#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1k3t n PRO 2 N 0.00 2.02 -1.84 0.03 -0.04 -1.26 -4.87 135.00 129.04 1k3t n PRO 2 Ca 0.00 0.00 -0.42 0.00 -0.04 0.00 0.00 63.50 63.04 1k3t n PRO 2 Cb 0.00 0.00 -0.03 0.00 -0.04 0.00 0.00 33.50 33.43 1k3t n PRO 2 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 1k3t s ILE 3 N 0.00 2.38 -0.58 0.52 1.01 -1.04 -4.75 121.20 118.74 1k3t s ILE 3 Ca 0.00 0.25 -0.18 0.00 0.00 0.00 0.00 60.65 60.71 1k3t s ILE 3 Cb 0.00 -3.16 0.11 0.00 0.01 0.00 0.00 42.46 39.42 1k3t s ILE 3 CO 0.00 0.02 0.65 -0.54 0.00 0.00 0.00 174.94 175.07 1k3t s LYS 4 N 1.30 3.03 0.01 2.79 -0.14 -1.26 -0.11 119.74 125.36 1k3t s LYS 4 Ca 0.73 -1.40 0.02 0.00 -1.36 0.00 0.00 55.97 53.96 1k3t s LYS 4 Cb -0.46 -4.27 -0.04 0.00 -1.68 0.00 0.00 37.83 31.38 1k3t s LYS 4 CO 0.32 -1.48 0.01 0.08 -0.76 0.00 0.00 175.35 173.52 1k3t s VAL 5 N 2.43 4.20 -0.02 3.17 1.01 0.25 -1.22 120.40 130.22 1k3t s VAL 5 Ca 0.10 -0.64 0.06 0.00 0.00 0.00 0.00 61.98 61.49 1k3t s VAL 5 Cb -0.25 -2.90 -0.01 0.00 0.00 0.00 0.00 36.38 33.21 1k3t s VAL 5 CO 0.06 0.33 -0.19 -0.83 0.00 0.00 0.00 175.10 174.46 1k3t s GLY 6 N -1.71 0.96 -0.23 4.51 0.00 -0.18 -0.29 107.32 110.38 1k3t s GLY 6 Ca 0.21 -0.81 -0.04 0.00 0.00 0.00 0.00 44.72 44.08 1k3t s GLY 6 CO 0.12 -0.61 -0.02 -0.42 0.00 0.00 0.00 173.10 172.17 1k3t s ILE 7 N -0.32 3.53 -0.38 0.90 1.01 -0.52 -1.30 121.20 124.13 1k3t s ILE 7 Ca 0.04 -0.45 -0.15 0.00 0.00 0.00 0.00 60.65 60.09 1k3t s ILE 7 Cb -0.09 -2.62 0.00 0.00 0.01 0.00 0.00 42.46 39.77 1k3t s ILE 7 CO 0.00 0.40 0.34 0.21 0.00 0.00 0.00 174.94 175.90 1k3t s ASN 8 N 1.50 6.14 0.00 3.58 3.04 -0.43 -0.84 114.94 127.94 1k3t s ASN 8 Ca 0.06 -0.53 0.00 0.00 0.04 0.00 0.00 52.86 52.43 1k3t s ASN 8 Cb -0.14 -2.18 0.00 0.00 -1.54 0.00 0.00 41.25 37.38 1k3t s ASN 8 CO -0.02 -0.40 0.00 0.61 -3.04 0.00 0.00 177.10 174.25 1k3t n GLY 9 N 5.07 2.07 2.51 1.21 0.00 0.90 -0.21 105.19 116.75 1k3t n GLY 9 Ca -0.10 -1.22 -0.22 0.00 0.00 0.00 0.00 46.02 44.48 1k3t n GLY 9 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1k3t n PHE 10 N 2.12 2.79 -0.28 1.61 7.35 -1.06 -4.21 117.46 125.78 1k3t n PHE 10 Ca 0.00 -2.99 0.00 0.00 -0.76 0.00 0.00 57.45 53.70 1k3t n PHE 10 Cb 0.00 -0.17 0.00 0.00 0.35 0.00 0.00 39.48 39.66 1k3t n PHE 10 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1k3t n GLY 11 N -0.38 1.24 0.22 7.13 0.00 -1.26 -4.62 105.19 107.52 1k3t n GLY 11 Ca 0.31 -1.60 -0.04 0.00 0.00 0.00 0.00 46.02 44.69 1k3t n GLY 11 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1k3t h ARG 12 N 0.00 0.43 0.24 1.61 2.43 -1.97 -1.94 114.38 115.19 1k3t h ARG 12 Ca 0.00 -0.20 -0.01 0.00 -0.81 0.00 0.00 59.98 58.96 1k3t h ARG 12 Cb 0.00 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 29.54 1k3t h ARG 12 CO 0.00 0.73 -0.12 0.82 -1.51 0.00 0.00 179.97 179.90 1k3t h ILE 13 N 0.37 0.81 -0.88 1.20 1.08 -1.92 0.13 117.51 118.30 1k3t h ILE 13 Ca 0.04 -0.66 -0.00 0.00 -0.39 0.00 0.00 64.86 63.85 1k3t h ILE 13 Cb 0.80 1.17 -0.04 0.00 -3.07 0.00 0.00 36.82 35.67 1k3t h ILE 13 CO 0.06 0.14 0.54 1.23 -0.69 0.00 0.00 178.15 179.43 1k3t h GLY 14 N -0.68 1.27 0.93 5.37 0.00 -1.72 -1.39 103.07 106.85 1k3t h GLY 14 Ca -0.03 -0.52 -0.01 0.00 0.00 0.00 0.00 47.33 46.77 1k3t h GLY 14 CO 0.06 0.50 0.11 -0.09 0.00 0.00 0.00 176.54 177.11 1k3t h ARG 15 N 1.21 0.29 -0.01 4.80 2.43 -1.14 -1.88 114.38 120.09 1k3t h ARG 15 Ca 0.32 -0.04 -0.12 0.00 -0.81 0.00 0.00 59.98 59.33 1k3t h ARG 15 Cb -0.06 -0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 29.41 1k3t h ARG 15 CO -0.06 0.30 -0.55 0.52 -1.51 0.00 0.00 179.97 178.67 1k3t h MET 16 N 0.21 0.03 -0.47 0.20 2.86 -0.45 -2.15 114.93 115.17 1k3t h MET 16 Ca 0.07 -0.02 -0.12 0.00 -2.06 0.00 0.00 59.70 57.57 1k3t h MET 16 Cb 0.10 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.74 1k3t h MET 16 CO -0.01 0.57 -0.18 0.28 1.06 0.00 0.00 176.91 178.63 1k3t h VAL 17 N 0.03 1.27 -0.24 -2.22 2.07 -1.02 -1.89 116.25 114.25 1k3t h VAL 17 Ca -0.00 -1.34 0.02 0.00 0.82 0.00 0.00 66.70 66.20 1k3t h VAL 17 Cb 0.97 1.15 -0.02 0.00 -1.52 0.00 0.00 31.29 31.87 1k3t h VAL 17 CO 0.07 0.46 0.10 0.15 0.02 0.00 0.00 177.57 178.37 1k3t h PHE 18 N 0.79 0.18 0.00 1.57 3.04 -1.17 -1.70 116.94 119.65 1k3t h PHE 18 Ca 0.11 0.01 -0.04 0.00 3.98 0.00 0.00 57.97 62.03 1k3t h PHE 18 Cb 0.75 -0.05 -0.01 0.00 2.56 0.00 0.00 35.95 39.21 1k3t h PHE 18 CO 0.05 0.09 -0.20 1.96 -2.02 0.00 0.00 178.31 178.19 1k3t h GLN 19 N 0.22 0.00 -0.21 1.11 4.20 -1.40 -1.53 115.11 117.50 1k3t h GLN 19 Ca 0.10 0.00 -0.18 0.00 0.06 0.00 0.00 58.65 58.63 1k3t h GLN 19 Cb 0.05 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 27.83 1k3t h GLN 19 CO -0.09 0.20 -0.60 0.00 -0.67 0.00 0.00 178.83 177.67 1k3t h ALA 20 N 1.80 0.54 -0.06 3.87 0.00 -1.00 -0.29 119.26 124.13 1k3t h ALA 20 Ca -0.00 -0.54 -0.15 0.00 0.00 0.00 0.00 54.91 54.22 1k3t h ALA 20 Cb 0.64 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 1k3t h ALA 20 CO 0.03 0.69 -0.63 1.37 0.00 0.00 0.00 179.25 180.71 1k3t h LEU 21 N 0.53 0.25 -0.62 0.00 8.10 -0.86 -1.21 115.31 121.50 1k3t h LEU 21 Ca -0.00 -0.15 -0.08 0.00 0.11 0.00 0.00 57.88 57.76 1k3t h LEU 21 Cb 1.18 -0.07 -0.02 0.00 -0.44 0.00 0.00 40.66 41.31 1k3t h LEU 21 CO 0.12 0.82 0.07 0.00 -4.11 0.00 0.00 178.44 175.33 1k3t h GLU 23 N 0.96 1.08 -0.39 0.00 4.81 -0.83 -0.52 114.58 119.69 1k3t h GLU 23 Ca 0.18 -0.06 0.00 0.00 -0.13 0.00 0.00 59.36 59.35 1k3t h GLU 23 Cb 0.48 -0.24 0.00 0.00 0.63 0.00 0.00 28.75 29.61 1k3t h GLU 23 CO 0.02 0.71 0.00 -0.25 -0.73 0.00 0.00 179.01 178.76 1k3t n ASP 24 N -4.42 1.28 -0.94 1.04 8.00 -0.48 -4.90 116.55 116.14 1k3t n ASP 24 Ca 0.10 -2.06 -0.09 0.00 0.71 0.00 0.00 54.79 53.44 1k3t n ASP 24 Cb 0.05 -0.24 -0.01 0.00 -0.02 0.00 0.00 41.12 40.89 1k3t n ASP 24 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1k3t n GLY 25 N 0.60 0.31 0.07 0.44 0.00 -0.20 -4.93 105.19 101.47 1k3t n GLY 25 Ca 0.06 -0.54 0.11 0.00 0.00 0.00 0.00 46.02 45.65 1k3t n GLY 25 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1k3t n LEU 26 N -1.23 0.51 -4.72 0.99 4.77 -0.99 -4.69 117.00 111.63 1k3t n LEU 26 Ca -0.10 0.20 -0.42 0.00 -0.03 0.00 0.00 56.01 55.65 1k3t n LEU 26 Cb 0.50 -0.03 -0.03 0.00 -2.33 0.00 0.00 43.42 41.54 1k3t n LEU 26 CO 0.13 -0.10 1.26 -0.22 -1.33 0.00 0.00 177.39 177.14 1k3t s LEU 27 N -5.04 4.37 0.00 2.23 2.96 -1.26 -1.13 118.68 120.81 1k3t s LEU 27 Ca -0.04 2.70 0.00 0.00 -0.22 0.00 0.00 54.13 56.57 1k3t s LEU 27 Cb 0.11 -3.60 0.00 0.00 0.50 0.00 0.00 46.19 43.20 1k3t s LEU 27 CO 0.84 -0.86 0.00 0.61 -1.32 0.00 0.00 176.35 175.62 1k3t n GLY 28 N 3.72 0.59 0.00 7.98 0.00 -0.99 -4.65 105.19 111.83 1k3t n GLY 28 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.16 1k3t n GLY 28 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1k3t n THR 29 N -2.00 0.00 0.00 2.61 5.66 -1.11 -4.84 114.28 114.60 1k3t n THR 29 Ca 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.00 1k3t n THR 29 Cb 0.00 -0.92 0.00 0.00 -1.55 0.00 0.00 70.33 67.86 1k3t n THR 29 CO 0.00 0.00 0.00 1.21 -3.05 0.00 0.00 175.07 173.23 1k3t n GLU 30 N -2.04 2.28 -4.44 1.09 2.13 -0.28 -4.90 120.64 114.48 1k3t n GLU 30 Ca 0.00 0.00 -0.21 0.00 0.66 0.00 0.00 57.16 57.61 1k3t n GLU 30 Cb 0.49 -0.87 -0.16 0.00 0.27 0.00 0.00 31.44 31.17 1k3t n GLU 30 CO 0.00 0.00 0.00 0.42 -0.41 0.00 0.00 177.13 177.14 1k3t s ILE 31 N -1.63 0.86 -0.29 6.31 -1.09 -0.31 -2.51 121.20 122.54 1k3t s ILE 31 Ca 0.00 -0.40 -0.07 0.00 -2.23 0.00 0.00 60.65 57.95 1k3t s ILE 31 Cb 0.00 -0.76 0.00 0.00 -1.58 0.00 0.00 42.46 40.12 1k3t s ILE 31 CO 0.00 0.27 0.08 -1.81 -1.23 0.00 0.00 174.94 172.25 1k3t s ASP 32 N 0.21 5.14 -0.66 3.58 -0.00 0.84 -2.35 116.67 123.43 1k3t s ASP 32 Ca -0.04 -0.62 -0.25 0.00 -0.00 0.00 0.00 52.55 51.64 1k3t s ASP 32 Cb -0.09 -1.89 0.05 0.00 -0.00 0.00 0.00 42.92 40.98 1k3t s ASP 32 CO 0.01 -0.17 1.10 -0.69 -0.00 0.00 0.00 175.17 175.42 1k3t s VAL 33 N 1.52 4.08 0.02 -1.27 1.01 -1.26 -0.58 120.40 123.92 1k3t s VAL 33 Ca 0.03 0.18 -0.27 0.00 0.00 0.00 0.00 61.98 61.93 1k3t s VAL 33 Cb -0.17 -4.75 -0.16 0.00 0.00 0.00 0.00 36.38 31.30 1k3t s VAL 33 CO 0.03 -1.53 1.22 0.58 0.00 0.00 0.00 175.10 175.40 1k3t h VAL 34 N 6.02 0.27 -4.24 2.92 2.07 -0.98 -3.43 116.25 118.88 1k3t h VAL 34 Ca -0.28 -0.35 -0.21 0.00 0.82 0.00 0.00 66.70 66.68 1k3t h VAL 34 Cb 1.06 0.37 -0.15 0.00 -1.52 0.00 0.00 31.29 31.05 1k3t h VAL 34 CO 1.20 0.04 -0.65 0.00 0.02 0.00 0.00 177.57 178.18 1k3t s ALA 35 N -5.07 0.99 -0.02 1.67 0.00 -1.25 -2.39 121.76 115.69 1k3t s ALA 35 Ca -0.15 -1.50 0.03 0.00 0.00 0.00 0.00 51.96 50.34 1k3t s ALA 35 Cb 0.02 0.77 -0.00 0.00 0.00 0.00 0.00 23.12 23.91 1k3t s ALA 35 CO 0.49 -0.44 -0.10 0.54 0.00 0.00 0.00 175.76 176.25 1k3t s VAL 36 N -3.94 0.85 -0.02 0.00 0.11 0.28 -1.43 120.40 116.24 1k3t s VAL 36 Ca 0.24 -0.42 0.07 0.00 -2.93 0.00 0.00 61.98 58.93 1k3t s VAL 36 Cb 0.07 -0.73 -0.02 0.00 -1.53 0.00 0.00 36.38 34.17 1k3t s VAL 36 CO 0.02 0.25 -0.22 0.54 -3.33 0.00 0.00 175.10 172.36 1k3t s VAL 37 N -0.00 2.39 0.22 2.04 0.11 -0.02 -0.05 120.40 125.10 1k3t s VAL 37 Ca -0.00 -1.03 -0.23 0.00 -2.93 0.00 0.00 61.98 57.79 1k3t s VAL 37 Cb -0.07 -1.88 0.04 0.00 -1.53 0.00 0.00 36.38 32.94 1k3t s VAL 37 CO 0.00 0.55 0.79 -0.62 -3.33 0.00 0.00 175.10 172.49 1k3t s ASP 38 N -0.76 -0.27 0.35 3.54 -1.08 -0.79 -0.07 116.67 117.60 1k3t s ASP 38 Ca 0.11 -0.47 0.23 0.00 -0.52 0.00 0.00 52.55 51.90 1k3t s ASP 38 Cb -0.10 0.63 0.21 0.00 -1.46 0.00 0.00 42.92 42.20 1k3t s ASP 38 CO 0.00 -1.15 1.40 -0.03 0.52 0.00 0.00 175.17 175.92 1k3t h MET 39 N 2.00 0.00 -6.70 4.34 1.85 -1.91 0.04 114.93 114.54 1k3t h MET 39 Ca -0.22 0.00 -0.50 0.00 -0.61 0.00 0.00 59.70 58.37 1k3t h MET 39 Cb 1.25 0.00 -0.03 0.00 0.43 0.00 0.00 31.60 33.25 1k3t h MET 39 CO 0.25 0.01 0.24 1.21 -0.40 0.00 0.00 176.91 178.22 1k3t s ASN 40 N -5.92 7.29 0.00 1.39 2.47 -1.26 -4.81 114.94 114.10 1k3t s ASN 40 Ca 0.04 1.68 0.00 0.00 0.42 0.00 0.00 52.86 55.00 1k3t s ASN 40 Cb 0.07 -2.52 0.00 0.00 -1.45 0.00 0.00 41.25 37.35 1k3t s ASN 40 CO 0.71 0.04 0.10 0.35 -3.72 0.00 0.00 177.10 174.58 1k3t n THR 41 N 0.90 0.00 -1.79 -5.21 -2.24 -1.26 -4.86 114.28 99.82 1k3t n THR 41 Ca -0.01 -0.42 -0.28 0.00 -2.27 0.00 0.00 64.05 61.07 1k3t n THR 41 Cb 0.50 1.04 -0.05 0.00 -2.10 0.00 0.00 70.33 69.72 1k3t n THR 41 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1k3t s ASP 42 N -0.65 4.63 0.37 3.42 -1.08 -1.26 -4.79 116.67 117.31 1k3t s ASP 42 Ca 0.00 0.20 0.08 0.00 -0.52 0.00 0.00 52.55 52.31 1k3t s ASP 42 Cb 0.00 -2.54 0.72 0.00 -1.46 0.00 0.00 42.92 39.64 1k3t s ASP 42 CO 0.00 -3.02 1.90 0.00 0.52 0.00 0.00 175.17 174.56 1k3t h ALA 43 N 14.65 1.45 -0.43 3.66 0.00 -1.93 -1.79 119.26 134.88 1k3t h ALA 43 Ca -0.10 -0.20 -0.10 0.00 0.00 0.00 0.00 54.91 54.51 1k3t h ALA 43 Cb 1.11 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.77 1k3t h ALA 43 CO 1.14 0.38 -0.13 0.93 0.00 0.00 0.00 179.25 181.58 1k3t h GLU 44 N 0.33 0.77 -0.47 0.00 3.07 -1.89 -0.33 114.58 116.06 1k3t h GLU 44 Ca 0.07 -0.27 -0.11 0.00 -0.50 0.00 0.00 59.36 58.55 1k3t h GLU 44 Cb 0.36 -0.06 -0.02 0.00 -0.84 0.00 0.00 28.75 28.19 1k3t h GLU 44 CO 0.02 0.87 -0.15 -0.92 -1.40 0.00 0.00 179.01 177.42 1k3t h TYR 45 N 0.70 1.00 -0.44 4.33 3.20 -1.80 -1.78 116.97 122.18 1k3t h TYR 45 Ca 0.12 -0.21 -0.03 0.00 3.14 0.00 0.00 58.73 61.74 1k3t h TYR 45 Cb 0.61 -0.25 -0.02 0.00 1.54 0.00 0.00 36.73 38.62 1k3t h TYR 45 CO 0.03 0.98 0.14 0.74 -1.64 0.00 0.00 178.16 178.41 1k3t h PHE 46 N 0.79 0.70 -0.60 -3.82 0.05 -1.01 -1.36 116.94 111.70 1k3t h PHE 46 Ca 0.12 -0.07 0.03 0.00 3.82 0.00 0.00 57.97 61.87 1k3t h PHE 46 Cb 0.68 -0.20 -0.04 0.00 2.00 0.00 0.00 35.95 38.39 1k3t h PHE 46 CO 0.04 0.63 0.36 0.00 -0.18 0.00 0.00 178.31 179.16 1k3t h ALA 47 N 0.99 0.77 -0.77 2.45 0.00 -0.92 0.89 119.26 122.68 1k3t h ALA 47 Ca 0.14 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.02 1k3t h ALA 47 Cb 0.26 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 17.84 1k3t h ALA 47 CO -0.01 0.08 0.41 -0.92 0.00 0.00 0.00 179.25 178.82 1k3t h TYR 48 N 0.70 1.08 -0.10 0.00 3.20 -1.16 0.05 116.97 120.74 1k3t h TYR 48 Ca 0.24 -0.03 -0.11 0.00 3.14 0.00 0.00 58.73 61.97 1k3t h TYR 48 Cb 0.04 -0.34 -0.01 0.00 1.54 0.00 0.00 36.73 37.96 1k3t h TYR 48 CO -0.06 0.76 -0.43 1.96 -1.64 0.00 0.00 178.16 178.75 1k3t h GLN 49 N 1.08 0.22 0.03 1.82 4.20 -0.56 -2.78 115.11 119.12 1k3t h GLN 49 Ca 0.27 -0.11 -0.22 0.00 0.06 0.00 0.00 58.65 58.65 1k3t h GLN 49 Cb 0.05 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.82 1k3t h GLN 49 CO -0.04 0.62 -0.98 1.98 -0.67 0.00 0.00 178.83 179.74 1k3t h MET 50 N 0.19 0.16 -0.06 1.46 4.05 -0.49 -3.31 114.93 116.92 1k3t h MET 50 Ca 0.01 -0.22 -0.21 0.00 -0.28 0.00 0.00 59.70 59.01 1k3t h MET 50 Cb 0.85 0.07 0.00 0.00 -0.80 0.00 0.00 31.60 31.72 1k3t h MET 50 CO 0.07 1.02 -0.81 -0.09 0.23 0.00 0.00 176.91 177.32 1k3t h ARG 51 N 0.07 0.48 -4.90 0.39 2.43 -0.83 -3.38 114.38 108.65 1k3t h ARG 51 Ca -0.06 -0.43 -0.63 0.00 -0.81 0.00 0.00 59.98 58.05 1k3t h ARG 51 Cb 1.67 0.10 -0.35 0.00 -0.42 0.00 0.00 29.97 30.97 1k3t h ARG 51 CO 0.15 1.07 -0.85 0.71 -1.51 0.00 0.00 179.97 179.54 1k3t s TYR 52 N -3.52 2.32 -0.18 2.20 2.02 -1.06 -2.03 117.35 117.09 1k3t s TYR 52 Ca -0.07 -1.20 0.01 0.00 -0.37 0.00 0.00 57.07 55.44 1k3t s TYR 52 Cb 0.09 -1.64 0.03 0.00 -0.40 0.00 0.00 41.96 40.05 1k3t s TYR 52 CO 0.86 -0.60 -0.13 0.34 -1.57 0.00 0.00 175.55 174.46 1k3t s ASP 53 N 1.07 3.13 0.39 2.29 -1.08 -0.69 -4.80 116.67 116.98 1k3t s ASP 53 Ca -0.03 -0.72 0.10 0.00 -0.52 0.00 0.00 52.55 51.38 1k3t s ASP 53 Cb -0.14 -1.25 0.89 0.00 -1.46 0.00 0.00 42.92 40.95 1k3t s ASP 53 CO -0.05 -0.09 1.94 0.71 0.52 0.00 0.00 175.17 178.19 1k3t h THR 54 N 6.22 0.91 0.01 1.71 1.35 -1.98 -0.89 112.91 120.24 1k3t h THR 54 Ca -0.34 -0.20 -0.39 0.00 -0.55 0.00 0.00 66.41 64.93 1k3t h THR 54 Cb 1.12 0.27 -0.07 0.00 -1.73 0.00 0.00 68.15 67.74 1k3t h THR 54 CO 0.52 0.11 -2.44 0.55 -0.25 0.00 0.00 175.52 174.00 1k3t n VAL 55 N -4.49 1.52 0.73 6.82 3.14 -1.26 -4.58 118.33 120.21 1k3t n VAL 55 Ca 0.13 -0.56 0.13 0.00 -2.96 0.00 0.00 64.34 61.07 1k3t n VAL 55 Cb 0.37 -1.48 0.35 0.00 -1.06 0.00 0.00 33.84 32.03 1k3t n VAL 55 CO 0.00 0.00 0.00 1.41 -6.46 0.00 0.00 176.83 171.78 1k3t n HIS 56 N -3.36 0.51 0.00 1.45 8.25 -1.18 -4.96 115.22 115.94 1k3t n HIS 56 Ca -0.46 0.15 0.00 0.00 -0.26 0.00 0.00 57.72 57.15 1k3t n HIS 56 Cb 0.98 -0.68 0.00 0.00 1.12 0.00 0.00 29.99 31.42 1k3t n HIS 56 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1k3t n GLY 57 N 1.38 -1.66 3.63 -1.41 0.00 -0.34 -4.96 105.19 101.83 1k3t n GLY 57 Ca 0.05 -2.05 -0.40 0.00 0.00 0.00 0.00 46.02 43.62 1k3t n GLY 57 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1k3t s LYS 58 N 0.00 4.12 0.31 1.61 1.02 -1.26 -1.71 119.74 123.82 1k3t s LYS 58 Ca 0.00 0.45 -0.27 0.00 0.02 0.00 0.00 55.97 56.17 1k3t s LYS 58 Cb 0.00 -3.63 -0.14 0.00 -0.52 0.00 0.00 37.83 33.54 1k3t s LYS 58 CO 0.00 -0.33 0.98 0.34 -0.92 0.00 0.00 175.35 175.42 1k3t n PHE 59 N 5.43 1.14 1.17 3.18 7.35 -0.86 -4.87 117.46 129.99 1k3t n PHE 59 Ca -0.03 0.69 0.12 0.00 -0.76 0.00 0.00 57.45 57.48 1k3t n PHE 59 Cb 0.50 -2.23 0.36 0.00 0.35 0.00 0.00 39.48 38.46 1k3t n PHE 59 CO 0.00 0.00 0.00 1.63 -0.76 0.00 0.00 176.76 177.63 1k3t n LYS 60 N 0.67 1.92 -4.53 -4.13 5.02 -1.26 -4.85 118.16 110.99 1k3t n LYS 60 Ca 0.10 -1.36 -0.32 0.00 -2.02 0.00 0.00 58.31 54.71 1k3t n LYS 60 Cb 0.33 -1.45 -0.11 0.00 -0.02 0.00 0.00 35.03 33.77 1k3t n LYS 60 CO 0.00 0.00 0.00 0.71 -0.52 0.00 0.00 177.40 177.59 1k3t s TYR 61 N -1.87 2.84 0.42 2.13 4.12 -1.26 -5.10 117.35 118.63 1k3t s TYR 61 Ca 0.34 -0.07 -0.25 0.00 0.02 0.00 0.00 57.07 57.11 1k3t s TYR 61 Cb 0.20 -1.60 -0.08 0.00 -1.52 0.00 0.00 41.96 38.96 1k3t s TYR 61 CO 0.30 0.34 1.27 -2.00 0.02 0.00 0.00 175.55 175.48 1k3t s GLU 62 N -1.31 3.92 -0.11 -0.62 2.12 -1.26 -4.85 118.70 116.59 1k3t s GLU 62 Ca 0.16 2.07 -0.01 0.00 0.36 0.00 0.00 54.97 57.55 1k3t s GLU 62 Cb -0.11 -2.68 0.03 0.00 0.26 0.00 0.00 34.13 31.62 1k3t s GLU 62 CO 0.06 -0.50 -0.04 0.08 -0.54 0.00 0.00 175.26 174.31 1k3t s VAL 63 N -1.32 0.79 0.32 3.70 1.01 -1.26 -2.24 120.40 121.40 1k3t s VAL 63 Ca 0.58 -0.18 0.04 0.00 0.00 0.00 0.00 61.98 62.42 1k3t s VAL 63 Cb -0.36 -0.89 -0.06 0.00 0.00 0.00 0.00 36.38 35.07 1k3t s VAL 63 CO 0.46 0.29 0.04 0.28 0.00 0.00 0.00 175.10 176.17 1k3t s THR 64 N 1.80 1.24 0.15 3.92 -1.32 -0.51 -4.95 115.64 115.97 1k3t s THR 64 Ca 0.04 -2.01 0.08 0.00 -1.21 0.00 0.00 61.69 58.59 1k3t s THR 64 Cb -0.13 -2.74 -0.04 0.00 -1.51 0.00 0.00 72.50 68.08 1k3t s THR 64 CO -0.07 -0.05 -0.18 0.42 -2.21 0.00 0.00 174.62 172.53 1k3t s THR 65 N -3.27 1.71 0.07 5.08 -4.23 -1.26 0.07 115.64 113.82 1k3t s THR 65 Ca 0.35 -1.83 0.00 0.00 -1.18 0.00 0.00 61.69 59.04 1k3t s THR 65 Cb 0.08 -1.74 -0.00 0.00 1.34 0.00 0.00 72.50 72.18 1k3t s THR 65 CO 0.15 -0.30 0.08 0.41 -0.54 0.00 0.00 174.62 174.43 1k3t n THR 66 N 0.45 0.00 -5.21 3.99 -1.04 -0.70 -4.92 114.28 106.85 1k3t n THR 66 Ca -0.14 -0.42 -0.32 0.00 -2.04 0.00 0.00 64.05 61.13 1k3t n THR 66 Cb 0.56 0.24 -0.16 0.00 -1.82 0.00 0.00 70.33 69.15 1k3t n THR 66 CO 0.00 0.00 0.00 -0.54 -0.64 0.00 0.00 175.07 173.89 1k3t s LYS 67 N -2.21 2.43 0.18 -2.82 -0.14 -1.26 -2.18 119.74 113.74 1k3t s LYS 67 Ca 0.07 -0.88 -0.08 0.00 -1.36 0.00 0.00 55.97 53.73 1k3t s LYS 67 Cb 0.00 -2.17 0.08 0.00 -1.68 0.00 0.00 37.83 34.06 1k3t s LYS 67 CO 0.05 0.47 1.57 0.66 -0.76 0.00 0.00 175.35 177.34 1k3t h SER 68 N 5.79 0.93 -4.45 2.83 4.64 -1.92 -3.44 113.55 117.93 1k3t h SER 68 Ca -0.38 -0.35 -0.18 0.00 -0.47 0.00 0.00 61.79 60.42 1k3t h SER 68 Cb 1.15 -0.26 -0.24 0.00 -0.31 0.00 0.00 62.40 62.75 1k3t h SER 68 CO 0.48 1.12 -0.59 -0.94 -0.87 0.00 0.00 176.83 176.03 1k3t s SER 69 N -6.75 0.02 0.25 4.97 1.04 -1.26 -5.06 113.70 106.91 1k3t s SER 69 Ca -0.10 -0.10 0.15 0.00 0.48 0.00 0.00 55.95 56.38 1k3t s SER 69 Cb 0.12 0.18 0.81 0.00 0.10 0.00 0.00 66.02 67.23 1k3t s SER 69 CO 0.86 -0.21 1.42 -2.65 0.98 0.00 0.00 173.24 173.64 1k3t n PRO 70 N 2.18 0.10 0.07 4.02 -0.02 -1.26 -1.33 135.00 138.75 1k3t n PRO 70 Ca -0.18 0.58 -0.13 0.00 -2.02 0.00 0.00 63.50 61.74 1k3t n PRO 70 Cb 0.57 -1.90 -0.08 0.00 -0.02 0.00 0.00 33.50 32.07 1k3t n PRO 70 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 1k3t h SER 71 N 0.00 -0.13 -1.06 2.55 0.87 -1.99 -3.47 113.55 110.32 1k3t h SER 71 Ca 0.00 -0.23 -0.73 0.00 -1.23 0.00 0.00 61.79 59.59 1k3t h SER 71 Cb 0.16 0.03 0.07 0.00 -0.44 0.00 0.00 62.40 62.23 1k3t h SER 71 CO 0.00 0.16 -0.15 0.52 -0.53 0.00 0.00 176.83 176.83 1k3t n VAL 72 N -5.03 0.82 -0.27 2.23 0.31 -0.44 -4.87 118.33 111.09 1k3t n VAL 72 Ca -0.09 -0.21 0.01 0.00 -0.01 0.00 0.00 64.34 64.05 1k3t n VAL 72 Cb 0.19 -0.05 0.14 0.00 -0.91 0.00 0.00 33.84 33.21 1k3t n VAL 72 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1k3t h ALA 73 N 2.26 1.05 -2.81 3.52 0.00 -1.90 -3.45 119.26 117.92 1k3t h ALA 73 Ca -0.42 0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.48 1k3t h ALA 73 Cb 1.43 -0.12 -0.13 0.00 0.00 0.00 0.00 17.79 18.97 1k3t h ALA 73 CO 0.62 0.07 -0.01 -1.59 0.00 0.00 0.00 179.25 178.34 1k3t s LYS 74 N -6.06 1.12 0.07 0.00 -2.85 -1.26 -5.12 119.74 105.63 1k3t s LYS 74 Ca -0.13 -0.65 -0.31 0.00 -1.00 0.00 0.00 55.97 53.89 1k3t s LYS 74 Cb 0.18 0.50 -0.17 0.00 -2.06 0.00 0.00 37.83 36.28 1k3t s LYS 74 CO 0.77 -0.45 0.76 -0.25 0.10 0.00 0.00 175.35 176.28 1k3t n ASP 75 N -0.25 -0.42 0.00 0.03 9.92 -1.26 -4.86 116.55 119.71 1k3t n ASP 75 Ca -0.16 1.01 0.00 0.00 -0.53 0.00 0.00 54.79 55.11 1k3t n ASP 75 Cb 0.64 -0.82 0.00 0.00 -0.64 0.00 0.00 41.12 40.30 1k3t n ASP 75 CO 0.00 0.00 0.00 -0.90 0.13 0.00 0.00 177.20 176.43 1k3t n ASP 76 N 1.49 0.29 -4.11 -2.24 5.75 -0.92 -4.32 116.55 112.49 1k3t n ASP 76 Ca 0.17 -1.04 -0.29 0.00 -0.01 0.00 0.00 54.79 53.62 1k3t n ASP 76 Cb 0.13 0.00 -0.17 0.00 -1.03 0.00 0.00 41.12 40.05 1k3t n ASP 76 CO 0.00 0.00 0.00 -0.89 -0.11 0.00 0.00 177.20 176.20 1k3t s THR 77 N -0.04 1.64 0.03 2.12 2.01 -1.14 -0.19 115.64 120.06 1k3t s THR 77 Ca 0.00 -0.75 -0.16 0.00 0.31 0.00 0.00 61.69 61.09 1k3t s THR 77 Cb 0.00 -1.46 -0.06 0.00 0.01 0.00 0.00 72.50 70.99 1k3t s THR 77 CO 0.00 0.47 0.47 -0.76 -0.69 0.00 0.00 174.62 174.10 1k3t s LEU 78 N 0.72 4.49 -0.30 4.42 2.01 0.21 -1.72 118.68 128.51 1k3t s LEU 78 Ca -0.12 1.07 -0.00 0.00 0.01 0.00 0.00 54.13 55.09 1k3t s LEU 78 Cb -0.16 -2.71 0.06 0.00 0.01 0.00 0.00 46.19 43.38 1k3t s LEU 78 CO 0.02 0.30 -0.02 -0.69 1.01 0.00 0.00 176.35 176.98 1k3t s VAL 79 N -1.11 2.74 -0.32 -1.59 1.01 0.11 -0.34 120.40 120.90 1k3t s VAL 79 Ca 0.26 -1.55 -0.02 0.00 0.00 0.00 0.00 61.98 60.67 1k3t s VAL 79 Cb -0.18 -2.63 0.06 0.00 0.00 0.00 0.00 36.38 33.64 1k3t s VAL 79 CO 0.16 -0.15 0.03 -0.69 0.00 0.00 0.00 175.10 174.45 1k3t s VAL 80 N 1.18 3.03 -1.51 2.92 1.01 0.29 -1.42 120.40 125.91 1k3t s VAL 80 Ca -0.05 -1.50 -0.06 0.00 0.00 0.00 0.00 61.98 60.37 1k3t s VAL 80 Cb -0.20 -2.81 0.01 0.00 0.00 0.00 0.00 36.38 33.38 1k3t s VAL 80 CO -0.03 -0.21 0.75 -3.20 0.00 0.00 0.00 175.10 172.41 1k3t n ASN 81 N 4.61 -6.11 0.00 3.32 5.15 -0.95 -1.47 115.26 119.81 1k3t n ASN 81 Ca -0.11 -0.36 0.00 0.00 -0.60 0.00 0.00 54.58 53.51 1k3t n ASN 81 Cb 0.43 -4.90 0.00 0.00 -0.53 0.00 0.00 39.78 34.78 1k3t n ASN 81 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1k3t n GLY 82 N -1.63 2.98 3.70 8.20 0.00 -1.26 -5.02 105.19 112.15 1k3t n GLY 82 Ca -0.08 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.52 1k3t n GLY 82 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1k3t s HIS 83 N -2.24 3.56 -0.15 1.61 3.76 -0.54 -5.01 115.29 116.27 1k3t s HIS 83 Ca 0.00 1.53 -0.22 0.00 -0.15 0.00 0.00 55.06 56.22 1k3t s HIS 83 Cb 0.00 -3.08 -0.03 0.00 1.11 0.00 0.00 32.58 30.58 1k3t s HIS 83 CO 0.00 -0.11 0.66 1.03 -0.85 0.00 0.00 174.74 175.47 1k3t s ARG 84 N 1.53 4.31 -0.07 1.40 0.52 -1.26 -0.55 118.95 124.83 1k3t s ARG 84 Ca 0.46 0.73 0.02 0.00 -0.52 0.00 0.00 55.73 56.42 1k3t s ARG 84 Cb -0.19 -3.52 0.01 0.00 0.52 0.00 0.00 34.95 31.77 1k3t s ARG 84 CO 0.20 -0.12 -0.12 0.42 0.02 0.00 0.00 175.30 175.71 1k3t s ILE 85 N 1.47 1.12 0.09 1.52 1.01 0.54 -4.86 121.20 122.08 1k3t s ILE 85 Ca 0.32 -0.45 -0.16 0.00 0.00 0.00 0.00 60.65 60.36 1k3t s ILE 85 Cb -0.16 -1.04 -0.07 0.00 0.01 0.00 0.00 42.46 41.20 1k3t s ILE 85 CO 0.13 0.36 0.52 -0.76 0.00 0.00 0.00 174.94 175.19 1k3t s LEU 86 N 0.80 4.44 -0.21 2.97 1.02 -1.00 0.67 118.68 127.35 1k3t s LEU 86 Ca -0.12 1.12 -0.12 0.00 0.02 0.00 0.00 54.13 55.03 1k3t s LEU 86 Cb -0.15 -2.98 -0.05 0.00 0.02 0.00 0.00 46.19 43.03 1k3t s LEU 86 CO 0.02 0.21 0.22 0.00 0.02 0.00 0.00 176.35 176.83 1k3t s VAL 88 N 0.91 2.00 0.35 0.00 -7.23 0.93 -4.86 120.40 112.50 1k3t s VAL 88 Ca 0.11 -1.56 -0.26 0.00 -1.81 0.00 0.00 61.98 58.46 1k3t s VAL 88 Cb -0.13 -1.77 -0.09 0.00 0.56 0.00 0.00 36.38 34.95 1k3t s VAL 88 CO 0.04 0.10 1.09 -0.75 -0.31 0.00 0.00 175.10 175.27 1k3t s LYS 89 N -1.77 4.32 0.36 4.82 2.36 -1.26 -1.89 119.74 126.68 1k3t s LYS 89 Ca 0.10 1.68 -0.27 0.00 -2.55 0.00 0.00 55.97 54.94 1k3t s LYS 89 Cb -0.10 -2.81 -0.09 0.00 -1.05 0.00 0.00 37.83 33.78 1k3t s LYS 89 CO 0.04 -0.04 1.24 0.00 1.55 0.00 0.00 175.35 178.14 1k3t s ALA 90 N -1.42 3.33 0.12 3.13 0.00 -0.00 -4.69 121.76 122.22 1k3t s ALA 90 Ca 0.53 1.12 0.07 0.00 0.00 0.00 0.00 51.96 53.67 1k3t s ALA 90 Cb -0.27 -3.43 -0.04 0.00 0.00 0.00 0.00 23.12 19.38 1k3t s ALA 90 CO 0.35 -0.58 -0.06 -0.65 0.00 0.00 0.00 175.76 174.82 1k3t s GLN 91 N -1.99 2.26 0.31 0.00 -1.52 -1.26 -4.92 119.66 112.54 1k3t s GLN 91 Ca 0.52 -1.02 0.03 0.00 -1.95 0.00 0.00 55.36 52.94 1k3t s GLN 91 Cb -0.36 -2.35 0.53 0.00 -0.22 0.00 0.00 33.01 30.61 1k3t s GLN 91 CO 0.46 0.50 1.83 0.00 -0.25 0.00 0.00 175.29 177.82 1k3t h ARG 92 N 3.32 0.54 -5.09 2.91 3.08 -2.01 -3.40 114.38 113.73 1k3t h ARG 92 Ca -0.48 -0.14 -0.67 0.00 0.07 0.00 0.00 59.98 58.77 1k3t h ARG 92 Cb 1.18 -0.07 -0.31 0.00 0.08 0.00 0.00 29.97 30.85 1k3t h ARG 92 CO 0.55 0.61 -0.80 -0.80 -1.07 0.00 0.00 179.97 178.46 1k3t s ASN 93 N -6.75 3.62 0.59 7.04 0.01 -1.26 -5.01 114.94 113.19 1k3t s ASN 93 Ca -0.08 -0.52 0.29 0.00 -0.71 0.00 0.00 52.86 51.84 1k3t s ASN 93 Cb 0.15 -1.58 1.74 0.00 0.41 0.00 0.00 41.25 41.97 1k3t s ASN 93 CO 0.78 0.03 2.20 -0.65 -1.51 0.00 0.00 177.10 177.94 1k3t h PRO 94 N 7.74 0.00 -0.04 -0.60 0.11 -1.85 -0.70 132.00 136.65 1k3t h PRO 94 Ca -0.40 0.00 0.01 0.00 0.11 0.00 0.00 66.00 65.73 1k3t h PRO 94 Cb 1.16 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.27 1k3t h PRO 94 CO 0.60 0.00 0.06 0.00 -0.21 0.00 0.00 178.00 178.45 1k3t h ALA 95 N 1.93 1.51 0.00 -0.75 0.00 -1.78 -1.87 119.26 118.30 1k3t h ALA 95 Ca 0.03 -0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.92 1k3t h ALA 95 Cb 0.16 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.95 1k3t h ALA 95 CO -0.00 -0.08 -0.07 -0.44 0.00 0.00 0.00 179.25 178.66 1k3t h ASP 96 N 0.00 0.00 -4.09 0.00 3.32 -1.41 -3.30 116.42 110.94 1k3t h ASP 96 Ca 0.02 0.00 -0.55 0.00 0.02 0.00 0.00 57.03 56.52 1k3t h ASP 96 Cb 0.13 0.00 0.15 0.00 0.22 0.00 0.00 39.33 39.83 1k3t h ASP 96 CO -0.00 0.07 0.54 -0.76 -1.72 0.00 0.00 179.24 177.37 1k3t s LEU 97 N -6.25 3.68 -0.21 1.55 2.01 -0.70 -4.88 118.68 113.87 1k3t s LEU 97 Ca 0.06 2.64 -0.02 0.00 0.01 0.00 0.00 54.13 56.82 1k3t s LEU 97 Cb 0.06 -4.50 0.03 0.00 0.01 0.00 0.00 46.19 41.78 1k3t s LEU 97 CO 0.67 -1.81 2.53 -0.81 1.01 0.00 0.00 176.35 177.93 1k3t n PRO 98 N -1.58 1.80 0.15 1.29 -0.04 -1.26 -4.61 135.00 130.75 1k3t n PRO 98 Ca 0.14 -1.27 -0.14 0.00 -0.04 0.00 0.00 63.50 62.19 1k3t n PRO 98 Cb 0.47 -1.68 -0.07 0.00 -0.04 0.00 0.00 33.50 32.19 1k3t n PRO 98 CO 0.00 0.00 0.00 -1.49 -0.04 0.00 0.00 175.50 173.97 1k3t h TRP 99 N 2.04 -0.88 -0.09 0.54 -0.00 -1.81 -1.49 115.95 114.25 1k3t h TRP 99 Ca 0.23 0.02 0.04 0.00 -0.00 0.00 0.00 58.89 59.17 1k3t h TRP 99 Cb 1.01 0.36 -0.05 0.00 -0.00 0.00 0.00 29.16 30.49 1k3t h TRP 99 CO 1.03 -0.44 -0.23 0.78 -0.00 0.00 0.00 178.44 179.58 1k3t h GLY 100 N -0.59 -0.27 -0.03 1.49 0.00 -1.09 -1.32 103.07 101.26 1k3t h GLY 100 Ca 0.01 0.28 0.18 0.00 0.00 0.00 0.00 47.33 47.80 1k3t h GLY 100 CO -0.15 -0.20 0.34 0.50 0.00 0.00 0.00 176.54 177.04 1k3t h LYS 101 N -0.32 0.42 0.00 4.80 1.57 -1.76 -0.98 116.57 120.30 1k3t h LYS 101 Ca 0.09 -0.03 -0.03 0.00 -1.87 0.00 0.00 60.65 58.82 1k3t h LYS 101 Cb 0.44 -0.09 -0.00 0.00 0.08 0.00 0.00 32.23 32.65 1k3t h LYS 101 CO -0.27 0.28 -0.12 -0.07 -0.57 0.00 0.00 179.45 178.70 1k3t h LEU 102 N 0.43 0.00 0.00 2.94 4.07 -0.65 -3.48 115.31 118.62 1k3t h LEU 102 Ca 0.49 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.45 1k3t h LEU 102 Cb 0.84 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.58 1k3t h LEU 102 CO -0.47 0.12 0.00 0.61 -1.08 0.00 0.00 178.44 177.62 1k3t n GLY 103 N 0.41 0.53 3.71 0.83 0.00 -0.37 -5.04 105.19 105.25 1k3t n GLY 103 Ca 0.01 -0.79 -0.42 0.00 0.00 0.00 0.00 46.02 44.82 1k3t n GLY 103 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1k3t s VAL 104 N -2.00 4.88 -0.20 1.61 1.01 -0.99 -4.79 120.40 119.92 1k3t s VAL 104 Ca 0.00 1.97 0.09 0.00 0.00 0.00 0.00 61.98 64.05 1k3t s VAL 104 Cb 0.00 -4.28 -0.19 0.00 0.00 0.00 0.00 36.38 31.91 1k3t s VAL 104 CO 0.00 0.14 -0.06 -1.84 0.00 0.00 0.00 175.10 173.34 1k3t n GLU 105 N 4.10 0.84 -4.36 2.72 0.28 -0.36 -4.31 120.64 119.55 1k3t n GLU 105 Ca 0.06 0.06 -0.34 0.00 -0.16 0.00 0.00 57.16 56.77 1k3t n GLU 105 Cb 0.51 -1.46 -0.13 0.00 1.43 0.00 0.00 31.44 31.79 1k3t n GLU 105 CO 0.00 0.00 0.00 0.71 -0.16 0.00 0.00 177.13 177.68 1k3t s TYR 106 N -2.45 2.99 -0.15 -1.84 1.51 -0.92 -0.33 117.35 116.17 1k3t s TYR 106 Ca -0.19 -0.43 -0.02 0.00 -1.01 0.00 0.00 57.07 55.43 1k3t s TYR 106 Cb 0.07 -1.98 -0.02 0.00 -0.11 0.00 0.00 41.96 39.92 1k3t s TYR 106 CO 0.64 -0.14 -0.09 0.08 -1.11 0.00 0.00 175.55 174.93 1k3t s VAL 107 N 0.56 3.28 -0.45 0.71 1.01 0.16 -1.02 120.40 124.66 1k3t s VAL 107 Ca -0.03 -0.57 -0.19 0.00 0.00 0.00 0.00 61.98 61.19 1k3t s VAL 107 Cb -0.14 -2.42 0.03 0.00 0.00 0.00 0.00 36.38 33.85 1k3t s VAL 107 CO 0.03 0.50 0.57 -0.63 0.00 0.00 0.00 175.10 175.57 1k3t s ILE 108 N 0.59 4.92 -0.71 2.22 1.01 -0.42 -0.09 121.20 128.72 1k3t s ILE 108 Ca -0.06 -0.17 -0.21 0.00 0.00 0.00 0.00 60.65 60.22 1k3t s ILE 108 Cb -0.15 -4.17 0.09 0.00 0.01 0.00 0.00 42.46 38.24 1k3t s ILE 108 CO 0.03 -0.59 0.95 -0.70 0.00 0.00 0.00 174.94 174.63 1k3t s GLU 109 N 2.56 3.21 0.00 2.79 2.56 0.11 -1.31 118.70 128.62 1k3t s GLU 109 Ca 0.18 -1.17 0.07 0.00 0.00 0.00 0.00 54.97 54.05 1k3t s GLU 109 Cb -0.16 -4.40 0.15 0.00 2.00 0.00 0.00 34.13 31.72 1k3t s GLU 109 CO 0.16 -1.75 1.00 -1.13 -0.56 0.00 0.00 175.26 172.98 1k3t n SER 110 N 7.11 2.22 0.24 -1.70 3.41 0.71 -1.53 113.62 124.09 1k3t n SER 110 Ca 0.02 -1.72 0.08 0.00 -0.26 0.00 0.00 58.87 56.99 1k3t n SER 110 Cb 0.46 -0.09 0.58 0.00 -0.26 0.00 0.00 64.21 64.90 1k3t n SER 110 CO 0.00 0.00 0.00 0.71 -0.16 0.00 0.00 175.04 175.59 1k3t h THR 111 N 1.43 0.93 0.00 6.66 1.35 -1.77 -3.44 112.91 118.06 1k3t h THR 111 Ca 0.00 -0.61 0.00 0.00 -0.55 0.00 0.00 66.41 65.25 1k3t h THR 111 Cb 0.52 1.35 0.00 0.00 -1.73 0.00 0.00 68.15 68.29 1k3t h THR 111 CO 0.00 0.16 0.00 0.61 -0.25 0.00 0.00 175.52 176.04 1k3t n GLY 112 N -0.88 0.90 0.03 5.82 0.00 -1.26 -4.88 105.19 104.91 1k3t n GLY 112 Ca -0.02 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.11 1k3t n GLY 112 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1k3t n LEU 113 N 0.00 0.15 -2.43 0.99 4.77 -1.26 -4.54 117.00 114.69 1k3t n LEU 113 Ca 0.00 0.04 -0.27 0.00 -0.03 0.00 0.00 56.01 55.75 1k3t n LEU 113 Cb 0.00 -0.01 0.00 0.00 -2.33 0.00 0.00 43.42 41.08 1k3t n LEU 113 CO 0.00 -0.02 0.20 0.49 -1.33 0.00 0.00 177.39 176.73 1k3t n PHE 114 N -2.31 3.34 0.19 -1.77 3.72 -1.26 -4.75 117.46 114.62 1k3t n PHE 114 Ca -0.03 -3.01 0.09 0.00 -0.05 0.00 0.00 57.45 54.44 1k3t n PHE 114 Cb 0.56 -0.12 0.12 0.00 -0.94 0.00 0.00 39.48 39.10 1k3t n PHE 114 CO 0.00 0.00 0.00 1.15 -0.05 0.00 0.00 176.76 177.86 1k3t h THR 115 N 2.53 0.32 -3.63 4.37 2.02 -1.91 -3.32 112.91 113.28 1k3t h THR 115 Ca 0.31 -1.45 -0.51 0.00 0.77 0.00 0.00 66.41 65.54 1k3t h THR 115 Cb 0.99 2.16 -0.02 0.00 -1.74 0.00 0.00 68.15 69.53 1k3t h THR 115 CO 0.84 0.18 0.34 0.00 0.37 0.00 0.00 175.52 177.26 1k3t s ALA 116 N -3.12 3.29 0.21 6.16 0.00 -1.26 -2.23 121.76 124.81 1k3t s ALA 116 Ca 0.06 0.57 -0.10 0.00 0.00 0.00 0.00 51.96 52.49 1k3t s ALA 116 Cb 0.06 -3.23 0.27 0.00 0.00 0.00 0.00 23.12 20.22 1k3t s ALA 116 CO 0.70 0.08 1.71 -0.22 0.00 0.00 0.00 175.76 178.03 1k3t h LYS 117 N 4.98 0.27 0.00 0.00 3.11 -1.21 -0.25 116.57 123.46 1k3t h LYS 117 Ca -0.44 -0.02 -0.08 0.00 -2.81 0.00 0.00 60.65 57.30 1k3t h LYS 117 Cb 1.21 -0.06 -0.01 0.00 -1.00 0.00 0.00 32.23 32.36 1k3t h LYS 117 CO 0.70 0.18 -0.39 0.00 -2.81 0.00 0.00 179.45 177.13 1k3t h ALA 118 N 1.45 1.27 -0.43 5.00 0.00 -1.89 0.36 119.26 125.02 1k3t h ALA 118 Ca 0.30 -0.35 -0.07 0.00 0.00 0.00 0.00 54.91 54.79 1k3t h ALA 118 Cb 0.43 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.14 1k3t h ALA 118 CO -0.37 0.49 0.00 0.00 0.00 0.00 0.00 179.25 179.37 1k3t h ALA 119 N 1.61 0.58 -0.03 0.00 0.00 -1.74 -2.63 119.26 117.05 1k3t h ALA 119 Ca -0.00 -0.26 -0.08 0.00 0.00 0.00 0.00 54.91 54.56 1k3t h ALA 119 Cb 0.73 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 1k3t h ALA 119 CO 0.05 0.36 -0.35 0.00 0.00 0.00 0.00 179.25 179.31 1k3t h ALA 120 N 0.90 1.36 -0.95 0.00 0.00 -0.36 -2.81 119.26 117.40 1k3t h ALA 120 Ca 0.12 -0.34 0.17 0.00 0.00 0.00 0.00 54.91 54.87 1k3t h ALA 120 Cb 0.48 -0.07 -0.08 0.00 0.00 0.00 0.00 17.79 18.12 1k3t h ALA 120 CO 0.02 0.47 0.60 0.93 0.00 0.00 0.00 179.25 181.28 1k3t h GLU 121 N 0.05 0.67 -0.84 0.00 5.08 0.10 -2.44 114.58 117.19 1k3t h GLU 121 Ca 0.00 -0.04 0.33 0.00 -1.00 0.00 0.00 59.36 58.65 1k3t h GLU 121 Cb 0.65 -0.15 -0.12 0.00 0.50 0.00 0.00 28.75 29.63 1k3t h GLU 121 CO 0.05 0.44 0.49 0.41 -1.00 0.00 0.00 179.01 179.40 1k3t n GLY 122 N -1.41 -0.58 0.28 -3.84 0.00 -1.06 0.26 105.19 98.84 1k3t n GLY 122 Ca 0.20 0.59 0.05 0.00 0.00 0.00 0.00 46.02 46.86 1k3t n GLY 122 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 173.32 173.77 1k3t h HIS 123 N 0.00 0.31 -0.01 1.61 3.86 -1.59 -1.86 115.15 117.46 1k3t h HIS 123 Ca 0.64 -0.00 -0.15 0.00 -1.16 0.00 0.00 60.37 59.70 1k3t h HIS 123 Cb 1.83 -0.10 -0.02 0.00 1.06 0.00 0.00 27.41 30.18 1k3t h HIS 123 CO -0.01 0.25 -0.70 -0.07 0.86 0.00 0.00 177.93 178.26 1k3t h LEU 124 N 0.33 0.10 -1.14 2.43 -0.00 -0.32 -1.58 115.31 115.13 1k3t h LEU 124 Ca 0.08 -0.07 -0.08 0.00 -0.00 0.00 0.00 57.88 57.82 1k3t h LEU 124 Cb 0.06 -0.03 -0.01 0.00 -0.00 0.00 0.00 40.66 40.68 1k3t h LEU 124 CO -0.01 0.77 -0.21 -0.09 -0.00 0.00 0.00 178.44 178.90 1k3t h ARG 125 N 0.06 0.35 -0.15 1.13 2.43 -1.34 -2.29 114.38 114.56 1k3t h ARG 125 Ca -0.01 -0.11 0.00 0.00 -0.81 0.00 0.00 59.98 59.05 1k3t h ARG 125 Cb 1.24 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 30.76 1k3t h ARG 125 CO 0.10 0.55 0.00 0.41 -1.51 0.00 0.00 179.97 179.51 1k3t n GLY 126 N -0.58 -0.26 0.00 2.80 0.00 -0.76 -4.86 105.19 101.52 1k3t n GLY 126 Ca -0.00 -0.19 0.00 0.00 0.00 0.00 0.00 46.02 45.83 1k3t n GLY 126 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1k3t n GLY 127 N 0.79 1.51 3.85 -0.02 0.00 -0.86 -0.75 105.19 109.71 1k3t n GLY 127 Ca 0.07 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.77 1k3t n GLY 127 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1k3t s ALA 128 N -2.06 3.17 -0.21 4.61 0.00 -0.64 -4.11 121.76 122.52 1k3t s ALA 128 Ca 0.00 0.06 0.06 0.00 0.00 0.00 0.00 51.96 52.08 1k3t s ALA 128 Cb 0.00 -2.97 -0.21 0.00 0.00 0.00 0.00 23.12 19.95 1k3t s ALA 128 CO 0.00 -0.12 -0.02 0.54 0.00 0.00 0.00 175.76 176.16 1k3t n ARG 129 N -1.39 0.67 -3.93 0.00 1.74 0.56 -4.00 116.66 110.31 1k3t n ARG 129 Ca 0.05 0.13 -0.10 0.00 -0.77 0.00 0.00 57.85 57.16 1k3t n ARG 129 Cb 0.54 -1.56 -0.12 0.00 -1.02 0.00 0.00 32.46 30.30 1k3t n ARG 129 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 1k3t s LYS 130 N -2.52 0.20 -0.06 5.56 -0.14 0.44 -4.85 119.74 118.36 1k3t s LYS 130 Ca -0.25 -0.35 0.04 0.00 -1.36 0.00 0.00 55.97 54.05 1k3t s LYS 130 Cb 0.08 0.07 0.00 0.00 -1.68 0.00 0.00 37.83 36.30 1k3t s LYS 130 CO 0.70 -0.03 -0.18 0.08 -0.76 0.00 0.00 175.35 175.16 1k3t s VAL 131 N -0.87 1.52 -0.28 3.17 1.01 0.75 0.40 120.40 126.10 1k3t s VAL 131 Ca -0.10 -0.73 -0.01 0.00 0.00 0.00 0.00 61.98 61.14 1k3t s VAL 131 Cb -0.06 -1.33 0.04 0.00 0.00 0.00 0.00 36.38 35.04 1k3t s VAL 131 CO -0.00 0.44 -0.04 -0.69 0.00 0.00 0.00 175.10 174.81 1k3t s VAL 132 N 0.29 2.84 -0.04 2.92 1.01 0.87 -0.83 120.40 127.47 1k3t s VAL 132 Ca -0.11 -1.29 -0.25 0.00 0.00 0.00 0.00 61.98 60.33 1k3t s VAL 132 Cb -0.14 -2.57 -0.04 0.00 0.00 0.00 0.00 36.38 33.63 1k3t s VAL 132 CO 0.04 0.01 0.78 -0.63 0.00 0.00 0.00 175.10 175.31 1k3t s ILE 133 N 1.26 4.96 -0.68 2.22 1.01 0.25 0.04 121.20 130.27 1k3t s ILE 133 Ca -0.04 1.63 -0.03 0.00 0.00 0.00 0.00 60.65 62.21 1k3t s ILE 133 Cb -0.19 -4.12 0.15 0.00 0.01 0.00 0.00 42.46 38.31 1k3t s ILE 133 CO -0.03 0.24 2.51 -1.54 0.00 0.00 0.00 174.94 176.12 1k3t n SER 134 N 3.70 6.95 -3.57 3.58 3.41 -0.58 -1.13 113.62 125.98 1k3t n SER 134 Ca 0.01 -3.37 0.03 0.00 -0.26 0.00 0.00 58.87 55.28 1k3t n SER 134 Cb 0.51 -1.21 -0.00 0.00 -0.26 0.00 0.00 64.21 63.25 1k3t n SER 134 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1k3t s ALA 135 N -2.33 -2.46 0.68 7.33 0.00 -1.19 -4.96 121.76 118.83 1k3t s ALA 135 Ca 0.56 1.00 -0.15 0.00 0.00 0.00 0.00 51.96 53.36 1k3t s ALA 135 Cb 0.36 0.20 0.01 0.00 0.00 0.00 0.00 23.12 23.70 1k3t s ALA 135 CO -0.25 -1.03 1.16 -2.14 0.00 0.00 0.00 175.76 173.50 1k3t s PRO 136 N -2.07 2.53 0.38 0.00 0.02 -1.17 -4.08 135.00 130.62 1k3t s PRO 136 Ca 0.15 1.57 0.04 0.00 0.02 0.00 0.00 61.00 62.77 1k3t s PRO 136 Cb 0.07 -1.90 -0.04 0.00 0.02 0.00 0.00 34.50 32.65 1k3t s PRO 136 CO -0.06 -1.49 0.08 0.00 -0.33 0.00 0.00 177.00 175.20 1k3t s ALA 137 N -2.14 2.79 0.28 -1.55 0.00 -1.26 -4.91 121.76 114.97 1k3t s ALA 137 Ca 0.71 -1.54 0.02 0.00 0.00 0.00 0.00 51.96 51.15 1k3t s ALA 137 Cb -0.25 0.63 -0.05 0.00 0.00 0.00 0.00 23.12 23.46 1k3t s ALA 137 CO 0.42 -0.29 0.11 -1.54 0.00 0.00 0.00 175.76 174.46 1k3t s SER 138 N -3.58 1.41 0.00 0.00 1.04 -0.95 -4.83 113.70 106.79 1k3t s SER 138 Ca 0.28 -1.43 0.00 0.00 0.48 0.00 0.00 55.95 55.28 1k3t s SER 138 Cb 0.05 0.21 0.00 0.00 0.10 0.00 0.00 66.02 66.38 1k3t s SER 138 CO 0.14 -0.77 0.00 0.61 0.98 0.00 0.00 173.24 174.20 1k3t n GLY 139 N -0.52 0.46 7.00 7.32 0.00 -1.26 -0.82 105.19 117.36 1k3t n GLY 139 Ca -0.00 -0.95 0.00 0.00 0.00 0.00 0.00 46.02 45.06 1k3t n GLY 139 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1k3t n GLY 140 N -2.81 -1.73 0.00 -0.02 0.00 -1.26 -4.72 105.19 94.65 1k3t n GLY 140 Ca 0.00 -1.34 0.00 0.00 0.00 0.00 0.00 46.02 44.68 1k3t n GLY 140 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1k3t n ALA 141 N 0.73 0.00 -1.65 4.61 0.00 -1.26 -4.53 120.51 118.40 1k3t n ALA 141 Ca 0.00 0.00 -0.51 0.00 0.00 0.00 0.00 53.44 52.93 1k3t n ALA 141 Cb 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.39 1k3t n ALA 141 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 1k3t n LYS 142 N 1.68 1.58 -3.40 0.00 3.00 -1.25 -4.66 118.16 115.11 1k3t n LYS 142 Ca 0.00 0.57 -0.38 0.00 -0.00 0.00 0.00 58.31 58.50 1k3t n LYS 142 Cb 0.00 -2.29 -0.08 0.00 0.00 0.00 0.00 35.03 32.66 1k3t n LYS 142 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.40 178.39 1k3t s THR 143 N 1.82 5.19 -0.09 3.15 2.01 -1.26 -0.74 115.64 125.73 1k3t s THR 143 Ca 0.87 0.64 0.03 0.00 0.31 0.00 0.00 61.69 63.53 1k3t s THR 143 Cb -0.86 -3.71 0.01 0.00 0.01 0.00 0.00 72.50 67.95 1k3t s THR 143 CO 0.49 0.22 -0.17 -0.76 -0.69 0.00 0.00 174.62 173.71 1k3t s LEU 144 N 1.59 1.81 -0.21 4.42 1.43 -0.18 -4.78 118.68 122.78 1k3t s LEU 144 Ca 0.17 -0.42 0.02 0.00 -1.03 0.00 0.00 54.13 52.87 1k3t s LEU 144 Cb -0.15 -1.09 0.03 0.00 0.03 0.00 0.00 46.19 45.02 1k3t s LEU 144 CO 0.08 0.07 -0.16 -0.69 0.23 0.00 0.00 176.35 175.88 1k3t s VAL 145 N 0.64 2.05 0.22 -1.59 1.01 -1.26 -4.33 120.40 117.13 1k3t s VAL 145 Ca -0.14 -1.15 -0.32 0.00 0.00 0.00 0.00 61.98 60.37 1k3t s VAL 145 Cb -0.16 -1.97 -0.13 0.00 0.00 0.00 0.00 36.38 34.12 1k3t s VAL 145 CO 0.04 0.33 1.61 0.23 0.00 0.00 0.00 175.10 177.31 1k3t n MET 146 N 4.57 2.49 -0.57 2.72 0.00 -1.26 -0.81 117.12 124.25 1k3t n MET 146 Ca -0.18 0.89 0.00 0.00 0.00 0.00 0.00 57.70 58.41 1k3t n MET 146 Cb 0.47 -2.68 0.00 0.00 0.00 0.00 0.00 33.22 31.01 1k3t n MET 146 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1k3t n GLY 147 N 3.17 1.47 0.61 3.03 0.00 -1.26 -4.82 105.19 107.39 1k3t n GLY 147 Ca 0.14 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.15 1k3t n GLY 147 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1k3t n VAL 148 N -2.00 0.20 -0.68 1.61 0.31 0.01 -4.92 118.33 112.86 1k3t n VAL 148 Ca 0.00 0.21 0.03 0.00 -0.01 0.00 0.00 64.34 64.57 1k3t n VAL 148 Cb 0.00 -1.30 0.04 0.00 -0.91 0.00 0.00 33.84 31.67 1k3t n VAL 148 CO 0.00 0.00 0.00 -0.46 -1.32 0.00 0.00 176.83 175.05 1k3t n ASN 149 N -2.71 1.60 0.28 4.52 6.94 -0.69 -4.89 115.26 120.31 1k3t n ASN 149 Ca -0.01 -2.19 0.17 0.00 -0.02 0.00 0.00 54.58 52.53 1k3t n ASN 149 Cb 0.03 -0.15 0.90 0.00 -2.36 0.00 0.00 39.78 38.20 1k3t n ASN 149 CO 0.00 0.00 0.00 1.12 -1.03 0.00 0.00 177.26 177.35 1k3t h HIS 150 N 0.00 0.00 0.00 -2.53 2.07 -1.90 -0.31 115.15 112.48 1k3t h HIS 150 Ca 0.00 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.52 1k3t h HIS 150 Cb 0.82 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.80 1k3t h HIS 150 CO 0.01 0.00 0.00 0.72 -3.07 0.00 0.00 177.93 175.59 1k3t n HIS 151 N -2.73 0.00 0.75 6.12 8.25 -1.26 -2.14 115.22 124.22 1k3t n HIS 151 Ca -0.02 0.00 0.13 0.00 -0.26 0.00 0.00 57.72 57.57 1k3t n HIS 151 Cb 0.14 -0.14 0.45 0.00 1.12 0.00 0.00 29.99 31.56 1k3t n HIS 151 CO 0.00 0.00 0.00 0.39 0.64 0.00 0.00 176.34 177.37 1k3t n GLU 152 N -1.14 0.17 -1.65 -0.41 1.02 -0.13 -4.81 120.64 113.69 1k3t n GLU 152 Ca 0.15 0.13 -0.50 0.00 -0.02 0.00 0.00 57.16 56.92 1k3t n GLU 152 Cb 0.14 -1.69 -0.05 0.00 -0.02 0.00 0.00 31.44 29.82 1k3t n GLU 152 CO 0.00 0.00 0.00 0.98 1.18 0.00 0.00 177.13 179.29 1k3t n TYR 153 N -1.98 2.02 -3.88 -0.32 9.36 -0.91 -4.94 117.16 116.51 1k3t n TYR 153 Ca 0.06 0.37 -0.30 0.00 3.32 0.00 0.00 57.90 61.34 1k3t n TYR 153 Cb 0.40 -2.49 -0.15 0.00 -0.63 0.00 0.00 39.34 36.47 1k3t n TYR 153 CO 0.00 0.00 0.00 1.21 0.22 0.00 0.00 176.86 178.29 1k3t s ASN 154 N 1.80 4.25 0.36 2.98 3.04 -1.26 -5.05 114.94 121.06 1k3t s ASN 154 Ca 0.86 -1.73 0.25 0.00 0.04 0.00 0.00 52.86 52.28 1k3t s ASN 154 Cb -0.83 -1.21 1.23 0.00 -1.54 0.00 0.00 41.25 38.91 1k3t s ASN 154 CO 0.48 -0.36 1.33 -2.65 -3.04 0.00 0.00 177.10 172.85 1k3t n PRO 155 N 4.59 -0.04 -0.33 0.43 -0.02 -1.26 -0.85 135.00 137.53 1k3t n PRO 155 Ca -0.02 1.09 0.08 0.00 -2.02 0.00 0.00 63.50 62.63 1k3t n PRO 155 Cb 0.42 -2.10 0.20 0.00 -0.02 0.00 0.00 33.50 32.00 1k3t n PRO 155 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1k3t n SER 156 N -4.54 2.86 -0.12 2.55 2.88 -1.26 -4.30 113.62 111.69 1k3t n SER 156 Ca 0.34 -3.21 -0.16 0.00 -1.33 0.00 0.00 58.87 54.51 1k3t n SER 156 Cb 1.27 -0.50 -0.13 0.00 -0.75 0.00 0.00 64.21 64.09 1k3t n SER 156 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 1k3t n GLU 157 N -1.05 0.66 -3.46 -1.46 1.02 -0.23 -4.87 120.64 111.25 1k3t n GLU 157 Ca 0.20 0.11 -0.43 0.00 -0.02 0.00 0.00 57.16 57.02 1k3t n GLU 157 Cb 0.78 -1.53 -0.09 0.00 -0.02 0.00 0.00 31.44 30.59 1k3t n GLU 157 CO 0.00 0.00 0.00 -1.01 1.18 0.00 0.00 177.13 177.30 1k3t s HIS 158 N -2.51 3.26 -0.17 -0.32 3.76 -0.03 -4.82 115.29 114.46 1k3t s HIS 158 Ca -0.28 -1.01 0.05 0.00 -0.15 0.00 0.00 55.06 53.68 1k3t s HIS 158 Cb 0.08 -3.00 -0.14 0.00 1.11 0.00 0.00 32.58 30.63 1k3t s HIS 158 CO 0.67 -0.77 -0.09 0.72 -0.85 0.00 0.00 174.74 174.41 1k3t n HIS 159 N 5.12 0.00 -4.03 1.40 8.25 -1.26 -4.71 115.22 119.99 1k3t n HIS 159 Ca -0.12 0.00 -0.33 0.00 -0.26 0.00 0.00 57.72 57.01 1k3t n HIS 159 Cb 0.44 -0.72 -0.15 0.00 1.12 0.00 0.00 29.99 30.69 1k3t n HIS 159 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 1k3t s VAL 160 N -2.37 2.37 0.17 1.59 1.01 -1.26 -0.18 120.40 121.73 1k3t s VAL 160 Ca -0.19 -1.50 0.08 0.00 0.00 0.00 0.00 61.98 60.37 1k3t s VAL 160 Cb 0.06 -2.35 -0.04 0.00 0.00 0.00 0.00 36.38 34.05 1k3t s VAL 160 CO 0.48 0.01 -0.17 0.68 0.00 0.00 0.00 175.10 176.11 1k3t s VAL 161 N 1.16 1.74 -0.14 2.92 -7.23 -0.01 -3.84 120.40 115.00 1k3t s VAL 161 Ca -0.07 -1.94 -0.04 0.00 -1.81 0.00 0.00 61.98 58.12 1k3t s VAL 161 Cb -0.19 -1.84 -0.03 0.00 0.56 0.00 0.00 36.38 34.88 1k3t s VAL 161 CO -0.05 -0.38 -0.01 -0.55 -0.31 0.00 0.00 175.10 173.80 1k3t s SER 162 N -2.76 5.03 -0.05 4.85 0.15 0.08 0.85 113.70 121.85 1k3t s SER 162 Ca 0.16 -0.02 0.09 0.00 0.70 0.00 0.00 55.95 56.88 1k3t s SER 162 Cb -0.05 -1.70 0.36 0.00 -1.71 0.00 0.00 66.02 62.92 1k3t s SER 162 CO 0.06 0.23 1.20 -3.20 1.20 0.00 0.00 173.24 172.73 1k3t n ASN 163 N 3.12 2.54 0.00 5.45 5.15 -0.29 -1.01 115.26 130.23 1k3t n ASN 163 Ca -0.18 -2.20 0.00 0.00 -0.60 0.00 0.00 54.58 51.61 1k3t n ASN 163 Cb 0.53 -0.39 0.00 0.00 -0.53 0.00 0.00 39.78 39.38 1k3t n ASN 163 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1k3t n ALA 164 N 0.45 0.00 -2.53 5.20 0.00 -1.26 -4.79 120.51 117.59 1k3t n ALA 164 Ca 0.13 0.00 -0.25 0.00 0.00 0.00 0.00 53.44 53.32 1k3t n ALA 164 Cb 0.48 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.84 1k3t n ALA 164 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1k3t s SER 165 N -4.00 3.87 0.17 0.00 1.04 -1.26 -3.01 113.70 110.51 1k3t s SER 165 Ca 0.00 -1.07 -0.12 0.00 0.48 0.00 0.00 55.95 55.23 1k3t s SER 165 Cb 0.00 -0.42 0.08 0.00 0.10 0.00 0.00 66.02 65.78 1k3t s SER 165 CO 0.00 -0.15 1.75 0.00 0.98 0.00 0.00 173.24 175.82 1k3t h THR 167 N 0.81 1.24 -0.04 0.00 2.02 -1.97 -2.90 112.91 112.08 1k3t h THR 167 Ca 0.20 -0.69 -0.13 0.00 0.77 0.00 0.00 66.41 66.56 1k3t h THR 167 Cb 0.14 0.30 -0.01 0.00 -1.74 0.00 0.00 68.15 66.84 1k3t h THR 167 CO -0.02 0.29 -0.56 0.74 0.37 0.00 0.00 175.52 176.34 1k3t h THR 168 N 1.07 1.39 0.00 3.16 2.02 -1.73 -0.46 112.91 118.35 1k3t h THR 168 Ca 0.26 -1.89 0.00 0.00 0.77 0.00 0.00 66.41 65.55 1k3t h THR 168 Cb 0.13 1.98 0.00 0.00 -1.74 0.00 0.00 68.15 68.52 1k3t h THR 168 CO -0.03 0.55 0.00 0.78 0.37 0.00 0.00 175.52 177.19 1k3t h ASN 169 N 0.09 0.00 0.05 4.18 2.35 -1.12 0.21 115.58 121.35 1k3t h ASN 169 Ca -0.00 0.00 -0.22 0.00 -0.55 0.00 0.00 56.30 55.53 1k3t h ASN 169 Cb 1.01 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.37 1k3t h ASN 169 CO 0.08 0.00 -1.14 0.00 -1.65 0.00 0.00 177.43 174.72 1k3t h LEU 171 N -0.66 0.73 -0.27 0.00 6.46 -1.05 -3.33 115.31 117.19 1k3t h LEU 171 Ca -0.27 -0.72 0.06 0.00 -0.12 0.00 0.00 57.88 56.83 1k3t h LEU 171 Cb 1.48 -0.22 -0.06 0.00 -0.73 0.00 0.00 40.66 41.13 1k3t h LEU 171 CO -0.05 1.34 -0.12 0.00 -0.62 0.00 0.00 178.44 178.99 1k3t h ALA 172 N 0.40 0.10 -0.88 1.25 0.00 -1.18 -0.35 119.26 118.58 1k3t h ALA 172 Ca -0.09 0.10 0.14 0.00 0.00 0.00 0.00 54.91 55.07 1k3t h ALA 172 Cb 1.43 0.30 -0.07 0.00 0.00 0.00 0.00 17.79 19.46 1k3t h ALA 172 CO 0.15 -0.53 0.57 -1.35 0.00 0.00 0.00 179.25 178.09 1k3t h PRO 173 N -0.09 0.65 0.00 0.00 0.11 -1.76 0.48 132.00 131.40 1k3t h PRO 173 Ca 0.14 -0.04 -0.00 0.00 0.11 0.00 0.00 66.00 66.21 1k3t h PRO 173 Cb 0.30 -0.15 0.00 0.00 0.11 0.00 0.00 31.00 31.26 1k3t h PRO 173 CO -0.32 0.43 -0.00 0.82 -0.21 0.00 0.00 178.00 178.72 1k3t h ILE 174 N 0.67 1.35 -0.86 4.15 1.08 -1.22 -2.30 117.51 120.39 1k3t h ILE 174 Ca 0.44 -1.06 -0.01 0.00 -0.39 0.00 0.00 64.86 63.85 1k3t h ILE 174 Cb 0.73 2.07 -0.04 0.00 -3.07 0.00 0.00 36.82 36.51 1k3t h ILE 174 CO -0.20 0.27 0.51 0.58 -0.69 0.00 0.00 178.15 178.62 1k3t h VAL 175 N -0.45 1.24 -0.56 1.67 2.07 -0.80 -0.88 116.25 118.53 1k3t h VAL 175 Ca -0.00 -0.54 0.04 0.00 0.82 0.00 0.00 66.70 67.01 1k3t h VAL 175 Cb 0.45 0.04 -0.04 0.00 -1.52 0.00 0.00 31.29 30.22 1k3t h VAL 175 CO 0.00 0.26 0.31 -0.74 0.02 0.00 0.00 177.57 177.42 1k3t h HIS 176 N 1.19 0.58 -0.41 1.57 -0.00 0.06 -1.45 115.15 116.68 1k3t h HIS 176 Ca 0.31 0.02 -0.07 0.00 -0.00 0.00 0.00 60.37 60.63 1k3t h HIS 176 Cb -0.03 -0.18 -0.01 0.00 -0.00 0.00 0.00 27.41 27.18 1k3t h HIS 176 CO 0.00 0.31 -0.01 0.28 -0.00 0.00 0.00 177.93 178.51 1k3t h VAL 177 N 0.61 1.26 -0.88 5.26 2.07 -1.06 0.98 116.25 124.49 1k3t h VAL 177 Ca 0.24 -1.03 0.09 0.00 0.82 0.00 0.00 66.70 66.82 1k3t h VAL 177 Cb 0.09 1.11 -0.06 0.00 -1.52 0.00 0.00 31.29 30.91 1k3t h VAL 177 CO -0.13 0.35 0.57 -0.07 0.02 0.00 0.00 177.57 178.30 1k3t h LEU 178 N 0.57 0.79 0.01 2.57 3.38 -0.63 0.67 115.31 122.67 1k3t h LEU 178 Ca 0.12 0.02 -0.00 0.00 0.09 0.00 0.00 57.88 58.10 1k3t h LEU 178 Cb 0.49 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 41.10 1k3t h LEU 178 CO 0.02 0.48 -0.01 0.58 0.09 0.00 0.00 178.44 179.60 1k3t h VAL 179 N 0.88 1.54 -0.70 1.22 2.07 -1.12 -0.88 116.25 119.26 1k3t h VAL 179 Ca 0.40 -1.86 -0.06 0.00 0.82 0.00 0.00 66.70 66.01 1k3t h VAL 179 Cb 0.38 2.76 -0.03 0.00 -1.52 0.00 0.00 31.29 32.88 1k3t h VAL 179 CO -0.17 0.47 0.21 0.50 0.02 0.00 0.00 177.57 178.61 1k3t h LYS 180 N -0.84 1.08 0.00 1.57 3.64 -0.64 -1.57 116.57 119.82 1k3t h LYS 180 Ca -0.00 -0.23 0.00 0.00 -1.27 0.00 0.00 60.65 59.15 1k3t h LYS 180 Cb 0.78 -0.16 0.00 0.00 -0.41 0.00 0.00 32.23 32.44 1k3t h LYS 180 CO 0.00 0.93 0.00 0.39 -2.27 0.00 0.00 179.45 178.50 1k3t n GLU 181 N -4.26 0.88 -0.42 1.90 -0.58 0.21 -4.90 120.64 113.48 1k3t n GLU 181 Ca 0.06 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.80 1k3t n GLU 181 Cb 0.23 -1.50 0.00 0.00 -0.57 0.00 0.00 31.44 29.60 1k3t n GLU 181 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1k3t n GLY 182 N 0.82 0.76 0.22 0.62 0.00 -0.59 -4.96 105.19 102.05 1k3t n GLY 182 Ca 0.21 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 46.07 1k3t n GLY 182 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 1k3t h PHE 183 N 0.00 1.04 -2.35 1.61 0.04 -1.40 -3.44 116.94 112.45 1k3t h PHE 183 Ca 0.00 -0.45 0.25 0.00 2.80 0.00 0.00 57.97 60.57 1k3t h PHE 183 Cb 0.00 -0.16 -0.11 0.00 2.20 0.00 0.00 35.95 37.88 1k3t h PHE 183 CO 0.00 1.28 -0.68 0.41 -0.60 0.00 0.00 178.31 178.73 1k3t n GLY 184 N 0.66 -2.57 2.80 -1.45 0.00 -0.77 0.32 105.19 104.18 1k3t n GLY 184 Ca -0.07 -1.21 -0.29 0.00 0.00 0.00 0.00 46.02 44.45 1k3t n GLY 184 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1k3t s VAL 185 N -3.06 0.85 -0.03 1.61 1.01 -1.26 -2.95 120.40 116.56 1k3t s VAL 185 Ca 0.00 -0.78 -0.15 0.00 0.00 0.00 0.00 61.98 61.05 1k3t s VAL 185 Cb 0.00 -1.28 -0.32 0.00 0.00 0.00 0.00 36.38 34.78 1k3t s VAL 185 CO 0.00 -0.18 0.80 -0.61 0.00 0.00 0.00 175.10 175.11 1k3t h GLN 186 N 8.15 0.41 -2.40 2.72 4.15 -0.88 -3.46 115.11 123.80 1k3t h GLN 186 Ca -0.17 -0.70 -0.08 0.00 0.77 0.00 0.00 58.65 58.48 1k3t h GLN 186 Cb 1.10 0.26 -0.19 0.00 0.21 0.00 0.00 27.48 28.86 1k3t h GLN 186 CO 0.36 1.33 0.02 0.95 -1.93 0.00 0.00 178.83 179.56 1k3t s THR 187 N -2.54 0.02 -0.27 2.39 -4.23 -1.23 -4.80 115.64 104.97 1k3t s THR 187 Ca -0.14 -0.18 -0.24 0.00 -1.18 0.00 0.00 61.69 59.95 1k3t s THR 187 Cb 0.04 -0.86 0.07 0.00 1.34 0.00 0.00 72.50 73.09 1k3t s THR 187 CO 0.87 -0.10 0.71 -0.83 -0.54 0.00 0.00 174.62 174.73 1k3t s GLY 188 N -1.27 -0.55 -0.04 3.99 0.00 -0.60 -0.55 107.32 108.31 1k3t s GLY 188 Ca -0.12 2.06 0.04 0.00 0.00 0.00 0.00 44.72 46.70 1k3t s GLY 188 CO 0.08 1.81 -0.15 1.08 0.00 0.00 0.00 173.10 175.91 1k3t s LEU 189 N 0.50 1.90 -0.12 0.66 1.43 0.23 -2.84 118.68 120.44 1k3t s LEU 189 Ca -0.01 -0.31 0.01 0.00 -1.03 0.00 0.00 54.13 52.79 1k3t s LEU 189 Cb -0.05 -0.86 -0.01 0.00 0.03 0.00 0.00 46.19 45.30 1k3t s LEU 189 CO -0.01 0.14 -0.15 0.00 0.23 0.00 0.00 176.35 176.56 1k3t s MET 190 N 0.02 3.29 -0.14 1.70 0.23 -0.33 0.20 119.30 124.27 1k3t s MET 190 Ca -0.02 -0.71 0.03 0.00 -1.03 0.00 0.00 55.69 53.95 1k3t s MET 190 Cb -0.10 -2.57 0.01 0.00 -1.53 0.00 0.00 34.83 30.64 1k3t s MET 190 CO 0.01 0.24 -0.22 0.99 -2.03 0.00 0.00 175.02 174.01 1k3t s THR 191 N 0.28 2.05 -0.20 3.16 2.01 0.24 -0.89 115.64 122.29 1k3t s THR 191 Ca -0.11 -0.98 -0.07 0.00 0.31 0.00 0.00 61.69 60.85 1k3t s THR 191 Cb -0.16 -1.81 -0.04 0.00 0.01 0.00 0.00 72.50 70.51 1k3t s THR 191 CO 0.06 0.55 0.05 0.28 -0.69 0.00 0.00 174.62 174.87 1k3t s THR 192 N 0.79 4.53 -0.43 -0.82 -1.32 -0.59 0.11 115.64 117.92 1k3t s THR 192 Ca -0.08 -0.12 -0.14 0.00 -1.21 0.00 0.00 61.69 60.14 1k3t s THR 192 Cb -0.16 -3.06 0.04 0.00 -1.51 0.00 0.00 72.50 67.82 1k3t s THR 192 CO -0.01 0.43 0.32 -0.63 -2.21 0.00 0.00 174.62 172.52 1k3t s ILE 193 N 0.69 5.12 -0.24 5.08 1.01 -0.20 -1.35 121.20 131.32 1k3t s ILE 193 Ca 0.03 -0.86 -0.08 0.00 0.00 0.00 0.00 60.65 59.74 1k3t s ILE 193 Cb -0.13 -3.94 -0.03 0.00 0.01 0.00 0.00 42.46 38.37 1k3t s ILE 193 CO 0.02 -0.40 0.09 -1.00 0.00 0.00 0.00 174.94 173.64 1k3t s HIS 194 N 1.64 3.14 0.83 3.97 3.76 -0.65 -1.28 115.29 126.69 1k3t s HIS 194 Ca 0.04 -0.23 -0.13 0.00 -0.15 0.00 0.00 55.06 54.60 1k3t s HIS 194 Cb -0.21 -2.23 0.09 0.00 1.11 0.00 0.00 32.58 31.35 1k3t s HIS 194 CO 0.08 -0.22 1.19 -1.12 -0.85 0.00 0.00 174.74 173.82 1k3t s SER 195 N 1.38 3.48 0.82 1.40 0.01 -1.24 -0.40 113.70 119.16 1k3t s SER 195 Ca 0.06 2.33 -0.11 0.00 1.31 0.00 0.00 55.95 59.53 1k3t s SER 195 Cb -0.15 -2.58 0.08 0.00 0.21 0.00 0.00 66.02 63.58 1k3t s SER 195 CO 0.04 -2.74 1.09 -0.72 0.41 0.00 0.00 173.24 171.33 1k3t s TYR 196 N -2.25 2.60 0.37 2.43 -0.85 -0.85 -4.76 117.35 114.05 1k3t s TYR 196 Ca 0.72 1.31 0.04 0.00 -0.52 0.00 0.00 57.07 58.61 1k3t s TYR 196 Cb -0.27 -3.10 -0.05 0.00 0.38 0.00 0.00 41.96 38.92 1k3t s TYR 196 CO 0.52 -1.97 0.07 0.95 -1.52 0.00 0.00 175.55 173.60 1k3t s THR 197 N -3.00 1.07 -0.55 -3.49 -4.23 -1.26 -4.79 115.64 99.38 1k3t s THR 197 Ca 0.62 -2.00 0.18 0.00 -1.18 0.00 0.00 61.69 59.31 1k3t s THR 197 Cb -0.16 -2.61 0.18 0.00 1.34 0.00 0.00 72.50 71.24 1k3t s THR 197 CO 0.56 0.00 1.55 0.00 -0.54 0.00 0.00 174.62 176.19 1k3t n ALA 198 N -0.83 1.37 1.17 3.99 0.00 -1.26 -1.46 120.51 123.48 1k3t n ALA 198 Ca -0.05 0.09 0.13 0.00 0.00 0.00 0.00 53.44 53.61 1k3t n ALA 198 Cb 0.66 -1.28 0.46 0.00 0.00 0.00 0.00 19.45 19.28 1k3t n ALA 198 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1k3t n THR 199 N -2.01 0.00 -1.87 0.00 -2.24 -1.26 -4.85 114.28 102.05 1k3t n THR 199 Ca 0.01 -0.04 -0.30 0.00 -2.27 0.00 0.00 64.05 61.45 1k3t n THR 199 Cb 0.12 0.02 0.20 0.00 -2.10 0.00 0.00 70.33 68.57 1k3t n THR 199 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 1k3t s GLN 200 N -2.75 0.40 -0.03 -0.78 -0.21 -0.54 -4.98 119.66 110.77 1k3t s GLN 200 Ca 0.19 -0.42 0.03 0.00 0.02 0.00 0.00 55.36 55.18 1k3t s GLN 200 Cb 0.19 -1.82 0.00 0.00 1.00 0.00 0.00 33.01 32.38 1k3t s GLN 200 CO 0.57 -2.58 -0.10 0.15 -2.12 0.00 0.00 175.29 171.21 1k3t s LYS 201 N -5.88 1.05 0.10 2.91 3.01 -1.26 -5.01 119.74 114.66 1k3t s LYS 201 Ca 0.75 -0.34 -0.27 0.00 -1.01 0.00 0.00 55.97 55.09 1k3t s LYS 201 Cb -0.04 -0.97 -0.11 0.00 -1.01 0.00 0.00 37.83 35.71 1k3t s LYS 201 CO 0.53 0.13 1.66 1.79 0.51 0.00 0.00 175.35 179.97 1k3t h THR 202 N 5.35 0.52 -1.96 2.17 1.35 -1.95 -0.63 112.91 117.76 1k3t h THR 202 Ca -0.33 0.00 -0.59 0.00 -0.55 0.00 0.00 66.41 64.94 1k3t h THR 202 Cb 1.17 0.52 -0.11 0.00 -1.73 0.00 0.00 68.15 67.99 1k3t h THR 202 CO 0.49 0.00 -0.64 0.68 -0.25 0.00 0.00 175.52 175.79 1k3t s VAL 203 N -6.09 2.59 0.12 6.82 -7.23 -1.26 -4.06 120.40 111.29 1k3t s VAL 203 Ca -0.15 -2.05 -0.35 0.00 -1.81 0.00 0.00 61.98 57.62 1k3t s VAL 203 Cb 0.07 -2.73 -0.14 0.00 0.56 0.00 0.00 36.38 34.13 1k3t s VAL 203 CO 0.65 -0.23 1.56 0.47 -0.31 0.00 0.00 175.10 177.25 1k3t n ASP 204 N -0.89 2.85 0.00 4.85 8.00 -1.26 -4.38 116.55 125.71 1k3t n ASP 204 Ca -0.05 1.08 0.00 0.00 0.71 0.00 0.00 54.79 56.53 1k3t n ASP 204 Cb 0.62 -1.37 0.00 0.00 -0.02 0.00 0.00 41.12 40.35 1k3t n ASP 204 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1k3t n GLY 205 N 3.35 5.53 3.18 0.44 0.00 -0.66 -4.94 105.19 112.08 1k3t n GLY 205 Ca 0.18 -1.14 -0.34 0.00 0.00 0.00 0.00 46.02 44.73 1k3t n GLY 205 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1k3t s VAL 206 N 2.35 2.53 -0.44 1.61 1.01 -1.26 -4.81 120.40 121.38 1k3t s VAL 206 Ca 0.00 -0.90 0.05 0.00 0.00 0.00 0.00 61.98 61.13 1k3t s VAL 206 Cb 0.00 -2.16 0.18 0.00 0.00 0.00 0.00 36.38 34.40 1k3t s VAL 206 CO 0.00 0.41 0.38 -0.24 0.00 0.00 0.00 175.10 175.65 1k3t n SER 207 N 4.66 -0.02 -0.30 3.32 2.88 -1.26 -4.93 113.62 117.97 1k3t n SER 207 Ca -0.19 -2.50 0.10 0.00 -1.33 0.00 0.00 58.87 54.94 1k3t n SER 207 Cb 0.49 -0.58 0.26 0.00 -0.75 0.00 0.00 64.21 63.63 1k3t n SER 207 CO 0.00 0.00 0.00 0.58 -1.23 0.00 0.00 175.04 174.39 1k3t h VAL 208 N 4.31 0.65 0.00 2.46 2.07 -1.96 -2.46 116.25 121.32 1k3t h VAL 208 Ca 0.24 -0.20 0.00 0.00 0.82 0.00 0.00 66.70 67.56 1k3t h VAL 208 Cb 0.89 0.03 0.00 0.00 -1.52 0.00 0.00 31.29 30.68 1k3t h VAL 208 CO 0.42 0.11 -0.26 0.11 0.02 0.00 0.00 177.57 177.97 1k3t h LYS 209 N 0.58 0.00 -2.82 1.57 1.79 -2.03 -3.39 116.57 112.26 1k3t h LYS 209 Ca 0.51 0.00 -0.59 0.00 -2.18 0.00 0.00 60.65 58.38 1k3t h LYS 209 Cb 0.80 0.00 -0.40 0.00 -1.58 0.00 0.00 32.23 31.06 1k3t h LYS 209 CO -0.41 0.00 -0.79 0.34 -1.08 0.00 0.00 179.45 177.50 1k3t s ASP 210 N -4.68 3.34 0.18 0.86 2.15 -0.93 -5.01 116.67 112.58 1k3t s ASP 210 Ca 0.08 -2.31 -0.12 0.00 0.43 0.00 0.00 52.55 50.63 1k3t s ASP 210 Cb 0.12 -0.69 0.14 0.00 -0.30 0.00 0.00 42.92 42.18 1k3t s ASP 210 CO 0.66 -0.30 1.81 -0.50 -0.17 0.00 0.00 175.17 176.66 1k3t h TRP 211 N 7.00 0.59 -0.24 -5.34 4.06 -1.77 -2.06 115.95 118.18 1k3t h TRP 211 Ca 0.01 0.02 -0.12 0.00 2.06 0.00 0.00 58.89 60.86 1k3t h TRP 211 Cb 0.96 -0.18 -0.01 0.00 -1.00 0.00 0.00 29.16 28.92 1k3t h TRP 211 CO 0.45 0.32 -0.34 0.00 -3.56 0.00 0.00 178.44 175.31 1k3t h ARG 212 N 0.62 0.52 -0.01 0.49 3.08 -1.89 -2.81 114.38 114.37 1k3t h ARG 212 Ca 0.23 -0.23 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1k3t h ARG 212 Cb 0.07 -0.01 -0.00 0.00 0.08 0.00 0.00 29.97 30.11 1k3t h ARG 212 CO -0.12 0.79 0.02 0.78 -1.07 0.00 0.00 179.97 180.37 1k3t h GLY 213 N 1.05 0.00 1.37 0.04 0.00 -1.67 -2.01 103.07 101.85 1k3t h GLY 213 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.38 1k3t h GLY 213 CO 0.07 0.00 -0.35 0.61 0.00 0.00 0.00 176.54 176.86 1k3t n GLY 214 N -1.23 -1.38 3.79 4.60 0.00 -0.88 -4.56 105.19 105.53 1k3t n GLY 214 Ca -0.03 -0.24 -0.30 0.00 0.00 0.00 0.00 46.02 45.45 1k3t n GLY 214 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1k3t s ARG 215 N -3.04 2.13 -0.17 1.61 1.81 -0.76 -1.65 118.95 118.89 1k3t s ARG 215 Ca 0.11 0.79 -0.32 0.00 -1.72 0.00 0.00 55.73 54.59 1k3t s ARG 215 Cb 0.17 -1.91 -0.10 0.00 -0.45 0.00 0.00 34.95 32.66 1k3t s ARG 215 CO 0.65 -1.62 2.05 0.00 -0.68 0.00 0.00 175.30 175.70 1k3t n ALA 216 N -3.46 1.22 0.09 2.13 0.00 -1.26 -4.50 120.51 114.74 1k3t n ALA 216 Ca 0.07 0.06 -0.06 0.00 0.00 0.00 0.00 53.44 53.51 1k3t n ALA 216 Cb 0.55 -2.64 0.01 0.00 0.00 0.00 0.00 19.45 17.37 1k3t n ALA 216 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1k3t h ALA 217 N 11.62 0.59 -0.09 0.00 0.00 -1.25 -3.20 119.26 126.93 1k3t h ALA 217 Ca -0.42 -0.74 0.00 0.00 0.00 0.00 0.00 54.91 53.75 1k3t h ALA 217 Cb 1.27 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.95 1k3t h ALA 217 CO 0.97 0.98 0.00 0.00 0.00 0.00 0.00 179.25 181.20 1k3t n ALA 218 N -2.41 2.56 -1.07 0.00 0.00 -1.26 -3.82 120.51 114.50 1k3t n ALA 218 Ca -0.02 -0.40 0.01 0.00 0.00 0.00 0.00 53.44 53.04 1k3t n ALA 218 Cb 0.80 -1.18 0.02 0.00 0.00 0.00 0.00 19.45 19.08 1k3t n ALA 218 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 1k3t n VAL 219 N -0.04 0.43 -4.24 0.00 0.24 -1.25 -4.76 118.33 108.71 1k3t n VAL 219 Ca 0.17 -0.48 -0.14 0.00 -2.04 0.00 0.00 64.34 61.85 1k3t n VAL 219 Cb 0.26 0.62 -0.10 0.00 -1.47 0.00 0.00 33.84 33.15 1k3t n VAL 219 CO 0.00 0.00 0.00 0.20 -2.14 0.00 0.00 176.83 174.89 1k3t s ASN 220 N -0.81 1.69 -0.31 -1.34 0.01 -1.21 -5.08 114.94 107.89 1k3t s ASN 220 Ca 0.04 -1.02 -0.11 0.00 -0.71 0.00 0.00 52.86 51.06 1k3t s ASN 220 Cb 0.03 0.01 -0.03 0.00 0.41 0.00 0.00 41.25 41.68 1k3t s ASN 220 CO 0.00 -0.36 0.19 -0.63 -1.51 0.00 0.00 177.10 174.80 1k3t s ILE 221 N -3.38 5.06 -0.26 0.60 1.01 -1.26 -4.14 121.20 118.83 1k3t s ILE 221 Ca 0.16 -0.13 0.02 0.00 0.00 0.00 0.00 60.65 60.70 1k3t s ILE 221 Cb 0.03 -3.51 0.06 0.00 0.01 0.00 0.00 42.46 39.05 1k3t s ILE 221 CO -0.00 0.12 -0.08 -0.63 0.00 0.00 0.00 174.94 174.35 1k3t s ILE 222 N 1.70 2.01 0.56 2.92 1.01 -0.09 -4.93 121.20 124.39 1k3t s ILE 222 Ca 0.06 -1.60 -0.19 0.00 0.00 0.00 0.00 60.65 58.92 1k3t s ILE 222 Cb -0.17 -2.19 -0.05 0.00 0.01 0.00 0.00 42.46 40.07 1k3t s ILE 222 CO 0.09 -0.10 1.18 -2.84 0.00 0.00 0.00 174.94 173.26 1k3t s PRO 223 N 1.16 3.18 -0.21 2.79 0.02 -1.26 -0.07 135.00 140.61 1k3t s PRO 223 Ca -0.06 1.74 -0.17 0.00 0.02 0.00 0.00 61.00 62.53 1k3t s PRO 223 Cb -0.20 -1.99 0.06 0.00 0.02 0.00 0.00 34.50 32.39 1k3t s PRO 223 CO -0.06 -1.02 0.54 0.45 -0.33 0.00 0.00 177.00 176.59 1k3t s SER 224 N -1.64 -0.61 0.96 2.53 0.15 0.22 -4.70 113.70 110.61 1k3t s SER 224 Ca 0.75 1.12 -0.12 0.00 0.70 0.00 0.00 55.95 58.40 1k3t s SER 224 Cb -0.28 1.10 0.17 0.00 -1.71 0.00 0.00 66.02 65.30 1k3t s SER 224 CO 0.31 -0.20 1.09 0.42 1.20 0.00 0.00 173.24 176.06 1k3t s THR 225 N 0.63 2.39 0.01 6.45 -4.23 -1.26 0.16 115.64 119.79 1k3t s THR 225 Ca -0.03 0.13 -0.28 0.00 -1.18 0.00 0.00 61.69 60.33 1k3t s THR 225 Cb -0.05 -2.42 0.08 0.00 1.34 0.00 0.00 72.50 71.44 1k3t s THR 225 CO -0.04 -0.17 0.68 0.28 -0.54 0.00 0.00 174.62 174.84 1k3t s THR 226 N -2.77 0.00 -1.85 3.99 -1.32 -1.26 -4.56 115.64 107.87 1k3t s THR 226 Ca 0.65 0.00 0.16 0.00 -1.21 0.00 0.00 61.69 61.29 1k3t s THR 226 Cb -0.21 -1.00 0.22 0.00 -1.51 0.00 0.00 72.50 70.00 1k3t s THR 226 CO 0.59 0.00 1.12 0.61 -2.21 0.00 0.00 174.62 174.73 1k3t n GLY 227 N 0.43 0.89 0.31 6.08 0.00 -1.26 -4.58 105.19 107.06 1k3t n GLY 227 Ca -0.17 -0.49 0.01 0.00 0.00 0.00 0.00 46.02 45.36 1k3t n GLY 227 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1k3t h ALA 228 N 3.14 1.15 -0.13 4.61 0.00 -1.96 0.30 119.26 126.37 1k3t h ALA 228 Ca 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 54.91 54.73 1k3t h ALA 228 Cb 0.73 -0.20 0.01 0.00 0.00 0.00 0.00 17.79 18.32 1k3t h ALA 228 CO 0.00 0.22 -0.65 0.00 0.00 0.00 0.00 179.25 178.82 1k3t h ALA 229 N 1.41 0.25 -0.60 0.00 0.00 -1.90 -1.95 119.26 116.47 1k3t h ALA 229 Ca 0.37 -0.56 -0.09 0.00 0.00 0.00 0.00 54.91 54.63 1k3t h ALA 229 Cb 0.22 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.97 1k3t h ALA 229 CO -0.19 0.54 0.02 0.87 0.00 0.00 0.00 179.25 180.49 1k3t h LYS 230 N 0.34 1.06 -0.40 0.00 1.57 -1.61 -2.20 116.57 115.33 1k3t h LYS 230 Ca -0.04 -0.33 0.10 0.00 -1.87 0.00 0.00 60.65 58.51 1k3t h LYS 230 Cb 1.29 -0.10 -0.02 0.00 0.08 0.00 0.00 32.23 33.48 1k3t h LYS 230 CO 0.13 1.03 0.28 0.00 -0.57 0.00 0.00 179.45 180.32 1k3t h ALA 231 N 0.99 2.28 -0.06 3.86 0.00 -0.22 0.66 119.26 126.76 1k3t h ALA 231 Ca 0.17 -0.01 0.02 0.00 0.00 0.00 0.00 54.91 55.09 1k3t h ALA 231 Cb 0.54 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.33 1k3t h ALA 231 CO 0.03 -0.39 0.19 0.28 0.00 0.00 0.00 179.25 179.36 1k3t h VAL 232 N 0.07 0.15 0.00 0.00 2.07 -0.69 -1.56 116.25 116.29 1k3t h VAL 232 Ca 0.19 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.70 1k3t h VAL 232 Cb 0.65 0.83 -0.00 0.00 -1.52 0.00 0.00 31.29 31.25 1k3t h VAL 232 CO -0.01 0.00 -0.04 1.23 0.02 0.00 0.00 177.57 178.77 1k3t h GLY 233 N 0.00 0.00 1.92 2.17 0.00 -1.00 -0.53 103.07 105.62 1k3t h GLY 233 Ca 0.03 0.00 -0.21 0.00 0.00 0.00 0.00 47.33 47.15 1k3t h GLY 233 CO -0.00 0.00 -0.99 -0.33 0.00 0.00 0.00 176.54 175.22 1k3t h MET 234 N 0.00 0.06 0.00 4.80 2.86 -1.46 -3.10 114.93 118.09 1k3t h MET 234 Ca -0.00 -0.10 -0.06 0.00 -2.06 0.00 0.00 59.70 57.48 1k3t h MET 234 Cb 0.26 0.03 -0.01 0.00 0.06 0.00 0.00 31.60 31.94 1k3t h MET 234 CO 0.00 1.00 -1.99 0.28 1.06 0.00 0.00 176.91 177.27 1k3t n VAL 235 N -3.45 0.24 -3.43 -2.22 0.31 -1.03 -4.65 118.33 104.10 1k3t n VAL 235 Ca -0.02 -0.52 -0.26 0.00 -0.01 0.00 0.00 64.34 63.53 1k3t n VAL 235 Cb 0.91 -0.06 -0.09 0.00 -0.91 0.00 0.00 33.84 33.69 1k3t n VAL 235 CO 0.00 0.00 0.00 -0.38 -1.32 0.00 0.00 176.83 175.13 1k3t n ILE 236 N -2.29 -0.30 -0.27 2.52 5.41 -0.24 -4.60 119.36 119.60 1k3t n ILE 236 Ca -0.09 -3.97 0.25 0.00 1.00 0.00 0.00 62.75 59.95 1k3t n ILE 236 Cb 0.63 -1.86 0.61 0.00 -0.71 0.00 0.00 39.64 38.31 1k3t n ILE 236 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 176.55 175.90 1k3t h PRO 237 N 5.06 0.22 -0.01 0.38 0.11 -1.77 0.20 132.00 136.19 1k3t h PRO 237 Ca 0.19 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.29 1k3t h PRO 237 Cb 0.85 -0.05 -0.00 0.00 0.11 0.00 0.00 31.00 31.91 1k3t h PRO 237 CO 0.49 0.15 0.05 0.66 -0.21 0.00 0.00 178.00 179.14 1k3t h SER 238 N 0.23 0.00 -0.08 -2.05 4.64 -1.94 -1.87 113.55 112.47 1k3t h SER 238 Ca 0.51 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.83 1k3t h SER 238 Cb 1.61 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.70 1k3t h SER 238 CO -0.14 0.00 0.00 0.35 -0.87 0.00 0.00 176.83 176.17 1k3t n THR 239 N -3.27 0.09 -1.75 2.95 -2.24 0.06 -4.87 114.28 105.25 1k3t n THR 239 Ca -0.03 -0.32 -0.42 0.00 -2.27 0.00 0.00 64.05 61.02 1k3t n THR 239 Cb 0.12 0.54 -0.00 0.00 -2.10 0.00 0.00 70.33 68.89 1k3t n THR 239 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1k3t n GLN 240 N 0.35 2.50 0.00 -0.78 6.02 -0.71 -1.29 117.38 123.48 1k3t n GLN 240 Ca 0.18 0.88 0.00 0.00 -0.01 0.00 0.00 57.00 58.04 1k3t n GLN 240 Cb 0.37 -2.56 0.00 0.00 1.02 0.00 0.00 30.24 29.07 1k3t n GLN 240 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1k3t n GLY 241 N 0.69 2.61 0.27 1.08 0.00 -1.26 -4.82 105.19 103.76 1k3t n GLY 241 Ca 0.03 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.13 1k3t n GLY 241 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1k3t n LYS 242 N -1.96 1.56 -3.88 1.61 5.02 -0.41 -4.98 118.16 115.12 1k3t n LYS 242 Ca 0.00 -0.58 -0.15 0.00 -2.02 0.00 0.00 58.31 55.56 1k3t n LYS 242 Cb 0.00 -1.31 -0.15 0.00 -0.02 0.00 0.00 35.03 33.55 1k3t n LYS 242 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1k3t s LEU 243 N -2.34 1.40 0.35 -0.35 1.02 -1.24 -1.56 118.68 115.96 1k3t s LEU 243 Ca 0.12 -0.00 -0.06 0.00 0.02 0.00 0.00 54.13 54.20 1k3t s LEU 243 Cb 0.14 -0.12 0.02 0.00 0.02 0.00 0.00 46.19 46.24 1k3t s LEU 243 CO 0.52 -0.07 0.57 0.28 0.02 0.00 0.00 176.35 177.66 1k3t s THR 244 N 0.70 0.00 0.00 5.49 -1.32 -1.13 -3.74 115.64 115.64 1k3t s THR 244 Ca -0.06 -1.42 -0.01 0.00 -1.21 0.00 0.00 61.69 58.99 1k3t s THR 244 Cb -0.09 -2.70 0.00 0.00 -1.51 0.00 0.00 72.50 68.20 1k3t s THR 244 CO -0.02 0.00 0.02 0.61 -2.21 0.00 0.00 174.62 173.03 1k3t n GLY 245 N -0.55 0.74 3.48 6.08 0.00 -1.26 -1.19 105.19 112.49 1k3t n GLY 245 Ca -0.02 -0.85 -0.10 0.00 0.00 0.00 0.00 46.02 45.05 1k3t n GLY 245 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 1k3t s MET 246 N -2.00 1.43 0.16 1.61 0.23 -0.07 -4.14 119.30 116.52 1k3t s MET 246 Ca 0.01 -1.31 0.11 0.00 -1.03 0.00 0.00 55.69 53.46 1k3t s MET 246 Cb -0.00 0.42 -0.04 0.00 -1.53 0.00 0.00 34.83 33.68 1k3t s MET 246 CO 0.00 -0.56 -0.24 0.45 -2.03 0.00 0.00 175.02 172.63 1k3t s SER 247 N -3.04 3.23 -0.15 -1.18 0.15 0.12 -1.55 113.70 111.29 1k3t s SER 247 Ca 0.25 -0.81 0.00 0.00 0.70 0.00 0.00 55.95 56.09 1k3t s SER 247 Cb 0.01 -0.22 0.03 0.00 -1.71 0.00 0.00 66.02 64.13 1k3t s SER 247 CO 0.08 0.12 -0.12 -0.36 1.20 0.00 0.00 173.24 174.17 1k3t s PHE 248 N -1.47 2.04 -0.15 3.44 0.08 -0.46 -0.61 117.98 120.85 1k3t s PHE 248 Ca 0.17 -1.18 -0.20 0.00 0.12 0.00 0.00 56.93 55.84 1k3t s PHE 248 Cb -0.09 -1.51 -0.03 0.00 -0.57 0.00 0.00 43.02 40.82 1k3t s PHE 248 CO 0.08 -0.65 0.56 1.03 -0.10 0.00 0.00 175.22 176.14 1k3t s ARG 249 N 1.53 4.28 0.19 0.44 0.52 0.90 -1.64 118.95 125.17 1k3t s ARG 249 Ca 0.04 0.54 0.08 0.00 -0.52 0.00 0.00 55.73 55.87 1k3t s ARG 249 Cb -0.13 -3.51 -0.04 0.00 0.52 0.00 0.00 34.95 31.78 1k3t s ARG 249 CO -0.10 -0.04 -0.17 0.14 0.02 0.00 0.00 175.30 175.15 1k3t s VAL 250 N 1.26 1.84 -1.13 3.52 -7.23 0.47 -0.92 120.40 118.21 1k3t s VAL 250 Ca 0.28 -2.08 -0.08 0.00 -1.81 0.00 0.00 61.98 58.30 1k3t s VAL 250 Cb -0.16 -1.96 -0.06 0.00 0.56 0.00 0.00 36.38 34.76 1k3t s VAL 250 CO 0.11 -0.44 2.36 -2.65 -0.31 0.00 0.00 175.10 174.17 1k3t n PRO 251 N -0.05 2.55 -4.76 4.82 -0.02 -1.26 -3.17 135.00 133.11 1k3t n PRO 251 Ca -0.10 -1.71 -0.30 0.00 -2.02 0.00 0.00 63.50 59.36 1k3t n PRO 251 Cb 0.59 -2.59 -0.14 0.00 -0.02 0.00 0.00 33.50 31.34 1k3t n PRO 251 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 1k3t s THR 252 N 3.10 2.42 0.20 3.45 -4.23 -1.26 -4.98 115.64 114.34 1k3t s THR 252 Ca 0.49 -1.33 -0.11 0.00 -1.18 0.00 0.00 61.69 59.56 1k3t s THR 252 Cb 0.13 -1.99 0.12 0.00 1.34 0.00 0.00 72.50 72.10 1k3t s THR 252 CO -0.04 0.33 1.82 1.55 -0.54 0.00 0.00 174.62 177.75 1k3t h PRO 253 N 4.61 0.69 -2.90 3.99 0.13 -1.91 -2.25 132.00 134.35 1k3t h PRO 253 Ca -0.47 -0.04 0.03 0.00 -0.87 0.00 0.00 66.00 64.65 1k3t h PRO 253 Cb 1.15 -0.15 -0.10 0.00 0.13 0.00 0.00 31.00 32.03 1k3t h PRO 253 CO 0.45 0.45 0.26 0.34 -0.23 0.00 0.00 178.00 179.27 1k3t s ASP 254 N -5.63 -0.42 0.00 1.44 2.15 -1.26 -4.47 116.67 108.47 1k3t s ASP 254 Ca -0.13 -0.24 0.00 0.00 0.43 0.00 0.00 52.55 52.61 1k3t s ASP 254 Cb 0.15 0.62 0.00 0.00 -0.30 0.00 0.00 42.92 43.39 1k3t s ASP 254 CO 0.76 -1.07 0.00 0.52 -0.17 0.00 0.00 175.17 175.20 1k3t n VAL 255 N -0.40 -0.43 -4.35 1.11 0.31 -1.26 -4.86 118.33 108.45 1k3t n VAL 255 Ca -0.11 0.00 -0.18 0.00 -0.01 0.00 0.00 64.34 64.04 1k3t n VAL 255 Cb 0.62 -0.43 -0.10 0.00 -0.91 0.00 0.00 33.84 33.02 1k3t n VAL 255 CO 0.00 0.00 0.00 -0.44 -1.32 0.00 0.00 176.83 175.07 1k3t s SER 256 N -0.36 1.50 -0.09 4.52 0.01 0.82 -3.64 113.70 116.46 1k3t s SER 256 Ca 0.00 -1.40 -0.11 0.00 1.31 0.00 0.00 55.95 55.76 1k3t s SER 256 Cb 0.00 0.12 0.03 0.00 0.21 0.00 0.00 66.02 66.38 1k3t s SER 256 CO 0.00 -0.71 0.29 0.54 0.41 0.00 0.00 173.24 173.76 1k3t s VAL 257 N -3.63 0.01 -0.13 3.43 0.11 -0.41 -1.46 120.40 118.32 1k3t s VAL 257 Ca 0.37 -0.09 -0.04 0.00 -2.93 0.00 0.00 61.98 59.29 1k3t s VAL 257 Cb 0.08 -0.44 -0.03 0.00 -1.53 0.00 0.00 36.38 34.46 1k3t s VAL 257 CO 0.14 -0.05 0.02 -0.69 -3.33 0.00 0.00 175.10 171.19 1k3t s VAL 258 N -0.09 4.41 -0.35 2.04 1.01 0.12 -1.03 120.40 126.50 1k3t s VAL 258 Ca -0.02 -0.19 0.04 0.00 0.00 0.00 0.00 61.98 61.81 1k3t s VAL 258 Cb -0.03 -2.91 0.10 0.00 0.00 0.00 0.00 36.38 33.54 1k3t s VAL 258 CO 0.01 0.54 0.07 -0.62 0.00 0.00 0.00 175.10 175.10 1k3t s ASP 259 N -0.27 4.75 -0.27 3.32 2.15 0.30 -1.74 116.67 124.92 1k3t s ASP 259 Ca 0.07 -2.22 -0.12 0.00 0.43 0.00 0.00 52.55 50.70 1k3t s ASP 259 Cb -0.12 -1.63 -0.05 0.00 -0.30 0.00 0.00 42.92 40.82 1k3t s ASP 259 CO 0.02 -0.37 0.25 -0.22 -0.17 0.00 0.00 175.17 174.68 1k3t s LEU 260 N 0.82 4.03 -0.13 -1.34 2.96 -0.02 -0.59 118.68 124.41 1k3t s LEU 260 Ca 0.11 0.10 -0.01 0.00 -0.22 0.00 0.00 54.13 54.11 1k3t s LEU 260 Cb -0.20 -2.22 -0.02 0.00 0.50 0.00 0.00 46.19 44.25 1k3t s LEU 260 CO -0.07 -0.09 -0.09 -0.89 -1.32 0.00 0.00 176.35 173.89 1k3t s THR 261 N 1.81 3.42 0.07 3.68 2.01 0.13 -1.01 115.64 125.75 1k3t s THR 261 Ca 0.10 -0.54 -0.20 0.00 0.31 0.00 0.00 61.69 61.36 1k3t s THR 261 Cb -0.16 -2.45 0.05 0.00 0.01 0.00 0.00 72.50 69.95 1k3t s THR 261 CO 0.10 0.52 0.48 0.72 -0.69 0.00 0.00 174.62 175.75 1k3t s PHE 262 N 0.20 -0.35 -0.27 4.92 -0.71 -0.29 0.77 117.98 122.24 1k3t s PHE 262 Ca -0.05 0.28 -0.09 0.00 -1.04 0.00 0.00 56.93 56.03 1k3t s PHE 262 Cb -0.15 0.32 -0.04 0.00 -1.21 0.00 0.00 43.02 41.94 1k3t s PHE 262 CO 0.04 -0.66 0.13 0.95 -1.34 0.00 0.00 175.22 174.35 1k3t s THR 263 N -2.86 4.82 0.69 -4.49 -4.23 0.29 -1.76 115.64 108.09 1k3t s THR 263 Ca -0.03 -0.02 -0.14 0.00 -1.18 0.00 0.00 61.69 60.32 1k3t s THR 263 Cb -0.00 -3.29 0.02 0.00 1.34 0.00 0.00 72.50 70.57 1k3t s THR 263 CO -0.05 0.28 1.11 0.00 -0.54 0.00 0.00 174.62 175.42 1k3t s ALA 264 N 1.69 2.39 -1.98 3.99 0.00 -0.66 -0.29 121.76 126.90 1k3t s ALA 264 Ca 0.07 0.51 0.29 0.00 0.00 0.00 0.00 51.96 52.83 1k3t s ALA 264 Cb -0.16 -3.32 1.22 0.00 0.00 0.00 0.00 23.12 20.86 1k3t s ALA 264 CO 0.07 -1.43 1.84 0.00 0.00 0.00 0.00 175.76 176.25 1k3t n ALA 265 N -2.68 2.74 -2.39 0.00 0.00 0.15 -4.52 120.51 113.81 1k3t n ALA 265 Ca 0.10 -0.33 -0.08 0.00 0.00 0.00 0.00 53.44 53.13 1k3t n ALA 265 Cb 0.52 -1.29 -0.08 0.00 0.00 0.00 0.00 19.45 18.60 1k3t n ALA 265 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.50 176.52 1k3t s ARG 266 N -2.26 0.80 0.37 0.00 1.70 -1.15 -4.97 118.95 113.44 1k3t s ARG 266 Ca 0.34 -1.09 -0.28 0.00 -0.47 0.00 0.00 55.73 54.23 1k3t s ARG 266 Cb 0.21 0.30 -0.11 0.00 -0.57 0.00 0.00 34.95 34.77 1k3t s ARG 266 CO 0.42 -0.23 1.51 -0.51 -1.08 0.00 0.00 175.30 175.41 1k3t s ASP 267 N -2.90 6.32 0.00 -2.89 1.01 -1.26 -4.84 116.67 112.10 1k3t s ASP 267 Ca 0.08 3.06 0.00 0.00 0.71 0.00 0.00 52.55 56.40 1k3t s ASP 267 Cb 0.06 -2.67 0.00 0.00 1.01 0.00 0.00 42.92 41.32 1k3t s ASP 267 CO -0.09 -0.90 0.00 1.07 0.21 0.00 0.00 175.17 175.46 1k3t n THR 268 N 0.65 0.00 -3.53 -1.27 5.66 -0.71 -5.06 114.28 110.03 1k3t n THR 268 Ca 0.02 0.00 -0.12 0.00 -3.05 0.00 0.00 64.05 60.90 1k3t n THR 268 Cb 0.39 0.00 -0.04 0.00 -1.55 0.00 0.00 70.33 69.13 1k3t n THR 268 CO 0.00 0.00 0.00 -0.94 -3.05 0.00 0.00 175.07 171.08 1k3t s SER 269 N 1.91 -0.45 0.41 1.09 1.04 -1.26 -4.29 113.70 112.15 1k3t s SER 269 Ca 0.00 0.31 0.13 0.00 0.48 0.00 0.00 55.95 56.87 1k3t s SER 269 Cb 0.00 0.41 0.87 0.00 0.10 0.00 0.00 66.02 67.40 1k3t s SER 269 CO 0.00 -0.55 1.92 -0.29 0.98 0.00 0.00 173.24 175.30 1k3t h ILE 270 N 2.43 1.19 -0.33 -1.02 6.09 -1.94 -1.91 117.51 122.02 1k3t h ILE 270 Ca -0.23 -0.90 0.02 0.00 -1.37 0.00 0.00 64.86 62.39 1k3t h ILE 270 Cb 1.20 1.47 -0.03 0.00 0.47 0.00 0.00 36.82 39.93 1k3t h ILE 270 CO 0.33 0.26 0.17 1.56 -3.07 0.00 0.00 178.15 177.40 1k3t h GLN 271 N 0.02 0.34 -0.39 2.19 7.50 -1.97 0.37 115.11 123.17 1k3t h GLN 271 Ca 0.00 -0.02 -0.16 0.00 0.50 0.00 0.00 58.65 58.97 1k3t h GLN 271 Cb 0.46 -0.08 -0.01 0.00 0.05 0.00 0.00 27.48 27.91 1k3t h GLN 271 CO 0.03 0.22 -0.38 0.93 -1.50 0.00 0.00 178.83 178.14 1k3t h GLU 272 N 0.35 0.94 -0.47 1.46 5.08 -1.77 -0.33 114.58 119.84 1k3t h GLU 272 Ca 0.14 -0.49 0.03 0.00 -1.00 0.00 0.00 59.36 58.04 1k3t h GLU 272 Cb 0.05 0.01 -0.04 0.00 0.50 0.00 0.00 28.75 29.28 1k3t h GLU 272 CO -0.09 1.15 0.25 0.82 -1.00 0.00 0.00 179.01 180.14 1k3t h ILE 273 N 0.77 1.00 -0.85 3.13 2.04 -1.23 -1.75 117.51 120.63 1k3t h ILE 273 Ca 0.06 -0.17 -0.01 0.00 1.00 0.00 0.00 64.86 65.74 1k3t h ILE 273 Cb 0.97 0.45 -0.04 0.00 -0.74 0.00 0.00 36.82 37.46 1k3t h ILE 273 CO 0.09 0.09 0.50 -0.78 0.00 0.00 0.00 178.15 178.05 1k3t h ASP 274 N 0.51 1.04 -0.35 1.72 3.58 -0.12 -1.22 116.42 121.59 1k3t h ASP 274 Ca 0.19 -0.07 -0.12 0.00 0.42 0.00 0.00 57.03 57.45 1k3t h ASP 274 Cb 0.06 -0.26 -0.01 0.00 1.72 0.00 0.00 39.33 40.84 1k3t h ASP 274 CO -0.11 0.81 -0.23 0.00 -2.88 0.00 0.00 179.24 176.83 1k3t h ALA 275 N 1.36 0.81 -0.43 -0.78 0.00 -0.65 -2.75 119.26 116.82 1k3t h ALA 275 Ca 0.30 -0.38 -0.07 0.00 0.00 0.00 0.00 54.91 54.76 1k3t h ALA 275 Cb -0.02 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.60 1k3t h ALA 275 CO -0.05 0.65 -0.01 0.00 0.00 0.00 0.00 179.25 179.83 1k3t h ALA 276 N 1.00 0.59 -0.75 0.00 0.00 -1.16 -0.48 119.26 118.47 1k3t h ALA 276 Ca 0.10 -0.27 0.01 0.00 0.00 0.00 0.00 54.91 54.75 1k3t h ALA 276 Cb 0.77 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 18.36 1k3t h ALA 276 CO 0.06 0.39 0.49 -0.07 0.00 0.00 0.00 179.25 180.12 1k3t h LEU 277 N 0.61 0.84 -0.49 0.00 3.38 -1.12 0.49 115.31 119.03 1k3t h LEU 277 Ca 0.12 -0.02 -0.05 0.00 0.09 0.00 0.00 57.88 58.02 1k3t h LEU 277 Cb 0.50 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 41.03 1k3t h LEU 277 CO 0.02 0.61 0.09 0.11 0.09 0.00 0.00 178.44 179.36 1k3t h LYS 278 N 1.00 0.80 -0.31 1.13 1.57 -1.33 -1.32 116.57 118.11 1k3t h LYS 278 Ca 0.28 -0.21 -0.01 0.00 -1.87 0.00 0.00 60.65 58.84 1k3t h LYS 278 Cb -0.09 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.11 1k3t h LYS 278 CO -0.07 0.80 0.15 -0.09 -0.57 0.00 0.00 179.45 179.66 1k3t h ARG 279 N 0.68 0.44 -0.48 3.15 2.43 -0.89 -2.38 114.38 117.33 1k3t h ARG 279 Ca 0.15 -0.07 0.00 0.00 -0.81 0.00 0.00 59.98 59.26 1k3t h ARG 279 Cb 0.37 -0.08 -0.02 0.00 -0.42 0.00 0.00 29.97 29.82 1k3t h ARG 279 CO 0.01 0.42 0.32 0.00 -1.51 0.00 0.00 179.97 179.20 1k3t h ALA 280 N 1.00 0.61 -0.66 2.80 0.00 -0.81 -2.17 119.26 120.04 1k3t h ALA 280 Ca 0.11 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.98 1k3t h ALA 280 Cb 0.12 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.68 1k3t h ALA 280 CO -0.01 0.07 0.43 0.66 0.00 0.00 0.00 179.25 180.40 1k3t h SER 281 N 0.65 0.77 1.30 0.00 4.64 -1.00 0.12 113.55 120.03 1k3t h SER 281 Ca 0.18 -0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.47 1k3t h SER 281 Cb -0.06 -0.19 0.00 0.00 -0.31 0.00 0.00 62.40 61.84 1k3t h SER 281 CO -0.04 0.57 -0.01 0.29 -0.87 0.00 0.00 176.83 176.77 1k3t n LYS 282 N -4.43 0.17 0.00 4.77 5.02 -0.92 -3.28 118.16 119.50 1k3t n LYS 282 Ca 0.07 0.14 0.00 0.00 -2.02 0.00 0.00 58.31 56.50 1k3t n LYS 282 Cb 0.04 -1.70 0.00 0.00 -0.02 0.00 0.00 35.03 33.36 1k3t n LYS 282 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 1k3t n THR 283 N -2.00 0.00 0.31 -0.18 -2.24 -0.11 -4.77 114.28 105.29 1k3t n THR 283 Ca 0.06 0.00 0.17 0.00 -2.27 0.00 0.00 64.05 62.01 1k3t n THR 283 Cb 0.40 0.00 0.74 0.00 -2.10 0.00 0.00 70.33 69.37 1k3t n THR 283 CO 0.00 0.00 0.00 0.10 -0.57 0.00 0.00 175.07 174.60 1k3t h TYR 284 N 0.00 0.00 -0.51 4.78 -0.00 -1.80 -1.44 116.97 118.00 1k3t h TYR 284 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.73 1k3t h TYR 284 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 36.73 1k3t h TYR 284 CO 0.00 0.00 0.00 -1.33 -0.00 0.00 0.00 178.16 176.83 1k3t n MET 285 N -2.85 2.57 -1.66 0.10 2.81 -0.41 -5.00 117.12 112.67 1k3t n MET 285 Ca 0.00 -2.35 -0.44 0.00 -1.81 0.00 0.00 57.70 53.10 1k3t n MET 285 Cb 0.23 -1.47 -0.02 0.00 -0.71 0.00 0.00 33.22 31.24 1k3t n MET 285 CO 0.00 0.00 0.00 1.17 1.51 0.00 0.00 175.97 178.65 1k3t n LYS 286 N 1.33 1.91 0.00 0.03 4.81 -0.55 -0.03 118.16 125.67 1k3t n LYS 286 Ca 0.19 0.68 0.00 0.00 -0.87 0.00 0.00 58.31 58.31 1k3t n LYS 286 Cb 0.56 -2.27 0.00 0.00 0.02 0.00 0.00 35.03 33.34 1k3t n LYS 286 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1k3t n GLY 287 N 1.68 2.99 0.30 3.14 0.00 -1.26 -4.71 105.19 107.34 1k3t n GLY 287 Ca 0.10 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.95 1k3t n GLY 287 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1k3t n ILE 288 N -2.00 1.00 -5.11 -0.61 2.08 0.96 -4.32 119.36 111.36 1k3t n ILE 288 Ca 0.00 -0.30 -0.32 0.00 0.56 0.00 0.00 62.75 62.69 1k3t n ILE 288 Cb 0.00 -1.51 -0.16 0.00 -0.75 0.00 0.00 39.64 37.22 1k3t n ILE 288 CO 0.00 0.00 0.00 -0.22 0.56 0.00 0.00 176.55 176.89 1k3t s LEU 289 N -6.63 2.25 0.00 1.39 2.96 -0.55 -0.17 118.68 117.94 1k3t s LEU 289 Ca -0.25 -0.49 0.00 0.00 -0.22 0.00 0.00 54.13 53.18 1k3t s LEU 289 Cb 0.08 -1.46 0.00 0.00 0.50 0.00 0.00 46.19 45.32 1k3t s LEU 289 CO 0.35 0.18 0.00 0.61 -1.32 0.00 0.00 176.35 176.17 1k3t n GLY 290 N 3.41 4.78 3.31 7.98 0.00 0.28 -4.52 105.19 120.42 1k3t n GLY 290 Ca -0.19 -2.02 -0.10 0.00 0.00 0.00 0.00 46.02 43.71 1k3t n GLY 290 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1k3t s TYR 291 N -0.92 -0.19 0.04 1.61 1.13 -1.26 0.01 117.35 117.78 1k3t s TYR 291 Ca 0.00 -0.13 0.06 0.00 -1.41 0.00 0.00 57.07 55.60 1k3t s TYR 291 Cb 0.00 0.24 -0.02 0.00 -1.10 0.00 0.00 41.96 41.08 1k3t s TYR 291 CO 0.00 -0.69 -0.18 -0.08 -2.51 0.00 0.00 175.55 172.09 1k3t s THR 292 N -3.78 1.47 -0.20 -3.49 -1.32 0.30 -4.87 115.64 103.76 1k3t s THR 292 Ca 0.03 -1.14 0.13 0.00 -1.21 0.00 0.00 61.69 59.50 1k3t s THR 292 Cb 0.02 -1.30 0.40 0.00 -1.51 0.00 0.00 72.50 70.11 1k3t s THR 292 CO -0.12 0.13 1.21 0.47 -2.21 0.00 0.00 174.62 174.10 1k3t n ASP 293 N 1.84 1.88 -5.00 8.08 8.00 -1.26 -1.88 116.55 128.21 1k3t n ASP 293 Ca -0.18 -3.73 -0.22 0.00 0.71 0.00 0.00 54.79 51.37 1k3t n ASP 293 Cb 0.54 -0.51 0.05 0.00 -0.02 0.00 0.00 41.12 41.17 1k3t n ASP 293 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 1k3t s GLU 294 N -3.17 2.23 -1.23 -1.24 2.02 -1.26 -4.73 118.70 111.33 1k3t s GLU 294 Ca 0.37 -1.82 -0.09 0.00 0.02 0.00 0.00 54.97 53.45 1k3t s GLU 294 Cb 0.35 -2.45 0.20 0.00 0.10 0.00 0.00 34.13 32.33 1k3t s GLU 294 CO -0.05 -0.86 1.73 0.39 0.02 0.00 0.00 175.26 176.50 1k3t n GLU 295 N -2.14 3.75 -3.18 1.61 -0.58 -1.26 -4.84 120.64 114.00 1k3t n GLU 295 Ca 0.11 -3.78 -0.29 0.00 -0.42 0.00 0.00 57.16 52.77 1k3t n GLU 295 Cb 0.63 -2.85 -0.03 0.00 -0.57 0.00 0.00 31.44 28.62 1k3t n GLU 295 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 1k3t s LEU 296 N -0.46 3.98 0.41 -4.62 1.43 -1.26 -5.09 118.68 113.07 1k3t s LEU 296 Ca 0.38 0.83 0.06 0.00 -1.03 0.00 0.00 54.13 54.38 1k3t s LEU 296 Cb 0.07 -3.67 -0.07 0.00 0.03 0.00 0.00 46.19 42.54 1k3t s LEU 296 CO 0.02 -0.27 0.01 0.68 0.23 0.00 0.00 176.35 177.03 1k3t s VAL 297 N -2.19 1.88 0.23 -1.59 -7.23 -1.26 -5.05 120.40 105.19 1k3t s VAL 297 Ca 0.46 -2.00 -0.07 0.00 -1.81 0.00 0.00 61.98 58.56 1k3t s VAL 297 Cb -0.11 -2.92 0.18 0.00 0.56 0.00 0.00 36.38 34.10 1k3t s VAL 297 CO 0.31 0.00 1.80 0.77 -0.31 0.00 0.00 175.10 177.67 1k3t h SER 298 N 1.76 0.58 -1.10 4.85 4.64 -1.97 -1.99 113.55 120.33 1k3t h SER 298 Ca -0.44 0.04 0.30 0.00 -0.47 0.00 0.00 61.79 61.23 1k3t h SER 298 Cb 1.25 -0.07 -0.07 0.00 -0.31 0.00 0.00 62.40 63.20 1k3t h SER 298 CO 0.80 0.35 0.74 0.00 -0.87 0.00 0.00 176.83 177.85 1k3t h ALA 299 N 1.41 2.62 0.00 5.18 0.00 -1.98 -1.19 119.26 125.30 1k3t h ALA 299 Ca 0.35 0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.28 1k3t h ALA 299 Cb 0.30 0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.15 1k3t h ALA 299 CO -0.23 -1.00 0.00 -0.25 0.00 0.00 0.00 179.25 177.77 1k3t n ASP 300 N -4.44 0.25 -0.94 0.00 8.00 -0.75 -2.38 116.55 116.29 1k3t n ASP 300 Ca 0.25 0.57 0.12 0.00 0.71 0.00 0.00 54.79 56.44 1k3t n ASP 300 Cb 1.04 -0.62 0.10 0.00 -0.02 0.00 0.00 41.12 41.62 1k3t n ASP 300 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 1k3t n PHE 301 N -1.79 0.01 -1.72 1.24 3.01 -0.45 -4.90 117.46 112.86 1k3t n PHE 301 Ca 0.03 -0.00 -0.42 0.00 1.01 0.00 0.00 57.45 58.06 1k3t n PHE 301 Cb 0.18 -0.00 -0.03 0.00 -0.01 0.00 0.00 39.48 39.62 1k3t n PHE 301 CO 0.00 0.00 0.00 0.42 1.01 0.00 0.00 176.76 178.19 1k3t s ILE 302 N -1.95 2.11 0.00 4.37 1.01 -1.00 -1.62 121.20 124.12 1k3t s ILE 302 Ca 0.28 0.01 0.00 0.00 0.00 0.00 0.00 60.65 60.94 1k3t s ILE 302 Cb 0.20 -3.01 0.00 0.00 0.01 0.00 0.00 42.46 39.66 1k3t s ILE 302 CO 0.29 0.00 0.00 0.59 0.00 0.00 0.00 174.94 175.83 1k3t n ASN 303 N 4.32 -3.05 -4.69 3.58 3.02 -1.26 -4.98 115.26 112.21 1k3t n ASN 303 Ca 0.16 0.00 -0.42 0.00 -0.03 0.00 0.00 54.58 54.29 1k3t n ASN 303 Cb 0.36 -0.82 -0.03 0.00 -0.61 0.00 0.00 39.78 38.68 1k3t n ASN 303 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1k3t s ASP 304 N -2.08 7.15 -0.08 6.41 -1.08 -0.64 -4.91 116.67 121.44 1k3t s ASP 304 Ca 0.00 1.71 0.16 0.00 -0.52 0.00 0.00 52.55 53.90 1k3t s ASP 304 Cb 0.00 -2.56 0.60 0.00 -1.46 0.00 0.00 42.92 39.50 1k3t s ASP 304 CO 0.00 -0.50 1.49 -0.46 0.52 0.00 0.00 175.17 176.22 1k3t n ASN 305 N 4.92 3.94 -4.83 -0.34 2.04 -1.26 -3.59 115.26 116.13 1k3t n ASN 305 Ca 0.10 -2.29 -0.32 0.00 -0.44 0.00 0.00 54.58 51.62 1k3t n ASN 305 Cb 0.48 -0.51 0.01 0.00 -2.53 0.00 0.00 39.78 37.23 1k3t n ASN 305 CO 0.00 0.00 0.00 -0.13 -0.44 0.00 0.00 177.26 176.69 1k3t s ARG 306 N -1.66 3.40 0.09 -3.83 3.00 -1.26 -4.54 118.95 114.15 1k3t s ARG 306 Ca 0.43 0.95 0.11 0.00 0.00 0.00 0.00 55.73 57.22 1k3t s ARG 306 Cb 0.27 -2.05 -0.16 0.00 0.00 0.00 0.00 34.95 33.01 1k3t s ARG 306 CO 0.23 -0.73 1.07 0.77 0.00 0.00 0.00 175.30 176.63 1k3t h SER 307 N -0.05 0.00 -2.98 0.23 0.02 -0.77 -3.38 113.55 106.62 1k3t h SER 307 Ca -0.45 0.00 -0.05 0.00 -0.84 0.00 0.00 61.79 60.45 1k3t h SER 307 Cb 1.20 0.00 -0.24 0.00 0.14 0.00 0.00 62.40 63.50 1k3t h SER 307 CO 0.59 0.85 -0.18 -0.55 -1.14 0.00 0.00 176.83 176.41 1k3t s SER 308 N -6.36 -0.70 -0.33 3.07 0.15 -0.90 -3.85 113.70 104.79 1k3t s SER 308 Ca -0.01 1.19 0.03 0.00 0.70 0.00 0.00 55.95 57.86 1k3t s SER 308 Cb 0.09 1.17 0.10 0.00 -1.71 0.00 0.00 66.02 65.67 1k3t s SER 308 CO 0.81 -0.22 0.07 -0.63 1.20 0.00 0.00 173.24 174.47 1k3t s ILE 309 N 1.73 1.87 0.26 6.45 1.09 -0.32 -0.56 121.20 131.72 1k3t s ILE 309 Ca -0.09 -2.08 -0.30 0.00 -1.10 0.00 0.00 60.65 57.08 1k3t s ILE 309 Cb -0.08 -2.39 -0.11 0.00 -1.06 0.00 0.00 42.46 38.82 1k3t s ILE 309 CO -0.16 -0.62 1.57 -0.47 -0.10 0.00 0.00 174.94 175.16 1k3t s TYR 310 N 1.10 2.87 -0.94 3.97 5.04 0.10 -0.97 117.35 128.52 1k3t s TYR 310 Ca 0.11 0.76 -0.13 0.00 -2.44 0.00 0.00 57.07 55.37 1k3t s TYR 310 Cb -0.19 -4.01 0.22 0.00 0.35 0.00 0.00 41.96 38.34 1k3t s TYR 310 CO -0.13 -3.46 0.94 0.34 -1.34 0.00 0.00 175.55 171.90 1k3t s ASP 311 N 0.63 6.93 0.13 4.32 -1.08 -0.33 -0.53 116.67 126.73 1k3t s ASP 311 Ca 0.65 -2.90 -0.27 0.00 -0.52 0.00 0.00 52.55 49.51 1k3t s ASP 311 Cb -0.46 -2.24 -0.04 0.00 -1.46 0.00 0.00 42.92 38.71 1k3t s ASP 311 CO 0.43 -0.55 1.61 -1.28 0.52 0.00 0.00 175.17 175.89 1k3t h SER 312 N 7.54 -1.05 -0.42 -0.34 0.87 -1.66 -0.56 113.55 117.93 1k3t h SER 312 Ca 0.14 0.14 -0.02 0.00 -1.23 0.00 0.00 61.79 60.82 1k3t h SER 312 Cb 0.98 0.43 -0.02 0.00 -0.44 0.00 0.00 62.40 63.36 1k3t h SER 312 CO 0.88 -0.39 0.18 0.11 -0.53 0.00 0.00 176.83 177.08 1k3t h LYS 313 N -0.46 0.62 -0.50 2.24 1.79 -1.85 0.80 116.57 119.20 1k3t h LYS 313 Ca 0.07 -0.11 0.01 0.00 -2.18 0.00 0.00 60.65 58.45 1k3t h LYS 313 Cb 0.58 -0.10 -0.03 0.00 -1.58 0.00 0.00 32.23 31.09 1k3t h LYS 313 CO -0.32 0.57 0.32 0.00 -1.08 0.00 0.00 179.45 178.93 1k3t h ALA 314 N 1.02 0.63 0.18 3.86 0.00 -1.90 -0.75 119.26 122.31 1k3t h ALA 314 Ca 0.14 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 1k3t h ALA 314 Cb 0.17 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.78 1k3t h ALA 314 CO -0.01 0.04 -0.09 1.15 0.00 0.00 0.00 179.25 180.34 1k3t h THR 315 N 0.64 0.88 -0.22 0.00 2.02 -0.92 -3.14 112.91 112.17 1k3t h THR 315 Ca 0.19 -0.27 -0.06 0.00 0.77 0.00 0.00 66.41 67.05 1k3t h THR 315 Cb -0.04 1.04 -0.01 0.00 -1.74 0.00 0.00 68.15 67.40 1k3t h THR 315 CO -0.06 0.06 -0.11 -0.07 0.37 0.00 0.00 175.52 175.72 1k3t h LEU 316 N -0.37 0.34 -0.15 2.58 3.38 -0.65 -3.13 115.31 117.30 1k3t h LEU 316 Ca -0.02 -0.07 -0.05 0.00 0.09 0.00 0.00 57.88 57.83 1k3t h LEU 316 Cb 0.29 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 40.94 1k3t h LEU 316 CO 0.04 0.48 -0.22 1.56 0.09 0.00 0.00 178.44 180.39 1k3t h GLN 317 N 0.33 0.00 -0.06 1.13 4.20 -1.15 -3.37 115.11 116.20 1k3t h GLN 317 Ca 0.07 0.00 -0.03 0.00 0.06 0.00 0.00 58.65 58.75 1k3t h GLN 317 Cb 0.40 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.16 1k3t h GLN 317 CO 0.02 0.22 -0.44 0.09 -0.67 0.00 0.00 178.83 178.05 1k3t n ASN 318 N -3.17 1.84 -4.74 1.46 3.02 -1.18 -5.01 115.26 107.47 1k3t n ASN 318 Ca 0.03 -3.89 -0.23 0.00 -0.03 0.00 0.00 54.58 50.46 1k3t n ASN 318 Cb 0.59 -0.55 -0.06 0.00 -0.61 0.00 0.00 39.78 39.16 1k3t n ASN 318 CO 0.00 0.00 0.00 0.20 -2.62 0.00 0.00 177.26 174.84 1k3t s ASN 319 N -3.14 4.83 0.04 6.41 0.01 -1.24 -4.86 114.94 116.99 1k3t s ASN 319 Ca 0.39 -0.63 -0.30 0.00 -0.71 0.00 0.00 52.86 51.60 1k3t s ASN 319 Cb 0.38 -0.88 -0.05 0.00 0.41 0.00 0.00 41.25 41.11 1k3t s ASN 319 CO -0.06 -0.19 1.13 -0.76 -1.51 0.00 0.00 177.10 175.71 1k3t s LEU 320 N -3.82 4.37 -0.18 0.60 1.43 -1.26 -4.96 118.68 114.86 1k3t s LEU 320 Ca 0.36 1.90 -0.39 0.00 -1.03 0.00 0.00 54.13 54.97 1k3t s LEU 320 Cb -0.05 -3.58 -0.15 0.00 0.03 0.00 0.00 46.19 42.44 1k3t s LEU 320 CO 0.23 -0.40 1.68 -2.65 0.23 0.00 0.00 176.35 175.43 1k3t n PRO 321 N 3.93 1.26 -1.20 1.29 -0.02 -1.26 -1.33 135.00 137.67 1k3t n PRO 321 Ca 0.08 0.46 -0.09 0.00 -2.02 0.00 0.00 63.50 61.93 1k3t n PRO 321 Cb 0.48 -2.15 -0.04 0.00 -0.02 0.00 0.00 33.50 31.77 1k3t n PRO 321 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 1k3t n LYS 322 N 4.91 -1.71 -1.74 -0.52 5.02 -1.26 -4.94 118.16 117.92 1k3t n LYS 322 Ca 0.24 0.76 -0.42 0.00 -2.02 0.00 0.00 58.31 56.87 1k3t n LYS 322 Cb 0.16 -5.06 -0.01 0.00 -0.02 0.00 0.00 35.03 30.10 1k3t n LYS 322 CO 0.00 0.00 0.00 -1.91 -0.52 0.00 0.00 177.40 174.97 1k3t n GLU 323 N -0.63 2.44 -0.01 1.97 4.07 -0.44 -4.92 120.64 123.13 1k3t n GLU 323 Ca -0.09 0.86 0.09 0.00 -0.06 0.00 0.00 57.16 57.96 1k3t n GLU 323 Cb 0.52 -2.54 -0.13 0.00 -0.06 0.00 0.00 31.44 29.23 1k3t n GLU 323 CO 0.00 0.00 0.00 0.54 -0.06 0.00 0.00 177.13 177.61 1k3t n ARG 324 N 0.89 0.72 0.00 5.31 1.74 -1.26 -4.37 116.66 119.68 1k3t n ARG 324 Ca 0.04 -0.12 0.00 0.00 -0.77 0.00 0.00 57.85 57.00 1k3t n ARG 324 Cb 0.37 -1.40 0.00 0.00 -1.02 0.00 0.00 32.46 30.41 1k3t n ARG 324 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 1k3t n ARG 325 N -1.95 1.61 -3.62 5.56 5.12 -1.26 -1.73 116.66 120.39 1k3t n ARG 325 Ca -0.02 0.00 -0.40 0.00 -1.93 0.00 0.00 57.85 55.51 1k3t n ARG 325 Cb 0.42 -0.67 -0.10 0.00 -1.16 0.00 0.00 32.46 30.95 1k3t n ARG 325 CO 0.00 0.00 0.00 0.12 -1.93 0.00 0.00 177.63 175.82 1k3t s PHE 326 N -1.26 3.36 0.15 -1.55 5.36 -1.26 -1.66 117.98 121.13 1k3t s PHE 326 Ca 0.00 -1.64 0.09 0.00 -0.96 0.00 0.00 56.93 54.42 1k3t s PHE 326 Cb 0.00 -3.01 -0.04 0.00 -0.34 0.00 0.00 43.02 39.63 1k3t s PHE 326 CO 0.00 -0.87 -0.19 -0.06 -1.46 0.00 0.00 175.22 172.64 1k3t s PHE 327 N 1.39 1.84 -0.14 10.12 0.08 -0.72 -4.72 117.98 125.83 1k3t s PHE 327 Ca 0.03 -0.45 -0.01 0.00 0.12 0.00 0.00 56.93 56.62 1k3t s PHE 327 Cb -0.23 -0.94 -0.02 0.00 -0.57 0.00 0.00 43.02 41.26 1k3t s PHE 327 CO 0.01 0.31 -0.11 0.21 -0.10 0.00 0.00 175.22 175.54 1k3t s LYS 328 N -2.59 3.43 -0.17 0.44 2.20 -1.26 -1.14 119.74 120.65 1k3t s LYS 328 Ca 0.14 -0.66 0.00 0.00 -0.36 0.00 0.00 55.97 55.10 1k3t s LYS 328 Cb -0.07 -2.69 0.01 0.00 -1.51 0.00 0.00 37.83 33.57 1k3t s LYS 328 CO 0.06 0.20 -0.16 0.42 -0.36 0.00 0.00 175.35 175.51 1k3t s ILE 329 N 0.39 2.49 -0.23 5.43 1.01 -0.18 -4.84 121.20 125.27 1k3t s ILE 329 Ca -0.09 -0.82 -0.10 0.00 0.00 0.00 0.00 60.65 59.64 1k3t s ILE 329 Cb -0.16 -2.05 -0.05 0.00 0.01 0.00 0.00 42.46 40.21 1k3t s ILE 329 CO 0.05 0.52 0.16 -0.69 0.00 0.00 0.00 174.94 174.97 1k3t s VAL 330 N 1.02 5.37 -0.09 2.92 1.01 -1.26 -0.84 120.40 128.54 1k3t s VAL 330 Ca -0.01 0.20 -0.07 0.00 0.00 0.00 0.00 61.98 62.09 1k3t s VAL 330 Cb -0.15 -3.50 0.03 0.00 0.00 0.00 0.00 36.38 32.77 1k3t s VAL 330 CO -0.04 0.37 0.23 -0.55 0.00 0.00 0.00 175.10 175.11 1k3t s SER 331 N 0.82 -0.24 0.44 3.32 0.15 -0.71 -1.18 113.70 116.30 1k3t s SER 331 Ca 0.08 0.48 0.05 0.00 0.70 0.00 0.00 55.95 57.26 1k3t s SER 331 Cb -0.13 0.44 0.01 0.00 -1.71 0.00 0.00 66.02 64.64 1k3t s SER 331 CO 0.02 -0.11 0.61 0.26 1.20 0.00 0.00 173.24 175.23 1k3t s TRP 332 N 0.50 2.92 -0.22 3.44 0.52 -0.15 0.10 118.94 126.06 1k3t s TRP 332 Ca -0.03 -0.21 -0.27 0.00 0.02 0.00 0.00 56.10 55.61 1k3t s TRP 332 Cb -0.05 -2.40 0.09 0.00 -1.15 0.00 0.00 33.47 29.96 1k3t s TRP 332 CO -0.03 -0.46 0.81 1.52 0.02 0.00 0.00 176.95 178.82 1k3t s TYR 333 N -2.44 -0.65 -0.88 -1.98 1.13 -0.54 -1.17 117.35 110.82 1k3t s TYR 333 Ca 0.53 1.46 -0.23 0.00 -1.41 0.00 0.00 57.07 57.42 1k3t s TYR 333 Cb -0.10 0.34 0.07 0.00 -1.10 0.00 0.00 41.96 41.17 1k3t s TYR 333 CO 0.34 -0.39 1.25 0.34 -2.51 0.00 0.00 175.55 174.59 1k3t s ASP 334 N -0.12 6.41 0.37 -0.18 -1.08 -1.26 -0.13 116.67 120.68 1k3t s ASP 334 Ca -0.02 -1.33 0.14 0.00 -0.52 0.00 0.00 52.55 50.83 1k3t s ASP 334 Cb -0.04 -2.50 0.97 0.00 -1.46 0.00 0.00 42.92 39.90 1k3t s ASP 334 CO 0.01 -1.45 1.80 -0.55 0.52 0.00 0.00 175.17 175.50 1k3t h ASN 335 N 9.56 0.55 0.01 -0.34 -1.07 -1.90 -2.35 115.58 120.04 1k3t h ASN 335 Ca 0.01 0.07 -0.00 0.00 0.07 0.00 0.00 56.30 56.45 1k3t h ASN 335 Cb 1.03 -0.02 0.00 0.00 -2.07 0.00 0.00 38.32 37.26 1k3t h ASN 335 CO 1.27 0.18 -0.00 -0.33 0.07 0.00 0.00 177.43 178.62 1k3t h GLU 336 N 0.52 -0.01 0.05 4.14 5.08 -1.99 -3.38 114.58 119.00 1k3t h GLU 336 Ca 0.55 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.91 1k3t h GLU 336 Cb 1.19 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.44 1k3t h GLU 336 CO -0.29 0.75 -0.02 2.35 -1.00 0.00 0.00 179.01 180.80 1k3t h TRP 337 N -0.97 -0.06 -0.22 4.33 2.91 -1.74 -3.00 115.95 117.19 1k3t h TRP 337 Ca -0.00 -0.00 0.04 0.00 1.13 0.00 0.00 58.89 60.06 1k3t h TRP 337 Cb 0.76 0.02 -0.04 0.00 -0.51 0.00 0.00 29.16 29.39 1k3t h TRP 337 CO 0.21 0.52 -0.05 0.78 -1.03 0.00 0.00 178.44 178.87 1k3t h GLY 338 N -0.73 0.17 0.51 2.65 0.00 -1.55 -1.83 103.07 102.28 1k3t h GLY 338 Ca -0.01 0.06 0.10 0.00 0.00 0.00 0.00 47.33 47.49 1k3t h GLY 338 CO 0.01 -0.08 0.48 -1.82 0.00 0.00 0.00 176.54 175.14 1k3t h TYR 339 N 0.01 0.87 -0.64 5.60 5.03 -1.74 -0.60 116.97 125.50 1k3t h TYR 339 Ca 0.10 0.03 -0.05 0.00 2.58 0.00 0.00 58.73 61.39 1k3t h TYR 339 Cb 0.16 -0.27 -0.03 0.00 1.55 0.00 0.00 36.73 38.14 1k3t h TYR 339 CO -0.22 0.35 0.20 0.77 -1.32 0.00 0.00 178.16 177.94 1k3t h SER 340 N 0.80 0.94 -0.16 -2.11 0.02 -1.33 -0.80 113.55 110.91 1k3t h SER 340 Ca 0.41 -0.21 -0.05 0.00 -0.84 0.00 0.00 61.79 61.10 1k3t h SER 340 Cb 0.38 -0.25 -0.02 0.00 0.14 0.00 0.00 62.40 62.66 1k3t h SER 340 CO -0.25 0.90 -0.04 0.45 -1.14 0.00 0.00 176.83 176.74 1k3t h HIS 341 N 0.93 0.47 0.00 3.45 3.86 -0.42 -2.60 115.15 120.85 1k3t h HIS 341 Ca 0.21 -0.05 -0.08 0.00 -1.16 0.00 0.00 60.37 59.29 1k3t h HIS 341 Cb 0.29 -0.14 -0.01 0.00 1.06 0.00 0.00 27.41 28.62 1k3t h HIS 341 CO 0.02 0.50 -0.38 0.00 0.86 0.00 0.00 177.93 178.94 1k3t h ARG 342 N 0.43 0.00 -0.66 2.45 2.47 0.24 -1.56 114.38 117.76 1k3t h ARG 342 Ca 0.09 0.00 -0.06 0.00 -1.26 0.00 0.00 59.98 58.76 1k3t h ARG 342 Cb 0.36 0.00 -0.03 0.00 -1.65 0.00 0.00 29.97 28.65 1k3t h ARG 342 CO 0.02 0.38 0.20 0.28 0.56 0.00 0.00 179.97 181.40 1k3t h VAL 343 N 0.00 1.25 -0.39 2.04 2.07 -0.93 0.78 116.25 121.08 1k3t h VAL 343 Ca -0.00 -0.88 -0.15 0.00 0.82 0.00 0.00 66.70 66.48 1k3t h VAL 343 Cb 0.70 0.57 -0.01 0.00 -1.52 0.00 0.00 31.29 31.03 1k3t h VAL 343 CO 0.05 0.34 -0.35 0.58 0.02 0.00 0.00 177.57 178.21 1k3t h VAL 344 N 0.97 1.27 -0.09 2.57 2.07 -1.40 -1.47 116.25 120.17 1k3t h VAL 344 Ca 0.21 -1.52 -0.00 0.00 0.82 0.00 0.00 66.70 66.21 1k3t h VAL 344 Cb 0.31 1.34 -0.00 0.00 -1.52 0.00 0.00 31.29 31.41 1k3t h VAL 344 CO -0.00 0.51 0.05 0.44 0.02 0.00 0.00 177.57 178.58 1k3t h ASP 345 N 0.75 0.11 -0.63 0.57 3.32 -0.93 -1.02 116.42 118.59 1k3t h ASP 345 Ca 0.07 -0.09 -0.03 0.00 0.02 0.00 0.00 57.03 57.00 1k3t h ASP 345 Cb 0.93 -0.03 -0.03 0.00 0.22 0.00 0.00 39.33 40.42 1k3t h ASP 345 CO 0.09 0.18 0.28 0.25 -1.72 0.00 0.00 179.24 178.31 1k3t h LEU 346 N 0.04 0.85 -0.31 1.55 5.85 -0.75 -2.17 115.31 120.37 1k3t h LEU 346 Ca 0.03 -0.15 0.02 0.00 0.84 0.00 0.00 57.88 58.62 1k3t h LEU 346 Cb 0.09 -0.22 -0.03 0.00 0.37 0.00 0.00 40.66 40.88 1k3t h LEU 346 CO -0.00 0.76 0.15 0.58 -0.34 0.00 0.00 178.44 179.58 1k3t h VAL 347 N 0.88 0.98 -0.69 1.05 2.07 -0.84 -1.86 116.25 117.84 1k3t h VAL 347 Ca 0.21 -0.11 -0.01 0.00 0.82 0.00 0.00 66.70 67.62 1k3t h VAL 347 Cb 0.16 0.64 -0.03 0.00 -1.52 0.00 0.00 31.29 30.54 1k3t h VAL 347 CO -0.02 0.06 0.40 0.03 0.02 0.00 0.00 177.57 178.05 1k3t h ARG 348 N 0.31 0.94 0.06 1.57 3.08 -0.95 -2.04 114.38 117.35 1k3t h ARG 348 Ca 0.13 -0.09 -0.00 0.00 0.07 0.00 0.00 59.98 60.08 1k3t h ARG 348 Cb 0.05 -0.19 0.00 0.00 0.08 0.00 0.00 29.97 29.91 1k3t h ARG 348 CO -0.09 0.69 -0.03 1.25 -1.07 0.00 0.00 179.97 180.71 1k3t h HIS 349 N 0.94 -0.08 -0.36 3.04 2.76 -1.26 0.17 115.15 120.36 1k3t h HIS 349 Ca 0.25 -0.00 0.07 0.00 -2.20 0.00 0.00 60.37 58.48 1k3t h HIS 349 Cb -0.00 0.03 -0.06 0.00 1.55 0.00 0.00 27.41 28.92 1k3t h HIS 349 CO -0.01 -0.04 -0.02 0.52 -1.30 0.00 0.00 177.93 177.08 1k3t h MET 350 N -0.10 0.07 -0.11 5.26 2.86 -1.28 0.26 114.93 121.89 1k3t h MET 350 Ca -0.01 -0.00 -0.00 0.00 -2.06 0.00 0.00 59.70 57.63 1k3t h MET 350 Cb 0.08 -0.02 -0.01 0.00 0.06 0.00 0.00 31.60 31.72 1k3t h MET 350 CO 0.01 0.04 0.07 0.00 1.06 0.00 0.00 176.91 178.10 1k3t h ALA 351 N 1.32 0.14 -0.09 6.32 0.00 -1.27 0.59 119.26 126.28 1k3t h ALA 351 Ca 0.17 -0.03 0.03 0.00 0.00 0.00 0.00 54.91 55.09 1k3t h ALA 351 Cb 0.25 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 17.95 1k3t h ALA 351 CO -0.31 -0.35 -0.14 1.03 0.00 0.00 0.00 179.25 179.48 1k3t h SER 352 N 0.12 -0.44 0.25 0.00 0.87 -0.38 0.02 113.55 113.99 1k3t h SER 352 Ca 0.04 0.08 -0.08 0.00 -1.23 0.00 0.00 61.79 60.60 1k3t h SER 352 Cb 0.03 0.20 -0.01 0.00 -0.44 0.00 0.00 62.40 62.18 1k3t h SER 352 CO -0.01 -0.19 -0.34 0.11 -0.53 0.00 0.00 176.83 175.87 1k3t h LYS 353 N -0.20 0.13 -0.02 2.24 1.57 0.17 -1.05 116.57 119.40 1k3t h LYS 353 Ca 0.08 -0.05 -0.00 0.00 -1.87 0.00 0.00 60.65 58.81 1k3t h LYS 353 Cb 0.31 -0.01 -0.00 0.00 0.08 0.00 0.00 32.23 32.61 1k3t h LYS 353 CO -0.20 0.46 0.00 -0.44 -0.57 0.00 0.00 179.45 178.69 1k3t h ASP 354 N 0.11 0.04 -0.66 0.86 3.32 0.48 -0.52 116.42 120.06 1k3t h ASP 354 Ca 0.01 -0.27 0.04 0.00 0.02 0.00 0.00 57.03 56.83 1k3t h ASP 354 Cb 0.66 -0.01 -0.04 0.00 0.22 0.00 0.00 39.33 40.15 1k3t h ASP 354 CO 0.05 0.30 0.40 0.03 -1.72 0.00 0.00 179.24 178.30 1k3t h ARG 355 N -0.23 0.75 -0.92 3.56 3.08 -0.85 -0.48 114.38 119.29 1k3t h ARG 355 Ca 0.01 -0.05 0.05 0.00 0.07 0.00 0.00 59.98 60.06 1k3t h ARG 355 Cb 0.28 -0.17 -0.06 0.00 0.08 0.00 0.00 29.97 30.10 1k3t h ARG 355 CO 0.00 0.50 0.60 0.77 -1.07 0.00 0.00 179.97 180.77 1k3t h SER 356 N 0.77 0.97 0.19 7.04 0.02 -1.06 -0.50 113.55 120.99 1k3t h SER 356 Ca 0.27 -0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.22 1k3t h SER 356 Cb 0.06 -0.22 0.00 0.00 0.14 0.00 0.00 62.40 62.38 1k3t h SER 356 CO -0.12 0.65 0.00 0.00 -1.14 0.00 0.00 176.83 176.22 1k3t h ALA 357 N 1.48 1.00 0.00 3.77 0.00 0.61 -1.23 119.26 124.89 1k3t h ALA 357 Ca 0.38 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.29 1k3t h ALA 357 Cb 0.08 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.87 1k3t h ALA 357 CO -0.13 0.00 -1.00 0.54 0.00 0.00 0.00 179.25 178.66 1k3t n ARG 358 N -2.48 0.23 0.00 0.00 1.74 -0.22 -5.09 116.66 110.83 1k3t n ARG 358 Ca -0.01 -0.01 0.06 0.00 -0.77 0.00 0.00 57.85 57.12 1k3t n ARG 358 Cb 0.09 -1.57 0.34 0.00 -1.02 0.00 0.00 32.46 30.31 1k3t n ARG 358 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39