#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ajw s VAL 61 N 0.00 1.70 0.54 0.00 -7.23 -1.26 -5.15 120.40 109.00 1ajw s VAL 61 Ca 0.00 -1.78 -0.04 0.00 -1.81 0.00 0.00 61.98 58.36 1ajw s VAL 61 Cb 0.00 -1.70 0.00 0.00 0.56 0.00 0.00 36.38 35.24 1ajw s VAL 61 CO 0.00 -0.27 0.82 -0.94 -0.31 0.00 0.00 175.10 174.41 1ajw s SER 62 N -2.42 5.68 0.38 4.85 1.04 -1.26 -5.10 113.70 116.88 1ajw s SER 62 Ca 0.12 0.58 0.08 0.00 0.48 0.00 0.00 55.95 57.20 1ajw s SER 62 Cb -0.07 -1.66 -0.02 0.00 0.10 0.00 0.00 66.02 64.38 1ajw s SER 62 CO 0.05 -0.94 0.40 0.00 0.98 0.00 0.00 173.24 173.74 1ajw s ALA 63 N -2.85 4.11 -0.50 5.32 0.00 -1.26 -5.07 121.76 121.51 1ajw s ALA 63 Ca 0.52 -1.73 -0.18 0.00 0.00 0.00 0.00 51.96 50.57 1ajw s ALA 63 Cb -0.10 -1.26 0.06 0.00 0.00 0.00 0.00 23.12 21.82 1ajw s ALA 63 CO 0.43 -0.15 0.59 -0.51 0.00 0.00 0.00 175.76 176.12 1ajw s ASP 64 N -4.14 6.21 -1.10 0.00 1.11 -1.26 -4.98 116.67 112.51 1ajw s ASP 64 Ca 0.47 -0.99 -0.23 0.00 0.18 0.00 0.00 52.55 51.98 1ajw s ASP 64 Cb -0.06 -2.27 -0.05 0.00 1.07 0.00 0.00 42.92 41.60 1ajw s ASP 64 CO 0.29 -0.85 1.90 -2.16 1.18 0.00 0.00 175.17 175.52 1ajw s PRO 65 N 2.46 2.70 -0.46 8.23 0.04 -1.26 -4.74 135.00 141.97 1ajw s PRO 65 Ca 0.13 -0.97 0.06 0.00 0.04 0.00 0.00 61.00 60.26 1ajw s PRO 65 Cb -0.20 -5.22 0.40 0.00 0.04 0.00 0.00 34.50 29.52 1ajw s PRO 65 CO 0.11 -3.56 1.06 -1.71 0.04 0.00 0.00 177.00 172.94 1ajw n ASN 66 N 13.45 4.40 -4.77 6.66 2.85 -1.26 -5.06 115.26 131.53 1ajw n ASN 66 Ca 0.43 -3.64 -0.25 0.00 -0.11 0.00 0.00 54.58 51.01 1ajw n ASN 66 Cb 0.47 -0.49 -0.06 0.00 1.24 0.00 0.00 39.78 40.94 1ajw n ASN 66 CO 0.00 0.00 0.00 0.68 -2.11 0.00 0.00 177.26 175.83 1ajw s VAL 67 N -5.12 4.27 0.00 3.44 -7.23 -1.26 -5.12 120.40 109.37 1ajw s VAL 67 Ca 0.47 -1.26 0.00 0.00 -1.81 0.00 0.00 61.98 59.38 1ajw s VAL 67 Cb 0.38 -3.20 0.00 0.00 0.56 0.00 0.00 36.38 34.11 1ajw s VAL 67 CO -0.16 -0.17 0.00 -0.81 -0.31 0.00 0.00 175.10 173.65 1ajw n PRO 68 N -0.49 -0.06 -0.02 4.82 -0.04 -1.26 -5.06 135.00 132.89 1ajw n PRO 68 Ca -0.08 0.00 -0.02 0.00 -0.04 0.00 0.00 63.50 63.36 1ajw n PRO 68 Cb 0.56 0.00 -0.01 0.00 -0.04 0.00 0.00 33.50 34.01 1ajw n PRO 68 CO 0.00 0.00 0.00 -1.71 -0.04 0.00 0.00 175.50 173.75 1ajw n ASN 69 N -1.87 0.36 -4.37 3.54 5.15 -1.26 -4.83 115.26 111.99 1ajw n ASN 69 Ca 0.00 0.11 -0.32 0.00 -0.60 0.00 0.00 54.58 53.77 1ajw n ASN 69 Cb 0.00 -0.55 -0.15 0.00 -0.53 0.00 0.00 39.78 38.55 1ajw n ASN 69 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 1ajw s VAL 70 N -1.34 2.77 0.02 3.44 1.01 -1.26 -3.08 120.40 121.96 1ajw s VAL 70 Ca -0.05 -0.80 -0.12 0.00 0.00 0.00 0.00 61.98 61.01 1ajw s VAL 70 Cb 0.01 -2.10 0.01 0.00 0.00 0.00 0.00 36.38 34.30 1ajw s VAL 70 CO 0.07 0.56 0.26 -0.69 0.00 0.00 0.00 175.10 175.30 1ajw s VAL 71 N -0.13 0.08 -0.31 2.92 1.01 -1.23 -4.78 120.40 117.97 1ajw s VAL 71 Ca -0.02 -0.67 -0.29 0.00 0.00 0.00 0.00 61.98 60.99 1ajw s VAL 71 Cb -0.14 -0.77 -0.01 0.00 0.00 0.00 0.00 36.38 35.46 1ajw s VAL 71 CO 0.04 -0.37 1.56 -0.69 0.00 0.00 0.00 175.10 175.63 1ajw s VAL 72 N -2.03 3.76 -0.03 2.92 1.01 -1.26 -3.29 120.40 121.47 1ajw s VAL 72 Ca -0.09 0.82 -0.25 0.00 0.00 0.00 0.00 61.98 62.46 1ajw s VAL 72 Cb -0.03 -3.89 -0.19 0.00 0.00 0.00 0.00 36.38 32.26 1ajw s VAL 72 CO -0.00 -0.48 1.15 0.71 0.00 0.00 0.00 175.10 176.48 1ajw h THR 73 N 6.37 1.25 -3.84 3.92 1.35 0.53 -3.40 112.91 119.10 1ajw h THR 73 Ca -0.31 -1.18 -0.23 0.00 -0.55 0.00 0.00 66.41 64.15 1ajw h THR 73 Cb 1.14 2.00 -0.05 0.00 -1.73 0.00 0.00 68.15 69.50 1ajw h THR 73 CO 1.04 0.29 -0.05 -0.13 -0.25 0.00 0.00 175.52 176.41 1ajw s ARG 74 N -3.98 2.07 -0.12 4.72 0.52 -1.19 -3.07 118.95 117.90 1ajw s ARG 74 Ca -0.15 -1.73 -0.05 0.00 -0.52 0.00 0.00 55.73 53.28 1ajw s ARG 74 Cb 0.01 0.50 0.06 0.00 0.52 0.00 0.00 34.95 36.04 1ajw s ARG 74 CO 0.62 -0.90 0.25 -1.17 0.02 0.00 0.00 175.30 174.13 1ajw s LEU 75 N -3.22 -0.19 0.31 2.53 0.20 -0.91 -2.50 118.68 114.91 1ajw s LEU 75 Ca 0.27 0.55 0.08 0.00 0.69 0.00 0.00 54.13 55.72 1ajw s LEU 75 Cb -0.02 0.65 -0.04 0.00 -0.43 0.00 0.00 46.19 46.35 1ajw s LEU 75 CO 0.19 -0.23 0.16 -0.89 -0.29 0.00 0.00 176.35 175.29 1ajw s THR 76 N 2.26 3.43 -0.20 3.68 2.01 -0.86 -0.49 115.64 125.47 1ajw s THR 76 Ca 0.00 -1.62 -0.04 0.00 0.31 0.00 0.00 61.69 60.34 1ajw s THR 76 Cb -0.12 -3.07 0.10 0.00 0.01 0.00 0.00 72.50 69.43 1ajw s THR 76 CO -0.08 -0.24 0.31 -0.76 -0.69 0.00 0.00 174.62 173.16 1ajw s LEU 77 N -3.85 -0.41 0.31 4.42 1.43 -1.07 -3.00 118.68 116.51 1ajw s LEU 77 Ca 0.37 0.30 0.06 0.00 -1.03 0.00 0.00 54.13 53.82 1ajw s LEU 77 Cb -0.05 0.84 -0.06 0.00 0.03 0.00 0.00 46.19 46.95 1ajw s LEU 77 CO 0.23 -0.28 -0.01 -0.69 0.23 0.00 0.00 176.35 175.83 1ajw s VAL 78 N 2.46 1.52 0.00 -1.59 1.01 -1.16 -3.14 120.40 119.51 1ajw s VAL 78 Ca 0.06 -2.06 0.00 0.00 0.00 0.00 0.00 61.98 59.98 1ajw s VAL 78 Cb -0.14 -2.64 0.00 0.00 0.00 0.00 0.00 36.38 33.60 1ajw s VAL 78 CO -0.12 -0.16 0.00 0.00 0.00 0.00 0.00 175.10 174.82 1ajw n SER 80 N -2.25 0.00 -2.04 0.00 3.41 -1.26 -4.88 113.62 106.61 1ajw n SER 80 Ca 0.00 0.00 -0.23 0.00 -0.26 0.00 0.00 58.87 58.38 1ajw n SER 80 Cb 0.00 0.18 0.14 0.00 -0.26 0.00 0.00 64.21 64.27 1ajw n SER 80 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 1ajw n THR 81 N -1.77 3.16 -1.88 6.66 -2.24 -1.26 -5.00 114.28 111.94 1ajw n THR 81 Ca 0.00 -2.54 -0.29 0.00 -2.27 0.00 0.00 64.05 58.94 1ajw n THR 81 Cb 0.00 -0.69 0.13 0.00 -2.10 0.00 0.00 70.33 67.67 1ajw n THR 81 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1ajw s ALA 82 N -3.47 2.45 0.21 6.98 0.00 -1.26 -4.59 121.76 122.08 1ajw s ALA 82 Ca 0.56 -0.83 0.15 0.00 0.00 0.00 0.00 51.96 51.84 1ajw s ALA 82 Cb 0.47 -2.90 0.55 0.00 0.00 0.00 0.00 23.12 21.24 1ajw s ALA 82 CO 0.05 -1.99 1.68 -1.00 0.00 0.00 0.00 175.76 174.51 1ajw h PRO 83 N -1.29 0.00 0.00 0.00 0.13 -1.95 -3.49 132.00 125.40 1ajw h PRO 83 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 1ajw h PRO 83 Cb 1.30 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.43 1ajw h PRO 83 CO 0.56 0.47 0.00 0.41 -0.23 0.00 0.00 178.00 179.21 1ajw n GLY 84 N 0.23 1.89 3.55 1.56 0.00 -1.26 -5.06 105.19 106.10 1ajw n GLY 84 Ca -0.01 -1.10 -0.37 0.00 0.00 0.00 0.00 46.02 44.54 1ajw n GLY 84 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1ajw s PRO 85 N -2.00 2.76 0.03 1.61 0.04 -1.26 -4.81 135.00 131.37 1ajw s PRO 85 Ca 0.00 0.22 -0.30 0.00 0.04 0.00 0.00 61.00 60.96 1ajw s PRO 85 Cb 0.00 -4.52 -0.08 0.00 0.04 0.00 0.00 34.50 29.95 1ajw s PRO 85 CO 0.00 -2.72 1.71 -0.51 0.04 0.00 0.00 177.00 175.51 1ajw s LEU 86 N 8.48 4.36 -0.34 -3.56 1.02 -1.19 -4.63 118.68 122.84 1ajw s LEU 86 Ca 0.61 2.44 -0.10 0.00 0.02 0.00 0.00 54.13 57.11 1ajw s LEU 86 Cb -0.10 -3.55 0.01 0.00 0.02 0.00 0.00 46.19 42.57 1ajw s LEU 86 CO 0.14 -0.93 0.16 -0.70 0.02 0.00 0.00 176.35 175.05 1ajw s GLU 87 N 3.37 3.05 -0.14 1.70 2.12 -1.26 -2.59 118.70 124.95 1ajw s GLU 87 Ca 0.76 -0.91 -0.14 0.00 0.36 0.00 0.00 54.97 55.03 1ajw s GLU 87 Cb -0.38 -3.60 -0.05 0.00 0.26 0.00 0.00 34.13 30.36 1ajw s GLU 87 CO 0.33 -0.55 0.33 -0.51 -0.54 0.00 0.00 175.26 174.32 1ajw s LEU 88 N 1.56 4.27 0.16 2.70 1.43 0.36 -4.90 118.68 124.27 1ajw s LEU 88 Ca 0.03 0.60 -0.30 0.00 -1.03 0.00 0.00 54.13 53.43 1ajw s LEU 88 Cb -0.18 -2.44 -0.07 0.00 0.03 0.00 0.00 46.19 43.53 1ajw s LEU 88 CO 0.06 0.11 1.10 -0.62 0.23 0.00 0.00 176.35 177.23 1ajw s ASP 89 N 0.32 7.26 -0.38 2.29 -1.08 -1.26 -2.14 116.67 121.68 1ajw s ASP 89 Ca 0.19 2.07 0.13 0.00 -0.52 0.00 0.00 52.55 54.42 1ajw s ASP 89 Cb -0.14 -2.60 0.40 0.00 -1.46 0.00 0.00 42.92 39.13 1ajw s ASP 89 CO 0.06 -0.24 0.89 0.18 0.52 0.00 0.00 175.17 176.58 1ajw n LEU 90 N 2.52 1.92 -2.57 -1.34 4.77 -1.17 -4.70 117.00 116.42 1ajw n LEU 90 Ca 0.03 -4.55 -0.18 0.00 -0.03 0.00 0.00 56.01 51.28 1ajw n LEU 90 Cb 0.46 0.33 0.02 0.00 -2.33 0.00 0.00 43.42 41.90 1ajw n LEU 90 CO 0.54 1.98 0.03 0.35 -1.33 0.00 0.00 177.39 178.96 1ajw n THR 91 N -0.01 1.67 0.00 -5.08 -2.24 -1.26 -4.38 114.28 102.99 1ajw n THR 91 Ca 0.21 -3.97 0.00 0.00 -2.27 0.00 0.00 64.05 58.02 1ajw n THR 91 Cb 0.70 -0.27 0.00 0.00 -2.10 0.00 0.00 70.33 68.66 1ajw n THR 91 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ajw n GLY 92 N -0.27 2.81 2.77 3.38 0.00 -1.26 -4.90 105.19 107.72 1ajw n GLY 92 Ca 0.24 -0.70 -0.32 0.00 0.00 0.00 0.00 46.02 45.24 1ajw n GLY 92 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1ajw n ASP 93 N 2.37 4.25 -0.72 1.61 -0.08 -1.26 -4.44 116.55 118.28 1ajw n ASP 93 Ca 0.00 -2.50 0.13 0.00 -1.51 0.00 0.00 54.79 50.91 1ajw n ASP 93 Cb 0.00 -1.18 0.30 0.00 2.34 0.00 0.00 41.12 42.59 1ajw n ASP 93 CO 0.00 0.00 0.00 0.18 0.12 0.00 0.00 177.20 177.50 1ajw n LEU 94 N 5.47 2.26 0.27 -2.67 4.77 -1.26 -4.28 117.00 121.55 1ajw n LEU 94 Ca 0.49 -0.75 0.17 0.00 -0.03 0.00 0.00 56.01 55.89 1ajw n LEU 94 Cb 0.25 -0.00 0.92 0.00 -2.33 0.00 0.00 43.42 42.26 1ajw n LEU 94 CO 0.85 0.38 1.14 -0.33 -1.33 0.00 0.00 177.39 178.10 1ajw h GLU 95 N 3.53 0.00 0.00 3.23 5.08 -1.96 -0.02 114.58 124.45 1ajw h GLU 95 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1ajw h GLU 95 Cb 0.75 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.00 1ajw h GLU 95 CO 0.00 0.00 0.00 0.45 -1.00 0.00 0.00 179.01 178.46 1ajw n SER 96 N -3.66 0.00 0.12 1.42 2.88 -1.26 -3.14 113.62 109.98 1ajw n SER 96 Ca -0.01 0.11 -0.22 0.00 -1.33 0.00 0.00 58.87 57.41 1ajw n SER 96 Cb 0.20 -0.33 -0.15 0.00 -0.75 0.00 0.00 64.21 63.18 1ajw n SER 96 CO 0.00 0.00 0.00 -0.26 -1.23 0.00 0.00 175.04 173.55 1ajw h PHE 97 N 0.00 0.81 0.00 0.66 -1.00 -1.29 -3.24 116.94 112.88 1ajw h PHE 97 Ca 0.00 -0.59 -0.00 0.00 2.81 0.00 0.00 57.97 60.18 1ajw h PHE 97 Cb 0.21 -0.03 -0.00 0.00 3.61 0.00 0.00 35.95 39.74 1ajw h PHE 97 CO 0.00 1.52 -0.01 1.57 -1.61 0.00 0.00 178.31 179.78 1ajw h LYS 98 N 0.12 0.00 -0.73 1.51 2.10 -1.70 -3.06 116.57 114.81 1ajw h LYS 98 Ca -0.25 0.00 -0.51 0.00 -2.00 0.00 0.00 60.65 57.89 1ajw h LYS 98 Cb 2.12 0.00 -0.34 0.00 -0.90 0.00 0.00 32.23 33.11 1ajw h LYS 98 CO 0.24 0.01 -0.31 0.36 -2.00 0.00 0.00 179.45 177.75 1ajw n LYS 99 N -3.11 3.08 -3.57 0.07 2.85 -1.24 -5.00 118.16 111.24 1ajw n LYS 99 Ca 0.00 -3.80 -0.10 0.00 -1.05 0.00 0.00 58.31 53.37 1ajw n LYS 99 Cb 0.30 -2.19 -0.05 0.00 -0.65 0.00 0.00 35.03 32.44 1ajw n LYS 99 CO 0.00 0.00 0.00 -1.14 -0.05 0.00 0.00 177.40 176.21 1ajw s GLN 100 N -3.59 0.60 0.00 -1.58 0.74 -1.16 -5.03 119.66 109.64 1ajw s GLN 100 Ca 0.53 0.08 0.00 0.00 0.05 0.00 0.00 55.36 56.02 1ajw s GLN 100 Cb 0.43 0.28 0.00 0.00 1.10 0.00 0.00 33.01 34.83 1ajw s GLN 100 CO 0.02 -0.20 0.00 -1.13 -0.55 0.00 0.00 175.29 173.43 1ajw n SER 101 N 0.57 1.12 -3.96 6.67 3.41 -1.26 -4.00 113.62 116.18 1ajw n SER 101 Ca -0.09 -0.95 -0.30 0.00 -0.26 0.00 0.00 58.87 57.26 1ajw n SER 101 Cb 0.58 0.00 -0.16 0.00 -0.26 0.00 0.00 64.21 64.38 1ajw n SER 101 CO 0.00 0.00 0.00 -0.36 -0.16 0.00 0.00 175.04 174.52 1ajw s PHE 102 N -1.36 2.41 0.58 7.33 0.40 0.13 -4.89 117.98 122.58 1ajw s PHE 102 Ca 0.00 -1.71 -0.21 0.00 -0.60 0.00 0.00 56.93 54.42 1ajw s PHE 102 Cb 0.00 -1.60 -0.04 0.00 0.51 0.00 0.00 43.02 41.89 1ajw s PHE 102 CO 0.00 -0.76 1.30 0.28 0.70 0.00 0.00 175.22 176.74 1ajw n VAL 103 N 4.67 4.10 -3.60 -0.44 0.31 -1.26 -0.95 118.33 121.16 1ajw n VAL 103 Ca -0.13 -0.50 -0.11 0.00 -0.01 0.00 0.00 64.34 63.60 1ajw n VAL 103 Cb 0.45 -1.56 -0.06 0.00 -0.91 0.00 0.00 33.84 31.75 1ajw n VAL 103 CO 0.00 0.00 0.00 -0.22 -1.32 0.00 0.00 176.83 175.29 1ajw s LEU 104 N -3.48 -0.44 0.55 7.52 0.20 -0.38 -4.83 118.68 117.82 1ajw s LEU 104 Ca 0.75 0.68 -0.15 0.00 0.69 0.00 0.00 54.13 56.10 1ajw s LEU 104 Cb -0.41 1.95 -0.06 0.00 -0.43 0.00 0.00 46.19 47.24 1ajw s LEU 104 CO 0.47 -0.27 1.01 -0.75 -0.29 0.00 0.00 176.35 176.52 1ajw s LYS 105 N -0.45 3.72 0.00 1.98 2.20 -1.26 -0.87 119.74 125.06 1ajw s LYS 105 Ca -0.00 0.98 0.00 0.00 -0.36 0.00 0.00 55.97 56.58 1ajw s LYS 105 Cb -0.03 -2.10 0.00 0.00 -1.51 0.00 0.00 37.83 34.19 1ajw s LYS 105 CO -0.01 -0.46 0.00 0.39 -0.36 0.00 0.00 175.35 174.90 1ajw n GLU 106 N -1.92 0.00 -3.22 4.03 4.71 -1.17 -3.53 120.64 119.55 1ajw n GLU 106 Ca 0.07 0.00 -0.24 0.00 -0.01 0.00 0.00 57.16 56.98 1ajw n GLU 106 Cb 0.54 0.00 -0.06 0.00 -1.01 0.00 0.00 31.44 30.91 1ajw n GLU 106 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1ajw n GLY 107 N -0.10 3.58 3.82 0.62 0.00 0.66 -3.23 105.19 110.54 1ajw n GLY 107 Ca 0.00 -1.91 -0.32 0.00 0.00 0.00 0.00 46.02 43.79 1ajw n GLY 107 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1ajw s VAL 108 N -1.91 4.11 -0.98 1.61 -7.23 -1.23 -4.05 120.40 110.71 1ajw s VAL 108 Ca 0.38 0.81 -0.20 0.00 -1.81 0.00 0.00 61.98 61.16 1ajw s VAL 108 Cb 0.21 -3.49 0.10 0.00 0.56 0.00 0.00 36.38 33.76 1ajw s VAL 108 CO -0.09 -0.77 1.28 -1.61 -0.31 0.00 0.00 175.10 173.60 1ajw s GLU 109 N -4.66 3.62 -0.08 4.82 8.01 -1.25 -3.01 118.70 126.14 1ajw s GLU 109 Ca 0.59 -1.53 -0.00 0.00 0.01 0.00 0.00 54.97 54.04 1ajw s GLU 109 Cb -0.14 -5.11 -0.03 0.00 -4.31 0.00 0.00 34.13 24.54 1ajw s GLU 109 CO 0.47 -1.96 -0.04 1.52 0.01 0.00 0.00 175.26 175.25 1ajw s TYR 110 N 3.61 3.01 0.33 1.61 -0.85 0.20 -4.65 117.35 120.62 1ajw s TYR 110 Ca 0.39 0.04 0.07 0.00 -0.52 0.00 0.00 57.07 57.05 1ajw s TYR 110 Cb -0.03 -1.76 -0.03 0.00 0.38 0.00 0.00 41.96 40.53 1ajw s TYR 110 CO -0.09 0.33 0.30 -0.98 -1.52 0.00 0.00 175.55 173.59 1ajw s ARG 111 N -0.70 2.74 0.10 -3.49 1.70 -0.77 0.12 118.95 118.65 1ajw s ARG 111 Ca 0.11 -1.28 0.08 0.00 -0.47 0.00 0.00 55.73 54.16 1ajw s ARG 111 Cb -0.11 -2.49 -0.03 0.00 -0.57 0.00 0.00 34.95 31.74 1ajw s ARG 111 CO 0.02 0.10 -0.19 0.42 -1.08 0.00 0.00 175.30 174.56 1ajw s ILE 112 N -2.30 1.58 -0.25 4.99 1.01 -1.21 -2.99 121.20 122.02 1ajw s ILE 112 Ca 0.41 -1.49 0.01 0.00 0.00 0.00 0.00 60.65 59.58 1ajw s ILE 112 Cb -0.06 -1.45 0.07 0.00 0.01 0.00 0.00 42.46 41.03 1ajw s ILE 112 CO 0.27 -0.10 -0.03 -0.75 0.00 0.00 0.00 174.94 174.33 1ajw s LYS 113 N -1.87 1.55 0.26 2.79 2.20 -1.16 0.72 119.74 124.22 1ajw s LYS 113 Ca 0.04 -1.11 -0.05 0.00 -0.36 0.00 0.00 55.97 54.50 1ajw s LYS 113 Cb -0.10 -2.61 -0.05 0.00 -1.51 0.00 0.00 37.83 33.55 1ajw s LYS 113 CO 0.04 -0.67 0.53 0.42 -0.36 0.00 0.00 175.35 175.30 1ajw s ILE 114 N 1.35 5.04 -0.00 5.43 -1.09 -1.10 -2.04 121.20 128.79 1ajw s ILE 114 Ca -0.03 0.08 0.04 0.00 -2.23 0.00 0.00 60.65 58.51 1ajw s ILE 114 Cb -0.19 -3.71 -0.01 0.00 -1.58 0.00 0.00 42.46 36.97 1ajw s ILE 114 CO -0.08 -0.25 -0.12 -0.44 -1.23 0.00 0.00 174.94 172.82 1ajw s SER 115 N -2.99 1.39 -0.15 3.58 0.01 -1.04 0.45 113.70 114.95 1ajw s SER 115 Ca 0.44 -0.25 -0.29 0.00 1.31 0.00 0.00 55.95 57.16 1ajw s SER 115 Cb -0.11 -0.14 0.10 0.00 0.21 0.00 0.00 66.02 66.08 1ajw s SER 115 CO 0.28 0.12 0.85 0.72 0.41 0.00 0.00 173.24 175.63 1ajw s PHE 116 N -0.37 -0.54 0.29 2.43 -0.12 -1.19 0.11 117.98 118.59 1ajw s PHE 116 Ca 0.04 1.03 0.10 0.00 -0.05 0.00 0.00 56.93 58.04 1ajw s PHE 116 Cb -0.05 0.40 -0.05 0.00 -0.63 0.00 0.00 43.02 42.70 1ajw s PHE 116 CO -0.00 -0.43 -0.02 -0.98 -0.05 0.00 0.00 175.22 173.74 1ajw s ARG 117 N -0.80 2.16 -0.12 1.99 1.04 -1.21 0.14 118.95 122.16 1ajw s ARG 117 Ca -0.04 -1.56 -0.01 0.00 -1.04 0.00 0.00 55.73 53.08 1ajw s ARG 117 Cb -0.01 -2.05 0.04 0.00 -2.04 0.00 0.00 34.95 30.88 1ajw s ARG 117 CO 0.04 0.28 -0.02 0.08 -0.04 0.00 0.00 175.30 175.64 1ajw s VAL 118 N -2.41 0.65 -0.35 4.99 1.01 -1.21 -3.54 120.40 119.55 1ajw s VAL 118 Ca 0.33 -0.22 0.12 0.00 0.00 0.00 0.00 61.98 62.20 1ajw s VAL 118 Cb -0.04 -0.86 0.45 0.00 0.00 0.00 0.00 36.38 35.93 1ajw s VAL 118 CO 0.19 0.17 1.08 -0.46 0.00 0.00 0.00 175.10 176.08 1ajw n ASN 119 N 5.04 3.35 0.04 3.32 0.23 -1.18 -3.85 115.26 122.22 1ajw n ASN 119 Ca -0.09 -3.19 0.00 0.00 -0.53 0.00 0.00 54.58 50.77 1ajw n ASN 119 Cb 0.49 -0.46 0.00 0.00 -2.08 0.00 0.00 39.78 37.73 1ajw n ASN 119 CO 0.00 0.00 0.00 -1.14 -0.93 0.00 0.00 177.26 175.19 1ajw n ARG 120 N -0.42 0.00 -4.19 -3.83 0.00 -1.26 -4.95 116.66 102.00 1ajw n ARG 120 Ca 0.27 0.00 -0.17 0.00 -0.00 0.00 0.00 57.85 57.94 1ajw n ARG 120 Cb 0.78 0.00 -0.06 0.00 0.00 0.00 0.00 32.46 33.18 1ajw n ARG 120 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.63 176.42 1ajw s GLU 121 N -1.21 1.84 -0.50 -0.14 2.02 -1.26 -4.84 118.70 114.61 1ajw s GLU 121 Ca 0.00 -1.91 -0.29 0.00 0.02 0.00 0.00 54.97 52.79 1ajw s GLU 121 Cb 0.00 0.38 0.03 0.00 0.10 0.00 0.00 34.13 34.64 1ajw s GLU 121 CO 0.00 -0.72 1.14 0.42 0.02 0.00 0.00 175.26 176.12 1ajw s ILE 122 N -3.24 4.18 -1.11 -1.63 1.09 -1.26 -3.83 121.20 115.40 1ajw s ILE 122 Ca 0.36 1.15 -0.14 0.00 -1.10 0.00 0.00 60.65 60.92 1ajw s ILE 122 Cb 0.01 -4.62 0.18 0.00 -1.06 0.00 0.00 42.46 36.96 1ajw s ILE 122 CO 0.24 -1.07 1.28 -0.69 -0.10 0.00 0.00 174.94 174.61 1ajw s VAL 123 N 4.53 5.11 -0.51 2.92 1.01 -0.66 -4.90 120.40 127.89 1ajw s VAL 123 Ca 0.47 -2.47 -0.25 0.00 0.00 0.00 0.00 61.98 59.72 1ajw s VAL 123 Cb -0.07 -4.82 0.03 0.00 0.00 0.00 0.00 36.38 31.52 1ajw s VAL 123 CO 0.31 -1.51 0.96 -0.94 0.00 0.00 0.00 175.10 173.92 1ajw s SER 124 N 2.80 6.42 0.00 3.32 1.04 -1.26 -3.11 113.70 122.91 1ajw s SER 124 Ca 0.37 -0.09 0.00 0.00 0.48 0.00 0.00 55.95 56.72 1ajw s SER 124 Cb -0.05 -2.46 0.00 0.00 0.10 0.00 0.00 66.02 63.62 1ajw s SER 124 CO -0.04 -1.17 0.00 0.61 0.98 0.00 0.00 173.24 173.62 1ajw n GLY 125 N 5.03 0.88 3.75 7.32 0.00 -1.26 -4.79 105.19 116.12 1ajw n GLY 125 Ca 0.05 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.66 1ajw n GLY 125 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1ajw s MET 126 N 0.00 4.71 0.23 1.61 1.75 -1.18 0.62 119.30 127.03 1ajw s MET 126 Ca 0.00 1.36 0.01 0.00 -1.25 0.00 0.00 55.69 55.81 1ajw s MET 126 Cb 0.00 -3.31 -0.04 0.00 2.84 0.00 0.00 34.83 34.32 1ajw s MET 126 CO 0.00 0.42 0.16 -1.59 -0.65 0.00 0.00 175.02 173.36 1ajw s LYS 127 N -0.72 1.33 -0.14 4.11 -2.85 0.48 0.10 119.74 122.06 1ajw s LYS 127 Ca 0.41 -1.72 -0.01 0.00 -1.00 0.00 0.00 55.97 53.65 1ajw s LYS 127 Cb -0.24 0.22 0.03 0.00 -2.06 0.00 0.00 37.83 35.79 1ajw s LYS 127 CO 0.29 -0.43 -0.06 -0.47 0.10 0.00 0.00 175.35 174.78 1ajw s TYR 128 N -3.98 1.55 0.51 1.78 5.04 0.28 -2.84 117.35 119.70 1ajw s TYR 128 Ca 0.39 -0.88 -0.01 0.00 -2.44 0.00 0.00 57.07 54.13 1ajw s TYR 128 Cb 0.06 -1.26 0.01 0.00 0.35 0.00 0.00 41.96 41.12 1ajw s TYR 128 CO 0.15 -0.56 0.76 0.42 -1.34 0.00 0.00 175.55 174.98 1ajw s ILE 129 N 1.68 3.61 -0.30 3.14 -1.09 -1.14 0.10 121.20 127.21 1ajw s ILE 129 Ca 0.03 -0.40 -0.15 0.00 -2.23 0.00 0.00 60.65 57.90 1ajw s ILE 129 Cb -0.14 -3.37 0.15 0.00 -1.58 0.00 0.00 42.46 37.53 1ajw s ILE 129 CO -0.08 -0.29 0.94 -1.58 -1.23 0.00 0.00 174.94 172.69 1ajw s GLN 130 N -4.72 0.37 -0.23 2.79 0.74 0.25 -2.55 119.66 116.31 1ajw s GLN 130 Ca 0.52 0.80 -0.03 0.00 0.05 0.00 0.00 55.36 56.70 1ajw s GLN 130 Cb -0.10 0.34 0.01 0.00 1.10 0.00 0.00 33.01 34.36 1ajw s GLN 130 CO 0.40 -0.11 -0.06 -1.01 -0.55 0.00 0.00 175.29 173.96 1ajw s HIS 131 N 2.06 2.99 -1.08 1.67 3.76 0.20 0.87 115.29 125.76 1ajw s HIS 131 Ca -0.06 -1.26 -0.23 0.00 -0.15 0.00 0.00 55.06 53.36 1ajw s HIS 131 Cb -0.06 -2.07 -0.04 0.00 1.11 0.00 0.00 32.58 31.52 1ajw s HIS 131 CO -0.17 -0.65 1.87 0.99 -0.85 0.00 0.00 174.74 175.93 1ajw s THR 132 N 1.40 3.61 0.04 1.30 2.01 0.29 -0.70 115.64 123.59 1ajw s THR 132 Ca 0.03 -0.83 -0.22 0.00 0.31 0.00 0.00 61.69 60.99 1ajw s THR 132 Cb -0.15 -4.49 -0.06 0.00 0.01 0.00 0.00 72.50 67.81 1ajw s THR 132 CO -0.05 -1.18 0.65 -0.31 -0.69 0.00 0.00 174.62 173.04 1ajw s TYR 133 N 9.36 3.75 -0.25 4.92 1.51 0.29 -2.25 117.35 134.66 1ajw s TYR 133 Ca 0.65 1.33 0.03 0.00 -1.01 0.00 0.00 57.07 58.07 1ajw s TYR 133 Cb -0.02 -2.66 0.06 0.00 -0.11 0.00 0.00 41.96 39.23 1ajw s TYR 133 CO 0.06 0.40 -0.11 0.50 -1.11 0.00 0.00 175.55 175.28 1ajw s ARG 134 N -0.44 2.24 -0.85 -0.62 3.52 -0.91 -0.67 118.95 121.20 1ajw s ARG 134 Ca 0.33 -1.29 -0.08 0.00 -0.13 0.00 0.00 55.73 54.56 1ajw s ARG 134 Cb -0.20 -2.85 0.08 0.00 -1.56 0.00 0.00 34.95 30.42 1ajw s ARG 134 CO 0.20 -0.55 0.19 0.36 -0.81 0.00 0.00 175.30 174.69 1ajw n LYS 135 N 4.46 -0.90 -0.79 5.12 -0.00 -1.26 0.12 118.16 124.91 1ajw n LYS 135 Ca -0.14 0.06 0.00 0.00 -0.00 0.00 0.00 58.31 58.23 1ajw n LYS 135 Cb 0.43 -2.08 0.00 0.00 -0.00 0.00 0.00 35.03 33.37 1ajw n LYS 135 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1ajw n GLY 136 N -1.12 1.24 2.63 2.58 0.00 -1.26 -5.06 105.19 104.21 1ajw n GLY 136 Ca -0.02 -0.29 -0.16 0.00 0.00 0.00 0.00 46.02 45.56 1ajw n GLY 136 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ajw s VAL 137 N -2.15 -0.31 0.04 1.61 1.01 0.31 -5.11 120.40 115.80 1ajw s VAL 137 Ca 0.00 -1.60 -0.30 0.00 0.00 0.00 0.00 61.98 60.08 1ajw s VAL 137 Cb 0.00 -0.65 -0.08 0.00 0.00 0.00 0.00 36.38 35.64 1ajw s VAL 137 CO 0.00 -0.63 1.83 -0.75 0.00 0.00 0.00 175.10 175.55 1ajw s LYS 138 N 0.73 4.16 -0.16 2.72 2.20 -1.26 -2.15 119.74 125.97 1ajw s LYS 138 Ca 0.27 2.48 0.12 0.00 -0.36 0.00 0.00 55.97 58.49 1ajw s LYS 138 Cb -0.03 -3.92 -0.19 0.00 -1.51 0.00 0.00 37.83 32.18 1ajw s LYS 138 CO -0.10 -0.88 0.02 0.44 -0.36 0.00 0.00 175.35 174.47 1ajw n ILE 139 N 5.24 1.10 -3.61 5.43 -5.35 -0.96 -4.95 119.36 116.26 1ajw n ILE 139 Ca 0.18 -0.64 -0.06 0.00 -0.27 0.00 0.00 62.75 61.96 1ajw n ILE 139 Cb 0.41 -0.67 -0.05 0.00 -1.74 0.00 0.00 39.64 37.59 1ajw n ILE 139 CO 0.00 0.00 0.00 1.51 -1.76 0.00 0.00 176.55 176.30 1ajw s ASP 140 N -5.11 -0.19 0.08 7.28 1.47 -1.25 -5.03 116.67 113.92 1ajw s ASP 140 Ca -0.11 0.21 0.05 0.00 1.18 0.00 0.00 52.55 53.89 1ajw s ASP 140 Cb 0.05 0.16 -0.03 0.00 -0.34 0.00 0.00 42.92 42.76 1ajw s ASP 140 CO 0.62 -0.17 -0.14 -1.59 0.68 0.00 0.00 175.17 174.57 1ajw s LYS 141 N -1.02 0.84 0.13 2.11 0.00 -1.26 0.10 119.74 120.65 1ajw s LYS 141 Ca 0.04 -0.99 0.04 0.00 0.00 0.00 0.00 55.97 55.05 1ajw s LYS 141 Cb -0.01 -0.83 -0.04 0.00 0.00 0.00 0.00 37.83 36.95 1ajw s LYS 141 CO -0.04 0.18 -0.09 0.99 0.00 0.00 0.00 175.35 176.39 1ajw s THR 142 N -1.41 1.03 -0.02 3.79 2.01 0.25 -4.95 115.64 116.34 1ajw s THR 142 Ca -0.00 -2.01 0.05 0.00 0.31 0.00 0.00 61.69 60.04 1ajw s THR 142 Cb -0.09 -1.78 -0.01 0.00 0.01 0.00 0.00 72.50 70.63 1ajw s THR 142 CO 0.02 -0.78 -0.18 1.51 -0.69 0.00 0.00 174.62 174.51 1ajw s ASP 143 N -3.10 2.14 -0.22 3.53 1.47 -1.26 -0.59 116.67 118.64 1ajw s ASP 143 Ca 0.15 -0.34 0.02 0.00 1.18 0.00 0.00 52.55 53.56 1ajw s ASP 143 Cb 0.03 -0.33 0.05 0.00 -0.34 0.00 0.00 42.92 42.33 1ajw s ASP 143 CO -0.01 0.21 -0.11 -0.31 0.68 0.00 0.00 175.17 175.63 1ajw s TYR 144 N -0.31 2.73 0.28 2.11 1.51 0.28 -4.89 117.35 119.05 1ajw s TYR 144 Ca 0.04 -1.85 -0.29 0.00 -1.01 0.00 0.00 57.07 53.95 1ajw s TYR 144 Cb -0.08 -1.76 -0.10 0.00 -0.11 0.00 0.00 41.96 39.92 1ajw s TYR 144 CO 0.00 -0.80 1.29 1.41 -1.11 0.00 0.00 175.55 176.34 1ajw s MET 145 N 1.29 4.40 -0.03 -0.62 1.75 -1.26 0.10 119.30 124.93 1ajw s MET 145 Ca -0.04 2.11 -0.03 0.00 -1.25 0.00 0.00 55.69 56.49 1ajw s MET 145 Cb -0.17 -3.13 -0.01 0.00 2.84 0.00 0.00 34.83 34.36 1ajw s MET 145 CO -0.07 -0.17 -0.05 0.28 -0.65 0.00 0.00 175.02 174.36 1ajw n VAL 146 N 1.54 0.23 0.00 10.11 0.31 0.29 -4.87 118.33 125.95 1ajw n VAL 146 Ca 0.02 0.45 0.00 0.00 -0.01 0.00 0.00 64.34 64.80 1ajw n VAL 146 Cb 0.42 -1.64 0.00 0.00 -0.91 0.00 0.00 33.84 31.72 1ajw n VAL 146 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1ajw n GLY 147 N 1.54 0.72 3.87 2.92 0.00 -1.15 -4.98 105.19 108.11 1ajw n GLY 147 Ca -0.02 -1.42 -0.31 0.00 0.00 0.00 0.00 46.02 44.27 1ajw n GLY 147 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1ajw s SER 148 N 0.00 6.61 -0.07 1.61 1.04 -1.26 -3.12 113.70 118.52 1ajw s SER 148 Ca 0.00 1.10 -0.11 0.00 0.48 0.00 0.00 55.95 57.42 1ajw s SER 148 Cb 0.00 -2.31 0.02 0.00 0.10 0.00 0.00 66.02 63.84 1ajw s SER 148 CO 0.00 -0.27 0.28 -0.31 0.98 0.00 0.00 173.24 173.92 1ajw s TYR 149 N -2.13 -0.23 0.14 5.02 2.02 -1.18 -4.95 117.35 116.03 1ajw s TYR 149 Ca 0.51 0.51 0.02 0.00 -0.37 0.00 0.00 57.07 57.73 1ajw s TYR 149 Cb -0.10 0.09 -0.04 0.00 -0.40 0.00 0.00 41.96 41.50 1ajw s TYR 149 CO 0.25 -0.25 0.29 0.20 -1.57 0.00 0.00 175.55 174.47 1ajw s GLY 150 N -0.50 1.80 -1.09 0.71 0.00 -1.26 -1.66 107.32 105.31 1ajw s GLY 150 Ca -0.06 -0.97 -0.13 0.00 0.00 0.00 0.00 44.72 43.56 1ajw s GLY 150 CO 0.02 -0.96 2.21 -1.55 0.00 0.00 0.00 173.10 172.82 1ajw n PRO 151 N -0.42 2.31 -1.66 2.90 -0.04 -1.25 -3.79 135.00 133.05 1ajw n PRO 151 Ca -0.06 -1.94 -0.02 0.00 -0.04 0.00 0.00 63.50 61.44 1ajw n PRO 151 Cb 0.53 -2.83 0.03 0.00 -0.04 0.00 0.00 33.50 31.19 1ajw n PRO 151 CO 0.00 0.00 0.00 -2.13 -0.04 0.00 0.00 175.50 173.33 1ajw n ARG 152 N 5.41 0.45 -0.25 0.54 0.63 -1.25 -4.77 116.66 117.42 1ajw n ARG 152 Ca 0.53 -0.52 0.00 0.00 -0.92 0.00 0.00 57.85 56.94 1ajw n ARG 152 Cb 0.29 0.28 0.00 0.00 0.45 0.00 0.00 32.46 33.48 1ajw n ARG 152 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1ajw n ALA 153 N -0.51 1.50 -0.73 5.13 0.00 -1.25 -5.14 120.51 119.52 1ajw n ALA 153 Ca -0.09 -0.59 0.00 0.00 0.00 0.00 0.00 53.44 52.76 1ajw n ALA 153 Cb 0.61 -0.20 0.00 0.00 0.00 0.00 0.00 19.45 19.86 1ajw n ALA 153 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1ajw n GLU 154 N 0.00 0.00 -1.68 0.00 2.13 -1.26 -4.67 120.64 115.16 1ajw n GLU 154 Ca 0.00 0.00 -0.32 0.00 0.66 0.00 0.00 57.16 57.50 1ajw n GLU 154 Cb 0.58 0.00 0.05 0.00 0.27 0.00 0.00 31.44 32.34 1ajw n GLU 154 CO 0.00 0.00 0.00 -1.83 -0.41 0.00 0.00 177.13 174.89 1ajw s GLU 155 N 0.00 2.83 0.51 5.31 -1.05 -1.26 -3.32 118.70 121.72 1ajw s GLU 155 Ca 0.00 1.21 0.03 0.00 -0.15 0.00 0.00 54.97 56.06 1ajw s GLU 155 Cb 0.00 -1.97 -0.00 0.00 -0.44 0.00 0.00 34.13 31.72 1ajw s GLU 155 CO 0.00 -1.20 0.16 0.71 0.95 0.00 0.00 175.26 175.88 1ajw s TYR 156 N -2.64 1.87 -0.36 4.83 2.02 0.38 -4.84 117.35 118.61 1ajw s TYR 156 Ca 0.63 -0.87 -0.00 0.00 -0.37 0.00 0.00 57.07 56.45 1ajw s TYR 156 Cb -0.17 -1.75 0.13 0.00 -0.40 0.00 0.00 41.96 39.76 1ajw s TYR 156 CO 0.46 -0.02 0.19 -1.21 -1.57 0.00 0.00 175.55 173.41 1ajw s GLU 157 N -4.02 0.72 0.76 -0.62 2.02 -1.26 -3.19 118.70 113.12 1ajw s GLU 157 Ca 0.20 -1.36 -0.11 0.00 0.02 0.00 0.00 54.97 53.71 1ajw s GLU 157 Cb 0.01 -1.66 0.06 0.00 0.10 0.00 0.00 34.13 32.63 1ajw s GLU 157 CO 0.12 -1.14 1.13 0.12 0.02 0.00 0.00 175.26 175.51 1ajw s PHE 158 N 1.10 3.06 -0.29 1.61 5.36 0.17 -4.90 117.98 124.10 1ajw s PHE 158 Ca 0.15 0.80 0.03 0.00 -0.96 0.00 0.00 56.93 56.95 1ajw s PHE 158 Cb -0.22 -3.32 0.17 0.00 -0.34 0.00 0.00 43.02 39.32 1ajw s PHE 158 CO -0.08 -1.53 0.46 -1.17 -1.46 0.00 0.00 175.22 171.43 1ajw s LEU 159 N -5.46 -1.02 0.59 6.12 1.98 -1.26 -2.70 118.68 116.94 1ajw s LEU 159 Ca 0.60 -0.18 -0.15 0.00 -2.89 0.00 0.00 54.13 51.52 1ajw s LEU 159 Cb -0.11 1.38 -0.04 0.00 0.66 0.00 0.00 46.19 48.08 1ajw s LEU 159 CO 0.49 -0.34 1.04 0.42 -1.89 0.00 0.00 176.35 176.08 1ajw s THR 160 N 2.63 4.07 0.64 3.68 -4.23 0.22 -4.92 115.64 117.73 1ajw s THR 160 Ca 0.10 0.91 -0.17 0.00 -1.18 0.00 0.00 61.69 61.35 1ajw s THR 160 Cb -0.12 -3.49 -0.01 0.00 1.34 0.00 0.00 72.50 70.22 1ajw s THR 160 CO -0.28 -0.65 1.15 -2.16 -0.54 0.00 0.00 174.62 172.14 1ajw s PRO 161 N -4.31 2.83 -0.17 3.99 0.04 -1.26 -3.34 135.00 132.78 1ajw s PRO 161 Ca 0.61 1.57 -0.30 0.00 0.04 0.00 0.00 61.00 62.92 1ajw s PRO 161 Cb -0.14 -1.94 -0.08 0.00 0.04 0.00 0.00 34.50 32.39 1ajw s PRO 161 CO 0.40 -1.26 2.12 0.00 0.04 0.00 0.00 177.00 178.30 1ajw n MET 162 N -2.11 2.05 -3.76 4.56 0.00 -1.26 -4.42 117.12 112.18 1ajw n MET 162 Ca 0.12 0.64 -0.21 0.00 0.00 0.00 0.00 57.70 58.25 1ajw n MET 162 Cb 0.51 -3.00 -0.01 0.00 0.00 0.00 0.00 33.22 30.71 1ajw n MET 162 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 175.97 173.97 1ajw s GLU 163 N 5.65 3.35 -0.07 3.17 2.56 0.32 -4.62 118.70 129.06 1ajw s GLU 163 Ca 0.99 -0.77 -0.03 0.00 0.00 0.00 0.00 54.97 55.16 1ajw s GLU 163 Cb -0.48 -2.84 -0.04 0.00 2.00 0.00 0.00 34.13 32.78 1ajw s GLU 163 CO 0.41 0.29 0.05 -2.00 -0.56 0.00 0.00 175.26 173.45 1ajw s GLU 164 N -4.08 3.09 0.67 4.30 2.12 -1.26 0.61 118.70 124.16 1ajw s GLU 164 Ca 0.38 -0.37 0.05 0.00 0.36 0.00 0.00 54.97 55.38 1ajw s GLU 164 Cb -0.09 -2.89 0.12 0.00 0.26 0.00 0.00 34.13 31.53 1ajw s GLU 164 CO 0.30 0.70 0.92 0.00 -0.54 0.00 0.00 175.26 176.65 1ajw s ALA 165 N -1.00 4.24 1.00 6.30 0.00 -1.17 -4.94 121.76 126.20 1ajw s ALA 165 Ca 0.16 -2.04 0.00 0.00 0.00 0.00 0.00 51.96 50.08 1ajw s ALA 165 Cb -0.12 -1.69 0.00 0.00 0.00 0.00 0.00 23.12 21.32 1ajw s ALA 165 CO 0.06 -1.26 0.00 -0.35 0.00 0.00 0.00 175.76 174.21 1ajw n PRO 166 N -2.60 1.81 -0.34 0.00 -0.04 -1.20 -4.05 135.00 128.59 1ajw n PRO 166 Ca 0.17 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.63 1ajw n PRO 166 Cb 0.61 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 34.07 1ajw n PRO 166 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 1ajw n LYS 167 N 0.00 2.85 -0.03 0.54 4.76 -1.25 -0.25 118.16 124.78 1ajw n LYS 167 Ca 0.00 0.00 -0.03 0.00 -2.87 0.00 0.00 58.31 55.41 1ajw n LYS 167 Cb 0.00 0.00 -0.01 0.00 -1.84 0.00 0.00 35.03 33.18 1ajw n LYS 167 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1ajw n GLY 168 N 5.00 -0.52 3.75 0.72 0.00 -1.26 -4.09 105.19 108.79 1ajw n GLY 168 Ca 0.00 -0.10 -0.39 0.00 0.00 0.00 0.00 46.02 45.53 1ajw n GLY 168 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1ajw s MET 169 N -1.59 3.22 0.00 1.61 -1.94 -1.26 0.78 119.30 120.11 1ajw s MET 169 Ca -0.09 2.25 0.00 0.00 -1.71 0.00 0.00 55.69 56.14 1ajw s MET 169 Cb 0.01 -2.31 0.00 0.00 2.01 0.00 0.00 34.83 34.54 1ajw s MET 169 CO 0.13 -1.14 0.00 -0.11 -0.01 0.00 0.00 175.02 173.90 1ajw n LEU 170 N -0.92 0.00 0.00 -0.03 -0.00 -1.26 -4.13 117.00 110.66 1ajw n LEU 170 Ca 0.10 0.00 0.10 0.00 -0.00 0.00 0.00 56.01 56.21 1ajw n LEU 170 Cb 0.45 0.00 0.56 0.00 -0.00 0.00 0.00 43.42 44.43 1ajw n LEU 170 CO 0.53 0.00 0.81 0.00 -0.00 0.00 0.00 177.39 178.73 1ajw n ALA 171 N 0.00 2.16 -1.73 1.96 0.00 -1.21 -4.83 120.51 116.86 1ajw n ALA 171 Ca 0.00 -0.11 -0.36 0.00 0.00 0.00 0.00 53.44 52.97 1ajw n ALA 171 Cb 0.00 -1.33 0.03 0.00 0.00 0.00 0.00 19.45 18.15 1ajw n ALA 171 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1ajw s ARG 172 N -2.29 3.01 0.00 0.00 0.52 0.23 -4.78 118.95 115.65 1ajw s ARG 172 Ca 0.25 1.76 0.00 0.00 -0.52 0.00 0.00 55.73 57.22 1ajw s ARG 172 Cb 0.14 -1.94 0.00 0.00 0.52 0.00 0.00 34.95 33.67 1ajw s ARG 172 CO 0.27 -1.16 0.00 0.41 0.02 0.00 0.00 175.30 174.85 1ajw n GLY 173 N 0.39 0.87 3.72 -3.53 0.00 -1.20 -4.93 105.19 100.52 1ajw n GLY 173 Ca 0.13 -2.14 -0.38 0.00 0.00 0.00 0.00 46.02 43.63 1ajw n GLY 173 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1ajw s SER 174 N -0.87 6.67 -0.45 1.61 1.04 -1.26 -0.34 113.70 120.10 1ajw s SER 174 Ca 0.00 0.80 -0.08 0.00 0.48 0.00 0.00 55.95 57.15 1ajw s SER 174 Cb 0.00 -2.28 0.11 0.00 0.10 0.00 0.00 66.02 63.95 1ajw s SER 174 CO 0.00 -0.00 0.30 -0.31 0.98 0.00 0.00 173.24 174.21 1ajw s TYR 175 N 0.66 3.44 0.07 5.02 1.51 0.50 -4.55 117.35 123.99 1ajw s TYR 175 Ca 0.26 -1.90 -0.31 0.00 -1.01 0.00 0.00 57.07 54.11 1ajw s TYR 175 Cb -0.15 -3.32 -0.08 0.00 -0.11 0.00 0.00 41.96 38.29 1ajw s TYR 175 CO 0.10 -0.96 1.64 1.21 -1.11 0.00 0.00 175.55 176.43 1ajw s ASN 176 N 2.40 6.61 -0.10 2.29 2.47 0.15 -0.29 114.94 128.46 1ajw s ASN 176 Ca 0.05 2.47 0.02 0.00 0.42 0.00 0.00 52.86 55.83 1ajw s ASN 176 Cb -0.25 -2.56 -0.01 0.00 -1.45 0.00 0.00 41.25 36.98 1ajw s ASN 176 CO -0.01 -0.88 -0.17 -0.63 -3.72 0.00 0.00 177.10 171.69 1ajw s ILE 177 N 2.63 2.74 -0.44 -5.21 1.01 0.14 0.10 121.20 122.17 1ajw s ILE 177 Ca 0.74 -0.79 -0.14 0.00 0.00 0.00 0.00 60.65 60.46 1ajw s ILE 177 Cb -0.39 -2.10 0.06 0.00 0.01 0.00 0.00 42.46 40.03 1ajw s ILE 177 CO 0.32 0.55 0.33 -0.75 0.00 0.00 0.00 174.94 175.39 1ajw s LYS 178 N 0.12 2.89 -0.09 2.79 2.20 0.12 -2.39 119.74 125.38 1ajw s LYS 178 Ca -0.08 -1.29 -0.08 0.00 -0.36 0.00 0.00 55.97 54.17 1ajw s LYS 178 Cb -0.15 -3.99 -0.04 0.00 -1.51 0.00 0.00 37.83 32.13 1ajw s LYS 178 CO 0.05 -0.93 0.18 -1.12 -0.36 0.00 0.00 175.35 173.17 1ajw s SER 179 N 2.23 6.44 -0.44 1.43 0.01 -1.18 0.62 113.70 122.81 1ajw s SER 179 Ca 0.04 0.53 0.02 0.00 1.31 0.00 0.00 55.95 57.84 1ajw s SER 179 Cb -0.23 -2.09 0.13 0.00 0.21 0.00 0.00 66.02 64.05 1ajw s SER 179 CO 0.06 0.38 0.24 -0.60 0.41 0.00 0.00 173.24 173.73 1ajw s ARG 180 N -1.13 1.30 0.19 12.44 3.52 -1.06 -2.43 118.95 131.79 1ajw s ARG 180 Ca 0.17 -2.01 -0.31 0.00 -0.13 0.00 0.00 55.73 53.46 1ajw s ARG 180 Cb -0.13 -2.36 -0.10 0.00 -1.56 0.00 0.00 34.95 30.80 1ajw s ARG 180 CO 0.07 -1.16 1.53 0.12 -0.81 0.00 0.00 175.30 175.05 1ajw s PHE 181 N 0.36 3.03 0.00 5.12 5.36 0.24 -2.89 117.98 129.20 1ajw s PHE 181 Ca 0.17 0.74 0.00 0.00 -0.96 0.00 0.00 56.93 56.89 1ajw s PHE 181 Cb -0.25 -3.91 0.00 0.00 -0.34 0.00 0.00 43.02 38.53 1ajw s PHE 181 CO 0.00 -3.22 0.00 -2.37 -1.46 0.00 0.00 175.22 168.17 1ajw n THR 182 N 3.42 0.00 -3.13 0.12 5.66 -1.13 -1.88 114.28 117.34 1ajw n THR 182 Ca 0.12 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.12 1ajw n THR 182 Cb 0.39 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.17 1ajw n THR 182 CO 0.00 0.00 0.00 -0.90 -3.05 0.00 0.00 175.07 171.12 1ajw n ASP 183 N -0.41 1.37 0.19 1.09 5.68 -1.26 -0.39 116.55 122.83 1ajw n ASP 183 Ca 0.00 -0.45 -0.15 0.00 -0.50 0.00 0.00 54.79 53.69 1ajw n ASP 183 Cb 0.00 0.00 -0.08 0.00 -1.14 0.00 0.00 41.12 39.90 1ajw n ASP 183 CO 0.00 0.00 0.00 0.44 -1.33 0.00 0.00 177.20 176.31 1ajw h ASP 184 N 0.00 -1.14 0.00 -1.12 5.19 -0.13 -3.43 116.42 115.79 1ajw h ASP 184 Ca 0.00 0.11 -0.05 0.00 -0.62 0.00 0.00 57.03 56.47 1ajw h ASP 184 Cb 0.00 0.40 -0.05 0.00 0.18 0.00 0.00 39.33 39.86 1ajw h ASP 184 CO 0.00 -0.52 -0.11 0.47 -3.12 0.00 0.00 179.24 175.96 1ajw n ASP 185 N -5.48 -0.39 0.11 6.45 8.00 -1.26 -4.98 116.55 118.99 1ajw n ASP 185 Ca -0.09 -0.88 -0.20 0.00 0.71 0.00 0.00 54.79 54.33 1ajw n ASP 185 Cb 0.39 0.12 -0.15 0.00 -0.02 0.00 0.00 41.12 41.45 1ajw n ASP 185 CO 0.00 0.00 0.00 0.03 -0.39 0.00 0.00 177.20 176.84 1ajw h ARG 186 N 0.00 0.39 0.00 -1.24 2.47 -1.96 -3.49 114.38 110.55 1ajw h ARG 186 Ca -0.22 -0.67 0.00 0.00 -1.26 0.00 0.00 59.98 57.83 1ajw h ARG 186 Cb 0.85 0.25 0.00 0.00 -1.65 0.00 0.00 29.97 29.42 1ajw h ARG 186 CO -0.11 1.30 0.00 -2.37 0.56 0.00 0.00 179.97 179.35 1ajw n THR 187 N -3.60 0.00 -3.98 2.04 5.66 -1.26 -5.10 114.28 108.04 1ajw n THR 187 Ca -0.15 0.00 -0.34 0.00 -3.05 0.00 0.00 64.05 60.51 1ajw n THR 187 Cb 1.07 0.00 -0.15 0.00 -1.55 0.00 0.00 70.33 69.70 1ajw n THR 187 CO 0.00 0.00 0.00 -1.81 -3.05 0.00 0.00 175.07 170.21 1ajw s ASP 188 N -0.23 4.01 -0.02 1.09 1.01 -1.26 -4.04 116.67 117.23 1ajw s ASP 188 Ca 0.00 -0.66 -0.02 0.00 0.71 0.00 0.00 52.55 52.58 1ajw s ASP 188 Cb 0.00 -1.64 -0.01 0.00 1.01 0.00 0.00 42.92 42.28 1ajw s ASP 188 CO 0.00 -0.06 0.28 0.45 0.21 0.00 0.00 175.17 176.05 1ajw h HIS 189 N 8.03 -0.08 -2.43 4.23 3.86 -1.79 -3.49 115.15 123.47 1ajw h HIS 189 Ca -0.39 -0.00 0.09 0.00 -1.16 0.00 0.00 60.37 58.90 1ajw h HIS 189 Cb 1.13 0.03 -0.14 0.00 1.06 0.00 0.00 27.41 29.49 1ajw h HIS 189 CO 0.55 -0.05 0.44 -1.17 0.86 0.00 0.00 177.93 178.56 1ajw s LEU 190 N -5.25 -0.40 -0.13 2.43 2.96 -0.79 -5.00 118.68 112.50 1ajw s LEU 190 Ca -0.01 -0.01 -0.22 0.00 -0.22 0.00 0.00 54.13 53.66 1ajw s LEU 190 Cb 0.00 2.14 0.05 0.00 0.50 0.00 0.00 46.19 48.89 1ajw s LEU 190 CO 0.04 -0.70 0.56 -0.94 -1.32 0.00 0.00 176.35 173.98 1ajw s SER 191 N -2.55 -0.54 0.00 3.68 1.04 -1.26 0.80 113.70 114.88 1ajw s SER 191 Ca 0.04 0.82 0.00 0.00 0.48 0.00 0.00 55.95 57.29 1ajw s SER 191 Cb -0.01 0.82 0.00 0.00 0.10 0.00 0.00 66.02 66.93 1ajw s SER 191 CO -0.09 -0.37 0.00 -2.67 0.98 0.00 0.00 173.24 171.09 1ajw n TRP 192 N 1.92 0.00 -3.66 5.02 2.14 -1.02 -5.00 117.44 116.85 1ajw n TRP 192 Ca -0.17 0.00 -0.08 0.00 2.07 0.00 0.00 57.50 59.33 1ajw n TRP 192 Cb 0.56 0.00 -0.08 0.00 -0.81 0.00 0.00 31.31 30.98 1ajw n TRP 192 CO 0.00 0.00 0.00 -1.83 2.07 0.00 0.00 177.69 177.93 1ajw s GLU 193 N 1.42 0.61 0.02 -2.67 4.04 -1.26 -3.13 118.70 117.72 1ajw s GLU 193 Ca 0.00 1.11 -0.00 0.00 0.04 0.00 0.00 54.97 56.12 1ajw s GLU 193 Cb 0.00 0.13 -0.02 0.00 0.02 0.00 0.00 34.13 34.27 1ajw s GLU 193 CO 0.00 -0.16 -0.02 1.67 -1.84 0.00 0.00 175.26 174.91 1ajw s TRP 194 N 1.65 0.21 0.16 4.83 1.48 -1.01 -4.23 118.94 122.04 1ajw s TRP 194 Ca -0.10 -0.42 0.02 0.00 -1.06 0.00 0.00 56.10 54.55 1ajw s TRP 194 Cb -0.06 -0.15 -0.04 0.00 -1.16 0.00 0.00 33.47 32.06 1ajw s TRP 194 CO -0.18 -0.15 0.31 -0.80 -4.06 0.00 0.00 176.95 172.07 1ajw s ASN 195 N -1.15 6.35 -0.39 -2.66 -0.87 -1.26 0.25 114.94 115.22 1ajw s ASN 195 Ca -0.13 0.22 -0.04 0.00 -1.57 0.00 0.00 52.86 51.34 1ajw s ASN 195 Cb -0.08 -1.93 0.09 0.00 -0.02 0.00 0.00 41.25 39.31 1ajw s ASN 195 CO -0.01 0.03 0.17 -0.76 -2.57 0.00 0.00 177.10 173.96 1ajw s LEU 196 N -3.27 4.93 -0.71 0.60 2.01 0.60 0.21 118.68 123.05 1ajw s LEU 196 Ca 0.35 -1.72 -0.27 0.00 0.01 0.00 0.00 54.13 52.50 1ajw s LEU 196 Cb -0.11 -1.85 0.03 0.00 0.01 0.00 0.00 46.19 44.28 1ajw s LEU 196 CO 0.29 -0.48 1.26 -0.89 1.01 0.00 0.00 176.35 177.53 1ajw s THR 197 N 1.24 3.79 0.35 5.49 2.01 -0.12 -0.37 115.64 128.03 1ajw s THR 197 Ca 0.04 0.48 -0.25 0.00 0.31 0.00 0.00 61.69 62.27 1ajw s THR 197 Cb -0.22 -4.88 -0.10 0.00 0.01 0.00 0.00 72.50 67.31 1ajw s THR 197 CO -0.02 -1.76 0.97 -0.63 -0.69 0.00 0.00 174.62 172.50 1ajw s ILE 198 N 5.55 4.11 0.00 1.82 -1.09 0.53 -1.25 121.20 130.88 1ajw s ILE 198 Ca 0.36 1.69 0.00 0.00 -2.23 0.00 0.00 60.65 60.47 1ajw s ILE 198 Cb -0.08 -3.91 0.00 0.00 -1.58 0.00 0.00 42.46 36.89 1ajw s ILE 198 CO 0.17 0.08 0.00 1.17 -1.23 0.00 0.00 174.94 175.12 1ajw n LYS 199 N 0.34 0.00 -0.06 2.79 4.81 -0.05 -3.23 118.16 122.76 1ajw n LYS 199 Ca 0.03 0.00 -0.07 0.00 -0.87 0.00 0.00 58.31 57.40 1ajw n LYS 199 Cb 0.50 0.00 -0.08 0.00 0.02 0.00 0.00 35.03 35.47 1ajw n LYS 199 CO 0.00 0.00 0.00 1.17 1.17 0.00 0.00 177.40 179.74 1ajw n LYS 200 N 0.00 1.70 -3.29 1.64 3.00 -1.26 -3.03 118.16 116.91 1ajw n LYS 200 Ca 0.00 0.02 -0.09 0.00 -0.00 0.00 0.00 58.31 58.24 1ajw n LYS 200 Cb 0.00 -1.29 -0.05 0.00 0.00 0.00 0.00 35.03 33.69 1ajw n LYS 200 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.40 176.19 1ajw s GLU 201 N -2.28 0.63 0.00 1.64 2.02 -1.26 -4.75 118.70 114.71 1ajw s GLU 201 Ca -0.09 -0.38 0.27 0.00 0.02 0.00 0.00 54.97 54.79 1ajw s GLU 201 Cb 0.04 -0.34 1.63 0.00 0.10 0.00 0.00 34.13 35.56 1ajw s GLU 201 CO 0.44 -1.15 1.98 -2.67 0.02 0.00 0.00 175.26 173.88 1ajw n TRP 202 N 4.62 0.00 -2.41 1.61 4.27 -1.26 -3.55 117.44 120.72 1ajw n TRP 202 Ca 0.08 0.00 -0.16 0.00 -3.89 0.00 0.00 57.50 53.53 1ajw n TRP 202 Cb 0.50 -0.01 0.03 0.00 -1.36 0.00 0.00 31.31 30.47 1ajw n TRP 202 CO 0.00 0.00 0.00 0.36 -2.29 0.00 0.00 177.69 175.76 1ajw n LYS 203 N -1.01 2.77 0.00 -2.67 2.85 -1.26 -4.48 118.16 114.36 1ajw n LYS 203 Ca 0.20 -3.95 0.12 0.00 -1.05 0.00 0.00 58.31 53.64 1ajw n LYS 203 Cb 0.10 -1.97 0.10 0.00 -0.65 0.00 0.00 35.03 32.61 1ajw n LYS 203 CO 0.00 0.00 0.00 -0.40 -0.05 0.00 0.00 177.40 176.95