#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1r24 s ILE 2 N 0.00 3.25 0.24 0.53 1.01 -1.26 -4.93 121.20 120.03 1r24 s ILE 2 Ca 0.00 1.23 -0.16 0.00 0.00 0.00 0.00 60.65 61.73 1r24 s ILE 2 Cb 0.00 -3.78 -0.08 0.00 0.01 0.00 0.00 42.46 38.61 1r24 s ILE 2 CO 0.00 0.28 0.68 -1.10 0.00 0.00 0.00 174.94 174.79 1r24 s GLN 3 N -1.63 4.06 -0.07 2.79 -0.21 -1.26 -4.83 119.66 118.51 1r24 s GLN 3 Ca 0.47 0.66 0.02 0.00 0.02 0.00 0.00 55.36 56.53 1r24 s GLN 3 Cb -0.34 -2.71 -0.02 0.00 1.00 0.00 0.00 33.01 30.94 1r24 s GLN 3 CO 0.44 0.32 -0.12 1.41 -2.12 0.00 0.00 175.29 175.21 1r24 s MET 4 N -2.41 2.74 -0.03 2.91 1.75 -1.26 -0.02 119.30 122.98 1r24 s MET 4 Ca 0.46 -0.66 -0.00 0.00 -1.25 0.00 0.00 55.69 54.24 1r24 s MET 4 Cb -0.13 -2.48 0.03 0.00 2.84 0.00 0.00 34.83 35.09 1r24 s MET 4 CO 0.19 0.55 0.02 0.99 -0.65 0.00 0.00 175.02 176.12 1r24 s THR 5 N -0.52 0.02 -0.36 10.11 2.01 0.47 -4.64 115.64 122.72 1r24 s THR 5 Ca 0.07 0.19 -0.06 0.00 0.31 0.00 0.00 61.69 62.21 1r24 s THR 5 Cb -0.12 -0.16 0.06 0.00 0.01 0.00 0.00 72.50 72.29 1r24 s THR 5 CO 0.02 0.12 0.14 -1.10 -0.69 0.00 0.00 174.62 173.10 1r24 s GLN 6 N 1.18 2.50 -0.34 4.92 -0.21 -1.26 -1.36 119.66 125.09 1r24 s GLN 6 Ca -0.08 -1.34 -0.17 0.00 0.02 0.00 0.00 55.36 53.79 1r24 s GLN 6 Cb -0.13 -3.51 -0.01 0.00 1.00 0.00 0.00 33.01 30.36 1r24 s GLN 6 CO -0.03 -0.78 0.47 0.96 -2.12 0.00 0.00 175.29 173.80 1r24 s ILE 7 N 1.35 5.06 0.00 1.08 -0.00 -1.26 -4.71 121.20 122.72 1r24 s ILE 7 Ca 0.00 0.30 0.00 0.00 -0.00 0.00 0.00 60.65 60.95 1r24 s ILE 7 Cb -0.21 -3.91 0.00 0.00 -0.00 0.00 0.00 42.46 38.34 1r24 s ILE 7 CO 0.01 -0.16 0.00 0.41 -0.00 0.00 0.00 174.94 175.20 1r24 n THR 8 N 5.36 0.00 -0.80 8.37 -1.04 -1.26 -4.93 114.28 119.98 1r24 n THR 8 Ca -0.06 0.00 0.08 0.00 -2.04 0.00 0.00 64.05 62.03 1r24 n THR 8 Cb 0.49 0.00 0.25 0.00 -1.82 0.00 0.00 70.33 69.25 1r24 n THR 8 CO 0.00 0.00 0.00 -1.54 -0.64 0.00 0.00 175.07 172.89 1r24 n SER 9 N 0.00 3.81 -3.68 8.00 3.41 -1.26 -4.63 113.62 119.27 1r24 n SER 9 Ca 0.00 -2.77 -0.14 0.00 -0.26 0.00 0.00 58.87 55.70 1r24 n SER 9 Cb 0.00 -0.49 -0.08 0.00 -0.26 0.00 0.00 64.21 63.38 1r24 n SER 9 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1r24 s SER 10 N -1.63 -0.47 -0.24 4.04 1.04 -1.16 -0.05 113.70 115.23 1r24 s SER 10 Ca 0.39 0.73 -0.09 0.00 0.48 0.00 0.00 55.95 57.46 1r24 s SER 10 Cb 0.30 0.76 0.10 0.00 0.10 0.00 0.00 66.02 67.27 1r24 s SER 10 CO 0.11 -0.33 0.53 -0.22 0.98 0.00 0.00 173.24 174.31 1r24 s LEU 11 N -0.42 -0.80 0.34 2.42 2.96 -0.64 -4.81 118.68 117.72 1r24 s LEU 11 Ca -0.06 1.25 -0.13 0.00 -0.22 0.00 0.00 54.13 54.97 1r24 s LEU 11 Cb -0.03 1.81 -0.08 0.00 0.50 0.00 0.00 46.19 48.39 1r24 s LEU 11 CO 0.03 -0.22 0.72 -0.55 -1.32 0.00 0.00 176.35 175.01 1r24 s SER 12 N 2.48 6.68 0.18 3.68 0.15 -1.10 0.38 113.70 126.15 1r24 s SER 12 Ca -0.05 1.19 -0.15 0.00 0.70 0.00 0.00 55.95 57.64 1r24 s SER 12 Cb -0.11 -2.34 0.02 0.00 -1.71 0.00 0.00 66.02 61.88 1r24 s SER 12 CO -0.16 -0.25 0.45 0.54 1.20 0.00 0.00 173.24 175.03 1r24 s VAL 13 N -2.08 0.04 0.00 4.45 0.11 0.32 -4.82 120.40 118.42 1r24 s VAL 13 Ca 0.52 -0.91 0.00 0.00 -2.93 0.00 0.00 61.98 58.67 1r24 s VAL 13 Cb -0.10 -1.60 0.00 0.00 -1.53 0.00 0.00 36.38 33.15 1r24 s VAL 13 CO 0.22 -0.18 0.00 -1.20 -3.33 0.00 0.00 175.10 170.61 1r24 n SER 14 N -0.30 0.00 -3.14 3.54 7.64 -1.26 -3.06 113.62 117.04 1r24 n SER 14 Ca -0.10 0.00 -0.18 0.00 1.01 0.00 0.00 58.87 59.60 1r24 n SER 14 Cb 0.63 0.00 -0.05 0.00 -1.01 0.00 0.00 64.21 63.78 1r24 n SER 14 CO 0.00 0.00 0.00 -0.11 -3.01 0.00 0.00 175.04 171.92 1r24 n LEU 15 N 0.00 0.00 -1.11 -3.43 7.94 -1.26 -4.80 117.00 114.34 1r24 n LEU 15 Ca 0.00 -2.22 -0.11 0.00 -1.11 0.00 0.00 56.01 52.57 1r24 n LEU 15 Cb 0.00 0.76 -0.05 0.00 0.53 0.00 0.00 43.42 44.66 1r24 n LEU 15 CO 0.00 -0.34 -0.11 0.61 -1.11 0.00 0.00 177.39 176.44 1r24 n GLY 16 N 0.08 1.06 3.43 -3.96 0.00 0.24 -4.59 105.19 101.44 1r24 n GLY 16 Ca -0.04 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.77 1r24 n GLY 16 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1r24 s ASP 17 N -2.01 2.98 -0.02 1.61 3.84 -1.26 -4.38 116.67 117.43 1r24 s ASP 17 Ca 0.00 -1.14 -0.15 0.00 -0.00 0.00 0.00 52.55 51.26 1r24 s ASP 17 Cb 0.00 -0.21 -0.06 0.00 -1.38 0.00 0.00 42.92 41.28 1r24 s ASP 17 CO 0.00 -0.24 0.41 -0.60 -0.00 0.00 0.00 175.17 174.74 1r24 s ARG 18 N -3.66 3.96 -0.12 2.11 3.52 -1.02 1.30 118.95 125.04 1r24 s ARG 18 Ca 0.29 0.40 -0.01 0.00 -0.13 0.00 0.00 55.73 56.27 1r24 s ARG 18 Cb 0.01 -3.25 -0.03 0.00 -1.56 0.00 0.00 34.95 30.13 1r24 s ARG 18 CO 0.12 0.63 -0.07 0.08 -0.81 0.00 0.00 175.30 175.25 1r24 s VAL 19 N -0.87 3.67 0.02 7.11 1.01 -0.93 -4.78 120.40 125.62 1r24 s VAL 19 Ca 0.24 -0.46 -0.01 0.00 0.00 0.00 0.00 61.98 61.75 1r24 s VAL 19 Cb -0.16 -2.56 -0.04 0.00 0.00 0.00 0.00 36.38 33.62 1r24 s VAL 19 CO 0.13 0.54 0.15 -0.51 0.00 0.00 0.00 175.10 175.41 1r24 s ILE 20 N -0.07 5.15 -0.02 2.22 2.07 -1.26 0.26 121.20 129.55 1r24 s ILE 20 Ca 0.01 -0.34 0.04 0.00 -1.41 0.00 0.00 60.65 58.95 1r24 s ILE 20 Cb -0.13 -3.42 -0.01 0.00 0.13 0.00 0.00 42.46 39.03 1r24 s ILE 20 CO 0.03 0.27 -0.14 -0.63 -1.91 0.00 0.00 174.94 172.57 1r24 s ILE 21 N -1.34 1.11 0.18 2.00 1.01 2.02 -4.88 121.20 121.30 1r24 s ILE 21 Ca 0.28 -0.57 0.11 0.00 0.00 0.00 0.00 60.65 60.47 1r24 s ILE 21 Cb -0.12 -0.94 -0.04 0.00 0.01 0.00 0.00 42.46 41.36 1r24 s ILE 21 CO 0.20 0.32 -0.24 -0.44 0.00 0.00 0.00 174.94 174.78 1r24 s SER 22 N -0.14 3.36 -0.05 3.58 0.01 -1.26 0.43 113.70 119.64 1r24 s SER 22 Ca 0.02 -0.85 -0.08 0.00 1.31 0.00 0.00 55.95 56.35 1r24 s SER 22 Cb -0.07 -0.24 0.01 0.00 0.21 0.00 0.00 66.02 65.93 1r24 s SER 22 CO 0.00 0.12 0.19 0.00 0.41 0.00 0.00 173.24 173.96 1r24 s ARG 24 N -0.42 0.33 0.35 0.00 3.52 -0.47 0.59 118.95 122.85 1r24 s ARG 24 Ca -0.05 0.66 -0.28 0.00 -0.13 0.00 0.00 55.73 55.93 1r24 s ARG 24 Cb -0.03 -0.03 -0.10 0.00 -1.56 0.00 0.00 34.95 33.22 1r24 s ARG 24 CO 0.01 -0.15 1.26 0.00 -0.81 0.00 0.00 175.30 175.62 1r24 s ALA 25 N 1.22 3.40 0.00 6.12 0.00 0.57 -0.40 121.76 132.67 1r24 s ALA 25 Ca -0.08 1.18 0.00 0.00 0.00 0.00 0.00 51.96 53.05 1r24 s ALA 25 Cb -0.08 -3.45 0.00 0.00 0.00 0.00 0.00 23.12 19.59 1r24 s ALA 25 CO -0.10 -0.60 0.00 -1.13 0.00 0.00 0.00 175.76 173.93 1r24 n SER 26 N 0.63 0.00 -4.70 0.00 3.41 0.98 -4.82 113.62 109.12 1r24 n SER 26 Ca 0.01 0.00 -0.33 0.00 -0.26 0.00 0.00 58.87 58.29 1r24 n SER 26 Cb 0.43 0.00 0.13 0.00 -0.26 0.00 0.00 64.21 64.51 1r24 n SER 26 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 1r24 s GLN 27 N 0.00 1.61 -0.36 4.33 1.11 -1.26 -4.84 119.66 120.25 1r24 s GLN 27 Ca 0.00 1.65 -0.31 0.00 0.01 0.00 0.00 55.36 56.72 1r24 s GLN 27 Cb 0.00 -1.78 -0.09 0.00 -1.01 0.00 0.00 33.01 30.13 1r24 s GLN 27 CO 0.00 -2.21 2.27 -3.47 0.01 0.00 0.00 175.29 171.89 1r24 n ASP 28 N -3.46 2.46 -0.05 5.90 4.64 -1.26 -4.90 116.55 119.88 1r24 n ASP 28 Ca 0.13 0.16 0.15 0.00 -1.38 0.00 0.00 54.79 53.85 1r24 n ASP 28 Cb 0.51 -1.41 0.83 0.00 -1.04 0.00 0.00 41.12 40.02 1r24 n ASP 28 CO 0.00 0.00 0.00 -0.38 -0.82 0.00 0.00 177.20 176.00 1r24 n ILE 29 N 7.57 0.00 -1.52 5.18 -0.00 -0.83 -4.90 119.36 124.85 1r24 n ILE 29 Ca 0.38 -0.03 -0.04 0.00 -0.00 0.00 0.00 62.75 63.06 1r24 n ILE 29 Cb 0.35 -0.37 -0.01 0.00 -0.00 0.00 0.00 39.64 39.61 1r24 n ILE 29 CO 0.00 0.00 0.00 0.61 -0.00 0.00 0.00 176.55 177.16 1r24 n GLY 30 N 1.11 0.48 2.82 7.39 0.00 -1.26 -3.46 105.19 112.27 1r24 n GLY 30 Ca 0.20 -0.82 -0.16 0.00 0.00 0.00 0.00 46.02 45.25 1r24 n GLY 30 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1r24 n ASN 31 N 1.32 -3.57 -1.70 1.61 3.02 -1.26 -4.84 115.26 109.84 1r24 n ASN 31 Ca -0.04 -0.01 -0.09 0.00 -0.03 0.00 0.00 54.58 54.40 1r24 n ASN 31 Cb 0.30 -3.01 0.02 0.00 -0.61 0.00 0.00 39.78 36.48 1r24 n ASN 31 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 1r24 n PHE 32 N -3.53 0.86 -4.03 3.10 3.01 -1.23 -0.97 117.46 114.68 1r24 n PHE 32 Ca -0.08 -1.51 -0.26 0.00 1.01 0.00 0.00 57.45 56.60 1r24 n PHE 32 Cb 0.57 -0.74 -0.04 0.00 -0.01 0.00 0.00 39.48 39.26 1r24 n PHE 32 CO 0.00 0.00 0.00 -1.17 1.01 0.00 0.00 176.76 176.60 1r24 s LEU 33 N -1.02 4.02 0.02 4.37 0.20 -1.26 -3.14 118.68 121.88 1r24 s LEU 33 Ca 0.17 -0.00 -0.15 0.00 0.69 0.00 0.00 54.13 54.84 1r24 s LEU 33 Cb 0.14 -2.62 0.03 0.00 -0.43 0.00 0.00 46.19 43.30 1r24 s LEU 33 CO -0.00 0.06 0.34 0.20 -0.29 0.00 0.00 176.35 176.66 1r24 s ASN 34 N -3.15 -0.19 -0.14 3.68 0.01 -1.18 0.19 114.94 114.17 1r24 s ASN 34 Ca 0.32 -0.05 0.02 0.00 -0.71 0.00 0.00 52.86 52.44 1r24 s ASN 34 Cb -0.10 0.36 0.01 0.00 0.41 0.00 0.00 41.25 41.93 1r24 s ASN 34 CO 0.25 -0.58 -0.21 0.26 -1.51 0.00 0.00 177.10 175.32 1r24 s TRP 35 N -2.15 2.58 0.25 2.20 0.52 -0.98 -0.50 118.94 120.86 1r24 s TRP 35 Ca -0.08 -1.32 0.11 0.00 0.02 0.00 0.00 56.10 54.84 1r24 s TRP 35 Cb -0.02 -1.77 -0.05 0.00 -1.15 0.00 0.00 33.47 30.48 1r24 s TRP 35 CO -0.01 -0.61 -0.16 0.71 0.02 0.00 0.00 176.95 176.90 1r24 s TYR 36 N 0.89 2.40 -0.20 -1.98 1.51 -0.90 -1.71 117.35 117.36 1r24 s TYR 36 Ca -0.06 -0.30 0.01 0.00 -1.01 0.00 0.00 57.07 55.71 1r24 s TYR 36 Cb -0.15 -1.08 0.03 0.00 -0.11 0.00 0.00 41.96 40.65 1r24 s TYR 36 CO -0.03 0.65 -0.15 -1.14 -1.11 0.00 0.00 175.55 173.77 1r24 s GLN 37 N -3.35 2.53 -0.17 -0.62 0.74 -0.50 -2.08 119.66 116.21 1r24 s GLN 37 Ca 0.28 -0.90 -0.06 0.00 0.05 0.00 0.00 55.36 54.74 1r24 s GLN 37 Cb -0.06 -2.53 -0.04 0.00 1.10 0.00 0.00 33.01 31.48 1r24 s GLN 37 CO 0.15 -0.33 0.03 -1.14 -0.55 0.00 0.00 175.29 173.44 1r24 s GLN 38 N 1.31 3.82 0.15 1.67 0.74 -0.99 0.84 119.66 127.21 1r24 s GLN 38 Ca 0.01 -0.40 0.08 0.00 0.05 0.00 0.00 55.36 55.10 1r24 s GLN 38 Cb -0.15 -3.09 -0.04 0.00 1.10 0.00 0.00 33.01 30.83 1r24 s GLN 38 CO -0.10 0.29 -0.19 -1.59 -0.55 0.00 0.00 175.29 173.15 1r24 s LYS 39 N 0.28 1.25 0.00 1.67 -2.85 -1.23 -2.75 119.74 116.11 1r24 s LYS 39 Ca 0.01 -1.37 0.00 0.00 -1.00 0.00 0.00 55.97 53.61 1r24 s LYS 39 Cb -0.13 -1.34 0.00 0.00 -2.06 0.00 0.00 37.83 34.30 1r24 s LYS 39 CO 0.01 0.28 0.00 -2.30 0.10 0.00 0.00 175.35 173.44 1r24 n PRO 40 N 0.42 0.00 0.00 1.78 -0.02 -1.26 -2.93 135.00 132.98 1r24 n PRO 40 Ca -0.14 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.34 1r24 n PRO 40 Cb 0.56 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 34.04 1r24 n PRO 40 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 1r24 n ASP 41 N 0.00 0.00 0.00 2.55 5.75 -1.26 -5.04 116.55 118.55 1r24 n ASP 41 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 54.79 54.78 1r24 n ASP 41 Cb 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.09 1r24 n ASP 41 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1r24 n GLY 42 N 5.00 0.45 2.09 6.12 0.00 -1.15 -4.95 105.19 112.75 1r24 n GLY 42 Ca 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.91 1r24 n GLY 42 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1r24 n SER 43 N -0.76 -3.13 -4.66 1.61 7.64 -1.26 -3.73 113.62 109.33 1r24 n SER 43 Ca 0.00 0.25 -0.47 0.00 1.01 0.00 0.00 58.87 59.66 1r24 n SER 43 Cb 0.00 -2.86 -0.05 0.00 -1.01 0.00 0.00 64.21 60.29 1r24 n SER 43 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 1r24 n LEU 44 N -2.16 2.99 -4.69 -3.43 4.77 -1.26 -3.57 117.00 109.66 1r24 n LEU 44 Ca -0.12 1.07 -0.34 0.00 -0.03 0.00 0.00 56.01 56.59 1r24 n LEU 44 Cb 0.46 -1.38 -0.09 0.00 -2.33 0.00 0.00 43.42 40.07 1r24 n LEU 44 CO 0.16 -0.33 -0.31 -0.75 -1.33 0.00 0.00 177.39 174.83 1r24 s LYS 45 N 1.54 2.92 0.67 3.23 2.20 0.25 -4.90 119.74 125.64 1r24 s LYS 45 Ca 0.83 -0.48 -0.12 0.00 -0.36 0.00 0.00 55.97 55.84 1r24 s LYS 45 Cb -0.72 -2.75 -0.01 0.00 -1.51 0.00 0.00 37.83 32.84 1r24 s LYS 45 CO 0.42 0.67 1.05 -1.17 -0.36 0.00 0.00 175.35 175.97 1r24 s LEU 46 N -1.14 3.20 0.10 5.43 1.98 -1.26 -1.40 118.68 125.59 1r24 s LEU 46 Ca 0.16 1.62 0.00 0.00 -2.89 0.00 0.00 54.13 53.01 1r24 s LEU 46 Cb -0.11 -4.50 0.00 0.00 0.66 0.00 0.00 46.19 42.24 1r24 s LEU 46 CO 0.05 -1.32 0.00 0.18 -1.89 0.00 0.00 176.35 173.37 1r24 n LEU 47 N -2.92 0.39 -3.85 -0.68 4.77 -0.69 -4.80 117.00 109.22 1r24 n LEU 47 Ca 0.07 0.17 -0.11 0.00 -0.03 0.00 0.00 56.01 56.11 1r24 n LEU 47 Cb 0.53 -0.03 -0.09 0.00 -2.33 0.00 0.00 43.42 41.50 1r24 n LEU 47 CO 0.55 -0.54 -0.12 -0.63 -1.33 0.00 0.00 177.39 175.31 1r24 s ILE 48 N -2.00 0.09 0.03 -0.08 1.01 -1.21 -2.03 121.20 117.02 1r24 s ILE 48 Ca 0.00 -0.78 0.01 0.00 0.00 0.00 0.00 60.65 59.89 1r24 s ILE 48 Cb 0.00 -0.68 -0.02 0.00 0.01 0.00 0.00 42.46 41.77 1r24 s ILE 48 CO 0.00 -0.43 -0.06 -0.72 0.00 0.00 0.00 174.94 173.73 1r24 s TYR 49 N -1.93 0.50 -0.57 3.97 1.13 0.14 -2.32 117.35 118.26 1r24 s TYR 49 Ca -0.10 -0.41 -0.03 0.00 -1.41 0.00 0.00 57.07 55.12 1r24 s TYR 49 Cb -0.04 -0.31 0.00 0.00 -1.10 0.00 0.00 41.96 40.51 1r24 s TYR 49 CO -0.01 -0.09 0.58 0.98 -2.51 0.00 0.00 175.55 174.50 1r24 n TYR 50 N 1.83 -2.61 0.00 -3.49 9.36 -0.26 0.16 117.16 122.15 1r24 n TYR 50 Ca -0.21 1.01 0.00 0.00 3.32 0.00 0.00 57.90 62.02 1r24 n TYR 50 Cb 0.56 -3.71 0.00 0.00 -0.63 0.00 0.00 39.34 35.55 1r24 n TYR 50 CO 0.00 0.00 0.00 2.41 0.22 0.00 0.00 176.86 179.49 1r24 n THR 51 N -1.39 0.00 -0.21 2.97 -1.04 0.51 -2.73 114.28 112.39 1r24 n THR 51 Ca 0.02 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.03 1r24 n THR 51 Cb 0.48 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.99 1r24 n THR 51 CO 0.00 0.00 0.00 -1.20 -0.64 0.00 0.00 175.07 173.23 1r24 n SER 52 N 0.00 0.19 -4.66 8.00 7.64 -1.08 -4.34 113.62 119.36 1r24 n SER 52 Ca 0.00 -0.54 -0.43 0.00 1.01 0.00 0.00 58.87 58.92 1r24 n SER 52 Cb 0.00 0.29 -0.02 0.00 -1.01 0.00 0.00 64.21 63.47 1r24 n SER 52 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 1r24 s ARG 53 N -0.29 4.21 0.23 1.43 1.81 0.42 -4.69 118.95 122.08 1r24 s ARG 53 Ca 0.00 1.95 -0.30 0.00 -1.72 0.00 0.00 55.73 55.67 1r24 s ARG 53 Cb 0.00 -3.86 -0.09 0.00 -0.45 0.00 0.00 34.95 30.55 1r24 s ARG 53 CO 0.00 -0.77 1.00 -1.17 -0.68 0.00 0.00 175.30 173.68 1r24 s LEU 54 N 3.70 4.59 0.87 2.53 2.96 -1.26 0.28 118.68 132.34 1r24 s LEU 54 Ca 0.65 2.04 -0.13 0.00 -0.22 0.00 0.00 54.13 56.47 1r24 s LEU 54 Cb -0.28 -3.61 0.12 0.00 0.50 0.00 0.00 46.19 42.92 1r24 s LEU 54 CO 0.23 0.02 1.22 0.00 -1.32 0.00 0.00 176.35 176.50 1r24 s GLN 55 N -1.07 1.48 0.23 1.98 1.03 -0.86 -4.90 119.66 117.55 1r24 s GLN 55 Ca 0.43 -0.03 -0.30 0.00 0.04 0.00 0.00 55.36 55.50 1r24 s GLN 55 Cb -0.28 -1.91 -0.10 0.00 0.03 0.00 0.00 33.01 30.75 1r24 s GLN 55 CO 0.35 -1.90 1.46 -1.54 -2.54 0.00 0.00 175.29 171.11 1r24 s SER 56 N -4.63 6.65 0.00 12.60 1.04 -1.26 -1.67 113.70 126.43 1r24 s SER 56 Ca 0.66 2.65 0.00 0.00 0.48 0.00 0.00 55.95 59.73 1r24 s SER 56 Cb -0.09 -2.62 0.00 0.00 0.10 0.00 0.00 66.02 63.41 1r24 s SER 56 CO 0.51 -0.72 0.00 0.61 0.98 0.00 0.00 173.24 174.62 1r24 n GLY 57 N 2.48 1.84 3.75 7.32 0.00 -1.26 -4.97 105.19 114.34 1r24 n GLY 57 Ca 0.08 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.69 1r24 n GLY 57 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1r24 s VAL 58 N -2.53 2.60 0.08 1.61 1.01 -0.67 -4.83 120.40 117.67 1r24 s VAL 58 Ca 0.00 0.51 -0.20 0.00 0.00 0.00 0.00 61.98 62.28 1r24 s VAL 58 Cb 0.00 -3.32 -0.07 0.00 0.00 0.00 0.00 36.38 32.99 1r24 s VAL 58 CO 0.00 0.08 0.60 -2.16 0.00 0.00 0.00 175.10 173.62 1r24 s PRO 59 N -0.46 4.26 0.00 2.72 0.05 -1.26 -4.86 135.00 135.45 1r24 s PRO 59 Ca 0.59 0.80 0.00 0.00 0.05 0.00 0.00 61.00 62.44 1r24 s PRO 59 Cb -0.42 -3.25 0.00 0.00 0.05 0.00 0.00 34.50 30.87 1r24 s PRO 59 CO 0.44 0.60 0.41 -1.13 0.05 0.00 0.00 177.00 177.38 1r24 n SER 60 N 1.82 1.04 0.09 6.66 3.41 -1.26 -3.24 113.62 122.14 1r24 n SER 60 Ca -0.09 -1.23 0.12 0.00 -0.26 0.00 0.00 58.87 57.41 1r24 n SER 60 Cb 0.50 -0.31 0.25 0.00 -0.26 0.00 0.00 64.21 64.40 1r24 n SER 60 CO 0.00 0.00 0.00 0.08 -0.16 0.00 0.00 175.04 174.96 1r24 h ARG 61 N 0.52 0.00 -6.58 4.33 0.11 -1.95 -3.46 114.38 107.35 1r24 h ARG 61 Ca 0.00 0.00 -0.52 0.00 0.10 0.00 0.00 59.98 59.56 1r24 h ARG 61 Cb 0.41 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.48 1r24 h ARG 61 CO 0.00 0.00 0.40 -0.06 0.10 0.00 0.00 179.97 180.41 1r24 s PHE 62 N -3.15 3.73 0.04 4.08 0.40 -1.20 -0.52 117.98 121.36 1r24 s PHE 62 Ca 0.08 1.72 -0.23 0.00 -0.60 0.00 0.00 56.93 57.90 1r24 s PHE 62 Cb 0.12 -3.13 0.05 0.00 0.51 0.00 0.00 43.02 40.58 1r24 s PHE 62 CO 0.68 -0.08 0.54 0.45 0.70 0.00 0.00 175.22 177.51 1r24 s SER 63 N 0.08 -0.47 0.14 1.36 0.15 -1.20 -4.98 113.70 108.78 1r24 s SER 63 Ca 0.48 0.22 -0.01 0.00 0.70 0.00 0.00 55.95 57.35 1r24 s SER 63 Cb -0.25 0.50 -0.04 0.00 -1.71 0.00 0.00 66.02 64.52 1r24 s SER 63 CO 0.31 -0.72 0.07 -0.83 1.20 0.00 0.00 173.24 173.27 1r24 s GLY 64 N -1.93 1.08 0.32 9.45 0.00 -1.26 0.33 107.32 115.30 1r24 s GLY 64 Ca -0.06 -1.52 -0.09 0.00 0.00 0.00 0.00 44.72 43.06 1r24 s GLY 64 CO -0.01 -1.37 0.54 -0.98 0.00 0.00 0.00 173.10 171.28 1r24 s TRP 65 N -4.06 0.61 0.00 1.90 0.52 0.32 -4.83 118.94 113.40 1r24 s TRP 65 Ca 0.27 -0.98 0.00 0.00 0.02 0.00 0.00 56.10 55.40 1r24 s TRP 65 Cb 0.07 0.21 0.00 0.00 -1.15 0.00 0.00 33.47 32.60 1r24 s TRP 65 CO 0.04 -1.18 0.00 0.41 0.02 0.00 0.00 176.95 176.24 1r24 n GLY 66 N -0.49 3.98 3.63 0.98 0.00 -1.26 -2.09 105.19 109.93 1r24 n GLY 66 Ca -0.02 -0.72 -0.09 0.00 0.00 0.00 0.00 46.02 45.19 1r24 n GLY 66 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1r24 s SER 67 N 0.00 -0.39 0.00 1.61 0.15 -0.81 -4.91 113.70 109.35 1r24 s SER 67 Ca 0.00 0.70 0.00 0.00 0.70 0.00 0.00 55.95 57.35 1r24 s SER 67 Cb 0.00 0.69 0.00 0.00 -1.71 0.00 0.00 66.02 65.00 1r24 s SER 67 CO 0.00 -0.17 0.00 0.61 1.20 0.00 0.00 173.24 174.88 1r24 n GLY 68 N 1.85 1.92 0.00 9.45 0.00 -1.26 -2.82 105.19 114.33 1r24 n GLY 68 Ca -0.12 -0.20 0.00 0.00 0.00 0.00 0.00 46.02 45.70 1r24 n GLY 68 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1r24 n THR 69 N 0.00 0.00 -4.79 2.61 -2.24 -1.26 -1.97 114.28 106.63 1r24 n THR 69 Ca 0.00 -0.24 -0.33 0.00 -2.27 0.00 0.00 64.05 61.21 1r24 n THR 69 Cb 0.00 0.90 -0.14 0.00 -2.10 0.00 0.00 70.33 68.99 1r24 n THR 69 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1r24 s ASP 70 N -0.65 4.05 0.07 3.42 1.11 -1.13 -0.32 116.67 123.23 1r24 s ASP 70 Ca 0.00 -0.28 -0.10 0.00 0.18 0.00 0.00 52.55 52.34 1r24 s ASP 70 Cb 0.00 -1.43 0.01 0.00 1.07 0.00 0.00 42.92 42.57 1r24 s ASP 70 CO 0.00 0.21 0.22 -0.31 1.18 0.00 0.00 175.17 176.47 1r24 s TYR 71 N 0.07 0.05 -0.14 4.23 1.51 2.46 -1.93 117.35 123.61 1r24 s TYR 71 Ca -0.05 -0.36 -0.15 0.00 -1.01 0.00 0.00 57.07 55.50 1r24 s TYR 71 Cb -0.15 -0.00 0.04 0.00 -0.11 0.00 0.00 41.96 41.74 1r24 s TYR 71 CO 0.04 -0.51 0.41 -1.12 -1.11 0.00 0.00 175.55 173.27 1r24 s SER 72 N -2.46 -0.42 -0.00 2.29 0.01 -0.89 2.27 113.70 114.50 1r24 s SER 72 Ca -0.00 0.76 -0.05 0.00 1.31 0.00 0.00 55.95 57.96 1r24 s SER 72 Cb 0.02 0.79 -0.04 0.00 0.21 0.00 0.00 66.02 66.99 1r24 s SER 72 CO -0.07 -0.19 0.24 -0.22 0.41 0.00 0.00 173.24 173.40 1r24 s LEU 73 N 0.02 4.37 -0.28 2.44 2.96 1.49 -0.52 118.68 129.16 1r24 s LEU 73 Ca -0.02 0.49 0.02 0.00 -0.22 0.00 0.00 54.13 54.41 1r24 s LEU 73 Cb -0.03 -2.63 0.08 0.00 0.50 0.00 0.00 46.19 44.11 1r24 s LEU 73 CO 0.01 0.26 -0.01 -0.89 -1.32 0.00 0.00 176.35 174.41 1r24 s THR 74 N -1.29 1.79 -0.27 3.68 2.01 0.15 0.52 115.64 122.23 1r24 s THR 74 Ca 0.27 -1.68 -0.18 0.00 0.31 0.00 0.00 61.69 60.41 1r24 s THR 74 Cb -0.13 -2.15 -0.03 0.00 0.01 0.00 0.00 72.50 70.21 1r24 s THR 74 CO 0.16 -0.33 0.50 -0.63 -0.69 0.00 0.00 174.62 173.63 1r24 s ILE 75 N 1.22 5.07 0.05 1.82 1.01 0.73 -3.27 121.20 127.83 1r24 s ILE 75 Ca 0.01 0.79 -0.23 0.00 0.00 0.00 0.00 60.65 61.22 1r24 s ILE 75 Cb -0.19 -3.83 -0.15 0.00 0.01 0.00 0.00 42.46 38.31 1r24 s ILE 75 CO -0.09 0.06 1.51 0.77 0.00 0.00 0.00 174.94 177.18 1r24 h SER 76 N 8.09 0.13 -3.41 3.58 4.64 -1.05 -2.40 113.55 123.14 1r24 h SER 76 Ca -0.29 -0.27 -0.62 0.00 -0.47 0.00 0.00 61.79 60.14 1r24 h SER 76 Cb 1.14 -0.04 -0.41 0.00 -0.31 0.00 0.00 62.40 62.79 1r24 h SER 76 CO 0.71 0.37 -0.67 0.21 -0.87 0.00 0.00 176.83 176.58 1r24 s ASN 77 N -5.60 4.05 -0.40 4.97 3.84 -1.23 -2.63 114.94 117.95 1r24 s ASN 77 Ca -0.14 -3.30 -0.36 0.00 0.21 0.00 0.00 52.86 49.26 1r24 s ASN 77 Cb 0.05 -1.37 -0.16 0.00 -0.55 0.00 0.00 41.25 39.22 1r24 s ASN 77 CO 0.69 -0.17 1.50 -0.11 -2.79 0.00 0.00 177.10 176.22 1r24 n LEU 78 N 2.68 0.79 -4.74 3.21 0.00 11.64 -4.11 117.00 126.47 1r24 n LEU 78 Ca 0.15 0.75 -0.31 0.00 0.00 0.00 0.00 56.01 56.60 1r24 n LEU 78 Cb 0.36 -0.71 -0.07 0.00 0.00 0.00 0.00 43.42 42.99 1r24 n LEU 78 CO 0.26 -0.65 -0.29 -1.61 0.00 0.00 0.00 177.39 175.10 1r24 s GLU 79 N 3.59 2.83 0.00 1.96 2.02 -1.26 0.79 118.70 128.63 1r24 s GLU 79 Ca 0.90 -0.66 0.00 0.00 0.02 0.00 0.00 54.97 55.23 1r24 s GLU 79 Cb -1.20 -2.70 0.00 0.00 0.10 0.00 0.00 34.13 30.32 1r24 s GLU 79 CO 0.59 0.59 0.22 -0.85 0.02 0.00 0.00 175.26 175.84 1r24 n GLU 80 N 0.84 0.00 -0.08 1.61 0.00 -1.26 -1.10 120.64 120.65 1r24 n GLU 80 Ca -0.11 0.03 0.08 0.00 0.00 0.00 0.00 57.16 57.15 1r24 n GLU 80 Cb 0.52 -1.59 0.11 0.00 0.00 0.00 0.00 31.44 30.48 1r24 n GLU 80 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.13 176.28 1r24 n GLU 81 N -0.72 1.48 -0.07 3.44 0.00 -1.26 -3.87 120.64 119.63 1r24 n GLU 81 Ca 0.00 -2.28 0.06 0.00 0.00 0.00 0.00 57.16 54.93 1r24 n GLU 81 Cb 0.09 -1.35 0.09 0.00 0.00 0.00 0.00 31.44 30.28 1r24 n GLU 81 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.13 176.88 1r24 n ASP 82 N -1.18 2.34 -4.40 -1.84 10.43 -0.26 -4.97 116.55 116.67 1r24 n ASP 82 Ca 0.12 -2.58 -0.44 0.00 2.57 0.00 0.00 54.79 54.46 1r24 n ASP 82 Cb 0.58 -0.25 -0.06 0.00 1.84 0.00 0.00 41.12 43.22 1r24 n ASP 82 CO 0.00 0.00 0.00 -0.51 -1.07 0.00 0.00 177.20 175.62 1r24 s ILE 83 N -2.01 5.01 0.36 0.53 2.07 -1.25 -4.89 121.20 121.02 1r24 s ILE 83 Ca 0.19 -0.86 -0.13 0.00 -1.41 0.00 0.00 60.65 58.45 1r24 s ILE 83 Cb 0.16 -4.29 0.04 0.00 0.13 0.00 0.00 42.46 38.50 1r24 s ILE 83 CO 0.03 -0.80 0.70 0.00 -1.91 0.00 0.00 174.94 172.96 1r24 s ALA 84 N 2.24 -0.41 0.22 1.50 0.00 -1.26 -4.78 121.76 119.28 1r24 s ALA 84 Ca 0.10 -0.90 0.09 0.00 0.00 0.00 0.00 51.96 51.25 1r24 s ALA 84 Cb -0.23 0.81 -0.04 0.00 0.00 0.00 0.00 23.12 23.66 1r24 s ALA 84 CO 0.08 -0.94 -0.03 0.95 0.00 0.00 0.00 175.76 175.82 1r24 s THR 85 N -2.66 3.41 -0.02 0.00 -4.23 -1.11 -3.64 115.64 107.40 1r24 s THR 85 Ca 0.19 -1.74 0.03 0.00 -1.18 0.00 0.00 61.69 58.98 1r24 s THR 85 Cb -0.04 -2.76 -0.00 0.00 1.34 0.00 0.00 72.50 71.04 1r24 s THR 85 CO 0.13 -0.24 -0.09 -0.36 -0.54 0.00 0.00 174.62 173.52 1r24 s PHE 86 N -2.02 0.89 0.23 3.99 2.99 -1.24 -2.33 117.98 120.50 1r24 s PHE 86 Ca 0.29 -0.20 0.10 0.00 0.00 0.00 0.00 56.93 57.12 1r24 s PHE 86 Cb -0.08 -0.61 -0.04 0.00 0.00 0.00 0.00 43.02 42.29 1r24 s PHE 86 CO 0.18 -0.06 -0.14 -0.06 -0.00 0.00 0.00 175.22 175.14 1r24 s PHE 87 N -0.00 2.47 0.03 0.36 0.40 -0.88 -0.48 117.98 119.89 1r24 s PHE 87 Ca 0.00 -0.28 0.00 0.00 -0.60 0.00 0.00 56.93 56.05 1r24 s PHE 87 Cb -0.06 -1.15 -0.03 0.00 0.51 0.00 0.00 43.02 42.29 1r24 s PHE 87 CO 0.00 0.59 -0.04 0.00 0.70 0.00 0.00 175.22 176.48 1r24 s GLN 89 N -2.25 1.06 -0.27 0.00 -2.07 0.34 0.60 119.66 117.08 1r24 s GLN 89 Ca -0.08 -1.36 -0.02 0.00 -1.82 0.00 0.00 55.36 52.09 1r24 s GLN 89 Cb -0.04 0.30 0.03 0.00 -1.09 0.00 0.00 33.01 32.21 1r24 s GLN 89 CO -0.03 -0.35 -0.04 1.14 -1.32 0.00 0.00 175.29 174.69 1r24 s GLN 90 N -4.03 2.72 -0.77 9.60 1.03 0.45 -3.08 119.66 125.57 1r24 s GLN 90 Ca 0.23 -1.06 -0.01 0.00 0.04 0.00 0.00 55.36 54.56 1r24 s GLN 90 Cb 0.06 -3.06 0.38 0.00 0.03 0.00 0.00 33.01 30.41 1r24 s GLN 90 CO 0.03 -0.47 1.92 0.41 -2.54 0.00 0.00 175.29 174.64 1r24 n GLY 91 N 4.66 5.65 0.00 2.60 0.00 -1.19 -3.42 105.19 113.49 1r24 n GLY 91 Ca -0.15 -2.49 0.00 0.00 0.00 0.00 0.00 46.02 43.38 1r24 n GLY 91 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1r24 n LYS 92 N -0.60 2.04 -3.66 1.61 3.00 -1.26 -4.99 118.16 114.30 1r24 n LYS 92 Ca 0.54 0.00 -0.06 0.00 -0.00 0.00 0.00 58.31 58.78 1r24 n LYS 92 Cb 0.36 -0.83 -0.07 0.00 0.00 0.00 0.00 35.03 34.48 1r24 n LYS 92 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.40 178.39 1r24 s THR 93 N -1.36 -0.35 0.80 3.15 2.01 -1.26 -5.11 115.64 113.52 1r24 s THR 93 Ca 0.00 0.04 -0.14 0.00 0.31 0.00 0.00 61.69 61.90 1r24 s THR 93 Cb 0.00 -0.88 0.06 0.00 0.01 0.00 0.00 72.50 71.69 1r24 s THR 93 CO 0.00 0.02 1.07 0.18 -0.69 0.00 0.00 174.62 175.20 1r24 n LEU 94 N 4.74 3.75 -4.62 4.42 4.32 -1.26 -3.79 117.00 124.56 1r24 n LEU 94 Ca -0.17 0.58 -0.40 0.00 -0.02 0.00 0.00 56.01 56.00 1r24 n LEU 94 Cb 0.54 -1.46 0.02 0.00 -1.62 0.00 0.00 43.42 40.91 1r24 n LEU 94 CO -0.00 -1.97 0.60 -0.81 -1.22 0.00 0.00 177.39 174.00 1r24 n PRO 95 N -2.81 1.29 -2.51 3.23 -0.04 -1.26 -4.75 135.00 128.14 1r24 n PRO 95 Ca 0.13 0.47 -0.32 0.00 -0.04 0.00 0.00 63.50 63.74 1r24 n PRO 95 Cb 0.50 -2.12 -0.04 0.00 -0.04 0.00 0.00 33.50 31.80 1r24 n PRO 95 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 1r24 s TYR 96 N -1.35 3.43 0.19 0.54 1.51 -1.25 -4.74 117.35 115.69 1r24 s TYR 96 Ca 0.66 1.44 -0.01 0.00 -1.01 0.00 0.00 57.07 58.16 1r24 s TYR 96 Cb -0.51 -2.76 -0.04 0.00 -0.11 0.00 0.00 41.96 38.54 1r24 s TYR 96 CO 0.54 -0.30 0.11 0.95 -1.11 0.00 0.00 175.55 175.74 1r24 s THR 97 N -2.53 0.07 -0.07 -0.71 -4.23 -1.22 -4.91 115.64 102.04 1r24 s THR 97 Ca 0.59 -1.98 0.06 0.00 -1.18 0.00 0.00 61.69 59.17 1r24 s THR 97 Cb -0.10 -2.42 -0.01 0.00 1.34 0.00 0.00 72.50 71.31 1r24 s THR 97 CO 0.28 -0.09 -0.24 -0.36 -0.54 0.00 0.00 174.62 173.67 1r24 s PHE 98 N -4.11 2.47 0.42 3.99 0.40 -1.26 -0.42 117.98 119.47 1r24 s PHE 98 Ca 0.36 -0.76 -0.26 0.00 -0.60 0.00 0.00 56.93 55.66 1r24 s PHE 98 Cb 0.07 -1.62 -0.09 0.00 0.51 0.00 0.00 43.02 41.89 1r24 s PHE 98 CO 0.10 -0.24 1.40 0.20 0.70 0.00 0.00 175.22 177.38 1r24 s GLY 99 N -0.08 2.93 0.00 4.36 0.00 2.57 -4.67 107.32 112.43 1r24 s GLY 99 Ca -0.06 1.41 0.00 0.00 0.00 0.00 0.00 44.72 46.07 1r24 s GLY 99 CO 0.05 2.03 0.15 0.61 0.00 0.00 0.00 173.10 175.94 1r24 n GLY 100 N 0.59 0.00 0.08 0.20 0.00 -1.26 -4.10 105.19 100.71 1r24 n GLY 100 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.06 1r24 n GLY 100 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1r24 n GLY 101 N -0.64 -1.89 3.26 -0.02 0.00 -1.22 -4.95 105.19 99.73 1r24 n GLY 101 Ca 0.00 -1.05 -0.44 0.00 0.00 0.00 0.00 46.02 44.53 1r24 n GLY 101 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1r24 s THR 102 N -0.53 4.90 0.68 2.61 2.01 0.37 -4.68 115.64 120.99 1r24 s THR 102 Ca 0.00 -2.29 -0.14 0.00 0.31 0.00 0.00 61.69 59.57 1r24 s THR 102 Cb 0.00 -4.10 0.01 0.00 0.01 0.00 0.00 72.50 68.41 1r24 s THR 102 CO 0.00 -0.93 1.10 -0.75 -0.69 0.00 0.00 174.62 173.35 1r24 s LYS 103 N 0.57 2.76 0.02 4.92 2.36 0.93 -3.59 119.74 127.71 1r24 s LYS 103 Ca 0.13 1.29 0.03 0.00 -2.55 0.00 0.00 55.97 54.86 1r24 s LYS 103 Cb -0.18 -1.95 -0.02 0.00 -1.05 0.00 0.00 37.83 34.63 1r24 s LYS 103 CO -0.04 -1.27 -0.09 -1.17 1.55 0.00 0.00 175.35 174.33 1r24 s LEU 104 N -5.10 2.13 0.03 5.43 0.20 -1.24 -1.62 118.68 118.51 1r24 s LEU 104 Ca 0.65 -0.34 -0.22 0.00 0.69 0.00 0.00 54.13 54.90 1r24 s LEU 104 Cb -0.19 -0.34 0.05 0.00 -0.43 0.00 0.00 46.19 45.28 1r24 s LEU 104 CO 0.45 -0.03 0.51 -1.83 -0.29 0.00 0.00 176.35 175.16 1r24 s GLU 105 N -0.86 1.00 -0.45 1.98 -1.05 0.16 -4.50 118.70 114.98 1r24 s GLU 105 Ca -0.02 -0.20 -0.27 0.00 -0.15 0.00 0.00 54.97 54.33 1r24 s GLU 105 Cb -0.06 0.45 0.03 0.00 -0.44 0.00 0.00 34.13 34.11 1r24 s GLU 105 CO 0.00 -0.35 1.04 0.42 0.95 0.00 0.00 175.26 177.32 1r24 s ILE 106 N -2.23 4.36 0.76 1.83 -1.09 -1.26 -0.52 121.20 123.04 1r24 s ILE 106 Ca -0.06 1.10 -0.15 0.00 -2.23 0.00 0.00 60.65 59.30 1r24 s ILE 106 Cb -0.01 -4.51 0.05 0.00 -1.58 0.00 0.00 42.46 36.42 1r24 s ILE 106 CO -0.00 -0.86 1.21 0.29 -1.23 0.00 0.00 174.94 174.35 1r24 n LYS 107 N 7.43 0.48 -3.62 2.79 5.02 -1.17 -4.93 118.16 124.16 1r24 n LYS 107 Ca 0.09 0.23 -0.01 0.00 -2.02 0.00 0.00 58.31 56.61 1r24 n LYS 107 Cb 0.49 -2.45 -0.01 0.00 -0.02 0.00 0.00 35.03 33.03 1r24 n LYS 107 CO 0.00 0.00 0.00 0.50 -0.52 0.00 0.00 177.40 177.38 1r24 s ARG 108 N -3.84 0.48 0.25 1.97 3.52 -1.26 -4.93 118.95 115.13 1r24 s ARG 108 Ca 0.76 -0.24 -0.14 0.00 -0.13 0.00 0.00 55.73 55.98 1r24 s ARG 108 Cb -0.32 0.18 -0.08 0.00 -1.56 0.00 0.00 34.95 33.17 1r24 s ARG 108 CO 0.48 -0.22 0.66 0.00 -0.81 0.00 0.00 175.30 175.41 1r24 s ALA 109 N -2.55 3.44 1.21 6.12 0.00 -1.26 -4.95 121.76 123.78 1r24 s ALA 109 Ca 0.12 -0.04 -0.20 0.00 0.00 0.00 0.00 51.96 51.84 1r24 s ALA 109 Cb 0.02 -2.65 0.29 0.00 0.00 0.00 0.00 23.12 20.78 1r24 s ALA 109 CO -0.04 0.40 1.13 -0.25 0.00 0.00 0.00 175.76 177.00 1r24 n ASP 110 N 0.09 -1.75 -3.69 0.00 9.92 -1.26 -4.83 116.55 115.03 1r24 n ASP 110 Ca 0.00 -1.22 0.02 0.00 -0.53 0.00 0.00 54.79 53.06 1r24 n ASP 110 Cb 0.52 -1.01 0.00 0.00 -0.64 0.00 0.00 41.12 40.00 1r24 n ASP 110 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1r24 s ALA 111 N -3.17 -2.31 0.03 2.24 0.00 0.03 -4.86 121.76 113.71 1r24 s ALA 111 Ca 0.72 0.40 0.02 0.00 0.00 0.00 0.00 51.96 53.09 1r24 s ALA 111 Cb -0.06 0.59 -0.02 0.00 0.00 0.00 0.00 23.12 23.63 1r24 s ALA 111 CO 0.54 -1.09 -0.07 0.00 0.00 0.00 0.00 175.76 175.14 1r24 s ALA 112 N -2.24 0.50 -0.23 0.00 0.00 -1.26 -4.31 121.76 114.23 1r24 s ALA 112 Ca 0.21 -0.58 -0.37 0.00 0.00 0.00 0.00 51.96 51.22 1r24 s ALA 112 Cb 0.03 -0.00 -0.13 0.00 0.00 0.00 0.00 23.12 23.02 1r24 s ALA 112 CO -0.02 0.01 1.92 -0.35 0.00 0.00 0.00 175.76 177.32 1r24 n PRO 113 N 1.96 1.52 -2.75 0.00 -0.04 -1.26 -4.73 135.00 129.71 1r24 n PRO 113 Ca -0.20 0.53 -0.42 0.00 -0.04 0.00 0.00 63.50 63.37 1r24 n PRO 113 Cb 0.56 -2.41 -0.03 0.00 -0.04 0.00 0.00 33.50 31.58 1r24 n PRO 113 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 1r24 s THR 114 N 4.79 4.29 0.87 0.52 -4.23 -1.22 -4.70 115.64 115.96 1r24 s THR 114 Ca 0.99 -0.92 -0.12 0.00 -1.18 0.00 0.00 61.69 60.47 1r24 s THR 114 Cb -0.87 -4.88 0.12 0.00 1.34 0.00 0.00 72.50 68.21 1r24 s THR 114 CO 0.56 -1.69 1.17 0.52 -0.54 0.00 0.00 174.62 174.64 1r24 n VAL 115 N 6.14 0.94 -3.66 2.29 0.31 -1.25 -0.81 118.33 122.29 1r24 n VAL 115 Ca 0.21 -0.10 -0.12 0.00 -0.01 0.00 0.00 64.34 64.33 1r24 n VAL 115 Cb 0.49 -1.09 -0.08 0.00 -0.91 0.00 0.00 33.84 32.25 1r24 n VAL 115 CO 0.00 0.00 0.00 -0.44 -1.32 0.00 0.00 176.83 175.07 1r24 s SER 116 N -2.39 -0.72 0.21 4.52 0.01 -0.90 -4.90 113.70 109.52 1r24 s SER 116 Ca 0.70 1.29 0.09 0.00 1.31 0.00 0.00 55.95 59.34 1r24 s SER 116 Cb -0.26 1.26 -0.04 0.00 0.21 0.00 0.00 66.02 67.19 1r24 s SER 116 CO 0.55 -0.22 -0.05 -0.51 0.41 0.00 0.00 173.24 173.42 1r24 s ILE 117 N 0.81 3.36 -0.10 1.44 2.07 -1.26 -0.37 121.20 127.15 1r24 s ILE 117 Ca -0.04 -1.72 -0.03 0.00 -1.41 0.00 0.00 60.65 57.45 1r24 s ILE 117 Cb -0.05 -2.72 0.05 0.00 0.13 0.00 0.00 42.46 39.87 1r24 s ILE 117 CO -0.06 -0.20 0.09 -0.36 -1.91 0.00 0.00 174.94 172.50 1r24 s PHE 118 N -1.93 0.05 0.55 3.50 0.08 0.13 -4.96 117.98 115.40 1r24 s PHE 118 Ca 0.28 0.10 -0.02 0.00 0.12 0.00 0.00 56.93 57.40 1r24 s PHE 118 Cb -0.08 -0.52 0.02 0.00 -0.57 0.00 0.00 43.02 41.87 1r24 s PHE 118 CO 0.17 -0.34 0.81 -1.25 -0.10 0.00 0.00 175.22 174.51 1r24 s PRO 119 N 2.19 2.81 -0.38 0.24 0.04 -1.26 -2.61 135.00 136.03 1r24 s PRO 119 Ca 0.04 -0.36 -0.39 0.00 0.04 0.00 0.00 61.00 60.33 1r24 s PRO 119 Cb -0.14 -2.41 -0.17 0.00 0.04 0.00 0.00 34.50 31.83 1r24 s PRO 119 CO -0.06 -0.61 1.30 -2.30 0.04 0.00 0.00 177.00 175.37 1r24 n PRO 120 N -2.39 0.00 -0.47 0.56 -0.02 -1.24 -4.93 135.00 126.51 1r24 n PRO 120 Ca 0.04 0.00 -0.28 0.00 -2.02 0.00 0.00 63.50 61.24 1r24 n PRO 120 Cb 0.58 -1.26 0.27 0.00 -0.02 0.00 0.00 33.50 33.07 1r24 n PRO 120 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 1r24 s SER 121 N 2.30 0.58 0.00 2.55 1.04 -1.26 -4.88 113.70 114.03 1r24 s SER 121 Ca 0.87 1.48 0.00 0.00 0.48 0.00 0.00 55.95 58.78 1r24 s SER 121 Cb -1.24 -2.30 0.00 0.00 0.10 0.00 0.00 66.02 62.58 1r24 s SER 121 CO 0.67 -4.45 0.94 -1.20 0.98 0.00 0.00 173.24 170.19 1r24 n SER 122 N -5.08 0.00 0.00 7.02 7.64 -1.26 -2.64 113.62 119.30 1r24 n SER 122 Ca 0.02 0.94 0.00 0.00 1.01 0.00 0.00 58.87 60.85 1r24 n SER 122 Cb 0.54 -0.44 0.00 0.00 -1.01 0.00 0.00 64.21 63.30 1r24 n SER 122 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1r24 n GLU 123 N -1.91 0.00 0.00 1.43 4.71 -1.26 -1.27 120.64 122.34 1r24 n GLU 123 Ca 0.00 0.02 0.00 0.00 -0.01 0.00 0.00 57.16 57.17 1r24 n GLU 123 Cb 0.00 -0.05 0.00 0.00 -1.01 0.00 0.00 31.44 30.38 1r24 n GLU 123 CO 0.00 0.00 0.00 0.94 0.09 0.00 0.00 177.13 178.16 1r24 n GLN 124 N -0.45 0.00 -0.28 3.49 7.27 -1.18 0.12 117.38 126.35 1r24 n GLN 124 Ca 0.00 0.60 0.10 0.00 0.07 0.00 0.00 57.00 57.76 1r24 n GLN 124 Cb 0.00 -0.91 0.24 0.00 2.41 0.00 0.00 30.24 31.98 1r24 n GLN 124 CO 0.00 0.00 0.00 -0.07 0.07 0.00 0.00 177.06 177.06 1r24 h LEU 125 N 0.00 -0.14 -0.89 1.69 3.38 -0.94 5.36 115.31 123.76 1r24 h LEU 125 Ca 0.00 0.20 0.22 0.00 0.09 0.00 0.00 57.88 58.39 1r24 h LEU 125 Cb 0.00 0.30 -0.16 0.00 0.09 0.00 0.00 40.66 40.89 1r24 h LEU 125 CO 0.00 -0.16 0.03 0.74 0.09 0.00 0.00 178.44 179.14 1r24 h THR 126 N 0.17 0.18 0.00 0.22 2.02 0.17 0.11 112.91 115.77 1r24 h THR 126 Ca 0.50 -0.02 0.00 0.00 0.77 0.00 0.00 66.41 67.65 1r24 h THR 126 Cb 0.95 0.10 0.00 0.00 -1.74 0.00 0.00 68.15 67.46 1r24 h THR 126 CO -0.66 0.01 0.00 -1.20 0.37 0.00 0.00 175.52 174.04 1r24 n SER 127 N -5.41 0.62 0.00 4.18 7.64 1.74 -4.79 113.62 117.60 1r24 n SER 127 Ca 0.19 0.61 0.00 0.00 1.01 0.00 0.00 58.87 60.68 1r24 n SER 127 Cb 0.63 -0.76 0.00 0.00 -1.01 0.00 0.00 64.21 63.07 1r24 n SER 127 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1r24 n GLY 128 N 0.48 1.21 4.00 0.23 0.00 0.38 -5.07 105.19 106.42 1r24 n GLY 128 Ca 0.04 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.84 1r24 n GLY 128 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1r24 s GLY 129 N -1.09 1.89 -0.30 -0.02 0.00 -1.22 -0.30 107.32 106.28 1r24 s GLY 129 Ca 0.00 -1.91 0.03 0.00 0.00 0.00 0.00 44.72 42.84 1r24 s GLY 129 CO 0.00 -1.79 0.47 0.00 0.00 0.00 0.00 173.10 171.78 1r24 s ALA 130 N -2.75 -1.54 -0.09 3.20 0.00 9.04 -2.52 121.76 127.11 1r24 s ALA 130 Ca 0.54 0.36 0.00 0.00 0.00 0.00 0.00 51.96 52.87 1r24 s ALA 130 Cb -0.04 -2.24 -0.03 0.00 0.00 0.00 0.00 23.12 20.81 1r24 s ALA 130 CO 0.34 -1.83 -0.09 -1.12 0.00 0.00 0.00 175.76 173.07 1r24 s SER 131 N 2.51 4.42 -0.05 0.00 0.01 -1.25 1.10 113.70 120.44 1r24 s SER 131 Ca 0.10 -0.14 0.06 0.00 1.31 0.00 0.00 55.95 57.29 1r24 s SER 131 Cb -0.11 -1.29 -0.02 0.00 0.21 0.00 0.00 66.02 64.80 1r24 s SER 131 CO -0.26 0.29 -0.23 -0.69 0.41 0.00 0.00 173.24 172.76 1r24 s VAL 132 N -0.36 2.29 0.13 3.43 1.01 0.11 -3.60 120.40 123.41 1r24 s VAL 132 Ca 0.05 -1.00 0.08 0.00 0.00 0.00 0.00 61.98 61.11 1r24 s VAL 132 Cb -0.12 -1.84 -0.04 0.00 0.00 0.00 0.00 36.38 34.38 1r24 s VAL 132 CO 0.02 0.57 -0.10 -0.69 0.00 0.00 0.00 175.10 174.91 1r24 s VAL 133 N -0.39 3.28 -0.07 2.92 1.01 -1.07 -0.84 120.40 125.23 1r24 s VAL 133 Ca 0.03 -1.42 -0.01 0.00 0.00 0.00 0.00 61.98 60.58 1r24 s VAL 133 Cb -0.12 -2.56 0.03 0.00 0.00 0.00 0.00 36.38 33.72 1r24 s VAL 133 CO 0.02 0.03 -0.01 0.00 0.00 0.00 0.00 175.10 175.14 1r24 s PHE 135 N 1.86 2.48 -0.79 0.00 5.99 0.50 -1.61 117.98 126.42 1r24 s PHE 135 Ca 0.03 -1.64 -0.22 0.00 0.00 0.00 0.00 56.93 55.10 1r24 s PHE 135 Cb -0.12 -1.67 0.07 0.00 0.00 0.00 0.00 43.02 41.30 1r24 s PHE 135 CO -0.05 -0.75 1.13 -0.51 -0.00 0.00 0.00 175.22 175.04 1r24 s LEU 136 N 1.37 4.20 0.00 6.12 1.02 -1.15 -2.13 118.68 128.13 1r24 s LEU 136 Ca -0.02 -1.22 0.00 0.00 0.02 0.00 0.00 54.13 52.92 1r24 s LEU 136 Cb -0.16 -2.46 0.00 0.00 0.02 0.00 0.00 46.19 43.59 1r24 s LEU 136 CO -0.08 -1.43 0.00 -3.20 0.02 0.00 0.00 176.35 171.66 1r24 n ASN 137 N 7.89 0.00 0.00 2.29 2.85 0.01 -3.48 115.26 124.82 1r24 n ASN 137 Ca 0.09 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.56 1r24 n ASN 137 Cb 0.48 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.50 1r24 n ASN 137 CO 0.00 0.00 0.00 0.59 -2.11 0.00 0.00 177.26 175.74 1r24 n ASN 138 N 0.00 0.00 -3.54 1.20 4.13 -1.22 -3.42 115.26 112.41 1r24 n ASN 138 Ca 0.00 0.00 -0.08 0.00 1.68 0.00 0.00 54.58 56.18 1r24 n ASN 138 Cb 0.00 0.00 -0.01 0.00 -1.54 0.00 0.00 39.78 38.23 1r24 n ASN 138 CO 0.00 0.00 0.00 0.72 0.28 0.00 0.00 177.26 178.26 1r24 s PHE 139 N 0.00 0.07 -0.24 3.10 -0.12 -0.78 -4.17 117.98 115.84 1r24 s PHE 139 Ca 0.00 -0.57 -0.21 0.00 -0.05 0.00 0.00 56.93 56.09 1r24 s PHE 139 Cb 0.00 0.62 0.06 0.00 -0.63 0.00 0.00 43.02 43.08 1r24 s PHE 139 CO 0.00 -1.30 0.64 -0.47 -0.05 0.00 0.00 175.22 174.04 1r24 s TYR 140 N -3.36 -0.74 0.76 3.49 6.04 -1.26 0.26 117.35 122.55 1r24 s TYR 140 Ca 0.15 1.75 -0.11 0.00 0.04 0.00 0.00 57.07 58.90 1r24 s TYR 140 Cb -0.05 0.29 0.05 0.00 -1.04 0.00 0.00 41.96 41.21 1r24 s TYR 140 CO 0.10 -0.36 1.10 -1.25 -1.54 0.00 0.00 175.55 173.59 1r24 s PRO 141 N 0.52 2.37 0.37 4.97 0.04 -1.26 -0.79 135.00 141.21 1r24 s PRO 141 Ca -0.01 0.57 0.19 0.00 0.04 0.00 0.00 61.00 61.79 1r24 s PRO 141 Cb -0.05 -1.96 1.23 0.00 0.04 0.00 0.00 34.50 33.76 1r24 s PRO 141 CO -0.02 -1.41 1.63 -0.22 0.04 0.00 0.00 177.00 177.03 1r24 h LYS 142 N -0.93 0.18 -6.26 4.56 3.64 -1.97 -3.40 116.57 112.39 1r24 h LYS 142 Ca -0.46 -0.01 -0.56 0.00 -1.27 0.00 0.00 60.65 58.35 1r24 h LYS 142 Cb 1.26 -0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 33.03 1r24 h LYS 142 CO 0.61 0.12 1.14 -0.51 -2.27 0.00 0.00 179.45 178.54 1r24 s ASP 143 N -4.72 6.43 -0.16 4.20 1.01 -1.26 -4.95 116.67 117.22 1r24 s ASP 143 Ca -0.09 1.91 -0.13 0.00 0.71 0.00 0.00 52.55 54.94 1r24 s ASP 143 Cb 0.31 -2.53 0.04 0.00 1.01 0.00 0.00 42.92 41.76 1r24 s ASP 143 CO 0.79 -1.17 0.41 -0.51 0.21 0.00 0.00 175.17 174.90 1r24 s ILE 144 N 4.95 -0.01 -0.17 0.77 -1.16 -1.26 -4.42 121.20 119.89 1r24 s ILE 144 Ca 0.75 0.02 -0.08 0.00 -0.51 0.00 0.00 60.65 60.83 1r24 s ILE 144 Cb -0.29 -0.59 -0.04 0.00 0.61 0.00 0.00 42.46 42.15 1r24 s ILE 144 CO 0.30 0.01 0.09 0.21 -2.81 0.00 0.00 174.94 172.74 1r24 s ASN 145 N 0.49 5.93 0.04 4.50 2.47 -1.24 -5.04 114.94 122.08 1r24 s ASN 145 Ca -0.02 0.19 0.03 0.00 0.42 0.00 0.00 52.86 53.48 1r24 s ASN 145 Cb -0.04 -2.00 -0.02 0.00 -1.45 0.00 0.00 41.25 37.74 1r24 s ASN 145 CO -0.02 0.22 -0.09 -0.69 -3.72 0.00 0.00 177.10 172.80 1r24 s VAL 146 N 0.10 0.65 0.39 -5.21 1.01 -1.26 -3.82 120.40 112.26 1r24 s VAL 146 Ca 0.07 -0.92 0.08 0.00 0.00 0.00 0.00 61.98 61.21 1r24 s VAL 146 Cb -0.12 -0.66 -0.06 0.00 0.00 0.00 0.00 36.38 35.54 1r24 s VAL 146 CO -0.00 -0.21 0.07 -0.54 0.00 0.00 0.00 175.10 174.42 1r24 s LYS 147 N -1.23 2.08 -0.14 2.72 1.02 0.40 -4.90 119.74 119.68 1r24 s LYS 147 Ca -0.05 -1.93 -0.06 0.00 0.02 0.00 0.00 55.97 53.95 1r24 s LYS 147 Cb -0.08 -1.83 0.06 0.00 -0.52 0.00 0.00 37.83 35.46 1r24 s LYS 147 CO 0.01 -0.03 0.32 -1.58 -0.92 0.00 0.00 175.35 173.14 1r24 s TRP 148 N -2.62 -0.50 -0.08 3.18 0.52 -1.25 -1.69 118.94 116.50 1r24 s TRP 148 Ca 0.37 1.08 0.00 0.00 0.02 0.00 0.00 56.10 57.58 1r24 s TRP 148 Cb 0.05 0.12 -0.03 0.00 -1.15 0.00 0.00 33.47 32.46 1r24 s TRP 148 CO 0.20 -0.34 -0.07 0.15 0.02 0.00 0.00 176.95 176.91 1r24 s LYS 149 N 1.86 2.92 -0.21 4.98 1.02 0.76 1.00 119.74 132.06 1r24 s LYS 149 Ca -0.05 -0.56 0.01 0.00 0.02 0.00 0.00 55.97 55.39 1r24 s LYS 149 Cb -0.11 -2.63 0.05 0.00 -0.52 0.00 0.00 37.83 34.62 1r24 s LYS 149 CO -0.10 0.57 -0.09 0.42 -0.92 0.00 0.00 175.35 175.23 1r24 s ILE 150 N -0.56 1.59 -2.03 2.17 1.01 1.92 -2.00 121.20 123.30 1r24 s ILE 150 Ca 0.08 -1.05 0.00 0.00 0.00 0.00 0.00 60.65 59.69 1r24 s ILE 150 Cb -0.12 -1.72 0.00 0.00 0.01 0.00 0.00 42.46 40.64 1r24 s ILE 150 CO 0.02 0.10 0.00 0.47 0.00 0.00 0.00 174.94 175.52 1r24 n ASP 151 N 4.69 -5.30 0.00 3.58 10.43 -1.09 -2.44 116.55 126.42 1r24 n ASP 151 Ca -0.14 0.40 0.00 0.00 2.57 0.00 0.00 54.79 57.62 1r24 n ASP 151 Cb 0.46 -4.65 0.00 0.00 1.84 0.00 0.00 41.12 38.77 1r24 n ASP 151 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 1r24 n GLY 152 N -0.48 0.97 3.33 0.44 0.00 -1.26 -4.93 105.19 103.26 1r24 n GLY 152 Ca -0.21 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.64 1r24 n GLY 152 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1r24 s SER 153 N -1.07 2.23 0.21 1.61 0.15 -1.02 -5.11 113.70 110.69 1r24 s SER 153 Ca 0.00 -1.09 -0.30 0.00 0.70 0.00 0.00 55.95 55.25 1r24 s SER 153 Cb 0.00 -0.08 -0.09 0.00 -1.71 0.00 0.00 66.02 64.14 1r24 s SER 153 CO 0.00 -0.32 1.40 -1.61 1.20 0.00 0.00 173.24 173.91 1r24 s GLU 154 N -3.74 4.31 -0.23 5.44 8.01 -1.25 0.51 118.70 131.75 1r24 s GLU 154 Ca 0.23 2.19 -0.13 0.00 0.01 0.00 0.00 54.97 57.28 1r24 s GLU 154 Cb 0.02 -3.16 -0.04 0.00 -4.31 0.00 0.00 34.13 26.64 1r24 s GLU 154 CO 0.06 -0.37 0.27 0.50 0.01 0.00 0.00 175.26 175.73 1r24 s ARG 155 N -0.01 4.09 0.00 1.61 6.06 6.66 -4.60 118.95 132.77 1r24 s ARG 155 Ca 0.60 -0.07 0.00 0.00 -2.50 0.00 0.00 55.73 53.76 1r24 s ARG 155 Cb -0.40 -3.56 0.00 0.00 0.06 0.00 0.00 34.95 31.06 1r24 s ARG 155 CO 0.39 -0.03 0.00 0.94 -2.50 0.00 0.00 175.30 174.10 1r24 n GLN 156 N 4.52 0.00 -1.41 5.12 -0.06 -1.26 -4.10 117.38 120.19 1r24 n GLN 156 Ca -0.12 0.00 -0.50 0.00 -2.00 0.00 0.00 57.00 54.38 1r24 n GLN 156 Cb 0.52 -0.31 -0.10 0.00 -4.06 0.00 0.00 30.24 26.29 1r24 n GLN 156 CO 0.00 0.00 0.00 0.09 -0.20 0.00 0.00 177.06 176.95 1r24 n ASN 157 N -2.36 1.36 0.00 1.69 4.13 -1.26 -2.49 115.26 116.32 1r24 n ASN 157 Ca 0.00 0.36 0.00 0.00 1.68 0.00 0.00 54.58 56.62 1r24 n ASN 157 Cb 0.00 -1.11 0.00 0.00 -1.54 0.00 0.00 39.78 37.13 1r24 n ASN 157 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1r24 n GLY 158 N 6.78 1.26 3.67 7.41 0.00 -1.26 -4.99 105.19 118.06 1r24 n GLY 158 Ca 0.50 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 46.23 1r24 n GLY 158 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1r24 s VAL 159 N -0.49 2.29 -0.01 1.61 1.01 -1.04 -3.63 120.40 120.15 1r24 s VAL 159 Ca 0.00 0.10 -0.22 0.00 0.00 0.00 0.00 61.98 61.86 1r24 s VAL 159 Cb 0.00 -2.51 0.04 0.00 0.00 0.00 0.00 36.38 33.91 1r24 s VAL 159 CO 0.00 -0.12 0.48 -0.22 0.00 0.00 0.00 175.10 175.23 1r24 s LEU 160 N -6.47 0.15 0.03 3.92 0.20 -0.70 -4.93 118.68 110.88 1r24 s LEU 160 Ca 0.65 0.29 -0.11 0.00 0.69 0.00 0.00 54.13 55.64 1r24 s LEU 160 Cb -0.19 1.89 0.01 0.00 -0.43 0.00 0.00 46.19 47.47 1r24 s LEU 160 CO 0.58 -0.58 0.24 0.20 -0.29 0.00 0.00 176.35 176.51 1r24 s ASN 161 N -1.50 -0.05 -0.01 3.68 -0.87 -1.26 -2.16 114.94 112.77 1r24 s ASN 161 Ca -0.10 -0.22 -0.27 0.00 -1.57 0.00 0.00 52.86 50.70 1r24 s ASN 161 Cb -0.02 0.31 0.06 0.00 -0.02 0.00 0.00 41.25 41.58 1r24 s ASN 161 CO 0.04 -0.54 0.60 -0.44 -2.57 0.00 0.00 177.10 174.20 1r24 s SER 162 N -1.89 -0.56 0.42 -1.22 0.01 -1.23 -5.01 113.70 104.21 1r24 s SER 162 Ca -0.07 0.48 0.08 0.00 1.31 0.00 0.00 55.95 57.74 1r24 s SER 162 Cb -0.02 0.51 -0.02 0.00 0.21 0.00 0.00 66.02 66.70 1r24 s SER 162 CO -0.02 -0.65 0.41 0.26 0.41 0.00 0.00 173.24 173.65 1r24 s TRP 163 N -1.70 2.73 0.87 2.43 0.23 -1.26 -2.61 118.94 119.63 1r24 s TRP 163 Ca -0.09 -0.47 -0.13 0.00 -2.03 0.00 0.00 56.10 53.38 1r24 s TRP 163 Cb -0.01 -2.20 0.15 0.00 0.03 0.00 0.00 33.47 31.44 1r24 s TRP 163 CO 0.05 -0.16 1.22 0.95 0.96 0.00 0.00 176.95 179.97 1r24 s THR 164 N -2.45 2.04 0.02 2.01 -4.23 0.41 -4.87 115.64 108.56 1r24 s THR 164 Ca 0.49 -0.09 0.00 0.00 -1.18 0.00 0.00 61.69 60.92 1r24 s THR 164 Cb -0.04 -2.96 0.00 0.00 1.34 0.00 0.00 72.50 70.85 1r24 s THR 164 CO 0.29 0.00 0.02 -0.67 -0.54 0.00 0.00 174.62 173.72 1r24 n ASP 165 N -3.48 0.04 -4.72 3.99 2.03 -1.26 -4.61 116.55 108.54 1r24 n ASP 165 Ca 0.13 -1.03 -0.42 0.00 0.52 0.00 0.00 54.79 53.99 1r24 n ASP 165 Cb 0.60 -0.01 -0.03 0.00 -0.72 0.00 0.00 41.12 40.96 1r24 n ASP 165 CO 0.00 0.00 0.00 -1.58 -1.92 0.00 0.00 177.20 173.70 1r24 s GLN 166 N -2.30 4.35 -0.08 -0.67 0.74 -1.26 -4.63 119.66 115.81 1r24 s GLN 166 Ca 0.01 2.03 -0.29 0.00 0.05 0.00 0.00 55.36 57.17 1r24 s GLN 166 Cb -0.00 -3.25 -0.02 0.00 1.10 0.00 0.00 33.01 30.84 1r24 s GLN 166 CO 0.01 -0.38 0.95 0.34 -0.55 0.00 0.00 175.29 175.66 1r24 s ASP 167 N 0.96 7.23 0.00 6.67 -1.08 -1.24 -4.84 116.67 124.37 1r24 s ASP 167 Ca 0.62 1.50 0.00 0.00 -0.52 0.00 0.00 52.55 54.15 1r24 s ASP 167 Cb -0.36 -2.54 0.00 0.00 -1.46 0.00 0.00 42.92 38.57 1r24 s ASP 167 CO 0.31 -0.35 0.70 -1.54 0.52 0.00 0.00 175.17 174.82 1r24 n SER 168 N 4.57 0.00 -0.02 -0.34 3.41 -1.26 0.46 113.62 120.44 1r24 n SER 168 Ca 0.06 0.70 -0.12 0.00 -0.26 0.00 0.00 58.87 59.25 1r24 n SER 168 Cb 0.50 -0.33 -0.08 0.00 -0.26 0.00 0.00 64.21 64.04 1r24 n SER 168 CO 0.00 0.00 0.00 0.50 -0.16 0.00 0.00 175.04 175.38 1r24 h LYS 169 N 0.00 -0.45 -0.76 4.33 3.64 -2.00 -3.35 116.57 117.98 1r24 h LYS 169 Ca 0.00 0.03 -0.39 0.00 -1.27 0.00 0.00 60.65 59.02 1r24 h LYS 169 Cb 0.00 0.10 -0.41 0.00 -0.41 0.00 0.00 32.23 31.51 1r24 h LYS 169 CO 0.00 -0.30 -1.01 -0.40 -2.27 0.00 0.00 179.45 175.48 1r24 n ASP 170 N -4.90 2.85 0.00 4.20 5.75 -0.45 -5.01 116.55 118.98 1r24 n ASP 170 Ca -0.05 -2.83 0.00 0.00 -0.01 0.00 0.00 54.79 51.90 1r24 n ASP 170 Cb 0.31 -0.45 0.00 0.00 -1.03 0.00 0.00 41.12 39.95 1r24 n ASP 170 CO 0.00 0.00 0.00 -1.20 -0.11 0.00 0.00 177.20 175.89 1r24 n SER 171 N -0.51 0.00 -4.71 -1.12 7.64 1.64 -4.81 113.62 111.75 1r24 n SER 171 Ca 0.21 0.00 -0.42 0.00 1.01 0.00 0.00 58.87 59.67 1r24 n SER 171 Cb 0.83 -1.14 -0.03 0.00 -1.01 0.00 0.00 64.21 62.87 1r24 n SER 171 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 1r24 s THR 172 N -0.72 4.10 0.67 0.44 -4.23 -1.26 -4.45 115.64 110.20 1r24 s THR 172 Ca 0.00 1.51 0.05 0.00 -1.18 0.00 0.00 61.69 62.06 1r24 s THR 172 Cb 0.00 -3.96 0.12 0.00 1.34 0.00 0.00 72.50 69.99 1r24 s THR 172 CO 0.00 0.11 0.92 -0.31 -0.54 0.00 0.00 174.62 174.79 1r24 s TYR 173 N 1.17 1.30 0.38 3.99 4.12 0.74 -3.61 117.35 125.43 1r24 s TYR 173 Ca 0.58 -0.56 0.04 0.00 0.02 0.00 0.00 57.07 57.15 1r24 s TYR 173 Cb -0.29 -2.59 -0.03 0.00 -1.52 0.00 0.00 41.96 37.53 1r24 s TYR 173 CO 0.28 -1.53 0.11 -1.12 0.02 0.00 0.00 175.55 173.32 1r24 s SER 174 N -4.74 2.55 -0.10 2.29 0.01 -1.26 -1.87 113.70 110.57 1r24 s SER 174 Ca 0.65 -1.59 -0.30 0.00 1.31 0.00 0.00 55.95 56.03 1r24 s SER 174 Cb -0.05 0.35 0.10 0.00 0.21 0.00 0.00 66.02 66.64 1r24 s SER 174 CO 0.42 -0.85 0.87 -0.32 0.41 0.00 0.00 173.24 173.78 1r24 s MET 175 N -3.78 0.79 -0.04 12.44 1.75 -1.23 -0.45 119.30 128.78 1r24 s MET 175 Ca 0.28 0.10 -0.01 0.00 -1.25 0.00 0.00 55.69 54.81 1r24 s MET 175 Cb 0.04 0.37 0.03 0.00 2.84 0.00 0.00 34.83 38.11 1r24 s MET 175 CO 0.15 -0.26 0.02 -1.12 -0.65 0.00 0.00 175.02 173.16 1r24 s SER 176 N -1.36 1.00 0.09 1.11 0.01 -1.07 -2.91 113.70 110.57 1r24 s SER 176 Ca -0.04 0.00 0.03 0.00 1.31 0.00 0.00 55.95 57.26 1r24 s SER 176 Cb -0.00 -0.24 -0.04 0.00 0.21 0.00 0.00 66.02 65.94 1r24 s SER 176 CO 0.02 -0.18 0.08 -0.55 0.41 0.00 0.00 173.24 173.02 1r24 s SER 177 N 1.72 5.49 -0.12 2.44 0.15 -0.63 -3.57 113.70 119.18 1r24 s SER 177 Ca -0.00 -0.04 -0.06 0.00 0.70 0.00 0.00 55.95 56.55 1r24 s SER 177 Cb -0.13 -1.46 0.05 0.00 -1.71 0.00 0.00 66.02 62.78 1r24 s SER 177 CO -0.03 0.16 0.27 -0.89 1.20 0.00 0.00 173.24 173.95 1r24 s THR 178 N -1.44 -0.12 -0.15 6.45 2.01 -0.92 -0.29 115.64 121.19 1r24 s THR 178 Ca 0.29 0.16 -0.08 0.00 0.31 0.00 0.00 61.69 62.38 1r24 s THR 178 Cb -0.12 -0.43 -0.04 0.00 0.01 0.00 0.00 72.50 71.92 1r24 s THR 178 CO 0.22 0.07 0.12 -0.76 -0.69 0.00 0.00 174.62 173.57 1r24 s LEU 179 N 1.51 4.20 -0.25 4.42 1.43 -0.02 -1.72 118.68 128.25 1r24 s LEU 179 Ca -0.07 0.32 -0.10 0.00 -1.03 0.00 0.00 54.13 53.25 1r24 s LEU 179 Cb -0.10 -2.04 -0.05 0.00 0.03 0.00 0.00 46.19 44.03 1r24 s LEU 179 CO -0.09 0.31 0.15 -0.89 0.23 0.00 0.00 176.35 176.06 1r24 s THR 180 N -0.42 5.21 0.11 5.49 2.01 -1.24 0.08 115.64 126.87 1r24 s THR 180 Ca 0.11 0.13 0.08 0.00 0.31 0.00 0.00 61.69 62.32 1r24 s THR 180 Cb -0.12 -3.44 -0.03 0.00 0.01 0.00 0.00 72.50 68.92 1r24 s THR 180 CO 0.02 0.33 -0.19 -0.76 -0.69 0.00 0.00 174.62 173.32 1r24 s LEU 181 N 1.23 2.32 0.93 4.42 1.43 8.21 -4.90 118.68 132.31 1r24 s LEU 181 Ca 0.07 -0.70 -0.10 0.00 -1.03 0.00 0.00 54.13 52.36 1r24 s LEU 181 Cb -0.14 -0.80 0.15 0.00 0.03 0.00 0.00 46.19 45.43 1r24 s LEU 181 CO 0.06 0.01 1.13 -0.89 0.23 0.00 0.00 176.35 176.89 1r24 s THR 182 N -1.34 2.16 0.12 5.49 2.01 -1.26 1.16 115.64 123.98 1r24 s THR 182 Ca 0.06 0.05 -0.13 0.00 0.31 0.00 0.00 61.69 61.98 1r24 s THR 182 Cb -0.09 -2.12 -0.07 0.00 0.01 0.00 0.00 72.50 70.23 1r24 s THR 182 CO 0.04 -0.07 1.44 0.50 -0.69 0.00 0.00 174.62 175.84 1r24 h LYS 183 N -1.89 0.81 -1.05 4.92 3.64 -0.35 -3.15 116.57 119.50 1r24 h LYS 183 Ca -0.45 -0.44 0.27 0.00 -1.27 0.00 0.00 60.65 58.77 1r24 h LYS 183 Cb 1.27 0.02 -0.09 0.00 -0.41 0.00 0.00 32.23 33.02 1r24 h LYS 183 CO 0.43 1.07 0.69 -0.44 -2.27 0.00 0.00 179.45 178.93 1r24 h ASP 184 N 0.59 0.39 -0.33 4.20 3.32 -1.90 0.38 116.42 123.06 1r24 h ASP 184 Ca 0.05 0.07 0.00 0.00 0.02 0.00 0.00 57.03 57.17 1r24 h ASP 184 Cb 0.93 0.01 0.00 0.00 0.22 0.00 0.00 39.33 40.49 1r24 h ASP 184 CO 0.08 0.07 0.00 1.21 -1.72 0.00 0.00 179.24 178.89 1r24 n GLU 185 N -4.57 2.33 -0.05 3.56 2.13 -1.25 -1.24 120.64 121.55 1r24 n GLU 185 Ca 0.25 -2.01 -0.09 0.00 0.66 0.00 0.00 57.16 55.97 1r24 n GLU 185 Cb 0.92 -1.49 -0.08 0.00 0.27 0.00 0.00 31.44 31.06 1r24 n GLU 185 CO 0.00 0.00 0.00 -0.92 -0.41 0.00 0.00 177.13 175.80 1r24 h TYR 186 N 3.99 -0.02 0.00 4.31 -0.00 -1.24 -2.22 116.97 121.80 1r24 h TYR 186 Ca 0.00 -0.00 -0.00 0.00 -0.00 0.00 0.00 58.73 58.72 1r24 h TYR 186 Cb 0.88 0.01 -0.00 0.00 -0.00 0.00 0.00 36.73 37.61 1r24 h TYR 186 CO 0.21 0.61 -0.02 0.93 -0.00 0.00 0.00 178.16 179.89 1r24 h GLU 187 N -0.98 0.00 -1.93 1.82 5.08 -0.23 -2.28 114.58 116.07 1r24 h GLU 187 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1r24 h GLU 187 Cb 0.63 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.88 1r24 h GLU 187 CO 0.00 0.02 0.00 0.54 -1.00 0.00 0.00 179.01 178.58 1r24 n ARG 188 N -4.21 0.15 -3.77 2.33 1.74 -0.37 -4.89 116.66 107.63 1r24 n ARG 188 Ca -0.03 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.05 1r24 n ARG 188 Cb 0.11 -1.43 0.00 0.00 -1.02 0.00 0.00 32.46 30.12 1r24 n ARG 188 CO 0.00 0.00 0.00 -1.01 -1.52 0.00 0.00 177.63 175.10 1r24 s HIS 189 N 1.28 -0.02 0.00 -1.55 3.76 -0.86 -5.02 115.29 112.87 1r24 s HIS 189 Ca 0.00 -0.17 0.00 0.00 -0.15 0.00 0.00 55.06 54.74 1r24 s HIS 189 Cb 0.00 0.59 0.00 0.00 1.11 0.00 0.00 32.58 34.28 1r24 s HIS 189 CO 0.00 -0.47 0.00 0.09 -0.85 0.00 0.00 174.74 173.51 1r24 n ASN 190 N -0.74 0.00 -4.70 1.40 3.02 -1.26 -5.02 115.26 107.96 1r24 n ASN 190 Ca -0.04 0.00 -0.23 0.00 -0.03 0.00 0.00 54.58 54.28 1r24 n ASN 190 Cb 0.61 0.06 -0.06 0.00 -0.61 0.00 0.00 39.78 39.78 1r24 n ASN 190 CO 0.00 0.00 0.00 -0.44 -2.62 0.00 0.00 177.26 174.20 1r24 s SER 191 N -3.63 4.81 -0.04 6.41 0.01 -1.26 -4.93 113.70 115.06 1r24 s SER 191 Ca 0.00 -0.56 0.05 0.00 1.31 0.00 0.00 55.95 56.75 1r24 s SER 191 Cb 0.00 -0.98 -0.01 0.00 0.21 0.00 0.00 66.02 65.25 1r24 s SER 191 CO 0.00 -0.04 -0.20 -0.31 0.41 0.00 0.00 173.24 173.10 1r24 s TYR 192 N -2.29 1.94 -0.02 2.43 2.02 -1.26 -2.65 117.35 117.52 1r24 s TYR 192 Ca 0.32 -0.55 0.01 0.00 -0.37 0.00 0.00 57.07 56.49 1r24 s TYR 192 Cb -0.06 -1.29 0.01 0.00 -0.40 0.00 0.00 41.96 40.22 1r24 s TYR 192 CO 0.21 -0.17 -0.02 0.99 -1.57 0.00 0.00 175.55 174.99 1r24 s THR 193 N -0.07 0.27 -0.14 -0.71 2.01 -0.85 -4.91 115.64 111.24 1r24 s THR 193 Ca -0.03 -0.05 -0.06 0.00 0.31 0.00 0.00 61.69 61.86 1r24 s THR 193 Cb -0.12 -0.30 -0.04 0.00 0.01 0.00 0.00 72.50 72.05 1r24 s THR 193 CO 0.02 0.13 0.09 0.00 -0.69 0.00 0.00 174.62 174.17 1r24 s GLU 195 N -0.42 0.34 -0.01 0.00 2.12 -0.68 -4.63 118.70 115.42 1r24 s GLU 195 Ca 0.10 0.51 0.01 0.00 0.36 0.00 0.00 54.97 55.96 1r24 s GLU 195 Cb -0.12 0.08 0.00 0.00 0.26 0.00 0.00 34.13 34.36 1r24 s GLU 195 CO 0.02 -0.09 -0.03 0.00 -0.54 0.00 0.00 175.26 174.62 1r24 s ALA 196 N 0.60 0.31 0.89 6.30 0.00 0.08 0.15 121.76 130.09 1r24 s ALA 196 Ca -0.04 -0.10 -0.13 0.00 0.00 0.00 0.00 51.96 51.69 1r24 s ALA 196 Cb -0.05 -0.12 0.15 0.00 0.00 0.00 0.00 23.12 23.10 1r24 s ALA 196 CO -0.04 0.05 1.24 0.99 0.00 0.00 0.00 175.76 178.00 1r24 s THR 197 N 0.10 2.03 0.00 0.00 2.01 -1.25 0.98 115.64 119.51 1r24 s THR 197 Ca -0.01 -0.06 0.00 0.00 0.31 0.00 0.00 61.69 61.93 1r24 s THR 197 Cb -0.04 -2.97 0.00 0.00 0.01 0.00 0.00 72.50 69.51 1r24 s THR 197 CO -0.00 0.00 0.00 1.57 -0.69 0.00 0.00 174.62 175.50 1r24 n HIS 198 N -3.52 0.00 0.03 4.92 -0.00 -1.26 -3.68 115.22 111.71 1r24 n HIS 198 Ca 0.13 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.85 1r24 n HIS 198 Cb 0.60 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 30.59 1r24 n HIS 198 CO 0.00 0.00 0.00 1.17 -0.00 0.00 0.00 176.34 177.51 1r24 n LYS 199 N 0.00 0.00 -0.52 1.57 4.81 -1.26 -1.09 118.16 121.67 1r24 n LYS 199 Ca 0.00 0.10 0.06 0.00 -0.87 0.00 0.00 58.31 57.61 1r24 n LYS 199 Cb 0.00 -0.27 0.28 0.00 0.02 0.00 0.00 35.03 35.06 1r24 n LYS 199 CO 0.00 0.00 0.00 0.25 1.17 0.00 0.00 177.40 178.82 1r24 n THR 200 N -0.71 1.56 -2.16 3.15 -2.24 -1.26 -4.94 114.28 107.68 1r24 n THR 200 Ca 0.00 -0.92 0.00 0.00 -2.27 0.00 0.00 64.05 60.86 1r24 n THR 200 Cb 0.11 -0.08 0.00 0.00 -2.10 0.00 0.00 70.33 68.26 1r24 n THR 200 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 1r24 n SER 201 N 0.70 0.00 0.00 3.42 2.88 -0.25 -4.97 113.62 115.40 1r24 n SER 201 Ca 0.20 -0.04 0.00 0.00 -1.33 0.00 0.00 58.87 57.70 1r24 n SER 201 Cb 0.77 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.23 1r24 n SER 201 CO 0.00 0.00 0.00 0.41 -1.23 0.00 0.00 175.04 174.22 1r24 n THR 202 N 0.00 0.00 -2.61 2.46 -1.04 -1.26 -4.77 114.28 107.06 1r24 n THR 202 Ca 0.00 0.00 -0.36 0.00 -2.04 0.00 0.00 64.05 61.65 1r24 n THR 202 Cb 0.00 0.00 -0.05 0.00 -1.82 0.00 0.00 70.33 68.46 1r24 n THR 202 CO 0.00 0.00 0.00 -0.94 -0.64 0.00 0.00 175.07 173.49 1r24 s SER 203 N -1.46 6.86 1.13 8.00 1.04 -1.26 -4.98 113.70 123.04 1r24 s SER 203 Ca 0.00 1.97 -0.17 0.00 0.48 0.00 0.00 55.95 58.22 1r24 s SER 203 Cb 0.00 -2.58 0.15 0.00 0.10 0.00 0.00 66.02 63.69 1r24 s SER 203 CO 0.00 -0.41 0.24 -2.65 0.98 0.00 0.00 173.24 171.39 1r24 n PRO 204 N -0.04 -1.77 -4.99 4.02 -0.02 -1.26 -4.81 135.00 126.12 1r24 n PRO 204 Ca 0.05 -0.50 -0.32 0.00 -2.02 0.00 0.00 63.50 60.72 1r24 n PRO 204 Cb 0.50 -1.81 -0.14 0.00 -0.02 0.00 0.00 33.50 32.03 1r24 n PRO 204 CO 0.00 0.00 0.00 -1.50 1.98 0.00 0.00 175.50 175.98 1r24 s ILE 205 N -2.28 2.60 0.00 4.25 -1.16 0.28 -4.89 121.20 120.00 1r24 s ILE 205 Ca 0.59 -0.99 0.00 0.00 -0.51 0.00 0.00 60.65 59.74 1r24 s ILE 205 Cb -0.15 -2.00 0.00 0.00 0.61 0.00 0.00 42.46 40.92 1r24 s ILE 205 CO 0.66 0.52 0.00 0.52 -2.81 0.00 0.00 174.94 173.83