#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 -0.19 -1.15 1.97 0.13 -1.93 -3.02 132.00 127.81 1rml h PRO 25 Ca 0.00 0.01 0.19 0.00 -0.87 0.00 0.00 66.00 65.34 1rml h PRO 25 Cb 0.00 0.04 -0.29 0.00 0.13 0.00 0.00 31.00 30.88 1rml h PRO 25 CO 0.00 -0.13 0.85 0.21 -0.23 0.00 0.00 178.00 178.71 1rml s LYS 26 N -2.17 0.15 -0.26 0.86 2.20 -1.26 -3.74 119.74 115.51 1rml s LYS 26 Ca -0.03 0.09 -0.03 0.00 -0.36 0.00 0.00 55.97 55.64 1rml s LYS 26 Cb 0.00 0.07 0.09 0.00 -1.51 0.00 0.00 37.83 36.48 1rml s LYS 26 CO 0.09 -0.03 0.10 -0.48 -0.36 0.00 0.00 175.35 174.66 1rml s LEU 27 N -0.56 1.13 0.99 5.43 0.05 -1.26 -1.88 118.68 122.58 1rml s LEU 27 Ca 0.07 -1.23 -0.12 0.00 0.05 0.00 0.00 54.13 52.90 1rml s LEU 27 Cb -0.03 -0.53 0.18 0.00 -2.05 0.00 0.00 46.19 43.76 1rml s LEU 27 CO -0.10 -0.40 1.08 -0.22 -0.55 0.00 0.00 176.35 176.17 1rml s LEU 28 N 1.92 1.75 -0.04 1.48 0.20 -1.26 -3.76 118.68 118.96 1rml s LEU 28 Ca 0.07 1.38 -0.30 0.00 0.69 0.00 0.00 54.13 55.97 1rml s LEU 28 Cb -0.17 -3.61 0.09 0.00 -0.43 0.00 0.00 46.19 42.07 1rml s LEU 28 CO -0.25 -3.13 0.76 -0.47 -0.29 0.00 0.00 176.35 172.97 1rml s TYR 29 N -2.87 -0.55 0.52 5.38 5.04 -1.17 -4.48 117.35 119.23 1rml s TYR 29 Ca 0.65 0.83 -0.11 0.00 -2.44 0.00 0.00 57.07 56.00 1rml s TYR 29 Cb -0.19 0.45 -0.05 0.00 0.35 0.00 0.00 41.96 42.51 1rml s TYR 29 CO 0.58 -0.57 0.92 0.00 -1.34 0.00 0.00 175.55 175.14 1rml n SER 31 N -2.07 0.00 -3.66 0.00 2.88 0.15 -4.22 113.62 106.70 1rml n SER 31 Ca 0.04 0.00 -0.36 0.00 -1.33 0.00 0.00 58.87 57.22 1rml n SER 31 Cb 0.54 0.00 -0.01 0.00 -0.75 0.00 0.00 64.21 64.00 1rml n SER 31 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40 1rml n ASN 32 N 0.00 -2.25 -2.83 -3.46 4.13 -1.26 -0.26 115.26 109.33 1rml n ASN 32 Ca 0.00 0.73 -0.01 0.00 1.68 0.00 0.00 54.58 56.98 1rml n ASN 32 Cb 0.00 -0.76 -0.00 0.00 -1.54 0.00 0.00 39.78 37.48 1rml n ASN 32 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1rml n GLY 33 N 1.95 -0.01 3.88 7.41 0.00 -1.26 -4.66 105.19 112.50 1rml n GLY 33 Ca 0.10 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.92 1rml n GLY 33 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1rml s GLY 34 N -3.50 1.68 0.00 -0.02 0.00 0.64 -4.73 107.32 101.39 1rml s GLY 34 Ca 0.00 -1.57 0.00 0.00 0.00 0.00 0.00 44.72 43.15 1rml s GLY 34 CO 0.02 -1.51 0.00 1.42 0.00 0.00 0.00 173.10 173.03 1rml n HIS 35 N -1.41 0.00 -3.68 1.90 8.25 -1.26 -4.62 115.22 114.41 1rml n HIS 35 Ca -0.02 0.00 -0.29 0.00 -0.26 0.00 0.00 57.72 57.14 1rml n HIS 35 Cb 0.59 0.00 -0.15 0.00 1.12 0.00 0.00 29.99 31.55 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 2.01 1.19 1.00 4.41 0.40 0.50 0.07 117.98 127.57 1rml s PHE 36 Ca 0.00 -1.35 -0.20 0.00 -0.60 0.00 0.00 56.93 54.78 1rml s PHE 36 Cb 0.00 -1.37 -0.14 0.00 0.51 0.00 0.00 43.02 42.02 1rml s PHE 36 CO 0.00 -0.82 -0.93 1.28 0.70 0.00 0.00 175.22 175.45 1rml n LEU 37 N 5.00 -4.42 -3.61 -0.37 4.77 -1.26 -0.84 117.00 116.27 1rml n LEU 37 Ca -0.04 0.12 -0.11 0.00 -0.03 0.00 0.00 56.01 55.94 1rml n LEU 37 Cb 0.43 -0.72 -0.05 0.00 -2.33 0.00 0.00 43.42 40.76 1rml n LEU 37 CO 0.09 -4.55 0.20 0.00 -1.33 0.00 0.00 177.39 171.80 1rml s ARG 38 N -2.20 1.07 -0.24 3.23 1.70 -0.68 -4.65 118.95 117.19 1rml s ARG 38 Ca 0.41 -0.59 -0.00 0.00 -0.47 0.00 0.00 55.73 55.08 1rml s ARG 38 Cb -0.08 0.48 0.07 0.00 -0.57 0.00 0.00 34.95 34.84 1rml s ARG 38 CO 0.75 -0.41 -0.02 -1.50 -1.08 0.00 0.00 175.30 173.04 1rml s ILE 39 N -3.49 1.29 0.12 4.99 1.10 -1.16 -3.97 121.20 120.09 1rml s ILE 39 Ca 0.01 -1.15 -0.20 0.00 -0.51 0.00 0.00 60.65 58.80 1rml s ILE 39 Cb 0.01 -1.67 -0.07 0.00 0.15 0.00 0.00 42.46 40.88 1rml s ILE 39 CO -0.10 -0.20 0.62 -0.76 -2.11 0.00 0.00 174.94 172.39 1rml s LEU 40 N 1.49 4.49 0.00 8.50 1.43 -1.09 -4.77 118.68 128.73 1rml s LEU 40 Ca -0.03 1.32 0.05 0.00 -1.03 0.00 0.00 54.13 54.45 1rml s LEU 40 Cb -0.18 -3.12 0.29 0.00 0.03 0.00 0.00 46.19 43.21 1rml s LEU 40 CO -0.08 0.21 0.96 -0.81 0.23 0.00 0.00 176.35 176.86 1rml n PRO 41 N 1.42 0.75 -0.05 1.29 -0.04 -1.26 -2.43 135.00 134.68 1rml n PRO 41 Ca -0.08 0.00 -0.13 0.00 -0.04 0.00 0.00 63.50 63.26 1rml n PRO 41 Cb 0.51 -1.10 -0.14 0.00 -0.04 0.00 0.00 33.50 32.72 1rml n PRO 41 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1rml n ASP 42 N -0.60 1.06 0.00 3.54 8.00 -1.26 -4.99 116.55 122.30 1rml n ASP 42 Ca 0.04 0.20 0.00 0.00 0.71 0.00 0.00 54.79 55.74 1rml n ASP 42 Cb 0.02 -0.01 0.00 0.00 -0.02 0.00 0.00 41.12 41.11 1rml n ASP 42 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1rml n GLY 43 N 1.79 1.73 3.35 0.44 0.00 -1.02 -5.15 105.19 106.33 1rml n GLY 43 Ca -0.28 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.56 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 -2.00 1.63 0.20 2.61 2.01 -1.26 -4.84 115.64 114.00 1rml s THR 44 Ca 0.00 -2.17 0.04 0.00 0.31 0.00 0.00 61.69 59.87 1rml s THR 44 Cb 0.00 -2.12 -0.05 0.00 0.01 0.00 0.00 72.50 70.34 1rml s THR 44 CO 0.00 -0.54 -0.04 -0.69 -0.69 0.00 0.00 174.62 172.66 1rml s VAL 45 N -3.04 1.09 -0.51 3.82 1.01 -1.26 -2.68 120.40 118.83 1rml s VAL 45 Ca 0.24 -2.05 0.00 0.00 0.00 0.00 0.00 61.98 60.17 1rml s VAL 45 Cb 0.01 -2.15 0.00 0.00 0.00 0.00 0.00 36.38 34.24 1rml s VAL 45 CO 0.07 -0.49 0.00 -0.90 0.00 0.00 0.00 175.10 173.79 1rml n ASP 46 N -0.33 0.00 -3.96 3.32 5.68 -1.25 -4.83 116.55 115.18 1rml n ASP 46 Ca -0.07 0.00 -0.17 0.00 -0.50 0.00 0.00 54.79 54.05 1rml n ASP 46 Cb 0.63 0.00 -0.15 0.00 -1.14 0.00 0.00 41.12 40.46 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 0.31 -0.23 6.12 0.00 -1.26 -1.68 107.32 110.58 1rml s GLY 47 Ca 0.00 -0.22 -0.06 0.00 0.00 0.00 0.00 44.72 44.44 1rml s GLY 47 CO 0.00 -0.11 0.04 -1.59 0.00 0.00 0.00 173.10 171.44 1rml s THR 48 N 0.03 4.13 0.26 0.90 2.01 -0.02 -4.48 115.64 118.47 1rml s THR 48 Ca 0.00 -0.24 -0.03 0.00 0.31 0.00 0.00 61.69 61.73 1rml s THR 48 Cb -0.04 -2.90 0.27 0.00 0.01 0.00 0.00 72.50 69.84 1rml s THR 48 CO -0.00 0.38 1.66 0.08 -0.69 0.00 0.00 174.62 176.05 1rml h ARG 49 N 7.90 0.19 -3.09 4.92 -0.00 -1.88 1.46 114.38 123.88 1rml h ARG 49 Ca -0.38 -0.01 -0.62 0.00 -0.00 0.00 0.00 59.98 58.97 1rml h ARG 49 Cb 1.17 -0.04 -0.40 0.00 -0.00 0.00 0.00 29.97 30.70 1rml h ARG 49 CO 0.60 0.12 -0.72 -0.51 -0.00 0.00 0.00 179.97 179.46 1rml s ASP 50 N -5.18 3.79 -0.15 0.08 1.01 -1.26 -4.53 116.67 110.43 1rml s ASP 50 Ca -0.13 -2.65 -0.14 0.00 0.71 0.00 0.00 52.55 50.34 1rml s ASP 50 Cb 0.23 -1.14 -0.06 0.00 1.01 0.00 0.00 42.92 42.96 1rml s ASP 50 CO 0.76 -0.27 0.53 -2.11 0.21 0.00 0.00 175.17 174.30 1rml n ARG 51 N 3.52 0.00 0.00 8.23 -4.01 -1.22 -4.80 116.66 118.38 1rml n ARG 51 Ca 0.08 0.00 0.00 0.00 -1.04 0.00 0.00 57.85 56.89 1rml n ARG 51 Cb 0.34 -0.45 0.00 0.00 -3.04 0.00 0.00 32.46 29.32 1rml n ARG 51 CO 0.00 0.00 0.00 0.45 -3.04 0.00 0.00 177.63 175.04 1rml n SER 52 N 1.57 0.00 -2.40 2.89 2.88 -1.26 -5.13 113.62 112.17 1rml n SER 52 Ca 0.12 0.00 -0.12 0.00 -1.33 0.00 0.00 58.87 57.54 1rml n SER 52 Cb -0.02 0.00 -0.04 0.00 -0.75 0.00 0.00 64.21 63.40 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 0.13 -0.21 -3.46 2.03 -1.26 -5.04 116.55 108.73 1rml n ASP 53 Ca 0.00 -2.18 -0.01 0.00 0.52 0.00 0.00 54.79 53.12 1rml n ASP 53 Cb 0.00 0.78 0.10 0.00 -0.72 0.00 0.00 41.12 41.28 1rml n ASP 53 CO 0.00 0.00 0.00 -0.61 -1.92 0.00 0.00 177.20 174.67 1rml h GLN 54 N 0.00 0.54 -0.67 -0.67 -0.00 -2.02 -3.41 115.11 108.88 1rml h GLN 54 Ca -0.14 -0.03 0.13 0.00 -0.00 0.00 0.00 58.65 58.60 1rml h GLN 54 Cb 0.65 -0.12 -0.20 0.00 0.00 0.00 0.00 27.48 27.81 1rml h GLN 54 CO 0.21 0.36 -0.18 -1.01 0.00 0.00 0.00 178.83 178.21 1rml s HIS 55 N -6.10 -1.21 -1.34 3.99 3.76 -1.26 -5.00 115.29 108.13 1rml s HIS 55 Ca -0.13 0.84 0.11 0.00 -0.15 0.00 0.00 55.06 55.74 1rml s HIS 55 Cb 0.16 0.26 0.08 0.00 1.11 0.00 0.00 32.58 34.19 1rml s HIS 55 CO 0.75 -0.70 0.83 0.44 -0.85 0.00 0.00 174.74 175.21 1rml n ILE 56 N 5.33 0.00 -1.69 0.60 -6.64 -1.26 -2.98 119.36 112.72 1rml n ILE 56 Ca 0.04 -0.49 -0.40 0.00 -1.77 0.00 0.00 62.75 60.13 1rml n ILE 56 Cb 0.55 1.22 0.02 0.00 -1.44 0.00 0.00 39.64 39.99 1rml n ILE 56 CO 0.00 0.00 0.00 0.00 -1.77 0.00 0.00 176.55 174.78 1rml n GLN 57 N 0.53 1.67 -4.25 6.28 3.00 -1.26 -4.18 117.38 119.16 1rml n GLN 57 Ca 0.06 0.60 -0.18 0.00 -0.01 0.00 0.00 57.00 57.47 1rml n GLN 57 Cb 0.27 -2.35 -0.08 0.00 0.00 0.00 0.00 30.24 28.08 1rml n GLN 57 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.06 176.55 1rml s LEU 58 N -1.94 1.63 -0.16 1.08 1.02 -0.79 -4.54 118.68 114.98 1rml s LEU 58 Ca 0.65 -1.71 -0.30 0.00 0.02 0.00 0.00 54.13 52.80 1rml s LEU 58 Cb -0.48 0.66 0.12 0.00 0.02 0.00 0.00 46.19 46.51 1rml s LEU 58 CO 0.55 -1.08 0.98 -1.58 0.02 0.00 0.00 176.35 175.23 1rml s GLN 59 N -3.43 0.62 0.36 1.70 2.00 -1.22 -4.32 119.66 115.38 1rml s GLN 59 Ca 0.39 0.17 0.07 0.00 -2.00 0.00 0.00 55.36 54.00 1rml s GLN 59 Cb 0.02 0.29 -0.02 0.00 0.80 0.00 0.00 33.01 34.10 1rml s GLN 59 CO 0.26 -0.19 0.34 -0.51 -0.50 0.00 0.00 175.29 174.69 1rml s LEU 60 N -1.07 3.58 -0.37 3.68 1.43 -1.26 -0.16 118.68 124.52 1rml s LEU 60 Ca -0.02 -0.53 0.13 0.00 -1.03 0.00 0.00 54.13 52.68 1rml s LEU 60 Cb -0.01 -2.24 0.40 0.00 0.03 0.00 0.00 46.19 44.38 1rml s LEU 60 CO 0.02 -0.46 1.01 -0.24 0.23 0.00 0.00 176.35 176.91 1rml n SER 61 N -1.47 0.06 -4.60 2.29 2.88 0.51 -4.74 113.62 108.56 1rml n SER 61 Ca 0.00 -2.85 -0.63 0.00 -1.33 0.00 0.00 58.87 54.07 1rml n SER 61 Cb 0.60 0.11 -0.09 0.00 -0.75 0.00 0.00 64.21 64.08 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 -0.05 -2.69 0.20 -1.46 0.00 -1.26 -2.65 120.51 112.60 1rml n ALA 62 Ca 0.10 0.56 0.02 0.00 0.00 0.00 0.00 53.44 54.12 1rml n ALA 62 Cb 0.78 -1.83 0.01 0.00 0.00 0.00 0.00 19.45 18.41 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 2.55 0.95 0.00 0.00 -0.00 -1.09 -4.82 120.64 118.22 1rml n GLU 63 Ca 0.25 -0.61 0.00 0.00 -0.00 0.00 0.00 57.16 56.79 1rml n GLU 63 Cb 0.02 -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 -0.03 0.00 -4.40 -1.84 7.64 -0.54 -5.01 113.62 109.43 1rml n SER 64 Ca 0.02 0.00 -0.48 0.00 1.01 0.00 0.00 58.87 59.42 1rml n SER 64 Cb 0.11 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.28 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 -0.05 1.94 -0.96 0.44 0.24 -1.26 0.74 118.33 119.41 1rml n VAL 65 Ca 0.00 -0.49 0.00 0.00 -2.04 0.00 0.00 64.34 61.81 1rml n VAL 65 Cb 0.00 -0.01 0.00 0.00 -1.47 0.00 0.00 33.84 32.36 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 1.98 0.71 3.15 7.63 0.00 -1.18 -4.92 105.19 112.55 1rml n GLY 66 Ca 0.18 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.24 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 -0.16 0.44 0.31 1.61 2.12 0.23 -3.98 118.70 119.26 1rml s GLU 67 Ca 0.00 0.64 0.05 0.00 0.36 0.00 0.00 54.97 56.01 1rml s GLU 67 Cb 0.00 0.34 -0.06 0.00 0.26 0.00 0.00 34.13 34.67 1rml s GLU 67 CO 0.00 -0.61 0.02 0.14 -0.54 0.00 0.00 175.26 174.27 1rml s VAL 68 N 2.88 1.32 0.41 3.70 -7.23 0.47 -1.47 120.40 120.48 1rml s VAL 68 Ca 0.14 -2.03 0.07 0.00 -1.81 0.00 0.00 61.98 58.35 1rml s VAL 68 Cb -0.11 -2.68 -0.08 0.00 0.56 0.00 0.00 36.38 34.07 1rml s VAL 68 CO -0.21 -0.10 0.02 -0.31 -0.31 0.00 0.00 175.10 174.20 1rml s TYR 69 N -3.21 2.52 -0.09 2.82 2.02 -1.08 0.14 117.35 120.46 1rml s TYR 69 Ca 0.34 -0.64 -0.04 0.00 -0.37 0.00 0.00 57.07 56.35 1rml s TYR 69 Cb 0.07 -1.77 0.05 0.00 -0.40 0.00 0.00 41.96 39.91 1rml s TYR 69 CO 0.14 0.43 0.22 0.42 -1.57 0.00 0.00 175.55 175.18 1rml s ILE 70 N -2.69 -0.08 -0.22 2.71 1.01 -1.26 0.19 121.20 120.87 1rml s ILE 70 Ca 0.36 0.17 -0.03 0.00 0.00 0.00 0.00 60.65 61.15 1rml s ILE 70 Cb 0.09 -0.34 0.07 0.00 0.01 0.00 0.00 42.46 42.29 1rml s ILE 70 CO 0.18 0.07 0.07 -0.75 0.00 0.00 0.00 174.94 174.52 1rml s LYS 71 N 1.35 0.48 -1.09 2.79 2.36 0.78 -1.13 119.74 125.28 1rml s LYS 71 Ca -0.08 -0.48 -0.24 0.00 -2.55 0.00 0.00 55.97 52.62 1rml s LYS 71 Cb -0.11 -1.89 -0.15 0.00 -1.05 0.00 0.00 37.83 34.63 1rml s LYS 71 CO -0.08 -0.76 1.98 0.45 1.55 0.00 0.00 175.35 178.49 1rml n SER 72 N 5.09 2.46 -4.53 1.43 2.88 0.14 -3.37 113.62 117.72 1rml n SER 72 Ca -0.07 -2.63 -0.18 0.00 -1.33 0.00 0.00 58.87 54.66 1rml n SER 72 Cb 0.46 -1.66 -0.14 0.00 -0.75 0.00 0.00 64.21 62.12 1rml n SER 72 CO 0.00 0.00 0.00 1.07 -1.23 0.00 0.00 175.04 174.88 1rml n THR 73 N 8.05 -0.00 0.00 2.46 5.66 -1.26 -3.09 114.28 126.09 1rml n THR 73 Ca 0.44 -0.50 0.00 0.00 -3.05 0.00 0.00 64.05 60.94 1rml n THR 73 Cb 0.46 -1.14 0.00 0.00 -1.55 0.00 0.00 70.33 68.10 1rml n THR 73 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 175.07 171.40 1rml n GLU 74 N 7.41 0.00 -2.77 1.09 -0.58 -1.26 -4.85 120.64 119.68 1rml n GLU 74 Ca 0.56 0.00 -0.10 0.00 -0.42 0.00 0.00 57.16 57.21 1rml n GLU 74 Cb 0.30 0.00 0.08 0.00 -0.57 0.00 0.00 31.44 31.26 1rml n GLU 74 CO 0.00 0.00 0.00 -2.37 -0.48 0.00 0.00 177.13 174.28 1rml n THR 75 N -0.99 0.00 -2.11 2.62 5.66 -1.18 -5.06 114.28 113.22 1rml n THR 75 Ca 0.00 -1.81 0.00 0.00 -3.05 0.00 0.00 64.05 59.19 1rml n THR 75 Cb 0.00 1.24 0.00 0.00 -1.55 0.00 0.00 70.33 70.02 1rml n THR 75 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1rml n GLY 76 N 0.19 0.00 3.29 1.09 0.00 -1.26 -4.97 105.19 103.53 1rml n GLY 76 Ca 0.06 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.00 1rml n GLY 76 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1rml s GLN 77 N -0.52 0.35 -0.40 1.61 -0.21 -1.26 -5.02 119.66 114.21 1rml s GLN 77 Ca 0.00 1.02 -0.09 0.00 0.02 0.00 0.00 55.36 56.31 1rml s GLN 77 Cb 0.00 0.30 0.06 0.00 1.00 0.00 0.00 33.01 34.37 1rml s GLN 77 CO 0.00 -0.23 0.23 0.71 -2.12 0.00 0.00 175.29 173.88 1rml s TYR 78 N 2.42 3.31 0.87 0.91 2.02 -1.26 0.28 117.35 125.89 1rml s TYR 78 Ca -0.03 -1.39 -0.16 0.00 -0.37 0.00 0.00 57.07 55.12 1rml s TYR 78 Cb -0.11 -2.76 -0.06 0.00 -0.40 0.00 0.00 41.96 38.62 1rml s TYR 78 CO -0.13 -0.79 -0.03 -0.11 -1.57 0.00 0.00 175.55 172.92 1rml n LEU 79 N 4.92 -2.30 0.00 -1.29 7.94 -0.28 -2.21 117.00 123.78 1rml n LEU 79 Ca -0.11 0.38 0.00 0.00 -1.11 0.00 0.00 56.01 55.17 1rml n LEU 79 Cb 0.44 -1.02 0.00 0.00 0.53 0.00 0.00 43.42 43.37 1rml n LEU 79 CO 0.38 -4.45 0.00 0.00 -1.11 0.00 0.00 177.39 172.20 1rml n ALA 80 N -2.72 0.00 -3.20 1.96 0.00 0.49 -4.42 120.51 112.62 1rml n ALA 80 Ca 0.05 0.00 -0.06 0.00 0.00 0.00 0.00 53.44 53.43 1rml n ALA 80 Cb 0.53 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.95 1rml n ALA 80 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 177.50 178.91 1rml s MET 81 N -1.93 0.81 1.03 0.00 1.75 -1.21 -1.67 119.30 118.08 1rml s MET 81 Ca 0.00 -0.63 -0.19 0.00 -1.25 0.00 0.00 55.69 53.62 1rml s MET 81 Cb 0.00 -0.22 -0.04 0.00 2.84 0.00 0.00 34.83 37.41 1rml s MET 81 CO 0.00 -1.22 -0.47 -0.25 -0.65 0.00 0.00 175.02 172.43 1rml n ASP 82 N 4.09 -3.24 0.23 1.11 8.00 -1.24 -4.53 116.55 120.97 1rml n ASP 82 Ca 0.13 0.07 0.13 0.00 0.71 0.00 0.00 54.79 55.83 1rml n ASP 82 Cb 0.53 -0.86 0.69 0.00 -0.02 0.00 0.00 41.12 41.46 1rml n ASP 82 CO 0.00 0.00 0.00 0.74 -0.39 0.00 0.00 177.20 177.55 1rml h THR 83 N -1.46 0.00 -0.01 -3.53 2.02 -1.94 0.83 112.91 108.83 1rml h THR 83 Ca -0.46 0.00 0.00 0.00 0.77 0.00 0.00 66.41 66.72 1rml h THR 83 Cb 1.34 0.56 0.00 0.00 -1.74 0.00 0.00 68.15 68.31 1rml h THR 83 CO 0.30 0.00 0.00 0.47 0.37 0.00 0.00 175.52 176.66 1rml n ASP 84 N -2.47 0.14 -2.41 4.18 8.00 -1.26 -4.86 116.55 117.86 1rml n ASP 84 Ca -0.02 -1.38 -0.18 0.00 0.71 0.00 0.00 54.79 53.92 1rml n ASP 84 Cb 0.18 -0.01 -0.01 0.00 -0.02 0.00 0.00 41.12 41.26 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 0.85 -0.50 3.27 0.44 0.00 0.29 0.19 105.19 109.73 1rml n GLY 85 Ca 0.16 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.80 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 -5.88 4.47 -0.45 0.99 0.20 -1.25 -1.88 118.68 114.88 1rml s LEU 86 Ca 0.00 -1.23 -0.46 0.00 0.69 0.00 0.00 54.13 53.13 1rml s LEU 86 Cb 0.00 -1.88 -0.20 0.00 -0.43 0.00 0.00 46.19 43.68 1rml s LEU 86 CO 0.00 -0.36 1.54 0.18 -0.29 0.00 0.00 176.35 177.41 1rml n LEU 87 N 4.81 1.09 -3.71 -0.68 4.32 -1.26 -3.66 117.00 117.91 1rml n LEU 87 Ca -0.12 1.17 -0.10 0.00 -0.02 0.00 0.00 56.01 56.95 1rml n LEU 87 Cb 0.44 -0.87 -0.05 0.00 -1.62 0.00 0.00 43.42 41.32 1rml n LEU 87 CO 0.32 -0.93 0.09 -0.72 -1.22 0.00 0.00 177.39 174.94 1rml s TYR 88 N 2.70 -0.08 0.01 -1.77 1.13 -0.67 -4.37 117.35 114.29 1rml s TYR 88 Ca 1.03 -0.27 0.06 0.00 -1.41 0.00 0.00 57.07 56.48 1rml s TYR 88 Cb -1.46 0.17 -0.03 0.00 -1.10 0.00 0.00 41.96 39.54 1rml s TYR 88 CO 0.79 -0.67 -0.18 0.20 -2.51 0.00 0.00 175.55 173.18 1rml s GLY 89 N -2.83 1.52 0.05 5.49 0.00 -1.26 0.18 107.32 110.47 1rml s GLY 89 Ca 0.04 -1.12 -0.09 0.00 0.00 0.00 0.00 44.72 43.56 1rml s GLY 89 CO -0.11 -0.97 0.19 -0.45 0.00 0.00 0.00 173.10 171.77 1rml s SER 90 N -1.12 0.05 -0.29 1.64 0.15 -0.94 -4.89 113.70 108.30 1rml s SER 90 Ca 0.13 -0.41 -0.01 0.00 0.70 0.00 0.00 55.95 56.37 1rml s SER 90 Cb -0.10 0.29 0.21 0.00 -1.71 0.00 0.00 66.02 64.71 1rml s SER 90 CO 0.03 -0.58 1.95 1.67 1.20 0.00 0.00 173.24 177.51 1rml n GLN 91 N 0.59 1.74 -3.59 5.44 7.27 -1.26 -4.04 117.38 123.53 1rml n GLN 91 Ca -0.18 -1.47 -0.29 0.00 0.07 0.00 0.00 57.00 55.12 1rml n GLN 91 Cb 0.59 -1.58 -0.12 0.00 2.41 0.00 0.00 30.24 31.54 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 -2.10 0.81 -0.63 1.69 -4.23 -1.26 -5.08 115.64 104.83 1rml s THR 92 Ca 0.29 -2.20 -0.27 0.00 -1.18 0.00 0.00 61.69 58.33 1rml s THR 92 Cb 0.23 -1.57 0.01 0.00 1.34 0.00 0.00 72.50 72.50 1rml s THR 92 CO 0.00 -0.95 1.54 -2.16 -0.54 0.00 0.00 174.62 172.51 1rml s PRO 93 N 0.64 3.02 0.00 3.99 0.04 -1.26 -4.36 135.00 137.06 1rml s PRO 93 Ca 0.19 0.30 0.00 0.00 0.04 0.00 0.00 61.00 61.53 1rml s PRO 93 Cb -0.22 -4.24 0.00 0.00 0.04 0.00 0.00 34.50 30.08 1rml s PRO 93 CO -0.01 -2.30 0.00 0.09 0.04 0.00 0.00 177.00 174.83 1rml n ASN 94 N 10.68 0.00 -3.14 6.66 3.02 -1.26 -4.98 115.26 126.24 1rml n ASN 94 Ca 0.12 0.00 -0.18 0.00 -0.03 0.00 0.00 54.58 54.49 1rml n ASN 94 Cb 0.50 0.00 -0.01 0.00 -0.61 0.00 0.00 39.78 39.66 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 0.00 1.74 0.00 3.52 4.71 -1.26 -2.39 120.64 126.96 1rml n GLU 95 Ca 0.00 -1.29 0.00 0.00 -0.01 0.00 0.00 57.16 55.86 1rml n GLU 95 Cb 0.00 -2.37 0.00 0.00 -1.01 0.00 0.00 31.44 28.06 1rml n GLU 95 CO 0.00 0.00 0.00 -1.91 0.09 0.00 0.00 177.13 175.31 1rml n GLU 96 N 4.32 0.00 0.22 3.49 2.13 -1.26 -4.48 120.64 125.06 1rml n GLU 96 Ca 0.37 0.00 0.10 0.00 0.66 0.00 0.00 57.16 58.29 1rml n GLU 96 Cb 0.11 0.00 0.40 0.00 0.27 0.00 0.00 31.44 32.22 1rml n GLU 96 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1rml s LEU 98 N -6.62 1.21 -0.21 0.00 1.43 -1.14 -4.24 118.68 109.09 1rml s LEU 98 Ca 0.02 0.73 -0.08 0.00 -1.03 0.00 0.00 54.13 53.76 1rml s LEU 98 Cb 0.09 -2.63 0.09 0.00 0.03 0.00 0.00 46.19 43.77 1rml s LEU 98 CO 0.64 -3.64 0.47 -0.36 0.23 0.00 0.00 176.35 173.69 1rml s PHE 99 N -3.12 -0.88 -0.53 0.29 0.08 0.36 -4.29 117.98 109.90 1rml s PHE 99 Ca 0.70 1.66 -0.26 0.00 0.12 0.00 0.00 56.93 59.14 1rml s PHE 99 Cb -0.11 0.40 -0.06 0.00 -0.57 0.00 0.00 43.02 42.68 1rml s PHE 99 CO 0.56 -0.50 2.27 -0.51 -0.10 0.00 0.00 175.22 176.95 1rml s LEU 100 N 2.46 3.36 0.19 -0.37 1.43 -0.99 -0.39 118.68 124.38 1rml s LEU 100 Ca -0.04 0.85 -0.30 0.00 -1.03 0.00 0.00 54.13 53.62 1rml s LEU 100 Cb -0.11 -2.51 -0.08 0.00 0.03 0.00 0.00 46.19 43.52 1rml s LEU 100 CO -0.14 -2.80 0.94 -0.70 0.23 0.00 0.00 176.35 173.89 1rml s GLU 101 N 7.99 4.79 -0.47 1.70 2.12 -1.26 -0.90 118.70 132.68 1rml s GLU 101 Ca 0.90 1.47 0.06 0.00 0.36 0.00 0.00 54.97 57.76 1rml s GLU 101 Cb -0.16 -3.31 0.18 0.00 0.26 0.00 0.00 34.13 31.10 1rml s GLU 101 CO 0.24 0.41 0.61 -0.98 -0.54 0.00 0.00 175.26 175.00 1rml s ARG 102 N -0.76 0.98 -0.50 4.30 1.70 -0.81 -3.12 118.95 120.74 1rml s ARG 102 Ca 0.43 -1.16 -0.15 0.00 -0.47 0.00 0.00 55.73 54.38 1rml s ARG 102 Cb -0.25 -0.36 -0.11 0.00 -0.57 0.00 0.00 34.95 33.66 1rml s ARG 102 CO 0.31 -1.31 1.33 -0.11 -1.08 0.00 0.00 175.30 174.44 1rml n LEU 103 N 3.21 0.12 0.19 -1.89 7.94 -1.26 -4.40 117.00 120.91 1rml n LEU 103 Ca 0.19 0.08 -0.15 0.00 -1.11 0.00 0.00 56.01 55.02 1rml n LEU 103 Cb 0.54 -0.45 -0.07 0.00 0.53 0.00 0.00 43.42 43.96 1rml n LEU 103 CO 0.01 -0.37 0.74 -0.08 -1.11 0.00 0.00 177.39 176.58 1rml h GLU 104 N 5.94 -0.47 0.00 1.96 4.22 -1.81 -3.45 114.58 120.97 1rml h GLU 104 Ca -0.02 0.03 0.00 0.00 0.08 0.00 0.00 59.36 59.45 1rml h GLU 104 Cb 0.65 0.11 0.00 0.00 0.50 0.00 0.00 28.75 30.00 1rml h GLU 104 CO 0.69 -0.32 0.00 -1.91 -2.18 0.00 0.00 179.01 175.30 1rml n GLU 105 N -5.32 0.00 -2.74 1.92 4.07 -1.26 -5.04 120.64 112.27 1rml n GLU 105 Ca -0.10 0.00 -0.01 0.00 -0.06 0.00 0.00 57.16 57.00 1rml n GLU 105 Cb 0.23 0.00 0.08 0.00 -0.06 0.00 0.00 31.44 31.69 1rml n GLU 105 CO 0.00 0.00 0.00 -1.71 -0.06 0.00 0.00 177.13 175.36 1rml n ASN 106 N 0.00 0.38 0.00 4.31 5.15 -1.26 -4.98 115.26 118.85 1rml n ASN 106 Ca 0.00 -2.10 0.00 0.00 -0.60 0.00 0.00 54.58 51.88 1rml n ASN 106 Cb 0.00 -0.02 0.00 0.00 -0.53 0.00 0.00 39.78 39.23 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 -0.94 -0.57 -0.81 1.20 8.25 -1.26 -5.15 115.22 115.94 1rml n HIS 107 Ca -0.03 0.00 -0.32 0.00 -0.26 0.00 0.00 57.72 57.11 1rml n HIS 107 Cb 0.83 0.11 0.09 0.00 1.12 0.00 0.00 29.99 32.15 1rml n HIS 107 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 1rml n TYR 108 N -1.29 -1.44 -2.59 4.41 4.01 -1.26 -4.94 117.16 114.07 1rml n TYR 108 Ca 0.00 0.41 -0.20 0.00 -0.16 0.00 0.00 57.90 57.96 1rml n TYR 108 Cb 0.00 -1.44 0.01 0.00 -0.31 0.00 0.00 39.34 37.60 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 1.11 3.30 -4.40 7.72 3.02 -1.17 -4.37 115.26 120.47 1rml n ASN 109 Ca -0.00 -3.30 -0.52 0.00 -0.03 0.00 0.00 54.58 50.73 1rml n ASN 109 Cb 0.62 -0.50 -0.08 0.00 -0.61 0.00 0.00 39.78 39.21 1rml n ASN 109 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 1rml n THR 110 N -0.28 0.13 -2.96 3.41 -2.24 -1.26 -4.61 114.28 106.47 1rml n THR 110 Ca 0.26 -0.20 -0.01 0.00 -2.27 0.00 0.00 64.05 61.83 1rml n THR 110 Cb 0.71 -1.37 0.00 0.00 -2.10 0.00 0.00 70.33 67.58 1rml n THR 110 CO 0.00 0.00 0.00 -1.22 -0.57 0.00 0.00 175.07 173.28 1rml n TYR 111 N 9.46 -2.99 -3.25 4.78 4.02 -1.26 -1.93 117.16 125.99 1rml n TYR 111 Ca 0.45 -0.12 0.00 0.00 -0.01 0.00 0.00 57.90 58.23 1rml n TYR 111 Cb 0.17 -0.03 -0.03 0.00 -0.02 0.00 0.00 39.34 39.43 1rml n TYR 111 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 176.86 176.27 1rml s ILE 112 N 0.75 -0.91 -0.62 -0.72 1.01 -0.08 -3.57 121.20 117.06 1rml s ILE 112 Ca 0.03 -0.01 -0.17 0.00 0.00 0.00 0.00 60.65 60.51 1rml s ILE 112 Cb -0.00 -0.95 -0.15 0.00 0.01 0.00 0.00 42.46 41.36 1rml s ILE 112 CO 0.02 -0.02 1.61 -0.24 0.00 0.00 0.00 174.94 176.31 1rml n SER 113 N 5.42 -0.04 0.28 3.58 2.88 -0.92 -2.33 113.62 122.48 1rml n SER 113 Ca -0.03 0.02 0.17 0.00 -1.33 0.00 0.00 58.87 57.71 1rml n SER 113 Cb 0.51 -0.52 0.92 0.00 -0.75 0.00 0.00 64.21 64.36 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 7.35 0.00 0.00 -1.46 3.64 -1.87 0.49 116.57 124.72 1rml h LYS 114 Ca -0.02 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.36 1rml h LYS 114 Cb 0.79 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.61 1rml h LYS 114 CO 0.90 0.00 0.00 1.17 -2.27 0.00 0.00 179.45 179.25 1rml n LYS 115 N -2.74 0.01 -2.66 1.90 0.00 -1.26 -4.05 118.16 109.35 1rml n LYS 115 Ca -0.02 0.28 -0.05 0.00 0.00 0.00 0.00 58.31 58.52 1rml n LYS 115 Cb 0.12 -1.50 0.08 0.00 0.00 0.00 0.00 35.03 33.73 1rml n LYS 115 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 177.40 175.01 1rml n HIS 116 N -1.49 -0.48 0.01 5.64 1.44 0.16 -4.88 115.22 115.63 1rml n HIS 116 Ca 0.03 -0.68 0.07 0.00 -2.01 0.00 0.00 57.72 55.13 1rml n HIS 116 Cb 0.15 1.08 0.26 0.00 0.12 0.00 0.00 29.99 31.60 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 1.51 2.93 0.18 1.59 0.00 -0.69 -3.77 120.51 122.26 1rml n ALA 117 Ca 0.01 -1.12 0.09 0.00 0.00 0.00 0.00 53.44 52.42 1rml n ALA 117 Cb 0.71 -1.02 0.11 0.00 0.00 0.00 0.00 19.45 19.25 1rml n ALA 117 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 1rml h GLU 118 N 2.94 0.00 -0.23 0.00 4.81 -1.92 -3.15 114.58 117.03 1rml h GLU 118 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1rml h GLU 118 Cb 1.11 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.49 1rml h GLU 118 CO 0.17 0.13 0.00 1.17 -0.73 0.00 0.00 179.01 179.75 1rml n LYS 119 N -3.08 1.92 -1.76 1.92 0.00 -1.25 -4.94 118.16 110.96 1rml n LYS 119 Ca 0.03 -1.76 -0.15 0.00 0.00 0.00 0.00 58.31 56.43 1rml n LYS 119 Cb 0.59 -1.30 -0.04 0.00 0.00 0.00 0.00 35.03 34.28 1rml n LYS 119 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.40 177.49 1rml n ASN 120 N 0.75 -4.63 -4.57 3.14 5.03 -1.19 -4.83 115.26 108.96 1rml n ASN 120 Ca 0.11 0.21 -0.14 0.00 0.87 0.00 0.00 54.58 55.63 1rml n ASN 120 Cb 0.41 -3.56 -0.10 0.00 -1.02 0.00 0.00 39.78 35.51 1rml n ASN 120 CO 0.00 0.00 0.00 0.26 -1.83 0.00 0.00 177.26 175.69 1rml s TRP 121 N -2.61 1.20 0.37 3.10 0.51 -1.25 -4.41 118.94 115.85 1rml s TRP 121 Ca 0.00 2.18 -0.06 0.00 -2.12 0.00 0.00 56.10 56.10 1rml s TRP 121 Cb 0.00 -3.37 0.10 0.00 -0.81 0.00 0.00 33.47 29.38 1rml s TRP 121 CO 0.00 -0.99 0.22 1.19 -0.51 0.00 0.00 176.95 176.86 1rml n PHE 122 N 19.30 -2.46 -3.87 -1.98 3.01 0.50 -2.17 117.46 129.80 1rml n PHE 122 Ca 0.43 -0.20 -0.30 0.00 1.01 0.00 0.00 57.45 58.39 1rml n PHE 122 Cb 0.46 -0.31 -0.15 0.00 -0.01 0.00 0.00 39.48 39.46 1rml n PHE 122 CO 0.00 0.00 0.00 0.54 1.01 0.00 0.00 176.76 178.31 1rml s VAL 123 N -1.27 1.49 -0.29 -4.37 0.11 -1.23 -4.37 120.40 110.46 1rml s VAL 123 Ca 0.17 -1.74 -0.22 0.00 -2.93 0.00 0.00 61.98 57.26 1rml s VAL 123 Cb -0.03 -2.07 0.17 0.00 -1.53 0.00 0.00 36.38 32.92 1rml s VAL 123 CO 0.14 -0.58 1.23 -0.83 -3.33 0.00 0.00 175.10 171.73 1rml s GLY 124 N 1.32 0.24 -0.23 6.54 0.00 -1.25 -3.88 107.32 110.05 1rml s GLY 124 Ca 0.08 3.33 -0.29 0.00 0.00 0.00 0.00 44.72 47.84 1rml s GLY 124 CO -0.16 2.20 1.13 1.08 0.00 0.00 0.00 173.10 177.35 1rml s LEU 125 N 0.51 4.07 -0.11 0.66 1.02 -1.26 -4.69 118.68 118.88 1rml s LEU 125 Ca 0.00 1.39 -0.10 0.00 0.02 0.00 0.00 54.13 55.45 1rml s LEU 125 Cb -0.04 -3.54 -0.04 0.00 0.02 0.00 0.00 46.19 42.58 1rml s LEU 125 CO -0.12 -0.77 0.37 1.17 0.02 0.00 0.00 176.35 177.02 1rml n LYS 126 N 6.59 0.00 -0.21 1.70 4.81 -0.85 -4.42 118.16 125.79 1rml n LYS 126 Ca 0.13 0.00 -0.09 0.00 -0.87 0.00 0.00 58.31 57.48 1rml n LYS 126 Cb 0.46 -0.33 -0.01 0.00 0.02 0.00 0.00 35.03 35.17 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 0.99 0.44 0.00 1.64 -0.00 -1.26 -2.32 118.16 117.66 1rml n LYS 127 Ca 0.08 -0.75 0.00 0.00 -0.00 0.00 0.00 58.31 57.63 1rml n LYS 127 Cb -0.01 -2.15 0.00 0.00 -0.00 0.00 0.00 35.03 32.87 1rml n LYS 127 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.40 177.49 1rml n ASN 128 N 5.20 0.00 0.00 -5.58 3.02 -1.26 -4.97 115.26 111.67 1rml n ASN 128 Ca 0.13 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.68 1rml n ASN 128 Cb 0.07 0.04 0.00 0.00 -0.61 0.00 0.00 39.78 39.27 1rml n ASN 128 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1rml n GLY 129 N 1.10 -0.22 0.00 7.41 0.00 -0.98 -5.01 105.19 107.49 1rml n GLY 129 Ca 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 46.02 45.87 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 -4.94 1.61 7.64 -1.25 -4.99 113.62 111.68 1rml n SER 130 Ca 0.00 0.00 -0.24 0.00 1.01 0.00 0.00 58.87 59.64 1rml n SER 130 Cb 0.00 0.00 -0.00 0.00 -1.01 0.00 0.00 64.21 63.20 1rml n SER 130 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1rml s LYS 132 N -4.47 2.09 -0.07 0.00 2.20 -1.26 -4.88 119.74 113.36 1rml s LYS 132 Ca 0.44 -2.31 -0.03 0.00 -0.36 0.00 0.00 55.97 53.71 1rml s LYS 132 Cb -0.10 -1.22 0.04 0.00 -1.51 0.00 0.00 37.83 35.04 1rml s LYS 132 CO 0.38 -0.39 0.15 -0.98 -0.36 0.00 0.00 175.35 174.15 1rml s ARG 133 N -3.81 0.08 2.80 4.03 1.70 -1.25 -4.21 118.95 118.29 1rml s ARG 133 Ca 0.13 0.41 0.00 0.00 -0.47 0.00 0.00 55.73 55.80 1rml s ARG 133 Cb 0.02 -0.20 0.00 0.00 -0.57 0.00 0.00 34.95 34.21 1rml s ARG 133 CO 0.07 -0.19 0.00 0.41 -1.08 0.00 0.00 175.30 174.51 1rml n GLY 134 N 4.43 0.61 3.10 3.88 0.00 0.51 -4.53 105.19 113.19 1rml n GLY 134 Ca -0.22 -1.14 -0.41 0.00 0.00 0.00 0.00 46.02 44.25 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 7.33 2.21 -0.71 1.61 -0.04 -1.26 -3.88 135.00 140.27 1rml n PRO 135 Ca 0.00 -2.38 -0.01 0.00 -0.04 0.00 0.00 63.50 61.07 1rml n PRO 135 Cb 0.00 -3.23 -0.02 0.00 -0.04 0.00 0.00 33.50 30.21 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 7.04 0.00 -3.41 0.54 3.00 -1.26 -5.04 116.66 117.53 1rml n ARG 136 Ca 0.50 -0.57 -0.21 0.00 -0.01 0.00 0.00 57.85 57.56 1rml n ARG 136 Cb 0.41 0.05 -0.10 0.00 0.00 0.00 0.00 32.46 32.82 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 -0.23 0.15 0.55 -1.32 -1.25 -4.76 115.64 108.78 1rml s THR 137 Ca 0.03 -0.97 0.03 0.00 -1.21 0.00 0.00 61.69 59.56 1rml s THR 137 Cb 0.03 -0.89 -0.01 0.00 -1.51 0.00 0.00 72.50 70.12 1rml s THR 137 CO -0.01 -0.65 0.10 1.41 -2.21 0.00 0.00 174.62 173.25 1rml n HIS 138 N 4.62 -0.19 0.00 9.09 8.25 -1.26 0.19 115.22 135.91 1rml n HIS 138 Ca 0.06 -1.14 0.00 0.00 -0.26 0.00 0.00 57.72 56.37 1rml n HIS 138 Cb 0.43 0.08 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 -0.31 -0.53 -2.01 4.41 9.36 -1.26 -3.78 117.16 123.04 1rml n TYR 139 Ca 0.01 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.23 1rml n TYR 139 Cb 0.25 0.00 0.00 0.00 -0.63 0.00 0.00 39.34 38.96 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 -0.34 2.51 2.98 0.00 -1.26 -4.80 105.19 104.28 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 -4.00 0.35 0.58 1.61 -0.21 -1.25 -4.97 119.66 111.77 1rml s GLN 141 Ca 0.00 -0.87 0.24 0.00 0.02 0.00 0.00 55.36 54.75 1rml s GLN 141 Cb 0.00 -1.23 0.82 0.00 1.00 0.00 0.00 33.01 33.60 1rml s GLN 141 CO 0.00 -1.10 1.22 1.63 -2.12 0.00 0.00 175.29 174.92 1rml n LYS 142 N 4.75 0.01 -0.32 2.91 4.01 -1.26 0.18 118.16 128.44 1rml n LYS 142 Ca 0.01 0.97 0.13 0.00 -0.51 0.00 0.00 58.31 58.92 1rml n LYS 142 Cb 0.40 -2.42 0.32 0.00 -0.51 0.00 0.00 35.03 32.82 1rml n LYS 142 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 1rml h ALA 143 N 0.47 1.55 -0.21 7.82 0.00 -1.86 0.89 119.26 127.93 1rml h ALA 143 Ca 0.44 0.12 -0.11 0.00 0.00 0.00 0.00 54.91 55.37 1rml h ALA 143 Cb 2.75 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 20.58 1rml h ALA 143 CO -0.00 -0.23 -0.34 -0.84 0.00 0.00 0.00 179.25 177.84 1rml h ILE 144 N 0.55 1.29 -3.33 0.00 3.07 0.18 -3.34 117.51 115.92 1rml h ILE 144 Ca 0.57 -1.42 -0.57 0.00 1.55 0.00 0.00 64.86 65.00 1rml h ILE 144 Cb 1.02 1.50 -0.06 0.00 -0.27 0.00 0.00 36.82 39.01 1rml h ILE 144 CO -0.46 0.44 0.99 -0.76 -1.05 0.00 0.00 178.15 177.31 1rml s LEU 145 N -8.51 3.72 -0.20 0.16 1.02 0.31 -4.06 118.68 111.12 1rml s LEU 145 Ca -0.06 0.89 -0.01 0.00 0.02 0.00 0.00 54.13 54.97 1rml s LEU 145 Cb 0.13 -3.54 0.01 0.00 0.02 0.00 0.00 46.19 42.81 1rml s LEU 145 CO 0.79 -1.24 -0.13 -0.36 0.02 0.00 0.00 176.35 175.43 1rml s PHE 146 N 4.75 2.86 -0.42 0.29 0.08 -1.26 0.33 117.98 124.61 1rml s PHE 146 Ca 0.56 -1.36 -0.12 0.00 0.12 0.00 0.00 56.93 56.12 1rml s PHE 146 Cb -0.13 -2.00 0.06 0.00 -0.57 0.00 0.00 43.02 40.37 1rml s PHE 146 CO 0.28 -0.70 0.29 -1.17 -0.10 0.00 0.00 175.22 173.82 1rml s LEU 147 N 1.37 5.16 0.08 -0.37 1.98 0.28 -3.04 118.68 124.15 1rml s LEU 147 Ca 0.05 -1.23 -0.30 0.00 -2.89 0.00 0.00 54.13 49.75 1rml s LEU 147 Cb -0.14 -2.08 -0.06 0.00 0.66 0.00 0.00 46.19 44.58 1rml s LEU 147 CO -0.09 -0.52 1.16 -2.16 -1.89 0.00 0.00 176.35 172.85 1rml s PRO 148 N 1.56 4.47 -0.48 0.98 0.04 -1.26 -3.03 135.00 137.28 1rml s PRO 148 Ca 0.03 1.73 0.08 0.00 0.04 0.00 0.00 61.00 62.88 1rml s PRO 148 Cb -0.22 -3.34 0.28 0.00 0.04 0.00 0.00 34.50 31.26 1rml s PRO 148 CO 0.06 -0.17 0.69 1.47 0.04 0.00 0.00 177.00 179.08 1rml n LEU 149 N 3.61 1.90 -4.79 -3.56 -0.00 -1.25 -5.03 117.00 107.88 1rml n LEU 149 Ca 0.07 -5.10 -0.29 0.00 -0.00 0.00 0.00 56.01 50.69 1rml n LEU 149 Cb 0.47 0.13 0.12 0.00 -0.00 0.00 0.00 43.42 44.13 1rml n LEU 149 CO 0.55 2.15 0.71 -2.16 -0.00 0.00 0.00 177.39 178.65 1rml s PRO 150 N -2.12 1.53 -0.35 1.47 0.04 -1.26 -4.16 135.00 130.14 1rml s PRO 150 Ca 0.39 0.43 0.04 0.00 0.04 0.00 0.00 61.00 61.91 1rml s PRO 150 Cb 0.22 -1.87 0.24 0.00 0.04 0.00 0.00 34.50 33.13 1rml s PRO 150 CO -0.08 -1.96 1.23 1.33 0.04 0.00 0.00 177.00 177.56 1rml n VAL 151 N -3.63 0.00 -1.54 -0.36 0.24 -1.25 -5.01 118.33 106.79 1rml n VAL 151 Ca 0.07 -0.91 -0.16 0.00 -2.04 0.00 0.00 64.34 61.30 1rml n VAL 151 Cb 0.58 0.95 -0.12 0.00 -1.47 0.00 0.00 33.84 33.78 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 -0.05 0.77 -3.15 -1.34 2.88 -1.14 -4.67 113.62 106.91 1rml n SER 152 Ca -0.11 -1.20 -0.19 0.00 -1.33 0.00 0.00 58.87 56.04 1rml n SER 152 Cb 0.72 -1.31 -0.03 0.00 -0.75 0.00 0.00 64.21 62.85 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 14.58 1.23 0.00 -3.46 2.88 -1.24 -5.07 113.62 122.55 1rml n SER 153 Ca 0.54 -3.07 0.00 0.00 -1.33 0.00 0.00 58.87 55.00 1rml n SER 153 Cb 0.34 -0.61 0.00 0.00 -0.75 0.00 0.00 64.21 63.19 1rml n SER 153 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14