#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rml h PRO 25 N 0.00 0.70 -2.08 1.97 0.13 -1.90 -3.39 132.00 127.43 1rml h PRO 25 Ca 0.00 -0.68 -0.04 0.00 -0.87 0.00 0.00 66.00 64.41 1rml h PRO 25 Cb 0.00 0.18 -0.21 0.00 0.13 0.00 0.00 31.00 31.09 1rml h PRO 25 CO 0.00 1.27 0.07 0.21 -0.23 0.00 0.00 178.00 179.33 1rml s LYS 26 N -3.46 0.78 -0.13 0.86 2.47 -1.26 -2.38 119.74 116.61 1rml s LYS 26 Ca -0.10 0.99 -0.04 0.00 -1.56 0.00 0.00 55.97 55.25 1rml s LYS 26 Cb 0.07 0.35 0.07 0.00 -1.46 0.00 0.00 37.83 36.85 1rml s LYS 26 CO 0.90 -0.10 0.25 -0.48 0.16 0.00 0.00 175.35 176.08 1rml s LEU 27 N 0.57 -0.26 0.69 5.43 0.05 -1.26 -2.04 118.68 121.86 1rml s LEU 27 Ca -0.02 0.47 -0.11 0.00 0.05 0.00 0.00 54.13 54.53 1rml s LEU 27 Cb -0.05 0.62 0.01 0.00 -2.05 0.00 0.00 46.19 44.73 1rml s LEU 27 CO -0.02 -0.25 1.07 -0.22 -0.55 0.00 0.00 176.35 176.38 1rml s LEU 28 N 2.40 2.94 -0.00 1.48 0.20 -1.26 -3.04 118.68 121.39 1rml s LEU 28 Ca 0.02 1.07 0.00 0.00 0.69 0.00 0.00 54.13 55.92 1rml s LEU 28 Cb -0.12 -3.87 0.00 0.00 -0.43 0.00 0.00 46.19 41.77 1rml s LEU 28 CO -0.09 -1.30 -0.01 -0.47 -0.29 0.00 0.00 176.35 174.19 1rml s TYR 29 N -3.31 0.14 -0.01 5.38 5.04 -0.89 -4.43 117.35 119.27 1rml s TYR 29 Ca 0.58 -0.01 -0.18 0.00 -2.44 0.00 0.00 57.07 55.01 1rml s TYR 29 Cb -0.11 -0.12 -0.05 0.00 0.35 0.00 0.00 41.96 42.03 1rml s TYR 29 CO 0.51 -0.02 0.50 0.00 -1.34 0.00 0.00 175.55 175.20 1rml n SER 31 N 2.44 0.00 -4.74 0.00 2.88 -0.17 -3.53 113.62 110.50 1rml n SER 31 Ca -0.10 0.65 -0.41 0.00 -1.33 0.00 0.00 58.87 57.69 1rml n SER 31 Cb 0.51 -0.30 -0.05 0.00 -0.75 0.00 0.00 64.21 63.63 1rml n SER 31 CO 0.00 0.00 0.00 0.20 -1.23 0.00 0.00 175.04 174.01 1rml s ASN 32 N -2.06 7.47 0.00 -3.46 -0.87 -1.24 -3.01 114.94 111.77 1rml s ASN 32 Ca 0.00 1.93 0.00 0.00 -1.57 0.00 0.00 52.86 53.22 1rml s ASN 32 Cb 0.00 -2.60 0.00 0.00 -0.02 0.00 0.00 41.25 38.63 1rml s ASN 32 CO 0.00 -0.05 0.00 0.61 -2.57 0.00 0.00 177.10 175.09 1rml n GLY 33 N 1.95 2.95 2.80 0.66 0.00 -1.26 -4.11 105.19 108.19 1rml n GLY 33 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.03 1rml n GLY 33 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1rml n GLY 34 N -2.00 0.12 3.39 -0.02 0.00 -1.16 -4.76 105.19 100.75 1rml n GLY 34 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.72 1rml n GLY 34 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1rml n HIS 35 N -2.23 -1.32 -3.56 1.61 8.25 -0.99 -4.24 115.22 112.74 1rml n HIS 35 Ca 0.00 -0.01 -0.26 0.00 -0.26 0.00 0.00 57.72 57.19 1rml n HIS 35 Cb 0.37 -1.65 -0.15 0.00 1.12 0.00 0.00 29.99 29.68 1rml n HIS 35 CO 0.00 0.00 0.00 -0.06 0.64 0.00 0.00 176.34 176.92 1rml s PHE 36 N -2.33 0.18 0.21 4.41 0.40 0.60 0.26 117.98 121.70 1rml s PHE 36 Ca 0.63 -0.51 -0.19 0.00 -0.60 0.00 0.00 56.93 56.26 1rml s PHE 36 Cb -0.19 -0.74 -0.12 0.00 0.51 0.00 0.00 43.02 42.47 1rml s PHE 36 CO 0.66 -0.68 0.26 -0.11 0.70 0.00 0.00 175.22 176.05 1rml n LEU 37 N 5.27 -1.40 -3.92 -0.37 0.00 -1.26 -2.70 117.00 112.61 1rml n LEU 37 Ca -0.06 0.75 -0.08 0.00 0.00 0.00 0.00 56.01 56.61 1rml n LEU 37 Cb 0.46 -0.69 -0.08 0.00 0.00 0.00 0.00 43.42 43.11 1rml n LEU 37 CO 0.07 -2.58 -0.17 0.00 0.00 0.00 0.00 177.39 174.71 1rml s ARG 38 N -0.74 0.76 0.01 1.96 1.70 0.38 -4.70 118.95 118.31 1rml s ARG 38 Ca 0.46 -1.00 -0.11 0.00 -0.47 0.00 0.00 55.73 54.61 1rml s ARG 38 Cb -0.61 0.30 0.01 0.00 -0.57 0.00 0.00 34.95 34.08 1rml s ARG 38 CO 0.44 -0.21 0.23 -1.50 -1.08 0.00 0.00 175.30 173.18 1rml s ILE 39 N -3.74 0.08 -0.02 4.99 2.07 -1.23 -1.25 121.20 122.10 1rml s ILE 39 Ca 0.04 -0.67 0.02 0.00 -1.41 0.00 0.00 60.65 58.64 1rml s ILE 39 Cb 0.05 -0.68 -0.03 0.00 0.13 0.00 0.00 42.46 41.92 1rml s ILE 39 CO -0.10 -0.37 -0.04 -0.76 -1.91 0.00 0.00 174.94 171.77 1rml s LEU 40 N -1.63 3.33 0.00 8.50 2.01 0.05 -4.51 118.68 126.42 1rml s LEU 40 Ca -0.11 -0.05 0.14 0.00 0.01 0.00 0.00 54.13 54.13 1rml s LEU 40 Cb -0.04 -1.86 0.86 0.00 0.01 0.00 0.00 46.19 45.16 1rml s LEU 40 CO 0.01 0.31 1.38 -0.81 1.01 0.00 0.00 176.35 178.24 1rml n PRO 41 N 1.69 0.75 -0.09 1.29 -0.04 -1.26 -2.98 135.00 134.36 1rml n PRO 41 Ca -0.16 0.00 -0.21 0.00 -0.04 0.00 0.00 63.50 63.09 1rml n PRO 41 Cb 0.53 -1.30 -0.12 0.00 -0.04 0.00 0.00 33.50 32.57 1rml n PRO 41 CO 0.00 0.00 0.00 0.22 -0.04 0.00 0.00 175.50 175.68 1rml h ASP 42 N 0.00 0.06 0.00 3.54 1.82 -1.98 -3.49 116.42 116.38 1rml h ASP 42 Ca 0.00 -0.60 0.00 0.00 -0.39 0.00 0.00 57.03 56.04 1rml h ASP 42 Cb 0.00 -0.02 0.00 0.00 0.68 0.00 0.00 39.33 39.99 1rml h ASP 42 CO 0.00 1.51 0.00 0.61 -1.61 0.00 0.00 179.24 179.75 1rml n GLY 43 N 1.51 0.00 3.24 -0.78 0.00 -1.16 -5.18 105.19 102.83 1rml n GLY 43 Ca -0.30 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.62 1rml n GLY 43 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1rml s THR 44 N 0.00 0.07 0.13 2.61 2.01 -1.24 -4.93 115.64 114.29 1rml s THR 44 Ca 0.00 -1.72 -0.05 0.00 0.31 0.00 0.00 61.69 60.24 1rml s THR 44 Cb 0.00 -2.03 -0.02 0.00 0.01 0.00 0.00 72.50 70.45 1rml s THR 44 CO 0.00 -0.33 0.14 -0.69 -0.69 0.00 0.00 174.62 173.05 1rml s VAL 45 N -4.03 0.11 -1.93 3.82 1.01 -1.26 -0.77 120.40 117.34 1rml s VAL 45 Ca 0.23 -1.62 0.00 0.00 0.00 0.00 0.00 61.98 60.59 1rml s VAL 45 Cb 0.06 -1.82 0.00 0.00 0.00 0.00 0.00 36.38 34.62 1rml s VAL 45 CO 0.03 -0.50 0.00 -0.90 0.00 0.00 0.00 175.10 173.73 1rml n ASP 46 N -0.10 0.00 -4.30 3.32 5.68 -0.38 -4.82 116.55 115.95 1rml n ASP 46 Ca -0.08 0.00 -0.27 0.00 -0.50 0.00 0.00 54.79 53.94 1rml n ASP 46 Cb 0.63 0.00 -0.08 0.00 -1.14 0.00 0.00 41.12 40.53 1rml n ASP 46 CO 0.00 0.00 0.00 -0.83 -1.33 0.00 0.00 177.20 175.04 1rml s GLY 47 N 0.00 2.64 -0.22 6.12 0.00 -1.26 0.14 107.32 114.74 1rml s GLY 47 Ca 0.00 -1.17 -0.09 0.00 0.00 0.00 0.00 44.72 43.46 1rml s GLY 47 CO 0.00 -1.91 0.49 -1.59 0.00 0.00 0.00 173.10 170.08 1rml s THR 48 N -3.14 -0.52 0.27 0.90 2.01 -1.10 -4.66 115.64 109.42 1rml s THR 48 Ca 0.22 0.10 0.15 0.00 0.31 0.00 0.00 61.69 62.47 1rml s THR 48 Cb 0.03 -0.75 0.26 0.00 0.01 0.00 0.00 72.50 72.06 1rml s THR 48 CO 0.12 0.04 1.18 -1.14 -0.69 0.00 0.00 174.62 174.14 1rml n ARG 49 N 5.05 -0.05 -3.70 4.92 0.00 -1.26 0.22 116.66 121.84 1rml n ARG 49 Ca -0.13 1.04 -0.15 0.00 -0.00 0.00 0.00 57.85 58.60 1rml n ARG 49 Cb 0.52 -1.85 -0.15 0.00 0.00 0.00 0.00 32.46 30.97 1rml n ARG 49 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.63 177.12 1rml s ASP 50 N -4.66 0.35 -0.31 6.15 1.01 -1.26 -2.33 116.67 115.62 1rml s ASP 50 Ca -0.07 0.32 -0.41 0.00 0.71 0.00 0.00 52.55 53.10 1rml s ASP 50 Cb 0.25 0.23 -0.16 0.00 1.01 0.00 0.00 42.92 44.26 1rml s ASP 50 CO 0.58 -0.20 1.76 -2.11 0.21 0.00 0.00 175.17 175.41 1rml n ARG 51 N 4.81 1.02 0.00 8.23 1.85 -1.25 -4.80 116.66 126.52 1rml n ARG 51 Ca -0.15 0.37 0.00 0.00 -1.00 0.00 0.00 57.85 57.07 1rml n ARG 51 Cb 0.51 -2.05 0.00 0.00 -1.05 0.00 0.00 32.46 29.87 1rml n ARG 51 CO 0.00 0.00 0.00 0.45 -0.01 0.00 0.00 177.63 178.07 1rml n SER 52 N 5.47 0.00 -2.27 2.89 2.88 -1.26 -5.11 113.62 116.22 1rml n SER 52 Ca 0.28 0.00 -0.11 0.00 -1.33 0.00 0.00 58.87 57.71 1rml n SER 52 Cb 0.11 0.00 -0.04 0.00 -0.75 0.00 0.00 64.21 63.53 1rml n SER 52 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14 1rml n ASP 53 N 0.00 -0.46 -0.19 -3.46 2.03 -1.26 -5.04 116.55 108.17 1rml n ASP 53 Ca 0.00 -2.24 0.00 0.00 0.52 0.00 0.00 54.79 53.07 1rml n ASP 53 Cb 0.00 1.04 0.10 0.00 -0.72 0.00 0.00 41.12 41.53 1rml n ASP 53 CO 0.00 0.00 0.00 1.56 -1.92 0.00 0.00 177.20 176.84 1rml h GLN 54 N 0.00 0.23 -0.53 -0.67 7.50 -2.02 -3.41 115.11 116.21 1rml h GLN 54 Ca -0.14 -0.01 0.16 0.00 0.50 0.00 0.00 58.65 59.16 1rml h GLN 54 Cb 0.69 -0.05 -0.20 0.00 0.05 0.00 0.00 27.48 27.97 1rml h GLN 54 CO 0.20 0.15 -0.09 -1.01 -1.50 0.00 0.00 178.83 176.57 1rml s HIS 55 N -6.12 -0.94 -0.92 2.96 3.76 -1.26 -5.01 115.29 107.76 1rml s HIS 55 Ca -0.13 0.69 0.15 0.00 -0.15 0.00 0.00 55.06 55.62 1rml s HIS 55 Cb 0.17 0.21 0.51 0.00 1.11 0.00 0.00 32.58 34.59 1rml s HIS 55 CO 0.74 -0.54 1.43 0.44 -0.85 0.00 0.00 174.74 175.96 1rml n ILE 56 N 5.30 1.53 -2.00 0.60 -6.64 -1.26 -3.54 119.36 113.35 1rml n ILE 56 Ca 0.03 -1.25 -0.36 0.00 -1.77 0.00 0.00 62.75 59.40 1rml n ILE 56 Cb 0.55 0.23 0.03 0.00 -1.44 0.00 0.00 39.64 39.01 1rml n ILE 56 CO 0.00 0.00 0.00 -1.10 -1.77 0.00 0.00 176.55 173.68 1rml s GLN 57 N -1.65 3.07 0.10 6.28 1.11 -1.26 -4.42 119.66 122.89 1rml s GLN 57 Ca 0.38 1.89 0.01 0.00 0.01 0.00 0.00 55.36 57.65 1rml s GLN 57 Cb 0.24 -2.02 -0.00 0.00 -1.01 0.00 0.00 33.01 30.22 1rml s GLN 57 CO 0.19 -1.14 0.11 1.28 0.01 0.00 0.00 175.29 175.73 1rml n LEU 58 N -1.40 0.00 -3.65 2.90 4.77 -0.86 -4.26 117.00 114.50 1rml n LEU 58 Ca 0.13 -0.94 -0.01 0.00 -0.03 0.00 0.00 56.01 55.16 1rml n LEU 58 Cb 0.49 0.62 -0.07 0.00 -2.33 0.00 0.00 43.42 42.13 1rml n LEU 58 CO 0.46 -0.18 1.02 -1.58 -1.33 0.00 0.00 177.39 175.79 1rml s GLN 59 N -2.35 0.10 0.31 3.23 2.00 -1.12 -4.06 119.66 117.77 1rml s GLN 59 Ca 0.11 0.15 0.03 0.00 -2.00 0.00 0.00 55.36 53.66 1rml s GLN 59 Cb 0.00 0.04 -0.03 0.00 0.80 0.00 0.00 33.01 33.82 1rml s GLN 59 CO 0.08 -0.02 0.47 -0.51 -0.50 0.00 0.00 175.29 174.81 1rml s LEU 60 N 0.64 4.11 -0.35 3.68 1.02 -1.26 0.19 118.68 126.71 1rml s LEU 60 Ca -0.02 0.18 0.15 0.00 0.02 0.00 0.00 54.13 54.47 1rml s LEU 60 Cb -0.04 -3.02 0.43 0.00 0.02 0.00 0.00 46.19 43.58 1rml s LEU 60 CO -0.12 -0.25 1.01 -0.24 0.02 0.00 0.00 176.35 176.76 1rml n SER 61 N -1.63 0.62 -4.60 2.29 2.88 0.53 -4.76 113.62 108.95 1rml n SER 61 Ca -0.05 -2.73 -0.63 0.00 -1.33 0.00 0.00 58.87 54.13 1rml n SER 61 Cb 0.57 -0.17 -0.09 0.00 -0.75 0.00 0.00 64.21 63.77 1rml n SER 61 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1rml n ALA 62 N -0.10 -2.72 0.21 -1.46 0.00 -1.26 -2.88 120.51 112.30 1rml n ALA 62 Ca 0.09 0.56 0.02 0.00 0.00 0.00 0.00 53.44 54.11 1rml n ALA 62 Cb 0.80 -1.83 0.01 0.00 0.00 0.00 0.00 19.45 18.44 1rml n ALA 62 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 1rml n GLU 63 N 2.51 1.13 0.00 0.00 -0.00 -1.05 -4.83 120.64 118.40 1rml n GLU 63 Ca 0.24 -0.61 0.00 0.00 -0.00 0.00 0.00 57.16 56.80 1rml n GLU 63 Cb 0.03 -1.00 0.00 0.00 -0.00 0.00 0.00 31.44 30.46 1rml n GLU 63 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.13 177.56 1rml n SER 64 N -0.05 0.00 -4.44 -1.84 7.64 -0.31 -5.01 113.62 109.61 1rml n SER 64 Ca 0.02 0.00 -0.50 0.00 1.01 0.00 0.00 58.87 59.40 1rml n SER 64 Cb 0.11 0.00 -0.04 0.00 -1.01 0.00 0.00 64.21 63.27 1rml n SER 64 CO 0.00 0.00 0.00 1.33 -3.01 0.00 0.00 175.04 173.36 1rml n VAL 65 N -0.25 1.53 -0.27 0.44 0.24 -1.26 0.14 118.33 118.90 1rml n VAL 65 Ca 0.00 -0.38 0.00 0.00 -2.04 0.00 0.00 64.34 61.92 1rml n VAL 65 Cb 0.00 -0.11 0.00 0.00 -1.47 0.00 0.00 33.84 32.26 1rml n VAL 65 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1rml n GLY 66 N 1.85 2.37 2.90 7.63 0.00 0.04 -4.92 105.19 115.06 1rml n GLY 66 Ca 0.18 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.10 1rml n GLY 66 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1rml s GLU 67 N -0.03 0.37 0.27 1.61 2.12 0.37 -3.74 118.70 119.67 1rml s GLU 67 Ca 0.00 0.29 0.05 0.00 0.36 0.00 0.00 54.97 55.67 1rml s GLU 67 Cb 0.00 -0.43 -0.06 0.00 0.26 0.00 0.00 34.13 33.91 1rml s GLU 67 CO 0.00 -0.85 -0.01 0.14 -0.54 0.00 0.00 175.26 174.00 1rml s VAL 68 N 2.53 1.25 0.37 3.70 -7.23 -1.23 -1.16 120.40 118.63 1rml s VAL 68 Ca 0.11 -2.05 0.08 0.00 -1.81 0.00 0.00 61.98 58.31 1rml s VAL 68 Cb -0.14 -2.47 -0.07 0.00 0.56 0.00 0.00 36.38 34.26 1rml s VAL 68 CO -0.24 -0.25 -0.04 -0.31 -0.31 0.00 0.00 175.10 173.95 1rml s TYR 69 N -3.27 2.44 -0.07 2.82 2.02 -1.14 -0.10 117.35 120.05 1rml s TYR 69 Ca 0.30 -0.59 -0.03 0.00 -0.37 0.00 0.00 57.07 56.39 1rml s TYR 69 Cb 0.06 -1.56 0.04 0.00 -0.40 0.00 0.00 41.96 40.10 1rml s TYR 69 CO 0.11 0.51 0.15 0.42 -1.57 0.00 0.00 175.55 175.17 1rml s ILE 70 N -2.67 -0.14 -0.28 2.71 1.01 -1.26 0.20 121.20 120.77 1rml s ILE 70 Ca 0.34 0.26 0.02 0.00 0.00 0.00 0.00 60.65 61.26 1rml s ILE 70 Cb 0.06 -0.26 0.08 0.00 0.01 0.00 0.00 42.46 42.35 1rml s ILE 70 CO 0.17 0.11 -0.01 -0.75 0.00 0.00 0.00 174.94 174.46 1rml s LYS 71 N 1.66 1.52 -0.84 2.79 2.36 0.52 -0.33 119.74 127.42 1rml s LYS 71 Ca -0.04 -1.28 -0.22 0.00 -2.55 0.00 0.00 55.97 51.88 1rml s LYS 71 Cb -0.12 -2.70 -0.18 0.00 -1.05 0.00 0.00 37.83 33.78 1rml s LYS 71 CO -0.06 -0.74 2.20 0.45 1.55 0.00 0.00 175.35 178.75 1rml n SER 72 N 4.56 0.97 -4.50 1.43 2.88 -1.15 -2.81 113.62 115.00 1rml n SER 72 Ca -0.07 -1.64 -0.13 0.00 -1.33 0.00 0.00 58.87 55.71 1rml n SER 72 Cb 0.43 -1.46 -0.10 0.00 -0.75 0.00 0.00 64.21 62.33 1rml n SER 72 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16 1rml n THR 73 N 8.16 0.00 0.00 2.46 -2.24 -1.26 -1.05 114.28 120.35 1rml n THR 73 Ca 0.45 -0.24 0.00 0.00 -2.27 0.00 0.00 64.05 61.99 1rml n THR 73 Cb 0.41 -1.62 0.00 0.00 -2.10 0.00 0.00 70.33 67.02 1rml n THR 73 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1rml n GLU 74 N 7.72 0.00 0.04 -0.78 -0.58 -1.26 -4.59 120.64 121.19 1rml n GLU 74 Ca 0.40 0.00 0.13 0.00 -0.42 0.00 0.00 57.16 57.27 1rml n GLU 74 Cb 0.44 0.00 0.51 0.00 -0.57 0.00 0.00 31.44 31.82 1rml n GLU 74 CO 0.00 0.00 0.00 0.25 -0.48 0.00 0.00 177.13 176.90 1rml n THR 75 N 0.00 0.21 -0.84 2.62 -2.24 -0.22 -4.88 114.28 108.93 1rml n THR 75 Ca 0.00 -0.11 0.00 0.00 -2.27 0.00 0.00 64.05 61.67 1rml n THR 75 Cb 0.00 -0.47 0.00 0.00 -2.10 0.00 0.00 70.33 67.76 1rml n THR 75 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1rml n GLY 76 N 1.43 0.31 0.00 3.38 0.00 -1.14 -4.95 105.19 104.23 1rml n GLY 76 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.08 1rml n GLY 76 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1rml n GLN 77 N -1.35 2.11 -4.25 1.61 3.00 -1.26 -5.00 117.38 112.24 1rml n GLN 77 Ca 0.00 0.00 -0.14 0.00 -0.01 0.00 0.00 57.00 56.85 1rml n GLN 77 Cb 0.14 0.00 -0.10 0.00 0.00 0.00 0.00 30.24 30.28 1rml n GLN 77 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.06 177.77 1rml s TYR 78 N 1.35 1.26 0.33 1.08 2.02 -1.26 -2.94 117.35 119.20 1rml s TYR 78 Ca 0.00 -0.74 -0.07 0.00 -0.37 0.00 0.00 57.07 55.88 1rml s TYR 78 Cb 0.00 -0.64 -0.06 0.00 -0.40 0.00 0.00 41.96 40.86 1rml s TYR 78 CO 0.00 0.08 0.64 -1.17 -1.57 0.00 0.00 175.55 173.54 1rml s LEU 79 N -3.10 3.97 0.04 -1.29 1.98 0.56 -3.34 118.68 117.50 1rml s LEU 79 Ca 0.16 0.89 -0.28 0.00 -2.89 0.00 0.00 54.13 52.01 1rml s LEU 79 Cb 0.02 -3.74 0.10 0.00 0.66 0.00 0.00 46.19 43.23 1rml s LEU 79 CO 0.01 -0.28 1.21 0.00 -1.89 0.00 0.00 176.35 175.40 1rml s ALA 80 N -2.19 -2.12 -0.33 5.97 0.00 0.53 -4.22 121.76 119.39 1rml s ALA 80 Ca 0.47 0.26 -0.01 0.00 0.00 0.00 0.00 51.96 52.67 1rml s ALA 80 Cb -0.11 0.62 0.11 0.00 0.00 0.00 0.00 23.12 23.74 1rml s ALA 80 CO 0.30 -1.08 0.15 1.41 0.00 0.00 0.00 175.76 176.54 1rml s MET 81 N -2.37 0.56 1.09 0.00 1.75 -1.25 0.19 119.30 119.27 1rml s MET 81 Ca 0.20 -1.05 -0.21 0.00 -1.25 0.00 0.00 55.69 53.38 1rml s MET 81 Cb 0.01 -1.59 0.03 0.00 2.84 0.00 0.00 34.83 36.13 1rml s MET 81 CO -0.01 -1.07 -0.34 -0.25 -0.65 0.00 0.00 175.02 172.70 1rml n ASP 82 N 4.65 -2.55 0.14 1.11 8.00 -1.19 -4.63 116.55 122.08 1rml n ASP 82 Ca 0.01 -0.08 0.09 0.00 0.71 0.00 0.00 54.79 55.52 1rml n ASP 82 Cb 0.40 -0.86 0.50 0.00 -0.02 0.00 0.00 41.12 41.14 1rml n ASP 82 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 1rml n THR 83 N -4.19 1.18 0.05 -3.53 -2.24 -1.26 -0.32 114.28 103.98 1rml n THR 83 Ca 0.00 0.69 0.02 0.00 -2.27 0.00 0.00 64.05 62.49 1rml n THR 83 Cb 0.65 -1.69 0.19 0.00 -2.10 0.00 0.00 70.33 67.38 1rml n THR 83 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1rml n ASP 84 N -2.14 3.35 -1.82 3.42 8.00 -1.26 -4.75 116.55 121.35 1rml n ASP 84 Ca -0.01 -2.49 -0.05 0.00 0.71 0.00 0.00 54.79 52.94 1rml n ASP 84 Cb 0.03 -0.60 -0.01 0.00 -0.02 0.00 0.00 41.12 40.52 1rml n ASP 84 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1rml n GLY 85 N 0.24 -0.01 3.35 0.44 0.00 0.57 0.14 105.19 109.92 1rml n GLY 85 Ca 0.15 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.76 1rml n GLY 85 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1rml s LEU 86 N -3.98 4.97 -0.39 0.99 0.20 -1.25 -3.50 118.68 115.72 1rml s LEU 86 Ca 0.00 -1.18 -0.45 0.00 0.69 0.00 0.00 54.13 53.19 1rml s LEU 86 Cb 0.00 -2.04 -0.20 0.00 -0.43 0.00 0.00 46.19 43.52 1rml s LEU 86 CO 0.00 -0.46 1.48 0.18 -0.29 0.00 0.00 176.35 177.26 1rml n LEU 87 N 5.01 0.95 -3.80 -0.68 4.32 -1.26 -3.15 117.00 118.40 1rml n LEU 87 Ca -0.11 1.18 -0.10 0.00 -0.02 0.00 0.00 56.01 56.96 1rml n LEU 87 Cb 0.45 -0.88 -0.06 0.00 -1.62 0.00 0.00 43.42 41.31 1rml n LEU 87 CO 0.39 -1.05 0.06 -0.72 -1.22 0.00 0.00 177.39 174.84 1rml s TYR 88 N 2.37 0.06 0.25 -1.77 1.13 0.50 -4.30 117.35 115.59 1rml s TYR 88 Ca 1.01 -0.43 0.10 0.00 -1.41 0.00 0.00 57.07 56.34 1rml s TYR 88 Cb -1.44 0.11 -0.04 0.00 -1.10 0.00 0.00 41.96 39.48 1rml s TYR 88 CO 0.76 -0.69 -0.05 0.20 -2.51 0.00 0.00 175.55 173.26 1rml s GLY 89 N -2.87 1.70 0.16 5.49 0.00 -1.24 0.20 107.32 110.75 1rml s GLY 89 Ca 0.08 -1.64 -0.20 0.00 0.00 0.00 0.00 44.72 42.97 1rml s GLY 89 CO -0.07 -1.69 0.52 -0.45 0.00 0.00 0.00 173.10 171.41 1rml s SER 90 N -3.46 -0.40 -0.27 1.64 0.15 -1.21 -4.95 113.70 105.21 1rml s SER 90 Ca 0.30 -0.20 -0.01 0.00 0.70 0.00 0.00 55.95 56.74 1rml s SER 90 Cb -0.07 0.56 0.19 0.00 -1.71 0.00 0.00 66.02 64.99 1rml s SER 90 CO 0.18 -0.96 1.98 1.67 1.20 0.00 0.00 173.24 177.31 1rml n GLN 91 N -0.32 1.68 -3.40 5.44 7.27 -1.26 -4.13 117.38 122.66 1rml n GLN 91 Ca -0.15 -1.34 -0.21 0.00 0.07 0.00 0.00 57.00 55.37 1rml n GLN 91 Cb 0.64 -1.53 -0.09 0.00 2.41 0.00 0.00 30.24 31.67 1rml n GLN 91 CO 0.00 0.00 0.00 0.95 0.07 0.00 0.00 177.06 178.08 1rml s THR 92 N -1.94 -0.20 -1.08 1.69 -4.23 -1.26 -5.07 115.64 103.55 1rml s THR 92 Ca 0.26 -1.11 -0.22 0.00 -1.18 0.00 0.00 61.69 59.44 1rml s THR 92 Cb 0.21 -0.85 -0.00 0.00 1.34 0.00 0.00 72.50 73.20 1rml s THR 92 CO -0.00 -0.69 1.75 -2.16 -0.54 0.00 0.00 174.62 172.98 1rml s PRO 93 N 1.48 3.15 0.22 3.99 0.04 -1.26 -4.31 135.00 138.31 1rml s PRO 93 Ca 0.16 -1.07 0.02 0.00 0.04 0.00 0.00 61.00 60.15 1rml s PRO 93 Cb -0.17 -5.29 -0.01 0.00 0.04 0.00 0.00 34.50 29.07 1rml s PRO 93 CO -0.08 -2.92 0.07 0.09 0.04 0.00 0.00 177.00 174.20 1rml n ASN 94 N 11.38 1.30 -0.50 6.66 3.02 -1.26 -4.93 115.26 130.93 1rml n ASN 94 Ca 0.41 -2.16 0.41 0.00 -0.03 0.00 0.00 54.58 53.21 1rml n ASN 94 Cb 0.48 0.50 0.67 0.00 -0.61 0.00 0.00 39.78 40.82 1rml n ASN 94 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1rml n GLU 95 N -0.51 -0.03 0.18 3.52 4.71 -1.26 -0.06 120.64 127.19 1rml n GLU 95 Ca -0.04 1.14 -0.07 0.00 -0.01 0.00 0.00 57.16 58.18 1rml n GLU 95 Cb 0.33 -2.34 -0.03 0.00 -1.01 0.00 0.00 31.44 28.39 1rml n GLU 95 CO 0.00 0.00 0.00 1.49 0.09 0.00 0.00 177.13 178.71 1rml h GLU 96 N 0.00 -0.44 -0.87 3.49 4.81 -1.91 -2.82 114.58 116.84 1rml h GLU 96 Ca 0.84 0.03 0.25 0.00 -0.13 0.00 0.00 59.36 60.36 1rml h GLU 96 Cb 2.89 0.10 -0.03 0.00 0.63 0.00 0.00 28.75 32.34 1rml h GLU 96 CO -0.34 -0.30 0.68 0.00 -0.73 0.00 0.00 179.01 178.33 1rml s LEU 98 N -8.14 1.35 -0.28 0.00 1.43 0.62 -4.24 118.68 109.41 1rml s LEU 98 Ca -0.05 1.46 -0.02 0.00 -1.03 0.00 0.00 54.13 54.50 1rml s LEU 98 Cb 0.20 -3.54 0.12 0.00 0.03 0.00 0.00 46.19 43.01 1rml s LEU 98 CO 0.72 -3.64 0.25 -0.36 0.23 0.00 0.00 176.35 173.55 1rml s PHE 99 N -2.68 -0.26 -0.84 0.29 0.08 0.85 -4.19 117.98 111.23 1rml s PHE 99 Ca 0.67 -0.32 -0.32 0.00 0.12 0.00 0.00 56.93 57.07 1rml s PHE 99 Cb -0.22 -0.56 -0.19 0.00 -0.57 0.00 0.00 43.02 41.47 1rml s PHE 99 CO 0.61 -0.88 2.57 1.28 -0.10 0.00 0.00 175.22 178.70 1rml n LEU 100 N 5.30 0.70 -4.63 -0.37 4.77 -0.73 -3.51 117.00 118.53 1rml n LEU 100 Ca -0.03 0.16 -0.32 0.00 -0.03 0.00 0.00 56.01 55.79 1rml n LEU 100 Cb 0.45 -1.02 -0.10 0.00 -2.33 0.00 0.00 43.42 40.43 1rml n LEU 100 CO 0.02 -0.84 -0.37 -0.70 -1.33 0.00 0.00 177.39 174.17 1rml s GLU 101 N 8.41 2.56 0.00 3.23 -6.30 -1.25 -0.62 118.70 124.74 1rml s GLU 101 Ca 1.28 -0.74 0.00 0.00 -2.50 0.00 0.00 54.97 53.00 1rml s GLU 101 Cb -1.13 -2.53 0.00 0.00 0.00 0.00 0.00 34.13 30.48 1rml s GLU 101 CO 0.48 0.59 0.00 2.89 0.02 0.00 0.00 175.26 179.24 1rml n ARG 102 N 1.29 0.00 0.00 4.30 1.85 -1.24 -0.78 116.66 122.07 1rml n ARG 102 Ca -0.14 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.71 1rml n ARG 102 Cb 0.52 0.00 0.00 0.00 -1.05 0.00 0.00 32.46 31.93 1rml n ARG 102 CO 0.00 0.00 0.00 -0.11 -0.01 0.00 0.00 177.63 177.51 1rml n LEU 103 N 0.00 0.00 -0.10 2.89 0.00 -1.26 -4.91 117.00 113.61 1rml n LEU 103 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 56.01 55.78 1rml n LEU 103 Cb 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 43.42 43.30 1rml n LEU 103 CO 0.00 0.00 -1.10 1.21 0.00 0.00 0.00 177.39 177.50 1rml n GLU 104 N 0.00 0.63 0.00 1.96 0.00 -1.26 -4.95 120.64 117.02 1rml n GLU 104 Ca 0.00 0.30 0.00 0.00 0.00 0.00 0.00 57.16 57.46 1rml n GLU 104 Cb 0.00 -1.60 0.00 0.00 0.00 0.00 0.00 31.44 29.84 1rml n GLU 104 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.13 177.52 1rml n GLU 105 N -3.89 0.00 -2.60 5.31 -0.58 -1.26 -5.07 120.64 112.55 1rml n GLU 105 Ca -0.43 0.00 -0.03 0.00 -0.42 0.00 0.00 57.16 56.28 1rml n GLU 105 Cb 0.90 0.00 0.12 0.00 -0.57 0.00 0.00 31.44 31.88 1rml n GLU 105 CO 0.00 0.00 0.00 -1.71 -0.48 0.00 0.00 177.13 174.94 1rml n ASN 106 N 0.00 -1.46 0.03 1.62 5.15 -1.26 -4.96 115.26 114.37 1rml n ASN 106 Ca 0.00 -2.18 0.00 0.00 -0.60 0.00 0.00 54.58 51.80 1rml n ASN 106 Cb 0.00 0.72 0.00 0.00 -0.53 0.00 0.00 39.78 39.97 1rml n ASN 106 CO 0.00 0.00 0.00 1.41 1.40 0.00 0.00 177.26 180.07 1rml n HIS 107 N -1.22 -2.44 -1.30 1.20 -0.00 -1.26 -5.15 115.22 105.06 1rml n HIS 107 Ca -0.14 0.19 -0.05 0.00 -0.00 0.00 0.00 57.72 57.72 1rml n HIS 107 Cb 0.84 0.85 0.03 0.00 -0.00 0.00 0.00 29.99 31.71 1rml n HIS 107 CO 0.00 0.00 0.00 0.66 -0.00 0.00 0.00 176.34 177.00 1rml n TYR 108 N -2.56 -3.91 -2.92 4.41 4.01 -1.26 -4.69 117.16 110.25 1rml n TYR 108 Ca 0.00 -0.21 -0.14 0.00 -0.16 0.00 0.00 57.90 57.39 1rml n TYR 108 Cb 0.00 -0.17 0.02 0.00 -0.31 0.00 0.00 39.34 38.88 1rml n TYR 108 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 1rml n ASN 109 N -3.13 -1.45 -4.70 7.72 4.13 -1.17 -4.61 115.26 112.06 1rml n ASN 109 Ca 0.03 -3.22 -0.56 0.00 1.68 0.00 0.00 54.58 52.50 1rml n ASN 109 Cb 0.10 0.89 -0.07 0.00 -1.54 0.00 0.00 39.78 39.16 1rml n ASN 109 CO 0.00 0.00 0.00 0.35 0.28 0.00 0.00 177.26 177.89 1rml n THR 110 N 1.04 0.29 -3.51 3.41 -2.24 -1.25 -4.75 114.28 107.27 1rml n THR 110 Ca 0.14 -0.05 -0.21 0.00 -2.27 0.00 0.00 64.05 61.65 1rml n THR 110 Cb 0.63 -1.23 -0.02 0.00 -2.10 0.00 0.00 70.33 67.61 1rml n THR 110 CO 0.00 0.00 0.00 -0.31 -0.57 0.00 0.00 175.07 174.19 1rml s TYR 111 N 3.25 2.50 -0.18 4.78 1.51 -1.26 -3.64 117.35 124.32 1rml s TYR 111 Ca 0.96 -0.54 -0.06 0.00 -1.01 0.00 0.00 57.07 56.42 1rml s TYR 111 Cb -1.03 -2.16 0.08 0.00 -0.11 0.00 0.00 41.96 38.74 1rml s TYR 111 CO 0.63 -0.26 0.37 0.42 -1.11 0.00 0.00 175.55 175.60 1rml s ILE 112 N -2.51 -0.58 -0.76 2.71 1.01 0.21 -2.57 121.20 118.70 1rml s ILE 112 Ca 0.48 0.20 -0.30 0.00 0.00 0.00 0.00 60.65 61.03 1rml s ILE 112 Cb -0.04 -0.60 -0.19 0.00 0.01 0.00 0.00 42.46 41.64 1rml s ILE 112 CO 0.28 0.08 2.25 -0.24 0.00 0.00 0.00 174.94 177.31 1rml n SER 113 N 5.37 0.36 0.27 3.58 2.88 -0.89 -1.77 113.62 123.43 1rml n SER 113 Ca -0.08 0.28 0.12 0.00 -1.33 0.00 0.00 58.87 57.86 1rml n SER 113 Cb 0.50 -0.80 0.79 0.00 -0.75 0.00 0.00 64.21 63.94 1rml n SER 113 CO 0.00 0.00 0.00 0.50 -1.23 0.00 0.00 175.04 174.31 1rml h LYS 114 N 9.86 0.00 0.00 -1.46 3.64 -1.77 0.70 116.57 127.54 1rml h LYS 114 Ca -0.06 0.00 -0.03 0.00 -1.27 0.00 0.00 60.65 59.29 1rml h LYS 114 Cb 1.18 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.99 1rml h LYS 114 CO 1.15 0.00 -0.15 -0.22 -2.27 0.00 0.00 179.45 177.96 1rml h LYS 115 N 0.00 0.00 -0.44 1.90 3.64 -1.81 -3.32 116.57 116.54 1rml h LYS 115 Ca 0.01 0.00 -0.29 0.00 -1.27 0.00 0.00 60.65 59.10 1rml h LYS 115 Cb 0.05 0.00 -0.20 0.00 -0.41 0.00 0.00 32.23 31.67 1rml h LYS 115 CO -0.00 0.15 -0.62 -2.39 -2.27 0.00 0.00 179.45 174.32 1rml n HIS 116 N -3.79 -2.44 1.01 1.91 1.44 0.92 -4.93 115.22 109.34 1rml n HIS 116 Ca -0.02 -2.34 0.12 0.00 -2.01 0.00 0.00 57.72 53.48 1rml n HIS 116 Cb 0.26 1.17 0.28 0.00 0.12 0.00 0.00 29.99 31.81 1rml n HIS 116 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1rml n ALA 117 N 0.94 3.44 0.66 1.59 0.00 0.21 -3.60 120.51 123.75 1rml n ALA 117 Ca 0.11 -0.33 0.08 0.00 0.00 0.00 0.00 53.44 53.29 1rml n ALA 117 Cb 0.65 -1.15 0.37 0.00 0.00 0.00 0.00 19.45 19.33 1rml n ALA 117 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1rml n GLU 118 N -1.47 0.13 0.00 0.00 2.13 -1.26 -1.30 120.64 118.87 1rml n GLU 118 Ca 0.06 0.18 0.05 0.00 0.66 0.00 0.00 57.16 58.10 1rml n GLU 118 Cb 0.34 -1.50 0.02 0.00 0.27 0.00 0.00 31.44 30.57 1rml n GLU 118 CO 0.00 0.00 0.00 1.17 -0.41 0.00 0.00 177.13 177.89 1rml n LYS 119 N -1.38 1.08 -3.37 5.31 4.81 -1.24 -4.98 118.16 118.39 1rml n LYS 119 Ca 0.06 -0.88 -0.19 0.00 -0.87 0.00 0.00 58.31 56.43 1rml n LYS 119 Cb 0.15 -1.14 0.07 0.00 0.02 0.00 0.00 35.03 34.13 1rml n LYS 119 CO 0.00 0.00 0.00 0.09 1.17 0.00 0.00 177.40 178.66 1rml n ASN 120 N 0.22 -4.89 -4.35 3.14 5.03 -0.42 -4.88 115.26 109.12 1rml n ASN 120 Ca 0.05 -0.47 -0.43 0.00 0.87 0.00 0.00 54.58 54.60 1rml n ASN 120 Cb 0.23 -4.32 0.00 0.00 -1.02 0.00 0.00 39.78 34.66 1rml n ASN 120 CO 0.00 0.00 0.00 0.79 -1.83 0.00 0.00 177.26 176.22 1rml n TRP 121 N -4.39 4.42 -0.20 3.10 8.01 -1.24 -4.02 117.44 123.10 1rml n TRP 121 Ca -0.05 -3.02 -0.13 0.00 -1.31 0.00 0.00 57.50 53.00 1rml n TRP 121 Cb 0.57 -2.42 0.12 0.00 -2.01 0.00 0.00 31.31 27.58 1rml n TRP 121 CO 0.00 0.00 0.00 1.19 -1.01 0.00 0.00 177.69 177.87 1rml n PHE 122 N 6.73 -2.39 -1.15 -5.99 3.01 0.52 -2.09 117.46 116.10 1rml n PHE 122 Ca 0.45 -0.23 0.08 0.00 1.01 0.00 0.00 57.45 58.75 1rml n PHE 122 Cb 0.43 -0.72 0.18 0.00 -0.01 0.00 0.00 39.48 39.36 1rml n PHE 122 CO 0.00 0.00 0.00 1.55 1.01 0.00 0.00 176.76 179.32 1rml n VAL 123 N -4.05 2.09 -2.90 -4.37 3.14 -1.06 -4.55 118.33 106.62 1rml n VAL 123 Ca 0.06 -2.33 -0.43 0.00 -2.96 0.00 0.00 64.34 58.68 1rml n VAL 123 Cb 0.25 -0.25 -0.04 0.00 -1.06 0.00 0.00 33.84 32.73 1rml n VAL 123 CO 0.00 0.00 0.00 -0.83 -6.46 0.00 0.00 176.83 169.54 1rml s GLY 124 N -2.65 1.47 0.12 7.55 0.00 -1.26 -4.80 107.32 107.76 1rml s GLY 124 Ca 0.36 -1.48 -0.31 0.00 0.00 0.00 0.00 44.72 43.30 1rml s GLY 124 CO 0.03 1.94 1.85 1.04 0.00 0.00 0.00 173.10 177.97 1rml n LEU 125 N 7.27 4.10 -2.51 0.66 4.77 -1.26 -4.67 117.00 125.36 1rml n LEU 125 Ca -0.01 0.98 -0.35 0.00 -0.03 0.00 0.00 56.01 56.60 1rml n LEU 125 Cb 0.47 -1.55 -0.05 0.00 -2.33 0.00 0.00 43.42 39.95 1rml n LEU 125 CO 0.62 0.20 0.51 1.17 -1.33 0.00 0.00 177.39 178.56 1rml n LYS 126 N 5.76 0.00 -0.45 3.23 4.81 -1.24 -4.54 118.16 125.74 1rml n LYS 126 Ca 0.18 0.00 -0.12 0.00 -0.87 0.00 0.00 58.31 57.50 1rml n LYS 126 Cb 0.38 -0.81 -0.02 0.00 0.02 0.00 0.00 35.03 34.60 1rml n LYS 126 CO 0.00 0.00 0.00 0.36 1.17 0.00 0.00 177.40 178.93 1rml n LYS 127 N 1.67 1.22 0.00 1.64 -0.00 -1.26 -2.44 118.16 118.99 1rml n LYS 127 Ca 0.15 -0.98 0.00 0.00 -0.00 0.00 0.00 58.31 57.47 1rml n LYS 127 Cb -0.01 -2.19 0.00 0.00 -0.00 0.00 0.00 35.03 32.84 1rml n LYS 127 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.40 175.69 1rml n ASN 128 N 4.23 0.00 0.00 -5.58 2.85 -1.26 -4.81 115.26 110.69 1rml n ASN 128 Ca 0.26 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.73 1rml n ASN 128 Cb 0.12 0.01 0.00 0.00 1.24 0.00 0.00 39.78 41.15 1rml n ASN 128 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1rml n GLY 129 N 1.29 0.30 0.00 8.20 0.00 -1.02 -4.92 105.19 109.04 1rml n GLY 129 Ca 0.00 -0.51 0.00 0.00 0.00 0.00 0.00 46.02 45.51 1rml n GLY 129 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1rml n SER 130 N 0.00 0.00 -4.72 1.61 7.64 -1.26 -4.99 113.62 111.90 1rml n SER 130 Ca 0.00 0.00 -0.31 0.00 1.01 0.00 0.00 58.87 59.57 1rml n SER 130 Cb 0.00 0.00 0.13 0.00 -1.01 0.00 0.00 64.21 63.33 1rml n SER 130 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1rml n LYS 132 N -3.79 0.76 -3.73 0.00 4.01 -1.26 -4.91 118.16 109.24 1rml n LYS 132 Ca 0.11 -3.52 -0.13 0.00 -0.51 0.00 0.00 58.31 54.26 1rml n LYS 132 Cb 0.52 0.74 -0.10 0.00 -0.51 0.00 0.00 35.03 35.69 1rml n LYS 132 CO 0.00 0.00 0.00 -0.98 -1.11 0.00 0.00 177.40 175.31 1rml s ARG 133 N -3.94 0.49 5.69 1.97 1.04 -1.25 -4.15 118.95 118.79 1rml s ARG 133 Ca 0.11 0.54 0.00 0.00 -1.04 0.00 0.00 55.73 55.34 1rml s ARG 133 Cb -0.01 0.24 0.00 0.00 -2.04 0.00 0.00 34.95 33.14 1rml s ARG 133 CO 0.07 -0.06 0.00 0.41 -0.04 0.00 0.00 175.30 175.68 1rml n GLY 134 N 2.79 2.64 3.39 3.88 0.00 0.36 -3.90 105.19 114.35 1rml n GLY 134 Ca -0.13 -0.44 -0.38 0.00 0.00 0.00 0.00 46.02 45.07 1rml n GLY 134 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1rml n PRO 135 N 13.11 2.34 -0.83 1.61 -0.04 -1.26 -3.99 135.00 145.94 1rml n PRO 135 Ca 0.00 -2.69 -0.05 0.00 -0.04 0.00 0.00 63.50 60.73 1rml n PRO 135 Cb 0.00 -3.46 -0.05 0.00 -0.04 0.00 0.00 33.50 29.95 1rml n PRO 135 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1rml n ARG 136 N 7.82 0.00 -3.30 0.54 3.00 -1.25 -5.05 116.66 118.42 1rml n ARG 136 Ca 0.48 -0.66 -0.10 0.00 -0.01 0.00 0.00 57.85 57.56 1rml n ARG 136 Cb 0.44 0.33 -0.05 0.00 0.00 0.00 0.00 32.46 33.18 1rml n ARG 136 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.63 177.55 1rml s THR 137 N 0.00 -0.59 0.01 0.55 -1.32 -1.26 -4.69 115.64 108.35 1rml s THR 137 Ca 0.00 -0.56 0.00 0.00 -1.21 0.00 0.00 61.69 59.92 1rml s THR 137 Cb 0.00 -0.57 -0.00 0.00 -1.51 0.00 0.00 72.50 70.42 1rml s THR 137 CO 0.00 -0.35 0.01 1.41 -2.21 0.00 0.00 174.62 173.48 1rml n HIS 138 N 4.55 -0.08 0.00 9.09 8.25 -1.26 0.19 115.22 135.96 1rml n HIS 138 Ca 0.09 -0.12 0.00 0.00 -0.26 0.00 0.00 57.72 57.43 1rml n HIS 138 Cb 0.49 0.01 0.00 0.00 1.12 0.00 0.00 29.99 31.62 1rml n HIS 138 CO 0.00 0.00 0.00 0.98 0.64 0.00 0.00 176.34 177.96 1rml n TYR 139 N -0.03 -0.85 -0.89 4.41 9.36 -1.26 -4.02 117.16 123.89 1rml n TYR 139 Ca 0.00 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.22 1rml n TYR 139 Cb 0.03 0.00 0.00 0.00 -0.63 0.00 0.00 39.34 38.74 1rml n TYR 139 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 1rml n GLY 140 N 0.00 0.12 2.58 2.98 0.00 -1.26 -4.89 105.19 104.71 1rml n GLY 140 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 1rml n GLY 140 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1rml s GLN 141 N -1.40 0.28 0.27 1.61 -0.21 -1.26 -4.96 119.66 113.99 1rml s GLN 141 Ca 0.00 -0.61 0.08 0.00 0.02 0.00 0.00 55.36 54.85 1rml s GLN 141 Cb 0.00 -1.32 0.45 0.00 1.00 0.00 0.00 33.01 33.14 1rml s GLN 141 CO 0.00 -1.01 1.09 1.17 -2.12 0.00 0.00 175.29 174.43 1rml n LYS 142 N 5.18 0.06 -0.09 2.91 3.00 -1.26 -0.46 118.16 127.50 1rml n LYS 142 Ca -0.05 0.49 0.26 0.00 -0.00 0.00 0.00 58.31 59.01 1rml n LYS 142 Cb 0.42 -2.07 0.70 0.00 0.00 0.00 0.00 35.03 34.07 1rml n LYS 142 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1rml h ALA 143 N 0.91 2.58 0.00 3.14 0.00 -1.85 2.17 119.26 126.21 1rml h ALA 143 Ca 0.00 -0.03 -0.14 0.00 0.00 0.00 0.00 54.91 54.74 1rml h ALA 143 Cb 0.76 0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.59 1rml h ALA 143 CO 0.00 -1.07 -0.68 -0.84 0.00 0.00 0.00 179.25 176.66 1rml h ILE 144 N 0.00 1.49 -0.56 0.00 3.07 -1.04 -3.38 117.51 117.09 1rml h ILE 144 Ca 0.36 -2.33 -0.28 0.00 1.55 0.00 0.00 64.86 64.16 1rml h ILE 144 Cb 1.73 2.26 -0.04 0.00 -0.27 0.00 0.00 36.82 40.49 1rml h ILE 144 CO -0.00 0.67 0.80 -0.76 -1.05 0.00 0.00 178.15 177.80 1rml s LEU 145 N -7.47 3.06 -0.27 0.16 1.02 0.73 -3.91 118.68 112.00 1rml s LEU 145 Ca -0.01 -1.06 -0.19 0.00 0.02 0.00 0.00 54.13 52.89 1rml s LEU 145 Cb 0.12 -2.57 -0.02 0.00 0.02 0.00 0.00 46.19 43.74 1rml s LEU 145 CO 0.77 -3.05 0.57 -0.36 0.02 0.00 0.00 176.35 174.30 1rml s PHE 146 N 11.09 3.26 -0.42 0.29 0.08 -1.26 -1.00 117.98 130.01 1rml s PHE 146 Ca 0.71 0.66 -0.14 0.00 0.12 0.00 0.00 56.93 58.28 1rml s PHE 146 Cb -0.04 -2.81 0.04 0.00 -0.57 0.00 0.00 43.02 39.64 1rml s PHE 146 CO 0.06 -0.34 0.31 -1.17 -0.10 0.00 0.00 175.22 173.98 1rml s LEU 147 N 2.42 5.20 0.02 -0.37 1.98 0.61 -3.07 118.68 125.48 1rml s LEU 147 Ca 0.23 -1.10 -0.30 0.00 -2.89 0.00 0.00 54.13 50.07 1rml s LEU 147 Cb -0.15 -2.13 -0.05 0.00 0.66 0.00 0.00 46.19 44.52 1rml s LEU 147 CO 0.10 -0.51 1.18 -2.16 -1.89 0.00 0.00 176.35 173.07 1rml s PRO 148 N 1.62 4.42 -0.47 0.98 0.04 -1.26 -2.08 135.00 138.25 1rml s PRO 148 Ca 0.04 1.71 0.08 0.00 0.04 0.00 0.00 61.00 62.88 1rml s PRO 148 Cb -0.21 -3.42 0.29 0.00 0.04 0.00 0.00 34.50 31.19 1rml s PRO 148 CO 0.08 -0.30 0.68 1.47 0.04 0.00 0.00 177.00 178.97 1rml n LEU 149 N 4.33 1.72 -4.80 -3.56 -0.00 -1.17 -5.00 117.00 108.52 1rml n LEU 149 Ca 0.09 -5.07 -0.29 0.00 -0.00 0.00 0.00 56.01 50.74 1rml n LEU 149 Cb 0.47 0.21 0.11 0.00 -0.00 0.00 0.00 43.42 44.21 1rml n LEU 149 CO 0.55 2.16 0.71 -2.16 -0.00 0.00 0.00 177.39 178.66 1rml s PRO 150 N -2.10 1.63 -0.29 1.47 0.04 -1.26 -4.27 135.00 130.22 1rml s PRO 150 Ca 0.39 0.47 0.04 0.00 0.04 0.00 0.00 61.00 61.95 1rml s PRO 150 Cb 0.23 -1.88 0.15 0.00 0.04 0.00 0.00 34.50 33.04 1rml s PRO 150 CO -0.09 -1.90 1.08 1.33 0.04 0.00 0.00 177.00 177.47 1rml n VAL 151 N -3.59 0.00 -1.51 -0.36 0.24 -1.16 -4.99 118.33 106.95 1rml n VAL 151 Ca 0.07 -0.77 -0.32 0.00 -2.04 0.00 0.00 64.34 61.28 1rml n VAL 151 Cb 0.58 0.69 -0.16 0.00 -1.47 0.00 0.00 33.84 33.48 1rml n VAL 151 CO 0.00 0.00 0.00 -0.24 -2.14 0.00 0.00 176.83 174.45 1rml n SER 152 N -0.56 -0.00 -3.12 -1.34 2.88 -1.00 -4.73 113.62 105.75 1rml n SER 152 Ca -0.17 -0.24 -0.21 0.00 -1.33 0.00 0.00 58.87 56.92 1rml n SER 152 Cb 0.69 -0.90 -0.03 0.00 -0.75 0.00 0.00 64.21 63.21 1rml n SER 152 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 1rml n SER 153 N 9.90 1.89 0.00 -3.46 2.88 -1.26 -5.06 113.62 118.51 1rml n SER 153 Ca 0.63 -3.21 0.00 0.00 -1.33 0.00 0.00 58.87 54.96 1rml n SER 153 Cb 0.14 -0.60 0.00 0.00 -0.75 0.00 0.00 64.21 63.00 1rml n SER 153 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14