#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1kli s VAL 17 N 0.00 3.95 -0.12 1.39 1.01 0.30 -4.09 120.40 122.84 1kli s VAL 17 Ca 0.00 -0.35 0.00 0.00 0.00 0.00 0.00 61.98 61.63 1kli s VAL 17 Cb 0.00 -2.71 0.00 0.00 0.00 0.00 0.00 36.38 33.67 1kli s VAL 17 CO 0.00 0.52 0.00 0.61 0.00 0.00 0.00 175.10 176.23 1kli n GLY 18 N 3.18 0.49 0.00 4.51 0.00 -1.24 -1.81 105.19 110.32 1kli n GLY 18 Ca -0.18 -0.29 0.00 0.00 0.00 0.00 0.00 46.02 45.55 1kli n GLY 18 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1kli n GLY 19 N -2.40 1.78 3.17 -0.02 0.00 -1.26 -4.87 105.19 101.59 1kli n GLY 19 Ca -0.01 -1.98 -0.10 0.00 0.00 0.00 0.00 46.02 43.92 1kli n GLY 19 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1kli s LYS 20 N 3.06 1.03 0.15 1.61 -2.85 -0.55 -4.95 119.74 117.24 1kli s LYS 20 Ca 0.00 -1.49 -0.31 0.00 -1.00 0.00 0.00 55.97 53.17 1kli s LYS 20 Cb 0.00 0.26 -0.09 0.00 -2.06 0.00 0.00 37.83 35.94 1kli s LYS 20 CO 0.00 -0.31 1.40 0.08 0.10 0.00 0.00 175.35 176.62 1kli s VAL 21 N -4.08 3.14 -0.31 1.79 1.01 -1.26 -0.03 120.40 120.66 1kli s VAL 21 Ca 0.29 0.85 -0.29 0.00 0.00 0.00 0.00 61.98 62.83 1kli s VAL 21 Cb 0.07 -3.54 0.01 0.00 0.00 0.00 0.00 36.38 32.92 1kli s VAL 21 CO 0.05 0.08 1.14 0.00 0.00 0.00 0.00 175.10 176.37 1kli n PRO 23 N 6.96 1.40 -1.72 0.00 -0.02 -1.26 -4.73 135.00 135.62 1kli n PRO 23 Ca 0.13 0.50 -0.62 0.00 -2.02 0.00 0.00 63.50 61.49 1kli n PRO 23 Cb 0.47 -2.11 -0.08 0.00 -0.02 0.00 0.00 33.50 31.75 1kli n PRO 23 CO 0.00 0.00 0.00 1.17 1.98 0.00 0.00 175.50 178.65 1kli n LYS 24 N 2.30 0.68 0.00 -0.52 4.81 -1.26 -0.31 118.16 123.87 1kli n LYS 24 Ca 0.16 0.25 0.00 0.00 -0.87 0.00 0.00 58.31 57.85 1kli n LYS 24 Cb 0.24 -1.86 0.00 0.00 0.02 0.00 0.00 35.03 33.43 1kli n LYS 24 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1kli n GLY 25 N 4.17 1.05 0.16 3.14 0.00 -1.26 -4.92 105.19 107.53 1kli n GLY 25 Ca 0.29 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.45 1kli n GLY 25 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1kli n GLU 26 N -2.00 0.75 -2.59 1.61 1.02 0.58 -3.74 120.64 116.27 1kli n GLU 26 Ca 0.00 -0.31 -0.18 0.00 -0.02 0.00 0.00 57.16 56.65 1kli n GLU 26 Cb 0.00 -1.49 0.01 0.00 -0.02 0.00 0.00 31.44 29.94 1kli n GLU 26 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1kli n PRO 28 N -0.26 0.11 0.00 0.00 -0.04 -1.25 -1.61 135.00 131.95 1kli n PRO 28 Ca 0.24 0.60 0.12 0.00 -0.04 0.00 0.00 63.50 64.42 1kli n PRO 28 Cb 0.73 -1.88 0.12 0.00 -0.04 0.00 0.00 33.50 32.43 1kli n PRO 28 CO 0.00 0.00 0.00 -2.67 -0.04 0.00 0.00 175.50 172.79 1kli n TRP 29 N -2.08 0.00 -2.04 0.54 2.14 -1.09 -2.02 117.44 112.89 1kli n TRP 29 Ca -0.01 0.00 -0.42 0.00 2.07 0.00 0.00 57.50 59.14 1kli n TRP 29 Cb 0.06 -0.04 -0.03 0.00 -0.81 0.00 0.00 31.31 30.48 1kli n TRP 29 CO 0.00 0.00 0.00 -1.14 2.07 0.00 0.00 177.69 178.62 1kli s GLN 30 N -2.51 4.27 0.00 -2.67 2.00 -0.63 -1.31 119.66 118.81 1kli s GLN 30 Ca 0.20 2.24 0.05 0.00 -2.00 0.00 0.00 55.36 55.85 1kli s GLN 30 Cb 0.18 -3.18 -0.03 0.00 0.80 0.00 0.00 33.01 30.78 1kli s GLN 30 CO 0.57 -0.50 -0.13 0.08 -0.50 0.00 0.00 175.29 174.80 1kli s VAL 31 N 0.93 3.16 -0.18 1.34 1.01 -0.01 -4.41 120.40 122.23 1kli s VAL 31 Ca 0.66 -0.92 -0.02 0.00 0.00 0.00 0.00 61.98 61.69 1kli s VAL 31 Cb -0.41 -2.32 -0.01 0.00 0.00 0.00 0.00 36.38 33.64 1kli s VAL 31 CO 0.33 0.42 -0.09 -0.22 0.00 0.00 0.00 175.10 175.54 1kli s LEU 32 N -1.25 2.80 -0.15 3.92 2.96 -0.52 -1.43 118.68 125.01 1kli s LEU 32 Ca 0.15 -0.37 -0.07 0.00 -0.22 0.00 0.00 54.13 53.61 1kli s LEU 32 Cb -0.11 -1.68 -0.04 0.00 0.50 0.00 0.00 46.19 44.86 1kli s LEU 32 CO 0.05 0.06 0.11 -0.76 -1.32 0.00 0.00 176.35 174.48 1kli s LEU 33 N 0.98 4.13 0.05 -0.68 1.43 0.06 0.02 118.68 124.68 1kli s LEU 33 Ca -0.01 0.29 0.06 0.00 -1.03 0.00 0.00 54.13 53.45 1kli s LEU 33 Cb -0.15 -2.03 -0.03 0.00 0.03 0.00 0.00 46.19 44.02 1kli s LEU 33 CO -0.01 0.30 -0.18 -0.76 0.23 0.00 0.00 176.35 175.93 1kli s LEU 34 N -0.36 2.19 -0.17 1.79 1.43 0.14 -1.11 118.68 122.58 1kli s LEU 34 Ca 0.11 -0.52 -0.01 0.00 -1.03 0.00 0.00 54.13 52.68 1kli s LEU 34 Cb -0.12 -0.81 0.04 0.00 0.03 0.00 0.00 46.19 45.34 1kli s LEU 34 CO 0.01 0.09 -0.04 0.54 0.23 0.00 0.00 176.35 177.18 1kli s VAL 35 N -0.88 1.08 -1.73 -1.59 0.11 0.03 -1.38 120.40 116.04 1kli s VAL 35 Ca 0.05 -0.65 -0.01 0.00 -2.93 0.00 0.00 61.98 58.44 1kli s VAL 35 Cb -0.09 -1.29 0.00 0.00 -1.53 0.00 0.00 36.38 33.48 1kli s VAL 35 CO 0.02 0.09 0.10 0.59 -3.33 0.00 0.00 175.10 172.56 1kli n ASN 37 N 4.88 -5.90 0.00 3.54 4.13 -1.10 -1.52 115.26 119.29 1kli n ASN 37 Ca -0.12 -0.05 0.00 0.00 1.68 0.00 0.00 54.58 56.09 1kli n ASN 37 Cb 0.47 -4.89 0.00 0.00 -1.54 0.00 0.00 39.78 33.82 1kli n ASN 37 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1kli n GLY 38 N -1.09 2.04 3.84 7.41 0.00 -1.26 -5.03 105.19 111.10 1kli n GLY 38 Ca -0.22 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.43 1kli n GLY 38 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1kli s ALA 39 N -2.46 3.64 0.19 4.61 0.00 -0.57 -5.00 121.76 122.16 1kli s ALA 39 Ca 0.00 -0.18 -0.32 0.00 0.00 0.00 0.00 51.96 51.46 1kli s ALA 39 Cb 0.00 -2.46 -0.12 0.00 0.00 0.00 0.00 23.12 20.55 1kli s ALA 39 CO 0.00 0.48 1.76 0.94 0.00 0.00 0.00 175.76 178.93 1kli n GLN 40 N 1.16 2.79 -0.03 0.00 7.27 -1.26 -0.79 117.38 126.52 1kli n GLN 40 Ca -0.08 1.01 -0.07 0.00 0.07 0.00 0.00 57.00 57.92 1kli n GLN 40 Cb 0.52 -2.87 -0.02 0.00 2.41 0.00 0.00 30.24 30.27 1kli n GLN 40 CO 0.00 0.00 0.00 -0.11 0.07 0.00 0.00 177.06 177.02 1kli n LEU 41 N 4.43 0.80 -3.85 1.69 7.94 -0.27 -4.85 117.00 122.90 1kli n LEU 41 Ca 0.17 0.13 -0.06 0.00 -1.11 0.00 0.00 56.01 55.14 1kli n LEU 41 Cb 0.36 -0.30 0.02 0.00 0.53 0.00 0.00 43.42 44.02 1kli n LEU 41 CO 0.65 -0.05 0.69 0.00 -1.11 0.00 0.00 177.39 177.56 1kli s GLY 43 N -3.25 2.14 0.30 0.00 0.00 0.23 -0.76 107.32 105.97 1kli s GLY 43 Ca 0.19 -1.69 -0.19 0.00 0.00 0.00 0.00 44.72 43.03 1kli s GLY 43 CO 0.08 -1.79 0.82 -0.32 0.00 0.00 0.00 173.10 171.89 1kli s GLY 44 N -4.31 0.11 -0.10 0.20 0.00 -0.51 -3.64 107.32 99.07 1kli s GLY 44 Ca 0.46 -0.45 -0.00 0.00 0.00 0.00 0.00 44.72 44.72 1kli s GLY 44 CO 0.28 0.12 -0.07 -1.59 0.00 0.00 0.00 173.10 171.84 1kli s THR 45 N -2.95 0.90 0.10 0.90 2.01 0.61 -0.83 115.64 116.36 1kli s THR 45 Ca 0.14 -0.23 -0.30 0.00 0.31 0.00 0.00 61.69 61.61 1kli s THR 45 Cb -0.05 -0.93 -0.06 0.00 0.01 0.00 0.00 72.50 71.48 1kli s THR 45 CO 0.08 0.34 1.17 -0.22 -0.69 0.00 0.00 174.62 175.30 1kli s LEU 46 N 1.59 4.40 0.00 4.42 2.96 -0.43 -0.48 118.68 131.14 1kli s LEU 46 Ca 0.02 2.04 0.02 0.00 -0.22 0.00 0.00 54.13 55.99 1kli s LEU 46 Cb -0.13 -3.59 -0.02 0.00 0.50 0.00 0.00 46.19 42.95 1kli s LEU 46 CO -0.06 -0.40 0.10 2.30 -1.32 0.00 0.00 176.35 176.98 1kli n ILE 47 N 3.44 0.00 -3.85 6.68 -5.35 -0.68 -0.80 119.36 118.80 1kli n ILE 47 Ca 0.07 -0.45 -0.03 0.00 -0.27 0.00 0.00 62.75 62.07 1kli n ILE 47 Cb 0.46 1.00 0.02 0.00 -1.74 0.00 0.00 39.64 39.38 1kli n ILE 47 CO 0.00 0.00 0.00 -0.46 -1.76 0.00 0.00 176.55 174.33 1kli n ASN 48 N -1.01 -1.60 0.23 7.28 0.23 -1.23 -4.61 115.26 114.55 1kli n ASN 48 Ca 0.00 -1.86 0.16 0.00 -0.53 0.00 0.00 54.58 52.36 1kli n ASN 48 Cb 0.03 2.61 0.78 0.00 -2.08 0.00 0.00 39.78 41.12 1kli n ASN 48 CO 0.00 0.00 0.00 0.71 -0.93 0.00 0.00 177.26 177.04 1kli h THR 49 N 1.89 0.00 0.00 5.53 1.35 -1.98 -3.24 112.91 116.46 1kli h THR 49 Ca -0.25 -0.16 0.00 0.00 -0.55 0.00 0.00 66.41 65.45 1kli h THR 49 Cb 1.09 0.97 0.00 0.00 -1.73 0.00 0.00 68.15 68.47 1kli h THR 49 CO 0.33 0.00 0.00 2.30 -0.25 0.00 0.00 175.52 177.90 1kli n ILE 50 N -2.68 0.00 -4.92 6.82 -5.35 -1.26 -1.04 119.36 110.93 1kli n ILE 50 Ca -0.01 -0.28 -0.33 0.00 -0.27 0.00 0.00 62.75 61.86 1kli n ILE 50 Cb 0.15 1.29 -0.14 0.00 -1.74 0.00 0.00 39.64 39.20 1kli n ILE 50 CO 0.00 0.00 0.00 0.26 -1.76 0.00 0.00 176.55 175.05 1kli s TRP 51 N -0.19 2.68 -0.04 4.28 0.52 -1.23 -0.34 118.94 124.63 1kli s TRP 51 Ca 0.00 -0.32 0.03 0.00 0.02 0.00 0.00 56.10 55.83 1kli s TRP 51 Cb 0.00 -1.67 0.00 0.00 -1.15 0.00 0.00 33.47 30.66 1kli s TRP 51 CO 0.00 0.06 -0.13 0.08 0.02 0.00 0.00 176.95 176.97 1kli s VAL 52 N -0.44 1.12 -0.14 4.03 1.01 -0.06 -1.68 120.40 124.24 1kli s VAL 52 Ca 0.05 -0.54 -0.06 0.00 0.00 0.00 0.00 61.98 61.44 1kli s VAL 52 Cb -0.12 -0.98 -0.04 0.00 0.00 0.00 0.00 36.38 35.24 1kli s VAL 52 CO 0.02 0.34 0.06 -0.69 0.00 0.00 0.00 175.10 174.83 1kli s VAL 53 N 0.18 4.83 0.00 2.92 1.01 0.36 0.15 120.40 129.85 1kli s VAL 53 Ca -0.05 -0.03 0.00 0.00 0.00 0.00 0.00 61.98 61.90 1kli s VAL 53 Cb -0.11 -3.12 0.00 0.00 0.00 0.00 0.00 36.38 33.15 1kli s VAL 53 CO 0.02 0.54 0.00 -0.24 0.00 0.00 0.00 175.10 175.42 1kli n SER 54 N 2.74 0.00 -4.57 3.32 2.88 -0.11 -0.29 113.62 117.59 1kli n SER 54 Ca -0.18 -0.09 -0.34 0.00 -1.33 0.00 0.00 58.87 56.93 1kli n SER 54 Cb 0.53 0.00 -0.11 0.00 -0.75 0.00 0.00 64.21 63.88 1kli n SER 54 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1kli s ALA 55 N -1.84 3.08 0.22 -1.46 0.00 -1.26 -1.51 121.76 118.99 1kli s ALA 55 Ca 0.00 -0.83 -0.08 0.00 0.00 0.00 0.00 51.96 51.05 1kli s ALA 55 Cb 0.00 -1.46 0.29 0.00 0.00 0.00 0.00 23.12 21.95 1kli s ALA 55 CO 0.00 0.41 1.79 0.00 0.00 0.00 0.00 175.76 177.95 1kli h ALA 56 N 5.91 0.93 0.00 0.00 0.00 -1.69 -2.14 119.26 122.27 1kli h ALA 56 Ca -0.41 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.54 1kli h ALA 56 Cb 1.19 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.91 1kli h ALA 56 CO 0.58 -0.02 0.00 -2.39 0.00 0.00 0.00 179.25 177.42 1kli n HIS 57 N -4.84 0.73 0.30 0.00 1.44 -1.26 -1.59 115.22 110.00 1kli n HIS 57 Ca 0.10 0.37 0.19 0.00 -2.01 0.00 0.00 57.72 56.36 1kli n HIS 57 Cb 0.23 -1.09 0.95 0.00 0.12 0.00 0.00 29.99 30.21 1kli n HIS 57 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1kli n PHE 59 N -3.24 0.88 -0.00 0.00 3.72 -0.62 -4.67 117.46 113.53 1kli n PHE 59 Ca -0.02 -0.81 0.03 0.00 -0.05 0.00 0.00 57.45 56.60 1kli n PHE 59 Cb 0.17 -0.27 0.40 0.00 -0.94 0.00 0.00 39.48 38.84 1kli n PHE 59 CO 0.00 0.00 0.00 -0.44 -0.05 0.00 0.00 176.76 176.27 1kli h ASP 60 N 1.87 0.48 -0.11 4.37 5.19 -1.60 -3.18 116.42 123.45 1kli h ASP 60 Ca 0.00 -0.03 -0.09 0.00 -0.62 0.00 0.00 57.03 56.30 1kli h ASP 60 Cb 1.34 -0.12 -0.09 0.00 0.18 0.00 0.00 39.33 40.64 1kli h ASP 60 CO 0.19 0.39 -0.58 0.29 -3.12 0.00 0.00 179.24 176.41 1kli n LYS 60 N -4.44 1.77 -2.66 3.56 4.76 -1.26 -5.03 118.16 114.85 1kli n LYS 60 Ca 0.03 -3.35 -0.42 0.00 -2.87 0.00 0.00 58.31 51.70 1kli n LYS 60 Cb 0.09 -1.61 -0.03 0.00 -1.84 0.00 0.00 35.03 31.64 1kli n LYS 60 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 1kli s ILE 60 N -3.23 4.74 -0.09 -0.18 -1.09 -1.21 -4.97 121.20 115.17 1kli s ILE 60 Ca 0.39 1.97 -0.05 0.00 -2.23 0.00 0.00 60.65 60.74 1kli s ILE 60 Cb 0.38 -4.27 -0.02 0.00 -1.58 0.00 0.00 42.46 36.97 1kli s ILE 60 CO -0.06 0.11 -0.10 0.11 -1.23 0.00 0.00 174.94 173.76 1kli h LYS 60 N 6.91 0.00 -4.78 2.79 1.57 -1.96 -3.45 116.57 117.65 1kli h LYS 60 Ca -0.38 0.00 -0.68 0.00 -1.87 0.00 0.00 60.65 57.72 1kli h LYS 60 Cb 1.20 0.00 -0.30 0.00 0.08 0.00 0.00 32.23 33.21 1kli h LYS 60 CO 0.79 0.00 -0.66 1.21 -0.57 0.00 0.00 179.45 180.22 1kli s ASN 60 N -4.99 4.95 0.25 0.86 2.47 -1.26 -4.97 114.94 112.26 1kli s ASN 60 Ca -0.08 -1.01 0.22 0.00 0.42 0.00 0.00 52.86 52.40 1kli s ASN 60 Cb 0.01 -1.79 0.97 0.00 -1.45 0.00 0.00 41.25 39.00 1kli s ASN 60 CO 0.12 -0.24 1.67 0.79 -3.72 0.00 0.00 177.10 175.73 1kli n TRP 61 N 4.75 0.73 1.54 0.43 7.02 -1.26 -2.27 117.44 128.38 1kli n TRP 61 Ca -0.14 0.30 0.12 0.00 -1.02 0.00 0.00 57.50 56.77 1kli n TRP 61 Cb 0.46 -0.99 0.73 0.00 -2.42 0.00 0.00 31.31 29.09 1kli n TRP 61 CO 0.00 0.00 0.00 0.54 -2.02 0.00 0.00 177.69 176.21 1kli n ARG 62 N -2.18 0.77 -0.29 -0.99 3.00 -1.26 -2.67 116.66 113.04 1kli n ARG 62 Ca 0.01 0.00 0.08 0.00 -0.01 0.00 0.00 57.85 57.93 1kli n ARG 62 Cb 0.18 -1.50 0.22 0.00 0.00 0.00 0.00 32.46 31.37 1kli n ARG 62 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.63 177.72 1kli n ASN 63 N -1.00 3.44 -4.67 0.55 5.03 -0.96 -4.96 115.26 112.69 1kli n ASN 63 Ca 0.18 -2.14 -0.40 0.00 0.87 0.00 0.00 54.58 53.10 1kli n ASN 63 Cb 0.08 -0.35 -0.06 0.00 -1.02 0.00 0.00 39.78 38.43 1kli n ASN 63 CO 0.00 0.00 0.00 -0.22 -1.83 0.00 0.00 177.26 175.21 1kli s LEU 64 N -1.25 4.17 -0.03 3.41 2.96 -1.09 -2.72 118.68 124.13 1kli s LEU 64 Ca 0.34 0.85 0.05 0.00 -0.22 0.00 0.00 54.13 55.14 1kli s LEU 64 Cb 0.19 -2.88 -0.01 0.00 0.50 0.00 0.00 46.19 44.00 1kli s LEU 64 CO 0.20 -0.24 -0.18 -0.63 -1.32 0.00 0.00 176.35 174.19 1kli s ILE 65 N 1.72 1.45 -0.12 6.68 -1.09 -0.48 -2.51 121.20 126.86 1kli s ILE 65 Ca 0.29 -0.76 -0.02 0.00 -2.23 0.00 0.00 60.65 57.94 1kli s ILE 65 Cb -0.16 -1.23 -0.03 0.00 -1.58 0.00 0.00 42.46 39.47 1kli s ILE 65 CO 0.11 0.41 -0.05 0.00 -1.23 0.00 0.00 174.94 174.18 1kli s ALA 66 N -0.20 2.99 -0.14 9.38 0.00 0.13 -0.69 121.76 133.24 1kli s ALA 66 Ca 0.02 -0.85 0.02 0.00 0.00 0.00 0.00 51.96 51.15 1kli s ALA 66 Cb -0.09 -1.41 0.01 0.00 0.00 0.00 0.00 23.12 21.63 1kli s ALA 66 CO 0.01 0.38 -0.21 0.08 0.00 0.00 0.00 175.76 176.02 1kli s VAL 67 N -0.18 2.12 0.25 0.00 1.01 0.10 -0.90 120.40 122.80 1kli s VAL 67 Ca 0.03 -0.96 0.07 0.00 0.00 0.00 0.00 61.98 61.12 1kli s VAL 67 Cb -0.13 -1.85 -0.04 0.00 0.00 0.00 0.00 36.38 34.36 1kli s VAL 67 CO 0.03 0.55 0.14 -0.76 0.00 0.00 0.00 175.10 175.06 1kli s LEU 68 N 0.80 3.67 -0.35 3.92 2.01 0.73 -1.44 118.68 128.02 1kli s LEU 68 Ca -0.07 -0.33 0.00 0.00 0.01 0.00 0.00 54.13 53.74 1kli s LEU 68 Cb -0.16 -2.21 0.00 0.00 0.01 0.00 0.00 46.19 43.84 1kli s LEU 68 CO -0.01 -0.02 0.00 0.61 1.01 0.00 0.00 176.35 177.94 1kli n GLY 69 N -1.03 0.52 3.82 -3.19 0.00 -1.25 -0.66 105.19 103.40 1kli n GLY 69 Ca -0.08 -0.14 -0.33 0.00 0.00 0.00 0.00 46.02 45.47 1kli n GLY 69 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1kli s GLU 70 N -1.62 3.92 0.20 1.61 2.56 -1.26 -3.98 118.70 120.13 1kli s GLU 70 Ca 0.00 1.15 0.00 0.00 0.00 0.00 0.00 54.97 56.12 1kli s GLU 70 Cb 0.00 -2.13 0.00 0.00 2.00 0.00 0.00 34.13 34.00 1kli s GLU 70 CO 0.00 -0.31 0.00 1.58 -0.56 0.00 0.00 175.26 175.97 1kli n HIS 71 N -1.18 -2.30 -3.71 5.30 -0.00 -1.26 -4.94 115.22 107.13 1kli n HIS 71 Ca 0.08 0.50 -0.38 0.00 -0.00 0.00 0.00 57.72 57.91 1kli n HIS 71 Cb 0.53 1.28 -0.12 0.00 -0.00 0.00 0.00 29.99 31.69 1kli n HIS 71 CO 0.00 0.00 0.00 0.34 -0.00 0.00 0.00 176.34 176.68 1kli s ASP 72 N -3.39 5.35 0.38 0.26 -1.08 -1.26 -1.85 116.67 115.08 1kli s ASP 72 Ca 0.00 -0.85 0.28 0.00 -0.52 0.00 0.00 52.55 51.45 1kli s ASP 72 Cb 0.00 -1.92 1.23 0.00 -1.46 0.00 0.00 42.92 40.77 1kli s ASP 72 CO 0.00 -0.27 1.83 -0.07 0.52 0.00 0.00 175.17 177.19 1kli h LEU 73 N 8.29 0.00 0.00 -1.34 3.38 -1.25 -2.93 115.31 121.46 1kli h LEU 73 Ca -0.28 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.69 1kli h LEU 73 Cb 1.11 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.86 1kli h LEU 73 CO 0.62 0.00 -0.13 -1.54 0.09 0.00 0.00 178.44 177.48 1kli n SER 74 N -2.54 0.40 -4.07 -0.43 3.41 -1.26 -4.92 113.62 104.21 1kli n SER 74 Ca 0.01 0.39 -0.11 0.00 -0.26 0.00 0.00 58.87 58.90 1kli n SER 74 Cb 0.21 -0.43 -0.08 0.00 -0.26 0.00 0.00 64.21 63.64 1kli n SER 74 CO 0.00 0.00 0.00 -1.83 -0.16 0.00 0.00 175.04 173.05 1kli s GLU 75 N -3.05 1.36 -0.16 4.33 -1.05 -1.11 -5.14 118.70 113.88 1kli s GLU 75 Ca 0.12 -1.52 0.01 0.00 -0.15 0.00 0.00 54.97 53.43 1kli s GLU 75 Cb 0.16 0.34 0.02 0.00 -0.44 0.00 0.00 34.13 34.21 1kli s GLU 75 CO 0.59 -0.50 -0.20 -1.58 0.95 0.00 0.00 175.26 174.53 1kli s HIS 76 N -4.05 2.62 -1.30 4.83 5.65 -1.26 -4.78 115.29 117.00 1kli s HIS 76 Ca 0.33 -1.45 0.11 0.00 0.25 0.00 0.00 55.06 54.30 1kli s HIS 76 Cb 0.04 -1.82 0.10 0.00 -1.18 0.00 0.00 32.58 29.73 1kli s HIS 76 CO 0.12 -0.71 0.87 -0.40 -0.65 0.00 0.00 174.74 173.98 1kli n ASP 77 N 4.42 1.98 0.00 9.88 5.68 -1.26 -4.99 116.55 132.26 1kli n ASP 77 Ca -0.20 -1.49 0.00 0.00 -0.50 0.00 0.00 54.79 52.60 1kli n ASP 77 Cb 0.51 -0.02 0.00 0.00 -1.14 0.00 0.00 41.12 40.47 1kli n ASP 77 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1kli n GLY 78 N 0.59 0.83 0.00 6.12 0.00 -1.26 -4.90 105.19 106.58 1kli n GLY 78 Ca 0.07 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.20 1kli n GLY 78 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1kli n ASP 79 N 0.00 0.55 -4.76 1.61 10.43 -1.26 -4.91 116.55 118.21 1kli n ASP 79 Ca 0.00 -0.32 -0.39 0.00 2.57 0.00 0.00 54.79 56.64 1kli n ASP 79 Cb 0.00 0.33 -0.04 0.00 1.84 0.00 0.00 41.12 43.25 1kli n ASP 79 CO 0.00 0.00 0.00 -1.61 -1.07 0.00 0.00 177.20 174.52 1kli s GLU 80 N -3.00 4.48 -0.10 -1.24 8.01 -1.26 -4.42 118.70 121.17 1kli s GLU 80 Ca 0.11 1.80 -0.01 0.00 0.01 0.00 0.00 54.97 56.87 1kli s GLU 80 Cb 0.17 -3.02 0.03 0.00 -4.31 0.00 0.00 34.13 27.00 1kli s GLU 80 CO 0.72 0.06 -0.04 -0.65 0.01 0.00 0.00 175.26 175.37 1kli s GLN 81 N -1.74 1.09 -0.08 1.61 -0.21 0.16 -4.98 119.66 115.52 1kli s GLN 81 Ca 0.48 -0.13 -0.03 0.00 0.02 0.00 0.00 55.36 55.71 1kli s GLN 81 Cb -0.31 -1.38 -0.04 0.00 1.00 0.00 0.00 33.01 32.29 1kli s GLN 81 CO 0.40 -0.31 0.04 -1.54 -2.12 0.00 0.00 175.29 171.76 1kli s SER 82 N 1.82 5.54 0.01 5.90 1.04 -1.26 -0.19 113.70 126.56 1kli s SER 82 Ca 0.04 0.21 -0.01 0.00 0.48 0.00 0.00 55.95 56.67 1kli s SER 82 Cb -0.13 -1.62 -0.01 0.00 0.10 0.00 0.00 66.02 64.36 1kli s SER 82 CO -0.07 0.37 0.00 -0.13 0.98 0.00 0.00 173.24 174.40 1kli s ARG 83 N -1.04 0.24 0.51 4.02 1.81 -0.08 -4.99 118.95 119.42 1kli s ARG 83 Ca 0.15 -0.39 -0.17 0.00 -1.72 0.00 0.00 55.73 53.60 1kli s ARG 83 Cb -0.12 0.09 -0.08 0.00 -0.45 0.00 0.00 34.95 34.39 1kli s ARG 83 CO 0.04 -0.04 0.98 1.03 -0.68 0.00 0.00 175.30 176.63 1kli s ARG 84 N -0.99 3.97 -0.37 3.54 0.52 -1.26 -0.69 118.95 123.67 1kli s ARG 84 Ca -0.11 0.98 -0.16 0.00 -0.52 0.00 0.00 55.73 55.92 1kli s ARG 84 Cb -0.07 -2.14 -0.00 0.00 0.52 0.00 0.00 34.95 33.26 1kli s ARG 84 CO -0.00 -0.25 0.40 0.08 0.02 0.00 0.00 175.30 175.54 1kli s VAL 85 N -2.57 5.13 -0.28 3.52 1.01 -1.04 -0.75 120.40 125.42 1kli s VAL 85 Ca 0.59 -0.06 0.21 0.00 0.00 0.00 0.00 61.98 62.72 1kli s VAL 85 Cb -0.10 -3.90 0.12 0.00 0.00 0.00 0.00 36.38 32.50 1kli s VAL 85 CO 0.29 -0.20 1.29 0.00 0.00 0.00 0.00 175.10 176.48 1kli h ALA 86 N 8.54 0.73 -2.18 5.51 0.00 -1.17 -3.46 119.26 127.23 1kli h ALA 86 Ca -0.29 -0.19 -0.05 0.00 0.00 0.00 0.00 54.91 54.38 1kli h ALA 86 Cb 1.13 0.02 -0.22 0.00 0.00 0.00 0.00 17.79 18.73 1kli h ALA 86 CO 0.73 0.23 0.03 -1.14 0.00 0.00 0.00 179.25 179.11 1kli s GLN 87 N -3.18 0.74 -0.22 0.00 2.00 -1.09 -4.37 119.66 113.53 1kli s GLN 87 Ca 0.03 0.92 0.01 0.00 -2.00 0.00 0.00 55.36 54.32 1kli s GLN 87 Cb 0.07 0.34 0.05 0.00 0.80 0.00 0.00 33.01 34.28 1kli s GLN 87 CO 0.74 -0.10 -0.08 0.08 -0.50 0.00 0.00 175.29 175.44 1kli s VAL 88 N 0.47 1.63 -0.22 1.34 1.01 -0.31 -1.23 120.40 123.09 1kli s VAL 88 Ca -0.01 -1.18 -0.07 0.00 0.00 0.00 0.00 61.98 60.72 1kli s VAL 88 Cb -0.05 -1.81 -0.03 0.00 0.00 0.00 0.00 36.38 34.49 1kli s VAL 88 CO -0.01 0.00 0.05 -0.63 0.00 0.00 0.00 175.10 174.51 1kli s ILE 89 N 1.37 4.37 -0.01 2.22 1.01 0.30 -0.87 121.20 129.59 1kli s ILE 89 Ca -0.05 -0.17 0.07 0.00 0.00 0.00 0.00 60.65 60.51 1kli s ILE 89 Cb -0.18 -3.01 -0.02 0.00 0.01 0.00 0.00 42.46 39.27 1kli s ILE 89 CO -0.07 0.39 -0.22 -0.63 0.00 0.00 0.00 174.94 174.41 1kli s ILE 90 N 1.13 1.75 0.38 2.92 1.01 -0.37 -0.78 121.20 127.22 1kli s ILE 90 Ca 0.04 -0.99 -0.28 0.00 0.00 0.00 0.00 60.65 59.42 1kli s ILE 90 Cb -0.14 -1.46 -0.10 0.00 0.01 0.00 0.00 42.46 40.77 1kli s ILE 90 CO 0.03 0.45 1.41 -2.16 0.00 0.00 0.00 174.94 174.67 1kli s PRO 91 N -0.63 4.10 0.61 2.79 0.04 -1.26 -1.29 135.00 139.36 1kli s PRO 91 Ca 0.09 2.42 0.32 0.00 0.04 0.00 0.00 61.00 63.87 1kli s PRO 91 Cb -0.09 -2.93 1.89 0.00 0.04 0.00 0.00 34.50 33.41 1kli s PRO 91 CO -0.00 -0.48 2.23 0.66 0.04 0.00 0.00 177.00 179.45 1kli h SER 92 N 2.98 0.00 1.33 6.66 4.64 -1.03 -1.69 113.55 126.44 1kli h SER 92 Ca -0.50 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.82 1kli h SER 92 Cb 1.24 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.33 1kli h SER 92 CO 0.64 0.00 0.00 0.71 -0.87 0.00 0.00 176.83 177.31 1kli h THR 93 N 0.00 0.00 -3.59 2.95 1.35 -1.85 -3.45 112.91 108.31 1kli h THR 93 Ca 0.02 -0.49 -0.51 0.00 -0.55 0.00 0.00 66.41 64.88 1kli h THR 93 Cb 0.15 1.42 0.01 0.00 -1.73 0.00 0.00 68.15 68.00 1kli h THR 93 CO -0.00 0.00 0.48 -0.47 -0.25 0.00 0.00 175.52 175.28 1kli s TYR 94 N -3.21 3.59 -0.22 4.73 5.04 -0.64 -4.89 117.35 121.76 1kli s TYR 94 Ca 0.08 1.61 0.01 0.00 -2.44 0.00 0.00 57.07 56.33 1kli s TYR 94 Cb 0.10 -3.28 0.03 0.00 0.35 0.00 0.00 41.96 39.17 1kli s TYR 94 CO 0.55 -0.61 -0.14 0.08 -1.34 0.00 0.00 175.55 174.09 1kli s VAL 95 N -0.36 2.25 0.09 3.14 1.01 -1.26 -4.99 120.40 120.28 1kli s VAL 95 Ca 0.49 -1.19 -0.36 0.00 0.00 0.00 0.00 61.98 60.92 1kli s VAL 95 Cb -0.30 -2.11 -0.17 0.00 0.00 0.00 0.00 36.38 33.80 1kli s VAL 95 CO 0.36 0.29 1.20 -2.65 0.00 0.00 0.00 175.10 174.29 1kli n PRO 96 N 4.57 0.84 0.00 2.72 -0.02 -1.26 -1.42 135.00 140.43 1kli n PRO 96 Ca -0.18 0.30 0.00 0.00 -2.02 0.00 0.00 63.50 61.60 1kli n PRO 96 Cb 0.47 -1.85 0.00 0.00 -0.02 0.00 0.00 33.50 32.10 1kli n PRO 96 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1kli n GLY 97 N 2.14 1.32 0.76 -1.23 0.00 -1.26 -5.05 105.19 101.86 1kli n GLY 97 Ca 0.18 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.15 1kli n GLY 97 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1kli n THR 98 N -2.00 0.00 -0.02 2.61 -2.24 -0.50 -5.09 114.28 107.04 1kli n THR 98 Ca 0.00 -0.41 -0.01 0.00 -2.27 0.00 0.00 64.05 61.36 1kli n THR 98 Cb 0.00 -0.58 -0.04 0.00 -2.10 0.00 0.00 70.33 67.62 1kli n THR 98 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1kli n THR 99 N -0.92 0.21 -1.87 4.28 -2.24 -1.26 -4.91 114.28 107.57 1kli n THR 99 Ca 0.01 -0.17 -0.38 0.00 -2.27 0.00 0.00 64.05 61.23 1kli n THR 99 Cb 0.12 -0.44 0.03 0.00 -2.10 0.00 0.00 70.33 67.94 1kli n THR 99 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 1kli s ASN 100 N -3.24 5.52 -1.36 3.42 3.04 -1.26 -3.25 114.94 117.81 1kli s ASN 100 Ca -0.02 2.70 -0.06 0.00 0.04 0.00 0.00 52.86 55.52 1kli s ASN 100 Cb 0.02 -2.63 0.03 0.00 -1.54 0.00 0.00 41.25 37.12 1kli s ASN 100 CO 0.20 -1.39 0.96 1.41 -3.04 0.00 0.00 177.10 175.24 1kli n HIS 101 N -0.80 -2.32 -2.37 0.43 8.25 -1.26 -4.51 115.22 112.64 1kli n HIS 101 Ca 0.09 0.92 -0.43 0.00 -0.26 0.00 0.00 57.72 58.04 1kli n HIS 101 Cb 0.45 -4.59 0.00 0.00 1.12 0.00 0.00 29.99 26.97 1kli n HIS 101 CO 0.00 0.00 0.00 -3.47 0.64 0.00 0.00 176.34 173.51 1kli n ASP 102 N -3.00 4.70 -3.81 0.41 2.03 -1.20 -4.61 116.55 111.07 1kli n ASP 102 Ca -0.13 -2.93 -0.12 0.00 0.52 0.00 0.00 54.79 52.12 1kli n ASP 102 Cb 0.61 -1.65 -0.10 0.00 -0.72 0.00 0.00 41.12 39.25 1kli n ASP 102 CO 0.00 0.00 0.00 -0.51 -1.92 0.00 0.00 177.20 174.77 1kli s ILE 103 N 2.93 0.05 -0.05 5.18 2.07 -1.26 -3.98 121.20 126.14 1kli s ILE 103 Ca 0.48 -0.44 -0.07 0.00 -1.41 0.00 0.00 60.65 59.21 1kli s ILE 103 Cb 0.06 -0.49 0.01 0.00 0.13 0.00 0.00 42.46 42.18 1kli s ILE 103 CO 0.01 -0.24 0.17 0.00 -1.91 0.00 0.00 174.94 172.97 1kli s ALA 104 N -1.00 -0.42 -0.19 1.50 0.00 -0.57 -3.71 121.76 117.37 1kli s ALA 104 Ca -0.11 0.32 -0.02 0.00 0.00 0.00 0.00 51.96 52.15 1kli s ALA 104 Cb -0.05 -0.17 -0.00 0.00 0.00 0.00 0.00 23.12 22.90 1kli s ALA 104 CO 0.02 -0.13 -0.11 -1.17 0.00 0.00 0.00 175.76 174.38 1kli s LEU 105 N -0.37 2.60 -0.13 0.00 2.96 0.04 -0.94 118.68 122.84 1kli s LEU 105 Ca -0.05 -0.47 -0.03 0.00 -0.22 0.00 0.00 54.13 53.37 1kli s LEU 105 Cb -0.03 -1.63 -0.03 0.00 0.50 0.00 0.00 46.19 45.00 1kli s LEU 105 CO 0.01 0.02 -0.02 -0.76 -1.32 0.00 0.00 176.35 174.27 1kli s LEU 106 N 1.21 3.36 -0.21 -0.68 1.02 0.12 -0.54 118.68 122.96 1kli s LEU 106 Ca 0.02 -0.04 -0.08 0.00 0.02 0.00 0.00 54.13 54.06 1kli s LEU 106 Cb -0.14 -1.79 -0.04 0.00 0.02 0.00 0.00 46.19 44.24 1kli s LEU 106 CO -0.05 0.24 0.07 -0.60 0.02 0.00 0.00 176.35 176.04 1kli s ARG 107 N -0.08 3.85 0.49 1.70 3.52 -0.36 -0.88 118.95 127.19 1kli s ARG 107 Ca 0.03 -0.40 -0.19 0.00 -0.13 0.00 0.00 55.73 55.04 1kli s ARG 107 Cb -0.13 -3.29 -0.09 0.00 -1.56 0.00 0.00 34.95 29.89 1kli s ARG 107 CO 0.02 0.06 0.98 -0.51 -0.81 0.00 0.00 175.30 175.05 1kli s LEU 108 N 0.95 3.75 0.38 -0.88 1.43 0.54 -0.71 118.68 124.14 1kli s LEU 108 Ca 0.04 1.67 0.15 0.00 -1.03 0.00 0.00 54.13 54.96 1kli s LEU 108 Cb -0.14 -4.53 0.76 0.00 0.03 0.00 0.00 46.19 42.31 1kli s LEU 108 CO 0.03 -0.57 1.82 -0.74 0.23 0.00 0.00 176.35 177.12 1kli h HIS 109 N 1.32 0.00 -3.46 0.29 -0.00 -1.27 -3.42 115.15 108.60 1kli h HIS 109 Ca -0.48 0.00 -0.17 0.00 -0.00 0.00 0.00 60.37 59.72 1kli h HIS 109 Cb 1.19 0.00 -0.24 0.00 -0.00 0.00 0.00 27.41 28.36 1kli h HIS 109 CO 0.62 0.37 -0.54 -0.65 -0.00 0.00 0.00 177.93 177.73 1kli s GLN 110 N -4.08 0.29 0.65 5.26 -0.21 -1.26 -5.02 119.66 115.28 1kli s GLN 110 Ca -0.02 -0.06 -0.16 0.00 0.02 0.00 0.00 55.36 55.14 1kli s GLN 110 Cb 0.14 0.13 -0.01 0.00 1.00 0.00 0.00 33.01 34.27 1kli s GLN 110 CO 0.71 -0.06 1.14 -1.25 -2.12 0.00 0.00 175.29 173.71 1kli s PRO 111 N -0.53 2.79 0.57 2.91 0.04 -1.26 -4.90 135.00 134.62 1kli s PRO 111 Ca -0.06 1.52 -0.07 0.00 0.04 0.00 0.00 61.00 62.42 1kli s PRO 111 Cb -0.04 -1.94 -0.01 0.00 0.04 0.00 0.00 34.50 32.55 1kli s PRO 111 CO 0.01 -1.28 0.90 0.14 0.04 0.00 0.00 177.00 176.81 1kli s VAL 112 N -2.14 4.23 -0.22 -0.36 -7.23 -0.20 -5.01 120.40 109.47 1kli s VAL 112 Ca 0.70 0.25 -0.12 0.00 -1.81 0.00 0.00 61.98 61.00 1kli s VAL 112 Cb -0.23 -3.66 -0.05 0.00 0.56 0.00 0.00 36.38 33.00 1kli s VAL 112 CO 0.39 -0.72 0.22 -0.69 -0.31 0.00 0.00 175.10 173.99 1kli s VAL 113 N -2.97 5.32 0.28 1.32 1.01 -1.26 -4.85 120.40 119.25 1kli s VAL 113 Ca 0.52 0.32 -0.29 0.00 0.00 0.00 0.00 61.98 62.53 1kli s VAL 113 Cb -0.11 -3.56 -0.10 0.00 0.00 0.00 0.00 36.38 32.62 1kli s VAL 113 CO 0.47 0.33 1.19 -0.76 0.00 0.00 0.00 175.10 176.33 1kli s LEU 114 N 1.03 4.49 0.00 3.92 1.43 -1.26 -4.79 118.68 123.50 1kli s LEU 114 Ca 0.11 2.40 -0.04 0.00 -1.03 0.00 0.00 54.13 55.56 1kli s LEU 114 Cb -0.14 -3.63 0.02 0.00 0.03 0.00 0.00 46.19 42.47 1kli s LEU 114 CO 0.05 -0.31 0.52 0.35 0.23 0.00 0.00 176.35 177.18 1kli n THR 115 N 1.33 0.00 0.19 5.49 -2.24 -0.52 -4.95 114.28 113.57 1kli n THR 115 Ca 0.00 -1.48 0.15 0.00 -2.27 0.00 0.00 64.05 60.45 1kli n THR 115 Cb 0.44 0.99 0.75 0.00 -2.10 0.00 0.00 70.33 70.41 1kli n THR 115 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 1kli h ASP 116 N 1.83 0.00 -0.02 3.42 5.19 -2.00 -1.95 116.42 122.89 1kli h ASP 116 Ca -0.26 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.15 1kli h ASP 116 Cb 1.11 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.62 1kli h ASP 116 CO 0.35 0.00 -0.22 1.41 -3.12 0.00 0.00 179.24 177.67 1kli n HIS 117 N -4.15 0.00 -3.69 4.55 8.25 -1.26 -4.83 115.22 114.08 1kli n HIS 117 Ca 0.01 0.00 -0.28 0.00 -0.26 0.00 0.00 57.72 57.19 1kli n HIS 117 Cb 0.28 0.00 -0.16 0.00 1.12 0.00 0.00 29.99 31.24 1kli n HIS 117 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 1kli s VAL 118 N -2.01 0.50 -0.02 1.59 1.01 -0.73 -3.95 120.40 116.79 1kli s VAL 118 Ca 0.20 -0.83 -0.02 0.00 0.00 0.00 0.00 61.98 61.34 1kli s VAL 118 Cb 0.17 -1.19 0.01 0.00 0.00 0.00 0.00 36.38 35.36 1kli s VAL 118 CO 0.39 -0.44 0.05 -0.69 0.00 0.00 0.00 175.10 174.40 1kli s VAL 119 N 1.84 -0.00 0.51 2.92 1.01 -0.86 -1.44 120.40 124.38 1kli s VAL 119 Ca 0.04 0.01 -0.18 0.00 0.00 0.00 0.00 61.98 61.85 1kli s VAL 119 Cb -0.17 -0.08 -0.08 0.00 0.00 0.00 0.00 36.38 36.05 1kli s VAL 119 CO -0.18 0.00 0.99 -2.16 0.00 0.00 0.00 175.10 173.75 1kli s PRO 120 N 0.06 3.91 0.15 2.72 0.04 -1.26 -2.68 135.00 137.94 1kli s PRO 120 Ca -0.00 1.06 -0.12 0.00 0.04 0.00 0.00 61.00 61.98 1kli s PRO 120 Cb -0.01 -2.13 -0.07 0.00 0.04 0.00 0.00 34.50 32.34 1kli s PRO 120 CO -0.00 -0.31 0.52 -1.17 0.04 0.00 0.00 177.00 176.08 1kli s LEU 121 N -3.89 4.30 -0.01 -3.56 2.96 0.02 -4.91 118.68 113.58 1kli s LEU 121 Ca 0.61 0.97 -0.30 0.00 -0.22 0.00 0.00 54.13 55.19 1kli s LEU 121 Cb -0.11 -3.31 -0.03 0.00 0.50 0.00 0.00 46.19 43.23 1kli s LEU 121 CO 0.27 0.07 1.09 0.00 -1.32 0.00 0.00 176.35 176.46 1kli s LEU 123 N 1.44 4.15 0.77 0.00 2.96 -1.26 -1.19 118.68 125.55 1kli s LEU 123 Ca 0.54 0.25 -0.11 0.00 -0.22 0.00 0.00 54.13 54.58 1kli s LEU 123 Cb -0.24 -3.01 0.05 0.00 0.50 0.00 0.00 46.19 43.50 1kli s LEU 123 CO 0.25 -0.77 1.09 -2.16 -1.32 0.00 0.00 176.35 173.44 1kli s PRO 124 N 3.14 2.30 0.57 0.98 0.04 -1.26 -5.00 135.00 135.78 1kli s PRO 124 Ca 0.31 0.68 -0.16 0.00 0.04 0.00 0.00 61.00 61.87 1kli s PRO 124 Cb -0.13 -1.94 -0.05 0.00 0.04 0.00 0.00 34.50 32.42 1kli s PRO 124 CO 0.18 -1.48 1.04 -1.21 0.04 0.00 0.00 177.00 175.58 1kli s GLU 125 N -5.15 3.47 0.12 4.56 2.02 -1.26 -4.89 118.70 117.58 1kli s GLU 125 Ca 0.60 1.14 -0.28 0.00 0.02 0.00 0.00 54.97 56.45 1kli s GLU 125 Cb -0.14 -2.06 -0.07 0.00 0.10 0.00 0.00 34.13 31.96 1kli s GLU 125 CO 0.54 -0.68 1.60 -0.09 0.02 0.00 0.00 175.26 176.66 1kli h ARG 126 N 0.56 -0.51 -0.27 1.61 2.43 -1.96 -1.77 114.38 114.47 1kli h ARG 126 Ca -0.47 0.03 0.06 0.00 -0.81 0.00 0.00 59.98 58.80 1kli h ARG 126 Cb 1.21 0.12 -0.06 0.00 -0.42 0.00 0.00 29.97 30.81 1kli h ARG 126 CO 0.58 -0.34 -0.16 1.79 -1.51 0.00 0.00 179.97 180.34 1kli h THR 127 N -0.53 0.54 -0.67 0.20 1.35 -1.94 0.70 112.91 112.55 1kli h THR 127 Ca 0.05 0.00 0.04 0.00 -0.55 0.00 0.00 66.41 65.95 1kli h THR 127 Cb 0.60 0.54 -0.05 0.00 -1.73 0.00 0.00 68.15 67.51 1kli h THR 127 CO -0.26 0.00 0.40 0.15 -0.25 0.00 0.00 175.52 175.56 1kli h PHE 128 N -0.13 0.74 -0.40 4.73 3.57 -1.92 0.14 116.94 123.67 1kli h PHE 128 Ca 0.14 0.02 -0.14 0.00 3.53 0.00 0.00 57.97 61.53 1kli h PHE 128 Cb 0.35 -0.24 -0.01 0.00 2.79 0.00 0.00 35.95 38.84 1kli h PHE 128 CO -0.34 0.40 -0.30 1.03 -2.23 0.00 0.00 178.31 176.86 1kli h SER 129 N 0.76 0.92 0.21 0.41 0.87 -0.68 -0.47 113.55 115.56 1kli h SER 129 Ca 0.28 -0.38 -0.27 0.00 -1.23 0.00 0.00 61.79 60.20 1kli h SER 129 Cb 0.09 -0.25 0.02 0.00 -0.44 0.00 0.00 62.40 61.82 1kli h SER 129 CO -0.14 1.14 -1.13 -0.33 -0.53 0.00 0.00 176.83 175.85 1kli h GLU 129 N 0.74 0.55 -0.55 2.24 5.08 -0.56 0.14 114.58 122.21 1kli h GLU 129 Ca 0.08 -0.68 0.00 0.00 -1.00 0.00 0.00 59.36 57.76 1kli h GLU 129 Cb 0.86 0.21 0.00 0.00 0.50 0.00 0.00 28.75 30.33 1kli h GLU 129 CO 0.08 1.28 0.00 2.89 -1.00 0.00 0.00 179.01 182.26 1kli n ARG 129 N -3.77 2.70 0.15 2.33 1.85 0.48 -4.47 116.66 115.93 1kli n ARG 129 Ca -0.11 -2.39 0.00 0.00 -1.00 0.00 0.00 57.85 54.36 1kli n ARG 129 Cb 0.93 -1.45 0.00 0.00 -1.05 0.00 0.00 32.46 30.89 1kli n ARG 129 CO 0.00 0.00 0.00 2.41 -0.01 0.00 0.00 177.63 180.03 1kli n THR 129 N 1.23 0.02 -0.31 8.89 -1.04 -0.24 -4.92 114.28 117.91 1kli n THR 129 Ca 0.19 0.01 -0.02 0.00 -2.04 0.00 0.00 64.05 62.19 1kli n THR 129 Cb 0.55 -0.51 0.14 0.00 -1.82 0.00 0.00 70.33 68.68 1kli n THR 129 CO 0.00 0.00 0.00 -0.07 -0.64 0.00 0.00 175.07 174.36 1kli h LEU 129 N 0.00 1.06 -1.77 -4.42 3.38 -1.37 -1.89 115.31 110.30 1kli h LEU 129 Ca 0.00 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.91 1kli h LEU 129 Cb 0.00 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 40.48 1kli h LEU 129 CO 0.00 0.81 0.00 0.00 0.09 0.00 0.00 178.44 179.34 1kli h ALA 129 N 1.37 1.00 -0.07 1.53 0.00 -0.95 -0.74 119.26 121.40 1kli h ALA 129 Ca 0.32 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.23 1kli h ALA 129 Cb -0.06 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.73 1kli h ALA 129 CO -0.06 0.00 0.00 1.19 0.00 0.00 0.00 179.25 180.38 1kli n PHE 129 N -2.46 0.05 -2.66 0.00 3.72 -0.71 -4.88 117.46 110.52 1kli n PHE 129 Ca -0.02 -0.03 -0.43 0.00 -0.05 0.00 0.00 57.45 56.93 1kli n PHE 129 Cb 0.05 -0.00 -0.02 0.00 -0.94 0.00 0.00 39.48 38.57 1kli n PHE 129 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 176.76 176.79 1kli s VAL 129 N -1.94 4.69 0.06 -4.37 1.01 -0.29 -4.96 120.40 114.60 1kli s VAL 129 Ca 0.29 2.03 -0.22 0.00 0.00 0.00 0.00 61.98 64.09 1kli s VAL 129 Cb 0.20 -4.31 -0.09 0.00 0.00 0.00 0.00 36.38 32.18 1kli s VAL 129 CO 0.30 -0.16 1.34 -0.09 0.00 0.00 0.00 175.10 176.49 1kli h ARG 134 N 7.42 -0.47 -5.87 2.72 9.65 -1.89 -3.43 114.38 122.50 1kli h ARG 134 Ca -0.20 0.03 -0.63 0.00 -1.10 0.00 0.00 59.98 58.08 1kli h ARG 134 Cb 1.07 0.11 -0.05 0.00 -1.39 0.00 0.00 29.97 29.71 1kli h ARG 134 CO 0.97 -0.31 -0.50 -0.06 2.80 0.00 0.00 179.97 182.87 1kli s PHE 135 N -4.71 3.53 0.07 2.20 0.08 -1.26 -0.61 117.98 117.28 1kli s PHE 135 Ca -0.10 0.30 -0.09 0.00 0.12 0.00 0.00 56.93 57.16 1kli s PHE 135 Cb 0.04 -1.79 -0.00 0.00 -0.57 0.00 0.00 43.02 40.69 1kli s PHE 135 CO 0.37 0.62 0.19 -1.12 -0.10 0.00 0.00 175.22 175.17 1kli s SER 136 N -2.24 0.11 -0.12 1.36 0.01 -0.50 -4.66 113.70 107.65 1kli s SER 136 Ca 0.31 -0.58 -0.10 0.00 1.31 0.00 0.00 55.95 56.89 1kli s SER 136 Cb -0.13 0.32 -0.05 0.00 0.21 0.00 0.00 66.02 66.38 1kli s SER 136 CO 0.23 -0.68 0.20 -0.76 0.41 0.00 0.00 173.24 172.65 1kli s LEU 137 N -2.64 4.35 0.00 2.44 1.43 -0.03 -0.61 118.68 123.62 1kli s LEU 137 Ca 0.02 0.51 0.07 0.00 -1.03 0.00 0.00 54.13 53.70 1kli s LEU 137 Cb 0.03 -2.20 -0.02 0.00 0.03 0.00 0.00 46.19 44.03 1kli s LEU 137 CO -0.09 0.31 -0.23 0.68 0.23 0.00 0.00 176.35 177.25 1kli s VAL 138 N -0.56 1.82 0.16 -1.59 -7.23 0.02 -0.55 120.40 112.47 1kli s VAL 138 Ca 0.15 -1.08 -0.06 0.00 -1.81 0.00 0.00 61.98 59.18 1kli s VAL 138 Cb -0.13 -1.54 -0.02 0.00 0.56 0.00 0.00 36.38 35.26 1kli s VAL 138 CO 0.04 0.43 0.22 -0.94 -0.31 0.00 0.00 175.10 174.54 1kli s SER 139 N -0.77 0.11 0.00 4.85 1.04 -1.21 -0.38 113.70 117.35 1kli s SER 139 Ca 0.09 -1.00 0.00 0.00 0.48 0.00 0.00 55.95 55.52 1kli s SER 139 Cb -0.09 0.40 0.00 0.00 0.10 0.00 0.00 66.02 66.43 1kli s SER 139 CO 0.00 -0.86 0.00 0.61 0.98 0.00 0.00 173.24 173.97 1kli n GLY 140 N -0.20 1.33 1.79 7.32 0.00 -0.69 -4.48 105.19 110.27 1kli n GLY 140 Ca -0.06 -1.18 -0.05 0.00 0.00 0.00 0.00 46.02 44.74 1kli n GLY 140 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1kli n TRP 141 N -1.03 2.16 -0.85 1.61 8.01 -1.26 -2.24 117.44 123.85 1kli n TRP 141 Ca 0.00 -1.23 -0.15 0.00 -1.31 0.00 0.00 57.50 54.81 1kli n TRP 141 Cb 0.00 -0.64 0.13 0.00 -2.01 0.00 0.00 31.31 28.79 1kli n TRP 141 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1kli n GLY 142 N -0.34 -2.49 3.74 6.99 0.00 -1.25 -2.70 105.19 109.15 1kli n GLY 142 Ca 0.39 -1.49 -0.42 0.00 0.00 0.00 0.00 46.02 44.49 1kli n GLY 142 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1kli n GLN 143 N -3.13 2.59 0.06 1.61 6.02 -0.18 -2.14 117.38 122.21 1kli n GLN 143 Ca 0.08 0.92 0.13 0.00 -0.01 0.00 0.00 57.00 58.12 1kli n GLN 143 Cb 0.30 -2.66 0.44 0.00 1.02 0.00 0.00 30.24 29.34 1kli n GLN 143 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 1kli n LEU 144 N 1.57 0.54 -3.63 1.08 4.77 -0.88 -1.01 117.00 119.44 1kli n LEU 144 Ca 0.06 0.49 -0.13 0.00 -0.03 0.00 0.00 56.01 56.40 1kli n LEU 144 Cb 0.37 -0.36 -0.06 0.00 -2.33 0.00 0.00 43.42 41.04 1kli n LEU 144 CO 0.64 -0.10 0.20 -0.76 -1.33 0.00 0.00 177.39 176.04 1kli s LEU 145 N -3.96 0.21 0.23 2.23 1.43 -1.26 -4.25 118.68 113.30 1kli s LEU 145 Ca 0.11 0.07 -0.31 0.00 -1.03 0.00 0.00 54.13 52.97 1kli s LEU 145 Cb 0.15 1.90 -0.11 0.00 0.03 0.00 0.00 46.19 48.16 1kli s LEU 145 CO 0.59 -0.69 1.55 -0.62 0.23 0.00 0.00 176.35 177.41 1kli s ASP 146 N -1.99 6.54 -1.61 2.29 3.68 -1.26 -1.06 116.67 123.25 1kli s ASP 146 Ca -0.05 2.74 0.00 0.00 2.13 0.00 0.00 52.55 57.37 1kli s ASP 146 Cb -0.01 -2.61 0.00 0.00 -1.45 0.00 0.00 42.92 38.85 1kli s ASP 146 CO -0.02 -0.82 0.00 0.54 0.13 0.00 0.00 175.17 175.00 1kli n ARG 147 N 2.98 -1.34 -4.67 4.34 5.12 -1.26 -4.98 116.66 116.85 1kli n ARG 147 Ca 0.10 0.94 -0.33 0.00 -1.93 0.00 0.00 57.85 56.63 1kli n ARG 147 Cb 0.38 -5.33 -0.07 0.00 -1.16 0.00 0.00 32.46 26.28 1kli n ARG 147 CO 0.00 0.00 0.00 0.20 -1.93 0.00 0.00 177.63 175.90 1kli s GLY 149 N -2.41 2.98 0.60 -0.13 0.00 -0.22 -5.14 107.32 103.01 1kli s GLY 149 Ca 0.00 -0.37 -0.16 0.00 0.00 0.00 0.00 44.72 44.20 1kli s GLY 149 CO 0.00 -2.18 1.06 0.00 0.00 0.00 0.00 173.10 171.98 1kli s ALA 150 N -2.88 2.73 0.65 3.20 0.00 -1.26 -4.71 121.76 119.50 1kli s ALA 150 Ca 0.07 0.40 -0.11 0.00 0.00 0.00 0.00 51.96 52.32 1kli s ALA 150 Cb 0.01 -3.23 -0.02 0.00 0.00 0.00 0.00 23.12 19.88 1kli s ALA 150 CO 0.04 -0.83 1.05 0.95 0.00 0.00 0.00 175.76 176.97 1kli s THR 151 N -2.45 4.21 0.30 0.00 -4.23 -1.26 -2.08 115.64 110.13 1kli s THR 151 Ca 0.64 0.69 -0.24 0.00 -1.18 0.00 0.00 61.69 61.59 1kli s THR 151 Cb -0.16 -3.71 -0.10 0.00 1.34 0.00 0.00 72.50 69.88 1kli s THR 151 CO 0.37 -0.92 0.90 0.00 -0.54 0.00 0.00 174.62 174.42 1kli s ALA 152 N -3.24 3.25 -0.10 3.99 0.00 -0.91 -4.82 121.76 119.93 1kli s ALA 152 Ca 0.56 0.44 0.15 0.00 0.00 0.00 0.00 51.96 53.11 1kli s ALA 152 Cb -0.11 -3.10 -0.16 0.00 0.00 0.00 0.00 23.12 19.75 1kli s ALA 152 CO 0.53 0.21 0.81 -0.07 0.00 0.00 0.00 175.76 177.23 1kli h LEU 153 N 3.17 0.00 -9.12 0.00 3.38 -1.93 -3.45 115.31 107.36 1kli h LEU 153 Ca -0.47 0.00 -0.68 0.00 0.09 0.00 0.00 57.88 56.82 1kli h LEU 153 Cb 1.19 0.00 -0.19 0.00 0.09 0.00 0.00 40.66 41.75 1kli h LEU 153 CO 0.65 0.70 -0.74 -1.61 0.09 0.00 0.00 178.44 177.52 1kli s GLU 154 N -2.83 2.33 0.20 1.13 2.02 -1.26 -0.66 118.70 119.63 1kli s GLU 154 Ca -0.03 -0.85 -0.32 0.00 0.02 0.00 0.00 54.97 53.79 1kli s GLU 154 Cb 0.08 -2.36 -0.13 0.00 0.10 0.00 0.00 34.13 31.83 1kli s GLU 154 CO 0.81 0.57 1.67 -0.11 0.02 0.00 0.00 175.26 178.22 1kli n LEU 155 N 1.46 3.77 -4.64 1.80 7.94 -0.77 -4.83 117.00 121.73 1kli n LEU 155 Ca -0.15 1.07 -0.29 0.00 -1.11 0.00 0.00 56.01 55.53 1kli n LEU 155 Cb 0.52 -1.54 -0.09 0.00 0.53 0.00 0.00 43.42 42.85 1kli n LEU 155 CO 0.30 0.05 -0.37 -0.04 -1.11 0.00 0.00 177.39 176.22 1kli s MET 156 N 0.97 2.34 0.03 1.96 -1.94 -0.95 -0.06 119.30 121.65 1kli s MET 156 Ca 0.75 -1.00 0.02 0.00 -1.71 0.00 0.00 55.69 53.74 1kli s MET 156 Cb -0.55 -2.39 -0.02 0.00 2.01 0.00 0.00 34.83 33.88 1kli s MET 156 CO 0.35 0.50 -0.07 0.54 -0.01 0.00 0.00 175.02 176.33 1kli s VAL 157 N -1.43 0.44 -0.06 -6.03 0.11 0.95 -1.70 120.40 112.69 1kli s VAL 157 Ca 0.25 -0.96 -0.04 0.00 -2.93 0.00 0.00 61.98 58.30 1kli s VAL 157 Cb -0.11 -0.51 0.02 0.00 -1.53 0.00 0.00 36.38 34.26 1kli s VAL 157 CO 0.17 -0.36 0.14 -0.22 -3.33 0.00 0.00 175.10 171.49 1kli s LEU 158 N -1.42 1.14 -0.22 2.54 2.96 0.49 -1.48 118.68 122.70 1kli s LEU 158 Ca -0.10 0.28 -0.18 0.00 -0.22 0.00 0.00 54.13 53.90 1kli s LEU 158 Cb -0.09 0.40 -0.03 0.00 0.50 0.00 0.00 46.19 46.97 1kli s LEU 158 CO 0.00 -0.09 0.53 0.21 -1.32 0.00 0.00 176.35 175.67 1kli s ASN 159 N 0.59 6.54 0.01 3.68 3.04 -1.26 -0.80 114.94 126.73 1kli s ASN 159 Ca -0.04 0.65 0.05 0.00 0.04 0.00 0.00 52.86 53.56 1kli s ASN 159 Cb -0.06 -2.29 -0.02 0.00 -1.54 0.00 0.00 41.25 37.34 1kli s ASN 159 CO -0.03 -0.21 -0.16 0.68 -3.04 0.00 0.00 177.10 174.34 1kli s VAL 160 N 1.82 1.28 0.15 -5.21 -7.23 0.21 -4.93 120.40 106.51 1kli s VAL 160 Ca 0.24 -0.83 -0.21 0.00 -1.81 0.00 0.00 61.98 59.37 1kli s VAL 160 Cb -0.15 -1.09 -0.08 0.00 0.56 0.00 0.00 36.38 35.62 1kli s VAL 160 CO 0.09 0.25 0.69 -2.16 -0.31 0.00 0.00 175.10 173.67 1kli s PRO 161 N -0.66 4.34 0.16 4.82 0.04 -1.26 -1.41 135.00 141.02 1kli s PRO 161 Ca 0.05 0.92 -0.14 0.00 0.04 0.00 0.00 61.00 61.88 1kli s PRO 161 Cb -0.07 -3.13 -0.07 0.00 0.04 0.00 0.00 34.50 31.27 1kli s PRO 161 CO 0.00 0.54 0.55 0.50 0.04 0.00 0.00 177.00 178.62 1kli s ARG 162 N -1.42 3.95 0.16 4.56 3.52 0.22 -1.54 118.95 128.40 1kli s ARG 162 Ca 0.36 0.45 0.07 0.00 -0.13 0.00 0.00 55.73 56.49 1kli s ARG 162 Cb -0.20 -2.90 -0.04 0.00 -1.56 0.00 0.00 34.95 30.25 1kli s ARG 162 CO 0.22 0.46 -0.16 -0.51 -0.81 0.00 0.00 175.30 174.50 1kli s LEU 163 N -2.07 2.46 0.33 -0.88 1.02 -0.82 -4.96 118.68 113.77 1kli s LEU 163 Ca 0.39 -0.89 -0.27 0.00 0.02 0.00 0.00 54.13 53.38 1kli s LEU 163 Cb -0.14 -0.70 -0.09 0.00 0.02 0.00 0.00 46.19 45.27 1kli s LEU 163 CO 0.19 -0.11 1.09 -0.04 0.02 0.00 0.00 176.35 177.51 1kli s MET 164 N -3.00 4.41 0.36 1.70 -1.94 -1.26 -4.23 119.30 115.34 1kli s MET 164 Ca 0.15 1.72 0.12 0.00 -1.71 0.00 0.00 55.69 55.97 1kli s MET 164 Cb -0.04 -2.92 0.91 0.00 2.01 0.00 0.00 34.83 34.79 1kli s MET 164 CO 0.05 0.03 1.81 1.15 -0.01 0.00 0.00 175.02 178.05 1kli h THR 165 N 2.71 0.68 -0.51 2.05 2.02 -1.94 0.11 112.91 118.03 1kli h THR 165 Ca -0.47 -0.20 -0.10 0.00 0.77 0.00 0.00 66.41 66.40 1kli h THR 165 Cb 1.22 0.04 -0.02 0.00 -1.74 0.00 0.00 68.15 67.65 1kli h THR 165 CO 0.65 0.11 -0.07 -0.61 0.37 0.00 0.00 175.52 175.96 1kli h GLN 166 N 0.59 0.94 -0.48 6.66 4.15 -1.99 -2.33 115.11 122.66 1kli h GLN 166 Ca 0.54 -0.34 -0.11 0.00 0.77 0.00 0.00 58.65 59.51 1kli h GLN 166 Cb 1.06 -0.07 -0.02 0.00 0.21 0.00 0.00 27.48 28.67 1kli h GLN 166 CO -0.29 1.00 -0.14 -0.44 -1.93 0.00 0.00 178.83 177.03 1kli h ASP 167 N 0.80 0.92 0.43 -0.69 3.32 -1.26 -3.20 116.42 116.74 1kli h ASP 167 Ca 0.13 -0.31 -0.01 0.00 0.02 0.00 0.00 57.03 56.86 1kli h ASP 167 Cb 0.62 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 39.91 1kli h ASP 167 CO 0.04 1.06 -0.32 0.00 -1.72 0.00 0.00 179.24 178.30 1kli n LEU 169 N -5.45 0.00 0.00 0.00 4.77 -0.89 -0.85 117.00 114.58 1kli n LEU 169 Ca -0.11 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.87 1kli n LEU 169 Cb 0.34 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.43 1kli n LEU 169 CO 0.32 0.00 0.00 0.00 -1.33 0.00 0.00 177.39 176.38 1kli n GLN 170 N 0.84 0.00 -4.11 3.23 6.02 -0.25 -4.83 117.38 118.28 1kli n GLN 170 Ca 0.00 0.00 -0.30 0.00 -0.01 0.00 0.00 57.00 56.69 1kli n GLN 170 Cb 0.00 0.00 -0.08 0.00 1.02 0.00 0.00 30.24 31.18 1kli n GLN 170 CO 0.00 0.00 0.00 -1.12 -1.01 0.00 0.00 177.06 174.93 1kli s SER 170 N 0.00 5.16 -0.11 1.08 0.01 -0.03 -4.73 113.70 115.08 1kli s SER 170 Ca 0.00 -0.13 -0.30 0.00 1.31 0.00 0.00 55.95 56.83 1kli s SER 170 Cb 0.00 -1.28 -0.01 0.00 0.21 0.00 0.00 66.02 64.94 1kli s SER 170 CO 0.00 0.17 1.02 -0.13 0.41 0.00 0.00 173.24 174.71 1kli s ARG 170 N -2.33 4.41 0.38 12.44 0.52 -0.73 -5.00 118.95 128.63 1kli s ARG 170 Ca 0.27 1.41 -0.28 0.00 -0.52 0.00 0.00 55.73 56.61 1kli s ARG 170 Cb -0.12 -3.55 -0.11 0.00 0.52 0.00 0.00 34.95 31.69 1kli s ARG 170 CO 0.19 -0.34 1.43 1.63 0.02 0.00 0.00 175.30 178.23 1kli n LYS 170 N 5.10 2.50 0.00 3.54 5.02 -1.26 -4.91 118.16 128.15 1kli n LYS 170 Ca 0.09 0.88 0.00 0.00 -2.02 0.00 0.00 58.31 57.26 1kli n LYS 170 Cb 0.48 -2.58 0.00 0.00 -0.02 0.00 0.00 35.03 32.91 1kli n LYS 170 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 1kli n VAL 170 N 0.34 0.00 0.00 -0.18 0.31 -1.26 -5.05 118.33 112.49 1kli n VAL 170 Ca 0.02 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.35 1kli n VAL 170 Cb 0.38 0.07 0.00 0.00 -0.91 0.00 0.00 33.84 33.38 1kli n VAL 170 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1kli n GLY 170 N 1.88 1.89 0.26 2.92 0.00 -1.26 -4.27 105.19 106.60 1kli n GLY 170 Ca 0.00 -0.02 0.16 0.00 0.00 0.00 0.00 46.02 46.16 1kli n GLY 170 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 1kli h ASP 170 N 0.00 0.00 -3.53 1.61 3.58 -2.02 -3.45 116.42 112.61 1kli h ASP 170 Ca 0.00 0.00 -0.53 0.00 0.42 0.00 0.00 57.03 56.92 1kli h ASP 170 Cb 0.00 0.00 0.08 0.00 1.72 0.00 0.00 39.33 41.13 1kli h ASP 170 CO 0.00 0.00 0.79 -0.94 -2.88 0.00 0.00 179.24 176.21 1kli s SER 170 N -5.76 6.52 0.76 2.28 1.04 -1.26 -4.96 113.70 112.32 1kli s SER 170 Ca 0.02 2.84 -0.15 0.00 0.48 0.00 0.00 55.95 59.14 1kli s SER 170 Cb 0.08 -2.64 0.02 0.00 0.10 0.00 0.00 66.02 63.59 1kli s SER 170 CO 0.56 -0.78 0.93 -2.65 0.98 0.00 0.00 173.24 172.28 1kli n PRO 170 N 1.74 0.32 -2.69 4.02 -0.02 -1.26 -4.96 135.00 132.15 1kli n PRO 170 Ca 0.05 0.17 -0.28 0.00 -2.02 0.00 0.00 63.50 61.43 1kli n PRO 170 Cb 0.39 -2.20 -0.01 0.00 -0.02 0.00 0.00 33.50 31.67 1kli n PRO 170 CO 0.00 0.00 0.00 -0.80 1.98 0.00 0.00 175.50 176.68 1kli s ASN 175 N -1.78 6.30 -0.54 2.55 0.01 -1.26 -5.04 114.94 115.18 1kli s ASN 175 Ca 0.71 0.94 -0.18 0.00 -0.71 0.00 0.00 52.86 53.61 1kli s ASN 175 Cb -0.32 -2.25 0.08 0.00 0.41 0.00 0.00 41.25 39.17 1kli s ASN 175 CO 0.53 -0.54 0.62 -0.63 -1.51 0.00 0.00 177.10 175.57 1kli s ILE 176 N -2.68 4.92 0.86 0.60 1.01 -1.26 -4.97 121.20 119.67 1kli s ILE 176 Ca 0.48 -0.83 -0.09 0.00 0.00 0.00 0.00 60.65 60.21 1kli s ILE 176 Cb -0.10 -4.36 0.17 0.00 0.01 0.00 0.00 42.46 38.18 1kli s ILE 176 CO 0.43 -0.91 1.18 0.42 0.00 0.00 0.00 174.94 176.06 1kli s THR 177 N 2.47 2.04 -1.78 2.92 -4.23 -1.26 -4.95 115.64 110.85 1kli s THR 177 Ca 0.11 -0.28 0.20 0.00 -1.18 0.00 0.00 61.69 60.54 1kli s THR 177 Cb -0.23 -2.76 0.47 0.00 1.34 0.00 0.00 72.50 71.33 1kli s THR 177 CO 0.08 0.00 1.58 -1.84 -0.54 0.00 0.00 174.62 173.90 1kli n GLU 178 N -3.36 0.48 -0.62 3.99 0.28 -1.26 -2.24 120.64 117.91 1kli n GLU 178 Ca 0.16 0.04 0.09 0.00 -0.16 0.00 0.00 57.16 57.28 1kli n GLU 178 Cb 0.60 -1.50 0.34 0.00 1.43 0.00 0.00 31.44 32.31 1kli n GLU 178 CO 0.00 0.00 0.00 0.66 -0.16 0.00 0.00 177.13 177.63 1kli n TYR 179 N -1.11 1.46 -4.08 -1.84 4.01 -1.26 -4.87 117.16 109.46 1kli n TYR 179 Ca 0.13 -0.67 -0.11 0.00 -0.16 0.00 0.00 57.90 57.09 1kli n TYR 179 Cb 0.10 -0.29 -0.07 0.00 -0.31 0.00 0.00 39.34 38.77 1kli n TYR 179 CO 0.00 0.00 0.00 -1.64 -0.46 0.00 0.00 176.86 174.76 1kli s MET 180 N -2.12 1.49 0.07 -0.72 -1.94 -0.95 -1.07 119.30 114.06 1kli s MET 180 Ca 0.48 -1.46 -0.23 0.00 -1.71 0.00 0.00 55.69 52.78 1kli s MET 180 Cb 0.33 0.40 0.06 0.00 2.01 0.00 0.00 34.83 37.63 1kli s MET 180 CO 0.20 -0.58 0.55 -0.59 -0.01 0.00 0.00 175.02 174.58 1kli s PHE 181 N -3.92 -0.46 0.18 -0.03 -0.12 0.06 -4.65 117.98 109.04 1kli s PHE 181 Ca 0.29 0.47 -0.03 0.00 -0.05 0.00 0.00 56.93 57.61 1kli s PHE 181 Cb 0.02 0.39 -0.05 0.00 -0.63 0.00 0.00 43.02 42.75 1kli s PHE 181 CO 0.12 -0.69 0.40 0.00 -0.05 0.00 0.00 175.22 175.00 1kli s ALA 183 N -1.80 -1.80 0.00 0.00 0.00 -0.67 -1.94 121.76 115.55 1kli s ALA 183 Ca 0.40 1.79 0.00 0.00 0.00 0.00 0.00 51.96 54.16 1kli s ALA 183 Cb -0.11 -0.84 0.00 0.00 0.00 0.00 0.00 23.12 22.17 1kli s ALA 183 CO 0.27 -0.34 0.00 0.41 0.00 0.00 0.00 175.76 176.10 1kli n GLY 184 N 2.06 0.45 3.15 0.00 0.00 -0.59 -1.89 105.19 108.36 1kli n GLY 184 Ca -0.15 -1.88 -0.13 0.00 0.00 0.00 0.00 46.02 43.86 1kli n GLY 184 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1kli s TYR 184 N -1.55 0.92 -2.04 1.61 1.51 -1.25 -4.44 117.35 112.11 1kli s TYR 184 Ca 0.00 -0.71 0.18 0.00 -1.01 0.00 0.00 57.07 55.53 1kli s TYR 184 Cb 0.00 -0.52 0.26 0.00 -0.11 0.00 0.00 41.96 41.59 1kli s TYR 184 CO 0.00 -0.07 1.19 -1.13 -1.11 0.00 0.00 175.55 174.43 1kli n SER 185 N 0.57 2.84 -0.36 2.29 3.41 -1.25 -4.34 113.62 116.78 1kli n SER 185 Ca -0.16 -1.84 0.09 0.00 -0.26 0.00 0.00 58.87 56.70 1kli n SER 185 Cb 0.58 -0.12 0.40 0.00 -0.26 0.00 0.00 64.21 64.81 1kli n SER 185 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 1kli n ASP 186 N 1.07 1.07 -3.04 4.04 5.75 -1.26 0.79 116.55 124.97 1kli n ASP 186 Ca 0.13 -1.65 -0.17 0.00 -0.01 0.00 0.00 54.79 53.10 1kli n ASP 186 Cb 0.48 -0.08 0.07 0.00 -1.03 0.00 0.00 41.12 40.57 1kli n ASP 186 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1kli n GLY 187 N 0.99 -0.26 0.16 6.12 0.00 -1.26 -4.77 105.19 106.17 1kli n GLY 187 Ca 0.14 0.05 -0.00 0.00 0.00 0.00 0.00 46.02 46.21 1kli n GLY 187 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1kli n SER 188 N -2.49 3.36 -3.99 1.61 3.41 -1.26 -4.85 113.62 109.41 1kli n SER 188 Ca -0.11 -0.00 -0.20 0.00 -0.26 0.00 0.00 58.87 58.30 1kli n SER 188 Cb 0.59 -0.00 -0.15 0.00 -0.26 0.00 0.00 64.21 64.39 1kli n SER 188 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 1kli s LYS 188 N -2.00 0.89 -0.16 4.33 1.02 -1.26 -3.60 119.74 118.97 1kli s LYS 188 Ca -0.00 -0.28 -0.35 0.00 0.02 0.00 0.00 55.97 55.36 1kli s LYS 188 Cb 0.00 -0.84 0.15 0.00 -0.52 0.00 0.00 37.83 36.62 1kli s LYS 188 CO 0.00 0.11 1.40 0.34 -0.92 0.00 0.00 175.35 176.28 1kli s ASP 189 N 0.19 -0.02 0.69 2.83 2.15 -0.75 -3.81 116.67 117.95 1kli s ASP 189 Ca -0.03 -0.02 -0.05 0.00 0.43 0.00 0.00 52.55 52.88 1kli s ASP 189 Cb -0.08 0.03 0.06 0.00 -0.30 0.00 0.00 42.92 42.63 1kli s ASP 189 CO 0.00 -0.05 0.98 -0.94 -0.17 0.00 0.00 175.17 175.00 1kli s SER 190 N -2.64 4.84 0.35 -0.34 1.04 -1.26 -0.54 113.70 115.15 1kli s SER 190 Ca 0.14 0.36 -0.04 0.00 0.48 0.00 0.00 55.95 56.89 1kli s SER 190 Cb 0.04 -1.03 0.02 0.00 0.10 0.00 0.00 66.02 65.15 1kli s SER 190 CO -0.05 -1.56 0.52 0.00 0.98 0.00 0.00 173.24 173.13 1kli n LYS 192 N -0.56 2.03 0.00 0.00 5.02 -1.26 -1.31 118.16 122.08 1kli n LYS 192 Ca -0.01 0.71 0.00 0.00 -2.02 0.00 0.00 58.31 57.00 1kli n LYS 192 Cb 0.58 -2.28 0.00 0.00 -0.02 0.00 0.00 35.03 33.31 1kli n LYS 192 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1kli n GLY 193 N 0.95 3.36 0.04 0.72 0.00 -1.26 -1.02 105.19 107.98 1kli n GLY 193 Ca 0.06 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.19 1kli n GLY 193 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1kli n ASP 194 N 0.01 0.63 -4.56 1.61 8.00 -0.42 -3.92 116.55 117.90 1kli n ASP 194 Ca 0.00 -0.16 -0.50 0.00 0.71 0.00 0.00 54.79 54.83 1kli n ASP 194 Cb 0.00 0.61 -0.05 0.00 -0.02 0.00 0.00 41.12 41.66 1kli n ASP 194 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 1kli n SER 195 N -1.94 1.04 0.00 -2.24 7.64 -1.25 -1.17 113.62 115.70 1kli n SER 195 Ca 0.03 1.14 0.00 0.00 1.01 0.00 0.00 58.87 61.05 1kli n SER 195 Cb 0.42 -1.16 0.00 0.00 -1.01 0.00 0.00 64.21 62.46 1kli n SER 195 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1kli n GLY 196 N 2.01 1.82 3.71 0.23 0.00 0.08 -0.60 105.19 112.44 1kli n GLY 196 Ca 0.16 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.89 1kli n GLY 196 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1kli s GLY 197 N -2.12 1.59 0.41 -0.02 0.00 -0.31 -3.16 107.32 103.72 1kli s GLY 197 Ca 0.00 -0.24 -0.22 0.00 0.00 0.00 0.00 44.72 44.26 1kli s GLY 197 CO 0.00 0.30 0.95 2.56 0.00 0.00 0.00 173.10 176.91 1kli s PRO 198 N -4.99 4.27 -0.33 2.90 0.04 -1.26 -1.67 135.00 133.96 1kli s PRO 198 Ca 0.64 1.16 0.02 0.00 0.04 0.00 0.00 61.00 62.86 1kli s PRO 198 Cb -0.18 -2.27 0.10 0.00 0.04 0.00 0.00 34.50 32.19 1kli s PRO 198 CO 0.57 0.01 0.07 -1.58 0.04 0.00 0.00 177.00 176.10 1kli s HIS 199 N -2.09 3.04 -0.16 0.56 2.46 -0.75 -3.29 115.29 115.07 1kli s HIS 199 Ca 0.60 -2.57 -0.07 0.00 0.47 0.00 0.00 55.06 53.50 1kli s HIS 199 Cb -0.11 -2.50 -0.04 0.00 -0.13 0.00 0.00 32.58 29.80 1kli s HIS 199 CO 0.15 -0.92 0.07 0.00 -2.47 0.00 0.00 174.74 171.56 1kli s ALA 200 N 1.14 3.48 -0.12 1.58 0.00 0.28 -1.58 121.76 126.54 1kli s ALA 200 Ca 0.11 -0.73 0.01 0.00 0.00 0.00 0.00 51.96 51.35 1kli s ALA 200 Cb -0.18 -1.89 -0.01 0.00 0.00 0.00 0.00 23.12 21.04 1kli s ALA 200 CO -0.14 0.30 -0.17 0.99 0.00 0.00 0.00 175.76 176.74 1kli s THR 201 N -0.01 2.70 -0.05 0.00 2.01 0.25 -0.85 115.64 119.71 1kli s THR 201 Ca 0.06 -0.79 -0.15 0.00 0.31 0.00 0.00 61.69 61.12 1kli s THR 201 Cb -0.12 -2.11 -0.05 0.00 0.01 0.00 0.00 72.50 70.23 1kli s THR 201 CO 0.01 0.54 0.41 -2.28 -0.69 0.00 0.00 174.62 172.61 1kli s HIS 202 N 0.37 3.65 -0.18 4.92 2.46 -1.26 -0.41 115.29 124.84 1kli s HIS 202 Ca -0.13 0.93 -0.05 0.00 0.47 0.00 0.00 55.06 56.27 1kli s HIS 202 Cb -0.17 -2.36 0.09 0.00 -0.13 0.00 0.00 32.58 30.01 1kli s HIS 202 CO 0.07 0.48 0.33 -0.47 -2.47 0.00 0.00 174.74 172.68 1kli s TYR 203 N -0.49 -0.61 -1.41 3.88 5.04 0.19 -4.94 117.35 119.01 1kli s TYR 203 Ca 0.23 1.09 -0.02 0.00 -2.44 0.00 0.00 57.07 55.94 1kli s TYR 203 Cb -0.16 0.07 0.01 0.00 0.35 0.00 0.00 41.96 42.23 1kli s TYR 203 CO 0.12 -0.47 0.52 0.54 -1.34 0.00 0.00 175.55 174.91 1kli n ARG 204 N 5.37 -3.73 -0.85 4.97 1.74 -1.26 -2.43 116.66 120.47 1kli n ARG 204 Ca -0.07 0.46 0.00 0.00 -0.77 0.00 0.00 57.85 57.47 1kli n ARG 204 Cb 0.50 -4.74 0.00 0.00 -1.02 0.00 0.00 32.46 27.20 1kli n ARG 204 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1kli n GLY 205 N -1.85 0.70 3.02 -0.13 0.00 -1.26 -5.04 105.19 100.63 1kli n GLY 205 Ca -0.28 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.60 1kli n GLY 205 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1kli s THR 206 N -2.62 0.53 -0.10 2.61 2.01 -1.02 -5.15 115.64 111.90 1kli s THR 206 Ca 0.00 -0.67 -0.04 0.00 0.31 0.00 0.00 61.69 61.29 1kli s THR 206 Cb 0.00 -0.52 -0.04 0.00 0.01 0.00 0.00 72.50 71.95 1kli s THR 206 CO 0.00 -0.11 0.06 0.26 -0.69 0.00 0.00 174.62 174.14 1kli s TRP 207 N -0.75 3.34 0.10 4.92 0.52 -1.26 -0.64 118.94 125.17 1kli s TRP 207 Ca -0.03 0.33 0.06 0.00 0.02 0.00 0.00 56.10 56.47 1kli s TRP 207 Cb -0.06 -1.85 -0.03 0.00 -1.15 0.00 0.00 33.47 30.38 1kli s TRP 207 CO 0.00 0.58 -0.14 0.71 0.02 0.00 0.00 176.95 178.12 1kli s TYR 208 N -0.95 1.33 -0.28 -1.98 1.51 0.45 -2.91 117.35 114.52 1kli s TYR 208 Ca 0.14 -0.51 -0.27 0.00 -1.01 0.00 0.00 57.07 55.43 1kli s TYR 208 Cb -0.12 -0.72 0.01 0.00 -0.11 0.00 0.00 41.96 41.02 1kli s TYR 208 CO 0.03 0.10 0.94 -1.17 -1.11 0.00 0.00 175.55 174.35 1kli s LEU 209 N -2.12 4.04 -0.02 -1.29 2.96 -0.34 -0.58 118.68 121.34 1kli s LEU 209 Ca 0.04 1.01 0.04 0.00 -0.22 0.00 0.00 54.13 55.00 1kli s LEU 209 Cb -0.07 -3.34 -0.06 0.00 0.50 0.00 0.00 46.19 43.22 1kli s LEU 209 CO 0.03 -0.69 0.06 0.35 -1.32 0.00 0.00 176.35 174.78 1kli n THR 210 N 5.53 0.12 -4.02 3.68 -2.24 -0.62 -4.55 114.28 112.19 1kli n THR 210 Ca 0.08 -0.13 -0.10 0.00 -2.27 0.00 0.00 64.05 61.63 1kli n THR 210 Cb 0.47 -0.13 -0.06 0.00 -2.10 0.00 0.00 70.33 68.51 1kli n THR 210 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1kli s GLY 211 N -2.93 0.64 -0.07 3.38 0.00 -0.93 -2.39 107.32 105.02 1kli s GLY 211 Ca -0.02 -0.98 0.02 0.00 0.00 0.00 0.00 44.72 43.74 1kli s GLY 211 CO 0.18 -0.74 -0.11 -0.42 0.00 0.00 0.00 173.10 172.01 1kli s ILE 212 N -4.03 1.06 -0.11 0.90 1.01 -1.10 -1.80 121.20 117.13 1kli s ILE 212 Ca 0.24 -0.42 -0.32 0.00 0.00 0.00 0.00 60.65 60.14 1kli s ILE 212 Cb 0.01 -0.99 -0.10 0.00 0.01 0.00 0.00 42.46 41.39 1kli s ILE 212 CO 0.08 0.34 2.00 0.52 0.00 0.00 0.00 174.94 177.89 1kli n VAL 213 N 3.94 0.55 0.00 2.92 0.31 -0.67 -1.35 118.33 124.02 1kli n VAL 213 Ca -0.22 -0.20 -0.00 0.00 -0.01 0.00 0.00 64.34 63.91 1kli n VAL 213 Cb 0.51 -2.09 -0.00 0.00 -0.91 0.00 0.00 33.84 31.35 1kli n VAL 213 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 1kli n SER 214 N 8.16 0.14 -1.90 4.52 2.88 -1.04 -0.74 113.62 125.64 1kli n SER 214 Ca 0.25 0.02 -0.05 0.00 -1.33 0.00 0.00 58.87 57.76 1kli n SER 214 Cb 0.34 -0.16 0.00 0.00 -0.75 0.00 0.00 64.21 63.65 1kli n SER 214 CO 0.00 0.00 0.00 -2.67 -1.23 0.00 0.00 175.04 171.14 1kli n TRP 215 N -2.63 -1.43 0.00 0.66 4.27 -0.85 -4.91 117.44 112.55 1kli n TRP 215 Ca -0.00 -0.98 0.00 0.00 -3.89 0.00 0.00 57.50 52.63 1kli n TRP 215 Cb 0.01 0.39 0.00 0.00 -1.36 0.00 0.00 31.31 30.36 1kli n TRP 215 CO 0.00 0.00 0.00 0.41 -2.29 0.00 0.00 177.69 175.81 1kli n GLY 216 N -0.27 2.92 3.58 -1.67 0.00 -1.26 -0.15 105.19 108.34 1kli n GLY 216 Ca -0.03 -0.64 -0.41 0.00 0.00 0.00 0.00 46.02 44.94 1kli n GLY 216 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1kli s GLN 217 N -2.00 2.86 4.76 1.61 -1.52 -1.26 -4.73 119.66 119.38 1kli s GLN 217 Ca 0.00 1.53 0.00 0.00 -1.95 0.00 0.00 55.36 54.94 1kli s GLN 217 Cb 0.00 -4.38 0.00 0.00 -0.22 0.00 0.00 33.01 28.41 1kli s GLN 217 CO 0.00 -2.42 0.00 0.41 -0.25 0.00 0.00 175.29 173.03 1kli n GLY 219 N 5.73 2.76 2.81 3.09 0.00 -1.26 -4.19 105.19 114.13 1kli n GLY 219 Ca 0.28 -0.26 -0.17 0.00 0.00 0.00 0.00 46.02 45.88 1kli n GLY 219 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1kli n ALA 221 N 5.27 -1.70 -2.69 0.00 0.00 -1.26 -4.49 120.51 115.63 1kli n ALA 221 Ca -0.05 0.08 -0.40 0.00 0.00 0.00 0.00 53.44 53.06 1kli n ALA 221 Cb 0.50 -3.47 -0.05 0.00 0.00 0.00 0.00 19.45 16.43 1kli n ALA 221 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1kli s THR 221 N -3.42 5.00 0.22 0.00 2.01 -1.26 -4.13 115.64 114.05 1kli s THR 221 Ca 0.27 1.45 -0.32 0.00 0.31 0.00 0.00 61.69 63.41 1kli s THR 221 Cb -0.13 -4.05 -0.14 0.00 0.01 0.00 0.00 72.50 68.19 1kli s THR 221 CO 0.77 0.16 1.28 0.52 -0.69 0.00 0.00 174.62 176.67 1kli n VAL 222 N 4.20 1.00 -1.05 3.82 0.31 -1.26 -1.37 118.33 123.99 1kli n VAL 222 Ca 0.00 -0.25 -0.02 0.00 -0.01 0.00 0.00 64.34 64.07 1kli n VAL 222 Cb 0.50 -1.19 -0.01 0.00 -0.91 0.00 0.00 33.84 32.23 1kli n VAL 222 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1kli n GLY 223 N 2.02 0.52 2.99 2.92 0.00 0.24 -4.92 105.19 108.96 1kli n GLY 223 Ca 0.13 -0.72 -0.09 0.00 0.00 0.00 0.00 46.02 45.33 1kli n GLY 223 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1kli s HIS 224 N -2.03 0.27 0.21 1.61 4.02 -0.47 -1.78 115.29 117.12 1kli s HIS 224 Ca 0.00 -0.56 0.11 0.00 1.02 0.00 0.00 55.06 55.63 1kli s HIS 224 Cb 0.00 -0.20 -0.05 0.00 -1.02 0.00 0.00 32.58 31.31 1kli s HIS 224 CO 0.00 -0.20 -0.23 -0.06 1.02 0.00 0.00 174.74 175.27 1kli s PHE 225 N -1.61 2.25 0.44 1.40 0.08 -1.26 -3.94 117.98 115.33 1kli s PHE 225 Ca -0.15 -0.36 -0.23 0.00 0.12 0.00 0.00 56.93 56.31 1kli s PHE 225 Cb -0.09 -1.08 -0.08 0.00 -0.57 0.00 0.00 43.02 41.19 1kli s PHE 225 CO -0.02 0.53 1.07 0.20 -0.10 0.00 0.00 175.22 176.91 1kli s GLY 226 N -2.85 2.68 -0.12 4.36 0.00 -0.79 -4.60 107.32 105.99 1kli s GLY 226 Ca 0.22 0.72 -0.01 0.00 0.00 0.00 0.00 44.72 45.65 1kli s GLY 226 CO 0.11 1.12 -0.08 0.14 0.00 0.00 0.00 173.10 174.39 1kli s VAL 227 N -1.73 3.58 0.10 1.40 1.01 0.78 -1.67 120.40 123.87 1kli s VAL 227 Ca 0.62 -0.49 0.08 0.00 0.00 0.00 0.00 61.98 62.19 1kli s VAL 227 Cb -0.22 -2.51 -0.03 0.00 0.00 0.00 0.00 36.38 33.62 1kli s VAL 227 CO 0.27 0.54 -0.20 -0.31 0.00 0.00 0.00 175.10 175.39 1kli s TYR 228 N -0.05 1.74 0.09 5.22 1.51 0.07 -2.01 117.35 123.92 1kli s TYR 228 Ca -0.00 -0.42 -0.31 0.00 -1.01 0.00 0.00 57.07 55.33 1kli s TYR 228 Cb -0.13 -0.96 -0.07 0.00 -0.11 0.00 0.00 41.96 40.69 1kli s TYR 228 CO 0.03 0.19 1.25 0.99 -1.11 0.00 0.00 175.55 176.90 1kli s THR 229 N -1.16 3.78 -1.00 -0.71 2.01 -0.46 -0.76 115.64 117.34 1kli s THR 229 Ca 0.06 1.31 -0.23 0.00 0.31 0.00 0.00 61.69 63.13 1kli s THR 229 Cb -0.10 -3.84 0.05 0.00 0.01 0.00 0.00 72.50 68.63 1kli s THR 229 CO 0.04 0.12 1.42 -0.60 -0.69 0.00 0.00 174.62 174.90 1kli s ARG 230 N 0.88 3.57 0.52 4.92 3.52 -0.23 -2.72 118.95 129.41 1kli s ARG 230 Ca 0.59 -1.11 0.26 0.00 -0.13 0.00 0.00 55.73 55.34 1kli s ARG 230 Cb -0.32 -5.26 1.38 0.00 -1.56 0.00 0.00 34.95 29.19 1kli s ARG 230 CO 0.31 -2.18 1.96 0.28 -0.81 0.00 0.00 175.30 174.86 1kli h VAL 231 N 6.69 0.69 -0.44 7.11 2.07 -1.79 -2.29 116.25 128.29 1kli h VAL 231 Ca 0.17 -0.02 0.13 0.00 0.82 0.00 0.00 66.70 67.80 1kli h VAL 231 Cb 1.01 0.64 -0.02 0.00 -1.52 0.00 0.00 31.29 31.41 1kli h VAL 231 CO 1.40 0.01 0.32 0.77 0.02 0.00 0.00 177.57 180.09 1kli h SER 232 N 0.05 0.00 0.93 0.57 4.64 -1.89 0.04 113.55 117.89 1kli h SER 232 Ca 0.31 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.63 1kli h SER 232 Cb 1.18 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.27 1kli h SER 232 CO -0.02 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.94 1kli n GLN 233 N -4.39 0.20 -0.07 4.77 1.13 -0.86 -3.40 117.38 114.75 1kli n GLN 233 Ca 0.08 0.35 0.04 0.00 -1.94 0.00 0.00 57.00 55.52 1kli n GLN 233 Cb 0.52 -1.83 0.08 0.00 0.11 0.00 0.00 30.24 29.12 1kli n GLN 233 CO 0.00 0.00 0.00 0.66 -1.44 0.00 0.00 177.06 176.28 1kli n TYR 234 N -2.19 0.19 0.02 1.08 4.01 -0.01 -4.77 117.16 115.49 1kli n TYR 234 Ca 0.03 -0.30 -0.11 0.00 -0.16 0.00 0.00 57.90 57.37 1kli n TYR 234 Cb 0.29 -0.02 -0.04 0.00 -0.31 0.00 0.00 39.34 39.26 1kli n TYR 234 CO 0.00 0.00 0.00 0.82 -0.46 0.00 0.00 176.86 177.22 1kli h ILE 235 N 1.43 0.38 -0.76 -0.72 1.08 -1.55 0.20 117.51 117.58 1kli h ILE 235 Ca 0.00 0.00 -0.04 0.00 -0.39 0.00 0.00 64.86 64.43 1kli h ILE 235 Cb 0.52 0.38 -0.03 0.00 -3.07 0.00 0.00 36.82 34.62 1kli h ILE 235 CO 0.00 0.00 0.32 -0.33 -0.69 0.00 0.00 178.15 177.45 1kli h GLU 236 N -0.36 1.12 -0.17 2.37 3.07 -1.86 -0.21 114.58 118.54 1kli h GLU 236 Ca 0.09 -0.19 0.02 0.00 -0.50 0.00 0.00 59.36 58.77 1kli h GLU 236 Cb 0.49 -0.19 -0.02 0.00 -0.84 0.00 0.00 28.75 28.19 1kli h GLU 236 CO -0.29 0.91 0.06 2.35 -1.40 0.00 0.00 179.01 180.64 1kli h TRP 237 N 1.09 0.11 -0.24 4.33 7.01 -1.71 -1.23 115.95 125.31 1kli h TRP 237 Ca 0.25 0.01 -0.01 0.00 2.11 0.00 0.00 58.89 61.25 1kli h TRP 237 Cb 0.19 -0.02 -0.01 0.00 -2.10 0.00 0.00 29.16 27.21 1kli h TRP 237 CO 0.02 0.06 0.10 -0.07 -2.79 0.00 0.00 178.44 175.75 1kli h LEU 238 N 0.15 0.33 -0.87 0.65 3.38 -0.30 -2.61 115.31 116.03 1kli h LEU 238 Ca 0.07 -0.17 0.00 0.00 0.09 0.00 0.00 57.88 57.88 1kli h LEU 238 Cb 0.04 -0.09 -0.04 0.00 0.09 0.00 0.00 40.66 40.66 1kli h LEU 238 CO -0.07 0.41 0.56 1.56 0.09 0.00 0.00 178.44 180.98 1kli h GLN 239 N 0.23 1.15 -0.51 1.13 1.08 -0.87 -1.19 115.11 116.14 1kli h GLN 239 Ca 0.08 -0.08 -0.04 0.00 -1.45 0.00 0.00 58.65 57.16 1kli h GLN 239 Cb 0.18 -0.25 -0.02 0.00 -0.05 0.00 0.00 27.48 27.33 1kli h GLN 239 CO -0.01 0.78 0.17 -0.22 -0.95 0.00 0.00 178.83 178.61 1kli h LYS 240 N 1.18 0.78 -0.44 1.46 3.64 -1.16 -2.81 116.57 119.23 1kli h LYS 240 Ca 0.32 -0.16 -0.07 0.00 -1.27 0.00 0.00 60.65 59.46 1kli h LYS 240 Cb -0.11 -0.12 -0.02 0.00 -0.41 0.00 0.00 32.23 31.58 1kli h LYS 240 CO -0.07 0.72 -0.02 -0.07 -2.27 0.00 0.00 179.45 177.74 1kli h LEU 241 N 0.69 0.70 -0.21 5.20 3.38 -1.07 -2.32 115.31 121.68 1kli h LEU 241 Ca 0.17 -0.17 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1kli h LEU 241 Cb 0.25 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 40.81 1kli h LEU 241 CO -0.01 0.78 0.00 0.23 0.09 0.00 0.00 178.44 179.53 1kli n MET 242 N -4.22 0.06 0.00 1.13 2.81 -0.48 -1.56 117.12 114.85 1kli n MET 242 Ca 0.02 0.30 0.12 0.00 -1.81 0.00 0.00 57.70 56.33 1kli n MET 242 Cb 0.30 -1.61 0.10 0.00 -0.71 0.00 0.00 33.22 31.30 1kli n MET 242 CO 0.00 0.00 0.00 0.54 1.51 0.00 0.00 175.97 178.02 1kli n ARG 243 N -1.72 2.31 -3.43 0.03 1.74 -0.88 -4.97 116.66 109.74 1kli n ARG 243 Ca 0.03 -1.91 -0.26 0.00 -0.77 0.00 0.00 57.85 54.94 1kli n ARG 243 Cb 0.19 -1.46 -0.02 0.00 -1.02 0.00 0.00 32.46 30.15 1kli n ARG 243 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 1kli s SER 244 N -2.01 6.35 0.36 0.55 1.04 -0.60 -5.09 113.70 114.30 1kli s SER 244 Ca 0.28 0.51 -0.23 0.00 0.48 0.00 0.00 55.95 56.99 1kli s SER 244 Cb 0.20 -2.06 -0.10 0.00 0.10 0.00 0.00 66.02 64.16 1kli s SER 244 CO 0.30 -0.22 0.92 -1.61 0.98 0.00 0.00 173.24 173.62 1kli s GLU 245 N -3.92 4.41 0.69 4.02 0.41 -1.26 -5.03 118.70 118.02 1kli s GLU 245 Ca 0.41 1.20 -0.16 0.00 -0.41 0.00 0.00 54.97 56.00 1kli s GLU 245 Cb -0.10 -2.56 0.02 0.00 -1.78 0.00 0.00 34.13 29.71 1kli s GLU 245 CO 0.33 0.17 1.21 -2.14 -0.49 0.00 0.00 175.26 174.34 1kli s PRO 246 N -2.50 2.37 0.08 0.39 0.02 -1.26 -5.05 135.00 129.05 1kli s PRO 246 Ca 0.54 1.77 0.06 0.00 0.02 0.00 0.00 61.00 63.39 1kli s PRO 246 Cb -0.15 -1.86 -0.03 0.00 0.02 0.00 0.00 34.50 32.48 1kli s PRO 246 CO 0.19 -1.66 -0.15 1.03 -0.33 0.00 0.00 177.00 176.08 1kli s ARG 247 N -3.77 0.87 0.43 5.54 0.52 -1.26 -5.12 118.95 116.16 1kli s ARG 247 Ca 0.75 -0.99 -0.24 0.00 -0.52 0.00 0.00 55.73 54.73 1kli s ARG 247 Cb -0.30 -0.92 -0.10 0.00 0.52 0.00 0.00 34.95 34.15 1kli s ARG 247 CO 0.42 0.21 1.00 -2.30 0.02 0.00 0.00 175.30 174.65 1kli n PRO 248 N 1.24 1.31 -0.21 3.54 -0.02 -1.26 -4.69 135.00 134.91 1kli n PRO 248 Ca -0.21 0.47 0.00 0.00 -2.02 0.00 0.00 63.50 61.74 1kli n PRO 248 Cb 0.54 -2.04 0.00 0.00 -0.02 0.00 0.00 33.50 31.98 1kli n PRO 248 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1kli n GLY 249 N 1.20 -1.66 0.40 -1.23 0.00 -1.26 -4.93 105.19 97.71 1kli n GLY 249 Ca 0.10 -1.00 -0.17 0.00 0.00 0.00 0.00 46.02 44.94 1kli n GLY 249 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1kli h VAL 250 N 0.00 0.24 -3.16 1.61 2.07 -1.84 -3.42 116.25 111.76 1kli h VAL 250 Ca 0.00 0.00 -0.53 0.00 0.82 0.00 0.00 66.70 66.99 1kli h VAL 250 Cb 0.00 0.24 0.03 0.00 -1.52 0.00 0.00 31.29 30.04 1kli h VAL 250 CO 0.00 0.00 0.71 -0.22 0.02 0.00 0.00 177.57 178.08 1kli s LEU 251 N -10.12 4.39 -0.05 2.57 2.96 -1.26 -1.17 118.68 116.00 1kli s LEU 251 Ca -0.17 2.38 -0.02 0.00 -0.22 0.00 0.00 54.13 56.09 1kli s LEU 251 Cb 0.04 -3.60 0.04 0.00 0.50 0.00 0.00 46.19 43.17 1kli s LEU 251 CO 0.62 -0.62 0.09 -0.22 -1.32 0.00 0.00 176.35 174.91 1kli s LEU 252 N 0.58 0.18 -0.22 -0.68 2.96 -0.05 -4.92 118.68 116.53 1kli s LEU 252 Ca 0.62 0.16 -0.14 0.00 -0.22 0.00 0.00 54.13 54.55 1kli s LEU 252 Cb -0.37 0.01 -0.04 0.00 0.50 0.00 0.00 46.19 46.28 1kli s LEU 252 CO 0.34 -0.23 0.31 -0.13 -1.32 0.00 0.00 176.35 175.32 1kli s ARG 253 N 2.08 4.12 -0.07 1.98 0.52 -1.26 -1.24 118.95 125.08 1kli s ARG 253 Ca 0.03 0.02 0.03 0.00 -0.52 0.00 0.00 55.73 55.29 1kli s ARG 253 Cb -0.12 -3.55 -0.02 0.00 0.52 0.00 0.00 34.95 31.78 1kli s ARG 253 CO -0.04 -0.03 -0.14 0.00 0.02 0.00 0.00 175.30 175.12 1kli s ALA 254 N 1.29 2.66 0.44 2.13 0.00 -0.41 -4.87 121.76 122.99 1kli s ALA 254 Ca 0.15 -0.96 -0.25 0.00 0.00 0.00 0.00 51.96 50.90 1kli s ALA 254 Cb -0.14 -1.02 -0.09 0.00 0.00 0.00 0.00 23.12 21.86 1kli s ALA 254 CO 0.07 0.49 1.18 -2.30 0.00 0.00 0.00 175.76 175.20 1kli n PRO 255 N 2.55 1.67 -3.90 0.00 -0.02 -1.26 -0.42 135.00 133.62 1kli n PRO 255 Ca -0.17 0.60 -0.15 0.00 -2.02 0.00 0.00 63.50 61.75 1kli n PRO 255 Cb 0.52 -2.27 -0.16 0.00 -0.02 0.00 0.00 33.50 31.58 1kli n PRO 255 CO 0.00 0.00 0.00 0.12 1.98 0.00 0.00 175.50 177.60 1kli s PHE 256 N -1.24 0.20 -1.67 6.00 5.36 -1.26 -4.73 117.98 120.64 1kli s PHE 256 Ca 0.63 0.02 0.00 0.00 -0.96 0.00 0.00 56.93 56.62 1kli s PHE 256 Cb -0.52 -0.28 0.00 0.00 -0.34 0.00 0.00 43.02 41.88 1kli s PHE 256 CO 0.57 -0.08 0.42 -2.30 -1.46 0.00 0.00 175.22 172.36