#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rml s PRO 25 N 0.00 3.20 0.00 1.97 0.04 -1.26 -4.73 135.00 134.22 1rml s PRO 25 Ca 0.00 -1.33 0.00 0.00 0.04 0.00 0.00 61.00 59.71 1rml s PRO 25 Cb 0.00 -5.34 0.00 0.00 0.04 0.00 0.00 34.50 29.20 1rml s PRO 25 CO 0.00 -3.01 0.00 1.17 0.04 0.00 0.00 177.00 175.20 1rml n LYS 26 N 8.50 0.00 -3.53 4.56 3.00 -1.26 -1.96 118.16 127.48 1rml n LYS 26 Ca 0.44 0.00 -0.14 0.00 -0.00 0.00 0.00 58.31 58.61 1rml n LYS 26 Cb 0.47 0.00 -0.05 0.00 0.00 0.00 0.00 35.03 35.45 1rml n LYS 26 CO 0.00 0.00 0.00 -0.48 0.00 0.00 0.00 177.40 176.92 1rml s LEU 27 N 0.00 -0.52 0.00 3.14 0.05 -1.25 -4.68 118.68 115.42 1rml s LEU 27 Ca 0.00 0.45 -0.02 0.00 0.05 0.00 0.00 54.13 54.61 1rml s LEU 27 Cb 0.00 2.27 -0.04 0.00 -2.05 0.00 0.00 46.19 46.37 1rml s LEU 27 CO 0.00 -0.57 0.17 -0.22 -0.55 0.00 0.00 176.35 175.19 1rml s LEU 28 N -1.49 4.31 0.03 1.48 0.20 -1.26 -2.28 118.68 119.66 1rml s LEU 28 Ca -0.05 0.31 0.02 0.00 0.69 0.00 0.00 54.13 55.10 1rml s LEU 28 Cb -0.00 -2.62 -0.02 0.00 -0.43 0.00 0.00 46.19 43.12 1rml s LEU 28 CO 0.03 0.25 -0.08 -0.47 -0.29 0.00 0.00 176.35 175.79 1rml s TYR 29 N -1.34 0.67 0.27 5.38 5.04 -1.02 -3.99 117.35 122.36 1rml s TYR 29 Ca 0.28 -0.39 -0.09 0.00 -2.44 0.00 0.00 57.07 54.43 1rml s TYR 29 Cb -0.13 -0.40 -0.07 0.00 0.35 0.00 0.00 41.96 41.71 1rml s TYR 29 CO 0.19 -0.05 0.59 0.00 -1.34 0.00 0.00 175.55 174.94 1rml n SER 31 N -0.44 0.00 0.12 0.00 3.41 0.11 -3.38 113.62 113.44 1rml n SER 31 Ca 0.01 0.00 -0.13 0.00 -0.26 0.00 0.00 58.87 58.48 1rml n SER 31 Cb 0.53 0.00 -0.08 0.00 -0.26 0.00 0.00 64.21 64.40 1rml n SER 31 CO 0.00 0.00 0.00 -1.13 -0.16 0.00 0.00 175.04 173.75 1rml h ASN 32 N 0.00 -0.25 -0.85 4.04 -1.24 -1.86 -2.88 115.58 112.55 1rml h ASN 32 Ca 0.00 -0.18 0.34 0.00 0.71 0.00 0.00 56.30 57.18 1rml h ASN 32 Cb 0.00 0.06 -0.14 0.00 0.73 0.00 0.00 38.32 38.98 1rml h ASN 32 CO 0.00 0.04 0.48 0.61 -1.29 0.00 0.00 177.43 177.27 1rml n GLY 33 N -0.51 -0.61 2.87 1.57 0.00 -1.26 -4.68 105.19 102.58 1rml n GLY 33 Ca -0.09 0.64 0.00 0.00 0.00 0.00 0.00 46.02 46.56 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 -1.24 0.22 3.93 -0.02 0.00 -1.09 -4.65 105.19 102.34 1rml n GLY 34 Ca 0.31 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 46.07 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 -1.52 3.28 -0.31 1.61 3.76 -1.26 -4.23 115.29 116.62 1rml s HIS 35 Ca 0.00 0.50 0.01 0.00 -0.15 0.00 0.00 55.06 55.43 1rml s HIS 35 Cb 0.00 -2.52 0.09 0.00 1.11 0.00 0.00 32.58 31.26 1rml s HIS 35 CO 0.00 -0.58 0.05 -0.06 -0.85 0.00 0.00 174.74 173.30 1rml s PHE 36 N -2.79 2.69 0.60 1.40 0.40 0.57 0.31 117.98 121.16 1rml s PHE 36 Ca 0.51 -2.28 -0.15 0.00 -0.60 0.00 0.00 56.93 54.41 1rml s PHE 36 Cb -0.10 -2.21 -0.13 0.00 0.51 0.00 0.00 43.02 41.09 1rml s PHE 36 CO 0.42 -0.89 -0.34 1.28 0.70 0.00 0.00 175.22 176.39 1rml n LEU 37 N 4.57 -3.95 -3.69 -0.37 4.77 -1.26 -3.13 117.00 113.94 1rml n LEU 37 Ca -0.01 0.39 -0.14 0.00 -0.03 0.00 0.00 56.01 56.22 1rml n LEU 37 Cb 0.42 -0.69 -0.08 0.00 -2.33 0.00 0.00 43.42 40.74 1rml n LEU 37 CO 0.17 -4.52 0.16 0.00 -1.33 0.00 0.00 177.39 171.88 1rml s ARG 38 N -1.20 0.72 -0.16 3.23 1.70 -0.79 -4.55 118.95 117.89 1rml s ARG 38 Ca 0.43 0.20 0.01 0.00 -0.47 0.00 0.00 55.73 55.89 1rml s ARG 38 Cb -0.31 0.33 0.02 0.00 -0.57 0.00 0.00 34.95 34.43 1rml s ARG 38 CO 0.62 -0.18 -0.15 -1.50 -1.08 0.00 0.00 175.30 173.01 1rml s ILE 39 N -0.76 1.74 0.15 4.99 1.10 -1.18 -3.23 121.20 124.01 1rml s ILE 39 Ca -0.08 -0.78 -0.20 0.00 -0.51 0.00 0.00 60.65 59.07 1rml s ILE 39 Cb -0.03 -1.63 -0.07 0.00 0.15 0.00 0.00 42.46 40.87 1rml s ILE 39 CO 0.04 0.45 0.66 -0.76 -2.11 0.00 0.00 174.94 173.22 1rml s LEU 40 N 1.41 4.48 0.00 8.50 1.43 -0.84 -4.64 118.68 129.02 1rml s LEU 40 Ca 0.04 1.39 0.05 0.00 -1.03 0.00 0.00 54.13 54.58 1rml s LEU 40 Cb -0.13 -3.22 0.32 0.00 0.03 0.00 0.00 46.19 43.18 1rml s LEU 40 CO -0.11 0.18 0.98 -0.81 0.23 0.00 0.00 176.35 176.82 1rml n PRO 41 N 1.32 0.75 -0.02 1.29 -0.04 -1.26 -2.41 135.00 134.63 1rml n PRO 41 Ca -0.06 0.00 -0.09 0.00 -0.04 0.00 0.00 63.50 63.31 1rml n PRO 41 Cb 0.50 -1.11 -0.14 0.00 -0.04 0.00 0.00 33.50 32.71 1rml n PRO 41 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 1rml n ASP 42 N -0.61 0.87 0.00 3.54 -0.08 -1.26 -4.96 116.55 114.04 1rml n ASP 42 Ca 0.04 0.40 0.00 0.00 -1.51 0.00 0.00 54.79 53.72 1rml n ASP 42 Cb 0.02 -0.05 0.00 0.00 2.34 0.00 0.00 41.12 43.43 1rml n ASP 42 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1rml n GLY 43 N 1.57 1.67 3.65 0.27 0.00 -1.01 -5.13 105.19 106.21 1rml n GLY 43 Ca -0.18 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.61 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 -1.98 2.94 0.24 2.61 2.01 -1.25 -4.55 115.64 115.65 1rml s THR 44 Ca 0.00 -1.91 0.04 0.00 0.31 0.00 0.00 61.69 60.13 1rml s THR 44 Cb 0.00 -2.83 -0.05 0.00 0.01 0.00 0.00 72.50 69.63 1rml s THR 44 CO 0.00 -0.25 -0.01 -0.69 -0.69 0.00 0.00 174.62 172.98 1rml s VAL 45 N -2.44 1.11 0.00 3.82 1.01 -1.26 -1.98 120.40 120.66 1rml s VAL 45 Ca 0.34 -2.04 0.00 0.00 0.00 0.00 0.00 61.98 60.28 1rml s VAL 45 Cb -0.03 -2.35 0.00 0.00 0.00 0.00 0.00 36.38 34.00 1rml s VAL 45 CO 0.20 -0.33 0.00 -0.90 0.00 0.00 0.00 175.10 174.07 1rml n ASP 46 N -0.44 0.00 -4.32 3.32 5.68 -1.20 -4.88 116.55 114.71 1rml n ASP 46 Ca -0.05 0.00 -0.20 0.00 -0.50 0.00 0.00 54.79 54.04 1rml n ASP 46 Cb 0.64 0.00 -0.11 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 1.36 -0.08 6.12 0.00 -1.26 -1.89 107.32 111.57 1rml s GLY 47 Ca 0.00 -1.51 0.00 0.00 0.00 0.00 0.00 44.72 43.21 1rml s GLY 47 CO 0.00 -1.58 -0.06 -1.59 0.00 0.00 0.00 173.10 169.87 1rml s THR 48 N -2.34 0.79 0.61 0.90 2.01 -1.18 -4.53 115.64 111.90 1rml s THR 48 Ca 0.17 -0.19 0.26 0.00 0.31 0.00 0.00 61.69 62.24 1rml s THR 48 Cb -0.04 -0.82 0.35 0.00 0.01 0.00 0.00 72.50 72.00 1rml s THR 48 CO 0.06 0.31 1.58 -0.09 -0.69 0.00 0.00 174.62 175.79 1rml h ARG 49 N 7.77 0.00 -2.52 4.92 1.12 -1.90 1.68 114.38 125.45 1rml h ARG 49 Ca -0.29 0.00 -0.09 0.00 -1.11 0.00 0.00 59.98 58.48 1rml h ARG 49 Cb 1.14 0.00 -0.26 0.00 -0.01 0.00 0.00 29.97 30.84 1rml h ARG 49 CO 0.40 0.00 -0.28 -0.51 -3.11 0.00 0.00 179.97 176.47 1rml s ASP 50 N -4.22 -0.50 -0.21 -3.80 1.01 -1.26 -4.00 116.67 103.69 1rml s ASP 50 Ca -0.03 1.00 -0.40 0.00 0.71 0.00 0.00 52.55 53.84 1rml s ASP 50 Cb 0.13 1.05 -0.16 0.00 1.01 0.00 0.00 42.92 44.95 1rml s ASP 50 CO 0.45 -0.21 1.65 -2.11 0.21 0.00 0.00 175.17 175.16 1rml n ARG 51 N 4.64 1.08 0.00 8.23 0.00 -1.26 -4.82 116.66 124.53 1rml n ARG 51 Ca -0.18 0.40 0.00 0.00 -0.00 0.00 0.00 57.85 58.06 1rml n ARG 51 Cb 0.54 -2.06 0.00 0.00 -0.00 0.00 0.00 32.46 30.94 1rml n ARG 51 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.63 178.08 1rml n SER 52 N 4.69 0.00 -3.98 2.89 2.88 -1.26 -5.11 113.62 113.72 1rml n SER 52 Ca 0.25 0.00 -0.09 0.00 -1.33 0.00 0.00 58.87 57.70 1rml n SER 52 Cb 0.13 0.00 -0.06 0.00 -0.75 0.00 0.00 64.21 63.53 1rml n SER 52 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 1rml s ASP 53 N 0.00 -0.07 0.24 -3.46 2.15 -1.26 -5.04 116.67 109.23 1rml s ASP 53 Ca 0.00 -0.92 -0.15 0.00 0.43 0.00 0.00 52.55 51.92 1rml s ASP 53 Cb 0.00 0.54 0.30 0.00 -0.30 0.00 0.00 42.92 43.46 1rml s ASP 53 CO 0.00 -1.07 1.56 0.06 -0.17 0.00 0.00 175.17 175.55 1rml h GLN 54 N 2.33 -0.00 -1.06 4.34 -0.00 -2.02 -3.37 115.11 115.32 1rml h GLN 54 Ca -0.28 0.00 0.01 0.00 -0.00 0.00 0.00 58.65 58.38 1rml h GLN 54 Cb 1.25 0.00 -0.22 0.00 -0.00 0.00 0.00 27.48 28.51 1rml h GLN 54 CO 0.39 -0.00 -0.40 -1.01 -0.00 0.00 0.00 178.83 177.81 1rml s HIS 55 N -6.04 -1.79 -0.35 0.06 3.76 -1.26 -5.00 115.29 104.67 1rml s HIS 55 Ca -0.14 0.99 0.08 0.00 -0.15 0.00 0.00 55.06 55.84 1rml s HIS 55 Cb 0.22 0.28 0.66 0.00 1.11 0.00 0.00 32.58 34.85 1rml s HIS 55 CO 0.73 -1.08 1.75 0.44 -0.85 0.00 0.00 174.74 175.72 1rml n ILE 56 N 5.38 2.90 -3.00 0.60 -0.00 -1.26 -3.08 119.36 120.89 1rml n ILE 56 Ca 0.05 -1.98 -0.40 0.00 -0.00 0.00 0.00 62.75 60.42 1rml n ILE 56 Cb 0.54 -0.38 -0.05 0.00 -0.00 0.00 0.00 39.64 39.75 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 -3.14 4.46 -0.10 6.28 1.11 -1.26 -4.36 119.66 122.65 1rml s GLN 57 Ca 0.53 0.99 -0.02 0.00 0.01 0.00 0.00 55.36 56.87 1rml s GLN 57 Cb 0.44 -3.41 0.04 0.00 -1.01 0.00 0.00 33.01 29.07 1rml s GLN 57 CO 0.10 0.16 0.04 -0.51 0.01 0.00 0.00 175.29 175.08 1rml s LEU 58 N 0.41 0.56 0.26 2.90 1.02 -1.26 -4.19 118.68 118.38 1rml s LEU 58 Ca 0.39 -0.28 0.07 0.00 0.02 0.00 0.00 54.13 54.33 1rml s LEU 58 Cb -0.19 -0.37 -0.03 0.00 0.02 0.00 0.00 46.19 45.61 1rml s LEU 58 CO 0.21 -0.25 0.25 -1.58 0.02 0.00 0.00 176.35 174.99 1rml s GLN 59 N 2.02 3.00 0.24 1.70 2.00 -0.85 -4.40 119.66 123.36 1rml s GLN 59 Ca 0.03 -1.03 0.08 0.00 -2.00 0.00 0.00 55.36 52.44 1rml s GLN 59 Cb -0.14 -2.62 -0.04 0.00 0.80 0.00 0.00 33.01 31.01 1rml s GLN 59 CO -0.06 0.35 0.03 -0.51 -0.50 0.00 0.00 175.29 174.61 1rml s LEU 60 N -3.90 3.34 -0.34 3.68 1.43 -1.26 0.08 118.68 121.71 1rml s LEU 60 Ca 0.35 -0.50 0.16 0.00 -1.03 0.00 0.00 54.13 53.10 1rml s LEU 60 Cb -0.08 -1.90 0.44 0.00 0.03 0.00 0.00 46.19 44.67 1rml s LEU 60 CO 0.26 0.02 0.98 -0.24 0.23 0.00 0.00 176.35 177.60 1rml n SER 61 N -0.72 0.85 -4.63 2.29 2.88 0.49 -4.77 113.62 110.01 1rml n SER 61 Ca -0.08 -2.73 -0.65 0.00 -1.33 0.00 0.00 58.87 54.09 1rml n SER 61 Cb 0.58 -0.29 -0.09 0.00 -0.75 0.00 0.00 64.21 63.66 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 -0.08 -2.06 0.29 -1.46 0.00 -1.26 -2.97 120.51 112.97 1rml n ALA 62 Ca 0.09 0.53 0.03 0.00 0.00 0.00 0.00 53.44 54.09 1rml n ALA 62 Cb 0.80 -1.85 0.03 0.00 0.00 0.00 0.00 19.45 18.42 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 3.20 0.22 0.00 0.00 0.28 -1.24 -4.83 120.64 118.26 1rml n GLU 63 Ca 0.27 -0.86 0.00 0.00 -0.16 0.00 0.00 57.16 56.41 1rml n GLU 63 Cb -0.02 -1.11 0.00 0.00 1.43 0.00 0.00 31.44 31.74 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 0.30 0.00 -4.84 -1.84 7.64 -1.04 -5.04 113.62 108.81 1rml n SER 64 Ca 0.04 0.00 -0.33 0.00 1.01 0.00 0.00 58.87 59.59 1rml n SER 64 Cb 0.17 0.00 -0.06 0.00 -1.01 0.00 0.00 64.21 63.31 1rml n SER 64 CO 0.00 0.00 0.00 0.68 -3.01 0.00 0.00 175.04 172.71 1rml s VAL 65 N -2.00 4.53 -2.05 0.44 -7.23 -1.26 -3.51 120.40 109.31 1rml s VAL 65 Ca 0.00 1.22 0.00 0.00 -1.81 0.00 0.00 61.98 61.39 1rml s VAL 65 Cb 0.00 -3.63 0.00 0.00 0.56 0.00 0.00 36.38 33.31 1rml s VAL 65 CO 0.00 -0.34 0.00 0.61 -0.31 0.00 0.00 175.10 175.06 1rml n GLY 66 N -0.71 1.66 3.32 2.32 0.00 -0.65 -4.87 105.19 106.25 1rml n GLY 66 Ca 0.06 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.10 1rml n GLY 66 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1rml s GLU 67 N -3.79 0.10 0.26 1.61 1.03 -1.23 -3.87 118.70 112.82 1rml s GLU 67 Ca 0.00 0.24 0.03 0.00 0.03 0.00 0.00 54.97 55.27 1rml s GLU 67 Cb 0.00 0.12 -0.04 0.00 -0.80 0.00 0.00 34.13 33.42 1rml s GLU 67 CO 0.00 -0.03 0.19 0.14 -1.33 0.00 0.00 175.26 174.23 1rml s VAL 68 N 1.94 0.02 0.35 1.83 -7.23 0.16 -2.49 120.40 114.98 1rml s VAL 68 Ca -0.02 -2.00 0.09 0.00 -1.81 0.00 0.00 61.98 58.24 1rml s VAL 68 Cb -0.02 -2.50 -0.06 0.00 0.56 0.00 0.00 36.38 34.36 1rml s VAL 68 CO -0.15 0.00 -0.03 -0.31 -0.31 0.00 0.00 175.10 174.29 1rml s TYR 69 N -3.84 2.48 -0.07 2.82 2.02 -1.16 0.17 117.35 119.77 1rml s TYR 69 Ca 0.40 -0.50 -0.03 0.00 -0.37 0.00 0.00 57.07 56.56 1rml s TYR 69 Cb 0.05 -1.49 0.04 0.00 -0.40 0.00 0.00 41.96 40.16 1rml s TYR 69 CO 0.19 0.51 0.16 0.42 -1.57 0.00 0.00 175.55 175.25 1rml s ILE 70 N -2.59 -0.06 -0.13 2.71 1.01 -1.26 0.19 121.20 121.07 1rml s ILE 70 Ca 0.34 0.19 -0.03 0.00 0.00 0.00 0.00 60.65 61.15 1rml s ILE 70 Cb 0.02 -0.26 0.05 0.00 0.01 0.00 0.00 42.46 42.29 1rml s ILE 70 CO 0.18 0.08 0.05 -0.75 0.00 0.00 0.00 174.94 174.50 1rml s LYS 71 N 1.24 0.29 -0.89 2.79 2.36 0.11 0.42 119.74 126.06 1rml s LYS 71 Ca -0.09 -0.03 -0.25 0.00 -2.55 0.00 0.00 55.97 53.06 1rml s LYS 71 Cb -0.12 -1.44 -0.09 0.00 -1.05 0.00 0.00 37.83 35.13 1rml s LYS 71 CO -0.06 -0.52 2.12 0.45 1.55 0.00 0.00 175.35 178.89 1rml s SER 72 N 2.04 4.61 -0.88 1.43 0.15 -1.19 -2.00 113.70 117.86 1rml s SER 72 Ca 0.03 -0.50 -0.18 0.00 0.70 0.00 0.00 55.95 55.99 1rml s SER 72 Cb -0.15 -2.56 -0.23 0.00 -1.71 0.00 0.00 66.02 61.37 1rml s SER 72 CO -0.07 -3.26 2.30 1.07 1.20 0.00 0.00 173.24 174.48 1rml n THR 73 N 8.25 -0.00 0.00 6.45 5.66 -1.26 -2.38 114.28 131.00 1rml n THR 73 Ca 0.43 -0.50 0.00 0.00 -3.05 0.00 0.00 64.05 60.93 1rml n THR 73 Cb 0.46 -1.10 0.00 0.00 -1.55 0.00 0.00 70.33 68.13 1rml n THR 73 CO 0.00 0.00 0.00 1.21 -3.05 0.00 0.00 175.07 173.23 1rml n GLU 74 N 7.34 0.00 0.00 1.09 4.07 -1.26 -4.90 120.64 126.98 1rml n GLU 74 Ca 0.56 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.66 1rml n GLU 74 Cb 0.30 0.00 0.00 0.00 -0.06 0.00 0.00 31.44 31.68 1rml n GLU 74 CO 0.00 0.00 0.00 0.25 -0.06 0.00 0.00 177.13 177.32 1rml n THR 75 N 0.00 0.00 -2.68 6.31 -2.24 -1.00 -5.06 114.28 109.61 1rml n THR 75 Ca 0.00 0.00 -0.05 0.00 -2.27 0.00 0.00 64.05 61.73 1rml n THR 75 Cb 0.00 -0.00 0.09 0.00 -2.10 0.00 0.00 70.33 68.32 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 4.97 -0.55 3.85 3.38 0.00 -1.26 -5.08 105.19 110.49 1rml n GLY 76 Ca 0.00 0.41 -0.07 0.00 0.00 0.00 0.00 46.02 46.36 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 0.12 1.89 0.04 1.61 -0.21 -1.26 -4.76 119.66 117.08 1rml s GLN 77 Ca 0.19 -1.09 0.06 0.00 0.02 0.00 0.00 55.36 54.53 1rml s GLN 77 Cb 0.27 0.61 -0.02 0.00 1.00 0.00 0.00 33.01 34.87 1rml s GLN 77 CO -0.12 -0.87 -0.17 0.71 -2.12 0.00 0.00 175.29 172.72 1rml s TYR 78 N -3.56 1.45 0.52 0.91 1.51 -1.00 -3.15 117.35 114.03 1rml s TYR 78 Ca 0.12 -0.35 -0.21 0.00 -1.01 0.00 0.00 57.07 55.62 1rml s TYR 78 Cb -0.06 -0.87 -0.08 0.00 -0.11 0.00 0.00 41.96 40.85 1rml s TYR 78 CO 0.08 0.05 0.99 -0.11 -1.11 0.00 0.00 175.55 175.45 1rml n LEU 79 N 1.96 3.18 -3.67 -1.29 -0.00 0.17 0.13 117.00 117.48 1rml n LEU 79 Ca -0.17 0.92 -0.07 0.00 -0.00 0.00 0.00 56.01 56.68 1rml n LEU 79 Cb 0.54 -1.38 -0.02 0.00 -0.00 0.00 0.00 43.42 42.57 1rml n LEU 79 CO 0.23 -1.65 0.56 0.00 -0.00 0.00 0.00 177.39 176.53 1rml s ALA 80 N -1.41 -1.53 -0.32 1.96 0.00 0.50 -4.51 121.76 116.46 1rml s ALA 80 Ca 0.69 0.22 -0.02 0.00 0.00 0.00 0.00 51.96 52.85 1rml s ALA 80 Cb -0.48 0.72 0.12 0.00 0.00 0.00 0.00 23.12 23.49 1rml s ALA 80 CO 0.52 -0.92 0.18 1.41 0.00 0.00 0.00 175.76 176.95 1rml s MET 81 N -3.56 0.36 1.05 0.00 1.75 -1.25 0.18 119.30 117.84 1rml s MET 81 Ca 0.08 -0.86 -0.17 0.00 -1.25 0.00 0.00 55.69 53.49 1rml s MET 81 Cb -0.03 -1.18 0.11 0.00 2.84 0.00 0.00 34.83 36.57 1rml s MET 81 CO -0.02 -1.11 0.03 -0.25 -0.65 0.00 0.00 175.02 173.02 1rml n ASP 82 N 4.71 -2.76 0.05 1.11 8.00 -1.25 -4.58 116.55 121.83 1rml n ASP 82 Ca 0.02 -0.26 0.05 0.00 0.71 0.00 0.00 54.79 55.32 1rml n ASP 82 Cb 0.40 -0.81 0.25 0.00 -0.02 0.00 0.00 41.12 40.94 1rml n ASP 82 CO 0.00 0.00 0.00 0.41 -0.39 0.00 0.00 177.20 177.22 1rml n THR 83 N -4.35 1.41 1.30 -3.53 -1.04 -1.26 -0.18 114.28 106.64 1rml n THR 83 Ca 0.03 0.45 0.14 0.00 -2.04 0.00 0.00 64.05 62.63 1rml n THR 83 Cb 0.50 -1.37 0.58 0.00 -1.82 0.00 0.00 70.33 68.22 1rml n THR 83 CO 0.00 0.00 0.00 0.47 -0.64 0.00 0.00 175.07 174.90 1rml n ASP 84 N -1.74 0.36 -1.02 8.00 8.00 -1.26 -4.89 116.55 124.00 1rml n ASP 84 Ca 0.01 -0.33 -0.12 0.00 0.71 0.00 0.00 54.79 55.06 1rml n ASP 84 Cb 0.08 -0.12 -0.04 0.00 -0.02 0.00 0.00 41.12 41.02 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 1.34 1.00 3.38 0.44 0.00 0.75 0.77 105.19 112.87 1rml n GLY 85 Ca 0.12 -0.45 -0.43 0.00 0.00 0.00 0.00 46.02 45.26 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 -2.90 5.45 -0.27 0.99 0.20 -1.26 -1.80 118.68 119.08 1rml s LEU 86 Ca 0.00 -1.29 -0.43 0.00 0.69 0.00 0.00 54.13 53.10 1rml s LEU 86 Cb 0.00 -2.14 -0.19 0.00 -0.43 0.00 0.00 46.19 43.43 1rml s LEU 86 CO 0.00 -0.59 1.43 0.18 -0.29 0.00 0.00 176.35 177.08 1rml n LEU 87 N 5.14 1.00 -3.74 -0.68 4.32 -1.26 -3.81 117.00 117.97 1rml n LEU 87 Ca -0.12 1.16 -0.10 0.00 -0.02 0.00 0.00 56.01 56.93 1rml n LEU 87 Cb 0.44 -0.95 -0.06 0.00 -1.62 0.00 0.00 43.42 41.23 1rml n LEU 87 CO 0.45 -1.15 0.03 -0.72 -1.22 0.00 0.00 177.39 174.79 1rml s TYR 88 N 1.92 -0.06 0.16 -1.77 1.13 0.48 -4.24 117.35 114.98 1rml s TYR 88 Ca 0.98 -0.23 -0.12 0.00 -1.41 0.00 0.00 57.07 56.28 1rml s TYR 88 Cb -1.33 0.10 -0.07 0.00 -1.10 0.00 0.00 41.96 39.56 1rml s TYR 88 CO 0.69 -0.58 0.53 0.20 -2.51 0.00 0.00 175.55 173.88 1rml s GLY 89 N -2.57 2.40 -0.09 5.49 0.00 -1.26 0.19 107.32 111.47 1rml s GLY 89 Ca 0.01 -0.20 -0.04 0.00 0.00 0.00 0.00 44.72 44.49 1rml s GLY 89 CO -0.09 0.04 0.21 -0.45 0.00 0.00 0.00 173.10 172.80 1rml s SER 90 N -1.90 0.06 0.00 1.64 0.15 0.12 -4.86 113.70 108.90 1rml s SER 90 Ca 0.40 0.44 0.18 0.00 0.70 0.00 0.00 55.95 57.67 1rml s SER 90 Cb -0.14 0.37 1.09 0.00 -1.71 0.00 0.00 66.02 65.64 1rml s SER 90 CO 0.20 -0.19 1.70 1.67 1.20 0.00 0.00 173.24 177.82 1rml n GLN 91 N 4.61 0.99 -3.80 5.44 7.27 -1.26 -2.38 117.38 128.25 1rml n GLN 91 Ca -0.19 0.00 -0.35 0.00 0.07 0.00 0.00 57.00 56.53 1rml n GLN 91 Cb 0.51 -1.29 -0.11 0.00 2.41 0.00 0.00 30.24 31.76 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 -2.00 3.29 -0.58 1.69 -4.23 -1.26 -4.98 115.64 107.58 1rml s THR 92 Ca 0.27 -2.66 -0.28 0.00 -1.18 0.00 0.00 61.69 57.85 1rml s THR 92 Cb 0.13 -3.22 0.01 0.00 1.34 0.00 0.00 72.50 70.75 1rml s THR 92 CO 0.21 -0.78 1.51 -2.16 -0.54 0.00 0.00 174.62 172.86 1rml s PRO 93 N 0.39 3.16 0.00 3.99 0.04 -1.26 -4.50 135.00 136.81 1rml s PRO 93 Ca 0.14 0.46 0.00 0.00 0.04 0.00 0.00 61.00 61.64 1rml s PRO 93 Cb -0.22 -4.19 0.00 0.00 0.04 0.00 0.00 34.50 30.13 1rml s PRO 93 CO -0.04 -2.11 0.00 0.09 0.04 0.00 0.00 177.00 174.98 1rml n ASN 94 N 10.22 0.00 -3.42 6.66 3.02 -1.26 -4.98 115.26 125.50 1rml n ASN 94 Ca 0.13 0.00 -0.33 0.00 -0.03 0.00 0.00 54.58 54.35 1rml n ASN 94 Cb 0.50 0.00 -0.05 0.00 -0.61 0.00 0.00 39.78 39.62 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 1.26 0.01 3.52 -0.58 -1.26 -2.40 120.64 121.18 1rml n GLU 95 Ca 0.00 -1.47 0.00 0.00 -0.42 0.00 0.00 57.16 55.27 1rml n GLU 95 Cb 0.00 -2.63 0.00 0.00 -0.57 0.00 0.00 31.44 28.24 1rml n GLU 95 CO 0.00 0.00 0.00 -1.91 -0.48 0.00 0.00 177.13 174.74 1rml n GLU 96 N 6.20 0.00 -0.14 3.49 2.13 -1.26 -4.74 120.64 126.32 1rml n GLU 96 Ca 0.42 0.00 -0.10 0.00 0.66 0.00 0.00 57.16 58.15 1rml n GLU 96 Cb 0.29 0.00 0.03 0.00 0.27 0.00 0.00 31.44 32.03 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 -4.12 -2.35 -3.60 0.00 4.77 -1.15 -4.31 117.00 106.24 1rml n LEU 98 Ca 0.01 -0.14 -0.09 0.00 -0.03 0.00 0.00 56.01 55.76 1rml n LEU 98 Cb 0.44 -0.75 -0.10 0.00 -2.33 0.00 0.00 43.42 40.68 1rml n LEU 98 CO 0.46 -2.87 -0.01 -0.36 -1.33 0.00 0.00 177.39 173.28 1rml s PHE 99 N -2.12 -0.77 -0.48 -1.77 0.08 0.44 -3.85 117.98 109.51 1rml s PHE 99 Ca 0.43 1.34 -0.26 0.00 0.12 0.00 0.00 56.93 58.56 1rml s PHE 99 Cb -0.03 0.22 -0.06 0.00 -0.57 0.00 0.00 43.02 42.58 1rml s PHE 99 CO 0.56 -0.51 2.31 -0.51 -0.10 0.00 0.00 175.22 176.97 1rml s LEU 100 N 2.58 3.40 0.12 -0.37 1.43 0.10 0.37 118.68 126.31 1rml s LEU 100 Ca 0.01 1.07 0.07 0.00 -1.03 0.00 0.00 54.13 54.25 1rml s LEU 100 Cb -0.13 -2.62 -0.04 0.00 0.03 0.00 0.00 46.19 43.43 1rml s LEU 100 CO -0.13 -2.72 -0.09 -0.70 0.23 0.00 0.00 176.35 172.95 1rml s GLU 101 N 7.89 2.16 0.00 1.70 -6.30 -1.25 0.68 118.70 123.58 1rml s GLU 101 Ca 0.94 -1.05 0.00 0.00 -2.50 0.00 0.00 54.97 52.35 1rml s GLU 101 Cb -0.18 -2.30 0.00 0.00 0.00 0.00 0.00 34.13 31.65 1rml s GLU 101 CO 0.26 0.50 0.00 2.89 0.02 0.00 0.00 175.26 178.93 1rml n ARG 102 N 0.55 0.00 0.00 4.30 0.00 -1.26 -1.64 116.66 118.61 1rml n ARG 102 Ca -0.13 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.72 1rml n ARG 102 Cb 0.53 0.00 0.00 0.00 -0.00 0.00 0.00 32.46 32.99 1rml n ARG 102 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.63 177.52 1rml n LEU 103 N 0.00 0.00 -0.10 2.89 0.00 -1.26 -4.95 117.00 113.58 1rml n LEU 103 Ca 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 56.01 55.81 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 -1.22 1.21 0.00 0.00 0.00 177.39 177.38 1rml n GLU 104 N 0.00 0.66 0.00 1.96 0.00 -1.26 -4.99 120.64 117.02 1rml n GLU 104 Ca 0.00 0.20 0.00 0.00 0.00 0.00 0.00 57.16 57.36 1rml n GLU 104 Cb 0.00 -1.57 0.00 0.00 0.00 0.00 0.00 31.44 29.87 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 -3.46 0.00 -2.70 5.31 2.13 -1.26 -5.08 120.64 115.58 1rml n GLU 105 Ca -0.43 0.00 -0.07 0.00 0.66 0.00 0.00 57.16 57.31 1rml n GLU 105 Cb 0.98 0.00 0.11 0.00 0.27 0.00 0.00 31.44 32.80 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 -1.77 0.00 4.31 2.85 -1.26 -4.98 115.26 114.41 1rml n ASN 106 Ca 0.00 -2.57 0.00 0.00 -0.11 0.00 0.00 54.58 51.90 1rml n ASN 106 Cb 0.00 1.00 0.00 0.00 1.24 0.00 0.00 39.78 42.02 1rml n ASN 106 CO 0.00 0.00 0.00 1.41 -2.11 0.00 0.00 177.26 176.56 1rml n HIS 107 N -0.50 0.00 0.00 1.20 8.25 -1.26 -5.15 115.22 117.76 1rml n HIS 107 Ca -0.02 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.44 1rml n HIS 107 Cb 0.84 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.95 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 0.00 -1.23 -2.73 4.41 4.01 -1.26 -4.83 117.16 115.54 1rml n TYR 108 Ca 0.00 0.00 -0.08 0.00 -0.16 0.00 0.00 57.90 57.66 1rml n TYR 108 Cb 0.00 0.00 0.10 0.00 -0.31 0.00 0.00 39.34 39.13 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 -1.58 -1.90 -4.52 7.72 5.03 -1.13 -4.77 115.26 114.11 1rml n ASN 109 Ca 0.00 -3.05 -0.39 0.00 0.87 0.00 0.00 54.58 52.01 1rml n ASN 109 Cb 0.00 1.33 -0.11 0.00 -1.02 0.00 0.00 39.78 39.98 1rml n ASN 109 CO 0.00 0.00 0.00 0.35 -1.83 0.00 0.00 177.26 175.78 1rml n THR 110 N -0.12 -0.03 -1.35 3.41 -2.24 -1.26 -4.77 114.28 107.92 1rml n THR 110 Ca 0.02 -0.29 -0.09 0.00 -2.27 0.00 0.00 64.05 61.42 1rml n THR 110 Cb 0.77 -1.33 0.06 0.00 -2.10 0.00 0.00 70.33 67.73 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 12.48 -3.95 -3.36 4.78 4.02 -1.26 -4.10 117.16 125.76 1rml n TYR 111 Ca 0.56 -0.37 0.01 0.00 -0.01 0.00 0.00 57.90 58.09 1rml n TYR 111 Cb 0.22 -0.31 -0.03 0.00 -0.02 0.00 0.00 39.34 39.20 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 -1.82 -0.97 -0.71 -0.72 1.01 0.22 -3.78 121.20 114.43 1rml s ILE 112 Ca 0.23 0.00 -0.19 0.00 0.00 0.00 0.00 60.65 60.69 1rml s ILE 112 Cb -0.01 -0.98 -0.17 0.00 0.01 0.00 0.00 42.46 41.31 1rml s ILE 112 CO 0.16 -0.00 1.85 -1.54 0.00 0.00 0.00 174.94 175.41 1rml n SER 113 N 5.43 0.00 0.25 3.58 3.41 -0.94 0.03 113.62 125.39 1rml n SER 113 Ca -0.05 0.04 0.14 0.00 -0.26 0.00 0.00 58.87 58.74 1rml n SER 113 Cb 0.50 -0.61 0.74 0.00 -0.26 0.00 0.00 64.21 64.58 1rml n SER 113 CO 0.00 0.00 0.00 0.50 -0.16 0.00 0.00 175.04 175.38 1rml h LYS 114 N 8.39 0.00 0.00 4.33 3.64 -1.82 2.18 116.57 133.30 1rml h LYS 114 Ca -0.03 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.35 1rml h LYS 114 Cb 0.91 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.73 1rml h LYS 114 CO 1.01 0.00 -0.61 1.17 -2.27 0.00 0.00 179.45 178.75 1rml n LYS 115 N -2.56 0.11 -2.51 1.90 4.81 -1.26 -4.12 118.16 114.53 1rml n LYS 115 Ca -0.02 0.02 -0.00 0.00 -0.87 0.00 0.00 58.31 57.44 1rml n LYS 115 Cb 0.21 -1.56 0.06 0.00 0.02 0.00 0.00 35.03 33.76 1rml n LYS 115 CO 0.00 0.00 0.00 0.72 1.17 0.00 0.00 177.40 179.29 1rml n HIS 116 N -1.71 0.32 0.29 5.64 8.25 0.61 -4.86 115.22 123.75 1rml n HIS 116 Ca 0.04 -1.72 0.16 0.00 -0.26 0.00 0.00 57.72 55.95 1rml n HIS 116 Cb 0.37 0.19 0.61 0.00 1.12 0.00 0.00 29.99 32.28 1rml n HIS 116 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1rml h ALA 117 N 1.90 1.00 0.00 -1.41 0.00 0.22 -2.05 119.26 118.92 1rml h ALA 117 Ca -0.24 0.00 -0.05 0.00 0.00 0.00 0.00 54.91 54.62 1rml h ALA 117 Cb 1.38 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 19.16 1rml h ALA 117 CO 0.07 0.00 -0.24 1.49 0.00 0.00 0.00 179.25 180.56 1rml h GLU 118 N 0.00 0.00 -0.08 0.00 4.81 -1.89 -1.63 114.58 115.78 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 0.56 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.94 1rml h GLU 118 CO 0.00 0.24 0.00 1.17 -0.73 0.00 0.00 179.01 179.69 1rml n LYS 119 N -3.89 1.80 -2.88 1.92 4.81 -0.93 -4.95 118.16 114.04 1rml n LYS 119 Ca -0.02 -1.74 -0.22 0.00 -0.87 0.00 0.00 58.31 55.46 1rml n LYS 119 Cb 0.33 -1.38 0.02 0.00 0.02 0.00 0.00 35.03 34.02 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 1.11 -6.01 -3.92 3.14 5.03 -0.61 -4.80 115.26 109.19 1rml n ASN 120 Ca 0.12 -0.22 -0.37 0.00 0.87 0.00 0.00 54.58 54.98 1rml n ASN 120 Cb 0.49 -4.90 -0.08 0.00 -1.02 0.00 0.00 39.78 34.28 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 -4.38 1.65 -0.35 3.10 7.02 -0.82 -4.33 117.44 119.33 1rml n TRP 121 Ca -0.14 -1.33 -0.12 0.00 -1.02 0.00 0.00 57.50 54.89 1rml n TRP 121 Cb 0.64 -1.83 0.11 0.00 -2.42 0.00 0.00 31.31 27.81 1rml n TRP 121 CO 0.00 0.00 0.00 1.19 -2.02 0.00 0.00 177.69 176.86 1rml n PHE 122 N 10.58 -2.16 -3.84 -5.99 3.01 0.61 -2.21 117.46 117.45 1rml n PHE 122 Ca 0.47 -0.07 -0.30 0.00 1.01 0.00 0.00 57.45 58.56 1rml n PHE 122 Cb 0.43 -0.96 -0.14 0.00 -0.01 0.00 0.00 39.48 38.79 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 -1.63 1.58 -0.29 -4.37 0.11 -1.25 -4.54 120.40 110.01 1rml s VAL 123 Ca 0.25 -2.11 -0.14 0.00 -2.93 0.00 0.00 61.98 57.05 1rml s VAL 123 Cb -0.04 -2.16 0.11 0.00 -1.53 0.00 0.00 36.38 32.76 1rml s VAL 123 CO 0.21 -0.71 0.74 -0.83 -3.33 0.00 0.00 175.10 171.18 1rml s GLY 124 N 0.95 -0.54 -0.15 6.54 0.00 -1.25 -4.13 107.32 108.73 1rml s GLY 124 Ca 0.12 2.55 -0.29 0.00 0.00 0.00 0.00 44.72 47.10 1rml s GLY 124 CO -0.12 2.66 1.26 1.08 0.00 0.00 0.00 173.10 177.98 1rml s LEU 125 N 1.98 4.20 -0.07 0.66 1.02 -1.24 -4.61 118.68 120.61 1rml s LEU 125 Ca -0.08 1.72 -0.10 0.00 0.02 0.00 0.00 54.13 55.69 1rml s LEU 125 Cb -0.07 -3.54 -0.04 0.00 0.02 0.00 0.00 46.19 42.56 1rml s LEU 125 CO -0.19 -0.74 0.31 1.17 0.02 0.00 0.00 176.35 176.93 1rml n LYS 126 N 6.42 0.00 -0.36 1.70 4.81 0.74 -4.44 118.16 127.03 1rml n LYS 126 Ca 0.14 0.00 -0.12 0.00 -0.87 0.00 0.00 58.31 57.45 1rml n LYS 126 Cb 0.45 -0.33 -0.01 0.00 0.02 0.00 0.00 35.03 35.15 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 0.70 0.93 0.00 1.64 -0.00 -1.26 -1.82 118.16 118.35 1rml n LYS 127 Ca 0.06 -0.96 0.00 0.00 -0.00 0.00 0.00 58.31 57.41 1rml n LYS 127 Cb -0.00 -2.23 0.00 0.00 -0.00 0.00 0.00 35.03 32.79 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 4.86 0.00 0.00 -5.58 4.13 -1.26 -4.82 115.26 112.59 1rml n ASN 128 Ca 0.22 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.48 1rml n ASN 128 Cb 0.08 0.16 0.00 0.00 -1.54 0.00 0.00 39.78 38.48 1rml n ASN 128 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1rml n GLY 129 N -0.99 -0.03 0.00 7.41 0.00 -0.75 -4.87 105.19 105.95 1rml n GLY 129 Ca 0.00 -0.12 0.00 0.00 0.00 0.00 0.00 46.02 45.90 1rml n GLY 129 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1rml n SER 130 N 0.00 0.00 -4.89 1.61 2.88 -1.25 -4.99 113.62 106.98 1rml n SER 130 Ca 0.00 0.00 -0.29 0.00 -1.33 0.00 0.00 58.87 57.25 1rml n SER 130 Cb 0.00 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 63.44 1rml n SER 130 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1rml s LYS 132 N -4.08 2.56 -0.08 0.00 3.01 -1.26 -4.84 119.74 115.04 1rml s LYS 132 Ca 0.50 -1.18 -0.02 0.00 -1.01 0.00 0.00 55.97 54.25 1rml s LYS 132 Cb -0.10 -2.37 0.04 0.00 -1.01 0.00 0.00 37.83 34.38 1rml s LYS 132 CO 0.35 0.41 0.05 -0.98 0.51 0.00 0.00 175.35 175.69 1rml s ARG 133 N -3.46 0.19 1.14 1.68 1.04 -1.26 -4.23 118.95 114.06 1rml s ARG 133 Ca 0.31 0.17 0.00 0.00 -1.04 0.00 0.00 55.73 55.16 1rml s ARG 133 Cb -0.08 -0.99 0.00 0.00 -2.04 0.00 0.00 34.95 31.84 1rml s ARG 133 CO 0.21 -0.41 0.00 0.41 -0.04 0.00 0.00 175.30 175.48 1rml n GLY 134 N 5.24 0.63 2.91 3.88 0.00 0.23 -4.59 105.19 113.48 1rml n GLY 134 Ca -0.05 -1.47 -0.42 0.00 0.00 0.00 0.00 46.02 44.08 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 2.77 2.16 -0.78 1.61 -0.04 -1.26 -3.72 135.00 135.73 1rml n PRO 135 Ca 0.00 -2.19 -0.03 0.00 -0.04 0.00 0.00 63.50 61.24 1rml n PRO 135 Cb 0.00 -3.08 -0.03 0.00 -0.04 0.00 0.00 33.50 30.35 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 6.49 0.00 -3.29 0.54 3.00 -1.26 -5.02 116.66 117.13 1rml n ARG 136 Ca 0.51 -0.61 -0.24 0.00 -0.01 0.00 0.00 57.85 57.50 1rml n ARG 136 Cb 0.39 0.22 -0.08 0.00 0.00 0.00 0.00 32.46 32.99 1rml n ARG 136 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.63 175.26 1rml n THR 137 N 0.02 -0.99 -4.61 0.55 5.66 -1.24 -4.73 114.28 108.93 1rml n THR 137 Ca -0.13 -3.37 -0.28 0.00 -3.05 0.00 0.00 64.05 57.22 1rml n THR 137 Cb 0.63 -1.48 -0.07 0.00 -1.55 0.00 0.00 70.33 67.86 1rml n THR 137 CO 0.00 0.00 0.00 1.41 -3.05 0.00 0.00 175.07 173.43 1rml n HIS 138 N 2.46 0.65 0.00 1.09 8.25 -1.26 0.22 115.22 126.63 1rml n HIS 138 Ca 0.27 -2.49 0.00 0.00 -0.26 0.00 0.00 57.72 55.24 1rml n HIS 138 Cb 0.50 -0.17 0.00 0.00 1.12 0.00 0.00 29.99 31.44 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 -1.06 -1.04 -0.99 4.41 9.36 -1.26 -3.85 117.16 122.73 1rml n TYR 139 Ca -0.13 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.09 1rml n TYR 139 Cb 0.61 0.00 0.00 0.00 -0.63 0.00 0.00 39.34 39.32 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 0.04 2.70 2.98 0.00 -1.26 -4.90 105.19 104.76 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 -1.80 0.62 0.33 1.61 -0.21 -1.25 -4.96 119.66 114.00 1rml s GLN 141 Ca 0.00 -0.81 0.11 0.00 0.02 0.00 0.00 55.36 54.68 1rml s GLN 141 Cb 0.00 -1.88 0.59 0.00 1.00 0.00 0.00 33.01 32.72 1rml s GLN 141 CO 0.00 -0.90 1.21 1.63 -2.12 0.00 0.00 175.29 175.11 1rml n LYS 142 N 4.97 0.08 -0.23 2.91 4.01 -1.26 -0.31 118.16 128.33 1rml n LYS 142 Ca -0.05 0.56 0.28 0.00 -0.51 0.00 0.00 58.31 58.59 1rml n LYS 142 Cb 0.43 -2.14 0.68 0.00 -0.51 0.00 0.00 35.03 33.50 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 0.97 2.76 0.00 7.82 0.00 -1.89 1.51 119.26 130.43 1rml h ALA 143 Ca 0.00 -0.02 -0.18 0.00 0.00 0.00 0.00 54.91 54.71 1rml h ALA 143 Cb 0.77 0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.59 1rml h ALA 143 CO 0.00 -1.05 -0.85 -0.84 0.00 0.00 0.00 179.25 176.51 1rml h ILE 144 N 0.09 1.58 -1.99 0.00 3.07 -0.82 -3.29 117.51 116.15 1rml h ILE 144 Ca 0.47 -2.94 -0.50 0.00 1.55 0.00 0.00 64.86 63.44 1rml h ILE 144 Cb 1.72 2.60 -0.03 0.00 -0.27 0.00 0.00 36.82 40.84 1rml h ILE 144 CO -0.05 0.83 1.40 -0.76 -1.05 0.00 0.00 178.15 178.52 1rml s LEU 145 N -6.98 3.34 -0.23 0.16 1.02 0.52 -4.01 118.68 112.50 1rml s LEU 145 Ca 0.00 0.59 -0.04 0.00 0.02 0.00 0.00 54.13 54.71 1rml s LEU 145 Cb 0.11 -2.64 -0.01 0.00 0.02 0.00 0.00 46.19 43.67 1rml s LEU 145 CO 0.80 -2.39 -0.03 -0.36 0.02 0.00 0.00 176.35 174.38 1rml s PHE 146 N 9.40 2.97 -0.45 0.29 0.08 -1.26 -0.71 117.98 128.30 1rml s PHE 146 Ca 0.74 -0.94 -0.10 0.00 0.12 0.00 0.00 56.93 56.76 1rml s PHE 146 Cb -0.15 -2.11 0.10 0.00 -0.57 0.00 0.00 43.02 40.29 1rml s PHE 146 CO 0.23 -0.55 0.31 -1.17 -0.10 0.00 0.00 175.22 173.95 1rml s LEU 147 N 1.48 5.47 0.10 -0.37 1.98 0.28 -2.85 118.68 124.76 1rml s LEU 147 Ca 0.05 -1.71 -0.30 0.00 -2.89 0.00 0.00 54.13 49.28 1rml s LEU 147 Cb -0.14 -2.01 -0.06 0.00 0.66 0.00 0.00 46.19 44.63 1rml s LEU 147 CO -0.03 -0.63 1.15 -2.16 -1.89 0.00 0.00 176.35 172.79 1rml s PRO 148 N 1.40 4.50 -0.60 0.98 0.04 -1.26 -2.44 135.00 137.62 1rml s PRO 148 Ca 0.04 1.73 0.06 0.00 0.04 0.00 0.00 61.00 62.87 1rml s PRO 148 Cb -0.25 -3.33 0.22 0.00 0.04 0.00 0.00 34.50 31.18 1rml s PRO 148 CO 0.01 -0.12 0.60 1.47 0.04 0.00 0.00 177.00 178.99 1rml n LEU 149 N 3.31 2.54 -4.79 -3.56 -0.00 -0.97 -5.00 117.00 108.54 1rml n LEU 149 Ca 0.06 -5.15 -0.29 0.00 -0.00 0.00 0.00 56.01 50.64 1rml n LEU 149 Cb 0.47 -0.36 0.13 0.00 -0.00 0.00 0.00 43.42 43.65 1rml n LEU 149 CO 0.55 1.95 0.71 -2.16 -0.00 0.00 0.00 177.39 178.44 1rml s PRO 150 N -1.71 1.30 -0.10 1.47 0.04 -1.26 -3.76 135.00 130.97 1rml s PRO 150 Ca 0.34 0.35 0.02 0.00 0.04 0.00 0.00 61.00 61.75 1rml s PRO 150 Cb 0.08 -1.85 0.08 0.00 0.04 0.00 0.00 34.50 32.85 1rml s PRO 150 CO -0.09 -2.10 0.76 1.33 0.04 0.00 0.00 177.00 176.93 1rml n VAL 151 N -3.71 0.00 -1.64 -0.36 0.24 -0.83 -4.90 118.33 107.14 1rml n VAL 151 Ca 0.07 -0.26 -0.16 0.00 -2.04 0.00 0.00 64.34 61.95 1rml n VAL 151 Cb 0.59 0.60 -0.10 0.00 -1.47 0.00 0.00 33.84 33.45 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 -0.23 3.60 -0.64 -1.34 0.15 -1.10 -4.68 113.70 109.47 1rml s SER 152 Ca 0.02 -0.90 0.06 0.00 0.70 0.00 0.00 55.95 55.83 1rml s SER 152 Cb 0.09 -2.59 0.25 0.00 -1.71 0.00 0.00 66.02 62.06 1rml s SER 152 CO -0.02 -4.54 0.76 -0.24 1.20 0.00 0.00 173.24 170.40 1rml n SER 153 N 19.18 3.81 0.00 5.45 2.88 -1.26 -5.12 113.62 138.56 1rml n SER 153 Ca 0.42 -3.46 0.00 0.00 -1.33 0.00 0.00 58.87 54.51 1rml n SER 153 Cb 0.46 -0.67 0.00 0.00 -0.75 0.00 0.00 64.21 63.26 1rml n SER 153 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14