#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2by9 s VAL 17 N 0.00 5.38 -0.67 1.39 1.01 0.71 -3.98 120.40 124.24 2by9 s VAL 17 Ca 0.00 0.17 0.00 0.00 0.00 0.00 0.00 61.98 62.15 2by9 s VAL 17 Cb 0.00 -3.43 0.00 0.00 0.00 0.00 0.00 36.38 32.95 2by9 s VAL 17 CO 0.00 0.49 0.00 0.61 0.00 0.00 0.00 175.10 176.20 2by9 n GLY 18 N 3.14 0.76 0.00 4.51 0.00 -1.24 -1.43 105.19 110.93 2by9 n GLY 18 Ca -0.17 -0.74 0.00 0.00 0.00 0.00 0.00 46.02 45.11 2by9 n GLY 18 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2by9 n GLY 19 N -2.01 1.70 3.08 -0.02 0.00 -1.26 -4.85 105.19 101.83 2by9 n GLY 19 Ca -0.07 -1.95 -0.08 0.00 0.00 0.00 0.00 46.02 43.93 2by9 n GLY 19 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2by9 s TYR 20 N 2.11 0.50 -0.07 1.61 1.13 0.22 -4.94 117.35 117.90 2by9 s TYR 20 Ca 0.00 -0.95 -0.30 0.00 -1.41 0.00 0.00 57.07 54.41 2by9 s TYR 20 Cb 0.00 -0.36 -0.04 0.00 -1.10 0.00 0.00 41.96 40.45 2by9 s TYR 20 CO 0.00 -0.32 1.50 0.99 -2.51 0.00 0.00 175.55 175.20 2by9 s THR 21 N -3.41 3.79 0.13 -3.49 2.01 -1.26 -0.34 115.64 113.07 2by9 s THR 21 Ca 0.03 1.01 -0.18 0.00 0.31 0.00 0.00 61.69 62.86 2by9 s THR 21 Cb 0.04 -3.65 -0.04 0.00 0.01 0.00 0.00 72.50 68.86 2by9 s THR 21 CO -0.08 -0.07 1.79 0.00 -0.69 0.00 0.00 174.62 175.57 2by9 n GLY 23 N -1.17 2.66 3.71 0.00 0.00 -1.26 -4.85 105.19 104.28 2by9 n GLY 23 Ca -0.02 -1.58 -0.42 0.00 0.00 0.00 0.00 46.02 44.00 2by9 n GLY 23 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2by9 s ALA 24 N -1.12 3.84 -1.99 4.61 0.00 -1.26 -2.35 121.76 123.49 2by9 s ALA 24 Ca 0.00 1.47 0.00 0.00 0.00 0.00 0.00 51.96 53.43 2by9 s ALA 24 Cb 0.00 -3.69 0.00 0.00 0.00 0.00 0.00 23.12 19.43 2by9 s ALA 24 CO 0.00 -0.97 0.00 0.09 0.00 0.00 0.00 175.76 174.88 2by9 n ASN 25 N 4.52 -5.71 -0.04 0.00 3.02 -1.26 -4.86 115.26 110.93 2by9 n ASN 25 Ca 0.16 0.24 0.13 0.00 -0.03 0.00 0.00 54.58 55.08 2by9 n ASN 25 Cb 0.37 -4.87 0.48 0.00 -0.61 0.00 0.00 39.78 35.15 2by9 n ASN 25 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 2by9 n THR 26 N -3.22 0.00 -3.55 3.41 -2.24 -0.99 -4.22 114.28 103.46 2by9 n THR 26 Ca -0.23 -0.02 -0.27 0.00 -2.27 0.00 0.00 64.05 61.26 2by9 n THR 26 Cb 0.69 -0.09 -0.10 0.00 -2.10 0.00 0.00 70.33 68.72 2by9 n THR 26 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 2by9 n VAL 27 N -1.32 0.98 0.53 2.28 0.31 -1.26 -4.99 118.33 114.86 2by9 n VAL 27 Ca 0.09 -4.58 0.12 0.00 -0.01 0.00 0.00 64.34 59.95 2by9 n VAL 27 Cb 0.32 -2.03 0.45 0.00 -0.91 0.00 0.00 33.84 31.67 2by9 n VAL 27 CO 0.00 0.00 0.00 -0.81 -1.32 0.00 0.00 176.83 174.70 2by9 n PRO 28 N 1.69 0.16 0.00 5.55 -0.04 -1.26 -1.54 135.00 139.56 2by9 n PRO 28 Ca 0.25 0.30 0.12 0.00 -0.04 0.00 0.00 63.50 64.14 2by9 n PRO 28 Cb 0.42 -1.75 0.30 0.00 -0.04 0.00 0.00 33.50 32.43 2by9 n PRO 28 CO 0.00 0.00 0.00 2.48 -0.04 0.00 0.00 175.50 177.94 2by9 n TYR 29 N -2.04 0.00 -2.34 0.54 0.18 -1.13 -2.16 117.16 110.22 2by9 n TYR 29 Ca 0.04 0.00 -0.42 0.00 1.88 0.00 0.00 57.90 59.40 2by9 n TYR 29 Cb 0.28 -0.24 -0.03 0.00 -0.38 0.00 0.00 39.34 38.97 2by9 n TYR 29 CO 0.00 0.00 0.00 -1.14 -2.08 0.00 0.00 176.86 173.64 2by9 s GLN 30 N -2.90 4.36 0.24 -3.48 2.00 -0.59 -0.86 119.66 118.43 2by9 s GLN 30 Ca 0.14 1.85 0.11 0.00 -2.00 0.00 0.00 55.36 55.46 2by9 s GLN 30 Cb 0.18 -3.41 -0.05 0.00 0.80 0.00 0.00 33.01 30.53 2by9 s GLN 30 CO 0.65 -0.39 -0.14 0.14 -0.50 0.00 0.00 175.29 175.04 2by9 s VAL 31 N 1.56 2.80 -0.15 1.34 -7.23 -0.25 -4.48 120.40 114.00 2by9 s VAL 31 Ca 0.60 -2.08 -0.03 0.00 -1.81 0.00 0.00 61.98 58.66 2by9 s VAL 31 Cb -0.30 -2.44 -0.03 0.00 0.56 0.00 0.00 36.38 34.17 2by9 s VAL 31 CO 0.28 -0.28 -0.05 -0.55 -0.31 0.00 0.00 175.10 174.19 2by9 s SER 32 N -3.25 4.72 -0.18 4.85 0.15 -0.56 -2.21 113.70 117.23 2by9 s SER 32 Ca 0.27 -0.14 -0.19 0.00 0.70 0.00 0.00 55.95 56.60 2by9 s SER 32 Cb -0.07 -1.74 -0.03 0.00 -1.71 0.00 0.00 66.02 62.47 2by9 s SER 32 CO 0.15 0.18 0.51 -0.76 1.20 0.00 0.00 173.24 174.53 2by9 s LEU 33 N 0.29 4.18 -0.06 3.45 1.43 0.15 -0.70 118.68 127.42 2by9 s LEU 33 Ca -0.04 0.72 0.04 0.00 -1.03 0.00 0.00 54.13 53.82 2by9 s LEU 33 Cb -0.14 -2.72 0.00 0.00 0.03 0.00 0.00 46.19 43.36 2by9 s LEU 33 CO 0.03 -0.14 -0.18 0.21 0.23 0.00 0.00 176.35 176.51 2by9 s ASN 34 N 1.01 2.31 -0.34 2.29 2.47 -0.10 -1.14 114.94 121.45 2by9 s ASN 34 Ca 0.25 -0.39 0.12 0.00 0.42 0.00 0.00 52.86 53.26 2by9 s ASN 34 Cb -0.15 -0.88 0.46 0.00 -1.45 0.00 0.00 41.25 39.23 2by9 s ASN 34 CO 0.10 0.12 1.09 -1.54 -3.72 0.00 0.00 177.10 173.15 2by9 n SER 37 N 3.44 3.33 0.00 -4.21 3.41 -1.26 -0.81 113.62 117.52 2by9 n SER 37 Ca -0.20 -3.13 0.00 0.00 -0.26 0.00 0.00 58.87 55.28 2by9 n SER 37 Cb 0.52 -0.45 0.00 0.00 -0.26 0.00 0.00 64.21 64.02 2by9 n SER 37 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2by9 n GLY 38 N -0.46 0.33 3.59 5.00 0.00 -1.26 -5.02 105.19 107.38 2by9 n GLY 38 Ca 0.26 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.22 2by9 n GLY 38 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2by9 s TYR 39 N -2.00 -0.22 0.25 1.61 -0.85 -1.26 -5.14 117.35 109.74 2by9 s TYR 39 Ca 0.00 0.32 -0.31 0.00 -0.52 0.00 0.00 57.07 56.57 2by9 s TYR 39 Cb 0.00 0.48 -0.11 0.00 0.38 0.00 0.00 41.96 42.71 2by9 s TYR 39 CO 0.00 -0.24 1.63 -1.58 -1.52 0.00 0.00 175.55 173.84 2by9 s HIS 40 N -1.49 2.84 0.00 -3.49 5.65 -1.26 -4.17 115.29 113.36 2by9 s HIS 40 Ca 0.04 0.63 0.00 0.00 0.25 0.00 0.00 55.06 55.98 2by9 s HIS 40 Cb -0.01 -4.07 0.00 0.00 -1.18 0.00 0.00 32.58 27.32 2by9 s HIS 40 CO -0.03 -3.80 0.00 1.97 -0.65 0.00 0.00 174.74 172.23 2by9 n PHE 41 N 2.93 0.00 -3.50 3.88 -1.74 -0.29 -4.95 117.46 113.79 2by9 n PHE 41 Ca 0.11 0.00 -0.11 0.00 -0.56 0.00 0.00 57.45 56.89 2by9 n PHE 41 Cb 0.37 0.00 -0.03 0.00 1.52 0.00 0.00 39.48 41.34 2by9 n PHE 41 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 2by9 s GLY 43 N -2.18 1.76 0.18 0.00 0.00 0.49 -0.68 107.32 106.90 2by9 s GLY 43 Ca 0.01 -1.59 -0.23 0.00 0.00 0.00 0.00 44.72 42.91 2by9 s GLY 43 CO -0.06 -1.01 1.00 -0.32 0.00 0.00 0.00 173.10 172.72 2by9 s GLY 44 N -4.74 -0.02 -0.07 0.20 0.00 -0.94 -3.72 107.32 98.03 2by9 s GLY 44 Ca 0.67 -0.16 0.01 0.00 0.00 0.00 0.00 44.72 45.25 2by9 s GLY 44 CO 0.46 1.30 -0.08 -0.56 0.00 0.00 0.00 173.10 174.21 2by9 s SER 45 N -3.20 1.62 -0.12 1.64 0.01 -0.30 -1.09 113.70 112.26 2by9 s SER 45 Ca 0.18 -0.24 -0.29 0.00 1.31 0.00 0.00 55.95 56.90 2by9 s SER 45 Cb -0.02 -0.70 -0.02 0.00 0.21 0.00 0.00 66.02 65.49 2by9 s SER 45 CO 0.04 -0.04 1.22 -0.22 0.41 0.00 0.00 173.24 174.65 2by9 s LEU 46 N 1.05 4.22 -0.00 2.44 2.96 -0.04 -0.83 118.68 128.47 2by9 s LEU 46 Ca -0.08 1.72 0.09 0.00 -0.22 0.00 0.00 54.13 55.63 2by9 s LEU 46 Cb -0.14 -3.55 -0.10 0.00 0.50 0.00 0.00 46.19 42.90 2by9 s LEU 46 CO -0.00 -0.67 0.34 2.30 -1.32 0.00 0.00 176.35 176.99 2by9 n ILE 47 N 5.04 0.00 -3.67 6.68 -5.35 -0.36 -0.80 119.36 120.89 2by9 n ILE 47 Ca 0.12 -0.28 -0.05 0.00 -0.27 0.00 0.00 62.75 62.28 2by9 n ILE 47 Cb 0.46 0.88 0.02 0.00 -1.74 0.00 0.00 39.64 39.26 2by9 n ILE 47 CO 0.00 0.00 0.00 -0.46 -1.76 0.00 0.00 176.55 174.33 2by9 n ASN 48 N -1.31 -1.56 0.23 7.28 0.23 -1.19 -4.63 115.26 114.31 2by9 n ASN 48 Ca 0.01 -1.99 0.16 0.00 -0.53 0.00 0.00 54.58 52.23 2by9 n ASN 48 Cb 0.15 2.58 0.77 0.00 -2.08 0.00 0.00 39.78 41.20 2by9 n ASN 48 CO 0.00 0.00 0.00 0.77 -0.93 0.00 0.00 177.26 177.10 2by9 h SER 49 N 1.49 0.00 0.00 0.53 4.64 -1.97 -3.13 113.55 115.11 2by9 h SER 49 Ca -0.23 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.09 2by9 h SER 49 Cb 0.92 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.01 2by9 h SER 49 CO 0.30 0.00 -0.01 1.67 -0.87 0.00 0.00 176.83 177.92 2by9 n GLN 50 N -2.64 1.60 -4.14 4.77 7.27 -1.26 -0.21 117.38 122.77 2by9 n GLN 50 Ca -0.01 -1.10 -0.16 0.00 0.07 0.00 0.00 57.00 55.80 2by9 n GLN 50 Cb 0.13 -0.79 -0.15 0.00 2.41 0.00 0.00 30.24 31.85 2by9 n GLN 50 CO 0.00 0.00 0.00 -1.58 0.07 0.00 0.00 177.06 175.55 2by9 s TRP 51 N -0.61 0.48 0.00 3.69 0.52 -1.18 -0.72 118.94 121.12 2by9 s TRP 51 Ca 0.01 -0.09 0.08 0.00 0.02 0.00 0.00 56.10 56.12 2by9 s TRP 51 Cb 0.01 -0.35 -0.02 0.00 -1.15 0.00 0.00 33.47 31.96 2by9 s TRP 51 CO 0.00 -0.04 -0.25 0.08 0.02 0.00 0.00 176.95 176.77 2by9 s VAL 52 N 0.08 2.21 -0.08 4.03 1.01 0.09 -1.23 120.40 126.51 2by9 s VAL 52 Ca -0.00 -1.17 0.02 0.00 0.00 0.00 0.00 61.98 60.82 2by9 s VAL 52 Cb -0.04 -1.81 -0.02 0.00 0.00 0.00 0.00 36.38 34.50 2by9 s VAL 52 CO -0.00 0.50 -0.12 0.54 0.00 0.00 0.00 175.10 176.01 2by9 s VAL 53 N -0.70 3.18 0.00 2.92 0.11 -0.01 -0.76 120.40 125.14 2by9 s VAL 53 Ca 0.11 -0.66 0.00 0.00 -2.93 0.00 0.00 61.98 58.50 2by9 s VAL 53 Cb -0.10 -2.29 -0.00 0.00 -1.53 0.00 0.00 36.38 32.46 2by9 s VAL 53 CO 0.00 0.57 0.00 -0.24 -3.33 0.00 0.00 175.10 172.10 2by9 n SER 54 N 2.72 -0.00 -4.83 3.54 2.88 -0.62 -1.15 113.62 116.15 2by9 n SER 54 Ca -0.18 -1.01 -0.36 0.00 -1.33 0.00 0.00 58.87 55.99 2by9 n SER 54 Cb 0.52 0.01 -0.06 0.00 -0.75 0.00 0.00 64.21 63.93 2by9 n SER 54 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2by9 s ALA 55 N -1.96 3.53 0.46 -1.46 0.00 -1.26 -1.14 121.76 119.95 2by9 s ALA 55 Ca 0.00 -0.03 0.12 0.00 0.00 0.00 0.00 51.96 52.06 2by9 s ALA 55 Cb 0.00 -2.62 1.06 0.00 0.00 0.00 0.00 23.12 21.56 2by9 s ALA 55 CO 0.00 0.41 2.07 0.00 0.00 0.00 0.00 175.76 178.25 2by9 h ALA 56 N 3.66 1.81 0.00 0.00 0.00 -1.69 -1.12 119.26 121.93 2by9 h ALA 56 Ca -0.49 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.37 2by9 h ALA 56 Cb 1.20 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.93 2by9 h ALA 56 CO 0.65 0.15 0.00 -2.39 0.00 0.00 0.00 179.25 177.66 2by9 n HIS 57 N -4.46 0.00 1.50 0.00 1.44 -1.26 -1.23 115.22 111.21 2by9 n HIS 57 Ca -0.01 0.00 0.14 0.00 -2.01 0.00 0.00 57.72 55.84 2by9 n HIS 57 Cb 0.12 -0.31 0.53 0.00 0.12 0.00 0.00 29.99 30.46 2by9 n HIS 57 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 2by9 n TYR 59 N 0.11 2.56 -3.62 0.00 9.36 -0.37 -4.99 117.16 120.22 2by9 n TYR 59 Ca 0.19 0.29 -0.08 0.00 3.32 0.00 0.00 57.90 61.62 2by9 n TYR 59 Cb 0.34 -2.55 -0.02 0.00 -0.63 0.00 0.00 39.34 36.47 2by9 n TYR 59 CO 0.00 0.00 0.00 -1.59 0.22 0.00 0.00 176.86 175.49 2by9 s LYS 60 N -0.18 1.30 0.60 2.98 -2.85 -1.26 -5.14 119.74 115.20 2by9 s LYS 60 Ca 0.68 -0.61 -0.09 0.00 -1.00 0.00 0.00 55.97 54.95 2by9 s LYS 60 Cb -0.56 0.52 -0.02 0.00 -2.06 0.00 0.00 37.83 35.70 2by9 s LYS 60 CO 0.46 -0.59 0.97 -1.54 0.10 0.00 0.00 175.35 174.75 2by9 s SER 61 N -2.78 5.96 -0.58 0.03 1.04 -1.26 -4.45 113.70 111.66 2by9 s SER 61 Ca 0.07 1.13 -0.03 0.00 0.48 0.00 0.00 55.95 57.60 2by9 s SER 61 Cb -0.02 -2.17 0.00 0.00 0.10 0.00 0.00 66.02 63.93 2by9 s SER 61 CO -0.04 -0.94 0.36 0.61 0.98 0.00 0.00 173.24 174.21 2by9 n GLY 62 N -2.67 0.28 3.74 7.32 0.00 -1.26 -5.00 105.19 107.60 2by9 n GLY 62 Ca 0.05 -0.36 -0.40 0.00 0.00 0.00 0.00 46.02 45.30 2by9 n GLY 62 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2by9 s ILE 63 N -2.95 4.66 -0.18 -0.61 1.01 -1.26 -4.59 121.20 117.28 2by9 s ILE 63 Ca 0.18 1.79 -0.05 0.00 0.00 0.00 0.00 60.65 62.56 2by9 s ILE 63 Cb -0.08 -4.19 -0.03 0.00 0.01 0.00 0.00 42.46 38.17 2by9 s ILE 63 CO 0.22 0.34 0.01 -1.58 0.00 0.00 0.00 174.94 173.92 2by9 s GLN 64 N 0.01 3.74 -0.11 2.79 0.74 0.01 -1.14 119.66 125.70 2by9 s GLN 64 Ca 0.42 -0.47 -0.18 0.00 0.05 0.00 0.00 55.36 55.17 2by9 s GLN 64 Cb -0.21 -3.07 -0.04 0.00 1.10 0.00 0.00 33.01 30.79 2by9 s GLN 64 CO 0.25 0.16 0.49 0.08 -0.55 0.00 0.00 175.29 175.72 2by9 s VAL 65 N 0.62 5.17 -0.29 1.34 1.01 0.22 -0.92 120.40 127.55 2by9 s VAL 65 Ca -0.00 0.98 -0.02 0.00 0.00 0.00 0.00 61.98 62.95 2by9 s VAL 65 Cb -0.14 -3.83 0.05 0.00 0.00 0.00 0.00 36.38 32.46 2by9 s VAL 65 CO 0.02 0.33 -0.01 -0.13 0.00 0.00 0.00 175.10 175.31 2by9 s ARG 66 N 0.55 2.48 0.31 2.72 0.52 0.12 -0.92 118.95 124.74 2by9 s ARG 66 Ca 0.27 -1.23 0.05 0.00 -0.52 0.00 0.00 55.73 54.30 2by9 s ARG 66 Cb -0.15 -3.14 -0.02 0.00 0.52 0.00 0.00 34.95 32.16 2by9 s ARG 66 CO 0.11 -0.59 0.46 -0.51 0.02 0.00 0.00 175.30 174.79 2by9 s LEU 67 N 1.26 4.06 -1.21 2.53 2.01 0.32 -1.50 118.68 126.15 2by9 s LEU 67 Ca -0.05 -0.04 0.00 0.00 0.01 0.00 0.00 54.13 54.05 2by9 s LEU 67 Cb -0.19 -2.85 0.00 0.00 0.01 0.00 0.00 46.19 43.16 2by9 s LEU 67 CO -0.02 -0.33 0.00 0.61 1.01 0.00 0.00 176.35 177.62 2by9 n GLY 69 N -1.61 1.23 3.78 -3.19 0.00 -1.26 -0.50 105.19 103.63 2by9 n GLY 69 Ca -0.03 -0.32 -0.39 0.00 0.00 0.00 0.00 46.02 45.28 2by9 n GLY 69 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2by9 s GLU 70 N -2.85 4.55 0.00 1.61 0.41 -1.26 -3.76 118.70 117.39 2by9 s GLU 70 Ca 0.00 1.14 0.00 0.00 -0.41 0.00 0.00 54.97 55.70 2by9 s GLU 70 Cb 0.00 -3.23 0.00 0.00 -1.78 0.00 0.00 34.13 29.12 2by9 s GLU 70 CO 0.00 0.56 0.00 -3.47 -0.49 0.00 0.00 175.26 171.86 2by9 n ASP 71 N 1.53 0.00 -4.63 -0.19 2.03 -1.26 -4.56 116.55 109.47 2by9 n ASP 71 Ca -0.05 0.00 -0.43 0.00 0.52 0.00 0.00 54.79 54.83 2by9 n ASP 71 Cb 0.49 0.00 -0.02 0.00 -0.72 0.00 0.00 41.12 40.87 2by9 n ASP 71 CO 0.00 0.00 0.00 0.21 -1.92 0.00 0.00 177.20 175.49 2by9 s ASN 72 N 0.72 6.57 0.00 1.67 3.84 -1.25 -3.59 114.94 122.90 2by9 s ASN 72 Ca 0.00 1.23 0.26 0.00 0.21 0.00 0.00 52.86 54.56 2by9 s ASN 72 Cb 0.00 -2.54 1.38 0.00 -0.55 0.00 0.00 41.25 39.54 2by9 s ASN 72 CO 0.00 -1.16 1.90 2.30 -2.79 0.00 0.00 177.10 177.34 2by9 n ILE 73 N 6.37 0.13 0.41 -5.21 -5.35 -0.30 -2.95 119.36 112.46 2by9 n ILE 73 Ca 0.16 0.03 0.07 0.00 -0.27 0.00 0.00 62.75 62.74 2by9 n ILE 73 Cb 0.47 -0.60 0.09 0.00 -1.74 0.00 0.00 39.64 37.85 2by9 n ILE 73 CO 0.00 0.00 0.00 0.59 -1.76 0.00 0.00 176.55 175.38 2by9 n ASN 74 N -1.22 2.43 -3.90 7.28 3.02 -1.26 -4.97 115.26 116.63 2by9 n ASN 74 Ca 0.14 -1.69 -0.16 0.00 -0.03 0.00 0.00 54.58 52.83 2by9 n ASN 74 Cb 0.18 -0.07 -0.15 0.00 -0.61 0.00 0.00 39.78 39.13 2by9 n ASN 74 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2by9 s VAL 75 N -1.16 0.33 -0.36 2.41 1.01 -1.15 -5.11 120.40 116.37 2by9 s VAL 75 Ca 0.20 -0.10 -0.26 0.00 0.00 0.00 0.00 61.98 61.82 2by9 s VAL 75 Cb 0.13 -0.33 0.01 0.00 0.00 0.00 0.00 36.38 36.19 2by9 s VAL 75 CO 0.19 0.13 0.94 -0.69 0.00 0.00 0.00 175.10 175.66 2by9 s VAL 76 N 0.36 4.58 -0.54 2.92 1.01 -1.26 -4.69 120.40 122.77 2by9 s VAL 76 Ca -0.04 1.23 0.13 0.00 0.00 0.00 0.00 61.98 63.31 2by9 s VAL 76 Cb -0.07 -4.34 -0.15 0.00 0.00 0.00 0.00 36.38 31.82 2by9 s VAL 76 CO -0.01 -0.53 0.53 -0.62 0.00 0.00 0.00 175.10 174.47 2by9 n GLU 77 N 6.79 2.30 0.00 2.72 1.02 -1.26 -5.02 120.64 127.18 2by9 n GLU 77 Ca 0.07 -0.02 0.00 0.00 -0.02 0.00 0.00 57.16 57.20 2by9 n GLU 77 Cb 0.48 -1.16 0.00 0.00 -0.02 0.00 0.00 31.44 30.74 2by9 n GLU 77 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2by9 n GLY 78 N 1.37 1.40 0.20 0.62 0.00 -1.26 -4.98 105.19 102.54 2by9 n GLY 78 Ca 0.02 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.06 2by9 n GLY 78 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2by9 n ASN 79 N 0.00 2.16 -4.78 1.61 3.02 -1.26 -5.06 115.26 110.95 2by9 n ASN 79 Ca 0.00 -1.87 -0.36 0.00 -0.03 0.00 0.00 54.58 52.32 2by9 n ASN 79 Cb 0.00 -0.07 -0.01 0.00 -0.61 0.00 0.00 39.78 39.09 2by9 n ASN 79 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 2by9 s GLU 80 N -0.90 3.73 -0.11 3.52 8.01 -1.25 -4.28 118.70 127.43 2by9 s GLU 80 Ca 0.07 1.66 0.01 0.00 0.01 0.00 0.00 54.97 56.72 2by9 s GLU 80 Cb 0.04 -2.31 0.02 0.00 -4.31 0.00 0.00 34.13 27.57 2by9 s GLU 80 CO 0.05 -0.55 -0.11 -0.65 0.01 0.00 0.00 175.26 174.01 2by9 s GLN 81 N -2.85 1.85 -0.26 1.61 -0.21 0.34 -4.96 119.66 115.19 2by9 s GLN 81 Ca 0.65 -0.40 -0.07 0.00 0.02 0.00 0.00 55.36 55.56 2by9 s GLN 81 Cb -0.25 -1.72 -0.02 0.00 1.00 0.00 0.00 33.01 32.01 2by9 s GLN 81 CO 0.31 -0.17 0.06 -0.06 -2.12 0.00 0.00 175.29 173.31 2by9 s PHE 82 N 1.34 3.08 -0.06 0.91 0.08 -1.26 -0.52 117.98 121.55 2by9 s PHE 82 Ca -0.01 -0.55 -0.01 0.00 0.12 0.00 0.00 56.93 56.48 2by9 s PHE 82 Cb -0.14 -2.23 0.03 0.00 -0.57 0.00 0.00 43.02 40.11 2by9 s PHE 82 CO -0.05 -0.41 0.00 0.42 -0.10 0.00 0.00 175.22 175.07 2by9 s ILE 83 N 1.59 0.34 0.54 0.64 1.01 -0.10 -4.99 121.20 120.24 2by9 s ILE 83 Ca 0.06 0.11 -0.21 0.00 0.00 0.00 0.00 60.65 60.61 2by9 s ILE 83 Cb -0.15 -0.49 -0.05 0.00 0.01 0.00 0.00 42.46 41.78 2by9 s ILE 83 CO 0.03 0.24 1.22 -0.44 0.00 0.00 0.00 174.94 175.99 2by9 s SER 84 N 1.78 5.51 0.26 3.58 0.01 -1.26 -0.61 113.70 122.97 2by9 s SER 84 Ca 0.02 2.43 -0.30 0.00 1.31 0.00 0.00 55.95 59.41 2by9 s SER 84 Cb -0.13 -2.61 -0.09 0.00 0.21 0.00 0.00 66.02 63.41 2by9 s SER 84 CO -0.04 -1.38 1.09 0.00 0.41 0.00 0.00 173.24 173.32 2by9 s ALA 85 N -1.53 3.40 -0.17 1.44 0.00 -0.29 -0.88 121.76 123.73 2by9 s ALA 85 Ca 0.72 0.87 0.22 0.00 0.00 0.00 0.00 51.96 53.76 2by9 s ALA 85 Cb -0.32 -3.32 -0.11 0.00 0.00 0.00 0.00 23.12 19.37 2by9 s ALA 85 CO 0.36 -0.14 0.84 -1.13 0.00 0.00 0.00 175.76 175.70 2by9 n SER 86 N 1.38 0.59 -3.53 0.00 3.41 0.22 -4.74 113.62 110.96 2by9 n SER 86 Ca -0.01 0.23 -0.15 0.00 -0.26 0.00 0.00 58.87 58.69 2by9 n SER 86 Cb 0.45 0.88 -0.05 0.00 -0.26 0.00 0.00 64.21 65.23 2by9 n SER 86 CO 0.00 0.00 0.00 -0.75 -0.16 0.00 0.00 175.04 174.13 2by9 s LYS 87 N -3.36 0.93 0.08 4.33 2.20 -1.23 -5.01 119.74 117.68 2by9 s LYS 87 Ca -0.03 0.12 0.01 0.00 -0.36 0.00 0.00 55.97 55.72 2by9 s LYS 87 Cb 0.11 0.44 -0.04 0.00 -1.51 0.00 0.00 37.83 36.83 2by9 s LYS 87 CO 0.83 -0.31 -0.06 -1.54 -0.36 0.00 0.00 175.35 173.90 2by9 s SER 88 N -1.40 0.98 -0.25 1.43 1.04 -1.26 -1.39 113.70 112.85 2by9 s SER 88 Ca -0.06 -0.89 -0.04 0.00 0.48 0.00 0.00 55.95 55.44 2by9 s SER 88 Cb -0.00 0.09 0.09 0.00 0.10 0.00 0.00 66.02 66.30 2by9 s SER 88 CO 0.04 -0.42 0.14 -0.63 0.98 0.00 0.00 173.24 173.36 2by9 s ILE 89 N -3.10 -0.12 0.35 -1.02 1.01 0.69 -4.99 121.20 114.02 2by9 s ILE 89 Ca 0.06 -0.53 -0.26 0.00 0.00 0.00 0.00 60.65 59.91 2by9 s ILE 89 Cb 0.02 -0.85 -0.09 0.00 0.01 0.00 0.00 42.46 41.55 2by9 s ILE 89 CO -0.04 -0.55 1.10 -0.69 0.00 0.00 0.00 174.94 174.76 2by9 s VAL 90 N 2.15 3.48 0.31 2.92 1.01 -1.26 -0.92 120.40 128.09 2by9 s VAL 90 Ca 0.07 1.29 -0.28 0.00 0.00 0.00 0.00 61.98 63.06 2by9 s VAL 90 Cb -0.16 -3.75 -0.13 0.00 0.00 0.00 0.00 36.38 32.34 2by9 s VAL 90 CO -0.28 0.16 1.13 1.57 0.00 0.00 0.00 175.10 177.69 2by9 n HIS 91 N 0.45 1.70 0.13 5.22 -0.00 -0.57 -4.83 115.22 117.31 2by9 n HIS 91 Ca 0.02 0.64 0.14 0.00 0.46 0.00 0.00 57.72 58.99 2by9 n HIS 91 Cb 0.47 -2.32 0.68 0.00 -0.12 0.00 0.00 29.99 28.69 2by9 n HIS 91 CO 0.00 0.00 0.00 -1.00 0.46 0.00 0.00 176.34 175.80 2by9 h PRO 92 N 2.26 0.00 -0.35 1.57 0.13 -1.93 -2.10 132.00 131.58 2by9 h PRO 92 Ca -0.42 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.71 2by9 h PRO 92 Cb 1.32 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.45 2by9 h PRO 92 CO 0.62 0.00 0.00 0.43 -0.23 0.00 0.00 178.00 178.82 2by9 n SER 93 N -4.42 3.91 -4.72 1.44 7.64 -1.26 -5.01 113.62 111.20 2by9 n SER 93 Ca 0.03 -2.71 -0.43 0.00 1.01 0.00 0.00 58.87 56.78 2by9 n SER 93 Cb 0.35 -0.48 -0.02 0.00 -1.01 0.00 0.00 64.21 63.04 2by9 n SER 93 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2by9 n TYR 94 N 0.00 2.66 -4.05 1.43 9.36 -0.79 -4.67 117.16 121.09 2by9 n TYR 94 Ca 0.20 0.21 -0.33 0.00 3.32 0.00 0.00 57.90 61.31 2by9 n TYR 94 Cb 0.81 -2.60 -0.15 0.00 -0.63 0.00 0.00 39.34 36.77 2by9 n TYR 94 CO 0.00 0.00 0.00 1.21 0.22 0.00 0.00 176.86 178.29 2by9 s ASN 95 N 0.72 4.03 0.29 2.98 3.84 -0.71 -5.00 114.94 121.09 2by9 s ASN 95 Ca 0.70 -1.05 0.26 0.00 0.21 0.00 0.00 52.86 52.98 2by9 s ASN 95 Cb -0.54 -1.56 0.90 0.00 -0.55 0.00 0.00 41.25 39.50 2by9 s ASN 95 CO 0.42 -0.12 1.76 0.77 -2.79 0.00 0.00 177.10 177.14 2by9 h SER 96 N 7.89 0.00 0.03 -4.21 4.64 -1.93 0.21 113.55 120.17 2by9 h SER 96 Ca -0.30 0.00 -0.14 0.00 -0.47 0.00 0.00 61.79 60.88 2by9 h SER 96 Cb 1.09 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 63.19 2by9 h SER 96 CO 0.54 0.00 -0.55 0.78 -0.87 0.00 0.00 176.83 176.74 2by9 h ASN 97 N 0.00 0.44 0.45 4.97 2.35 -1.97 -3.36 115.58 118.45 2by9 h ASN 97 Ca 0.00 -0.81 0.00 0.00 -0.55 0.00 0.00 56.30 54.94 2by9 h ASN 97 Cb 0.59 -0.14 0.00 0.00 0.05 0.00 0.00 38.32 38.82 2by9 h ASN 97 CO 0.00 1.19 -1.22 0.35 -1.65 0.00 0.00 177.43 176.10 2by9 n THR 98 N -4.27 0.22 -1.52 2.81 -2.24 -1.18 -4.96 114.28 103.14 2by9 n THR 98 Ca -0.11 -0.35 -0.17 0.00 -2.27 0.00 0.00 64.05 61.14 2by9 n THR 98 Cb 0.66 0.08 -0.07 0.00 -2.10 0.00 0.00 70.33 68.89 2by9 n THR 98 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 2by9 n LEU 99 N -2.16 -1.28 -4.74 3.22 4.77 0.73 -4.99 117.00 112.55 2by9 n LEU 99 Ca 0.00 0.43 -0.41 0.00 -0.03 0.00 0.00 56.01 56.00 2by9 n LEU 99 Cb 0.48 -2.48 -0.03 0.00 -2.33 0.00 0.00 43.42 39.07 2by9 n LEU 99 CO 0.41 -0.91 1.05 0.21 -1.33 0.00 0.00 177.39 176.83 2by9 s ASN 100 N -2.81 6.76 -0.84 -1.43 2.47 -1.20 -3.01 114.94 114.88 2by9 s ASN 100 Ca 0.00 2.55 -0.01 0.00 0.42 0.00 0.00 52.86 55.81 2by9 s ASN 100 Cb 0.00 -2.62 0.00 0.00 -1.45 0.00 0.00 41.25 37.18 2by9 s ASN 100 CO 0.00 -0.62 0.71 0.59 -3.72 0.00 0.00 177.10 174.06 2by9 n ASN 101 N 2.46 -2.74 -4.17 -4.21 3.02 -1.26 -1.73 115.26 106.63 2by9 n ASN 101 Ca 0.06 -0.41 -0.43 0.00 -0.03 0.00 0.00 54.58 53.78 2by9 n ASN 101 Cb 0.41 -3.62 0.00 0.00 -0.61 0.00 0.00 39.78 35.97 2by9 n ASN 101 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 2by9 n ASP 102 N -2.23 4.78 -3.77 6.41 2.03 -1.17 -4.24 116.55 118.37 2by9 n ASP 102 Ca -0.15 -2.96 -0.13 0.00 0.52 0.00 0.00 54.79 52.07 2by9 n ASP 102 Cb 0.60 -1.62 -0.11 0.00 -0.72 0.00 0.00 41.12 39.27 2by9 n ASP 102 CO 0.00 0.00 0.00 -0.51 -1.92 0.00 0.00 177.20 174.77 2by9 s ILE 103 N 2.41 0.01 0.12 5.18 2.07 -1.26 -3.84 121.20 125.89 2by9 s ILE 103 Ca 0.46 -0.07 -0.03 0.00 -1.41 0.00 0.00 60.65 59.60 2by9 s ILE 103 Cb 0.06 -0.47 -0.03 0.00 0.13 0.00 0.00 42.46 42.16 2by9 s ILE 103 CO 0.00 -0.04 0.10 0.00 -1.91 0.00 0.00 174.94 173.10 2by9 s MET 104 N -0.03 0.91 0.02 3.50 0.23 -0.29 -1.51 119.30 122.13 2by9 s MET 104 Ca -0.02 -1.30 0.07 0.00 -1.03 0.00 0.00 55.69 53.41 2by9 s MET 104 Cb -0.03 0.27 -0.03 0.00 -1.53 0.00 0.00 34.83 33.52 2by9 s MET 104 CO 0.01 -0.27 -0.20 -0.51 -2.03 0.00 0.00 175.02 172.02 2by9 s LEU 105 N -2.99 2.47 -0.10 0.18 1.43 -0.10 -1.59 118.68 117.98 2by9 s LEU 105 Ca 0.18 -0.43 0.01 0.00 -1.03 0.00 0.00 54.13 52.86 2by9 s LEU 105 Cb 0.06 -1.45 0.02 0.00 0.03 0.00 0.00 46.19 44.85 2by9 s LEU 105 CO -0.02 0.28 -0.11 -0.63 0.23 0.00 0.00 176.35 176.10 2by9 s ILE 106 N -0.83 1.15 -0.10 -0.59 1.01 0.06 -0.22 121.20 121.68 2by9 s ILE 106 Ca 0.13 -0.42 -0.12 0.00 0.00 0.00 0.00 60.65 60.23 2by9 s ILE 106 Cb -0.10 -1.10 -0.05 0.00 0.01 0.00 0.00 42.46 41.22 2by9 s ILE 106 CO 0.03 0.38 0.29 -0.75 0.00 0.00 0.00 174.94 174.89 2by9 s LYS 107 N 1.20 3.95 0.20 2.79 2.20 -0.49 -0.74 119.74 128.85 2by9 s LYS 107 Ca -0.04 0.14 -0.27 0.00 -0.36 0.00 0.00 55.97 55.44 2by9 s LYS 107 Cb -0.14 -3.30 -0.08 0.00 -1.51 0.00 0.00 37.83 32.79 2by9 s LYS 107 CO -0.03 0.51 0.83 -0.51 -0.36 0.00 0.00 175.35 175.80 2by9 s LEU 108 N -0.38 4.60 0.52 5.43 1.43 0.10 -0.61 118.68 129.77 2by9 s LEU 108 Ca 0.18 1.74 0.21 0.00 -1.03 0.00 0.00 54.13 55.24 2by9 s LEU 108 Cb -0.14 -3.43 1.40 0.00 0.03 0.00 0.00 46.19 44.05 2by9 s LEU 108 CO 0.07 0.18 2.13 0.11 0.23 0.00 0.00 176.35 179.07 2by9 h LYS 109 N 4.20 0.00 -4.39 1.70 1.57 -1.30 -3.43 116.57 114.91 2by9 h LYS 109 Ca -0.46 0.00 -0.18 0.00 -1.87 0.00 0.00 60.65 58.13 2by9 h LYS 109 Cb 1.20 0.00 -0.17 0.00 0.08 0.00 0.00 32.23 33.35 2by9 h LYS 109 CO 0.67 0.06 -0.70 -1.54 -0.57 0.00 0.00 179.45 177.37 2by9 s SER 110 N -6.64 0.73 0.20 0.86 1.04 -1.26 -5.01 113.70 103.62 2by9 s SER 110 Ca -0.04 -0.88 -0.30 0.00 0.48 0.00 0.00 55.95 55.21 2by9 s SER 110 Cb 0.16 0.13 -0.08 0.00 0.10 0.00 0.00 66.02 66.32 2by9 s SER 110 CO 0.63 -0.46 1.15 0.00 0.98 0.00 0.00 173.24 175.53 2by9 s ALA 111 N -3.17 3.41 0.56 5.32 0.00 -1.26 -4.83 121.76 121.79 2by9 s ALA 111 Ca 0.03 0.90 -0.20 0.00 0.00 0.00 0.00 51.96 52.70 2by9 s ALA 111 Cb 0.02 -3.38 -0.05 0.00 0.00 0.00 0.00 23.12 19.72 2by9 s ALA 111 CO -0.06 -0.29 1.20 0.00 0.00 0.00 0.00 175.76 176.61 2by9 s ALA 112 N -0.31 2.66 -0.42 0.00 0.00 0.71 -4.99 121.76 119.41 2by9 s ALA 112 Ca 0.50 0.98 -0.22 0.00 0.00 0.00 0.00 51.96 53.23 2by9 s ALA 112 Cb -0.31 -3.43 0.02 0.00 0.00 0.00 0.00 23.12 19.40 2by9 s ALA 112 CO 0.37 -1.01 0.71 -1.12 0.00 0.00 0.00 175.76 174.71 2by9 s SER 113 N -1.55 6.40 -0.06 0.00 0.01 -1.26 -4.84 113.70 112.39 2by9 s SER 113 Ca 0.74 -0.10 -0.16 0.00 1.31 0.00 0.00 55.95 57.74 2by9 s SER 113 Cb -0.29 -2.35 -0.05 0.00 0.21 0.00 0.00 66.02 63.53 2by9 s SER 113 CO 0.33 -0.79 0.41 -0.76 0.41 0.00 0.00 173.24 172.83 2by9 s LEU 114 N 3.01 4.38 0.00 2.44 1.43 -1.26 -4.80 118.68 123.87 2by9 s LEU 114 Ca 0.26 0.84 -0.08 0.00 -1.03 0.00 0.00 54.13 54.12 2by9 s LEU 114 Cb -0.13 -2.58 0.03 0.00 0.03 0.00 0.00 46.19 43.54 2by9 s LEU 114 CO 0.19 0.19 0.41 -0.46 0.23 0.00 0.00 176.35 176.92 2by9 n ASN 115 N 2.68 -1.02 -0.16 2.29 0.23 -0.74 -5.03 115.26 113.51 2by9 n ASN 115 Ca -0.12 -1.66 0.00 0.00 -0.53 0.00 0.00 54.58 52.28 2by9 n ASN 115 Cb 0.52 1.69 0.26 0.00 -2.08 0.00 0.00 39.78 40.17 2by9 n ASN 115 CO 0.00 0.00 0.00 0.77 -0.93 0.00 0.00 177.26 177.10 2by9 h SER 116 N 0.94 0.78 1.30 0.53 4.64 -2.00 -3.03 113.55 116.73 2by9 h SER 116 Ca -0.15 -0.04 0.00 0.00 -0.47 0.00 0.00 61.79 61.13 2by9 h SER 116 Cb 0.58 -0.20 0.00 0.00 -0.31 0.00 0.00 62.40 62.48 2by9 h SER 116 CO 0.19 0.60 -0.70 0.03 -0.87 0.00 0.00 176.83 176.09 2by9 h ARG 117 N 0.90 0.00 -4.09 4.77 3.08 -1.93 -3.42 114.38 113.69 2by9 h ARG 117 Ca 0.24 0.00 -0.56 0.00 0.07 0.00 0.00 59.98 59.73 2by9 h ARG 117 Cb -0.03 0.00 -0.38 0.00 0.08 0.00 0.00 29.97 29.64 2by9 h ARG 117 CO -0.04 0.00 -0.79 0.08 -1.07 0.00 0.00 179.97 178.15 2by9 s VAL 118 N -3.32 1.08 -0.01 2.04 1.01 -1.14 -4.50 120.40 115.56 2by9 s VAL 118 Ca 0.02 -0.71 -0.14 0.00 0.00 0.00 0.00 61.98 61.14 2by9 s VAL 118 Cb 0.08 -1.33 0.02 0.00 0.00 0.00 0.00 36.38 35.16 2by9 s VAL 118 CO 0.75 0.04 0.30 0.00 0.00 0.00 0.00 175.10 176.18 2by9 s ALA 119 N 1.63 -0.74 0.64 5.51 0.00 -0.92 -1.78 121.76 126.10 2by9 s ALA 119 Ca -0.01 0.26 -0.12 0.00 0.00 0.00 0.00 51.96 52.09 2by9 s ALA 119 Cb -0.16 0.10 -0.02 0.00 0.00 0.00 0.00 23.12 23.04 2by9 s ALA 119 CO -0.07 -0.27 1.04 -1.54 0.00 0.00 0.00 175.76 174.92 2by9 s SER 120 N -1.40 5.83 -0.08 0.00 1.04 -1.26 -2.82 113.70 115.01 2by9 s SER 120 Ca -0.13 1.56 -0.00 0.00 0.48 0.00 0.00 55.95 57.86 2by9 s SER 120 Cb -0.05 -2.49 -0.03 0.00 0.10 0.00 0.00 66.02 63.55 2by9 s SER 120 CO 0.03 -1.14 -0.04 -0.51 0.98 0.00 0.00 173.24 172.57 2by9 s ILE 121 N -3.00 3.94 0.42 -1.02 1.10 0.02 -4.85 121.20 117.80 2by9 s ILE 121 Ca 0.58 -0.38 -0.25 0.00 -0.51 0.00 0.00 60.65 60.08 2by9 s ILE 121 Cb -0.13 -2.64 -0.08 0.00 0.15 0.00 0.00 42.46 39.76 2by9 s ILE 121 CO 0.51 0.59 1.25 -0.44 -2.11 0.00 0.00 174.94 174.74 2by9 s SER 122 N -0.76 6.30 0.51 4.50 0.01 -1.26 -4.59 113.70 118.42 2by9 s SER 122 Ca 0.12 2.53 -0.18 0.00 1.31 0.00 0.00 55.95 59.73 2by9 s SER 122 Cb -0.11 -2.63 -0.08 0.00 0.21 0.00 0.00 66.02 63.41 2by9 s SER 122 CO 0.02 -0.85 1.00 -0.76 0.41 0.00 0.00 173.24 173.06 2by9 s LEU 123 N -2.57 3.68 0.53 2.44 1.43 -1.26 -0.94 118.68 121.99 2by9 s LEU 123 Ca 0.58 1.70 -0.20 0.00 -1.03 0.00 0.00 54.13 55.19 2by9 s LEU 123 Cb -0.35 -4.53 -0.06 0.00 0.03 0.00 0.00 46.19 41.28 2by9 s LEU 123 CO 0.44 -0.70 1.11 -2.16 0.23 0.00 0.00 176.35 175.27 2by9 s PRO 124 N -3.79 3.46 -0.03 1.29 0.04 -1.26 -4.77 135.00 129.94 2by9 s PRO 124 Ca 0.62 1.55 0.21 0.00 0.04 0.00 0.00 61.00 63.42 2by9 s PRO 124 Cb -0.12 -2.03 -0.32 0.00 0.04 0.00 0.00 34.50 32.07 2by9 s PRO 124 CO 0.28 -0.75 0.47 0.25 0.04 0.00 0.00 177.00 177.29 2by9 n THR 125 N -1.22 0.00 -4.10 1.26 -2.24 -1.26 -4.96 114.28 101.76 2by9 n THR 125 Ca 0.11 -0.46 -0.12 0.00 -2.27 0.00 0.00 64.05 61.31 2by9 n THR 125 Cb 0.51 0.06 -0.11 0.00 -2.10 0.00 0.00 70.33 68.69 2by9 n THR 125 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 2by9 s SER 127 N -4.35 0.92 0.56 3.42 1.04 -1.26 -5.15 113.70 108.88 2by9 s SER 127 Ca -0.07 -0.71 -0.19 0.00 0.48 0.00 0.00 55.95 55.46 2by9 s SER 127 Cb 0.13 0.06 -0.05 0.00 0.10 0.00 0.00 66.02 66.27 2by9 s SER 127 CO 0.87 -0.30 1.13 0.00 0.98 0.00 0.00 173.24 175.91 2by9 s ALA 129 N -1.87 3.33 0.14 0.00 0.00 -1.26 -5.09 121.76 117.00 2by9 s ALA 129 Ca 0.72 -0.27 0.03 0.00 0.00 0.00 0.00 51.96 52.44 2by9 s ALA 129 Cb -0.23 -2.73 -0.04 0.00 0.00 0.00 0.00 23.12 20.12 2by9 s ALA 129 CO 0.29 -0.20 0.20 -1.12 0.00 0.00 0.00 175.76 174.93 2by9 s SER 130 N -3.57 5.93 0.35 0.00 0.01 -1.26 -5.06 113.70 110.10 2by9 s SER 130 Ca 0.51 0.04 -0.27 0.00 1.31 0.00 0.00 55.95 57.54 2by9 s SER 130 Cb -0.10 -1.68 -0.12 0.00 0.21 0.00 0.00 66.02 64.32 2by9 s SER 130 CO 0.38 0.08 1.11 0.00 0.41 0.00 0.00 173.24 175.22 2by9 n ALA 132 N -0.31 0.44 0.00 1.44 0.00 -1.26 -1.55 120.51 119.28 2by9 n ALA 132 Ca -0.07 0.33 0.00 0.00 0.00 0.00 0.00 53.44 53.70 2by9 n ALA 132 Cb 0.54 -2.12 0.00 0.00 0.00 0.00 0.00 19.45 17.87 2by9 n ALA 132 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2by9 n GLY 133 N 1.05 2.93 3.71 0.00 0.00 0.42 -4.97 105.19 108.34 2by9 n GLY 133 Ca 0.08 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.68 2by9 n GLY 133 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2by9 s THR 134 N -2.49 2.60 0.03 2.61 2.01 -0.59 -4.69 115.64 115.12 2by9 s THR 134 Ca 0.00 0.36 -0.26 0.00 0.31 0.00 0.00 61.69 62.10 2by9 s THR 134 Cb 0.00 -3.23 -0.05 0.00 0.01 0.00 0.00 72.50 69.23 2by9 s THR 134 CO 0.00 0.02 0.80 -1.58 -0.69 0.00 0.00 174.62 173.17 2by9 s GLN 135 N 1.56 4.52 0.27 4.92 2.00 -1.26 -1.32 119.66 130.35 2by9 s GLN 135 Ca 0.72 1.12 0.06 0.00 -2.00 0.00 0.00 55.36 55.27 2by9 s GLN 135 Cb -0.44 -3.39 -0.06 0.00 0.80 0.00 0.00 33.01 29.92 2by9 s GLN 135 CO 0.32 0.20 -0.05 0.00 -0.50 0.00 0.00 175.29 175.26 2by9 s LEU 137 N -3.42 2.73 -0.06 0.00 2.96 0.79 -1.28 118.68 120.40 2by9 s LEU 137 Ca 0.29 -0.42 0.03 0.00 -0.22 0.00 0.00 54.13 53.81 2by9 s LEU 137 Cb 0.04 -1.67 -0.02 0.00 0.50 0.00 0.00 46.19 45.04 2by9 s LEU 137 CO 0.11 0.02 -0.13 -0.63 -1.32 0.00 0.00 176.35 174.41 2by9 s ILE 138 N 1.20 3.16 0.06 6.68 1.01 0.16 -1.35 121.20 132.12 2by9 s ILE 138 Ca 0.02 -0.68 -0.07 0.00 0.00 0.00 0.00 60.65 59.92 2by9 s ILE 138 Cb -0.14 -2.26 -0.01 0.00 0.01 0.00 0.00 42.46 40.06 2by9 s ILE 138 CO -0.03 0.58 0.15 -0.94 0.00 0.00 0.00 174.94 174.70 2by9 s SER 139 N -0.58 0.15 0.00 3.58 1.04 -1.20 -0.59 113.70 116.09 2by9 s SER 139 Ca 0.08 -0.58 0.00 0.00 0.48 0.00 0.00 55.95 55.93 2by9 s SER 139 Cb -0.11 0.29 0.00 0.00 0.10 0.00 0.00 66.02 66.29 2by9 s SER 139 CO 0.01 -0.62 0.00 0.61 0.98 0.00 0.00 173.24 174.22 2by9 n GLY 140 N 0.33 -0.34 1.43 7.32 0.00 -0.53 -4.34 105.19 109.07 2by9 n GLY 140 Ca -0.17 -1.16 0.04 0.00 0.00 0.00 0.00 46.02 44.73 2by9 n GLY 140 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 2by9 n TRP 141 N -0.66 1.60 -1.68 1.61 8.01 -1.26 -1.80 117.44 123.27 2by9 n TRP 141 Ca 0.00 -0.97 -0.28 0.00 -1.31 0.00 0.00 57.50 54.95 2by9 n TRP 141 Cb 0.00 -0.47 0.20 0.00 -2.01 0.00 0.00 31.31 29.03 2by9 n TRP 141 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 2by9 n GLY 142 N -0.17 -1.76 3.70 6.99 0.00 -1.24 -4.38 105.19 108.31 2by9 n GLY 142 Ca 0.28 -1.66 -0.43 0.00 0.00 0.00 0.00 46.02 44.22 2by9 n GLY 142 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2by9 n ASN 143 N -4.01 2.75 -0.97 1.61 2.85 0.11 -2.88 115.26 114.73 2by9 n ASN 143 Ca 0.15 1.20 0.11 0.00 -0.11 0.00 0.00 54.58 55.93 2by9 n ASN 143 Cb 0.54 -1.48 0.16 0.00 1.24 0.00 0.00 39.78 40.24 2by9 n ASN 143 CO 0.00 0.00 0.00 0.35 -2.11 0.00 0.00 177.26 175.50 2by9 n THR 144 N 0.45 0.34 -4.88 -0.44 -2.24 -0.38 -0.89 114.28 106.24 2by9 n THR 144 Ca 0.05 -0.67 -0.31 0.00 -2.27 0.00 0.00 64.05 60.85 2by9 n THR 144 Cb 0.36 1.12 -0.14 0.00 -2.10 0.00 0.00 70.33 69.57 2by9 n THR 144 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 2by9 s LYS 145 N -1.50 2.00 0.21 -0.78 1.02 -1.26 -4.37 119.74 115.07 2by9 s LYS 145 Ca 0.31 -1.00 0.23 0.00 0.02 0.00 0.00 55.97 55.53 2by9 s LYS 145 Cb 0.19 -2.10 0.14 0.00 -0.52 0.00 0.00 37.83 35.55 2by9 s LYS 145 CO 0.27 0.54 1.20 0.66 -0.92 0.00 0.00 175.35 177.10 2by9 h SER 146 N 4.86 0.00 -3.30 2.83 4.64 -1.93 -3.43 113.55 117.22 2by9 h SER 146 Ca -0.46 -0.06 -0.50 0.00 -0.47 0.00 0.00 61.79 60.30 2by9 h SER 146 Cb 1.14 0.00 -0.35 0.00 -0.31 0.00 0.00 62.40 62.88 2by9 h SER 146 CO 0.46 0.03 -0.80 -0.44 -0.87 0.00 0.00 176.83 175.21 2by9 s SER 147 N -5.16 1.87 0.04 4.97 0.01 -1.26 -4.64 113.70 109.52 2by9 s SER 147 Ca 0.02 -0.27 0.00 0.00 1.31 0.00 0.00 55.95 57.02 2by9 s SER 147 Cb 0.10 -0.77 0.00 0.00 0.21 0.00 0.00 66.02 65.56 2by9 s SER 147 CO 0.75 -0.06 0.00 0.61 0.41 0.00 0.00 173.24 174.95 2by9 n GLY 148 N 4.47 -1.75 3.06 3.44 0.00 -1.26 -4.97 105.19 108.18 2by9 n GLY 148 Ca -0.17 -1.36 -0.13 0.00 0.00 0.00 0.00 46.02 44.37 2by9 n GLY 148 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2by9 s THR 149 N 0.00 -0.15 -0.18 2.61 2.01 -1.26 -4.62 115.64 114.05 2by9 s THR 149 Ca 0.00 0.18 -0.07 0.00 0.31 0.00 0.00 61.69 62.12 2by9 s THR 149 Cb 0.00 -0.42 0.08 0.00 0.01 0.00 0.00 72.50 72.17 2by9 s THR 149 CO 0.00 0.08 0.38 -0.55 -0.69 0.00 0.00 174.62 173.83 2by9 s SER 150 N 1.62 -0.13 -0.21 3.53 0.15 -1.26 -4.99 113.70 112.41 2by9 s SER 150 Ca -0.06 0.88 -0.08 0.00 0.70 0.00 0.00 55.95 57.39 2by9 s SER 150 Cb -0.11 1.12 -0.04 0.00 -1.71 0.00 0.00 66.02 65.29 2by9 s SER 150 CO -0.09 -0.23 0.07 -0.31 1.20 0.00 0.00 173.24 173.88 2by9 s TYR 151 N 2.43 3.19 -0.50 3.44 1.51 -1.26 -1.25 117.35 124.91 2by9 s TYR 151 Ca -0.02 -0.08 0.07 0.00 -1.01 0.00 0.00 57.07 56.04 2by9 s TYR 151 Cb -0.12 -2.15 0.47 0.00 -0.11 0.00 0.00 41.96 40.06 2by9 s TYR 151 CO -0.12 -0.03 1.30 -0.35 -1.11 0.00 0.00 175.55 175.24 2by9 n PRO 152 N 4.08 3.05 0.00 -1.71 -0.04 -1.26 -5.00 135.00 134.12 2by9 n PRO 152 Ca -0.16 -1.86 0.00 0.00 -0.04 0.00 0.00 63.50 61.44 2by9 n PRO 152 Cb 0.52 -1.91 0.00 0.00 -0.04 0.00 0.00 33.50 32.07 2by9 n PRO 152 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 2by9 n ASP 153 N 0.22 0.00 -4.96 3.54 8.00 -1.26 -4.85 116.55 117.24 2by9 n ASP 153 Ca 0.20 0.00 -0.22 0.00 0.71 0.00 0.00 54.79 55.48 2by9 n ASP 153 Cb 0.88 0.00 -0.02 0.00 -0.02 0.00 0.00 41.12 41.96 2by9 n ASP 153 CO 0.00 0.00 0.00 0.68 -0.39 0.00 0.00 177.20 177.49 2by9 s VAL 154 N 0.00 5.26 0.22 2.53 -7.23 -1.26 -1.15 120.40 118.76 2by9 s VAL 154 Ca 0.00 -0.88 -0.30 0.00 -1.81 0.00 0.00 61.98 59.00 2by9 s VAL 154 Cb 0.00 -3.84 -0.09 0.00 0.56 0.00 0.00 36.38 33.01 2by9 s VAL 154 CO 0.00 -0.31 1.30 -0.22 -0.31 0.00 0.00 175.10 175.56 2by9 s LEU 155 N -3.87 4.42 0.12 1.32 2.96 -1.24 -4.81 118.68 117.59 2by9 s LEU 155 Ca 0.35 2.42 0.05 0.00 -0.22 0.00 0.00 54.13 56.74 2by9 s LEU 155 Cb -0.09 -3.62 -0.04 0.00 0.50 0.00 0.00 46.19 42.94 2by9 s LEU 155 CO 0.30 -0.51 0.02 -0.54 -1.32 0.00 0.00 176.35 174.30 2by9 s LYS 156 N -0.37 2.57 0.07 1.98 -0.14 -0.74 -1.94 119.74 121.17 2by9 s LYS 156 Ca 0.55 -0.91 0.05 0.00 -1.36 0.00 0.00 55.97 54.30 2by9 s LYS 156 Cb -0.37 -2.52 -0.03 0.00 -1.68 0.00 0.00 37.83 33.24 2by9 s LYS 156 CO 0.40 0.51 -0.13 0.00 -0.76 0.00 0.00 175.35 175.37 2by9 s LEU 158 N -1.82 0.40 -0.12 0.00 2.96 0.24 -0.61 118.68 119.72 2by9 s LEU 158 Ca -0.02 0.45 -0.18 0.00 -0.22 0.00 0.00 54.13 54.16 2by9 s LEU 158 Cb -0.09 0.59 -0.04 0.00 0.50 0.00 0.00 46.19 47.14 2by9 s LEU 158 CO 0.02 -0.17 0.49 -0.54 -1.32 0.00 0.00 176.35 174.83 2by9 s LYS 159 N 1.43 4.33 -0.03 1.98 1.02 -1.26 -0.66 119.74 126.55 2by9 s LYS 159 Ca -0.07 0.47 -0.18 0.00 0.02 0.00 0.00 55.97 56.20 2by9 s LYS 159 Cb -0.11 -3.45 0.03 0.00 -0.52 0.00 0.00 37.83 33.78 2by9 s LYS 159 CO -0.08 0.12 0.38 0.00 -0.92 0.00 0.00 175.35 174.86 2by9 s ALA 160 N 0.74 -0.98 0.25 5.17 0.00 -0.41 -4.96 121.76 121.57 2by9 s ALA 160 Ca 0.26 0.55 -0.09 0.00 0.00 0.00 0.00 51.96 52.68 2by9 s ALA 160 Cb -0.15 0.03 -0.07 0.00 0.00 0.00 0.00 23.12 22.93 2by9 s ALA 160 CO 0.11 -0.28 0.57 -1.25 0.00 0.00 0.00 175.76 174.91 2by9 s PRO 161 N -1.23 3.79 0.23 0.00 0.04 -1.26 -0.64 135.00 135.92 2by9 s PRO 161 Ca -0.12 0.27 -0.30 0.00 0.04 0.00 0.00 61.00 60.88 2by9 s PRO 161 Cb -0.04 -2.62 -0.09 0.00 0.04 0.00 0.00 34.50 31.78 2by9 s PRO 161 CO 0.05 0.28 1.33 0.42 0.04 0.00 0.00 177.00 179.12 2by9 s ILE 162 N -1.89 3.04 0.26 0.56 1.01 -0.43 -1.28 121.20 122.46 2by9 s ILE 162 Ca 0.47 0.88 -0.01 0.00 0.00 0.00 0.00 60.65 61.99 2by9 s ILE 162 Cb -0.11 -3.56 -0.04 0.00 0.01 0.00 0.00 42.46 38.76 2by9 s ILE 162 CO 0.23 0.15 0.47 -0.76 0.00 0.00 0.00 174.94 175.02 2by9 s LEU 163 N -0.41 4.13 0.60 2.97 1.43 0.04 -0.43 118.68 127.01 2by9 s LEU 163 Ca 0.56 0.47 -0.20 0.00 -1.03 0.00 0.00 54.13 53.93 2by9 s LEU 163 Cb -0.38 -3.28 -0.03 0.00 0.03 0.00 0.00 46.19 42.53 2by9 s LEU 163 CO 0.41 -0.15 1.30 -1.54 0.23 0.00 0.00 176.35 176.61 2by9 n SER 164 N -1.06 2.28 -0.30 2.29 3.41 -1.26 -4.58 113.62 114.40 2by9 n SER 164 Ca -0.04 0.90 0.05 0.00 -0.26 0.00 0.00 58.87 59.52 2by9 n SER 164 Cb 0.55 -1.56 0.20 0.00 -0.26 0.00 0.00 64.21 63.14 2by9 n SER 164 CO 0.00 0.00 0.00 -0.78 -0.16 0.00 0.00 175.04 174.10 2by9 h ASP 165 N 0.96 0.63 -0.72 4.04 3.58 -1.97 -0.73 116.42 122.20 2by9 h ASP 165 Ca -0.51 0.07 -0.07 0.00 0.42 0.00 0.00 57.03 56.94 2by9 h ASP 165 Cb 1.32 -0.05 -0.03 0.00 1.72 0.00 0.00 39.33 42.30 2by9 h ASP 165 CO 0.55 0.32 0.19 0.77 -2.88 0.00 0.00 179.24 178.19 2by9 h SER 166 N 0.73 1.08 -0.00 2.28 4.64 -1.99 -0.57 113.55 119.72 2by9 h SER 166 Ca 0.43 -0.23 -0.12 0.00 -0.47 0.00 0.00 61.79 61.41 2by9 h SER 166 Cb 0.50 -0.28 -0.01 0.00 -0.31 0.00 0.00 62.40 62.29 2by9 h SER 166 CO -0.30 1.02 -0.37 0.77 -0.87 0.00 0.00 176.83 177.09 2by9 h SER 167 N 1.09 0.52 -0.10 4.97 4.64 -1.80 -0.57 113.55 122.30 2by9 h SER 167 Ca 0.23 -0.21 -0.01 0.00 -0.47 0.00 0.00 61.79 61.33 2by9 h SER 167 Cb 0.36 -0.14 -0.00 0.00 -0.31 0.00 0.00 62.40 62.30 2by9 h SER 167 CO -0.00 0.84 0.03 0.00 -0.87 0.00 0.00 176.83 176.83 2by9 h LYS 169 N -0.02 0.80 -0.37 0.00 1.57 -1.03 -1.95 116.57 115.57 2by9 h LYS 169 Ca 0.03 -0.18 -0.08 0.00 -1.87 0.00 0.00 60.65 58.55 2by9 h LYS 169 Cb 0.22 -0.11 -0.02 0.00 0.08 0.00 0.00 32.23 32.40 2by9 h LYS 169 CO -0.00 0.76 -0.09 0.77 -0.57 0.00 0.00 179.45 180.32 2by9 h SER 170 N 0.76 0.61 -0.12 0.86 0.02 -0.96 -2.51 113.55 112.21 2by9 h SER 170 Ca 0.16 -0.16 -0.11 0.00 -0.84 0.00 0.00 61.79 60.84 2by9 h SER 170 Cb 0.36 -0.16 -0.01 0.00 0.14 0.00 0.00 62.40 62.73 2by9 h SER 170 CO 0.01 0.74 -0.26 0.00 -1.14 0.00 0.00 176.83 176.18 2by9 h ALA 171 N 1.33 1.00 -2.15 3.77 0.00 -0.78 -3.37 119.26 119.05 2by9 h ALA 171 Ca 0.11 -0.37 -0.58 0.00 0.00 0.00 0.00 54.91 54.07 2by9 h ALA 171 Cb 0.50 -0.13 -0.40 0.00 0.00 0.00 0.00 17.79 17.76 2by9 h ALA 171 CO 0.03 0.59 -0.88 0.66 0.00 0.00 0.00 179.25 179.65 2by9 n TYR 172 N -4.11 1.25 -1.66 0.00 4.01 -0.78 -4.90 117.16 110.97 2by9 n TYR 172 Ca -0.00 -3.80 -0.45 0.00 -0.16 0.00 0.00 57.90 53.48 2by9 n TYR 172 Cb 0.43 -0.40 -0.03 0.00 -0.31 0.00 0.00 39.34 39.03 2by9 n TYR 172 CO 0.00 0.00 0.00 -2.30 -0.46 0.00 0.00 176.86 174.10 2by9 n PRO 173 N 1.34 1.96 -0.97 -0.72 -0.02 -0.96 -2.21 135.00 133.41 2by9 n PRO 173 Ca 0.25 0.70 0.00 0.00 -2.02 0.00 0.00 63.50 62.43 2by9 n PRO 173 Cb 0.47 -2.36 0.00 0.00 -0.02 0.00 0.00 33.50 31.60 2by9 n PRO 173 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2by9 n GLY 174 N 2.31 0.58 0.00 -1.23 0.00 -1.26 -4.84 105.19 100.75 2by9 n GLY 174 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.15 2by9 n GLY 174 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2by9 n GLN 175 N -2.27 2.24 -3.44 1.61 6.02 -0.94 -5.01 117.38 115.59 2by9 n GLN 175 Ca 0.00 0.00 -0.40 0.00 -0.01 0.00 0.00 57.00 56.59 2by9 n GLN 175 Cb 0.05 -0.78 -0.10 0.00 1.02 0.00 0.00 30.24 30.42 2by9 n GLN 175 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 2by9 s ILE 176 N -1.43 5.20 0.62 5.09 -1.09 -1.25 -5.02 121.20 123.32 2by9 s ILE 176 Ca 0.00 0.18 0.02 0.00 -2.23 0.00 0.00 60.65 58.62 2by9 s ILE 176 Cb 0.00 -3.73 0.08 0.00 -1.58 0.00 0.00 42.46 37.23 2by9 s ILE 176 CO 0.00 0.04 0.86 0.42 -1.23 0.00 0.00 174.94 175.03 2by9 s THR 177 N 1.97 2.37 -1.34 2.92 -4.23 -1.26 -4.98 115.64 111.09 2by9 s THR 177 Ca 0.11 -0.70 0.10 0.00 -1.18 0.00 0.00 61.69 60.02 2by9 s THR 177 Cb -0.16 -2.67 0.16 0.00 1.34 0.00 0.00 72.50 71.16 2by9 s THR 177 CO 0.11 0.00 1.23 -1.54 -0.54 0.00 0.00 174.62 173.88 2by9 n SER 178 N -2.52 0.00 -1.47 3.99 3.41 -1.26 -2.09 113.62 113.68 2by9 n SER 178 Ca 0.12 0.22 0.08 0.00 -0.26 0.00 0.00 58.87 59.03 2by9 n SER 178 Cb 0.60 -0.33 0.34 0.00 -0.26 0.00 0.00 64.21 64.56 2by9 n SER 178 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 2by9 n ASN 179 N -1.33 4.78 -4.09 4.04 3.02 -1.26 -4.92 115.26 115.49 2by9 n ASN 179 Ca 0.04 -2.69 -0.14 0.00 -0.03 0.00 0.00 54.58 51.76 2by9 n ASN 179 Cb 0.09 -0.58 -0.11 0.00 -0.61 0.00 0.00 39.78 38.56 2by9 n ASN 179 CO 0.00 0.00 0.00 -0.04 -2.62 0.00 0.00 177.26 174.60 2by9 s MET 180 N -2.29 0.61 0.04 3.52 -1.94 -0.89 -1.07 119.30 117.28 2by9 s MET 180 Ca 0.48 -0.85 -0.02 0.00 -1.71 0.00 0.00 55.69 53.60 2by9 s MET 180 Cb 0.35 -0.37 -0.03 0.00 2.01 0.00 0.00 34.83 36.79 2by9 s MET 180 CO 0.18 0.06 -0.01 -0.59 -0.01 0.00 0.00 175.02 174.66 2by9 s PHE 181 N -1.60 0.42 0.04 -0.03 -0.12 -0.36 -4.78 117.98 111.54 2by9 s PHE 181 Ca -0.06 -0.88 -0.04 0.00 -0.05 0.00 0.00 56.93 55.90 2by9 s PHE 181 Cb -0.08 -0.31 -0.05 0.00 -0.63 0.00 0.00 43.02 41.95 2by9 s PHE 181 CO 0.00 -0.35 0.25 0.00 -0.05 0.00 0.00 175.22 175.07 2by9 s ALA 183 N -1.41 -0.38 0.00 0.00 0.00 -0.65 -0.78 121.76 118.54 2by9 s ALA 183 Ca 0.31 -0.18 0.00 0.00 0.00 0.00 0.00 51.96 52.10 2by9 s ALA 183 Cb -0.13 0.20 0.00 0.00 0.00 0.00 0.00 23.12 23.19 2by9 s ALA 183 CO 0.21 -0.30 0.00 0.41 0.00 0.00 0.00 175.76 176.08 2by9 n GLY 183 N 1.01 0.19 2.71 0.00 0.00 -0.41 -2.70 105.19 106.00 2by9 n GLY 183 Ca -0.20 -1.68 -0.21 0.00 0.00 0.00 0.00 46.02 43.93 2by9 n GLY 183 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2by9 s TYR 184 N -1.36 -0.02 0.47 1.61 2.02 -1.26 -4.32 117.35 114.49 2by9 s TYR 184 Ca 0.00 0.19 0.33 0.00 -0.37 0.00 0.00 57.07 57.22 2by9 s TYR 184 Cb 0.00 -0.46 1.76 0.00 -0.40 0.00 0.00 41.96 42.86 2by9 s TYR 184 CO 0.00 -0.37 2.17 -0.07 -1.57 0.00 0.00 175.55 175.71 2by9 h LEU 185 N 8.39 0.00 0.46 -1.29 3.38 -1.95 -3.44 115.31 120.87 2by9 h LEU 185 Ca -0.14 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.81 2by9 h LEU 185 Cb 1.13 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.89 2by9 h LEU 185 CO 0.21 0.05 -0.22 1.05 0.09 0.00 0.00 178.44 179.62 2by9 h GLU 186 N 0.00 -0.59 0.00 1.13 9.09 -1.96 0.20 114.58 122.45 2by9 h GLU 186 Ca -0.00 0.04 0.00 0.00 0.05 0.00 0.00 59.36 59.45 2by9 h GLU 186 Cb 0.22 0.13 0.00 0.00 -1.65 0.00 0.00 28.75 27.45 2by9 h GLU 186 CO 0.01 -0.40 0.00 0.41 0.05 0.00 0.00 179.01 179.08 2by9 n GLY 187 N 0.13 2.44 2.73 1.06 0.00 -0.05 -4.47 105.19 107.03 2by9 n GLY 187 Ca -0.08 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.72 2by9 n GLY 187 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2by9 s LYS 188 N -0.33 0.35 -0.01 1.61 1.02 -1.26 -3.64 119.74 117.50 2by9 s LYS 188 Ca 0.00 0.18 -0.30 0.00 0.02 0.00 0.00 55.97 55.87 2by9 s LYS 188 Cb 0.00 -0.88 0.11 0.00 -0.52 0.00 0.00 37.83 36.54 2by9 s LYS 188 CO 0.00 -0.34 1.16 0.34 -0.92 0.00 0.00 175.35 175.59 2by9 s ASP 189 N 2.04 -0.13 0.91 2.83 2.15 -0.51 -4.30 116.67 119.66 2by9 s ASP 189 Ca 0.05 -0.16 -0.14 0.00 0.43 0.00 0.00 52.55 52.72 2by9 s ASP 189 Cb -0.12 0.26 0.15 0.00 -0.30 0.00 0.00 42.92 42.90 2by9 s ASP 189 CO -0.05 -0.46 1.24 -0.94 -0.17 0.00 0.00 175.17 174.80 2by9 s SER 190 N -2.78 3.62 0.39 -0.34 1.04 -1.26 -0.21 113.70 114.16 2by9 s SER 190 Ca 0.12 0.54 -0.14 0.00 0.48 0.00 0.00 55.95 56.95 2by9 s SER 190 Cb 0.02 -0.81 0.06 0.00 0.10 0.00 0.00 66.02 65.38 2by9 s SER 190 CO -0.03 -2.44 0.76 0.00 0.98 0.00 0.00 173.24 172.51 2by9 n GLN 192 N -0.53 0.98 0.00 0.00 3.00 -1.26 -0.90 117.38 118.68 2by9 n GLN 192 Ca -0.08 0.35 0.00 0.00 -0.01 0.00 0.00 57.00 57.26 2by9 n GLN 192 Cb 0.58 -1.90 0.00 0.00 0.00 0.00 0.00 30.24 28.92 2by9 n GLN 192 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2by9 n GLY 193 N 2.18 2.22 0.13 1.08 0.00 -1.26 -0.71 105.19 108.82 2by9 n GLY 193 Ca 0.17 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.31 2by9 n GLY 193 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2by9 h ASP 194 N 0.00 0.00 -1.01 1.61 3.32 -1.33 -3.31 116.42 115.70 2by9 h ASP 194 Ca 0.00 -0.05 -0.74 0.00 0.02 0.00 0.00 57.03 56.26 2by9 h ASP 194 Cb 0.00 0.00 0.08 0.00 0.22 0.00 0.00 39.33 39.63 2by9 h ASP 194 CO 0.00 0.03 -0.19 -1.20 -1.72 0.00 0.00 179.24 176.16 2by9 n SER 195 N -2.61 -0.52 0.00 6.45 7.64 -1.25 -1.37 113.62 121.96 2by9 n SER 195 Ca 0.02 1.15 0.00 0.00 1.01 0.00 0.00 58.87 61.05 2by9 n SER 195 Cb 0.50 -0.94 0.00 0.00 -1.01 0.00 0.00 64.21 62.77 2by9 n SER 195 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2by9 n GLY 196 N 1.71 2.57 3.95 0.23 0.00 -0.01 -0.38 105.19 113.26 2by9 n GLY 196 Ca 0.19 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.93 2by9 n GLY 196 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2by9 s GLY 197 N -1.96 1.76 0.37 -0.02 0.00 -0.47 -3.31 107.32 103.68 2by9 s GLY 197 Ca 0.00 -1.31 -0.17 0.00 0.00 0.00 0.00 44.72 43.25 2by9 s GLY 197 CO 0.00 -0.61 0.82 2.56 0.00 0.00 0.00 173.10 175.87 2by9 s PRO 198 N -5.66 4.07 -0.24 2.90 0.04 -1.26 -0.97 135.00 133.88 2by9 s PRO 198 Ca 0.71 0.83 0.02 0.00 0.04 0.00 0.00 61.00 62.60 2by9 s PRO 198 Cb -0.05 -2.33 0.06 0.00 0.04 0.00 0.00 34.50 32.22 2by9 s PRO 198 CO 0.50 0.07 -0.09 0.08 0.04 0.00 0.00 177.00 177.61 2by9 s VAL 199 N -2.09 1.82 -0.12 -0.36 1.01 -0.26 -3.22 120.40 117.18 2by9 s VAL 199 Ca 0.57 -1.37 0.00 0.00 0.00 0.00 0.00 61.98 61.18 2by9 s VAL 199 Cb -0.10 -1.99 -0.01 0.00 0.00 0.00 0.00 36.38 34.27 2by9 s VAL 199 CO 0.17 -0.03 -0.15 -0.69 0.00 0.00 0.00 175.10 174.40 2by9 s VAL 200 N 1.27 2.92 -0.08 2.92 1.01 -0.45 -1.10 120.40 126.88 2by9 s VAL 200 Ca -0.07 -0.71 -0.00 0.00 0.00 0.00 0.00 61.98 61.20 2by9 s VAL 200 Cb -0.19 -2.21 0.02 0.00 0.00 0.00 0.00 36.38 34.00 2by9 s VAL 200 CO -0.06 0.53 -0.05 0.00 0.00 0.00 0.00 175.10 175.53 2by9 n SER 202 N 4.74 -3.71 -0.04 0.00 7.64 -1.26 -1.59 113.62 119.40 2by9 n SER 202 Ca -0.14 -0.90 -0.01 0.00 1.01 0.00 0.00 58.87 58.84 2by9 n SER 202 Cb 0.50 -3.36 -0.00 0.00 -1.01 0.00 0.00 64.21 60.34 2by9 n SER 202 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2by9 n GLY 203 N -1.59 0.48 3.27 0.23 0.00 -1.26 -5.03 105.19 101.30 2by9 n GLY 203 Ca 0.02 -0.32 -0.27 0.00 0.00 0.00 0.00 46.02 45.45 2by9 n GLY 203 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2by9 s LYS 204 N -0.78 1.51 -0.68 1.61 -0.14 -0.62 -4.07 119.74 116.58 2by9 s LYS 204 Ca 0.00 -0.98 -0.27 0.00 -1.36 0.00 0.00 55.97 53.36 2by9 s LYS 204 Cb 0.00 -1.64 0.03 0.00 -1.68 0.00 0.00 37.83 34.55 2by9 s LYS 204 CO 0.00 0.42 1.21 -1.17 -0.76 0.00 0.00 175.35 175.06 2by9 s LEU 209 N -1.16 3.38 -0.05 3.17 2.96 -0.12 -0.96 118.68 125.90 2by9 s LEU 209 Ca 0.09 -0.32 0.20 0.00 -0.22 0.00 0.00 54.13 53.88 2by9 s LEU 209 Cb -0.09 -2.74 -0.31 0.00 0.50 0.00 0.00 46.19 43.54 2by9 s LEU 209 CO 0.02 -1.67 0.40 0.00 -1.32 0.00 0.00 176.35 173.77 2by9 n GLN 210 N 8.88 0.66 -4.03 1.98 1.13 -0.26 -4.16 117.38 121.59 2by9 n GLN 210 Ca 0.04 -0.16 -0.08 0.00 -1.94 0.00 0.00 57.00 54.85 2by9 n GLN 210 Cb 0.49 -1.50 -0.09 0.00 0.11 0.00 0.00 30.24 29.25 2by9 n GLN 210 CO 0.00 0.00 0.00 0.20 -1.44 0.00 0.00 177.06 175.82 2by9 s GLY 211 N -4.55 0.49 -0.07 1.08 0.00 -0.75 -1.71 107.32 101.81 2by9 s GLY 211 Ca -0.08 -1.08 0.03 0.00 0.00 0.00 0.00 44.72 43.59 2by9 s GLY 211 CO 0.86 -1.15 -0.16 -0.42 0.00 0.00 0.00 173.10 172.23 2by9 s ILE 212 N -3.94 1.44 -0.03 0.90 1.01 -1.06 -1.11 121.20 118.42 2by9 s ILE 212 Ca 0.11 -0.67 -0.31 0.00 0.00 0.00 0.00 60.65 59.79 2by9 s ILE 212 Cb 0.07 -1.28 -0.09 0.00 0.01 0.00 0.00 42.46 41.16 2by9 s ILE 212 CO -0.07 0.42 1.98 0.52 0.00 0.00 0.00 174.94 177.80 2by9 n VAL 213 N 3.63 0.68 0.02 2.92 0.31 -0.15 -1.29 118.33 124.45 2by9 n VAL 213 Ca -0.21 -0.16 -0.00 0.00 -0.01 0.00 0.00 64.34 63.95 2by9 n VAL 213 Cb 0.52 -2.21 -0.00 0.00 -0.91 0.00 0.00 33.84 31.24 2by9 n VAL 213 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 2by9 n SER 214 N 7.72 0.64 -3.51 4.52 2.88 -0.98 -0.83 113.62 124.06 2by9 n SER 214 Ca 0.22 0.08 -0.07 0.00 -1.33 0.00 0.00 58.87 57.78 2by9 n SER 214 Cb 0.38 -0.21 -0.00 0.00 -0.75 0.00 0.00 64.21 63.62 2by9 n SER 214 CO 0.00 0.00 0.00 -1.66 -1.23 0.00 0.00 175.04 172.15 2by9 s TRP 215 N -1.58 -0.06 0.00 0.66 1.48 -0.66 -4.93 118.94 113.85 2by9 s TRP 215 Ca -0.01 -0.44 0.00 0.00 -1.06 0.00 0.00 56.10 54.59 2by9 s TRP 215 Cb 0.00 0.74 0.00 0.00 -1.16 0.00 0.00 33.47 33.05 2by9 s TRP 215 CO 0.02 -1.26 0.00 0.41 -4.06 0.00 0.00 176.95 172.06 2by9 n GLY 216 N -0.50 0.62 3.53 3.67 0.00 -1.26 -0.64 105.19 110.61 2by9 n GLY 216 Ca -0.06 -0.81 -0.43 0.00 0.00 0.00 0.00 46.02 44.72 2by9 n GLY 216 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2by9 s SER 217 N 0.00 6.37 0.93 1.61 0.15 -1.26 -4.86 113.70 116.63 2by9 s SER 217 Ca 0.00 -0.21 0.00 0.00 0.70 0.00 0.00 55.95 56.44 2by9 s SER 217 Cb 0.00 -2.35 0.00 0.00 -1.71 0.00 0.00 66.02 61.96 2by9 s SER 217 CO 0.00 -0.84 0.00 0.61 1.20 0.00 0.00 173.24 174.21 2by9 n GLY 219 N 5.00 1.02 2.84 9.45 0.00 -1.26 -4.60 105.19 117.63 2by9 n GLY 219 Ca 0.00 -0.62 -0.15 0.00 0.00 0.00 0.00 46.02 45.26 2by9 n GLY 219 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2by9 n ALA 220 N 3.69 -0.40 -2.13 0.00 0.00 -1.26 -4.60 120.51 115.80 2by9 n ALA 220 Ca -0.21 0.19 -0.34 0.00 0.00 0.00 0.00 53.44 53.08 2by9 n ALA 220 Cb 0.54 -1.83 -0.06 0.00 0.00 0.00 0.00 19.45 18.10 2by9 n ALA 220 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 2by9 s GLN 221 N -4.29 4.12 0.23 0.00 -1.52 -1.26 -0.87 119.66 116.07 2by9 s GLN 221 Ca 0.00 0.75 -0.32 0.00 -1.95 0.00 0.00 55.36 53.84 2by9 s GLN 221 Cb 0.00 -2.66 -0.13 0.00 -0.22 0.00 0.00 33.01 29.99 2by9 s GLN 221 CO 0.00 0.28 1.46 1.17 -0.25 0.00 0.00 175.29 177.95 2by9 n LYS 222 N 0.19 2.13 -1.27 2.91 4.81 -1.26 -2.09 118.16 123.58 2by9 n LYS 222 Ca 0.00 0.76 -0.09 0.00 -0.87 0.00 0.00 58.31 58.11 2by9 n LYS 222 Cb 0.52 -2.45 -0.04 0.00 0.02 0.00 0.00 35.03 33.08 2by9 n LYS 222 CO 0.00 0.00 0.00 0.09 1.17 0.00 0.00 177.40 178.66 2by9 n ASN 223 N 2.40 -4.98 -3.37 3.14 5.03 0.68 -4.91 115.26 113.26 2by9 n ASN 223 Ca 0.12 0.23 -0.26 0.00 0.87 0.00 0.00 54.58 55.55 2by9 n ASN 223 Cb 0.32 -3.30 -0.09 0.00 -1.02 0.00 0.00 39.78 35.69 2by9 n ASN 223 CO 0.00 0.00 0.00 0.29 -1.83 0.00 0.00 177.26 175.72 2by9 n LYS 224 N -1.60 1.06 -1.29 3.52 4.76 -0.89 -4.73 118.16 119.00 2by9 n LYS 224 Ca -0.09 -3.64 -0.29 0.00 -2.87 0.00 0.00 58.31 51.42 2by9 n LYS 224 Cb 0.45 -1.66 0.17 0.00 -1.84 0.00 0.00 35.03 32.15 2by9 n LYS 224 CO 0.00 0.00 0.00 -1.25 -1.37 0.00 0.00 177.40 174.78 2by9 s PRO 225 N -1.15 0.39 0.44 1.97 0.04 -1.26 -4.31 135.00 131.12 2by9 s PRO 225 Ca 0.34 0.33 -0.24 0.00 0.04 0.00 0.00 61.00 61.48 2by9 s PRO 225 Cb 0.11 -1.75 -0.08 0.00 0.04 0.00 0.00 34.50 32.82 2by9 s PRO 225 CO -0.12 -2.72 1.20 0.20 0.04 0.00 0.00 177.00 175.60 2by9 s GLY 226 N -3.72 2.83 -0.10 0.56 0.00 -1.10 -4.67 107.32 101.13 2by9 s GLY 226 Ca 0.66 1.02 0.01 0.00 0.00 0.00 0.00 44.72 46.41 2by9 s GLY 226 CO 0.56 1.52 -0.13 0.14 0.00 0.00 0.00 173.10 175.18 2by9 s VAL 227 N -1.45 3.07 0.01 1.40 1.01 0.19 -1.64 120.40 122.99 2by9 s VAL 227 Ca 0.62 -0.68 0.04 0.00 0.00 0.00 0.00 61.98 61.95 2by9 s VAL 227 Cb -0.32 -2.25 -0.01 0.00 0.00 0.00 0.00 36.38 33.80 2by9 s VAL 227 CO 0.39 0.55 -0.12 -0.31 0.00 0.00 0.00 175.10 175.61 2by9 s TYR 228 N -0.11 1.10 0.19 5.22 2.02 0.37 -1.65 117.35 124.49 2by9 s TYR 228 Ca -0.02 -0.28 -0.30 0.00 -0.37 0.00 0.00 57.07 56.10 2by9 s TYR 228 Cb -0.14 -0.68 -0.09 0.00 -0.40 0.00 0.00 41.96 40.65 2by9 s TYR 228 CO 0.04 0.00 1.39 0.99 -1.57 0.00 0.00 175.55 176.39 2by9 s THR 229 N -0.56 3.03 -0.96 -0.71 2.01 -0.41 -1.23 115.64 116.80 2by9 s THR 229 Ca 0.03 0.81 -0.20 0.00 0.31 0.00 0.00 61.69 62.64 2by9 s THR 229 Cb -0.06 -3.52 0.10 0.00 0.01 0.00 0.00 72.50 69.03 2by9 s THR 229 CO 0.00 0.10 1.24 -0.75 -0.69 0.00 0.00 174.62 174.53 2by9 s LYS 230 N 0.23 3.60 0.40 4.92 2.20 -0.23 -2.55 119.74 128.31 2by9 s LYS 230 Ca 0.60 -1.56 0.08 0.00 -0.36 0.00 0.00 55.97 54.74 2by9 s LYS 230 Cb -0.39 -5.07 0.85 0.00 -1.51 0.00 0.00 37.83 31.72 2by9 s LYS 230 CO 0.37 -1.92 2.02 0.28 -0.36 0.00 0.00 175.35 175.74 2by9 h VAL 231 N 6.14 1.04 -0.12 4.02 2.07 -1.63 -1.93 116.25 125.85 2by9 h VAL 231 Ca 0.17 -0.20 0.03 0.00 0.82 0.00 0.00 66.70 67.53 2by9 h VAL 231 Cb 1.02 0.40 -0.00 0.00 -1.52 0.00 0.00 31.29 31.18 2by9 h VAL 231 CO 1.22 0.11 0.13 0.00 0.02 0.00 0.00 177.57 179.04 2by9 n ASN 233 N -3.86 0.68 -0.40 0.00 3.02 -0.72 -3.53 115.26 110.45 2by9 n ASN 233 Ca 0.00 0.65 0.05 0.00 -0.03 0.00 0.00 54.58 55.25 2by9 n ASN 233 Cb 0.24 -0.80 0.05 0.00 -0.61 0.00 0.00 39.78 38.66 2by9 n ASN 233 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 2by9 n TYR 234 N -2.23 0.05 -0.30 3.10 4.01 0.02 -4.70 117.16 117.11 2by9 n TYR 234 Ca 0.03 -0.06 -0.05 0.00 -0.16 0.00 0.00 57.90 57.65 2by9 n TYR 234 Cb 0.25 -0.00 0.07 0.00 -0.31 0.00 0.00 39.34 39.35 2by9 n TYR 234 CO 0.00 0.00 0.00 0.28 -0.46 0.00 0.00 176.86 176.68 2by9 h VAL 235 N 1.82 1.26 -0.50 -0.72 2.07 -1.59 0.57 116.25 119.17 2by9 h VAL 235 Ca 0.00 -0.75 -0.06 0.00 0.82 0.00 0.00 66.70 66.71 2by9 h VAL 235 Cb 0.43 0.22 -0.02 0.00 -1.52 0.00 0.00 31.29 30.40 2by9 h VAL 235 CO 0.00 0.32 0.09 0.28 0.02 0.00 0.00 177.57 178.27 2by9 h SER 236 N 1.18 0.78 -0.55 0.57 0.02 -1.86 -0.43 113.55 113.26 2by9 h SER 236 Ca 0.28 -0.26 -0.01 0.00 -0.84 0.00 0.00 61.79 60.97 2by9 h SER 236 Cb 0.14 -0.21 -0.03 0.00 0.14 0.00 0.00 62.40 62.45 2by9 h SER 236 CO -0.03 0.84 0.31 -0.25 -1.14 0.00 0.00 176.83 176.56 2by9 h TRP 237 N 0.70 0.73 -0.11 3.45 7.01 -1.77 -1.00 115.95 124.96 2by9 h TRP 237 Ca 0.15 -0.01 -0.00 0.00 2.11 0.00 0.00 58.89 61.14 2by9 h TRP 237 Cb 0.39 -0.24 -0.01 0.00 -2.10 0.00 0.00 29.16 27.20 2by9 h TRP 237 CO 0.03 0.52 0.07 0.82 -2.79 0.00 0.00 178.44 177.09 2by9 h ILE 238 N 0.73 1.07 -0.44 2.65 2.04 -0.63 -0.18 117.51 122.74 2by9 h ILE 238 Ca 0.19 -0.17 -0.04 0.00 1.00 0.00 0.00 64.86 65.84 2by9 h ILE 238 Cb 0.02 0.98 -0.02 0.00 -0.74 0.00 0.00 36.82 37.06 2by9 h ILE 238 CO -0.03 0.06 0.11 0.11 0.00 0.00 0.00 178.15 178.40 2by9 h LYS 239 N 0.11 0.71 -0.24 2.37 1.57 -0.99 -0.87 116.57 119.24 2by9 h LYS 239 Ca 0.04 -0.17 -0.13 0.00 -1.87 0.00 0.00 60.65 58.52 2by9 h LYS 239 Cb 0.04 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.24 2by9 h LYS 239 CO -0.01 0.71 -0.41 -0.56 -0.57 0.00 0.00 179.45 178.61 2by9 h GLN 240 N 0.58 0.57 -0.30 3.15 -0.00 -1.06 -1.54 115.11 116.51 2by9 h GLN 240 Ca 0.14 -0.29 -0.03 0.00 -0.00 0.00 0.00 58.65 58.47 2by9 h GLN 240 Cb 0.31 0.01 -0.01 0.00 -0.00 0.00 0.00 27.48 27.79 2by9 h GLN 240 CO 0.00 0.88 0.08 1.15 -0.00 0.00 0.00 178.83 180.94 2by9 h THR 241 N 0.46 1.21 -0.94 1.86 2.02 -0.81 -2.69 112.91 114.02 2by9 h THR 241 Ca 0.04 -0.68 -0.00 0.00 0.77 0.00 0.00 66.41 66.53 2by9 h THR 241 Cb 0.91 1.09 -0.05 0.00 -1.74 0.00 0.00 68.15 68.37 2by9 h THR 241 CO 0.08 0.23 0.58 0.40 0.37 0.00 0.00 175.52 177.17 2by9 h ILE 242 N 0.32 1.26 0.00 3.11 2.04 -1.03 -2.30 117.51 120.91 2by9 h ILE 242 Ca 0.10 -0.54 -0.00 0.00 1.00 0.00 0.00 64.86 65.41 2by9 h ILE 242 Cb 0.26 -0.08 -0.00 0.00 -0.74 0.00 0.00 36.82 36.26 2by9 h ILE 242 CO -0.00 0.27 -0.02 0.00 0.00 0.00 0.00 178.15 178.40 2by9 h ALA 243 N 1.34 1.04 -0.02 1.87 0.00 -0.96 -2.99 119.26 119.54 2by9 h ALA 243 Ca 0.34 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.23 2by9 h ALA 243 Cb -0.07 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.72 2by9 h ALA 243 CO -0.07 0.02 0.00 0.43 0.00 0.00 0.00 179.25 179.64 2by9 n SER 244 N -3.16 2.13 0.00 0.00 7.64 -0.99 -5.10 113.62 114.13 2by9 n SER 244 Ca -0.01 -2.17 0.00 0.00 1.01 0.00 0.00 58.87 57.70 2by9 n SER 244 Cb 0.20 -0.08 0.00 0.00 -1.01 0.00 0.00 64.21 63.32 2by9 n SER 244 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62