#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3kzm s LYS 4 N 0.00 4.22 0.48 1.96 2.47 -1.26 -5.08 119.74 122.53 3kzm s LYS 4 Ca 0.00 0.12 0.04 0.00 -1.56 0.00 0.00 55.97 54.56 3kzm s LYS 4 Cb 0.00 -3.47 -0.02 0.00 -1.46 0.00 0.00 37.83 32.87 3kzm s LYS 4 CO 0.00 0.13 0.08 -1.01 0.16 0.00 0.00 175.35 174.71 3kzm s HIS 5 N 0.80 2.05 -0.60 4.03 3.76 -1.26 -4.62 115.29 119.45 3kzm s HIS 5 Ca 0.17 -0.84 0.05 0.00 -0.15 0.00 0.00 55.06 54.29 3kzm s HIS 5 Cb -0.14 -1.73 0.19 0.00 1.11 0.00 0.00 32.58 32.01 3kzm s HIS 5 CO 0.06 0.18 0.49 0.34 -0.85 0.00 0.00 174.74 174.95 3kzm n PHE 6 N -1.27 1.97 -0.06 1.40 7.35 -0.35 -4.88 117.46 121.62 3kzm n PHE 6 Ca -0.12 -3.98 -0.17 0.00 -0.76 0.00 0.00 57.45 52.42 3kzm n PHE 6 Cb 0.66 -0.36 -0.13 0.00 0.35 0.00 0.00 39.48 39.99 3kzm n PHE 6 CO 0.00 0.00 0.00 1.28 -0.76 0.00 0.00 176.76 177.28 3kzm n LEU 7 N 2.00 2.21 -3.63 -2.13 4.77 -1.26 -1.10 117.00 117.86 3kzm n LEU 7 Ca 0.24 0.08 -0.15 0.00 -0.03 0.00 0.00 56.01 56.14 3kzm n LEU 7 Cb 0.40 -0.68 -0.07 0.00 -2.33 0.00 0.00 43.42 40.74 3kzm n LEU 7 CO 0.23 0.78 0.29 0.20 -1.33 0.00 0.00 177.39 177.57 3kzm s ASN 8 N -6.53 -0.54 0.47 -1.43 0.01 -1.26 -4.69 114.94 100.97 3kzm s ASN 8 Ca -0.23 0.74 0.24 0.00 -0.71 0.00 0.00 52.86 52.89 3kzm s ASN 8 Cb 0.08 0.72 1.18 0.00 0.41 0.00 0.00 41.25 43.64 3kzm s ASN 8 CO 0.72 -0.43 1.97 0.71 -1.51 0.00 0.00 177.10 178.56 3kzm h THR 9 N 3.62 0.70 0.00 1.60 1.35 -1.94 -2.48 112.91 115.77 3kzm h THR 9 Ca -0.28 -0.82 -0.01 0.00 -0.55 0.00 0.00 66.41 64.75 3kzm h THR 9 Cb 1.16 1.51 -0.00 0.00 -1.73 0.00 0.00 68.15 69.09 3kzm h THR 9 CO 0.30 0.19 -0.05 -0.61 -0.25 0.00 0.00 175.52 175.10 3kzm h GLN 10 N 0.00 0.00 0.00 4.72 5.75 -1.97 -0.73 115.11 122.89 3kzm h GLN 10 Ca -0.00 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.50 3kzm h GLN 10 Cb 0.49 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.04 3kzm h GLN 10 CO 0.03 0.05 0.00 -0.25 -2.65 0.00 0.00 178.83 176.01 3kzm n ASP 11 N -3.93 0.78 -4.91 -0.69 8.00 -0.93 -4.83 116.55 110.04 3kzm n ASP 11 Ca -0.03 0.58 -0.33 0.00 0.71 0.00 0.00 54.79 55.72 3kzm n ASP 11 Cb 0.14 -0.79 -0.05 0.00 -0.02 0.00 0.00 41.12 40.41 3kzm n ASP 11 CO 0.00 0.00 0.00 0.26 -0.39 0.00 0.00 177.20 177.07 3kzm s TRP 12 N -3.11 3.54 0.78 1.24 0.52 -0.28 -5.10 118.94 116.54 3kzm s TRP 12 Ca 0.11 0.34 -0.11 0.00 0.02 0.00 0.00 56.10 56.45 3kzm s TRP 12 Cb 0.12 -1.82 0.06 0.00 -1.15 0.00 0.00 33.47 30.68 3kzm s TRP 12 CO 0.59 0.64 1.08 -1.54 0.02 0.00 0.00 176.95 177.73 3kzm s SER 13 N -2.05 4.64 0.35 2.95 1.04 -1.26 -4.85 113.70 114.52 3kzm s SER 13 Ca 0.29 1.48 0.06 0.00 0.48 0.00 0.00 55.95 58.25 3kzm s SER 13 Cb -0.13 -2.25 0.66 0.00 0.10 0.00 0.00 66.02 64.40 3kzm s SER 13 CO 0.21 -1.90 1.89 -0.09 0.98 0.00 0.00 173.24 174.33 3kzm h ARG 14 N -1.03 0.45 -0.38 4.02 9.65 -1.99 -1.36 114.38 123.74 3kzm h ARG 14 Ca -0.46 -0.10 -0.13 0.00 -1.10 0.00 0.00 59.98 58.20 3kzm h ARG 14 Cb 1.25 -0.07 -0.01 0.00 -1.39 0.00 0.00 29.97 29.75 3kzm h ARG 14 CO 0.57 0.50 -0.28 0.00 2.80 0.00 0.00 179.97 183.57 3kzm h ALA 15 N 1.54 0.79 -0.44 2.80 0.00 -1.99 -0.13 119.26 121.84 3kzm h ALA 15 Ca 0.09 -0.40 -0.15 0.00 0.00 0.00 0.00 54.91 54.46 3kzm h ALA 15 Cb 0.33 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 3kzm h ALA 15 CO 0.01 0.65 -0.30 0.93 0.00 0.00 0.00 179.25 180.55 3kzm h GLU 16 N 0.69 0.97 -0.50 0.00 5.08 -1.80 -1.58 114.58 117.44 3kzm h GLU 16 Ca 0.08 -0.46 -0.11 0.00 -1.00 0.00 0.00 59.36 57.88 3kzm h GLU 16 Cb 0.81 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 30.04 3kzm h GLU 16 CO 0.07 1.13 -0.11 -0.07 -1.00 0.00 0.00 179.01 179.02 3kzm h LEU 17 N 0.82 0.96 -0.91 1.33 3.38 -1.13 -1.63 115.31 118.13 3kzm h LEU 17 Ca 0.09 -0.36 -0.03 0.00 0.09 0.00 0.00 57.88 57.67 3kzm h LEU 17 Cb 0.88 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 41.33 3kzm h LEU 17 CO 0.08 1.10 0.41 0.44 0.09 0.00 0.00 178.44 180.56 3kzm h ASP 18 N 0.82 1.08 -0.69 -0.43 3.32 -0.92 -0.69 116.42 118.90 3kzm h ASP 18 Ca 0.13 -0.12 -0.07 0.00 0.02 0.00 0.00 57.03 56.99 3kzm h ASP 18 Cb 0.67 -0.28 -0.03 0.00 0.22 0.00 0.00 39.33 39.92 3kzm h ASP 18 CO 0.05 0.90 0.17 0.00 -1.72 0.00 0.00 179.24 178.64 3kzm h ALA 19 N 1.27 0.91 -0.19 3.45 0.00 -1.07 -1.09 119.26 122.53 3kzm h ALA 19 Ca 0.29 -0.25 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 3kzm h ALA 19 Cb 0.10 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 3kzm h ALA 19 CO -0.04 0.64 0.10 -0.07 0.00 0.00 0.00 179.25 179.88 3kzm h LEU 20 N 1.04 0.25 -1.14 0.00 3.38 -0.58 -0.09 115.31 118.17 3kzm h LEU 20 Ca 0.22 -0.10 -0.02 0.00 0.09 0.00 0.00 57.88 58.06 3kzm h LEU 20 Cb 0.37 -0.06 -0.03 0.00 0.09 0.00 0.00 40.66 41.03 3kzm h LEU 20 CO 0.00 0.28 0.30 -0.07 0.09 0.00 0.00 178.44 179.04 3kzm h LEU 21 N 0.20 0.81 -0.36 1.67 3.38 -0.95 -0.27 115.31 119.79 3kzm h LEU 21 Ca 0.07 -0.08 -0.17 0.00 0.09 0.00 0.00 57.88 57.78 3kzm h LEU 21 Cb 0.09 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 40.63 3kzm h LEU 21 CO -0.01 0.69 -0.43 0.74 0.09 0.00 0.00 178.44 179.52 3kzm h THR 22 N 0.89 1.27 -0.37 0.22 2.02 -0.93 -1.61 112.91 114.41 3kzm h THR 22 Ca 0.22 -1.60 -0.08 0.00 0.77 0.00 0.00 66.41 65.72 3kzm h THR 22 Cb 0.10 1.45 -0.02 0.00 -1.74 0.00 0.00 68.15 67.95 3kzm h THR 22 CO -0.03 0.53 -0.09 -0.61 0.37 0.00 0.00 175.52 175.70 3kzm h GLN 23 N 0.74 0.63 -0.55 6.66 5.75 -0.60 -1.46 115.11 126.27 3kzm h GLN 23 Ca 0.05 -0.18 -0.00 0.00 -0.15 0.00 0.00 58.65 58.36 3kzm h GLN 23 Cb 1.03 -0.07 -0.03 0.00 1.07 0.00 0.00 27.48 29.49 3kzm h GLN 23 CO 0.10 0.71 0.33 0.00 -2.65 0.00 0.00 178.83 177.32 3kzm h ALA 24 N 1.33 0.70 -0.44 3.38 0.00 -0.82 0.60 119.26 124.01 3kzm h ALA 24 Ca 0.11 -0.07 -0.05 0.00 0.00 0.00 0.00 54.91 54.90 3kzm h ALA 24 Cb 0.50 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.05 3kzm h ALA 24 CO 0.03 0.18 0.07 0.00 0.00 0.00 0.00 179.25 179.53 3kzm h ALA 25 N 1.16 1.31 -0.35 0.00 0.00 -0.84 -1.17 119.26 119.36 3kzm h ALA 25 Ca 0.20 -0.20 -0.08 0.00 0.00 0.00 0.00 54.91 54.83 3kzm h ALA 25 Cb -0.01 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 3kzm h ALA 25 CO -0.04 0.48 -0.08 1.25 0.00 0.00 0.00 179.25 180.87 3kzm h LEU 26 N 0.64 0.68 -1.40 0.00 6.46 -0.44 -2.76 115.31 118.50 3kzm h LEU 26 Ca 0.14 -0.36 -0.05 0.00 -0.12 0.00 0.00 57.88 57.49 3kzm h LEU 26 Cb 0.30 -0.19 -0.01 0.00 -0.73 0.00 0.00 40.66 40.03 3kzm h LEU 26 CO 0.00 0.88 -0.18 -0.26 -0.62 0.00 0.00 178.44 178.27 3kzm h PHE 27 N 0.47 0.18 0.00 1.25 0.05 -0.59 -1.43 116.94 116.87 3kzm h PHE 27 Ca 0.09 -0.02 -0.04 0.00 3.82 0.00 0.00 57.97 61.82 3kzm h PHE 27 Cb 0.58 -0.05 -0.01 0.00 2.00 0.00 0.00 35.95 38.47 3kzm h PHE 27 CO 0.05 0.35 -0.17 -0.22 -0.18 0.00 0.00 178.31 178.15 3kzm h LYS 28 N 0.17 0.00 0.00 1.51 3.64 -0.94 -2.14 116.57 118.81 3kzm h LYS 28 Ca 0.03 0.00 -0.28 0.00 -1.27 0.00 0.00 60.65 59.13 3kzm h LYS 28 Cb 0.42 0.00 -0.05 0.00 -0.41 0.00 0.00 32.23 32.19 3kzm h LYS 28 CO 0.03 0.17 -1.65 0.00 -2.27 0.00 0.00 179.45 175.73 3kzm h ARG 29 N 0.00 0.00 -2.76 1.90 3.08 -1.11 -3.42 114.38 112.07 3kzm h ARG 29 Ca -0.00 -0.00 -0.58 0.00 0.07 0.00 0.00 59.98 59.46 3kzm h ARG 29 Cb 0.45 0.00 -0.39 0.00 0.08 0.00 0.00 29.97 30.11 3kzm h ARG 29 CO 0.02 0.54 -0.81 -0.80 -1.07 0.00 0.00 179.97 177.85 3kzm s ASN 30 N -6.14 3.26 0.32 7.04 0.01 -0.67 -5.03 114.94 113.72 3kzm s ASN 30 Ca -0.04 -2.17 0.17 0.00 -0.71 0.00 0.00 52.86 50.10 3kzm s ASN 30 Cb 0.08 -0.58 0.36 0.00 0.41 0.00 0.00 41.25 41.52 3kzm s ASN 30 CO 0.82 -0.32 1.58 0.07 -1.51 0.00 0.00 177.10 177.74 3kzm h LYS 31 N 7.15 0.00 -5.90 -0.60 2.10 -1.66 -3.40 116.57 114.26 3kzm h LYS 31 Ca 0.01 0.00 -0.58 0.00 -2.00 0.00 0.00 60.65 58.08 3kzm h LYS 31 Cb 0.97 0.00 -0.07 0.00 -0.90 0.00 0.00 32.23 32.23 3kzm h LYS 31 CO 0.35 0.47 -0.11 -0.51 -2.00 0.00 0.00 179.45 177.64 3kzm s LEU 32 N -6.76 4.36 0.00 7.07 1.43 -1.26 -4.65 118.68 118.87 3kzm s LEU 32 Ca 0.02 0.96 -0.05 0.00 -1.03 0.00 0.00 54.13 54.03 3kzm s LEU 32 Cb 0.09 -2.74 0.02 0.00 0.03 0.00 0.00 46.19 43.59 3kzm s LEU 32 CO 0.72 0.10 0.34 0.61 0.23 0.00 0.00 176.35 178.35 3kzm n GLY 33 N 2.71 1.99 0.06 -3.19 0.00 -0.46 -5.02 105.19 101.27 3kzm n GLY 33 Ca -0.08 -1.30 0.05 0.00 0.00 0.00 0.00 46.02 44.69 3kzm n GLY 33 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3kzm n SER 34 N -1.55 2.03 0.12 1.61 3.41 -1.26 -3.52 113.62 114.47 3kzm n SER 34 Ca -0.02 -2.55 0.18 0.00 -0.26 0.00 0.00 58.87 56.22 3kzm n SER 34 Cb 0.31 -0.24 0.76 0.00 -0.26 0.00 0.00 64.21 64.77 3kzm n SER 34 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 3kzm h GLU 35 N 0.00 0.00 0.00 4.33 3.07 -1.94 -1.78 114.58 118.26 3kzm h GLU 35 Ca 0.00 0.00 -0.00 0.00 -0.50 0.00 0.00 59.36 58.86 3kzm h GLU 35 Cb 0.83 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.73 3kzm h GLU 35 CO 0.00 0.00 -0.32 1.28 -1.40 0.00 0.00 179.01 178.57 3kzm n LEU 36 N -3.97 2.48 -4.65 1.33 4.77 -0.07 -4.94 117.00 111.95 3kzm n LEU 36 Ca 0.05 -3.49 -0.45 0.00 -0.03 0.00 0.00 56.01 52.09 3kzm n LEU 36 Cb 0.47 -0.47 -0.04 0.00 -2.33 0.00 0.00 43.42 41.06 3kzm n LEU 36 CO 0.30 1.09 1.61 1.17 -1.33 0.00 0.00 177.39 180.24 3kzm n LYS 37 N -1.19 2.43 -0.91 3.23 4.81 -0.67 -0.68 118.16 125.18 3kzm n LYS 37 Ca 0.17 0.86 0.00 0.00 -0.87 0.00 0.00 58.31 58.47 3kzm n LYS 37 Cb 0.68 -2.89 0.00 0.00 0.02 0.00 0.00 35.03 32.84 3kzm n LYS 37 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3kzm n GLY 38 N 4.75 1.14 3.98 3.14 0.00 -0.75 -4.93 105.19 112.54 3kzm n GLY 38 Ca 0.23 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 46.05 3kzm n GLY 38 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3kzm s LYS 39 N -0.02 2.94 0.08 1.61 -0.14 0.15 -4.97 119.74 119.40 3kzm s LYS 39 Ca 0.00 -0.89 -0.06 0.00 -1.36 0.00 0.00 55.97 53.67 3kzm s LYS 39 Cb 0.00 -2.68 -0.02 0.00 -1.68 0.00 0.00 37.83 33.45 3kzm s LYS 39 CO 0.00 -0.23 0.12 -1.54 -0.76 0.00 0.00 175.35 172.94 3kzm s SER 40 N -4.27 0.25 -0.02 2.83 1.04 -1.26 -1.45 113.70 110.82 3kzm s SER 40 Ca 0.50 -0.81 0.02 0.00 0.48 0.00 0.00 55.95 56.14 3kzm s SER 40 Cb -0.10 0.30 0.00 0.00 0.10 0.00 0.00 66.02 66.32 3kzm s SER 40 CO 0.35 -0.70 -0.07 -0.51 0.98 0.00 0.00 173.24 173.28 3kzm s ILE 41 N -3.90 0.62 -0.32 -1.02 2.07 -0.62 -1.16 121.20 116.87 3kzm s ILE 41 Ca 0.08 -0.29 -0.15 0.00 -1.41 0.00 0.00 60.65 58.88 3kzm s ILE 41 Cb 0.06 -0.56 -0.02 0.00 0.13 0.00 0.00 42.46 42.07 3kzm s ILE 41 CO -0.09 0.20 0.35 0.00 -1.91 0.00 0.00 174.94 173.48 3kzm s ALA 42 N 0.13 3.52 -0.59 1.50 0.00 -0.32 -0.80 121.76 125.20 3kzm s ALA 42 Ca -0.02 -1.09 -0.17 0.00 0.00 0.00 0.00 51.96 50.68 3kzm s ALA 42 Cb -0.07 -2.76 0.13 0.00 0.00 0.00 0.00 23.12 20.43 3kzm s ALA 42 CO 0.00 -0.91 0.60 -0.51 0.00 0.00 0.00 175.76 174.95 3kzm s LEU 43 N 2.01 5.97 -0.44 0.00 1.43 0.26 -0.43 118.68 127.48 3kzm s LEU 43 Ca 0.12 -1.77 -0.21 0.00 -1.03 0.00 0.00 54.13 51.24 3kzm s LEU 43 Cb -0.16 -2.24 0.02 0.00 0.03 0.00 0.00 46.19 43.84 3kzm s LEU 43 CO 0.11 -0.92 0.65 -0.69 0.23 0.00 0.00 176.35 175.74 3kzm s VAL 44 N 1.83 4.82 -0.27 -1.59 1.01 -0.13 -1.43 120.40 124.63 3kzm s VAL 44 Ca 0.08 0.15 -0.08 0.00 0.00 0.00 0.00 61.98 62.13 3kzm s VAL 44 Cb -0.26 -4.21 -0.01 0.00 0.00 0.00 0.00 36.38 31.90 3kzm s VAL 44 CO 0.03 -0.60 0.09 -0.36 0.00 0.00 0.00 175.10 174.26 3kzm s PHE 45 N 2.85 3.11 -2.34 5.22 0.08 -0.02 -1.12 117.98 125.76 3kzm s PHE 45 Ca 0.23 -0.60 0.24 0.00 0.12 0.00 0.00 56.93 56.93 3kzm s PHE 45 Cb -0.14 -2.26 0.30 0.00 -0.57 0.00 0.00 43.02 40.35 3kzm s PHE 45 CO 0.19 -0.44 1.30 1.19 -0.10 0.00 0.00 175.22 177.36 3kzm n PHE 46 N 4.92 0.00 -3.96 0.36 3.01 0.15 -3.89 117.46 118.06 3kzm n PHE 46 Ca -0.15 0.00 -0.09 0.00 1.01 0.00 0.00 57.45 58.22 3kzm n PHE 46 Cb 0.50 -0.02 -0.08 0.00 -0.01 0.00 0.00 39.48 39.87 3kzm n PHE 46 CO 0.00 0.00 0.00 -0.80 1.01 0.00 0.00 176.76 176.97 3kzm s ASN 47 N -2.28 0.18 0.99 4.37 -0.87 -1.26 -4.88 114.94 111.19 3kzm s ASN 47 Ca 0.25 -0.83 -0.12 0.00 -1.57 0.00 0.00 52.86 50.58 3kzm s ASN 47 Cb 0.19 0.34 0.13 0.00 -0.02 0.00 0.00 41.25 41.89 3kzm s ASN 47 CO 0.45 -0.75 0.77 -2.65 -2.57 0.00 0.00 177.10 172.35 3kzm n PRO 48 N -0.08 -0.85 -3.63 -0.60 -0.02 -1.26 -5.02 135.00 123.53 3kzm n PRO 48 Ca -0.12 -0.20 -0.08 0.00 -2.02 0.00 0.00 63.50 61.08 3kzm n PRO 48 Cb 0.62 -2.11 -0.07 0.00 -0.02 0.00 0.00 33.50 31.93 3kzm n PRO 48 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 3kzm s SER 49 N -2.32 -0.38 0.06 2.55 0.15 -1.26 -5.06 113.70 107.45 3kzm s SER 49 Ca 0.63 0.71 -0.01 0.00 0.70 0.00 0.00 55.95 57.97 3kzm s SER 49 Cb -0.22 0.71 -0.00 0.00 -1.71 0.00 0.00 66.02 64.80 3kzm s SER 49 CO 0.63 -0.15 -0.02 0.80 1.20 0.00 0.00 173.24 175.70 3kzm n MET 50 N 1.98 0.04 0.00 5.44 1.56 -1.26 -4.63 117.12 120.25 3kzm n MET 50 Ca -0.12 0.02 -0.12 0.00 -0.27 0.00 0.00 57.70 57.20 3kzm n MET 50 Cb 0.56 -0.57 -0.08 0.00 2.15 0.00 0.00 33.22 35.28 3kzm n MET 50 CO 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 175.97 175.24 3kzm h ARG 51 N -0.07 0.03 -0.22 2.12 3.08 -1.98 -2.30 114.38 115.04 3kzm h ARG 51 Ca -0.01 -0.01 -0.01 0.00 0.07 0.00 0.00 59.98 60.03 3kzm h ARG 51 Cb 0.22 -0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.26 3kzm h ARG 51 CO -0.00 0.31 0.11 1.15 -1.07 0.00 0.00 179.97 180.46 3kzm h THR 52 N -0.25 1.14 -0.05 2.04 2.02 -1.96 0.10 112.91 115.95 3kzm h THR 52 Ca 0.00 -0.40 -0.00 0.00 0.77 0.00 0.00 66.41 66.78 3kzm h THR 52 Cb 0.29 1.00 -0.00 0.00 -1.74 0.00 0.00 68.15 67.70 3kzm h THR 52 CO 0.00 0.14 0.02 -0.09 0.37 0.00 0.00 175.52 175.96 3kzm h ARG 53 N 0.23 0.07 0.08 6.66 1.12 -1.82 -1.85 114.38 118.87 3kzm h ARG 53 Ca 0.08 -0.01 -0.00 0.00 -1.11 0.00 0.00 59.98 58.93 3kzm h ARG 53 Cb 0.12 -0.01 0.00 0.00 -0.01 0.00 0.00 29.97 30.07 3kzm h ARG 53 CO -0.01 0.20 -0.04 1.15 -3.11 0.00 0.00 179.97 178.16 3kzm h THR 54 N -0.07 0.95 -0.64 0.20 2.02 -1.33 -0.93 112.91 113.11 3kzm h THR 54 Ca 0.02 -0.11 -0.03 0.00 0.77 0.00 0.00 66.41 67.06 3kzm h THR 54 Cb 0.15 1.03 -0.03 0.00 -1.74 0.00 0.00 68.15 67.56 3kzm h THR 54 CO -0.00 0.03 0.30 0.77 0.37 0.00 0.00 175.52 176.99 3kzm h SER 55 N -0.16 0.85 -0.32 4.18 4.64 -0.81 -1.04 113.55 120.89 3kzm h SER 55 Ca -0.01 -0.14 -0.06 0.00 -0.47 0.00 0.00 61.79 61.11 3kzm h SER 55 Cb 0.13 -0.22 -0.01 0.00 -0.31 0.00 0.00 62.40 61.99 3kzm h SER 55 CO 0.02 0.75 -0.05 -0.26 -0.87 0.00 0.00 176.83 176.42 3kzm h PHE 56 N 0.89 0.66 -0.50 4.77 0.04 -1.30 0.26 116.94 121.75 3kzm h PHE 56 Ca 0.22 -0.13 -0.00 0.00 2.80 0.00 0.00 57.97 60.86 3kzm h PHE 56 Cb 0.14 -0.17 -0.02 0.00 2.20 0.00 0.00 35.95 38.10 3kzm h PHE 56 CO 0.00 0.75 0.31 1.49 -0.60 0.00 0.00 178.31 180.27 3kzm h GLU 57 N 0.38 0.68 -0.27 1.51 4.81 -1.01 -1.28 114.58 119.39 3kzm h GLU 57 Ca 0.08 -0.06 -0.15 0.00 -0.13 0.00 0.00 59.36 59.11 3kzm h GLU 57 Cb 0.52 -0.15 -0.01 0.00 0.63 0.00 0.00 28.75 29.75 3kzm h GLU 57 CO 0.03 0.48 -0.42 -0.07 -0.73 0.00 0.00 179.01 178.30 3kzm h LEU 58 N 0.68 0.72 -0.76 1.64 3.38 -1.16 -2.41 115.31 117.40 3kzm h LEU 58 Ca 0.18 -0.33 -0.01 0.00 0.09 0.00 0.00 57.88 57.81 3kzm h LEU 58 Cb -0.03 -0.20 -0.04 0.00 0.09 0.00 0.00 40.66 40.48 3kzm h LEU 58 CO -0.04 1.05 0.44 1.23 0.09 0.00 0.00 178.44 181.22 3kzm h GLY 59 N 0.97 1.11 0.92 0.83 0.00 -0.57 0.90 103.07 107.24 3kzm h GLY 59 Ca 0.04 -0.48 -0.03 0.00 0.00 0.00 0.00 47.33 46.86 3kzm h GLY 59 CO 0.09 0.46 0.11 0.00 0.00 0.00 0.00 176.54 177.19 3kzm h ALA 60 N 1.23 0.47 -0.27 3.60 0.00 -1.15 -2.65 119.26 120.49 3kzm h ALA 60 Ca 0.27 -0.17 0.02 0.00 0.00 0.00 0.00 54.91 55.03 3kzm h ALA 60 Cb -0.01 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.62 3kzm h ALA 60 CO -0.05 0.11 0.14 0.35 0.00 0.00 0.00 179.25 179.80 3kzm h PHE 61 N 0.42 0.26 0.00 0.00 3.57 -0.99 0.29 116.94 120.50 3kzm h PHE 61 Ca 0.11 0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.62 3kzm h PHE 61 Cb 0.26 -0.08 -0.00 0.00 2.79 0.00 0.00 35.95 38.93 3kzm h PHE 61 CO 0.01 0.15 -0.02 1.96 -2.23 0.00 0.00 178.31 178.17 3kzm h GLN 62 N 0.29 0.00 -0.65 1.11 4.20 -0.73 -1.93 115.11 117.40 3kzm h GLN 62 Ca 0.11 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.82 3kzm h GLN 62 Cb 0.03 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.81 3kzm h GLN 62 CO -0.07 0.02 0.00 1.28 -0.67 0.00 0.00 178.83 179.39 3kzm n LEU 63 N -3.19 4.65 0.00 1.46 4.77 -1.01 -1.36 117.00 122.32 3kzm n LEU 63 Ca -0.01 -2.40 0.00 0.00 -0.03 0.00 0.00 56.01 53.57 3kzm n LEU 63 Cb 0.20 -0.56 0.00 0.00 -2.33 0.00 0.00 43.42 40.72 3kzm n LEU 63 CO 0.25 0.84 0.00 0.61 -1.33 0.00 0.00 177.39 177.75 3kzm n GLY 64 N 1.16 0.66 0.00 -0.72 0.00 -0.73 -0.90 105.19 104.67 3kzm n GLY 64 Ca 0.26 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.28 3kzm n GLY 64 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3kzm n GLY 65 N -2.65 2.77 3.07 -0.02 0.00 0.10 -1.80 105.19 106.65 3kzm n GLY 65 Ca 0.00 -2.10 -0.13 0.00 0.00 0.00 0.00 46.02 43.80 3kzm n GLY 65 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 3kzm s HIS 66 N 1.10 -0.30 -0.14 1.61 2.46 -0.53 -3.73 115.29 115.77 3kzm s HIS 66 Ca 0.00 0.72 -0.06 0.00 0.47 0.00 0.00 55.06 56.19 3kzm s HIS 66 Cb 0.00 0.06 -0.04 0.00 -0.13 0.00 0.00 32.58 32.47 3kzm s HIS 66 CO 0.00 -0.19 0.08 0.00 -2.47 0.00 0.00 174.74 172.15 3kzm s ALA 67 N 0.87 3.54 -0.24 1.58 0.00 -1.26 -1.59 121.76 124.66 3kzm s ALA 67 Ca -0.06 -0.72 -0.06 0.00 0.00 0.00 0.00 51.96 51.11 3kzm s ALA 67 Cb -0.07 -1.85 -0.02 0.00 0.00 0.00 0.00 23.12 21.18 3kzm s ALA 67 CO -0.05 0.41 0.04 0.08 0.00 0.00 0.00 175.76 176.23 3kzm s VAL 68 N -0.35 4.04 -0.25 0.00 1.01 0.02 -4.95 120.40 119.92 3kzm s VAL 68 Ca 0.09 -0.28 -0.16 0.00 0.00 0.00 0.00 61.98 61.64 3kzm s VAL 68 Cb -0.12 -2.89 -0.04 0.00 0.00 0.00 0.00 36.38 33.34 3kzm s VAL 68 CO 0.02 0.35 0.41 -0.69 0.00 0.00 0.00 175.10 175.19 3kzm s VAL 69 N 1.57 5.16 0.00 2.92 1.01 -1.26 -0.58 120.40 129.22 3kzm s VAL 69 Ca 0.06 0.68 0.08 0.00 0.00 0.00 0.00 61.98 62.80 3kzm s VAL 69 Cb -0.15 -3.74 -0.02 0.00 0.00 0.00 0.00 36.38 32.47 3kzm s VAL 69 CO 0.02 0.17 -0.25 -0.76 0.00 0.00 0.00 175.10 174.28 3kzm s LEU 70 N 1.88 2.08 -0.42 3.92 1.43 -0.52 -4.98 118.68 122.07 3kzm s LEU 70 Ca 0.18 -0.49 0.02 0.00 -1.03 0.00 0.00 54.13 52.81 3kzm s LEU 70 Cb -0.15 -1.26 0.14 0.00 0.03 0.00 0.00 46.19 44.94 3kzm s LEU 70 CO 0.09 0.29 0.23 -1.10 0.23 0.00 0.00 176.35 176.09 3kzm s GLN 71 N -0.78 1.18 0.23 1.70 -0.21 -1.26 -0.84 119.66 119.68 3kzm s GLN 71 Ca 0.10 -1.89 -0.32 0.00 0.02 0.00 0.00 55.36 53.27 3kzm s GLN 71 Cb -0.10 -2.19 -0.13 0.00 1.00 0.00 0.00 33.01 31.59 3kzm s GLN 71 CO -0.00 -1.16 1.52 -2.30 -2.12 0.00 0.00 175.29 171.23 3kzm n PRO 72 N 3.64 2.31 0.00 2.91 -0.02 -1.25 -0.75 135.00 141.84 3kzm n PRO 72 Ca 0.09 0.82 0.00 0.00 -2.02 0.00 0.00 63.50 62.39 3kzm n PRO 72 Cb 0.35 -2.56 0.00 0.00 -0.02 0.00 0.00 33.50 31.27 3kzm n PRO 72 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3kzm n GLY 73 N 2.61 2.06 0.00 -1.23 0.00 -0.38 -4.84 105.19 103.41 3kzm n GLY 73 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.14 3kzm n GLY 73 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3kzm n LYS 74 N -2.00 0.00 0.00 1.61 4.76 0.07 -4.91 118.16 117.69 3kzm n LYS 74 Ca 0.00 0.00 0.11 0.00 -2.87 0.00 0.00 58.31 55.55 3kzm n LYS 74 Cb 0.00 0.00 -0.14 0.00 -1.84 0.00 0.00 35.03 33.05 3kzm n LYS 74 CO 0.00 0.00 0.00 -0.40 -1.37 0.00 0.00 177.40 175.63 3kzm n ASP 75 N -1.12 0.24 -4.79 4.39 5.68 -0.39 -4.96 116.55 115.59 3kzm n ASP 75 Ca 0.00 -0.12 -0.24 0.00 -0.50 0.00 0.00 54.79 53.93 3kzm n ASP 75 Cb 0.00 1.67 -0.05 0.00 -1.14 0.00 0.00 41.12 41.60 3kzm n ASP 75 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3kzm s ALA 76 N -3.42 3.82 0.37 2.12 0.00 -0.92 -4.94 121.76 118.80 3kzm s ALA 76 Ca -0.05 -1.91 -0.24 0.00 0.00 0.00 0.00 51.96 49.76 3kzm s ALA 76 Cb 0.14 -0.58 -0.10 0.00 0.00 0.00 0.00 23.12 22.58 3kzm s ALA 76 CO 0.89 -0.21 0.97 -1.58 0.00 0.00 0.00 175.76 175.82 3kzm s TRP 77 N -2.59 3.48 0.36 0.00 0.52 -1.26 -1.25 118.94 118.19 3kzm s TRP 77 Ca 0.41 1.70 -0.28 0.00 0.02 0.00 0.00 56.10 57.95 3kzm s TRP 77 Cb 0.01 -2.94 -0.10 0.00 -1.15 0.00 0.00 33.47 29.29 3kzm s TRP 77 CO 0.23 -0.07 1.35 -1.25 0.02 0.00 0.00 176.95 177.24 3kzm s PRO 78 N -2.52 4.21 -0.06 4.98 0.04 -1.26 -4.06 135.00 136.33 3kzm s PRO 78 Ca 0.56 2.30 0.01 0.00 0.04 0.00 0.00 61.00 63.90 3kzm s PRO 78 Cb -0.16 -2.98 -0.03 0.00 0.04 0.00 0.00 34.50 31.37 3kzm s PRO 78 CO 0.21 -0.34 -0.05 0.42 0.04 0.00 0.00 177.00 177.27 3kzm s ILE 79 N -1.16 3.81 -0.13 0.56 1.01 -1.26 -1.76 121.20 122.27 3kzm s ILE 79 Ca 0.51 -0.48 -0.10 0.00 0.00 0.00 0.00 60.65 60.59 3kzm s ILE 79 Cb -0.41 -2.58 -0.05 0.00 0.01 0.00 0.00 42.46 39.43 3kzm s ILE 79 CO 0.55 0.57 0.19 -0.70 0.00 0.00 0.00 174.94 175.55 3kzm s GLU 80 N -0.91 3.78 -0.02 2.79 2.56 0.00 -4.91 118.70 121.98 3kzm s GLU 80 Ca 0.13 -0.05 0.06 0.00 0.00 0.00 0.00 54.97 55.11 3kzm s GLU 80 Cb -0.11 -3.28 -0.08 0.00 2.00 0.00 0.00 34.13 32.66 3kzm s GLU 80 CO 0.02 0.59 0.10 1.19 -0.56 0.00 0.00 175.26 176.60 3kzm n PHE 81 N 2.51 0.00 -2.14 5.30 3.01 -1.26 -1.23 117.46 123.65 3kzm n PHE 81 Ca -0.17 0.00 -0.39 0.00 1.01 0.00 0.00 57.45 57.90 3kzm n PHE 81 Cb 0.54 -0.17 -0.01 0.00 -0.01 0.00 0.00 39.48 39.83 3kzm n PHE 81 CO 0.00 0.00 0.00 -0.80 1.01 0.00 0.00 176.76 176.97 3kzm s ASN 82 N -2.93 6.42 0.22 4.37 0.01 -1.26 -4.94 114.94 116.82 3kzm s ASN 82 Ca -0.02 2.55 -0.10 0.00 -0.71 0.00 0.00 52.86 54.58 3kzm s ASN 82 Cb 0.03 -2.63 -0.07 0.00 0.41 0.00 0.00 41.25 38.99 3kzm s ASN 82 CO 0.24 -0.77 0.54 -0.76 -1.51 0.00 0.00 177.10 174.84 3kzm s LEU 83 N -2.40 4.18 -1.18 0.60 1.43 -1.26 -4.49 118.68 115.56 3kzm s LEU 83 Ca 0.56 0.91 -0.19 0.00 -1.03 0.00 0.00 54.13 54.38 3kzm s LEU 83 Cb -0.36 -3.64 -0.00 0.00 0.03 0.00 0.00 46.19 42.22 3kzm s LEU 83 CO 0.46 -0.06 0.74 0.61 0.23 0.00 0.00 176.35 178.33 3kzm n GLY 84 N -0.07 -0.88 3.16 -3.19 0.00 -1.26 -5.00 105.19 97.95 3kzm n GLY 84 Ca -0.00 0.41 -0.17 0.00 0.00 0.00 0.00 46.02 46.26 3kzm n GLY 84 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3kzm s THR 85 N -3.53 1.00 -0.44 2.61 2.01 -1.26 -5.10 115.64 110.93 3kzm s THR 85 Ca 0.42 -1.37 -0.27 0.00 0.31 0.00 0.00 61.69 60.77 3kzm s THR 85 Cb -0.16 -1.09 0.03 0.00 0.01 0.00 0.00 72.50 71.29 3kzm s THR 85 CO 0.87 -0.34 1.03 -0.69 -0.69 0.00 0.00 174.62 174.81 3kzm s VAL 86 N -1.61 4.38 -1.35 3.82 1.01 -1.26 -4.95 120.40 120.44 3kzm s VAL 86 Ca -0.01 1.14 -0.15 0.00 0.00 0.00 0.00 61.98 62.96 3kzm s VAL 86 Cb -0.08 -4.49 0.08 0.00 0.00 0.00 0.00 36.38 31.89 3kzm s VAL 86 CO 0.02 -0.82 1.92 0.23 0.00 0.00 0.00 175.10 176.44 3kzm n MET 87 N 7.35 3.13 -0.28 2.72 2.81 -1.26 -4.55 117.12 127.04 3kzm n MET 87 Ca 0.09 -3.10 0.08 0.00 -1.81 0.00 0.00 57.70 52.97 3kzm n MET 87 Cb 0.48 -3.30 0.17 0.00 -0.71 0.00 0.00 33.22 29.86 3kzm n MET 87 CO 0.00 0.00 0.00 -0.40 1.51 0.00 0.00 175.97 177.08 3kzm n ASP 88 N 6.68 2.18 0.00 7.83 5.68 -1.26 -5.00 116.55 132.66 3kzm n ASP 88 Ca 0.48 -3.39 0.00 0.00 -0.50 0.00 0.00 54.79 51.38 3kzm n ASP 88 Cb 0.42 -0.47 0.00 0.00 -1.14 0.00 0.00 41.12 39.92 3kzm n ASP 88 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3kzm n GLY 89 N -1.29 2.19 0.07 6.12 0.00 -1.26 -5.03 105.19 105.99 3kzm n GLY 89 Ca 0.18 -0.82 -0.06 0.00 0.00 0.00 0.00 46.02 45.32 3kzm n GLY 89 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3kzm h ASP 90 N 0.00 0.00 -3.80 1.61 3.32 -1.99 -3.46 116.42 112.10 3kzm h ASP 90 Ca 0.00 0.00 -0.51 0.00 0.02 0.00 0.00 57.03 56.54 3kzm h ASP 90 Cb 0.00 0.00 0.03 0.00 0.22 0.00 0.00 39.33 39.58 3kzm h ASP 90 CO 0.00 0.93 0.52 0.42 -1.72 0.00 0.00 179.24 179.39 3kzm s THR 91 N -2.73 3.32 -0.19 0.35 -4.23 -1.26 -4.78 115.64 106.12 3kzm s THR 91 Ca 0.00 1.31 0.09 0.00 -1.18 0.00 0.00 61.69 61.91 3kzm s THR 91 Cb 0.09 -3.83 -0.22 0.00 1.34 0.00 0.00 72.50 69.88 3kzm s THR 91 CO 0.81 0.30 0.07 -0.62 -0.54 0.00 0.00 174.62 174.65 3kzm n GLU 92 N 1.21 0.68 -4.06 3.99 -0.58 -0.72 -4.82 120.64 116.34 3kzm n GLU 92 Ca -0.00 0.12 -0.08 0.00 -0.42 0.00 0.00 57.16 56.77 3kzm n GLU 92 Cb 0.44 -1.58 -0.09 0.00 -0.57 0.00 0.00 31.44 29.64 3kzm n GLU 92 CO 0.00 0.00 0.00 -1.83 -0.48 0.00 0.00 177.13 174.82 3kzm s GLU 93 N -2.52 0.82 0.10 3.49 -1.05 -1.19 -5.04 118.70 113.30 3kzm s GLU 93 Ca -0.20 -1.25 -0.08 0.00 -0.15 0.00 0.00 54.97 53.30 3kzm s GLU 93 Cb 0.07 0.26 -0.06 0.00 -0.44 0.00 0.00 34.13 33.97 3kzm s GLU 93 CO 0.74 -0.22 0.39 -1.58 0.95 0.00 0.00 175.26 175.54 3kzm s HIS 94 N -3.96 3.54 0.56 4.83 5.65 -1.26 -0.82 115.29 123.82 3kzm s HIS 94 Ca 0.14 0.69 0.25 0.00 0.25 0.00 0.00 55.06 56.39 3kzm s HIS 94 Cb 0.07 -2.10 1.51 0.00 -1.18 0.00 0.00 32.58 30.88 3kzm s HIS 94 CO -0.05 0.48 2.10 0.97 -0.65 0.00 0.00 174.74 177.59 3kzm h ILE 95 N 2.55 0.67 -0.63 0.89 6.09 -1.53 -0.28 117.51 125.28 3kzm h ILE 95 Ca -0.48 0.00 0.02 0.00 -1.37 0.00 0.00 64.86 63.03 3kzm h ILE 95 Cb 1.18 0.86 -0.04 0.00 0.47 0.00 0.00 36.82 39.29 3kzm h ILE 95 CO 0.69 0.00 0.39 0.00 -3.07 0.00 0.00 178.15 176.16 3kzm h ALA 96 N 1.83 0.82 0.05 0.18 0.00 -1.92 -0.25 119.26 119.97 3kzm h ALA 96 Ca 0.10 -0.02 -0.23 0.00 0.00 0.00 0.00 54.91 54.76 3kzm h ALA 96 Cb 0.47 -0.20 0.02 0.00 0.00 0.00 0.00 17.79 18.08 3kzm h ALA 96 CO -0.00 0.15 -0.93 0.93 0.00 0.00 0.00 179.25 179.40 3kzm h GLU 97 N 0.78 0.53 -0.60 0.00 3.07 -1.50 -3.13 114.58 113.73 3kzm h GLU 97 Ca 0.25 -0.64 0.02 0.00 -0.50 0.00 0.00 59.36 58.48 3kzm h GLU 97 Cb 0.00 0.20 -0.03 0.00 -0.84 0.00 0.00 28.75 28.08 3kzm h GLU 97 CO -0.09 1.26 0.38 0.28 -1.40 0.00 0.00 179.01 179.43 3kzm h VAL 98 N 0.09 1.10 -0.47 3.13 2.07 -1.07 0.33 116.25 121.44 3kzm h VAL 98 Ca -0.13 -0.26 -0.12 0.00 0.82 0.00 0.00 66.70 67.01 3kzm h VAL 98 Cb 1.63 0.28 -0.02 0.00 -1.52 0.00 0.00 31.29 31.66 3kzm h VAL 98 CO 0.18 0.14 -0.18 0.00 0.02 0.00 0.00 177.57 177.73 3kzm h ALA 99 N 1.24 0.79 -0.35 1.67 0.00 -1.17 -1.34 119.26 120.11 3kzm h ALA 99 Ca 0.23 -0.37 -0.14 0.00 0.00 0.00 0.00 54.91 54.63 3kzm h ALA 99 Cb -0.03 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 3kzm h ALA 99 CO -0.08 0.66 -0.32 0.00 0.00 0.00 0.00 179.25 179.51 3kzm h ARG 100 N 0.81 0.83 0.19 0.00 3.08 -1.44 -1.41 114.38 116.44 3kzm h ARG 100 Ca 0.12 -0.43 -0.01 0.00 0.07 0.00 0.00 59.98 59.73 3kzm h ARG 100 Cb 0.73 0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.79 3kzm h ARG 100 CO 0.06 1.07 -0.09 0.28 -1.07 0.00 0.00 179.97 180.22 3kzm h VAL 101 N 0.62 0.90 -0.81 2.04 2.07 -0.86 -2.69 116.25 117.52 3kzm h VAL 101 Ca 0.06 -0.43 0.09 0.00 0.82 0.00 0.00 66.70 67.24 3kzm h VAL 101 Cb 0.90 1.15 -0.06 0.00 -1.52 0.00 0.00 31.29 31.77 3kzm h VAL 101 CO 0.08 0.10 0.53 -0.07 0.02 0.00 0.00 177.57 178.23 3kzm h LEU 102 N -0.46 0.72 -1.81 2.57 3.38 -1.28 0.11 115.31 118.53 3kzm h LEU 102 Ca -0.03 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.96 3kzm h LEU 102 Cb 0.35 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 40.97 3kzm h LEU 102 CO 0.04 0.44 0.00 1.23 0.09 0.00 0.00 178.44 180.24 3kzm h GLY 103 N 0.80 0.00 0.75 0.83 0.00 -0.93 0.62 103.07 105.14 3kzm h GLY 103 Ca 0.37 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.70 3kzm h GLY 103 CO -0.14 0.00 -0.65 0.54 0.00 0.00 0.00 176.54 176.29 3kzm n ARG 104 N -2.59 0.02 -0.07 4.80 5.12 0.37 -4.54 116.66 119.76 3kzm n ARG 104 Ca -0.01 0.00 -0.14 0.00 -1.93 0.00 0.00 57.85 55.77 3kzm n ARG 104 Cb 0.10 -1.51 -0.05 0.00 -1.16 0.00 0.00 32.46 29.85 3kzm n ARG 104 CO 0.00 0.00 0.00 0.66 -1.93 0.00 0.00 177.63 176.36 3kzm n TYR 105 N -1.53 0.00 -3.26 -1.55 0.53 0.01 -5.08 117.16 106.27 3kzm n TYR 105 Ca 0.05 0.00 -0.19 0.00 -1.02 0.00 0.00 57.90 56.74 3kzm n TYR 105 Cb 0.34 -0.52 -0.01 0.00 -1.03 0.00 0.00 39.34 38.12 3kzm n TYR 105 CO 0.00 0.00 0.00 0.14 -1.02 0.00 0.00 176.86 175.98 3kzm s VAL 106 N -2.50 2.83 -0.67 -0.72 -7.23 -0.05 -4.90 120.40 107.16 3kzm s VAL 106 Ca -0.24 -1.16 0.20 0.00 -1.81 0.00 0.00 61.98 58.97 3kzm s VAL 106 Cb 0.07 -2.98 -0.24 0.00 0.56 0.00 0.00 36.38 33.78 3kzm s VAL 106 CO 0.32 0.00 0.72 0.47 -0.31 0.00 0.00 175.10 176.30 3kzm n ASP 107 N -1.72 0.77 -3.74 4.85 8.00 -0.31 -4.67 116.55 119.73 3kzm n ASP 107 Ca 0.06 -0.69 -0.13 0.00 0.71 0.00 0.00 54.79 54.74 3kzm n ASP 107 Cb 0.60 1.26 -0.08 0.00 -0.02 0.00 0.00 41.12 42.88 3kzm n ASP 107 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 3kzm s LEU 108 N -3.34 0.74 -0.08 0.64 1.43 -1.07 -4.20 118.68 112.80 3kzm s LEU 108 Ca 0.03 0.06 -0.00 0.00 -1.03 0.00 0.00 54.13 53.19 3kzm s LEU 108 Cb 0.14 1.39 0.02 0.00 0.03 0.00 0.00 46.19 47.78 3kzm s LEU 108 CO 0.81 -0.51 -0.05 -0.63 0.23 0.00 0.00 176.35 176.21 3kzm s ILE 109 N -1.66 0.71 -0.02 -0.59 1.01 -0.44 -1.17 121.20 119.04 3kzm s ILE 109 Ca -0.11 -0.14 -0.01 0.00 0.00 0.00 0.00 60.65 60.39 3kzm s ILE 109 Cb -0.04 -0.76 -0.04 0.00 0.01 0.00 0.00 42.46 41.64 3kzm s ILE 109 CO 0.03 0.30 0.10 -0.83 0.00 0.00 0.00 174.94 174.53 3kzm s GLY 110 N 1.46 2.05 -0.02 6.18 0.00 0.43 -0.02 107.32 117.40 3kzm s GLY 110 Ca -0.01 -0.83 -0.00 0.00 0.00 0.00 0.00 44.72 43.87 3kzm s GLY 110 CO -0.04 -0.69 0.03 0.54 0.00 0.00 0.00 173.10 172.94 3kzm s VAL 111 N -1.19 -0.04 -0.18 1.40 0.11 0.08 -0.96 120.40 119.62 3kzm s VAL 111 Ca 0.23 0.23 0.00 0.00 -2.93 0.00 0.00 61.98 59.51 3kzm s VAL 111 Cb -0.12 -0.11 0.01 0.00 -1.53 0.00 0.00 36.38 34.63 3kzm s VAL 111 CO 0.13 0.11 -0.16 -0.60 -3.33 0.00 0.00 175.10 171.25 3kzm s ARG 112 N 1.22 3.11 -0.27 1.54 6.06 -0.28 -0.86 118.95 129.47 3kzm s ARG 112 Ca -0.07 -0.78 -0.00 0.00 -2.50 0.00 0.00 55.73 52.37 3kzm s ARG 112 Cb -0.13 -2.65 0.15 0.00 0.06 0.00 0.00 34.95 32.39 3kzm s ARG 112 CO -0.03 -0.14 0.42 0.00 -2.50 0.00 0.00 175.30 173.04 3kzm s ALA 113 N 1.18 -1.29 0.62 6.12 0.00 -0.62 -0.67 121.76 127.11 3kzm s ALA 113 Ca 0.02 0.71 -0.14 0.00 0.00 0.00 0.00 51.96 52.55 3kzm s ALA 113 Cb -0.14 -1.92 -0.02 0.00 0.00 0.00 0.00 23.12 21.04 3kzm s ALA 113 CO -0.08 -1.49 1.06 -0.06 0.00 0.00 0.00 175.76 175.19 3kzm s PHE 114 N 2.58 2.99 0.79 0.00 0.08 -1.26 -4.17 117.98 118.99 3kzm s PHE 114 Ca 0.12 1.49 -0.13 0.00 0.12 0.00 0.00 56.93 58.54 3kzm s PHE 114 Cb -0.14 -2.99 0.07 0.00 -0.57 0.00 0.00 43.02 39.40 3kzm s PHE 114 CO -0.23 -1.18 1.15 -1.25 -0.10 0.00 0.00 175.22 173.62 3kzm s PRO 115 N -4.31 1.88 0.43 0.24 0.04 -1.26 -4.91 135.00 127.09 3kzm s PRO 115 Ca 0.62 1.53 0.23 0.00 0.04 0.00 0.00 61.00 63.43 3kzm s PRO 115 Cb -0.16 -1.83 0.64 0.00 0.04 0.00 0.00 34.50 33.20 3kzm s PRO 115 CO 0.42 -1.99 1.71 0.87 0.04 0.00 0.00 177.00 178.05 3kzm h LYS 116 N -0.93 0.00 -0.32 4.56 1.57 -1.95 -3.47 116.57 116.03 3kzm h LYS 116 Ca -0.45 0.00 -0.14 0.00 -1.87 0.00 0.00 60.65 58.19 3kzm h LYS 116 Cb 1.27 0.00 -0.05 0.00 0.08 0.00 0.00 32.23 33.52 3kzm h LYS 116 CO 0.48 0.18 -0.12 1.19 -0.57 0.00 0.00 179.45 180.60 3kzm n PHE 117 N -3.21 0.00 -0.10 -1.35 3.01 -1.26 -4.89 117.46 109.66 3kzm n PHE 117 Ca 0.02 0.00 -0.22 0.00 1.01 0.00 0.00 57.45 58.26 3kzm n PHE 117 Cb 0.50 -1.53 -0.12 0.00 -0.01 0.00 0.00 39.48 38.33 3kzm n PHE 117 CO 0.00 0.00 0.00 0.28 1.01 0.00 0.00 176.76 178.05 3kzm n VAL 118 N -2.72 1.58 -3.40 -4.37 0.31 -1.26 -3.70 118.33 104.77 3kzm n VAL 118 Ca -0.07 -0.50 -0.13 0.00 -0.01 0.00 0.00 64.34 63.63 3kzm n VAL 118 Cb 0.26 -1.65 -0.10 0.00 -0.91 0.00 0.00 33.84 31.45 3kzm n VAL 118 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 3kzm s ASP 119 N -6.87 0.69 0.41 4.52 2.15 -1.26 -3.77 116.67 112.54 3kzm s ASP 119 Ca -0.32 0.03 0.10 0.00 0.43 0.00 0.00 52.55 52.79 3kzm s ASP 119 Cb 0.09 0.84 0.92 0.00 -0.30 0.00 0.00 42.92 44.48 3kzm s ASP 119 CO 0.62 -0.31 2.00 -0.25 -0.17 0.00 0.00 175.17 177.05 3kzm h TRP 120 N 8.23 0.53 -0.42 -5.34 -0.00 -1.91 0.19 115.95 117.22 3kzm h TRP 120 Ca -0.18 0.01 0.10 0.00 -0.00 0.00 0.00 58.89 58.82 3kzm h TRP 120 Cb 1.15 -0.17 -0.02 0.00 -0.00 0.00 0.00 29.16 30.12 3kzm h TRP 120 CO 0.13 0.28 0.29 1.03 -0.00 0.00 0.00 178.44 180.18 3kzm h SER 121 N 0.52 0.12 0.14 2.65 0.87 -1.98 0.32 113.55 116.19 3kzm h SER 121 Ca 0.25 0.00 -0.36 0.00 -1.23 0.00 0.00 61.79 60.45 3kzm h SER 121 Cb 0.32 -0.02 -0.02 0.00 -0.44 0.00 0.00 62.40 62.24 3kzm h SER 121 CO -0.07 0.07 -2.03 0.29 -0.53 0.00 0.00 176.83 174.56 3kzm n LYS 122 N -4.45 0.74 -0.23 2.24 5.02 -0.09 -4.23 118.16 117.17 3kzm n LYS 122 Ca 0.07 0.25 -0.06 0.00 -2.02 0.00 0.00 58.31 56.55 3kzm n LYS 122 Cb 0.40 -1.70 0.09 0.00 -0.02 0.00 0.00 35.03 33.81 3kzm n LYS 122 CO 0.00 0.00 0.00 -0.44 -0.52 0.00 0.00 177.40 176.44 3kzm h ASP 123 N 0.06 1.01 0.39 4.39 3.32 -0.55 -2.81 116.42 122.22 3kzm h ASP 123 Ca -0.43 -0.19 0.00 0.00 0.02 0.00 0.00 57.03 56.43 3kzm h ASP 123 Cb 2.02 -0.26 0.00 0.00 0.22 0.00 0.00 39.33 41.31 3kzm h ASP 123 CO 0.07 0.95 0.00 -2.11 -1.72 0.00 0.00 179.24 176.43 3kzm n ARG 124 N -4.25 0.12 0.20 3.56 1.85 0.11 -1.91 116.66 116.34 3kzm n ARG 124 Ca 0.05 0.47 0.14 0.00 -1.00 0.00 0.00 57.85 57.51 3kzm n ARG 124 Cb 0.24 -1.80 0.45 0.00 -1.05 0.00 0.00 32.46 30.30 3kzm n ARG 124 CO 0.00 0.00 0.00 1.49 -0.01 0.00 0.00 177.63 179.11 3kzm h GLU 125 N 0.00 0.00 -5.75 2.89 4.57 -1.67 -3.47 114.58 111.15 3kzm h GLU 125 Ca 0.00 0.00 -0.36 0.00 -1.18 0.00 0.00 59.36 57.82 3kzm h GLU 125 Cb 0.19 0.00 0.15 0.00 -0.16 0.00 0.00 28.75 28.94 3kzm h GLU 125 CO 0.00 0.00 -0.74 -3.47 -1.18 0.00 0.00 179.01 173.62 3kzm n ASP 126 N -2.77 -3.67 -0.16 1.04 2.03 -0.80 -4.87 116.55 107.36 3kzm n ASP 126 Ca 0.03 -0.60 -0.05 0.00 0.52 0.00 0.00 54.79 54.69 3kzm n ASP 126 Cb 0.38 -5.04 0.04 0.00 -0.72 0.00 0.00 41.12 35.78 3kzm n ASP 126 CO 0.00 0.00 0.00 -0.61 -1.92 0.00 0.00 177.20 174.67 3kzm h GLN 127 N -2.20 0.46 0.45 -0.67 4.15 -1.83 -1.86 115.11 113.60 3kzm h GLN 127 Ca -0.58 -0.03 -0.02 0.00 0.77 0.00 0.00 58.65 58.79 3kzm h GLN 127 Cb 1.35 -0.10 0.00 0.00 0.21 0.00 0.00 27.48 28.94 3kzm h GLN 127 CO 0.53 0.30 -0.22 0.28 -1.93 0.00 0.00 178.83 177.79 3kzm h VAL 128 N 0.47 0.56 -0.34 2.39 2.07 -1.96 -0.51 116.25 118.93 3kzm h VAL 128 Ca 0.21 -0.06 0.01 0.00 0.82 0.00 0.00 66.70 67.69 3kzm h VAL 128 Cb 0.12 0.58 -0.02 0.00 -1.52 0.00 0.00 31.29 30.46 3kzm h VAL 128 CO -0.15 0.01 0.21 0.25 0.02 0.00 0.00 177.57 177.91 3kzm h LEU 129 N -0.64 0.34 -1.23 2.57 5.85 -1.94 -1.63 115.31 118.65 3kzm h LEU 129 Ca -0.06 -0.00 -0.03 0.00 0.84 0.00 0.00 57.88 58.62 3kzm h LEU 129 Cb 0.48 -0.07 -0.02 0.00 0.37 0.00 0.00 40.66 41.41 3kzm h LEU 129 CO 0.10 0.25 0.15 0.11 -0.34 0.00 0.00 178.44 178.71 3kzm h LYS 130 N 0.42 0.68 -0.36 1.25 1.57 -1.30 -1.47 116.57 117.37 3kzm h LYS 130 Ca 0.13 -0.11 -0.14 0.00 -1.87 0.00 0.00 60.65 58.66 3kzm h LYS 130 Cb -0.01 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 32.17 3kzm h LYS 130 CO -0.05 0.60 -0.35 0.77 -0.57 0.00 0.00 179.45 179.84 3kzm h SER 131 N 0.67 0.87 -0.37 0.86 0.02 -0.72 -0.40 113.55 114.48 3kzm h SER 131 Ca 0.16 -0.38 -0.04 0.00 -0.84 0.00 0.00 61.79 60.69 3kzm h SER 131 Cb 0.20 -0.24 -0.02 0.00 0.14 0.00 0.00 62.40 62.48 3kzm h SER 131 CO -0.01 1.13 0.09 -0.26 -1.14 0.00 0.00 176.83 176.65 3kzm h PHE 132 N 0.69 0.62 -0.08 3.45 -1.00 -0.88 -1.80 116.94 117.94 3kzm h PHE 132 Ca 0.07 -0.07 -0.05 0.00 2.81 0.00 0.00 57.97 60.72 3kzm h PHE 132 Cb 0.91 -0.18 -0.01 0.00 3.61 0.00 0.00 35.95 40.28 3kzm h PHE 132 CO 0.05 0.61 -0.19 0.00 -1.61 0.00 0.00 178.31 177.17 3kzm h ALA 133 N 0.94 1.53 -0.08 2.45 0.00 -1.13 0.25 119.26 123.22 3kzm h ALA 133 Ca 0.12 -0.22 -0.11 0.00 0.00 0.00 0.00 54.91 54.70 3kzm h ALA 133 Cb 0.30 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.03 3kzm h ALA 133 CO 0.00 0.34 -0.38 -0.22 0.00 0.00 0.00 179.25 178.99 3kzm h LYS 134 N 0.13 0.40 0.00 0.00 3.64 -0.79 -3.36 116.57 116.59 3kzm h LYS 134 Ca 0.02 -0.32 0.00 0.00 -1.27 0.00 0.00 60.65 59.08 3kzm h LYS 134 Cb 0.41 0.06 0.00 0.00 -0.41 0.00 0.00 32.23 32.30 3kzm h LYS 134 CO 0.03 0.96 -1.28 0.66 -2.27 0.00 0.00 179.45 177.55 3kzm n TYR 135 N -4.36 0.42 -2.50 1.91 4.01 -0.70 -4.95 117.16 110.98 3kzm n TYR 135 Ca -0.08 0.12 -0.41 0.00 -0.16 0.00 0.00 57.90 57.37 3kzm n TYR 135 Cb 0.53 -0.61 -0.04 0.00 -0.31 0.00 0.00 39.34 38.91 3kzm n TYR 135 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 3kzm s SER 136 N -4.53 7.25 0.00 7.72 0.15 0.07 -4.25 113.70 120.11 3kzm s SER 136 Ca -0.01 2.10 0.28 0.00 0.70 0.00 0.00 55.95 59.02 3kzm s SER 136 Cb 0.13 -2.60 1.03 0.00 -1.71 0.00 0.00 66.02 62.87 3kzm s SER 136 CO 0.83 -0.24 1.73 -0.81 1.20 0.00 0.00 173.24 175.95 3kzm n PRO 137 N 2.39 1.21 -4.39 5.44 -0.04 -1.26 -4.86 135.00 133.49 3kzm n PRO 137 Ca 0.03 -0.64 -0.21 0.00 -0.04 0.00 0.00 63.50 62.63 3kzm n PRO 137 Cb 0.46 -1.49 -0.10 0.00 -0.04 0.00 0.00 33.50 32.33 3kzm n PRO 137 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 3kzm s VAL 138 N -2.23 2.02 0.35 0.52 -7.23 -1.26 -5.11 120.40 107.46 3kzm s VAL 138 Ca 0.33 -2.23 -0.28 0.00 -1.81 0.00 0.00 61.98 57.99 3kzm s VAL 138 Cb 0.20 -2.11 -0.12 0.00 0.56 0.00 0.00 36.38 34.92 3kzm s VAL 138 CO 0.42 -0.47 1.26 -2.65 -0.31 0.00 0.00 175.10 173.35 3kzm n PRO 139 N -0.34 2.03 -4.61 4.82 -0.02 -1.26 -4.76 135.00 130.86 3kzm n PRO 139 Ca -0.08 0.71 -0.34 0.00 -2.02 0.00 0.00 63.50 61.78 3kzm n PRO 139 Cb 0.60 -2.30 -0.11 0.00 -0.02 0.00 0.00 33.50 31.67 3kzm n PRO 139 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 3kzm s VAL 140 N -1.11 3.71 -0.09 -1.45 1.01 -1.26 -1.33 120.40 119.88 3kzm s VAL 140 Ca 0.57 -0.47 0.04 0.00 0.00 0.00 0.00 61.98 62.11 3kzm s VAL 140 Cb -0.57 -2.52 0.00 0.00 0.00 0.00 0.00 36.38 33.29 3kzm s VAL 140 CO 0.61 0.59 -0.22 -0.63 0.00 0.00 0.00 175.10 175.46 3kzm s ILE 141 N -0.72 1.90 -0.32 2.22 1.01 0.97 -1.21 121.20 125.05 3kzm s ILE 141 Ca 0.11 -0.93 -0.29 0.00 0.00 0.00 0.00 60.65 59.54 3kzm s ILE 141 Cb -0.11 -1.65 0.00 0.00 0.01 0.00 0.00 42.46 40.71 3kzm s ILE 141 CO 0.02 0.52 1.34 0.21 0.00 0.00 0.00 174.94 177.03 3kzm s ASN 142 N 0.41 6.59 -0.15 3.58 3.84 -0.26 -0.74 114.94 128.20 3kzm s ASN 142 Ca -0.18 1.14 0.17 0.00 0.21 0.00 0.00 52.86 54.20 3kzm s ASN 142 Cb -0.18 -2.54 0.71 0.00 -0.55 0.00 0.00 41.25 38.70 3kzm s ASN 142 CO 0.08 -1.16 1.63 0.23 -2.79 0.00 0.00 177.10 175.08 3kzm n MET 143 N 7.49 3.94 0.00 0.43 2.81 -0.04 -4.44 117.12 127.31 3kzm n MET 143 Ca 0.15 -2.93 0.00 0.00 -1.81 0.00 0.00 57.70 53.12 3kzm n MET 143 Cb 0.47 -1.96 0.00 0.00 -0.71 0.00 0.00 33.22 31.02 3kzm n MET 143 CO 0.00 0.00 0.00 -1.91 1.51 0.00 0.00 175.97 175.57 3kzm n GLU 144 N 0.80 0.00 0.00 0.03 2.13 -1.25 -4.69 120.64 117.66 3kzm n GLU 144 Ca 0.25 0.00 0.00 0.00 0.66 0.00 0.00 57.16 58.07 3kzm n GLU 144 Cb 0.95 0.00 0.00 0.00 0.27 0.00 0.00 31.44 32.66 3kzm n GLU 144 CO 0.00 0.00 0.00 0.25 -0.41 0.00 0.00 177.13 176.97 3kzm n THR 145 N 1.43 0.00 0.74 6.31 -2.24 -1.26 -1.58 114.28 117.68 3kzm n THR 145 Ca 0.00 0.00 0.09 0.00 -2.27 0.00 0.00 64.05 61.87 3kzm n THR 145 Cb 0.00 0.00 0.05 0.00 -2.10 0.00 0.00 70.33 68.28 3kzm n THR 145 CO 0.00 0.00 0.00 2.30 -0.57 0.00 0.00 175.07 176.80 3kzm n ILE 146 N 0.00 0.00 -4.08 2.28 -5.35 -1.26 -4.43 119.36 106.52 3kzm n ILE 146 Ca 0.00 -0.45 -0.09 0.00 -0.27 0.00 0.00 62.75 61.94 3kzm n ILE 146 Cb 0.00 1.33 -0.09 0.00 -1.74 0.00 0.00 39.64 39.13 3kzm n ILE 146 CO 0.00 0.00 0.00 0.42 -1.76 0.00 0.00 176.55 175.21 3kzm s THR 147 N -1.61 0.14 -0.40 7.28 -4.23 -1.26 -3.64 115.64 111.92 3kzm s THR 147 Ca 0.19 -1.74 0.08 0.00 -1.18 0.00 0.00 61.69 59.04 3kzm s THR 147 Cb 0.14 -1.79 0.25 0.00 1.34 0.00 0.00 72.50 72.45 3kzm s THR 147 CO 0.27 -0.63 0.53 1.57 -0.54 0.00 0.00 174.62 175.83 3kzm n HIS 148 N -0.04 -0.19 0.08 3.99 -0.00 -1.26 -4.25 115.22 113.55 3kzm n HIS 148 Ca -0.09 -3.59 0.12 0.00 0.46 0.00 0.00 57.72 54.62 3kzm n HIS 148 Cb 0.63 -0.35 0.59 0.00 -0.12 0.00 0.00 29.99 30.74 3kzm n HIS 148 CO 0.00 0.00 0.00 -1.00 0.46 0.00 0.00 176.34 175.80 3kzm h PRO 149 N 4.02 0.16 -0.24 1.57 0.13 -1.84 -1.17 132.00 134.63 3kzm h PRO 149 Ca 0.08 -0.01 -0.11 0.00 -0.87 0.00 0.00 66.00 65.08 3kzm h PRO 149 Cb 0.87 -0.04 -0.01 0.00 0.13 0.00 0.00 31.00 31.95 3kzm h PRO 149 CO 0.48 0.11 -0.33 0.00 -0.23 0.00 0.00 178.00 178.02 3kzm h GLN 151 N 0.44 0.76 -0.33 0.00 5.75 -1.61 -2.60 115.11 117.51 3kzm h GLN 151 Ca 0.05 -0.32 0.05 0.00 -0.15 0.00 0.00 58.65 58.28 3kzm h GLN 151 Cb 0.79 -0.03 -0.05 0.00 1.07 0.00 0.00 27.48 29.27 3kzm h GLN 151 CO 0.06 0.93 0.05 0.93 -2.65 0.00 0.00 178.83 178.16 3kzm h GLU 152 N 0.65 0.16 -0.15 1.69 5.08 -1.00 -0.29 114.58 120.72 3kzm h GLU 152 Ca 0.08 -0.01 -0.13 0.00 -1.00 0.00 0.00 59.36 58.30 3kzm h GLU 152 Cb 0.78 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.98 3kzm h GLU 152 CO 0.06 0.11 -0.48 -0.07 -1.00 0.00 0.00 179.01 177.63 3kzm h LEU 153 N 0.16 0.43 -0.53 1.33 3.38 -1.41 0.90 115.31 119.57 3kzm h LEU 153 Ca 0.16 -0.21 -0.11 0.00 0.09 0.00 0.00 57.88 57.81 3kzm h LEU 153 Cb 0.18 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 40.79 3kzm h LEU 153 CO -0.22 0.84 -0.10 0.00 0.09 0.00 0.00 178.44 179.06 3kzm h ALA 154 N 1.18 0.72 -0.01 1.53 0.00 -1.20 -0.38 119.26 121.10 3kzm h ALA 154 Ca 0.02 -0.34 -0.00 0.00 0.00 0.00 0.00 54.91 54.58 3kzm h ALA 154 Cb 0.96 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 18.56 3kzm h ALA 154 CO 0.08 0.63 0.00 1.25 0.00 0.00 0.00 179.25 181.21 3kzm h HIS 155 N 0.87 0.01 -0.41 0.00 -0.00 -0.87 -1.73 115.15 113.03 3kzm h HIS 155 Ca 0.14 -0.00 0.02 0.00 -0.00 0.00 0.00 60.37 60.53 3kzm h HIS 155 Cb 0.66 -0.00 -0.03 0.00 -0.00 0.00 0.00 27.41 28.04 3kzm h HIS 155 CO 0.05 0.22 0.24 0.00 -0.00 0.00 0.00 177.93 178.43 3kzm h ALA 156 N 0.79 0.52 -0.37 5.26 0.00 -0.70 -1.61 119.26 123.16 3kzm h ALA 156 Ca 0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 3kzm h ALA 156 Cb 0.22 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 3kzm h ALA 156 CO -0.00 -0.10 0.23 1.25 0.00 0.00 0.00 179.25 180.63 3kzm h LEU 157 N 0.47 0.44 -1.16 0.00 5.85 -1.02 -1.31 115.31 118.59 3kzm h LEU 157 Ca 0.17 -0.04 0.06 0.00 0.84 0.00 0.00 57.88 58.91 3kzm h LEU 157 Cb 0.03 -0.11 -0.06 0.00 0.37 0.00 0.00 40.66 40.89 3kzm h LEU 157 CO -0.09 0.35 0.58 0.00 -0.34 0.00 0.00 178.44 178.94 3kzm h ALA 158 N 1.10 1.52 -0.30 1.25 0.00 -0.97 -0.25 119.26 121.61 3kzm h ALA 158 Ca 0.13 -0.02 -0.10 0.00 0.00 0.00 0.00 54.91 54.92 3kzm h ALA 158 Cb -0.01 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.51 3kzm h ALA 158 CO -0.03 0.34 -0.19 -0.07 0.00 0.00 0.00 179.25 179.31 3kzm h LEU 159 N 1.01 0.69 -1.15 0.00 3.38 -0.79 -1.23 115.31 117.22 3kzm h LEU 159 Ca 0.38 -0.43 -0.03 0.00 0.09 0.00 0.00 57.88 57.89 3kzm h LEU 159 Cb 0.20 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 40.73 3kzm h LEU 159 CO -0.14 0.97 0.19 1.56 0.09 0.00 0.00 178.44 181.11 3kzm h GLN 160 N 0.41 0.79 -0.41 1.13 4.20 -0.60 -1.42 115.11 119.22 3kzm h GLN 160 Ca 0.06 -0.13 -0.15 0.00 0.06 0.00 0.00 58.65 58.49 3kzm h GLN 160 Cb 0.73 -0.14 -0.01 0.00 0.30 0.00 0.00 27.48 28.36 3kzm h GLN 160 CO 0.05 0.67 -0.33 0.93 -0.67 0.00 0.00 178.83 179.48 3kzm h GLU 161 N 0.78 0.94 0.00 1.46 5.08 -0.93 -0.17 114.58 121.73 3kzm h GLU 161 Ca 0.18 -0.46 -0.00 0.00 -1.00 0.00 0.00 59.36 58.08 3kzm h GLU 161 Cb 0.19 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.44 3kzm h GLU 161 CO -0.01 1.12 -0.00 1.25 -1.00 0.00 0.00 179.01 180.37 3kzm h HIS 162 N 0.78 -0.00 -0.00 4.33 2.76 -0.75 -2.89 115.15 119.38 3kzm h HIS 162 Ca 0.08 -0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.25 3kzm h HIS 162 Cb 0.92 0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.88 3kzm h HIS 162 CO 0.06 0.15 -0.05 1.19 -1.30 0.00 0.00 177.93 177.98 3kzm n PHE 163 N -5.02 0.00 -2.33 5.26 3.01 -0.58 -4.93 117.46 112.87 3kzm n PHE 163 Ca -0.07 0.00 -0.14 0.00 1.01 0.00 0.00 57.45 58.24 3kzm n PHE 163 Cb 0.10 -0.18 -0.00 0.00 -0.01 0.00 0.00 39.48 39.38 3kzm n PHE 163 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3kzm n GLY 164 N 1.23 -0.22 3.52 1.37 0.00 -0.18 -5.01 105.19 105.91 3kzm n GLY 164 Ca 0.16 -0.27 -0.17 0.00 0.00 0.00 0.00 46.02 45.74 3kzm n GLY 164 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 3kzm s THR 165 N -2.75 0.00 -0.57 2.61 -1.32 -0.56 -5.02 115.64 108.03 3kzm s THR 165 Ca 0.02 0.00 0.24 0.00 -1.21 0.00 0.00 61.69 60.75 3kzm s THR 165 Cb -0.01 -1.00 0.29 0.00 -1.51 0.00 0.00 72.50 70.27 3kzm s THR 165 CO 0.03 0.00 1.64 1.55 -2.21 0.00 0.00 174.62 175.63 3kzm h PRO 166 N 2.94 0.00 -5.26 7.08 0.13 -1.95 -3.40 132.00 131.54 3kzm h PRO 166 Ca -0.26 0.00 -0.66 0.00 -0.87 0.00 0.00 66.00 64.21 3kzm h PRO 166 Cb 1.15 0.00 -0.16 0.00 0.13 0.00 0.00 31.00 32.11 3kzm h PRO 166 CO 0.38 0.00 0.22 0.34 -0.23 0.00 0.00 178.00 178.71 3kzm s ASP 167 N -5.34 6.26 0.00 1.44 2.15 -1.26 -4.90 116.67 115.02 3kzm s ASP 167 Ca 0.08 -0.73 0.23 0.00 0.43 0.00 0.00 52.55 52.56 3kzm s ASP 167 Cb 0.09 -2.34 0.50 0.00 -0.30 0.00 0.00 42.92 40.88 3kzm s ASP 167 CO 0.65 -1.00 1.45 0.18 -0.17 0.00 0.00 175.17 176.27 3kzm n LEU 168 N 6.59 3.39 -4.69 -1.34 4.77 -1.26 -4.99 117.00 119.46 3kzm n LEU 168 Ca -0.04 -1.53 -0.41 0.00 -0.03 0.00 0.00 56.01 54.00 3kzm n LEU 168 Cb 0.46 -0.30 0.01 0.00 -2.33 0.00 0.00 43.42 41.26 3kzm n LEU 168 CO 0.57 0.76 0.86 0.54 -1.33 0.00 0.00 177.39 178.79 3kzm n ARG 169 N 1.41 1.89 0.00 3.23 1.74 -1.25 -2.31 116.66 121.37 3kzm n ARG 169 Ca 0.20 0.67 0.00 0.00 -0.77 0.00 0.00 57.85 57.95 3kzm n ARG 169 Cb 0.58 -2.34 0.00 0.00 -1.02 0.00 0.00 32.46 29.68 3kzm n ARG 169 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3kzm n GLY 170 N 0.84 3.17 3.77 -0.13 0.00 -1.24 -4.99 105.19 106.61 3kzm n GLY 170 Ca 0.07 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.69 3kzm n GLY 170 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3kzm s LYS 171 N -0.44 4.38 -0.33 1.61 3.01 -0.98 -4.72 119.74 122.26 3kzm s LYS 171 Ca 0.00 2.04 -0.24 0.00 -1.01 0.00 0.00 55.97 56.77 3kzm s LYS 171 Cb 0.00 -3.03 0.01 0.00 -1.01 0.00 0.00 37.83 33.79 3kzm s LYS 171 CO 0.00 -0.11 0.80 0.15 0.51 0.00 0.00 175.35 176.71 3kzm s LYS 172 N -1.79 3.87 -0.18 1.68 -0.14 -1.26 -0.99 119.74 120.93 3kzm s LYS 172 Ca 0.49 0.49 -0.03 0.00 -1.36 0.00 0.00 55.97 55.56 3kzm s LYS 172 Cb -0.36 -3.77 -0.01 0.00 -1.68 0.00 0.00 37.83 32.01 3kzm s LYS 172 CO 0.47 -0.77 -0.06 -0.47 -0.76 0.00 0.00 175.35 173.76 3kzm s TYR 173 N 3.07 2.94 -0.25 3.18 5.04 0.42 -0.49 117.35 131.26 3kzm s TYR 173 Ca 0.33 -0.70 -0.02 0.00 -2.44 0.00 0.00 57.07 54.24 3kzm s TYR 173 Cb -0.13 -2.00 0.03 0.00 0.35 0.00 0.00 41.96 40.20 3kzm s TYR 173 CO 0.15 -0.33 -0.05 0.08 -1.34 0.00 0.00 175.55 174.05 3kzm s VAL 174 N 0.92 2.92 -0.49 3.14 1.01 0.20 -1.07 120.40 127.03 3kzm s VAL 174 Ca -0.01 -1.04 -0.16 0.00 0.00 0.00 0.00 61.98 60.77 3kzm s VAL 174 Cb -0.15 -2.49 0.08 0.00 0.00 0.00 0.00 36.38 33.82 3kzm s VAL 174 CO 0.01 0.18 0.45 -0.22 0.00 0.00 0.00 175.10 175.51 3kzm s LEU 175 N 1.33 5.57 -0.08 3.92 2.96 -0.64 -0.83 118.68 130.90 3kzm s LEU 175 Ca -0.00 -1.31 -0.01 0.00 -0.22 0.00 0.00 54.13 52.59 3kzm s LEU 175 Cb -0.17 -2.23 -0.03 0.00 0.50 0.00 0.00 46.19 44.26 3kzm s LEU 175 CO -0.04 -0.71 -0.02 0.28 -1.32 0.00 0.00 176.35 174.54 3kzm s THR 176 N 1.81 4.14 0.50 3.68 -1.32 -0.17 -1.07 115.64 123.22 3kzm s THR 176 Ca 0.06 -0.31 -0.20 0.00 -1.21 0.00 0.00 61.69 60.03 3kzm s THR 176 Cb -0.24 -2.73 -0.08 0.00 -1.51 0.00 0.00 72.50 67.94 3kzm s THR 176 CO 0.07 0.60 1.06 0.86 -2.21 0.00 0.00 174.62 175.00 3kzm s TRP 177 N -0.81 2.92 0.14 9.09 -0.00 -0.38 -1.78 118.94 128.11 3kzm s TRP 177 Ca 0.12 1.57 0.01 0.00 -0.00 0.00 0.00 56.10 57.80 3kzm s TRP 177 Cb -0.11 -3.12 -0.04 0.00 -0.00 0.00 0.00 33.47 30.20 3kzm s TRP 177 CO 0.02 -1.02 -0.01 0.95 -0.00 0.00 0.00 176.95 176.90 3kzm s THR 178 N -1.96 0.53 0.63 5.86 -4.23 -0.86 -4.77 115.64 110.84 3kzm s THR 178 Ca 0.68 -1.94 -0.12 0.00 -1.18 0.00 0.00 61.69 59.13 3kzm s THR 178 Cb -0.18 -1.96 -0.03 0.00 1.34 0.00 0.00 72.50 71.67 3kzm s THR 178 CO 0.22 -0.61 1.04 -0.47 -0.54 0.00 0.00 174.62 174.26 3kzm s TYR 179 N -3.75 3.42 -0.29 3.99 5.04 -1.26 -4.15 117.35 120.35 3kzm s TYR 179 Ca 0.20 1.36 -0.17 0.00 -2.44 0.00 0.00 57.07 56.02 3kzm s TYR 179 Cb 0.06 -2.79 0.16 0.00 0.35 0.00 0.00 41.96 39.74 3kzm s TYR 179 CO 0.00 -0.85 1.05 -1.58 -1.34 0.00 0.00 175.55 172.83 3kzm s HIS 180 N -3.05 -0.45 -0.84 4.97 5.65 -1.26 -4.87 115.29 115.44 3kzm s HIS 180 Ca 0.57 0.92 0.00 0.00 0.25 0.00 0.00 55.06 56.80 3kzm s HIS 180 Cb -0.12 0.30 0.00 0.00 -1.18 0.00 0.00 32.58 31.58 3kzm s HIS 180 CO 0.51 -0.22 0.56 -0.35 -0.65 0.00 0.00 174.74 174.59 3kzm n PRO 181 N 3.36 0.00 -3.81 2.88 -0.04 -1.26 -4.57 135.00 131.56 3kzm n PRO 181 Ca -0.17 0.16 -0.10 0.00 -0.04 0.00 0.00 63.50 63.34 3kzm n PRO 181 Cb 0.57 -1.62 -0.07 0.00 -0.04 0.00 0.00 33.50 32.34 3kzm n PRO 181 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 3kzm s LYS 182 N -2.12 0.82 0.06 0.54 1.02 -1.26 -5.09 119.74 113.71 3kzm s LYS 182 Ca 0.00 -0.76 -0.30 0.00 0.02 0.00 0.00 55.97 54.93 3kzm s LYS 182 Cb 0.00 0.34 -0.05 0.00 -0.52 0.00 0.00 37.83 37.60 3kzm s LYS 182 CO 0.00 -0.26 1.15 -1.25 -0.92 0.00 0.00 175.35 174.07 3kzm s PRO 183 N -3.25 4.47 0.49 -1.68 0.04 -1.26 -4.82 135.00 128.98 3kzm s PRO 183 Ca 0.00 1.70 0.06 0.00 0.04 0.00 0.00 61.00 62.79 3kzm s PRO 183 Cb 0.02 -3.36 -0.00 0.00 0.04 0.00 0.00 34.50 31.19 3kzm s PRO 183 CO -0.08 -0.19 0.28 -0.51 0.04 0.00 0.00 177.00 176.55 3kzm s LEU 184 N 0.95 2.86 0.32 -3.56 1.43 -1.26 -4.64 118.68 114.78 3kzm s LEU 184 Ca 0.57 -1.19 -0.29 0.00 -1.03 0.00 0.00 54.13 52.19 3kzm s LEU 184 Cb -0.28 -1.31 -0.10 0.00 0.03 0.00 0.00 46.19 44.53 3kzm s LEU 184 CO 0.29 -0.85 1.32 0.21 0.23 0.00 0.00 176.35 177.56 3kzm s ASN 185 N -4.10 6.75 0.00 2.29 2.47 -1.26 -1.67 114.94 119.42 3kzm s ASN 185 Ca 0.34 2.69 0.28 0.00 0.42 0.00 0.00 52.86 56.60 3kzm s ASN 185 Cb -0.00 -2.65 1.17 0.00 -1.45 0.00 0.00 41.25 38.32 3kzm s ASN 185 CO 0.20 -0.56 1.84 0.35 -3.72 0.00 0.00 177.10 175.21 3kzm n THR 186 N 0.94 0.00 -0.29 -5.21 -2.24 -1.26 -4.52 114.28 101.70 3kzm n THR 186 Ca 0.01 -0.03 -0.08 0.00 -2.27 0.00 0.00 64.05 61.68 3kzm n THR 186 Cb 0.42 -0.18 -0.07 0.00 -2.10 0.00 0.00 70.33 68.40 3kzm n THR 186 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3kzm n ALA 187 N -1.17 -0.44 -0.09 6.98 0.00 -1.24 0.18 120.51 124.73 3kzm n ALA 187 Ca 0.12 0.58 0.00 0.00 0.00 0.00 0.00 53.44 54.14 3kzm n ALA 187 Cb 0.29 -0.02 0.29 0.00 0.00 0.00 0.00 19.45 20.01 3kzm n ALA 187 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 3kzm h VAL 188 N 0.00 1.18 -0.32 0.00 2.07 -1.85 -0.20 116.25 117.13 3kzm h VAL 188 Ca 0.11 -0.53 -0.10 0.00 0.82 0.00 0.00 66.70 67.00 3kzm h VAL 188 Cb 0.28 0.54 -0.01 0.00 -1.52 0.00 0.00 31.29 30.58 3kzm h VAL 188 CO -0.64 0.21 -0.18 0.00 0.02 0.00 0.00 177.57 176.98 3kzm h ALA 189 N 1.53 0.46 -0.68 1.67 0.00 -1.23 0.74 119.26 121.74 3kzm h ALA 189 Ca 0.18 -0.35 0.04 0.00 0.00 0.00 0.00 54.91 54.78 3kzm h ALA 189 Cb 0.10 -0.11 -0.05 0.00 0.00 0.00 0.00 17.79 17.74 3kzm h ALA 189 CO -0.02 0.39 0.42 -0.91 0.00 0.00 0.00 179.25 179.12 3kzm h ASN 190 N 0.46 0.67 -0.42 0.00 2.35 0.28 -1.70 115.58 117.22 3kzm h ASN 190 Ca 0.07 0.01 -0.13 0.00 -0.55 0.00 0.00 56.30 55.69 3kzm h ASN 190 Cb 0.72 -0.13 -0.01 0.00 0.05 0.00 0.00 38.32 38.94 3kzm h ASN 190 CO 0.05 0.46 -0.25 0.28 -1.65 0.00 0.00 177.43 176.32 3kzm h SER 191 N 0.80 0.97 -0.42 5.81 0.02 -0.82 -2.05 113.55 117.86 3kzm h SER 191 Ca 0.28 -0.38 -0.03 0.00 -0.84 0.00 0.00 61.79 60.82 3kzm h SER 191 Cb 0.06 -0.27 -0.02 0.00 0.14 0.00 0.00 62.40 62.31 3kzm h SER 191 CO -0.12 1.16 0.13 0.00 -1.14 0.00 0.00 176.83 176.86 3kzm h ALA 192 N 0.90 0.56 -0.80 3.77 0.00 -0.51 -0.73 119.26 122.45 3kzm h ALA 192 Ca 0.10 -0.17 -0.03 0.00 0.00 0.00 0.00 54.91 54.80 3kzm h ALA 192 Cb 0.82 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 18.41 3kzm h ALA 192 CO 0.07 0.20 0.37 1.25 0.00 0.00 0.00 179.25 181.14 3kzm h LEU 193 N 0.54 1.06 0.17 0.00 5.85 -1.30 -0.67 115.31 120.97 3kzm h LEU 193 Ca 0.14 -0.15 -0.01 0.00 0.84 0.00 0.00 57.88 58.70 3kzm h LEU 193 Cb 0.26 -0.27 0.00 0.00 0.37 0.00 0.00 40.66 41.02 3kzm h LEU 193 CO -0.00 0.91 -0.08 0.74 -0.34 0.00 0.00 178.44 179.66 3kzm h THR 194 N 1.13 0.91 -0.14 1.05 2.02 -1.05 -2.88 112.91 113.96 3kzm h THR 194 Ca 0.27 -0.39 -0.21 0.00 0.77 0.00 0.00 66.41 66.85 3kzm h THR 194 Cb 0.15 1.15 0.01 0.00 -1.74 0.00 0.00 68.15 67.71 3kzm h THR 194 CO -0.03 0.09 -0.76 -0.29 0.37 0.00 0.00 175.52 174.90 3kzm h ILE 195 N -0.42 1.31 -0.71 3.11 6.09 -1.06 -1.89 117.51 123.92 3kzm h ILE 195 Ca -0.02 -2.01 -0.01 0.00 -1.37 0.00 0.00 64.86 61.44 3kzm h ILE 195 Cb 0.33 2.01 -0.03 0.00 0.47 0.00 0.00 36.82 39.59 3kzm h ILE 195 CO 0.04 0.63 0.41 0.00 -3.07 0.00 0.00 178.15 176.16 3kzm h ALA 196 N 0.68 1.38 0.06 0.18 0.00 -1.20 -0.52 119.26 119.83 3kzm h ALA 196 Ca -0.04 -0.09 -0.24 0.00 0.00 0.00 0.00 54.91 54.53 3kzm h ALA 196 Cb 1.37 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 18.87 3kzm h ALA 196 CO 0.15 0.52 -1.07 1.79 0.00 0.00 0.00 179.25 180.64 3kzm h THR 197 N 0.99 1.47 0.00 0.00 1.35 -1.51 -2.55 112.91 112.66 3kzm h THR 197 Ca 0.25 -2.78 -0.04 0.00 -0.55 0.00 0.00 66.41 63.30 3kzm h THR 197 Cb -0.01 2.68 -0.01 0.00 -1.73 0.00 0.00 68.15 69.09 3kzm h THR 197 CO -0.04 0.82 -0.20 -0.09 -0.25 0.00 0.00 175.52 175.75 3kzm h ARG 198 N 0.13 0.00 -0.01 4.72 9.65 -0.83 -0.88 114.38 127.16 3kzm h ARG 198 Ca -0.10 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.78 3kzm h ARG 198 Cb 1.75 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 30.33 3kzm h ARG 198 CO 0.18 0.20 -0.04 -1.33 2.80 0.00 0.00 179.97 181.77 3kzm n MET 199 N -3.95 1.07 -1.71 0.20 2.81 -0.25 -4.82 117.12 110.48 3kzm n MET 199 Ca -0.02 -0.38 -0.04 0.00 -1.81 0.00 0.00 57.70 55.45 3kzm n MET 199 Cb 0.28 -1.49 -0.01 0.00 -0.71 0.00 0.00 33.22 31.29 3kzm n MET 199 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3kzm n GLY 200 N 1.16 0.40 3.93 3.03 0.00 -0.34 -3.92 105.19 109.46 3kzm n GLY 200 Ca 0.19 -0.77 -0.25 0.00 0.00 0.00 0.00 46.02 45.19 3kzm n GLY 200 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3kzm s MET 201 N -3.49 2.64 -0.71 1.61 -1.94 -0.97 -3.61 119.30 112.83 3kzm s MET 201 Ca 0.00 -0.25 -0.22 0.00 -1.71 0.00 0.00 55.69 53.51 3kzm s MET 201 Cb 0.00 -2.30 0.08 0.00 2.01 0.00 0.00 34.83 34.63 3kzm s MET 201 CO 0.00 -0.84 0.98 -0.51 -0.01 0.00 0.00 175.02 174.64 3kzm s ASP 202 N -4.38 6.26 -0.10 3.03 -0.00 -0.17 -2.44 116.67 118.88 3kzm s ASP 202 Ca 0.56 -1.23 -0.16 0.00 -0.00 0.00 0.00 52.55 51.72 3kzm s ASP 202 Cb -0.11 -2.41 -0.05 0.00 -0.00 0.00 0.00 42.92 40.36 3kzm s ASP 202 CO 0.43 -1.35 0.41 -0.69 -0.00 0.00 0.00 175.17 173.97 3kzm s VAL 203 N 3.72 5.18 -0.14 -1.27 1.01 0.88 -0.43 120.40 129.34 3kzm s VAL 203 Ca 0.24 0.81 0.01 0.00 0.00 0.00 0.00 61.98 63.04 3kzm s VAL 203 Cb -0.15 -3.74 0.02 0.00 0.00 0.00 0.00 36.38 32.51 3kzm s VAL 203 CO 0.06 0.41 -0.16 -0.89 0.00 0.00 0.00 175.10 174.52 3kzm s THR 204 N 0.11 1.65 -0.59 3.92 2.01 -0.23 -0.71 115.64 121.79 3kzm s THR 204 Ca 0.23 -0.70 -0.20 0.00 0.31 0.00 0.00 61.69 61.32 3kzm s THR 204 Cb -0.15 -1.52 0.08 0.00 0.01 0.00 0.00 72.50 70.93 3kzm s THR 204 CO 0.09 0.47 0.77 -0.22 -0.69 0.00 0.00 174.62 175.05 3kzm s LEU 205 N 1.23 5.00 -0.23 4.42 2.96 0.34 -1.62 118.68 130.77 3kzm s LEU 205 Ca -0.00 -1.19 -0.18 0.00 -0.22 0.00 0.00 54.13 52.54 3kzm s LEU 205 Cb -0.14 -2.38 -0.03 0.00 0.50 0.00 0.00 46.19 44.14 3kzm s LEU 205 CO -0.07 -1.17 0.51 -0.22 -1.32 0.00 0.00 176.35 174.07 3kzm s LEU 206 N 3.10 4.10 0.05 -0.68 0.20 -0.23 -0.78 118.68 124.45 3kzm s LEU 206 Ca 0.16 0.58 -0.15 0.00 0.69 0.00 0.00 54.13 55.41 3kzm s LEU 206 Cb -0.21 -2.67 0.02 0.00 -0.43 0.00 0.00 46.19 42.91 3kzm s LEU 206 CO 0.09 -0.22 0.34 0.00 -0.29 0.00 0.00 176.35 176.26 3kzm h PRO 208 N 3.08 -0.45 -4.98 0.00 0.13 -1.88 -3.36 132.00 124.54 3kzm h PRO 208 Ca -0.32 0.03 -0.38 0.00 -0.87 0.00 0.00 66.00 64.46 3kzm h PRO 208 Cb 1.21 0.10 -0.14 0.00 0.13 0.00 0.00 31.00 32.29 3kzm h PRO 208 CO 0.46 -0.30 -0.61 0.95 -0.23 0.00 0.00 178.00 178.27 3kzm s THR 209 N -4.98 0.73 0.66 1.56 -4.23 -1.26 -4.79 115.64 103.32 3kzm s THR 209 Ca -0.11 -2.00 0.39 0.00 -1.18 0.00 0.00 61.69 58.78 3kzm s THR 209 Cb 0.05 -2.68 0.40 0.00 1.34 0.00 0.00 72.50 71.61 3kzm s THR 209 CO 0.44 -0.01 2.22 -0.65 -0.54 0.00 0.00 174.62 176.09 3kzm h PRO 210 N 2.31 0.00 0.00 3.99 0.11 -1.98 -0.13 132.00 136.30 3kzm h PRO 210 Ca -0.39 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.72 3kzm h PRO 210 Cb 1.25 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.36 3kzm h PRO 210 CO 0.63 0.00 0.00 -0.44 -0.21 0.00 0.00 178.00 177.98 3kzm h ASP 211 N 0.00 0.00 -0.56 -2.05 3.45 -1.98 -2.72 116.42 112.56 3kzm h ASP 211 Ca 0.01 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.47 3kzm h ASP 211 Cb 0.22 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 38.99 3kzm h ASP 211 CO -0.00 0.00 0.00 -1.22 -1.57 0.00 0.00 179.24 176.45 3kzm n TYR 212 N -2.88 1.10 -2.44 4.55 4.02 -0.06 -3.99 117.16 117.46 3kzm n TYR 212 Ca 0.00 -0.46 -0.39 0.00 -0.01 0.00 0.00 57.90 57.04 3kzm n TYR 212 Cb 0.25 -0.15 -0.04 0.00 -0.02 0.00 0.00 39.34 39.38 3kzm n TYR 212 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 176.86 176.27 3kzm s ILE 213 N -1.61 3.45 0.88 -0.72 1.01 -1.03 -4.96 121.20 118.22 3kzm s ILE 213 Ca 0.41 1.28 -0.11 0.00 0.00 0.00 0.00 60.65 62.23 3kzm s ILE 213 Cb 0.25 -3.75 0.12 0.00 0.01 0.00 0.00 42.46 39.10 3kzm s ILE 213 CO 0.22 0.17 1.09 -0.76 0.00 0.00 0.00 174.94 175.67 3kzm s LEU 214 N -2.12 2.45 0.44 2.97 1.43 -1.26 -4.77 118.68 117.83 3kzm s LEU 214 Ca 0.52 1.65 -0.23 0.00 -1.03 0.00 0.00 54.13 55.04 3kzm s LEU 214 Cb -0.29 -4.11 -0.11 0.00 0.03 0.00 0.00 46.19 41.72 3kzm s LEU 214 CO 0.36 -2.60 0.80 -0.67 0.23 0.00 0.00 176.35 174.48 3kzm n ASP 215 N -3.87 0.27 -0.25 2.29 -0.08 -1.26 -4.70 116.55 108.95 3kzm n ASP 215 Ca 0.08 0.95 0.12 0.00 -1.51 0.00 0.00 54.79 54.43 3kzm n ASP 215 Cb 0.54 -1.25 0.39 0.00 2.34 0.00 0.00 41.12 43.14 3kzm n ASP 215 CO 0.00 0.00 0.00 -0.33 0.12 0.00 0.00 177.20 176.99 3kzm h GLU 216 N 1.09 0.64 -0.57 -0.67 5.08 -1.99 -2.18 114.58 115.98 3kzm h GLU 216 Ca -0.43 -0.04 0.12 0.00 -1.00 0.00 0.00 59.36 58.01 3kzm h GLU 216 Cb 1.37 -0.14 -0.10 0.00 0.50 0.00 0.00 28.75 30.38 3kzm h GLU 216 CO 0.54 0.42 -0.02 -0.09 -1.00 0.00 0.00 179.01 178.86 3kzm h ARG 217 N 0.66 0.09 0.01 2.33 2.43 -1.99 0.10 114.38 118.01 3kzm h ARG 217 Ca 0.43 -0.01 -0.21 0.00 -0.81 0.00 0.00 59.98 59.39 3kzm h ARG 217 Cb 0.71 -0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 30.22 3kzm h ARG 217 CO -0.19 0.06 -0.97 1.88 -1.51 0.00 0.00 179.97 179.25 3kzm h TYR 218 N 0.10 0.06 -0.34 2.20 -1.99 -1.76 -1.79 116.97 113.45 3kzm h TYR 218 Ca 0.29 -0.04 -0.08 0.00 2.00 0.00 0.00 58.73 60.90 3kzm h TYR 218 Cb 0.46 -0.00 -0.02 0.00 2.00 0.00 0.00 36.73 39.17 3kzm h TYR 218 CO -0.36 0.98 -0.11 0.52 -0.00 0.00 0.00 178.16 179.19 3kzm h MET 219 N 0.01 0.59 -0.10 4.88 2.86 -0.96 -0.82 114.93 121.40 3kzm h MET 219 Ca -0.02 -0.17 -0.22 0.00 -2.06 0.00 0.00 59.70 57.22 3kzm h MET 219 Cb 1.70 -0.06 0.01 0.00 0.06 0.00 0.00 31.60 33.30 3kzm h MET 219 CO 0.13 0.69 -0.81 -0.44 1.06 0.00 0.00 176.91 177.54 3kzm h ASP 220 N 0.54 0.79 -0.72 1.22 3.32 -0.75 -1.53 116.42 119.30 3kzm h ASP 220 Ca 0.10 -0.54 -0.00 0.00 0.02 0.00 0.00 57.03 56.61 3kzm h ASP 220 Cb 0.51 -0.23 -0.03 0.00 0.22 0.00 0.00 39.33 39.79 3kzm h ASP 220 CO 0.03 1.32 0.44 -0.50 -1.72 0.00 0.00 179.24 178.81 3kzm h TRP 221 N 0.43 0.94 -0.54 4.55 4.06 -1.03 -1.29 115.95 123.07 3kzm h TRP 221 Ca -0.06 -0.00 -0.02 0.00 2.06 0.00 0.00 58.89 60.87 3kzm h TRP 221 Cb 1.43 -0.31 -0.02 0.00 -1.00 0.00 0.00 29.16 29.26 3kzm h TRP 221 CO 0.08 0.63 0.27 0.00 -3.56 0.00 0.00 178.44 175.85 3kzm h ALA 222 N 1.23 0.70 -0.68 1.49 0.00 -1.04 0.38 119.26 121.33 3kzm h ALA 222 Ca 0.26 -0.12 -0.02 0.00 0.00 0.00 0.00 54.91 55.02 3kzm h ALA 222 Cb -0.04 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.51 3kzm h ALA 222 CO -0.05 0.25 0.34 0.00 0.00 0.00 0.00 179.25 179.79 3kzm h ALA 223 N 1.10 0.88 -0.17 0.00 0.00 -0.92 -0.53 119.26 119.62 3kzm h ALA 223 Ca 0.19 -0.13 -0.12 0.00 0.00 0.00 0.00 54.91 54.84 3kzm h ALA 223 Cb 0.11 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 3kzm h ALA 223 CO -0.02 0.43 -0.41 1.96 0.00 0.00 0.00 179.25 181.21 3kzm h GLN 224 N 0.94 0.39 -0.30 0.00 4.20 -0.96 -2.65 115.11 116.73 3kzm h GLN 224 Ca 0.24 -0.19 -0.07 0.00 0.06 0.00 0.00 58.65 58.68 3kzm h GLN 224 Cb 0.10 -0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.87 3kzm h GLN 224 CO -0.03 0.73 -0.10 -0.91 -0.67 0.00 0.00 178.83 177.85 3kzm h ASN 225 N 0.32 0.61 -0.68 1.46 2.35 -0.40 -2.71 115.58 116.53 3kzm h ASN 225 Ca 0.03 -0.39 0.02 0.00 -0.55 0.00 0.00 56.30 55.41 3kzm h ASN 225 Cb 0.86 -0.17 -0.04 0.00 0.05 0.00 0.00 38.32 39.02 3kzm h ASN 225 CO 0.07 0.86 0.44 0.58 -1.65 0.00 0.00 177.43 177.72 3kzm h VAL 226 N 0.36 1.14 -0.27 2.81 2.07 -1.03 0.46 116.25 121.79 3kzm h VAL 226 Ca 0.07 -0.30 -0.03 0.00 0.82 0.00 0.00 66.70 67.26 3kzm h VAL 226 Cb 0.61 0.18 -0.01 0.00 -1.52 0.00 0.00 31.29 30.54 3kzm h VAL 226 CO 0.04 0.16 0.04 0.00 0.02 0.00 0.00 177.57 177.83 3kzm h ALA 227 N 1.26 1.59 0.04 1.67 0.00 -1.42 0.19 119.26 122.59 3kzm h ALA 227 Ca 0.26 -0.13 -0.31 0.00 0.00 0.00 0.00 54.91 54.74 3kzm h ALA 227 Cb -0.06 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 17.57 3kzm h ALA 227 CO -0.07 0.31 -1.72 0.93 0.00 0.00 0.00 179.25 178.70 3kzm h GLU 228 N 0.38 0.08 0.00 0.00 5.08 -1.06 -3.39 114.58 115.67 3kzm h GLU 228 Ca 0.09 -0.14 -0.17 0.00 -1.00 0.00 0.00 59.36 58.15 3kzm h GLU 228 Cb 0.18 0.05 -0.03 0.00 0.50 0.00 0.00 28.75 29.46 3kzm h GLU 228 CO -0.00 0.73 -1.27 0.77 -1.00 0.00 0.00 179.01 178.25 3kzm h SER 229 N 0.02 0.00 0.00 1.42 0.02 0.04 -3.48 113.55 111.57 3kzm h SER 229 Ca -0.30 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.65 3kzm h SER 229 Cb 2.01 0.00 0.00 0.00 0.14 0.00 0.00 62.40 64.55 3kzm h SER 229 CO 0.09 0.60 0.00 0.61 -1.14 0.00 0.00 176.83 176.99 3kzm n GLY 230 N 1.37 0.80 0.00 -3.77 0.00 0.65 -4.66 105.19 99.57 3kzm n GLY 230 Ca -0.08 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.94 3kzm n GLY 230 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3kzm n GLY 231 N -2.14 1.16 3.50 -0.02 0.00 -1.14 -4.95 105.19 101.60 3kzm n GLY 231 Ca 0.00 -1.54 -0.16 0.00 0.00 0.00 0.00 46.02 44.32 3kzm n GLY 231 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3kzm s SER 232 N -1.00 -0.62 -0.02 1.61 1.04 -1.02 -4.83 113.70 108.86 3kzm s SER 232 Ca 0.00 0.51 0.06 0.00 0.48 0.00 0.00 55.95 57.00 3kzm s SER 232 Cb 0.00 0.54 -0.02 0.00 0.10 0.00 0.00 66.02 66.64 3kzm s SER 232 CO 0.00 -0.69 -0.20 -0.22 0.98 0.00 0.00 173.24 173.11 3kzm s LEU 233 N -1.60 2.04 -0.16 2.42 2.96 -1.26 -0.09 118.68 123.00 3kzm s LEU 233 Ca -0.07 -0.37 -0.16 0.00 -0.22 0.00 0.00 54.13 53.31 3kzm s LEU 233 Cb -0.00 -1.05 0.04 0.00 0.50 0.00 0.00 46.19 45.68 3kzm s LEU 233 CO 0.03 0.25 0.46 -1.58 -1.32 0.00 0.00 176.35 174.19 3kzm s GLN 234 N -0.48 0.56 -0.13 1.98 0.74 0.11 -4.98 119.66 117.46 3kzm s GLN 234 Ca 0.08 0.56 -0.03 0.00 0.05 0.00 0.00 55.36 56.02 3kzm s GLN 234 Cb -0.08 0.27 -0.03 0.00 1.10 0.00 0.00 33.01 34.27 3kzm s GLN 234 CO -0.01 -0.08 -0.01 0.08 -0.55 0.00 0.00 175.29 174.72 3kzm s VAL 235 N 0.08 4.19 0.02 1.34 1.01 -1.26 0.13 120.40 125.91 3kzm s VAL 235 Ca -0.01 -0.27 0.00 0.00 0.00 0.00 0.00 61.98 61.70 3kzm s VAL 235 Cb -0.03 -2.81 -0.02 0.00 0.00 0.00 0.00 36.38 33.51 3kzm s VAL 235 CO 0.01 0.53 -0.04 -0.55 0.00 0.00 0.00 175.10 175.06 3kzm s SER 236 N -0.15 0.34 0.00 3.32 0.15 0.04 -4.90 113.70 112.51 3kzm s SER 236 Ca 0.04 -0.51 0.00 0.00 0.70 0.00 0.00 55.95 56.18 3kzm s SER 236 Cb -0.13 0.09 0.00 0.00 -1.71 0.00 0.00 66.02 64.27 3kzm s SER 236 CO 0.02 -0.29 0.75 1.41 1.20 0.00 0.00 173.24 176.33 3kzm n HIS 237 N 1.56 0.00 -3.68 3.44 8.25 -1.26 -1.36 115.22 122.18 3kzm n HIS 237 Ca -0.24 -0.27 -0.39 0.00 -0.26 0.00 0.00 57.72 56.57 3kzm n HIS 237 Cb 0.55 -0.03 -0.12 0.00 1.12 0.00 0.00 29.99 31.52 3kzm n HIS 237 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 3kzm s ASP 238 N -0.53 5.48 0.06 0.41 2.15 -1.26 -4.85 116.67 118.14 3kzm s ASP 238 Ca 0.00 -0.94 -0.23 0.00 0.43 0.00 0.00 52.55 51.81 3kzm s ASP 238 Cb 0.00 -1.95 -0.10 0.00 -0.30 0.00 0.00 42.92 40.57 3kzm s ASP 238 CO 0.00 -0.31 1.37 0.40 -0.17 0.00 0.00 175.17 176.45 3kzm h ILE 239 N 5.94 0.00 -0.55 4.11 2.04 -1.96 -2.88 117.51 124.21 3kzm h ILE 239 Ca -0.27 0.00 0.11 0.00 1.00 0.00 0.00 64.86 65.71 3kzm h ILE 239 Cb 1.11 0.00 -0.10 0.00 -0.74 0.00 0.00 36.82 37.09 3kzm h ILE 239 CO 0.63 0.00 -0.08 0.44 0.00 0.00 0.00 178.15 179.14 3kzm h ASP 240 N -0.55 -0.40 0.54 1.72 5.19 -1.99 -0.64 116.42 120.29 3kzm h ASP 240 Ca -0.02 0.15 -0.02 0.00 -0.62 0.00 0.00 57.03 56.53 3kzm h ASP 240 Cb 0.53 0.30 -0.00 0.00 0.18 0.00 0.00 39.33 40.33 3kzm h ASP 240 CO -0.14 -0.15 -0.08 0.77 -3.12 0.00 0.00 179.24 176.51 3kzm h SER 241 N 0.04 0.00 0.26 6.45 4.64 -1.97 -2.66 113.55 120.31 3kzm h SER 241 Ca 0.27 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.58 3kzm h SER 241 Cb 0.42 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.52 3kzm h SER 241 CO -0.52 0.08 -0.12 0.00 -0.87 0.00 0.00 176.83 175.40 3kzm h ALA 242 N 1.92 -0.36 0.00 5.18 0.00 -0.90 -3.32 119.26 121.77 3kzm h ALA 242 Ca -0.00 -0.08 -0.00 0.00 0.00 0.00 0.00 54.91 54.83 3kzm h ALA 242 Cb 0.38 0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.30 3kzm h ALA 242 CO 0.01 -0.33 -0.00 1.88 0.00 0.00 0.00 179.25 180.81 3kzm h TYR 243 N -1.05 0.00 -1.67 0.00 -1.99 -1.44 -3.42 116.97 107.41 3kzm h TYR 243 Ca -0.04 0.00 -0.66 0.00 2.00 0.00 0.00 58.73 60.04 3kzm h TYR 243 Cb 0.26 0.00 0.01 0.00 2.00 0.00 0.00 36.73 39.00 3kzm h TYR 243 CO 0.00 0.00 1.17 0.00 -0.00 0.00 0.00 178.16 179.34 3kzm n ALA 244 N -2.31 0.76 -1.07 3.88 0.00 -1.01 -1.19 120.51 119.58 3kzm n ALA 244 Ca -0.03 0.18 -0.02 0.00 0.00 0.00 0.00 53.44 53.56 3kzm n ALA 244 Cb 0.08 -2.48 -0.01 0.00 0.00 0.00 0.00 19.45 17.04 3kzm n ALA 244 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3kzm n GLY 245 N 5.04 0.46 3.76 0.00 0.00 -0.94 -4.91 105.19 108.60 3kzm n GLY 245 Ca 0.29 -0.12 -0.38 0.00 0.00 0.00 0.00 46.02 45.81 3kzm n GLY 245 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3kzm s ALA 246 N -1.69 3.01 -0.16 4.61 0.00 -0.33 -4.17 121.76 123.02 3kzm s ALA 246 Ca 0.00 1.13 0.18 0.00 0.00 0.00 0.00 51.96 53.27 3kzm s ALA 246 Cb 0.00 -3.46 -0.25 0.00 0.00 0.00 0.00 23.12 19.40 3kzm s ALA 246 CO 0.00 -0.91 0.13 -0.25 0.00 0.00 0.00 175.76 174.73 3kzm n ASP 247 N -0.47 0.25 -3.85 0.00 8.00 0.36 -0.57 116.55 120.28 3kzm n ASP 247 Ca 0.07 0.00 -0.12 0.00 0.71 0.00 0.00 54.79 55.45 3kzm n ASP 247 Cb 0.46 1.14 -0.14 0.00 -0.02 0.00 0.00 41.12 42.56 3kzm n ASP 247 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 3kzm s VAL 248 N -2.63 -0.01 -0.16 2.53 1.01 -0.72 -1.39 120.40 119.03 3kzm s VAL 248 Ca -0.09 0.02 -0.01 0.00 0.00 0.00 0.00 61.98 61.90 3kzm s VAL 248 Cb 0.07 -0.08 0.04 0.00 0.00 0.00 0.00 36.38 36.41 3kzm s VAL 248 CO 0.80 0.01 -0.03 -0.69 0.00 0.00 0.00 175.10 175.19 3kzm s VAL 249 N 0.13 0.89 -0.20 2.92 1.01 0.22 -0.62 120.40 124.75 3kzm s VAL 249 Ca -0.01 -0.51 -0.02 0.00 0.00 0.00 0.00 61.98 61.43 3kzm s VAL 249 Cb -0.01 -1.13 -0.00 0.00 0.00 0.00 0.00 36.38 35.23 3kzm s VAL 249 CO -0.00 0.08 -0.09 -0.47 0.00 0.00 0.00 175.10 174.61 3kzm s TYR 250 N 1.72 2.90 0.03 5.22 6.04 -0.01 -2.29 117.35 130.96 3kzm s TYR 250 Ca 0.01 -1.07 0.01 0.00 0.04 0.00 0.00 57.07 56.05 3kzm s TYR 250 Cb -0.15 -2.03 -0.04 0.00 -1.04 0.00 0.00 41.96 38.70 3kzm s TYR 250 CO -0.07 -0.57 0.10 0.00 -1.54 0.00 0.00 175.55 173.47 3kzm s ALA 251 N 1.31 3.66 -0.28 3.97 0.00 -1.15 -1.00 121.76 128.27 3kzm s ALA 251 Ca 0.04 -0.90 -0.23 0.00 0.00 0.00 0.00 51.96 50.86 3kzm s ALA 251 Cb -0.14 -1.59 0.11 0.00 0.00 0.00 0.00 23.12 21.50 3kzm s ALA 251 CO -0.05 0.73 0.94 0.21 0.00 0.00 0.00 175.76 177.59 3kzm s LYS 252 N -2.05 0.57 0.02 0.00 2.47 -0.74 -4.66 119.74 115.36 3kzm s LYS 252 Ca 0.27 0.73 -0.01 0.00 -1.56 0.00 0.00 55.97 55.40 3kzm s LYS 252 Cb -0.12 0.25 -0.04 0.00 -1.46 0.00 0.00 37.83 36.46 3kzm s LYS 252 CO 0.19 -0.08 0.16 0.45 0.16 0.00 0.00 175.35 176.23 3kzm s SER 253 N 0.49 6.17 -0.08 1.43 0.15 -1.26 -2.04 113.70 118.57 3kzm s SER 253 Ca 0.00 0.25 -0.30 0.00 0.70 0.00 0.00 55.95 56.60 3kzm s SER 253 Cb -0.05 -1.87 0.08 0.00 -1.71 0.00 0.00 66.02 62.46 3kzm s SER 253 CO -0.07 0.23 0.71 -1.66 1.20 0.00 0.00 173.24 173.65 3kzm s TRP 254 N -1.37 -0.64 0.29 3.44 -2.14 -1.26 -4.52 118.94 112.73 3kzm s TRP 254 Ca 0.29 1.15 -0.28 0.00 2.66 0.00 0.00 56.10 59.92 3kzm s TRP 254 Cb -0.13 0.40 -0.09 0.00 -3.10 0.00 0.00 33.47 30.55 3kzm s TRP 254 CO 0.21 -0.56 0.95 0.20 -2.66 0.00 0.00 176.95 175.09 3kzm s GLY 255 N -1.05 2.94 0.07 3.67 0.00 -0.67 -4.57 107.32 107.72 3kzm s GLY 255 Ca -0.09 0.59 -0.31 0.00 0.00 0.00 0.00 44.72 44.91 3kzm s GLY 255 CO 0.08 1.09 1.91 0.00 0.00 0.00 0.00 173.10 176.18 3kzm n ALA 256 N 0.95 1.85 -0.22 3.20 0.00 -1.26 -4.86 120.51 120.17 3kzm n ALA 256 Ca 0.00 0.26 0.03 0.00 0.00 0.00 0.00 53.44 53.73 3kzm n ALA 256 Cb 0.49 -2.64 0.14 0.00 0.00 0.00 0.00 19.45 17.44 3kzm n ALA 256 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 3kzm h LEU 257 N 9.59 0.00 -1.96 0.00 3.38 -1.86 -0.94 115.31 123.51 3kzm h LEU 257 Ca -0.48 0.13 0.00 0.00 0.09 0.00 0.00 57.88 57.62 3kzm h LEU 257 Cb 1.23 0.18 0.00 0.00 0.09 0.00 0.00 40.66 42.16 3kzm h LEU 257 CO 0.94 -0.01 0.09 1.55 0.09 0.00 0.00 178.44 181.10 3kzm h PRO 258 N 0.26 0.00 -0.46 1.13 0.13 -1.90 0.45 132.00 131.61 3kzm h PRO 258 Ca 0.36 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 65.48 3kzm h PRO 258 Cb 0.58 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.70 3kzm h PRO 258 CO -0.46 0.00 0.02 1.19 -0.23 0.00 0.00 178.00 178.52 3kzm n PHE 259 N -2.60 1.66 -2.06 1.56 3.01 -0.36 -4.96 117.46 113.71 3kzm n PHE 259 Ca -0.02 -0.84 -0.42 0.00 1.01 0.00 0.00 57.45 57.18 3kzm n PHE 259 Cb 0.14 -0.45 -0.03 0.00 -0.01 0.00 0.00 39.48 39.13 3kzm n PHE 259 CO 0.00 0.00 0.00 0.12 1.01 0.00 0.00 176.76 177.89 3kzm s PHE 260 N -2.82 3.14 0.00 1.38 5.36 0.15 -2.30 117.98 122.88 3kzm s PHE 260 Ca 0.50 0.79 0.00 0.00 -0.96 0.00 0.00 56.93 57.26 3kzm s PHE 260 Cb 0.39 -3.80 0.00 0.00 -0.34 0.00 0.00 43.02 39.28 3kzm s PHE 260 CO 0.13 -2.87 0.00 0.41 -1.46 0.00 0.00 175.22 171.42 3kzm n GLY 261 N 3.62 2.87 2.44 13.12 0.00 -1.24 -4.78 105.19 121.22 3kzm n GLY 261 Ca 0.13 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.88 3kzm n GLY 261 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3kzm n ASN 262 N 0.40 3.15 0.02 1.61 5.15 -0.97 -4.90 115.26 119.72 3kzm n ASN 262 Ca 0.00 -3.34 0.12 0.00 -0.60 0.00 0.00 54.58 50.76 3kzm n ASN 262 Cb 0.00 -0.65 0.49 0.00 -0.53 0.00 0.00 39.78 39.09 3kzm n ASN 262 CO 0.00 0.00 0.00 0.79 1.40 0.00 0.00 177.26 179.45 3kzm n TRP 263 N 0.77 0.18 0.02 1.20 7.02 -1.19 -4.07 117.44 121.38 3kzm n TRP 263 Ca 0.28 0.06 -0.11 0.00 -1.02 0.00 0.00 57.50 56.71 3kzm n TRP 263 Cb 0.44 -0.60 -0.05 0.00 -2.42 0.00 0.00 31.31 28.68 3kzm n TRP 263 CO 0.00 0.00 0.00 0.93 -2.02 0.00 0.00 177.69 176.60 3kzm h GLU 264 N 0.00 -0.44 0.00 -0.99 4.39 -1.90 -1.81 114.58 113.83 3kzm h GLU 264 Ca 0.00 0.03 0.00 0.00 0.34 0.00 0.00 59.36 59.73 3kzm h GLU 264 Cb 0.45 0.10 0.00 0.00 -0.10 0.00 0.00 28.75 29.20 3kzm h GLU 264 CO 0.00 -0.29 0.00 -0.35 -1.16 0.00 0.00 179.01 177.21 3kzm n PRO 265 N -5.42 0.09 0.17 2.33 -0.04 -1.26 -3.04 135.00 127.82 3kzm n PRO 265 Ca -0.04 0.17 0.12 0.00 -0.04 0.00 0.00 63.50 63.71 3kzm n PRO 265 Cb 0.34 -1.62 0.10 0.00 -0.04 0.00 0.00 33.50 32.28 3kzm n PRO 265 CO 0.00 0.00 0.00 1.49 -0.04 0.00 0.00 175.50 176.95 3kzm h GLU 266 N 0.00 0.00 0.37 0.54 4.22 -1.55 -3.36 114.58 114.81 3kzm h GLU 266 Ca 0.00 0.00 -0.02 0.00 0.08 0.00 0.00 59.36 59.42 3kzm h GLU 266 Cb 0.48 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.73 3kzm h GLU 266 CO 0.00 0.00 -0.18 0.87 -2.18 0.00 0.00 179.01 177.52 3kzm h LYS 267 N 0.00 -0.48 0.00 1.92 1.57 -1.32 -1.91 116.57 116.35 3kzm h LYS 267 Ca 0.00 0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.81 3kzm h LYS 267 Cb 0.99 0.11 0.00 0.00 0.08 0.00 0.00 32.23 33.41 3kzm h LYS 267 CO 0.00 -0.32 0.00 -1.00 -0.57 0.00 0.00 179.45 177.56 3kzm h PRO 268 N -0.51 0.00 0.13 3.15 0.13 -1.76 -1.90 132.00 131.24 3kzm h PRO 268 Ca -0.05 0.00 -0.21 0.00 -0.87 0.00 0.00 66.00 64.86 3kzm h PRO 268 Cb 0.39 0.00 0.01 0.00 0.13 0.00 0.00 31.00 31.53 3kzm h PRO 268 CO 0.08 0.00 -1.01 0.82 -0.23 0.00 0.00 178.00 177.66 3kzm h ILE 269 N 0.00 1.34 -0.21 -3.56 2.04 -1.56 -3.30 117.51 112.26 3kzm h ILE 269 Ca 0.00 -2.48 -0.16 0.00 1.00 0.00 0.00 64.86 63.22 3kzm h ILE 269 Cb 0.15 3.02 -0.01 0.00 -0.74 0.00 0.00 36.82 39.24 3kzm h ILE 269 CO 0.00 0.70 -0.53 0.08 0.00 0.00 0.00 178.15 178.40 3kzm h ARG 270 N -0.38 0.61 0.00 2.37 0.11 -1.05 -3.12 114.38 112.92 3kzm h ARG 270 Ca -0.20 -0.37 0.00 0.00 0.10 0.00 0.00 59.98 59.51 3kzm h ARG 270 Cb 1.66 0.04 0.00 0.00 1.11 0.00 0.00 29.97 32.78 3kzm h ARG 270 CO 0.11 0.98 0.00 -0.44 0.10 0.00 0.00 179.97 180.72 3kzm h ASP 271 N 0.47 0.00 -0.54 0.08 5.19 -1.49 -1.42 116.42 118.71 3kzm h ASP 271 Ca 0.01 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.42 3kzm h ASP 271 Cb 1.08 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.59 3kzm h ASP 271 CO 0.10 0.00 0.00 0.00 -3.12 0.00 0.00 179.24 176.22 3kzm n GLN 272 N -2.98 2.84 -1.72 3.56 10.64 -1.18 -4.04 117.38 124.50 3kzm n GLN 272 Ca -0.02 -2.19 -0.01 0.00 -1.83 0.00 0.00 57.00 52.94 3kzm n GLN 272 Cb 0.10 -1.64 0.07 0.00 -0.86 0.00 0.00 30.24 27.91 3kzm n GLN 272 CO 0.00 0.00 0.00 0.66 -1.83 0.00 0.00 177.06 175.89 3kzm n TYR 273 N 0.99 0.77 0.31 2.61 4.02 -0.53 -4.80 117.16 120.52 3kzm n TYR 273 Ca 0.20 -1.43 0.15 0.00 -0.01 0.00 0.00 57.90 56.81 3kzm n TYR 273 Cb 0.63 -0.22 0.68 0.00 -0.02 0.00 0.00 39.34 40.41 3kzm n TYR 273 CO 0.00 0.00 0.00 1.96 -1.01 0.00 0.00 176.86 177.81 3kzm h GLN 274 N 1.60 0.00 0.00 -0.72 4.20 -1.70 -2.48 115.11 116.01 3kzm h GLN 274 Ca -0.05 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.66 3kzm h GLN 274 Cb 1.47 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.25 3kzm h GLN 274 CO 0.21 0.00 0.00 -2.39 -0.67 0.00 0.00 178.83 175.98 3kzm n HIS 275 N -2.60 0.00 1.51 2.96 1.44 -1.26 -2.76 115.22 114.51 3kzm n HIS 275 Ca 0.00 0.00 0.14 0.00 -2.01 0.00 0.00 57.72 55.86 3kzm n HIS 275 Cb 0.19 0.00 0.63 0.00 0.12 0.00 0.00 29.99 30.93 3kzm n HIS 275 CO 0.00 0.00 0.00 1.19 -2.81 0.00 0.00 176.34 174.72 3kzm n PHE 276 N -0.71 0.00 -1.70 -1.40 3.01 -0.94 -4.89 117.46 110.84 3kzm n PHE 276 Ca 0.08 0.00 -0.44 0.00 1.01 0.00 0.00 57.45 58.10 3kzm n PHE 276 Cb 0.04 -0.11 -0.02 0.00 -0.01 0.00 0.00 39.48 39.37 3kzm n PHE 276 CO 0.00 0.00 0.00 1.51 1.01 0.00 0.00 176.76 179.28 3kzm n ILE 277 N -0.71 0.81 -2.46 4.37 3.06 -1.11 -4.71 119.36 118.61 3kzm n ILE 277 Ca 0.17 -0.20 -0.43 0.00 -2.50 0.00 0.00 62.75 59.79 3kzm n ILE 277 Cb 0.27 -1.70 -0.02 0.00 0.54 0.00 0.00 39.64 38.73 3kzm n ILE 277 CO 0.00 0.00 0.00 -0.69 -2.50 0.00 0.00 176.55 173.36 3kzm s VAL 278 N 0.15 4.13 0.35 9.51 1.01 -1.26 -4.95 120.40 129.34 3kzm s VAL 278 Ca 0.68 1.23 0.02 0.00 0.00 0.00 0.00 61.98 63.91 3kzm s VAL 278 Cb -0.58 -4.28 -0.01 0.00 0.00 0.00 0.00 36.38 31.51 3kzm s VAL 278 CO 0.47 -0.65 0.06 -0.90 0.00 0.00 0.00 175.10 174.08 3kzm n ASP 279 N 7.91 2.06 -0.25 3.32 5.68 -1.26 -1.81 116.55 132.19 3kzm n ASP 279 Ca 0.14 -2.71 -0.03 0.00 -0.50 0.00 0.00 54.79 51.70 3kzm n ASP 279 Cb 0.47 0.56 0.15 0.00 -1.14 0.00 0.00 41.12 41.17 3kzm n ASP 279 CO 0.00 0.00 0.00 -0.33 -1.33 0.00 0.00 177.20 175.54 3kzm h GLU 280 N 0.00 1.08 -0.45 0.11 5.08 -1.95 -2.38 114.58 116.07 3kzm h GLU 280 Ca -0.28 -0.14 0.05 0.00 -1.00 0.00 0.00 59.36 57.98 3kzm h GLU 280 Cb 0.97 -0.21 -0.04 0.00 0.50 0.00 0.00 28.75 29.97 3kzm h GLU 280 CO 0.46 0.82 0.20 -0.09 -1.00 0.00 0.00 179.01 179.40 3kzm h ARG 281 N 1.08 0.39 -0.08 2.33 2.43 -1.98 0.23 114.38 118.78 3kzm h ARG 281 Ca 0.27 -0.02 -0.04 0.00 -0.81 0.00 0.00 59.98 59.38 3kzm h ARG 281 Cb 0.07 -0.09 -0.00 0.00 -0.42 0.00 0.00 29.97 29.53 3kzm h ARG 281 CO -0.04 0.26 -0.09 0.87 -1.51 0.00 0.00 179.97 179.46 3kzm h LYS 282 N 0.40 0.21 0.00 0.20 1.57 -1.91 -3.08 116.57 113.96 3kzm h LYS 282 Ca 0.20 -0.11 -0.01 0.00 -1.87 0.00 0.00 60.65 58.86 3kzm h LYS 282 Cb 0.15 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.46 3kzm h LYS 282 CO -0.17 0.64 -0.04 0.52 -0.57 0.00 0.00 179.45 179.83 3kzm h MET 283 N -0.21 0.00 0.00 3.15 2.86 -1.26 -0.24 114.93 119.22 3kzm h MET 283 Ca 0.01 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.65 3kzm h MET 283 Cb 0.60 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.26 3kzm h MET 283 CO 0.02 0.04 0.00 0.00 1.06 0.00 0.00 176.91 178.03 3kzm h ALA 284 N 1.96 1.00 0.00 6.32 0.00 -0.85 -2.52 119.26 125.16 3kzm h ALA 284 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3kzm h ALA 284 Cb 0.15 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.94 3kzm h ALA 284 CO 0.01 0.00 -0.26 1.28 0.00 0.00 0.00 179.25 180.27 3kzm n LEU 285 N -2.65 0.49 -4.89 0.00 4.77 -0.10 -4.90 117.00 109.71 3kzm n LEU 285 Ca 0.02 0.35 -0.29 0.00 -0.03 0.00 0.00 56.01 56.06 3kzm n LEU 285 Cb 0.32 -0.32 0.05 0.00 -2.33 0.00 0.00 43.42 41.14 3kzm n LEU 285 CO 0.26 -0.03 0.71 0.42 -1.33 0.00 0.00 177.39 177.41 3kzm s THR 286 N -3.07 3.30 -1.46 -5.08 -4.23 -0.95 -2.21 115.64 101.94 3kzm s THR 286 Ca 0.11 0.31 -0.11 0.00 -1.18 0.00 0.00 61.69 60.81 3kzm s THR 286 Cb 0.16 -3.40 0.04 0.00 1.34 0.00 0.00 72.50 70.64 3kzm s THR 286 CO 0.63 -0.50 2.38 -3.20 -0.54 0.00 0.00 174.62 173.39 3kzm n ASN 287 N -2.96 5.85 -3.74 3.99 5.15 0.27 -4.36 115.26 119.46 3kzm n ASN 287 Ca 0.07 -2.85 -0.29 0.00 -0.60 0.00 0.00 54.58 50.91 3kzm n ASN 287 Cb 0.58 -1.57 0.01 0.00 -0.53 0.00 0.00 39.78 38.27 3kzm n ASN 287 CO 0.00 0.00 0.00 -3.20 1.40 0.00 0.00 177.26 175.46 3kzm n ASN 288 N 4.54 -4.30 -4.71 1.20 5.15 -1.26 -4.74 115.26 111.13 3kzm n ASN 288 Ca 0.58 -0.67 -0.31 0.00 -0.60 0.00 0.00 54.58 53.59 3kzm n ASN 288 Cb 0.33 -3.48 0.14 0.00 -0.53 0.00 0.00 39.78 36.23 3kzm n ASN 288 CO 0.00 0.00 0.00 -0.83 1.40 0.00 0.00 177.26 177.83 3kzm s GLY 289 N -3.07 1.66 0.07 8.20 0.00 -1.24 -5.01 107.32 107.93 3kzm s GLY 289 Ca 0.58 0.33 0.00 0.00 0.00 0.00 0.00 44.72 45.63 3kzm s GLY 289 CO 0.71 0.74 0.22 0.54 0.00 0.00 0.00 173.10 175.31 3kzm s VAL 290 N -2.78 5.38 0.08 1.40 0.11 -0.49 -4.90 120.40 119.20 3kzm s VAL 290 Ca 0.64 -0.41 0.10 0.00 -2.93 0.00 0.00 61.98 59.38 3kzm s VAL 290 Cb -0.20 -3.64 -0.03 0.00 -1.53 0.00 0.00 36.38 30.98 3kzm s VAL 290 CO 0.57 0.12 -0.26 0.12 -3.33 0.00 0.00 175.10 172.33 3kzm s PHE 291 N -1.53 2.24 0.21 1.54 5.36 -0.56 -0.61 117.98 124.63 3kzm s PHE 291 Ca 0.35 -0.40 -0.18 0.00 -0.96 0.00 0.00 56.93 55.75 3kzm s PHE 291 Cb -0.13 -1.29 0.03 0.00 -0.34 0.00 0.00 43.02 41.29 3kzm s PHE 291 CO 0.28 0.20 0.54 0.45 -1.46 0.00 0.00 175.22 175.23 3kzm s SER 292 N -1.57 -0.25 -0.07 6.13 0.15 -0.97 -1.19 113.70 115.93 3kzm s SER 292 Ca 0.12 -0.52 -0.19 0.00 0.70 0.00 0.00 55.95 56.06 3kzm s SER 292 Cb -0.10 0.59 0.04 0.00 -1.71 0.00 0.00 66.02 64.84 3kzm s SER 292 CO 0.04 -1.08 0.44 -2.28 1.20 0.00 0.00 173.24 171.55 3kzm s HIS 293 N -3.89 -0.38 0.28 3.44 2.46 -1.26 -2.94 115.29 113.00 3kzm s HIS 293 Ca 0.10 0.73 0.24 0.00 0.47 0.00 0.00 55.06 56.60 3kzm s HIS 293 Cb -0.01 0.19 1.08 0.00 -0.13 0.00 0.00 32.58 33.71 3kzm s HIS 293 CO -0.01 -0.40 1.91 0.00 -2.47 0.00 0.00 174.74 173.77 3kzm n LEU 295 N -3.58 -0.78 -4.76 0.00 4.77 -1.26 -4.93 117.00 106.46 3kzm n LEU 295 Ca -0.01 1.40 -0.39 0.00 -0.03 0.00 0.00 56.01 56.99 3kzm n LEU 295 Cb 0.36 -1.21 0.00 0.00 -2.33 0.00 0.00 43.42 40.25 3kzm n LEU 295 CO 0.33 -0.57 0.93 -2.16 -1.33 0.00 0.00 177.39 174.58 3kzm s PRO 296 N -4.48 3.76 -0.09 3.23 0.04 -1.26 -5.06 135.00 131.14 3kzm s PRO 296 Ca 0.00 2.06 0.04 0.00 0.04 0.00 0.00 61.00 63.14 3kzm s PRO 296 Cb 0.00 -2.57 0.00 0.00 0.04 0.00 0.00 34.50 31.97 3kzm s PRO 296 CO 0.00 -0.63 -0.21 -1.17 0.04 0.00 0.00 177.00 175.02 3kzm s LEU 297 N -2.79 1.99 -0.44 -3.56 0.20 -1.26 -5.09 118.68 107.73 3kzm s LEU 297 Ca 0.61 -0.50 -0.26 0.00 0.69 0.00 0.00 54.13 54.67 3kzm s LEU 297 Cb -0.36 -1.28 0.02 0.00 -0.43 0.00 0.00 46.19 44.15 3kzm s LEU 297 CO 0.45 0.13 0.95 -0.13 -0.29 0.00 0.00 176.35 177.46 3kzm s ARG 298 N 0.42 3.64 0.40 1.98 0.52 -1.26 -5.02 118.95 119.62 3kzm s ARG 298 Ca -0.18 0.32 -0.26 0.00 -0.52 0.00 0.00 55.73 55.09 3kzm s ARG 298 Cb -0.17 -3.89 -0.09 0.00 0.52 0.00 0.00 34.95 31.32 3kzm s ARG 298 CO 0.08 -1.17 1.29 1.03 0.02 0.00 0.00 175.30 176.56 3kzm s ARG 299 N 3.75 4.02 -1.49 3.54 0.52 -1.26 -2.95 118.95 125.08 3kzm s ARG 299 Ca 0.38 2.14 0.00 0.00 -0.52 0.00 0.00 55.73 57.73 3kzm s ARG 299 Cb -0.10 -2.79 0.00 0.00 0.52 0.00 0.00 34.95 32.58 3kzm s ARG 299 CO 0.25 -0.44 0.00 0.09 0.02 0.00 0.00 175.30 175.22 3kzm n ASN 300 N 0.21 -4.71 0.00 0.23 3.02 -1.26 -4.92 115.26 107.82 3kzm n ASN 300 Ca 0.03 0.25 0.00 0.00 -0.03 0.00 0.00 54.58 54.83 3kzm n ASN 300 Cb 0.44 -3.63 0.00 0.00 -0.61 0.00 0.00 39.78 35.98 3kzm n ASN 300 CO 0.00 0.00 0.00 0.52 -2.62 0.00 0.00 177.26 175.16 3kzm n VAL 301 N -3.02 0.00 -1.51 2.41 0.31 -1.15 -4.95 118.33 110.41 3kzm n VAL 301 Ca -0.16 -0.13 -0.36 0.00 -0.01 0.00 0.00 64.34 63.68 3kzm n VAL 301 Cb 0.54 1.03 0.08 0.00 -0.91 0.00 0.00 33.84 34.58 3kzm n VAL 301 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3kzm n ALA 303 N -0.25 0.54 -1.94 3.52 0.00 -1.26 -4.33 120.51 116.80 3kzm n ALA 303 Ca 0.00 -0.11 -0.30 0.00 0.00 0.00 0.00 53.44 53.03 3kzm n ALA 303 Cb 0.01 -2.25 0.00 0.00 0.00 0.00 0.00 19.45 17.21 3kzm n ALA 303 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 3kzm s THR 304 N -1.64 4.73 0.25 0.00 -4.23 -0.75 -4.54 115.64 109.47 3kzm s THR 304 Ca 0.78 0.79 -0.03 0.00 -1.18 0.00 0.00 61.69 62.05 3kzm s THR 304 Cb -0.36 -3.85 0.23 0.00 1.34 0.00 0.00 72.50 69.86 3kzm s THR 304 CO 0.45 -1.05 1.81 0.44 -0.54 0.00 0.00 174.62 175.73 3kzm h ASP 305 N -0.10 0.72 -0.29 3.99 3.45 -1.94 -0.94 116.42 121.30 3kzm h ASP 305 Ca -0.45 0.05 0.01 0.00 0.43 0.00 0.00 57.03 57.07 3kzm h ASP 305 Cb 1.19 -0.09 -0.02 0.00 -0.56 0.00 0.00 39.33 39.86 3kzm h ASP 305 CO 0.62 0.40 0.19 0.00 -1.57 0.00 0.00 179.24 178.88 3kzm h ALA 306 N 1.47 0.37 -0.44 3.45 0.00 -1.96 -0.07 119.26 122.08 3kzm h ALA 306 Ca 0.42 -0.02 -0.05 0.00 0.00 0.00 0.00 54.91 55.27 3kzm h ALA 306 Cb 0.39 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.06 3kzm h ALA 306 CO -0.25 -0.18 0.10 0.28 0.00 0.00 0.00 179.25 179.20 3kzm h VAL 307 N 0.38 1.24 -0.45 0.00 2.07 -1.72 -1.06 116.25 116.70 3kzm h VAL 307 Ca 0.11 -0.83 -0.05 0.00 0.82 0.00 0.00 66.70 66.75 3kzm h VAL 307 Cb -0.03 0.93 -0.02 0.00 -1.52 0.00 0.00 31.29 30.65 3kzm h VAL 307 CO -0.03 0.29 0.07 0.24 0.02 0.00 0.00 177.57 178.16 3kzm h MET 308 N 0.58 0.70 -0.04 1.57 2.07 -0.97 -2.38 114.93 116.47 3kzm h MET 308 Ca 0.14 -0.15 0.00 0.00 -2.07 0.00 0.00 59.70 57.62 3kzm h MET 308 Cb 0.34 -0.10 0.00 0.00 -1.87 0.00 0.00 31.60 29.96 3kzm h MET 308 CO 0.00 0.66 0.00 -0.25 1.07 0.00 0.00 176.91 178.40 3kzm n ASP 309 N -4.28 1.47 -4.78 1.22 8.00 -0.06 -4.83 116.55 113.30 3kzm n ASP 309 Ca 0.03 -1.52 -0.35 0.00 0.71 0.00 0.00 54.79 53.66 3kzm n ASP 309 Cb 0.23 -0.02 -0.00 0.00 -0.02 0.00 0.00 41.12 41.31 3kzm n ASP 309 CO 0.00 0.00 0.00 -0.55 -0.39 0.00 0.00 177.20 176.26 3kzm s SER 310 N -1.93 5.85 0.10 -2.24 0.15 -0.42 -4.92 113.70 110.31 3kzm s SER 310 Ca 0.37 2.16 0.19 0.00 0.70 0.00 0.00 55.95 59.38 3kzm s SER 310 Cb 0.20 -2.58 0.80 0.00 -1.71 0.00 0.00 66.02 62.74 3kzm s SER 310 CO 0.32 -1.13 1.60 -0.81 1.20 0.00 0.00 173.24 174.43 3kzm n PRO 311 N -1.16 0.08 0.00 5.44 -0.04 -1.26 -2.10 135.00 135.97 3kzm n PRO 311 Ca 0.11 0.29 0.14 0.00 -0.04 0.00 0.00 63.50 64.00 3kzm n PRO 311 Cb 0.51 -1.65 0.51 0.00 -0.04 0.00 0.00 33.50 32.83 3kzm n PRO 311 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 3kzm n ASN 312 N -1.81 0.72 -4.61 3.54 4.13 -1.26 -4.77 115.26 111.20 3kzm n ASN 312 Ca 0.03 -0.73 -0.42 0.00 1.68 0.00 0.00 54.58 55.15 3kzm n ASN 312 Cb 0.22 0.01 -0.05 0.00 -1.54 0.00 0.00 39.78 38.42 3kzm n ASN 312 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 3kzm n ILE 314 N 5.56 2.27 -0.19 0.00 -5.35 -0.34 -4.65 119.36 116.66 3kzm n ILE 314 Ca 0.04 -1.55 0.09 0.00 -0.27 0.00 0.00 62.75 61.06 3kzm n ILE 314 Cb 0.48 -0.14 0.38 0.00 -1.74 0.00 0.00 39.64 38.62 3kzm n ILE 314 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3kzm h ALA 315 N 2.89 1.79 -0.22 -1.28 0.00 -1.87 -0.28 119.26 120.30 3kzm h ALA 315 Ca 0.00 -0.01 -0.16 0.00 0.00 0.00 0.00 54.91 54.74 3kzm h ALA 315 Cb 1.56 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 19.19 3kzm h ALA 315 CO 0.29 0.06 -0.53 0.82 0.00 0.00 0.00 179.25 179.89 3kzm h ILE 316 N 0.69 1.31 -0.51 0.00 1.08 -1.92 -1.14 117.51 117.02 3kzm h ILE 316 Ca 0.35 -1.76 -0.10 0.00 -0.39 0.00 0.00 64.86 62.96 3kzm h ILE 316 Cb 0.43 1.71 -0.02 0.00 -3.07 0.00 0.00 36.82 35.88 3kzm h ILE 316 CO -0.13 0.55 -0.07 0.44 -0.69 0.00 0.00 178.15 178.26 3kzm h ASP 317 N 0.50 0.94 -0.66 1.72 3.32 -1.63 -1.14 116.42 119.47 3kzm h ASP 317 Ca 0.01 -0.34 -0.02 0.00 0.02 0.00 0.00 57.03 56.70 3kzm h ASP 317 Cb 1.09 -0.26 -0.03 0.00 0.22 0.00 0.00 39.33 40.36 3kzm h ASP 317 CO 0.11 1.06 0.32 -0.08 -1.72 0.00 0.00 179.24 178.93 3kzm h GLU 318 N 0.81 0.95 -0.54 3.56 4.81 -0.96 -1.33 114.58 121.88 3kzm h GLU 318 Ca 0.14 -0.14 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 3kzm h GLU 318 Cb 0.62 -0.17 -0.03 0.00 0.63 0.00 0.00 28.75 29.80 3kzm h GLU 318 CO 0.04 0.75 0.34 0.00 -0.73 0.00 0.00 179.01 179.41 3kzm h ALA 319 N 1.15 0.68 -0.52 2.92 0.00 -0.95 -2.59 119.26 119.96 3kzm h ALA 319 Ca 0.23 -0.05 0.01 0.00 0.00 0.00 0.00 54.91 55.09 3kzm h ALA 319 Cb 0.11 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.66 3kzm h ALA 319 CO -0.03 0.14 0.34 1.49 0.00 0.00 0.00 179.25 181.20 3kzm h GLU 320 N 0.73 0.68 0.00 0.00 4.81 -0.83 -2.28 114.58 117.68 3kzm h GLU 320 Ca 0.20 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.38 3kzm h GLU 320 Cb -0.06 -0.15 0.00 0.00 0.63 0.00 0.00 28.75 29.17 3kzm h GLU 320 CO -0.04 0.45 0.06 -0.91 -0.73 0.00 0.00 179.01 177.84 3kzm h ASN 321 N 0.70 0.00 -0.99 1.04 2.35 -0.85 -0.75 115.58 117.07 3kzm h ASN 321 Ca 0.19 0.00 0.04 0.00 -0.55 0.00 0.00 56.30 55.98 3kzm h ASN 321 Cb -0.08 0.00 -0.06 0.00 0.05 0.00 0.00 38.32 38.23 3kzm h ASN 321 CO -0.04 0.00 0.65 0.03 -1.65 0.00 0.00 177.43 176.41 3kzm h ARG 322 N 0.00 1.20 -0.22 0.81 2.47 -1.25 -1.03 114.38 116.37 3kzm h ARG 322 Ca 0.00 -0.07 -0.00 0.00 -1.26 0.00 0.00 59.98 58.64 3kzm h ARG 322 Cb 0.11 -0.27 -0.01 0.00 -1.65 0.00 0.00 29.97 28.15 3kzm h ARG 322 CO 0.00 0.80 0.12 1.25 0.56 0.00 0.00 179.97 182.70 3kzm h LEU 323 N 1.24 0.27 -0.26 3.04 5.85 -1.29 -2.37 115.31 121.80 3kzm h LEU 323 Ca 0.40 -0.07 -0.09 0.00 0.84 0.00 0.00 57.88 58.96 3kzm h LEU 323 Cb 0.03 -0.07 -0.01 0.00 0.37 0.00 0.00 40.66 40.99 3kzm h LEU 323 CO -0.13 0.27 -0.18 0.45 -0.34 0.00 0.00 178.44 178.51 3kzm h HIS 324 N 0.25 0.68 -0.02 1.25 -0.00 -1.53 -2.70 115.15 113.07 3kzm h HIS 324 Ca 0.08 -0.18 -0.11 0.00 -0.00 0.00 0.00 60.37 60.15 3kzm h HIS 324 Cb 0.05 -0.15 -0.01 0.00 -0.00 0.00 0.00 27.41 27.30 3kzm h HIS 324 CO -0.04 0.86 -0.52 -0.39 -0.00 0.00 0.00 177.93 177.84 3kzm h VAL 325 N 0.30 1.37 -0.14 2.45 -1.51 -1.25 -2.54 116.25 114.93 3kzm h VAL 325 Ca 0.05 -1.79 -0.14 0.00 -1.23 0.00 0.00 66.70 63.59 3kzm h VAL 325 Cb 0.71 1.94 -0.01 0.00 -2.13 0.00 0.00 31.29 31.80 3kzm h VAL 325 CO 0.05 0.52 -0.50 1.56 -1.23 0.00 0.00 177.57 177.96 3kzm h GLN 326 N 0.05 0.39 -0.39 5.19 4.20 -1.43 -0.75 115.11 122.37 3kzm h GLN 326 Ca -0.00 -0.23 -0.11 0.00 0.06 0.00 0.00 58.65 58.37 3kzm h GLN 326 Cb 0.94 0.02 -0.02 0.00 0.30 0.00 0.00 27.48 28.72 3kzm h GLN 326 CO 0.07 0.81 -0.19 0.87 -0.67 0.00 0.00 178.83 179.71 3kzm h LYS 327 N 0.31 0.75 -0.66 1.46 1.57 -1.29 -0.42 116.57 118.29 3kzm h LYS 327 Ca 0.01 -0.29 -0.07 0.00 -1.87 0.00 0.00 60.65 58.44 3kzm h LYS 327 Cb 1.00 -0.04 -0.03 0.00 0.08 0.00 0.00 32.23 33.24 3kzm h LYS 327 CO 0.09 0.89 0.15 0.00 -0.57 0.00 0.00 179.45 180.00 3kzm h ALA 328 N 1.12 0.87 -0.03 3.86 0.00 -1.08 -0.57 119.26 123.44 3kzm h ALA 328 Ca 0.10 -0.25 -0.00 0.00 0.00 0.00 0.00 54.91 54.76 3kzm h ALA 328 Cb 0.69 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 18.22 3kzm h ALA 328 CO 0.05 0.61 0.01 0.82 0.00 0.00 0.00 179.25 180.74 3kzm h ILE 329 N 0.99 1.19 -0.68 0.00 2.04 -0.80 -1.02 117.51 119.23 3kzm h ILE 329 Ca 0.21 -0.56 -0.03 0.00 1.00 0.00 0.00 64.86 65.48 3kzm h ILE 329 Cb 0.39 1.50 -0.03 0.00 -0.74 0.00 0.00 36.82 37.94 3kzm h ILE 329 CO 0.01 0.15 0.32 0.24 0.00 0.00 0.00 178.15 178.86 3kzm h MET 330 N -0.17 0.99 -0.87 2.37 2.86 -1.00 -1.70 114.93 117.42 3kzm h MET 330 Ca 0.01 -0.15 -0.00 0.00 -2.06 0.00 0.00 59.70 57.49 3kzm h MET 330 Cb 0.24 -0.17 -0.04 0.00 0.06 0.00 0.00 31.60 31.68 3kzm h MET 330 CO 0.00 0.80 0.54 0.00 1.06 0.00 0.00 176.91 179.31 3kzm h ALA 331 N 1.15 1.10 -0.15 6.32 0.00 -1.01 -1.31 119.26 125.36 3kzm h ALA 331 Ca 0.23 -0.09 -0.12 0.00 0.00 0.00 0.00 54.91 54.94 3kzm h ALA 331 Cb 0.14 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 3kzm h ALA 331 CO -0.03 0.55 -0.44 0.00 0.00 0.00 0.00 179.25 179.33 3kzm h ALA 332 N 1.29 0.98 0.05 0.00 0.00 -0.82 -3.30 119.26 117.47 3kzm h ALA 332 Ca 0.31 -0.44 -0.27 0.00 0.00 0.00 0.00 54.91 54.51 3kzm h ALA 332 Cb -0.08 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.59 3kzm h ALA 332 CO -0.06 0.63 -1.42 -0.07 0.00 0.00 0.00 179.25 178.33 3kzm h LEU 333 N 0.29 0.18 0.00 0.00 3.38 -1.00 -3.51 115.31 114.64 3kzm h LEU 333 Ca 0.02 -0.25 0.00 0.00 0.09 0.00 0.00 57.88 57.74 3kzm h LEU 333 Cb 0.89 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.58 3kzm h LEU 333 CO 0.07 1.21 0.00 0.55 0.09 0.00 0.00 178.44 180.37