#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rao s VAL 2 N 0.00 5.00 -0.08 12.58 1.01 -1.26 -0.24 120.40 137.40 1rao s VAL 2 Ca 0.00 0.59 -0.04 0.00 0.00 0.00 0.00 61.98 62.54 1rao s VAL 2 Cb 0.00 -3.95 -0.04 0.00 0.00 0.00 0.00 36.38 32.39 1rao s VAL 2 CO 0.00 -0.14 0.07 0.00 0.00 0.00 0.00 175.10 175.03 1rao s ALA 3 N 2.46 3.59 -0.17 5.51 0.00 0.49 -0.68 121.76 132.95 1rao s ALA 3 Ca 0.21 -0.75 -0.04 0.00 0.00 0.00 0.00 51.96 51.38 1rao s ALA 3 Cb -0.15 -1.70 -0.02 0.00 0.00 0.00 0.00 23.12 21.24 1rao s ALA 3 CO 0.12 0.62 -0.03 0.71 0.00 0.00 0.00 175.76 177.18 1rao s TYR 4 N -1.00 3.01 -0.11 0.00 2.02 -0.25 -0.44 117.35 120.57 1rao s TYR 4 Ca 0.16 -0.43 0.02 0.00 -0.37 0.00 0.00 57.07 56.45 1rao s TYR 4 Cb -0.12 -2.00 -0.01 0.00 -0.40 0.00 0.00 41.96 39.44 1rao s TYR 4 CO 0.05 -0.15 -0.18 0.42 -1.57 0.00 0.00 175.55 174.12 1rao s ILE 5 N 0.64 2.59 -0.03 2.71 1.01 0.38 -0.05 121.20 128.45 1rao s ILE 5 Ca -0.02 -0.83 -0.16 0.00 0.00 0.00 0.00 60.65 59.64 1rao s ILE 5 Cb -0.14 -2.04 -0.05 0.00 0.01 0.00 0.00 42.46 40.23 1rao s ILE 5 CO 0.02 0.54 0.43 0.00 0.00 0.00 0.00 174.94 175.94 1rao s ALA 6 N 0.32 3.63 -0.13 9.38 0.00 0.15 -0.37 121.76 134.75 1rao s ALA 6 Ca -0.14 -0.20 -0.00 0.00 0.00 0.00 0.00 51.96 51.61 1rao s ALA 6 Cb -0.17 -2.46 -0.02 0.00 0.00 0.00 0.00 23.12 20.47 1rao s ALA 6 CO 0.07 0.35 -0.12 0.42 0.00 0.00 0.00 175.76 176.48 1rao s ILE 7 N -0.63 3.15 0.01 0.00 1.01 0.13 -1.08 121.20 123.78 1rao s ILE 7 Ca 0.24 -0.63 0.02 0.00 0.00 0.00 0.00 60.65 60.28 1rao s ILE 7 Cb -0.16 -2.32 -0.01 0.00 0.01 0.00 0.00 42.46 39.97 1rao s ILE 7 CO 0.13 0.53 -0.06 -0.83 0.00 0.00 0.00 174.94 174.70 1rao s GLY 8 N 0.28 0.34 -0.05 6.18 0.00 -0.31 -1.48 107.32 112.27 1rao s GLY 8 Ca -0.09 -0.39 -0.02 0.00 0.00 0.00 0.00 44.72 44.22 1rao s GLY 8 CO 0.05 -0.37 0.10 -0.45 0.00 0.00 0.00 173.10 172.43 1rao s SER 9 N -0.54 -0.05 -0.20 1.64 0.15 -0.61 0.07 113.70 114.15 1rao s SER 9 Ca -0.01 0.21 0.13 0.00 0.70 0.00 0.00 55.95 56.98 1rao s SER 9 Cb -0.04 0.10 0.42 0.00 -1.71 0.00 0.00 66.02 64.78 1rao s SER 9 CO -0.00 -0.14 1.28 -0.46 1.20 0.00 0.00 173.24 175.12 1rao n ASN 10 N 4.14 2.29 -4.61 5.45 6.94 -0.95 -0.58 115.26 127.93 1rao n ASN 10 Ca -0.26 -3.56 -0.38 0.00 -0.02 0.00 0.00 54.58 50.36 1rao n ASN 10 Cb 0.52 -0.53 0.05 0.00 -2.36 0.00 0.00 39.78 37.45 1rao n ASN 10 CO 0.00 0.00 0.00 -0.11 -1.03 0.00 0.00 177.26 176.12 1rao n LEU 11 N -1.15 3.39 -0.26 -4.53 7.94 -1.26 -4.73 117.00 116.41 1rao n LEU 11 Ca 0.22 0.83 -0.01 0.00 -1.11 0.00 0.00 56.01 55.93 1rao n LEU 11 Cb 0.77 -1.37 0.18 0.00 0.53 0.00 0.00 43.42 43.53 1rao n LEU 11 CO 0.05 -1.87 1.20 0.00 -1.11 0.00 0.00 177.39 175.65 1rao h ALA 12 N 0.61 1.33 -2.84 1.96 0.00 -1.95 -3.29 119.26 115.09 1rao h ALA 12 Ca -0.48 -0.09 -0.61 0.00 0.00 0.00 0.00 54.91 53.73 1rao h ALA 12 Cb 1.36 -0.32 -0.41 0.00 0.00 0.00 0.00 17.79 18.42 1rao h ALA 12 CO 0.51 0.57 -0.69 0.43 0.00 0.00 0.00 179.25 180.07 1rao n SER 13 N -4.37 2.01 -0.20 0.00 7.64 -1.26 -5.00 113.62 112.43 1rao n SER 13 Ca 0.08 -2.97 0.15 0.00 1.01 0.00 0.00 58.87 57.14 1rao n SER 13 Cb 0.07 -0.70 0.66 0.00 -1.01 0.00 0.00 64.21 63.24 1rao n SER 13 CO 0.00 0.00 0.00 -0.81 -3.01 0.00 0.00 175.04 171.22 1rao n PRO 14 N 2.17 1.06 -0.31 1.43 -0.04 -1.24 -4.42 135.00 133.65 1rao n PRO 14 Ca 0.23 -0.40 -0.03 0.00 -0.04 0.00 0.00 63.50 63.27 1rao n PRO 14 Cb 0.39 -1.49 0.09 0.00 -0.04 0.00 0.00 33.50 32.45 1rao n PRO 14 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 1rao h LEU 15 N 0.97 0.92 -0.42 1.53 3.38 -1.94 0.12 115.31 119.86 1rao h LEU 15 Ca 0.00 -0.01 -0.18 0.00 0.09 0.00 0.00 57.88 57.78 1rao h LEU 15 Cb 0.31 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 40.84 1rao h LEU 15 CO 0.00 0.64 -0.67 -0.33 0.09 0.00 0.00 178.44 178.18 1rao h GLU 16 N 1.08 0.50 -0.64 1.13 5.08 -2.00 -0.46 114.58 119.26 1rao h GLU 16 Ca 0.32 -0.37 -0.02 0.00 -1.00 0.00 0.00 59.36 58.30 1rao h GLU 16 Cb -0.05 0.07 -0.03 0.00 0.50 0.00 0.00 28.75 29.24 1rao h GLU 16 CO -0.10 0.99 0.34 0.37 -1.00 0.00 0.00 179.01 179.62 1rao h GLN 17 N 0.36 0.91 -0.42 2.33 4.15 -1.73 0.80 115.11 121.50 1rao h GLN 17 Ca -0.02 -0.11 -0.09 0.00 0.77 0.00 0.00 58.65 59.19 1rao h GLN 17 Cb 1.24 -0.17 -0.01 0.00 0.21 0.00 0.00 27.48 28.74 1rao h GLN 17 CO 0.12 0.70 -0.11 0.28 -1.93 0.00 0.00 178.83 177.89 1rao h VAL 18 N 0.88 1.27 -0.34 2.39 2.07 -0.65 0.03 116.25 121.90 1rao h VAL 18 Ca 0.23 -1.21 -0.05 0.00 0.82 0.00 0.00 66.70 66.48 1rao h VAL 18 Cb 0.06 1.19 -0.02 0.00 -1.52 0.00 0.00 31.29 31.00 1rao h VAL 18 CO -0.03 0.41 -0.00 0.78 0.02 0.00 0.00 177.57 178.74 1rao h ASN 19 N 0.64 0.49 -0.25 0.57 2.35 -0.82 -0.66 115.58 117.90 1rao h ASN 19 Ca 0.11 -0.09 -0.12 0.00 -0.55 0.00 0.00 56.30 55.65 1rao h ASN 19 Cb 0.64 -0.13 -0.01 0.00 0.05 0.00 0.00 38.32 38.87 1rao h ASN 19 CO 0.04 0.56 -0.25 0.00 -1.65 0.00 0.00 177.43 176.14 1rao h ALA 20 N 1.50 0.88 -0.32 -0.83 0.00 -0.50 -0.82 119.26 119.17 1rao h ALA 20 Ca 0.11 -0.38 0.00 0.00 0.00 0.00 0.00 54.91 54.64 1rao h ALA 20 Cb 0.33 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.96 1rao h ALA 20 CO 0.01 0.63 0.20 0.00 0.00 0.00 0.00 179.25 180.09 1rao h ALA 21 N 1.08 0.40 -0.65 0.00 0.00 -0.29 -0.95 119.26 118.86 1rao h ALA 21 Ca 0.08 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.95 1rao h ALA 21 Cb 0.75 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.39 1rao h ALA 21 CO 0.06 -0.12 0.39 -0.07 0.00 0.00 0.00 179.25 179.51 1rao h LEU 22 N 0.42 0.78 -0.82 0.00 3.38 -0.80 0.11 115.31 118.37 1rao h LEU 22 Ca 0.11 -0.06 -0.03 0.00 0.09 0.00 0.00 57.88 57.99 1rao h LEU 22 Cb -0.02 -0.20 -0.04 0.00 0.09 0.00 0.00 40.66 40.50 1rao h LEU 22 CO -0.02 0.61 0.38 0.50 0.09 0.00 0.00 178.44 180.00 1rao h LYS 23 N 0.88 1.19 -0.55 1.13 3.64 -1.01 -0.67 116.57 121.18 1rao h LYS 23 Ca 0.23 -0.19 -0.00 0.00 -1.27 0.00 0.00 60.65 59.42 1rao h LYS 23 Cb -0.02 -0.21 -0.03 0.00 -0.41 0.00 0.00 32.23 31.56 1rao h LYS 23 CO -0.04 0.93 0.34 0.00 -2.27 0.00 0.00 179.45 178.41 1rao h ALA 24 N 1.20 0.70 -0.55 5.00 0.00 -0.52 -1.17 119.26 123.92 1rao h ALA 24 Ca 0.28 -0.06 0.01 0.00 0.00 0.00 0.00 54.91 55.14 1rao h ALA 24 Cb 0.14 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.69 1rao h ALA 24 CO -0.03 0.17 0.36 -0.07 0.00 0.00 0.00 179.25 179.68 1rao h LEU 25 N 0.74 0.63 -0.68 0.00 3.38 -0.35 -1.38 115.31 117.65 1rao h LEU 25 Ca 0.20 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.15 1rao h LEU 25 Cb -0.04 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 40.56 1rao h LEU 25 CO -0.04 0.45 0.00 1.23 0.09 0.00 0.00 178.44 180.18 1rao h GLY 26 N 0.74 0.00 -1.75 0.83 0.00 0.09 -2.76 103.07 100.21 1rao h GLY 26 Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.53 1rao h GLY 26 CO -0.04 0.00 -0.08 1.22 0.00 0.00 0.00 176.54 177.64 1rao n ASP 27 N -2.36 2.82 -4.76 0.19 8.00 -0.53 -4.78 116.55 115.13 1rao n ASP 27 Ca 0.02 -1.91 -0.41 0.00 0.71 0.00 0.00 54.79 53.20 1rao n ASP 27 Cb 0.27 0.08 -0.02 0.00 -0.02 0.00 0.00 41.12 41.44 1rao n ASP 27 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1rao s ILE 28 N -2.08 2.41 0.66 0.53 1.01 -1.04 -4.93 121.20 117.75 1rao s ILE 28 Ca 0.26 0.37 -0.16 0.00 0.00 0.00 0.00 60.65 61.13 1rao s ILE 28 Cb 0.20 -3.24 0.00 0.00 0.01 0.00 0.00 42.46 39.43 1rao s ILE 28 CO 0.35 0.07 1.14 -2.16 0.00 0.00 0.00 174.94 174.34 1rao s PRO 29 N -0.99 2.70 -1.52 2.79 0.04 -1.26 -3.46 135.00 133.29 1rao s PRO 29 Ca 0.57 1.53 -0.04 0.00 0.04 0.00 0.00 61.00 63.10 1rao s PRO 29 Cb -0.44 -1.93 0.01 0.00 0.04 0.00 0.00 34.50 32.19 1rao s PRO 29 CO 0.50 -1.35 0.40 0.39 0.04 0.00 0.00 177.00 176.97 1rao n GLU 30 N -2.34 -3.71 -3.65 4.56 1.02 -1.26 -4.82 120.64 110.44 1rao n GLU 30 Ca 0.11 0.84 -0.14 0.00 -0.02 0.00 0.00 57.16 57.95 1rao n GLU 30 Cb 0.51 -5.61 -0.07 0.00 -0.02 0.00 0.00 31.44 26.25 1rao n GLU 30 CO 0.00 0.00 0.00 -1.12 1.18 0.00 0.00 177.13 177.19 1rao s SER 31 N -2.49 -0.36 -0.00 1.62 0.01 -1.22 -1.35 113.70 109.90 1rao s SER 31 Ca 0.22 0.20 -0.11 0.00 1.31 0.00 0.00 55.95 57.57 1rao s SER 31 Cb -0.10 0.42 0.01 0.00 0.21 0.00 0.00 66.02 66.56 1rao s SER 31 CO 0.27 -0.59 0.23 -1.38 0.41 0.00 0.00 173.24 172.18 1rao s HIS 32 N -1.84 -0.07 0.12 2.43 -3.43 0.12 -4.78 115.29 107.83 1rao s HIS 32 Ca -0.09 0.06 -0.31 0.00 -0.80 0.00 0.00 55.06 53.92 1rao s HIS 32 Cb -0.02 0.03 -0.08 0.00 -1.43 0.00 0.00 32.58 31.08 1rao s HIS 32 CO 0.02 -0.34 1.34 0.42 -2.00 0.00 0.00 174.74 174.18 1rao s ILE 33 N -1.40 3.43 -0.21 -5.38 1.01 -1.26 -0.01 121.20 117.39 1rao s ILE 33 Ca -0.14 1.05 -0.17 0.00 0.00 0.00 0.00 60.65 61.39 1rao s ILE 33 Cb -0.06 -3.67 -0.19 0.00 0.01 0.00 0.00 42.46 38.55 1rao s ILE 33 CO 0.03 0.09 0.13 0.18 0.00 0.00 0.00 174.94 175.37 1rao n LEU 34 N 3.77 2.04 -3.64 2.97 4.77 0.61 -4.88 117.00 122.64 1rao n LEU 34 Ca 0.10 0.35 -0.14 0.00 -0.03 0.00 0.00 56.01 56.30 1rao n LEU 34 Cb 0.43 -0.97 -0.07 0.00 -2.33 0.00 0.00 43.42 40.49 1rao n LEU 34 CO 0.58 0.44 0.21 0.28 -1.33 0.00 0.00 177.39 177.57 1rao s THR 35 N -2.42 0.04 -0.04 -5.08 -1.32 -1.18 -5.01 115.64 100.62 1rao s THR 35 Ca -0.30 -0.32 0.03 0.00 -1.21 0.00 0.00 61.69 59.90 1rao s THR 35 Cb 0.08 -0.89 0.00 0.00 -1.51 0.00 0.00 72.50 70.18 1rao s THR 35 CO 0.60 -0.18 -0.13 -0.69 -2.21 0.00 0.00 174.62 172.02 1rao s VAL 36 N -1.95 1.15 1.03 5.08 1.01 -1.26 -1.40 120.40 124.05 1rao s VAL 36 Ca -0.08 -0.54 -0.14 0.00 0.00 0.00 0.00 61.98 61.21 1rao s VAL 36 Cb -0.02 -1.01 0.20 0.00 0.00 0.00 0.00 36.38 35.56 1rao s VAL 36 CO 0.02 0.34 1.12 -0.94 0.00 0.00 0.00 175.10 175.64 1rao s SER 37 N 0.23 2.42 1.09 3.32 1.04 -0.03 -5.01 113.70 116.76 1rao s SER 37 Ca -0.06 0.94 -0.12 0.00 0.48 0.00 0.00 55.95 57.18 1rao s SER 37 Cb -0.11 -1.45 0.24 0.00 0.10 0.00 0.00 66.02 64.80 1rao s SER 37 CO 0.02 -3.23 1.06 -0.44 0.98 0.00 0.00 173.24 171.63 1rao s SER 38 N -3.78 1.65 -0.17 7.02 0.01 -1.26 -4.77 113.70 112.41 1rao s SER 38 Ca 0.67 1.52 -0.17 0.00 1.31 0.00 0.00 55.95 59.27 1rao s SER 38 Cb -0.15 -2.24 -0.04 0.00 0.21 0.00 0.00 66.02 63.81 1rao s SER 38 CO 0.56 -3.78 0.46 -0.36 0.41 0.00 0.00 173.24 170.53 1rao s PHE 39 N -2.61 3.43 0.13 2.43 0.08 -1.26 -4.59 117.98 115.59 1rao s PHE 39 Ca 0.67 0.77 0.06 0.00 0.12 0.00 0.00 56.93 58.56 1rao s PHE 39 Cb -0.23 -2.57 -0.04 0.00 -0.57 0.00 0.00 43.02 39.61 1rao s PHE 39 CO 0.62 0.04 -0.02 0.71 -0.10 0.00 0.00 175.22 176.47 1rao s TYR 40 N 1.10 2.87 -0.23 0.36 2.02 -0.10 0.03 117.35 123.40 1rao s TYR 40 Ca 0.23 -0.10 -0.06 0.00 -0.37 0.00 0.00 57.07 56.77 1rao s TYR 40 Cb -0.15 -1.45 -0.02 0.00 -0.40 0.00 0.00 41.96 39.94 1rao s TYR 40 CO 0.09 0.48 0.02 0.50 -1.57 0.00 0.00 175.55 175.08 1rao s ARG 41 N -2.57 3.57 0.03 -0.62 3.52 0.53 -0.84 118.95 122.56 1rao s ARG 41 Ca 0.26 -0.53 0.03 0.00 -0.13 0.00 0.00 55.73 55.36 1rao s ARG 41 Cb -0.10 -3.18 -0.02 0.00 -1.56 0.00 0.00 34.95 30.09 1rao s ARG 41 CO 0.17 -0.14 -0.10 0.95 -0.81 0.00 0.00 175.30 175.37 1rao s THR 42 N 1.43 0.76 0.48 4.11 -4.23 0.76 -4.22 115.64 114.73 1rao s THR 42 Ca 0.05 -0.84 -0.22 0.00 -1.18 0.00 0.00 61.69 59.50 1rao s THR 42 Cb -0.15 -0.72 -0.07 0.00 1.34 0.00 0.00 72.50 72.91 1rao s THR 42 CO 0.01 -0.10 1.16 -2.16 -0.54 0.00 0.00 174.62 173.00 1rao s PRO 43 N -1.05 3.63 0.77 3.99 0.04 -1.26 -0.47 135.00 140.65 1rao s PRO 43 Ca -0.02 1.75 -0.11 0.00 0.04 0.00 0.00 61.00 62.66 1rao s PRO 43 Cb -0.07 -2.30 0.05 0.00 0.04 0.00 0.00 34.50 32.22 1rao s PRO 43 CO 0.01 -0.66 1.09 -1.25 0.04 0.00 0.00 177.00 176.23 1rao s PRO 44 N -2.85 2.32 0.56 0.56 0.04 -1.26 -4.77 135.00 129.59 1rao s PRO 44 Ca 0.66 0.70 -0.08 0.00 0.04 0.00 0.00 61.00 62.32 1rao s PRO 44 Cb -0.28 -1.94 -0.03 0.00 0.04 0.00 0.00 34.50 32.29 1rao s PRO 44 CO 0.33 -1.47 0.91 -0.51 0.04 0.00 0.00 177.00 176.30 1rao s LEU 45 N -5.70 3.37 0.00 -3.56 1.43 -1.26 -4.84 118.68 108.13 1rao s LEU 45 Ca 0.60 1.08 0.00 0.00 -1.03 0.00 0.00 54.13 54.78 1rao s LEU 45 Cb -0.14 -4.03 0.00 0.00 0.03 0.00 0.00 46.19 42.05 1rao s LEU 45 CO 0.54 -0.81 0.00 0.61 0.23 0.00 0.00 176.35 176.92 1rao n GLY 46 N -2.54 -0.30 3.72 -3.19 0.00 -1.26 -4.88 105.19 96.74 1rao n GLY 46 Ca 0.03 -1.05 -0.34 0.00 0.00 0.00 0.00 46.02 44.67 1rao n GLY 46 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1rao s PRO 47 N 0.00 2.02 -0.29 1.61 0.04 -1.26 -4.93 135.00 132.18 1rao s PRO 47 Ca 0.00 1.75 0.11 0.00 0.04 0.00 0.00 61.00 62.91 1rao s PRO 47 Cb 0.00 -1.82 0.76 0.00 0.04 0.00 0.00 34.50 33.48 1rao s PRO 47 CO 0.00 -1.93 1.78 1.04 0.04 0.00 0.00 177.00 177.93 1rao n GLN 48 N -2.87 4.03 -0.96 4.56 1.13 -1.26 -4.07 117.38 117.95 1rao n GLN 48 Ca 0.13 -3.11 -0.02 0.00 -1.94 0.00 0.00 57.00 52.06 1rao n GLN 48 Cb 0.50 -2.22 0.33 0.00 0.11 0.00 0.00 30.24 28.97 1rao n GLN 48 CO 0.00 0.00 0.00 -3.47 -1.44 0.00 0.00 177.06 172.15 1rao n ASP 49 N 0.04 5.07 -4.50 1.08 -0.08 -1.26 -4.92 116.55 111.99 1rao n ASP 49 Ca 0.36 -3.08 -0.24 0.00 -1.51 0.00 0.00 54.79 50.32 1rao n ASP 49 Cb 1.31 -0.72 -0.10 0.00 2.34 0.00 0.00 41.12 43.96 1rao n ASP 49 CO 0.00 0.00 0.00 -1.10 0.12 0.00 0.00 177.20 176.22 1rao s GLN 50 N -2.83 1.79 0.45 -0.67 -1.52 -1.26 -5.10 119.66 110.51 1rao s GLN 50 Ca 0.53 -1.71 -0.24 0.00 -1.95 0.00 0.00 55.36 51.99 1rao s GLN 50 Cb 0.42 -1.84 -0.08 0.00 -0.22 0.00 0.00 33.01 31.29 1rao s GLN 50 CO 0.14 0.34 1.30 -2.14 -0.25 0.00 0.00 175.29 174.67 1rao s PRO 51 N -3.53 3.73 0.89 2.91 0.02 -1.26 -4.82 135.00 132.94 1rao s PRO 51 Ca 0.30 2.12 -0.10 0.00 0.02 0.00 0.00 61.00 63.34 1rao s PRO 51 Cb -0.05 -2.57 0.13 0.00 0.02 0.00 0.00 34.50 32.02 1rao s PRO 51 CO 0.16 -0.68 1.14 -0.51 -0.33 0.00 0.00 177.00 176.78 1rao s ASP 52 N -0.89 3.19 -0.01 2.53 1.01 -1.26 -4.40 116.67 116.84 1rao s ASP 52 Ca 0.62 2.12 -0.02 0.00 0.71 0.00 0.00 52.55 55.97 1rao s ASP 52 Cb -0.37 -2.56 -0.04 0.00 1.01 0.00 0.00 42.92 40.96 1rao s ASP 52 CO 0.46 -2.92 0.14 -0.31 0.21 0.00 0.00 175.17 172.76 1rao s TYR 53 N -2.70 3.46 -0.18 4.23 1.51 0.38 -4.40 117.35 119.65 1rao s TYR 53 Ca 0.66 0.31 -0.15 0.00 -1.01 0.00 0.00 57.07 56.88 1rao s TYR 53 Cb -0.22 -1.80 -0.04 0.00 -0.11 0.00 0.00 41.96 39.79 1rao s TYR 53 CO 0.58 0.62 0.34 -1.17 -1.11 0.00 0.00 175.55 174.80 1rao s LEU 54 N -1.82 4.20 0.08 -1.29 0.20 0.25 -0.17 118.68 120.12 1rao s LEU 54 Ca 0.25 0.50 0.06 0.00 0.69 0.00 0.00 54.13 55.64 1rao s LEU 54 Cb -0.12 -2.43 -0.03 0.00 -0.43 0.00 0.00 46.19 43.17 1rao s LEU 54 CO 0.16 0.02 -0.17 0.20 -0.29 0.00 0.00 176.35 176.27 1rao s ASN 55 N 0.76 2.04 0.15 3.68 0.01 -0.02 -1.58 114.94 119.97 1rao s ASN 55 Ca 0.17 -0.62 -0.18 0.00 -0.71 0.00 0.00 52.86 51.53 1rao s ASN 55 Cb -0.14 -0.10 0.04 0.00 0.41 0.00 0.00 41.25 41.47 1rao s ASN 55 CO 0.06 -0.00 0.48 0.00 -1.51 0.00 0.00 177.10 176.12 1rao s ALA 56 N -1.16 -1.07 0.06 0.60 0.00 -0.55 -0.92 121.76 118.71 1rao s ALA 56 Ca 0.02 0.01 0.08 0.00 0.00 0.00 0.00 51.96 52.07 1rao s ALA 56 Cb -0.10 0.78 -0.03 0.00 0.00 0.00 0.00 23.12 23.77 1rao s ALA 56 CO 0.03 -0.72 -0.19 0.00 0.00 0.00 0.00 175.76 174.88 1rao s ALA 57 N -3.81 2.57 -0.05 0.00 0.00 -1.26 0.18 121.76 119.38 1rao s ALA 57 Ca 0.04 -1.24 0.02 0.00 0.00 0.00 0.00 51.96 50.79 1rao s ALA 57 Cb 0.00 -0.69 0.01 0.00 0.00 0.00 0.00 23.12 22.45 1rao s ALA 57 CO -0.10 0.57 -0.10 0.08 0.00 0.00 0.00 175.76 176.21 1rao s VAL 58 N -0.96 0.97 -0.24 0.00 1.01 0.50 -0.85 120.40 120.84 1rao s VAL 58 Ca 0.15 -0.40 -0.17 0.00 0.00 0.00 0.00 61.98 61.56 1rao s VAL 58 Cb -0.10 -0.90 -0.03 0.00 0.00 0.00 0.00 36.38 35.35 1rao s VAL 58 CO 0.06 0.31 0.46 0.00 0.00 0.00 0.00 175.10 175.93 1rao s ALA 59 N 0.63 3.57 -0.14 5.51 0.00 -0.50 -0.47 121.76 130.35 1rao s ALA 59 Ca -0.12 -0.58 0.02 0.00 0.00 0.00 0.00 51.96 51.28 1rao s ALA 59 Cb -0.14 -2.78 0.01 0.00 0.00 0.00 0.00 23.12 20.21 1rao s ALA 59 CO 0.03 -0.56 -0.21 -1.17 0.00 0.00 0.00 175.76 173.84 1rao s LEU 60 N 1.89 2.07 0.02 0.00 2.96 0.42 -0.28 118.68 125.76 1rao s LEU 60 Ca 0.20 -0.59 -0.25 0.00 -0.22 0.00 0.00 54.13 53.27 1rao s LEU 60 Cb -0.15 -1.41 -0.05 0.00 0.50 0.00 0.00 46.19 45.07 1rao s LEU 60 CO 0.09 0.06 0.78 -0.70 -1.32 0.00 0.00 176.35 175.26 1rao s GLU 61 N 0.90 4.50 -0.08 1.98 2.56 0.99 -0.38 118.70 129.17 1rao s GLU 61 Ca -0.05 1.08 -0.22 0.00 0.00 0.00 0.00 54.97 55.78 1rao s GLU 61 Cb -0.15 -3.39 0.05 0.00 2.00 0.00 0.00 34.13 32.64 1rao s GLU 61 CO -0.03 0.22 0.50 -0.08 -0.56 0.00 0.00 175.26 175.31 1rao s THR 62 N 0.18 0.02 -1.18 -1.70 -1.32 0.66 0.12 115.64 112.42 1rao s THR 62 Ca 0.40 -0.17 0.13 0.00 -1.21 0.00 0.00 61.69 60.83 1rao s THR 62 Cb -0.20 -0.79 0.33 0.00 -1.51 0.00 0.00 72.50 70.33 1rao s THR 62 CO 0.23 -0.09 1.25 -1.54 -2.21 0.00 0.00 174.62 172.25 1rao n SER 63 N 1.57 2.96 -4.78 8.08 3.41 -0.46 -0.39 113.62 124.02 1rao n SER 63 Ca -0.18 -1.94 -0.32 0.00 -0.26 0.00 0.00 58.87 56.17 1rao n SER 63 Cb 0.56 -0.24 0.05 0.00 -0.26 0.00 0.00 64.21 64.33 1rao n SER 63 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1rao s LEU 64 N -1.01 3.31 0.57 1.04 1.43 -1.26 -5.03 118.68 117.73 1rao s LEU 64 Ca 0.26 1.90 -0.18 0.00 -1.03 0.00 0.00 54.13 55.08 1rao s LEU 64 Cb 0.14 -4.54 -0.04 0.00 0.03 0.00 0.00 46.19 41.78 1rao s LEU 64 CO 0.18 -1.62 1.13 0.00 0.23 0.00 0.00 176.35 176.27 1rao s ALA 65 N -2.53 2.63 0.21 4.21 0.00 -1.26 -4.84 121.76 120.18 1rao s ALA 65 Ca 0.64 0.77 -0.11 0.00 0.00 0.00 0.00 51.96 53.26 1rao s ALA 65 Cb -0.19 -3.35 0.29 0.00 0.00 0.00 0.00 23.12 19.87 1rao s ALA 65 CO 0.45 -0.91 1.66 -1.35 0.00 0.00 0.00 175.76 175.60 1rao h PRO 66 N 0.90 0.09 0.00 0.00 0.11 -1.99 0.95 132.00 132.06 1rao h PRO 66 Ca -0.49 -0.01 -0.07 0.00 0.11 0.00 0.00 66.00 65.54 1rao h PRO 66 Cb 1.26 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 32.34 1rao h PRO 66 CO 0.56 0.06 -0.34 0.93 -0.21 0.00 0.00 178.00 179.00 1rao h GLU 67 N 0.09 0.00 -0.38 1.05 5.08 -1.98 0.24 114.58 118.69 1rao h GLU 67 Ca 0.32 0.00 -0.09 0.00 -1.00 0.00 0.00 59.36 58.59 1rao h GLU 67 Cb 0.52 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.76 1rao h GLU 67 CO -0.55 0.34 -0.12 0.93 -1.00 0.00 0.00 179.01 178.61 1rao h GLU 68 N 0.00 0.75 -0.87 2.33 5.08 -1.56 -0.85 114.58 119.46 1rao h GLU 68 Ca -0.00 -0.30 0.02 0.00 -1.00 0.00 0.00 59.36 58.08 1rao h GLU 68 Cb 0.89 -0.04 -0.05 0.00 0.50 0.00 0.00 28.75 30.06 1rao h GLU 68 CO 0.04 0.90 0.57 1.25 -1.00 0.00 0.00 179.01 180.78 1rao h LEU 69 N 0.55 0.96 -0.92 1.33 5.85 -0.31 -1.90 115.31 120.86 1rao h LEU 69 Ca 0.09 -0.02 -0.06 0.00 0.84 0.00 0.00 57.88 58.73 1rao h LEU 69 Cb 0.64 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 41.42 1rao h LEU 69 CO 0.04 0.68 0.09 0.25 -0.34 0.00 0.00 178.44 179.17 1rao h LEU 70 N 1.13 0.83 -0.65 2.25 5.85 -0.70 -0.94 115.31 123.09 1rao h LEU 70 Ca 0.33 -0.17 0.09 0.00 0.84 0.00 0.00 57.88 58.97 1rao h LEU 70 Cb -0.06 -0.22 -0.07 0.00 0.37 0.00 0.00 40.66 40.68 1rao h LEU 70 CO -0.09 0.84 0.29 0.78 -0.34 0.00 0.00 178.44 179.92 1rao h ASN 71 N 0.84 0.35 -0.32 1.25 2.35 -0.40 -0.62 115.58 119.03 1rao h ASN 71 Ca 0.17 0.07 -0.08 0.00 -0.55 0.00 0.00 56.30 55.91 1rao h ASN 71 Cb 0.37 0.01 -0.01 0.00 0.05 0.00 0.00 38.32 38.74 1rao h ASN 71 CO 0.01 0.20 -0.11 0.45 -1.65 0.00 0.00 177.43 176.33 1rao h HIS 72 N 0.51 0.73 -0.16 1.19 3.86 -0.77 0.49 115.15 120.99 1rao h HIS 72 Ca 0.32 -0.17 -0.09 0.00 -1.16 0.00 0.00 60.37 59.27 1rao h HIS 72 Cb 0.35 -0.17 -0.01 0.00 1.06 0.00 0.00 27.41 28.64 1rao h HIS 72 CO -0.13 0.84 -0.31 1.79 0.86 0.00 0.00 177.93 180.97 1rao h THR 73 N 0.41 1.27 -0.10 2.45 1.35 -0.95 -0.45 112.91 116.89 1rao h THR 73 Ca 0.08 -1.30 -0.16 0.00 -0.55 0.00 0.00 66.41 64.47 1rao h THR 73 Cb 0.62 1.49 -0.01 0.00 -1.73 0.00 0.00 68.15 68.53 1rao h THR 73 CO 0.04 0.40 -0.63 1.56 -0.25 0.00 0.00 175.52 176.64 1rao h GLN 74 N 0.27 0.37 -0.30 4.72 4.20 -0.95 -1.21 115.11 122.21 1rao h GLN 74 Ca 0.04 -0.26 -0.00 0.00 0.06 0.00 0.00 58.65 58.48 1rao h GLN 74 Cb 0.69 0.04 -0.01 0.00 0.30 0.00 0.00 27.48 28.50 1rao h GLN 74 CO 0.05 0.88 0.17 -0.09 -0.67 0.00 0.00 178.83 179.17 1rao h ARG 75 N 0.27 0.41 -0.39 1.46 2.43 -0.59 -0.66 114.38 117.31 1rao h ARG 75 Ca -0.01 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.12 1rao h ARG 75 Cb 1.17 -0.08 -0.02 0.00 -0.42 0.00 0.00 29.97 30.62 1rao h ARG 75 CO 0.11 0.34 0.25 0.82 -1.51 0.00 0.00 179.97 179.97 1rao h ILE 76 N 0.37 1.12 -0.98 1.20 2.04 -0.88 0.58 117.51 120.97 1rao h ILE 76 Ca 0.11 -0.25 0.14 0.00 1.00 0.00 0.00 64.86 65.86 1rao h ILE 76 Cb 0.04 0.57 -0.09 0.00 -0.74 0.00 0.00 36.82 36.60 1rao h ILE 76 CO -0.02 0.12 0.59 -0.33 0.00 0.00 0.00 178.15 178.51 1rao h GLU 77 N 0.53 0.84 -0.27 2.37 5.08 -1.01 0.12 114.58 122.24 1rao h GLU 77 Ca 0.14 -0.05 -0.19 0.00 -1.00 0.00 0.00 59.36 58.27 1rao h GLU 77 Cb -0.03 -0.19 0.00 0.00 0.50 0.00 0.00 28.75 29.04 1rao h GLU 77 CO -0.03 0.56 -0.56 -0.07 -1.00 0.00 0.00 179.01 177.91 1rao h LEU 78 N 0.87 0.95 0.13 1.33 3.38 0.09 -0.63 115.31 121.42 1rao h LEU 78 Ca 0.51 -0.55 -0.27 0.00 0.09 0.00 0.00 57.88 57.67 1rao h LEU 78 Cb 0.63 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 41.11 1rao h LEU 78 CO -0.31 1.32 -1.24 1.56 0.09 0.00 0.00 178.44 179.86 1rao h GLN 79 N 0.62 0.26 -0.00 1.13 4.20 -0.43 -3.39 115.11 117.50 1rao h GLN 79 Ca 0.01 -0.45 0.00 0.00 0.06 0.00 0.00 58.65 58.26 1rao h GLN 79 Cb 1.17 0.17 0.00 0.00 0.30 0.00 0.00 27.48 29.12 1rao h GLN 79 CO 0.12 1.22 -0.04 1.04 -0.67 0.00 0.00 178.83 180.50 1rao n GLN 80 N -3.53 3.58 0.00 1.46 1.13 0.36 -4.80 117.38 115.58 1rao n GLN 80 Ca -0.08 -0.24 0.14 0.00 -1.94 0.00 0.00 57.00 54.87 1rao n GLN 80 Cb 1.02 -0.75 0.60 0.00 0.11 0.00 0.00 30.24 31.22 1rao n GLN 80 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1rao n GLY 81 N 0.65 -1.46 3.55 1.08 0.00 -0.24 -4.74 105.19 104.03 1rao n GLY 81 Ca 0.00 -0.10 -0.34 0.00 0.00 0.00 0.00 46.02 45.59 1rao n GLY 81 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1rao s ARG 82 N -2.99 3.06 0.02 1.61 0.52 -1.26 -0.36 118.95 119.56 1rao s ARG 82 Ca 0.14 -0.54 -0.01 0.00 -0.52 0.00 0.00 55.73 54.80 1rao s ARG 82 Cb 0.18 -2.70 -0.04 0.00 0.52 0.00 0.00 34.95 32.92 1rao s ARG 82 CO 0.51 0.52 0.16 0.08 0.02 0.00 0.00 175.30 176.58 1rao s VAL 83 N -0.41 5.16 -0.20 3.52 1.01 -1.26 -4.85 120.40 123.37 1rao s VAL 83 Ca 0.06 -0.36 -0.29 0.00 0.00 0.00 0.00 61.98 61.39 1rao s VAL 83 Cb -0.12 -3.44 0.00 0.00 0.00 0.00 0.00 36.38 32.82 1rao s VAL 83 CO 0.02 0.25 1.10 -0.60 0.00 0.00 0.00 175.10 175.87 1rao s ARG 84 N -2.12 4.27 -0.97 2.72 6.06 -1.26 0.07 118.95 127.71 1rao s ARG 84 Ca 0.29 1.45 -0.08 0.00 -2.50 0.00 0.00 55.73 54.89 1rao s ARG 84 Cb -0.13 -3.66 0.24 0.00 0.06 0.00 0.00 34.95 31.46 1rao s ARG 84 CO 0.21 -0.63 0.92 0.15 -2.50 0.00 0.00 175.30 173.45 1rao s LYS 85 N 3.18 3.75 4.17 5.12 1.02 0.23 -4.87 119.74 132.34 1rao s LYS 85 Ca 0.47 -3.03 0.00 0.00 0.02 0.00 0.00 55.97 53.44 1rao s LYS 85 Cb -0.17 -4.33 0.00 0.00 -0.52 0.00 0.00 37.83 32.80 1rao s LYS 85 CO 0.09 -1.25 0.00 0.00 -0.92 0.00 0.00 175.35 173.27 1rao n ALA 86 N 2.94 0.00 0.57 5.17 0.00 -1.26 -1.93 120.51 126.00 1rao n ALA 86 Ca 0.20 0.00 0.13 0.00 0.00 0.00 0.00 53.44 53.77 1rao n ALA 86 Cb 0.40 0.00 0.43 0.00 0.00 0.00 0.00 19.45 20.29 1rao n ALA 86 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 1rao n GLU 87 N 0.00 0.24 -3.85 0.00 -0.00 -1.26 -4.94 120.64 110.82 1rao n GLU 87 Ca 0.00 0.27 -0.05 0.00 -0.00 0.00 0.00 57.16 57.38 1rao n GLU 87 Cb 0.00 -1.82 0.02 0.00 -0.00 0.00 0.00 31.44 29.64 1rao n GLU 87 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.13 176.15 1rao s ARG 88 N -3.16 1.63 0.19 3.44 1.70 -0.81 -5.12 118.95 116.82 1rao s ARG 88 Ca 0.09 -1.05 -0.30 0.00 -0.47 0.00 0.00 55.73 54.00 1rao s ARG 88 Cb 0.12 0.46 -0.08 0.00 -0.57 0.00 0.00 34.95 34.88 1rao s ARG 88 CO 0.54 -0.77 1.11 -1.58 -1.08 0.00 0.00 175.30 173.52 1rao s TRP 89 N -2.26 3.58 0.58 5.89 0.52 -1.26 0.76 118.94 126.75 1rao s TRP 89 Ca 0.19 1.59 -0.08 0.00 0.02 0.00 0.00 56.10 57.83 1rao s TRP 89 Cb -0.03 -3.29 0.13 0.00 -1.15 0.00 0.00 33.47 29.12 1rao s TRP 89 CO 0.07 -0.66 0.79 0.41 0.02 0.00 0.00 176.95 177.59 1rao n GLY 90 N 1.99 -0.80 3.75 0.98 0.00 0.11 -4.79 105.19 106.43 1rao n GLY 90 Ca 0.03 -1.78 -0.34 0.00 0.00 0.00 0.00 46.02 43.92 1rao n GLY 90 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1rao s PRO 91 N -4.66 2.73 0.32 1.61 0.04 -1.26 -4.54 135.00 129.25 1rao s PRO 91 Ca 0.47 1.62 -0.29 0.00 0.04 0.00 0.00 61.00 62.84 1rao s PRO 91 Cb -0.02 -1.92 -0.11 0.00 0.04 0.00 0.00 34.50 32.49 1rao s PRO 91 CO 0.32 -1.35 1.56 -2.13 0.04 0.00 0.00 177.00 175.45 1rao n ARG 92 N -2.16 2.70 -0.06 4.56 0.63 -1.26 -4.44 116.66 116.63 1rao n ARG 92 Ca 0.12 0.96 0.01 0.00 -0.92 0.00 0.00 57.85 58.02 1rao n ARG 92 Cb 0.51 -2.72 0.02 0.00 0.45 0.00 0.00 32.46 30.71 1rao n ARG 92 CO 0.00 0.00 0.00 0.25 -2.51 0.00 0.00 177.63 175.37 1rao n THR 93 N 1.55 0.63 -4.88 5.15 -2.24 0.52 -4.99 114.28 110.02 1rao n THR 93 Ca 0.06 -0.67 -0.30 0.00 -2.27 0.00 0.00 64.05 60.87 1rao n THR 93 Cb 0.37 0.60 -0.17 0.00 -2.10 0.00 0.00 70.33 69.04 1rao n THR 93 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 1rao s LEU 94 N -0.74 1.93 -0.12 3.22 2.96 -1.21 -2.24 118.68 122.48 1rao s LEU 94 Ca 0.04 -0.48 0.02 0.00 -0.22 0.00 0.00 54.13 53.49 1rao s LEU 94 Cb 0.03 -1.22 -0.01 0.00 0.50 0.00 0.00 46.19 45.49 1rao s LEU 94 CO 0.00 0.10 -0.19 -1.81 -1.32 0.00 0.00 176.35 173.13 1rao s ASP 95 N 0.58 3.49 -0.15 3.68 1.01 0.11 -4.91 116.67 120.47 1rao s ASP 95 Ca -0.15 -0.46 0.01 0.00 0.71 0.00 0.00 52.55 52.66 1rao s ASP 95 Cb -0.17 -1.50 0.02 0.00 1.01 0.00 0.00 42.92 42.28 1rao s ASP 95 CO 0.05 0.15 -0.18 -0.76 0.21 0.00 0.00 175.17 174.64 1rao s LEU 96 N 0.40 1.95 -0.00 1.23 1.43 -1.26 -1.16 118.68 121.27 1rao s LEU 96 Ca -0.14 -0.57 0.04 0.00 -1.03 0.00 0.00 54.13 52.43 1rao s LEU 96 Cb -0.17 -1.34 -0.01 0.00 0.03 0.00 0.00 46.19 44.70 1rao s LEU 96 CO 0.07 0.00 -0.13 -1.81 0.23 0.00 0.00 176.35 174.71 1rao s ASP 97 N 1.20 1.53 -0.46 2.29 1.01 -0.24 -4.92 116.67 117.07 1rao s ASP 97 Ca 0.01 -0.28 -0.25 0.00 0.71 0.00 0.00 52.55 52.74 1rao s ASP 97 Cb -0.14 -0.15 0.03 0.00 1.01 0.00 0.00 42.92 43.67 1rao s ASP 97 CO -0.08 0.13 0.90 -0.63 0.21 0.00 0.00 175.17 175.70 1rao s ILE 98 N -0.41 4.50 -0.11 0.77 1.01 -1.26 0.35 121.20 126.04 1rao s ILE 98 Ca 0.04 0.67 -0.26 0.00 0.00 0.00 0.00 60.65 61.11 1rao s ILE 98 Cb -0.06 -4.42 -0.27 0.00 0.01 0.00 0.00 42.46 37.72 1rao s ILE 98 CO -0.00 -0.82 0.77 0.24 0.00 0.00 0.00 174.94 175.12 1rao h MET 99 N 9.07 0.11 -3.85 2.79 2.86 -0.83 -3.35 114.93 121.73 1rao h MET 99 Ca -0.24 -0.19 -0.15 0.00 -2.06 0.00 0.00 59.70 57.06 1rao h MET 99 Cb 1.08 0.07 -0.20 0.00 0.06 0.00 0.00 31.60 32.61 1rao h MET 99 CO 1.02 1.09 -0.60 -0.51 1.06 0.00 0.00 176.91 178.96 1rao s LEU 100 N -8.06 1.99 -0.27 1.22 1.43 -1.12 -1.49 118.68 112.39 1rao s LEU 100 Ca -0.18 -0.49 -0.04 0.00 -1.03 0.00 0.00 54.13 52.40 1rao s LEU 100 Cb -0.01 0.37 0.09 0.00 0.03 0.00 0.00 46.19 46.67 1rao s LEU 100 CO 0.73 -0.40 0.12 0.12 0.23 0.00 0.00 176.35 177.16 1rao s PHE 101 N -1.95 0.44 0.00 0.29 2.19 -1.26 -1.09 117.98 116.59 1rao s PHE 101 Ca -0.11 -0.86 0.00 0.00 0.33 0.00 0.00 56.93 56.29 1rao s PHE 101 Cb -0.06 -0.94 0.00 0.00 -1.31 0.00 0.00 43.02 40.71 1rao s PHE 101 CO -0.02 -0.78 0.00 0.41 1.83 0.00 0.00 175.22 176.66 1rao n GLY 102 N 5.22 2.57 1.60 13.12 0.00 0.14 -0.46 105.19 127.38 1rao n GLY 102 Ca -0.06 -0.18 0.02 0.00 0.00 0.00 0.00 46.02 45.80 1rao n GLY 102 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1rao n ASN 103 N 1.17 4.65 -4.85 1.61 3.02 -1.26 -4.93 115.26 114.68 1rao n ASN 103 Ca 0.00 -3.13 -0.33 0.00 -0.03 0.00 0.00 54.58 51.08 1rao n ASN 103 Cb 0.00 -0.67 -0.06 0.00 -0.61 0.00 0.00 39.78 38.44 1rao n ASN 103 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 1rao s GLU 104 N -2.91 4.02 -0.19 3.52 2.02 0.40 -4.66 118.70 120.89 1rao s GLU 104 Ca 0.51 0.64 -0.06 0.00 0.02 0.00 0.00 54.97 56.08 1rao s GLU 104 Cb 0.41 -2.58 -0.03 0.00 0.10 0.00 0.00 34.13 32.02 1rao s GLU 104 CO 0.12 0.25 0.04 0.08 0.02 0.00 0.00 175.26 175.76 1rao s VAL 105 N -1.83 4.41 -0.05 2.63 1.01 -1.26 -4.44 120.40 120.87 1rao s VAL 105 Ca 0.50 -0.16 0.02 0.00 0.00 0.00 0.00 61.98 62.34 1rao s VAL 105 Cb -0.12 -2.99 0.01 0.00 0.00 0.00 0.00 36.38 33.28 1rao s VAL 105 CO 0.19 0.43 -0.10 -0.63 0.00 0.00 0.00 175.10 174.99 1rao s ILE 106 N 0.74 0.96 -0.46 2.22 1.01 0.39 -4.97 121.20 121.10 1rao s ILE 106 Ca 0.02 -0.41 0.04 0.00 0.00 0.00 0.00 60.65 60.30 1rao s ILE 106 Cb -0.14 -0.88 0.16 0.00 0.01 0.00 0.00 42.46 41.62 1rao s ILE 106 CO 0.02 0.31 0.34 0.20 0.00 0.00 0.00 174.94 175.81 1rao s ASN 107 N 0.52 2.37 0.46 3.58 -0.87 -1.24 -0.79 114.94 118.96 1rao s ASN 107 Ca -0.10 -3.07 0.04 0.00 -1.57 0.00 0.00 52.86 48.17 1rao s ASN 107 Cb -0.13 -0.69 -0.05 0.00 -0.02 0.00 0.00 41.25 40.36 1rao s ASN 107 CO 0.02 -0.18 0.01 0.42 -2.57 0.00 0.00 177.10 174.80 1rao s THR 108 N -0.06 1.61 0.38 1.60 -4.23 0.43 -4.99 115.64 110.38 1rao s THR 108 Ca 0.29 -1.99 0.12 0.00 -1.18 0.00 0.00 61.69 58.92 1rao s THR 108 Cb -0.03 -2.61 0.34 0.00 1.34 0.00 0.00 72.50 71.54 1rao s THR 108 CO -0.15 0.00 1.87 -0.33 -0.54 0.00 0.00 174.62 175.47 1rao h GLU 109 N 1.56 0.56 0.00 3.99 3.07 -2.06 -3.05 114.58 118.66 1rao h GLU 109 Ca -0.44 -0.03 -0.33 0.00 -0.50 0.00 0.00 59.36 58.06 1rao h GLU 109 Cb 1.28 -0.13 -0.06 0.00 -0.84 0.00 0.00 28.75 29.00 1rao h GLU 109 CO 0.78 0.37 -2.05 0.54 -1.40 0.00 0.00 179.01 177.25 1rao n ARG 110 N -4.55 0.66 -4.09 2.33 1.74 -1.26 -4.97 116.66 106.52 1rao n ARG 110 Ca 0.18 0.15 -0.23 0.00 -0.77 0.00 0.00 57.85 57.17 1rao n ARG 110 Cb 0.54 -1.66 -0.17 0.00 -1.02 0.00 0.00 32.46 30.15 1rao n ARG 110 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 1rao s LEU 111 N -5.81 1.19 -0.25 0.55 2.96 -1.15 -5.09 118.68 111.08 1rao s LEU 111 Ca -0.08 -0.18 0.02 0.00 -0.22 0.00 0.00 54.13 53.67 1rao s LEU 111 Cb 0.07 -0.59 0.05 0.00 0.50 0.00 0.00 46.19 46.22 1rao s LEU 111 CO 0.83 -0.08 -0.12 -0.89 -1.32 0.00 0.00 176.35 174.77 1rao s THR 112 N 1.27 2.26 -0.06 3.68 2.01 -1.26 -0.43 115.64 123.11 1rao s THR 112 Ca -0.05 -1.44 0.03 0.00 0.31 0.00 0.00 61.69 60.54 1rao s THR 112 Cb -0.14 -2.24 0.00 0.00 0.01 0.00 0.00 72.50 70.13 1rao s THR 112 CO -0.02 0.09 -0.16 -0.69 -0.69 0.00 0.00 174.62 173.15 1rao s VAL 113 N 1.16 1.36 0.62 3.82 1.01 0.03 -3.68 120.40 124.71 1rao s VAL 113 Ca -0.05 -0.64 -0.18 0.00 0.00 0.00 0.00 61.98 61.11 1rao s VAL 113 Cb -0.18 -1.20 -0.06 0.00 0.00 0.00 0.00 36.38 34.94 1rao s VAL 113 CO -0.06 0.40 0.75 -2.65 0.00 0.00 0.00 175.10 173.54 1rao n PRO 114 N 3.48 0.64 -1.63 2.72 -0.02 -1.26 -0.46 135.00 138.48 1rao n PRO 114 Ca -0.20 0.26 -0.45 0.00 -2.02 0.00 0.00 63.50 61.09 1rao n PRO 114 Cb 0.52 -1.96 -0.02 0.00 -0.02 0.00 0.00 33.50 32.02 1rao n PRO 114 CO 0.00 0.00 0.00 1.58 1.98 0.00 0.00 175.50 179.06 1rao n HIS 115 N -1.87 1.70 0.34 6.00 -0.00 -0.55 -4.82 115.22 116.02 1rao n HIS 115 Ca 0.13 0.60 0.22 0.00 -0.00 0.00 0.00 57.72 58.67 1rao n HIS 115 Cb 0.48 -2.34 1.20 0.00 -0.00 0.00 0.00 29.99 29.33 1rao n HIS 115 CO 0.00 0.00 0.00 0.10 -0.00 0.00 0.00 176.34 176.44 1rao h TYR 116 N 2.91 0.00 0.00 1.57 -0.00 -1.92 -3.13 116.97 116.39 1rao h TYR 116 Ca -0.43 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.30 1rao h TYR 116 Cb 1.31 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 38.04 1rao h TYR 116 CO 0.52 0.00 -0.16 -3.47 -0.00 0.00 0.00 178.16 175.05 1rao n ASP 117 N -3.08 0.00 0.05 0.10 2.03 -1.26 -4.87 116.55 109.52 1rao n ASP 117 Ca -0.03 -1.31 0.13 0.00 0.52 0.00 0.00 54.79 54.10 1rao n ASP 117 Cb 0.09 -0.06 0.60 0.00 -0.72 0.00 0.00 41.12 41.02 1rao n ASP 117 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1rao h MET 118 N 0.00 0.17 0.00 -0.67 -0.00 -1.92 -0.20 114.93 112.31 1rao h MET 118 Ca 0.00 -0.01 0.00 0.00 -0.00 0.00 0.00 59.70 59.69 1rao h MET 118 Cb 1.13 -0.04 0.00 0.00 -0.00 0.00 0.00 31.60 32.69 1rao h MET 118 CO 0.00 0.11 0.00 1.63 -0.00 0.00 0.00 176.91 178.65 1rao n LYS 119 N -4.46 0.13 0.00 -0.10 5.02 -1.26 -1.35 118.16 116.14 1rao n LYS 119 Ca 0.06 0.38 0.13 0.00 -2.02 0.00 0.00 58.31 56.86 1rao n LYS 119 Cb 0.34 -1.76 0.41 0.00 -0.02 0.00 0.00 35.03 34.00 1rao n LYS 119 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1rao n ASN 120 N -2.01 1.87 -3.86 4.39 3.02 -0.09 -4.87 115.26 113.71 1rao n ASN 120 Ca 0.02 -1.61 -0.30 0.00 -0.03 0.00 0.00 54.58 52.67 1rao n ASN 120 Cb 0.21 0.01 -0.15 0.00 -0.61 0.00 0.00 39.78 39.23 1rao n ASN 120 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 1rao s ARG 121 N -2.02 1.13 0.51 3.52 0.52 -0.46 -4.95 118.95 117.21 1rao s ARG 121 Ca 0.35 -1.22 0.20 0.00 -0.52 0.00 0.00 55.73 54.54 1rao s ARG 121 Cb 0.21 -2.46 1.31 0.00 0.52 0.00 0.00 34.95 34.53 1rao s ARG 121 CO 0.33 -0.86 2.09 0.78 0.02 0.00 0.00 175.30 177.67 1rao h GLY 122 N 7.94 0.00 2.00 -3.53 0.00 -1.89 -0.10 103.07 107.49 1rao h GLY 122 Ca -0.12 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.21 1rao h GLY 122 CO 0.46 0.00 0.00 0.27 0.00 0.00 0.00 176.54 177.27 1rao h PHE 123 N 0.00 0.00 0.04 5.60 -5.15 -1.93 0.17 116.94 115.66 1rao h PHE 123 Ca -0.00 0.00 -0.38 0.00 -0.20 0.00 0.00 57.97 57.39 1rao h PHE 123 Cb 0.19 0.00 -0.05 0.00 0.22 0.00 0.00 35.95 36.31 1rao h PHE 123 CO 0.00 0.00 -2.32 -1.33 -2.00 0.00 0.00 178.31 172.66 1rao n MET 124 N -2.46 0.68 -0.10 6.09 2.81 -0.24 -4.52 117.12 119.37 1rao n MET 124 Ca 0.01 0.19 -0.13 0.00 -1.81 0.00 0.00 57.70 55.96 1rao n MET 124 Cb 0.21 -1.58 -0.04 0.00 -0.71 0.00 0.00 33.22 31.11 1rao n MET 124 CO 0.00 0.00 0.00 -0.07 1.51 0.00 0.00 175.97 177.41 1rao h LEU 125 N -0.03 0.80 -0.16 4.03 3.38 -0.64 -3.08 115.31 119.61 1rao h LEU 125 Ca -0.53 -0.47 -0.09 0.00 0.09 0.00 0.00 57.88 56.87 1rao h LEU 125 Cb 1.92 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 42.45 1rao h LEU 125 CO -0.05 1.11 -0.26 -0.50 0.09 0.00 0.00 178.44 178.83 1rao h TRP 126 N 0.50 0.57 -0.84 1.13 4.06 -0.93 0.30 115.95 120.75 1rao h TRP 126 Ca 0.05 -0.19 0.06 0.00 2.06 0.00 0.00 58.89 60.86 1rao h TRP 126 Cb 0.89 -0.11 -0.05 0.00 -1.00 0.00 0.00 29.16 28.89 1rao h TRP 126 CO 0.07 0.89 0.55 -1.35 -3.56 0.00 0.00 178.44 175.04 1rao h PRO 127 N 0.09 0.93 -0.68 0.49 0.11 -1.78 -1.61 132.00 129.55 1rao h PRO 127 Ca 0.01 -0.06 -0.06 0.00 0.11 0.00 0.00 66.00 66.00 1rao h PRO 127 Cb 0.83 -0.21 -0.03 0.00 0.11 0.00 0.00 31.00 31.71 1rao h PRO 127 CO 0.06 0.61 0.18 1.25 -0.21 0.00 0.00 178.00 179.89 1rao h LEU 128 N 0.95 1.02 -1.28 2.35 5.85 -1.40 -2.68 115.31 120.12 1rao h LEU 128 Ca 0.35 -0.23 -0.07 0.00 0.84 0.00 0.00 57.88 58.78 1rao h LEU 128 Cb 0.17 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 40.92 1rao h LEU 128 CO -0.12 0.98 -0.24 0.15 -0.34 0.00 0.00 178.44 178.87 1rao h PHE 129 N 1.01 0.19 -0.68 1.25 3.57 -0.29 0.32 116.94 122.31 1rao h PHE 129 Ca 0.21 -0.03 -0.08 0.00 3.53 0.00 0.00 57.97 61.60 1rao h PHE 129 Cb 0.35 -0.05 -0.03 0.00 2.79 0.00 0.00 35.95 39.01 1rao h PHE 129 CO 0.03 0.42 0.12 1.49 -2.23 0.00 0.00 178.31 178.13 1rao h GLU 130 N 0.16 1.12 -0.00 1.11 4.81 -0.98 -2.36 114.58 118.45 1rao h GLU 130 Ca 0.03 -0.30 0.00 0.00 -0.13 0.00 0.00 59.36 58.96 1rao h GLU 130 Cb 0.53 -0.13 0.00 0.00 0.63 0.00 0.00 28.75 29.77 1rao h GLU 130 CO 0.04 1.02 -0.80 0.44 -0.73 0.00 0.00 179.01 178.98 1rao n ILE 131 N -4.22 0.00 -3.01 2.32 -5.35 -0.80 -4.61 119.36 103.71 1rao n ILE 131 Ca 0.04 -0.01 -0.15 0.00 -0.27 0.00 0.00 62.75 62.36 1rao n ILE 131 Cb 0.29 0.73 0.01 0.00 -1.74 0.00 0.00 39.64 38.93 1rao n ILE 131 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1rao n ALA 132 N -1.45 0.86 0.30 -1.28 0.00 0.11 -5.00 120.51 114.05 1rao n ALA 132 Ca 0.05 -2.60 0.16 0.00 0.00 0.00 0.00 53.44 51.05 1rao n ALA 132 Cb 0.34 -1.02 0.94 0.00 0.00 0.00 0.00 19.45 19.70 1rao n ALA 132 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1rao h PRO 133 N 3.28 0.00 -0.51 0.00 0.13 -1.61 -2.08 132.00 131.21 1rao h PRO 133 Ca 0.01 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.14 1rao h PRO 133 Cb 1.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.13 1rao h PRO 133 CO 0.37 0.03 0.00 0.39 -0.23 0.00 0.00 178.00 178.55 1rao n GLU 134 N -3.62 2.36 -1.75 0.86 -0.58 -1.26 -4.33 120.64 112.33 1rao n GLU 134 Ca -0.03 -2.10 -0.42 0.00 -0.42 0.00 0.00 57.16 54.20 1rao n GLU 134 Cb 0.12 -1.48 -0.01 0.00 -0.57 0.00 0.00 31.44 29.50 1rao n GLU 134 CO 0.00 0.00 0.00 -0.11 -0.48 0.00 0.00 177.13 176.54 1rao n LEU 135 N 1.23 4.33 -4.25 -4.62 0.00 -0.78 -4.90 117.00 108.02 1rao n LEU 135 Ca 0.20 1.19 -0.31 0.00 0.00 0.00 0.00 56.01 57.09 1rao n LEU 135 Cb 0.52 -1.58 -0.16 0.00 0.00 0.00 0.00 43.42 42.19 1rao n LEU 135 CO 0.14 0.02 -0.56 -0.69 0.00 0.00 0.00 177.39 176.31 1rao s VAL 136 N -0.60 1.98 0.66 1.96 1.01 -1.26 -1.46 120.40 122.69 1rao s VAL 136 Ca 0.59 -1.02 -0.11 0.00 0.00 0.00 0.00 61.98 61.44 1rao s VAL 136 Cb -0.51 -1.68 -0.01 0.00 0.00 0.00 0.00 36.38 34.18 1rao s VAL 136 CO 0.57 0.55 1.05 -0.36 0.00 0.00 0.00 175.10 176.90 1rao s PHE 137 N -0.08 3.31 0.48 5.22 0.40 0.62 -4.92 117.98 123.01 1rao s PHE 137 Ca -0.05 1.37 0.25 0.00 -0.60 0.00 0.00 56.93 57.90 1rao s PHE 137 Cb -0.14 -2.82 1.30 0.00 0.51 0.00 0.00 43.02 41.87 1rao s PHE 137 CO 0.04 -1.02 1.85 -1.35 0.70 0.00 0.00 175.22 175.45 1rao h PRO 138 N -0.52 0.19 -0.13 0.24 0.11 -1.87 0.08 132.00 130.09 1rao h PRO 138 Ca -0.44 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.66 1rao h PRO 138 Cb 1.20 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.27 1rao h PRO 138 CO 0.59 0.13 0.00 -0.40 -0.21 0.00 0.00 178.00 178.10 1rao n ASP 139 N -4.40 1.55 0.00 -2.05 5.75 -1.26 -4.89 116.55 111.24 1rao n ASP 139 Ca 0.20 -1.65 0.00 0.00 -0.01 0.00 0.00 54.79 53.33 1rao n ASP 139 Cb 0.89 -0.08 0.00 0.00 -1.03 0.00 0.00 41.12 40.89 1rao n ASP 139 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1rao n GLY 140 N 1.12 1.51 3.74 6.12 0.00 0.01 -5.07 105.19 112.62 1rao n GLY 140 Ca 0.17 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.87 1rao n GLY 140 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1rao s GLU 141 N -0.89 2.12 -0.01 1.61 2.02 -1.26 -4.74 118.70 117.55 1rao s GLU 141 Ca 0.00 1.38 0.08 0.00 0.02 0.00 0.00 54.97 56.45 1rao s GLU 141 Cb 0.00 -1.87 -0.02 0.00 0.10 0.00 0.00 34.13 32.34 1rao s GLU 141 CO 0.00 -1.77 -0.26 -1.64 0.02 0.00 0.00 175.26 171.61 1rao s MET 142 N -4.53 2.05 0.23 1.61 -1.94 -1.26 -0.28 119.30 115.18 1rao s MET 142 Ca 0.65 -0.97 -0.08 0.00 -1.71 0.00 0.00 55.69 53.58 1rao s MET 142 Cb -0.21 -2.03 0.21 0.00 2.01 0.00 0.00 34.83 34.81 1rao s MET 142 CO 0.51 0.55 1.90 1.25 -0.01 0.00 0.00 175.02 179.23 1rao h LEU 143 N 5.35 1.00 -0.76 -0.03 5.85 -1.57 -0.87 115.31 124.28 1rao h LEU 143 Ca -0.44 -0.03 0.08 0.00 0.84 0.00 0.00 57.88 58.33 1rao h LEU 143 Cb 1.12 -0.25 -0.06 0.00 0.37 0.00 0.00 40.66 41.84 1rao h LEU 143 CO 0.46 0.73 0.43 -0.09 -0.34 0.00 0.00 178.44 179.63 1rao h ARG 144 N 1.18 0.73 -0.43 1.25 2.43 -1.79 -1.85 114.38 115.90 1rao h ARG 144 Ca 0.32 -0.04 -0.04 0.00 -0.81 0.00 0.00 59.98 59.41 1rao h ARG 144 Cb -0.13 -0.17 -0.02 0.00 -0.42 0.00 0.00 29.97 29.23 1rao h ARG 144 CO -0.07 0.48 0.13 0.37 -1.51 0.00 0.00 179.97 179.37 1rao h GLN 145 N 0.75 0.67 -0.42 0.20 4.15 -1.62 0.96 115.11 119.80 1rao h GLN 145 Ca 0.35 -0.15 -0.05 0.00 0.77 0.00 0.00 58.65 59.57 1rao h GLN 145 Cb 0.27 -0.09 -0.02 0.00 0.21 0.00 0.00 27.48 27.85 1rao h GLN 145 CO -0.22 0.66 0.06 0.82 -1.93 0.00 0.00 178.83 178.22 1rao h ILE 146 N 0.55 1.24 -0.39 2.39 2.04 -0.90 -0.52 117.51 121.93 1rao h ILE 146 Ca 0.14 -0.89 -0.10 0.00 1.00 0.00 0.00 64.86 65.00 1rao h ILE 146 Cb 0.27 1.02 -0.02 0.00 -0.74 0.00 0.00 36.82 37.35 1rao h ILE 146 CO -0.00 0.31 -0.17 -0.07 0.00 0.00 0.00 178.15 178.22 1rao h LEU 147 N 0.55 0.74 -0.43 1.44 3.38 -1.09 -1.52 115.31 118.38 1rao h LEU 147 Ca 0.13 -0.24 -0.02 0.00 0.09 0.00 0.00 57.88 57.84 1rao h LEU 147 Cb 0.38 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.92 1rao h LEU 147 CO 0.01 0.91 0.19 -0.74 0.09 0.00 0.00 178.44 178.89 1rao h HIS 148 N 0.66 0.64 -0.17 1.13 2.76 -0.55 0.19 115.15 119.80 1rao h HIS 148 Ca 0.10 -0.04 -0.04 0.00 -2.20 0.00 0.00 60.37 58.19 1rao h HIS 148 Cb 0.65 -0.19 -0.01 0.00 1.55 0.00 0.00 27.41 29.41 1rao h HIS 148 CO 0.03 0.54 -0.05 1.15 -1.30 0.00 0.00 177.93 178.30 1rao h THR 149 N 0.55 1.29 0.00 6.26 2.02 -0.95 -3.23 112.91 118.85 1rao h THR 149 Ca 0.14 -1.03 -0.09 0.00 0.77 0.00 0.00 66.41 66.21 1rao h THR 149 Cb 0.16 1.62 -0.01 0.00 -1.74 0.00 0.00 68.15 68.17 1rao h THR 149 CO -0.01 0.31 -0.70 0.03 0.37 0.00 0.00 175.52 175.51 1rao h ARG 150 N 0.04 0.00 -3.28 6.66 2.47 -1.26 -3.48 114.38 115.54 1rao h ARG 150 Ca 0.04 0.00 -0.41 0.00 -1.26 0.00 0.00 59.98 58.35 1rao h ARG 150 Cb 0.49 0.00 -0.00 0.00 -1.65 0.00 0.00 29.97 28.81 1rao h ARG 150 CO 0.02 0.30 -0.55 0.00 0.56 0.00 0.00 179.97 180.30 1rao n ALA 151 N -2.24 -0.69 -1.64 0.04 0.00 0.67 -4.92 120.51 111.73 1rao n ALA 151 Ca -0.01 0.19 -0.47 0.00 0.00 0.00 0.00 53.44 53.16 1rao n ALA 151 Cb 0.70 -2.56 -0.04 0.00 0.00 0.00 0.00 19.45 17.55 1rao n ALA 151 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1rao n PHE 152 N -4.13 1.97 -1.68 0.00 3.72 -1.26 -4.90 117.46 111.19 1rao n PHE 152 Ca -0.22 0.44 -0.38 0.00 -0.05 0.00 0.00 57.45 57.25 1rao n PHE 152 Cb 0.67 -2.44 0.06 0.00 -0.94 0.00 0.00 39.48 36.83 1rao n PHE 152 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 176.76 173.24 1rao n ASP 153 N 2.71 1.53 -4.73 4.37 2.03 -1.26 -4.94 116.55 116.26 1rao n ASP 153 Ca 0.16 0.83 -0.38 0.00 0.52 0.00 0.00 54.79 55.92 1rao n ASP 153 Cb 0.27 -1.48 0.05 0.00 -0.72 0.00 0.00 41.12 39.24 1rao n ASP 153 CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 1rao n LYS 154 N -1.40 1.55 -2.78 -0.67 5.02 -1.26 -5.00 118.16 113.62 1rao n LYS 154 Ca 0.14 0.57 -0.29 0.00 -2.02 0.00 0.00 58.31 56.72 1rao n LYS 154 Cb 0.47 -2.55 -0.02 0.00 -0.02 0.00 0.00 35.03 32.92 1rao n LYS 154 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1rao s LEU 155 N -3.53 3.75 0.22 -0.35 1.43 -1.26 -5.07 118.68 113.88 1rao s LEU 155 Ca 0.74 1.03 -0.24 0.00 -1.03 0.00 0.00 54.13 54.63 1rao s LEU 155 Cb -0.41 -3.94 -0.08 0.00 0.03 0.00 0.00 46.19 41.79 1rao s LEU 155 CO 0.47 -0.47 0.80 0.20 0.23 0.00 0.00 176.35 177.59 1rao s ASN 156 N -3.56 7.28 0.59 2.29 0.01 -1.26 -4.97 114.94 115.33 1rao s ASN 156 Ca 0.49 1.63 -0.15 0.00 -0.71 0.00 0.00 52.86 54.12 1rao s ASN 156 Cb -0.10 -2.49 -0.04 0.00 0.41 0.00 0.00 41.25 39.02 1rao s ASN 156 CO 0.37 0.09 1.04 -0.54 -1.51 0.00 0.00 177.10 176.56 1rao s LYS 157 N -1.61 3.40 0.00 -0.60 1.02 -1.26 -0.35 119.74 120.34 1rao s LYS 157 Ca 0.41 1.11 0.00 0.00 0.02 0.00 0.00 55.97 57.52 1rao s LYS 157 Cb -0.20 -2.05 0.00 0.00 -0.52 0.00 0.00 37.83 35.06 1rao s LYS 157 CO 0.24 -0.74 0.48 1.87 -0.92 0.00 0.00 175.35 176.28