1bzx n ASN 93 Cb 0.11 -0.60 0.02 0.00 -1.02 0.00 0.00 39.78 38.29 1bzx n ASN 93 CO 0.00 0.00 0.00 -0.47 -1.83 0.00 0.00 177.26 174.96 1bzx s TYR 94 N -1.98 2.45 -0.15 3.10 5.04 -1.01 -4.69 117.35 120.11 1bzx s TYR 94 Ca 0.52 1.24 -0.02 0.00 -2.44 0.00 0.00 57.07 56.37 1bzx s TYR 94 Cb 0.34 -3.95 0.05 0.00 0.35 0.00 0.00 41.96 38.75 1bzx s TYR 94 CO 0.24 -3.00 0.01 0.45 -1.34 0.00 0.00 175.55 171.91 1bzx s SER 95 N -0.45 2.47 0.24 4.32 0.15 -0.14 -4.98 113.70 115.31 1bzx s SER 95 Ca 0.60 -0.56 -0.04 0.00 0.70 0.00 0.00 55.95 56.66 1bzx s SER 95 Cb -0.44 -0.59 0.26 0.00 -1.71 0.00 0.00 66.02 63.54 1bzx s SER 95 CO 0.58 -0.25 1.72 0.77 1.20 0.00 0.00 173.24 177.25 1bzx h SER 96 N 8.25 0.82 -0.45 5.45 4.64 -1.95 0.38 113.55 130.69 1bzx h SER 96 Ca -0.19 -0.22 -0.09 0.00 -0.47 0.00 0.00 61.79 60.83 1bzx h SER 96 Cb 1.12 -0.22 -0.01 0.00 -0.31 0.00 0.00 62.40 62.98 1bzx h SER 96 CO 0.32 0.90 -0.08 0.22 -0.87 0.00 0.00 176.83 177.33 1bzx h TYR 97 N 0.78 0.95 0.00 4.77 3.20 -1.97 -2.98 116.97 121.72 1bzx h TYR 97 Ca 0.14 -0.19 0.00 0.00 3.14 0.00 0.00 58.73 61.82 1bzx h TYR 97 Cb 0.51 -0.23 0.00 0.00 1.54 0.00 0.00 36.73 38.54 1bzx h TYR 97 CO 0.03 0.93 -0.44 0.09 -1.64 0.00 0.00 178.16 177.13 1bzx n ASN 98 N -4.30 0.48 -3.75 -2.11 3.02 -1.19 -4.91 115.26 102.51 1bzx n ASN 98 Ca -0.00 -0.01 -0.26 0.00 -0.03 0.00 0.00 54.58 54.28 1bzx n ASN 98 Cb 0.36 0.08 0.05 0.00 -0.61 0.00 0.00 39.78 39.66 1bzx n ASN 98 CO 0.00 0.00 0.00 -0.38 -2.62 0.00 0.00 177.26 174.26 1bzx n ILE 99 N -1.69 -2.80 -3.86 2.41 5.41 0.12 -4.94 119.36 114.02 1bzx n ILE 99 Ca 0.05 -0.07 -0.36 0.00 1.00 0.00 0.00 62.75 63.38 1bzx n ILE 99 Cb 0.37 -3.48 -0.07 0.00 -0.71 0.00 0.00 39.64 35.75 1bzx n ILE 99 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 176.55 175.93 1bzx s ASP 100 N -3.45 6.20 -0.98 4.38 2.15 -0.38 -4.34 116.67 120.25 1bzx s ASP 100 Ca 0.55 0.33 -0.02 0.00 0.43 0.00 0.00 52.55 53.85 1bzx s ASP 100 Cb -0.26 -2.04 0.00 0.00 -0.30 0.00 0.00 42.92 40.32 1bzx s ASP 100 CO 0.78 0.30 0.83 0.59 -0.17 0.00 0.00 175.17 177.50 1bzx n ASN 101 N 2.71 -2.81 -3.62 -0.34 3.02 -1.26 -0.96 115.26 111.99 1bzx n ASN 101 Ca -0.18 -0.48 -0.41 0.00 -0.03 0.00 0.00 54.58 53.48 1bzx n ASN 101 Cb 0.54 -4.16 -0.01 0.00 -0.61 0.00 0.00 39.78 35.53 1bzx n ASN 101 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 1bzx n ASP 102 N -2.56 4.86 -3.91 6.41 2.03 -1.26 -4.22 116.55 117.91 1bzx n ASP 102 Ca -0.18 -2.76 -0.10 0.00 0.52 0.00 0.00 54.79 52.27 1bzx n ASP 102 Cb 0.62 -1.59 -0.10 0.00 -0.72 0.00 0.00 41.12 39.32 1bzx n ASP 102 CO 0.00 0.00 0.00 -0.51 -1.92 0.00 0.00 177.20 174.77 1bzx s ILE 103 N 3.09 0.10 0.06 5.18 2.07 -1.26 -3.59 121.20 126.86 1bzx s ILE 103 Ca 0.52 -0.86 -0.23 0.00 -1.41 0.00 0.00 60.65 58.68 1bzx s ILE 103 Cb 0.15 -0.55 0.05 0.00 0.13 0.00 0.00 42.46 42.24 1bzx s ILE 103 CO -0.07 -0.47 0.54 0.00 -1.91 0.00 0.00 174.94 173.02 1bzx s MET 104 N -1.80 1.08 0.00 3.50 0.23 -0.64 -1.06 119.30 120.62 1bzx s MET 104 Ca -0.12 -0.27 0.06 0.00 -1.03 0.00 0.00 55.69 54.33 1bzx s MET 104 Cb -0.06 0.49 -0.03 0.00 -1.53 0.00 0.00 34.83 33.70 1bzx s MET 104 CO -0.01 -0.40 -0.16 -0.51 -2.03 0.00 0.00 175.02 171.91 1bzx s LEU 105 N -2.10 2.67 -0.13 0.18 1.43 0.73 -1.35 118.68 120.10 1bzx s LEU 105 Ca -0.04 -0.33 0.02 0.00 -1.03 0.00 0.00 54.13 52.75 1bzx s LEU 105 Cb -0.00 -1.55 0.01 0.00 0.03 0.00 0.00 46.19 44.68 1bzx s LEU 105 CO -0.03 0.29 -0.18 -0.63 0.23 0.00 0.00 176.35 176.03 1bzx s ILE 106 N -0.85 1.76 -0.14 -0.59 1.01 0.21 -0.01 121.20 122.59 1bzx s ILE 106 Ca 0.14 -0.79 -0.20 0.00 0.00 0.00 0.00 60.65 59.79 1bzx s ILE 106 Cb -0.11 -1.59 -0.03 0.00 0.01 0.00 0.00 42.46 40.74 1bzx s ILE 106 CO 0.04 0.49 0.59 -0.75 0.00 0.00 0.00 174.94 175.31 1bzx s LYS 107 N 1.04 4.31 0.08 2.79 2.20 0.90 -1.32 119.74 129.74 1bzx s LYS 107 Ca -0.04 0.62 -0.30 0.00 -0.36 0.00 0.00 55.97 55.89 1bzx s LYS 107 Cb -0.15 -3.50 -0.05 0.00 -1.51 0.00 0.00 37.83 32.62 1bzx s LYS 107 CO -0.04 -0.04 1.08 -0.51 -0.36 0.00 0.00 175.35 175.47 1bzx s LEU 108 N 1.23 4.42 0.40 5.43 1.43 -0.07 -0.27 118.68 131.24 1bzx s LEU 108 Ca 0.30 1.90 0.08 0.00 -1.03 0.00 0.00 54.13 55.37 1bzx s LEU 108 Cb -0.16 -3.58 0.86 0.00 0.03 0.00 0.00 46.19 43.34 1bzx s LEU 108 CO 0.12 -0.29 2.03 0.77 0.23 0.00 0.00 176.35 179.21 1bzx h SER 109 N 6.19 0.50 -3.61 2.29 4.64 -1.11 -3.40 113.55 119.06 1bzx h SER 109 Ca -0.42 -0.01 -0.38 0.00 -0.47 0.00 0.00 61.79 60.51 1bzx h SER 109 Cb 1.21 -0.12 -0.32 0.00 -0.31 0.00 0.00 62.40 62.87 1bzx h SER 109 CO 0.76 0.34 -0.77 -0.54 -0.87 0.00 0.00 176.83 175.75 1bzx s LYS 110 N -5.52 0.69 0.43 4.77 1.02 -1.26 -4.99 119.74 114.89 1bzx s LYS 110 Ca -0.08 -0.12 -0.25 0.00 0.02 0.00 0.00 55.97 55.53 1bzx s LYS 110 Cb 0.18 -0.70 -0.09 0.00 -0.52 0.00 0.00 37.83 36.70 1bzx s LYS 110 CO 0.74 -0.02 1.29 -0.35 -0.92 0.00 0.00 175.35 176.09 1bzx n PRO 111 N 3.72 1.95 -2.25 -1.68 -0.04 -1.26 -4.95 135.00 130.49 1bzx n PRO 111 Ca -0.22 0.70 -0.37 0.00 -0.04 0.00 0.00 63.50 63.57 1bzx n PRO 111 Cb 0.53 -2.42 -0.01 0.00 -0.04 0.00 0.00 33.50 31.56 1bzx n PRO 111 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1bzx s ALA 112 N -1.20 2.94 -0.45 0.55 0.00 0.11 -4.98 121.76 118.72 1bzx s ALA 112 Ca 0.61 0.93 -0.20 0.00 0.00 0.00 0.00 51.96 53.30 1bzx s ALA 112 Cb -0.50 -3.38 0.03 0.00 0.00 0.00 0.00 23.12 19.27 1bzx s ALA 112 CO 0.58 -0.68 0.61 0.99 0.00 0.00 0.00 175.76 177.25 1bzx s THR 113 N -1.57 4.87 0.23 0.00 2.01 -1.26 -4.80 115.64 115.12 1bzx s THR 113 Ca 0.65 -0.07 -0.30 0.00 0.31 0.00 0.00 61.69 62.28 1bzx s THR 113 Cb -0.28 -4.20 -0.09 0.00 0.01 0.00 0.00 72.50 67.94 1bzx s THR 113 CO 0.34 -0.62 1.15 -0.76 -0.69 0.00 0.00 174.62 174.04 1bzx s LEU 114 N 2.69 4.49 0.00 4.42 1.43 -1.26 -4.62 118.68 125.84 1bzx s LEU 114 Ca 0.20 2.25 0.00 0.00 -1.03 0.00 0.00 54.13 55.55 1bzx s LEU 114 Cb -0.15 -3.62 0.00 0.00 0.03 0.00 0.00 46.19 42.45 1bzx s LEU 114 CO 0.17 -0.27 0.00 -0.46 0.23 0.00 0.00 176.35 176.02 1bzx n ASN 115 N 1.88 0.00 0.29 2.29 0.23 0.50 -4.93 115.26 115.52 1bzx n ASN 115 Ca 0.02 -0.05 0.14 0.00 -0.53 0.00 0.00 54.58 54.16 1bzx n ASN 115 Cb 0.45 0.00 0.88 0.00 -2.08 0.00 0.00 39.78 39.03 1bzx n ASN 115 CO 0.00 0.00 0.00 0.74 -0.93 0.00 0.00 177.26 177.07 1bzx h THR 116 N 0.05 0.57 0.00 5.53 2.02 -2.01 -3.09 112.91 115.97 1bzx h THR 116 Ca 0.00 -0.06 -0.20 0.00 0.77 0.00 0.00 66.41 66.92 1bzx h THR 116 Cb 0.00 1.04 -0.04 0.00 -1.74 0.00 0.00 68.15 67.41 1bzx h THR 116 CO 0.00 0.01 -1.99 -1.22 0.37 0.00 0.00 175.52 172.70 1bzx n TYR 117 N -3.88 0.00 -4.03 3.16 4.01 -1.26 -4.89 117.16 110.27 1bzx n TYR 117 Ca -0.03 0.00 -0.31 0.00 -0.16 0.00 0.00 57.90 57.40 1bzx n TYR 117 Cb 0.10 -0.66 -0.15 0.00 -0.31 0.00 0.00 39.34 38.32 1bzx n TYR 117 CO 0.00 0.00 0.00 0.08 -0.46 0.00 0.00 176.86 176.48 1bzx s VAL 118 N -2.61 2.08 -0.06 -0.72 1.01 -1.17 -4.22 120.40 114.70 1bzx s VAL 118 Ca -0.07 -1.76 -0.05 0.00 0.00 0.00 0.00 61.98 60.10 1bzx s VAL 118 Cb 0.06 -2.30 0.02 0.00 0.00 0.00 0.00 36.38 34.16 1bzx s VAL 118 CO 0.66 -0.20 0.16 -1.58 0.00 0.00 0.00 175.10 174.15 1bzx s GLN 119 N 1.10 0.16 1.06 2.72 2.00 -1.12 -0.37 119.66 125.21 1bzx s GLN 119 Ca -0.03 0.28 -0.12 0.00 -2.00 0.00 0.00 55.36 53.48 1bzx s GLN 119 Cb -0.20 0.01 0.22 0.00 0.80 0.00 0.00 33.01 33.84 1bzx s GLN 119 CO -0.06 -0.07 1.07 -1.25 -0.50 0.00 0.00 175.29 174.48 1bzx s PRO 120 N 0.45 -0.07 -0.00 1.67 0.04 -1.26 -2.10 135.00 133.72 1bzx s PRO 120 Ca -0.03 0.68 0.07 0.00 0.04 0.00 0.00 61.00 61.76 1bzx s PRO 120 Cb -0.04 -1.67 -0.03 0.00 0.04 0.00 0.00 34.50 32.80 1bzx s PRO 120 CO -0.02 -3.11 -0.21 0.54 0.04 0.00 0.00 177.00 174.24 1bzx s VAL 121 N -2.76 2.56 0.31 -0.36 0.11 -0.31 -4.72 120.40 115.24 1bzx s VAL 121 Ca 0.66 -1.07 -0.28 0.00 -2.93 0.00 0.00 61.98 58.37 1bzx s VAL 121 Cb -0.21 -1.99 -0.09 0.00 -1.53 0.00 0.00 36.38 32.55 1bzx s VAL 121 CO 0.60 0.48 1.05 0.00 -3.33 0.00 0.00 175.10 173.90 1bzx s ALA 122 N -0.77 3.29 0.73 1.54 0.00 -1.24 -4.57 121.76 120.74 1bzx s ALA 122 Ca 0.12 0.78 -0.11 0.00 0.00 0.00 0.00 51.96 52.74 1bzx s ALA 122 Cb -0.10 -3.28 0.03 0.00 0.00 0.00 0.00 23.12 19.76 1bzx s ALA 122 CO 0.02 -0.10 1.08 -0.51 0.00 0.00 0.00 175.76 176.25 1bzx s LEU 123 N -1.79 3.13 0.21 0.00 1.43 -1.26 -0.60 118.68 119.80 1bzx s LEU 123 Ca 0.48 1.78 -0.30 0.00 -1.03 0.00 0.00 54.13 55.06 1bzx s LEU 123 Cb -0.27 -4.52 -0.08 0.00 0.03 0.00 0.00 46.19 41.35 1bzx s LEU 123 CO 0.35 -1.77 1.16 -2.16 0.23 0.00 0.00 176.35 174.16 1bzx s PRO 124 N -4.81 4.54 -0.03 1.29 0.04 -1.25 -4.62 135.00 130.16 1bzx s PRO 124 Ca 0.61 1.84 -0.15 0.00 0.04 0.00 0.00 61.00 63.34 1bzx s PRO 124 Cb -0.16 -3.23 -0.32 0.00 0.04 0.00 0.00 34.50 30.82 1bzx s PRO 124 CO 0.53 0.01 0.81 1.79 0.04 0.00 0.00 177.00 180.18 1bzx h THR 125 N 3.56 1.16 -3.15 1.26 1.35 -1.96 -3.47 112.91 111.66 1bzx h THR 125 Ca -0.45 -2.57 -0.41 0.00 -0.55 0.00 0.00 66.41 62.43 1bzx h THR 125 Cb 1.21 2.93 -0.14 0.00 -1.73 0.00 0.00 68.15 70.42 1bzx h THR 125 CO 0.72 0.80 -0.65 -0.94 -0.25 0.00 0.00 175.52 175.20 1bzx s SER 127 N -7.32 2.04 0.04 5.36 1.04 -1.26 -5.11 113.70 108.48 1bzx s SER 127 Ca -0.14 -1.26 -0.26 0.00 0.48 0.00 0.00 55.95 54.77 1bzx s SER 127 Cb 0.04 -0.03 -0.05 0.00 0.10 0.00 0.00 66.02 66.08 1bzx s SER 127 CO 0.87 -0.52 0.80 0.00 0.98 0.00 0.00 173.24 175.37 1bzx s ALA 129 N 0.11 3.35 0.62 0.00 0.00 -1.26 -5.05 121.76 119.53 1bzx s ALA 129 Ca 0.40 0.67 -0.14 0.00 0.00 0.00 0.00 51.96 52.89 1bzx s ALA 129 Cb -0.21 -3.24 -0.03 0.00 0.00 0.00 0.00 23.12 19.65 1bzx s ALA 129 CO 0.24 0.13 1.05 -2.14 0.00 0.00 0.00 175.76 175.04 1bzx s PRO 130 N -1.15 3.25 0.46 0.00 0.02 -1.26 -4.98 135.00 131.34 1bzx s PRO 130 Ca 0.42 1.11 -0.25 0.00 0.02 0.00 0.00 61.00 62.30 1bzx s PRO 130 Cb -0.27 -2.03 -0.08 0.00 0.02 0.00 0.00 34.50 32.14 1bzx s PRO 130 CO 0.33 -0.86 1.44 0.00 -0.33 0.00 0.00 177.00 177.59 1bzx n ALA 132 N -2.33 2.07 0.00 -1.55 0.00 -1.26 -1.73 120.51 115.71 1bzx n ALA 132 Ca 0.08 0.24 0.00 0.00 0.00 0.00 0.00 53.44 53.77 1bzx n ALA 132 Cb 0.53 -2.40 0.00 0.00 0.00 0.00 0.00 19.45 17.58 1bzx n ALA 132 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1bzx n GLY 133 N 0.57 2.76 3.68 0.00 0.00 0.94 -4.94 105.19 108.21 1bzx n GLY 133 Ca 0.05 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.62 1bzx n GLY 133 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1bzx n THR 134 N -0.22 0.26 -2.91 2.61 -1.04 -0.71 -4.53 114.28 107.74 1bzx n THR 134 Ca 0.00 -0.05 -0.40 0.00 -2.04 0.00 0.00 64.05 61.56 1bzx n THR 134 Cb 0.00 -1.83 -0.04 0.00 -1.82 0.00 0.00 70.33 66.63 1bzx n THR 134 CO 0.00 0.00 0.00 -0.32 -0.64 0.00 0.00 175.07 174.11 1bzx s MET 135 N 2.29 4.52 0.35 -2.82 -2.45 -1.26 -1.12 119.30 118.81 1bzx s MET 135 Ca 0.83 1.14 0.04 0.00 -1.25 0.00 0.00 55.69 56.45 1bzx s MET 135 Cb -0.61 -3.40 -0.04 0.00 1.25 0.00 0.00 34.83 32.03 1bzx s MET 135 CO 0.41 0.16 0.14 0.00 1.05 0.00 0.00 175.02 176.77 1bzx s THR 137 N -3.40 1.66 0.05 0.00 2.01 -0.32 -0.39 115.64 115.25 1bzx s THR 137 Ca 0.31 -0.88 0.06 0.00 0.31 0.00 0.00 61.69 61.49 1bzx s THR 137 Cb 0.05 -1.39 -0.03 0.00 0.01 0.00 0.00 72.50 71.14 1bzx s THR 137 CO 0.16 0.47 -0.16 0.54 -0.69 0.00 0.00 174.62 174.94 1bzx s VAL 138 N -0.35 1.25 0.08 3.82 0.11 -0.10 -0.21 120.40 124.99 1bzx s VAL 138 Ca 0.04 -1.16 -0.08 0.00 -2.93 0.00 0.00 61.98 57.85 1bzx s VAL 138 Cb -0.09 -1.14 -0.00 0.00 -1.53 0.00 0.00 36.38 33.62 1bzx s VAL 138 CO 0.00 -0.03 0.18 -0.94 -3.33 0.00 0.00 175.10 170.98 1bzx s SER 139 N -1.37 0.12 0.00 3.54 1.04 -1.21 -1.15 113.70 114.67 1bzx s SER 139 Ca 0.02 -0.61 0.00 0.00 0.48 0.00 0.00 55.95 55.84 1bzx s SER 139 Cb -0.09 0.32 0.00 0.00 0.10 0.00 0.00 66.02 66.35 1bzx s SER 139 CO 0.02 -0.68 0.00 0.61 0.98 0.00 0.00 173.24 174.17 1bzx n GLY 140 N 0.12 -0.10 1.27 7.32 0.00 -0.82 -4.40 105.19 108.57 1bzx n GLY 140 Ca -0.16 -1.07 -0.05 0.00 0.00 0.00 0.00 46.02 44.74 1bzx n GLY 140 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1bzx n TRP 141 N -0.46 1.32 -1.77 1.61 8.01 -1.26 -2.44 117.44 122.46 1bzx n TRP 141 Ca 0.00 -1.54 -0.24 0.00 -1.31 0.00 0.00 57.50 54.42 1bzx n TRP 141 Cb 0.00 -0.53 0.17 0.00 -2.01 0.00 0.00 31.31 28.94 1bzx n TRP 141 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1bzx n GLY 142 N -1.04 -1.39 3.67 6.99 0.00 -1.25 -4.74 105.19 107.44 1bzx n GLY 142 Ca 0.35 -1.71 -0.46 0.00 0.00 0.00 0.00 46.02 44.21 1bzx n GLY 142 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1bzx n ASN 143 N -3.68 2.85 -0.06 1.61 5.15 0.18 -2.67 115.26 118.64 1bzx n ASN 143 Ca 0.14 1.12 0.08 0.00 -0.60 0.00 0.00 54.58 55.32 1bzx n ASN 143 Cb 0.47 -1.42 -0.09 0.00 -0.53 0.00 0.00 39.78 38.22 1bzx n ASN 143 CO 0.00 0.00 0.00 0.35 1.40 0.00 0.00 177.26 179.01 1bzx n THR 144 N 2.54 0.00 -3.38 -0.44 -2.24 -1.25 -0.35 114.28 109.16 1bzx n THR 144 Ca 0.14 -0.12 -0.24 0.00 -2.27 0.00 0.00 64.05 61.56 1bzx n THR 144 Cb 0.30 1.03 0.01 0.00 -2.10 0.00 0.00 70.33 69.57 1bzx n THR 144 CO 0.00 0.00 0.00 0.23 -0.57 0.00 0.00 175.07 174.73 1bzx n MET 145 N -1.22 -3.92 -3.72 -0.78 2.81 -1.26 -4.36 117.12 104.67 1bzx n MET 145 Ca 0.04 0.57 -0.12 0.00 -1.81 0.00 0.00 57.70 56.38 1bzx n MET 145 Cb 0.29 -5.33 -0.10 0.00 -0.71 0.00 0.00 33.22 27.37 1bzx n MET 145 CO 0.00 0.00 0.00 0.45 1.51 0.00 0.00 175.97 177.93 1bzx s SER 147 N -2.80 -0.46 0.15 7.83 0.15 -1.26 -5.03 113.70 112.29 1bzx s SER 147 Ca 0.42 0.85 0.23 0.00 0.70 0.00 0.00 55.95 58.16 1bzx s SER 147 Cb -0.22 0.82 0.90 0.00 -1.71 0.00 0.00 66.02 65.82 1bzx s SER 147 CO 0.52 -0.16 1.71 -1.54 1.20 0.00 0.00 173.24 174.97 1bzx n SER 148 N 3.30 0.47 -0.06 5.45 3.41 -1.26 -3.46 113.62 121.46 1bzx n SER 148 Ca -0.16 0.58 -0.20 0.00 -0.26 0.00 0.00 58.87 58.83 1bzx n SER 148 Cb 0.57 -0.70 -0.13 0.00 -0.26 0.00 0.00 64.21 63.69 1bzx n SER 148 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 1bzx n THR 149 N -1.98 1.64 -2.40 6.66 -2.24 -1.26 -4.85 114.28 109.83 1bzx n THR 149 Ca 0.04 -0.59 -0.43 0.00 -2.27 0.00 0.00 64.05 60.80 1bzx n THR 149 Cb 0.29 -1.60 -0.02 0.00 -2.10 0.00 0.00 70.33 66.90 1bzx n THR 149 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1bzx s ALA 150 N -2.53 3.49 -0.38 6.98 0.00 -1.23 -4.98 121.76 123.11 1bzx s ALA 150 Ca -0.29 0.28 -0.23 0.00 0.00 0.00 0.00 51.96 51.72 1bzx s ALA 150 Cb 0.08 -3.71 0.01 0.00 0.00 0.00 0.00 23.12 19.50 1bzx s ALA 150 CO 0.68 -1.52 0.78 0.34 0.00 0.00 0.00 175.76 176.03 1bzx s ASP 151 N 2.52 6.51 0.19 0.00 2.15 -1.26 -4.72 116.67 122.06 1bzx s ASP 151 Ca 0.56 0.25 0.19 0.00 0.43 0.00 0.00 52.55 53.98 1bzx s ASP 151 Cb -0.19 -2.39 0.86 0.00 -0.30 0.00 0.00 42.92 40.89 1bzx s ASP 151 CO 0.20 -0.76 1.59 -1.54 -0.17 0.00 0.00 175.17 174.48 1bzx n SER 152 N 6.46 0.45 0.21 -0.34 3.41 -1.26 -2.00 113.62 120.55 1bzx n SER 152 Ca 0.03 0.64 0.10 0.00 -0.26 0.00 0.00 58.87 59.37 1bzx n SER 152 Cb 0.48 -0.72 0.31 0.00 -0.26 0.00 0.00 64.21 64.02 1bzx n SER 152 CO 0.00 0.00 0.00 0.78 -0.16 0.00 0.00 175.04 175.66 1bzx h ASN 153 N 0.00 0.00 -3.61 4.04 2.35 -1.92 -3.40 115.58 113.04 1bzx h ASN 153 Ca 0.00 0.00 -0.62 0.00 -0.55 0.00 0.00 56.30 55.13 1bzx h ASN 153 Cb 0.24 0.00 -0.14 0.00 0.05 0.00 0.00 38.32 38.47 1bzx h ASN 153 CO 0.00 0.21 -0.34 -0.54 -1.65 0.00 0.00 177.43 175.10 1bzx s LYS 154 N -3.36 4.08 -0.14 0.81 1.02 -0.85 -1.52 119.74 119.78 1bzx s LYS 154 Ca 0.03 -0.04 -0.40 0.00 0.02 0.00 0.00 55.97 55.58 1bzx s LYS 154 Cb 0.08 -3.58 -0.18 0.00 -0.52 0.00 0.00 37.83 33.64 1bzx s LYS 154 CO 0.66 -0.07 1.45 -0.11 -0.92 0.00 0.00 175.35 176.36 1bzx n LEU 155 N 4.66 1.45 -4.82 3.17 7.94 -0.77 -4.87 117.00 123.76 1bzx n LEU 155 Ca -0.11 1.13 -0.33 0.00 -1.11 0.00 0.00 56.01 55.58 1bzx n LEU 155 Cb 0.51 -1.07 -0.06 0.00 0.53 0.00 0.00 43.42 43.33 1bzx n LEU 155 CO 0.37 -1.01 -0.22 -1.10 -1.11 0.00 0.00 177.39 174.33 1bzx s GLN 156 N 1.71 3.21 0.15 1.96 -1.52 -1.02 -1.05 119.66 123.10 1bzx s GLN 156 Ca 0.93 -0.40 0.09 0.00 -1.95 0.00 0.00 55.36 54.03 1bzx s GLN 156 Cb -1.14 -2.96 -0.04 0.00 -0.22 0.00 0.00 33.01 28.65 1bzx s GLN 156 CO 0.60 0.67 -0.22 0.00 -0.25 0.00 0.00 175.29 176.09 1bzx s LEU 158 N -2.33 -0.32 -0.25 0.00 2.96 -0.30 0.41 118.68 118.86 1bzx s LEU 158 Ca 0.14 1.17 -0.14 0.00 -0.22 0.00 0.00 54.13 55.08 1bzx s LEU 158 Cb -0.08 1.93 -0.04 0.00 0.50 0.00 0.00 46.19 48.49 1bzx s LEU 158 CO 0.06 -0.21 0.31 0.20 -1.32 0.00 0.00 176.35 175.40 1bzx s ASN 159 N 0.77 6.23 0.01 3.68 0.02 -1.26 -0.93 114.94 123.46 1bzx s ASN 159 Ca -0.04 0.25 0.03 0.00 -1.02 0.00 0.00 52.86 52.08 1bzx s ASN 159 Cb -0.05 -2.18 -0.01 0.00 0.02 0.00 0.00 41.25 39.03 1bzx s ASN 159 CO -0.06 -0.09 -0.08 0.27 0.02 0.00 0.00 177.10 177.15 1bzx s ILE 160 N 1.67 0.66 0.19 0.60 -4.36 0.47 -4.93 121.20 115.50 1bzx s ILE 160 Ca 0.13 -0.53 -0.15 0.00 -0.26 0.00 0.00 60.65 59.84 1bzx s ILE 160 Cb -0.15 -0.58 -0.07 0.00 1.25 0.00 0.00 42.46 42.90 1bzx s ILE 160 CO 0.09 0.06 0.60 -2.16 0.24 0.00 0.00 174.94 173.77 1bzx s PRO 161 N -0.52 4.03 0.10 0.37 0.04 -1.26 -0.13 135.00 137.62 1bzx s PRO 161 Ca 0.01 0.57 -0.30 0.00 0.04 0.00 0.00 61.00 61.31 1bzx s PRO 161 Cb -0.05 -2.85 -0.06 0.00 0.04 0.00 0.00 34.50 31.58 1bzx s PRO 161 CO 0.00 0.42 1.09 0.42 0.04 0.00 0.00 177.00 178.97 1bzx s ILE 162 N -1.55 4.20 0.34 0.56 1.01 -0.27 -1.99 121.20 123.49 1bzx s ILE 162 Ca 0.41 1.71 -0.03 0.00 0.00 0.00 0.00 60.65 62.74 1bzx s ILE 162 Cb -0.15 -4.09 -0.04 0.00 0.01 0.00 0.00 42.46 38.19 1bzx s ILE 162 CO 0.20 0.20 0.60 -0.76 0.00 0.00 0.00 174.94 175.18 1bzx s LEU 163 N 0.43 3.96 0.63 2.97 1.43 -0.51 -0.04 118.68 127.55 1bzx s LEU 163 Ca 0.53 0.68 -0.17 0.00 -1.03 0.00 0.00 54.13 54.14 1bzx s LEU 163 Cb -0.27 -3.53 -0.02 0.00 0.03 0.00 0.00 46.19 42.40 1bzx s LEU 163 CO 0.31 -0.30 1.14 -0.94 0.23 0.00 0.00 176.35 176.79 1bzx s SER 164 N -3.61 5.17 0.53 2.29 1.04 -1.26 -4.56 113.70 113.29 1bzx s SER 164 Ca 0.43 2.14 0.20 0.00 0.48 0.00 0.00 55.95 59.20 1bzx s SER 164 Cb -0.10 -2.57 1.38 0.00 0.10 0.00 0.00 66.02 64.83 1bzx s SER 164 CO 0.35 -1.59 2.15 0.22 0.98 0.00 0.00 173.24 175.34 1bzx h TYR 165 N 0.41 0.00 0.12 5.02 3.20 -1.97 -0.69 116.97 123.06 1bzx h TYR 165 Ca -0.48 0.00 -0.01 0.00 3.14 0.00 0.00 58.73 61.38 1bzx h TYR 165 Cb 1.26 0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.53 1bzx h TYR 165 CO 0.52 0.04 -0.06 1.03 -1.64 0.00 0.00 178.16 178.05 1bzx h SER 166 N 0.00 -0.13 0.16 -2.11 0.87 -1.98 0.17 113.55 110.52 1bzx h SER 166 Ca -0.00 -0.17 -0.09 0.00 -1.23 0.00 0.00 61.79 60.30 1bzx h SER 166 Cb 0.08 0.03 -0.01 0.00 -0.44 0.00 0.00 62.40 62.06 1bzx h SER 166 CO 0.01 0.09 -0.34 0.44 -0.53 0.00 0.00 176.83 176.50 1bzx h ASP 167 N -0.36 0.27 0.20 6.23 3.32 -1.79 -0.94 116.42 123.36 1bzx h ASP 167 Ca -0.02 -0.10 -0.01 0.00 0.02 0.00 0.00 57.03 56.93 1bzx h ASP 167 Cb 0.29 -0.07 0.00 0.00 0.22 0.00 0.00 39.33 39.77 1bzx h ASP 167 CO 0.03 0.60 -0.10 0.00 -1.72 0.00 0.00 179.24 178.05 1bzx h ASN 169 N -0.58 0.03 0.10 0.00 -0.73 -0.54 -2.14 115.58 111.73 1bzx h ASN 169 Ca -0.03 -0.01 -0.13 0.00 1.87 0.00 0.00 56.30 58.01 1bzx h ASN 169 Cb 0.43 -0.01 -0.01 0.00 0.27 0.00 0.00 38.32 39.00 1bzx h ASN 169 CO 0.04 0.21 -0.46 -1.13 -0.37 0.00 0.00 177.43 175.73 1bzx h ASN 170 N 0.04 0.46 0.02 1.15 -0.00 -1.12 -1.47 115.58 114.65 1bzx h ASN 170 Ca 0.01 -0.21 -0.15 0.00 -0.00 0.00 0.00 56.30 55.94 1bzx h ASN 170 Cb 0.33 -0.13 -0.01 0.00 -0.00 0.00 0.00 38.32 38.51 1bzx h ASN 170 CO 0.02 0.85 -0.49 0.28 -0.00 0.00 0.00 177.43 178.09 1bzx h SER 171 N 0.34 0.59 -2.20 1.15 0.02 -0.90 -3.36 113.55 109.20 1bzx h SER 171 Ca 0.02 -0.29 -0.58 0.00 -0.84 0.00 0.00 61.79 60.10 1bzx h SER 171 Cb 0.94 -0.17 -0.40 0.00 0.14 0.00 0.00 62.40 62.91 1bzx h SER 171 CO 0.08 0.98 -0.94 -1.22 -1.14 0.00 0.00 176.83 174.59 1bzx n TYR 172 N -3.98 0.58 -1.46 3.45 4.01 -0.96 -4.94 117.16 113.86 1bzx n TYR 172 Ca -0.02 -3.68 -0.57 0.00 -0.16 0.00 0.00 57.90 53.47 1bzx n TYR 172 Cb 0.57 -0.28 -0.09 0.00 -0.31 0.00 0.00 39.34 39.22 1bzx n TYR 172 CO 0.00 0.00 0.00 -2.30 -0.46 0.00 0.00 176.86 174.10 1bzx n PRO 173 N 1.64 0.64 -0.85 -0.72 -0.02 -0.56 -1.36 135.00 133.77 1bzx n PRO 173 Ca 0.25 0.20 0.00 0.00 -2.02 0.00 0.00 63.50 61.92 1bzx n PRO 173 Cb 0.48 -1.98 0.00 0.00 -0.02 0.00 0.00 33.50 31.98 1bzx n PRO 173 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1bzx n GLY 174 N 6.17 1.06 0.05 -1.23 0.00 -1.26 -4.87 105.19 105.11 1bzx n GLY 174 Ca 0.42 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.55 1bzx n GLY 174 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1bzx n MET 175 N -2.00 0.33 -3.03 1.61 2.81 -0.46 -4.88 117.12 111.49 1bzx n MET 175 Ca 0.00 0.04 -0.41 0.00 -1.81 0.00 0.00 57.70 55.51 1bzx n MET 175 Cb 0.00 -1.65 -0.06 0.00 -0.71 0.00 0.00 33.22 30.80 1bzx n MET 175 CO 0.00 0.00 0.00 0.42 1.51 0.00 0.00 175.97 177.90 1bzx s ILE 176 N -3.21 4.87 0.37 2.02 -1.09 -1.25 -5.05 121.20 117.85 1bzx s ILE 176 Ca 0.04 0.99 0.06 0.00 -2.23 0.00 0.00 60.65 59.51 1bzx s ILE 176 Cb 0.13 -4.07 0.06 0.00 -1.58 0.00 0.00 42.46 37.00 1bzx s ILE 176 CO 0.77 -0.20 0.48 0.35 -1.23 0.00 0.00 174.94 175.11 1bzx n THR 177 N 5.47 0.00 0.25 2.92 -2.24 -1.26 -4.99 114.28 114.43 1bzx n THR 177 Ca 0.01 -1.25 0.14 0.00 -2.27 0.00 0.00 64.05 60.68 1bzx n THR 177 Cb 0.48 -0.63 0.55 0.00 -2.10 0.00 0.00 70.33 68.64 1bzx n THR 177 CO 0.00 0.00 0.00 0.78 -0.57 0.00 0.00 175.07 175.28 1bzx h ASN 178 N 0.11 0.00 -0.07 3.42 2.35 -2.02 -2.42 115.58 116.94 1bzx h ASN 178 Ca -0.18 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.57 1bzx h ASN 178 Cb 0.80 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.17 1bzx h ASN 178 CO 0.26 0.08 0.00 0.00 -1.65 0.00 0.00 177.43 176.12 1bzx n ALA 179 N -2.14 2.52 -2.39 -0.83 0.00 -1.26 -4.77 120.51 111.65 1bzx n ALA 179 Ca 0.01 -0.18 -0.13 0.00 0.00 0.00 0.00 53.44 53.13 1bzx n ALA 179 Cb 0.38 -1.09 -0.11 0.00 0.00 0.00 0.00 19.45 18.63 1bzx n ALA 179 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 1bzx s MET 180 N -1.90 0.85 0.03 0.00 -1.94 -0.91 0.49 119.30 115.92 1bzx s MET 180 Ca 0.15 -1.22 -0.16 0.00 -1.71 0.00 0.00 55.69 52.75 1bzx s MET 180 Cb 0.07 -0.44 0.03 0.00 2.01 0.00 0.00 34.83 36.50 1bzx s MET 180 CO 0.11 0.05 0.35 -0.59 -0.01 0.00 0.00 175.02 174.93 1bzx s PHE 181 N -2.82 -0.18 0.15 -0.03 -0.12 -0.80 -4.75 117.98 109.43 1bzx s PHE 181 Ca 0.08 0.13 0.03 0.00 -0.05 0.00 0.00 56.93 57.12 1bzx s PHE 181 Cb -0.00 0.14 -0.04 0.00 -0.63 0.00 0.00 43.02 42.49 1bzx s PHE 181 CO -0.01 -0.51 0.22 0.00 -0.05 0.00 0.00 175.22 174.88 1bzx s ALA 183 N -1.73 -1.46 0.00 0.00 0.00 -0.75 -1.42 121.76 116.40 1bzx s ALA 183 Ca 0.33 1.51 0.00 0.00 0.00 0.00 0.00 51.96 53.80 1bzx s ALA 183 Cb -0.11 -0.74 0.00 0.00 0.00 0.00 0.00 23.12 22.28 1bzx s ALA 183 CO 0.26 -0.29 0.00 0.41 0.00 0.00 0.00 175.76 176.14 1bzx n GLY 184 N 2.35 0.60 2.85 0.00 0.00 -0.84 -2.86 105.19 107.29 1bzx n GLY 184 Ca -0.15 -1.52 -0.22 0.00 0.00 0.00 0.00 46.02 44.13 1bzx n GLY 184 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1bzx s TYR 184 N -3.68 0.78 0.42 1.61 1.51 -1.26 -4.37 117.35 112.36 1bzx s TYR 184 Ca 0.00 -0.24 0.40 0.00 -1.01 0.00 0.00 57.07 56.22 1bzx s TYR 184 Cb 0.00 -0.76 1.97 0.00 -0.11 0.00 0.00 41.96 43.06 1bzx s TYR 184 CO 0.00 -0.26 2.21 -0.07 -1.11 0.00 0.00 175.55 176.31 1bzx h LEU 185 N 7.65 0.00 -0.31 -1.29 3.38 -1.96 0.11 115.31 122.89 1bzx h LEU 185 Ca -0.31 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.66 1bzx h LEU 185 Cb 1.14 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.89 1bzx h LEU 185 CO 0.39 0.00 0.00 -0.33 0.09 0.00 0.00 178.44 178.59 1bzx h GLU 186 N 0.00 0.00 0.00 1.13 3.07 -1.94 0.55 114.58 117.38 1bzx h GLU 186 Ca -0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 1bzx h GLU 186 Cb 0.23 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.14 1bzx h GLU 186 CO 0.00 0.00 0.00 0.41 -1.40 0.00 0.00 179.01 178.02 1bzx n GLY 187 N 0.80 -1.86 1.90 -3.84 0.00 0.39 -4.18 105.19 98.40 1bzx n GLY 187 Ca 0.04 -1.46 0.00 0.00 0.00 0.00 0.00 46.02 44.60 1bzx n GLY 187 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1bzx n GLY 188 N 0.00 2.96 2.78 -0.02 0.00 -0.13 -4.81 105.19 105.97 1bzx n GLY 188 Ca 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.85 1bzx n GLY 188 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1bzx s LYS 188 N -0.21 0.12 0.03 1.61 1.02 -1.26 -3.74 119.74 117.32 1bzx s LYS 188 Ca 0.00 0.16 -0.29 0.00 0.02 0.00 0.00 55.97 55.86 1bzx s LYS 188 Cb 0.00 -0.40 0.11 0.00 -0.52 0.00 0.00 37.83 37.01 1bzx s LYS 188 CO 0.00 -0.18 1.21 0.34 -0.92 0.00 0.00 175.35 175.80 1bzx s ASP 189 N 1.21 -0.08 0.34 2.83 -1.08 -0.75 -4.41 116.67 114.73 1bzx s ASP 189 Ca -0.07 -0.22 -0.05 0.00 -0.52 0.00 0.00 52.55 51.68 1bzx s ASP 189 Cb -0.13 0.24 -0.05 0.00 -1.46 0.00 0.00 42.92 41.52 1bzx s ASP 189 CO -0.03 -0.45 0.62 -0.94 0.52 0.00 0.00 175.17 174.89 1bzx s SER 190 N -3.05 6.42 0.17 -0.34 1.04 -1.26 -0.39 113.70 116.29 1bzx s SER 190 Ca 0.15 0.78 0.02 0.00 0.48 0.00 0.00 55.95 57.38 1bzx s SER 190 Cb 0.03 -2.17 -0.01 0.00 0.10 0.00 0.00 66.02 63.97 1bzx s SER 190 CO -0.02 -0.29 0.19 0.00 0.98 0.00 0.00 173.24 174.10 1bzx n GLN 192 N -0.31 1.95 0.00 0.00 3.00 -1.26 -1.56 117.38 119.20 1bzx n GLN 192 Ca 0.02 0.71 0.00 0.00 -0.01 0.00 0.00 57.00 57.72 1bzx n GLN 192 Cb 0.30 -2.49 0.00 0.00 0.00 0.00 0.00 30.24 28.05 1bzx n GLN 192 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1bzx n GLY 193 N 3.93 0.70 0.02 1.08 0.00 -1.26 -0.64 105.19 109.02 1bzx n GLY 193 Ca 0.21 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.34 1bzx n GLY 193 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1bzx n ASP 194 N 0.00 0.17 -4.36 1.61 8.00 -0.60 -3.82 116.55 117.54 1bzx n ASP 194 Ca 0.00 -0.04 -0.41 0.00 0.71 0.00 0.00 54.79 55.05 1bzx n ASP 194 Cb 0.00 1.75 0.00 0.00 -0.02 0.00 0.00 41.12 42.85 1bzx n ASP 194 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 1bzx n SER 195 N -2.24 -2.09 0.00 -2.24 7.64 -1.26 -1.65 113.62 111.77 1bzx n SER 195 Ca -0.03 0.83 0.00 0.00 1.01 0.00 0.00 58.87 60.68 1bzx n SER 195 Cb 0.55 -0.98 0.00 0.00 -1.01 0.00 0.00 64.21 62.77 1bzx n SER 195 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1bzx n GLY 196 N 2.11 3.00 3.55 0.23 0.00 -0.17 -0.05 105.19 113.87 1bzx n GLY 196 Ca 0.11 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.85 1bzx n GLY 196 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1bzx s GLY 197 N -1.05 1.54 0.27 -0.02 0.00 -0.66 -3.51 107.32 103.89 1bzx s GLY 197 Ca 0.00 -0.39 -0.14 0.00 0.00 0.00 0.00 44.72 44.19 1bzx s GLY 197 CO 0.00 0.34 0.67 2.56 0.00 0.00 0.00 173.10 176.67 1bzx s PRO 198 N -4.81 3.97 -0.29 2.90 0.04 -1.26 -1.49 135.00 134.06 1bzx s PRO 198 Ca 0.68 0.57 0.01 0.00 0.04 0.00 0.00 61.00 62.29 1bzx s PRO 198 Cb -0.20 -2.57 0.09 0.00 0.04 0.00 0.00 34.50 31.86 1bzx s PRO 198 CO 0.61 0.25 0.05 0.08 0.04 0.00 0.00 177.00 178.02 1bzx s VAL 199 N -1.85 1.35 -0.24 -0.36 1.01 -0.77 -3.31 120.40 116.24 1bzx s VAL 199 Ca 0.50 -1.53 -0.06 0.00 0.00 0.00 0.00 61.98 60.89 1bzx s VAL 199 Cb -0.11 -1.91 -0.02 0.00 0.00 0.00 0.00 36.38 34.34 1bzx s VAL 199 CO 0.19 -0.49 0.03 -0.69 0.00 0.00 0.00 175.10 174.14 1bzx s VAL 200 N 1.40 3.97 -0.26 2.92 1.01 0.71 -1.16 120.40 128.99 1bzx s VAL 200 Ca 0.06 -0.29 0.01 0.00 0.00 0.00 0.00 61.98 61.75 1bzx s VAL 200 Cb -0.18 -2.84 0.05 0.00 0.00 0.00 0.00 36.38 33.41 1bzx s VAL 200 CO -0.15 0.38 -0.09 0.00 0.00 0.00 0.00 175.10 175.24 1bzx n ASN 202 N 4.54 -3.78 0.00 0.00 5.03 -1.26 -2.25 115.26 117.54 1bzx n ASN 202 Ca -0.15 -0.90 0.00 0.00 0.87 0.00 0.00 54.58 54.40 1bzx n ASN 202 Cb 0.44 -3.90 0.00 0.00 -1.02 0.00 0.00 39.78 35.30 1bzx n ASN 202 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1bzx n GLY 203 N -1.59 0.53 3.39 7.41 0.00 -1.26 -4.99 105.19 108.69 1bzx n GLY 203 Ca -0.17 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.54 1bzx n GLY 203 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1bzx s GLU 204 N -0.49 2.01 -0.82 1.61 2.02 -0.95 -3.73 118.70 118.35 1bzx s GLU 204 Ca 0.00 -1.00 -0.26 0.00 0.02 0.00 0.00 54.97 53.73 1bzx s GLU 204 Cb 0.00 -2.10 0.03 0.00 0.10 0.00 0.00 34.13 32.16 1bzx s GLU 204 CO 0.00 0.54 1.35 -1.17 0.02 0.00 0.00 175.26 176.00 1bzx s LEU 209 N -1.17 3.27 0.02 1.80 2.96 0.24 -1.18 118.68 124.61 1bzx s LEU 209 Ca 0.12 -0.74 -0.06 0.00 -0.22 0.00 0.00 54.13 53.24 1bzx s LEU 209 Cb -0.10 -2.56 -0.30 0.00 0.50 0.00 0.00 46.19 43.73 1bzx s LEU 209 CO 0.03 -1.76 0.92 1.56 -1.32 0.00 0.00 176.35 175.78 1bzx h GLN 210 N 10.08 0.32 -4.15 1.98 1.08 -1.47 -3.34 115.11 119.62 1bzx h GLN 210 Ca -0.13 -0.55 -0.21 0.00 -1.45 0.00 0.00 58.65 56.31 1bzx h GLN 210 Cb 1.04 0.20 -0.11 0.00 -0.05 0.00 0.00 27.48 28.57 1bzx h GLN 210 CO 1.32 1.22 -0.31 0.20 -0.95 0.00 0.00 178.83 180.32 1bzx s GLY 211 N -4.85 1.22 -0.09 3.46 0.00 -1.05 -1.71 107.32 104.29 1bzx s GLY 211 Ca -0.09 -1.39 0.02 0.00 0.00 0.00 0.00 44.72 43.26 1bzx s GLY 211 CO 0.88 -1.02 -0.15 0.14 0.00 0.00 0.00 173.10 172.95 1bzx s VAL 212 N -3.71 1.42 0.01 1.40 1.01 -1.10 -1.85 120.40 117.57 1bzx s VAL 212 Ca 0.31 -0.62 -0.34 0.00 0.00 0.00 0.00 61.98 61.33 1bzx s VAL 212 Cb 0.02 -1.29 -0.13 0.00 0.00 0.00 0.00 36.38 34.98 1bzx s VAL 212 CO 0.15 0.42 1.74 0.52 0.00 0.00 0.00 175.10 177.93 1bzx n VAL 213 N 4.01 0.32 0.00 2.92 0.31 -0.56 -0.96 118.33 124.38 1bzx n VAL 213 Ca -0.20 -0.06 0.00 0.00 -0.01 0.00 0.00 64.34 64.07 1bzx n VAL 213 Cb 0.52 -1.69 0.00 0.00 -0.91 0.00 0.00 33.84 31.76 1bzx n VAL 213 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 1bzx n SER 214 N 5.19 0.00 -1.96 4.52 2.88 -1.12 -1.00 113.62 122.14 1bzx n SER 214 Ca 0.20 0.00 -0.06 0.00 -1.33 0.00 0.00 58.87 57.68 1bzx n SER 214 Cb 0.28 0.00 -0.00 0.00 -0.75 0.00 0.00 64.21 63.74 1bzx n SER 214 CO 0.00 0.00 0.00 -2.67 -1.23 0.00 0.00 175.04 171.14 1bzx n TRP 215 N -2.11 -1.31 0.00 0.66 4.27 -0.90 -4.88 117.44 113.16 1bzx n TRP 215 Ca 0.00 -1.07 0.00 0.00 -3.89 0.00 0.00 57.50 52.54 1bzx n TRP 215 Cb 0.00 0.37 0.00 0.00 -1.36 0.00 0.00 31.31 30.32 1bzx n TRP 215 CO 0.00 0.00 0.00 0.41 -2.29 0.00 0.00 177.69 175.81 1bzx n GLY 216 N -0.28 1.98 3.48 -1.67 0.00 -1.26 -0.41 105.19 107.02 1bzx n GLY 216 Ca -0.02 -0.92 -0.43 0.00 0.00 0.00 0.00 46.02 44.65 1bzx n GLY 216 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1bzx s TYR 217 N -2.00 2.90 0.00 1.61 2.02 -1.26 -4.91 117.35 115.71 1bzx s TYR 217 Ca 0.00 -0.32 0.00 0.00 -0.37 0.00 0.00 57.07 56.38 1bzx s TYR 217 Cb 0.00 -3.86 0.00 0.00 -0.40 0.00 0.00 41.96 37.70 1bzx s TYR 217 CO 0.00 -1.24 0.00 0.41 -1.57 0.00 0.00 175.55 173.15 1bzx n GLY 219 N 5.16 -0.86 2.80 0.71 0.00 -1.26 -4.69 105.19 107.07 1bzx n GLY 219 Ca -0.03 -1.18 -0.15 0.00 0.00 0.00 0.00 46.02 44.67 1bzx n GLY 219 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bzx n ALA 221 N 4.10 -0.58 -2.30 0.00 0.00 -1.26 -4.89 120.51 115.58 1bzx n ALA 221 Ca -0.26 0.19 -0.39 0.00 0.00 0.00 0.00 53.44 52.98 1bzx n ALA 221 Cb 0.51 -2.04 -0.06 0.00 0.00 0.00 0.00 19.45 17.86 1bzx n ALA 221 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 1bzx s GLU 221 N -4.76 4.24 0.31 0.00 2.02 -1.26 -0.96 118.70 118.29 1bzx s GLU 221 Ca 0.00 0.76 -0.30 0.00 0.02 0.00 0.00 54.97 55.45 1bzx s GLU 221 Cb 0.00 -3.26 -0.12 0.00 0.10 0.00 0.00 34.13 30.86 1bzx s GLU 221 CO 0.00 0.59 1.58 -2.30 0.02 0.00 0.00 175.26 175.15 1bzx n PRO 222 N 1.90 2.69 -0.74 0.39 -0.02 -1.26 -1.76 135.00 136.20 1bzx n PRO 222 Ca -0.09 0.95 0.00 0.00 -2.02 0.00 0.00 63.50 62.34 1bzx n PRO 222 Cb 0.51 -2.73 0.00 0.00 -0.02 0.00 0.00 33.50 31.26 1bzx n PRO 222 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1bzx n GLY 223 N 1.91 1.38 2.65 -1.23 0.00 0.19 -4.91 105.19 105.18 1bzx n GLY 223 Ca 0.08 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.82 1bzx n GLY 223 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1bzx n ASN 224 N 0.00 1.57 -4.83 1.61 5.03 -0.72 -4.75 115.26 113.17 1bzx n ASN 224 Ca 0.00 -2.87 -0.30 0.00 0.87 0.00 0.00 54.58 52.28 1bzx n ASN 224 Cb 0.00 -0.67 0.08 0.00 -1.02 0.00 0.00 39.78 38.17 1bzx n ASN 224 CO 0.00 0.00 0.00 -2.16 -1.83 0.00 0.00 177.26 173.27 1bzx s PRO 225 N -0.90 2.27 0.40 3.52 0.04 -1.26 -4.24 135.00 134.83 1bzx s PRO 225 Ca 0.29 0.57 -0.24 0.00 0.04 0.00 0.00 61.00 61.66 1bzx s PRO 225 Cb 0.01 -1.94 -0.09 0.00 0.04 0.00 0.00 34.50 32.51 1bzx s PRO 225 CO -0.17 -1.48 1.07 0.20 0.04 0.00 0.00 177.00 176.66 1bzx s GLY 226 N -4.05 2.76 -0.12 0.56 0.00 -1.13 -4.67 107.32 100.66 1bzx s GLY 226 Ca 0.60 0.74 -0.02 0.00 0.00 0.00 0.00 44.72 46.04 1bzx s GLY 226 CO 0.53 1.18 -0.04 0.14 0.00 0.00 0.00 173.10 174.91 1bzx s VAL 227 N -1.62 3.91 0.10 1.40 1.01 0.45 -1.80 120.40 123.84 1bzx s VAL 227 Ca 0.58 -0.38 0.09 0.00 0.00 0.00 0.00 61.98 62.27 1bzx s VAL 227 Cb -0.23 -2.66 -0.04 0.00 0.00 0.00 0.00 36.38 33.45 1bzx s VAL 227 CO 0.29 0.55 -0.24 -0.31 0.00 0.00 0.00 175.10 175.39 1bzx s TYR 228 N -0.21 2.03 0.37 5.22 1.51 0.29 -2.12 117.35 124.44 1bzx s TYR 228 Ca 0.04 -0.40 -0.26 0.00 -1.01 0.00 0.00 57.07 55.44 1bzx s TYR 228 Cb -0.13 -1.12 -0.09 0.00 -0.11 0.00 0.00 41.96 40.51 1bzx s TYR 228 CO 0.02 0.24 1.17 0.00 -1.11 0.00 0.00 175.55 175.87 1bzx s ALA 229 N -1.06 3.23 -0.74 3.71 0.00 -0.13 -1.91 121.76 124.86 1bzx s ALA 229 Ca 0.10 0.97 -0.19 0.00 0.00 0.00 0.00 51.96 52.84 1bzx s ALA 229 Cb -0.10 -3.38 0.12 0.00 0.00 0.00 0.00 23.12 19.76 1bzx s ALA 229 CO 0.04 -0.46 0.91 0.21 0.00 0.00 0.00 175.76 176.47 1bzx s LYS 230 N -2.11 3.29 0.22 0.00 2.20 0.18 -2.73 119.74 120.79 1bzx s LYS 230 Ca 0.54 -1.45 -0.08 0.00 -0.36 0.00 0.00 55.97 54.62 1bzx s LYS 230 Cb -0.31 -4.48 0.28 0.00 -1.51 0.00 0.00 37.83 31.80 1bzx s LYS 230 CO 0.40 -1.66 1.81 0.28 -0.36 0.00 0.00 175.35 175.82 1bzx h VAL 231 N 5.80 0.97 -0.03 4.02 2.07 -1.63 -2.82 116.25 124.63 1bzx h VAL 231 Ca -0.11 -0.26 0.01 0.00 0.82 0.00 0.00 66.70 67.16 1bzx h VAL 231 Cb 1.06 0.16 -0.00 0.00 -1.52 0.00 0.00 31.29 30.98 1bzx h VAL 231 CO 1.09 0.14 0.07 0.00 0.02 0.00 0.00 177.57 178.89 1bzx n ILE 233 N -3.34 0.34 0.02 0.00 -6.64 -1.06 -3.75 119.36 104.93 1bzx n ILE 233 Ca -0.02 -0.37 0.00 0.00 -1.77 0.00 0.00 62.75 60.59 1bzx n ILE 233 Cb 0.15 0.21 0.00 0.00 -1.44 0.00 0.00 39.64 38.56 1bzx n ILE 233 CO 0.00 0.00 0.00 0.49 -1.77 0.00 0.00 176.55 175.27 1bzx n PHE 234 N 0.31 0.00 -0.33 4.28 3.72 0.15 -4.79 117.46 120.80 1bzx n PHE 234 Ca 0.11 0.00 0.26 0.00 -0.05 0.00 0.00 57.45 57.77 1bzx n PHE 234 Cb 0.26 0.00 0.49 0.00 -0.94 0.00 0.00 39.48 39.29 1bzx n PHE 234 CO 0.00 0.00 0.00 -0.91 -0.05 0.00 0.00 176.76 175.80 1bzx h ASN 235 N 0.07 0.21 -0.28 4.37 2.35 -1.63 0.56 115.58 121.23 1bzx h ASN 235 Ca 0.00 0.24 -0.06 0.00 -0.55 0.00 0.00 56.30 55.93 1bzx h ASN 235 Cb 0.02 0.28 -0.01 0.00 0.05 0.00 0.00 38.32 38.66 1bzx h ASN 235 CO 0.00 -0.34 -0.06 0.44 -1.65 0.00 0.00 177.43 175.82 1bzx h ASP 236 N 0.09 0.53 -0.35 5.81 5.19 -1.89 -1.51 116.42 124.29 1bzx h ASP 236 Ca 0.76 -0.36 -0.17 0.00 -0.62 0.00 0.00 57.03 56.64 1bzx h ASP 236 Cb 1.87 -0.15 -0.00 0.00 0.18 0.00 0.00 39.33 41.23 1bzx h ASP 236 CO -0.75 0.77 -0.44 -0.25 -3.12 0.00 0.00 179.24 175.45 1bzx h TRP 237 N 0.29 1.13 0.36 4.55 7.01 -1.34 -1.21 115.95 126.74 1bzx h TRP 237 Ca 0.07 -0.36 -0.01 0.00 2.11 0.00 0.00 58.89 60.70 1bzx h TRP 237 Cb 0.54 -0.23 -0.01 0.00 -2.10 0.00 0.00 29.16 27.36 1bzx h TRP 237 CO 0.05 1.19 -0.28 -0.07 -2.79 0.00 0.00 178.44 176.54 1bzx h LEU 238 N 0.74 -0.74 -0.37 0.65 3.38 -0.98 -0.65 115.31 117.34 1bzx h LEU 238 Ca 0.04 0.06 -0.06 0.00 0.09 0.00 0.00 57.88 58.01 1bzx h LEU 238 Cb 1.05 0.24 -0.01 0.00 0.09 0.00 0.00 40.66 42.02 1bzx h LEU 238 CO 0.11 -0.42 0.01 0.71 0.09 0.00 0.00 178.44 178.93 1bzx h THR 239 N -0.65 1.26 -0.63 0.22 1.35 -1.27 -2.20 112.91 110.99 1bzx h THR 239 Ca -0.03 -0.97 0.01 0.00 -0.55 0.00 0.00 66.41 64.87 1bzx h THR 239 Cb 0.56 1.15 -0.03 0.00 -1.73 0.00 0.00 68.15 68.10 1bzx h THR 239 CO -0.01 0.32 0.42 0.77 -0.25 0.00 0.00 175.52 176.77 1bzx h SER 240 N 0.48 0.72 -0.70 5.36 4.64 -1.14 -2.86 113.55 120.04 1bzx h SER 240 Ca 0.11 -0.02 -0.07 0.00 -0.47 0.00 0.00 61.79 61.34 1bzx h SER 240 Cb 0.45 -0.18 -0.03 0.00 -0.31 0.00 0.00 62.40 62.33 1bzx h SER 240 CO 0.02 0.52 0.18 0.74 -0.87 0.00 0.00 176.83 177.41 1bzx h THR 241 N 0.85 1.26 0.00 2.95 2.02 -1.02 -1.92 112.91 117.04 1bzx h THR 241 Ca 0.24 -0.96 0.00 0.00 0.77 0.00 0.00 66.41 66.46 1bzx h THR 241 Cb -0.08 0.54 0.00 0.00 -1.74 0.00 0.00 68.15 66.86 1bzx h THR 241 CO -0.06 0.37 0.00 0.23 0.37 0.00 0.00 175.52 176.43 1bzx n MET 242 N -4.25 0.76 -0.00 6.66 2.81 -0.84 -2.44 117.12 119.82 1bzx n MET 242 Ca 0.05 0.00 0.05 0.00 -1.81 0.00 0.00 57.70 55.99 1bzx n MET 242 Cb 0.25 -1.36 -0.07 0.00 -0.71 0.00 0.00 33.22 31.33 1bzx n MET 242 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1bzx n ALA 243 N -0.86 2.38 -1.63 3.04 0.00 -0.78 -4.79 120.51 117.87 1bzx n ALA 243 Ca 0.13 -0.22 -0.41 0.00 0.00 0.00 0.00 53.44 52.95 1bzx n ALA 243 Cb 0.06 -0.31 -0.01 0.00 0.00 0.00 0.00 19.45 19.19 1bzx n ALA 243 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1bzx n SER 244 N -1.78 5.99 0.00 0.00 7.64 -0.88 -5.11 113.62 119.47 1bzx n SER 244 Ca -0.01 -2.78 0.00 0.00 1.01 0.00 0.00 58.87 57.09 1bzx n SER 244 Cb 0.23 -1.59 0.00 0.00 -1.01 0.00 0.00 64.21 61.83 1bzx n SER 244 CO 0.00 0.00 0.00 -1.22 -3.01 0.00 0.00 175.04 170.81