#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x5o s SER 2 N 0.00 2.05 -0.51 1.61 0.01 -1.26 -5.09 113.70 110.51 1x5o s SER 2 Ca 0.00 -0.43 -0.27 0.00 1.31 0.00 0.00 55.95 56.56 1x5o s SER 2 Cb 0.00 -0.25 -0.04 0.00 0.21 0.00 0.00 66.02 65.94 1x5o s SER 2 CO 0.00 -0.32 2.08 -0.55 0.41 0.00 0.00 173.24 174.86 1x5o s SER 3 N 2.12 5.05 -0.02 2.44 0.15 -1.26 -4.86 113.70 117.32 1x5o s SER 3 Ca 0.03 0.82 -0.30 0.00 0.70 0.00 0.00 55.95 57.19 1x5o s SER 3 Cb -0.15 -2.52 0.12 0.00 -1.71 0.00 0.00 66.02 61.76 1x5o s SER 3 CO -0.07 -2.46 1.27 -0.83 1.20 0.00 0.00 173.24 172.35 1x5o s GLY 4 N 9.38 -0.40 -0.29 9.45 0.00 -1.26 -5.17 107.32 119.03 1x5o s GLY 4 Ca 0.82 0.71 -0.14 0.00 0.00 0.00 0.00 44.72 46.11 1x5o s GLY 4 CO 0.25 0.13 0.71 -1.35 0.00 0.00 0.00 173.10 172.85 1x5o s SER 5 N -2.95 -0.97 0.94 1.64 1.04 -1.26 -5.16 113.70 106.99 1x5o s SER 5 Ca 0.14 1.44 -0.16 0.00 0.48 0.00 0.00 55.95 57.85 1x5o s SER 5 Cb 0.04 1.76 -0.09 0.00 0.10 0.00 0.00 66.02 67.83 1x5o s SER 5 CO -0.04 -0.22 -0.36 -0.24 0.98 0.00 0.00 173.24 173.37 1x5o n SER 6 N 4.76 -4.56 -3.90 7.02 2.88 -1.26 -4.91 113.62 113.65 1x5o n SER 6 Ca -0.16 0.27 -0.29 0.00 -1.33 0.00 0.00 58.87 57.36 1x5o n SER 6 Cb 0.55 -0.91 0.27 0.00 -0.75 0.00 0.00 64.21 63.37 1x5o n SER 6 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 1x5o s GLY 7 N -1.31 1.47 -0.53 0.46 0.00 -1.26 -4.93 107.32 101.22 1x5o s GLY 7 Ca 0.47 -0.53 -0.21 0.00 0.00 0.00 0.00 44.72 44.45 1x5o s GLY 7 CO 0.76 0.36 0.75 -2.27 0.00 0.00 0.00 173.10 172.70 1x5o s LEU 8 N -7.59 4.67 0.22 0.66 0.20 -1.26 -5.04 118.68 110.53 1x5o s LEU 8 Ca 0.69 -0.75 0.05 0.00 0.69 0.00 0.00 54.13 54.81 1x5o s LEU 8 Cb -0.18 -2.57 -0.03 0.00 -0.43 0.00 0.00 46.19 42.97 1x5o s LEU 8 CO 0.61 -1.03 0.27 -0.75 -0.29 0.00 0.00 176.35 175.16 1x5o s LYS 9 N 3.13 3.22 0.60 1.98 2.20 -1.26 -5.12 119.74 124.49 1x5o s LYS 9 Ca 0.20 -0.83 -0.05 0.00 -0.36 0.00 0.00 55.97 54.93 1x5o s LYS 9 Cb -0.17 -2.77 0.02 0.00 -1.51 0.00 0.00 37.83 33.40 1x5o s LYS 9 CO 0.14 0.44 0.89 0.00 -0.36 0.00 0.00 175.35 176.47 1x5o s ALA 10 N -1.96 3.38 -0.02 3.13 0.00 -1.26 -5.11 121.76 119.92 1x5o s ALA 10 Ca 0.33 -0.87 0.00 0.00 0.00 0.00 0.00 51.96 51.42 1x5o s ALA 10 Cb -0.09 -2.49 0.02 0.00 0.00 0.00 0.00 23.12 20.56 1x5o s ALA 10 CO 0.27 -0.89 0.01 -1.12 0.00 0.00 0.00 175.76 174.03 1x5o s SER 11 N -4.37 0.21 -0.21 0.00 0.01 -1.26 -5.15 113.70 102.94 1x5o s SER 11 Ca 0.55 0.01 -0.18 0.00 1.31 0.00 0.00 55.95 57.64 1x5o s SER 11 Cb -0.11 -0.12 0.06 0.00 0.21 0.00 0.00 66.02 66.06 1x5o s SER 11 CO 0.43 -0.10 0.55 -0.83 0.41 0.00 0.00 173.24 173.71 1x5o s GLY 12 N 0.91 -0.42 -0.31 3.44 0.00 -1.26 -5.13 107.32 104.54 1x5o s GLY 12 Ca -0.08 1.63 -0.25 0.00 0.00 0.00 0.00 44.72 46.02 1x5o s GLY 12 CO -0.02 1.47 0.87 0.54 0.00 0.00 0.00 173.10 175.96 1x5o s VAL 13 N 0.52 4.71 0.31 1.40 0.11 -1.26 -4.93 120.40 121.27 1x5o s VAL 13 Ca -0.02 1.32 0.07 0.00 -2.93 0.00 0.00 61.98 60.42 1x5o s VAL 13 Cb -0.04 -4.23 0.38 0.00 -1.53 0.00 0.00 36.38 30.96 1x5o s VAL 13 CO -0.02 -0.32 1.50 1.67 -3.33 0.00 0.00 175.10 174.59 1x5o n GLN 14 N 6.40 -0.07 -2.40 1.54 0.00 -1.26 -3.17 117.38 118.41 1x5o n GLN 14 Ca 0.06 1.40 -0.37 0.00 -0.00 0.00 0.00 57.00 58.08 1x5o n GLN 14 Cb 0.48 -2.30 -0.03 0.00 0.00 0.00 0.00 30.24 28.39 1x5o n GLN 14 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1x5o s ALA 15 N -5.80 2.55 0.65 1.69 0.00 -1.26 -4.97 121.76 114.62 1x5o s ALA 15 Ca -0.11 -2.28 -0.17 0.00 0.00 0.00 0.00 51.96 49.40 1x5o s ALA 15 Cb 0.29 -4.59 -0.03 0.00 0.00 0.00 0.00 23.12 18.80 1x5o s ALA 15 CO 0.74 -3.97 0.92 1.04 0.00 0.00 0.00 175.76 174.49 1x5o n GLN 16 N 8.67 0.70 -4.86 0.00 1.13 -1.19 -5.02 117.38 116.82 1x5o n GLN 16 Ca 0.40 0.29 -0.27 0.00 -1.94 0.00 0.00 57.00 55.47 1x5o n GLN 16 Cb 0.48 -2.15 -0.15 0.00 0.11 0.00 0.00 30.24 28.53 1x5o n GLN 16 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1x5o s MET 17 N -2.95 1.62 -0.17 -1.09 0.23 -1.26 -5.05 119.30 110.63 1x5o s MET 17 Ca 0.75 -0.93 -0.21 0.00 -1.03 0.00 0.00 55.69 54.26 1x5o s MET 17 Cb -0.39 -1.69 -0.22 0.00 -1.53 0.00 0.00 34.83 31.00 1x5o s MET 17 CO 0.48 0.44 0.39 0.00 -2.03 0.00 0.00 175.02 174.31 1x5o h ALA 18 N 5.09 0.20 -2.56 3.16 0.00 -2.05 -3.46 119.26 119.64 1x5o h ALA 18 Ca -0.43 -1.06 -0.53 0.00 0.00 0.00 0.00 54.91 52.90 1x5o h ALA 18 Cb 1.15 0.55 0.04 0.00 0.00 0.00 0.00 17.79 19.52 1x5o h ALA 18 CO 0.45 0.61 0.98 0.15 0.00 0.00 0.00 179.25 181.43 1x5o s LYS 19 N -2.36 4.18 -0.10 0.00 1.02 -1.26 -4.94 119.74 116.28 1x5o s LYS 19 Ca -0.25 2.45 -0.30 0.00 0.02 0.00 0.00 55.97 57.89 1x5o s LYS 19 Cb 0.04 -3.32 -0.03 0.00 -0.52 0.00 0.00 37.83 34.00 1x5o s LYS 19 CO 0.65 -0.71 1.29 -0.65 -0.92 0.00 0.00 175.35 175.01 1x5o s GLN 20 N 1.79 4.27 -0.14 1.68 -0.21 -1.26 -4.99 119.66 120.80 1x5o s GLN 20 Ca 0.74 1.75 -0.27 0.00 0.02 0.00 0.00 55.36 57.60 1x5o s GLN 20 Cb -0.44 -3.69 -0.01 0.00 1.00 0.00 0.00 33.01 29.87 1x5o s GLN 20 CO 0.32 -0.61 0.91 -1.14 -2.12 0.00 0.00 175.29 172.65 1x5o s GLN 21 N 2.96 4.35 0.45 2.91 2.00 -1.26 -5.04 119.66 126.04 1x5o s GLN 21 Ca 0.58 1.18 -0.18 0.00 -2.00 0.00 0.00 55.36 54.94 1x5o s GLN 21 Cb -0.25 -3.56 -0.09 0.00 0.80 0.00 0.00 33.01 29.91 1x5o s GLN 21 CO 0.20 -0.32 0.93 -2.00 -0.50 0.00 0.00 175.29 173.60 1x5o s GLU 22 N 2.08 4.06 -0.17 1.67 2.12 -1.26 -5.06 118.70 122.15 1x5o s GLU 22 Ca 0.43 0.96 -0.08 0.00 0.36 0.00 0.00 54.97 56.65 1x5o s GLU 22 Cb -0.17 -2.20 -0.04 0.00 0.26 0.00 0.00 34.13 31.97 1x5o s GLU 22 CO 0.15 -0.11 0.09 1.14 -0.54 0.00 0.00 175.26 175.99 1x5o s GLN 23 N -3.56 3.86 -0.55 4.30 -2.07 -1.26 -4.78 119.66 115.61 1x5o s GLN 23 Ca 0.59 -0.28 0.06 0.00 -1.82 0.00 0.00 55.36 53.91 1x5o s GLN 23 Cb -0.10 -3.23 0.22 0.00 -1.09 0.00 0.00 33.01 28.82 1x5o s GLN 23 CO 0.22 0.40 0.56 -3.47 -1.32 0.00 0.00 175.29 171.68 1x5o n ASP 24 N 3.15 1.88 0.00 12.60 2.03 -1.26 -4.91 116.55 130.03 1x5o n ASP 24 Ca -0.17 -3.00 0.07 0.00 0.52 0.00 0.00 54.79 52.21 1x5o n ASP 24 Cb 0.53 -0.66 0.33 0.00 -0.72 0.00 0.00 41.12 40.60 1x5o n ASP 24 CO 0.00 0.00 0.00 -0.81 -1.92 0.00 0.00 177.20 174.47 1x5o n PRO 25 N 1.57 0.10 -0.36 -0.67 -0.04 -1.26 -3.55 135.00 130.79 1x5o n PRO 25 Ca 0.25 0.20 0.28 0.00 -0.04 0.00 0.00 63.50 64.20 1x5o n PRO 25 Cb 0.44 -1.50 0.54 0.00 -0.04 0.00 0.00 33.50 32.94 1x5o n PRO 25 CO 0.00 0.00 0.00 1.79 -0.04 0.00 0.00 175.50 177.25 1x5o h THR 26 N 0.00 0.27 -4.41 0.52 1.35 -1.89 -3.40 112.91 105.35 1x5o h THR 26 Ca 0.00 -0.09 -0.50 0.00 -0.55 0.00 0.00 66.41 65.28 1x5o h THR 26 Cb 0.19 -0.00 0.07 0.00 -1.73 0.00 0.00 68.15 66.68 1x5o h THR 26 CO 0.00 0.05 0.41 0.20 -0.25 0.00 0.00 175.52 175.93 1x5o s ASN 27 N -4.83 5.70 -0.02 5.36 -0.87 -1.23 -2.35 114.94 116.71 1x5o s ASN 27 Ca -0.09 1.21 0.02 0.00 -1.57 0.00 0.00 52.86 52.43 1x5o s ASN 27 Cb 0.29 -2.10 0.00 0.00 -0.02 0.00 0.00 41.25 39.43 1x5o s ASN 27 CO 0.80 -1.18 -0.05 -0.76 -2.57 0.00 0.00 177.10 173.34 1x5o s LEU 28 N -5.29 1.78 -0.62 0.60 1.43 -0.72 -3.58 118.68 112.28 1x5o s LEU 28 Ca 0.57 -0.11 -0.20 0.00 -1.03 0.00 0.00 54.13 53.36 1x5o s LEU 28 Cb -0.11 -0.35 0.10 0.00 0.03 0.00 0.00 46.19 45.86 1x5o s LEU 28 CO 0.52 0.03 0.79 -0.47 0.23 0.00 0.00 176.35 177.45 1x5o s TYR 29 N 0.20 2.91 -0.16 0.29 6.14 -0.47 -3.64 117.35 122.62 1x5o s TYR 29 Ca -0.02 -0.86 -0.05 0.00 0.64 0.00 0.00 57.07 56.78 1x5o s TYR 29 Cb -0.06 -4.10 -0.03 0.00 0.42 0.00 0.00 41.96 38.19 1x5o s TYR 29 CO -0.00 -1.40 -0.01 0.42 0.64 0.00 0.00 175.55 175.20 1x5o s ILE 30 N 3.07 4.14 0.23 3.14 1.01 -1.12 -1.91 121.20 129.76 1x5o s ILE 30 Ca 0.15 -0.27 0.04 0.00 0.00 0.00 0.00 60.65 60.56 1x5o s ILE 30 Cb -0.22 -2.83 -0.01 0.00 0.01 0.00 0.00 42.46 39.41 1x5o s ILE 30 CO 0.07 0.49 0.13 -1.20 0.00 0.00 0.00 174.94 174.43 1x5o n SER 31 N 3.49 0.41 -3.03 3.58 7.64 -0.48 -0.93 113.62 124.30 1x5o n SER 31 Ca -0.17 -2.36 -0.17 0.00 1.01 0.00 0.00 58.87 57.17 1x5o n SER 31 Cb 0.52 0.83 0.07 0.00 -1.01 0.00 0.00 64.21 64.62 1x5o n SER 31 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 1x5o n ASN 32 N -1.93 -4.19 -4.87 6.43 4.13 0.67 -2.93 115.26 112.57 1x5o n ASN 32 Ca 0.00 -0.47 -0.27 0.00 1.68 0.00 0.00 54.58 55.52 1x5o n ASN 32 Cb 0.38 -4.26 -0.04 0.00 -1.54 0.00 0.00 39.78 34.31 1x5o n ASN 32 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 1x5o s LEU 33 N -5.96 4.09 0.19 3.41 1.43 -0.76 -4.59 118.68 116.49 1x5o s LEU 33 Ca 0.29 0.04 -0.30 0.00 -1.03 0.00 0.00 54.13 53.13 1x5o s LEU 33 Cb -0.13 -2.69 -0.09 0.00 0.03 0.00 0.00 46.19 43.32 1x5o s LEU 33 CO 0.60 0.07 1.31 -2.16 0.23 0.00 0.00 176.35 176.41 1x5o s PRO 34 N -3.08 4.39 0.28 1.29 0.04 -1.26 -4.11 135.00 132.54 1x5o s PRO 34 Ca 0.33 2.05 0.15 0.00 0.04 0.00 0.00 61.00 63.56 1x5o s PRO 34 Cb -0.11 -3.20 0.80 0.00 0.04 0.00 0.00 34.50 32.03 1x5o s PRO 34 CO 0.26 -0.27 1.38 1.28 0.04 0.00 0.00 177.00 179.70 1x5o n LEU 35 N 2.77 0.38 -1.50 -3.56 4.77 -1.26 0.54 117.00 119.15 1x5o n LEU 35 Ca 0.07 0.61 0.08 0.00 -0.03 0.00 0.00 56.01 56.74 1x5o n LEU 35 Cb 0.43 -0.62 0.32 0.00 -2.33 0.00 0.00 43.42 41.23 1x5o n LEU 35 CO 0.58 -0.74 0.77 -1.20 -1.33 0.00 0.00 177.39 175.46 1x5o n SER 36 N -2.04 4.43 -4.76 -1.43 7.64 -1.26 -4.50 113.62 111.69 1x5o n SER 36 Ca -0.01 -2.47 -0.39 0.00 1.01 0.00 0.00 58.87 57.00 1x5o n SER 36 Cb 0.18 -0.57 -0.05 0.00 -1.01 0.00 0.00 64.21 62.77 1x5o n SER 36 CO 0.00 0.00 0.00 -0.32 -3.01 0.00 0.00 175.04 171.71 1x5o s MET 37 N -1.96 4.62 0.14 1.43 0.00 0.19 -5.01 119.30 118.71 1x5o s MET 37 Ca 0.46 1.60 0.09 0.00 0.00 0.00 0.00 55.69 57.84 1x5o s MET 37 Cb 0.30 -3.06 -0.04 0.00 0.00 0.00 0.00 34.83 32.04 1x5o s MET 37 CO 0.20 0.26 -0.21 0.16 0.00 0.00 0.00 175.02 175.43 1x5o s ASP 38 N -1.18 2.83 0.56 1.11 -4.77 -1.26 -4.99 116.67 108.97 1x5o s ASP 38 Ca 0.46 -0.79 0.43 0.00 -3.30 0.00 0.00 52.55 49.36 1x5o s ASP 38 Cb -0.27 -0.17 1.60 0.00 -1.09 0.00 0.00 42.92 42.99 1x5o s ASP 38 CO 0.34 0.05 1.64 -0.33 0.70 0.00 0.00 175.17 177.57 1x5o h GLU 39 N 3.62 0.00 0.02 2.11 5.08 -1.96 -1.36 114.58 122.08 1x5o h GLU 39 Ca -0.45 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 57.91 1x5o h GLU 39 Cb 1.19 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.44 1x5o h GLU 39 CO 0.45 0.00 -0.01 0.37 -1.00 0.00 0.00 179.01 178.82 1x5o h GLN 40 N 0.00 -0.03 -0.53 2.33 4.15 -1.99 -3.11 115.11 115.93 1x5o h GLN 40 Ca 0.75 0.00 0.08 0.00 0.77 0.00 0.00 58.65 60.26 1x5o h GLN 40 Cb 3.10 0.01 -0.10 0.00 0.21 0.00 0.00 27.48 30.70 1x5o h GLN 40 CO -0.01 -0.02 -0.42 1.49 -1.93 0.00 0.00 178.83 177.95 1x5o h GLU 41 N -0.03 -0.24 -1.77 1.69 4.57 -1.68 0.45 114.58 117.57 1x5o h GLU 41 Ca -0.00 0.02 0.53 0.00 -1.18 0.00 0.00 59.36 58.73 1x5o h GLU 41 Cb 0.02 0.05 -0.09 0.00 -0.16 0.00 0.00 28.75 28.57 1x5o h GLU 41 CO 0.00 -0.16 1.24 -0.11 -1.18 0.00 0.00 179.01 178.81 1x5o n LEU 42 N -5.41 0.06 -0.09 1.64 7.94 -0.93 0.11 117.00 120.32 1x5o n LEU 42 Ca 0.01 1.08 -0.23 0.00 -1.11 0.00 0.00 56.01 55.76 1x5o n LEU 42 Cb 0.35 -0.54 -0.12 0.00 0.53 0.00 0.00 43.42 43.64 1x5o n LEU 42 CO 0.00 -1.11 -0.86 1.21 -1.11 0.00 0.00 177.39 175.52 1x5o n GLU 43 N -4.10 0.63 -0.36 1.96 2.13 0.13 -4.02 120.64 117.02 1x5o n GLU 43 Ca 0.42 0.39 0.26 0.00 0.66 0.00 0.00 57.16 58.90 1x5o n GLU 43 Cb 1.85 -1.67 0.53 0.00 0.27 0.00 0.00 31.44 32.42 1x5o n GLU 43 CO 0.00 0.00 0.00 -0.91 -0.41 0.00 0.00 177.13 175.81 1x5o h ASN 44 N -0.63 0.43 -0.32 4.31 2.35 0.25 1.57 115.58 123.54 1x5o h ASN 44 Ca -0.46 0.12 -0.13 0.00 -0.55 0.00 0.00 56.30 55.28 1x5o h ASN 44 Cb 1.61 0.06 -0.01 0.00 0.05 0.00 0.00 38.32 40.03 1x5o h ASN 44 CO -0.16 -0.02 -0.29 0.00 -1.65 0.00 0.00 177.43 175.31 1x5o h MET 45 N 0.32 0.83 -0.00 0.81 -0.00 -1.30 -2.88 114.93 112.71 1x5o h MET 45 Ca 0.68 -0.38 0.00 0.00 -0.00 0.00 0.00 59.70 60.00 1x5o h MET 45 Cb 1.77 -0.02 0.00 0.00 -0.00 0.00 0.00 31.60 33.35 1x5o h MET 45 CO -0.40 1.01 -0.39 1.28 -0.00 0.00 0.00 176.91 178.42 1x5o n LEU 46 N -4.09 0.83 0.49 -0.10 4.77 0.20 -4.29 117.00 114.82 1x5o n LEU 46 Ca -0.01 -0.17 -0.20 0.00 -0.03 0.00 0.00 56.01 55.60 1x5o n LEU 46 Cb 0.48 -0.17 -0.10 0.00 -2.33 0.00 0.00 43.42 41.30 1x5o n LEU 46 CO 0.46 0.17 0.54 0.11 -1.33 0.00 0.00 177.39 177.34 1x5o h LYS 47 N 0.69 -1.25 0.00 3.23 1.57 0.21 -0.39 116.57 120.64 1x5o h LYS 47 Ca 0.00 0.09 0.00 0.00 -1.87 0.00 0.00 60.65 58.87 1x5o h LYS 47 Cb 0.51 0.28 0.00 0.00 0.08 0.00 0.00 32.23 33.10 1x5o h LYS 47 CO 0.00 -0.83 0.00 -0.35 -0.57 0.00 0.00 179.45 177.70 1x5o n PRO 48 N -5.65 0.49 -0.12 3.15 -0.04 -1.25 -2.77 135.00 128.80 1x5o n PRO 48 Ca -0.16 0.00 -0.20 0.00 -0.04 0.00 0.00 63.50 63.10 1x5o n PRO 48 Cb 0.52 -1.37 -0.11 0.00 -0.04 0.00 0.00 33.50 32.51 1x5o n PRO 48 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 1x5o n PHE 49 N -0.87 0.00 -3.88 0.54 3.01 -0.85 -5.10 117.46 110.31 1x5o n PHE 49 Ca 0.09 0.00 0.01 0.00 1.01 0.00 0.00 57.45 58.56 1x5o n PHE 49 Cb 0.04 -0.92 0.01 0.00 -0.01 0.00 0.00 39.48 38.60 1x5o n PHE 49 CO 0.00 0.00 0.00 0.20 1.01 0.00 0.00 176.76 177.97 1x5o s GLY 50 N -6.07 -0.15 -0.33 1.37 0.00 -0.21 -5.00 107.32 96.93 1x5o s GLY 50 Ca -0.33 0.11 -0.28 0.00 0.00 0.00 0.00 44.72 44.21 1x5o s GLY 50 CO 0.52 3.60 1.73 1.62 0.00 0.00 0.00 173.10 180.58 1x5o s GLN 51 N -2.18 3.41 -0.11 2.90 2.00 -1.26 -4.35 119.66 120.06 1x5o s GLN 51 Ca 0.24 1.38 -0.30 0.00 -2.00 0.00 0.00 55.36 54.69 1x5o s GLN 51 Cb 0.00 -4.16 -0.01 0.00 0.80 0.00 0.00 33.01 29.64 1x5o s GLN 51 CO -0.00 -1.77 1.03 0.08 -0.50 0.00 0.00 175.29 174.13 1x5o s VAL 52 N 6.55 4.72 -0.13 1.34 1.01 -1.26 -2.60 120.40 130.03 1x5o s VAL 52 Ca 0.77 1.99 -0.08 0.00 0.00 0.00 0.00 61.98 64.67 1x5o s VAL 52 Cb -0.21 -4.28 -0.04 0.00 0.00 0.00 0.00 36.38 31.84 1x5o s VAL 52 CO 0.33 -0.02 -0.02 0.40 0.00 0.00 0.00 175.10 175.79 1x5o h ILE 53 N 5.13 0.18 -2.76 2.22 1.08 -1.35 -3.49 117.51 118.52 1x5o h ILE 53 Ca -0.30 -1.17 -0.12 0.00 -0.39 0.00 0.00 64.86 62.88 1x5o h ILE 53 Cb 1.14 0.37 -0.23 0.00 -3.07 0.00 0.00 36.82 35.04 1x5o h ILE 53 CO 0.87 0.06 -0.21 -0.44 -0.69 0.00 0.00 178.15 177.74 1x5o s SER 54 N -5.78 -0.39 0.06 1.72 0.01 -1.23 -5.00 113.70 103.10 1x5o s SER 54 Ca -0.10 0.64 0.07 0.00 1.31 0.00 0.00 55.95 57.86 1x5o s SER 54 Cb 0.01 0.69 -0.03 0.00 0.21 0.00 0.00 66.02 66.91 1x5o s SER 54 CO 0.19 -0.25 -0.19 0.42 0.41 0.00 0.00 173.24 173.82 1x5o s THR 55 N -0.27 1.51 -0.04 1.44 -4.23 -1.26 -1.28 115.64 111.50 1x5o s THR 55 Ca -0.04 -1.26 -0.11 0.00 -1.18 0.00 0.00 61.69 59.10 1x5o s THR 55 Cb -0.03 -1.35 0.02 0.00 1.34 0.00 0.00 72.50 72.48 1x5o s THR 55 CO 0.02 0.05 0.25 -0.60 -0.54 0.00 0.00 174.62 173.80 1x5o s ARG 56 N -1.43 0.50 -0.29 3.99 3.52 -0.34 -4.99 118.95 119.91 1x5o s ARG 56 Ca 0.05 -0.05 0.03 0.00 -0.13 0.00 0.00 55.73 55.63 1x5o s ARG 56 Cb -0.09 0.22 0.07 0.00 -1.56 0.00 0.00 34.95 33.60 1x5o s ARG 56 CO 0.02 -0.12 -0.05 0.42 -0.81 0.00 0.00 175.30 174.77 1x5o s ILE 57 N -0.83 2.15 -0.01 4.11 -1.09 -1.26 -0.30 121.20 123.96 1x5o s ILE 57 Ca -0.09 -1.84 -0.36 0.00 -2.23 0.00 0.00 60.65 56.13 1x5o s ILE 57 Cb -0.05 -2.38 -0.14 0.00 -1.58 0.00 0.00 42.46 38.32 1x5o s ILE 57 CO 0.02 -0.23 1.66 0.18 -1.23 0.00 0.00 174.94 175.34 1x5o n LEU 58 N 4.39 2.82 -4.57 2.97 4.77 0.02 -4.88 117.00 122.53 1x5o n LEU 58 Ca -0.08 1.05 -0.25 0.00 -0.03 0.00 0.00 56.01 56.71 1x5o n LEU 58 Cb 0.42 -1.32 -0.09 0.00 -2.33 0.00 0.00 43.42 40.11 1x5o n LEU 58 CO 0.21 -0.38 -0.40 -0.13 -1.33 0.00 0.00 177.39 175.36 1x5o s ARG 59 N 2.33 2.03 0.80 3.23 0.52 -1.26 -0.49 118.95 126.10 1x5o s ARG 59 Ca 0.88 -1.45 -0.05 0.00 -0.52 0.00 0.00 55.73 54.59 1x5o s ARG 59 Cb -0.80 -2.05 0.16 0.00 0.52 0.00 0.00 34.95 32.77 1x5o s ARG 59 CO 0.49 0.38 1.10 -0.51 0.02 0.00 0.00 175.30 176.78 1x5o s ASP 60 N -3.28 3.91 0.25 0.23 1.01 0.12 -4.84 116.67 114.06 1x5o s ASP 60 Ca 0.28 -0.24 0.18 0.00 0.71 0.00 0.00 52.55 53.48 1x5o s ASP 60 Cb -0.07 0.00 0.92 0.00 1.01 0.00 0.00 42.92 44.78 1x5o s ASP 60 CO 0.16 -2.17 1.54 -1.54 0.21 0.00 0.00 175.17 173.37 1x5o n SER 61 N -3.13 0.45 -1.47 0.27 3.41 -1.26 -0.47 113.62 111.42 1x5o n SER 61 Ca 0.16 0.70 0.09 0.00 -0.26 0.00 0.00 58.87 59.55 1x5o n SER 61 Cb 0.60 -0.76 0.34 0.00 -0.26 0.00 0.00 64.21 64.13 1x5o n SER 61 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 1x5o n SER 62 N -2.09 4.67 -2.37 4.04 2.88 -1.26 -4.93 113.62 114.55 1x5o n SER 62 Ca -0.01 -2.57 -0.19 0.00 -1.33 0.00 0.00 58.87 54.78 1x5o n SER 62 Cb 0.05 -0.56 0.01 0.00 -0.75 0.00 0.00 64.21 62.96 1x5o n SER 62 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1x5o n GLY 63 N 0.77 -0.35 3.29 0.46 0.00 0.38 -5.00 105.19 104.74 1x5o n GLY 63 Ca 0.24 -0.06 -0.32 0.00 0.00 0.00 0.00 46.02 45.88 1x5o n GLY 63 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1x5o s THR 64 N -3.01 2.44 0.49 2.61 2.01 -1.25 -4.81 115.64 114.12 1x5o s THR 64 Ca 0.15 -0.89 -0.20 0.00 0.31 0.00 0.00 61.69 61.06 1x5o s THR 64 Cb -0.07 -1.96 -0.12 0.00 0.01 0.00 0.00 72.50 70.36 1x5o s THR 64 CO 0.19 0.55 0.31 -0.24 -0.69 0.00 0.00 174.62 174.74 1x5o n SER 65 N 3.36 -1.91 -0.78 3.53 2.88 -1.26 0.10 113.62 119.55 1x5o n SER 65 Ca -0.18 0.78 0.08 0.00 -1.33 0.00 0.00 58.87 58.22 1x5o n SER 65 Cb 0.53 -1.03 0.23 0.00 -0.75 0.00 0.00 64.21 63.19 1x5o n SER 65 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1x5o n ARG 66 N 0.71 2.78 -2.04 -1.46 1.74 0.35 -4.66 116.66 114.09 1x5o n ARG 66 Ca 0.11 -2.71 -0.15 0.00 -0.77 0.00 0.00 57.85 54.32 1x5o n ARG 66 Cb 0.44 -1.74 -0.03 0.00 -1.02 0.00 0.00 32.46 30.12 1x5o n ARG 66 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1x5o n GLY 67 N -0.48 0.29 2.80 -0.13 0.00 -1.26 -4.87 105.19 101.54 1x5o n GLY 67 Ca 0.19 -0.26 -0.16 0.00 0.00 0.00 0.00 46.02 45.79 1x5o n GLY 67 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1x5o s VAL 68 N -2.71 -0.11 0.10 1.61 1.01 -1.26 -0.23 120.40 118.80 1x5o s VAL 68 Ca 0.00 0.29 0.07 0.00 0.00 0.00 0.00 61.98 62.35 1x5o s VAL 68 Cb 0.00 -0.18 -0.03 0.00 0.00 0.00 0.00 36.38 36.16 1x5o s VAL 68 CO 0.00 0.12 -0.18 -0.83 0.00 0.00 0.00 175.10 174.21 1x5o s GLY 69 N 1.65 1.14 -0.20 4.51 0.00 -0.11 -0.80 107.32 113.51 1x5o s GLY 69 Ca -0.03 -1.21 -0.01 0.00 0.00 0.00 0.00 44.72 43.47 1x5o s GLY 69 CO -0.04 -1.23 -0.13 -1.36 0.00 0.00 0.00 173.10 170.34 1x5o s PHE 70 N -1.37 2.86 -0.04 1.90 0.08 0.59 -2.77 117.98 119.22 1x5o s PHE 70 Ca 0.05 -1.31 0.06 0.00 0.12 0.00 0.00 56.93 55.85 1x5o s PHE 70 Cb -0.09 -2.00 -0.02 0.00 -0.57 0.00 0.00 43.02 40.34 1x5o s PHE 70 CO 0.04 -0.68 -0.21 0.00 -0.10 0.00 0.00 175.22 174.26 1x5o s ALA 71 N 1.35 2.35 -0.34 5.36 0.00 -1.24 -1.20 121.76 128.04 1x5o s ALA 71 Ca 0.05 -1.05 -0.04 0.00 0.00 0.00 0.00 51.96 50.91 1x5o s ALA 71 Cb -0.14 -0.74 0.06 0.00 0.00 0.00 0.00 23.12 22.31 1x5o s ALA 71 CO -0.08 0.51 0.10 0.50 0.00 0.00 0.00 175.76 176.79 1x5o s ARG 72 N -0.56 2.43 0.56 0.00 3.52 -0.41 -1.75 118.95 122.75 1x5o s ARG 72 Ca 0.08 -1.35 -0.13 0.00 -0.13 0.00 0.00 55.73 54.19 1x5o s ARG 72 Cb -0.11 -3.40 -0.06 0.00 -1.56 0.00 0.00 34.95 29.82 1x5o s ARG 72 CO 0.00 -0.75 1.00 -1.64 -0.81 0.00 0.00 175.30 173.10 1x5o s MET 73 N 1.30 3.76 0.49 5.12 -1.94 -0.99 -0.93 119.30 126.11 1x5o s MET 73 Ca -0.01 0.82 0.20 0.00 -1.71 0.00 0.00 55.69 55.00 1x5o s MET 73 Cb -0.20 -2.12 1.26 0.00 2.01 0.00 0.00 34.83 35.77 1x5o s MET 73 CO -0.00 -0.42 2.00 1.05 -0.01 0.00 0.00 175.02 177.64 1x5o h GLU 74 N 0.28 0.14 0.00 2.03 4.11 -1.82 -3.46 114.58 115.86 1x5o h GLU 74 Ca -0.45 -0.01 0.09 0.00 0.07 0.00 0.00 59.36 59.06 1x5o h GLU 74 Cb 1.19 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 30.39 1x5o h GLU 74 CO 0.62 0.09 0.46 0.43 0.07 0.00 0.00 179.01 180.68 1x5o n SER 75 N -4.43 -1.80 -0.07 3.06 7.64 -1.26 -5.05 113.62 111.70 1x5o n SER 75 Ca 0.09 -2.06 -0.13 0.00 1.01 0.00 0.00 58.87 57.77 1x5o n SER 75 Cb 0.48 2.96 -0.06 0.00 -1.01 0.00 0.00 64.21 66.58 1x5o n SER 75 CO 0.00 0.00 0.00 0.74 -3.01 0.00 0.00 175.04 172.77 1x5o h THR 76 N 1.93 1.33 -1.07 0.44 2.02 -1.89 -3.05 112.91 112.61 1x5o h THR 76 Ca -0.27 -1.42 0.40 0.00 0.77 0.00 0.00 66.41 65.88 1x5o h THR 76 Cb 1.14 1.77 -0.14 0.00 -1.74 0.00 0.00 68.15 69.18 1x5o h THR 76 CO 0.36 0.44 0.65 1.21 0.37 0.00 0.00 175.52 178.55 1x5o n GLU 77 N -4.39 -0.04 0.04 6.66 4.07 -1.26 0.12 120.64 125.84 1x5o n GLU 77 Ca -0.05 1.14 -0.21 0.00 -0.06 0.00 0.00 57.16 57.98 1x5o n GLU 77 Cb 0.43 -2.16 -0.14 0.00 -0.06 0.00 0.00 31.44 29.51 1x5o n GLU 77 CO 0.00 0.00 0.00 0.87 -0.06 0.00 0.00 177.13 177.94 1x5o h LYS 78 N 0.00 0.30 -0.67 5.31 1.79 -1.94 -3.34 116.57 118.02 1x5o h LYS 78 Ca 0.76 -0.51 0.10 0.00 -2.18 0.00 0.00 60.65 58.82 1x5o h LYS 78 Cb 2.28 0.19 -0.12 0.00 -1.58 0.00 0.00 32.23 33.00 1x5o h LYS 78 CO -0.51 1.24 -0.42 0.00 -1.08 0.00 0.00 179.45 178.68 1x5o h GLU 80 N -0.17 -0.16 -0.45 0.00 5.08 -1.53 -1.69 114.58 115.67 1x5o h GLU 80 Ca 0.21 0.01 0.09 0.00 -1.00 0.00 0.00 59.36 58.68 1x5o h GLU 80 Cb 0.56 0.04 -0.10 0.00 0.50 0.00 0.00 28.75 29.75 1x5o h GLU 80 CO -0.75 -0.11 -0.27 0.00 -1.00 0.00 0.00 179.01 176.89 1x5o h ALA 81 N 1.03 -0.01 0.01 3.43 0.00 -1.17 -0.03 119.26 122.52 1x5o h ALA 81 Ca 0.18 0.14 -0.00 0.00 0.00 0.00 0.00 54.91 55.23 1x5o h ALA 81 Cb 0.45 0.62 -0.00 0.00 0.00 0.00 0.00 17.79 18.86 1x5o h ALA 81 CO -0.47 -0.64 -0.02 0.28 0.00 0.00 0.00 179.25 178.41 1x5o h VAL 82 N -0.18 0.00 -0.90 0.00 2.07 -0.49 -1.47 116.25 115.28 1x5o h VAL 82 Ca 0.20 0.00 0.09 0.00 0.82 0.00 0.00 66.70 67.81 1x5o h VAL 82 Cb 0.50 0.00 -0.12 0.00 -1.52 0.00 0.00 31.29 30.16 1x5o h VAL 82 CO -0.55 0.00 -0.57 0.40 0.02 0.00 0.00 177.57 176.87 1x5o h ILE 83 N -0.03 0.00 -1.08 4.57 2.04 -1.19 1.36 117.51 123.19 1x5o h ILE 83 Ca -0.00 0.00 0.29 0.00 1.00 0.00 0.00 64.86 66.15 1x5o h ILE 83 Cb 0.03 0.00 -0.08 0.00 -0.74 0.00 0.00 36.82 36.03 1x5o h ILE 83 CO -0.00 0.00 0.72 1.23 0.00 0.00 0.00 178.15 180.10 1x5o h GLY 84 N -0.07 0.83 0.00 5.37 0.00 -0.95 0.23 103.07 108.48 1x5o h GLY 84 Ca 0.16 -0.14 0.00 0.00 0.00 0.00 0.00 47.33 47.35 1x5o h GLY 84 CO -0.88 -0.10 0.00 1.42 0.00 0.00 0.00 176.54 176.97 1x5o n HIS 85 N -4.49 0.00 -0.34 5.60 8.25 0.25 -4.47 115.22 120.02 1x5o n HIS 85 Ca 0.25 0.00 0.16 0.00 -0.26 0.00 0.00 57.72 57.88 1x5o n HIS 85 Cb 1.00 -0.17 0.32 0.00 1.12 0.00 0.00 29.99 32.26 1x5o n HIS 85 CO 0.00 0.00 0.00 1.19 0.64 0.00 0.00 176.34 178.17 1x5o n PHE 86 N -1.99 0.68 -1.49 4.41 3.01 0.40 -4.32 117.46 118.15 1x5o n PHE 86 Ca 0.00 1.19 -0.33 0.00 1.01 0.00 0.00 57.45 59.32 1x5o n PHE 86 Cb 0.00 -1.27 -0.18 0.00 -0.01 0.00 0.00 39.48 38.01 1x5o n PHE 86 CO 0.00 0.00 0.00 -1.71 1.01 0.00 0.00 176.76 176.06 1x5o n ASN 87 N -5.47 -0.43 -0.18 4.37 5.15 0.81 0.18 115.26 119.69 1x5o n ASN 87 Ca 0.25 -0.12 0.00 0.00 -0.60 0.00 0.00 54.58 54.11 1x5o n ASN 87 Cb 0.81 -0.76 0.00 0.00 -0.53 0.00 0.00 39.78 39.30 1x5o n ASN 87 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1x5o n GLY 88 N 6.07 1.00 3.47 8.20 0.00 -0.92 -4.98 105.19 118.03 1x5o n GLY 88 Ca 0.67 -0.46 -0.27 0.00 0.00 0.00 0.00 46.02 45.96 1x5o n GLY 88 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1x5o s LYS 89 N -2.90 1.70 -0.32 1.61 2.47 0.48 -4.84 119.74 117.94 1x5o s LYS 89 Ca 0.00 -1.41 0.00 0.00 -1.56 0.00 0.00 55.97 53.01 1x5o s LYS 89 Cb 0.00 -1.97 0.08 0.00 -1.46 0.00 0.00 37.83 34.48 1x5o s LYS 89 CO 0.00 0.42 0.03 -0.06 0.16 0.00 0.00 175.35 175.90 1x5o s PHE 90 N -1.60 3.45 0.56 4.03 0.40 -1.26 -0.71 117.98 122.86 1x5o s PHE 90 Ca 0.21 -2.36 -0.17 0.00 -0.60 0.00 0.00 56.93 54.01 1x5o s PHE 90 Cb -0.09 -2.50 -0.05 0.00 0.51 0.00 0.00 43.02 40.90 1x5o s PHE 90 CO 0.11 -0.89 1.06 0.96 0.70 0.00 0.00 175.22 177.16 1x5o s ILE 91 N 1.11 3.71 0.94 0.64 -4.36 -1.26 -5.06 121.20 116.93 1x5o s ILE 91 Ca 0.01 0.90 -0.14 0.00 -0.26 0.00 0.00 60.65 61.16 1x5o s ILE 91 Cb -0.20 -3.38 0.20 0.00 1.25 0.00 0.00 42.46 40.33 1x5o s ILE 91 CO -0.04 -0.39 1.29 -0.54 0.24 0.00 0.00 174.94 175.49 1x5o s LYS 92 N -3.77 0.65 0.04 0.37 1.02 -1.26 -4.77 119.74 112.03 1x5o s LYS 92 Ca 0.66 -0.60 0.01 0.00 0.02 0.00 0.00 55.97 56.06 1x5o s LYS 92 Cb -0.17 -1.91 -0.03 0.00 -0.52 0.00 0.00 37.83 35.20 1x5o s LYS 92 CO 0.32 -2.36 -0.05 0.95 -0.92 0.00 0.00 175.35 173.29 1x5o s THR 93 N -3.81 0.36 1.00 2.17 -4.23 -1.26 -5.02 115.64 104.86 1x5o s THR 93 Ca 0.74 -1.27 -0.12 0.00 -1.18 0.00 0.00 61.69 59.86 1x5o s THR 93 Cb -0.03 -0.79 0.19 0.00 1.34 0.00 0.00 72.50 73.21 1x5o s THR 93 CO 0.52 -0.60 1.09 -2.16 -0.54 0.00 0.00 174.62 172.94 1x5o s PRO 94 N -2.25 0.38 -0.55 3.99 0.04 -1.26 -4.92 135.00 130.43 1x5o s PRO 94 Ca -0.06 0.50 -0.27 0.00 0.04 0.00 0.00 61.00 61.21 1x5o s PRO 94 Cb -0.05 -1.73 -0.02 0.00 0.04 0.00 0.00 34.50 32.74 1x5o s PRO 94 CO -0.03 -2.76 1.83 -1.25 0.04 0.00 0.00 177.00 174.83 1x5o s PRO 95 N -4.97 2.80 0.00 0.56 0.04 -1.26 -2.49 135.00 129.68 1x5o s PRO 95 Ca 0.65 0.77 0.00 0.00 0.04 0.00 0.00 61.00 62.47 1x5o s PRO 95 Cb -0.19 -4.34 0.00 0.00 0.04 0.00 0.00 34.50 30.02 1x5o s PRO 95 CO 0.58 -2.52 0.00 0.41 0.04 0.00 0.00 177.00 175.51 1x5o n GLY 96 N 5.62 0.24 3.43 0.56 0.00 -1.26 -5.13 105.19 108.64 1x5o n GLY 96 Ca 0.21 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.94 1x5o n GLY 96 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1x5o s VAL 97 N -1.24 2.45 -0.16 1.61 1.01 -1.04 -5.12 120.40 117.91 1x5o s VAL 97 Ca 0.00 -1.81 -0.20 0.00 0.00 0.00 0.00 61.98 59.97 1x5o s VAL 97 Cb 0.00 -2.13 -0.03 0.00 0.00 0.00 0.00 36.38 34.22 1x5o s VAL 97 CO 0.00 0.01 0.60 -0.44 0.00 0.00 0.00 175.10 175.26 1x5o s SER 98 N -2.34 6.72 0.37 3.32 0.01 -1.26 -4.80 113.70 115.71 1x5o s SER 98 Ca 0.18 0.87 -0.27 0.00 1.31 0.00 0.00 55.95 58.03 1x5o s SER 98 Cb -0.09 -2.34 -0.09 0.00 0.21 0.00 0.00 66.02 63.70 1x5o s SER 98 CO 0.09 -0.19 1.27 0.00 0.41 0.00 0.00 173.24 174.82 1x5o s ALA 99 N 1.46 3.34 0.70 1.44 0.00 -1.26 -4.87 121.76 122.57 1x5o s ALA 99 Ca 0.29 1.17 -0.13 0.00 0.00 0.00 0.00 51.96 53.29 1x5o s ALA 99 Cb -0.16 -3.45 0.02 0.00 0.00 0.00 0.00 23.12 19.53 1x5o s ALA 99 CO 0.11 -0.66 1.10 -1.25 0.00 0.00 0.00 175.76 175.07 1x5o s PRO 100 N -2.02 2.61 -0.19 0.00 0.04 -1.26 -4.99 135.00 129.18 1x5o s PRO 100 Ca 0.53 1.32 0.17 0.00 0.04 0.00 0.00 61.00 63.06 1x5o s PRO 100 Cb -0.37 -1.93 -0.24 0.00 0.04 0.00 0.00 34.50 32.00 1x5o s PRO 100 CO 0.48 -1.39 0.07 2.41 0.04 0.00 0.00 177.00 178.61 1x5o n THR 101 N -2.79 1.34 -3.43 1.26 -1.04 -1.26 -4.97 114.28 103.39 1x5o n THR 101 Ca 0.10 -0.82 -0.33 0.00 -2.04 0.00 0.00 64.05 60.96 1x5o n THR 101 Cb 0.52 -0.49 -0.05 0.00 -1.82 0.00 0.00 70.33 68.49 1x5o n THR 101 CO 0.00 0.00 0.00 -1.61 -0.64 0.00 0.00 175.07 172.82 1x5o s GLU 102 N -2.47 3.82 1.10 -2.82 0.41 -1.26 -5.09 118.70 112.39 1x5o s GLU 102 Ca -0.10 0.29 -0.15 0.00 -0.41 0.00 0.00 54.97 54.60 1x5o s GLU 102 Cb 0.06 -2.73 0.24 0.00 -1.78 0.00 0.00 34.13 29.92 1x5o s GLU 102 CO 0.80 0.37 1.10 -1.25 -0.49 0.00 0.00 175.26 175.78 1x5o s PRO 103 N -2.61 -0.38 -0.34 0.39 0.04 -1.26 -4.92 135.00 125.93 1x5o s PRO 103 Ca 0.45 0.24 -0.18 0.00 0.04 0.00 0.00 61.00 61.55 1x5o s PRO 103 Cb -0.12 -1.67 -0.01 0.00 0.04 0.00 0.00 34.50 32.75 1x5o s PRO 103 CO 0.21 -3.21 0.52 -0.51 0.04 0.00 0.00 177.00 174.05 1x5o s LEU 104 N -6.70 4.31 -0.23 -3.56 1.43 0.12 -4.64 118.68 109.41 1x5o s LEU 104 Ca 0.68 0.03 -0.18 0.00 -1.03 0.00 0.00 54.13 53.63 1x5o s LEU 104 Cb -0.15 -2.60 -0.03 0.00 0.03 0.00 0.00 46.19 43.44 1x5o s LEU 104 CO 0.57 -0.47 0.52 -0.22 0.23 0.00 0.00 176.35 176.97 1x5o s LEU 105 N 2.41 4.11 0.02 1.79 2.96 -1.15 -2.15 118.68 126.66 1x5o s LEU 105 Ca 0.19 0.61 0.08 0.00 -0.22 0.00 0.00 54.13 54.79 1x5o s LEU 105 Cb -0.15 -2.69 -0.02 0.00 0.50 0.00 0.00 46.19 43.83 1x5o s LEU 105 CO 0.13 -0.23 -0.23 0.00 -1.32 0.00 0.00 176.35 174.71 1x5o s LYS 107 N -0.89 0.75 -0.44 0.00 -2.85 -0.80 -4.90 119.74 110.60 1x5o s LYS 107 Ca 0.09 1.11 -0.41 0.00 -1.00 0.00 0.00 55.97 55.75 1x5o s LYS 107 Cb -0.09 0.25 -0.17 0.00 -2.06 0.00 0.00 37.83 35.77 1x5o s LYS 107 CO 0.01 -0.13 2.09 1.19 0.10 0.00 0.00 175.35 178.61 1x5o n PHE 108 N 3.57 1.39 -2.54 1.78 3.72 -1.26 -1.37 117.46 122.75 1x5o n PHE 108 Ca -0.17 0.64 -0.42 0.00 -0.05 0.00 0.00 57.45 57.44 1x5o n PHE 108 Cb 0.57 -2.37 -0.03 0.00 -0.94 0.00 0.00 39.48 36.72 1x5o n PHE 108 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 176.76 175.17 1x5o s SER 109 N 6.01 7.12 1.08 4.37 1.04 -1.24 -4.81 113.70 127.28 1x5o s SER 109 Ca 1.15 1.73 -0.12 0.00 0.48 0.00 0.00 55.95 59.19 1x5o s SER 109 Cb -1.29 -2.56 0.24 0.00 0.10 0.00 0.00 66.02 62.51 1x5o s SER 109 CO 0.62 -0.52 1.06 -0.83 0.98 0.00 0.00 173.24 174.55 1x5o s GLY 110 N 1.32 1.58 -1.03 7.32 0.00 -1.26 -4.50 107.32 110.75 1x5o s GLY 110 Ca 0.53 -0.02 -0.24 0.00 0.00 0.00 0.00 44.72 45.00 1x5o s GLY 110 CO 0.21 0.62 1.94 2.56 0.00 0.00 0.00 173.10 178.43 1x5o s PRO 111 N -4.59 2.53 -0.06 2.90 0.04 -1.26 -4.92 135.00 129.63 1x5o s PRO 111 Ca 0.67 -0.69 0.05 0.00 0.04 0.00 0.00 61.00 61.07 1x5o s PRO 111 Cb -0.23 -5.15 -0.01 0.00 0.04 0.00 0.00 34.50 29.16 1x5o s PRO 111 CO 0.62 -3.66 -0.23 -1.54 0.04 0.00 0.00 177.00 172.23 1x5o s SER 112 N 7.33 2.89 0.50 6.66 1.04 -1.26 -5.01 113.70 125.85 1x5o s SER 112 Ca 0.69 -0.49 -0.14 0.00 0.48 0.00 0.00 55.95 56.49 1x5o s SER 112 Cb -0.04 -0.91 -0.07 0.00 0.10 0.00 0.00 66.02 65.10 1x5o s SER 112 CO 0.06 0.21 0.93 -0.44 0.98 0.00 0.00 173.24 174.98 1x5o s SER 113 N -0.01 6.55 0.00 7.02 0.01 -1.26 -5.18 113.70 120.82 1x5o s SER 113 Ca -0.07 1.43 0.00 0.00 1.31 0.00 0.00 55.95 58.62 1x5o s SER 113 Cb -0.14 -2.45 0.00 0.00 0.21 0.00 0.00 66.02 63.64 1x5o s SER 113 CO 0.04 -0.57 0.00 0.61 0.41 0.00 0.00 173.24 173.73