#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xki n VAL 13 N 0.00 0.00 -2.37 2.12 0.24 -1.26 -4.89 118.33 112.17 1xki n VAL 13 Ca 0.00 -0.13 -0.35 0.00 -2.04 0.00 0.00 64.34 61.82 1xki n VAL 13 Cb 0.00 0.48 -0.01 0.00 -1.47 0.00 0.00 33.84 32.83 1xki n VAL 13 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 1xki s SER 14 N -2.52 5.96 0.00 -1.34 1.04 -1.26 -4.76 113.70 110.82 1xki s SER 14 Ca 0.23 2.08 0.00 0.00 0.48 0.00 0.00 55.95 58.74 1xki s SER 14 Cb 0.19 -2.57 0.00 0.00 0.10 0.00 0.00 66.02 63.74 1xki s SER 14 CO 0.53 -1.05 0.00 0.61 0.98 0.00 0.00 173.24 174.31 1xki n GLY 15 N 0.00 0.52 3.52 7.32 0.00 -0.60 -4.97 105.19 110.98 1xki n GLY 15 Ca 0.11 -1.80 -0.36 0.00 0.00 0.00 0.00 46.02 43.97 1xki n GLY 15 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1xki s THR 16 N -1.98 4.49 -0.12 2.61 2.01 -1.26 -1.10 115.64 120.28 1xki s THR 16 Ca 0.00 -0.12 -0.00 0.00 0.31 0.00 0.00 61.69 61.87 1xki s THR 16 Cb 0.00 -3.06 -0.02 0.00 0.01 0.00 0.00 72.50 69.43 1xki s THR 16 CO 0.00 0.39 -0.11 0.26 -0.69 0.00 0.00 174.62 174.47 1xki s TRP 17 N 1.07 2.84 -0.12 4.92 0.52 0.40 -4.48 118.94 124.08 1xki s TRP 17 Ca 0.04 -0.52 -0.03 0.00 0.02 0.00 0.00 56.10 55.61 1xki s TRP 17 Cb -0.14 -1.84 -0.03 0.00 -1.15 0.00 0.00 33.47 30.31 1xki s TRP 17 CO 0.03 -0.13 -0.02 0.71 0.02 0.00 0.00 176.95 177.56 1xki s TYR 18 N 0.22 3.07 0.03 -1.98 1.51 0.10 -1.39 117.35 118.91 1xki s TYR 18 Ca -0.07 -0.05 -0.30 0.00 -1.01 0.00 0.00 57.07 55.63 1xki s TYR 18 Cb -0.15 -1.87 -0.04 0.00 -0.11 0.00 0.00 41.96 39.78 1xki s TYR 18 CO 0.05 0.21 1.12 -1.17 -1.11 0.00 0.00 175.55 174.65 1xki s LEU 19 N -0.24 4.36 -0.20 -1.29 2.96 -1.26 -1.32 118.68 121.69 1xki s LEU 19 Ca 0.05 1.87 0.06 0.00 -0.22 0.00 0.00 54.13 55.89 1xki s LEU 19 Cb -0.13 -3.57 -0.16 0.00 0.50 0.00 0.00 46.19 42.83 1xki s LEU 19 CO 0.02 -0.41 -0.11 0.29 -1.32 0.00 0.00 176.35 174.82 1xki n LYS 20 N 4.07 0.77 -3.59 1.98 4.76 0.22 -4.61 118.16 121.75 1xki n LYS 20 Ca 0.08 0.08 -0.13 0.00 -2.87 0.00 0.00 58.31 55.47 1xki n LYS 20 Cb 0.48 -1.43 -0.06 0.00 -1.84 0.00 0.00 35.03 32.17 1xki n LYS 20 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1xki s ALA 21 N -2.43 -1.85 -0.00 7.82 0.00 -1.19 -4.28 121.76 119.83 1xki s ALA 21 Ca -0.22 1.72 -0.03 0.00 0.00 0.00 0.00 51.96 53.42 1xki s ALA 21 Cb 0.07 -0.83 -0.00 0.00 0.00 0.00 0.00 23.12 22.35 1xki s ALA 21 CO 0.56 -0.32 0.06 1.41 0.00 0.00 0.00 175.76 177.47 1xki s MET 22 N -0.35 0.28 0.41 0.00 0.00 -0.42 -0.64 119.30 118.58 1xki s MET 22 Ca -0.03 -0.29 -0.23 0.00 0.00 0.00 0.00 55.69 55.14 1xki s MET 22 Cb -0.03 0.11 -0.09 0.00 0.00 0.00 0.00 34.83 34.83 1xki s MET 22 CO 0.02 -0.06 1.03 0.95 0.00 0.00 0.00 175.02 176.97 1xki s THR 23 N -0.90 3.81 0.31 10.11 -4.23 -0.46 -0.84 115.64 123.44 1xki s THR 23 Ca -0.10 1.32 0.03 0.00 -1.18 0.00 0.00 61.69 61.76 1xki s THR 23 Cb -0.06 -3.65 -0.04 0.00 1.34 0.00 0.00 72.50 70.09 1xki s THR 23 CO 0.00 -0.05 0.14 -0.69 -0.54 0.00 0.00 174.62 173.48 1xki s VAL 24 N -1.75 0.45 0.99 2.29 1.01 0.08 -4.72 120.40 118.75 1xki s VAL 24 Ca 0.59 -2.00 -0.16 0.00 0.00 0.00 0.00 61.98 60.41 1xki s VAL 24 Cb -0.20 -2.53 -0.03 0.00 0.00 0.00 0.00 36.38 33.61 1xki s VAL 24 CO 0.25 0.00 -0.20 -3.20 0.00 0.00 0.00 175.10 171.95 1xki n ASN 32 N -0.87 -3.48 0.00 3.32 5.15 -1.26 -2.32 115.26 115.80 1xki n ASN 32 Ca -0.00 0.20 0.00 0.00 -0.60 0.00 0.00 54.58 54.17 1xki n ASN 32 Cb 0.65 -0.97 0.00 0.00 -0.53 0.00 0.00 39.78 38.93 1xki n ASN 32 CO 0.00 0.00 0.00 0.18 1.40 0.00 0.00 177.26 178.84 1xki n LEU 33 N 0.58 0.00 0.22 1.20 4.77 -1.26 -4.20 117.00 118.32 1xki n LEU 33 Ca 0.02 0.00 0.08 0.00 -0.03 0.00 0.00 56.01 56.08 1xki n LEU 33 Cb 0.57 0.00 0.52 0.00 -2.33 0.00 0.00 43.42 42.18 1xki n LEU 33 CO 0.51 0.00 0.83 -0.33 -1.33 0.00 0.00 177.39 177.07 1xki h GLU 34 N 0.00 0.00 -0.57 3.23 4.39 -2.08 -3.22 114.58 116.33 1xki h GLU 34 Ca 0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 1xki h GLU 34 Cb 0.00 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.65 1xki h GLU 34 CO 0.00 0.25 0.00 -1.13 -1.16 0.00 0.00 179.01 176.97 1xki n SER 35 N -3.80 3.09 -4.72 1.42 3.41 -1.26 -4.95 113.62 106.81 1xki n SER 35 Ca -0.01 -2.02 -0.42 0.00 -0.26 0.00 0.00 58.87 56.15 1xki n SER 35 Cb 0.35 -0.39 -0.03 0.00 -0.26 0.00 0.00 64.21 63.88 1xki n SER 35 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1xki s VAL 36 N -1.28 2.03 -0.07 -3.33 1.01 -1.22 -5.01 120.40 112.54 1xki s VAL 36 Ca 0.38 0.03 -0.12 0.00 0.00 0.00 0.00 61.98 62.26 1xki s VAL 36 Cb 0.20 -3.02 0.03 0.00 0.00 0.00 0.00 36.38 33.59 1xki s VAL 36 CO 0.25 0.00 0.31 0.28 0.00 0.00 0.00 175.10 175.94 1xki s THR 37 N 1.03 0.03 0.84 3.92 -1.32 -1.26 -4.64 115.64 114.23 1xki s THR 37 Ca 0.73 -0.24 -0.12 0.00 -1.21 0.00 0.00 61.69 60.85 1xki s THR 37 Cb -0.49 -0.52 0.12 0.00 -1.51 0.00 0.00 72.50 70.09 1xki s THR 37 CO 0.34 -0.13 1.19 -2.16 -2.21 0.00 0.00 174.62 171.65 1xki s PRO 38 N -0.55 1.58 -0.04 7.08 0.04 -1.26 -4.76 135.00 137.09 1xki s PRO 38 Ca -0.07 -0.16 0.06 0.00 0.04 0.00 0.00 61.00 60.87 1xki s PRO 38 Cb -0.04 -1.97 -0.01 0.00 0.04 0.00 0.00 34.50 32.52 1xki s PRO 38 CO 0.02 -1.79 -0.22 1.41 0.04 0.00 0.00 177.00 176.46 1xki s MET 39 N -5.60 2.04 -0.14 4.56 1.75 -0.49 -4.61 119.30 116.81 1xki s MET 39 Ca 0.66 -0.79 -0.04 0.00 -1.25 0.00 0.00 55.69 54.27 1xki s MET 39 Cb -0.08 -1.84 -0.03 0.00 2.84 0.00 0.00 34.83 35.71 1xki s MET 39 CO 0.49 0.40 -0.01 0.99 -0.65 0.00 0.00 175.02 176.24 1xki s THR 40 N -0.28 4.19 -0.17 10.11 2.01 0.01 -0.46 115.64 131.05 1xki s THR 40 Ca 0.02 -0.26 -0.02 0.00 0.31 0.00 0.00 61.69 61.74 1xki s THR 40 Cb -0.11 -2.83 -0.01 0.00 0.01 0.00 0.00 72.50 69.56 1xki s THR 40 CO 0.01 0.52 -0.09 -0.76 -0.69 0.00 0.00 174.62 173.62 1xki s LEU 41 N -0.02 2.83 -0.09 4.42 1.43 -0.26 -0.94 118.68 126.04 1xki s LEU 41 Ca 0.03 -0.34 0.04 0.00 -1.03 0.00 0.00 54.13 52.83 1xki s LEU 41 Cb -0.13 -1.68 -0.01 0.00 0.03 0.00 0.00 46.19 44.41 1xki s LEU 41 CO 0.02 0.09 -0.23 -0.89 0.23 0.00 0.00 176.35 175.57 1xki s THR 42 N 0.83 2.18 0.14 5.49 2.01 -0.40 -1.55 115.64 124.34 1xki s THR 42 Ca -0.03 -0.99 -0.30 0.00 0.31 0.00 0.00 61.69 60.68 1xki s THR 42 Cb -0.15 -1.83 -0.07 0.00 0.01 0.00 0.00 72.50 70.47 1xki s THR 42 CO 0.01 0.56 1.03 -0.89 -0.69 0.00 0.00 174.62 174.64 1xki s THR 43 N 0.17 4.19 0.25 -0.82 2.01 -1.26 -0.53 115.64 119.65 1xki s THR 43 Ca -0.13 1.85 0.07 0.00 0.31 0.00 0.00 61.69 63.79 1xki s THR 43 Cb -0.16 -4.18 -0.04 0.00 0.01 0.00 0.00 72.50 68.13 1xki s THR 43 CO 0.07 0.30 0.17 -0.76 -0.69 0.00 0.00 174.62 173.70 1xki s LEU 44 N -0.16 3.73 0.19 4.42 1.43 0.19 -4.93 118.68 123.55 1xki s LEU 44 Ca 0.48 -0.30 -0.32 0.00 -1.03 0.00 0.00 54.13 52.96 1xki s LEU 44 Cb -0.26 -2.26 -0.11 0.00 0.03 0.00 0.00 46.19 43.59 1xki s LEU 44 CO 0.32 -0.03 1.65 -1.61 0.23 0.00 0.00 176.35 176.91 1xki s GLU 45 N -3.79 4.17 0.00 1.70 2.02 -1.26 -1.82 118.70 119.72 1xki s GLU 45 Ca 0.33 2.48 0.00 0.00 0.02 0.00 0.00 54.97 57.80 1xki s GLU 45 Cb -0.08 -3.12 0.00 0.00 0.10 0.00 0.00 34.13 31.04 1xki s GLU 45 CO 0.24 -0.68 0.00 0.41 0.02 0.00 0.00 175.26 175.25 1xki n GLY 46 N 3.87 0.46 0.71 -1.39 0.00 -1.26 -4.56 105.19 103.02 1xki n GLY 46 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.17 1xki n GLY 46 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xki n GLY 47 N -1.52 0.69 3.77 -0.02 0.00 -0.75 -4.96 105.19 102.40 1xki n GLY 47 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.72 1xki n GLY 47 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1xki s ASN 48 N -2.58 4.01 0.07 1.61 0.01 -1.25 -4.57 114.94 112.24 1xki s ASN 48 Ca 0.00 1.34 0.10 0.00 -0.71 0.00 0.00 52.86 53.59 1xki s ASN 48 Cb 0.00 -2.04 -0.03 0.00 0.41 0.00 0.00 41.25 39.59 1xki s ASN 48 CO 0.00 -2.28 -0.26 -0.76 -1.51 0.00 0.00 177.10 172.29 1xki s LEU 49 N -5.97 2.22 -0.21 0.60 1.43 -0.57 -0.64 118.68 115.55 1xki s LEU 49 Ca 0.62 -0.64 -0.10 0.00 -1.03 0.00 0.00 54.13 52.99 1xki s LEU 49 Cb -0.16 -1.22 -0.05 0.00 0.03 0.00 0.00 46.19 44.80 1xki s LEU 49 CO 0.55 0.22 0.12 -0.70 0.23 0.00 0.00 176.35 176.77 1xki s GLU 50 N -1.52 4.12 -0.17 1.70 2.12 0.31 -0.78 118.70 124.47 1xki s GLU 50 Ca 0.12 -0.26 -0.07 0.00 0.36 0.00 0.00 54.97 55.12 1xki s GLU 50 Cb -0.10 -3.41 -0.04 0.00 0.26 0.00 0.00 34.13 30.84 1xki s GLU 50 CO 0.03 0.23 0.07 0.00 -0.54 0.00 0.00 175.26 175.06 1xki s ALA 51 N 0.55 3.49 -0.01 6.30 0.00 0.33 -1.27 121.76 131.15 1xki s ALA 51 Ca 0.07 -0.73 0.01 0.00 0.00 0.00 0.00 51.96 51.32 1xki s ALA 51 Cb -0.12 -1.92 0.00 0.00 0.00 0.00 0.00 23.12 21.08 1xki s ALA 51 CO 0.00 0.27 -0.04 0.21 0.00 0.00 0.00 175.76 176.19 1xki s LYS 52 N 0.09 0.46 0.25 0.00 2.20 -0.12 -0.44 119.74 122.19 1xki s LYS 52 Ca 0.06 -0.15 0.01 0.00 -0.36 0.00 0.00 55.97 55.54 1xki s LYS 52 Cb -0.12 -0.47 -0.05 0.00 -1.51 0.00 0.00 37.83 35.68 1xki s LYS 52 CO 0.00 0.06 0.09 0.14 -0.36 0.00 0.00 175.35 175.28 1xki s VAL 53 N 0.14 0.54 -0.09 4.02 -7.23 -0.61 -0.81 120.40 116.36 1xki s VAL 53 Ca -0.01 -2.00 0.04 0.00 -1.81 0.00 0.00 61.98 58.20 1xki s VAL 53 Cb -0.05 -2.60 -0.00 0.00 0.56 0.00 0.00 36.38 34.29 1xki s VAL 53 CO -0.00 -0.03 -0.24 -0.89 -0.31 0.00 0.00 175.10 173.62 1xki s THR 54 N -3.77 2.05 0.00 5.32 2.01 -1.26 -0.94 115.64 119.04 1xki s THR 54 Ca 0.37 -1.02 0.00 0.00 0.31 0.00 0.00 61.69 61.35 1xki s THR 54 Cb 0.08 -1.76 0.00 0.00 0.01 0.00 0.00 72.50 70.82 1xki s THR 54 CO 0.13 0.56 0.00 0.23 -0.69 0.00 0.00 174.62 174.85 1xki n MET 55 N 3.44 0.92 -2.00 4.92 2.81 -0.06 -4.95 117.12 122.20 1xki n MET 55 Ca -0.19 0.00 -0.43 0.00 -1.81 0.00 0.00 57.70 55.27 1xki n MET 55 Cb 0.53 0.00 -0.03 0.00 -0.71 0.00 0.00 33.22 33.01 1xki n MET 55 CO 0.00 0.00 0.00 0.45 1.51 0.00 0.00 175.97 177.93 1xki s SER 58 N 1.00 6.06 0.00 7.83 0.15 -1.26 0.57 113.70 128.05 1xki s SER 58 Ca 0.00 1.51 0.00 0.00 0.70 0.00 0.00 55.95 58.16 1xki s SER 58 Cb 0.00 -2.53 0.00 0.00 -1.71 0.00 0.00 66.02 61.78 1xki s SER 58 CO 0.00 -1.54 0.00 0.61 1.20 0.00 0.00 173.24 173.51 1xki n GLY 59 N 5.15 -0.43 3.99 9.45 0.00 -1.26 -5.13 105.19 116.95 1xki n GLY 59 Ca 0.22 0.10 -0.19 0.00 0.00 0.00 0.00 46.02 46.15 1xki n GLY 59 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1xki s ARG 60 N 0.00 2.79 -0.23 1.61 0.52 -1.26 -5.08 118.95 117.31 1xki s ARG 60 Ca 0.00 -1.01 -0.21 0.00 -0.52 0.00 0.00 55.73 53.99 1xki s ARG 60 Cb 0.00 -2.67 -0.02 0.00 0.52 0.00 0.00 34.95 32.79 1xki s ARG 60 CO 0.00 -0.37 0.66 0.00 0.02 0.00 0.00 175.30 175.61 1xki s GLN 62 N 2.29 0.07 0.30 0.00 0.74 0.19 -4.96 119.66 118.30 1xki s GLN 62 Ca 0.29 -0.05 -0.29 0.00 0.05 0.00 0.00 55.36 55.36 1xki s GLN 62 Cb -0.16 0.03 -0.10 0.00 1.10 0.00 0.00 33.01 33.89 1xki s GLN 62 CO 0.09 -0.01 1.14 -2.00 -0.55 0.00 0.00 175.29 173.96 1xki s GLU 63 N -0.19 4.53 -0.08 1.67 2.12 -1.26 -0.88 118.70 124.62 1xki s GLU 63 Ca -0.02 1.86 0.00 0.00 0.36 0.00 0.00 54.97 57.17 1xki s GLU 63 Cb -0.01 -3.11 0.02 0.00 0.26 0.00 0.00 34.13 31.29 1xki s GLU 63 CO -0.00 0.10 -0.06 0.08 -0.54 0.00 0.00 175.26 174.83 1xki s VAL 64 N -1.20 0.83 0.08 3.70 1.01 -0.12 -4.96 120.40 119.74 1xki s VAL 64 Ca 0.47 -0.21 0.10 0.00 0.00 0.00 0.00 61.98 62.33 1xki s VAL 64 Cb -0.33 -0.85 -0.03 0.00 0.00 0.00 0.00 36.38 35.17 1xki s VAL 64 CO 0.42 0.32 -0.26 -0.54 0.00 0.00 0.00 175.10 175.04 1xki s LYS 65 N 1.40 1.60 -0.03 2.72 1.02 -1.26 -1.57 119.74 123.62 1xki s LYS 65 Ca -0.02 -1.18 -0.11 0.00 0.02 0.00 0.00 55.97 54.68 1xki s LYS 65 Cb -0.13 -1.89 0.02 0.00 -0.52 0.00 0.00 37.83 35.31 1xki s LYS 65 CO -0.04 0.47 0.25 0.00 -0.92 0.00 0.00 175.35 175.12 1xki s ALA 66 N -0.90 -0.63 -0.15 5.17 0.00 0.42 -4.99 121.76 120.69 1xki s ALA 66 Ca 0.12 0.30 -0.15 0.00 0.00 0.00 0.00 51.96 52.22 1xki s ALA 66 Cb -0.10 -0.04 -0.04 0.00 0.00 0.00 0.00 23.12 22.94 1xki s ALA 66 CO 0.03 -0.21 0.35 0.08 0.00 0.00 0.00 175.76 176.01 1xki s VAL 67 N -1.00 5.27 -0.34 0.00 1.01 -1.26 -0.52 120.40 123.55 1xki s VAL 67 Ca -0.11 0.68 -0.14 0.00 0.00 0.00 0.00 61.98 62.42 1xki s VAL 67 Cb -0.05 -3.69 -0.01 0.00 0.00 0.00 0.00 36.38 32.62 1xki s VAL 67 CO 0.03 0.37 0.29 -0.76 0.00 0.00 0.00 175.10 175.03 1xki s LEU 68 N 0.51 4.52 -0.07 3.92 1.43 0.04 -4.62 118.68 124.41 1xki s LEU 68 Ca 0.20 -0.37 -0.26 0.00 -1.03 0.00 0.00 54.13 52.66 1xki s LEU 68 Cb -0.14 -2.22 -0.03 0.00 0.03 0.00 0.00 46.19 43.84 1xki s LEU 68 CO 0.06 -0.29 0.83 -1.61 0.23 0.00 0.00 176.35 175.57 1xki s GLU 69 N 1.84 4.45 0.44 1.70 2.02 0.08 -1.51 118.70 127.71 1xki s GLU 69 Ca 0.08 1.10 -0.24 0.00 0.02 0.00 0.00 54.97 55.93 1xki s GLU 69 Cb -0.17 -3.48 -0.08 0.00 0.10 0.00 0.00 34.13 30.50 1xki s GLU 69 CO 0.11 -0.07 1.23 0.21 0.02 0.00 0.00 175.26 176.77 1xki s LYS 70 N 1.19 3.83 0.43 1.61 2.47 -1.26 -1.63 119.74 126.37 1xki s LYS 70 Ca 0.43 1.97 0.05 0.00 -1.56 0.00 0.00 55.97 56.86 1xki s LYS 70 Cb -0.19 -2.58 0.05 0.00 -1.46 0.00 0.00 37.83 33.66 1xki s LYS 70 CO 0.20 -0.55 0.39 0.25 0.16 0.00 0.00 175.35 175.80 1xki n THR 71 N -0.20 0.00 1.40 3.43 -2.24 -1.05 -4.87 114.28 110.75 1xki n THR 71 Ca 0.06 -1.62 0.13 0.00 -2.27 0.00 0.00 64.05 60.34 1xki n THR 71 Cb 0.46 -0.26 0.70 0.00 -2.10 0.00 0.00 70.33 69.13 1xki n THR 71 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1xki n ASP 72 N -2.02 0.00 -4.60 3.42 8.00 -1.26 -4.78 116.55 115.31 1xki n ASP 72 Ca 0.02 -0.41 -0.35 0.00 0.71 0.00 0.00 54.79 54.76 1xki n ASP 72 Cb 0.47 -0.16 -0.10 0.00 -0.02 0.00 0.00 41.12 41.31 1xki n ASP 72 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 1xki s GLU 73 N -2.31 3.92 -0.03 -1.24 2.02 -1.26 -5.05 118.70 114.74 1xki s GLU 73 Ca 0.31 -0.36 -0.38 0.00 0.02 0.00 0.00 54.97 54.56 1xki s GLU 73 Cb 0.17 -3.25 -0.16 0.00 0.10 0.00 0.00 34.13 30.99 1xki s GLU 73 CO 0.35 0.18 1.51 -2.30 0.02 0.00 0.00 175.26 175.02 1xki n PRO 74 N 3.82 1.26 -0.94 0.39 -0.02 -1.26 -1.99 135.00 136.26 1xki n PRO 74 Ca -0.16 0.46 0.00 0.00 -2.02 0.00 0.00 63.50 61.77 1xki n PRO 74 Cb 0.52 -2.13 0.00 0.00 -0.02 0.00 0.00 33.50 31.87 1xki n PRO 74 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1xki n GLY 75 N 3.20 1.01 3.53 -1.23 0.00 -1.26 -4.98 105.19 105.46 1xki n GLY 75 Ca 0.21 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.89 1xki n GLY 75 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1xki s LYS 76 N -0.04 3.66 0.10 1.61 2.20 -0.84 -0.99 119.74 125.44 1xki s LYS 76 Ca 0.00 -0.49 0.04 0.00 -0.36 0.00 0.00 55.97 55.16 1xki s LYS 76 Cb 0.00 -2.94 -0.04 0.00 -1.51 0.00 0.00 37.83 33.35 1xki s LYS 76 CO 0.00 0.28 -0.10 0.71 -0.36 0.00 0.00 175.35 175.88 1xki s TYR 77 N 0.27 1.10 0.21 4.03 1.51 0.10 -2.51 117.35 122.06 1xki s TYR 77 Ca -0.02 -0.66 0.11 0.00 -1.01 0.00 0.00 57.07 55.49 1xki s TYR 77 Cb -0.14 -0.60 -0.05 0.00 -0.11 0.00 0.00 41.96 41.07 1xki s TYR 77 CO 0.03 0.01 -0.21 0.95 -1.11 0.00 0.00 175.55 175.22 1xki s THR 78 N -2.48 2.20 0.29 -0.71 -4.23 -0.65 -0.95 115.64 109.10 1xki s THR 78 Ca 0.06 -2.12 -0.05 0.00 -1.18 0.00 0.00 61.69 58.41 1xki s THR 78 Cb -0.03 -2.09 -0.01 0.00 1.34 0.00 0.00 72.50 71.71 1xki s THR 78 CO 0.00 -0.29 0.40 0.00 -0.54 0.00 0.00 174.62 174.20 1xki s ALA 79 N -2.11 0.61 -1.36 3.99 0.00 0.31 -0.74 121.76 122.46 1xki s ALA 79 Ca 0.22 -1.40 -0.07 0.00 0.00 0.00 0.00 51.96 50.72 1xki s ALA 79 Cb -0.06 1.19 0.00 0.00 0.00 0.00 0.00 23.12 24.25 1xki s ALA 79 CO 0.10 -0.77 0.46 -0.25 0.00 0.00 0.00 175.76 175.30 1xki n ASP 80 N -0.92 -1.39 -1.91 0.00 8.00 -1.26 -1.29 116.55 117.77 1xki n ASP 80 Ca 0.01 -1.06 -0.17 0.00 0.71 0.00 0.00 54.79 54.28 1xki n ASP 80 Cb 0.62 -2.83 -0.01 0.00 -0.02 0.00 0.00 41.12 38.88 1xki n ASP 80 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1xki n GLY 81 N -2.01 -0.32 1.93 0.44 0.00 -1.26 -2.38 105.19 101.60 1xki n GLY 81 Ca -0.26 -0.18 0.00 0.00 0.00 0.00 0.00 46.02 45.58 1xki n GLY 81 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xki n GLY 82 N -1.02 1.31 0.18 -0.02 0.00 -0.41 -4.90 105.19 100.33 1xki n GLY 82 Ca -0.20 0.00 0.14 0.00 0.00 0.00 0.00 46.02 45.96 1xki n GLY 82 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1xki n LYS 83 N -2.00 0.90 -4.71 1.61 5.02 -1.00 -4.73 118.16 113.25 1xki n LYS 83 Ca 0.00 -0.36 -0.26 0.00 -2.02 0.00 0.00 58.31 55.67 1xki n LYS 83 Cb 0.00 -1.49 -0.17 0.00 -0.02 0.00 0.00 35.03 33.35 1xki n LYS 83 CO 0.00 0.00 0.00 -1.58 -0.52 0.00 0.00 177.40 175.30 1xki s HIS 84 N -2.35 1.69 -0.06 2.13 2.46 -0.74 -4.07 115.29 114.36 1xki s HIS 84 Ca 0.32 -0.65 0.04 0.00 0.47 0.00 0.00 55.06 55.24 1xki s HIS 84 Cb 0.20 -1.21 -0.00 0.00 -0.13 0.00 0.00 32.58 31.45 1xki s HIS 84 CO 0.45 -0.31 -0.19 0.08 -2.47 0.00 0.00 174.74 172.30 1xki s VAL 85 N 0.61 1.59 -0.05 0.89 1.01 -0.04 -0.53 120.40 123.88 1xki s VAL 85 Ca -0.15 -0.78 0.05 0.00 0.00 0.00 0.00 61.98 61.09 1xki s VAL 85 Cb -0.16 -1.38 -0.01 0.00 0.00 0.00 0.00 36.38 34.84 1xki s VAL 85 CO 0.05 0.45 -0.21 0.00 0.00 0.00 0.00 175.10 175.39 1xki s ALA 86 N 0.17 1.82 -0.11 5.51 0.00 -0.13 -1.22 121.76 127.81 1xki s ALA 86 Ca -0.08 -0.85 0.02 0.00 0.00 0.00 0.00 51.96 51.04 1xki s ALA 86 Cb -0.14 -0.58 -0.01 0.00 0.00 0.00 0.00 23.12 22.39 1xki s ALA 86 CO 0.04 0.34 -0.18 0.71 0.00 0.00 0.00 175.76 176.66 1xki s TYR 87 N -0.05 2.68 -0.29 0.00 1.51 0.70 -0.72 117.35 121.18 1xki s TYR 87 Ca -0.04 -0.78 -0.11 0.00 -1.01 0.00 0.00 57.07 55.13 1xki s TYR 87 Cb -0.13 -1.76 -0.04 0.00 -0.11 0.00 0.00 41.96 39.93 1xki s TYR 87 CO 0.03 -0.27 0.19 0.42 -1.11 0.00 0.00 175.55 174.81 1xki s ILE 88 N 0.23 5.19 -0.08 2.71 1.01 -0.16 -1.05 121.20 129.05 1xki s ILE 88 Ca -0.12 0.02 0.03 0.00 0.00 0.00 0.00 60.65 60.59 1xki s ILE 88 Cb -0.16 -3.52 -0.01 0.00 0.01 0.00 0.00 42.46 38.77 1xki s ILE 88 CO 0.06 0.19 -0.19 -0.63 0.00 0.00 0.00 174.94 174.37 1xki s ILE 89 N 1.73 2.55 0.56 2.92 1.01 0.58 -4.78 121.20 125.76 1xki s ILE 89 Ca 0.07 -0.87 -0.18 0.00 0.00 0.00 0.00 60.65 59.66 1xki s ILE 89 Cb -0.16 -1.99 -0.05 0.00 0.01 0.00 0.00 42.46 40.26 1xki s ILE 89 CO 0.10 0.56 1.09 -0.13 0.00 0.00 0.00 174.94 176.56 1xki s ARG 90 N -0.05 3.37 0.17 2.79 0.52 -1.26 -0.88 118.95 123.60 1xki s ARG 90 Ca -0.05 1.43 0.07 0.00 -0.52 0.00 0.00 55.73 56.66 1xki s ARG 90 Cb -0.14 -2.02 -0.04 0.00 0.52 0.00 0.00 34.95 33.26 1xki s ARG 90 CO 0.04 -0.80 -0.02 0.45 0.02 0.00 0.00 175.30 174.99 1xki s SER 91 N -2.17 4.67 0.10 0.23 0.15 -1.26 -4.71 113.70 110.71 1xki s SER 91 Ca 0.68 -0.42 0.23 0.00 0.70 0.00 0.00 55.95 57.15 1xki s SER 91 Cb -0.20 -0.96 0.92 0.00 -1.71 0.00 0.00 66.02 64.07 1xki s SER 91 CO 0.30 0.10 1.72 1.41 1.20 0.00 0.00 173.24 177.97 1xki n HIS 92 N -0.00 0.38 -3.33 3.44 -0.00 -1.26 -4.74 115.22 109.71 1xki n HIS 92 Ca -0.10 0.13 -0.39 0.00 -0.00 0.00 0.00 57.72 57.36 1xki n HIS 92 Cb 0.55 -0.71 -0.08 0.00 -0.00 0.00 0.00 29.99 29.75 1xki n HIS 92 CO 0.00 0.00 0.00 0.08 -0.00 0.00 0.00 176.34 176.42 1xki s VAL 93 N -3.09 5.14 0.23 1.59 1.01 -1.26 -5.04 120.40 118.98 1xki s VAL 93 Ca 0.09 0.75 -0.29 0.00 0.00 0.00 0.00 61.98 62.53 1xki s VAL 93 Cb 0.13 -3.76 -0.16 0.00 0.00 0.00 0.00 36.38 32.59 1xki s VAL 93 CO 0.44 0.17 0.84 1.17 0.00 0.00 0.00 175.10 177.72 1xki n LYS 94 N 5.08 0.76 -2.15 2.72 4.81 -1.26 -2.59 118.16 125.52 1xki n LYS 94 Ca -0.07 0.27 -0.18 0.00 -0.87 0.00 0.00 58.31 57.46 1xki n LYS 94 Cb 0.50 -1.52 -0.02 0.00 0.02 0.00 0.00 35.03 34.01 1xki n LYS 94 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 1xki n ASP 95 N 1.64 -5.19 -4.29 3.14 8.00 -1.26 -4.98 116.55 113.60 1xki n ASP 95 Ca 0.14 0.09 -0.21 0.00 0.71 0.00 0.00 54.79 55.52 1xki n ASP 95 Cb 0.27 -4.27 -0.11 0.00 -0.02 0.00 0.00 41.12 36.99 1xki n ASP 95 CO 0.00 0.00 0.00 -1.00 -0.39 0.00 0.00 177.20 175.81 1xki s HIS 96 N -2.84 1.68 0.15 1.24 3.76 -1.07 -1.89 115.29 116.33 1xki s HIS 96 Ca 0.00 -0.48 -0.02 0.00 -0.15 0.00 0.00 55.06 54.41 1xki s HIS 96 Cb 0.00 -0.87 -0.04 0.00 1.11 0.00 0.00 32.58 32.79 1xki s HIS 96 CO 0.00 0.25 0.10 0.71 -0.85 0.00 0.00 174.74 174.94 1xki s TYR 97 N -1.87 0.86 -0.07 1.40 2.02 -0.40 -4.19 117.35 115.09 1xki s TYR 97 Ca 0.11 -1.21 0.03 0.00 -0.37 0.00 0.00 57.07 55.63 1xki s TYR 97 Cb -0.06 -0.44 -0.02 0.00 -0.40 0.00 0.00 41.96 41.03 1xki s TYR 97 CO 0.05 -0.56 -0.15 0.42 -1.57 0.00 0.00 175.55 173.74 1xki s ILE 98 N -4.06 3.00 -0.14 2.71 -1.09 -0.06 -1.07 121.20 120.49 1xki s ILE 98 Ca 0.26 -0.73 0.00 0.00 -2.23 0.00 0.00 60.65 57.95 1xki s ILE 98 Cb 0.07 -2.20 -0.01 0.00 -1.58 0.00 0.00 42.46 38.75 1xki s ILE 98 CO 0.03 0.57 -0.14 -0.36 -1.23 0.00 0.00 174.94 173.81 1xki s PHE 99 N -0.39 2.79 -0.12 3.97 0.08 0.14 -0.31 117.98 124.14 1xki s PHE 99 Ca 0.04 -0.85 0.02 0.00 0.12 0.00 0.00 56.93 56.26 1xki s PHE 99 Cb -0.12 -1.87 -0.01 0.00 -0.57 0.00 0.00 43.02 40.45 1xki s PHE 99 CO 0.02 -0.35 -0.19 -0.47 -0.10 0.00 0.00 175.22 174.13 1xki s TYR 100 N 0.60 2.68 0.02 0.36 5.04 -0.21 -0.32 117.35 125.52 1xki s TYR 100 Ca -0.08 -0.87 0.03 0.00 -2.44 0.00 0.00 57.07 53.71 1xki s TYR 100 Cb -0.16 -1.78 -0.02 0.00 0.35 0.00 0.00 41.96 40.36 1xki s TYR 100 CO 0.03 -0.33 -0.10 -1.12 -1.34 0.00 0.00 175.55 172.69 1xki s SER 101 N 0.37 1.13 -0.07 4.32 0.01 -0.62 -0.21 113.70 118.63 1xki s SER 101 Ca -0.15 -0.37 0.03 0.00 1.31 0.00 0.00 55.95 56.78 1xki s SER 101 Cb -0.17 -0.06 0.01 0.00 0.21 0.00 0.00 66.02 66.01 1xki s SER 101 CO 0.07 -0.02 -0.16 -1.61 0.41 0.00 0.00 173.24 171.93 1xki s GLU 102 N -0.92 2.05 0.00 12.44 2.02 -0.35 -1.69 118.70 132.25 1xki s GLU 102 Ca -0.01 -0.58 0.00 0.00 0.02 0.00 0.00 54.97 54.40 1xki s GLU 102 Cb -0.07 -1.66 0.00 0.00 0.10 0.00 0.00 34.13 32.50 1xki s GLU 102 CO 0.00 0.12 0.00 0.41 0.02 0.00 0.00 175.26 175.82 1xki n GLY 103 N 3.56 3.34 3.37 -1.39 0.00 0.16 -0.86 105.19 113.37 1xki n GLY 103 Ca -0.21 -1.26 -0.10 0.00 0.00 0.00 0.00 46.02 44.46 1xki n GLY 103 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1xki s GLU 104 N -1.10 1.22 0.47 1.61 2.02 -1.26 -1.57 118.70 120.09 1xki s GLU 104 Ca 0.00 -1.19 0.17 0.00 0.02 0.00 0.00 54.97 53.97 1xki s GLU 104 Cb 0.00 0.39 1.15 0.00 0.10 0.00 0.00 34.13 35.77 1xki s GLU 104 CO 0.00 -0.46 2.01 0.78 0.02 0.00 0.00 175.26 177.61 1xki h GLY 107 N 2.49 0.36 -3.10 -1.39 0.00 -2.06 -3.45 103.07 95.92 1xki h GLY 107 Ca -0.31 -0.11 -0.46 0.00 0.00 0.00 0.00 47.33 46.45 1xki h GLY 107 CO 0.46 0.06 -0.42 0.54 0.00 0.00 0.00 176.54 177.19 1xki s LYS 108 N -5.26 3.35 0.36 4.80 1.02 -1.26 -5.08 119.74 117.66 1xki s LYS 108 Ca -0.07 -0.83 -0.28 0.00 0.02 0.00 0.00 55.97 54.81 1xki s LYS 108 Cb 0.19 -2.86 -0.11 0.00 -0.52 0.00 0.00 37.83 34.54 1xki s LYS 108 CO 0.73 0.36 1.44 -2.14 -0.92 0.00 0.00 175.35 174.82 1xki s PRO 109 N -4.01 4.18 0.02 -1.68 0.02 -1.26 -5.02 135.00 127.26 1xki s PRO 109 Ca 0.36 2.46 -0.01 0.00 0.02 0.00 0.00 61.00 63.83 1xki s PRO 109 Cb -0.09 -3.00 -0.02 0.00 0.02 0.00 0.00 34.50 31.41 1xki s PRO 109 CO 0.29 -0.43 -0.00 0.14 -0.33 0.00 0.00 177.00 176.66 1xki s VAL 110 N -1.05 0.12 0.15 3.83 -7.23 -0.61 -4.94 120.40 110.66 1xki s VAL 110 Ca 0.52 -0.96 -0.14 0.00 -1.81 0.00 0.00 61.98 59.59 1xki s VAL 110 Cb -0.44 -0.41 0.02 0.00 0.56 0.00 0.00 36.38 36.10 1xki s VAL 110 CO 0.59 -0.53 0.38 0.00 -0.31 0.00 0.00 175.10 175.23 1xki s ARG 111 N -1.70 1.13 -0.03 4.82 1.70 -1.26 -0.66 118.95 122.95 1xki s ARG 111 Ca -0.14 -0.87 -0.31 0.00 -0.47 0.00 0.00 55.73 53.94 1xki s ARG 111 Cb -0.08 0.45 0.12 0.00 -0.57 0.00 0.00 34.95 34.87 1xki s ARG 111 CO -0.02 -0.44 1.24 0.20 -1.08 0.00 0.00 175.30 175.21 1xki s GLY 112 N -2.86 -0.38 -0.01 3.88 0.00 -0.68 -5.01 107.32 102.26 1xki s GLY 112 Ca 0.08 0.82 0.07 0.00 0.00 0.00 0.00 44.72 45.68 1xki s GLY 112 CO -0.07 0.19 -0.22 0.14 0.00 0.00 0.00 173.10 173.14 1xki s VAL 113 N -2.50 1.71 -0.04 1.40 1.01 -1.26 -1.59 120.40 119.13 1xki s VAL 113 Ca 0.13 -0.97 0.04 0.00 0.00 0.00 0.00 61.98 61.17 1xki s VAL 113 Cb 0.03 -1.43 -0.00 0.00 0.00 0.00 0.00 36.38 34.98 1xki s VAL 113 CO -0.04 0.44 -0.15 -0.54 0.00 0.00 0.00 175.10 174.82 1xki s LYS 114 N -0.62 1.51 -0.17 2.72 1.02 0.56 -1.35 119.74 123.42 1xki s LYS 114 Ca 0.08 -0.51 -0.14 0.00 0.02 0.00 0.00 55.97 55.42 1xki s LYS 114 Cb -0.08 -1.34 -0.05 0.00 -0.52 0.00 0.00 37.83 35.84 1xki s LYS 114 CO -0.00 0.21 0.29 -1.17 -0.92 0.00 0.00 175.35 173.75 1xki s LEU 115 N 0.08 4.23 0.14 3.17 2.96 0.19 -0.69 118.68 128.76 1xki s LEU 115 Ca -0.03 0.49 0.06 0.00 -0.22 0.00 0.00 54.13 54.43 1xki s LEU 115 Cb -0.10 -2.37 -0.04 0.00 0.50 0.00 0.00 46.19 44.18 1xki s LEU 115 CO 0.02 0.09 -0.13 0.68 -1.32 0.00 0.00 176.35 175.68 1xki s VAL 116 N 0.54 1.35 0.19 1.68 -7.23 -0.23 -0.61 120.40 116.08 1xki s VAL 116 Ca 0.16 -1.87 -0.12 0.00 -1.81 0.00 0.00 61.98 58.34 1xki s VAL 116 Cb -0.13 -1.68 0.00 0.00 0.56 0.00 0.00 36.38 35.13 1xki s VAL 116 CO 0.04 -0.52 0.38 -0.83 -0.31 0.00 0.00 175.10 173.86 1xki s GLY 117 N -2.75 0.35 0.38 2.32 0.00 -0.43 -1.28 107.32 105.91 1xki s GLY 117 Ca 0.13 -0.72 0.21 0.00 0.00 0.00 0.00 44.72 44.34 1xki s GLY 117 CO 0.03 -0.65 1.62 3.21 0.00 0.00 0.00 173.10 177.31 1xki h ARG 118 N 2.40 0.00 -6.64 2.90 3.08 -1.60 0.29 114.38 114.81 1xki h ARG 118 Ca -0.30 0.00 -0.51 0.00 0.07 0.00 0.00 59.98 59.24 1xki h ARG 118 Cb 1.24 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.29 1xki h ARG 118 CO 0.43 0.26 0.43 0.34 -1.07 0.00 0.00 179.97 180.36 1xki s ASP 119 N -6.28 7.38 0.52 7.04 -1.08 -1.26 -4.82 116.67 118.17 1xki s ASP 119 Ca 0.04 1.99 0.20 0.00 -0.52 0.00 0.00 52.55 54.25 1xki s ASP 119 Cb 0.08 -2.60 1.34 0.00 -1.46 0.00 0.00 42.92 40.27 1xki s ASP 119 CO 0.68 -0.13 2.12 -0.65 0.52 0.00 0.00 175.17 177.72 1xki h PRO 120 N 5.12 0.00 -6.57 4.34 0.11 -1.96 -3.43 132.00 129.60 1xki h PRO 120 Ca -0.44 0.00 -0.52 0.00 0.11 0.00 0.00 66.00 65.15 1xki h PRO 120 Cb 1.21 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.29 1xki h PRO 120 CO 0.72 0.06 0.25 0.21 -0.21 0.00 0.00 178.00 179.03 1xki s LYS 121 N -4.77 4.67 -0.61 1.05 2.20 -1.26 -4.94 119.74 116.08 1xki s LYS 121 Ca -0.04 1.29 -0.21 0.00 -0.36 0.00 0.00 55.97 56.64 1xki s LYS 121 Cb 0.16 -3.29 0.08 0.00 -1.51 0.00 0.00 37.83 33.26 1xki s LYS 121 CO 0.64 0.47 0.85 1.21 -0.36 0.00 0.00 175.35 178.16 1xki s ASN 122 N -0.88 6.20 0.00 1.43 3.84 -1.26 -4.89 114.94 119.38 1xki s ASN 122 Ca 0.39 -1.06 0.27 0.00 0.21 0.00 0.00 52.86 52.67 1xki s ASN 122 Cb -0.24 -2.37 0.94 0.00 -0.55 0.00 0.00 41.25 39.03 1xki s ASN 122 CO 0.28 -1.27 1.68 0.59 -2.79 0.00 0.00 177.10 175.59 1xki n ASN 123 N 7.11 1.11 -4.44 -4.21 3.02 -1.26 -4.96 115.26 111.62 1xki n ASN 123 Ca -0.05 -1.07 -0.38 0.00 -0.03 0.00 0.00 54.58 53.05 1xki n ASN 123 Cb 0.45 0.06 -0.08 0.00 -0.61 0.00 0.00 39.78 39.59 1xki n ASN 123 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1xki n LEU 124 N -0.41 -0.94 -0.00 3.41 4.77 -1.26 -4.84 117.00 117.73 1xki n LEU 124 Ca 0.15 -1.25 0.09 0.00 -0.03 0.00 0.00 56.01 54.98 1xki n LEU 124 Cb 0.34 -1.63 -0.12 0.00 -2.33 0.00 0.00 43.42 39.68 1xki n LEU 124 CO 0.22 0.25 -0.13 -1.84 -1.33 0.00 0.00 177.39 174.56 1xki n GLU 125 N -4.28 0.48 -1.01 3.23 0.00 -1.26 -4.36 120.64 113.44 1xki n GLU 125 Ca -0.06 -0.02 -0.10 0.00 0.00 0.00 0.00 57.16 56.98 1xki n GLU 125 Cb 0.55 -1.44 0.25 0.00 0.00 0.00 0.00 31.44 30.80 1xki n GLU 125 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1xki n ALA 126 N -1.56 4.73 0.20 -1.84 0.00 -1.26 -4.77 120.51 116.01 1xki n ALA 126 Ca 0.03 -2.63 0.06 0.00 0.00 0.00 0.00 53.44 50.89 1xki n ALA 126 Cb 0.34 -1.19 0.43 0.00 0.00 0.00 0.00 19.45 19.02 1xki n ALA 126 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 1xki h LEU 127 N 1.86 0.00 -0.33 0.00 5.85 -1.99 -3.11 115.31 117.58 1xki h LEU 127 Ca 0.35 0.00 0.02 0.00 0.84 0.00 0.00 57.88 59.10 1xki h LEU 127 Cb 2.33 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 43.33 1xki h LEU 127 CO 0.76 0.32 0.16 -0.08 -0.34 0.00 0.00 178.44 179.26 1xki h GLU 128 N 0.00 0.33 -0.68 1.25 4.81 -1.94 -0.11 114.58 118.23 1xki h GLU 128 Ca -0.00 -0.02 -0.05 0.00 -0.13 0.00 0.00 59.36 59.15 1xki h GLU 128 Cb 0.70 -0.07 -0.03 0.00 0.63 0.00 0.00 28.75 29.98 1xki h GLU 128 CO 0.04 0.22 0.21 -0.44 -0.73 0.00 0.00 179.01 178.31 1xki h ASP 129 N 0.34 0.98 -0.14 1.04 3.32 -1.94 -1.30 116.42 118.72 1xki h ASP 129 Ca 0.14 -0.18 0.04 0.00 0.02 0.00 0.00 57.03 57.05 1xki h ASP 129 Cb 0.05 -0.26 -0.04 0.00 0.22 0.00 0.00 39.33 39.31 1xki h ASP 129 CO -0.10 0.92 -0.10 0.15 -1.72 0.00 0.00 179.24 178.38 1xki h PHE 130 N 1.01 -0.25 -0.72 4.55 3.57 -1.46 -0.66 116.94 122.98 1xki h PHE 130 Ca 0.22 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.74 1xki h PHE 130 Cb 0.29 0.13 -0.04 0.00 2.79 0.00 0.00 35.95 39.13 1xki h PHE 130 CO 0.02 -0.16 0.46 0.93 -2.23 0.00 0.00 178.31 177.33 1xki h GLU 131 N -0.11 0.97 -0.17 1.11 5.08 -0.50 -1.87 114.58 119.09 1xki h GLU 131 Ca 0.09 -0.07 -0.01 0.00 -1.00 0.00 0.00 59.36 58.36 1xki h GLU 131 Cb 0.24 -0.21 -0.01 0.00 0.50 0.00 0.00 28.75 29.27 1xki h GLU 131 CO -0.21 0.66 0.06 -0.22 -1.00 0.00 0.00 179.01 178.31 1xki h LYS 132 N 0.98 0.26 -0.64 2.33 3.64 -1.22 -0.73 116.57 121.20 1xki h LYS 132 Ca 0.26 -0.05 0.02 0.00 -1.27 0.00 0.00 60.65 59.61 1xki h LYS 132 Cb -0.07 -0.04 -0.04 0.00 -0.41 0.00 0.00 32.23 31.67 1xki h LYS 132 CO -0.05 0.36 0.41 0.00 -2.27 0.00 0.00 179.45 177.89 1xki h ALA 133 N 0.89 0.83 -0.25 5.00 0.00 -0.89 -0.49 119.26 124.34 1xki h ALA 133 Ca 0.06 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.92 1xki h ALA 133 Cb 0.20 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 1xki h ALA 133 CO -0.00 0.18 0.09 0.00 0.00 0.00 0.00 179.25 179.52 1xki h ALA 134 N 1.26 0.33 -0.34 0.00 0.00 -1.24 -2.99 119.26 116.28 1xki h ALA 134 Ca 0.25 -0.13 -0.10 0.00 0.00 0.00 0.00 54.91 54.93 1xki h ALA 134 Cb -0.02 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 1xki h ALA 134 CO -0.09 -0.06 -0.21 0.78 0.00 0.00 0.00 179.25 179.67 1xki h GLY 135 N 0.25 0.71 1.96 0.00 0.00 -0.93 -0.39 103.07 104.68 1xki h GLY 135 Ca 0.08 -0.58 0.00 0.00 0.00 0.00 0.00 47.33 46.84 1xki h GLY 135 CO -0.01 0.53 0.02 0.00 0.00 0.00 0.00 176.54 177.08 1xki h ALA 136 N 1.19 1.27 -0.21 3.60 0.00 -1.04 -2.79 119.26 121.29 1xki h ALA 136 Ca 0.09 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1xki h ALA 136 Cb 0.68 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.47 1xki h ALA 136 CO 0.05 -0.02 0.00 0.54 0.00 0.00 0.00 179.25 179.82 1xki n ARG 137 N -3.45 2.59 -1.49 0.00 1.74 -0.69 -4.98 116.66 110.38 1xki n ARG 137 Ca -0.03 -2.61 -0.00 0.00 -0.77 0.00 0.00 57.85 54.44 1xki n ARG 137 Cb 0.09 -1.65 -0.00 0.00 -1.02 0.00 0.00 32.46 29.88 1xki n ARG 137 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1xki n GLY 138 N -0.55 0.38 0.44 -0.13 0.00 -1.03 -4.92 105.19 99.38 1xki n GLY 138 Ca 0.18 -0.98 0.07 0.00 0.00 0.00 0.00 46.02 45.29 1xki n GLY 138 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1xki n LEU 139 N -0.04 2.85 0.22 0.99 4.77 -0.24 -4.77 117.00 120.77 1xki n LEU 139 Ca -0.00 -3.36 0.15 0.00 -0.03 0.00 0.00 56.01 52.77 1xki n LEU 139 Cb 0.25 -0.49 0.54 0.00 -2.33 0.00 0.00 43.42 41.39 1xki n LEU 139 CO 0.00 0.94 0.92 0.77 -1.33 0.00 0.00 177.39 178.70 1xki h SER 140 N 0.62 0.00 -0.19 -1.43 4.64 -1.86 -2.92 113.55 112.41 1xki h SER 140 Ca 0.02 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.34 1xki h SER 140 Cb 1.13 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.22 1xki h SER 140 CO 0.07 0.00 0.00 0.35 -0.87 0.00 0.00 176.83 176.38 1xki n THR 141 N -2.79 0.28 -1.98 2.95 -2.24 -1.26 -5.00 114.28 104.23 1xki n THR 141 Ca 0.02 -0.64 -0.33 0.00 -2.27 0.00 0.00 64.05 60.83 1xki n THR 141 Cb 0.33 1.16 0.02 0.00 -2.10 0.00 0.00 70.33 69.74 1xki n THR 141 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 1xki s GLU 142 N -1.49 3.15 0.71 -0.78 0.41 -1.10 -5.02 118.70 114.57 1xki s GLU 142 Ca 0.29 1.32 -0.13 0.00 -0.41 0.00 0.00 54.97 56.04 1xki s GLU 142 Cb 0.18 -2.00 0.03 0.00 -1.78 0.00 0.00 34.13 30.56 1xki s GLU 142 CO 0.26 -0.96 1.11 -1.12 -0.49 0.00 0.00 175.26 174.06 1xki s SER 143 N -2.57 4.78 -0.05 -0.19 0.01 -0.98 -4.81 113.70 109.89 1xki s SER 143 Ca 0.66 1.96 0.05 0.00 1.31 0.00 0.00 55.95 59.93 1xki s SER 143 Cb -0.18 -2.54 -0.02 0.00 0.21 0.00 0.00 66.02 63.48 1xki s SER 143 CO 0.37 -1.85 -0.20 -0.51 0.41 0.00 0.00 173.24 171.46 1xki s ILE 144 N -2.54 2.57 -0.20 1.44 2.07 -1.26 -0.74 121.20 122.54 1xki s ILE 144 Ca 0.65 -0.90 -0.08 0.00 -1.41 0.00 0.00 60.65 58.92 1xki s ILE 144 Cb -0.20 -1.97 -0.04 0.00 0.13 0.00 0.00 42.46 40.38 1xki s ILE 144 CO 0.47 0.58 0.07 -0.22 -1.91 0.00 0.00 174.94 173.93 1xki s LEU 145 N -0.46 3.77 -0.30 8.50 2.96 -0.02 -4.94 118.68 128.19 1xki s LEU 145 Ca 0.05 0.04 0.00 0.00 -0.22 0.00 0.00 54.13 54.00 1xki s LEU 145 Cb -0.12 -1.97 0.06 0.00 0.50 0.00 0.00 46.19 44.67 1xki s LEU 145 CO 0.01 0.13 -0.01 -0.63 -1.32 0.00 0.00 176.35 174.54 1xki s ILE 146 N 0.61 2.68 0.49 6.68 1.01 -1.26 -1.30 121.20 130.10 1xki s ILE 146 Ca 0.04 -1.64 -0.22 0.00 0.00 0.00 0.00 60.65 58.82 1xki s ILE 146 Cb -0.13 -2.63 -0.07 0.00 0.01 0.00 0.00 42.46 39.64 1xki s ILE 146 CO 0.01 -0.20 1.19 -2.84 0.00 0.00 0.00 174.94 173.11 1xki s PRO 147 N 1.15 3.59 -0.10 2.79 0.02 -1.26 -4.96 135.00 136.23 1xki s PRO 147 Ca -0.03 1.83 0.07 0.00 0.02 0.00 0.00 61.00 62.89 1xki s PRO 147 Cb -0.20 -2.32 -0.11 0.00 0.02 0.00 0.00 34.50 31.89 1xki s PRO 147 CO -0.03 -0.71 -0.00 0.54 -0.33 0.00 0.00 177.00 176.46 1xki n ARG 148 N -0.70 1.89 -4.20 5.54 1.74 -1.26 -4.90 116.66 114.76 1xki n ARG 148 Ca 0.08 0.01 -0.14 0.00 -0.77 0.00 0.00 57.85 57.04 1xki n ARG 148 Cb 0.48 -1.25 -0.10 0.00 -1.02 0.00 0.00 32.46 30.57 1xki n ARG 148 CO 0.00 0.00 0.00 1.14 -1.52 0.00 0.00 177.63 177.25 1xki s GLN 149 N -2.24 0.92 0.00 5.56 -2.07 -1.26 -4.74 119.66 115.84 1xki s GLN 149 Ca -0.08 -1.30 0.30 0.00 -1.82 0.00 0.00 55.36 52.47 1xki s GLN 149 Cb 0.03 -0.51 1.82 0.00 -1.09 0.00 0.00 33.01 33.26 1xki s GLN 149 CO 0.37 0.06 2.14 0.43 -1.32 0.00 0.00 175.29 176.98