#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ajw n VAL 61 N 0.00 0.33 -2.55 0.00 3.14 -1.26 -5.10 118.33 112.89 1ajw n VAL 61 Ca 0.00 -0.28 0.00 0.00 -2.96 0.00 0.00 64.34 61.10 1ajw n VAL 61 Cb 0.00 -0.37 0.00 0.00 -1.06 0.00 0.00 33.84 32.41 1ajw n VAL 61 CO 0.00 0.00 0.00 -1.54 -6.46 0.00 0.00 176.83 168.83 1ajw n SER 62 N -2.10 -0.77 -2.68 6.55 3.41 -1.26 -4.73 113.62 112.04 1ajw n SER 62 Ca -0.08 0.00 -0.06 0.00 -0.26 0.00 0.00 58.87 58.47 1ajw n SER 62 Cb 0.55 0.00 0.06 0.00 -0.26 0.00 0.00 64.21 64.56 1ajw n SER 62 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1ajw n ALA 63 N 2.76 -0.63 -2.80 7.33 0.00 -1.26 -5.07 120.51 120.83 1ajw n ALA 63 Ca 0.00 -0.90 -0.02 0.00 0.00 0.00 0.00 53.44 52.51 1ajw n ALA 63 Cb 0.00 -1.16 0.01 0.00 0.00 0.00 0.00 19.45 18.31 1ajw n ALA 63 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1ajw s ASP 64 N -0.73 -1.00 -1.14 0.00 2.15 -1.26 -5.06 116.67 109.63 1ajw s ASP 64 Ca 0.14 -1.02 -0.21 0.00 0.43 0.00 0.00 52.55 51.90 1ajw s ASP 64 Cb 0.25 1.30 -0.06 0.00 -0.30 0.00 0.00 42.92 44.11 1ajw s ASP 64 CO -0.06 -0.05 1.92 -0.81 -0.17 0.00 0.00 175.17 175.99 1ajw n PRO 65 N 3.13 2.06 -3.76 4.34 -0.04 -1.26 -4.21 135.00 135.26 1ajw n PRO 65 Ca 0.14 -2.51 -0.23 0.00 -0.04 0.00 0.00 63.50 60.86 1ajw n PRO 65 Cb 0.60 -3.43 0.03 0.00 -0.04 0.00 0.00 33.50 30.65 1ajw n PRO 65 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1ajw n ASN 66 N 10.50 -1.72 -3.82 3.54 4.13 -1.26 -4.97 115.26 121.67 1ajw n ASN 66 Ca 0.48 -0.83 -0.30 0.00 1.68 0.00 0.00 54.58 55.60 1ajw n ASN 66 Cb 0.44 -3.93 -0.15 0.00 -1.54 0.00 0.00 39.78 34.60 1ajw n ASN 66 CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 1ajw s VAL 67 N -3.63 1.30 0.99 2.41 1.01 -1.26 -5.12 120.40 116.09 1ajw s VAL 67 Ca 0.12 -1.69 -0.13 0.00 0.00 0.00 0.00 61.98 60.28 1ajw s VAL 67 Cb -0.06 -1.98 0.18 0.00 0.00 0.00 0.00 36.38 34.52 1ajw s VAL 67 CO 0.82 -0.66 1.12 -2.16 0.00 0.00 0.00 175.10 174.23 1ajw s PRO 68 N 1.39 0.53 -0.08 2.72 0.04 -1.26 -4.98 135.00 133.37 1ajw s PRO 68 Ca 0.10 0.33 -0.07 0.00 0.04 0.00 0.00 61.00 61.40 1ajw s PRO 68 Cb -0.18 -1.77 -0.02 0.00 0.04 0.00 0.00 34.50 32.57 1ajw s PRO 68 CO -0.20 -2.62 -0.14 -1.71 0.04 0.00 0.00 177.00 172.37 1ajw n ASN 69 N -4.06 0.89 -4.19 6.66 2.85 -1.26 -4.52 115.26 111.64 1ajw n ASN 69 Ca 0.07 0.22 -0.32 0.00 -0.11 0.00 0.00 54.58 54.43 1ajw n ASN 69 Cb 0.58 -0.63 -0.17 0.00 1.24 0.00 0.00 39.78 40.81 1ajw n ASN 69 CO 0.00 0.00 0.00 -0.69 -2.11 0.00 0.00 177.26 174.46 1ajw s VAL 70 N -1.82 2.07 -0.13 3.44 1.01 -1.26 -3.27 120.40 120.43 1ajw s VAL 70 Ca -0.12 -0.99 -0.08 0.00 0.00 0.00 0.00 61.98 60.79 1ajw s VAL 70 Cb 0.02 -1.81 0.05 0.00 0.00 0.00 0.00 36.38 34.63 1ajw s VAL 70 CO 0.18 0.55 0.33 -0.69 0.00 0.00 0.00 175.10 175.47 1ajw s VAL 71 N 0.67 -0.02 -0.35 2.92 1.01 -1.24 -4.72 120.40 118.66 1ajw s VAL 71 Ca -0.11 0.09 -0.28 0.00 0.00 0.00 0.00 61.98 61.68 1ajw s VAL 71 Cb -0.16 -0.49 -0.02 0.00 0.00 0.00 0.00 36.38 35.71 1ajw s VAL 71 CO 0.01 0.04 1.86 -0.69 0.00 0.00 0.00 175.10 176.32 1ajw s VAL 72 N 1.04 3.41 -0.02 2.92 1.01 -1.26 -3.24 120.40 124.25 1ajw s VAL 72 Ca -0.07 0.40 -0.13 0.00 0.00 0.00 0.00 61.98 62.18 1ajw s VAL 72 Cb -0.08 -3.59 -0.07 0.00 0.00 0.00 0.00 36.38 32.64 1ajw s VAL 72 CO -0.08 -0.41 0.64 0.71 0.00 0.00 0.00 175.10 175.96 1ajw h THR 73 N 6.87 0.00 -4.48 3.92 1.35 -1.23 -3.36 112.91 115.99 1ajw h THR 73 Ca -0.33 -0.45 -0.21 0.00 -0.55 0.00 0.00 66.41 64.87 1ajw h THR 73 Cb 1.18 0.00 -0.15 0.00 -1.73 0.00 0.00 68.15 67.45 1ajw h THR 73 CO 1.05 0.00 -0.58 -0.13 -0.25 0.00 0.00 175.52 175.60 1ajw s ARG 74 N -3.17 1.17 -0.08 4.72 0.52 -1.18 -0.65 118.95 120.28 1ajw s ARG 74 Ca -0.07 -1.56 0.01 0.00 -0.52 0.00 0.00 55.73 53.59 1ajw s ARG 74 Cb 0.01 0.28 0.02 0.00 0.52 0.00 0.00 34.95 35.78 1ajw s ARG 74 CO 0.21 -0.38 -0.08 -1.17 0.02 0.00 0.00 175.30 173.90 1ajw s LEU 75 N -3.12 1.29 0.26 2.53 0.20 -0.56 -2.33 118.68 116.94 1ajw s LEU 75 Ca 0.35 -0.25 0.08 0.00 0.69 0.00 0.00 54.13 55.00 1ajw s LEU 75 Cb 0.06 -0.74 -0.04 0.00 -0.43 0.00 0.00 46.19 45.05 1ajw s LEU 75 CO 0.10 -0.07 0.08 -0.89 -0.29 0.00 0.00 176.35 175.27 1ajw s THR 76 N 1.30 3.88 -0.39 3.68 2.01 -1.04 -0.10 115.64 124.98 1ajw s THR 76 Ca -0.03 -1.67 0.02 0.00 0.31 0.00 0.00 61.69 60.31 1ajw s THR 76 Cb -0.14 -3.08 0.16 0.00 0.01 0.00 0.00 72.50 69.45 1ajw s THR 76 CO -0.03 -0.35 0.29 -0.76 -0.69 0.00 0.00 174.62 173.08 1ajw s LEU 77 N -3.71 1.25 0.70 4.42 1.43 -1.00 -2.64 118.68 119.14 1ajw s LEU 77 Ca 0.32 -2.71 -0.10 0.00 -1.03 0.00 0.00 54.13 50.61 1ajw s LEU 77 Cb -0.07 -0.43 0.04 0.00 0.03 0.00 0.00 46.19 45.76 1ajw s LEU 77 CO 0.22 -0.23 1.06 -0.69 0.23 0.00 0.00 176.35 176.94 1ajw s VAL 78 N 0.47 2.99 0.00 -1.59 1.01 -0.97 -3.21 120.40 119.10 1ajw s VAL 78 Ca 0.27 0.15 0.00 0.00 0.00 0.00 0.00 61.98 62.40 1ajw s VAL 78 Cb -0.07 -3.29 0.00 0.00 0.00 0.00 0.00 36.38 33.02 1ajw s VAL 78 CO -0.11 -0.35 0.00 0.00 0.00 0.00 0.00 175.10 174.64 1ajw n SER 80 N 0.00 3.71 -0.64 0.00 7.64 -1.26 -4.83 113.62 118.24 1ajw n SER 80 Ca 0.00 0.00 0.06 0.00 1.01 0.00 0.00 58.87 59.94 1ajw n SER 80 Cb 0.00 0.16 0.13 0.00 -1.01 0.00 0.00 64.21 63.49 1ajw n SER 80 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 1ajw n THR 81 N -2.13 1.39 -2.30 0.44 -2.24 -1.26 -5.07 114.28 103.11 1ajw n THR 81 Ca 0.00 -2.13 -0.14 0.00 -2.27 0.00 0.00 64.05 59.52 1ajw n THR 81 Cb 0.42 0.11 0.08 0.00 -2.10 0.00 0.00 70.33 68.84 1ajw n THR 81 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1ajw n ALA 82 N -0.72 -0.05 0.07 6.98 0.00 -1.26 -4.70 120.51 120.82 1ajw n ALA 82 Ca 0.13 -1.09 -0.09 0.00 0.00 0.00 0.00 53.44 52.39 1ajw n ALA 82 Cb 0.78 0.14 -0.12 0.00 0.00 0.00 0.00 19.45 20.25 1ajw n ALA 82 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1ajw h PRO 83 N 0.00 0.05 0.00 0.00 0.13 -1.97 -3.50 132.00 126.71 1ajw h PRO 83 Ca -0.20 -0.09 0.00 0.00 -0.87 0.00 0.00 66.00 64.84 1ajw h PRO 83 Cb 0.69 0.03 0.00 0.00 0.13 0.00 0.00 31.00 31.85 1ajw h PRO 83 CO 0.20 1.04 0.00 0.41 -0.23 0.00 0.00 178.00 179.41 1ajw n GLY 84 N 1.39 0.15 3.57 1.56 0.00 -1.26 -5.08 105.19 105.52 1ajw n GLY 84 Ca -0.02 -1.14 -0.41 0.00 0.00 0.00 0.00 46.02 44.45 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 3.10 -0.28 1.61 0.04 -1.26 -4.77 135.00 131.44 1ajw s PRO 85 Ca 0.00 0.73 -0.29 0.00 0.04 0.00 0.00 61.00 61.48 1ajw s PRO 85 Cb 0.00 -4.22 -0.02 0.00 0.04 0.00 0.00 34.50 30.30 1ajw s PRO 85 CO 0.00 -2.16 1.67 -0.51 0.04 0.00 0.00 177.00 176.04 1ajw s LEU 86 N 7.17 3.71 0.13 -3.56 1.02 -1.20 -4.57 118.68 121.38 1ajw s LEU 86 Ca 0.63 1.42 -0.10 0.00 0.02 0.00 0.00 54.13 56.10 1ajw s LEU 86 Cb -0.14 -3.53 -0.06 0.00 0.02 0.00 0.00 46.19 42.48 1ajw s LEU 86 CO 0.26 -1.46 0.46 -1.61 0.02 0.00 0.00 176.35 174.02 1ajw s GLU 87 N 5.10 3.81 0.09 1.70 2.02 -1.25 -2.38 118.70 127.78 1ajw s GLU 87 Ca 0.74 0.24 0.04 0.00 0.02 0.00 0.00 54.97 56.01 1ajw s GLU 87 Cb -0.23 -2.90 -0.03 0.00 0.10 0.00 0.00 34.13 31.07 1ajw s GLU 87 CO 0.32 0.48 -0.11 -1.17 0.02 0.00 0.00 175.26 174.80 1ajw s LEU 88 N -2.17 2.37 -0.16 1.80 0.20 0.85 -4.90 118.68 116.67 1ajw s LEU 88 Ca 0.38 -0.76 -0.07 0.00 0.69 0.00 0.00 54.13 54.37 1ajw s LEU 88 Cb -0.13 -0.36 -0.04 0.00 -0.43 0.00 0.00 46.19 45.23 1ajw s LEU 88 CO 0.20 -0.21 0.08 -0.62 -0.29 0.00 0.00 176.35 175.50 1ajw s ASP 89 N -2.25 5.82 -0.38 3.68 2.15 -1.26 -1.49 116.67 122.93 1ajw s ASP 89 Ca 0.03 0.20 0.12 0.00 0.43 0.00 0.00 52.55 53.33 1ajw s ASP 89 Cb -0.05 -1.93 0.43 0.00 -0.30 0.00 0.00 42.92 41.07 1ajw s ASP 89 CO 0.01 0.26 0.98 0.18 -0.17 0.00 0.00 175.17 176.42 1ajw n LEU 90 N 2.97 2.66 0.00 -1.34 4.77 0.18 -4.74 117.00 121.49 1ajw n LEU 90 Ca -0.18 -4.50 -0.00 0.00 -0.03 0.00 0.00 56.01 51.30 1ajw n LEU 90 Cb 0.53 0.10 -0.00 0.00 -2.33 0.00 0.00 43.42 41.72 1ajw n LEU 90 CO 0.34 1.93 -0.01 0.35 -1.33 0.00 0.00 177.39 178.66 1ajw n THR 91 N -0.17 0.06 0.00 -5.08 -2.24 -1.26 -4.36 114.28 101.22 1ajw n THR 91 Ca 0.22 0.17 0.00 0.00 -2.27 0.00 0.00 64.05 62.17 1ajw n THR 91 Cb 0.72 -1.19 0.00 0.00 -2.10 0.00 0.00 70.33 67.76 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 2.85 0.00 2.79 3.38 0.00 -1.26 -4.86 105.19 108.09 1ajw n GLY 92 Ca -0.00 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 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 -2.55 4.16 0.06 1.61 2.03 -1.26 -4.41 116.55 116.20 1ajw n ASP 93 Ca 0.00 -2.53 0.05 0.00 0.52 0.00 0.00 54.79 52.83 1ajw n ASP 93 Cb 0.25 -1.19 -0.05 0.00 -0.72 0.00 0.00 41.12 39.41 1ajw n ASP 93 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 1ajw n LEU 94 N 5.62 0.85 0.05 -2.67 4.77 -1.26 -4.04 117.00 120.32 1ajw n LEU 94 Ca 0.50 0.35 0.16 0.00 -0.03 0.00 0.00 56.01 56.98 1ajw n LEU 94 Cb 0.27 0.01 0.64 0.00 -2.33 0.00 0.00 43.42 42.02 1ajw n LEU 94 CO 0.87 -0.00 1.16 -0.08 -1.33 0.00 0.00 177.39 178.00 1ajw h GLU 95 N 0.00 0.07 -0.00 3.23 4.57 -1.97 -0.27 114.58 120.20 1ajw h GLU 95 Ca -0.09 -0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.09 1ajw h GLU 95 Cb 1.32 -0.02 -0.00 0.00 -0.16 0.00 0.00 28.75 29.89 1ajw h GLU 95 CO 0.02 0.05 0.10 0.77 -1.18 0.00 0.00 179.01 178.77 1ajw h SER 96 N 0.08 0.00 -0.04 1.04 0.02 -1.95 -1.30 113.55 111.40 1ajw h SER 96 Ca 0.19 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.14 1ajw h SER 96 Cb 0.67 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.20 1ajw h SER 96 CO -0.02 0.00 0.03 -0.26 -1.14 0.00 0.00 176.83 175.44 1ajw h PHE 97 N 0.00 0.05 0.00 3.45 -1.00 -1.31 -0.99 116.94 117.14 1ajw h PHE 97 Ca 0.00 0.00 -0.02 0.00 2.81 0.00 0.00 57.97 60.77 1ajw h PHE 97 Cb 0.20 -0.02 -0.00 0.00 3.61 0.00 0.00 35.95 39.74 1ajw h PHE 97 CO 0.00 0.03 -0.08 0.87 -1.61 0.00 0.00 178.31 177.52 1ajw h LYS 98 N 0.05 0.00 -2.26 1.51 1.57 -1.43 -3.23 116.57 112.78 1ajw h LYS 98 Ca 0.01 0.00 -0.58 0.00 -1.87 0.00 0.00 60.65 58.21 1ajw h LYS 98 Cb -0.00 0.00 -0.42 0.00 0.08 0.00 0.00 32.23 31.89 1ajw h LYS 98 CO -0.00 0.08 -0.69 1.63 -0.57 0.00 0.00 179.45 179.89 1ajw n LYS 99 N -3.38 3.02 -3.52 3.15 5.02 -0.37 -5.00 118.16 117.07 1ajw n LYS 99 Ca -0.01 -4.72 -0.00 0.00 -2.02 0.00 0.00 58.31 51.55 1ajw n LYS 99 Cb 0.24 -2.19 -0.05 0.00 -0.02 0.00 0.00 35.03 33.01 1ajw n LYS 99 CO 0.00 0.00 0.00 1.14 -0.52 0.00 0.00 177.40 178.02 1ajw s GLN 100 N -3.37 0.30 -0.05 1.97 1.03 -1.22 -5.03 119.66 113.29 1ajw s GLN 100 Ca 0.48 0.63 0.00 0.00 0.04 0.00 0.00 55.36 56.52 1ajw s GLN 100 Cb 0.29 0.24 0.02 0.00 0.03 0.00 0.00 33.01 33.59 1ajw s GLN 100 CO -0.13 -0.08 -0.03 -1.54 -2.54 0.00 0.00 175.29 170.97 1ajw s SER 101 N 1.86 1.05 0.26 12.60 1.04 -1.26 -3.84 113.70 125.41 1ajw s SER 101 Ca -0.06 -0.11 -0.30 0.00 0.48 0.00 0.00 55.95 55.97 1ajw s SER 101 Cb -0.05 -0.42 -0.09 0.00 0.10 0.00 0.00 66.02 65.56 1ajw s SER 101 CO -0.16 -0.09 1.12 -0.36 0.98 0.00 0.00 173.24 174.73 1ajw s PHE 102 N 1.19 3.54 -0.45 5.02 0.08 -1.21 -4.56 117.98 121.60 1ajw s PHE 102 Ca -0.07 1.65 -0.17 0.00 0.12 0.00 0.00 56.93 58.46 1ajw s PHE 102 Cb -0.14 -3.31 0.04 0.00 -0.57 0.00 0.00 43.02 39.04 1ajw s PHE 102 CO -0.02 -0.67 0.45 0.08 -0.10 0.00 0.00 175.22 174.96 1ajw s VAL 103 N -0.95 5.09 0.35 -0.44 1.01 -1.25 0.93 120.40 125.14 1ajw s VAL 103 Ca 0.46 -0.54 0.08 0.00 0.00 0.00 0.00 61.98 61.99 1ajw s VAL 103 Cb -0.32 -4.10 -0.05 0.00 0.00 0.00 0.00 36.38 31.92 1ajw s VAL 103 CO 0.40 -0.51 0.09 -0.76 0.00 0.00 0.00 175.10 174.32 1ajw s LEU 104 N 2.10 3.12 0.36 3.92 1.43 0.23 -4.94 118.68 124.91 1ajw s LEU 104 Ca 0.10 -0.91 0.01 0.00 -1.03 0.00 0.00 54.13 52.30 1ajw s LEU 104 Cb -0.19 -1.52 -0.03 0.00 0.03 0.00 0.00 46.19 44.48 1ajw s LEU 104 CO 0.12 -0.31 0.56 -0.75 0.23 0.00 0.00 176.35 176.20 1ajw s LYS 105 N -3.80 3.40 0.00 1.70 2.20 -1.26 -0.47 119.74 121.51 1ajw s LYS 105 Ca 0.37 -0.39 0.00 0.00 -0.36 0.00 0.00 55.97 55.59 1ajw s LYS 105 Cb -0.00 -2.65 0.00 0.00 -1.51 0.00 0.00 37.83 33.66 1ajw s LYS 105 CO 0.21 0.08 0.00 0.39 -0.36 0.00 0.00 175.35 175.67 1ajw n GLU 106 N -1.83 0.00 -3.21 4.03 1.02 -1.15 -3.26 120.64 116.24 1ajw n GLU 106 Ca -0.04 0.00 -0.43 0.00 -0.02 0.00 0.00 57.16 56.67 1ajw n GLU 106 Cb 0.56 0.00 -0.00 0.00 -0.02 0.00 0.00 31.44 31.98 1ajw n GLU 106 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1ajw n GLY 107 N 0.00 4.65 3.81 0.62 0.00 -1.14 -4.03 105.19 109.11 1ajw n GLY 107 Ca 0.00 -2.63 -0.37 0.00 0.00 0.00 0.00 46.02 43.02 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 -2.00 4.53 -0.96 1.61 -7.23 -1.20 -4.58 120.40 110.57 1ajw s VAL 108 Ca 0.31 1.37 -0.19 0.00 -1.81 0.00 0.00 61.98 61.66 1ajw s VAL 108 Cb -0.03 -3.91 0.13 0.00 0.56 0.00 0.00 36.38 33.14 1ajw s VAL 108 CO 0.00 0.26 1.17 -1.61 -0.31 0.00 0.00 175.10 174.61 1ajw s GLU 109 N -1.84 3.64 -0.14 4.82 2.02 -1.25 -2.71 118.70 123.23 1ajw s GLU 109 Ca 0.42 -1.78 -0.03 0.00 0.02 0.00 0.00 54.97 53.60 1ajw s GLU 109 Cb -0.18 -4.96 -0.03 0.00 0.10 0.00 0.00 34.13 29.07 1ajw s GLU 109 CO 0.22 -1.80 -0.06 1.52 0.02 0.00 0.00 175.26 175.16 1ajw s TYR 110 N 2.75 2.98 0.25 1.61 1.13 0.25 -4.62 117.35 121.70 1ajw s TYR 110 Ca 0.34 -0.32 0.04 0.00 -1.41 0.00 0.00 57.07 55.73 1ajw s TYR 110 Cb -0.04 -1.91 -0.03 0.00 -1.10 0.00 0.00 41.96 38.87 1ajw s TYR 110 CO -0.09 -0.02 0.39 -0.98 -2.51 0.00 0.00 175.55 172.34 1ajw s ARG 111 N 0.22 3.45 0.04 -3.49 1.70 -1.03 0.10 118.95 119.95 1ajw s ARG 111 Ca -0.04 -0.67 0.07 0.00 -0.47 0.00 0.00 55.73 54.62 1ajw s ARG 111 Cb -0.14 -2.86 -0.02 0.00 -0.57 0.00 0.00 34.95 31.36 1ajw s ARG 111 CO 0.03 0.39 -0.19 0.42 -1.08 0.00 0.00 175.30 174.87 1ajw s ILE 112 N -2.02 1.51 -0.34 4.99 1.01 -1.20 -2.28 121.20 122.86 1ajw s ILE 112 Ca 0.35 -1.15 0.02 0.00 0.00 0.00 0.00 60.65 59.87 1ajw s ILE 112 Cb -0.09 -1.33 0.09 0.00 0.01 0.00 0.00 42.46 41.14 1ajw s ILE 112 CO 0.30 0.14 0.06 -0.54 0.00 0.00 0.00 174.94 174.90 1ajw s LYS 113 N -1.19 1.79 -0.11 2.79 1.02 -1.08 -0.43 119.74 122.53 1ajw s LYS 113 Ca 0.06 -1.74 -0.25 0.00 0.02 0.00 0.00 55.97 54.07 1ajw s LYS 113 Cb -0.09 -3.24 -0.03 0.00 -0.52 0.00 0.00 37.83 33.96 1ajw s LYS 113 CO 0.02 -0.89 0.78 0.42 -0.92 0.00 0.00 175.35 174.76 1ajw s ILE 114 N 1.01 4.96 0.02 2.17 -1.09 -1.10 -2.49 121.20 124.69 1ajw s ILE 114 Ca 0.06 1.57 0.02 0.00 -2.23 0.00 0.00 60.65 60.06 1ajw s ILE 114 Cb -0.20 -4.10 -0.04 0.00 -1.58 0.00 0.00 42.46 36.54 1ajw s ILE 114 CO -0.06 0.14 0.02 -0.55 -1.23 0.00 0.00 174.94 173.26 1ajw s SER 115 N 0.99 5.24 -0.10 3.58 0.15 -0.98 -0.01 113.70 122.56 1ajw s SER 115 Ca 0.39 -0.00 -0.30 0.00 0.70 0.00 0.00 55.95 56.73 1ajw s SER 115 Cb -0.17 -1.38 0.09 0.00 -1.71 0.00 0.00 66.02 62.84 1ajw s SER 115 CO 0.16 0.26 0.77 0.72 1.20 0.00 0.00 173.24 176.35 1ajw s PHE 116 N -1.16 -0.59 -0.17 3.44 -0.71 -1.19 -0.92 117.98 116.69 1ajw s PHE 116 Ca 0.22 1.05 -0.08 0.00 -1.04 0.00 0.00 56.93 57.08 1ajw s PHE 116 Cb -0.12 0.41 -0.04 0.00 -1.21 0.00 0.00 43.02 42.06 1ajw s PHE 116 CO 0.13 -0.52 0.10 1.03 -1.34 0.00 0.00 175.22 174.62 1ajw s ARG 117 N -1.04 3.86 -0.39 1.99 0.52 -1.20 0.11 118.95 122.80 1ajw s ARG 117 Ca -0.08 -0.25 0.03 0.00 -0.52 0.00 0.00 55.73 54.92 1ajw s ARG 117 Cb -0.01 -3.26 0.11 0.00 0.52 0.00 0.00 34.95 32.32 1ajw s ARG 117 CO 0.07 0.44 0.13 0.08 0.02 0.00 0.00 175.30 176.04 1ajw s VAL 118 N -0.07 2.03 -0.37 3.52 1.01 -1.22 -3.71 120.40 121.59 1ajw s VAL 118 Ca 0.09 -2.45 0.12 0.00 0.00 0.00 0.00 61.98 59.73 1ajw s VAL 118 Cb -0.12 -2.47 0.45 0.00 0.00 0.00 0.00 36.38 34.24 1ajw s VAL 118 CO 0.00 -0.69 1.05 -3.20 0.00 0.00 0.00 175.10 172.26 1ajw n ASN 119 N 3.99 3.18 0.01 3.32 2.85 -1.20 -3.85 115.26 123.55 1ajw n ASN 119 Ca 0.04 -3.20 0.00 0.00 -0.11 0.00 0.00 54.58 51.31 1ajw n ASN 119 Cb 0.39 -0.48 0.00 0.00 1.24 0.00 0.00 39.78 40.93 1ajw n ASN 119 CO 0.00 0.00 0.00 -1.14 -2.11 0.00 0.00 177.26 174.01 1ajw n ARG 120 N -0.33 0.00 -4.25 1.20 3.00 -1.26 -4.90 116.66 110.12 1ajw n ARG 120 Ca 0.25 0.00 -0.15 0.00 -0.00 0.00 0.00 57.85 57.95 1ajw n ARG 120 Cb 0.76 0.00 -0.10 0.00 0.00 0.00 0.00 32.46 33.11 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 -1.03 1.04 -0.66 -0.14 0.41 -1.26 -4.77 118.70 112.29 1ajw s GLU 121 Ca 0.00 -1.37 -0.27 0.00 -0.41 0.00 0.00 54.97 52.91 1ajw s GLU 121 Cb 0.00 -0.71 0.03 0.00 -1.78 0.00 0.00 34.13 31.67 1ajw s GLU 121 CO 0.00 0.11 1.23 0.42 -0.49 0.00 0.00 175.26 176.53 1ajw s ILE 122 N -2.91 3.87 -0.82 -1.63 1.01 -1.26 -4.49 121.20 114.97 1ajw s ILE 122 Ca 0.14 0.63 -0.22 0.00 0.00 0.00 0.00 60.65 61.19 1ajw s ILE 122 Cb -0.00 -4.82 0.08 0.00 0.01 0.00 0.00 42.46 37.72 1ajw s ILE 122 CO 0.02 -1.61 1.16 -0.69 0.00 0.00 0.00 174.94 173.81 1ajw s VAL 123 N 5.34 4.28 -0.78 2.92 1.01 -0.99 -4.89 120.40 127.29 1ajw s VAL 123 Ca 0.38 -0.70 -0.25 0.00 0.00 0.00 0.00 61.98 61.42 1ajw s VAL 123 Cb -0.08 -4.82 0.05 0.00 0.00 0.00 0.00 36.38 31.53 1ajw s VAL 123 CO 0.20 -1.63 1.24 -0.94 0.00 0.00 0.00 175.10 173.97 1ajw s SER 124 N 3.94 6.24 0.00 3.32 1.04 -1.26 -3.09 113.70 123.89 1ajw s SER 124 Ca 0.32 -0.81 0.00 0.00 0.48 0.00 0.00 55.95 55.94 1ajw s SER 124 Cb -0.09 -2.52 0.00 0.00 0.10 0.00 0.00 66.02 63.51 1ajw s SER 124 CO 0.01 -1.66 0.00 0.61 0.98 0.00 0.00 173.24 173.17 1ajw n GLY 125 N 5.63 0.74 3.69 7.32 0.00 -1.26 -4.59 105.19 116.72 1ajw n GLY 125 Ca 0.08 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.67 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 4.43 0.02 1.61 0.00 -1.18 0.10 119.30 124.28 1ajw s MET 126 Ca 0.00 1.47 0.01 0.00 0.00 0.00 0.00 55.69 57.17 1ajw s MET 126 Cb 0.00 -3.53 -0.02 0.00 0.00 0.00 0.00 34.83 31.29 1ajw s MET 126 CO 0.00 -0.30 -0.06 -1.59 0.00 0.00 0.00 175.02 173.07 1ajw s LYS 127 N 1.88 0.41 -0.08 4.11 -2.85 0.04 0.92 119.74 124.17 1ajw s LYS 127 Ca 0.51 -0.53 0.01 0.00 -1.00 0.00 0.00 55.97 54.95 1ajw s LYS 127 Cb -0.20 -0.21 -0.03 0.00 -2.06 0.00 0.00 37.83 35.33 1ajw s LYS 127 CO 0.21 0.04 -0.08 -0.47 0.10 0.00 0.00 175.35 175.14 1ajw s TYR 128 N -0.99 2.90 0.20 1.78 5.04 0.34 -1.32 117.35 125.30 1ajw s TYR 128 Ca -0.08 -0.10 0.10 0.00 -2.44 0.00 0.00 57.07 54.55 1ajw s TYR 128 Cb -0.07 -1.74 -0.04 0.00 0.35 0.00 0.00 41.96 40.45 1ajw s TYR 128 CO -0.00 0.22 -0.19 0.42 -1.34 0.00 0.00 175.55 174.65 1ajw s ILE 129 N -0.55 2.05 -0.21 3.14 1.01 -1.19 0.11 121.20 125.55 1ajw s ILE 129 Ca 0.08 -2.07 -0.13 0.00 0.00 0.00 0.00 60.65 58.53 1ajw s ILE 129 Cb -0.12 -2.01 0.06 0.00 0.01 0.00 0.00 42.46 40.40 1ajw s ILE 129 CO 0.02 -0.32 0.52 -1.58 0.00 0.00 0.00 174.94 173.57 1ajw s GLN 130 N -3.00 0.53 -0.13 2.79 0.74 -0.79 -1.41 119.66 118.38 1ajw s GLN 130 Ca 0.20 0.91 -0.02 0.00 0.05 0.00 0.00 55.36 56.50 1ajw s GLN 130 Cb -0.05 0.09 -0.02 0.00 1.10 0.00 0.00 33.01 34.12 1ajw s GLN 130 CO 0.09 -0.14 -0.07 -1.01 -0.55 0.00 0.00 175.29 173.61 1ajw s HIS 131 N 1.26 2.95 -1.46 1.67 3.76 0.99 -1.29 115.29 123.17 1ajw s HIS 131 Ca -0.08 -0.34 -0.12 0.00 -0.15 0.00 0.00 55.06 54.37 1ajw s HIS 131 Cb -0.06 -1.89 0.03 0.00 1.11 0.00 0.00 32.58 31.77 1ajw s HIS 131 CO -0.12 -0.02 2.35 2.41 -0.85 0.00 0.00 174.74 178.50 1ajw n THR 132 N 3.32 3.86 -1.84 1.30 -1.04 0.28 -0.97 114.28 119.20 1ajw n THR 132 Ca -0.18 -3.18 -0.41 0.00 -2.04 0.00 0.00 64.05 58.24 1ajw n THR 132 Cb 0.53 -2.55 -0.01 0.00 -1.82 0.00 0.00 70.33 66.47 1ajw n THR 132 CO 0.00 0.00 0.00 -0.31 -0.64 0.00 0.00 175.07 174.12 1ajw s TYR 133 N 2.35 2.75 -0.25 -1.42 1.51 0.13 -3.24 117.35 119.18 1ajw s TYR 133 Ca 0.51 0.97 0.03 0.00 -1.01 0.00 0.00 57.07 57.57 1ajw s TYR 133 Cb 0.14 -4.00 0.06 0.00 -0.11 0.00 0.00 41.96 38.05 1ajw s TYR 133 CO -0.07 -3.18 -0.11 0.50 -1.11 0.00 0.00 175.55 171.59 1ajw s ARG 134 N -1.06 2.19 -1.41 -0.62 3.52 0.28 0.46 118.95 122.31 1ajw s ARG 134 Ca 0.59 -1.27 -0.08 0.00 -0.13 0.00 0.00 55.73 54.84 1ajw s ARG 134 Cb -0.46 -2.83 0.05 0.00 -1.56 0.00 0.00 34.95 30.15 1ajw s ARG 134 CO 0.52 -0.56 0.59 1.17 -0.81 0.00 0.00 175.30 176.22 1ajw n LYS 135 N 4.48 -4.24 -1.78 5.12 0.00 -1.26 -1.46 118.16 119.01 1ajw n LYS 135 Ca -0.14 0.65 0.00 0.00 0.00 0.00 0.00 58.31 58.82 1ajw n LYS 135 Cb 0.43 -5.44 0.00 0.00 0.00 0.00 0.00 35.03 30.02 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 -1.37 0.85 2.88 3.14 0.00 -1.26 -5.06 105.19 104.37 1ajw n GLY 136 Ca -0.04 -0.61 -0.15 0.00 0.00 0.00 0.00 46.02 45.22 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 -2.42 -0.42 0.01 1.61 1.01 -0.54 -5.12 120.40 114.54 1ajw s VAL 137 Ca 0.00 0.03 -0.30 0.00 0.00 0.00 0.00 61.98 61.71 1ajw s VAL 137 Cb 0.00 -0.63 -0.07 0.00 0.00 0.00 0.00 36.38 35.69 1ajw s VAL 137 CO 0.00 -0.07 1.55 -1.59 0.00 0.00 0.00 175.10 174.99 1ajw s LYS 138 N 2.41 4.23 -0.01 2.72 0.00 -1.26 0.10 119.74 127.92 1ajw s LYS 138 Ca 0.06 2.15 0.03 0.00 0.00 0.00 0.00 55.97 58.22 1ajw s LYS 138 Cb -0.14 -3.67 -0.05 0.00 0.00 0.00 0.00 37.83 33.96 1ajw s LYS 138 CO -0.12 -0.70 0.06 0.44 0.00 0.00 0.00 175.35 175.04 1ajw n ILE 139 N 4.88 0.07 -3.50 3.79 -5.35 -1.20 -4.91 119.36 113.13 1ajw n ILE 139 Ca 0.15 -0.10 -0.00 0.00 -0.27 0.00 0.00 62.75 62.53 1ajw n ILE 139 Cb 0.42 0.04 -0.05 0.00 -1.74 0.00 0.00 39.64 38.31 1ajw n ILE 139 CO 0.00 0.00 0.00 -0.62 -1.76 0.00 0.00 176.55 174.17 1ajw s ASP 140 N -2.70 -0.57 0.11 7.28 -1.08 -1.26 -4.99 116.67 113.45 1ajw s ASP 140 Ca -0.01 0.83 0.05 0.00 -0.52 0.00 0.00 52.55 52.89 1ajw s ASP 140 Cb 0.02 1.51 -0.04 0.00 -1.46 0.00 0.00 42.92 42.96 1ajw s ASP 140 CO 0.15 -0.12 -0.13 -1.59 0.52 0.00 0.00 175.17 174.00 1ajw s LYS 141 N 2.05 0.93 -0.01 4.34 0.00 -1.26 0.10 119.74 125.89 1ajw s LYS 141 Ca -0.05 -1.17 -0.04 0.00 0.00 0.00 0.00 55.97 54.72 1ajw s LYS 141 Cb -0.05 -0.76 -0.00 0.00 0.00 0.00 0.00 37.83 37.01 1ajw s LYS 141 CO -0.17 0.14 0.07 0.99 0.00 0.00 0.00 175.35 176.39 1ajw s THR 142 N -2.11 0.06 -0.23 3.79 2.01 -0.41 -4.97 115.64 113.79 1ajw s THR 142 Ca 0.06 -0.48 -0.05 0.00 0.31 0.00 0.00 61.69 61.52 1ajw s THR 142 Cb -0.05 -0.26 -0.02 0.00 0.01 0.00 0.00 72.50 72.18 1ajw s THR 142 CO 0.02 -0.26 0.01 1.51 -0.69 0.00 0.00 174.62 175.20 1ajw s ASP 143 N -0.84 4.68 -0.29 3.53 -4.77 -1.26 -1.88 116.67 115.83 1ajw s ASP 143 Ca -0.09 -0.30 -0.09 0.00 -3.30 0.00 0.00 52.55 48.77 1ajw s ASP 143 Cb -0.06 -1.82 -0.02 0.00 -1.09 0.00 0.00 42.92 39.94 1ajw s ASP 143 CO 0.00 -0.02 0.13 -0.31 0.70 0.00 0.00 175.17 175.68 1ajw s TYR 144 N 1.48 3.15 0.05 2.11 2.02 0.29 -4.92 117.35 121.53 1ajw s TYR 144 Ca 0.06 -0.43 -0.31 0.00 -0.37 0.00 0.00 57.07 56.02 1ajw s TYR 144 Cb -0.15 -2.32 -0.08 0.00 -0.40 0.00 0.00 41.96 39.02 1ajw s TYR 144 CO -0.00 -0.38 1.59 1.41 -1.57 0.00 0.00 175.55 176.60 1ajw s MET 145 N 1.63 4.22 -0.17 -0.62 1.75 -1.26 -0.51 119.30 124.34 1ajw s MET 145 Ca 0.05 2.24 -0.14 0.00 -1.25 0.00 0.00 55.69 56.60 1ajw s MET 145 Cb -0.16 -3.61 -0.09 0.00 2.84 0.00 0.00 34.83 33.82 1ajw s MET 145 CO 0.06 -0.70 -0.06 0.28 -0.65 0.00 0.00 175.02 173.95 1ajw n VAL 146 N 4.74 1.46 0.00 10.11 0.31 0.26 -4.90 118.33 130.31 1ajw n VAL 146 Ca 0.15 0.12 0.00 0.00 -0.01 0.00 0.00 64.34 64.61 1ajw n VAL 146 Cb 0.41 -2.27 0.00 0.00 -0.91 0.00 0.00 33.84 31.08 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 3.60 3.76 2.92 0.00 -0.78 -4.98 105.19 111.25 1ajw n GLY 147 Ca -0.17 -1.64 -0.39 0.00 0.00 0.00 0.00 46.02 43.82 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 7.54 -0.02 1.61 1.04 -1.26 -3.12 113.70 119.49 1ajw s SER 148 Ca 0.00 1.86 0.00 0.00 0.48 0.00 0.00 55.95 58.29 1ajw s SER 148 Cb 0.00 -2.58 0.03 0.00 0.10 0.00 0.00 66.02 63.57 1ajw s SER 148 CO 0.00 0.14 0.02 -0.31 0.98 0.00 0.00 173.24 174.07 1ajw s TYR 149 N -1.23 0.10 0.36 5.02 2.02 -1.18 -4.97 117.35 117.47 1ajw s TYR 149 Ca 0.41 0.10 0.08 0.00 -0.37 0.00 0.00 57.07 57.28 1ajw s TYR 149 Cb -0.24 -0.28 -0.02 0.00 -0.40 0.00 0.00 41.96 41.01 1ajw s TYR 149 CO 0.30 -0.10 0.33 0.20 -1.57 0.00 0.00 175.55 174.71 1ajw s GLY 150 N 1.06 1.90 -0.83 0.71 0.00 -1.26 -2.33 107.32 106.56 1ajw s GLY 150 Ca -0.09 -1.73 -0.20 0.00 0.00 0.00 0.00 44.72 42.70 1ajw s GLY 150 CO -0.03 -1.61 1.97 -1.55 0.00 0.00 0.00 173.10 171.88 1ajw n PRO 151 N -1.45 1.66 -0.79 2.90 -0.04 -1.25 -3.82 135.00 132.21 1ajw n PRO 151 Ca 0.00 -1.85 -0.04 0.00 -0.04 0.00 0.00 63.50 61.57 1ajw n PRO 151 Cb 0.60 -2.89 -0.04 0.00 -0.04 0.00 0.00 33.50 31.13 1ajw n PRO 151 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1ajw n ARG 152 N 6.63 0.00 -0.13 0.54 1.74 -1.26 -4.93 116.66 119.25 1ajw n ARG 152 Ca 0.49 -0.62 0.00 0.00 -0.77 0.00 0.00 57.85 56.95 1ajw n ARG 152 Cb 0.37 0.36 0.00 0.00 -1.02 0.00 0.00 32.46 32.18 1ajw n ARG 152 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1ajw n ALA 153 N 0.00 1.25 -0.61 7.54 0.00 -1.25 -5.14 120.51 122.31 1ajw n ALA 153 Ca -0.17 -0.40 0.00 0.00 0.00 0.00 0.00 53.44 52.87 1ajw n ALA 153 Cb 0.58 -0.08 0.00 0.00 0.00 0.00 0.00 19.45 19.95 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 -2.23 0.00 4.07 -1.26 -4.43 120.64 116.79 1ajw n GLU 154 Ca 0.00 0.00 -0.42 0.00 -0.06 0.00 0.00 57.16 56.68 1ajw n GLU 154 Cb 0.53 0.00 -0.03 0.00 -0.06 0.00 0.00 31.44 31.89 1ajw n GLU 154 CO 0.00 0.00 0.00 -1.83 -0.06 0.00 0.00 177.13 175.24 1ajw s GLU 155 N 0.00 4.24 0.32 5.31 -1.05 -1.26 -3.37 118.70 122.90 1ajw s GLU 155 Ca 0.00 1.93 -0.04 0.00 -0.15 0.00 0.00 54.97 56.71 1ajw s GLU 155 Cb 0.00 -3.73 0.07 0.00 -0.44 0.00 0.00 34.13 30.03 1ajw s GLU 155 CO 0.00 -0.68 0.44 0.66 0.95 0.00 0.00 175.26 176.63 1ajw n TYR 156 N 6.17 -3.74 -3.28 4.83 4.01 0.30 -4.82 117.16 120.63 1ajw n TYR 156 Ca 0.14 -0.49 -0.06 0.00 -0.16 0.00 0.00 57.90 57.33 1ajw n TYR 156 Cb 0.44 -0.33 -0.05 0.00 -0.31 0.00 0.00 39.34 39.08 1ajw n TYR 156 CO 0.00 0.00 0.00 -1.21 -0.46 0.00 0.00 176.86 175.19 1ajw s GLU 157 N -3.82 0.43 0.57 -0.72 2.02 -1.26 -3.17 118.70 112.75 1ajw s GLU 157 Ca 0.26 0.42 -0.07 0.00 0.02 0.00 0.00 54.97 55.61 1ajw s GLU 157 Cb -0.01 -0.17 -0.01 0.00 0.10 0.00 0.00 34.13 34.03 1ajw s GLU 157 CO 0.18 -0.86 0.90 0.12 0.02 0.00 0.00 175.26 175.62 1ajw s PHE 158 N 2.62 3.41 -0.37 1.61 5.36 0.98 -4.91 117.98 126.68 1ajw s PHE 158 Ca 0.12 0.82 0.01 0.00 -0.96 0.00 0.00 56.93 56.92 1ajw s PHE 158 Cb -0.13 -2.63 0.15 0.00 -0.34 0.00 0.00 43.02 40.07 1ajw s PHE 158 CO -0.24 -0.67 0.26 -0.51 -1.46 0.00 0.00 175.22 172.60 1ajw s LEU 159 N -4.97 1.03 0.53 6.12 1.43 -1.26 -2.69 118.68 118.87 1ajw s LEU 159 Ca 0.52 -2.41 -0.21 0.00 -1.03 0.00 0.00 54.13 51.01 1ajw s LEU 159 Cb -0.11 -0.35 -0.06 0.00 0.03 0.00 0.00 46.19 45.71 1ajw s LEU 159 CO 0.47 -0.27 1.20 0.42 0.23 0.00 0.00 176.35 178.40 1ajw s THR 160 N 0.80 2.84 0.74 5.49 -4.23 0.43 -4.93 115.64 116.78 1ajw s THR 160 Ca 0.22 0.57 -0.12 0.00 -1.18 0.00 0.00 61.69 61.18 1ajw s THR 160 Cb -0.15 -3.26 0.04 0.00 1.34 0.00 0.00 72.50 70.47 1ajw s THR 160 CO -0.05 -0.06 1.11 -2.16 -0.54 0.00 0.00 174.62 172.92 1ajw s PRO 161 N -3.04 2.32 -0.34 3.99 0.04 -1.26 -3.27 135.00 133.44 1ajw s PRO 161 Ca 0.71 1.33 -0.32 0.00 0.04 0.00 0.00 61.00 62.77 1ajw s PRO 161 Cb -0.30 -1.89 -0.09 0.00 0.04 0.00 0.00 34.50 32.26 1ajw s PRO 161 CO 0.34 -1.62 2.24 0.00 0.04 0.00 0.00 177.00 178.01 1ajw n MET 162 N -3.13 1.34 -2.98 4.56 0.00 -1.26 -4.35 117.12 111.30 1ajw n MET 162 Ca 0.10 0.33 -0.29 0.00 0.00 0.00 0.00 57.70 57.85 1ajw n MET 162 Cb 0.52 -2.80 -0.02 0.00 0.00 0.00 0.00 33.22 30.92 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 6.58 3.68 -0.10 3.17 2.12 0.29 -4.54 118.70 129.89 1ajw s GLU 163 Ca 1.06 0.24 -0.03 0.00 0.36 0.00 0.00 54.97 56.61 1ajw s GLU 163 Cb -0.62 -2.48 -0.03 0.00 0.26 0.00 0.00 34.13 31.26 1ajw s GLU 163 CO 0.42 0.01 0.01 -2.00 -0.54 0.00 0.00 175.26 173.16 1ajw s GLU 164 N -3.95 3.18 0.57 4.30 2.12 -1.26 0.86 118.70 124.52 1ajw s GLU 164 Ca 0.48 -0.41 0.02 0.00 0.36 0.00 0.00 54.97 55.42 1ajw s GLU 164 Cb -0.10 -2.86 0.05 0.00 0.26 0.00 0.00 34.13 31.48 1ajw s GLU 164 CO 0.34 0.60 0.80 0.00 -0.54 0.00 0.00 175.26 176.46 1ajw s ALA 165 N -0.60 3.98 1.17 6.30 0.00 -1.10 -4.92 121.76 126.59 1ajw s ALA 165 Ca 0.10 -1.50 -0.20 0.00 0.00 0.00 0.00 51.96 50.36 1ajw s ALA 165 Cb -0.12 -1.97 0.28 0.00 0.00 0.00 0.00 23.12 21.31 1ajw s ALA 165 CO 0.02 -0.85 1.19 -1.25 0.00 0.00 0.00 175.76 174.87 1ajw s PRO 166 N -4.79 -0.96 0.09 0.00 0.04 -1.26 -4.02 135.00 124.11 1ajw s PRO 166 Ca 0.59 -0.31 -0.01 0.00 0.04 0.00 0.00 61.00 61.30 1ajw s PRO 166 Cb -0.09 -1.65 0.02 0.00 0.04 0.00 0.00 34.50 32.82 1ajw s PRO 166 CO 0.39 -3.49 0.05 1.63 0.04 0.00 0.00 177.00 175.62 1ajw n LYS 167 N -4.55 -1.65 0.00 4.56 4.01 -1.26 -2.87 118.16 116.39 1ajw n LYS 167 Ca 0.16 -0.09 0.00 0.00 -0.51 0.00 0.00 58.31 57.87 1ajw n LYS 167 Cb 0.60 -0.12 0.00 0.00 -0.51 0.00 0.00 35.03 34.99 1ajw n LYS 167 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 1ajw n GLY 168 N -0.32 0.00 0.00 0.72 0.00 -1.26 -4.51 105.19 99.82 1ajw n GLY 168 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.03 1ajw n GLY 168 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1ajw n MET 169 N -2.03 0.00 0.00 1.61 2.81 -1.26 0.11 117.12 118.35 1ajw n MET 169 Ca 0.00 0.33 0.14 0.00 -1.81 0.00 0.00 57.70 56.36 1ajw n MET 169 Cb 0.07 -1.24 0.76 0.00 -0.71 0.00 0.00 33.22 32.11 1ajw n MET 169 CO 0.00 0.00 0.00 1.47 1.51 0.00 0.00 175.97 178.95 1ajw n LEU 170 N -1.35 0.00 -0.71 4.03 -0.00 -1.26 -3.25 117.00 114.46 1ajw n LEU 170 Ca 0.00 0.13 0.06 0.00 -0.00 0.00 0.00 56.01 56.20 1ajw n LEU 170 Cb 0.00 -0.13 0.16 0.00 -0.00 0.00 0.00 43.42 43.45 1ajw n LEU 170 CO 0.00 -0.02 0.32 0.00 -0.00 0.00 0.00 177.39 177.70 1ajw n ALA 171 N -1.13 3.24 -1.48 1.47 0.00 -1.13 -5.07 120.51 116.41 1ajw n ALA 171 Ca 0.17 -3.00 -0.30 0.00 0.00 0.00 0.00 53.44 50.31 1ajw n ALA 171 Cb 0.15 -0.43 0.09 0.00 0.00 0.00 0.00 19.45 19.26 1ajw n ALA 171 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 1ajw s ARG 172 N -2.51 2.07 0.00 0.00 3.52 0.29 -4.48 118.95 117.83 1ajw s ARG 172 Ca 0.36 0.73 0.00 0.00 -0.13 0.00 0.00 55.73 56.69 1ajw s ARG 172 Cb 0.36 -1.91 0.00 0.00 -1.56 0.00 0.00 34.95 31.84 1ajw s ARG 172 CO -0.08 -1.66 0.00 0.41 -0.81 0.00 0.00 175.30 173.17 1ajw n GLY 173 N -1.88 0.33 3.55 8.12 0.00 -1.20 -4.92 105.19 109.18 1ajw n GLY 173 Ca 0.07 -2.28 -0.34 0.00 0.00 0.00 0.00 46.02 43.47 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 -4.00 5.09 -0.18 1.61 1.04 -1.26 -0.25 113.70 115.75 1ajw s SER 174 Ca 0.00 -0.05 -0.08 0.00 0.48 0.00 0.00 55.95 56.31 1ajw s SER 174 Cb 0.00 -1.83 -0.04 0.00 0.10 0.00 0.00 66.02 64.25 1ajw s SER 174 CO 0.00 0.18 0.06 -0.31 0.98 0.00 0.00 173.24 174.16 1ajw s TYR 175 N 0.30 3.25 0.35 5.02 1.51 0.24 -4.56 117.35 123.46 1ajw s TYR 175 Ca -0.01 0.07 -0.26 0.00 -1.01 0.00 0.00 57.07 55.86 1ajw s TYR 175 Cb -0.13 -2.08 -0.09 0.00 -0.11 0.00 0.00 41.96 39.54 1ajw s TYR 175 CO 0.02 0.15 1.11 1.21 -1.11 0.00 0.00 175.55 176.93 1ajw s ASN 176 N 0.39 6.88 -0.09 2.29 3.84 0.17 0.98 114.94 129.40 1ajw s ASN 176 Ca 0.03 2.23 0.04 0.00 0.21 0.00 0.00 52.86 55.37 1ajw s ASN 176 Cb -0.12 -2.61 0.00 0.00 -0.55 0.00 0.00 41.25 37.97 1ajw s ASN 176 CO 0.00 -0.42 -0.22 -0.63 -2.79 0.00 0.00 177.10 173.04 1ajw s ILE 177 N -1.39 1.91 -0.46 -5.21 -1.09 0.30 0.21 121.20 115.47 1ajw s ILE 177 Ca 0.52 -0.94 -0.05 0.00 -2.23 0.00 0.00 60.65 57.96 1ajw s ILE 177 Cb -0.29 -1.65 0.12 0.00 -1.58 0.00 0.00 42.46 39.06 1ajw s ILE 177 CO 0.36 0.53 0.28 -0.75 -1.23 0.00 0.00 174.94 174.13 1ajw s LYS 178 N 0.35 2.23 -0.17 2.79 2.20 -0.14 -2.34 119.74 124.66 1ajw s LYS 178 Ca -0.17 -1.89 -0.08 0.00 -0.36 0.00 0.00 55.97 53.47 1ajw s LYS 178 Cb -0.17 -3.72 -0.04 0.00 -1.51 0.00 0.00 37.83 32.38 1ajw s LYS 178 CO 0.08 -1.13 0.12 -1.12 -0.36 0.00 0.00 175.35 172.94 1ajw s SER 179 N 1.98 6.14 -0.35 1.43 0.01 -1.18 -0.01 113.70 121.72 1ajw s SER 179 Ca 0.08 0.28 -0.00 0.00 1.31 0.00 0.00 55.95 57.63 1ajw s SER 179 Cb -0.23 -2.04 0.14 0.00 0.21 0.00 0.00 66.02 64.09 1ajw s SER 179 CO -0.03 0.26 0.21 -0.60 0.41 0.00 0.00 173.24 173.49 1ajw s ARG 180 N -0.14 0.56 -0.26 12.44 3.52 -0.50 -1.75 118.95 132.80 1ajw s ARG 180 Ca 0.10 -1.31 -0.29 0.00 -0.13 0.00 0.00 55.73 54.10 1ajw s ARG 180 Cb -0.12 -1.33 -0.00 0.00 -1.56 0.00 0.00 34.95 31.94 1ajw s ARG 180 CO 0.00 -1.20 1.29 0.12 -0.81 0.00 0.00 175.30 174.70 1ajw s PHE 181 N 1.10 2.74 0.24 5.12 2.19 -0.87 -3.19 117.98 125.31 1ajw s PHE 181 Ca 0.18 0.92 0.02 0.00 0.33 0.00 0.00 56.93 58.38 1ajw s PHE 181 Cb -0.23 -3.78 -0.01 0.00 -1.31 0.00 0.00 43.02 37.69 1ajw s PHE 181 CO -0.01 -1.68 0.07 -2.37 1.83 0.00 0.00 175.22 173.06 1ajw n THR 182 N 5.96 0.00 -1.29 0.12 5.66 -0.43 -2.86 114.28 121.44 1ajw n THR 182 Ca 0.14 -1.35 0.00 0.00 -3.05 0.00 0.00 64.05 59.80 1ajw n THR 182 Cb 0.46 0.45 0.00 0.00 -1.55 0.00 0.00 70.33 69.69 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 -1.67 0.02 0.25 1.09 5.68 -1.16 -0.78 116.55 119.99 1ajw n ASP 183 Ca -0.04 0.00 -0.17 0.00 -0.50 0.00 0.00 54.79 54.07 1ajw n ASP 183 Cb 0.35 0.00 -0.09 0.00 -1.14 0.00 0.00 41.12 40.24 1ajw n ASP 183 CO 0.00 0.00 0.00 -0.78 -1.33 0.00 0.00 177.20 175.09 1ajw h ASP 184 N 0.00 -1.26 0.00 -1.12 3.58 0.44 -3.39 116.42 114.67 1ajw h ASP 184 Ca 0.00 0.11 -0.02 0.00 0.42 0.00 0.00 57.03 57.54 1ajw h ASP 184 Cb 0.00 0.42 -0.02 0.00 1.72 0.00 0.00 39.33 41.46 1ajw h ASP 184 CO 0.00 -0.60 -0.03 0.47 -2.88 0.00 0.00 179.24 176.19 1ajw n ASP 185 N -5.53 -0.12 0.05 2.28 8.00 -1.26 -5.00 116.55 114.98 1ajw n ASP 185 Ca -0.11 -0.54 -0.21 0.00 0.71 0.00 0.00 54.79 54.64 1ajw n ASP 185 Cb 0.43 0.03 -0.15 0.00 -0.02 0.00 0.00 41.12 41.42 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 0.31 0.00 -1.24 3.08 -1.98 -3.50 114.38 111.06 1ajw h ARG 186 Ca -0.07 -0.53 0.00 0.00 0.07 0.00 0.00 59.98 59.45 1ajw h ARG 186 Cb 0.55 0.20 0.00 0.00 0.08 0.00 0.00 29.97 30.80 1ajw h ARG 186 CO -0.03 1.26 0.00 -2.37 -1.07 0.00 0.00 179.97 177.75 1ajw n THR 187 N -3.99 0.00 -3.52 2.04 5.66 -1.26 -5.08 114.28 108.13 1ajw n THR 187 Ca -0.18 0.00 -0.40 0.00 -3.05 0.00 0.00 64.05 60.41 1ajw n THR 187 Cb 0.89 0.00 -0.10 0.00 -1.55 0.00 0.00 70.33 69.57 1ajw n THR 187 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 175.07 171.40 1ajw s ASP 188 N 0.00 6.08 0.26 1.09 2.15 -1.26 -2.97 116.67 122.02 1ajw s ASP 188 Ca 0.00 -0.36 0.25 0.00 0.43 0.00 0.00 52.55 52.87 1ajw s ASP 188 Cb 0.00 -2.15 0.91 0.00 -0.30 0.00 0.00 42.92 41.39 1ajw s ASP 188 CO 0.00 -0.23 1.75 1.12 -0.17 0.00 0.00 175.17 177.64 1ajw h HIS 189 N 8.47 0.00 -1.91 -5.34 2.07 -1.84 -3.46 115.15 113.15 1ajw h HIS 189 Ca -0.31 0.00 0.12 0.00 -2.85 0.00 0.00 60.37 57.32 1ajw h HIS 189 Cb 1.16 0.00 -0.19 0.00 2.57 0.00 0.00 27.41 30.95 1ajw h HIS 189 CO 0.67 0.00 0.55 -1.17 -3.07 0.00 0.00 177.93 174.92 1ajw s LEU 190 N -4.66 -0.34 -0.23 6.12 2.96 -1.18 -4.87 118.68 116.47 1ajw s LEU 190 Ca 0.07 0.15 -0.27 0.00 -0.22 0.00 0.00 54.13 53.86 1ajw s LEU 190 Cb 0.10 1.88 0.12 0.00 0.50 0.00 0.00 46.19 48.80 1ajw s LEU 190 CO 0.49 -0.47 1.02 -0.94 -1.32 0.00 0.00 176.35 175.14 1ajw s SER 191 N -1.92 -0.42 0.00 3.68 1.04 -1.26 -2.06 113.70 112.76 1ajw s SER 191 Ca 0.03 0.68 0.00 0.00 0.48 0.00 0.00 55.95 57.14 1ajw s SER 191 Cb -0.01 0.65 0.00 0.00 0.10 0.00 0.00 66.02 66.76 1ajw s SER 191 CO -0.04 -0.22 0.00 -2.67 0.98 0.00 0.00 173.24 171.28 1ajw n TRP 192 N 1.64 0.00 -3.64 5.02 2.14 -0.72 -5.01 117.44 116.87 1ajw n TRP 192 Ca -0.12 0.00 -0.07 0.00 2.07 0.00 0.00 57.50 59.39 1ajw n TRP 192 Cb 0.57 0.00 -0.07 0.00 -0.81 0.00 0.00 31.31 31.00 1ajw n TRP 192 CO 0.00 0.00 0.00 -2.00 2.07 0.00 0.00 177.69 177.76 1ajw s GLU 193 N 1.39 0.58 0.14 -2.67 2.12 -1.26 -3.13 118.70 115.86 1ajw s GLU 193 Ca 0.00 0.90 -0.01 0.00 0.36 0.00 0.00 54.97 56.22 1ajw s GLU 193 Cb 0.00 0.17 -0.04 0.00 0.26 0.00 0.00 34.13 34.52 1ajw s GLU 193 CO 0.00 -0.10 0.05 1.67 -0.54 0.00 0.00 175.26 176.34 1ajw s TRP 194 N 1.15 0.92 0.24 5.30 1.48 -0.99 -4.52 118.94 122.52 1ajw s TRP 194 Ca -0.06 -1.21 0.06 0.00 -1.06 0.00 0.00 56.10 53.82 1ajw s TRP 194 Cb -0.05 -0.51 -0.03 0.00 -1.16 0.00 0.00 33.47 31.72 1ajw s TRP 194 CO -0.13 -0.48 0.29 -0.80 -4.06 0.00 0.00 176.95 171.77 1ajw s ASN 195 N -3.07 6.02 -0.22 -2.66 -0.87 -1.25 0.11 114.94 113.00 1ajw s ASN 195 Ca 0.25 -0.04 -0.01 0.00 -1.57 0.00 0.00 52.86 51.49 1ajw s ASN 195 Cb 0.07 -1.69 0.06 0.00 -0.02 0.00 0.00 41.25 39.67 1ajw s ASN 195 CO 0.02 -0.05 -0.01 -0.22 -2.57 0.00 0.00 177.10 174.27 1ajw s LEU 196 N -3.88 2.00 -0.05 0.60 2.96 0.28 -3.35 118.68 117.23 1ajw s LEU 196 Ca 0.34 -1.04 -0.25 0.00 -0.22 0.00 0.00 54.13 52.95 1ajw s LEU 196 Cb -0.09 -0.93 -0.04 0.00 0.50 0.00 0.00 46.19 45.64 1ajw s LEU 196 CO 0.27 -0.27 0.76 -0.89 -1.32 0.00 0.00 176.35 174.90 1ajw s THR 197 N 1.59 5.01 0.13 3.68 2.01 0.26 0.80 115.64 129.13 1ajw s THR 197 Ca -0.03 1.57 0.07 0.00 0.31 0.00 0.00 61.69 63.60 1ajw s THR 197 Cb -0.18 -4.10 -0.04 0.00 0.01 0.00 0.00 72.50 68.19 1ajw s THR 197 CO -0.07 0.24 -0.03 -0.63 -0.69 0.00 0.00 174.62 173.43 1ajw s ILE 198 N 0.82 3.69 0.00 1.82 -1.09 0.66 0.78 121.20 127.87 1ajw s ILE 198 Ca 0.40 -1.28 0.00 0.00 -2.23 0.00 0.00 60.65 57.55 1ajw s ILE 198 Cb -0.18 -2.79 0.00 0.00 -1.58 0.00 0.00 42.46 37.90 1ajw s ILE 198 CO 0.20 0.01 0.00 2.29 -1.23 0.00 0.00 174.94 176.21 1ajw n LYS 199 N 0.29 0.00 -0.08 2.79 2.85 0.38 -3.28 118.16 121.12 1ajw n LYS 199 Ca -0.11 0.00 -0.11 0.00 -1.05 0.00 0.00 58.31 57.04 1ajw n LYS 199 Cb 0.53 0.00 -0.08 0.00 -0.65 0.00 0.00 35.03 34.84 1ajw n LYS 199 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 177.40 178.98 1ajw n LYS 200 N 0.00 0.49 -3.44 -1.58 5.02 -1.26 -2.92 118.16 114.47 1ajw n LYS 200 Ca 0.00 0.09 -0.22 0.00 -2.02 0.00 0.00 58.31 56.16 1ajw n LYS 200 Cb 0.00 -1.33 -0.11 0.00 -0.02 0.00 0.00 35.03 33.57 1ajw n LYS 200 CO 0.00 0.00 0.00 -2.00 -0.52 0.00 0.00 177.40 174.88 1ajw s GLU 201 N -2.33 0.34 -0.26 1.97 2.56 -1.26 -4.59 118.70 115.14 1ajw s GLU 201 Ca -0.21 -0.43 0.00 0.00 0.00 0.00 0.00 54.97 54.33 1ajw s GLU 201 Cb 0.06 -0.86 0.25 0.00 2.00 0.00 0.00 34.13 35.58 1ajw s GLU 201 CO 0.38 -1.06 1.72 -2.67 -0.56 0.00 0.00 175.26 173.08 1ajw n TRP 202 N 5.07 1.44 -2.10 5.30 4.27 -1.26 -3.97 117.44 126.18 1ajw n TRP 202 Ca -0.01 -1.53 -0.03 0.00 -3.89 0.00 0.00 57.50 52.05 1ajw n TRP 202 Cb 0.44 -0.76 0.01 0.00 -1.36 0.00 0.00 31.31 29.64 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 0.08 0.29 0.00 -2.67 2.85 -1.26 -4.47 118.16 112.98 1ajw n LYS 203 Ca 0.28 -0.56 0.14 0.00 -1.05 0.00 0.00 58.31 57.12 1ajw n LYS 203 Cb 0.80 0.38 0.82 0.00 -0.65 0.00 0.00 35.03 36.38 1ajw n LYS 203 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 177.40 173.88