#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 4.17 0.00 1.97 0.04 -1.26 -4.93 135.00 134.99 1rml s PRO 25 Ca 0.00 1.61 0.00 0.00 0.04 0.00 0.00 61.00 62.65 1rml s PRO 25 Cb 0.00 -3.80 0.00 0.00 0.04 0.00 0.00 34.50 30.74 1rml s PRO 25 CO 0.00 -0.79 0.00 1.17 0.04 0.00 0.00 177.00 177.42 1rml n LYS 26 N 6.76 0.00 -3.33 4.56 3.00 -1.26 -2.76 118.16 125.14 1rml n LYS 26 Ca 0.14 0.00 0.03 0.00 -0.00 0.00 0.00 58.31 58.48 1rml n LYS 26 Cb 0.45 0.00 -0.03 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 -0.77 0.00 3.14 0.05 -1.26 -4.11 118.68 115.73 1rml s LEU 27 Ca 0.00 0.79 -0.08 0.00 0.05 0.00 0.00 54.13 54.89 1rml s LEU 27 Cb 0.00 1.77 0.13 0.00 -2.05 0.00 0.00 46.19 46.04 1rml s LEU 27 CO 0.00 -0.15 0.41 -0.11 -0.55 0.00 0.00 176.35 175.95 1rml n LEU 28 N 5.24 0.00 0.00 1.48 0.00 -1.26 -3.48 117.00 118.97 1rml n LEU 28 Ca -0.08 -0.43 0.00 0.00 0.00 0.00 0.00 56.01 55.51 1rml n LEU 28 Cb 0.52 -0.39 0.00 0.00 0.00 0.00 0.00 43.42 43.55 1rml n LEU 28 CO -0.05 -1.60 0.00 0.00 0.00 0.00 0.00 177.39 175.75 1rml n TYR 29 N -3.59 0.00 -1.94 1.96 9.36 -1.20 -4.69 117.16 117.06 1rml n TYR 29 Ca 0.06 0.00 -0.32 0.00 3.32 0.00 0.00 57.90 60.96 1rml n TYR 29 Cb 0.23 0.00 0.01 0.00 -0.63 0.00 0.00 39.34 38.95 1rml n TYR 29 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 1rml n SER 31 N -2.43 0.00 -4.22 0.00 2.88 0.93 -4.01 113.62 106.77 1rml n SER 31 Ca 0.07 0.00 -0.30 0.00 -1.33 0.00 0.00 58.87 57.31 1rml n SER 31 Cb 0.54 0.00 -0.18 0.00 -0.75 0.00 0.00 64.21 63.82 1rml n SER 31 CO 0.00 0.00 0.00 -3.20 -1.23 0.00 0.00 175.04 170.61 1rml n ASN 32 N 0.00 -0.51 -1.66 -3.46 5.15 -1.26 -2.32 115.26 111.20 1rml n ASN 32 Ca 0.00 -0.15 0.00 0.00 -0.60 0.00 0.00 54.58 53.83 1rml n ASN 32 Cb 0.00 -0.69 0.00 0.00 -0.53 0.00 0.00 39.78 38.56 1rml n ASN 32 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1rml n GLY 33 N 5.66 0.00 0.00 8.20 0.00 -1.26 -4.75 105.19 113.03 1rml n GLY 33 Ca 0.63 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.65 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 -0.62 -0.36 3.92 -0.02 0.00 -0.98 -5.03 105.19 102.09 1rml n GLY 34 Ca 0.00 -1.37 -0.24 0.00 0.00 0.00 0.00 46.02 44.40 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 0.00 1.80 -0.33 1.61 3.76 -1.26 -4.61 115.29 116.25 1rml s HIS 35 Ca 0.00 -0.76 0.00 0.00 -0.15 0.00 0.00 55.06 54.16 1rml s HIS 35 Cb 0.00 -2.01 0.08 0.00 1.11 0.00 0.00 32.58 31.76 1rml s HIS 35 CO 0.00 -0.52 0.05 -0.06 -0.85 0.00 0.00 174.74 173.36 1rml s PHE 36 N -2.70 3.48 0.36 1.40 0.40 0.44 0.96 117.98 122.32 1rml s PHE 36 Ca 0.41 -2.39 -0.14 0.00 -0.60 0.00 0.00 56.93 54.22 1rml s PHE 36 Cb -0.03 -2.59 -0.11 0.00 0.51 0.00 0.00 43.02 40.80 1rml s PHE 36 CO 0.25 -0.90 -0.05 1.28 0.70 0.00 0.00 175.22 176.50 1rml n LEU 37 N 4.49 -2.59 -3.72 -0.37 4.77 -1.26 -2.50 117.00 115.82 1rml n LEU 37 Ca -0.06 0.52 -0.12 0.00 -0.03 0.00 0.00 56.01 56.33 1rml n LEU 37 Cb 0.42 -0.64 -0.12 0.00 -2.33 0.00 0.00 43.42 40.75 1rml n LEU 37 CO 0.26 -3.47 -0.03 0.00 -1.33 0.00 0.00 177.39 172.83 1rml s ARG 38 N -0.75 0.32 -0.31 3.23 1.70 -0.74 -4.55 118.95 117.85 1rml s ARG 38 Ca 0.43 0.62 -0.05 0.00 -0.47 0.00 0.00 55.73 56.26 1rml s ARG 38 Cb -0.40 -0.02 0.03 0.00 -0.57 0.00 0.00 34.95 33.99 1rml s ARG 38 CO 0.49 -0.14 0.06 0.42 -1.08 0.00 0.00 175.30 175.05 1rml s ILE 39 N 1.10 3.63 0.18 4.99 1.01 -1.24 -2.66 121.20 128.21 1rml s ILE 39 Ca -0.08 -1.00 -0.21 0.00 0.00 0.00 0.00 60.65 59.37 1rml s ILE 39 Cb -0.08 -2.97 -0.08 0.00 0.01 0.00 0.00 42.46 39.34 1rml s ILE 39 CO -0.08 -0.03 0.70 -0.76 0.00 0.00 0.00 174.94 174.76 1rml s LEU 40 N 1.41 4.44 0.00 2.97 1.43 -0.90 -4.79 118.68 123.23 1rml s LEU 40 Ca -0.00 1.43 0.03 0.00 -1.03 0.00 0.00 54.13 54.56 1rml s LEU 40 Cb -0.18 -3.38 0.19 0.00 0.03 0.00 0.00 46.19 42.85 1rml s LEU 40 CO 0.01 0.12 0.89 -0.81 0.23 0.00 0.00 176.35 176.79 1rml n PRO 41 N 1.12 0.75 -0.04 1.29 -0.04 -1.26 -2.32 135.00 134.49 1rml n PRO 41 Ca -0.05 0.00 -0.07 0.00 -0.04 0.00 0.00 63.50 63.34 1rml n PRO 41 Cb 0.50 -1.07 -0.14 0.00 -0.04 0.00 0.00 33.50 32.76 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 -0.57 0.55 0.00 3.54 -0.08 -1.26 -4.97 116.55 113.76 1rml n ASP 42 Ca 0.02 0.26 0.00 0.00 -1.51 0.00 0.00 54.79 53.56 1rml n ASP 42 Cb 0.01 0.40 0.00 0.00 2.34 0.00 0.00 41.12 43.87 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 1.58 1.74 3.21 0.27 0.00 -0.98 -5.12 105.19 105.89 1rml n GLY 43 Ca -0.21 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.52 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 1.84 0.36 2.61 2.01 -1.25 -4.65 115.64 114.56 1rml s THR 44 Ca 0.00 -0.93 0.08 0.00 0.31 0.00 0.00 61.69 61.14 1rml s THR 44 Cb 0.00 -1.57 -0.03 0.00 0.01 0.00 0.00 72.50 70.91 1rml s THR 44 CO 0.00 0.51 0.26 0.54 -0.69 0.00 0.00 174.62 175.24 1rml s VAL 45 N 0.01 3.06 0.00 3.82 0.11 -1.26 -2.13 120.40 124.01 1rml s VAL 45 Ca -0.07 -1.49 0.00 0.00 -2.93 0.00 0.00 61.98 57.50 1rml s VAL 45 Cb -0.14 -3.06 0.00 0.00 -1.53 0.00 0.00 36.38 31.65 1rml s VAL 45 CO 0.04 -0.12 0.00 0.47 -3.33 0.00 0.00 175.10 172.16 1rml n ASP 46 N -1.34 0.00 -3.71 3.54 9.92 -1.09 -4.82 116.55 119.05 1rml n ASP 46 Ca -0.01 -0.33 -0.12 0.00 -0.53 0.00 0.00 54.79 53.80 1rml n ASP 46 Cb 0.61 0.00 -0.13 0.00 -0.64 0.00 0.00 41.12 40.96 1rml n ASP 46 CO 0.00 0.00 0.00 -0.83 0.13 0.00 0.00 177.20 176.50 1rml s GLY 47 N -1.53 -0.18 -0.24 0.44 0.00 -1.26 -1.79 107.32 102.76 1rml s GLY 47 Ca 0.00 1.10 -0.12 0.00 0.00 0.00 0.00 44.72 45.70 1rml s GLY 47 CO 0.00 1.47 0.22 -1.59 0.00 0.00 0.00 173.10 173.19 1rml s THR 48 N 1.49 5.32 0.22 0.90 2.01 -1.04 -4.18 115.64 120.35 1rml s THR 48 Ca -0.08 0.29 -0.14 0.00 0.31 0.00 0.00 61.69 62.08 1rml s THR 48 Cb -0.10 -3.56 0.26 0.00 0.01 0.00 0.00 72.50 69.12 1rml s THR 48 CO -0.09 0.31 1.42 -2.11 -0.69 0.00 0.00 174.62 173.45 1rml n ARG 49 N 4.47 -0.18 -3.79 4.92 1.85 -1.26 0.17 116.66 122.83 1rml n ARG 49 Ca -0.13 1.41 -0.29 0.00 -1.00 0.00 0.00 57.85 57.83 1rml n ARG 49 Cb 0.52 -2.09 -0.16 0.00 -1.05 0.00 0.00 32.46 29.68 1rml n ARG 49 CO 0.00 0.00 0.00 -0.51 -0.01 0.00 0.00 177.63 177.11 1rml s ASP 50 N -5.31 3.49 -0.11 2.89 1.11 -1.26 -4.03 116.67 113.46 1rml s ASP 50 Ca -0.13 -1.16 -0.10 0.00 0.18 0.00 0.00 52.55 51.35 1rml s ASP 50 Cb 0.20 -0.84 -0.04 0.00 1.07 0.00 0.00 42.92 43.31 1rml s ASP 50 CO 0.66 -0.32 0.44 -2.11 1.18 0.00 0.00 175.17 175.03 1rml n ARG 51 N 4.88 0.00 -2.72 8.23 -4.01 -1.24 -4.80 116.66 117.00 1rml n ARG 51 Ca -0.08 0.00 -0.08 0.00 -1.04 0.00 0.00 57.85 56.65 1rml n ARG 51 Cb 0.45 -0.32 0.09 0.00 -3.04 0.00 0.00 32.46 29.64 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 1.50 -2.25 -1.12 2.89 2.88 -1.26 -5.12 113.62 111.15 1rml n SER 52 Ca 0.11 -3.49 0.00 0.00 -1.33 0.00 0.00 58.87 54.16 1rml n SER 52 Cb -0.01 1.85 0.00 0.00 -0.75 0.00 0.00 64.21 65.30 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 0.43 0.46 0.08 -3.46 2.03 -1.26 -5.07 116.55 109.77 1rml n ASP 53 Ca 0.05 -0.91 -0.21 0.00 0.52 0.00 0.00 54.79 54.24 1rml n ASP 53 Cb 0.70 0.00 -0.15 0.00 -0.72 0.00 0.00 41.12 40.96 1rml n ASP 53 CO 0.00 0.00 0.00 0.06 -1.92 0.00 0.00 177.20 175.34 1rml h GLN 54 N 0.00 0.37 -1.42 -0.67 -0.00 -2.01 -3.44 115.11 107.94 1rml h GLN 54 Ca 0.00 -0.64 -0.09 0.00 -0.00 0.00 0.00 58.65 57.92 1rml h GLN 54 Cb 0.00 0.24 -0.25 0.00 -0.00 0.00 0.00 27.48 27.46 1rml h GLN 54 CO 0.00 1.27 -0.46 -3.38 -0.00 0.00 0.00 178.83 176.26 1rml s HIS 55 N -2.60 -1.34 0.00 0.06 -3.43 -1.26 -4.97 115.29 101.75 1rml s HIS 55 Ca -0.12 0.69 0.00 0.00 -0.80 0.00 0.00 55.06 54.83 1rml s HIS 55 Cb 0.06 0.06 0.00 0.00 -1.43 0.00 0.00 32.58 31.26 1rml s HIS 55 CO 0.87 -1.01 0.72 0.44 -2.00 0.00 0.00 174.74 173.77 1rml n ILE 56 N 5.38 0.48 -0.49 -5.38 -6.64 -1.26 -3.63 119.36 107.82 1rml n ILE 56 Ca 0.02 -0.71 -0.28 0.00 -1.77 0.00 0.00 62.75 60.01 1rml n ILE 56 Cb 0.51 0.79 0.26 0.00 -1.44 0.00 0.00 39.64 39.77 1rml n ILE 56 CO 0.00 0.00 0.00 -1.10 -1.77 0.00 0.00 176.55 173.68 1rml s GLN 57 N -0.48 -1.15 0.34 6.28 -0.21 -1.26 -4.24 119.66 118.94 1rml s GLN 57 Ca 0.00 0.84 -0.09 0.00 0.02 0.00 0.00 55.36 56.12 1rml s GLN 57 Cb 0.00 -1.53 0.02 0.00 1.00 0.00 0.00 33.01 32.50 1rml s GLN 57 CO 0.00 -3.88 0.59 -0.51 -2.12 0.00 0.00 175.29 169.38 1rml s LEU 58 N -7.32 0.50 -0.30 2.90 1.43 -1.26 -4.65 118.68 109.99 1rml s LEU 58 Ca 0.69 -1.24 -0.12 0.00 -1.03 0.00 0.00 54.13 52.42 1rml s LEU 58 Cb -0.26 2.05 0.16 0.00 0.03 0.00 0.00 46.19 48.17 1rml s LEU 58 CO 0.65 -1.41 0.88 -1.58 0.23 0.00 0.00 176.35 175.12 1rml s GLN 59 N -2.99 0.37 0.51 1.70 2.00 0.24 -4.52 119.66 116.98 1rml s GLN 59 Ca 0.23 0.88 -0.17 0.00 -2.00 0.00 0.00 55.36 54.31 1rml s GLN 59 Cb -0.02 0.52 -0.08 0.00 0.80 0.00 0.00 33.01 34.23 1rml s GLN 59 CO 0.15 -0.19 0.98 -0.51 -0.50 0.00 0.00 175.29 175.22 1rml s LEU 60 N 2.66 3.64 -0.32 3.68 1.43 -1.26 0.23 118.68 128.74 1rml s LEU 60 Ca -0.01 1.56 0.17 0.00 -1.03 0.00 0.00 54.13 54.83 1rml s LEU 60 Cb -0.09 -4.50 0.45 0.00 0.03 0.00 0.00 46.19 42.09 1rml s LEU 60 CO -0.17 -0.57 1.09 -0.24 0.23 0.00 0.00 176.35 176.69 1rml n SER 61 N -1.53 0.68 -4.23 2.29 2.88 0.70 -4.80 113.62 109.60 1rml n SER 61 Ca 0.06 -2.49 -0.59 0.00 -1.33 0.00 0.00 58.87 54.52 1rml n SER 61 Cb 0.54 -0.16 -0.08 0.00 -0.75 0.00 0.00 64.21 63.75 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 -0.36 -2.10 0.72 -1.46 0.00 -1.26 -2.73 120.51 113.33 1rml n ALA 62 Ca 0.05 0.49 0.07 0.00 0.00 0.00 0.00 53.44 54.05 1rml n ALA 62 Cb 0.83 -1.69 -0.08 0.00 0.00 0.00 0.00 19.45 18.51 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 2.72 1.93 -3.08 0.00 0.28 -1.24 -4.79 120.64 116.47 1rml n GLU 63 Ca 0.24 -0.06 0.00 0.00 -0.16 0.00 0.00 57.16 57.18 1rml n GLU 63 Cb -0.00 -1.23 0.00 0.00 1.43 0.00 0.00 31.44 31.64 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 -1.27 0.00 -4.90 -1.84 7.64 -1.07 -5.05 113.62 107.14 1rml n SER 64 Ca 0.03 0.00 -0.29 0.00 1.01 0.00 0.00 58.87 59.62 1rml n SER 64 Cb 0.25 0.00 -0.03 0.00 -1.01 0.00 0.00 64.21 63.41 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 -3.00 4.96 -0.97 0.44 -7.23 -1.26 -4.00 120.40 109.34 1rml s VAL 65 Ca 0.00 0.22 0.00 0.00 -1.81 0.00 0.00 61.98 60.39 1rml s VAL 65 Cb 0.00 -3.73 0.00 0.00 0.56 0.00 0.00 36.38 33.21 1rml s VAL 65 CO 0.00 -0.36 0.00 0.61 -0.31 0.00 0.00 175.10 175.04 1rml n GLY 66 N -0.98 -0.12 3.54 2.32 0.00 -1.04 -4.84 105.19 104.07 1rml n GLY 66 Ca -0.01 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.04 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 -4.49 0.06 0.15 1.61 -1.05 -1.25 -4.16 118.70 109.57 1rml s GLU 67 Ca 0.00 0.11 -0.02 0.00 -0.15 0.00 0.00 54.97 54.91 1rml s GLU 67 Cb 0.00 0.03 -0.04 0.00 -0.44 0.00 0.00 34.13 33.68 1rml s GLU 67 CO 0.00 -0.01 0.10 0.14 0.95 0.00 0.00 175.26 176.44 1rml s VAL 68 N 1.31 0.08 -0.29 1.83 -7.23 -1.16 -2.59 120.40 112.34 1rml s VAL 68 Ca -0.06 -1.86 0.03 0.00 -1.81 0.00 0.00 61.98 58.28 1rml s VAL 68 Cb -0.02 -2.11 0.08 0.00 0.56 0.00 0.00 36.38 34.89 1rml s VAL 68 CO -0.12 -0.36 -0.04 -0.31 -0.31 0.00 0.00 175.10 173.97 1rml s TYR 69 N -4.06 3.48 -0.01 2.82 1.51 -1.10 -0.49 117.35 119.51 1rml s TYR 69 Ca 0.26 -2.62 -0.19 0.00 -1.01 0.00 0.00 57.07 53.52 1rml s TYR 69 Cb 0.07 -2.35 -0.05 0.00 -0.11 0.00 0.00 41.96 39.51 1rml s TYR 69 CO 0.04 -0.91 0.54 0.42 -1.11 0.00 0.00 175.55 174.52 1rml s ILE 70 N 1.02 4.94 -0.02 2.71 1.01 -1.26 0.25 121.20 129.85 1rml s ILE 70 Ca -0.01 1.12 0.02 0.00 0.00 0.00 0.00 60.65 61.78 1rml s ILE 70 Cb -0.20 -3.86 0.00 0.00 0.01 0.00 0.00 42.46 38.41 1rml s ILE 70 CO -0.06 0.46 -0.05 -0.75 0.00 0.00 0.00 174.94 174.54 1rml s LYS 71 N -0.41 0.55 -1.22 2.79 2.36 0.63 -2.38 119.74 122.06 1rml s LYS 71 Ca 0.28 -0.16 -0.13 0.00 -2.55 0.00 0.00 55.97 53.41 1rml s LYS 71 Cb -0.18 -0.55 0.17 0.00 -1.05 0.00 0.00 37.83 36.22 1rml s LYS 71 CO 0.16 0.06 1.50 0.45 1.55 0.00 0.00 175.35 179.06 1rml n SER 72 N 3.30 5.21 -4.57 1.43 2.88 0.23 0.82 113.62 122.92 1rml n SER 72 Ca -0.17 -3.00 -0.19 0.00 -1.33 0.00 0.00 58.87 54.18 1rml n SER 72 Cb 0.56 -1.56 -0.08 0.00 -0.75 0.00 0.00 64.21 62.38 1rml n SER 72 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 1rml s THR 73 N 1.39 3.21 0.00 2.46 -1.32 -1.26 -2.42 115.64 117.70 1rml s THR 73 Ca 0.42 -0.28 0.00 0.00 -1.21 0.00 0.00 61.69 60.62 1rml s THR 73 Cb -0.01 -3.86 0.00 0.00 -1.51 0.00 0.00 72.50 67.12 1rml s THR 73 CO 0.00 -0.41 0.00 1.21 -2.21 0.00 0.00 174.62 173.22 1rml n GLU 74 N 8.50 0.00 -0.03 7.08 4.07 -1.26 -4.78 120.64 134.22 1rml n GLU 74 Ca 0.43 0.00 -0.02 0.00 -0.06 0.00 0.00 57.16 57.51 1rml n GLU 74 Cb 0.46 0.00 -0.04 0.00 -0.06 0.00 0.00 31.44 31.79 1rml n GLU 74 CO 0.00 0.00 0.00 -2.37 -0.06 0.00 0.00 177.13 174.70 1rml n THR 75 N 0.00 0.35 -0.17 6.31 5.66 -1.05 -5.08 114.28 120.29 1rml n THR 75 Ca 0.00 -0.22 0.00 0.00 -3.05 0.00 0.00 64.05 60.78 1rml n THR 75 Cb 0.00 -0.76 0.00 0.00 -1.55 0.00 0.00 70.33 68.02 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 2.63 0.50 3.50 1.09 0.00 -1.02 -4.99 105.19 106.90 1rml n GLY 76 Ca -0.08 -0.59 -0.17 0.00 0.00 0.00 0.00 46.02 45.18 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 -0.95 1.09 -0.24 1.61 -0.21 -1.25 -4.99 119.66 114.71 1rml s GLN 77 Ca 0.00 0.12 0.02 0.00 0.02 0.00 0.00 55.36 55.52 1rml s GLN 77 Cb 0.00 0.51 0.05 0.00 1.00 0.00 0.00 33.01 34.57 1rml s GLN 77 CO 0.00 -0.37 -0.12 0.71 -2.12 0.00 0.00 175.29 173.39 1rml s TYR 78 N -1.68 3.11 0.08 0.91 1.51 -1.26 0.78 117.35 120.79 1rml s TYR 78 Ca -0.08 -2.16 -0.37 0.00 -1.01 0.00 0.00 57.07 53.45 1rml s TYR 78 Cb -0.00 -1.90 -0.18 0.00 -0.11 0.00 0.00 41.96 39.77 1rml s TYR 78 CO 0.05 -0.86 1.15 -0.11 -1.11 0.00 0.00 175.55 174.67 1rml n LEU 79 N 4.48 0.80 -3.87 -1.29 7.94 -1.00 -3.57 117.00 120.49 1rml n LEU 79 Ca -0.15 1.14 -0.08 0.00 -1.11 0.00 0.00 56.01 55.80 1rml n LEU 79 Cb 0.44 -1.08 -0.03 0.00 0.53 0.00 0.00 43.42 43.27 1rml n LEU 79 CO 0.22 -1.56 0.33 0.00 -1.11 0.00 0.00 177.39 175.27 1rml s ALA 80 N 0.07 -0.84 -0.11 1.96 0.00 0.37 -4.42 121.76 118.79 1rml s ALA 80 Ca 0.83 -0.46 -0.03 0.00 0.00 0.00 0.00 51.96 52.30 1rml s ALA 80 Cb -1.05 0.92 0.05 0.00 0.00 0.00 0.00 23.12 23.05 1rml s ALA 80 CO 0.52 -0.92 0.13 1.41 0.00 0.00 0.00 175.76 176.91 1rml s MET 81 N -3.94 0.03 1.00 0.00 1.75 -1.24 0.17 119.30 117.08 1rml s MET 81 Ca 0.14 0.34 -0.15 0.00 -1.25 0.00 0.00 55.69 54.77 1rml s MET 81 Cb -0.03 -0.76 0.19 0.00 2.84 0.00 0.00 34.83 37.07 1rml s MET 81 CO 0.05 -0.43 1.18 -0.51 -0.65 0.00 0.00 175.02 174.65 1rml s ASP 82 N 2.24 2.71 0.45 1.11 1.01 -1.25 -4.74 116.67 118.20 1rml s ASP 82 Ca 0.04 0.70 0.26 0.00 0.71 0.00 0.00 52.55 54.26 1rml s ASP 82 Cb -0.13 -1.05 1.42 0.00 1.01 0.00 0.00 42.92 44.16 1rml s ASP 82 CO -0.07 -3.02 1.78 0.71 0.21 0.00 0.00 175.17 174.78 1rml h THR 83 N -1.83 0.00 -0.19 -1.27 1.35 -1.94 0.77 112.91 109.80 1rml h THR 83 Ca -0.47 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.39 1rml h THR 83 Cb 1.30 0.58 0.00 0.00 -1.73 0.00 0.00 68.15 68.30 1rml h THR 83 CO 0.48 0.00 0.00 -0.67 -0.25 0.00 0.00 175.52 175.08 1rml n ASP 84 N -2.48 1.08 -1.42 5.36 2.03 -1.26 -4.85 116.55 115.01 1rml n ASP 84 Ca -0.02 -1.94 -0.12 0.00 0.52 0.00 0.00 54.79 53.24 1rml n ASP 84 Cb 0.15 -0.13 -0.05 0.00 -0.72 0.00 0.00 41.12 40.38 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 0.85 1.01 3.40 0.27 0.00 0.27 -3.23 105.19 107.75 1rml n GLY 85 Ca 0.08 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.66 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 -3.70 5.38 0.05 0.99 0.20 -1.25 -2.11 118.68 118.22 1rml s LEU 86 Ca 0.00 -1.24 -0.35 0.00 0.69 0.00 0.00 54.13 53.24 1rml s LEU 86 Cb 0.00 -2.32 -0.18 0.00 -0.43 0.00 0.00 46.19 43.26 1rml s LEU 86 CO 0.00 -0.87 0.87 0.18 -0.29 0.00 0.00 176.35 176.24 1rml n LEU 87 N 5.84 -0.29 -3.45 -0.68 4.32 -1.26 -3.77 117.00 117.70 1rml n LEU 87 Ca -0.10 1.07 -0.11 0.00 -0.02 0.00 0.00 56.01 56.85 1rml n LEU 87 Cb 0.44 -0.86 -0.02 0.00 -1.62 0.00 0.00 43.42 41.35 1rml n LEU 87 CO 0.53 -2.03 0.49 -0.72 -1.22 0.00 0.00 177.39 174.44 1rml s TYR 88 N -0.23 -0.49 0.21 -1.77 1.13 0.45 -4.31 117.35 112.34 1rml s TYR 88 Ca 0.79 0.35 0.11 0.00 -1.41 0.00 0.00 57.07 56.91 1rml s TYR 88 Cb -1.11 0.54 -0.05 0.00 -1.10 0.00 0.00 41.96 40.25 1rml s TYR 88 CO 0.53 -0.74 -0.23 0.20 -2.51 0.00 0.00 175.55 172.80 1rml s GLY 89 N -2.55 1.73 0.10 5.49 0.00 -1.26 0.14 107.32 110.97 1rml s GLY 89 Ca 0.01 -1.69 -0.12 0.00 0.00 0.00 0.00 44.72 42.93 1rml s GLY 89 CO -0.10 -1.73 0.28 -0.45 0.00 0.00 0.00 173.10 171.10 1rml s SER 90 N -2.85 -0.03 0.00 1.64 0.15 -1.23 -4.88 113.70 106.49 1rml s SER 90 Ca 0.22 -0.48 0.19 0.00 0.70 0.00 0.00 55.95 56.59 1rml s SER 90 Cb -0.07 0.39 1.13 0.00 -1.71 0.00 0.00 66.02 65.75 1rml s SER 90 CO 0.11 -0.76 1.71 1.67 1.20 0.00 0.00 173.24 177.17 1rml n GLN 91 N -0.03 0.98 -3.79 5.44 7.27 -1.26 -4.08 117.38 121.90 1rml n GLN 91 Ca -0.16 0.00 -0.34 0.00 0.07 0.00 0.00 57.00 56.57 1rml n GLN 91 Cb 0.62 -1.30 -0.11 0.00 2.41 0.00 0.00 30.24 31.86 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 3.37 -0.40 1.69 -4.23 -1.26 -5.06 115.64 107.75 1rml s THR 92 Ca 0.28 -3.12 -0.29 0.00 -1.18 0.00 0.00 61.69 57.38 1rml s THR 92 Cb 0.13 -3.23 0.01 0.00 1.34 0.00 0.00 72.50 70.75 1rml s THR 92 CO 0.22 -0.86 1.40 -2.16 -0.54 0.00 0.00 174.62 172.68 1rml s PRO 93 N -0.20 3.60 0.14 3.99 0.04 -1.26 -4.60 135.00 136.71 1rml s PRO 93 Ca 0.17 0.97 -0.00 0.00 0.04 0.00 0.00 61.00 62.18 1rml s PRO 93 Cb -0.22 -4.01 0.00 0.00 0.04 0.00 0.00 34.50 30.31 1rml s PRO 93 CO -0.02 -1.53 0.18 0.09 0.04 0.00 0.00 177.00 175.76 1rml n ASN 94 N 8.72 -0.50 -0.33 6.66 3.02 -1.26 -4.92 115.26 126.64 1rml n ASN 94 Ca 0.16 -1.78 0.35 0.00 -0.03 0.00 0.00 54.58 53.28 1rml n ASN 94 Cb 0.48 0.97 0.63 0.00 -0.61 0.00 0.00 39.78 41.24 1rml n ASN 94 CO 0.00 0.00 0.00 -0.33 -2.62 0.00 0.00 177.26 174.31 1rml h GLU 95 N 0.00 0.00 -0.05 3.52 3.07 -1.94 1.55 114.58 120.73 1rml h GLU 95 Ca -0.11 0.00 -0.10 0.00 -0.50 0.00 0.00 59.36 58.66 1rml h GLU 95 Cb 0.48 0.00 0.01 0.00 -0.84 0.00 0.00 28.75 28.39 1rml h GLU 95 CO 0.15 0.00 -0.34 1.49 -1.40 0.00 0.00 179.01 178.91 1rml h GLU 96 N 0.00 0.32 -0.15 2.33 4.81 -1.93 -3.17 114.58 116.80 1rml h GLU 96 Ca 0.59 -0.28 -0.10 0.00 -0.13 0.00 0.00 59.36 59.45 1rml h GLU 96 Cb 2.85 0.06 -0.01 0.00 0.63 0.00 0.00 28.75 32.28 1rml h GLU 96 CO -0.01 0.93 -0.33 0.00 -0.73 0.00 0.00 179.01 178.88 1rml n LEU 98 N -4.09 -2.39 -3.35 0.00 4.77 0.10 -4.23 117.00 107.82 1rml n LEU 98 Ca -0.01 -0.13 -0.14 0.00 -0.03 0.00 0.00 56.01 55.70 1rml n LEU 98 Cb 0.43 -0.93 -0.08 0.00 -2.33 0.00 0.00 43.42 40.51 1rml n LEU 98 CO 0.41 -3.04 -0.13 -0.36 -1.33 0.00 0.00 177.39 172.95 1rml s PHE 99 N -2.22 -0.65 -0.69 -1.77 0.08 0.36 -4.20 117.98 108.89 1rml s PHE 99 Ca 0.55 -0.14 -0.36 0.00 0.12 0.00 0.00 56.93 57.10 1rml s PHE 99 Cb -0.11 -0.32 -0.18 0.00 -0.57 0.00 0.00 43.02 41.84 1rml s PHE 99 CO 0.66 -0.96 2.41 1.28 -0.10 0.00 0.00 175.22 178.50 1rml n LEU 100 N 5.06 0.86 -4.41 -0.37 4.77 -0.16 -2.99 117.00 119.75 1rml n LEU 100 Ca 0.02 0.34 -0.30 0.00 -0.03 0.00 0.00 56.01 56.05 1rml n LEU 100 Cb 0.47 -1.01 -0.13 0.00 -2.33 0.00 0.00 43.42 40.42 1rml n LEU 100 CO 0.01 -0.80 -0.53 -0.70 -1.33 0.00 0.00 177.39 174.04 1rml s GLU 101 N 7.47 1.78 0.00 3.23 -6.30 -1.26 -0.28 118.70 123.34 1rml s GLU 101 Ca 1.24 -1.14 0.00 0.00 -2.50 0.00 0.00 54.97 52.56 1rml s GLU 101 Cb -1.21 -2.05 0.00 0.00 0.00 0.00 0.00 34.13 30.87 1rml s GLU 101 CO 0.54 0.50 0.00 2.89 0.02 0.00 0.00 175.26 179.20 1rml n ARG 102 N 1.33 0.00 0.00 4.30 1.85 -1.26 -2.49 116.66 120.39 1rml n ARG 102 Ca -0.17 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.68 1rml n ARG 102 Cb 0.52 0.00 0.00 0.00 -1.05 0.00 0.00 32.46 31.93 1rml n ARG 102 CO 0.00 0.00 0.00 -0.11 -0.01 0.00 0.00 177.63 177.51 1rml n LEU 103 N 0.00 0.00 -0.03 2.89 0.00 -1.26 -4.95 117.00 113.64 1rml n LEU 103 Ca 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 56.01 55.80 1rml n LEU 103 Cb 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 43.42 43.29 1rml n LEU 103 CO 0.00 0.00 -0.90 1.21 0.00 0.00 0.00 177.39 177.70 1rml n GLU 104 N 0.00 0.72 0.00 1.96 0.00 -1.26 -4.98 120.64 117.07 1rml n GLU 104 Ca 0.00 0.27 0.00 0.00 0.00 0.00 0.00 57.16 57.43 1rml n GLU 104 Cb 0.00 -1.67 0.00 0.00 0.00 0.00 0.00 31.44 29.77 1rml n GLU 104 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.13 177.52 1rml n GLU 105 N -3.56 0.00 -1.93 5.31 -0.58 -1.26 -5.06 120.64 113.56 1rml n GLU 105 Ca -0.35 0.00 -0.04 0.00 -0.42 0.00 0.00 57.16 56.35 1rml n GLU 105 Cb 1.00 0.00 0.05 0.00 -0.57 0.00 0.00 31.44 31.92 1rml n GLU 105 CO 0.00 0.00 0.00 -1.71 -0.48 0.00 0.00 177.13 174.94 1rml n ASN 106 N 0.00 -1.16 0.02 1.62 5.15 -1.26 -5.00 115.26 114.62 1rml n ASN 106 Ca 0.00 -1.99 0.00 0.00 -0.60 0.00 0.00 54.58 51.99 1rml n ASN 106 Cb 0.00 0.49 0.00 0.00 -0.53 0.00 0.00 39.78 39.74 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 -0.86 -2.10 -0.23 1.20 8.25 -1.26 -5.15 115.22 115.08 1rml n HIS 107 Ca -0.20 0.13 -0.09 0.00 -0.26 0.00 0.00 57.72 57.30 1rml n HIS 107 Cb 0.77 0.66 0.09 0.00 1.12 0.00 0.00 29.99 32.63 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 -2.35 -1.94 -3.00 4.41 4.01 -1.26 -4.93 117.16 112.09 1rml n TYR 108 Ca 0.00 -0.09 -0.14 0.00 -0.16 0.00 0.00 57.90 57.51 1rml n TYR 108 Cb 0.00 -0.66 -0.03 0.00 -0.31 0.00 0.00 39.34 38.34 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 -1.88 -1.98 -4.55 7.72 5.03 -1.14 -4.67 115.26 113.78 1rml n ASN 109 Ca 0.04 -2.80 -0.36 0.00 0.87 0.00 0.00 54.58 52.33 1rml n ASN 109 Cb 0.17 0.76 -0.03 0.00 -1.02 0.00 0.00 39.78 39.66 1rml n ASN 109 CO 0.00 0.00 0.00 0.42 -1.83 0.00 0.00 177.26 175.85 1rml s THR 110 N 0.31 3.30 0.59 3.41 -4.23 -1.26 -4.58 115.64 113.18 1rml s THR 110 Ca 0.32 0.09 -0.10 0.00 -1.18 0.00 0.00 61.69 60.82 1rml s THR 110 Cb 0.08 -3.78 0.14 0.00 1.34 0.00 0.00 72.50 70.27 1rml s THR 110 CO -0.14 -0.75 0.78 -1.22 -0.54 0.00 0.00 174.62 172.74 1rml n TYR 111 N 13.58 -3.96 -3.62 3.99 4.02 -1.26 -4.24 117.16 125.66 1rml n TYR 111 Ca 0.26 -0.69 -0.03 0.00 -0.01 0.00 0.00 57.90 57.43 1rml n TYR 111 Cb 0.52 -0.61 -0.06 0.00 -0.02 0.00 0.00 39.34 39.16 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 -2.68 -0.11 -0.39 -0.72 1.01 0.61 -3.92 121.20 115.00 1rml s ILE 112 Ca 0.44 0.00 -0.32 0.00 0.00 0.00 0.00 60.65 60.77 1rml s ILE 112 Cb -0.01 -1.00 -0.14 0.00 0.01 0.00 0.00 42.46 41.31 1rml s ILE 112 CO 0.31 0.00 1.60 -0.24 0.00 0.00 0.00 174.94 176.61 1rml n SER 113 N 4.09 0.54 0.13 3.58 2.88 0.48 -0.99 113.62 124.33 1rml n SER 113 Ca -0.18 0.49 -0.00 0.00 -1.33 0.00 0.00 58.87 57.85 1rml n SER 113 Cb 0.57 -0.67 0.13 0.00 -0.75 0.00 0.00 64.21 63.49 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 6.75 0.00 0.00 -1.46 3.11 -1.80 0.84 116.57 124.01 1rml h LYS 114 Ca -0.07 0.00 0.00 0.00 -2.81 0.00 0.00 60.65 57.77 1rml h LYS 114 Cb 1.05 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 32.28 1rml h LYS 114 CO 0.82 0.63 0.00 1.17 -2.81 0.00 0.00 179.45 179.25 1rml n LYS 115 N -3.56 0.01 -2.65 1.90 4.81 -1.24 -4.04 118.16 113.39 1rml n LYS 115 Ca -0.00 0.31 -0.04 0.00 -0.87 0.00 0.00 58.31 57.71 1rml n LYS 115 Cb 0.68 -1.50 0.08 0.00 0.02 0.00 0.00 35.03 34.31 1rml n LYS 115 CO 0.00 0.00 0.00 -2.39 1.17 0.00 0.00 177.40 176.18 1rml n HIS 116 N -1.49 -0.01 1.53 5.64 1.44 -0.98 -4.99 115.22 116.36 1rml n HIS 116 Ca 0.03 -0.50 0.15 0.00 -2.01 0.00 0.00 57.72 55.38 1rml n HIS 116 Cb 0.12 1.01 0.70 0.00 0.12 0.00 0.00 29.99 31.94 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 1.43 2.67 0.28 1.59 0.00 0.29 -3.48 120.51 123.29 1rml n ALA 117 Ca -0.01 -0.24 0.18 0.00 0.00 0.00 0.00 53.44 53.38 1rml n ALA 117 Cb 0.72 -1.39 0.94 0.00 0.00 0.00 0.00 19.45 19.72 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 0.45 0.00 -0.02 0.00 4.81 -1.92 0.53 114.58 118.42 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 0.28 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.66 1rml h GLU 118 CO 0.00 0.00 -0.08 1.17 -0.73 0.00 0.00 179.01 179.37 1rml n LYS 119 N -2.76 1.85 -1.19 1.92 0.00 -1.23 -4.93 118.16 111.82 1rml n LYS 119 Ca -0.02 -1.61 -0.07 0.00 0.00 0.00 0.00 58.31 56.62 1rml n LYS 119 Cb 0.08 -1.41 -0.03 0.00 0.00 0.00 0.00 35.03 33.67 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 0.96 -4.52 -4.42 3.14 5.03 0.18 -4.86 115.26 110.76 1rml n ASN 120 Ca 0.12 0.16 -0.52 0.00 0.87 0.00 0.00 54.58 55.21 1rml n ASN 120 Cb 0.51 -2.60 -0.08 0.00 -1.02 0.00 0.00 39.78 36.59 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 -2.57 1.55 -2.67 3.10 8.01 -1.26 -4.52 117.44 119.09 1rml n TRP 121 Ca -0.07 0.36 -0.23 0.00 -1.31 0.00 0.00 57.50 56.25 1rml n TRP 121 Cb 0.34 -2.49 0.11 0.00 -2.01 0.00 0.00 31.31 27.25 1rml n TRP 121 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 177.69 176.62 1rml s PHE 122 N 6.99 1.41 -0.51 -5.99 0.40 -1.03 0.18 117.98 119.44 1rml s PHE 122 Ca 1.11 -0.39 0.09 0.00 -0.60 0.00 0.00 56.93 57.14 1rml s PHE 122 Cb -0.96 -2.87 0.26 0.00 0.51 0.00 0.00 43.02 39.96 1rml s PHE 122 CO 0.52 -1.69 1.21 1.55 0.70 0.00 0.00 175.22 177.50 1rml n VAL 123 N -2.77 1.26 -2.73 -0.44 3.14 -1.25 -4.63 118.33 110.90 1rml n VAL 123 Ca 0.16 -1.23 -0.42 0.00 -2.96 0.00 0.00 64.34 59.89 1rml n VAL 123 Cb 0.61 0.33 -0.04 0.00 -1.06 0.00 0.00 33.84 33.68 1rml n VAL 123 CO 0.00 0.00 0.00 -0.83 -6.46 0.00 0.00 176.83 169.54 1rml s GLY 124 N -1.28 1.20 0.01 7.55 0.00 -1.26 -4.81 107.32 108.74 1rml s GLY 124 Ca 0.21 -1.50 -0.31 0.00 0.00 0.00 0.00 44.72 43.11 1rml s GLY 124 CO 0.10 2.28 1.95 1.04 0.00 0.00 0.00 173.10 178.47 1rml n LEU 125 N 8.26 4.01 -1.04 0.66 4.32 -1.25 -4.43 117.00 127.53 1rml n LEU 125 Ca 0.00 0.92 -0.15 0.00 -0.02 0.00 0.00 56.01 56.76 1rml n LEU 125 Cb 0.47 -1.49 -0.02 0.00 -1.62 0.00 0.00 43.42 40.76 1rml n LEU 125 CO 0.67 0.15 0.30 1.17 -1.22 0.00 0.00 177.39 178.46 1rml n LYS 126 N 7.30 0.00 -0.24 3.23 4.81 -1.12 -4.44 118.16 127.71 1rml n LYS 126 Ca 0.21 0.00 -0.07 0.00 -0.87 0.00 0.00 58.31 57.57 1rml n LYS 126 Cb 0.38 -0.34 -0.01 0.00 0.02 0.00 0.00 35.03 35.09 1rml n LYS 126 CO 0.00 0.00 0.00 0.36 1.17 0.00 0.00 177.40 178.93 1rml n LYS 127 N 1.15 0.66 0.00 1.64 -0.00 -1.26 -2.36 118.16 117.99 1rml n LYS 127 Ca 0.09 -0.81 0.00 0.00 -0.00 0.00 0.00 58.31 57.59 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 -1.71 0.00 0.00 0.00 177.40 175.69 1rml n ASN 128 N 4.77 0.00 0.00 -5.58 2.85 -1.26 -5.03 115.26 111.00 1rml n ASN 128 Ca 0.14 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.61 1rml n ASN 128 Cb 0.04 0.01 0.00 0.00 1.24 0.00 0.00 39.78 41.07 1rml n ASN 128 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1rml n GLY 129 N 1.38 -0.02 0.00 8.20 0.00 -1.00 -4.94 105.19 108.82 1rml n GLY 129 Ca 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 46.02 45.81 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 -4.75 1.61 7.64 -1.26 -4.98 113.62 111.89 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 0.11 0.00 -1.01 0.00 0.00 64.21 63.31 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 -4.92 0.99 1.22 0.00 1.02 -1.26 -4.79 119.74 111.99 1rml s LYS 132 Ca 0.62 -0.76 -0.14 0.00 0.02 0.00 0.00 55.97 55.71 1rml s LYS 132 Cb -0.17 -1.00 0.31 0.00 -0.52 0.00 0.00 37.83 36.44 1rml s LYS 132 CO 0.56 0.25 0.97 -2.13 -0.92 0.00 0.00 175.35 174.08 1rml n ARG 133 N 1.94 -2.80 -0.19 1.68 3.00 -1.26 -4.75 116.66 114.28 1rml n ARG 133 Ca -0.18 -0.79 -0.12 0.00 -0.00 0.00 0.00 57.85 56.76 1rml n ARG 133 Cb 0.55 -2.12 -0.09 0.00 0.00 0.00 0.00 32.46 30.79 1rml n ARG 133 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.63 178.41 1rml h GLY 134 N -2.82 -1.08 -4.51 5.14 0.00 -1.40 -1.02 103.07 97.39 1rml h GLY 134 Ca -0.63 0.76 -0.24 0.00 0.00 0.00 0.00 47.33 47.22 1rml h GLY 134 CO 0.48 -0.14 0.70 -1.55 0.00 0.00 0.00 176.54 176.03 1rml n PRO 135 N -5.11 1.83 -0.80 4.80 -0.04 -1.26 -2.78 135.00 131.64 1rml n PRO 135 Ca -0.02 -1.02 -0.04 0.00 -0.04 0.00 0.00 63.50 62.38 1rml n PRO 135 Cb 0.29 -2.06 -0.04 0.00 -0.04 0.00 0.00 33.50 31.64 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 2.97 0.00 -3.49 0.54 3.00 -0.38 -5.07 116.66 114.22 1rml n ARG 136 Ca 0.39 -0.63 -0.26 0.00 -0.01 0.00 0.00 57.85 57.34 1rml n ARG 136 Cb 0.55 0.42 -0.13 0.00 0.00 0.00 0.00 32.46 33.31 1rml n ARG 136 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.63 178.58 1rml s THR 137 N 0.00 -0.14 0.28 0.55 -4.23 -1.12 -4.68 115.64 106.31 1rml s THR 137 Ca 0.00 -0.83 0.02 0.00 -1.18 0.00 0.00 61.69 59.69 1rml s THR 137 Cb 0.00 -0.98 -0.03 0.00 1.34 0.00 0.00 72.50 72.83 1rml s THR 137 CO 0.00 -0.69 0.27 -1.00 -0.54 0.00 0.00 174.62 172.65 1rml s HIS 138 N 1.99 1.35 0.00 3.99 3.76 -1.26 -2.46 115.29 122.66 1rml s HIS 138 Ca 0.11 -1.45 0.00 0.00 -0.15 0.00 0.00 55.06 53.57 1rml s HIS 138 Cb -0.16 -0.51 0.00 0.00 1.11 0.00 0.00 32.58 33.02 1rml s HIS 138 CO -0.29 -0.84 0.00 0.98 -0.85 0.00 0.00 174.74 173.74 1rml n TYR 139 N -0.47 -1.05 -0.78 1.40 9.36 -1.26 -3.85 117.16 120.52 1rml n TYR 139 Ca 0.04 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.26 1rml n TYR 139 Cb 0.63 0.00 0.00 0.00 -0.63 0.00 0.00 39.34 39.34 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 0.16 2.79 2.98 0.00 -1.26 -4.90 105.19 104.96 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 -1.13 0.90 0.16 1.61 1.11 -1.25 -4.96 119.66 116.11 1rml s GLN 141 Ca 0.00 -0.89 0.07 0.00 0.01 0.00 0.00 55.36 54.55 1rml s GLN 141 Cb 0.00 -2.19 0.39 0.00 -1.01 0.00 0.00 33.01 30.20 1rml s GLN 141 CO 0.00 -0.80 1.09 1.63 0.01 0.00 0.00 175.29 177.22 1rml n LYS 142 N 4.85 0.05 -0.29 2.91 4.76 -1.26 -0.95 118.16 128.23 1rml n LYS 142 Ca -0.06 0.45 0.20 0.00 -2.87 0.00 0.00 58.31 56.04 1rml n LYS 142 Cb 0.44 -1.88 0.49 0.00 -1.84 0.00 0.00 35.03 32.24 1rml n LYS 142 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1rml h ALA 143 N 1.31 2.16 -0.02 7.82 0.00 -1.87 1.15 119.26 129.81 1rml h ALA 143 Ca 0.00 0.04 -0.14 0.00 0.00 0.00 0.00 54.91 54.82 1rml h ALA 143 Cb 0.43 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.19 1rml h ALA 143 CO 0.00 -0.51 -0.62 -0.84 0.00 0.00 0.00 179.25 177.28 1rml h ILE 144 N 0.45 1.43 -2.65 0.00 3.07 -1.26 -3.33 117.51 115.21 1rml h ILE 144 Ca 0.54 -2.10 -0.57 0.00 1.55 0.00 0.00 64.86 64.28 1rml h ILE 144 Cb 1.29 2.11 -0.02 0.00 -0.27 0.00 0.00 36.82 39.93 1rml h ILE 144 CO -0.25 0.61 1.21 -0.76 -1.05 0.00 0.00 178.15 177.90 1rml s LEU 145 N -7.70 3.78 -0.22 0.16 1.43 0.40 -3.99 118.68 112.53 1rml s LEU 145 Ca -0.02 1.61 0.00 0.00 -1.03 0.00 0.00 54.13 54.69 1rml s LEU 145 Cb 0.12 -3.53 0.03 0.00 0.03 0.00 0.00 46.19 42.84 1rml s LEU 145 CO 0.78 -1.43 -0.13 -0.36 0.23 0.00 0.00 176.35 175.43 1rml s PHE 146 N 5.90 2.96 -0.43 0.29 0.08 -1.26 -0.05 117.98 125.48 1rml s PHE 146 Ca 0.77 -1.66 -0.10 0.00 0.12 0.00 0.00 56.93 56.06 1rml s PHE 146 Cb -0.26 -1.98 0.08 0.00 -0.57 0.00 0.00 43.02 40.29 1rml s PHE 146 CO 0.32 -0.77 0.28 -1.17 -0.10 0.00 0.00 175.22 173.78 1rml s LEU 147 N 1.29 5.26 0.36 -0.37 1.98 0.23 -2.90 118.68 124.53 1rml s LEU 147 Ca 0.01 -1.54 -0.26 0.00 -2.89 0.00 0.00 54.13 49.46 1rml s LEU 147 Cb -0.15 -2.01 -0.09 0.00 0.66 0.00 0.00 46.19 44.60 1rml s LEU 147 CO -0.08 -0.57 1.06 -2.16 -1.89 0.00 0.00 176.35 172.71 1rml s PRO 148 N 1.44 4.31 -0.43 0.98 0.04 -1.26 -3.23 135.00 136.85 1rml s PRO 148 Ca 0.03 1.60 0.10 0.00 0.04 0.00 0.00 61.00 62.77 1rml s PRO 148 Cb -0.23 -2.75 0.32 0.00 0.04 0.00 0.00 34.50 31.88 1rml s PRO 148 CO 0.02 -0.03 0.73 1.47 0.04 0.00 0.00 177.00 179.24 1rml n LEU 149 N 0.33 1.56 -4.77 -3.56 -0.00 -1.23 -5.01 117.00 104.32 1rml n LEU 149 Ca 0.03 -5.10 -0.30 0.00 -0.00 0.00 0.00 56.01 50.64 1rml n LEU 149 Cb 0.48 0.39 0.20 0.00 -0.00 0.00 0.00 43.42 44.49 1rml n LEU 149 CO 0.48 2.25 0.75 -2.16 -0.00 0.00 0.00 177.39 178.70 1rml s PRO 150 N -2.39 -0.14 -0.16 1.47 0.04 -1.26 -4.21 135.00 128.34 1rml s PRO 150 Ca 0.41 -0.19 0.01 0.00 0.04 0.00 0.00 61.00 61.27 1rml s PRO 150 Cb 0.29 -1.73 0.05 0.00 0.04 0.00 0.00 34.50 33.15 1rml s PRO 150 CO -0.09 -2.97 0.81 1.33 0.04 0.00 0.00 177.00 176.12 1rml n VAL 151 N -4.21 0.00 -1.40 -0.36 0.24 -1.11 -4.92 118.33 106.57 1rml n VAL 151 Ca 0.13 -0.34 -0.49 0.00 -2.04 0.00 0.00 64.34 61.60 1rml n VAL 151 Cb 0.59 0.56 -0.12 0.00 -1.47 0.00 0.00 33.84 33.40 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 -0.33 0.77 -2.68 -1.34 2.88 -1.22 -4.71 113.62 106.98 1rml n SER 152 Ca -0.14 0.35 -0.05 0.00 -1.33 0.00 0.00 58.87 57.71 1rml n SER 152 Cb 0.59 -0.99 0.06 0.00 -0.75 0.00 0.00 64.21 63.13 1rml n SER 152 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 1rml n SER 153 N 9.60 -1.67 0.00 -3.46 2.88 -1.26 -5.04 113.62 114.67 1rml n SER 153 Ca 0.58 -2.02 0.00 0.00 -1.33 0.00 0.00 58.87 56.10 1rml n SER 153 Cb 0.05 0.95 0.00 0.00 -0.75 0.00 0.00 64.21 64.47 1rml n SER 153 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14