#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 0.00 -6.35 1.97 0.13 -1.98 -3.44 132.00 122.33 1rml h PRO 25 Ca 0.00 0.00 -0.65 0.00 -0.87 0.00 0.00 66.00 64.48 1rml h PRO 25 Cb 0.00 0.00 -0.12 0.00 0.13 0.00 0.00 31.00 31.01 1rml h PRO 25 CO 0.00 0.48 -0.66 0.21 -0.23 0.00 0.00 178.00 177.80 1rml s LYS 26 N -3.35 2.54 -0.27 0.86 2.20 -1.26 -4.28 119.74 116.17 1rml s LYS 26 Ca 0.01 -0.84 -0.28 0.00 -0.36 0.00 0.00 55.97 54.51 1rml s LYS 26 Cb 0.10 -2.53 0.18 0.00 -1.51 0.00 0.00 37.83 34.06 1rml s LYS 26 CO 0.72 0.54 1.30 -0.48 -0.36 0.00 0.00 175.35 177.07 1rml s LEU 27 N -2.28 -0.13 0.71 5.43 0.05 -1.26 -4.49 118.68 116.70 1rml s LEU 27 Ca 0.25 0.19 -0.07 0.00 0.05 0.00 0.00 54.13 54.56 1rml s LEU 27 Cb -0.12 1.29 0.06 0.00 -2.05 0.00 0.00 46.19 45.38 1rml s LEU 27 CO 0.18 -0.09 1.02 -0.22 -0.55 0.00 0.00 176.35 176.69 1rml s LEU 28 N -0.60 2.82 -0.22 1.48 0.20 -1.26 -2.48 118.68 118.62 1rml s LEU 28 Ca 0.06 0.44 -0.11 0.00 0.69 0.00 0.00 54.13 55.21 1rml s LEU 28 Cb -0.02 -3.07 0.08 0.00 -0.43 0.00 0.00 46.19 42.74 1rml s LEU 28 CO -0.09 -1.62 0.51 -0.47 -0.29 0.00 0.00 176.35 174.40 1rml s TYR 29 N -3.25 -0.83 -0.16 5.38 5.04 -0.96 -4.25 117.35 118.31 1rml s TYR 29 Ca 0.60 1.66 -0.29 0.00 -2.44 0.00 0.00 57.07 56.60 1rml s TYR 29 Cb -0.11 0.42 -0.01 0.00 0.35 0.00 0.00 41.96 42.61 1rml s TYR 29 CO 0.45 -0.45 1.23 0.00 -1.34 0.00 0.00 175.55 175.44 1rml n SER 31 N 6.38 0.00 -0.12 0.00 2.88 0.37 -2.19 113.62 120.95 1rml n SER 31 Ca 0.13 0.86 -0.16 0.00 -1.33 0.00 0.00 58.87 58.37 1rml n SER 31 Cb 0.45 -0.41 -0.13 0.00 -0.75 0.00 0.00 64.21 63.37 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 -2.74 1.42 -0.26 -3.46 4.13 -1.25 -4.39 115.26 108.71 1rml n ASN 32 Ca 0.00 -0.09 0.25 0.00 1.68 0.00 0.00 54.58 56.42 1rml n ASN 32 Cb 0.00 -0.02 0.47 0.00 -1.54 0.00 0.00 39.78 38.69 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 2.11 -0.63 3.25 7.41 0.00 -1.23 -4.69 105.19 111.41 1rml n GLY 33 Ca -0.42 0.66 0.00 0.00 0.00 0.00 0.00 46.02 46.26 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 -1.22 0.70 3.95 -0.02 0.00 -0.93 -4.77 105.19 102.90 1rml n GLY 34 Ca 0.30 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 46.09 1rml n GLY 34 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1rml s HIS 35 N -3.09 3.48 -0.34 1.61 3.76 -1.26 -4.25 115.29 115.20 1rml s HIS 35 Ca 0.00 0.23 0.01 0.00 -0.15 0.00 0.00 55.06 55.15 1rml s HIS 35 Cb 0.00 -1.79 0.09 0.00 1.11 0.00 0.00 32.58 31.99 1rml s HIS 35 CO 0.00 0.25 0.06 -0.06 -0.85 0.00 0.00 174.74 174.15 1rml s PHE 36 N -2.15 3.53 0.04 1.40 0.40 0.57 -0.53 117.98 121.24 1rml s PHE 36 Ca 0.38 -2.48 -0.33 0.00 -0.60 0.00 0.00 56.93 53.89 1rml s PHE 36 Cb -0.10 -2.69 -0.17 0.00 0.51 0.00 0.00 43.02 40.57 1rml s PHE 36 CO 0.33 -0.91 0.85 1.28 0.70 0.00 0.00 175.22 177.47 1rml n LEU 37 N 4.46 -0.23 -4.17 -0.37 4.77 -1.26 -3.14 117.00 117.06 1rml n LEU 37 Ca -0.04 1.03 -0.11 0.00 -0.03 0.00 0.00 56.01 56.86 1rml n LEU 37 Cb 0.42 -0.82 -0.10 0.00 -2.33 0.00 0.00 43.42 40.59 1rml n LEU 37 CO 0.26 -1.89 -0.38 0.00 -1.33 0.00 0.00 177.39 174.05 1rml s ARG 38 N -0.18 0.85 -0.00 3.23 1.70 -0.02 -4.52 118.95 120.00 1rml s ARG 38 Ca 0.76 -1.35 -0.25 0.00 -0.47 0.00 0.00 55.73 54.43 1rml s ARG 38 Cb -1.07 -0.19 0.06 0.00 -0.57 0.00 0.00 34.95 33.18 1rml s ARG 38 CO 0.50 -0.03 0.55 -1.50 -1.08 0.00 0.00 175.30 173.75 1rml s ILE 39 N -3.64 0.02 -0.05 4.99 -1.16 -1.18 -2.34 121.20 117.83 1rml s ILE 39 Ca 0.13 -0.17 0.03 0.00 -0.51 0.00 0.00 60.65 60.13 1rml s ILE 39 Cb 0.05 -0.93 -0.03 0.00 0.61 0.00 0.00 42.46 42.17 1rml s ILE 39 CO -0.04 -0.09 -0.13 -0.76 -2.81 0.00 0.00 174.94 171.10 1rml s LEU 40 N -1.56 2.78 0.00 8.50 2.01 0.27 -4.43 118.68 126.25 1rml s LEU 40 Ca -0.09 -0.18 0.12 0.00 0.01 0.00 0.00 54.13 53.99 1rml s LEU 40 Cb -0.01 -1.57 0.73 0.00 0.01 0.00 0.00 46.19 45.34 1rml s LEU 40 CO 0.04 0.34 1.28 -0.81 1.01 0.00 0.00 176.35 178.21 1rml n PRO 41 N 2.33 0.75 -0.01 1.29 -0.04 -1.26 -2.78 135.00 135.28 1rml n PRO 41 Ca -0.17 0.00 -0.22 0.00 -0.04 0.00 0.00 63.50 63.07 1rml n PRO 41 Cb 0.52 -1.25 -0.13 0.00 -0.04 0.00 0.00 33.50 32.60 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 0.33 0.00 3.54 1.82 -2.03 -3.48 116.42 116.60 1rml h ASP 42 Ca 0.00 -0.83 0.00 0.00 -0.39 0.00 0.00 57.03 55.81 1rml h ASP 42 Cb 0.00 -0.11 0.00 0.00 0.68 0.00 0.00 39.33 39.90 1rml h ASP 42 CO 0.00 1.73 0.00 0.61 -1.61 0.00 0.00 179.24 179.97 1rml n GLY 43 N 1.81 0.00 3.17 -0.78 0.00 -1.12 -5.10 105.19 103.17 1rml n GLY 43 Ca -0.30 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.63 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 0.15 0.13 2.61 2.01 -1.23 -4.83 115.64 114.47 1rml s THR 44 Ca 0.00 -1.63 -0.13 0.00 0.31 0.00 0.00 61.69 60.24 1rml s THR 44 Cb 0.00 -1.67 0.02 0.00 0.01 0.00 0.00 72.50 70.86 1rml s THR 44 CO 0.00 -0.67 0.33 -0.69 -0.69 0.00 0.00 174.62 172.90 1rml s VAL 45 N -3.95 0.09 -2.02 3.82 1.01 -1.26 -0.56 120.40 117.53 1rml s VAL 45 Ca 0.13 -0.89 0.00 0.00 0.00 0.00 0.00 61.98 61.22 1rml s VAL 45 Cb 0.06 -1.35 0.00 0.00 0.00 0.00 0.00 36.38 35.09 1rml s VAL 45 CO -0.06 -0.40 0.00 -0.90 0.00 0.00 0.00 175.10 173.75 1rml n ASP 46 N -0.19 0.00 -4.45 3.32 5.68 -0.99 -4.79 116.55 115.14 1rml n ASP 46 Ca -0.14 0.00 -0.22 0.00 -0.50 0.00 0.00 54.79 53.93 1rml n ASP 46 Cb 0.63 0.00 -0.10 0.00 -1.14 0.00 0.00 41.12 40.51 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 1.93 -0.08 6.12 0.00 -1.26 -0.84 107.32 113.19 1rml s GLY 47 Ca 0.00 -1.97 -0.03 0.00 0.00 0.00 0.00 44.72 42.72 1rml s GLY 47 CO 0.00 -1.85 0.17 -1.59 0.00 0.00 0.00 173.10 169.83 1rml s THR 48 N -3.06 -0.18 0.60 0.90 2.01 -1.19 -4.34 115.64 110.39 1rml s THR 48 Ca 0.31 0.27 0.27 0.00 0.31 0.00 0.00 61.69 62.86 1rml s THR 48 Cb 0.05 -0.29 0.37 0.00 0.01 0.00 0.00 72.50 72.64 1rml s THR 48 CO 0.13 0.11 1.63 -0.09 -0.69 0.00 0.00 174.62 175.71 1rml h ARG 49 N 7.86 0.00 -2.59 4.92 1.12 -1.88 1.68 114.38 125.49 1rml h ARG 49 Ca -0.26 0.00 -0.10 0.00 -1.11 0.00 0.00 59.98 58.50 1rml h ARG 49 Cb 1.13 0.00 -0.26 0.00 -0.01 0.00 0.00 29.97 30.82 1rml h ARG 49 CO 0.26 0.00 -0.29 -0.51 -3.11 0.00 0.00 179.97 176.33 1rml s ASP 50 N -4.37 -0.51 -0.23 -3.80 1.11 -1.26 -4.18 116.67 103.43 1rml s ASP 50 Ca -0.03 0.94 -0.35 0.00 0.18 0.00 0.00 52.55 53.29 1rml s ASP 50 Cb 0.14 0.88 -0.12 0.00 1.07 0.00 0.00 42.92 44.90 1rml s ASP 50 CO 0.49 -0.20 2.00 -2.11 1.18 0.00 0.00 175.17 176.53 1rml n ARG 51 N 4.40 1.60 -2.66 8.23 1.85 -1.26 -4.78 116.66 124.05 1rml n ARG 51 Ca -0.21 0.53 -0.04 0.00 -1.00 0.00 0.00 57.85 57.13 1rml n ARG 51 Cb 0.55 -2.55 0.08 0.00 -1.05 0.00 0.00 32.46 29.49 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 8.07 -1.18 -2.20 2.89 2.88 -1.26 -5.13 113.62 117.69 1rml n SER 52 Ca 0.31 -1.69 -0.10 0.00 -1.33 0.00 0.00 58.87 56.06 1rml n SER 52 Cb 0.26 0.72 -0.04 0.00 -0.75 0.00 0.00 64.21 64.40 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 1.32 -0.45 -0.18 -3.46 2.03 -1.26 -5.03 116.55 109.51 1rml n ASP 53 Ca -0.01 -2.17 0.07 0.00 0.52 0.00 0.00 54.79 53.20 1rml n ASP 53 Cb 0.72 1.00 0.36 0.00 -0.72 0.00 0.00 41.12 42.48 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 0.71 -0.03 -0.67 -0.00 -2.02 -3.42 115.11 109.68 1rml h GLN 54 Ca -0.13 -0.04 0.30 0.00 -0.00 0.00 0.00 58.65 58.78 1rml h GLN 54 Cb 0.66 -0.16 -0.21 0.00 0.00 0.00 0.00 27.48 27.77 1rml h GLN 54 CO 0.19 0.47 0.29 -1.01 0.00 0.00 0.00 178.83 178.77 1rml s HIS 55 N -5.66 -0.04 -0.27 3.99 3.76 -1.26 -5.03 115.29 110.79 1rml s HIS 55 Ca -0.10 0.04 0.11 0.00 -0.15 0.00 0.00 55.06 54.97 1rml s HIS 55 Cb 0.20 0.01 0.53 0.00 1.11 0.00 0.00 32.58 34.43 1rml s HIS 55 CO 0.77 -0.02 1.49 0.44 -0.85 0.00 0.00 174.74 176.57 1rml n ILE 56 N 5.44 2.52 -2.59 0.60 -0.00 -1.26 -3.07 119.36 121.00 1rml n ILE 56 Ca -0.07 -2.40 -0.42 0.00 -0.00 0.00 0.00 62.75 59.85 1rml n ILE 56 Cb 0.55 -0.31 -0.03 0.00 -0.00 0.00 0.00 39.64 39.86 1rml n ILE 56 CO 0.00 0.00 0.00 -1.10 -0.00 0.00 0.00 176.55 175.45 1rml s GLN 57 N -3.12 4.38 -0.11 6.28 -0.21 -1.26 -4.32 119.66 121.30 1rml s GLN 57 Ca 0.45 1.50 -0.03 0.00 0.02 0.00 0.00 55.36 57.30 1rml s GLN 57 Cb 0.39 -3.56 0.04 0.00 1.00 0.00 0.00 33.01 30.89 1rml s GLN 57 CO 0.04 -0.39 0.06 -0.51 -2.12 0.00 0.00 175.29 172.37 1rml s LEU 58 N 2.18 0.40 0.22 2.90 1.02 -1.26 -3.67 118.68 120.48 1rml s LEU 58 Ca 0.51 -0.31 0.06 0.00 0.02 0.00 0.00 54.13 54.41 1rml s LEU 58 Cb -0.21 -0.28 -0.04 0.00 0.02 0.00 0.00 46.19 45.69 1rml s LEU 58 CO 0.19 -0.29 0.18 -1.58 0.02 0.00 0.00 176.35 174.87 1rml s GLN 59 N 2.09 2.92 0.31 1.70 2.00 0.45 -4.50 119.66 124.64 1rml s GLN 59 Ca 0.03 -0.99 0.08 0.00 -2.00 0.00 0.00 55.36 52.48 1rml s GLN 59 Cb -0.14 -2.59 -0.03 0.00 0.80 0.00 0.00 33.01 31.04 1rml s GLN 59 CO -0.06 0.43 0.22 -0.51 -0.50 0.00 0.00 175.29 174.87 1rml s LEU 60 N -3.58 3.57 -0.37 3.68 1.43 -1.26 0.14 118.68 122.28 1rml s LEU 60 Ca 0.32 -0.49 0.12 0.00 -1.03 0.00 0.00 54.13 53.05 1rml s LEU 60 Cb -0.09 -2.13 0.40 0.00 0.03 0.00 0.00 46.19 44.40 1rml s LEU 60 CO 0.24 -0.24 1.09 -0.24 0.23 0.00 0.00 176.35 177.44 1rml n SER 61 N -1.25 -0.36 -4.57 2.29 2.88 0.51 -4.66 113.62 108.45 1rml n SER 61 Ca -0.04 -2.79 -0.56 0.00 -1.33 0.00 0.00 58.87 54.16 1rml n SER 61 Cb 0.59 0.35 -0.07 0.00 -0.75 0.00 0.00 64.21 64.33 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 -0.16 -2.03 -0.10 -1.46 0.00 -1.26 -2.33 120.51 113.18 1rml n ALA 62 Ca 0.06 0.54 0.00 0.00 0.00 0.00 0.00 53.44 54.05 1rml n ALA 62 Cb 0.79 -1.95 0.00 0.00 0.00 0.00 0.00 19.45 18.29 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 2.34 -0.61 0.00 0.00 0.28 -1.09 -4.82 120.64 116.74 1rml n GLU 63 Ca 0.20 -0.53 0.00 0.00 -0.16 0.00 0.00 57.16 56.67 1rml n GLU 63 Cb 0.13 -0.95 0.00 0.00 1.43 0.00 0.00 31.44 32.05 1rml n GLU 63 CO 0.00 0.00 0.00 0.43 -0.16 0.00 0.00 177.13 177.40 1rml n SER 64 N -0.04 0.00 -4.73 -1.84 7.64 -0.16 -4.99 113.62 109.50 1rml n SER 64 Ca 0.00 0.00 -0.42 0.00 1.01 0.00 0.00 58.87 59.46 1rml n SER 64 Cb 0.05 0.00 -0.01 0.00 -1.01 0.00 0.00 64.21 63.23 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 -0.91 1.44 -0.92 0.44 0.24 -1.26 -0.42 118.33 116.94 1rml n VAL 65 Ca 0.00 -0.36 0.00 0.00 -2.04 0.00 0.00 64.34 61.94 1rml n VAL 65 Cb 0.00 -1.80 0.00 0.00 -1.47 0.00 0.00 33.84 30.57 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 1.48 0.42 3.05 7.63 0.00 0.23 -4.91 105.19 113.09 1rml n GLY 66 Ca 0.07 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.07 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 -0.64 0.50 0.24 1.61 2.12 0.45 -3.91 118.70 119.06 1rml s GLU 67 Ca 0.00 0.46 0.03 0.00 0.36 0.00 0.00 54.97 55.82 1rml s GLU 67 Cb 0.00 0.05 -0.05 0.00 0.26 0.00 0.00 34.13 34.39 1rml s GLU 67 CO 0.00 -0.97 0.02 0.14 -0.54 0.00 0.00 175.26 173.91 1rml s VAL 68 N 2.72 0.96 0.38 3.70 -7.23 -1.07 -0.99 120.40 118.86 1rml s VAL 68 Ca 0.11 -2.02 0.08 0.00 -1.81 0.00 0.00 61.98 58.34 1rml s VAL 68 Cb -0.12 -2.41 -0.06 0.00 0.56 0.00 0.00 36.38 34.34 1rml s VAL 68 CO -0.26 -0.26 0.03 -0.31 -0.31 0.00 0.00 175.10 173.99 1rml s TYR 69 N -3.47 2.53 -0.09 2.82 2.02 -0.98 0.15 117.35 120.32 1rml s TYR 69 Ca 0.30 -0.56 -0.04 0.00 -0.37 0.00 0.00 57.07 56.40 1rml s TYR 69 Cb 0.06 -1.68 0.05 0.00 -0.40 0.00 0.00 41.96 39.99 1rml s TYR 69 CO 0.10 0.42 0.18 0.42 -1.57 0.00 0.00 175.55 175.10 1rml s ILE 70 N -2.62 -0.23 -0.14 2.71 1.01 -1.26 0.19 121.20 120.86 1rml s ILE 70 Ca 0.36 0.30 -0.01 0.00 0.00 0.00 0.00 60.65 61.30 1rml s ILE 70 Cb 0.05 -0.31 -0.02 0.00 0.01 0.00 0.00 42.46 42.19 1rml s ILE 70 CO 0.19 0.13 -0.10 -0.75 0.00 0.00 0.00 174.94 174.41 1rml s LYS 71 N 2.04 3.46 -1.18 2.79 2.20 0.36 0.35 119.74 129.77 1rml s LYS 71 Ca -0.00 -0.62 -0.17 0.00 -0.36 0.00 0.00 55.97 54.82 1rml s LYS 71 Cb -0.12 -2.73 -0.04 0.00 -1.51 0.00 0.00 37.83 33.43 1rml s LYS 71 CO -0.06 0.24 2.12 0.45 -0.36 0.00 0.00 175.35 177.74 1rml n SER 72 N 3.47 3.45 -2.06 1.43 2.88 -1.25 0.17 113.62 121.71 1rml n SER 72 Ca -0.18 -2.76 -0.15 0.00 -1.33 0.00 0.00 58.87 54.45 1rml n SER 72 Cb 0.53 -1.43 -0.09 0.00 -0.75 0.00 0.00 64.21 62.47 1rml n SER 72 CO 0.00 0.00 0.00 0.41 -1.23 0.00 0.00 175.04 174.22 1rml n THR 73 N 5.41 0.00 0.00 2.46 -1.04 -1.24 -3.35 114.28 116.52 1rml n THR 73 Ca 0.51 -0.10 0.00 0.00 -2.04 0.00 0.00 64.05 62.42 1rml n THR 73 Cb 0.39 -0.12 0.00 0.00 -1.82 0.00 0.00 70.33 68.77 1rml n THR 73 CO 0.00 0.00 0.00 1.21 -0.64 0.00 0.00 175.07 175.64 1rml n GLU 74 N 3.26 0.00 -3.00 -2.82 0.00 -1.26 -4.66 120.64 112.15 1rml n GLU 74 Ca 0.31 0.00 -0.23 0.00 0.00 0.00 0.00 57.16 57.23 1rml n GLU 74 Cb 0.04 0.00 -0.03 0.00 0.00 0.00 0.00 31.44 31.44 1rml n GLU 74 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.13 174.76 1rml n THR 75 N 0.00 1.89 -3.72 6.31 5.66 -1.21 -4.96 114.28 118.25 1rml n THR 75 Ca 0.00 -5.16 -0.22 0.00 -3.05 0.00 0.00 64.05 55.62 1rml n THR 75 Cb 0.00 -0.96 0.01 0.00 -1.55 0.00 0.00 70.33 67.83 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 -0.07 -0.51 0.00 1.09 0.00 -1.26 -4.91 105.19 99.53 1rml n GLY 76 Ca 0.29 0.22 0.00 0.00 0.00 0.00 0.00 46.02 46.52 1rml n GLY 76 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 1rml n GLN 77 N -2.71 1.89 -3.63 1.61 7.27 -1.26 -4.98 117.38 115.57 1rml n GLN 77 Ca -0.09 0.00 -0.02 0.00 0.07 0.00 0.00 57.00 56.96 1rml n GLN 77 Cb 0.32 0.00 -0.05 0.00 2.41 0.00 0.00 30.24 32.92 1rml n GLN 77 CO 0.00 0.00 0.00 0.71 0.07 0.00 0.00 177.06 177.84 1rml s TYR 78 N 1.42 -1.21 0.23 3.69 2.02 -1.26 -3.85 117.35 118.39 1rml s TYR 78 Ca 0.00 2.17 -0.30 0.00 -0.37 0.00 0.00 57.07 58.57 1rml s TYR 78 Cb 0.00 0.73 -0.09 0.00 -0.40 0.00 0.00 41.96 42.20 1rml s TYR 78 CO 0.00 -0.60 1.04 -1.17 -1.57 0.00 0.00 175.55 173.25 1rml s LEU 79 N 2.54 4.56 0.31 -1.29 2.96 0.16 -2.39 118.68 125.53 1rml s LEU 79 Ca -0.07 2.09 -0.10 0.00 -0.22 0.00 0.00 54.13 55.83 1rml s LEU 79 Cb -0.10 -3.61 0.01 0.00 0.50 0.00 0.00 46.19 42.99 1rml s LEU 79 CO -0.19 -0.07 0.56 0.00 -1.32 0.00 0.00 176.35 175.33 1rml s ALA 80 N -0.83 -0.06 -0.06 5.97 0.00 0.24 -4.52 121.76 122.50 1rml s ALA 80 Ca 0.45 -1.04 -0.02 0.00 0.00 0.00 0.00 51.96 51.35 1rml s ALA 80 Cb -0.29 1.00 0.03 0.00 0.00 0.00 0.00 23.12 23.86 1rml s ALA 80 CO 0.36 -0.87 0.03 1.41 0.00 0.00 0.00 175.76 176.69 1rml s MET 81 N -3.30 0.31 1.09 0.00 1.75 -1.26 0.20 119.30 118.09 1rml s MET 81 Ca 0.23 0.21 -0.17 0.00 -1.25 0.00 0.00 55.69 54.71 1rml s MET 81 Cb -0.02 -0.82 0.24 0.00 2.84 0.00 0.00 34.83 37.06 1rml s MET 81 CO 0.13 -0.33 1.15 -0.51 -0.65 0.00 0.00 175.02 174.81 1rml s ASP 82 N 2.06 1.91 0.53 1.11 1.01 -1.22 -4.75 116.67 117.31 1rml s ASP 82 Ca 0.05 0.70 0.29 0.00 0.71 0.00 0.00 52.55 54.30 1rml s ASP 82 Cb -0.12 -1.03 1.58 0.00 1.01 0.00 0.00 42.92 44.36 1rml s ASP 82 CO -0.04 -3.52 1.87 0.74 0.21 0.00 0.00 175.17 174.43 1rml h THR 83 N -2.17 0.00 -0.35 -1.27 2.02 -1.97 0.99 112.91 110.17 1rml h THR 83 Ca -0.47 0.00 0.00 0.00 0.77 0.00 0.00 66.41 66.71 1rml h THR 83 Cb 1.30 0.65 0.00 0.00 -1.74 0.00 0.00 68.15 68.35 1rml h THR 83 CO 0.43 0.00 0.00 -0.67 0.37 0.00 0.00 175.52 175.65 1rml n ASP 84 N -2.64 2.43 -1.41 4.18 2.03 -1.26 -4.83 116.55 115.04 1rml n ASP 84 Ca -0.02 -2.14 -0.11 0.00 0.52 0.00 0.00 54.79 53.03 1rml n ASP 84 Cb 0.21 -0.36 -0.05 0.00 -0.72 0.00 0.00 41.12 40.20 1rml n ASP 84 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1rml n GLY 85 N 0.86 0.98 3.42 0.27 0.00 0.34 -0.99 105.19 110.08 1rml n GLY 85 Ca 0.13 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.71 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 -3.66 5.07 -0.14 0.99 0.20 -1.25 -3.56 118.68 116.33 1rml s LEU 86 Ca 0.00 -1.08 -0.38 0.00 0.69 0.00 0.00 54.13 53.36 1rml s LEU 86 Cb 0.00 -2.40 -0.18 0.00 -0.43 0.00 0.00 46.19 43.17 1rml s LEU 86 CO 0.00 -0.99 1.12 0.18 -0.29 0.00 0.00 176.35 176.37 1rml n LEU 87 N 6.30 0.34 -3.80 -0.68 4.32 -1.26 -3.44 117.00 118.78 1rml n LEU 87 Ca -0.07 1.06 -0.10 0.00 -0.02 0.00 0.00 56.01 56.88 1rml n LEU 87 Cb 0.44 -0.82 -0.07 0.00 -1.62 0.00 0.00 43.42 41.35 1rml n LEU 87 CO 0.56 -1.43 -0.03 -0.72 -1.22 0.00 0.00 177.39 174.55 1rml s TYR 88 N 0.86 0.04 0.08 -1.77 1.13 0.54 -4.14 117.35 114.09 1rml s TYR 88 Ca 0.87 -0.39 -0.10 0.00 -1.41 0.00 0.00 57.07 56.04 1rml s TYR 88 Cb -1.22 0.02 -0.06 0.00 -1.10 0.00 0.00 41.96 39.60 1rml s TYR 88 CO 0.59 -0.55 0.40 0.20 -2.51 0.00 0.00 175.55 173.67 1rml s GLY 89 N -2.65 2.34 -0.13 5.49 0.00 -1.26 0.79 107.32 111.91 1rml s GLY 89 Ca 0.02 -0.38 -0.09 0.00 0.00 0.00 0.00 44.72 44.26 1rml s GLY 89 CO -0.09 -0.17 0.32 -0.45 0.00 0.00 0.00 173.10 172.71 1rml s SER 90 N -1.77 -0.35 -0.28 1.64 0.15 -1.00 -4.94 113.70 107.14 1rml s SER 90 Ca 0.33 0.66 -0.01 0.00 0.70 0.00 0.00 55.95 57.63 1rml s SER 90 Cb -0.14 0.61 0.15 0.00 -1.71 0.00 0.00 66.02 64.93 1rml s SER 90 CO 0.18 -0.14 2.16 1.67 1.20 0.00 0.00 173.24 178.31 1rml n GLN 91 N 3.57 1.77 -3.42 5.44 7.27 -1.26 -4.30 117.38 126.45 1rml n GLN 91 Ca -0.19 -1.42 -0.24 0.00 0.07 0.00 0.00 57.00 55.23 1rml n GLN 91 Cb 0.56 -1.60 -0.10 0.00 2.41 0.00 0.00 30.24 31.50 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 -1.86 -0.08 -0.81 1.69 -4.23 -1.26 -5.08 115.64 104.01 1rml s THR 92 Ca 0.31 -1.35 -0.25 0.00 -1.18 0.00 0.00 61.69 59.21 1rml s THR 92 Cb 0.23 -0.92 0.00 0.00 1.34 0.00 0.00 72.50 73.16 1rml s THR 92 CO -0.03 -0.80 1.63 -2.16 -0.54 0.00 0.00 174.62 172.72 1rml s PRO 93 N 1.27 2.99 0.00 3.99 0.04 -1.26 -4.30 135.00 137.73 1rml s PRO 93 Ca 0.17 -0.23 0.00 0.00 0.04 0.00 0.00 61.00 60.98 1rml s PRO 93 Cb -0.19 -4.71 0.00 0.00 0.04 0.00 0.00 34.50 29.64 1rml s PRO 93 CO -0.02 -2.60 0.00 0.09 0.04 0.00 0.00 177.00 174.51 1rml n ASN 94 N 11.21 0.00 -3.78 6.66 3.02 -1.26 -5.00 115.26 126.11 1rml n ASN 94 Ca 0.23 0.00 -0.39 0.00 -0.03 0.00 0.00 54.58 54.38 1rml n ASN 94 Cb 0.50 0.00 -0.09 0.00 -0.61 0.00 0.00 39.78 39.58 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 0.83 0.00 3.52 1.02 -1.26 -2.55 120.64 122.19 1rml n GLU 95 Ca 0.00 -1.59 0.00 0.00 -0.02 0.00 0.00 57.16 55.55 1rml n GLU 95 Cb 0.00 -2.96 0.00 0.00 -0.02 0.00 0.00 31.44 28.46 1rml n GLU 95 CO 0.00 0.00 0.00 -1.91 1.18 0.00 0.00 177.13 176.40 1rml n GLU 96 N 7.63 0.00 -0.08 3.49 2.13 -1.26 -4.66 120.64 127.89 1rml n GLU 96 Ca 0.47 0.00 -0.02 0.00 0.66 0.00 0.00 57.16 58.28 1rml n GLU 96 Cb 0.42 0.00 0.24 0.00 0.27 0.00 0.00 31.44 32.37 1rml n GLU 96 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1rml n LEU 98 N -4.28 -2.68 -3.36 0.00 4.77 -1.17 -4.31 117.00 105.96 1rml n LEU 98 Ca 0.03 -0.07 -0.14 0.00 -0.03 0.00 0.00 56.01 55.80 1rml n LEU 98 Cb 0.23 -0.71 -0.08 0.00 -2.33 0.00 0.00 43.42 40.52 1rml n LEU 98 CO 0.39 -2.77 -0.13 0.12 -1.33 0.00 0.00 177.39 173.67 1rml s PHE 99 N -2.11 -0.67 -0.79 -1.77 2.19 0.39 -4.07 117.98 111.15 1rml s PHE 99 Ca 0.45 -0.01 -0.29 0.00 0.33 0.00 0.00 56.93 57.41 1rml s PHE 99 Cb 0.00 -0.34 -0.16 0.00 -1.31 0.00 0.00 43.02 41.21 1rml s PHE 99 CO 0.65 -0.95 2.58 1.28 1.83 0.00 0.00 175.22 180.62 1rml n LEU 100 N 5.29 1.13 -4.49 6.12 4.77 0.34 -2.61 117.00 127.54 1rml n LEU 100 Ca -0.00 -0.10 -0.24 0.00 -0.03 0.00 0.00 56.01 55.63 1rml n LEU 100 Cb 0.47 -1.19 -0.10 0.00 -2.33 0.00 0.00 43.42 40.27 1rml n LEU 100 CO -0.00 -1.07 -0.46 -0.70 -1.33 0.00 0.00 177.39 173.82 1rml s GLU 101 N 8.69 1.75 0.00 3.23 -6.30 -1.25 0.19 118.70 125.01 1rml s GLU 101 Ca 1.20 -1.68 0.00 0.00 -2.50 0.00 0.00 54.97 51.99 1rml s GLU 101 Cb -0.82 -1.84 0.00 0.00 0.00 0.00 0.00 34.13 31.48 1rml s GLU 101 CO 0.40 0.35 0.00 2.89 0.02 0.00 0.00 175.26 178.91 1rml n ARG 102 N -0.53 0.00 -3.23 4.30 0.00 -1.25 0.76 116.66 116.71 1rml n ARG 102 Ca -0.06 0.00 0.03 0.00 -0.00 0.00 0.00 57.85 57.82 1rml n ARG 102 Cb 0.59 0.00 -0.04 0.00 -0.00 0.00 0.00 32.46 33.01 1rml n ARG 102 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.63 176.46 1rml s LEU 103 N 0.00 -0.21 -0.17 2.89 2.96 -1.26 -4.88 118.68 118.01 1rml s LEU 103 Ca 0.00 0.27 0.06 0.00 -0.22 0.00 0.00 54.13 54.24 1rml s LEU 103 Cb 0.00 1.23 -0.22 0.00 0.50 0.00 0.00 46.19 47.70 1rml s LEU 103 CO 0.00 -0.04 0.17 1.21 -1.32 0.00 0.00 176.35 176.37 1rml n GLU 104 N 4.75 0.68 0.00 1.98 0.00 -1.26 -4.98 120.64 121.81 1rml n GLU 104 Ca -0.07 0.17 0.00 0.00 0.00 0.00 0.00 57.16 57.26 1rml n GLU 104 Cb 0.55 -1.62 0.00 0.00 0.00 0.00 0.00 31.44 30.37 1rml n GLU 104 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.13 175.22 1rml n GLU 105 N -3.15 0.00 -1.42 5.31 2.13 -1.26 -5.05 120.64 117.21 1rml n GLU 105 Ca -0.34 0.00 0.04 0.00 0.66 0.00 0.00 57.16 57.53 1rml n GLU 105 Cb 1.06 0.00 0.04 0.00 0.27 0.00 0.00 31.44 32.81 1rml n GLU 105 CO 0.00 0.00 0.00 -1.71 -0.41 0.00 0.00 177.13 175.01 1rml n ASN 106 N 0.00 1.09 0.04 4.31 2.85 -1.26 -4.93 115.26 117.35 1rml n ASN 106 Ca 0.00 -2.21 0.00 0.00 -0.11 0.00 0.00 54.58 52.26 1rml n ASN 106 Cb 0.00 -0.33 0.00 0.00 1.24 0.00 0.00 39.78 40.69 1rml n ASN 106 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1rml n HIS 107 N 0.31 -1.98 -0.96 1.20 1.44 -1.26 -5.15 115.22 108.83 1rml n HIS 107 Ca 0.07 0.26 -0.34 0.00 -2.01 0.00 0.00 57.72 55.70 1rml n HIS 107 Cb 1.10 0.89 0.04 0.00 0.12 0.00 0.00 29.99 32.13 1rml n HIS 107 CO 0.00 0.00 0.00 0.66 -2.81 0.00 0.00 176.34 174.19 1rml n TYR 108 N -2.37 -4.73 -3.25 -1.40 4.01 -1.26 -4.93 117.16 103.21 1rml n TYR 108 Ca 0.00 0.01 -0.25 0.00 -0.16 0.00 0.00 57.90 57.50 1rml n TYR 108 Cb 0.00 -1.37 -0.07 0.00 -0.31 0.00 0.00 39.34 37.59 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 3.21 1.63 -4.55 7.72 4.13 -1.20 -4.29 115.26 121.91 1rml n ASN 109 Ca -0.01 -3.02 -0.35 0.00 1.68 0.00 0.00 54.58 52.88 1rml n ASN 109 Cb 0.52 -0.64 -0.03 0.00 -1.54 0.00 0.00 39.78 38.08 1rml n ASN 109 CO 0.00 0.00 0.00 0.42 0.28 0.00 0.00 177.26 177.96 1rml s THR 110 N -1.87 3.01 0.82 3.41 -4.23 -1.26 -4.80 115.64 110.72 1rml s THR 110 Ca 0.38 0.00 -0.14 0.00 -1.18 0.00 0.00 61.69 60.75 1rml s THR 110 Cb 0.18 -3.03 0.19 0.00 1.34 0.00 0.00 72.50 71.19 1rml s THR 110 CO -0.08 -0.02 1.10 -1.22 -0.54 0.00 0.00 174.62 173.86 1rml n TYR 111 N 16.06 -3.99 -3.66 3.99 4.02 -1.26 -3.91 117.16 128.41 1rml n TYR 111 Ca 0.37 -0.97 -0.11 0.00 -0.01 0.00 0.00 57.90 57.18 1rml n TYR 111 Cb 0.54 -0.86 -0.08 0.00 -0.02 0.00 0.00 39.34 38.92 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 -3.38 -0.00 -0.87 -0.72 1.01 0.51 -3.22 121.20 114.51 1rml s ILE 112 Ca 0.63 0.02 -0.20 0.00 0.00 0.00 0.00 60.65 61.09 1rml s ILE 112 Cb -0.02 -0.86 -0.23 0.00 0.01 0.00 0.00 42.46 41.37 1rml s ILE 112 CO 0.44 0.01 2.36 -0.24 0.00 0.00 0.00 174.94 177.51 1rml n SER 113 N 3.57 0.29 -0.36 3.58 2.88 0.40 0.12 113.62 124.11 1rml n SER 113 Ca -0.18 -0.68 0.06 0.00 -1.33 0.00 0.00 58.87 56.74 1rml n SER 113 Cb 0.57 -1.07 0.22 0.00 -0.75 0.00 0.00 64.21 63.18 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 12.82 1.00 -0.06 -1.46 3.11 -1.83 1.18 116.57 131.34 1rml h LYS 114 Ca -0.03 -0.06 0.02 0.00 -2.81 0.00 0.00 60.65 57.77 1rml h LYS 114 Cb 1.14 -0.23 -0.00 0.00 -1.00 0.00 0.00 32.23 32.15 1rml h LYS 114 CO 1.34 0.66 0.34 -0.22 -2.81 0.00 0.00 179.45 178.76 1rml h LYS 115 N 1.03 0.00 -0.07 1.90 3.64 -1.83 -3.23 116.57 118.01 1rml h LYS 115 Ca 0.47 0.00 -0.14 0.00 -1.27 0.00 0.00 60.65 59.72 1rml h LYS 115 Cb 0.39 0.00 -0.14 0.00 -0.41 0.00 0.00 32.23 32.08 1rml h LYS 115 CO -0.24 0.00 -0.28 -2.39 -2.27 0.00 0.00 179.45 174.27 1rml n HIS 116 N -3.02 -2.04 1.11 1.91 1.44 0.18 -4.97 115.22 109.81 1rml n HIS 116 Ca -0.01 -1.22 0.13 0.00 -2.01 0.00 0.00 57.72 54.61 1rml n HIS 116 Cb 0.40 1.34 0.40 0.00 0.12 0.00 0.00 29.99 32.25 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 1.72 3.12 0.19 1.59 0.00 0.35 -3.70 120.51 123.78 1rml n ALA 117 Ca 0.06 -0.30 0.12 0.00 0.00 0.00 0.00 53.44 53.32 1rml n ALA 117 Cb 0.66 -1.22 0.65 0.00 0.00 0.00 0.00 19.45 19.53 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 0.30 0.00 -0.16 0.00 4.81 -1.89 0.92 114.58 118.56 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 0.48 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.86 1rml h GLU 118 CO 0.00 0.00 0.00 1.17 -0.73 0.00 0.00 179.01 179.45 1rml n LYS 119 N -2.35 1.61 -2.47 1.92 4.81 -1.24 -4.95 118.16 115.49 1rml n LYS 119 Ca -0.02 -1.64 -0.20 0.00 -0.87 0.00 0.00 58.31 55.58 1rml n LYS 119 Cb 0.08 -1.30 -0.00 0.00 0.02 0.00 0.00 35.03 33.83 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 0.81 -5.65 -4.57 3.14 5.03 0.32 -4.82 115.26 109.52 1rml n ASN 120 Ca 0.11 -0.06 -0.20 0.00 0.87 0.00 0.00 54.58 55.30 1rml n ASN 120 Cb 0.40 -4.66 -0.07 0.00 -1.02 0.00 0.00 39.78 34.43 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 -3.00 1.46 0.62 3.10 0.51 -1.25 -4.21 118.94 116.18 1rml s TRP 121 Ca 0.04 1.44 -0.10 0.00 -2.12 0.00 0.00 56.10 55.36 1rml s TRP 121 Cb -0.02 -3.67 0.15 0.00 -0.81 0.00 0.00 33.47 29.12 1rml s TRP 121 CO 0.06 -1.39 0.59 1.19 -0.51 0.00 0.00 176.95 176.88 1rml n PHE 122 N 16.92 -3.53 -3.95 -1.98 3.72 0.53 0.15 117.46 129.32 1rml n PHE 122 Ca 0.44 -0.53 -0.30 0.00 -0.05 0.00 0.00 57.45 57.00 1rml n PHE 122 Cb 0.45 -0.59 -0.15 0.00 -0.94 0.00 0.00 39.48 38.25 1rml n PHE 122 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25 1rml s VAL 123 N -2.09 1.61 0.20 -4.37 0.11 -1.20 -4.57 120.40 110.09 1rml s VAL 123 Ca 0.37 -1.37 -0.20 0.00 -2.93 0.00 0.00 61.98 57.86 1rml s VAL 123 Cb -0.03 -1.91 0.04 0.00 -1.53 0.00 0.00 36.38 32.95 1rml s VAL 123 CO 0.28 -0.17 0.57 -0.83 -3.33 0.00 0.00 175.10 171.63 1rml s GLY 124 N 1.34 -0.24 -0.20 6.54 0.00 -1.26 -4.65 107.32 108.85 1rml s GLY 124 Ca -0.04 -0.04 0.01 0.00 0.00 0.00 0.00 44.72 44.65 1rml s GLY 124 CO -0.07 -0.12 -0.17 1.08 0.00 0.00 0.00 173.10 173.82 1rml s LEU 125 N -2.85 2.39 0.02 0.66 1.43 -1.23 -3.02 118.68 116.08 1rml s LEU 125 Ca 0.07 -0.73 -0.27 0.00 -1.03 0.00 0.00 54.13 52.17 1rml s LEU 125 Cb -0.02 -1.52 -0.14 0.00 0.03 0.00 0.00 46.19 44.55 1rml s LEU 125 CO -0.04 -0.03 0.69 1.17 0.23 0.00 0.00 176.35 178.37 1rml n LYS 126 N 4.61 0.00 -0.52 1.70 4.81 -0.51 -4.56 118.16 123.69 1rml n LYS 126 Ca -0.20 0.00 -0.15 0.00 -0.87 0.00 0.00 58.31 57.09 1rml n LYS 126 Cb 0.49 -0.99 -0.02 0.00 0.02 0.00 0.00 35.03 34.53 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 1.45 0.00 1.64 -0.00 -1.26 -2.10 118.16 118.88 1rml n LYS 127 Ca 0.14 -1.14 0.00 0.00 -0.00 0.00 0.00 58.31 57.31 1rml n LYS 127 Cb 0.07 -2.28 0.00 0.00 -0.00 0.00 0.00 35.03 32.82 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 4.32 0.00 0.00 -5.58 2.85 -1.26 -5.09 115.26 110.49 1rml n ASN 128 Ca 0.31 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.78 1rml n ASN 128 Cb 0.11 0.15 0.00 0.00 1.24 0.00 0.00 39.78 41.28 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 -0.73 0.23 0.00 8.20 0.00 -0.89 -4.84 105.19 107.16 1rml n GLY 129 Ca 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 46.02 45.92 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 -4.73 1.61 7.64 -1.26 -4.97 113.62 111.91 1rml n SER 130 Ca 0.00 0.00 -0.30 0.00 1.01 0.00 0.00 58.87 59.58 1rml n SER 130 Cb 0.00 0.00 0.12 0.00 -1.01 0.00 0.00 64.21 63.32 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 -4.91 3.33 0.06 0.00 2.47 -1.17 -4.55 119.74 114.97 1rml s LYS 132 Ca 0.63 -0.73 0.02 0.00 -1.56 0.00 0.00 55.97 54.32 1rml s LYS 132 Cb -0.18 -2.86 -0.04 0.00 -1.46 0.00 0.00 37.83 33.29 1rml s LYS 132 CO 0.57 0.47 0.10 0.50 0.16 0.00 0.00 175.35 177.15 1rml s ARG 133 N -3.57 3.00 0.22 4.03 6.06 -1.26 -4.39 118.95 123.04 1rml s ARG 133 Ca 0.34 -0.62 -0.17 0.00 -2.50 0.00 0.00 55.73 52.78 1rml s ARG 133 Cb -0.10 -2.80 0.22 0.00 0.06 0.00 0.00 34.95 32.34 1rml s ARG 133 CO 0.28 0.59 1.58 0.78 -2.50 0.00 0.00 175.30 176.02 1rml h GLY 134 N 3.40 0.14 -4.15 8.12 0.00 -1.11 0.36 103.07 109.83 1rml h GLY 134 Ca -0.47 0.42 -0.13 0.00 0.00 0.00 0.00 47.33 47.15 1rml h GLY 134 CO 0.67 -0.23 -0.15 -1.55 0.00 0.00 0.00 176.54 175.27 1rml n PRO 135 N -5.47 1.43 0.00 4.80 -0.04 -1.26 -2.62 135.00 131.83 1rml n PRO 135 Ca 0.08 -0.68 0.00 0.00 -0.04 0.00 0.00 63.50 62.86 1rml n PRO 135 Cb 0.39 -1.80 0.00 0.00 -0.04 0.00 0.00 33.50 32.05 1rml n PRO 135 CO 0.00 0.00 0.00 -2.13 -0.04 0.00 0.00 175.50 173.33 1rml n ARG 136 N 2.53 0.00 -3.03 0.54 0.63 0.10 -5.06 116.66 112.35 1rml n ARG 136 Ca 0.29 0.00 -0.26 0.00 -0.92 0.00 0.00 57.85 56.96 1rml n ARG 136 Cb 0.66 0.00 -0.04 0.00 0.45 0.00 0.00 32.46 33.53 1rml n ARG 136 CO 0.00 0.00 0.00 2.41 -2.51 0.00 0.00 177.63 177.53 1rml n THR 137 N 0.00 2.58 -4.77 5.15 -1.04 -1.08 -4.42 114.28 110.70 1rml n THR 137 Ca 0.00 -5.41 -0.25 0.00 -2.04 0.00 0.00 64.05 56.35 1rml n THR 137 Cb 0.00 -1.38 -0.16 0.00 -1.82 0.00 0.00 70.33 66.97 1rml n THR 137 CO 0.00 0.00 0.00 -1.00 -0.64 0.00 0.00 175.07 173.43 1rml s HIS 138 N -3.19 1.59 1.11 -1.42 3.76 -1.26 0.20 115.29 116.07 1rml s HIS 138 Ca 0.47 -0.44 -0.19 0.00 -0.15 0.00 0.00 55.06 54.75 1rml s HIS 138 Cb 0.27 -1.07 0.28 0.00 1.11 0.00 0.00 32.58 33.17 1rml s HIS 138 CO -0.12 -0.14 0.85 2.48 -0.85 0.00 0.00 174.74 176.96 1rml n TYR 139 N 3.12 -3.67 0.00 1.40 4.11 -1.26 -4.89 117.16 115.97 1rml n TYR 139 Ca -0.18 -0.78 0.00 0.00 -0.00 0.00 0.00 57.90 56.94 1rml n TYR 139 Cb 0.53 -0.99 0.00 0.00 -0.00 0.00 0.00 39.34 38.88 1rml n TYR 139 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.86 177.27 1rml n GLY 140 N -4.08 0.46 0.00 -7.48 0.00 -1.26 -5.04 105.19 87.80 1rml n GLY 140 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.14 1rml n GLY 140 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1rml n GLN 141 N 0.00 0.00 0.00 1.61 3.00 -1.26 -5.07 117.38 115.66 1rml n GLN 141 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.99 1rml n GLN 141 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30.24 30.24 1rml n GLN 141 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.06 177.42 1rml n LYS 142 N -0.78 0.00 -0.25 -1.09 0.00 -1.26 -4.99 118.16 109.80 1rml n LYS 142 Ca 0.00 0.00 0.10 0.00 -0.00 0.00 0.00 58.31 58.41 1rml n LYS 142 Cb 0.00 0.00 0.26 0.00 -0.00 0.00 0.00 35.03 35.29 1rml n LYS 142 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1rml n ALA 143 N 0.00 2.42 0.00 0.58 0.00 -1.26 -3.60 120.51 118.65 1rml n ALA 143 Ca 0.00 -0.95 0.00 0.00 0.00 0.00 0.00 53.44 52.49 1rml n ALA 143 Cb 0.00 -0.96 0.00 0.00 0.00 0.00 0.00 19.45 18.49 1rml n ALA 143 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.50 177.94 1rml n ILE 144 N 1.14 0.00 -1.50 0.00 -5.35 -1.26 -3.50 119.36 108.88 1rml n ILE 144 Ca 0.19 0.00 -0.42 0.00 -0.27 0.00 0.00 62.75 62.25 1rml n ILE 144 Cb 0.49 0.08 -0.07 0.00 -1.74 0.00 0.00 39.64 38.40 1rml n ILE 144 CO 0.00 0.00 0.00 0.18 -1.76 0.00 0.00 176.55 174.97 1rml n LEU 145 N -1.57 1.77 -4.37 7.28 4.77 -1.25 -4.56 117.00 119.07 1rml n LEU 145 Ca 0.00 -0.01 -0.36 0.00 -0.03 0.00 0.00 56.01 55.61 1rml n LEU 145 Cb 0.13 -1.31 -0.13 0.00 -2.33 0.00 0.00 43.42 39.78 1rml n LEU 145 CO 0.00 -1.05 -0.31 -0.36 -1.33 0.00 0.00 177.39 174.34 1rml s PHE 146 N 9.66 3.06 -0.40 -1.77 0.08 -1.26 0.14 117.98 127.49 1rml s PHE 146 Ca 1.12 -0.75 -0.05 0.00 0.12 0.00 0.00 56.93 57.36 1rml s PHE 146 Cb -0.68 -2.20 0.09 0.00 -0.57 0.00 0.00 43.02 39.66 1rml s PHE 146 CO 0.40 -0.48 0.20 -1.17 -0.10 0.00 0.00 175.22 174.06 1rml s LEU 147 N 1.54 5.00 0.25 -0.37 1.98 0.27 -3.26 118.68 124.08 1rml s LEU 147 Ca 0.05 -1.69 -0.30 0.00 -2.89 0.00 0.00 54.13 49.31 1rml s LEU 147 Cb -0.15 -1.88 -0.09 0.00 0.66 0.00 0.00 46.19 44.73 1rml s LEU 147 CO 0.01 -0.50 1.09 -2.16 -1.89 0.00 0.00 176.35 172.90 1rml s PRO 148 N 1.28 4.64 -0.60 0.98 0.04 -1.26 -2.27 135.00 137.81 1rml s PRO 148 Ca 0.04 1.76 0.06 0.00 0.04 0.00 0.00 61.00 62.90 1rml s PRO 148 Cb -0.22 -3.22 0.22 0.00 0.04 0.00 0.00 34.50 31.32 1rml s PRO 148 CO -0.01 0.20 0.61 1.47 0.04 0.00 0.00 177.00 179.31 1rml n LEU 149 N 1.52 2.67 -4.81 -3.56 -0.00 -1.03 -4.98 117.00 106.81 1rml n LEU 149 Ca -0.00 -5.18 -0.30 0.00 -0.00 0.00 0.00 56.01 50.53 1rml n LEU 149 Cb 0.45 -0.39 0.08 0.00 -0.00 0.00 0.00 43.42 43.57 1rml n LEU 149 CO 0.54 1.97 0.71 -2.16 -0.00 0.00 0.00 177.39 178.44 1rml s PRO 150 N -1.81 2.23 -0.34 1.47 0.04 -1.26 -4.09 135.00 131.23 1rml s PRO 150 Ca 0.35 0.69 0.04 0.00 0.04 0.00 0.00 61.00 62.12 1rml s PRO 150 Cb 0.09 -1.93 0.21 0.00 0.04 0.00 0.00 34.50 32.91 1rml s PRO 150 CO -0.08 -1.53 1.21 1.33 0.04 0.00 0.00 177.00 177.97 1rml n VAL 151 N -3.38 0.00 -1.66 -0.36 0.24 -1.26 -5.01 118.33 106.90 1rml n VAL 151 Ca 0.07 -0.82 -0.16 0.00 -2.04 0.00 0.00 64.34 61.38 1rml n VAL 151 Cb 0.56 0.86 -0.11 0.00 -1.47 0.00 0.00 33.84 33.68 1rml n VAL 151 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 1rml s SER 152 N -0.40 3.63 -0.42 -1.34 0.15 -1.26 -4.61 113.70 109.46 1rml s SER 152 Ca 0.13 -1.01 0.11 0.00 0.70 0.00 0.00 55.95 55.87 1rml s SER 152 Cb 0.20 -2.59 0.37 0.00 -1.71 0.00 0.00 66.02 62.28 1rml s SER 152 CO -0.09 -4.54 0.83 -0.24 1.20 0.00 0.00 173.24 170.41 1rml n SER 153 N 19.05 2.04 0.00 5.45 2.88 -1.26 -5.21 113.62 136.57 1rml n SER 153 Ca 0.42 -3.18 0.00 0.00 -1.33 0.00 0.00 58.87 54.78 1rml n SER 153 Cb 0.47 -0.58 0.00 0.00 -0.75 0.00 0.00 64.21 63.34 1rml n SER 153 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14