#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ukf h LEU 82 N 0.00 1.08 -2.23 2.46 5.85 -1.92 -1.81 115.31 118.75 1ukf h LEU 82 Ca 0.00 -0.10 -0.01 0.00 0.84 0.00 0.00 57.88 58.61 1ukf h LEU 82 Cb 0.00 -0.28 -0.00 0.00 0.37 0.00 0.00 40.66 40.75 1ukf h LEU 82 CO 0.00 0.87 -0.06 0.77 -0.34 0.00 0.00 178.44 179.69 1ukf h SER 83 N 1.21 0.00 0.59 1.25 4.64 -1.98 -1.16 113.55 118.09 1ukf h SER 83 Ca 0.30 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.60 1ukf h SER 83 Cb 0.04 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.12 1ukf h SER 83 CO -0.05 0.06 -0.11 0.44 -0.87 0.00 0.00 176.83 176.30 1ukf h ASP 84 N 0.00 0.00 0.08 4.97 3.32 -1.77 -2.37 116.42 120.65 1ukf h ASP 84 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1ukf h ASP 84 Cb 0.17 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.72 1ukf h ASP 84 CO 0.01 0.11 -0.50 0.49 -1.72 0.00 0.00 179.24 177.62 1ukf n PHE 85 N -3.41 0.00 -2.05 4.55 3.01 -0.45 -4.96 117.46 114.15 1ukf n PHE 85 Ca -0.01 0.00 -0.42 0.00 1.01 0.00 0.00 57.45 58.03 1ukf n PHE 85 Cb 0.28 -0.05 -0.03 0.00 -0.01 0.00 0.00 39.48 39.67 1ukf n PHE 85 CO 0.00 0.00 0.00 0.45 1.01 0.00 0.00 176.76 178.22 1ukf s SER 86 N -2.60 6.70 -0.01 4.37 0.15 -0.90 -0.64 113.70 120.79 1ukf s SER 86 Ca 0.18 2.50 0.03 0.00 0.70 0.00 0.00 55.95 59.35 1ukf s SER 86 Cb 0.18 -2.59 -0.04 0.00 -1.71 0.00 0.00 66.02 61.85 1ukf s SER 86 CO 0.61 -0.73 0.05 1.33 1.20 0.00 0.00 173.24 175.71 1ukf n VAL 87 N 3.71 0.05 -3.22 4.45 0.24 -0.39 -4.88 118.33 118.29 1ukf n VAL 87 Ca 0.12 -0.08 -0.01 0.00 -2.04 0.00 0.00 64.34 62.33 1ukf n VAL 87 Cb 0.40 0.07 -0.02 0.00 -1.47 0.00 0.00 33.84 32.82 1ukf n VAL 87 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1ukf s ALA 88 N -2.17 -2.09 0.07 2.33 0.00 -0.99 -4.63 121.76 114.28 1ukf s ALA 88 Ca -0.01 0.34 -0.30 0.00 0.00 0.00 0.00 51.96 51.99 1ukf s ALA 88 Cb 0.02 -2.55 -0.05 0.00 0.00 0.00 0.00 23.12 20.53 1ukf s ALA 88 CO 0.12 -2.06 1.15 0.45 0.00 0.00 0.00 175.76 175.42 1ukf s SER 89 N 2.16 7.15 -0.30 0.00 0.15 -1.26 -0.82 113.70 120.78 1ukf s SER 89 Ca 0.14 1.97 -0.16 0.00 0.70 0.00 0.00 55.95 58.60 1ukf s SER 89 Cb -0.08 -2.58 0.17 0.00 -1.71 0.00 0.00 66.02 61.83 1ukf s SER 89 CO -0.14 -0.40 1.07 -0.60 1.20 0.00 0.00 173.24 174.37 1ukf s ARG 90 N 0.84 0.22 -0.60 5.44 6.06 0.63 -4.93 118.95 126.61 1ukf s ARG 90 Ca 0.56 0.54 -0.22 0.00 -2.50 0.00 0.00 55.73 54.12 1ukf s ARG 90 Cb -0.28 0.33 0.07 0.00 0.06 0.00 0.00 34.95 35.12 1ukf s ARG 90 CO 0.30 -0.09 0.85 0.34 -2.50 0.00 0.00 175.30 174.20 1ukf s ASP 91 N 2.38 6.22 -0.07 -2.12 -1.08 -1.26 -2.29 116.67 118.45 1ukf s ASP 91 Ca -0.02 -0.93 0.13 0.00 -0.52 0.00 0.00 52.55 51.21 1ukf s ASP 91 Cb -0.05 -2.38 0.41 0.00 -1.46 0.00 0.00 42.92 39.44 1ukf s ASP 91 CO -0.17 -1.24 1.33 1.33 0.52 0.00 0.00 175.17 176.94 1ukf n VAL 92 N 5.85 1.48 -1.20 1.11 0.24 -0.33 -4.65 118.33 120.84 1ukf n VAL 92 Ca -0.04 -1.31 -0.05 0.00 -2.04 0.00 0.00 64.34 60.90 1ukf n VAL 92 Cb 0.45 0.22 0.24 0.00 -1.47 0.00 0.00 33.84 33.29 1ukf n VAL 92 CO 0.00 0.00 0.00 -3.20 -2.14 0.00 0.00 176.83 171.49 1ukf n ASN 93 N 0.21 3.68 0.18 -1.34 5.15 -0.97 -4.64 115.26 117.53 1ukf n ASN 93 Ca 0.16 -3.42 0.13 0.00 -0.60 0.00 0.00 54.58 50.85 1ukf n ASN 93 Cb 0.61 -0.68 0.69 0.00 -0.53 0.00 0.00 39.78 39.87 1ukf n ASN 93 CO 0.00 0.00 0.00 -0.74 1.40 0.00 0.00 177.26 177.92 1ukf h HIS 94 N 1.67 0.00 -0.35 1.20 -0.00 -1.89 -1.29 115.15 114.49 1ukf h HIS 94 Ca 0.25 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.62 1ukf h HIS 94 Cb 1.99 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 29.40 1ukf h HIS 94 CO 1.07 0.00 0.00 0.09 -0.00 0.00 0.00 177.93 179.09 1ukf n ASN 95 N -4.38 1.96 -3.65 3.26 3.02 -1.26 -4.96 115.26 109.24 1ukf n ASN 95 Ca 0.01 -1.97 -0.28 0.00 -0.03 0.00 0.00 54.58 52.32 1ukf n ASN 95 Cb 0.26 -0.23 0.04 0.00 -0.61 0.00 0.00 39.78 39.24 1ukf n ASN 95 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1ukf n ASN 96 N 0.56 -4.60 -2.49 6.41 3.02 -0.49 -4.92 115.26 112.75 1ukf n ASN 96 Ca 0.13 -0.95 -0.15 0.00 -0.03 0.00 0.00 54.58 53.58 1ukf n ASN 96 Cb 0.32 -3.68 0.03 0.00 -0.61 0.00 0.00 39.78 35.84 1ukf n ASN 96 CO 0.00 0.00 0.00 2.30 -2.62 0.00 0.00 177.26 176.94 1ukf n ILE 97 N -4.09 1.82 -0.17 2.41 -5.35 -1.26 -4.95 119.36 107.77 1ukf n ILE 97 Ca -0.13 -3.78 -0.03 0.00 -0.27 0.00 0.00 62.75 58.54 1ukf n ILE 97 Cb 0.61 -0.12 0.07 0.00 -1.74 0.00 0.00 39.64 38.47 1ukf n ILE 97 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1ukf h ALA 99 N 1.34 0.76 -0.30 0.00 0.00 -1.92 0.61 119.26 119.74 1ukf h ALA 99 Ca 0.25 -0.13 -0.03 0.00 0.00 0.00 0.00 54.91 55.00 1ukf h ALA 99 Cb 0.26 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 1ukf h ALA 99 CO -0.24 0.32 0.05 0.78 0.00 0.00 0.00 179.25 180.17 1ukf h GLY 100 N 0.80 0.54 1.03 0.00 0.00 -1.66 -1.34 103.07 102.43 1ukf h GLY 100 Ca 0.20 -0.35 -0.05 0.00 0.00 0.00 0.00 47.33 47.13 1ukf h GLY 100 CO -0.03 0.33 0.21 1.41 0.00 0.00 0.00 176.54 178.46 1ukf h LEU 101 N 0.33 0.95 -0.84 3.11 3.38 -0.99 -0.93 115.31 120.32 1ukf h LEU 101 Ca 0.09 -0.21 -0.06 0.00 0.09 0.00 0.00 57.88 57.80 1ukf h LEU 101 Cb 0.33 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.80 1ukf h LEU 101 CO 0.00 0.91 0.23 0.28 0.09 0.00 0.00 178.44 179.95 1ukf h SER 102 N 0.95 1.02 -0.26 -0.43 0.02 -0.78 -0.10 113.55 113.96 1ukf h SER 102 Ca 0.21 -0.18 -0.16 0.00 -0.84 0.00 0.00 61.79 60.82 1ukf h SER 102 Cb 0.29 -0.27 -0.01 0.00 0.14 0.00 0.00 62.40 62.56 1ukf h SER 102 CO -0.01 0.94 -0.42 0.74 -1.14 0.00 0.00 176.83 176.94 1ukf h THR 103 N 1.05 1.28 -0.81 -2.27 2.02 -1.01 -1.24 112.91 111.93 1ukf h THR 103 Ca 0.23 -1.60 -0.03 0.00 0.77 0.00 0.00 66.41 65.77 1ukf h THR 103 Cb 0.29 1.48 -0.04 0.00 -1.74 0.00 0.00 68.15 68.14 1ukf h THR 103 CO -0.01 0.53 0.38 -0.08 0.37 0.00 0.00 175.52 176.71 1ukf h GLU 104 N 0.66 1.18 -0.67 6.66 4.57 -0.82 -1.40 114.58 124.77 1ukf h GLU 104 Ca 0.05 -0.18 -0.02 0.00 -1.18 0.00 0.00 59.36 58.02 1ukf h GLU 104 Cb 1.00 -0.21 -0.03 0.00 -0.16 0.00 0.00 28.75 29.35 1ukf h GLU 104 CO 0.10 0.92 0.33 2.35 -1.18 0.00 0.00 179.01 181.52 1ukf h TRP 105 N 1.16 0.96 -0.86 0.92 7.01 -0.77 -2.37 115.95 122.00 1ukf h TRP 105 Ca 0.28 -0.04 0.03 0.00 2.11 0.00 0.00 58.89 61.27 1ukf h TRP 105 Cb 0.14 -0.30 -0.05 0.00 -2.10 0.00 0.00 29.16 26.85 1ukf h TRP 105 CO 0.01 0.72 0.55 -0.07 -2.79 0.00 0.00 178.44 176.87 1ukf h LEU 106 N 0.93 0.92 -0.83 0.65 3.38 -0.51 0.35 115.31 120.20 1ukf h LEU 106 Ca 0.23 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.19 1ukf h LEU 106 Cb 0.11 -0.21 -0.04 0.00 0.09 0.00 0.00 40.66 40.61 1ukf h LEU 106 CO -0.03 0.63 0.48 0.58 0.09 0.00 0.00 178.44 180.19 1ukf h VAL 107 N 1.08 1.24 -0.27 1.22 2.07 -0.79 -3.18 116.25 117.62 1ukf h VAL 107 Ca 0.34 -0.55 -0.18 0.00 0.82 0.00 0.00 66.70 67.13 1ukf h VAL 107 Cb 0.00 0.10 -0.12 0.00 -1.52 0.00 0.00 31.29 29.75 1ukf h VAL 107 CO -0.12 0.26 -0.43 1.15 0.02 0.00 0.00 177.57 178.45 1ukf n MET 108 N -4.42 2.10 0.31 1.57 0.00 -0.96 -4.75 117.12 110.97 1ukf n MET 108 Ca 0.08 -3.46 0.20 0.00 0.00 0.00 0.00 57.70 54.52 1ukf n MET 108 Cb 0.07 -1.83 1.00 0.00 0.00 0.00 0.00 33.22 32.46 1ukf n MET 108 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 175.97 176.63 1ukf h SER 109 N 1.27 0.00 -0.06 3.17 4.64 -0.29 -2.27 113.55 120.01 1ukf h SER 109 Ca 0.15 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.47 1ukf h SER 109 Cb 1.27 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.36 1ukf h SER 109 CO 0.30 0.01 0.00 -1.54 -0.87 0.00 0.00 176.83 174.73 1ukf n SER 110 N -3.13 3.01 -4.80 4.97 3.41 -1.26 -4.95 113.62 110.87 1ukf n SER 110 Ca -0.02 -1.98 -0.38 0.00 -0.26 0.00 0.00 58.87 56.23 1ukf n SER 110 Cb 0.17 -0.02 -0.06 0.00 -0.26 0.00 0.00 64.21 64.04 1ukf n SER 110 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 1ukf s ASP 111 N -1.93 6.92 0.86 4.04 1.01 -0.86 -4.94 116.67 121.78 1ukf s ASP 111 Ca 0.28 1.10 0.00 0.00 0.71 0.00 0.00 52.55 54.64 1ukf s ASP 111 Cb 0.20 -2.32 0.00 0.00 1.01 0.00 0.00 42.92 41.81 1ukf s ASP 111 CO 0.30 0.23 0.00 0.61 0.21 0.00 0.00 175.17 176.52 1ukf n GLY 112 N 2.06 2.12 3.67 0.21 0.00 -1.26 -4.67 105.19 107.33 1ukf n GLY 112 Ca -0.10 -0.44 -0.30 0.00 0.00 0.00 0.00 46.02 45.17 1ukf n GLY 112 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1ukf s ASP 113 N -4.00 3.67 0.22 1.61 1.47 -1.26 -5.00 116.67 113.39 1ukf s ASP 113 Ca 0.00 -1.64 -0.07 0.00 1.18 0.00 0.00 52.55 52.02 1ukf s ASP 113 Cb 0.00 0.45 0.34 0.00 -0.34 0.00 0.00 42.92 43.36 1ukf s ASP 113 CO 0.00 -0.85 1.76 0.00 0.68 0.00 0.00 175.17 176.76 1ukf h ALA 114 N 1.53 0.93 -0.38 2.11 0.00 -1.90 -0.92 119.26 120.62 1ukf h ALA 114 Ca -0.41 0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.57 1ukf h ALA 114 Cb 1.30 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 19.08 1ukf h ALA 114 CO 0.69 -0.13 0.21 0.93 0.00 0.00 0.00 179.25 180.96 1ukf h GLU 115 N 0.51 0.53 -0.02 0.00 4.39 -1.94 -1.34 114.58 116.71 1ukf h GLU 115 Ca 0.35 -0.06 -0.08 0.00 0.34 0.00 0.00 59.36 59.90 1ukf h GLU 115 Cb 0.42 -0.10 -0.01 0.00 -0.10 0.00 0.00 28.75 28.95 1ukf h GLU 115 CO -0.31 0.43 -0.38 0.66 -1.16 0.00 0.00 179.01 178.25 1ukf h SER 116 N 0.49 0.03 -0.33 1.42 4.64 -1.82 -0.44 113.55 117.54 1ukf h SER 116 Ca 0.13 -0.01 -0.15 0.00 -0.47 0.00 0.00 61.79 61.30 1ukf h SER 116 Cb 0.06 -0.01 -0.01 0.00 -0.31 0.00 0.00 62.40 62.13 1ukf h SER 116 CO -0.02 0.41 -0.35 0.03 -0.87 0.00 0.00 176.83 176.04 1ukf h ARG 117 N 0.03 0.87 -0.12 4.77 3.08 -0.77 -1.23 114.38 121.00 1ukf h ARG 117 Ca 0.00 -0.43 -0.15 0.00 0.07 0.00 0.00 59.98 59.47 1ukf h ARG 117 Cb 0.69 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.73 1ukf h ARG 117 CO 0.05 1.08 -0.55 0.52 -1.07 0.00 0.00 179.97 179.99 1ukf h MET 118 N 0.72 0.37 -0.63 0.04 2.86 -0.89 -2.37 114.93 115.04 1ukf h MET 118 Ca 0.07 -0.24 -0.04 0.00 -2.06 0.00 0.00 59.70 57.43 1ukf h MET 118 Cb 0.92 0.03 -0.03 0.00 0.06 0.00 0.00 31.60 32.58 1ukf h MET 118 CO 0.08 0.83 0.21 -0.44 1.06 0.00 0.00 176.91 178.66 1ukf h ASP 119 N 0.29 0.87 -0.66 1.22 3.32 -0.85 0.67 116.42 121.28 1ukf h ASP 119 Ca 0.00 -0.14 -0.03 0.00 0.02 0.00 0.00 57.03 56.88 1ukf h ASP 119 Cb 1.06 -0.23 -0.03 0.00 0.22 0.00 0.00 39.33 40.36 1ukf h ASP 119 CO 0.09 0.81 0.28 -0.74 -1.72 0.00 0.00 179.24 177.96 1ukf h HIS 120 N 0.92 0.99 0.00 4.55 -0.00 -0.94 -3.00 115.15 117.67 1ukf h HIS 120 Ca 0.21 -0.06 0.00 0.00 -0.00 0.00 0.00 60.37 60.51 1ukf h HIS 120 Cb 0.24 -0.30 0.00 0.00 -0.00 0.00 0.00 27.41 27.35 1ukf h HIS 120 CO 0.02 0.76 -0.32 1.28 -0.00 0.00 0.00 177.93 179.67 1ukf n LEU 121 N -4.43 0.39 -4.61 0.26 4.77 -0.92 0.30 117.00 112.76 1ukf n LEU 121 Ca 0.05 0.24 -0.30 0.00 -0.03 0.00 0.00 56.01 55.97 1ukf n LEU 121 Cb 0.16 -0.33 0.20 0.00 -2.33 0.00 0.00 43.42 41.11 1ukf n LEU 121 CO 0.39 0.04 0.61 -0.62 -1.33 0.00 0.00 177.39 176.47 1ukf s ASP 122 N -3.29 2.23 0.49 -1.43 -1.08 0.19 -3.83 116.67 109.96 1ukf s ASP 122 Ca 0.11 1.72 0.22 0.00 -0.52 0.00 0.00 52.55 54.09 1ukf s ASP 122 Cb 0.17 -2.35 1.27 0.00 -1.46 0.00 0.00 42.92 40.55 1ukf s ASP 122 CO 0.64 -3.46 1.96 1.88 0.52 0.00 0.00 175.17 176.71 1ukf h TYR 123 N -2.11 0.18 -0.66 -5.34 -1.99 -1.90 0.23 116.97 105.38 1ukf h TYR 123 Ca -0.53 0.01 0.00 0.00 2.00 0.00 0.00 58.73 60.21 1ukf h TYR 123 Cb 1.30 -0.06 0.00 0.00 2.00 0.00 0.00 36.73 39.97 1ukf h TYR 123 CO 0.38 0.07 0.00 0.27 -0.00 0.00 0.00 178.16 178.88 1ukf n ASN 124 N -4.41 4.29 -4.85 3.88 6.94 -1.26 -4.89 115.26 114.96 1ukf n ASN 124 Ca 0.12 -2.26 -0.25 0.00 -0.02 0.00 0.00 54.58 52.17 1ukf n ASN 124 Cb 0.61 -0.53 -0.05 0.00 -2.36 0.00 0.00 39.78 37.45 1ukf n ASN 124 CO 0.00 0.00 0.00 -0.83 -1.03 0.00 0.00 177.26 175.40 1ukf s GLY 125 N -0.92 1.66 0.44 4.83 0.00 0.07 -5.01 107.32 108.38 1ukf s GLY 125 Ca 0.49 -1.19 0.12 0.00 0.00 0.00 0.00 44.72 44.13 1ukf s GLY 125 CO 0.27 -1.20 2.03 -2.09 0.00 0.00 0.00 173.10 172.11 1ukf h GLU 126 N 2.19 0.41 0.00 2.90 4.57 -1.83 -1.96 114.58 120.85 1ukf h GLU 126 Ca -0.48 -0.02 -0.03 0.00 -1.18 0.00 0.00 59.36 57.65 1ukf h GLU 126 Cb 1.20 -0.09 -0.00 0.00 -0.16 0.00 0.00 28.75 29.70 1ukf h GLU 126 CO 0.64 0.27 -0.13 0.78 -1.18 0.00 0.00 179.01 179.39 1ukf h GLY 127 N 0.42 0.00 0.92 1.92 0.00 -0.45 -0.39 103.07 105.49 1ukf h GLY 127 Ca 0.20 0.00 -0.06 0.00 0.00 0.00 0.00 47.33 47.47 1ukf h GLY 127 CO -0.05 0.00 -0.01 -1.61 0.00 0.00 0.00 176.54 174.87 1ukf h GLN 128 N 0.00 0.64 -0.33 4.80 5.75 -1.32 0.33 115.11 124.97 1ukf h GLN 128 Ca -0.00 -0.21 -0.12 0.00 -0.15 0.00 0.00 58.65 58.17 1ukf h GLN 128 Cb 0.23 -0.05 -0.01 0.00 1.07 0.00 0.00 27.48 28.72 1ukf h GLN 128 CO 0.02 0.76 -0.25 0.77 -2.65 0.00 0.00 178.83 177.48 1ukf h SER 129 N 0.44 0.79 -0.58 -0.69 0.02 -1.49 -0.72 113.55 111.33 1ukf h SER 129 Ca 0.10 -0.44 -0.06 0.00 -0.84 0.00 0.00 61.79 60.55 1ukf h SER 129 Cb 0.48 -0.22 -0.02 0.00 0.14 0.00 0.00 62.40 62.77 1ukf h SER 129 CO 0.02 1.06 0.12 -0.09 -1.14 0.00 0.00 176.83 176.81 1ukf h ARG 130 N 0.52 0.94 -0.77 3.45 9.65 -1.01 -0.97 114.38 126.19 1ukf h ARG 130 Ca 0.06 -0.23 -0.03 0.00 -1.10 0.00 0.00 59.98 58.68 1ukf h ARG 130 Cb 0.81 -0.12 -0.04 0.00 -1.39 0.00 0.00 29.97 29.23 1ukf h ARG 130 CO 0.07 0.88 0.37 0.78 2.80 0.00 0.00 179.97 184.86 1ukf h GLY 131 N 0.84 1.19 1.02 2.80 0.00 -0.24 -0.21 103.07 108.47 1ukf h GLY 131 Ca 0.18 -0.58 -0.05 0.00 0.00 0.00 0.00 47.33 46.88 1ukf h GLY 131 CO 0.01 0.55 0.20 0.23 0.00 0.00 0.00 176.54 177.52 1ukf h SER 132 N 1.10 0.91 -0.57 0.19 0.87 -0.67 0.72 113.55 116.10 1ukf h SER 132 Ca 0.27 -0.21 -0.03 0.00 -1.23 0.00 0.00 61.79 60.59 1ukf h SER 132 Cb 0.11 -0.24 -0.03 0.00 -0.44 0.00 0.00 62.40 61.81 1ukf h SER 132 CO -0.03 0.88 0.26 -0.33 -0.53 0.00 0.00 176.83 177.08 1ukf h GLU 133 N 0.90 0.84 -0.44 2.24 5.08 -0.59 -1.16 114.58 121.46 1ukf h GLU 133 Ca 0.20 -0.13 -0.08 0.00 -1.00 0.00 0.00 59.36 58.35 1ukf h GLU 133 Cb 0.29 -0.15 -0.02 0.00 0.50 0.00 0.00 28.75 29.38 1ukf h GLU 133 CO -0.01 0.70 -0.05 0.00 -1.00 0.00 0.00 179.01 178.65 1ukf h ARG 134 N 0.78 0.75 0.00 2.33 3.08 -0.73 -2.01 114.38 118.58 1ukf h ARG 134 Ca 0.20 -0.22 -0.05 0.00 0.07 0.00 0.00 59.98 59.98 1ukf h ARG 134 Cb 0.15 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 30.11 1ukf h ARG 134 CO -0.02 0.79 -0.25 1.25 -1.07 0.00 0.00 179.97 180.67 1ukf h HIS 135 N 0.69 0.00 -0.15 3.04 2.76 -0.24 -1.03 115.15 120.22 1ukf h HIS 135 Ca 0.13 0.00 -0.11 0.00 -2.20 0.00 0.00 60.37 58.19 1ukf h HIS 135 Cb 0.50 0.00 -0.01 0.00 1.55 0.00 0.00 27.41 29.45 1ukf h HIS 135 CO 0.02 0.25 -0.40 1.96 -1.30 0.00 0.00 177.93 178.46 1ukf h GLN 136 N 0.00 0.33 -0.49 5.26 4.20 -0.50 0.12 115.11 124.03 1ukf h GLN 136 Ca -0.00 -0.16 -0.05 0.00 0.06 0.00 0.00 58.65 58.50 1ukf h GLN 136 Cb 0.47 -0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.23 1ukf h GLN 136 CO 0.03 0.68 0.11 0.28 -0.67 0.00 0.00 178.83 179.27 1ukf h VAL 137 N 0.28 1.24 -0.04 -0.54 2.07 -0.82 0.15 116.25 118.59 1ukf h VAL 137 Ca 0.03 -0.85 0.00 0.00 0.82 0.00 0.00 66.70 66.70 1ukf h VAL 137 Cb 0.83 0.86 -0.00 0.00 -1.52 0.00 0.00 31.29 31.46 1ukf h VAL 137 CO 0.07 0.30 0.01 0.22 0.02 0.00 0.00 177.57 178.19 1ukf h TYR 138 N 0.66 0.02 -0.77 1.57 3.20 -0.83 -1.63 116.97 119.20 1ukf h TYR 138 Ca 0.15 0.00 -0.02 0.00 3.14 0.00 0.00 58.73 62.00 1ukf h TYR 138 Cb 0.33 -0.00 -0.04 0.00 1.54 0.00 0.00 36.73 38.56 1ukf h TYR 138 CO 0.02 0.01 0.40 -0.91 -1.64 0.00 0.00 178.16 176.05 1ukf h ASN 139 N 0.03 0.98 -0.47 -2.11 2.35 -0.53 -0.16 115.58 115.66 1ukf h ASN 139 Ca 0.02 -0.11 -0.00 0.00 -0.55 0.00 0.00 56.30 55.65 1ukf h ASN 139 Cb 0.01 -0.25 -0.02 0.00 0.05 0.00 0.00 38.32 38.11 1ukf h ASN 139 CO -0.02 0.81 0.28 0.44 -1.65 0.00 0.00 177.43 177.29 1ukf h ASP 140 N 1.07 0.57 -0.31 5.81 3.32 -0.52 0.58 116.42 126.94 1ukf h ASP 140 Ca 0.27 -0.06 -0.10 0.00 0.02 0.00 0.00 57.03 57.15 1ukf h ASP 140 Cb 0.07 -0.14 -0.02 0.00 0.22 0.00 0.00 39.33 39.46 1ukf h ASP 140 CO -0.04 0.46 -0.16 0.00 -1.72 0.00 0.00 179.24 177.78 1ukf h ALA 141 N 1.13 0.95 -0.23 3.45 0.00 -0.99 -2.07 119.26 121.49 1ukf h ALA 141 Ca 0.17 -0.34 -0.05 0.00 0.00 0.00 0.00 54.91 54.69 1ukf h ALA 141 Cb 0.00 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 1ukf h ALA 141 CO -0.03 0.61 -0.04 1.25 0.00 0.00 0.00 179.25 181.04 1ukf h LEU 142 N 0.68 0.43 -0.72 0.00 5.85 -0.66 -0.91 115.31 119.99 1ukf h LEU 142 Ca 0.11 -0.35 0.02 0.00 0.84 0.00 0.00 57.88 58.50 1ukf h LEU 142 Cb 0.65 -0.12 -0.04 0.00 0.37 0.00 0.00 40.66 41.52 1ukf h LEU 142 CO 0.05 0.68 0.46 0.03 -0.34 0.00 0.00 178.44 179.32 1ukf h ARG 143 N 0.18 0.88 -0.45 1.25 -0.00 -0.79 0.01 114.38 115.46 1ukf h ARG 143 Ca 0.06 -0.05 -0.06 0.00 -0.50 0.00 0.00 59.98 59.43 1ukf h ARG 143 Cb 0.49 -0.20 -0.02 0.00 0.00 0.00 0.00 29.97 30.24 1ukf h ARG 143 CO 0.02 0.58 0.04 0.00 0.00 0.00 0.00 179.97 180.61 1ukf h ALA 144 N 1.29 0.60 -0.69 0.04 0.00 -1.29 -1.20 119.26 118.02 1ukf h ALA 144 Ca 0.28 -0.25 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 1ukf h ALA 144 Cb -0.01 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.58 1ukf h ALA 144 CO -0.10 0.35 0.38 0.00 0.00 0.00 0.00 179.25 179.89 1ukf h ALA 145 N 0.93 0.89 -0.32 0.00 0.00 -0.63 0.10 119.26 120.22 1ukf h ALA 145 Ca 0.13 -0.11 -0.13 0.00 0.00 0.00 0.00 54.91 54.80 1ukf h ALA 145 Cb 0.43 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 1ukf h ALA 145 CO 0.01 0.40 -0.32 -0.07 0.00 0.00 0.00 179.25 179.28 1ukf h LEU 146 N 0.95 0.73 -1.04 0.00 3.38 -0.91 0.59 115.31 119.01 1ukf h LEU 146 Ca 0.24 -0.30 -0.09 0.00 0.09 0.00 0.00 57.88 57.82 1ukf h LEU 146 Cb 0.04 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.57 1ukf h LEU 146 CO -0.04 0.99 -0.33 -1.28 0.09 0.00 0.00 178.44 177.87 1ukf h SER 147 N 0.59 0.27 -0.40 -0.43 0.87 -0.77 -2.72 113.55 110.97 1ukf h SER 147 Ca 0.07 -0.10 0.00 0.00 -1.23 0.00 0.00 61.79 60.53 1ukf h SER 147 Cb 0.83 -0.07 0.00 0.00 -0.44 0.00 0.00 62.40 62.72 1ukf h SER 147 CO 0.07 0.59 0.00 0.59 -0.53 0.00 0.00 176.83 177.55 1ukf n ASN 148 N -4.09 2.15 -3.76 6.23 5.03 -0.02 -4.93 115.26 115.87 1ukf n ASN 148 Ca -0.01 -1.99 -0.25 0.00 0.87 0.00 0.00 54.58 53.21 1ukf n ASN 148 Cb 0.42 -0.26 0.03 0.00 -1.02 0.00 0.00 39.78 38.96 1ukf n ASN 148 CO 0.00 0.00 0.00 0.47 -1.83 0.00 0.00 177.26 175.90 1ukf n ASP 149 N 0.68 -2.76 -4.77 6.41 8.00 -0.94 -4.91 116.55 118.25 1ukf n ASP 149 Ca 0.14 -0.78 -0.40 0.00 0.71 0.00 0.00 54.79 54.45 1ukf n ASP 149 Cb 0.34 -4.08 0.00 0.00 -0.02 0.00 0.00 41.12 37.37 1ukf n ASP 149 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1ukf s ASP 150 N -3.93 6.22 0.30 -2.24 -1.08 0.16 -4.91 116.67 111.18 1ukf s ASP 150 Ca 0.27 2.87 0.08 0.00 -0.52 0.00 0.00 52.55 55.25 1ukf s ASP 150 Cb -0.13 -2.65 0.48 0.00 -1.46 0.00 0.00 42.92 39.15 1ukf s ASP 150 CO 0.81 -0.94 1.70 1.05 0.52 0.00 0.00 175.17 178.32 1ukf h GLU 151 N 2.72 0.16 -2.06 4.34 -0.00 -1.91 -3.34 114.58 114.50 1ukf h GLU 151 Ca -0.50 -0.08 -0.57 0.00 -0.00 0.00 0.00 59.36 58.21 1ukf h GLU 151 Cb 1.25 0.00 -0.40 0.00 -0.00 0.00 0.00 28.75 29.60 1ukf h GLU 151 CO 0.63 0.58 -1.00 0.00 -0.00 0.00 0.00 179.01 179.22 1ukf n ALA 152 N -2.47 2.79 -0.32 1.06 0.00 -1.26 -4.99 120.51 115.32 1ukf n ALA 152 Ca -0.02 -3.69 0.05 0.00 0.00 0.00 0.00 53.44 49.79 1ukf n ALA 152 Cb 0.49 -0.83 0.24 0.00 0.00 0.00 0.00 19.45 19.36 1ukf n ALA 152 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1ukf h PRO 153 N 4.09 0.99 -0.09 0.00 0.13 -1.90 -1.43 132.00 133.79 1ukf h PRO 153 Ca 0.10 -0.06 -0.18 0.00 -0.87 0.00 0.00 66.00 64.99 1ukf h PRO 153 Cb 0.83 -0.22 -0.01 0.00 0.13 0.00 0.00 31.00 31.74 1ukf h PRO 153 CO 0.54 0.65 -0.71 0.74 -0.23 0.00 0.00 178.00 179.00 1ukf h PHE 154 N 1.02 0.55 -0.54 1.56 -1.00 -1.94 -0.62 116.94 115.97 1ukf h PHE 154 Ca 0.42 -0.24 -0.10 0.00 2.81 0.00 0.00 57.97 60.86 1ukf h PHE 154 Cb 0.29 -0.09 -0.02 0.00 3.61 0.00 0.00 35.95 39.74 1ukf h PHE 154 CO -0.00 0.99 -0.05 0.74 -1.61 0.00 0.00 178.31 178.37 1ukf h PHE 155 N 0.29 1.05 -0.36 -0.55 0.05 -1.90 -0.85 116.94 114.67 1ukf h PHE 155 Ca -0.03 -0.19 -0.04 0.00 3.82 0.00 0.00 57.97 61.54 1ukf h PHE 155 Cb 1.27 -0.27 -0.01 0.00 2.00 0.00 0.00 35.95 38.94 1ukf h PHE 155 CO 0.04 0.97 0.08 1.15 -0.18 0.00 0.00 178.31 180.37 1ukf h THR 156 N 0.87 1.23 -0.39 -1.55 2.02 -1.07 -1.27 112.91 112.75 1ukf h THR 156 Ca 0.15 -0.78 -0.04 0.00 0.77 0.00 0.00 66.41 66.51 1ukf h THR 156 Cb 0.59 1.05 -0.02 0.00 -1.74 0.00 0.00 68.15 68.03 1ukf h THR 156 CO 0.04 0.26 0.09 0.00 0.37 0.00 0.00 175.52 176.28 1ukf h ALA 157 N 0.93 0.51 -0.59 6.16 0.00 -0.93 -0.99 119.26 124.34 1ukf h ALA 157 Ca 0.11 -0.19 -0.06 0.00 0.00 0.00 0.00 54.91 54.77 1ukf h ALA 157 Cb 0.31 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.93 1ukf h ALA 157 CO 0.00 0.19 0.14 0.77 0.00 0.00 0.00 179.25 180.36 1ukf h SER 158 N 0.48 0.87 -0.60 0.00 0.02 -1.11 -2.04 113.55 111.16 1ukf h SER 158 Ca 0.12 -0.16 -0.09 0.00 -0.84 0.00 0.00 61.79 60.81 1ukf h SER 158 Cb 0.32 -0.23 -0.02 0.00 0.14 0.00 0.00 62.40 62.61 1ukf h SER 158 CO 0.00 0.84 0.01 0.74 -1.14 0.00 0.00 176.83 177.29 1ukf h THR 159 N 0.89 1.26 -0.55 -2.27 2.02 -1.01 -2.76 112.91 110.49 1ukf h THR 159 Ca 0.19 -1.13 -0.02 0.00 0.77 0.00 0.00 66.41 66.22 1ukf h THR 159 Cb 0.32 0.78 -0.03 0.00 -1.74 0.00 0.00 68.15 67.48 1ukf h THR 159 CO -0.00 0.41 0.27 0.00 0.37 0.00 0.00 175.52 176.57 1ukf h ALA 160 N 1.03 0.70 -0.25 6.16 0.00 -0.66 -1.36 119.26 124.88 1ukf h ALA 160 Ca 0.18 -0.12 -0.11 0.00 0.00 0.00 0.00 54.91 54.85 1ukf h ALA 160 Cb 0.54 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 1ukf h ALA 160 CO 0.03 0.26 -0.33 -0.24 0.00 0.00 0.00 179.25 178.97 1ukf h VAL 161 N 0.73 1.29 -0.01 0.00 3.04 -1.31 -1.33 116.25 118.67 1ukf h VAL 161 Ca 0.19 -1.43 -0.18 0.00 -1.01 0.00 0.00 66.70 64.26 1ukf h VAL 161 Cb 0.11 1.45 -0.01 0.00 -2.01 0.00 0.00 31.29 30.83 1ukf h VAL 161 CO -0.02 0.45 -0.82 0.16 -1.01 0.00 0.00 177.57 176.32 1ukf h ILE 162 N 0.45 1.49 -0.20 3.17 -0.00 -1.32 -2.91 117.51 118.19 1ukf h ILE 162 Ca 0.05 -2.54 -0.13 0.00 -0.00 0.00 0.00 64.86 62.24 1ukf h ILE 162 Cb 0.79 2.40 -0.01 0.00 -0.00 0.00 0.00 36.82 40.00 1ukf h ILE 162 CO 0.06 0.74 -0.44 -0.33 -0.00 0.00 0.00 178.15 178.18 1ukf h GLU 163 N 0.10 0.49 0.00 0.16 5.08 -1.10 -1.45 114.58 117.86 1ukf h GLU 163 Ca -0.03 -0.26 -0.03 0.00 -1.00 0.00 0.00 59.36 58.04 1ukf h GLU 163 Cb 1.43 0.01 -0.00 0.00 0.50 0.00 0.00 28.75 30.69 1ukf h GLU 163 CO 0.12 0.84 -0.13 0.22 -1.00 0.00 0.00 179.01 179.06 1ukf h ASP 164 N 0.40 0.00 -0.04 1.42 3.58 -1.17 -1.29 116.42 119.31 1ukf h ASP 164 Ca 0.03 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.48 1ukf h ASP 164 Cb 0.93 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.98 1ukf h ASP 164 CO 0.08 0.13 0.00 0.00 -2.88 0.00 0.00 179.24 176.57 1ukf n ALA 165 N -2.46 2.60 -0.20 -0.78 0.00 -0.94 -4.90 120.51 113.83 1ukf n ALA 165 Ca -0.02 -0.33 0.00 0.00 0.00 0.00 0.00 53.44 53.09 1ukf n ALA 165 Cb 0.21 -1.27 0.00 0.00 0.00 0.00 0.00 19.45 18.38 1ukf n ALA 165 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ukf n GLY 166 N 1.04 0.77 3.99 0.00 0.00 -0.49 -5.00 105.19 105.51 1ukf n GLY 166 Ca 0.19 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 46.02 1ukf n GLY 166 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1ukf s PHE 167 N -2.18 2.89 0.02 1.61 0.40 -0.59 -4.61 117.98 115.53 1ukf s PHE 167 Ca 0.00 -0.22 0.01 0.00 -0.60 0.00 0.00 56.93 56.12 1ukf s PHE 167 Cb 0.00 -2.43 -0.02 0.00 0.51 0.00 0.00 43.02 41.08 1ukf s PHE 167 CO 0.00 -0.49 -0.05 -1.54 0.70 0.00 0.00 175.22 173.83 1ukf s SER 168 N -4.34 0.56 0.08 1.36 1.04 -0.15 -3.84 113.70 108.41 1ukf s SER 168 Ca 0.54 -0.41 -0.31 0.00 0.48 0.00 0.00 55.95 56.25 1ukf s SER 168 Cb -0.10 0.03 -0.06 0.00 0.10 0.00 0.00 66.02 65.99 1ukf s SER 168 CO 0.35 -0.17 1.26 -0.76 0.98 0.00 0.00 173.24 174.90 1ukf s LEU 169 N -1.18 4.37 0.08 2.42 1.43 -1.26 -2.08 118.68 122.46 1ukf s LEU 169 Ca -0.09 2.12 0.18 0.00 -1.03 0.00 0.00 54.13 55.31 1ukf s LEU 169 Cb -0.08 -3.58 -0.12 0.00 0.03 0.00 0.00 46.19 42.44 1ukf s LEU 169 CO -0.00 -0.53 0.84 0.54 0.23 0.00 0.00 176.35 177.43 1ukf n ARG 170 N 3.94 0.62 -4.03 1.70 5.12 0.32 -4.95 116.66 119.37 1ukf n ARG 170 Ca 0.10 0.17 -0.10 0.00 -1.93 0.00 0.00 57.85 56.09 1ukf n ARG 170 Cb 0.45 -1.79 -0.07 0.00 -1.16 0.00 0.00 32.46 29.89 1ukf n ARG 170 CO 0.00 0.00 0.00 1.03 -1.93 0.00 0.00 177.63 176.73 1ukf s ARG 171 N -3.05 1.25 0.32 5.56 1.81 -1.26 -5.08 118.95 118.51 1ukf s ARG 171 Ca -0.03 -1.31 -0.29 0.00 -1.72 0.00 0.00 55.73 52.39 1ukf s ARG 171 Cb 0.09 0.37 -0.10 0.00 -0.45 0.00 0.00 34.95 34.86 1ukf s ARG 171 CO 0.81 -0.46 1.32 -2.00 -0.68 0.00 0.00 175.30 174.29 1ukf s GLU 172 N -4.03 4.35 0.21 3.54 2.56 -1.26 -4.69 118.70 119.39 1ukf s GLU 172 Ca 0.24 2.22 -0.32 0.00 0.00 0.00 0.00 54.97 57.10 1ukf s GLU 172 Cb 0.03 -3.08 -0.14 0.00 2.00 0.00 0.00 34.13 32.95 1ukf s GLU 172 CO 0.05 -0.21 1.45 -2.30 -0.56 0.00 0.00 175.26 173.69 1ukf n PRO 173 N 0.96 2.03 -4.09 4.30 -0.02 -1.26 -4.91 135.00 132.01 1ukf n PRO 173 Ca 0.01 0.73 -0.36 0.00 -2.02 0.00 0.00 63.50 61.85 1ukf n PRO 173 Cb 0.42 -2.41 -0.08 0.00 -0.02 0.00 0.00 33.50 31.41 1ukf n PRO 173 CO 0.00 0.00 0.00 0.21 1.98 0.00 0.00 175.50 177.69 1ukf s LYS 174 N -0.01 3.30 -0.23 -0.52 2.20 -0.78 -4.89 119.74 118.82 1ukf s LYS 174 Ca 0.72 -0.26 -0.03 0.00 -0.36 0.00 0.00 55.97 56.04 1ukf s LYS 174 Cb -0.67 -3.03 0.00 0.00 -1.51 0.00 0.00 37.83 32.62 1ukf s LYS 174 CO 0.46 0.71 -0.06 0.99 -0.36 0.00 0.00 175.35 177.09 1ukf s THR 175 N -0.86 3.12 -0.26 3.43 2.01 -1.26 0.30 115.64 122.12 1ukf s THR 175 Ca 0.13 -0.68 -0.07 0.00 0.31 0.00 0.00 61.69 61.39 1ukf s THR 175 Cb -0.12 -2.46 -0.01 0.00 0.01 0.00 0.00 72.50 69.92 1ukf s THR 175 CO 0.03 0.37 0.06 -0.69 -0.69 0.00 0.00 174.62 173.70 1ukf s VAL 176 N 1.42 4.04 0.39 3.82 1.01 -0.06 -4.95 120.40 126.07 1ukf s VAL 176 Ca 0.04 -0.42 -0.15 0.00 0.00 0.00 0.00 61.98 61.46 1ukf s VAL 176 Cb -0.15 -2.96 -0.08 0.00 0.00 0.00 0.00 36.38 33.19 1ukf s VAL 176 CO -0.05 0.25 0.82 -1.00 0.00 0.00 0.00 175.10 175.12 1ukf s HIS 177 N 1.55 3.41 -1.78 5.22 3.76 -1.26 -0.76 115.29 125.43 1ukf s HIS 177 Ca 0.05 1.26 0.00 0.00 -0.15 0.00 0.00 55.06 56.22 1ukf s HIS 177 Cb -0.16 -2.59 0.00 0.00 1.11 0.00 0.00 32.58 30.94 1ukf s HIS 177 CO 0.02 -0.07 0.65 0.00 -0.85 0.00 0.00 174.74 174.49 1ukf n ALA 178 N -0.89 2.20 -1.51 -1.40 0.00 -0.32 -4.84 120.51 113.75 1ukf n ALA 178 Ca 0.04 0.00 -0.43 0.00 0.00 0.00 0.00 53.44 53.06 1ukf n ALA 178 Cb 0.54 -1.00 -0.06 0.00 0.00 0.00 0.00 19.45 18.92 1ukf n ALA 178 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1ukf n SER 179 N -0.36 2.01 0.00 0.00 3.41 -1.26 -4.56 113.62 112.86 1ukf n SER 179 Ca 0.00 -0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 1ukf n SER 179 Cb 0.04 -1.36 0.00 0.00 -0.26 0.00 0.00 64.21 62.63 1ukf n SER 179 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1ukf n GLY 180 N 6.24 -0.70 3.61 5.00 0.00 -1.26 -4.86 105.19 113.22 1ukf n GLY 180 Ca 0.43 -2.21 -0.28 0.00 0.00 0.00 0.00 46.02 43.95 1ukf n GLY 180 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1ukf s GLY 181 N 0.00 1.56 0.51 -0.02 0.00 -1.26 -4.89 107.32 103.22 1ukf s GLY 181 Ca 0.00 -0.29 0.30 0.00 0.00 0.00 0.00 44.72 44.73 1ukf s GLY 181 CO 0.00 0.37 1.86 1.48 0.00 0.00 0.00 173.10 176.81 1ukf h SER 182 N -2.16 0.00 -0.36 1.64 4.64 -1.95 -2.89 113.55 112.47 1ukf h SER 182 Ca -0.57 0.00 -0.15 0.00 -0.47 0.00 0.00 61.79 60.59 1ukf h SER 182 Cb 1.33 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.42 1ukf h SER 182 CO 0.55 0.01 -0.38 0.00 -0.87 0.00 0.00 176.83 176.14 1ukf h ALA 183 N 1.99 0.53 -0.24 5.18 0.00 -1.92 -0.38 119.26 124.42 1ukf h ALA 183 Ca -0.00 -0.45 -0.02 0.00 0.00 0.00 0.00 54.91 54.44 1ukf h ALA 183 Cb 0.67 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.34 1ukf h ALA 183 CO 0.00 0.62 0.06 0.37 0.00 0.00 0.00 179.25 180.31 1ukf h GLN 184 N 0.69 0.37 -0.15 0.00 4.15 -1.88 0.74 115.11 119.03 1ukf h GLN 184 Ca 0.05 -0.09 0.00 0.00 0.77 0.00 0.00 58.65 59.39 1ukf h GLN 184 Cb 0.97 -0.05 -0.01 0.00 0.21 0.00 0.00 27.48 28.61 1ukf h GLN 184 CO 0.09 0.48 0.09 1.25 -1.93 0.00 0.00 178.83 178.81 1ukf h LEU 185 N 0.20 0.17 -1.13 -2.39 5.85 -1.48 -0.66 115.31 115.87 1ukf h LEU 185 Ca 0.07 -0.03 0.02 0.00 0.84 0.00 0.00 57.88 58.78 1ukf h LEU 185 Cb 0.27 -0.04 -0.05 0.00 0.37 0.00 0.00 40.66 41.21 1ukf h LEU 185 CO -0.00 0.15 0.59 1.23 -0.34 0.00 0.00 178.44 180.07 1ukf h GLY 186 N 0.18 1.26 0.81 3.75 0.00 -0.92 -1.35 103.07 106.80 1ukf h GLY 186 Ca 0.05 -0.46 -0.03 0.00 0.00 0.00 0.00 47.33 46.90 1ukf h GLY 186 CO -0.01 0.43 -0.00 -1.61 0.00 0.00 0.00 176.54 175.34 1ukf h GLN 187 N 1.17 0.33 -0.25 4.80 5.75 -0.40 -0.17 115.11 126.35 1ukf h GLN 187 Ca 0.34 -0.11 -0.01 0.00 -0.15 0.00 0.00 58.65 58.72 1ukf h GLN 187 Cb -0.08 -0.03 -0.01 0.00 1.07 0.00 0.00 27.48 28.43 1ukf h GLN 187 CO -0.08 0.54 0.13 1.15 -2.65 0.00 0.00 178.83 177.92 1ukf h THR 188 N 0.08 1.13 -0.60 2.39 2.02 -0.87 -0.93 112.91 116.13 1ukf h THR 188 Ca 0.05 -0.36 -0.06 0.00 0.77 0.00 0.00 66.41 66.81 1ukf h THR 188 Cb 0.40 0.92 -0.02 0.00 -1.74 0.00 0.00 68.15 67.70 1ukf h THR 188 CO 0.01 0.13 0.14 0.58 0.37 0.00 0.00 175.52 176.75 1ukf h VAL 189 N 0.28 1.25 -0.94 3.16 2.07 -1.26 -2.75 116.25 118.07 1ukf h VAL 189 Ca 0.09 -0.92 0.00 0.00 0.82 0.00 0.00 66.70 66.69 1ukf h VAL 189 Cb 0.09 0.70 -0.05 0.00 -1.52 0.00 0.00 31.29 30.51 1ukf h VAL 189 CO -0.01 0.34 0.60 0.00 0.02 0.00 0.00 177.57 178.52 1ukf h ALA 190 N 1.03 1.20 -0.20 1.67 0.00 -0.80 0.76 119.26 122.92 1ukf h ALA 190 Ca 0.19 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 1ukf h ALA 190 Cb 0.36 -0.38 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 1ukf h ALA 190 CO 0.00 0.62 0.07 1.25 0.00 0.00 0.00 179.25 181.20 1ukf h HIS 191 N 1.29 0.27 0.21 0.00 6.17 -0.90 0.31 115.15 122.50 1ukf h HIS 191 Ca 0.34 -0.00 -0.34 0.00 0.71 0.00 0.00 60.37 61.08 1ukf h HIS 191 Cb -0.10 -0.09 0.02 0.00 2.52 0.00 0.00 27.41 29.76 1ukf h HIS 191 CO -0.00 0.23 -1.58 -0.44 0.71 0.00 0.00 177.93 176.86 1ukf h ASP 192 N 0.28 0.69 0.00 3.26 3.32 -0.95 -3.41 116.42 119.61 1ukf h ASP 192 Ca 0.07 -0.85 -0.16 0.00 0.02 0.00 0.00 57.03 56.11 1ukf h ASP 192 Cb 0.08 -0.22 -0.03 0.00 0.22 0.00 0.00 39.33 39.37 1ukf h ASP 192 CO -0.01 1.69 -2.16 1.33 -1.72 0.00 0.00 179.24 178.37 1ukf n VAL 193 N -3.63 0.59 -2.00 -1.35 0.24 0.14 -4.60 118.33 107.72 1ukf n VAL 193 Ca -0.19 -0.65 -0.39 0.00 -2.04 0.00 0.00 64.34 61.07 1ukf n VAL 193 Cb 1.08 -0.20 -0.01 0.00 -1.47 0.00 0.00 33.84 33.25 1ukf n VAL 193 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1ukf n ALA 194 N -2.47 6.73 -3.08 2.33 0.00 0.11 -4.59 120.51 119.54 1ukf n ALA 194 Ca -0.16 -4.04 -0.26 0.00 0.00 0.00 0.00 53.44 48.98 1ukf n ALA 194 Cb 0.82 -2.67 -0.16 0.00 0.00 0.00 0.00 19.45 17.44 1ukf n ALA 194 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1ukf s GLN 195 N -1.47 1.86 0.13 0.00 -1.52 -1.26 -4.90 119.66 112.50 1ukf s GLN 195 Ca 0.53 -0.58 -0.35 0.00 -1.95 0.00 0.00 55.36 53.02 1ukf s GLN 195 Cb 0.20 -1.57 -0.16 0.00 -0.22 0.00 0.00 33.01 31.26 1ukf s GLN 195 CO -0.11 0.18 1.25 0.45 -0.25 0.00 0.00 175.29 176.81 1ukf n SER 196 N 3.36 1.50 0.00 5.90 2.88 -1.26 -1.72 113.62 124.27 1ukf n SER 196 Ca -0.19 1.13 0.00 0.00 -1.33 0.00 0.00 58.87 58.48 1ukf n SER 196 Cb 0.53 -1.20 0.00 0.00 -0.75 0.00 0.00 64.21 62.78 1ukf n SER 196 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1ukf n GLY 197 N 2.28 2.48 3.77 0.46 0.00 0.73 -4.92 105.19 109.99 1ukf n GLY 197 Ca 0.17 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.81 1ukf n GLY 197 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ukf s ARG 198 N -0.36 4.63 0.01 1.61 0.52 -0.70 -4.84 118.95 119.81 1ukf s ARG 198 Ca 0.00 1.30 0.05 0.00 -0.52 0.00 0.00 55.73 56.56 1ukf s ARG 198 Cb 0.00 -3.02 -0.02 0.00 0.52 0.00 0.00 34.95 32.44 1ukf s ARG 198 CO 0.00 0.41 -0.16 0.15 0.02 0.00 0.00 175.30 175.72 1ukf s LYS 199 N -1.65 1.20 -0.00 3.54 1.02 -1.25 -1.09 119.74 121.50 1ukf s LYS 199 Ca 0.45 -0.66 -0.06 0.00 0.02 0.00 0.00 55.97 55.72 1ukf s LYS 199 Cb -0.21 -1.19 0.00 0.00 -0.52 0.00 0.00 37.83 35.91 1ukf s LYS 199 CO 0.26 0.32 0.13 -1.01 -0.92 0.00 0.00 175.35 174.12 1ukf s HIS 200 N -0.54 0.03 -0.15 3.18 3.76 -0.29 -1.18 115.29 120.10 1ukf s HIS 200 Ca 0.05 -0.09 -0.05 0.00 -0.15 0.00 0.00 55.06 54.83 1ukf s HIS 200 Cb -0.07 -0.04 -0.03 0.00 1.11 0.00 0.00 32.58 33.55 1ukf s HIS 200 CO 0.00 -0.25 -0.00 -1.17 -0.85 0.00 0.00 174.74 172.47 1ukf s LEU 201 N -1.17 3.47 0.04 0.89 2.96 -0.58 -1.47 118.68 122.83 1ukf s LEU 201 Ca -0.13 -0.02 0.08 0.00 -0.22 0.00 0.00 54.13 53.84 1ukf s LEU 201 Cb -0.07 -1.84 -0.03 0.00 0.50 0.00 0.00 46.19 44.75 1ukf s LEU 201 CO 0.01 0.20 -0.23 -0.76 -1.32 0.00 0.00 176.35 174.25 1ukf s LEU 202 N 0.18 2.16 -0.10 -0.68 1.43 0.58 -1.03 118.68 121.23 1ukf s LEU 202 Ca 0.00 -0.55 0.04 0.00 -1.03 0.00 0.00 54.13 52.59 1ukf s LEU 202 Cb -0.13 -1.13 -0.00 0.00 0.03 0.00 0.00 46.19 44.96 1ukf s LEU 202 CO 0.02 0.21 -0.23 -0.94 0.23 0.00 0.00 176.35 175.64 1ukf s SER 203 N -1.19 3.17 -0.25 2.29 1.04 -0.35 -0.72 113.70 117.69 1ukf s SER 203 Ca 0.09 -0.54 -0.12 0.00 0.48 0.00 0.00 55.95 55.87 1ukf s SER 203 Cb -0.09 -1.40 -0.05 0.00 0.10 0.00 0.00 66.02 64.58 1ukf s SER 203 CO 0.02 0.16 0.22 -0.76 0.98 0.00 0.00 173.24 173.86 1ukf s LEU 204 N 0.32 4.08 -0.67 2.42 1.43 0.10 -0.89 118.68 125.46 1ukf s LEU 204 Ca -0.18 0.13 -0.15 0.00 -1.03 0.00 0.00 54.13 52.90 1ukf s LEU 204 Cb -0.18 -2.19 0.17 0.00 0.03 0.00 0.00 46.19 44.02 1ukf s LEU 204 CO 0.09 -0.02 0.63 -0.13 0.23 0.00 0.00 176.35 177.15 1ukf s ARG 205 N 1.46 3.27 0.08 1.70 3.00 -0.59 -1.48 118.95 126.38 1ukf s ARG 205 Ca 0.09 -2.02 -0.31 0.00 0.00 0.00 0.00 55.73 53.50 1ukf s ARG 205 Cb -0.15 -4.36 -0.08 0.00 0.00 0.00 0.00 34.95 30.36 1ukf s ARG 205 CO 0.08 -1.33 1.46 -0.06 0.00 0.00 0.00 175.30 175.44 1ukf s PHE 206 N 1.05 2.98 0.40 -0.53 2.99 0.86 -0.81 117.98 124.93 1ukf s PHE 206 Ca 0.10 0.77 0.34 0.00 0.00 0.00 0.00 56.93 58.14 1ukf s PHE 206 Cb -0.21 -3.75 1.27 0.00 0.00 0.00 0.00 43.02 40.33 1ukf s PHE 206 CO -0.02 -2.77 1.21 0.00 -0.00 0.00 0.00 175.22 173.64 1ukf n ALA 207 N 4.61 1.31 -0.80 5.36 0.00 0.47 0.08 120.51 131.55 1ukf n ALA 207 Ca 0.13 0.58 -0.09 0.00 0.00 0.00 0.00 53.44 54.06 1ukf n ALA 207 Cb 0.42 -0.86 -0.04 0.00 0.00 0.00 0.00 19.45 18.97 1ukf n ALA 207 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 1ukf n ASN 208 N -3.80 5.68 0.00 0.00 2.04 -1.26 -4.79 115.26 113.13 1ukf n ASN 208 Ca 0.33 -2.65 0.00 0.00 -0.44 0.00 0.00 54.58 51.83 1ukf n ASN 208 Cb 1.43 -1.19 0.00 0.00 -2.53 0.00 0.00 39.78 37.49 1ukf n ASN 208 CO 0.00 0.00 0.00 1.33 -0.44 0.00 0.00 177.26 178.15 1ukf n VAL 209 N 1.43 0.00 -3.08 3.53 0.24 0.11 -4.89 118.33 115.67 1ukf n VAL 209 Ca 0.21 0.00 -0.37 0.00 -2.04 0.00 0.00 64.34 62.14 1ukf n VAL 209 Cb 0.62 -0.24 -0.06 0.00 -1.47 0.00 0.00 33.84 32.69 1ukf n VAL 209 CO 0.00 0.00 0.00 -1.58 -2.14 0.00 0.00 176.83 173.11 1ukf s GLN 210 N -0.48 4.35 0.32 7.34 0.74 -1.12 -4.87 119.66 125.94 1ukf s GLN 210 Ca 0.00 0.95 0.08 0.00 0.05 0.00 0.00 55.36 56.44 1ukf s GLN 210 Cb 0.00 -3.04 -0.04 0.00 1.10 0.00 0.00 33.01 31.02 1ukf s GLN 210 CO 0.00 0.48 0.12 0.20 -0.55 0.00 0.00 175.29 175.54 1ukf s GLY 211 N -1.42 1.84 -0.25 2.59 0.00 -1.26 -0.10 107.32 108.72 1ukf s GLY 211 Ca 0.39 -1.76 -0.10 0.00 0.00 0.00 0.00 44.72 43.26 1ukf s GLY 211 CO 0.22 -1.72 0.55 -1.58 0.00 0.00 0.00 173.10 170.58 1ukf s HIS 212 N -2.38 -1.04 -0.05 1.90 2.46 -0.55 -4.95 115.29 110.68 1ukf s HIS 212 Ca 0.36 1.92 -0.12 0.00 0.47 0.00 0.00 55.06 57.70 1ukf s HIS 212 Cb -0.04 0.56 -0.05 0.00 -0.13 0.00 0.00 32.58 32.92 1ukf s HIS 212 CO 0.22 -0.55 0.30 0.00 -2.47 0.00 0.00 174.74 172.25 1ukf s ALA 213 N 2.43 3.77 0.29 1.58 0.00 -1.26 0.00 121.76 128.58 1ukf s ALA 213 Ca -0.06 -0.39 0.03 0.00 0.00 0.00 0.00 51.96 51.55 1ukf s ALA 213 Cb -0.10 -2.22 -0.04 0.00 0.00 0.00 0.00 23.12 20.76 1ukf s ALA 213 CO -0.16 0.54 0.18 0.96 0.00 0.00 0.00 175.76 177.27 1ukf s ILE 214 N -1.06 0.21 0.09 0.00 -4.36 0.11 -4.48 121.20 111.70 1ukf s ILE 214 Ca 0.20 -2.00 -0.05 0.00 -0.26 0.00 0.00 60.65 58.54 1ukf s ILE 214 Cb -0.15 -2.51 -0.02 0.00 1.25 0.00 0.00 42.46 41.03 1ukf s ILE 214 CO 0.10 0.00 0.11 0.00 0.24 0.00 0.00 174.94 175.38 1ukf s ALA 215 N -3.68 0.20 0.05 2.27 0.00 -0.41 -0.31 121.76 119.89 1ukf s ALA 215 Ca 0.37 -0.97 -0.18 0.00 0.00 0.00 0.00 51.96 51.18 1ukf s ALA 215 Cb 0.05 0.50 0.04 0.00 0.00 0.00 0.00 23.12 23.71 1ukf s ALA 215 CO 0.18 -0.47 0.42 0.00 0.00 0.00 0.00 175.76 175.89 1ukf s SER 217 N -2.09 -0.26 -0.30 0.00 0.15 -0.12 -1.13 113.70 109.93 1ukf s SER 217 Ca -0.04 0.52 -0.05 0.00 0.70 0.00 0.00 55.95 57.07 1ukf s SER 217 Cb -0.00 0.44 0.03 0.00 -1.71 0.00 0.00 66.02 64.77 1ukf s SER 217 CO -0.03 -0.14 0.06 0.00 1.20 0.00 0.00 173.24 174.32 1ukf s GLU 219 N 1.42 2.57 7.91 0.00 2.02 0.55 -0.19 118.70 132.98 1ukf s GLU 219 Ca 0.00 -2.03 0.00 0.00 0.02 0.00 0.00 54.97 52.96 1ukf s GLU 219 Cb -0.18 -3.90 0.00 0.00 0.10 0.00 0.00 34.13 30.15 1ukf s GLU 219 CO 0.01 -1.19 0.00 0.41 0.02 0.00 0.00 175.26 174.51 1ukf n GLY 220 N 4.43 3.73 0.02 -1.39 0.00 -1.26 -1.35 105.19 109.37 1ukf n GLY 220 Ca -0.01 -0.03 0.13 0.00 0.00 0.00 0.00 46.02 46.11 1ukf n GLY 220 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1ukf n SER 221 N 8.31 0.41 -4.58 1.61 2.88 -1.26 -4.37 113.62 116.62 1ukf n SER 221 Ca 0.00 0.12 -0.41 0.00 -1.33 0.00 0.00 58.87 57.24 1ukf n SER 221 Cb 0.00 -0.08 -0.07 0.00 -0.75 0.00 0.00 64.21 63.31 1ukf n SER 221 CO 0.00 0.00 0.00 -1.58 -1.23 0.00 0.00 175.04 172.23 1ukf s GLN 222 N -3.04 3.78 -0.26 -1.46 0.74 -0.46 -2.07 119.66 116.89 1ukf s GLN 222 Ca 0.11 0.13 -0.10 0.00 0.05 0.00 0.00 55.36 55.55 1ukf s GLN 222 Cb 0.17 -3.77 -0.05 0.00 1.10 0.00 0.00 33.01 30.46 1ukf s GLN 222 CO 0.64 -0.63 0.16 0.12 -0.55 0.00 0.00 175.29 175.03 1ukf s PHE 223 N 2.59 3.22 -0.09 1.67 5.36 0.27 -0.33 117.98 130.68 1ukf s PHE 223 Ca 0.23 0.05 0.01 0.00 -0.96 0.00 0.00 56.93 56.26 1ukf s PHE 223 Cb -0.15 -2.31 -0.03 0.00 -0.34 0.00 0.00 43.02 40.19 1ukf s PHE 223 CO 0.13 -0.13 -0.09 0.15 -1.46 0.00 0.00 175.22 173.82 1ukf s LYS 224 N 1.50 2.93 -0.03 10.12 1.02 0.19 -1.35 119.74 134.12 1ukf s LYS 224 Ca 0.07 -0.61 0.01 0.00 0.02 0.00 0.00 55.97 55.46 1ukf s LYS 224 Cb -0.15 -2.59 0.02 0.00 -0.52 0.00 0.00 37.83 34.59 1ukf s LYS 224 CO 0.08 0.52 -0.04 -1.17 -0.92 0.00 0.00 175.35 173.82 1ukf s LEU 225 N -0.42 1.50 -0.13 3.17 0.20 0.04 -0.95 118.68 122.09 1ukf s LEU 225 Ca 0.06 -0.09 0.02 0.00 0.69 0.00 0.00 54.13 54.81 1ukf s LEU 225 Cb -0.12 -0.34 0.01 0.00 -0.43 0.00 0.00 46.19 45.31 1ukf s LEU 225 CO 0.02 -0.03 -0.21 0.12 -0.29 0.00 0.00 176.35 175.97 1ukf s PHE 226 N 0.61 2.52 -0.23 5.38 5.36 0.50 -0.01 117.98 132.12 1ukf s PHE 226 Ca -0.07 -1.26 0.02 0.00 -0.96 0.00 0.00 56.93 54.65 1ukf s PHE 226 Cb -0.11 -1.73 0.04 0.00 -0.34 0.00 0.00 43.02 40.88 1ukf s PHE 226 CO -0.00 -0.58 -0.14 0.34 -1.46 0.00 0.00 175.22 173.38 1ukf s ASP 227 N 0.85 3.93 0.54 6.13 -1.08 -0.41 -1.29 116.67 125.35 1ukf s ASP 227 Ca -0.07 -1.03 0.35 0.00 -0.52 0.00 0.00 52.55 51.28 1ukf s ASP 227 Cb -0.15 -1.54 1.53 0.00 -1.46 0.00 0.00 42.92 41.29 1ukf s ASP 227 CO -0.02 -0.11 1.83 -0.65 0.52 0.00 0.00 175.17 176.74 1ukf h PRO 228 N 7.87 0.00 0.00 4.34 0.11 -1.83 0.23 132.00 142.72 1ukf h PRO 228 Ca -0.31 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.77 1ukf h PRO 228 Cb 1.09 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.20 1ukf h PRO 228 CO 0.55 0.00 -0.11 -0.91 -0.21 0.00 0.00 178.00 177.32 1ukf h ASN 229 N 0.00 0.00 0.00 -2.05 2.35 -1.92 -0.75 115.58 113.20 1ukf h ASN 229 Ca 0.51 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.26 1ukf h ASN 229 Cb 2.08 0.00 0.00 0.00 0.05 0.00 0.00 38.32 40.45 1ukf h ASN 229 CO -0.01 0.11 -0.89 0.18 -1.65 0.00 0.00 177.43 175.17 1ukf n LEU 230 N -3.14 2.09 0.00 1.61 4.77 0.17 -4.23 117.00 118.27 1ukf n LEU 230 Ca 0.03 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.01 1ukf n LEU 230 Cb 0.54 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.63 1ukf n LEU 230 CO 0.34 0.35 0.00 0.61 -1.33 0.00 0.00 177.39 177.36 1ukf n GLY 231 N 3.16 0.61 3.73 -0.72 0.00 0.57 -0.27 105.19 112.26 1ukf n GLY 231 Ca 0.00 -2.03 -0.35 0.00 0.00 0.00 0.00 46.02 43.63 1ukf n GLY 231 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1ukf s GLU 232 N -0.77 3.08 0.15 1.61 2.12 -0.00 -1.29 118.70 123.60 1ukf s GLU 232 Ca 0.00 -0.35 0.08 0.00 0.36 0.00 0.00 54.97 55.05 1ukf s GLU 232 Cb 0.00 -2.88 -0.04 0.00 0.26 0.00 0.00 34.13 31.47 1ukf s GLU 232 CO 0.00 0.72 -0.17 -0.06 -0.54 0.00 0.00 175.26 175.20 1ukf s PHE 233 N -0.93 1.73 -0.01 5.30 0.40 0.99 -1.26 117.98 124.19 1ukf s PHE 233 Ca 0.14 -0.49 -0.07 0.00 -0.60 0.00 0.00 56.93 55.92 1ukf s PHE 233 Cb -0.11 -0.87 0.01 0.00 0.51 0.00 0.00 43.02 42.55 1ukf s PHE 233 CO 0.03 0.28 0.15 -0.65 0.70 0.00 0.00 175.22 175.73 1ukf s GLN 234 N -2.74 0.41 0.25 0.44 -0.21 0.19 -0.78 119.66 117.23 1ukf s GLN 234 Ca 0.14 -0.23 -0.17 0.00 0.02 0.00 0.00 55.36 55.12 1ukf s GLN 234 Cb -0.06 0.17 0.01 0.00 1.00 0.00 0.00 33.01 34.14 1ukf s GLN 234 CO 0.06 -0.09 0.58 -1.54 -2.12 0.00 0.00 175.29 172.18 1ukf s SER 235 N -1.00 -0.18 0.80 5.90 1.04 -0.46 -4.69 113.70 115.12 1ukf s SER 235 Ca -0.11 -0.73 -0.12 0.00 0.48 0.00 0.00 55.95 55.47 1ukf s SER 235 Cb -0.06 0.64 0.07 0.00 0.10 0.00 0.00 66.02 66.78 1ukf s SER 235 CO 0.01 -1.21 1.13 -0.94 0.98 0.00 0.00 173.24 173.21 1ukf s SER 236 N -2.96 4.53 0.38 7.02 1.04 -1.26 -0.56 113.70 121.89 1ukf s SER 236 Ca 0.16 1.05 0.07 0.00 0.48 0.00 0.00 55.95 57.71 1ukf s SER 236 Cb -0.03 -1.70 0.75 0.00 0.10 0.00 0.00 66.02 65.14 1ukf s SER 236 CO 0.06 -1.92 1.94 0.03 0.98 0.00 0.00 173.24 174.34 1ukf h ARG 237 N -1.06 0.40 -0.86 4.02 3.08 -1.76 -2.55 114.38 115.65 1ukf h ARG 237 Ca -0.47 -0.07 0.06 0.00 0.07 0.00 0.00 59.98 59.57 1ukf h ARG 237 Cb 1.29 -0.07 -0.06 0.00 0.08 0.00 0.00 29.97 31.22 1ukf h ARG 237 CO 0.63 0.42 0.54 0.77 -1.07 0.00 0.00 179.97 181.26 1ukf h SER 238 N 0.39 0.86 -0.07 7.04 0.02 -1.91 -2.70 113.55 117.18 1ukf h SER 238 Ca 0.09 0.01 0.00 0.00 -0.84 0.00 0.00 61.79 61.05 1ukf h SER 238 Cb 0.24 -0.17 0.00 0.00 0.14 0.00 0.00 62.40 62.61 1ukf h SER 238 CO 0.00 0.56 0.00 0.00 -1.14 0.00 0.00 176.83 176.25 1ukf n ALA 239 N -2.35 2.53 -0.34 3.77 0.00 -0.99 -4.40 120.51 118.72 1ukf n ALA 239 Ca 0.12 -0.55 0.11 0.00 0.00 0.00 0.00 53.44 53.12 1ukf n ALA 239 Cb 0.16 -1.05 0.31 0.00 0.00 0.00 0.00 19.45 18.87 1ukf n ALA 239 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ukf h ALA 240 N 4.39 1.67 -0.71 0.00 0.00 -1.12 -0.56 119.26 122.92 1ukf h ALA 240 Ca 0.00 0.05 0.02 0.00 0.00 0.00 0.00 54.91 54.98 1ukf h ALA 240 Cb 0.64 -0.13 -0.04 0.00 0.00 0.00 0.00 17.79 18.26 1ukf h ALA 240 CO 0.00 0.01 0.47 -1.35 0.00 0.00 0.00 179.25 178.39 1ukf h PRO 241 N 0.82 0.88 -0.37 0.00 0.11 -1.79 -0.52 132.00 131.12 1ukf h PRO 241 Ca 0.53 -0.05 -0.16 0.00 0.11 0.00 0.00 66.00 66.43 1ukf h PRO 241 Cb 0.76 -0.20 -0.01 0.00 0.11 0.00 0.00 31.00 31.66 1ukf h PRO 241 CO -0.31 0.58 -0.39 1.96 -0.21 0.00 0.00 178.00 179.63 1ukf h GLN 242 N 0.90 0.91 -0.13 1.05 7.50 -1.44 -0.94 115.11 122.97 1ukf h GLN 242 Ca 0.28 -0.48 -0.02 0.00 0.50 0.00 0.00 58.65 58.93 1ukf h GLN 242 Cb -0.01 0.02 -0.00 0.00 0.05 0.00 0.00 27.48 27.53 1ukf h GLN 242 CO -0.07 1.13 0.01 1.25 -1.50 0.00 0.00 178.83 179.65 1ukf h LEU 243 N 0.74 0.21 -0.62 1.46 5.85 -0.86 -1.08 115.31 121.02 1ukf h LEU 243 Ca 0.06 -0.29 -0.05 0.00 0.84 0.00 0.00 57.88 58.45 1ukf h LEU 243 Cb 0.98 -0.06 -0.03 0.00 0.37 0.00 0.00 40.66 41.93 1ukf h LEU 243 CO 0.09 0.45 0.20 0.40 -0.34 0.00 0.00 178.44 179.24 1ukf h ILE 244 N -0.03 1.24 -0.83 4.05 2.04 -1.10 -1.72 117.51 121.16 1ukf h ILE 244 Ca 0.04 -0.82 0.01 0.00 1.00 0.00 0.00 64.86 65.09 1ukf h ILE 244 Cb 0.33 0.61 -0.04 0.00 -0.74 0.00 0.00 36.82 36.98 1ukf h ILE 244 CO 0.00 0.31 0.55 0.50 0.00 0.00 0.00 178.15 179.52 1ukf h LYS 245 N 0.88 1.09 -1.00 2.37 3.64 -1.10 -1.39 116.57 121.05 1ukf h LYS 245 Ca 0.20 -0.07 0.02 0.00 -1.27 0.00 0.00 60.65 59.54 1ukf h LYS 245 Cb 0.28 -0.24 -0.05 0.00 -0.41 0.00 0.00 32.23 31.80 1ukf h LYS 245 CO -0.01 0.72 0.66 0.78 -2.27 0.00 0.00 179.45 179.33 1ukf h GLY 246 N 1.12 1.44 0.92 5.01 0.00 -0.63 0.22 103.07 111.15 1ukf h GLY 246 Ca 0.31 -0.51 -0.06 0.00 0.00 0.00 0.00 47.33 47.07 1ukf h GLY 246 CO -0.07 0.47 -0.01 -2.00 0.00 0.00 0.00 176.54 174.92 1ukf h LEU 247 N 1.31 0.62 -0.38 3.11 5.85 -0.60 -0.63 115.31 124.60 1ukf h LEU 247 Ca 0.38 -0.32 -0.01 0.00 0.84 0.00 0.00 57.88 58.78 1ukf h LEU 247 Cb -0.07 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 40.77 1ukf h LEU 247 CO -0.10 0.79 0.21 0.40 -0.34 0.00 0.00 178.44 179.39 1ukf h ILE 248 N 0.44 1.15 -0.37 4.05 1.08 -0.82 -2.38 117.51 120.65 1ukf h ILE 248 Ca 0.10 -0.38 -0.04 0.00 -0.39 0.00 0.00 64.86 64.15 1ukf h ILE 248 Cb 0.47 0.71 -0.02 0.00 -3.07 0.00 0.00 36.82 34.91 1ukf h ILE 248 CO 0.02 0.15 0.07 0.44 -0.69 0.00 0.00 178.15 178.14 1ukf h ASP 249 N 0.49 0.51 0.01 1.72 3.32 -0.84 -1.14 116.42 120.48 1ukf h ASP 249 Ca 0.13 -0.08 0.01 0.00 0.02 0.00 0.00 57.03 57.12 1ukf h ASP 249 Cb 0.06 -0.13 -0.02 0.00 0.22 0.00 0.00 39.33 39.46 1ukf h ASP 249 CO -0.02 0.53 -0.08 -0.74 -1.72 0.00 0.00 179.24 177.21 1ukf h HIS 250 N 0.54 -0.20 -0.45 4.55 -0.00 -0.62 0.46 115.15 119.42 1ukf h HIS 250 Ca 0.12 0.01 -0.13 0.00 -0.00 0.00 0.00 60.37 60.37 1ukf h HIS 250 Cb 0.24 0.09 -0.01 0.00 -0.00 0.00 0.00 27.41 27.73 1ukf h HIS 250 CO 0.01 -0.13 -0.24 1.88 -0.00 0.00 0.00 177.93 179.45 1ukf h TYR 251 N -0.15 1.12 -0.52 5.26 -1.99 -1.14 -2.92 116.97 116.63 1ukf h TYR 251 Ca 0.03 -0.28 -0.03 0.00 2.00 0.00 0.00 58.73 60.45 1ukf h TYR 251 Cb 0.18 -0.25 -0.02 0.00 2.00 0.00 0.00 36.73 38.63 1ukf h TYR 251 CO -0.14 1.10 0.20 -0.91 -0.00 0.00 0.00 178.16 178.41 1ukf h ASN 252 N 0.81 0.67 0.64 3.88 2.35 -1.03 -0.39 115.58 122.51 1ukf h ASN 252 Ca 0.10 -0.08 0.00 0.00 -0.55 0.00 0.00 56.30 55.77 1ukf h ASN 252 Cb 0.82 -0.17 0.00 0.00 0.05 0.00 0.00 38.32 39.02 1ukf h ASN 252 CO 0.07 0.62 0.00 0.77 -1.65 0.00 0.00 177.43 177.24 1ukf h SER 253 N 0.73 0.00 -0.73 5.81 4.64 -0.73 -1.02 113.55 122.25 1ukf h SER 253 Ca 0.18 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.50 1ukf h SER 253 Cb 0.16 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.25 1ukf h SER 253 CO -0.02 0.00 0.00 0.18 -0.87 0.00 0.00 176.83 176.12 1ukf n LEU 254 N -3.03 4.11 -1.05 5.97 4.77 -0.44 -4.94 117.00 122.39 1ukf n LEU 254 Ca -0.01 -2.07 -0.09 0.00 -0.03 0.00 0.00 56.01 53.82 1ukf n LEU 254 Cb 0.22 -0.51 -0.00 0.00 -2.33 0.00 0.00 43.42 40.80 1ukf n LEU 254 CO 0.24 0.97 -0.10 0.59 -1.33 0.00 0.00 177.39 177.76 1ukf n ASN 255 N 1.59 -3.13 -3.67 -1.43 3.02 -0.39 -4.97 115.26 106.28 1ukf n ASN 255 Ca 0.25 -0.02 -0.31 0.00 -0.03 0.00 0.00 54.58 54.47 1ukf n ASN 255 Cb 0.67 -2.38 -0.07 0.00 -0.61 0.00 0.00 39.78 37.38 1ukf n ASN 255 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 1ukf n TYR 256 N -3.99 3.46 -1.64 3.10 4.02 -0.29 -4.99 117.16 116.84 1ukf n TYR 256 Ca -0.10 -3.95 -0.49 0.00 -0.01 0.00 0.00 57.90 53.35 1ukf n TYR 256 Cb 0.58 -0.74 -0.05 0.00 -0.02 0.00 0.00 39.34 39.10 1ukf n TYR 256 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 176.86 172.38 1ukf n ASP 257 N 1.26 3.15 -4.54 7.72 2.03 -1.26 -3.82 116.55 121.09 1ukf n ASP 257 Ca 0.27 0.83 -0.41 0.00 0.52 0.00 0.00 54.79 56.00 1ukf n ASP 257 Cb 0.38 -1.35 -0.03 0.00 -0.72 0.00 0.00 41.12 39.40 1ukf n ASP 257 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 1ukf s VAL 258 N 4.90 3.86 0.24 5.18 1.01 -1.26 0.18 120.40 134.50 1ukf s VAL 258 Ca 0.97 -0.01 -0.03 0.00 0.00 0.00 0.00 61.98 62.90 1ukf s VAL 258 Cb -0.72 -4.92 0.08 0.00 0.00 0.00 0.00 36.38 30.81 1ukf s VAL 258 CO 0.51 -1.83 1.69 0.00 0.00 0.00 0.00 175.10 175.48 1ukf h ALA 259 N 9.89 0.99 -2.57 5.51 0.00 -1.29 -3.41 119.26 128.38 1ukf h ALA 259 Ca -0.15 -0.32 0.11 0.00 0.00 0.00 0.00 54.91 54.56 1ukf h ALA 259 Cb 1.04 -0.17 -0.09 0.00 0.00 0.00 0.00 17.79 18.57 1ukf h ALA 259 CO 1.30 0.60 0.39 0.00 0.00 0.00 0.00 179.25 181.54 1ukf s VAL 261 N -3.47 1.35 -0.15 0.00 1.01 0.07 -1.54 120.40 117.67 1ukf s VAL 261 Ca 0.09 -0.56 -0.10 0.00 0.00 0.00 0.00 61.98 61.41 1ukf s VAL 261 Cb -0.02 -1.24 -0.05 0.00 0.00 0.00 0.00 36.38 35.07 1ukf s VAL 261 CO -0.01 0.41 0.18 0.20 0.00 0.00 0.00 175.10 175.88 1ukf s ASN 262 N 0.94 6.36 -0.15 3.32 0.01 -0.07 -0.88 114.94 124.47 1ukf s ASN 262 Ca -0.08 0.42 -0.03 0.00 -0.71 0.00 0.00 52.86 52.46 1ukf s ASN 262 Cb -0.15 -2.11 -0.03 0.00 0.41 0.00 0.00 41.25 39.38 1ukf s ASN 262 CO -0.00 0.27 -0.05 -1.61 -1.51 0.00 0.00 177.10 174.19 1ukf s GLU 263 N -0.27 3.62 -0.38 -0.60 2.02 0.15 -1.22 118.70 122.02 1ukf s GLU 263 Ca 0.13 -0.55 0.02 0.00 0.02 0.00 0.00 54.97 54.60 1ukf s GLU 263 Cb -0.12 -2.86 0.11 0.00 0.10 0.00 0.00 34.13 31.35 1ukf s GLU 263 CO 0.02 0.24 0.12 -0.06 0.02 0.00 0.00 175.26 175.60 1ukf s PHE 264 N 0.35 3.66 -0.22 1.61 0.40 -0.19 -1.86 117.98 121.73 1ukf s PHE 264 Ca -0.05 -2.90 -0.28 0.00 -0.60 0.00 0.00 56.93 53.09 1ukf s PHE 264 Cb -0.14 -2.99 0.01 0.00 0.51 0.00 0.00 43.02 40.40 1ukf s PHE 264 CO 0.03 -0.93 1.01 0.50 0.70 0.00 0.00 175.22 176.53 1ukf s ARG 265 N 0.80 4.27 0.22 0.44 3.52 -1.26 -1.53 118.95 125.40 1ukf s ARG 265 Ca 0.11 1.30 0.08 0.00 -0.13 0.00 0.00 55.73 57.10 1ukf s ARG 265 Cb -0.21 -3.63 -0.05 0.00 -1.56 0.00 0.00 34.95 29.51 1ukf s ARG 265 CO -0.06 -0.58 -0.15 0.14 -0.81 0.00 0.00 175.30 173.84 1ukf s VAL 266 N 3.03 1.81 0.01 7.11 -7.23 -0.33 -0.52 120.40 124.28 1ukf s VAL 266 Ca 0.43 -2.23 -0.15 0.00 -1.81 0.00 0.00 61.98 58.22 1ukf s VAL 266 Cb -0.15 -2.09 0.02 0.00 0.56 0.00 0.00 36.38 34.72 1ukf s VAL 266 CO 0.07 -0.56 0.32 -0.94 -0.31 0.00 0.00 175.10 173.68 1ukf s SER 267 N -3.34 -0.18 0.00 4.85 1.04 -0.88 -3.78 113.70 111.41 1ukf s SER 267 Ca 0.24 -0.00 0.11 0.00 0.48 0.00 0.00 55.95 56.77 1ukf s SER 267 Cb -0.01 0.33 0.65 0.00 0.10 0.00 0.00 66.02 67.10 1ukf s SER 267 CO 0.08 -0.51 1.09 0.52 0.98 0.00 0.00 173.24 175.40