#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1zkn s PRO 80 N 0.00 0.28 -0.27 9.51 0.04 -1.26 -4.75 135.00 138.56 1zkn s PRO 80 Ca 0.00 0.37 -0.02 0.00 0.04 0.00 0.00 61.00 61.39 1zkn s PRO 80 Cb 0.00 -1.73 0.03 0.00 0.04 0.00 0.00 34.50 32.84 1zkn s PRO 80 CO 0.00 -2.79 -0.03 1.03 0.04 0.00 0.00 177.00 175.24 1zkn s ARG 81 N -5.09 2.73 -1.46 4.56 1.81 -0.35 -4.68 118.95 116.46 1zkn s ARG 81 Ca 0.66 -1.06 -0.06 0.00 -1.72 0.00 0.00 55.73 53.55 1zkn s ARG 81 Cb -0.17 -3.08 0.03 0.00 -0.45 0.00 0.00 34.95 31.28 1zkn s ARG 81 CO 0.57 -0.47 0.54 1.19 -0.68 0.00 0.00 175.30 176.45 1zkn n PHE 82 N 4.67 -1.89 -0.81 -0.53 3.72 -1.26 -1.47 117.46 119.89 1zkn n PHE 82 Ca -0.15 0.48 0.00 0.00 -0.05 0.00 0.00 57.45 57.73 1zkn n PHE 82 Cb 0.46 -3.95 0.00 0.00 -0.94 0.00 0.00 39.48 35.05 1zkn n PHE 82 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1zkn n GLY 83 N -1.38 0.69 3.55 1.37 0.00 -1.26 -5.04 105.19 103.12 1zkn n GLY 83 Ca -0.09 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.63 1zkn n GLY 83 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1zkn s VAL 84 N -2.52 3.27 0.51 1.61 1.01 -0.54 -5.10 120.40 118.65 1zkn s VAL 84 Ca 0.00 -1.18 -0.23 0.00 0.00 0.00 0.00 61.98 60.57 1zkn s VAL 84 Cb 0.00 -2.48 -0.06 0.00 0.00 0.00 0.00 36.38 33.84 1zkn s VAL 84 CO 0.00 0.20 1.33 -0.54 0.00 0.00 0.00 175.10 176.10 1zkn s LYS 85 N -1.92 3.35 0.79 2.72 1.02 -1.26 -1.21 119.74 123.23 1zkn s LYS 85 Ca 0.19 2.18 -0.12 0.00 0.02 0.00 0.00 55.97 58.25 1zkn s LYS 85 Cb -0.11 -2.36 0.07 0.00 -0.52 0.00 0.00 37.83 34.91 1zkn s LYS 85 CO 0.11 -1.01 1.12 0.99 -0.92 0.00 0.00 175.35 175.64 1zkn s THR 86 N -1.33 2.76 0.24 2.17 2.01 -1.26 -4.72 115.64 115.51 1zkn s THR 86 Ca 0.68 0.25 -0.06 0.00 0.31 0.00 0.00 61.69 62.87 1zkn s THR 86 Cb -0.39 -3.13 0.24 0.00 0.01 0.00 0.00 72.50 69.22 1zkn s THR 86 CO 0.47 -0.32 1.90 1.05 -0.69 0.00 0.00 174.62 177.03 1zkn h GLU 87 N -1.01 1.18 -0.31 4.92 4.11 -1.97 -1.09 114.58 120.41 1zkn h GLU 87 Ca -0.47 -0.07 -0.04 0.00 0.07 0.00 0.00 59.36 58.86 1zkn h GLU 87 Cb 1.29 -0.27 -0.01 0.00 0.50 0.00 0.00 28.75 30.26 1zkn h GLU 87 CO 0.63 0.78 0.06 1.96 0.07 0.00 0.00 179.01 182.51 1zkn h GLN 88 N 1.22 0.51 -0.47 1.06 4.20 -1.96 -2.13 115.11 117.54 1zkn h GLN 88 Ca 0.36 -0.13 -0.00 0.00 0.06 0.00 0.00 58.65 58.94 1zkn h GLN 88 Cb -0.05 -0.06 -0.02 0.00 0.30 0.00 0.00 27.48 27.64 1zkn h GLN 88 CO -0.10 0.60 0.27 0.93 -0.67 0.00 0.00 178.83 179.86 1zkn h GLU 89 N 0.34 0.64 -0.11 1.46 5.08 -1.79 0.35 114.58 120.55 1zkn h GLU 89 Ca 0.10 -0.05 -0.02 0.00 -1.00 0.00 0.00 59.36 58.39 1zkn h GLU 89 Cb 0.33 -0.14 -0.00 0.00 0.50 0.00 0.00 28.75 29.44 1zkn h GLU 89 CO 0.00 0.46 0.01 0.22 -1.00 0.00 0.00 179.01 178.70 1zkn h ASP 90 N 0.65 0.18 -0.92 1.42 -0.00 -0.89 0.21 116.42 117.08 1zkn h ASP 90 Ca 0.17 -0.29 -0.01 0.00 -0.00 0.00 0.00 57.03 56.90 1zkn h ASP 90 Cb -0.01 -0.05 -0.04 0.00 -0.00 0.00 0.00 39.33 39.23 1zkn h ASP 90 CO -0.03 0.43 0.52 0.58 -0.00 0.00 0.00 179.24 180.74 1zkn h VAL 91 N -0.07 1.26 -0.29 2.25 2.07 -0.93 -1.12 116.25 119.42 1zkn h VAL 91 Ca 0.03 -0.61 0.01 0.00 0.82 0.00 0.00 66.70 66.95 1zkn h VAL 91 Cb 0.33 -0.00 -0.02 0.00 -1.52 0.00 0.00 31.29 30.08 1zkn h VAL 91 CO 0.00 0.28 0.17 0.25 0.02 0.00 0.00 177.57 178.30 1zkn h LEU 92 N 1.27 0.28 -0.84 2.57 6.46 -0.73 -1.94 115.31 122.38 1zkn h LEU 92 Ca 0.33 0.00 0.03 0.00 -0.12 0.00 0.00 57.88 58.12 1zkn h LEU 92 Cb -0.01 -0.06 -0.05 0.00 -0.73 0.00 0.00 40.66 39.81 1zkn h LEU 92 CO -0.06 0.20 0.54 0.00 -0.62 0.00 0.00 178.44 178.51 1zkn h ALA 93 N 1.12 1.11 -0.48 1.25 0.00 -0.23 -0.78 119.26 121.26 1zkn h ALA 93 Ca 0.11 -0.03 -0.07 0.00 0.00 0.00 0.00 54.91 54.92 1zkn h ALA 93 Cb -0.01 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.48 1zkn h ALA 93 CO -0.05 0.37 0.02 0.87 0.00 0.00 0.00 179.25 180.46 1zkn h LYS 94 N 1.05 0.78 -0.40 0.00 1.57 -0.82 -2.55 116.57 116.19 1zkn h LYS 94 Ca 0.34 -0.20 -0.06 0.00 -1.87 0.00 0.00 60.65 58.86 1zkn h LYS 94 Cb 0.01 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.21 1zkn h LYS 94 CO -0.12 0.78 0.02 0.93 -0.57 0.00 0.00 179.45 180.49 1zkn h GLU 95 N 0.73 0.70 0.00 3.15 4.39 -0.65 -2.38 114.58 120.53 1zkn h GLU 95 Ca 0.15 -0.21 0.00 0.00 0.34 0.00 0.00 59.36 59.64 1zkn h GLU 95 Cb 0.43 -0.07 0.00 0.00 -0.10 0.00 0.00 28.75 29.01 1zkn h GLU 95 CO 0.02 0.77 0.00 1.28 -1.16 0.00 0.00 179.01 179.92 1zkn n LEU 96 N -4.47 0.00 0.20 1.33 4.77 -0.37 -1.65 117.00 116.81 1zkn n LEU 96 Ca -0.01 0.37 0.14 0.00 -0.03 0.00 0.00 56.01 56.49 1zkn n LEU 96 Cb 0.27 -0.37 0.62 0.00 -2.33 0.00 0.00 43.42 41.61 1zkn n LEU 96 CO 0.40 -0.33 0.92 -0.33 -1.33 0.00 0.00 177.39 176.72 1zkn h GLU 97 N 0.00 0.00 -0.67 3.23 5.08 -1.18 -2.18 114.58 118.85 1zkn h GLU 97 Ca 0.00 0.00 -0.14 0.00 -1.00 0.00 0.00 59.36 58.22 1zkn h GLU 97 Cb 0.04 0.00 -0.08 0.00 0.50 0.00 0.00 28.75 29.21 1zkn h GLU 97 CO 0.00 0.00 0.17 -0.25 -1.00 0.00 0.00 179.01 177.93 1zkn n ASP 98 N -2.58 5.12 0.09 1.42 8.00 -0.66 -4.57 116.55 123.38 1zkn n ASP 98 Ca 0.01 -3.13 0.10 0.00 0.71 0.00 0.00 54.79 52.47 1zkn n ASP 98 Cb 0.22 -0.72 0.57 0.00 -0.02 0.00 0.00 41.12 41.17 1zkn n ASP 98 CO 0.00 0.00 0.00 1.62 -0.39 0.00 0.00 177.20 178.43 1zkn h VAL 99 N 3.09 0.96 -0.20 2.53 3.04 -1.60 0.03 116.25 124.10 1zkn h VAL 99 Ca 0.17 -0.07 0.00 0.00 -1.01 0.00 0.00 66.70 65.79 1zkn h VAL 99 Cb 2.20 0.74 0.00 0.00 -2.01 0.00 0.00 31.29 32.22 1zkn h VAL 99 CO 0.65 0.04 0.00 0.59 -1.01 0.00 0.00 177.57 177.84 1zkn n ASN 100 N -4.49 1.48 -4.64 3.17 3.02 -1.26 -4.78 115.26 107.76 1zkn n ASN 100 Ca 0.03 -1.79 -0.33 0.00 -0.03 0.00 0.00 54.58 52.46 1zkn n ASN 100 Cb 0.22 -0.13 -0.10 0.00 -0.61 0.00 0.00 39.78 39.16 1zkn n ASN 100 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 1zkn s LYS 101 N -1.74 2.74 -0.26 3.52 1.02 -0.01 -4.86 119.74 120.15 1zkn s LYS 101 Ca 0.27 -0.60 -0.29 0.00 0.02 0.00 0.00 55.97 55.37 1zkn s LYS 101 Cb 0.14 -2.63 -0.00 0.00 -0.52 0.00 0.00 37.83 34.82 1zkn s LYS 101 CO 0.21 0.64 1.26 -0.46 -0.92 0.00 0.00 175.35 176.07 1zkn s TRP 102 N -0.99 2.80 0.00 3.18 -0.11 -1.26 -3.31 118.94 119.25 1zkn s TRP 102 Ca 0.17 0.97 0.00 0.00 1.22 0.00 0.00 56.10 58.45 1zkn s TRP 102 Cb -0.11 -3.75 0.00 0.00 -1.50 0.00 0.00 33.47 28.11 1zkn s TRP 102 CO 0.07 -1.56 0.00 0.41 -4.62 0.00 0.00 176.95 171.25 1zkn n GLY 103 N 4.03 1.64 3.57 5.86 0.00 -1.26 -4.95 105.19 114.07 1zkn n GLY 103 Ca 0.14 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.76 1zkn n GLY 103 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1zkn n LEU 104 N 0.00 2.11 -3.83 0.99 7.94 -1.21 -4.79 117.00 118.20 1zkn n LEU 104 Ca 0.00 0.94 -0.42 0.00 -1.11 0.00 0.00 56.01 55.42 1zkn n LEU 104 Cb 0.00 -1.29 0.00 0.00 0.53 0.00 0.00 43.42 42.66 1zkn n LEU 104 CO 0.00 -1.99 2.51 1.41 -1.11 0.00 0.00 177.39 178.21 1zkn n HIS 105 N -0.91 3.56 0.25 1.96 8.25 -1.26 -4.72 115.22 122.34 1zkn n HIS 105 Ca 0.11 -2.95 0.11 0.00 -0.26 0.00 0.00 57.72 54.73 1zkn n HIS 105 Cb 0.42 -2.47 0.73 0.00 1.12 0.00 0.00 29.99 29.78 1zkn n HIS 105 CO 0.00 0.00 0.00 -0.24 0.64 0.00 0.00 176.34 176.74 1zkn h VAL 106 N 4.10 0.83 -0.23 1.59 3.04 -1.99 -1.65 116.25 121.94 1zkn h VAL 106 Ca 0.53 0.00 -0.19 0.00 -1.01 0.00 0.00 66.70 66.03 1zkn h VAL 106 Cb 0.66 0.97 0.00 0.00 -2.01 0.00 0.00 31.29 30.91 1zkn h VAL 106 CO 1.81 0.00 -0.61 -0.26 -1.01 0.00 0.00 177.57 177.50 1zkn h PHE 107 N 0.00 0.99 -0.53 3.17 0.04 -1.97 -1.62 116.94 117.02 1zkn h PHE 107 Ca 0.02 -0.37 -0.12 0.00 2.80 0.00 0.00 57.97 60.30 1zkn h PHE 107 Cb 0.10 -0.18 -0.02 0.00 2.20 0.00 0.00 35.95 38.06 1zkn h PHE 107 CO 0.00 1.18 -0.13 0.00 -0.60 0.00 0.00 178.31 178.76 1zkn h ARG 108 N 0.57 1.02 -0.95 1.51 3.08 -1.76 -2.28 114.38 115.57 1zkn h ARG 108 Ca -0.00 -0.39 0.02 0.00 0.07 0.00 0.00 59.98 59.68 1zkn h ARG 108 Cb 1.21 -0.06 -0.05 0.00 0.08 0.00 0.00 29.97 31.15 1zkn h ARG 108 CO 0.13 1.07 0.63 0.82 -1.07 0.00 0.00 179.97 181.55 1zkn h ILE 109 N 0.90 1.22 -0.48 2.04 2.04 -1.22 0.12 117.51 122.14 1zkn h ILE 109 Ca 0.13 -0.43 -0.02 0.00 1.00 0.00 0.00 64.86 65.54 1zkn h ILE 109 Cb 0.70 -0.15 -0.02 0.00 -0.74 0.00 0.00 36.82 36.61 1zkn h ILE 109 CO 0.05 0.23 0.21 0.00 0.00 0.00 0.00 178.15 178.65 1zkn h ALA 110 N 1.42 0.62 -0.18 1.87 0.00 -0.88 -0.95 119.26 121.15 1zkn h ALA 110 Ca 0.36 -0.13 -0.04 0.00 0.00 0.00 0.00 54.91 55.09 1zkn h ALA 110 Cb -0.11 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.49 1zkn h ALA 110 CO -0.09 0.19 -0.06 0.93 0.00 0.00 0.00 179.25 180.23 1zkn h GLU 111 N 0.63 0.36 -0.09 0.00 5.08 -0.87 0.32 114.58 120.01 1zkn h GLU 111 Ca 0.16 -0.14 -0.05 0.00 -1.00 0.00 0.00 59.36 58.32 1zkn h GLU 111 Cb 0.15 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.37 1zkn h GLU 111 CO -0.02 0.64 -0.19 -0.07 -1.00 0.00 0.00 179.01 178.37 1zkn h LEU 112 N 0.06 0.14 -1.02 1.33 3.38 -0.70 -2.77 115.31 115.73 1zkn h LEU 112 Ca 0.04 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.98 1zkn h LEU 112 Cb 0.51 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.23 1zkn h LEU 112 CO 0.02 0.34 0.00 -1.54 0.09 0.00 0.00 178.44 177.35 1zkn n SER 113 N -4.25 1.53 -1.82 -0.43 3.41 -0.37 -4.85 113.62 106.83 1zkn n SER 113 Ca -0.01 -1.73 -0.10 0.00 -0.26 0.00 0.00 58.87 56.77 1zkn n SER 113 Cb 0.29 -0.11 0.03 0.00 -0.26 0.00 0.00 64.21 64.16 1zkn n SER 113 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1zkn n GLY 114 N 1.08 0.31 2.94 5.00 0.00 -1.04 -3.40 105.19 110.07 1zkn n GLY 114 Ca 0.15 -0.28 -0.16 0.00 0.00 0.00 0.00 46.02 45.73 1zkn n GLY 114 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1zkn n ASN 115 N -0.46 -4.83 -2.46 1.61 5.15 0.11 -4.95 115.26 109.42 1zkn n ASN 115 Ca 0.00 -0.38 -0.18 0.00 -0.60 0.00 0.00 54.58 53.42 1zkn n ASN 115 Cb 0.53 -3.65 0.02 0.00 -0.53 0.00 0.00 39.78 36.15 1zkn n ASN 115 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 1zkn n ARG 116 N -3.60 2.71 -0.27 1.20 5.12 -1.22 -4.89 116.66 115.72 1zkn n ARG 116 Ca -0.01 -4.00 -0.05 0.00 -1.93 0.00 0.00 57.85 51.86 1zkn n ARG 116 Cb 0.55 -1.93 0.06 0.00 -1.16 0.00 0.00 32.46 29.97 1zkn n ARG 116 CO 0.00 0.00 0.00 -1.00 -1.93 0.00 0.00 177.63 174.70 1zkn h PRO 117 N 2.59 0.99 -0.23 5.56 0.13 -1.82 -2.53 132.00 136.68 1zkn h PRO 117 Ca 0.16 -0.09 -0.02 0.00 -0.87 0.00 0.00 66.00 65.19 1zkn h PRO 117 Cb 1.18 -0.21 -0.01 0.00 0.13 0.00 0.00 31.00 32.09 1zkn h PRO 117 CO 0.65 0.70 0.07 1.25 -0.23 0.00 0.00 178.00 180.44 1zkn h LEU 118 N 1.00 0.34 -0.07 1.56 5.85 -1.90 -1.64 115.31 120.44 1zkn h LEU 118 Ca 0.26 -0.21 -0.00 0.00 0.84 0.00 0.00 57.88 58.77 1zkn h LEU 118 Cb -0.04 -0.09 -0.00 0.00 0.37 0.00 0.00 40.66 40.89 1zkn h LEU 118 CO -0.05 0.46 0.04 0.74 -0.34 0.00 0.00 178.44 179.29 1zkn h THR 119 N 0.20 1.04 -0.31 1.05 2.02 -1.81 -0.33 112.91 114.77 1zkn h THR 119 Ca 0.07 -0.11 -0.10 0.00 0.77 0.00 0.00 66.41 67.04 1zkn h THR 119 Cb 0.24 0.99 -0.01 0.00 -1.74 0.00 0.00 68.15 67.64 1zkn h THR 119 CO -0.00 0.04 -0.20 -0.37 0.37 0.00 0.00 175.52 175.35 1zkn h VAL 120 N 0.07 1.29 -0.38 3.16 -1.51 -1.47 -0.34 116.25 117.07 1zkn h VAL 120 Ca 0.03 -1.33 -0.04 0.00 -1.23 0.00 0.00 66.70 64.13 1zkn h VAL 120 Cb 0.03 1.48 -0.02 0.00 -2.13 0.00 0.00 31.29 30.65 1zkn h VAL 120 CO -0.00 0.43 0.10 0.40 -1.23 0.00 0.00 177.57 177.26 1zkn h ILE 121 N 0.45 1.22 -0.44 7.19 2.04 -1.29 0.92 117.51 127.60 1zkn h ILE 121 Ca 0.06 -0.75 -0.01 0.00 1.00 0.00 0.00 64.86 65.17 1zkn h ILE 121 Cb 0.75 1.00 -0.02 0.00 -0.74 0.00 0.00 36.82 37.80 1zkn h ILE 121 CO 0.06 0.26 0.25 0.24 0.00 0.00 0.00 178.15 178.96 1zkn h MET 122 N 0.46 0.61 -0.44 2.37 2.86 -1.02 0.16 114.93 119.94 1zkn h MET 122 Ca 0.12 -0.07 -0.01 0.00 -2.06 0.00 0.00 59.70 57.69 1zkn h MET 122 Cb 0.29 -0.12 -0.02 0.00 0.06 0.00 0.00 31.60 31.81 1zkn h MET 122 CO -0.00 0.47 0.24 1.25 1.06 0.00 0.00 176.91 179.94 1zkn h HIS 123 N 0.58 0.60 -0.23 -0.22 -0.00 -0.83 0.57 115.15 115.62 1zkn h HIS 123 Ca 0.16 -0.01 0.01 0.00 -0.00 0.00 0.00 60.37 60.53 1zkn h HIS 123 Cb 0.03 -0.19 -0.02 0.00 -0.00 0.00 0.00 27.41 27.23 1zkn h HIS 123 CO -0.03 0.45 0.12 1.15 -0.00 0.00 0.00 177.93 179.62 1zkn h THR 124 N 0.58 1.00 -0.66 6.26 2.02 -0.50 -2.05 112.91 119.55 1zkn h THR 124 Ca 0.16 -0.08 -0.04 0.00 0.77 0.00 0.00 66.41 67.21 1zkn h THR 124 Cb 0.05 0.73 -0.03 0.00 -1.74 0.00 0.00 68.15 67.16 1zkn h THR 124 CO -0.03 0.05 0.25 0.40 0.37 0.00 0.00 175.52 176.56 1zkn h ILE 125 N 0.25 1.24 -0.75 3.11 2.04 -0.66 0.18 117.51 122.92 1zkn h ILE 125 Ca 0.09 -0.78 -0.02 0.00 1.00 0.00 0.00 64.86 65.15 1zkn h ILE 125 Cb 0.02 0.52 -0.04 0.00 -0.74 0.00 0.00 36.82 36.58 1zkn h ILE 125 CO -0.06 0.31 0.39 -0.26 0.00 0.00 0.00 178.15 178.53 1zkn h PHE 126 N 0.94 1.05 -0.16 1.37 -1.00 -0.72 -1.05 116.94 117.36 1zkn h PHE 126 Ca 0.22 -0.04 -0.02 0.00 2.81 0.00 0.00 57.97 60.94 1zkn h PHE 126 Cb 0.23 -0.33 -0.01 0.00 3.61 0.00 0.00 35.95 39.45 1zkn h PHE 126 CO 0.02 0.76 0.03 1.96 -1.61 0.00 0.00 178.31 179.46 1zkn h GLN 127 N 1.05 0.27 -0.98 1.51 4.20 -1.07 0.20 115.11 120.28 1zkn h GLN 127 Ca 0.26 -0.07 0.08 0.00 0.06 0.00 0.00 58.65 58.99 1zkn h GLN 127 Cb 0.07 -0.03 -0.07 0.00 0.30 0.00 0.00 27.48 27.75 1zkn h GLN 127 CO -0.04 0.43 0.63 1.49 -0.67 0.00 0.00 178.83 180.67 1zkn h GLU 128 N 0.06 1.04 -0.41 1.46 4.57 -0.70 -0.81 114.58 119.79 1zkn h GLU 128 Ca 0.05 -0.06 0.00 0.00 -1.18 0.00 0.00 59.36 58.17 1zkn h GLU 128 Cb 0.29 -0.24 0.00 0.00 -0.16 0.00 0.00 28.75 28.64 1zkn h GLU 128 CO 0.00 0.69 0.00 0.54 -1.18 0.00 0.00 179.01 179.06 1zkn n ARG 129 N -4.53 2.10 -3.73 1.92 1.74 -0.42 -4.93 116.66 108.79 1zkn n ARG 129 Ca 0.16 -1.69 -0.29 0.00 -0.77 0.00 0.00 57.85 55.27 1zkn n ARG 129 Cb 0.25 -1.40 0.02 0.00 -1.02 0.00 0.00 32.46 30.31 1zkn n ARG 129 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 1zkn n ASP 130 N 0.88 -4.58 0.12 0.55 2.03 -0.31 -4.88 116.55 110.37 1zkn n ASP 130 Ca 0.17 -0.66 -0.01 0.00 0.52 0.00 0.00 54.79 54.80 1zkn n ASP 130 Cb 0.42 -3.69 0.10 0.00 -0.72 0.00 0.00 41.12 37.23 1zkn n ASP 130 CO 0.00 0.00 0.00 -0.07 -1.92 0.00 0.00 177.20 175.21 1zkn h LEU 131 N -1.71 0.00 -0.71 -2.67 3.38 -0.92 -2.66 115.31 110.02 1zkn h LEU 131 Ca -0.54 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.38 1zkn h LEU 131 Cb 1.36 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 42.07 1zkn h LEU 131 CO 0.64 0.67 0.26 -0.07 0.09 0.00 0.00 178.44 180.03 1zkn h LEU 132 N 0.00 1.00 -0.10 1.67 4.07 -1.88 -1.90 115.31 118.17 1zkn h LEU 132 Ca -0.01 -0.19 -0.09 0.00 0.08 0.00 0.00 57.88 57.68 1zkn h LEU 132 Cb 1.28 -0.26 0.00 0.00 1.08 0.00 0.00 40.66 42.76 1zkn h LEU 132 CO 0.09 0.92 -0.27 0.11 -1.08 0.00 0.00 178.44 178.20 1zkn h LYS 133 N 1.02 0.36 -0.73 1.13 1.57 -1.87 0.13 116.57 118.19 1zkn h LYS 133 Ca 0.23 -0.25 0.03 0.00 -1.87 0.00 0.00 60.65 58.79 1zkn h LYS 133 Cb 0.25 0.04 -0.04 0.00 0.08 0.00 0.00 32.23 32.56 1zkn h LYS 133 CO -0.01 0.87 0.48 1.15 -0.57 0.00 0.00 179.45 181.37 1zkn h THR 134 N -0.10 1.13 -0.21 -0.16 2.02 -1.41 -2.78 112.91 111.39 1zkn h THR 134 Ca -0.01 -0.31 0.00 0.00 0.77 0.00 0.00 66.41 66.86 1zkn h THR 134 Cb 0.89 0.14 0.00 0.00 -1.74 0.00 0.00 68.15 67.44 1zkn h THR 134 CO 0.06 0.17 0.00 0.49 0.37 0.00 0.00 175.52 176.60 1zkn n PHE 135 N -4.45 0.55 -4.14 3.16 3.72 -0.72 -5.00 117.46 110.58 1zkn n PHE 135 Ca 0.09 -0.75 -0.37 0.00 -0.05 0.00 0.00 57.45 56.37 1zkn n PHE 135 Cb 0.10 -0.18 -0.03 0.00 -0.94 0.00 0.00 39.48 38.43 1zkn n PHE 135 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34 1zkn n LYS 136 N -0.37 -0.96 -3.13 -1.08 4.01 0.02 -4.61 118.16 112.04 1zkn n LYS 136 Ca 0.15 0.14 -0.41 0.00 -0.51 0.00 0.00 58.31 57.68 1zkn n LYS 136 Cb 0.65 -3.31 -0.07 0.00 -0.51 0.00 0.00 35.03 31.79 1zkn n LYS 136 CO 0.00 0.00 0.00 0.42 -1.11 0.00 0.00 177.40 176.71 1zkn s ILE 137 N -3.95 4.92 0.40 -0.18 1.01 0.26 -4.63 121.20 119.02 1zkn s ILE 137 Ca 0.22 0.66 -0.27 0.00 0.00 0.00 0.00 60.65 61.27 1zkn s ILE 137 Cb -0.12 -4.04 -0.09 0.00 0.01 0.00 0.00 42.46 38.22 1zkn s ILE 137 CO 0.97 -0.24 1.35 -2.16 0.00 0.00 0.00 174.94 174.86 1zkn s PRO 138 N 2.64 4.01 0.21 2.79 0.04 -1.26 -4.81 135.00 138.63 1zkn s PRO 138 Ca 0.24 2.28 -0.09 0.00 0.04 0.00 0.00 61.00 63.47 1zkn s PRO 138 Cb -0.15 -2.83 0.23 0.00 0.04 0.00 0.00 34.50 31.80 1zkn s PRO 138 CO 0.14 -0.50 1.83 -0.24 0.04 0.00 0.00 177.00 178.26 1zkn h VAL 139 N 2.62 1.02 -0.89 -0.36 3.04 -1.96 -1.84 116.25 117.89 1zkn h VAL 139 Ca -0.50 -0.27 0.01 0.00 -1.01 0.00 0.00 66.70 64.93 1zkn h VAL 139 Cb 1.24 0.17 -0.04 0.00 -2.01 0.00 0.00 31.29 30.65 1zkn h VAL 139 CO 0.63 0.14 0.59 0.44 -1.01 0.00 0.00 177.57 178.36 1zkn h ASP 140 N 0.79 1.02 -0.43 3.17 5.19 -1.97 -1.16 116.42 123.02 1zkn h ASP 140 Ca 0.30 -0.03 -0.04 0.00 -0.62 0.00 0.00 57.03 56.64 1zkn h ASP 140 Cb 0.12 -0.25 -0.02 0.00 0.18 0.00 0.00 39.33 39.36 1zkn h ASP 140 CO -0.15 0.74 0.10 0.74 -3.12 0.00 0.00 179.24 177.54 1zkn h THR 141 N 1.20 1.23 -0.15 0.35 2.02 -1.65 -0.11 112.91 115.81 1zkn h THR 141 Ca 0.33 -0.82 -0.00 0.00 0.77 0.00 0.00 66.41 66.68 1zkn h THR 141 Cb -0.14 0.95 -0.01 0.00 -1.74 0.00 0.00 68.15 67.22 1zkn h THR 141 CO -0.07 0.29 0.08 0.25 0.37 0.00 0.00 175.52 176.44 1zkn h LEU 142 N 0.56 0.18 -0.49 2.58 5.85 -0.94 0.17 115.31 123.21 1zkn h LEU 142 Ca 0.13 -0.07 -0.03 0.00 0.84 0.00 0.00 57.88 58.76 1zkn h LEU 142 Cb 0.33 -0.05 -0.02 0.00 0.37 0.00 0.00 40.66 41.29 1zkn h LEU 142 CO 0.00 0.19 0.19 0.40 -0.34 0.00 0.00 178.44 178.88 1zkn h ILE 143 N 0.15 1.21 -0.23 4.05 2.04 -1.13 0.59 117.51 124.19 1zkn h ILE 143 Ca 0.05 -0.67 0.01 0.00 1.00 0.00 0.00 64.86 65.25 1zkn h ILE 143 Cb 0.05 0.74 -0.01 0.00 -0.74 0.00 0.00 36.82 36.86 1zkn h ILE 143 CO -0.01 0.25 0.14 0.74 0.00 0.00 0.00 178.15 179.27 1zkn h THR 144 N 0.65 1.03 -0.61 -0.27 2.02 -0.78 -1.16 112.91 113.78 1zkn h THR 144 Ca 0.16 -0.10 -0.06 0.00 0.77 0.00 0.00 66.41 67.19 1zkn h THR 144 Cb 0.21 0.72 -0.03 0.00 -1.74 0.00 0.00 68.15 67.32 1zkn h THR 144 CO -0.01 0.05 0.16 0.22 0.37 0.00 0.00 175.52 176.31 1zkn h TYR 145 N 0.28 1.02 -0.26 3.16 3.20 -0.78 -1.81 116.97 121.79 1zkn h TYR 145 Ca 0.09 -0.12 0.03 0.00 3.14 0.00 0.00 58.73 61.87 1zkn h TYR 145 Cb -0.01 -0.29 -0.03 0.00 1.54 0.00 0.00 36.73 37.95 1zkn h TYR 145 CO -0.08 0.85 0.09 -0.07 -1.64 0.00 0.00 178.16 177.32 1zkn h LEU 146 N 0.89 0.10 -0.93 2.82 3.38 -0.48 0.31 115.31 121.39 1zkn h LEU 146 Ca 0.19 0.03 -0.07 0.00 0.09 0.00 0.00 57.88 58.12 1zkn h LEU 146 Cb 0.34 0.02 -0.02 0.00 0.09 0.00 0.00 40.66 41.09 1zkn h LEU 146 CO 0.00 0.09 -0.00 0.24 0.09 0.00 0.00 178.44 178.86 1zkn h MET 147 N 0.20 0.78 -0.25 1.13 2.86 -1.16 0.90 114.93 119.39 1zkn h MET 147 Ca 0.11 -0.21 -0.05 0.00 -2.06 0.00 0.00 59.70 57.49 1zkn h MET 147 Cb 0.08 -0.09 -0.01 0.00 0.06 0.00 0.00 31.60 31.64 1zkn h MET 147 CO -0.12 0.79 -0.04 1.15 1.06 0.00 0.00 176.91 179.76 1zkn h THR 148 N 0.73 1.27 -0.27 2.22 2.02 -0.82 0.32 112.91 118.39 1zkn h THR 148 Ca 0.14 -1.00 -0.00 0.00 0.77 0.00 0.00 66.41 66.32 1zkn h THR 148 Cb 0.45 1.43 -0.01 0.00 -1.74 0.00 0.00 68.15 68.28 1zkn h THR 148 CO 0.02 0.31 0.16 0.25 0.37 0.00 0.00 175.52 176.63 1zkn h LEU 149 N 0.22 0.33 -0.98 2.58 5.85 -0.18 -2.56 115.31 120.57 1zkn h LEU 149 Ca 0.07 -0.07 -0.04 0.00 0.84 0.00 0.00 57.88 58.68 1zkn h LEU 149 Cb 0.48 -0.08 -0.03 0.00 0.37 0.00 0.00 40.66 41.40 1zkn h LEU 149 CO 0.02 0.30 0.26 -0.08 -0.34 0.00 0.00 178.44 178.60 1zkn h GLU 150 N 0.33 1.00 0.00 1.25 4.81 -0.67 -1.81 114.58 119.50 1zkn h GLU 150 Ca 0.10 -0.17 -0.00 0.00 -0.13 0.00 0.00 59.36 59.15 1zkn h GLU 150 Cb 0.04 -0.17 -0.00 0.00 0.63 0.00 0.00 28.75 29.25 1zkn h GLU 150 CO -0.02 0.82 -0.01 -0.44 -0.73 0.00 0.00 179.01 178.63 1zkn h ASP 151 N 0.98 0.00 -0.23 1.04 3.45 0.04 -2.16 116.42 119.54 1zkn h ASP 151 Ca 0.23 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.69 1zkn h ASP 151 Cb 0.20 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 38.97 1zkn h ASP 151 CO -0.02 0.01 0.00 1.41 -1.57 0.00 0.00 179.24 179.07 1zkn n HIS 152 N -3.19 0.29 -3.42 4.55 8.25 -0.68 -4.79 115.22 116.22 1zkn n HIS 152 Ca -0.02 -0.14 -0.35 0.00 -0.26 0.00 0.00 57.72 56.94 1zkn n HIS 152 Cb 0.12 0.00 -0.06 0.00 1.12 0.00 0.00 29.99 31.17 1zkn n HIS 152 CO 0.00 0.00 0.00 0.71 0.64 0.00 0.00 176.34 177.69 1zkn s TYR 153 N -1.71 3.59 -0.22 4.41 1.51 -0.81 -1.31 117.35 122.81 1zkn s TYR 153 Ca 0.33 0.98 -0.24 0.00 -1.01 0.00 0.00 57.07 57.13 1zkn s TYR 153 Cb 0.18 -2.30 -0.01 0.00 -0.11 0.00 0.00 41.96 39.71 1zkn s TYR 153 CO 0.27 0.45 0.78 -1.01 -1.11 0.00 0.00 175.55 174.92 1zkn s HIS 154 N -1.46 3.34 0.44 2.71 3.76 -1.26 -4.85 115.29 117.97 1zkn s HIS 154 Ca 0.37 1.10 0.25 0.00 -0.15 0.00 0.00 55.06 56.62 1zkn s HIS 154 Cb -0.14 -2.98 1.40 0.00 1.11 0.00 0.00 32.58 31.96 1zkn s HIS 154 CO 0.19 -0.32 2.07 0.00 -0.85 0.00 0.00 174.74 175.84 1zkn h ALA 155 N 7.59 1.39 -0.01 -1.40 0.00 -1.94 -2.33 119.26 122.56 1zkn h ALA 155 Ca -0.26 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.54 1zkn h ALA 155 Cb 1.11 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.88 1zkn h ALA 155 CO 0.84 0.15 -0.03 -0.40 0.00 0.00 0.00 179.25 179.80 1zkn n ASP 156 N -3.79 0.77 -4.57 0.00 5.75 -1.26 -4.76 116.55 108.69 1zkn n ASP 156 Ca -0.02 -1.12 -0.40 0.00 -0.01 0.00 0.00 54.79 53.24 1zkn n ASP 156 Cb 0.22 -0.01 -0.09 0.00 -1.03 0.00 0.00 41.12 40.22 1zkn n ASP 156 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 1zkn s VAL 157 N -2.12 5.11 0.27 2.12 1.01 -0.88 -4.98 120.40 120.94 1zkn s VAL 157 Ca 0.39 0.33 -0.02 0.00 0.00 0.00 0.00 61.98 62.68 1zkn s VAL 157 Cb 0.21 -3.83 0.27 0.00 0.00 0.00 0.00 36.38 33.03 1zkn s VAL 157 CO 0.38 -0.06 1.88 0.00 0.00 0.00 0.00 175.10 177.31 1zkn h ALA 158 N 8.36 1.42 0.00 5.51 0.00 -1.85 -3.39 119.26 129.31 1zkn h ALA 158 Ca -0.30 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.56 1zkn h ALA 158 Cb 1.14 -0.30 -0.00 0.00 0.00 0.00 0.00 17.79 18.63 1zkn h ALA 158 CO 0.71 0.42 -0.70 0.98 0.00 0.00 0.00 179.25 180.66 1zkn n TYR 159 N -4.51 0.00 -1.46 0.00 9.36 -1.26 -4.76 117.16 114.54 1zkn n TYR 159 Ca 0.16 0.00 -0.41 0.00 3.32 0.00 0.00 57.90 60.97 1zkn n TYR 159 Cb 0.20 -0.30 -0.02 0.00 -0.63 0.00 0.00 39.34 38.59 1zkn n TYR 159 CO 0.00 0.00 0.00 0.72 0.22 0.00 0.00 176.86 177.80 1zkn n HIS 160 N -3.96 2.81 -3.74 2.98 8.25 -1.26 -4.28 115.22 116.02 1zkn n HIS 160 Ca -0.10 -2.62 0.00 0.00 -0.26 0.00 0.00 57.72 54.74 1zkn n HIS 160 Cb 0.33 -2.27 0.00 0.00 1.12 0.00 0.00 29.99 29.17 1zkn n HIS 160 CO 0.00 0.00 0.00 0.27 0.64 0.00 0.00 176.34 177.25 1zkn n ASN 161 N 6.00 1.36 0.22 0.41 0.23 -1.26 -4.58 115.26 117.64 1zkn n ASN 161 Ca 0.54 -0.74 0.06 0.00 -0.53 0.00 0.00 54.58 53.91 1zkn n ASN 161 Cb 0.35 0.00 0.49 0.00 -2.08 0.00 0.00 39.78 38.55 1zkn n ASN 161 CO 0.00 0.00 0.00 -0.55 -0.93 0.00 0.00 177.26 175.78 1zkn h ASN 162 N 0.00 0.00 -0.37 0.53 -1.07 -1.88 -1.86 115.58 110.93 1zkn h ASN 162 Ca 0.00 0.00 -0.08 0.00 0.07 0.00 0.00 56.30 56.29 1zkn h ASN 162 Cb 0.00 0.00 -0.01 0.00 -2.07 0.00 0.00 38.32 36.24 1zkn h ASN 162 CO 0.00 0.25 -0.10 0.40 0.07 0.00 0.00 177.43 178.05 1zkn h ILE 163 N 0.00 1.28 -0.42 6.14 2.04 -1.97 0.14 117.51 124.72 1zkn h ILE 163 Ca -0.00 -1.18 -0.00 0.00 1.00 0.00 0.00 64.86 64.68 1zkn h ILE 163 Cb 0.47 1.28 -0.02 0.00 -0.74 0.00 0.00 36.82 37.81 1zkn h ILE 163 CO 0.03 0.39 0.25 -0.74 0.00 0.00 0.00 178.15 178.08 1zkn h HIS 164 N 0.51 0.56 -0.36 1.37 2.76 -1.66 -0.08 115.15 118.26 1zkn h HIS 164 Ca 0.09 -0.01 0.03 0.00 -2.20 0.00 0.00 60.37 58.29 1zkn h HIS 164 Cb 0.61 -0.18 -0.03 0.00 1.55 0.00 0.00 27.41 29.36 1zkn h HIS 164 CO 0.05 0.41 0.16 0.00 -1.30 0.00 0.00 177.93 177.25 1zkn h ALA 165 N 1.10 0.44 -0.96 5.26 0.00 -1.11 0.27 119.26 124.26 1zkn h ALA 165 Ca 0.15 0.02 0.01 0.00 0.00 0.00 0.00 54.91 55.09 1zkn h ALA 165 Cb 0.02 -0.03 -0.05 0.00 0.00 0.00 0.00 17.79 17.73 1zkn h ALA 165 CO -0.03 -0.22 0.63 0.00 0.00 0.00 0.00 179.25 179.64 1zkn h ALA 166 N 1.20 1.32 -0.37 0.00 0.00 -0.33 -0.92 119.26 120.16 1zkn h ALA 166 Ca 0.16 -0.07 -0.03 0.00 0.00 0.00 0.00 54.91 54.97 1zkn h ALA 166 Cb 0.09 -0.39 -0.02 0.00 0.00 0.00 0.00 17.79 17.48 1zkn h ALA 166 CO -0.13 0.63 0.11 0.22 0.00 0.00 0.00 179.25 180.08 1zkn h ASP 167 N 1.30 0.55 -0.20 0.00 3.58 -0.10 -0.80 116.42 120.74 1zkn h ASP 167 Ca 0.35 -0.22 -0.07 0.00 0.42 0.00 0.00 57.03 57.51 1zkn h ASP 167 Cb -0.15 -0.14 -0.02 0.00 1.72 0.00 0.00 39.33 40.74 1zkn h ASP 167 CO -0.08 0.62 -0.09 0.58 -2.88 0.00 0.00 179.24 177.39 1zkn h VAL 168 N 0.45 1.23 0.36 2.25 2.07 -0.61 0.77 116.25 122.77 1zkn h VAL 168 Ca 0.12 -1.00 -0.02 0.00 0.82 0.00 0.00 66.70 66.62 1zkn h VAL 168 Cb 0.27 1.08 0.00 0.00 -1.52 0.00 0.00 31.29 31.13 1zkn h VAL 168 CO -0.00 0.33 -0.17 0.58 0.02 0.00 0.00 177.57 178.33 1zkn h VAL 169 N 0.52 0.65 -0.18 2.57 2.07 -0.85 -0.58 116.25 120.45 1zkn h VAL 169 Ca 0.10 -0.34 -0.06 0.00 0.82 0.00 0.00 66.70 67.22 1zkn h VAL 169 Cb 0.47 0.82 -0.01 0.00 -1.52 0.00 0.00 31.29 31.05 1zkn h VAL 169 CO 0.03 0.07 -0.15 -0.61 0.02 0.00 0.00 177.57 176.93 1zkn h GLN 170 N -0.67 0.30 -0.26 1.57 -0.00 -0.99 0.39 115.11 115.45 1zkn h GLN 170 Ca -0.05 -0.08 -0.11 0.00 -0.00 0.00 0.00 58.65 58.41 1zkn h GLN 170 Cb 0.48 -0.04 -0.00 0.00 0.00 0.00 0.00 27.48 27.92 1zkn h GLN 170 CO 0.08 0.45 -0.28 0.77 0.00 0.00 0.00 178.83 179.85 1zkn h SER 171 N 0.28 0.70 -0.64 -0.69 0.02 -0.78 -1.05 113.55 111.39 1zkn h SER 171 Ca 0.05 -0.48 -0.04 0.00 -0.84 0.00 0.00 61.79 60.49 1zkn h SER 171 Cb 0.43 -0.20 -0.03 0.00 0.14 0.00 0.00 62.40 62.75 1zkn h SER 171 CO 0.03 1.04 0.26 0.74 -1.14 0.00 0.00 176.83 177.76 1zkn h THR 172 N 0.37 1.24 -0.81 -2.27 2.02 -0.76 -0.46 112.91 112.24 1zkn h THR 172 Ca 0.04 -0.73 0.09 0.00 0.77 0.00 0.00 66.41 66.58 1zkn h THR 172 Cb 0.85 0.51 -0.07 0.00 -1.74 0.00 0.00 68.15 67.70 1zkn h THR 172 CO 0.07 0.29 0.46 -0.74 0.37 0.00 0.00 175.52 175.97 1zkn h HIS 173 N 0.90 0.83 -0.33 3.16 6.17 -0.69 0.91 115.15 126.10 1zkn h HIS 173 Ca 0.22 0.03 -0.16 0.00 0.71 0.00 0.00 60.37 61.17 1zkn h HIS 173 Cb 0.20 -0.25 -0.00 0.00 2.52 0.00 0.00 27.41 29.88 1zkn h HIS 173 CO 0.01 0.34 -0.42 0.28 0.71 0.00 0.00 177.93 178.85 1zkn h VAL 174 N 0.77 1.28 -0.21 5.26 2.07 -0.67 -3.12 116.25 121.63 1zkn h VAL 174 Ca 0.39 -1.60 -0.05 0.00 0.82 0.00 0.00 66.70 66.27 1zkn h VAL 174 Cb 0.35 1.52 -0.01 0.00 -1.52 0.00 0.00 31.29 31.63 1zkn h VAL 174 CO -0.24 0.52 -0.08 -0.07 0.02 0.00 0.00 177.57 177.72 1zkn h LEU 175 N 0.65 0.30 -1.22 2.57 3.38 -0.19 -2.63 115.31 118.17 1zkn h LEU 175 Ca 0.04 -0.06 -0.08 0.00 0.09 0.00 0.00 57.88 57.88 1zkn h LEU 175 Cb 1.01 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.67 1zkn h LEU 175 CO 0.10 0.42 -0.31 -0.07 0.09 0.00 0.00 178.44 178.67 1zkn h LEU 176 N 0.31 0.12 -0.56 1.67 3.38 -0.79 -2.81 115.31 116.63 1zkn h LEU 176 Ca 0.07 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.00 1zkn h LEU 176 Cb 0.34 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.05 1zkn h LEU 176 CO 0.02 0.44 0.00 -1.20 0.09 0.00 0.00 178.44 177.78 1zkn n SER 177 N -4.13 0.84 -4.76 -0.43 7.64 -0.99 -4.74 113.62 107.04 1zkn n SER 177 Ca -0.02 -1.64 -0.40 0.00 1.01 0.00 0.00 58.87 57.83 1zkn n SER 177 Cb 0.38 -0.06 0.01 0.00 -1.01 0.00 0.00 64.21 63.54 1zkn n SER 177 CO 0.00 0.00 0.00 1.07 -3.01 0.00 0.00 175.04 173.10 1zkn n THR 178 N -0.20 2.60 -0.26 0.44 5.66 -1.06 -4.87 114.28 116.58 1zkn n THR 178 Ca 0.13 -0.50 0.04 0.00 -3.05 0.00 0.00 64.05 60.67 1zkn n THR 178 Cb 0.19 -1.86 0.17 0.00 -1.55 0.00 0.00 70.33 67.28 1zkn n THR 178 CO 0.00 0.00 0.00 -0.65 -3.05 0.00 0.00 175.07 171.37 1zkn h PRO 179 N 2.43 0.57 0.00 1.09 0.11 -1.92 -1.32 132.00 132.97 1zkn h PRO 179 Ca -0.51 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.57 1zkn h PRO 179 Cb 1.26 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 32.24 1zkn h PRO 179 CO 0.62 0.38 0.00 0.00 -0.21 0.00 0.00 178.00 178.79 1zkn n ALA 180 N -2.43 1.22 -0.53 -0.75 0.00 -1.26 -1.30 120.51 115.46 1zkn n ALA 180 Ca 0.13 0.16 0.06 0.00 0.00 0.00 0.00 53.44 53.80 1zkn n ALA 180 Cb 0.34 -1.33 0.16 0.00 0.00 0.00 0.00 19.45 18.62 1zkn n ALA 180 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1zkn n LEU 181 N -2.24 3.03 -4.68 0.00 4.77 -0.51 -2.09 117.00 115.28 1zkn n LEU 181 Ca -0.00 -2.47 -0.46 0.00 -0.03 0.00 0.00 56.01 53.04 1zkn n LEU 181 Cb 0.09 -0.32 -0.04 0.00 -2.33 0.00 0.00 43.42 40.81 1zkn n LEU 181 CO 0.12 0.67 1.29 1.21 -1.33 0.00 0.00 177.39 179.36 1zkn n GLU 182 N -0.22 2.26 -2.02 3.23 2.13 -0.42 -1.79 120.64 123.81 1zkn n GLU 182 Ca 0.14 0.82 -0.15 0.00 0.66 0.00 0.00 57.16 58.62 1zkn n GLU 182 Cb 0.58 -2.62 -0.03 0.00 0.27 0.00 0.00 31.44 29.64 1zkn n GLU 182 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1zkn n ALA 183 N 4.32 -0.52 -0.03 4.31 0.00 -1.26 -4.87 120.51 122.47 1zkn n ALA 183 Ca 0.18 0.18 -0.20 0.00 0.00 0.00 0.00 53.44 53.60 1zkn n ALA 183 Cb 0.30 -1.69 -0.13 0.00 0.00 0.00 0.00 19.45 17.93 1zkn n ALA 183 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1zkn h VAL 184 N 0.00 1.16 -2.86 0.00 2.07 -1.72 -3.48 116.25 111.42 1zkn h VAL 184 Ca -0.35 -2.34 -0.56 0.00 0.82 0.00 0.00 66.70 64.27 1zkn h VAL 184 Cb 1.16 2.73 -0.03 0.00 -1.52 0.00 0.00 31.29 33.63 1zkn h VAL 184 CO 0.45 0.59 -0.39 -0.36 0.02 0.00 0.00 177.57 177.87 1zkn s PHE 185 N -2.40 3.49 0.75 1.57 0.08 -1.26 -5.03 117.98 115.18 1zkn s PHE 185 Ca -0.22 0.32 -0.09 0.00 0.12 0.00 0.00 56.93 57.06 1zkn s PHE 185 Cb 0.03 -1.82 0.07 0.00 -0.57 0.00 0.00 43.02 40.73 1zkn s PHE 185 CO 0.71 0.46 1.09 0.95 -0.10 0.00 0.00 175.22 178.33 1zkn s THR 186 N -1.73 2.22 0.36 0.64 -4.23 -1.26 -4.87 115.64 106.76 1zkn s THR 186 Ca 0.37 -0.12 0.03 0.00 -1.18 0.00 0.00 61.69 60.80 1zkn s THR 186 Cb -0.12 -3.02 0.24 0.00 1.34 0.00 0.00 72.50 70.94 1zkn s THR 186 CO 0.28 -0.03 1.99 0.44 -0.54 0.00 0.00 174.62 176.76 1zkn h ASP 187 N -0.80 0.64 -0.47 3.99 3.32 -1.99 -0.73 116.42 120.37 1zkn h ASP 187 Ca -0.45 -0.04 -0.14 0.00 0.02 0.00 0.00 57.03 56.42 1zkn h ASP 187 Cb 1.32 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 40.70 1zkn h ASP 187 CO 0.63 0.50 -0.25 0.25 -1.72 0.00 0.00 179.24 178.66 1zkn h LEU 188 N 0.73 1.03 -0.54 1.55 5.85 -1.98 0.25 115.31 122.19 1zkn h LEU 188 Ca 0.19 -0.41 -0.13 0.00 0.84 0.00 0.00 57.88 58.38 1zkn h LEU 188 Cb -0.00 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 40.73 1zkn h LEU 188 CO -0.03 1.21 -0.22 -0.33 -0.34 0.00 0.00 178.44 178.73 1zkn h GLU 189 N 0.85 0.95 -0.30 1.25 5.08 -1.80 0.16 114.58 120.77 1zkn h GLU 189 Ca 0.10 -0.40 -0.02 0.00 -1.00 0.00 0.00 59.36 58.05 1zkn h GLU 189 Cb 0.83 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 30.03 1zkn h GLU 189 CO 0.07 1.06 0.12 0.82 -1.00 0.00 0.00 179.01 180.09 1zkn h ILE 190 N 0.82 1.18 -0.42 3.13 2.04 -0.93 -0.70 117.51 122.62 1zkn h ILE 190 Ca 0.11 -0.54 0.04 0.00 1.00 0.00 0.00 64.86 65.47 1zkn h ILE 190 Cb 0.78 0.97 -0.04 0.00 -0.74 0.00 0.00 36.82 37.79 1zkn h ILE 190 CO 0.06 0.19 0.19 0.25 0.00 0.00 0.00 178.15 178.84 1zkn h LEU 191 N 0.34 0.25 -0.45 1.44 5.85 -0.25 -2.01 115.31 120.48 1zkn h LEU 191 Ca 0.10 0.03 -0.00 0.00 0.84 0.00 0.00 57.88 58.85 1zkn h LEU 191 Cb 0.18 -0.01 -0.02 0.00 0.37 0.00 0.00 40.66 41.17 1zkn h LEU 191 CO -0.01 0.18 0.27 0.00 -0.34 0.00 0.00 178.44 178.55 1zkn h ALA 192 N 1.24 0.58 -0.73 1.25 0.00 -0.66 0.65 119.26 121.58 1zkn h ALA 192 Ca 0.19 -0.06 -0.04 0.00 0.00 0.00 0.00 54.91 55.00 1zkn h ALA 192 Cb 0.13 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.70 1zkn h ALA 192 CO -0.15 0.06 0.30 0.00 0.00 0.00 0.00 179.25 179.46 1zkn h ALA 193 N 1.13 1.15 -0.08 0.00 0.00 -0.84 0.15 119.26 120.77 1zkn h ALA 193 Ca 0.16 -0.18 -0.08 0.00 0.00 0.00 0.00 54.91 54.81 1zkn h ALA 193 Cb -0.01 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 17.50 1zkn h ALA 193 CO -0.03 0.62 -0.28 0.82 0.00 0.00 0.00 179.25 180.37 1zkn h ILE 194 N 1.06 1.42 -0.45 0.00 2.04 -1.11 -2.04 117.51 118.44 1zkn h ILE 194 Ca 0.25 -1.66 -0.02 0.00 1.00 0.00 0.00 64.86 64.42 1zkn h ILE 194 Cb 0.19 2.28 -0.02 0.00 -0.74 0.00 0.00 36.82 38.52 1zkn h ILE 194 CO -0.02 0.48 0.19 0.15 0.00 0.00 0.00 178.15 178.94 1zkn h PHE 195 N -0.16 0.67 -0.90 1.37 3.57 -0.81 -1.24 116.94 119.44 1zkn h PHE 195 Ca -0.01 -0.04 0.06 0.00 3.53 0.00 0.00 57.97 61.50 1zkn h PHE 195 Cb 0.92 -0.20 -0.06 0.00 2.79 0.00 0.00 35.95 39.39 1zkn h PHE 195 CO 0.12 0.56 0.57 0.00 -2.23 0.00 0.00 178.31 177.33 1zkn h ALA 196 N 1.04 1.24 -0.67 2.41 0.00 -1.00 -1.77 119.26 120.50 1zkn h ALA 196 Ca 0.15 -0.01 -0.05 0.00 0.00 0.00 0.00 54.91 55.00 1zkn h ALA 196 Cb 0.17 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.67 1zkn h ALA 196 CO -0.01 0.33 0.22 0.77 0.00 0.00 0.00 179.25 180.56 1zkn h SER 197 N 1.03 0.97 -0.44 0.00 0.02 -0.78 0.02 113.55 114.38 1zkn h SER 197 Ca 0.39 -0.20 -0.07 0.00 -0.84 0.00 0.00 61.79 61.07 1zkn h SER 197 Cb 0.16 -0.25 -0.02 0.00 0.14 0.00 0.00 62.40 62.43 1zkn h SER 197 CO -0.17 0.91 0.03 0.00 -1.14 0.00 0.00 176.83 176.47 1zkn h ALA 198 N 1.10 1.10 -0.01 3.77 0.00 -0.43 -3.16 119.26 121.62 1zkn h ALA 198 Ca 0.22 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1zkn h ALA 198 Cb 0.28 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 17.87 1zkn h ALA 198 CO -0.01 0.58 -0.52 0.44 0.00 0.00 0.00 179.25 179.74 1zkn n ILE 199 N -4.22 0.00 0.11 0.00 -5.35 -0.76 -4.68 119.36 104.46 1zkn n ILE 199 Ca 0.03 -0.24 0.19 0.00 -0.27 0.00 0.00 62.75 62.46 1zkn n ILE 199 Cb 0.29 1.23 0.65 0.00 -1.74 0.00 0.00 39.64 40.07 1zkn n ILE 199 CO 0.00 0.00 0.00 1.12 -1.76 0.00 0.00 176.55 175.91 1zkn h HIS 200 N 2.24 0.00 0.00 4.28 2.07 -0.94 -2.14 115.15 120.65 1zkn h HIS 200 Ca 0.00 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.52 1zkn h HIS 200 Cb 0.74 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.72 1zkn h HIS 200 CO 0.00 0.00 -0.20 -0.25 -3.07 0.00 0.00 177.93 174.41 1zkn n ASP 201 N -3.34 1.05 -4.74 3.10 8.00 -1.26 -4.85 116.55 114.50 1zkn n ASP 201 Ca 0.07 -2.25 -0.42 0.00 0.71 0.00 0.00 54.79 52.91 1zkn n ASP 201 Cb 0.75 -0.23 -0.01 0.00 -0.02 0.00 0.00 41.12 41.61 1zkn n ASP 201 CO 0.00 0.00 0.00 0.55 -0.39 0.00 0.00 177.20 177.36 1zkn n VAL 202 N -0.56 1.23 -2.29 2.53 3.14 -0.81 -2.08 118.33 119.50 1zkn n VAL 202 Ca 0.06 -0.31 -0.14 0.00 -2.96 0.00 0.00 64.34 60.99 1zkn n VAL 202 Cb 0.60 -1.92 -0.00 0.00 -1.06 0.00 0.00 33.84 31.45 1zkn n VAL 202 CO 0.00 0.00 0.00 -0.67 -6.46 0.00 0.00 176.83 169.70 1zkn n ASP 203 N 1.81 -4.22 -4.70 6.55 2.03 -0.43 -4.39 116.55 113.21 1zkn n ASP 203 Ca 0.07 -0.02 -0.42 0.00 0.52 0.00 0.00 54.79 54.94 1zkn n ASP 203 Cb 0.37 -3.38 -0.03 0.00 -0.72 0.00 0.00 41.12 37.36 1zkn n ASP 203 CO 0.00 0.00 0.00 -2.28 -1.92 0.00 0.00 177.20 173.00 1zkn s HIS 204 N -2.69 2.93 -1.27 -0.67 2.46 -0.88 -4.91 115.29 110.25 1zkn s HIS 204 Ca 0.01 0.82 0.29 0.00 0.47 0.00 0.00 55.06 56.65 1zkn s HIS 204 Cb -0.01 -3.69 1.40 0.00 -0.13 0.00 0.00 32.58 30.16 1zkn s HIS 204 CO 0.01 -2.53 1.99 -0.35 -2.47 0.00 0.00 174.74 171.40 1zkn n PRO 205 N 5.00 0.27 -0.32 2.88 -0.04 -1.26 -4.54 135.00 136.98 1zkn n PRO 205 Ca 0.13 0.01 0.00 0.00 -0.04 0.00 0.00 63.50 63.59 1zkn n PRO 205 Cb 0.43 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.39 1zkn n PRO 205 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1zkn n GLY 206 N 1.32 0.72 3.25 0.55 0.00 -1.26 -4.98 105.19 104.79 1zkn n GLY 206 Ca 0.11 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.94 1zkn n GLY 206 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1zkn s VAL 207 N -2.44 1.41 0.84 1.61 -7.23 -1.26 -4.73 120.40 108.61 1zkn s VAL 207 Ca 0.00 -1.65 -0.11 0.00 -1.81 0.00 0.00 61.98 58.41 1zkn s VAL 207 Cb 0.00 -1.50 0.09 0.00 0.56 0.00 0.00 36.38 35.53 1zkn s VAL 207 CO 0.00 -0.32 1.10 -0.94 -0.31 0.00 0.00 175.10 174.63 1zkn s SER 208 N -2.28 4.08 0.21 4.85 1.04 -1.26 -4.89 113.70 115.44 1zkn s SER 208 Ca 0.08 1.37 -0.10 0.00 0.48 0.00 0.00 55.95 57.78 1zkn s SER 208 Cb -0.07 -2.08 0.25 0.00 0.10 0.00 0.00 66.02 64.23 1zkn s SER 208 CO 0.04 -2.24 1.77 0.78 0.98 0.00 0.00 173.24 174.57 1zkn h ASN 209 N -1.27 0.36 -0.61 7.02 2.35 -2.01 -1.93 115.58 119.49 1zkn h ASN 209 Ca -0.48 0.06 0.03 0.00 -0.55 0.00 0.00 56.30 55.36 1zkn h ASN 209 Cb 1.28 -0.00 -0.03 0.00 0.05 0.00 0.00 38.32 39.61 1zkn h ASN 209 CO 0.57 0.22 0.40 -0.61 -1.65 0.00 0.00 177.43 176.37 1zkn h GLN 210 N 0.51 0.70 -0.35 0.81 5.75 -1.97 0.25 115.11 120.81 1zkn h GLN 210 Ca 0.30 -0.04 -0.15 0.00 -0.15 0.00 0.00 58.65 58.61 1zkn h GLN 210 Cb 0.29 -0.16 -0.01 0.00 1.07 0.00 0.00 27.48 28.68 1zkn h GLN 210 CO -0.25 0.46 -0.37 0.35 -2.65 0.00 0.00 178.83 176.38 1zkn h PHE 211 N 0.72 0.98 -0.31 3.99 3.04 -1.74 0.22 116.94 123.84 1zkn h PHE 211 Ca 0.24 -0.28 -0.12 0.00 3.98 0.00 0.00 57.97 61.79 1zkn h PHE 211 Cb 0.07 -0.21 -0.01 0.00 2.56 0.00 0.00 35.95 38.36 1zkn h PHE 211 CO -0.00 1.06 -0.30 -0.07 -2.02 0.00 0.00 178.31 176.99 1zkn h LEU 212 N 0.68 0.66 -0.18 0.59 3.38 -0.54 -1.92 115.31 117.98 1zkn h LEU 212 Ca 0.06 -0.26 -0.10 0.00 0.09 0.00 0.00 57.88 57.67 1zkn h LEU 212 Cb 0.93 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 41.50 1zkn h LEU 212 CO 0.09 0.92 -0.29 0.40 0.09 0.00 0.00 178.44 179.64 1zkn h ILE 213 N 0.55 1.34 0.00 1.22 2.04 -0.34 -1.93 117.51 120.40 1zkn h ILE 213 Ca 0.07 -1.52 -0.05 0.00 1.00 0.00 0.00 64.86 64.36 1zkn h ILE 213 Cb 0.78 1.88 -0.01 0.00 -0.74 0.00 0.00 36.82 38.74 1zkn h ILE 213 CO 0.06 0.46 -0.26 0.78 0.00 0.00 0.00 178.15 179.20 1zkn h ASN 214 N 0.17 0.00 -0.13 1.72 2.35 -0.47 -2.37 115.58 116.85 1zkn h ASN 214 Ca 0.01 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.76 1zkn h ASN 214 Cb 0.88 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.25 1zkn h ASN 214 CO 0.07 0.26 0.00 0.35 -1.65 0.00 0.00 177.43 176.45 1zkn n THR 215 N -3.65 0.16 -3.81 2.81 -2.24 -0.73 -4.94 114.28 101.88 1zkn n THR 215 Ca -0.01 -0.38 -0.27 0.00 -2.27 0.00 0.00 64.05 61.12 1zkn n THR 215 Cb 0.38 0.60 0.04 0.00 -2.10 0.00 0.00 70.33 69.24 1zkn n THR 215 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 1zkn n ASN 216 N 0.52 -4.16 -4.70 3.42 3.02 -0.89 -4.94 115.26 107.53 1zkn n ASN 216 Ca 0.17 -0.75 -0.33 0.00 -0.03 0.00 0.00 54.58 53.64 1zkn n ASN 216 Cb 0.40 -4.12 0.12 0.00 -0.61 0.00 0.00 39.78 35.57 1zkn n ASN 216 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 1zkn s SER 217 N -3.57 3.65 0.47 6.41 1.04 -0.74 -4.85 113.70 116.11 1zkn s SER 217 Ca 0.49 2.30 0.24 0.00 0.48 0.00 0.00 55.95 59.46 1zkn s SER 217 Cb -0.24 -2.58 1.12 0.00 0.10 0.00 0.00 66.02 64.42 1zkn s SER 217 CO 0.81 -2.62 1.92 1.05 0.98 0.00 0.00 173.24 175.38 1zkn h GLU 218 N -0.96 0.00 -0.36 4.02 4.11 -1.92 -2.38 114.58 117.09 1zkn h GLU 218 Ca -0.46 0.00 -0.01 0.00 0.07 0.00 0.00 59.36 58.96 1zkn h GLU 218 Cb 1.29 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.52 1zkn h GLU 218 CO 0.46 0.20 0.18 1.25 0.07 0.00 0.00 179.01 181.18 1zkn h LEU 219 N 0.00 0.47 -1.09 3.06 5.85 -1.93 0.33 115.31 122.01 1zkn h LEU 219 Ca -0.00 -0.12 -0.08 0.00 0.84 0.00 0.00 57.88 58.52 1zkn h LEU 219 Cb 0.58 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 41.48 1zkn h LEU 219 CO 0.03 0.46 -0.24 0.00 -0.34 0.00 0.00 178.44 178.34 1zkn h ALA 220 N 1.03 1.24 -0.12 1.25 0.00 -1.73 -1.92 119.26 119.01 1zkn h ALA 220 Ca 0.13 -0.31 -0.02 0.00 0.00 0.00 0.00 54.91 54.70 1zkn h ALA 220 Cb 0.10 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 17.78 1zkn h ALA 220 CO -0.02 0.50 -0.02 1.25 0.00 0.00 0.00 179.25 180.97 1zkn h LEU 221 N 0.32 0.22 -0.72 0.00 5.85 -0.97 -0.66 115.31 119.35 1zkn h LEU 221 Ca 0.05 -0.34 0.02 0.00 0.84 0.00 0.00 57.88 58.45 1zkn h LEU 221 Cb 0.60 -0.06 -0.04 0.00 0.37 0.00 0.00 40.66 41.53 1zkn h LEU 221 CO 0.04 0.51 0.46 -0.03 -0.34 0.00 0.00 178.44 179.08 1zkn h MET 222 N -0.07 0.88 -0.63 1.25 4.05 -0.75 -2.85 114.93 116.80 1zkn h MET 222 Ca 0.03 -0.05 0.00 0.00 -0.28 0.00 0.00 59.70 59.40 1zkn h MET 222 Cb 0.41 -0.20 0.00 0.00 -0.80 0.00 0.00 31.60 31.01 1zkn h MET 222 CO 0.01 0.58 0.00 0.66 0.23 0.00 0.00 176.91 178.39 1zkn n TYR 223 N -4.64 1.76 -4.07 1.39 4.01 -0.74 -4.96 117.16 109.92 1zkn n TYR 223 Ca 0.07 -0.64 -0.30 0.00 -0.16 0.00 0.00 57.90 56.87 1zkn n TYR 223 Cb 0.07 -0.38 -0.02 0.00 -0.31 0.00 0.00 39.34 38.70 1zkn n TYR 223 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 1zkn n ASN 224 N 0.84 -1.95 -0.66 7.72 3.02 -0.52 -1.70 115.26 122.02 1zkn n ASN 224 Ca 0.26 -0.99 -0.07 0.00 -0.03 0.00 0.00 54.58 53.75 1zkn n ASN 224 Cb 1.03 -2.99 -0.03 0.00 -0.61 0.00 0.00 39.78 37.18 1zkn n ASN 224 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 1zkn n ASP 225 N -2.84 -4.30 -4.33 6.41 8.00 -0.37 -4.94 116.55 114.19 1zkn n ASP 225 Ca -0.12 0.18 -0.36 0.00 0.71 0.00 0.00 54.79 55.20 1zkn n ASP 225 Cb 0.59 -3.19 -0.13 0.00 -0.02 0.00 0.00 41.12 38.36 1zkn n ASP 225 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 1zkn s SER 226 N -1.87 4.64 -1.63 -2.24 0.01 -0.69 -4.61 113.70 107.31 1zkn s SER 226 Ca 0.00 -0.50 -0.09 0.00 1.31 0.00 0.00 55.95 56.67 1zkn s SER 226 Cb 0.00 -1.79 0.08 0.00 0.21 0.00 0.00 66.02 64.52 1zkn s SER 226 CO 0.00 -0.08 0.35 -1.20 0.41 0.00 0.00 173.24 172.72 1zkn n SER 227 N 4.82 -0.63 -0.08 2.44 7.64 -1.26 -4.80 113.62 121.75 1zkn n SER 227 Ca -0.17 -1.18 -0.12 0.00 1.01 0.00 0.00 58.87 58.41 1zkn n SER 227 Cb 0.50 -2.04 -0.07 0.00 -1.01 0.00 0.00 64.21 61.58 1zkn n SER 227 CO 0.00 0.00 0.00 0.58 -3.01 0.00 0.00 175.04 172.61 1zkn h VAL 228 N -1.52 0.08 -0.55 0.44 2.07 -1.86 0.47 116.25 115.37 1zkn h VAL 228 Ca -0.63 0.00 -0.08 0.00 0.82 0.00 0.00 66.70 66.81 1zkn h VAL 228 Cb 1.39 0.08 -0.02 0.00 -1.52 0.00 0.00 31.29 31.22 1zkn h VAL 228 CO 0.75 0.00 0.02 -0.07 0.02 0.00 0.00 177.57 178.29 1zkn h LEU 229 N -0.42 0.94 -0.77 2.57 3.38 -1.95 -2.00 115.31 117.05 1zkn h LEU 229 Ca 0.09 -0.30 -0.05 0.00 0.09 0.00 0.00 57.88 57.72 1zkn h LEU 229 Cb 0.62 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 41.08 1zkn h LEU 229 CO -0.52 1.00 0.30 -0.33 0.09 0.00 0.00 178.44 178.98 1zkn h GLU 230 N 0.84 1.17 -0.60 1.13 3.07 -1.83 0.16 114.58 118.51 1zkn h GLU 230 Ca 0.16 -0.22 -0.08 0.00 -0.50 0.00 0.00 59.36 58.72 1zkn h GLU 230 Cb 0.51 -0.19 -0.02 0.00 -0.84 0.00 0.00 28.75 28.21 1zkn h GLU 230 CO 0.02 0.96 0.08 -0.91 -1.40 0.00 0.00 179.01 177.76 1zkn h ASN 231 N 1.13 0.97 -0.50 1.42 2.35 -0.81 -2.65 115.58 117.49 1zkn h ASN 231 Ca 0.26 -0.27 -0.07 0.00 -0.55 0.00 0.00 56.30 55.66 1zkn h ASN 231 Cb 0.23 -0.26 -0.02 0.00 0.05 0.00 0.00 38.32 38.33 1zkn h ASN 231 CO -0.02 1.00 0.03 -0.74 -1.65 0.00 0.00 177.43 176.05 1zkn h HIS 232 N 0.91 0.94 -0.33 1.19 2.76 -0.81 -1.38 115.15 118.43 1zkn h HIS 232 Ca 0.18 -0.15 0.02 0.00 -2.20 0.00 0.00 60.37 58.22 1zkn h HIS 232 Cb 0.45 -0.25 -0.03 0.00 1.55 0.00 0.00 27.41 29.13 1zkn h HIS 232 CO 0.03 0.87 0.16 0.45 -1.30 0.00 0.00 177.93 178.14 1zkn h HIS 233 N 0.73 0.29 0.10 5.26 3.86 -0.59 -0.37 115.15 124.44 1zkn h HIS 233 Ca 0.15 0.01 0.00 0.00 -1.16 0.00 0.00 60.37 59.37 1zkn h HIS 233 Cb 0.48 -0.08 -0.01 0.00 1.06 0.00 0.00 27.41 28.86 1zkn h HIS 233 CO 0.04 0.15 -0.08 -0.07 0.86 0.00 0.00 177.93 178.83 1zkn h LEU 234 N 0.33 -0.20 -0.76 2.43 3.38 -1.34 0.13 115.31 119.28 1zkn h LEU 234 Ca 0.14 0.02 0.05 0.00 0.09 0.00 0.00 57.88 58.18 1zkn h LEU 234 Cb 0.06 0.07 -0.06 0.00 0.09 0.00 0.00 40.66 40.82 1zkn h LEU 234 CO -0.10 -0.13 0.46 0.00 0.09 0.00 0.00 178.44 178.76 1zkn h ALA 235 N 0.70 1.02 -0.26 1.53 0.00 -0.97 -1.12 119.26 120.16 1zkn h ALA 235 Ca -0.00 -0.00 -0.07 0.00 0.00 0.00 0.00 54.91 54.83 1zkn h ALA 235 Cb 0.17 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 1zkn h ALA 235 CO -0.01 0.18 -0.12 0.28 0.00 0.00 0.00 179.25 179.59 1zkn h VAL 236 N 0.84 1.30 -0.72 0.00 2.07 -0.85 -0.03 116.25 118.86 1zkn h VAL 236 Ca 0.33 -1.19 0.11 0.00 0.82 0.00 0.00 66.70 66.77 1zkn h VAL 236 Cb 0.14 1.52 -0.08 0.00 -1.52 0.00 0.00 31.29 31.36 1zkn h VAL 236 CO -0.16 0.37 0.33 1.23 0.02 0.00 0.00 177.57 179.36 1zkn h GLY 237 N 0.27 1.07 1.28 2.17 0.00 -0.12 -1.54 103.07 106.20 1zkn h GLY 237 Ca 0.06 -0.19 -0.29 0.00 0.00 0.00 0.00 47.33 46.91 1zkn h GLY 237 CO 0.04 -0.00 -1.23 0.74 0.00 0.00 0.00 176.54 176.09 1zkn h PHE 238 N 0.53 0.97 -0.62 5.60 0.04 -1.19 -3.32 116.94 118.95 1zkn h PHE 238 Ca 0.37 -0.61 0.03 0.00 2.80 0.00 0.00 57.97 60.55 1zkn h PHE 238 Cb 0.46 -0.08 -0.03 0.00 2.20 0.00 0.00 35.95 38.49 1zkn h PHE 238 CO -0.13 1.45 0.41 -0.22 -0.60 0.00 0.00 178.31 179.22 1zkn h LYS 239 N 0.27 0.74 0.00 1.51 1.63 -0.55 -2.15 116.57 118.02 1zkn h LYS 239 Ca -0.18 -0.04 0.00 0.00 -0.85 0.00 0.00 60.65 59.58 1zkn h LYS 239 Cb 1.90 -0.17 0.00 0.00 -0.60 0.00 0.00 32.23 33.36 1zkn h LYS 239 CO 0.23 0.49 0.00 -0.07 -3.45 0.00 0.00 179.45 176.65 1zkn h LEU 240 N 0.76 0.00 -1.50 5.20 3.38 -1.39 -1.62 115.31 120.15 1zkn h LEU 240 Ca 0.24 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.21 1zkn h LEU 240 Cb 0.03 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.78 1zkn h LEU 240 CO -0.06 0.00 0.00 -0.07 0.09 0.00 0.00 178.44 178.40 1zkn h LEU 241 N 0.00 0.00 -0.23 1.67 3.38 -1.55 -2.41 115.31 116.16 1zkn h LEU 241 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1zkn h LEU 241 Cb 0.20 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.95 1zkn h LEU 241 CO 0.00 0.00 -0.18 0.00 0.09 0.00 0.00 178.44 178.35 1zkn n GLN 242 N -2.68 0.56 -1.66 1.13 6.02 -0.61 -2.02 117.38 118.12 1zkn n GLN 242 Ca 0.00 -0.23 -0.30 0.00 -0.01 0.00 0.00 57.00 56.46 1zkn n GLN 242 Cb 0.19 -1.50 0.08 0.00 1.02 0.00 0.00 30.24 30.04 1zkn n GLN 242 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 177.06 174.84 1zkn s GLU 243 N -2.60 2.32 -0.32 -1.09 2.02 -0.91 -4.90 118.70 113.23 1zkn s GLU 243 Ca 0.24 0.57 -0.41 0.00 0.02 0.00 0.00 54.97 55.39 1zkn s GLU 243 Cb 0.19 -1.95 -0.16 0.00 0.10 0.00 0.00 34.13 32.31 1zkn s GLU 243 CO 0.52 -1.44 1.74 -1.91 0.02 0.00 0.00 175.26 174.18 1zkn n GLU 244 N -3.30 0.99 -3.82 1.61 4.07 -1.26 -1.65 120.64 117.28 1zkn n GLU 244 Ca 0.07 0.36 -0.28 0.00 -0.06 0.00 0.00 57.16 57.26 1zkn n GLU 244 Cb 0.57 -2.03 0.04 0.00 -0.06 0.00 0.00 31.44 29.96 1zkn n GLU 244 CO 0.00 0.00 0.00 -1.71 -0.06 0.00 0.00 177.13 175.36 1zkn n ASN 245 N 5.29 -4.45 -0.11 4.31 4.05 -1.26 -4.91 115.26 118.18 1zkn n ASN 245 Ca 0.28 -0.74 0.02 0.00 0.45 0.00 0.00 54.58 54.58 1zkn n ASN 245 Cb 0.10 -4.12 0.00 0.00 1.23 0.00 0.00 39.78 36.99 1zkn n ASN 245 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1zkn s ASP 247 N -0.71 6.59 0.21 0.00 2.15 -0.86 -4.52 116.67 119.52 1zkn s ASP 247 Ca 0.04 -1.71 0.21 0.00 0.43 0.00 0.00 52.55 51.52 1zkn s ASP 247 Cb 0.03 -2.56 0.90 0.00 -0.30 0.00 0.00 42.92 40.99 1zkn s ASP 247 CO 0.09 -1.40 1.64 2.30 -0.17 0.00 0.00 175.17 177.63 1zkn n ILE 248 N 6.67 0.90 -0.73 4.11 -5.35 -1.26 -2.18 119.36 121.52 1zkn n ILE 248 Ca 0.36 0.28 0.08 0.00 -0.27 0.00 0.00 62.75 63.20 1zkn n ILE 248 Cb 0.50 -1.18 0.34 0.00 -1.74 0.00 0.00 39.64 37.56 1zkn n ILE 248 CO 0.00 0.00 0.00 0.49 -1.76 0.00 0.00 176.55 175.28 1zkn n PHE 249 N -2.08 1.47 0.11 4.28 3.72 -1.26 -4.63 117.46 119.07 1zkn n PHE 249 Ca 0.02 -0.68 0.16 0.00 -0.05 0.00 0.00 57.45 56.90 1zkn n PHE 249 Cb 0.20 -0.31 0.70 0.00 -0.94 0.00 0.00 39.48 39.13 1zkn n PHE 249 CO 0.00 0.00 0.00 -0.56 -0.05 0.00 0.00 176.76 176.15 1zkn h GLN 250 N 3.48 0.00 -0.35 -1.08 3.07 -1.80 -2.16 115.11 116.28 1zkn h GLN 250 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.74 1zkn h GLN 250 Cb 1.54 0.00 0.00 0.00 0.08 0.00 0.00 27.48 29.10 1zkn h GLN 250 CO 0.28 0.00 0.00 0.09 0.09 0.00 0.00 178.83 179.29 1zkn n ASN 251 N -4.31 2.86 -4.83 0.06 3.02 -1.26 -4.93 115.26 105.87 1zkn n ASN 251 Ca 0.05 -1.91 -0.34 0.00 -0.03 0.00 0.00 54.58 52.35 1zkn n ASN 251 Cb 0.42 -0.22 -0.06 0.00 -0.61 0.00 0.00 39.78 39.31 1zkn n ASN 251 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1zkn s LEU 252 N -1.45 4.14 0.90 3.41 1.02 -0.81 -4.95 118.68 120.94 1zkn s LEU 252 Ca 0.37 1.38 -0.12 0.00 0.02 0.00 0.00 54.13 55.77 1zkn s LEU 252 Cb 0.21 -3.98 0.13 0.00 0.02 0.00 0.00 46.19 42.56 1zkn s LEU 252 CO 0.29 -0.15 1.13 0.42 0.02 0.00 0.00 176.35 178.06 1zkn s THR 253 N -1.86 2.15 0.23 5.49 -4.23 -1.26 -4.79 115.64 111.36 1zkn s THR 253 Ca 0.52 0.05 -0.08 0.00 -1.18 0.00 0.00 61.69 61.00 1zkn s THR 253 Cb -0.12 -2.79 0.20 0.00 1.34 0.00 0.00 72.50 71.12 1zkn s THR 253 CO 0.18 -0.06 1.88 0.50 -0.54 0.00 0.00 174.62 176.58 1zkn h LYS 254 N -1.45 1.03 -0.08 3.99 3.11 -1.98 -0.74 116.57 120.46 1zkn h LYS 254 Ca -0.50 -0.06 0.00 0.00 -2.81 0.00 0.00 60.65 57.28 1zkn h LYS 254 Cb 1.32 -0.23 -0.01 0.00 -1.00 0.00 0.00 32.23 32.31 1zkn h LYS 254 CO 0.62 0.68 0.04 0.87 -2.81 0.00 0.00 179.45 178.84 1zkn h LYS 255 N 1.06 0.08 -0.58 1.90 1.57 -1.99 0.64 116.57 119.24 1zkn h LYS 255 Ca 0.33 -0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.11 1zkn h LYS 255 Cb -0.02 -0.02 -0.03 0.00 0.08 0.00 0.00 32.23 32.25 1zkn h LYS 255 CO -0.11 0.05 0.38 1.96 -0.57 0.00 0.00 179.45 181.16 1zkn h GLN 256 N 0.08 0.77 -0.48 3.15 4.20 -1.83 -1.88 115.11 119.12 1zkn h GLN 256 Ca 0.03 -0.05 -0.06 0.00 0.06 0.00 0.00 58.65 58.63 1zkn h GLN 256 Cb 0.00 -0.17 -0.02 0.00 0.30 0.00 0.00 27.48 27.59 1zkn h GLN 256 CO -0.02 0.52 0.07 0.00 -0.67 0.00 0.00 178.83 178.73 1zkn h ARG 257 N 0.79 0.79 -0.46 1.46 3.08 -0.80 0.30 114.38 119.54 1zkn h ARG 257 Ca 0.21 -0.22 -0.11 0.00 0.07 0.00 0.00 59.98 59.93 1zkn h ARG 257 Cb -0.07 -0.09 -0.02 0.00 0.08 0.00 0.00 29.97 29.87 1zkn h ARG 257 CO -0.04 0.80 -0.16 1.96 -1.07 0.00 0.00 179.97 181.46 1zkn h GLN 258 N 0.66 0.89 0.03 0.04 4.20 -0.79 0.51 115.11 120.66 1zkn h GLN 258 Ca 0.14 -0.34 -0.00 0.00 0.06 0.00 0.00 58.65 58.52 1zkn h GLN 258 Cb 0.40 -0.05 0.00 0.00 0.30 0.00 0.00 27.48 28.13 1zkn h GLN 258 CO 0.01 0.98 -0.01 1.03 -0.67 0.00 0.00 178.83 180.17 1zkn h SER 259 N 0.79 -0.03 -0.24 1.46 0.87 -1.19 -1.41 113.55 113.80 1zkn h SER 259 Ca 0.12 -0.38 0.06 0.00 -1.23 0.00 0.00 61.79 60.35 1zkn h SER 259 Cb 0.69 0.01 -0.06 0.00 -0.44 0.00 0.00 62.40 62.60 1zkn h SER 259 CO 0.05 0.37 -0.16 0.25 -0.53 0.00 0.00 176.83 176.81 1zkn h LEU 260 N -0.44 -0.51 -0.43 2.23 5.85 -0.29 -1.78 115.31 119.93 1zkn h LEU 260 Ca -0.00 0.11 0.03 0.00 0.84 0.00 0.00 57.88 58.85 1zkn h LEU 260 Cb 0.41 0.26 -0.03 0.00 0.37 0.00 0.00 40.66 41.67 1zkn h LEU 260 CO 0.01 -0.19 0.24 -0.09 -0.34 0.00 0.00 178.44 178.06 1zkn h ARG 261 N -0.14 0.46 -0.39 1.25 2.43 -0.90 -0.95 114.38 116.14 1zkn h ARG 261 Ca 0.13 -0.03 0.01 0.00 -0.81 0.00 0.00 59.98 59.29 1zkn h ARG 261 Cb 0.34 -0.10 -0.02 0.00 -0.42 0.00 0.00 29.97 29.76 1zkn h ARG 261 CO -0.32 0.30 0.23 -0.22 -1.51 0.00 0.00 179.97 178.45 1zkn h LYS 262 N 0.47 0.46 -0.47 0.20 3.64 -0.81 -0.73 116.57 119.32 1zkn h LYS 262 Ca 0.18 -0.03 -0.03 0.00 -1.27 0.00 0.00 60.65 59.51 1zkn h LYS 262 Cb 0.05 -0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 31.75 1zkn h LYS 262 CO -0.11 0.30 0.19 0.52 -2.27 0.00 0.00 179.45 178.09 1zkn h MET 263 N 0.47 0.70 -0.38 1.90 2.86 -1.04 -0.65 114.93 118.80 1zkn h MET 263 Ca 0.15 -0.13 -0.01 0.00 -2.06 0.00 0.00 59.70 57.66 1zkn h MET 263 Cb -0.01 -0.11 -0.02 0.00 0.06 0.00 0.00 31.60 31.52 1zkn h MET 263 CO -0.06 0.63 0.20 0.28 1.06 0.00 0.00 176.91 179.02 1zkn h VAL 264 N 0.62 1.15 -0.41 -2.22 2.07 -0.96 0.06 116.25 116.56 1zkn h VAL 264 Ca 0.16 -0.40 -0.00 0.00 0.82 0.00 0.00 66.70 67.27 1zkn h VAL 264 Cb 0.19 0.73 -0.02 0.00 -1.52 0.00 0.00 31.29 30.67 1zkn h VAL 264 CO -0.01 0.16 0.24 0.40 0.02 0.00 0.00 177.57 178.38 1zkn h ILE 265 N 0.48 1.13 -0.60 4.57 2.04 -1.00 -0.55 117.51 123.58 1zkn h ILE 265 Ca 0.13 -0.30 -0.00 0.00 1.00 0.00 0.00 64.86 65.69 1zkn h ILE 265 Cb 0.07 0.60 -0.03 0.00 -0.74 0.00 0.00 36.82 36.72 1zkn h ILE 265 CO -0.02 0.13 0.37 0.44 0.00 0.00 0.00 178.15 179.07 1zkn h ASP 266 N 0.53 0.71 0.23 1.72 3.45 -0.82 -1.85 116.42 120.39 1zkn h ASP 266 Ca 0.15 -0.03 -0.01 0.00 0.43 0.00 0.00 57.03 57.56 1zkn h ASP 266 Cb 0.00 -0.18 0.00 0.00 -0.56 0.00 0.00 39.33 38.59 1zkn h ASP 266 CO -0.03 0.54 -0.11 0.40 -1.57 0.00 0.00 179.24 178.47 1zkn h ILE 267 N 0.83 0.70 -0.67 0.35 2.04 -0.49 -3.09 117.51 117.18 1zkn h ILE 267 Ca 0.22 -0.94 0.00 0.00 1.00 0.00 0.00 64.86 65.14 1zkn h ILE 267 Cb -0.05 1.14 -0.03 0.00 -0.74 0.00 0.00 36.82 37.14 1zkn h ILE 267 CO -0.04 0.17 0.43 0.58 0.00 0.00 0.00 178.15 179.29 1zkn h VAL 268 N -0.87 1.18 0.00 1.67 2.07 -1.06 -1.39 116.25 117.84 1zkn h VAL 268 Ca -0.03 -0.34 -0.00 0.00 0.82 0.00 0.00 66.70 67.14 1zkn h VAL 268 Cb 0.51 0.21 -0.00 0.00 -1.52 0.00 0.00 31.29 30.49 1zkn h VAL 268 CO 0.05 0.18 -0.01 -0.07 0.02 0.00 0.00 177.57 177.74 1zkn h LEU 269 N 0.91 0.00 0.00 2.57 3.38 -1.45 0.68 115.31 121.39 1zkn h LEU 269 Ca 0.24 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.21 1zkn h LEU 269 Cb -0.08 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.67 1zkn h LEU 269 CO -0.05 0.01 0.00 0.00 0.09 0.00 0.00 178.44 178.49 1zkn n ALA 270 N -2.32 2.22 1.00 1.53 0.00 -0.53 -2.88 120.51 119.53 1zkn n ALA 270 Ca -0.03 -0.11 0.13 0.00 0.00 0.00 0.00 53.44 53.43 1zkn n ALA 270 Cb 0.09 -1.39 0.45 0.00 0.00 0.00 0.00 19.45 18.60 1zkn n ALA 270 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1zkn n THR 271 N -1.30 0.00 -1.97 0.00 -2.24 0.23 -4.77 114.28 104.23 1zkn n THR 271 Ca 0.11 -0.00 -0.43 0.00 -2.27 0.00 0.00 64.05 61.46 1zkn n THR 271 Cb 0.20 -0.15 -0.03 0.00 -2.10 0.00 0.00 70.33 68.25 1zkn n THR 271 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1zkn s ASP 272 N -3.00 6.37 0.58 3.42 -1.08 -1.14 -4.85 116.67 116.96 1zkn s ASP 272 Ca 0.13 1.95 0.29 0.00 -0.52 0.00 0.00 52.55 54.40 1zkn s ASP 272 Cb 0.18 -2.53 1.47 0.00 -1.46 0.00 0.00 42.92 40.58 1zkn s ASP 272 CO 0.61 -1.22 1.90 0.24 0.52 0.00 0.00 175.17 177.22 1zkn h MET 273 N 10.86 0.00 0.00 4.34 2.86 -1.92 0.21 114.93 131.28 1zkn h MET 273 Ca -0.38 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.26 1zkn h MET 273 Cb 1.18 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.84 1zkn h MET 273 CO 0.98 0.00 0.00 -1.13 1.06 0.00 0.00 176.91 177.82 1zkn n SER 274 N -3.84 0.00 -0.00 1.22 3.41 -1.26 -0.49 113.62 112.66 1zkn n SER 274 Ca 0.10 0.44 0.09 0.00 -0.26 0.00 0.00 58.87 59.25 1zkn n SER 274 Cb 0.71 -0.46 -0.11 0.00 -0.26 0.00 0.00 64.21 64.09 1zkn n SER 274 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1zkn n LYS 275 N -1.46 0.63 -0.22 4.33 4.76 0.74 -4.69 118.16 122.25 1zkn n LYS 275 Ca 0.02 -0.02 -0.09 0.00 -2.87 0.00 0.00 58.31 55.34 1zkn n LYS 275 Cb 0.06 -1.42 -0.08 0.00 -1.84 0.00 0.00 35.03 31.76 1zkn n LYS 275 CO 0.00 0.00 0.00 1.25 -1.37 0.00 0.00 177.40 177.28 1zkn h HIS 276 N 0.00 -1.37 -0.45 2.13 -0.00 -0.86 -1.36 115.15 113.24 1zkn h HIS 276 Ca 0.00 0.08 0.09 0.00 -0.00 0.00 0.00 60.37 60.54 1zkn h HIS 276 Cb 0.50 0.67 -0.09 0.00 -0.00 0.00 0.00 27.41 28.50 1zkn h HIS 276 CO 0.00 -0.32 -0.14 0.52 -0.00 0.00 0.00 177.93 177.99 1zkn h MET 277 N -0.13 -0.04 -0.22 5.26 2.86 -1.84 0.18 114.93 121.00 1zkn h MET 277 Ca 0.09 0.00 -0.08 0.00 -2.06 0.00 0.00 59.70 57.65 1zkn h MET 277 Cb 0.37 0.01 -0.01 0.00 0.06 0.00 0.00 31.60 32.03 1zkn h MET 277 CO -0.60 -0.03 -0.22 -0.91 1.06 0.00 0.00 176.91 176.22 1zkn h ASN 278 N -0.04 0.40 -0.11 1.22 2.35 -1.82 0.28 115.58 117.86 1zkn h ASN 278 Ca 0.22 -0.12 -0.01 0.00 -0.55 0.00 0.00 56.30 55.83 1zkn h ASN 278 Cb 0.37 -0.11 -0.00 0.00 0.05 0.00 0.00 38.32 38.63 1zkn h ASN 278 CO -0.48 0.63 0.02 -0.07 -1.65 0.00 0.00 177.43 175.88 1zkn h LEU 279 N 0.36 0.17 -0.81 1.61 3.38 -0.24 -1.06 115.31 118.73 1zkn h LEU 279 Ca 0.06 -0.25 -0.04 0.00 0.09 0.00 0.00 57.88 57.75 1zkn h LEU 279 Cb 0.59 -0.05 -0.04 0.00 0.09 0.00 0.00 40.66 41.26 1zkn h LEU 279 CO 0.04 0.37 0.36 0.25 0.09 0.00 0.00 178.44 179.55 1zkn h LEU 280 N -0.04 1.08 -0.47 1.67 5.85 -0.35 0.65 115.31 123.71 1zkn h LEU 280 Ca 0.03 -0.15 0.02 0.00 0.84 0.00 0.00 57.88 58.62 1zkn h LEU 280 Cb 0.27 -0.28 -0.03 0.00 0.37 0.00 0.00 40.66 40.99 1zkn h LEU 280 CO 0.00 0.94 0.28 0.00 -0.34 0.00 0.00 178.44 179.32 1zkn h ALA 281 N 1.19 0.59 -0.57 1.25 0.00 -0.27 -1.36 119.26 120.09 1zkn h ALA 281 Ca 0.27 -0.01 -0.10 0.00 0.00 0.00 0.00 54.91 55.07 1zkn h ALA 281 Cb 0.17 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 1zkn h ALA 281 CO -0.03 -0.03 -0.03 -0.44 0.00 0.00 0.00 179.25 178.72 1zkn h ASP 282 N 0.56 1.02 -0.58 0.00 3.32 -0.72 -2.19 116.42 117.83 1zkn h ASP 282 Ca 0.19 -0.32 0.01 0.00 0.02 0.00 0.00 57.03 56.93 1zkn h ASP 282 Cb 0.01 -0.27 -0.03 0.00 0.22 0.00 0.00 39.33 39.25 1zkn h ASP 282 CO -0.08 1.09 0.37 0.25 -1.72 0.00 0.00 179.24 179.15 1zkn h LEU 283 N 0.92 0.63 -0.28 1.55 5.85 -0.50 -1.95 115.31 121.53 1zkn h LEU 283 Ca 0.16 -0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.86 1zkn h LEU 283 Cb 0.59 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 41.46 1zkn h LEU 283 CO 0.04 0.45 0.15 0.11 -0.34 0.00 0.00 178.44 178.85 1zkn h LYS 284 N 0.75 0.39 -0.81 1.25 1.57 -1.12 -1.20 116.57 117.40 1zkn h LYS 284 Ca 0.22 -0.05 0.16 0.00 -1.87 0.00 0.00 60.65 59.11 1zkn h LYS 284 Cb -0.05 -0.08 -0.10 0.00 0.08 0.00 0.00 32.23 32.08 1zkn h LYS 284 CO -0.07 0.34 0.34 1.15 -0.57 0.00 0.00 179.45 180.65 1zkn h THR 285 N 0.34 0.63 -0.41 -0.16 2.02 -1.04 0.23 112.91 114.52 1zkn h THR 285 Ca 0.10 -0.16 -0.10 0.00 0.77 0.00 0.00 66.41 67.02 1zkn h THR 285 Cb 0.07 0.12 -0.02 0.00 -1.74 0.00 0.00 68.15 66.58 1zkn h THR 285 CO -0.02 0.09 -0.15 -0.03 0.37 0.00 0.00 175.52 175.78 1zkn h MET 286 N 0.47 0.76 -0.41 6.66 1.85 -0.81 -2.00 114.93 121.45 1zkn h MET 286 Ca 0.46 -0.27 -0.08 0.00 -0.61 0.00 0.00 59.70 59.20 1zkn h MET 286 Cb 0.73 -0.05 -0.02 0.00 0.43 0.00 0.00 31.60 32.69 1zkn h MET 286 CO -0.43 0.87 -0.07 0.28 -0.40 0.00 0.00 176.91 177.17 1zkn h VAL 287 N 0.68 1.24 -0.01 -5.77 2.07 0.51 0.70 116.25 115.67 1zkn h VAL 287 Ca 0.11 -1.05 -0.00 0.00 0.82 0.00 0.00 66.70 66.58 1zkn h VAL 287 Cb 0.64 1.01 -0.00 0.00 -1.52 0.00 0.00 31.29 31.41 1zkn h VAL 287 CO 0.04 0.36 0.01 -0.33 0.02 0.00 0.00 177.57 177.67 1zkn h GLU 288 N 0.64 0.02 -0.55 1.57 5.08 -0.30 -2.86 114.58 118.18 1zkn h GLU 288 Ca 0.12 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.48 1zkn h GLU 288 Cb 0.50 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.74 1zkn h GLU 288 CO 0.03 0.11 0.00 0.25 -1.00 0.00 0.00 179.01 178.39 1zkn n THR 289 N -5.03 0.92 -1.51 1.13 -2.24 -0.79 -4.99 114.28 101.77 1zkn n THR 289 Ca -0.07 -0.72 -0.48 0.00 -2.27 0.00 0.00 64.05 60.51 1zkn n THR 289 Cb 0.07 0.18 -0.03 0.00 -2.10 0.00 0.00 70.33 68.45 1zkn n THR 289 CO 0.00 0.00 0.00 1.17 -0.57 0.00 0.00 175.07 175.67 1zkn n LYS 290 N 0.83 0.69 -4.03 -0.78 4.81 0.24 -4.98 118.16 114.94 1zkn n LYS 290 Ca 0.17 0.24 -0.19 0.00 -0.87 0.00 0.00 58.31 57.67 1zkn n LYS 290 Cb 0.52 -1.51 -0.16 0.00 0.02 0.00 0.00 35.03 33.89 1zkn n LYS 290 CO 0.00 0.00 0.00 0.15 1.17 0.00 0.00 177.40 178.72 1zkn s LYS 291 N -0.96 0.57 0.13 1.64 1.02 -1.26 -5.05 119.74 115.82 1zkn s LYS 291 Ca 0.67 -0.01 0.01 0.00 0.02 0.00 0.00 55.97 56.66 1zkn s LYS 291 Cb -0.87 -0.68 -0.04 0.00 -0.52 0.00 0.00 37.83 35.72 1zkn s LYS 291 CO 0.57 -0.12 0.27 0.14 -0.92 0.00 0.00 175.35 175.29 1zkn s VAL 292 N 1.03 5.33 0.00 3.17 -7.23 -1.26 -1.28 120.40 120.16 1zkn s VAL 292 Ca -0.09 -0.57 0.00 0.00 -1.81 0.00 0.00 61.98 59.51 1zkn s VAL 292 Cb -0.14 -3.71 0.00 0.00 0.56 0.00 0.00 36.38 33.09 1zkn s VAL 292 CO -0.01 -0.03 0.00 0.35 -0.31 0.00 0.00 175.10 175.10 1zkn n THR 293 N -0.31 0.00 0.20 5.32 -2.24 0.23 -4.87 114.28 112.61 1zkn n THR 293 Ca -0.06 0.00 0.15 0.00 -2.27 0.00 0.00 64.05 61.87 1zkn n THR 293 Cb 0.53 -1.36 0.77 0.00 -2.10 0.00 0.00 70.33 68.16 1zkn n THR 293 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 1zkn h SER 294 N 0.00 0.00 -0.52 3.42 0.02 -2.00 -1.45 113.55 113.03 1zkn h SER 294 Ca 0.00 0.00 -0.11 0.00 -0.84 0.00 0.00 61.79 60.84 1zkn h SER 294 Cb 0.00 0.00 -0.07 0.00 0.14 0.00 0.00 62.40 62.47 1zkn h SER 294 CO 0.00 0.00 0.10 -1.54 -1.14 0.00 0.00 176.83 174.25 1zkn n SER 295 N -4.12 4.36 -1.32 3.07 3.41 -1.26 -4.92 113.62 112.83 1zkn n SER 295 Ca 0.01 -3.20 -0.16 0.00 -0.26 0.00 0.00 58.87 55.26 1zkn n SER 295 Cb 0.28 -0.66 -0.06 0.00 -0.26 0.00 0.00 64.21 63.50 1zkn n SER 295 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1zkn n GLY 296 N -0.30 1.44 3.95 5.00 0.00 -0.54 -4.99 105.19 109.75 1zkn n GLY 296 Ca 0.32 -0.24 -0.26 0.00 0.00 0.00 0.00 46.02 45.85 1zkn n GLY 296 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1zkn s VAL 297 N -2.63 5.31 0.51 1.61 1.01 -1.26 -4.75 120.40 120.20 1zkn s VAL 297 Ca 0.00 -0.68 -0.23 0.00 0.00 0.00 0.00 61.98 61.07 1zkn s VAL 297 Cb 0.00 -3.75 -0.06 0.00 0.00 0.00 0.00 36.38 32.57 1zkn s VAL 297 CO 0.00 -0.12 1.33 -0.22 0.00 0.00 0.00 175.10 176.08 1zkn s LEU 298 N -3.31 3.94 -0.22 3.92 2.96 -0.89 0.73 118.68 125.81 1zkn s LEU 298 Ca 0.35 2.69 -0.02 0.00 -0.22 0.00 0.00 54.13 56.92 1zkn s LEU 298 Cb -0.11 -4.20 0.01 0.00 0.50 0.00 0.00 46.19 42.39 1zkn s LEU 298 CO 0.29 -1.35 -0.08 -0.22 -1.32 0.00 0.00 176.35 173.67 1zkn s LEU 299 N -3.25 2.82 -0.32 -0.68 0.20 -0.41 -4.71 118.68 112.33 1zkn s LEU 299 Ca 0.68 -0.57 -0.00 0.00 0.69 0.00 0.00 54.13 54.93 1zkn s LEU 299 Cb -0.38 -1.67 0.10 0.00 -0.43 0.00 0.00 46.19 43.81 1zkn s LEU 299 CO 0.46 -0.05 0.11 -0.76 -0.29 0.00 0.00 176.35 175.82 1zkn s LEU 300 N 1.40 2.48 0.00 -0.68 1.43 -1.26 -4.73 118.68 117.32 1zkn s LEU 300 Ca 0.04 -1.77 0.00 0.00 -1.03 0.00 0.00 54.13 51.37 1zkn s LEU 300 Cb -0.15 -0.94 0.00 0.00 0.03 0.00 0.00 46.19 45.14 1zkn s LEU 300 CO -0.05 -0.40 0.00 0.47 0.23 0.00 0.00 176.35 176.60 1zkn n ASP 301 N 4.68 0.00 -3.11 2.29 10.43 -1.26 -4.76 116.55 124.82 1zkn n ASP 301 Ca -0.00 0.00 -0.29 0.00 2.57 0.00 0.00 54.79 57.06 1zkn n ASP 301 Cb 0.41 0.00 0.03 0.00 1.84 0.00 0.00 41.12 43.40 1zkn n ASP 301 CO 0.00 0.00 0.00 -0.46 -1.07 0.00 0.00 177.20 175.67 1zkn n ASN 302 N 0.00 -3.33 -0.06 -2.24 6.94 -1.26 -4.70 115.26 110.61 1zkn n ASN 302 Ca 0.00 0.06 -0.11 0.00 -0.02 0.00 0.00 54.58 54.50 1zkn n ASN 302 Cb 0.00 -0.47 0.02 0.00 -2.36 0.00 0.00 39.78 36.96 1zkn n ASN 302 CO 0.00 0.00 0.00 0.22 -1.03 0.00 0.00 177.26 176.45 1zkn h TYR 303 N -0.78 0.93 -0.76 -2.53 3.20 -1.99 -3.05 116.97 111.99 1zkn h TYR 303 Ca -0.32 -0.30 0.13 0.00 3.14 0.00 0.00 58.73 61.38 1zkn h TYR 303 Cb 1.06 -0.19 -0.09 0.00 1.54 0.00 0.00 36.73 39.05 1zkn h TYR 303 CO 0.07 1.08 0.36 0.77 -1.64 0.00 0.00 178.16 178.79 1zkn h SER 304 N 0.61 0.41 0.64 -2.11 0.02 -1.99 0.39 113.55 111.52 1zkn h SER 304 Ca 0.03 0.09 -0.26 0.00 -0.84 0.00 0.00 61.79 60.81 1zkn h SER 304 Cb 1.03 0.03 0.00 0.00 0.14 0.00 0.00 62.40 63.60 1zkn h SER 304 CO 0.10 0.19 -1.18 0.44 -1.14 0.00 0.00 176.83 175.24 1zkn h ASP 305 N 0.55 0.39 -0.09 3.07 3.32 -1.89 -2.33 116.42 119.43 1zkn h ASP 305 Ca 0.40 -0.40 -0.03 0.00 0.02 0.00 0.00 57.03 57.02 1zkn h ASP 305 Cb 0.54 -0.13 -0.00 0.00 0.22 0.00 0.00 39.33 39.96 1zkn h ASP 305 CO -0.34 1.30 -0.06 0.03 -1.72 0.00 0.00 179.24 178.44 1zkn h ARG 306 N 0.08 0.19 -0.33 3.56 3.08 -1.35 -2.58 114.38 117.02 1zkn h ARG 306 Ca -0.11 -0.09 -0.08 0.00 0.07 0.00 0.00 59.98 59.76 1zkn h ARG 306 Cb 1.90 -0.00 -0.02 0.00 0.08 0.00 0.00 29.97 31.93 1zkn h ARG 306 CO 0.19 0.58 -0.15 0.97 -1.07 0.00 0.00 179.97 180.49 1zkn h ILE 307 N -0.20 1.25 -0.86 2.04 6.09 -1.04 -2.33 117.51 122.45 1zkn h ILE 307 Ca 0.02 -1.13 0.03 0.00 -1.37 0.00 0.00 64.86 62.40 1zkn h ILE 307 Cb 0.53 1.16 -0.05 0.00 0.47 0.00 0.00 36.82 38.93 1zkn h ILE 307 CO 0.02 0.37 0.56 -0.61 -3.07 0.00 0.00 178.15 175.42 1zkn h GLN 308 N 0.54 1.07 -0.28 2.19 4.15 -1.37 0.31 115.11 121.73 1zkn h GLN 308 Ca 0.09 -0.06 -0.10 0.00 0.77 0.00 0.00 58.65 59.34 1zkn h GLN 308 Cb 0.57 -0.24 -0.01 0.00 0.21 0.00 0.00 27.48 28.00 1zkn h GLN 308 CO 0.04 0.71 -0.27 0.28 -1.93 0.00 0.00 178.83 177.66 1zkn h VAL 309 N 1.11 1.27 -0.19 2.39 2.07 -1.12 -1.27 116.25 120.51 1zkn h VAL 309 Ca 0.34 -1.32 -0.20 0.00 0.82 0.00 0.00 66.70 66.34 1zkn h VAL 309 Cb -0.03 1.35 0.00 0.00 -1.52 0.00 0.00 31.29 31.09 1zkn h VAL 309 CO -0.10 0.42 -0.66 -0.07 0.02 0.00 0.00 177.57 177.18 1zkn h LEU 310 N 0.48 0.83 -0.27 2.57 3.38 -0.77 0.23 115.31 121.76 1zkn h LEU 310 Ca 0.07 -0.49 -0.02 0.00 0.09 0.00 0.00 57.88 57.53 1zkn h LEU 310 Cb 0.71 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.21 1zkn h LEU 310 CO 0.05 1.27 0.11 1.56 0.09 0.00 0.00 178.44 181.52 1zkn h GLN 311 N 0.52 0.41 -0.25 1.13 4.20 -0.23 -1.64 115.11 119.26 1zkn h GLN 311 Ca -0.02 -0.07 -0.10 0.00 0.06 0.00 0.00 58.65 58.52 1zkn h GLN 311 Cb 1.26 -0.07 -0.01 0.00 0.30 0.00 0.00 27.48 28.96 1zkn h GLN 311 CO 0.13 0.44 -0.25 -0.91 -0.67 0.00 0.00 178.83 177.57 1zkn h ASN 312 N 0.29 0.48 -0.14 1.46 2.35 -1.19 -0.85 115.58 117.97 1zkn h ASN 312 Ca 0.09 -0.16 -0.01 0.00 -0.55 0.00 0.00 56.30 55.67 1zkn h ASN 312 Cb 0.18 -0.13 -0.01 0.00 0.05 0.00 0.00 38.32 38.42 1zkn h ASN 312 CO -0.01 0.73 0.05 -0.03 -1.65 0.00 0.00 177.43 176.52 1zkn h MET 313 N 0.42 0.21 -0.08 0.81 4.05 -0.70 0.20 114.93 119.84 1zkn h MET 313 Ca 0.06 -0.04 -0.11 0.00 -0.28 0.00 0.00 59.70 59.33 1zkn h MET 313 Cb 0.67 -0.03 -0.01 0.00 -0.80 0.00 0.00 31.60 31.42 1zkn h MET 313 CO 0.05 0.32 -0.47 0.28 0.23 0.00 0.00 176.91 177.32 1zkn h VAL 314 N 0.05 1.34 -0.44 -5.77 2.07 -1.21 -1.43 116.25 110.86 1zkn h VAL 314 Ca 0.04 -1.65 -0.09 0.00 0.82 0.00 0.00 66.70 65.82 1zkn h VAL 314 Cb 0.20 1.79 -0.01 0.00 -1.52 0.00 0.00 31.29 31.75 1zkn h VAL 314 CO -0.00 0.49 -0.09 -0.74 0.02 0.00 0.00 177.57 177.24 1zkn h HIS 315 N 0.16 0.95 -0.50 1.57 6.17 -0.93 0.00 115.15 122.57 1zkn h HIS 315 Ca 0.01 -0.20 -0.01 0.00 0.71 0.00 0.00 60.37 60.88 1zkn h HIS 315 Cb 0.89 -0.23 -0.02 0.00 2.52 0.00 0.00 27.41 30.56 1zkn h HIS 315 CO 0.01 0.94 0.27 0.00 0.71 0.00 0.00 177.93 179.86 1zkn h ALA 317 N 1.11 1.34 0.00 0.00 0.00 -0.95 -0.64 119.26 120.12 1zkn h ALA 317 Ca 0.18 -0.09 -0.04 0.00 0.00 0.00 0.00 54.91 54.96 1zkn h ALA 317 Cb 0.06 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.52 1zkn h ALA 317 CO -0.03 0.57 -0.17 0.22 0.00 0.00 0.00 179.25 179.84 1zkn h ASP 318 N 1.11 0.00 -0.61 0.00 3.58 -0.57 -2.91 116.42 117.02 1zkn h ASP 318 Ca 0.29 0.00 -0.41 0.00 0.42 0.00 0.00 57.03 57.33 1zkn h ASP 318 Cb -0.05 0.00 -0.26 0.00 1.72 0.00 0.00 39.33 40.73 1zkn h ASP 318 CO -0.06 0.17 -0.24 0.18 -2.88 0.00 0.00 179.24 176.42 1zkn n LEU 319 N -3.32 5.01 -0.41 2.28 4.77 -0.45 -4.71 117.00 120.17 1zkn n LEU 319 Ca 0.00 -4.28 0.12 0.00 -0.03 0.00 0.00 56.01 51.82 1zkn n LEU 319 Cb 0.41 -0.57 0.12 0.00 -2.33 0.00 0.00 43.42 41.05 1zkn n LEU 319 CO 0.32 1.66 0.42 -1.54 -1.33 0.00 0.00 177.39 176.92 1zkn n SER 320 N -0.92 1.70 -0.24 -1.43 3.41 -0.38 -4.54 113.62 111.23 1zkn n SER 320 Ca 0.42 -1.31 0.04 0.00 -0.26 0.00 0.00 58.87 57.76 1zkn n SER 320 Cb 0.92 0.37 0.16 0.00 -0.26 0.00 0.00 64.21 65.40 1zkn n SER 320 CO 0.00 0.00 0.00 0.78 -0.16 0.00 0.00 175.04 175.66 1zkn h ASN 321 N 2.03 0.09 0.63 4.04 2.35 -1.84 -0.79 115.58 122.10 1zkn h ASN 321 Ca 0.00 0.12 0.00 0.00 -0.55 0.00 0.00 56.30 55.87 1zkn h ASN 321 Cb 0.67 0.15 0.00 0.00 0.05 0.00 0.00 38.32 39.19 1zkn h ASN 321 CO 0.00 0.02 0.00 -0.65 -1.65 0.00 0.00 177.43 175.15 1zkn h PRO 322 N 0.32 0.00 -0.01 0.81 0.11 -1.92 -2.56 132.00 128.75 1zkn h PRO 322 Ca 0.38 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.49 1zkn h PRO 322 Cb 0.61 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.72 1zkn h PRO 322 CO -0.44 0.00 -0.33 0.25 -0.21 0.00 0.00 178.00 177.26 1zkn n THR 323 N -2.40 0.00 -3.01 -1.15 -2.24 -0.31 -4.19 114.28 100.97 1zkn n THR 323 Ca 0.01 -0.14 -0.27 0.00 -2.27 0.00 0.00 64.05 61.38 1zkn n THR 323 Cb 0.20 0.58 -0.01 0.00 -2.10 0.00 0.00 70.33 69.00 1zkn n THR 323 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1zkn s LYS 324 N -2.54 3.56 0.35 -0.78 -0.14 -0.96 -4.47 119.74 114.76 1zkn s LYS 324 Ca 0.22 0.02 -0.25 0.00 -1.36 0.00 0.00 55.97 54.60 1zkn s LYS 324 Cb 0.19 -2.51 -0.14 0.00 -1.68 0.00 0.00 37.83 33.69 1zkn s LYS 324 CO 0.55 -0.01 0.66 -2.30 -0.76 0.00 0.00 175.35 173.49 1zkn n PRO 325 N -1.80 0.68 -0.34 -1.68 -0.02 -1.26 -4.41 135.00 126.17 1zkn n PRO 325 Ca -0.01 0.24 0.19 0.00 -2.02 0.00 0.00 63.50 61.90 1zkn n PRO 325 Cb 0.55 -1.51 0.40 0.00 -0.02 0.00 0.00 33.50 32.92 1zkn n PRO 325 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 1zkn h LEU 326 N 1.12 0.60 -0.58 2.45 5.85 -1.94 -0.44 115.31 122.38 1zkn h LEU 326 Ca -0.38 0.15 0.08 0.00 0.84 0.00 0.00 57.88 58.57 1zkn h LEU 326 Cb 1.39 0.07 -0.06 0.00 0.37 0.00 0.00 40.66 42.43 1zkn h LEU 326 CO 0.55 0.03 0.24 1.56 -0.34 0.00 0.00 178.44 180.48 1zkn h GLN 327 N 0.50 0.43 -0.02 1.25 4.20 -2.00 0.86 115.11 120.33 1zkn h GLN 327 Ca 0.66 -0.03 -0.21 0.00 0.06 0.00 0.00 58.65 59.13 1zkn h GLN 327 Cb 1.33 -0.10 0.02 0.00 0.30 0.00 0.00 27.48 29.03 1zkn h GLN 327 CO -0.52 0.29 -0.82 -0.07 -0.67 0.00 0.00 178.83 177.04 1zkn h LEU 328 N 0.45 0.76 -0.38 1.46 3.38 -1.44 -3.21 115.31 116.32 1zkn h LEU 328 Ca 0.28 -0.73 0.06 0.00 0.09 0.00 0.00 57.88 57.58 1zkn h LEU 328 Cb 0.30 -0.23 -0.05 0.00 0.09 0.00 0.00 40.66 40.76 1zkn h LEU 328 CO -0.26 1.38 0.07 0.22 0.09 0.00 0.00 178.44 179.95 1zkn h TYR 329 N 0.21 0.12 -0.28 1.13 3.20 -0.84 -2.01 116.97 118.50 1zkn h TYR 329 Ca -0.10 0.02 -0.03 0.00 3.14 0.00 0.00 58.73 61.77 1zkn h TYR 329 Cb 1.49 0.01 -0.02 0.00 1.54 0.00 0.00 36.73 39.75 1zkn h TYR 329 CO 0.12 0.01 0.05 0.00 -1.64 0.00 0.00 178.16 176.70 1zkn h ARG 330 N 0.20 0.40 -0.29 1.82 3.08 -0.93 -0.52 114.38 118.14 1zkn h ARG 330 Ca 0.18 -0.06 -0.14 0.00 0.07 0.00 0.00 59.98 60.04 1zkn h ARG 330 Cb 0.22 -0.07 -0.01 0.00 0.08 0.00 0.00 29.97 30.19 1zkn h ARG 330 CO -0.24 0.39 -0.38 1.96 -1.07 0.00 0.00 179.97 180.63 1zkn h GLN 331 N 0.40 0.67 -0.42 0.04 4.20 -1.39 -1.46 115.11 117.16 1zkn h GLN 331 Ca 0.09 -0.34 -0.10 0.00 0.06 0.00 0.00 58.65 58.37 1zkn h GLN 331 Cb 0.18 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.95 1zkn h GLN 331 CO -0.00 0.94 -0.11 -1.49 -0.67 0.00 0.00 178.83 177.50 1zkn h TRP 332 N 0.56 0.92 -0.73 2.96 -0.00 -0.74 -2.61 115.95 116.31 1zkn h TRP 332 Ca 0.05 -0.20 -0.02 0.00 -0.00 0.00 0.00 58.89 58.72 1zkn h TRP 332 Cb 0.90 -0.22 -0.03 0.00 -0.00 0.00 0.00 29.16 29.80 1zkn h TRP 332 CO 0.04 0.94 0.38 1.15 -0.00 0.00 0.00 178.44 180.95 1zkn h THR 333 N 0.64 1.23 -0.75 1.49 2.02 -0.96 -0.75 112.91 115.84 1zkn h THR 333 Ca 0.10 -0.61 -0.02 0.00 0.77 0.00 0.00 66.41 66.65 1zkn h THR 333 Cb 0.65 0.29 -0.03 0.00 -1.74 0.00 0.00 68.15 67.31 1zkn h THR 333 CO 0.04 0.26 0.38 0.44 0.37 0.00 0.00 175.52 177.01 1zkn h ASP 334 N 1.02 0.97 -0.14 4.18 3.32 -1.19 -1.52 116.42 123.06 1zkn h ASP 334 Ca 0.26 -0.12 -0.03 0.00 0.02 0.00 0.00 57.03 57.15 1zkn h ASP 334 Cb 0.07 -0.25 -0.00 0.00 0.22 0.00 0.00 39.33 39.37 1zkn h ASP 334 CO -0.04 0.82 -0.02 0.03 -1.72 0.00 0.00 179.24 178.31 1zkn h ARG 335 N 1.05 0.27 -0.48 3.56 3.08 -1.05 -0.75 114.38 120.07 1zkn h ARG 335 Ca 0.26 -0.10 -0.07 0.00 0.07 0.00 0.00 59.98 60.14 1zkn h ARG 335 Cb 0.10 -0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.11 1zkn h ARG 335 CO -0.04 0.54 0.01 0.97 -1.07 0.00 0.00 179.97 180.38 1zkn h ILE 336 N -0.02 1.24 -0.48 2.04 6.09 -1.08 -0.71 117.51 124.59 1zkn h ILE 336 Ca 0.04 -0.99 -0.12 0.00 -1.37 0.00 0.00 64.86 62.42 1zkn h ILE 336 Cb 0.43 0.87 -0.01 0.00 0.47 0.00 0.00 36.82 38.57 1zkn h ILE 336 CO 0.01 0.35 -0.19 0.24 -3.07 0.00 0.00 178.15 175.49 1zkn h MET 337 N 0.74 0.95 -0.73 2.19 2.86 -1.21 0.87 114.93 120.60 1zkn h MET 337 Ca 0.15 -0.39 -0.04 0.00 -2.06 0.00 0.00 59.70 57.36 1zkn h MET 337 Cb 0.44 -0.04 -0.03 0.00 0.06 0.00 0.00 31.60 32.02 1zkn h MET 337 CO 0.02 1.05 0.32 1.49 1.06 0.00 0.00 176.91 180.85 1zkn h GLU 338 N 0.83 1.08 -0.42 1.72 4.81 -0.74 0.10 114.58 121.96 1zkn h GLU 338 Ca 0.11 -0.18 -0.09 0.00 -0.13 0.00 0.00 59.36 59.07 1zkn h GLU 338 Cb 0.75 -0.18 -0.01 0.00 0.63 0.00 0.00 28.75 29.94 1zkn h GLU 338 CO 0.06 0.87 -0.11 1.49 -0.73 0.00 0.00 179.01 180.59 1zkn h GLU 339 N 1.04 0.81 -0.36 1.92 4.81 -0.81 -2.12 114.58 119.87 1zkn h GLU 339 Ca 0.25 -0.31 -0.01 0.00 -0.13 0.00 0.00 59.36 59.15 1zkn h GLU 339 Cb 0.18 -0.04 -0.02 0.00 0.63 0.00 0.00 28.75 29.49 1zkn h GLU 339 CO -0.02 0.94 0.19 0.74 -0.73 0.00 0.00 179.01 180.12 1zkn h PHE 340 N 0.63 0.51 -0.33 0.92 -1.00 -0.53 -2.51 116.94 114.63 1zkn h PHE 340 Ca 0.11 -0.02 -0.05 0.00 2.81 0.00 0.00 57.97 60.82 1zkn h PHE 340 Cb 0.64 -0.16 -0.02 0.00 3.61 0.00 0.00 35.95 40.02 1zkn h PHE 340 CO 0.05 0.41 -0.01 0.74 -1.61 0.00 0.00 178.31 177.90 1zkn h PHE 341 N 0.46 0.52 -0.63 -0.55 0.04 -0.73 -0.73 116.94 115.31 1zkn h PHE 341 Ca 0.13 -0.05 -0.09 0.00 2.80 0.00 0.00 57.97 60.76 1zkn h PHE 341 Cb 0.08 -0.15 -0.02 0.00 2.20 0.00 0.00 35.95 38.06 1zkn h PHE 341 CO -0.02 0.52 0.05 0.00 -0.60 0.00 0.00 178.31 178.25 1zkn h ARG 342 N 0.48 1.07 -0.55 1.51 3.08 -1.15 0.81 114.38 119.63 1zkn h ARG 342 Ca 0.10 -0.31 -0.09 0.00 0.07 0.00 0.00 59.98 59.75 1zkn h ARG 342 Cb 0.32 -0.11 -0.02 0.00 0.08 0.00 0.00 29.97 30.24 1zkn h ARG 342 CO 0.01 1.02 0.00 0.37 -1.07 0.00 0.00 179.97 180.30 1zkn h GLN 343 N 0.99 0.97 -0.68 0.04 4.15 -1.00 -1.53 115.11 118.06 1zkn h GLN 343 Ca 0.19 -0.31 0.00 0.00 0.77 0.00 0.00 58.65 59.30 1zkn h GLN 343 Cb 0.50 -0.09 -0.03 0.00 0.21 0.00 0.00 27.48 28.07 1zkn h GLN 343 CO 0.02 0.98 0.44 0.78 -1.93 0.00 0.00 178.83 179.12 1zkn h GLY 344 N 0.86 0.97 1.10 2.39 0.00 -0.73 0.19 103.07 107.83 1zkn h GLY 344 Ca 0.16 -0.37 -0.04 0.00 0.00 0.00 0.00 47.33 47.07 1zkn h GLY 344 CO 0.03 0.36 0.33 -0.55 0.00 0.00 0.00 176.54 176.71 1zkn h ASP 345 N 0.92 1.06 -0.15 0.19 3.32 -0.54 0.12 116.42 121.34 1zkn h ASP 345 Ca 0.25 -0.15 -0.15 0.00 0.02 0.00 0.00 57.03 57.00 1zkn h ASP 345 Cb -0.09 -0.27 -0.01 0.00 0.22 0.00 0.00 39.33 39.18 1zkn h ASP 345 CO -0.05 0.93 -0.43 0.03 -1.72 0.00 0.00 179.24 178.00 1zkn h ARG 346 N 1.13 0.69 -0.69 3.56 3.08 -0.71 -0.61 114.38 120.82 1zkn h ARG 346 Ca 0.26 -0.37 -0.07 0.00 0.07 0.00 0.00 59.98 59.87 1zkn h ARG 346 Cb 0.19 0.02 -0.03 0.00 0.08 0.00 0.00 29.97 30.23 1zkn h ARG 346 CO -0.02 0.99 0.17 0.93 -1.07 0.00 0.00 179.97 180.97 1zkn h GLU 347 N 0.56 1.10 -0.29 0.04 5.08 -0.08 -1.84 114.58 119.16 1zkn h GLU 347 Ca 0.04 -0.26 -0.09 0.00 -1.00 0.00 0.00 59.36 58.05 1zkn h GLU 347 Cb 0.97 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 30.07 1zkn h GLU 347 CO 0.09 0.97 -0.18 -0.09 -1.00 0.00 0.00 179.01 178.80 1zkn h ARG 348 N 1.04 0.63 -0.95 2.33 2.43 -0.55 0.28 114.38 119.58 1zkn h ARG 348 Ca 0.22 -0.29 0.10 0.00 -0.81 0.00 0.00 59.98 59.19 1zkn h ARG 348 Cb 0.36 -0.01 -0.07 0.00 -0.42 0.00 0.00 29.97 29.83 1zkn h ARG 348 CO 0.00 0.88 0.61 0.93 -1.51 0.00 0.00 179.97 180.88 1zkn h GLU 349 N 0.37 0.94 -0.01 0.20 5.08 -0.97 -0.89 114.58 119.30 1zkn h GLU 349 Ca 0.06 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1zkn h GLU 349 Cb 0.72 -0.21 0.00 0.00 0.50 0.00 0.00 28.75 29.76 1zkn h GLU 349 CO 0.05 0.62 -0.02 0.54 -1.00 0.00 0.00 179.01 179.21 1zkn n ARG 350 N -4.55 1.18 -1.85 2.33 1.74 -0.71 -4.92 116.66 109.88 1zkn n ARG 350 Ca 0.17 -0.37 -0.12 0.00 -0.77 0.00 0.00 57.85 56.76 1zkn n ARG 350 Cb 0.31 -1.49 -0.02 0.00 -1.02 0.00 0.00 32.46 30.23 1zkn n ARG 350 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1zkn n GLY 351 N 1.11 0.48 3.95 -0.13 0.00 -0.34 -5.01 105.19 105.24 1zkn n GLY 351 Ca 0.21 -0.43 -0.23 0.00 0.00 0.00 0.00 46.02 45.56 1zkn n GLY 351 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1zkn s MET 352 N -3.91 3.39 0.25 1.61 -1.94 0.92 -5.01 119.30 114.61 1zkn s MET 352 Ca 0.00 -0.40 -0.30 0.00 -1.71 0.00 0.00 55.69 53.29 1zkn s MET 352 Cb 0.00 -2.65 -0.10 0.00 2.01 0.00 0.00 34.83 34.09 1zkn s MET 352 CO 0.00 0.07 1.35 -2.00 -0.01 0.00 0.00 175.02 174.43 1zkn s GLU 353 N -4.35 4.34 -0.13 2.03 2.12 -1.26 -4.38 118.70 117.07 1zkn s GLU 353 Ca 0.42 2.18 -0.28 0.00 0.36 0.00 0.00 54.97 57.65 1zkn s GLU 353 Cb -0.10 -3.13 -0.01 0.00 0.26 0.00 0.00 34.13 31.15 1zkn s GLU 353 CO 0.36 -0.28 0.93 0.42 -0.54 0.00 0.00 175.26 176.15 1zkn s ILE 354 N -0.28 4.83 0.73 -3.70 1.01 -1.26 -4.92 121.20 117.60 1zkn s ILE 354 Ca 0.55 1.86 -0.15 0.00 0.00 0.00 0.00 60.65 62.91 1zkn s ILE 354 Cb -0.39 -4.23 0.04 0.00 0.01 0.00 0.00 42.46 37.88 1zkn s ILE 354 CO 0.44 0.02 1.23 -0.44 0.00 0.00 0.00 174.94 176.18 1zkn s SER 355 N 1.11 4.12 0.14 3.58 0.01 -1.26 -4.88 113.70 116.52 1zkn s SER 355 Ca 0.44 2.43 -0.35 0.00 1.31 0.00 0.00 55.95 59.78 1zkn s SER 355 Cb -0.17 -2.60 -0.15 0.00 0.21 0.00 0.00 66.02 63.31 1zkn s SER 355 CO 0.15 -2.32 1.45 -2.65 0.41 0.00 0.00 173.24 170.29 1zkn n PRO 356 N -2.68 1.69 -0.92 12.44 -0.02 -1.26 -1.10 135.00 143.16 1zkn n PRO 356 Ca 0.14 0.61 0.00 0.00 -2.02 0.00 0.00 63.50 62.23 1zkn n PRO 356 Cb 0.50 -2.31 0.00 0.00 -0.02 0.00 0.00 33.50 31.67 1zkn n PRO 356 CO 0.00 0.00 0.00 -1.33 1.98 0.00 0.00 175.50 176.15 1zkn n MET 357 N 2.86 -0.60 -0.10 -0.52 2.81 -1.26 -4.87 117.12 115.45 1zkn n MET 357 Ca 0.17 0.15 0.12 0.00 -1.81 0.00 0.00 57.70 56.33 1zkn n MET 357 Cb 0.25 -3.74 0.16 0.00 -0.71 0.00 0.00 33.22 29.18 1zkn n MET 357 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1zkn s ASP 359 N -1.68 6.21 0.01 0.00 -1.08 -1.26 -3.67 116.67 115.21 1zkn s ASP 359 Ca 0.33 -0.65 0.16 0.00 -0.52 0.00 0.00 52.55 51.87 1zkn s ASP 359 Cb 0.21 -2.24 0.69 0.00 -1.46 0.00 0.00 42.92 40.12 1zkn s ASP 359 CO 0.30 -0.62 1.51 2.29 0.52 0.00 0.00 175.17 179.18 1zkn n LYS 360 N 5.70 0.01 0.02 4.34 2.85 -1.26 -2.17 118.16 127.65 1zkn n LYS 360 Ca -0.07 0.24 0.11 0.00 -1.05 0.00 0.00 58.31 57.54 1zkn n LYS 360 Cb 0.47 -1.52 -0.10 0.00 -0.65 0.00 0.00 35.03 33.24 1zkn n LYS 360 CO 0.00 0.00 0.00 0.72 -0.05 0.00 0.00 177.40 178.07 1zkn n HIS 361 N -1.53 0.25 -3.19 5.58 8.25 -1.26 -4.59 115.22 118.72 1zkn n HIS 361 Ca 0.04 0.07 -0.22 0.00 -0.26 0.00 0.00 57.72 57.35 1zkn n HIS 361 Cb 0.19 -0.54 -0.06 0.00 1.12 0.00 0.00 29.99 30.70 1zkn n HIS 361 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 1zkn n ASN 362 N -2.23 0.76 -4.21 0.41 3.02 -0.92 -5.11 115.26 106.98 1zkn n ASN 362 Ca -0.01 -2.88 -0.18 0.00 -0.03 0.00 0.00 54.58 51.48 1zkn n ASN 362 Cb 0.52 -0.63 -0.11 0.00 -0.61 0.00 0.00 39.78 38.95 1zkn n ASN 362 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1zkn s ALA 363 N -1.78 1.35 -0.55 5.41 0.00 -1.11 -4.67 121.76 120.40 1zkn s ALA 363 Ca 0.38 -1.19 0.04 0.00 0.00 0.00 0.00 51.96 51.19 1zkn s ALA 363 Cb 0.24 -0.07 0.17 0.00 0.00 0.00 0.00 23.12 23.46 1zkn s ALA 363 CO -0.09 0.10 0.42 0.43 0.00 0.00 0.00 175.76 176.61 1zkn n SER 364 N 0.76 1.17 -0.22 0.00 7.64 -1.26 -5.00 113.62 116.71 1zkn n SER 364 Ca -0.17 -2.77 -0.01 0.00 1.01 0.00 0.00 58.87 56.93 1zkn n SER 364 Cb 0.56 -0.65 0.06 0.00 -1.01 0.00 0.00 64.21 63.18 1zkn n SER 364 CO 0.00 0.00 0.00 0.58 -3.01 0.00 0.00 175.04 172.61 1zkn h VAL 365 N 4.49 0.32 -0.20 0.44 2.07 -1.98 0.15 116.25 121.53 1zkn h VAL 365 Ca 0.21 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.73 1zkn h VAL 365 Cb 0.83 0.32 -0.01 0.00 -1.52 0.00 0.00 31.29 30.91 1zkn h VAL 365 CO 0.54 0.00 0.11 -0.33 0.02 0.00 0.00 177.57 177.91 1zkn h GLU 366 N -0.02 0.27 -0.67 1.57 3.07 -1.94 -0.91 114.58 115.95 1zkn h GLU 366 Ca 0.31 -0.03 0.01 0.00 -0.50 0.00 0.00 59.36 59.15 1zkn h GLU 366 Cb 0.49 -0.05 -0.03 0.00 -0.84 0.00 0.00 28.75 28.32 1zkn h GLU 366 CO -0.68 0.26 0.44 0.87 -1.40 0.00 0.00 179.01 178.50 1zkn h LYS 367 N 0.22 0.88 -0.51 2.33 1.57 -1.63 -0.77 116.57 118.67 1zkn h LYS 367 Ca 0.07 -0.05 -0.03 0.00 -1.87 0.00 0.00 60.65 58.77 1zkn h LYS 367 Cb 0.06 -0.20 -0.02 0.00 0.08 0.00 0.00 32.23 32.15 1zkn h LYS 367 CO -0.01 0.58 0.20 0.77 -0.57 0.00 0.00 179.45 180.42 1zkn h SER 368 N 0.90 0.70 -0.70 0.86 0.02 -0.56 0.51 113.55 115.29 1zkn h SER 368 Ca 0.25 -0.17 -0.03 0.00 -0.84 0.00 0.00 61.79 60.99 1zkn h SER 368 Cb -0.10 -0.18 -0.03 0.00 0.14 0.00 0.00 62.40 62.23 1zkn h SER 368 CO -0.06 0.68 0.31 1.56 -1.14 0.00 0.00 176.83 178.18 1zkn h GLN 369 N 0.68 1.05 -0.36 3.45 1.08 -0.72 0.42 115.11 120.70 1zkn h GLN 369 Ca 0.17 -0.17 -0.04 0.00 -1.45 0.00 0.00 58.65 57.16 1zkn h GLN 369 Cb 0.20 -0.18 -0.01 0.00 -0.05 0.00 0.00 27.48 27.43 1zkn h GLN 369 CO -0.01 0.84 0.06 0.28 -0.95 0.00 0.00 178.83 179.05 1zkn h VAL 370 N 1.04 1.24 -0.60 -0.54 2.07 -0.76 -1.16 116.25 117.53 1zkn h VAL 370 Ca 0.25 -0.83 -0.07 0.00 0.82 0.00 0.00 66.70 66.87 1zkn h VAL 370 Cb 0.16 1.08 -0.02 0.00 -1.52 0.00 0.00 31.29 30.98 1zkn h VAL 370 CO -0.03 0.28 0.11 1.23 0.02 0.00 0.00 177.57 179.19 1zkn h GLY 371 N 0.44 1.07 0.80 2.17 0.00 -0.37 -0.69 103.07 106.49 1zkn h GLY 371 Ca 0.11 -0.70 0.04 0.00 0.00 0.00 0.00 47.33 46.78 1zkn h GLY 371 CO 0.01 0.65 0.32 -2.75 0.00 0.00 0.00 176.54 174.77 1zkn h PHE 372 N 0.90 0.60 0.05 5.60 3.57 0.02 -1.41 116.94 126.27 1zkn h PHE 372 Ca 0.18 0.02 -0.00 0.00 3.53 0.00 0.00 57.97 61.70 1zkn h PHE 372 Cb 0.41 -0.19 0.00 0.00 2.79 0.00 0.00 35.95 38.96 1zkn h PHE 372 CO 0.03 0.32 -0.03 0.82 -2.23 0.00 0.00 178.31 177.23 1zkn h ILE 373 N 0.63 1.26 -0.17 1.41 2.04 -1.01 -1.82 117.51 119.85 1zkn h ILE 373 Ca 0.24 -1.13 0.03 0.00 1.00 0.00 0.00 64.86 65.00 1zkn h ILE 373 Cb 0.08 1.99 -0.03 0.00 -0.74 0.00 0.00 36.82 38.12 1zkn h ILE 373 CO -0.13 0.28 -0.02 0.44 0.00 0.00 0.00 178.15 178.73 1zkn h ASP 374 N -0.58 -0.10 1.10 1.72 3.32 -1.02 0.32 116.42 121.17 1zkn h ASP 374 Ca -0.01 0.04 -0.13 0.00 0.02 0.00 0.00 57.03 56.95 1zkn h ASP 374 Cb 0.51 0.08 -0.02 0.00 0.22 0.00 0.00 39.33 40.12 1zkn h ASP 374 CO 0.01 -0.03 -0.95 1.88 -1.72 0.00 0.00 179.24 178.43 1zkn h TYR 375 N 0.04 0.00 0.00 4.55 -1.99 -1.38 -3.39 116.97 114.80 1zkn h TYR 375 Ca 0.08 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.81 1zkn h TYR 375 Cb 0.11 0.00 0.00 0.00 2.00 0.00 0.00 36.73 38.84 1zkn h TYR 375 CO -0.17 0.53 0.00 -0.89 -0.00 0.00 0.00 178.16 177.62 1zkn n ILE 376 N -3.05 0.51 0.00 -2.88 5.41 -0.75 -4.73 119.36 113.88 1zkn n ILE 376 Ca -0.04 0.17 -0.10 0.00 1.00 0.00 0.00 62.75 63.78 1zkn n ILE 376 Cb 0.78 -1.13 -0.05 0.00 -0.71 0.00 0.00 39.64 38.54 1zkn n ILE 376 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 176.55 177.13 1zkn h VAL 377 N 0.00 0.86 -0.44 1.39 2.07 -1.35 -2.20 116.25 116.58 1zkn h VAL 377 Ca 0.00 0.00 -0.06 0.00 0.82 0.00 0.00 66.70 67.46 1zkn h VAL 377 Cb 0.00 0.86 -0.02 0.00 -1.52 0.00 0.00 31.29 30.61 1zkn h VAL 377 CO 0.00 0.00 0.05 -0.74 0.02 0.00 0.00 177.57 176.90 1zkn h HIS 378 N -0.03 0.78 -0.99 1.57 -0.00 -0.60 -1.17 115.15 114.72 1zkn h HIS 378 Ca 0.06 -0.12 0.03 0.00 -0.00 0.00 0.00 60.37 60.34 1zkn h HIS 378 Cb 0.11 -0.21 -0.05 0.00 -0.00 0.00 0.00 27.41 27.25 1zkn h HIS 378 CO -0.16 0.76 0.65 -1.35 -0.00 0.00 0.00 177.93 177.82 1zkn h PRO 379 N 0.59 1.24 0.28 5.26 0.11 -1.71 0.63 132.00 138.39 1zkn h PRO 379 Ca 0.13 -0.07 -0.01 0.00 0.11 0.00 0.00 66.00 66.15 1zkn h PRO 379 Cb 0.41 -0.28 0.00 0.00 0.11 0.00 0.00 31.00 31.24 1zkn h PRO 379 CO 0.01 0.82 -0.13 1.25 -0.21 0.00 0.00 178.00 179.74 1zkn h LEU 380 N 1.28 -0.31 -1.21 2.35 5.85 -1.22 -2.81 115.31 119.24 1zkn h LEU 380 Ca 0.38 -0.20 -0.07 0.00 0.84 0.00 0.00 57.88 58.83 1zkn h LEU 380 Cb -0.05 0.08 -0.01 0.00 0.37 0.00 0.00 40.66 41.05 1zkn h LEU 380 CO -0.11 0.07 -0.22 -0.50 -0.34 0.00 0.00 178.44 177.34 1zkn h TRP 381 N -0.75 0.29 -0.52 1.25 4.06 -1.10 -0.67 115.95 118.50 1zkn h TRP 381 Ca -0.04 -0.05 -0.09 0.00 2.06 0.00 0.00 58.89 60.78 1zkn h TRP 381 Cb 0.50 -0.08 -0.02 0.00 -1.00 0.00 0.00 29.16 28.56 1zkn h TRP 381 CO 0.03 0.48 -0.02 1.49 -3.56 0.00 0.00 178.44 176.86 1zkn h GLU 382 N 0.24 0.91 -0.10 0.49 4.81 -0.94 0.72 114.58 120.71 1zkn h GLU 382 Ca 0.04 -0.27 -0.15 0.00 -0.13 0.00 0.00 59.36 58.85 1zkn h GLU 382 Cb 0.54 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 29.82 1zkn h GLU 382 CO 0.04 0.91 -0.59 1.15 -0.73 0.00 0.00 179.01 179.79 1zkn h THR 383 N 0.83 1.37 -0.03 0.32 2.02 -1.17 -1.62 112.91 114.64 1zkn h THR 383 Ca 0.15 -1.92 -0.25 0.00 0.77 0.00 0.00 66.41 65.16 1zkn h THR 383 Cb 0.53 1.94 0.01 0.00 -1.74 0.00 0.00 68.15 68.89 1zkn h THR 383 CO 0.03 0.57 -0.97 -0.25 0.37 0.00 0.00 175.52 175.28 1zkn h TRP 384 N 0.24 0.94 -0.70 3.16 2.91 -0.64 -1.94 115.95 119.92 1zkn h TRP 384 Ca -0.00 -0.49 0.01 0.00 1.13 0.00 0.00 58.89 59.54 1zkn h TRP 384 Cb 1.10 -0.11 -0.04 0.00 -0.51 0.00 0.00 29.16 29.60 1zkn h TRP 384 CO 0.03 1.32 0.46 0.00 -1.03 0.00 0.00 178.44 179.22 1zkn h ALA 385 N 0.53 1.52 -0.17 2.65 0.00 0.57 -1.66 119.26 122.69 1zkn h ALA 385 Ca -0.10 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.73 1zkn h ALA 385 Cb 1.61 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 19.12 1zkn h ALA 385 CO 0.19 0.44 -0.02 -0.44 0.00 0.00 0.00 179.25 179.42 1zkn h ASP 386 N 0.93 0.31 -0.61 0.00 5.19 -1.17 0.20 116.42 121.27 1zkn h ASP 386 Ca 0.26 -0.33 0.08 0.00 -0.62 0.00 0.00 57.03 56.41 1zkn h ASP 386 Cb -0.08 -0.08 -0.06 0.00 0.18 0.00 0.00 39.33 39.28 1zkn h ASP 386 CO -0.06 0.57 0.28 0.25 -3.12 0.00 0.00 179.24 177.16 1zkn h LEU 387 N 0.04 0.35 -3.28 1.55 5.85 -0.54 -2.43 115.31 116.84 1zkn h LEU 387 Ca 0.05 0.06 0.00 0.00 0.84 0.00 0.00 57.88 58.82 1zkn h LEU 387 Cb 0.42 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.45 1zkn h LEU 387 CO 0.01 0.22 0.00 1.33 -0.34 0.00 0.00 178.44 179.66 1zkn n VAL 388 N -4.92 2.17 -1.50 1.05 0.24 -0.70 -5.00 118.33 109.68 1zkn n VAL 388 Ca 0.08 -1.43 -0.55 0.00 -2.04 0.00 0.00 64.34 60.41 1zkn n VAL 388 Cb 0.23 -0.06 -0.06 0.00 -1.47 0.00 0.00 33.84 32.47 1zkn n VAL 388 CO 0.00 0.00 0.00 1.57 -2.14 0.00 0.00 176.83 176.26 1zkn n HIS 389 N 0.49 0.54 -1.14 6.34 -0.00 0.68 -1.42 115.22 120.71 1zkn n HIS 389 Ca 0.24 0.96 -0.01 0.00 -0.00 0.00 0.00 57.72 58.91 1zkn n HIS 389 Cb 0.95 -2.11 0.26 0.00 -0.00 0.00 0.00 29.99 29.09 1zkn n HIS 389 CO 0.00 0.00 0.00 -0.35 -0.00 0.00 0.00 176.34 175.99 1zkn n PRO 390 N 1.50 2.89 0.02 1.57 -0.04 -1.26 -4.99 135.00 134.70 1zkn n PRO 390 Ca 0.19 -3.03 0.18 0.00 -0.04 0.00 0.00 63.50 60.80 1zkn n PRO 390 Cb 0.15 -1.98 0.66 0.00 -0.04 0.00 0.00 33.50 32.29 1zkn n PRO 390 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 1zkn h ASP 391 N 1.86 0.05 -0.47 3.54 3.32 -1.53 -2.02 116.42 121.17 1zkn h ASP 391 Ca 0.17 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.23 1zkn h ASP 391 Cb 1.86 -0.01 0.00 0.00 0.22 0.00 0.00 39.33 41.41 1zkn h ASP 391 CO 0.48 0.03 0.00 0.00 -1.72 0.00 0.00 179.24 178.03 1zkn n ALA 392 N -2.61 3.44 0.06 3.45 0.00 -1.26 -4.55 120.51 119.03 1zkn n ALA 392 Ca 0.08 -1.44 -0.13 0.00 0.00 0.00 0.00 53.44 51.96 1zkn n ALA 392 Cb 0.51 -1.08 -0.08 0.00 0.00 0.00 0.00 19.45 18.80 1zkn n ALA 392 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.50 177.87 1zkn h GLN 393 N 3.16 -0.08 -0.45 0.00 5.75 -1.71 -2.06 115.11 119.72 1zkn h GLN 393 Ca 0.00 0.01 0.02 0.00 -0.15 0.00 0.00 58.65 58.52 1zkn h GLN 393 Cb 1.55 0.02 -0.03 0.00 1.07 0.00 0.00 27.48 30.09 1zkn h GLN 393 CO 0.34 0.01 0.27 -0.44 -2.65 0.00 0.00 178.83 176.36 1zkn h ASP 394 N -0.15 0.44 -0.66 -0.69 3.32 -1.84 -1.23 116.42 115.61 1zkn h ASP 394 Ca -0.01 0.00 0.07 0.00 0.02 0.00 0.00 57.03 57.12 1zkn h ASP 394 Cb 0.12 -0.09 -0.06 0.00 0.22 0.00 0.00 39.33 39.52 1zkn h ASP 394 CO 0.01 0.31 0.34 0.40 -1.72 0.00 0.00 179.24 178.59 1zkn h ILE 395 N 0.54 0.91 -0.52 0.35 2.04 -1.85 -0.70 117.51 118.27 1zkn h ILE 395 Ca 0.18 -0.21 -0.09 0.00 1.00 0.00 0.00 64.86 65.74 1zkn h ILE 395 Cb 0.01 0.24 -0.02 0.00 -0.74 0.00 0.00 36.82 36.31 1zkn h ILE 395 CO -0.08 0.11 -0.01 0.25 0.00 0.00 0.00 178.15 178.42 1zkn h LEU 396 N 0.61 0.92 -0.90 1.44 5.85 -1.00 -1.66 115.31 120.57 1zkn h LEU 396 Ca 0.31 -0.31 -0.02 0.00 0.84 0.00 0.00 57.88 58.70 1zkn h LEU 396 Cb 0.26 -0.25 -0.04 0.00 0.37 0.00 0.00 40.66 41.00 1zkn h LEU 396 CO -0.22 1.01 0.48 0.44 -0.34 0.00 0.00 178.44 179.81 1zkn h ASP 397 N 0.81 1.13 -0.61 1.25 3.32 -0.55 -0.94 116.42 120.83 1zkn h ASP 397 Ca 0.15 -0.11 -0.09 0.00 0.02 0.00 0.00 57.03 57.00 1zkn h ASP 397 Cb 0.55 -0.29 -0.02 0.00 0.22 0.00 0.00 39.33 39.79 1zkn h ASP 397 CO 0.03 0.92 0.02 0.74 -1.72 0.00 0.00 179.24 179.22 1zkn h THR 398 N 1.26 1.27 0.18 0.35 2.02 -0.94 -1.37 112.91 115.68 1zkn h THR 398 Ca 0.32 -1.13 -0.01 0.00 0.77 0.00 0.00 66.41 66.35 1zkn h THR 398 Cb 0.04 0.79 0.00 0.00 -1.74 0.00 0.00 68.15 67.24 1zkn h THR 398 CO -0.05 0.41 -0.08 0.25 0.37 0.00 0.00 175.52 176.42 1zkn h LEU 399 N 0.96 -0.20 -1.39 2.58 5.85 -0.70 -0.87 115.31 121.53 1zkn h LEU 399 Ca 0.17 0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.89 1zkn h LEU 399 Cb 0.54 0.05 -0.03 0.00 0.37 0.00 0.00 40.66 41.60 1zkn h LEU 399 CO 0.03 -0.14 0.28 -0.33 -0.34 0.00 0.00 178.44 177.94 1zkn h GLU 400 N -0.24 0.69 -0.44 1.25 5.08 -1.10 -0.17 114.58 119.66 1zkn h GLU 400 Ca -0.02 -0.07 -0.12 0.00 -1.00 0.00 0.00 59.36 58.15 1zkn h GLU 400 Cb 0.18 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.28 1zkn h GLU 400 CO 0.04 0.51 -0.19 -0.44 -1.00 0.00 0.00 179.01 177.93 1zkn h ASP 401 N 0.70 0.92 -0.25 1.42 5.19 -0.93 -1.31 116.42 122.17 1zkn h ASP 401 Ca 0.18 -0.40 -0.11 0.00 -0.62 0.00 0.00 57.03 56.09 1zkn h ASP 401 Cb 0.02 -0.25 -0.01 0.00 0.18 0.00 0.00 39.33 39.26 1zkn h ASP 401 CO -0.03 1.11 -0.23 0.78 -3.12 0.00 0.00 179.24 177.75 1zkn h ASN 402 N 0.73 0.73 -0.27 6.45 2.35 -0.60 -0.81 115.58 124.15 1zkn h ASN 402 Ca 0.10 -0.26 0.01 0.00 -0.55 0.00 0.00 56.30 55.60 1zkn h ASN 402 Cb 0.75 -0.20 -0.02 0.00 0.05 0.00 0.00 38.32 38.91 1zkn h ASN 402 CO 0.06 0.94 0.17 -0.09 -1.65 0.00 0.00 177.43 176.85 1zkn h ARG 403 N 0.63 0.33 -0.41 0.81 1.12 -0.82 -0.77 114.38 115.27 1zkn h ARG 403 Ca 0.09 -0.02 -0.09 0.00 -1.11 0.00 0.00 59.98 58.85 1zkn h ARG 403 Cb 0.72 -0.07 -0.02 0.00 -0.01 0.00 0.00 29.97 30.59 1zkn h ARG 403 CO 0.06 0.22 -0.11 1.49 -3.11 0.00 0.00 179.97 178.51 1zkn h GLU 404 N 0.34 0.73 0.12 0.20 4.57 -1.02 -1.49 114.58 118.02 1zkn h GLU 404 Ca 0.10 -0.24 0.00 0.00 -1.18 0.00 0.00 59.36 58.05 1zkn h GLU 404 Cb -0.02 -0.06 -0.01 0.00 -0.16 0.00 0.00 28.75 28.50 1zkn h GLU 404 CO -0.04 0.82 -0.10 2.35 -1.18 0.00 0.00 179.01 180.86 1zkn h TRP 405 N 0.66 -0.25 -0.08 0.92 7.01 -0.52 -1.26 115.95 122.43 1zkn h TRP 405 Ca 0.11 -0.00 -0.01 0.00 2.11 0.00 0.00 58.89 61.10 1zkn h TRP 405 Cb 0.57 0.09 -0.01 0.00 -2.10 0.00 0.00 29.16 27.72 1zkn h TRP 405 CO 0.03 -0.15 -0.02 1.88 -2.79 0.00 0.00 178.44 177.39 1zkn h TYR 406 N -0.22 0.10 -0.07 2.65 0.05 -1.01 -2.56 116.97 115.91 1zkn h TYR 406 Ca -0.00 -0.00 -0.00 0.00 0.05 0.00 0.00 58.73 58.78 1zkn h TYR 406 Cb 0.21 -0.03 -0.00 0.00 1.01 0.00 0.00 36.73 37.91 1zkn h TYR 406 CO -0.10 0.13 0.04 1.96 -1.05 0.00 0.00 178.16 179.13 1zkn h GLN 407 N 0.10 0.09 0.00 4.88 1.08 -0.24 -2.39 115.11 118.64 1zkn h GLN 407 Ca 0.03 -0.01 0.00 0.00 -1.45 0.00 0.00 58.65 57.22 1zkn h GLN 407 Cb 0.10 -0.02 0.00 0.00 -0.05 0.00 0.00 27.48 27.52 1zkn h GLN 407 CO 0.00 0.11 0.00 -1.13 -0.95 0.00 0.00 178.83 176.86 1zkn n SER 408 N -5.02 0.00 0.04 1.46 3.41 -0.58 -2.70 113.62 110.23 1zkn n SER 408 Ca -0.06 0.25 0.04 0.00 -0.26 0.00 0.00 58.87 58.85 1zkn n SER 408 Cb 0.05 -0.39 -0.08 0.00 -0.26 0.00 0.00 64.21 63.53 1zkn n SER 408 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 1zkn n THR 409 N -1.39 0.85 -1.58 6.66 -2.24 -0.92 -4.89 114.28 110.77 1zkn n THR 409 Ca 0.07 -0.63 -0.48 0.00 -2.27 0.00 0.00 64.05 60.73 1zkn n THR 409 Cb 0.18 -0.48 -0.05 0.00 -2.10 0.00 0.00 70.33 67.88 1zkn n THR 409 CO 0.00 0.00 0.00 -0.38 -0.57 0.00 0.00 175.07 174.12 1zkn n ILE 410 N -2.72 0.38 -2.11 2.28 5.41 -1.06 -4.90 119.36 116.65 1zkn n ILE 410 Ca -0.08 -0.24 -0.41 0.00 1.00 0.00 0.00 62.75 63.02 1zkn n ILE 410 Cb 0.74 -1.93 -0.02 0.00 -0.71 0.00 0.00 39.64 37.71 1zkn n ILE 410 CO 0.00 0.00 0.00 -2.16 0.00 0.00 0.00 176.55 174.39 1zkn s PRO 411 N 5.35 4.34 0.00 0.38 0.04 -1.26 -5.08 135.00 138.77 1zkn s PRO 411 Ca 1.01 2.20 0.08 0.00 0.04 0.00 0.00 61.00 64.33 1zkn s PRO 411 Cb -0.68 -3.11 0.07 0.00 0.04 0.00 0.00 34.50 30.81 1zkn s PRO 411 CO 0.48 -0.27 0.76 1.04 0.04 0.00 0.00 177.00 179.05