#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3kqx s GLU 87 N 0.00 4.07 -0.09 1.43 8.01 -1.26 -4.82 118.70 126.04 3kqx s GLU 87 Ca 0.00 1.91 -0.30 0.00 0.01 0.00 0.00 54.97 56.60 3kqx s GLU 87 Cb 0.00 -3.95 -0.03 0.00 -4.31 0.00 0.00 34.13 25.84 3kqx s GLU 87 CO 0.00 -0.95 1.20 0.08 0.01 0.00 0.00 175.26 175.60 3kqx s VAL 88 N 4.28 4.30 0.72 2.63 1.01 -1.26 -5.01 120.40 127.07 3kqx s VAL 88 Ca 0.69 1.60 -0.15 0.00 0.00 0.00 0.00 61.98 64.12 3kqx s VAL 88 Cb -0.28 -4.03 0.03 0.00 0.00 0.00 0.00 36.38 32.10 3kqx s VAL 88 CO 0.26 -0.04 1.19 -2.16 0.00 0.00 0.00 175.10 174.35 3kqx s PRO 89 N 2.57 2.24 0.06 2.72 0.04 -1.26 -4.94 135.00 136.44 3kqx s PRO 89 Ca 0.55 1.70 0.05 0.00 0.04 0.00 0.00 61.00 63.34 3kqx s PRO 89 Cb -0.23 -1.85 -0.03 0.00 0.04 0.00 0.00 34.50 32.43 3kqx s PRO 89 CO 0.19 -1.74 -0.14 -0.65 0.04 0.00 0.00 177.00 174.70 3kqx s GLN 90 N -3.94 0.82 -0.18 4.56 -0.21 -1.26 -5.02 119.66 114.42 3kqx s GLN 90 Ca 0.73 -0.91 -0.23 0.00 0.02 0.00 0.00 55.36 54.96 3kqx s GLN 90 Cb -0.28 -0.82 -0.21 0.00 1.00 0.00 0.00 33.01 32.71 3kqx s GLN 90 CO 0.45 0.18 0.38 0.28 -2.12 0.00 0.00 175.29 174.46 3kqx h VAL 91 N 4.34 1.16 -2.17 1.09 2.07 -1.97 -3.48 116.25 117.29 3kqx h VAL 91 Ca -0.40 -2.20 -0.59 0.00 0.82 0.00 0.00 66.70 64.33 3kqx h VAL 91 Cb 1.19 2.52 -0.14 0.00 -1.52 0.00 0.00 31.29 33.35 3kqx h VAL 91 CO 0.41 0.39 -0.70 0.68 0.02 0.00 0.00 177.57 178.37 3kqx s VAL 92 N -2.31 2.16 0.34 2.57 -7.23 -1.26 -5.05 120.40 109.62 3kqx s VAL 92 Ca -0.25 -2.23 0.35 0.00 -1.81 0.00 0.00 61.98 58.03 3kqx s VAL 92 Cb 0.03 -2.51 0.38 0.00 0.56 0.00 0.00 36.38 34.84 3kqx s VAL 92 CO 0.61 -0.28 2.11 0.77 -0.31 0.00 0.00 175.10 178.00 3kqx h SER 93 N 2.15 0.00 0.77 4.85 4.64 -2.04 -2.11 113.55 121.82 3kqx h SER 93 Ca -0.41 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.91 3kqx h SER 93 Cb 1.25 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.34 3kqx h SER 93 CO 0.67 0.04 0.00 0.18 -0.87 0.00 0.00 176.83 176.85 3kqx n LEU 94 N -3.23 0.21 -4.70 5.97 4.77 -1.26 -4.85 117.00 113.90 3kqx n LEU 94 Ca -0.01 0.54 -0.42 0.00 -0.03 0.00 0.00 56.01 56.09 3kqx n LEU 94 Cb 0.23 -0.50 -0.03 0.00 -2.33 0.00 0.00 43.42 40.80 3kqx n LEU 94 CO 0.26 -0.23 1.08 -1.81 -1.33 0.00 0.00 177.39 175.35 3kqx s ASP 95 N -3.38 6.85 0.50 -1.43 1.01 -0.80 -4.98 116.67 114.45 3kqx s ASP 95 Ca 0.09 2.22 -0.23 0.00 0.71 0.00 0.00 52.55 55.34 3kqx s ASP 95 Cb 0.12 -2.58 -0.06 0.00 1.01 0.00 0.00 42.92 41.41 3kqx s ASP 95 CO 0.39 -0.67 1.38 -2.84 0.21 0.00 0.00 175.17 173.64 3kqx s PRO 96 N 1.63 3.40 -0.03 8.23 0.02 -1.26 -4.97 135.00 142.02 3kqx s PRO 96 Ca 0.64 2.29 0.05 0.00 0.02 0.00 0.00 61.00 64.00 3kqx s PRO 96 Cb -0.34 -2.43 0.12 0.00 0.02 0.00 0.00 34.50 31.86 3kqx s PRO 96 CO 0.29 -1.00 1.08 0.25 -0.33 0.00 0.00 177.00 177.29 3kqx n THR 97 N -0.65 1.19 -3.62 0.99 -2.24 -1.26 -4.84 114.28 103.85 3kqx n THR 97 Ca 0.08 -1.23 -0.10 0.00 -2.27 0.00 0.00 64.05 60.52 3kqx n THR 97 Cb 0.44 0.35 -0.04 0.00 -2.10 0.00 0.00 70.33 68.99 3kqx n THR 97 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 3kqx s SER 98 N -1.33 -0.33 -0.16 3.42 1.04 -1.26 -4.74 113.70 110.33 3kqx s SER 98 Ca 0.10 -0.30 -0.26 0.00 0.48 0.00 0.00 55.95 55.98 3kqx s SER 98 Cb 0.08 0.55 -0.02 0.00 0.10 0.00 0.00 66.02 66.73 3kqx s SER 98 CO 0.03 -0.96 0.84 -0.63 0.98 0.00 0.00 173.24 173.50 3kqx s ILE 99 N -3.82 4.88 0.39 -1.02 1.01 -1.23 -4.86 121.20 116.55 3kqx s ILE 99 Ca 0.05 1.66 -0.26 0.00 0.00 0.00 0.00 60.65 62.09 3kqx s ILE 99 Cb 0.00 -4.15 -0.09 0.00 0.01 0.00 0.00 42.46 38.24 3kqx s ILE 99 CO -0.09 0.03 1.23 -2.16 0.00 0.00 0.00 174.94 173.96 3kqx s PRO 100 N 2.08 4.09 -0.08 2.79 0.04 -1.26 -5.02 135.00 137.63 3kqx s PRO 100 Ca 0.39 2.00 -0.04 0.00 0.04 0.00 0.00 61.00 63.40 3kqx s PRO 100 Cb -0.17 -2.78 0.04 0.00 0.04 0.00 0.00 34.50 31.63 3kqx s PRO 100 CO 0.13 -0.34 0.18 0.42 0.04 0.00 0.00 177.00 177.43 3kqx s ILE 101 N -1.31 -0.10 -0.22 0.56 -1.09 -1.26 -4.98 121.20 112.81 3kqx s ILE 101 Ca 0.55 0.20 -0.10 0.00 -2.23 0.00 0.00 60.65 59.07 3kqx s ILE 101 Cb -0.35 -0.30 -0.05 0.00 -1.58 0.00 0.00 42.46 40.19 3kqx s ILE 101 CO 0.44 0.08 0.14 -1.61 -1.23 0.00 0.00 174.94 172.77 3kqx s GLU 102 N 1.42 4.12 -0.08 2.79 2.02 -1.26 -4.99 118.70 122.72 3kqx s GLU 102 Ca -0.07 -0.25 -0.12 0.00 0.02 0.00 0.00 54.97 54.55 3kqx s GLU 102 Cb -0.11 -3.47 -0.04 0.00 0.10 0.00 0.00 34.13 30.61 3kqx s GLU 102 CO -0.07 0.18 -0.22 0.66 0.02 0.00 0.00 175.26 175.83 3kqx n TYR 103 N 3.90 0.00 -2.41 1.61 4.02 -1.26 -4.82 117.16 118.20 3kqx n TYR 103 Ca -0.16 0.00 -0.39 0.00 -0.01 0.00 0.00 57.90 57.34 3kqx n TYR 103 Cb 0.52 -0.32 -0.03 0.00 -0.02 0.00 0.00 39.34 39.49 3kqx n TYR 103 CO 0.00 0.00 0.00 -0.80 -1.01 0.00 0.00 176.86 175.05 3kqx s ASN 104 N -5.89 5.99 0.27 7.72 0.02 -1.26 -5.00 114.94 116.79 3kqx s ASN 104 Ca -0.19 -0.60 0.06 0.00 -1.02 0.00 0.00 52.86 51.12 3kqx s ASN 104 Cb 0.03 -2.56 -0.03 0.00 0.02 0.00 0.00 41.25 38.71 3kqx s ASN 104 CO 0.28 -1.94 0.34 0.42 0.02 0.00 0.00 177.10 176.22 3kqx s THR 105 N 6.55 4.71 0.55 1.60 -4.23 -1.26 -4.98 115.64 118.58 3kqx s THR 105 Ca 0.47 -1.11 0.21 0.00 -1.18 0.00 0.00 61.69 60.08 3kqx s THR 105 Cb -0.07 -3.62 0.30 0.00 1.34 0.00 0.00 72.50 70.46 3kqx s THR 105 CO 0.08 -0.29 2.19 -0.65 -0.54 0.00 0.00 174.62 175.41 3kqx h PRO 106 N 1.19 0.00 -0.20 3.99 0.11 -2.00 0.29 132.00 135.38 3kqx h PRO 106 Ca -0.49 0.00 0.03 0.00 0.11 0.00 0.00 66.00 65.65 3kqx h PRO 106 Cb 1.24 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.34 3kqx h PRO 106 CO 0.59 0.00 0.14 0.82 -0.21 0.00 0.00 178.00 179.34 3kqx h ILE 107 N 0.00 0.97 0.00 4.15 1.08 -1.94 -1.53 117.51 120.24 3kqx h ILE 107 Ca 0.00 -0.04 0.00 0.00 -0.39 0.00 0.00 64.86 64.43 3kqx h ILE 107 Cb 0.02 0.83 0.00 0.00 -3.07 0.00 0.00 36.82 34.60 3kqx h ILE 107 CO -0.00 0.02 0.00 0.45 -0.69 0.00 0.00 178.15 177.93 3kqx h HIS 108 N 0.13 0.00 -0.00 1.37 3.86 -0.80 -2.93 115.15 116.78 3kqx h HIS 108 Ca 0.09 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.30 3kqx h HIS 108 Cb 0.19 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.66 3kqx h HIS 108 CO -0.00 0.00 -0.14 -0.25 0.86 0.00 0.00 177.93 178.40 3kqx n ASP 109 N -2.89 0.23 -4.65 2.45 8.00 -0.58 -4.84 116.55 114.27 3kqx n ASP 109 Ca 0.01 -0.00 -0.43 0.00 0.71 0.00 0.00 54.79 55.08 3kqx n ASP 109 Cb 0.31 -0.20 -0.02 0.00 -0.02 0.00 0.00 41.12 41.19 3kqx n ASP 109 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3kqx s ILE 110 N -2.82 4.57 -0.27 0.53 1.01 -1.11 -4.86 121.20 118.26 3kqx s ILE 110 Ca 0.19 1.86 -0.26 0.00 0.00 0.00 0.00 60.65 62.44 3kqx s ILE 110 Cb 0.19 -4.33 0.00 0.00 0.01 0.00 0.00 42.46 38.34 3kqx s ILE 110 CO 0.55 -0.30 0.89 -0.75 0.00 0.00 0.00 174.94 175.33 3kqx s LYS 111 N 3.43 4.12 -0.16 2.79 2.20 -0.33 -4.93 119.74 126.86 3kqx s LYS 111 Ca 0.46 0.94 -0.06 0.00 -0.36 0.00 0.00 55.97 56.95 3kqx s LYS 111 Cb -0.14 -3.68 -0.04 0.00 -1.51 0.00 0.00 37.83 32.46 3kqx s LYS 111 CO 0.11 -0.64 0.04 0.08 -0.36 0.00 0.00 175.35 174.58 3kqx s VAL 112 N 3.05 4.57 0.01 4.02 1.01 -1.26 -1.46 120.40 130.35 3kqx s VAL 112 Ca 0.37 -0.12 0.05 0.00 0.00 0.00 0.00 61.98 62.28 3kqx s VAL 112 Cb -0.14 -3.03 -0.01 0.00 0.00 0.00 0.00 36.38 33.19 3kqx s VAL 112 CO 0.10 0.50 -0.15 -1.10 0.00 0.00 0.00 175.10 174.44 3kqx s GLN 113 N 0.13 1.11 -0.05 2.72 -1.52 0.12 -4.98 119.66 117.19 3kqx s GLN 113 Ca 0.03 -0.61 0.04 0.00 -1.95 0.00 0.00 55.36 52.87 3kqx s GLN 113 Cb -0.13 -1.10 -0.03 0.00 -0.22 0.00 0.00 33.01 31.54 3kqx s GLN 113 CO 0.01 0.29 -0.15 0.08 -0.25 0.00 0.00 175.29 175.27 3kqx s VAL 114 N -0.51 3.01 0.06 1.09 1.01 -1.26 -0.68 120.40 123.12 3kqx s VAL 114 Ca 0.05 -0.74 0.03 0.00 0.00 0.00 0.00 61.98 61.31 3kqx s VAL 114 Cb -0.06 -2.17 -0.03 0.00 0.00 0.00 0.00 36.38 34.12 3kqx s VAL 114 CO 0.00 0.59 -0.10 -0.31 0.00 0.00 0.00 175.10 175.28 3kqx s TYR 115 N -0.70 0.88 0.10 5.22 1.51 0.96 -4.93 117.35 120.39 3kqx s TYR 115 Ca 0.11 -0.51 -0.31 0.00 -1.01 0.00 0.00 57.07 55.35 3kqx s TYR 115 Cb -0.11 -0.51 -0.07 0.00 -0.11 0.00 0.00 41.96 41.17 3kqx s TYR 115 CO 0.01 -0.03 1.26 0.16 -1.11 0.00 0.00 175.55 175.83 3kqx s ASP 116 N -1.73 7.00 0.52 2.29 -4.77 -1.26 -1.28 116.67 117.43 3kqx s ASP 116 Ca -0.06 2.16 0.27 0.00 -3.30 0.00 0.00 52.55 51.62 3kqx s ASP 116 Cb -0.09 -2.59 1.45 0.00 -1.09 0.00 0.00 42.92 40.60 3kqx s ASP 116 CO 0.01 -0.51 2.08 0.40 0.70 0.00 0.00 175.17 177.85 3kqx h ILE 117 N 4.26 0.59 -0.85 2.11 2.04 -1.87 -2.83 117.51 120.96 3kqx h ILE 117 Ca -0.42 -0.50 0.12 0.00 1.00 0.00 0.00 64.86 65.06 3kqx h ILE 117 Cb 1.21 1.32 -0.08 0.00 -0.74 0.00 0.00 36.82 38.53 3kqx h ILE 117 CO 0.81 0.11 0.46 0.07 0.00 0.00 0.00 178.15 179.61 3kqx h LYS 118 N 0.00 0.70 0.00 2.37 -0.00 -1.90 -0.89 116.57 116.85 3kqx h LYS 118 Ca -0.00 -0.04 0.00 0.00 -0.00 0.00 0.00 60.65 60.61 3kqx h LYS 118 Cb 0.31 -0.16 0.00 0.00 -0.00 0.00 0.00 32.23 32.38 3kqx h LYS 118 CO 0.01 0.46 0.00 0.41 -0.00 0.00 0.00 179.45 180.34 3kqx n GLY 119 N -1.32 -0.69 0.29 0.07 0.00 -1.07 -5.01 105.19 97.46 3kqx n GLY 119 Ca 0.16 -0.06 0.04 0.00 0.00 0.00 0.00 46.02 46.15 3kqx n GLY 119 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3kqx n GLY 120 N -0.23 -2.15 3.54 -0.02 0.00 -0.34 -4.96 105.19 101.03 3kqx n GLY 120 Ca 0.06 -1.41 -0.34 0.00 0.00 0.00 0.00 46.02 44.33 3kqx n GLY 120 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3kqx s ASN 122 N 0.29 7.33 -0.53 0.00 0.01 -1.26 -0.07 114.94 120.72 3kqx s ASN 122 Ca -0.02 1.58 0.04 0.00 -0.71 0.00 0.00 52.86 53.75 3kqx s ASN 122 Cb -0.14 -2.49 0.14 0.00 0.41 0.00 0.00 41.25 39.18 3kqx s ASN 122 CO 0.02 0.17 0.29 -0.69 -1.51 0.00 0.00 177.10 175.38 3kqx s VAL 123 N -0.89 2.33 -0.11 1.60 1.01 -1.26 -4.95 120.40 118.13 3kqx s VAL 123 Ca 0.36 -3.29 0.02 0.00 0.00 0.00 0.00 61.98 59.08 3kqx s VAL 123 Cb -0.22 -2.61 -0.08 0.00 0.00 0.00 0.00 36.38 33.47 3kqx s VAL 123 CO 0.25 -0.86 -0.07 -0.62 0.00 0.00 0.00 175.10 173.80 3kqx n GLU 124 N 3.03 0.77 -4.20 2.72 1.02 -1.26 -4.90 120.64 117.81 3kqx n GLU 124 Ca 0.08 0.05 -0.12 0.00 -0.02 0.00 0.00 57.16 57.16 3kqx n GLU 124 Cb 0.33 -1.23 -0.10 0.00 -0.02 0.00 0.00 31.44 30.43 3kqx n GLU 124 CO 0.00 0.00 0.00 -1.83 1.18 0.00 0.00 177.13 176.48 3kqx s GLU 125 N -2.22 1.08 3.88 3.49 -1.05 -1.26 -4.85 118.70 117.76 3kqx s GLU 125 Ca -0.13 -1.54 0.00 0.00 -0.15 0.00 0.00 54.97 53.15 3kqx s GLU 125 Cb 0.04 0.09 0.00 0.00 -0.44 0.00 0.00 34.13 33.82 3kqx s GLU 125 CO 0.28 -0.27 0.00 0.41 0.95 0.00 0.00 175.26 176.63 3kqx n GLY 126 N -0.20 2.42 3.23 -3.83 0.00 -1.26 -4.67 105.19 100.88 3kqx n GLY 126 Ca -0.03 -0.31 -0.33 0.00 0.00 0.00 0.00 46.02 45.35 3kqx n GLY 126 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3kqx s LEU 127 N 0.00 2.36 -0.25 0.99 2.96 -0.38 -0.86 118.68 123.50 3kqx s LEU 127 Ca 0.00 -0.51 -0.04 0.00 -0.22 0.00 0.00 54.13 53.35 3kqx s LEU 127 Cb 0.00 -1.52 0.00 0.00 0.50 0.00 0.00 46.19 45.17 3kqx s LEU 127 CO 0.00 0.08 -0.01 -0.89 -1.32 0.00 0.00 176.35 174.22 3kqx s THR 128 N 0.81 3.47 -0.10 3.68 2.01 0.42 -0.13 115.64 125.80 3kqx s THR 128 Ca -0.06 -0.67 0.04 0.00 0.31 0.00 0.00 61.69 61.31 3kqx s THR 128 Cb -0.15 -2.69 0.00 0.00 0.01 0.00 0.00 72.50 69.67 3kqx s THR 128 CO -0.01 0.26 -0.23 -0.63 -0.69 0.00 0.00 174.62 173.32 3kqx s ILE 129 N 1.45 2.01 -0.18 1.82 -1.09 -0.47 -0.72 121.20 124.03 3kqx s ILE 129 Ca 0.03 -0.99 -0.10 0.00 -2.23 0.00 0.00 60.65 57.36 3kqx s ILE 129 Cb -0.16 -1.74 -0.05 0.00 -1.58 0.00 0.00 42.46 38.93 3kqx s ILE 129 CO -0.02 0.55 0.15 -0.36 -1.23 0.00 0.00 174.94 174.03 3kqx s PHE 130 N 0.35 3.45 -0.46 3.97 0.40 -0.51 -0.91 117.98 124.27 3kqx s PHE 130 Ca -0.19 0.40 -0.23 0.00 -0.60 0.00 0.00 56.93 56.31 3kqx s PHE 130 Cb -0.18 -2.14 0.03 0.00 0.51 0.00 0.00 43.02 41.24 3kqx s PHE 130 CO 0.09 0.37 0.77 -0.51 0.70 0.00 0.00 175.22 176.64 3kqx s LEU 131 N 0.11 4.30 0.01 -0.37 1.43 0.72 -1.51 118.68 123.38 3kqx s LEU 131 Ca 0.10 -0.20 0.06 0.00 -1.03 0.00 0.00 54.13 53.07 3kqx s LEU 131 Cb -0.11 -2.90 -0.02 0.00 0.03 0.00 0.00 46.19 43.19 3kqx s LEU 131 CO -0.00 -0.92 -0.18 0.68 0.23 0.00 0.00 176.35 176.15 3kqx s VAL 132 N 3.26 1.47 0.40 -1.59 -7.23 -1.02 -1.91 120.40 113.78 3kqx s VAL 132 Ca 0.28 -0.92 0.04 0.00 -1.81 0.00 0.00 61.98 59.58 3kqx s VAL 132 Cb -0.13 -1.25 -0.03 0.00 0.56 0.00 0.00 36.38 35.54 3kqx s VAL 132 CO 0.22 0.31 0.13 0.54 -0.31 0.00 0.00 175.10 175.99 3kqx s ASN 133 N -0.71 2.71 -0.42 4.85 2.20 -1.26 0.08 114.94 122.39 3kqx s ASN 133 Ca 0.07 -1.66 0.08 0.00 -0.94 0.00 0.00 52.86 50.40 3kqx s ASN 133 Cb -0.08 0.48 0.18 0.00 -2.00 0.00 0.00 41.25 39.84 3kqx s ASN 133 CO 0.00 -0.92 0.63 0.21 -2.94 0.00 0.00 177.10 174.08 3kqx s ASN 134 N -3.59 -1.43 -0.32 3.54 3.04 -0.28 -4.90 114.94 110.99 3kqx s ASN 134 Ca 0.25 -0.91 -0.42 0.00 0.04 0.00 0.00 52.86 51.82 3kqx s ASN 134 Cb 0.03 1.91 -0.17 0.00 -1.54 0.00 0.00 41.25 41.48 3kqx s ASN 134 CO 0.15 -0.16 1.66 -2.65 -3.04 0.00 0.00 177.10 173.06 3kqx n PRO 135 N 4.26 0.76 -2.27 0.43 -0.02 -1.22 -3.50 135.00 133.44 3kqx n PRO 135 Ca 0.12 0.28 -0.02 0.00 -2.02 0.00 0.00 63.50 61.86 3kqx n PRO 135 Cb 0.56 -1.90 0.00 0.00 -0.02 0.00 0.00 33.50 32.15 3kqx n PRO 135 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3kqx n GLY 136 N 3.98 -2.71 0.00 -1.23 0.00 -1.26 -5.07 105.19 98.90 3kqx n GLY 136 Ca 0.27 0.40 0.00 0.00 0.00 0.00 0.00 46.02 46.69 3kqx n GLY 136 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3kqx n LYS 137 N 0.12 0.00 0.00 1.61 5.02 -1.23 -4.62 118.16 119.06 3kqx n LYS 137 Ca 0.03 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.32 3kqx n LYS 137 Cb 0.11 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.12 3kqx n LYS 137 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 3kqx n GLU 138 N 0.00 0.00 -2.64 1.97 4.71 -1.26 -3.89 120.64 119.53 3kqx n GLU 138 Ca 0.00 0.00 -0.27 0.00 -0.01 0.00 0.00 57.16 56.88 3kqx n GLU 138 Cb 0.00 0.00 0.01 0.00 -1.01 0.00 0.00 31.44 30.44 3kqx n GLU 138 CO 0.00 0.00 0.00 1.21 0.09 0.00 0.00 177.13 178.43 3kqx s ASN 139 N 0.00 6.08 1.07 1.62 2.47 -1.26 -4.89 114.94 120.03 3kqx s ASN 139 Ca 0.00 0.81 -0.10 0.00 0.42 0.00 0.00 52.86 54.00 3kqx s ASN 139 Cb 0.00 -2.07 0.14 0.00 -1.45 0.00 0.00 41.25 37.87 3kqx s ASN 139 CO 0.00 -0.68 0.62 0.61 -3.72 0.00 0.00 177.10 173.93 3kqx n GLY 140 N -2.30 -2.04 3.78 1.21 0.00 -1.25 -4.50 105.19 100.09 3kqx n GLY 140 Ca 0.01 -1.57 -0.32 0.00 0.00 0.00 0.00 46.02 44.15 3kqx n GLY 140 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3kqx s PRO 141 N -4.39 2.55 0.09 1.61 0.04 -1.26 -1.65 135.00 131.99 3kqx s PRO 141 Ca 0.38 1.21 -0.27 0.00 0.04 0.00 0.00 61.00 62.36 3kqx s PRO 141 Cb -0.02 -1.93 -0.06 0.00 0.04 0.00 0.00 34.50 32.53 3kqx s PRO 141 CO 0.28 -1.42 0.85 0.08 0.04 0.00 0.00 177.00 176.83 3kqx s VAL 142 N -2.73 4.59 -0.03 -0.36 1.01 0.68 -4.56 120.40 119.00 3kqx s VAL 142 Ca 0.63 1.83 0.00 0.00 0.00 0.00 0.00 61.98 64.43 3kqx s VAL 142 Cb -0.18 -4.21 0.03 0.00 0.00 0.00 0.00 36.38 32.02 3kqx s VAL 142 CO 0.51 0.36 0.00 -1.59 0.00 0.00 0.00 175.10 174.38 3kqx s LYS 143 N -0.14 0.31 -0.06 2.72 -2.85 -1.26 -3.42 119.74 115.04 3kqx s LYS 143 Ca 0.42 0.09 -0.13 0.00 -1.00 0.00 0.00 55.97 55.35 3kqx s LYS 143 Cb -0.22 -0.53 -0.05 0.00 -2.06 0.00 0.00 37.83 34.97 3kqx s LYS 143 CO 0.26 -0.16 0.34 0.42 0.10 0.00 0.00 175.35 176.31 3kqx s ILE 144 N 1.17 5.18 -0.05 3.79 1.09 -1.26 -4.98 121.20 126.13 3kqx s ILE 144 Ca -0.08 0.68 0.11 0.00 -1.10 0.00 0.00 60.65 60.26 3kqx s ILE 144 Cb -0.13 -3.64 -0.16 0.00 -1.06 0.00 0.00 42.46 37.46 3kqx s ILE 144 CO -0.02 0.54 0.17 -0.24 -0.10 0.00 0.00 174.94 175.29 3kqx n SER 145 N 2.26 2.31 -4.80 3.58 2.88 -1.26 -4.91 113.62 113.67 3kqx n SER 145 Ca -0.14 0.00 -0.34 0.00 -1.33 0.00 0.00 58.87 57.05 3kqx n SER 145 Cb 0.53 1.23 -0.06 0.00 -0.75 0.00 0.00 64.21 65.16 3kqx n SER 145 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 3kqx s SER 146 N -3.75 6.90 0.00 -3.46 0.01 -1.26 -5.02 113.70 107.12 3kqx s SER 146 Ca -0.05 1.80 -0.30 0.00 1.31 0.00 0.00 55.95 58.71 3kqx s SER 146 Cb 0.06 -2.56 -0.06 0.00 0.21 0.00 0.00 66.02 63.67 3kqx s SER 146 CO 0.47 -0.39 1.53 -1.59 0.41 0.00 0.00 173.24 173.68 3kqx s LYS 147 N -2.88 4.23 -0.18 12.44 0.00 -1.26 -4.97 119.74 127.12 3kqx s LYS 147 Ca 0.60 2.12 -0.03 0.00 0.00 0.00 0.00 55.97 58.66 3kqx s LYS 147 Cb -0.14 -3.69 -0.01 0.00 0.00 0.00 0.00 37.83 33.99 3kqx s LYS 147 CO 0.18 -0.69 -0.07 0.08 0.00 0.00 0.00 175.35 174.85 3kqx s VAL 148 N 2.91 3.35 -0.04 1.79 1.01 -1.26 0.51 120.40 128.68 3kqx s VAL 148 Ca 0.69 -0.52 0.00 0.00 0.00 0.00 0.00 61.98 62.15 3kqx s VAL 148 Cb -0.34 -2.48 0.05 0.00 0.00 0.00 0.00 36.38 33.61 3kqx s VAL 148 CO 0.28 0.47 1.22 -0.46 0.00 0.00 0.00 175.10 176.61 3kqx n ASN 149 N 4.20 3.45 -3.67 3.32 2.04 0.90 -4.73 115.26 120.76 3kqx n ASN 149 Ca -0.18 -2.19 -0.10 0.00 -0.44 0.00 0.00 54.58 51.68 3kqx n ASN 149 Cb 0.52 -0.62 -0.09 0.00 -2.53 0.00 0.00 39.78 37.05 3kqx n ASN 149 CO 0.00 0.00 0.00 1.51 -0.44 0.00 0.00 177.26 178.33 3kqx s ASP 150 N 0.96 -0.68 -0.65 0.53 3.84 -1.26 -4.88 116.67 114.53 3kqx s ASP 150 Ca 0.04 1.15 0.04 0.00 -0.00 0.00 0.00 52.55 53.78 3kqx s ASP 150 Cb 0.04 1.04 0.16 0.00 -1.38 0.00 0.00 42.92 42.78 3kqx s ASP 150 CO 0.01 -0.21 0.43 -0.54 -0.00 0.00 0.00 175.17 174.86 3kqx s LYS 151 N 1.33 2.37 0.00 2.11 -0.14 -1.26 -0.33 119.74 123.82 3kqx s LYS 151 Ca -0.08 -3.06 0.00 0.00 -1.36 0.00 0.00 55.97 51.47 3kqx s LYS 151 Cb -0.07 -3.45 0.00 0.00 -1.68 0.00 0.00 37.83 32.64 3kqx s LYS 151 CO -0.13 -1.22 0.00 1.55 -0.76 0.00 0.00 175.35 174.79 3kqx n VAL 153 N 2.46 0.00 -0.24 3.17 3.14 -1.26 -4.42 118.33 121.18 3kqx n VAL 153 Ca 0.14 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.53 3kqx n VAL 153 Cb 0.34 0.00 0.08 0.00 -1.06 0.00 0.00 33.84 33.20 3kqx n VAL 153 CO 0.00 0.00 0.00 0.28 -6.46 0.00 0.00 176.83 170.65 3kqx h SER 154 N 0.00 -0.68 -1.00 6.55 0.02 -0.98 -1.32 113.55 116.13 3kqx h SER 154 Ca 0.00 0.21 0.14 0.00 -0.84 0.00 0.00 61.79 61.30 3kqx h SER 154 Cb 0.00 0.45 -0.15 0.00 0.14 0.00 0.00 62.40 62.84 3kqx h SER 154 CO 0.00 -0.24 -0.44 -0.62 -1.14 0.00 0.00 176.83 174.40 3kqx n GLU 155 N -5.47 -0.28 -0.16 3.45 4.71 -1.26 -1.46 120.64 120.17 3kqx n GLU 155 Ca 0.09 1.53 -0.08 0.00 -0.01 0.00 0.00 57.16 58.69 3kqx n GLU 155 Cb 0.36 -2.26 0.01 0.00 -1.01 0.00 0.00 31.44 28.54 3kqx n GLU 155 CO 0.00 0.00 0.00 0.27 0.09 0.00 0.00 177.13 177.49 3kqx h PHE 156 N 0.00 0.65 0.00 -0.32 -0.00 -1.61 -3.07 116.94 112.59 3kqx h PHE 156 Ca 0.30 -0.02 0.00 0.00 -0.00 0.00 0.00 57.97 58.25 3kqx h PHE 156 Cb 0.55 -0.21 0.00 0.00 -0.00 0.00 0.00 35.95 36.30 3kqx h PHE 156 CO -0.91 0.50 0.00 1.47 -0.00 0.00 0.00 178.31 179.36 3kqx n LEU 157 N -4.67 0.00 -4.76 2.10 -0.00 -0.54 -4.54 117.00 104.60 3kqx n LEU 157 Ca 0.01 0.00 -0.41 0.00 -0.00 0.00 0.00 56.01 55.61 3kqx n LEU 157 Cb 0.09 0.00 -0.01 0.00 -0.00 0.00 0.00 43.42 43.50 3kqx n LEU 157 CO 0.36 0.00 1.19 0.29 -0.00 0.00 0.00 177.39 179.23 3kqx n LYS 158 N -0.60 2.71 -0.36 1.47 4.01 -0.98 -4.51 118.16 119.91 3kqx n LYS 158 Ca 0.04 0.96 0.35 0.00 -0.51 0.00 0.00 58.31 59.15 3kqx n LYS 158 Cb 0.02 -2.71 0.73 0.00 -0.51 0.00 0.00 35.03 32.55 3kqx n LYS 158 CO 0.00 0.00 0.00 -0.44 -1.11 0.00 0.00 177.40 175.85 3kqx h ASP 159 N 3.80 0.06 0.08 4.39 3.32 -1.90 0.36 116.42 126.53 3kqx h ASP 159 Ca -0.49 0.01 -0.00 0.00 0.02 0.00 0.00 57.03 56.57 3kqx h ASP 159 Cb 1.23 0.01 0.00 0.00 0.22 0.00 0.00 39.33 40.79 3kqx h ASP 159 CO 0.71 0.00 -0.04 1.05 -1.72 0.00 0.00 179.24 179.24 3kqx h GLU 160 N 0.04 -0.11 -0.00 3.56 -0.00 -1.94 -3.15 114.58 112.99 3kqx h GLU 160 Ca 0.60 0.01 -0.17 0.00 -0.00 0.00 0.00 59.36 59.80 3kqx h GLU 160 Cb 2.31 0.02 -0.02 0.00 -0.00 0.00 0.00 28.75 31.07 3kqx h GLU 160 CO -0.05 -0.06 -0.80 -2.95 -0.00 0.00 0.00 179.01 175.15 3kqx h ASN 161 N -0.12 0.09 0.85 3.06 7.08 -0.54 -3.31 115.58 122.68 3kqx h ASN 161 Ca -0.01 -0.07 -0.11 0.00 -3.08 0.00 0.00 56.30 53.03 3kqx h ASN 161 Cb 0.10 -0.03 -0.02 0.00 -2.08 0.00 0.00 38.32 36.30 3kqx h ASN 161 CO 0.02 0.85 -0.51 0.24 -2.08 0.00 0.00 177.43 175.94 3kqx h MET 162 N 0.04 0.00 -1.13 4.14 0.00 -1.49 -3.17 114.93 113.33 3kqx h MET 162 Ca -0.02 0.00 0.32 0.00 0.00 0.00 0.00 59.70 60.00 3kqx h MET 162 Cb 1.40 0.00 -0.06 0.00 0.00 0.00 0.00 31.60 32.94 3kqx h MET 162 CO 0.11 0.51 0.79 0.93 0.00 0.00 0.00 176.91 179.25 3kqx h GLU 163 N 0.00 0.10 0.00 1.72 4.39 -1.56 0.68 114.58 119.91 3kqx h GLU 163 Ca -0.01 -0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.69 3kqx h GLU 163 Cb 1.08 -0.02 0.00 0.00 -0.10 0.00 0.00 28.75 29.70 3kqx h GLU 163 CO 0.07 0.07 0.00 0.36 -1.16 0.00 0.00 179.01 178.35 3kqx n LYS 164 N -4.32 0.38 -4.45 2.33 -0.00 -1.20 -4.68 118.16 106.23 3kqx n LYS 164 Ca 0.25 0.00 -0.21 0.00 -0.00 0.00 0.00 58.31 58.35 3kqx n LYS 164 Cb 1.13 -1.44 -0.14 0.00 -0.00 0.00 0.00 35.03 34.58 3kqx n LYS 164 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.40 177.34 3kqx s PHE 165 N -2.00 1.32 0.25 5.58 0.40 0.23 -5.09 117.98 118.67 3kqx s PHE 165 Ca 0.16 -0.33 0.11 0.00 -0.60 0.00 0.00 56.93 56.27 3kqx s PHE 165 Cb 0.07 -0.79 -0.05 0.00 0.51 0.00 0.00 43.02 42.76 3kqx s PHE 165 CO 0.12 0.03 -0.14 0.54 0.70 0.00 0.00 175.22 176.48 3kqx s ASN 166 N -0.98 3.91 -0.03 1.36 2.20 -1.26 -0.23 114.94 119.91 3kqx s ASN 166 Ca 0.03 -0.85 0.05 0.00 -0.94 0.00 0.00 52.86 51.15 3kqx s ASN 166 Cb -0.07 -0.49 0.19 0.00 -2.00 0.00 0.00 41.25 38.87 3kqx s ASN 166 CO 0.01 0.05 0.97 0.52 -2.94 0.00 0.00 177.10 175.71 3kqx n VAL 167 N -0.52 0.50 -1.67 3.54 0.31 -0.66 -4.76 118.33 115.07 3kqx n VAL 167 Ca -0.07 -0.31 -0.55 0.00 -0.01 0.00 0.00 64.34 63.40 3kqx n VAL 167 Cb 0.59 -0.17 -0.07 0.00 -0.91 0.00 0.00 33.84 33.28 3kqx n VAL 167 CO 0.00 0.00 0.00 1.17 -1.32 0.00 0.00 176.83 176.68 3kqx n LYS 168 N 0.11 1.23 -1.72 5.55 3.00 -1.26 -0.18 118.16 124.89 3kqx n LYS 168 Ca 0.07 0.45 -0.63 0.00 -0.00 0.00 0.00 58.31 58.20 3kqx n LYS 168 Cb 0.34 -2.13 -0.09 0.00 0.00 0.00 0.00 35.03 33.15 3kqx n LYS 168 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.40 177.29 3kqx n LEU 169 N 4.45 1.68 0.00 3.14 0.00 -1.26 0.04 117.00 125.05 3kqx n LEU 169 Ca 0.23 1.14 0.00 0.00 0.00 0.00 0.00 56.01 57.38 3kqx n LEU 169 Cb 0.16 -1.00 0.00 0.00 0.00 0.00 0.00 43.42 42.58 3kqx n LEU 169 CO 0.74 -0.71 0.00 0.61 0.00 0.00 0.00 177.39 178.03 3kqx n GLY 170 N 3.97 2.07 3.76 -3.96 0.00 0.11 -4.93 105.19 106.20 3kqx n GLY 170 Ca 0.28 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.92 3kqx n GLY 170 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3kqx s THR 171 N -3.10 2.55 0.07 2.61 2.01 0.11 -4.78 115.64 115.11 3kqx s THR 171 Ca 0.00 0.44 -0.03 0.00 0.31 0.00 0.00 61.69 62.41 3kqx s THR 171 Cb 0.00 -3.23 -0.03 0.00 0.01 0.00 0.00 72.50 69.25 3kqx s THR 171 CO 0.00 0.01 0.04 -0.94 -0.69 0.00 0.00 174.62 173.04 3kqx s SER 172 N -1.03 0.37 -0.07 3.53 1.04 -1.26 -0.48 113.70 115.79 3kqx s SER 172 Ca 0.65 -0.94 -0.13 0.00 0.48 0.00 0.00 55.95 56.01 3kqx s SER 172 Cb -0.36 0.25 0.03 0.00 0.10 0.00 0.00 66.02 66.04 3kqx s SER 172 CO 0.44 -0.65 0.31 -0.54 0.98 0.00 0.00 173.24 173.78 3kqx s LYS 173 N -3.92 0.50 -0.02 4.02 1.02 -1.17 -5.01 119.74 115.16 3kqx s LYS 173 Ca 0.09 0.16 -0.01 0.00 0.02 0.00 0.00 55.97 56.23 3kqx s LYS 173 Cb 0.07 0.23 0.01 0.00 -0.52 0.00 0.00 37.83 37.63 3kqx s LYS 173 CO -0.09 -0.10 0.05 -3.38 -0.92 0.00 0.00 175.35 170.91 3kqx s HIS 174 N -0.49 -0.04 -0.02 3.18 -3.43 -1.26 -1.68 115.29 111.55 3kqx s HIS 174 Ca -0.06 0.15 0.06 0.00 -0.80 0.00 0.00 55.06 54.41 3kqx s HIS 174 Cb -0.04 -0.07 -0.01 0.00 -1.43 0.00 0.00 32.58 31.03 3kqx s HIS 174 CO 0.02 -0.06 -0.21 -0.06 -2.00 0.00 0.00 174.74 172.43 3kqx s PHE 175 N 0.44 1.95 -0.03 0.38 2.99 0.37 -4.95 117.98 119.13 3kqx s PHE 175 Ca -0.04 -0.42 -0.19 0.00 0.00 0.00 0.00 56.93 56.29 3kqx s PHE 175 Cb -0.05 -1.27 -0.05 0.00 0.00 0.00 0.00 43.02 41.65 3kqx s PHE 175 CO -0.01 -0.07 0.53 0.71 -0.00 0.00 0.00 175.22 176.38 3kqx s TYR 176 N -0.40 3.66 0.32 0.36 2.02 -1.26 -1.49 117.35 120.56 3kqx s TYR 176 Ca 0.05 1.10 -0.12 0.00 -0.37 0.00 0.00 57.07 57.73 3kqx s TYR 176 Cb -0.09 -2.53 0.02 0.00 -0.40 0.00 0.00 41.96 38.95 3kqx s TYR 176 CO 0.00 0.37 0.60 0.00 -1.57 0.00 0.00 175.55 174.96 3kqx s MET 177 N -0.21 1.87 -0.15 -0.62 0.23 0.04 -5.01 119.30 115.46 3kqx s MET 177 Ca 0.28 -1.39 -0.08 0.00 -1.03 0.00 0.00 55.69 53.47 3kqx s MET 177 Cb -0.17 0.53 -0.04 0.00 -1.53 0.00 0.00 34.83 33.61 3kqx s MET 177 CO 0.15 -0.82 0.13 -0.06 -2.03 0.00 0.00 175.02 172.39 3kqx s PHE 178 N -3.27 3.52 0.00 3.16 0.08 -1.26 -0.64 117.98 119.57 3kqx s PHE 178 Ca 0.21 0.45 0.00 0.00 0.12 0.00 0.00 56.93 57.71 3kqx s PHE 178 Cb -0.03 -2.02 0.00 0.00 -0.57 0.00 0.00 43.02 40.40 3kqx s PHE 178 CO 0.12 0.57 0.00 0.27 -0.10 0.00 0.00 175.22 176.08 3kqx n ASN 179 N 2.56 0.00 0.21 1.36 6.94 -0.29 -4.80 115.26 121.24 3kqx n ASN 179 Ca -0.18 -0.77 0.15 0.00 -0.02 0.00 0.00 54.58 53.75 3kqx n ASN 179 Cb 0.54 0.00 0.77 0.00 -2.36 0.00 0.00 39.78 38.73 3kqx n ASN 179 CO 0.00 0.00 0.00 0.44 -1.03 0.00 0.00 177.26 176.67 3kqx h ASP 180 N 0.00 0.00 -0.14 0.53 3.32 -1.90 -1.83 116.42 116.39 3kqx h ASP 180 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3kqx h ASP 180 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 3kqx h ASP 180 CO 0.00 0.00 0.00 0.59 -1.72 0.00 0.00 179.24 178.11 3kqx n ASN 181 N -4.12 1.90 -0.82 6.45 3.02 -1.26 -4.91 115.26 115.52 3kqx n ASN 181 Ca 0.01 -1.70 -0.08 0.00 -0.03 0.00 0.00 54.58 52.77 3kqx n ASN 181 Cb 0.25 -0.09 -0.02 0.00 -0.61 0.00 0.00 39.78 39.32 3kqx n ASN 181 CO 0.00 0.00 0.00 2.29 -2.62 0.00 0.00 177.26 176.93 3kqx n LYS 182 N 0.47 -0.62 -3.84 3.52 2.85 -0.69 -5.03 118.16 114.82 3kqx n LYS 182 Ca 0.17 0.55 -0.30 0.00 -1.05 0.00 0.00 58.31 57.67 3kqx n LYS 182 Cb 0.38 -4.46 -0.04 0.00 -0.65 0.00 0.00 35.03 30.26 3kqx n LYS 182 CO 0.00 0.00 0.00 -0.80 -0.05 0.00 0.00 177.40 176.55 3kqx s ASN 183 N -2.74 6.39 -0.44 -5.58 0.01 -1.26 -4.84 114.94 106.48 3kqx s ASN 183 Ca 0.00 0.35 -0.29 0.00 -0.71 0.00 0.00 52.86 52.21 3kqx s ASN 183 Cb 0.00 -1.99 0.02 0.00 0.41 0.00 0.00 41.25 39.69 3kqx s ASN 183 CO 0.00 0.11 1.30 -0.55 -1.51 0.00 0.00 177.10 176.45 3kqx s SER 184 N -2.61 6.47 -0.04 -1.22 0.15 -1.26 -1.13 113.70 114.06 3kqx s SER 184 Ca 0.37 0.69 -0.00 0.00 0.70 0.00 0.00 55.95 57.71 3kqx s SER 184 Cb -0.12 -2.54 -0.03 0.00 -1.71 0.00 0.00 66.02 61.61 3kqx s SER 184 CO 0.27 -1.35 0.01 -0.69 1.20 0.00 0.00 173.24 172.68 3kqx s VAL 185 N 5.00 4.25 -0.17 4.45 1.01 0.19 -4.37 120.40 130.76 3kqx s VAL 185 Ca 0.56 -0.44 -0.07 0.00 0.00 0.00 0.00 61.98 62.03 3kqx s VAL 185 Cb -0.11 -2.85 -0.04 0.00 0.00 0.00 0.00 36.38 33.38 3kqx s VAL 185 CO 0.32 0.48 0.05 0.00 0.00 0.00 0.00 175.10 175.95 3kqx s ALA 186 N -1.00 3.37 0.02 5.51 0.00 -0.04 -0.78 121.76 128.84 3kqx s ALA 186 Ca 0.17 -0.75 0.05 0.00 0.00 0.00 0.00 51.96 51.43 3kqx s ALA 186 Cb -0.11 -1.86 -0.02 0.00 0.00 0.00 0.00 23.12 21.12 3kqx s ALA 186 CO 0.07 0.21 -0.15 0.08 0.00 0.00 0.00 175.76 175.98 3kqx s VAL 187 N 0.28 1.15 0.01 0.00 1.01 -0.55 -0.44 120.40 121.86 3kqx s VAL 187 Ca 0.03 -0.84 -0.01 0.00 0.00 0.00 0.00 61.98 61.15 3kqx s VAL 187 Cb -0.12 -1.01 0.00 0.00 0.00 0.00 0.00 36.38 35.25 3kqx s VAL 187 CO 0.01 0.15 0.06 0.61 0.00 0.00 0.00 175.10 175.93 3kqx n GLY 188 N 2.25 1.34 3.14 4.51 0.00 0.10 -0.48 105.19 116.06 3kqx n GLY 188 Ca -0.16 -0.94 -0.09 0.00 0.00 0.00 0.00 46.02 44.82 3kqx n GLY 188 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3kqx s TYR 189 N -6.11 0.79 -0.10 1.61 1.13 -0.68 -1.43 117.35 112.56 3kqx s TYR 189 Ca 0.01 -1.15 0.03 0.00 -1.41 0.00 0.00 57.07 54.55 3kqx s TYR 189 Cb -0.00 -0.47 0.01 0.00 -1.10 0.00 0.00 41.96 40.39 3kqx s TYR 189 CO 0.00 -0.44 -0.19 0.08 -2.51 0.00 0.00 175.55 172.50 3kqx s VAL 190 N -3.96 1.69 0.06 -3.49 1.01 -0.57 -3.04 120.40 112.11 3kqx s VAL 190 Ca 0.18 -0.79 -0.31 0.00 0.00 0.00 0.00 61.98 61.07 3kqx s VAL 190 Cb 0.07 -1.50 -0.06 0.00 0.00 0.00 0.00 36.38 34.89 3kqx s VAL 190 CO -0.02 0.48 1.31 -0.83 0.00 0.00 0.00 175.10 176.04 3kqx s GLY 191 N 0.67 2.11 -0.15 4.51 0.00 0.37 -2.44 107.32 112.39 3kqx s GLY 191 Ca -0.13 0.94 0.16 0.00 0.00 0.00 0.00 44.72 45.69 3kqx s GLY 191 CO 0.03 2.27 1.49 0.00 0.00 0.00 0.00 173.10 176.88 3kqx n GLY 193 N 0.09 0.34 0.06 0.00 0.00 0.75 -4.47 105.19 101.96 3kqx n GLY 193 Ca 0.22 -0.86 -0.04 0.00 0.00 0.00 0.00 46.02 45.33 3kqx n GLY 193 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3kqx n SER 194 N -0.69 1.58 -4.67 1.61 7.64 -1.26 -1.13 113.62 116.69 3kqx n SER 194 Ca 0.00 0.00 -0.42 0.00 1.01 0.00 0.00 58.87 59.46 3kqx n SER 194 Cb 0.00 1.02 -0.03 0.00 -1.01 0.00 0.00 64.21 64.19 3kqx n SER 194 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 3kqx s VAL 195 N -2.48 4.77 0.28 0.44 1.01 -1.26 -3.40 120.40 119.75 3kqx s VAL 195 Ca -0.07 1.97 0.31 0.00 0.00 0.00 0.00 61.98 64.19 3kqx s VAL 195 Cb 0.05 -4.28 0.34 0.00 0.00 0.00 0.00 36.38 32.49 3kqx s VAL 195 CO 0.58 -0.05 2.03 0.00 0.00 0.00 0.00 175.10 177.66 3kqx h ALA 196 N 7.26 1.08 -3.15 5.51 0.00 -1.94 -3.39 119.26 124.64 3kqx h ALA 196 Ca -0.27 -0.08 -0.65 0.00 0.00 0.00 0.00 54.91 53.92 3kqx h ALA 196 Cb 1.11 -0.01 -0.25 0.00 0.00 0.00 0.00 17.79 18.64 3kqx h ALA 196 CO 0.89 0.10 -0.71 0.16 0.00 0.00 0.00 179.25 179.70 3kqx s ASP 197 N -5.85 4.42 -0.06 0.00 1.47 -1.26 -4.59 116.67 110.79 3kqx s ASP 197 Ca -0.01 -0.29 -0.18 0.00 1.18 0.00 0.00 52.55 53.25 3kqx s ASP 197 Cb 0.11 -1.73 -0.05 0.00 -0.34 0.00 0.00 42.92 40.91 3kqx s ASP 197 CO 0.56 0.07 0.48 -0.76 0.68 0.00 0.00 175.17 176.20 3kqx s LEU 198 N 0.92 4.35 0.66 2.11 1.02 -1.26 -5.07 118.68 121.41 3kqx s LEU 198 Ca -0.01 0.92 -0.12 0.00 0.02 0.00 0.00 54.13 54.95 3kqx s LEU 198 Cb -0.15 -2.72 -0.01 0.00 0.02 0.00 0.00 46.19 43.34 3kqx s LEU 198 CO 0.01 0.10 1.05 -0.94 0.02 0.00 0.00 176.35 176.59 3kqx s SER 199 N 0.03 5.63 0.42 2.29 1.04 -1.26 -4.88 113.70 116.98 3kqx s SER 199 Ca 0.26 1.60 0.25 0.00 0.48 0.00 0.00 55.95 58.54 3kqx s SER 199 Cb -0.16 -2.50 1.29 0.00 0.10 0.00 0.00 66.02 64.75 3kqx s SER 199 CO 0.12 -1.27 1.68 -0.08 0.98 0.00 0.00 173.24 174.67 3kqx h GLU 200 N -0.44 0.20 0.13 4.02 4.22 -1.98 -0.13 114.58 120.60 3kqx h GLU 200 Ca -0.44 -0.01 -0.28 0.00 0.08 0.00 0.00 59.36 58.71 3kqx h GLU 200 Cb 1.21 -0.05 0.01 0.00 0.50 0.00 0.00 28.75 30.42 3kqx h GLU 200 CO 0.58 0.13 -1.26 0.00 -2.18 0.00 0.00 179.01 176.28 3kqx h ALA 201 N 1.64 0.09 -0.38 2.92 0.00 -1.94 -2.71 119.26 118.88 3kqx h ALA 201 Ca 0.73 -0.89 -0.06 0.00 0.00 0.00 0.00 54.91 54.69 3kqx h ALA 201 Cb 2.12 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 19.92 3kqx h ALA 201 CO -0.40 0.97 -0.02 -0.44 0.00 0.00 0.00 179.25 179.36 3kqx h ASP 202 N 0.08 0.67 -0.43 0.00 3.45 -1.76 -2.91 116.42 115.52 3kqx h ASP 202 Ca -0.14 -0.32 -0.09 0.00 0.43 0.00 0.00 57.03 56.91 3kqx h ASP 202 Cb 1.98 -0.18 -0.02 0.00 -0.56 0.00 0.00 39.33 40.55 3kqx h ASP 202 CO 0.21 0.82 -0.07 -0.03 -1.57 0.00 0.00 179.24 178.59 3kqx h MET 203 N 0.49 0.87 -0.90 3.56 4.05 -1.13 -1.59 114.93 120.29 3kqx h MET 203 Ca 0.10 -0.28 0.08 0.00 -0.28 0.00 0.00 59.70 59.32 3kqx h MET 203 Cb 0.49 -0.08 -0.07 0.00 -0.80 0.00 0.00 31.60 31.15 3kqx h MET 203 CO 0.02 0.91 0.56 0.87 0.23 0.00 0.00 176.91 179.50 3kqx h LYS 204 N 0.79 0.95 -0.17 0.39 6.56 -1.46 -1.16 116.57 122.47 3kqx h LYS 204 Ca 0.14 -0.06 -0.13 0.00 -1.06 0.00 0.00 60.65 59.54 3kqx h LYS 204 Cb 0.58 -0.21 -0.01 0.00 -0.57 0.00 0.00 32.23 32.01 3kqx h LYS 204 CO 0.04 0.63 -0.44 0.00 -2.06 0.00 0.00 179.45 177.61 3kqx h ARG 205 N 0.98 0.42 -0.19 3.15 3.08 -1.23 -1.15 114.38 119.44 3kqx h ARG 205 Ca 0.41 -0.22 -0.03 0.00 0.07 0.00 0.00 59.98 60.21 3kqx h ARG 205 Cb 0.25 0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.30 3kqx h ARG 205 CO -0.20 0.78 0.02 0.28 -1.07 0.00 0.00 179.97 179.78 3kqx h VAL 206 N 0.34 1.24 -0.71 2.04 2.07 -0.88 -2.99 116.25 117.35 3kqx h VAL 206 Ca 0.03 -0.80 -0.07 0.00 0.82 0.00 0.00 66.70 66.68 3kqx h VAL 206 Cb 0.91 1.40 -0.03 0.00 -1.52 0.00 0.00 31.29 32.05 3kqx h VAL 206 CO 0.08 0.24 0.17 0.58 0.02 0.00 0.00 177.57 178.66 3kqx h VAL 207 N 0.10 1.26 -0.78 2.57 2.07 -1.07 -2.21 116.25 118.19 3kqx h VAL 207 Ca 0.06 -0.99 -0.04 0.00 0.82 0.00 0.00 66.70 66.55 3kqx h VAL 207 Cb 0.35 0.54 -0.04 0.00 -1.52 0.00 0.00 31.29 30.62 3kqx h VAL 207 CO 0.01 0.38 0.35 -0.07 0.02 0.00 0.00 177.57 178.25 3kqx h LEU 208 N 1.08 1.04 -0.30 2.57 3.38 -1.25 0.16 115.31 122.00 3kqx h LEU 208 Ca 0.22 -0.14 -0.06 0.00 0.09 0.00 0.00 57.88 57.99 3kqx h LEU 208 Cb 0.39 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.86 3kqx h LEU 208 CO 0.00 0.90 -0.06 -1.28 0.09 0.00 0.00 178.44 178.10 3kqx h SER 209 N 1.13 0.57 -0.45 -0.43 0.87 -1.39 -1.08 113.55 112.76 3kqx h SER 209 Ca 0.27 -0.35 0.07 0.00 -1.23 0.00 0.00 61.79 60.54 3kqx h SER 209 Cb 0.16 -0.16 -0.06 0.00 -0.44 0.00 0.00 62.40 61.90 3kqx h SER 209 CO -0.03 0.79 0.10 0.25 -0.53 0.00 0.00 176.83 177.41 3kqx h LEU 210 N 0.34 0.03 -1.02 2.23 5.85 -0.94 -2.94 115.31 118.86 3kqx h LEU 210 Ca 0.08 0.08 -0.08 0.00 0.84 0.00 0.00 57.88 58.79 3kqx h LEU 210 Cb 0.53 0.10 -0.02 0.00 0.37 0.00 0.00 40.66 41.64 3kqx h LEU 210 CO 0.03 0.05 -0.14 0.58 -0.34 0.00 0.00 178.44 178.61 3kqx h VAL 211 N 0.24 1.24 -0.74 1.05 2.07 -0.51 -2.04 116.25 117.56 3kqx h VAL 211 Ca 0.22 -1.08 0.09 0.00 0.82 0.00 0.00 66.70 66.74 3kqx h VAL 211 Cb 0.27 1.16 -0.07 0.00 -1.52 0.00 0.00 31.29 31.14 3kqx h VAL 211 CO -0.28 0.35 0.40 0.74 0.02 0.00 0.00 177.57 178.80 3kqx h THR 212 N 0.49 0.89 -0.54 2.57 2.02 -1.02 -0.22 112.91 117.11 3kqx h THR 212 Ca 0.09 -0.23 -0.11 0.00 0.77 0.00 0.00 66.41 66.92 3kqx h THR 212 Cb 0.54 0.15 -0.02 0.00 -1.74 0.00 0.00 68.15 67.08 3kqx h THR 212 CO 0.03 0.12 -0.09 0.24 0.37 0.00 0.00 175.52 176.20 3kqx h MET 213 N 0.68 1.02 -0.27 6.66 2.07 -1.36 -2.92 114.93 120.82 3kqx h MET 213 Ca 0.36 -0.37 -0.07 0.00 -2.07 0.00 0.00 59.70 57.54 3kqx h MET 213 Cb 0.33 -0.07 -0.02 0.00 -1.87 0.00 0.00 31.60 29.97 3kqx h MET 213 CO -0.24 1.06 -0.13 -0.07 1.07 0.00 0.00 176.91 178.60 3kqx h LEU 214 N 0.90 0.44 -0.54 1.22 3.38 -0.55 -2.83 115.31 117.34 3kqx h LEU 214 Ca 0.14 -0.11 0.00 0.00 0.09 0.00 0.00 57.88 58.00 3kqx h LEU 214 Cb 0.66 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.29 3kqx h LEU 214 CO 0.05 0.60 0.00 0.45 0.09 0.00 0.00 178.44 179.63 3kqx h HIS 215 N 0.42 0.00 0.00 1.13 3.86 -0.91 -3.23 115.15 116.43 3kqx h HIS 215 Ca 0.08 0.00 -0.01 0.00 -1.16 0.00 0.00 60.37 59.28 3kqx h HIS 215 Cb 0.48 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.94 3kqx h HIS 215 CO 0.01 0.00 -0.19 -0.25 0.86 0.00 0.00 177.93 178.36 3kqx n ASP 216 N -2.72 1.85 -4.01 2.45 10.43 -1.10 -4.98 116.55 118.47 3kqx n ASP 216 Ca 0.03 -3.02 -0.23 0.00 2.57 0.00 0.00 54.79 54.14 3kqx n ASP 216 Cb 0.38 -0.41 -0.16 0.00 1.84 0.00 0.00 41.12 42.77 3kqx n ASP 216 CO 0.00 0.00 0.00 0.20 -1.07 0.00 0.00 177.20 176.33 3kqx s ASN 217 N -2.62 1.60 -0.70 -2.24 0.01 -1.08 -5.06 114.94 104.84 3kqx s ASN 217 Ca 0.28 -0.26 -0.27 0.00 -0.71 0.00 0.00 52.86 51.90 3kqx s ASN 217 Cb 0.26 -0.69 0.03 0.00 0.41 0.00 0.00 41.25 41.26 3kqx s ASN 217 CO 0.00 0.03 1.24 -0.54 -1.51 0.00 0.00 177.10 176.32 3kqx s LYS 218 N 0.59 3.26 0.04 -0.60 3.01 -1.26 -4.88 119.74 119.90 3kqx s LYS 218 Ca -0.12 -0.16 0.06 0.00 -1.01 0.00 0.00 55.97 54.74 3kqx s LYS 218 Cb -0.14 -4.14 -0.02 0.00 -1.01 0.00 0.00 37.83 32.51 3kqx s LYS 218 CO 0.03 -2.01 -0.18 -0.51 0.51 0.00 0.00 175.35 173.19 3kqx s LEU 219 N 5.44 2.15 0.06 3.17 1.43 -1.26 -5.02 118.68 124.65 3kqx s LEU 219 Ca 0.36 -0.47 0.18 0.00 -1.03 0.00 0.00 54.13 53.17 3kqx s LEU 219 Cb -0.08 -0.82 -0.14 0.00 0.03 0.00 0.00 46.19 45.18 3kqx s LEU 219 CO 0.17 0.12 0.77 -1.54 0.23 0.00 0.00 176.35 176.10 3kqx n SER 220 N 1.96 0.71 -3.88 2.29 3.41 -1.26 -3.97 113.62 112.87 3kqx n SER 220 Ca -0.17 0.30 -0.12 0.00 -0.26 0.00 0.00 58.87 58.62 3kqx n SER 220 Cb 0.54 0.46 -0.13 0.00 -0.26 0.00 0.00 64.21 64.82 3kqx n SER 220 CO 0.00 0.00 0.00 -0.75 -0.16 0.00 0.00 175.04 174.13 3kqx s LYS 221 N -3.03 0.06 -0.06 4.33 2.36 -1.26 -0.92 119.74 121.22 3kqx s LYS 221 Ca -0.04 -0.07 0.06 0.00 -2.55 0.00 0.00 55.97 53.38 3kqx s LYS 221 Cb 0.09 0.02 -0.01 0.00 -1.05 0.00 0.00 37.83 36.89 3kqx s LYS 221 CO 0.82 -0.01 -0.24 -1.17 1.55 0.00 0.00 175.35 176.30 3kqx s LEU 222 N -0.20 2.05 -0.05 5.43 2.96 -0.75 -1.25 118.68 126.87 3kqx s LEU 222 Ca -0.02 -0.50 0.05 0.00 -0.22 0.00 0.00 54.13 53.44 3kqx s LEU 222 Cb -0.01 -1.33 -0.01 0.00 0.50 0.00 0.00 46.19 45.33 3kqx s LEU 222 CO -0.00 0.22 -0.21 0.42 -1.32 0.00 0.00 176.35 175.46 3kqx s THR 223 N -0.08 1.77 -0.10 3.68 -4.23 0.82 -1.09 115.64 116.41 3kqx s THR 223 Ca -0.06 -0.90 0.01 0.00 -1.18 0.00 0.00 61.69 59.56 3kqx s THR 223 Cb -0.14 -1.51 -0.02 0.00 1.34 0.00 0.00 72.50 72.17 3kqx s THR 223 CO 0.04 0.50 -0.12 -0.69 -0.54 0.00 0.00 174.62 173.81 3kqx s VAL 224 N -0.02 3.21 -0.21 2.29 1.01 0.37 -1.36 120.40 125.68 3kqx s VAL 224 Ca -0.05 -0.63 -0.02 0.00 0.00 0.00 0.00 61.98 61.29 3kqx s VAL 224 Cb -0.13 -2.33 0.01 0.00 0.00 0.00 0.00 36.38 33.93 3kqx s VAL 224 CO 0.03 0.55 -0.10 -0.69 0.00 0.00 0.00 175.10 174.89 3kqx s VAL 225 N -0.06 2.81 -0.62 2.92 1.01 -0.09 -0.62 120.40 125.74 3kqx s VAL 225 Ca -0.02 -0.78 -0.25 0.00 0.00 0.00 0.00 61.98 60.94 3kqx s VAL 225 Cb -0.14 -2.29 0.05 0.00 0.00 0.00 0.00 36.38 34.00 3kqx s VAL 225 CO 0.04 0.40 1.05 -0.36 0.00 0.00 0.00 175.10 176.23 3kqx s PHE 226 N 1.38 2.63 -0.37 5.22 0.40 0.45 -0.20 117.98 127.49 3kqx s PHE 226 Ca 0.04 -0.12 0.06 0.00 -0.60 0.00 0.00 56.93 56.31 3kqx s PHE 226 Cb -0.14 -4.31 0.49 0.00 0.51 0.00 0.00 43.02 39.57 3kqx s PHE 226 CO -0.07 -1.62 1.51 0.39 0.70 0.00 0.00 175.22 176.14 3kqx n GLU 227 N 8.05 2.55 -4.00 0.44 1.02 -0.80 -4.80 120.64 123.09 3kqx n GLU 227 Ca 0.01 -3.50 -0.08 0.00 -0.02 0.00 0.00 57.16 53.56 3kqx n GLU 227 Cb 0.47 -2.06 -0.10 0.00 -0.02 0.00 0.00 31.44 29.73 3kqx n GLU 227 CO 0.00 0.00 0.00 0.96 1.18 0.00 0.00 177.13 179.27 3kqx s ILE 228 N -3.97 0.15 -0.10 -3.67 -4.36 -1.24 -4.42 121.20 103.58 3kqx s ILE 228 Ca 0.51 -1.26 -0.24 0.00 -0.26 0.00 0.00 60.65 59.41 3kqx s ILE 228 Cb 0.43 -0.84 -0.03 0.00 1.25 0.00 0.00 42.46 43.27 3kqx s ILE 228 CO 0.01 -0.69 0.73 0.20 0.24 0.00 0.00 174.94 175.43 3kqx s ASN 229 N -2.11 6.96 -0.03 4.36 -0.87 -1.26 -5.07 114.94 116.92 3kqx s ASN 229 Ca -0.06 1.17 0.01 0.00 -1.57 0.00 0.00 52.86 52.41 3kqx s ASN 229 Cb -0.02 -2.42 0.01 0.00 -0.02 0.00 0.00 41.25 38.81 3kqx s ASN 229 CO -0.05 -0.20 -0.05 0.68 -2.57 0.00 0.00 177.10 174.92 3kqx s VAL 230 N 1.20 0.49 0.67 1.60 -7.23 -1.26 -4.77 120.40 111.11 3kqx s VAL 230 Ca 0.37 -0.15 -0.17 0.00 -1.81 0.00 0.00 61.98 60.22 3kqx s VAL 230 Cb -0.17 -0.49 -0.15 0.00 0.56 0.00 0.00 36.38 36.13 3kqx s VAL 230 CO 0.17 0.19 -0.36 -0.67 -0.31 0.00 0.00 175.10 174.11 3kqx n ASP 231 N 3.68 -4.46 -0.30 4.85 2.03 -1.26 -4.76 116.55 116.33 3kqx n ASP 231 Ca -0.22 0.48 -0.04 0.00 0.52 0.00 0.00 54.79 55.53 3kqx n ASP 231 Cb 0.53 -0.81 0.07 0.00 -0.72 0.00 0.00 41.12 40.20 3kqx n ASP 231 CO 0.00 0.00 0.00 0.07 -1.92 0.00 0.00 177.20 175.35 3kqx h LYS 232 N -0.36 1.06 -0.62 -0.67 2.10 -1.99 -1.02 116.57 115.08 3kqx h LYS 232 Ca -0.42 -0.06 -0.09 0.00 -2.00 0.00 0.00 60.65 58.08 3kqx h LYS 232 Cb 1.38 -0.24 -0.02 0.00 -0.90 0.00 0.00 32.23 32.44 3kqx h LYS 232 CO 0.35 0.70 0.02 -0.91 -2.00 0.00 0.00 179.45 177.61 3kqx h ASN 233 N 1.09 1.06 -0.22 7.07 2.35 -1.92 -2.38 115.58 122.63 3kqx h ASN 233 Ca 0.30 -0.30 -0.18 0.00 -0.55 0.00 0.00 56.30 55.57 3kqx h ASN 233 Cb -0.12 -0.28 -0.00 0.00 0.05 0.00 0.00 38.32 37.96 3kqx h ASN 233 CO -0.07 1.10 -0.53 0.25 -1.65 0.00 0.00 177.43 176.53 3kqx h LEU 234 N 0.99 0.90 -0.17 1.61 5.85 -1.86 -0.81 115.31 121.81 3kqx h LEU 234 Ca 0.18 -0.47 0.00 0.00 0.84 0.00 0.00 57.88 58.43 3kqx h LEU 234 Cb 0.54 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 41.31 3kqx h LEU 234 CO 0.03 1.25 0.10 0.15 -0.34 0.00 0.00 178.44 179.63 3kqx h PHE 235 N 0.63 0.20 -0.89 1.25 3.57 -1.15 0.85 116.94 121.39 3kqx h PHE 235 Ca 0.02 0.01 0.08 0.00 3.53 0.00 0.00 57.97 61.60 3kqx h PHE 235 Cb 1.12 -0.06 -0.07 0.00 2.79 0.00 0.00 35.95 39.73 3kqx h PHE 235 CO 0.07 0.12 0.54 -0.09 -2.23 0.00 0.00 178.31 176.72 3kqx h ARG 236 N 0.22 0.93 -0.28 1.11 2.43 -1.31 -2.24 114.38 115.23 3kqx h ARG 236 Ca 0.06 -0.06 0.02 0.00 -0.81 0.00 0.00 59.98 59.20 3kqx h ARG 236 Cb -0.01 -0.21 -0.02 0.00 -0.42 0.00 0.00 29.97 29.31 3kqx h ARG 236 CO -0.03 0.61 0.15 0.35 -1.51 0.00 0.00 179.97 179.55 3kqx h PHE 237 N 0.95 0.27 -0.54 2.20 3.57 -0.52 -0.26 116.94 122.63 3kqx h PHE 237 Ca 0.40 0.01 0.09 0.00 3.53 0.00 0.00 57.97 62.01 3kqx h PHE 237 Cb 0.26 -0.08 -0.11 0.00 2.79 0.00 0.00 35.95 38.81 3kqx h PHE 237 CO -0.03 0.15 -0.37 0.35 -2.23 0.00 0.00 178.31 176.19 3kqx h PHE 238 N 0.31 -1.03 0.16 0.41 3.57 -0.69 -1.24 116.94 118.43 3kqx h PHE 238 Ca 0.12 0.07 -0.01 0.00 3.53 0.00 0.00 57.97 61.68 3kqx h PHE 238 Cb 0.03 0.53 0.00 0.00 2.79 0.00 0.00 35.95 39.30 3kqx h PHE 238 CO -0.09 -0.40 -0.08 -0.07 -2.23 0.00 0.00 178.31 175.44 3kqx h LEU 239 N -0.21 -0.19 -0.88 0.59 4.07 -0.68 -0.63 115.31 117.38 3kqx h LEU 239 Ca 0.20 0.01 -0.05 0.00 0.08 0.00 0.00 57.88 58.12 3kqx h LEU 239 Cb 0.56 0.05 -0.03 0.00 1.08 0.00 0.00 40.66 42.32 3kqx h LEU 239 CO -0.65 -0.13 0.23 -0.33 -1.08 0.00 0.00 178.44 176.48 3kqx h GLU 240 N -0.22 1.06 -0.44 1.13 5.08 -0.92 -0.44 114.58 119.83 3kqx h GLU 240 Ca -0.02 -0.21 -0.13 0.00 -1.00 0.00 0.00 59.36 58.00 3kqx h GLU 240 Cb 0.17 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 29.25 3kqx h GLU 240 CO 0.03 0.90 -0.25 1.15 -1.00 0.00 0.00 179.01 179.84 3kqx h THR 241 N 1.03 1.27 0.52 1.13 2.02 -1.16 -1.03 112.91 116.69 3kqx h THR 241 Ca 0.23 -1.41 -0.03 0.00 0.77 0.00 0.00 66.41 65.97 3kqx h THR 241 Cb 0.26 1.22 0.01 0.00 -1.74 0.00 0.00 68.15 67.90 3kqx h THR 241 CO -0.01 0.48 -0.25 0.25 0.37 0.00 0.00 175.52 176.36 3kqx h LEU 242 N 0.79 -0.59 -0.39 2.58 5.85 -0.64 -0.77 115.31 122.14 3kqx h LEU 242 Ca 0.09 0.02 0.08 0.00 0.84 0.00 0.00 57.88 58.91 3kqx h LEU 242 Cb 0.83 0.15 -0.09 0.00 0.37 0.00 0.00 40.66 41.93 3kqx h LEU 242 CO 0.07 -0.42 -0.25 -0.26 -0.34 0.00 0.00 178.44 177.24 3kqx h PHE 243 N -0.71 -0.67 0.20 1.25 0.04 -1.09 0.11 116.94 116.08 3kqx h PHE 243 Ca -0.07 0.05 -0.01 0.00 2.80 0.00 0.00 57.97 60.74 3kqx h PHE 243 Cb 0.54 0.35 0.00 0.00 2.20 0.00 0.00 35.95 39.05 3kqx h PHE 243 CO -0.04 -0.33 -0.10 -0.92 -0.60 0.00 0.00 178.31 176.33 3kqx h TYR 244 N -0.19 -0.25 -0.56 -0.55 3.20 -1.11 -0.95 116.97 116.55 3kqx h TYR 244 Ca 0.18 -0.01 -0.11 0.00 3.14 0.00 0.00 58.73 61.94 3kqx h TYR 244 Cb 0.48 0.08 -0.02 0.00 1.54 0.00 0.00 36.73 38.82 3kqx h TYR 244 CO -0.47 -0.09 -0.08 0.93 -1.64 0.00 0.00 178.16 176.81 3kqx h GLU 245 N -0.35 1.04 -0.28 1.82 4.39 -1.12 -3.10 114.58 116.98 3kqx h GLU 245 Ca -0.03 -0.37 -0.00 0.00 0.34 0.00 0.00 59.36 59.30 3kqx h GLU 245 Cb 0.27 -0.07 -0.01 0.00 -0.10 0.00 0.00 28.75 28.83 3kqx h GLU 245 CO 0.05 1.07 0.17 -0.92 -1.16 0.00 0.00 179.01 178.21 3kqx h TYR 246 N 0.93 0.37 -3.34 4.33 3.20 -0.70 -3.43 116.97 118.33 3kqx h TYR 246 Ca 0.15 -0.00 -0.53 0.00 3.14 0.00 0.00 58.73 61.49 3kqx h TYR 246 Cb 0.64 -0.12 0.07 0.00 1.54 0.00 0.00 36.73 38.87 3kqx h TYR 246 CO 0.04 0.28 0.85 1.41 -1.64 0.00 0.00 178.16 179.10 3kqx s MET 247 N -6.01 4.17 -0.03 1.82 1.75 -0.37 -5.01 119.30 115.62 3kqx s MET 247 Ca -0.13 2.49 0.07 0.00 -1.25 0.00 0.00 55.69 56.86 3kqx s MET 247 Cb 0.09 -3.05 -0.01 0.00 2.84 0.00 0.00 34.83 34.70 3kqx s MET 247 CO 0.71 -0.56 -0.23 0.95 -0.65 0.00 0.00 175.02 175.23 3kqx s THR 248 N -0.00 1.88 -0.50 10.11 -4.23 -1.26 -4.94 115.64 116.69 3kqx s THR 248 Ca 0.62 -1.00 -0.19 0.00 -1.18 0.00 0.00 61.69 59.94 3kqx s THR 248 Cb -0.46 -1.57 0.06 0.00 1.34 0.00 0.00 72.50 71.87 3kqx s THR 248 CO 0.46 0.53 0.59 -0.62 -0.54 0.00 0.00 174.62 175.05 3kqx s ASP 249 N -0.40 6.22 -0.21 3.99 -1.08 -1.26 -4.93 116.67 119.00 3kqx s ASP 249 Ca 0.05 -0.95 0.14 0.00 -0.52 0.00 0.00 52.55 51.27 3kqx s ASP 249 Cb -0.11 -2.28 0.50 0.00 -1.46 0.00 0.00 42.92 39.57 3kqx s ASP 249 CO 0.01 -0.85 1.41 -0.62 0.52 0.00 0.00 175.17 175.63 3kqx n GLU 250 N 6.04 2.39 0.22 4.34 1.02 -1.26 -4.71 120.64 128.68 3kqx n GLU 250 Ca -0.07 -2.92 0.06 0.00 -0.02 0.00 0.00 57.16 54.21 3kqx n GLU 250 Cb 0.45 -1.80 0.51 0.00 -0.02 0.00 0.00 31.44 30.58 3kqx n GLU 250 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3kqx h ARG 251 N 1.34 0.00 -0.28 3.49 3.08 -1.99 -2.53 114.38 117.50 3kqx h ARG 251 Ca 0.07 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.12 3kqx h ARG 251 Cb 1.47 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.52 3kqx h ARG 251 CO 0.25 0.21 0.00 1.19 -1.07 0.00 0.00 179.97 180.56 3kqx n PHE 252 N -4.13 0.35 -3.02 3.04 3.01 -1.26 -4.93 117.46 110.51 3kqx n PHE 252 Ca -0.02 -0.22 -0.39 0.00 1.01 0.00 0.00 57.45 57.82 3kqx n PHE 252 Cb 0.28 -0.00 -0.06 0.00 -0.01 0.00 0.00 39.48 39.69 3kqx n PHE 252 CO 0.00 0.00 0.00 0.15 1.01 0.00 0.00 176.76 177.92 3kqx s LYS 253 N -1.31 4.52 0.00 -1.08 -0.14 -0.96 -5.27 119.74 115.50 3kqx s LYS 253 Ca 0.30 1.10 0.00 0.00 -1.36 0.00 0.00 55.97 56.01 3kqx s LYS 253 Cb 0.18 -3.25 0.00 0.00 -1.68 0.00 0.00 37.83 33.08 3kqx s LYS 253 CO 0.25 0.58 0.85 -1.13 -0.76 0.00 0.00 175.35 175.13 3kqx n SER 254 N 1.58 2.51 0.00 2.83 3.41 -1.26 -5.07 113.62 117.62 3kqx n SER 254 Ca -0.06 -1.76 0.00 0.00 -0.26 0.00 0.00 58.87 56.79 3kqx n SER 254 Cb 0.49 -0.44 0.00 0.00 -0.26 0.00 0.00 64.21 64.00 3kqx n SER 254 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3kqx n GLU 262 N 0.52 0.00 -2.42 4.33 1.02 -1.26 -5.18 120.64 117.65 3kqx n GLU 262 Ca 0.00 0.00 -0.32 0.00 -0.02 0.00 0.00 57.16 56.82 3kqx n GLU 262 Cb 0.42 0.00 -0.04 0.00 -0.02 0.00 0.00 31.44 31.81 3kqx n GLU 262 CO 0.00 0.00 0.00 0.71 1.18 0.00 0.00 177.13 179.02 3kqx s TYR 263 N -0.07 3.45 0.83 -0.32 2.02 -1.26 -4.65 117.35 117.35 3kqx s TYR 263 Ca 0.00 1.46 -0.13 0.00 -0.37 0.00 0.00 57.07 58.03 3kqx s TYR 263 Cb 0.00 -2.78 0.09 0.00 -0.40 0.00 0.00 41.96 38.87 3kqx s TYR 263 CO 0.00 -0.35 1.20 0.96 -1.57 0.00 0.00 175.55 175.78 3kqx s ILE 264 N -2.61 2.04 -0.26 2.71 -4.36 -1.25 -4.90 121.20 112.56 3kqx s ILE 264 Ca 0.59 0.02 0.10 0.00 -0.26 0.00 0.00 60.65 61.09 3kqx s ILE 264 Cb -0.10 -2.35 -0.13 0.00 1.25 0.00 0.00 42.46 41.13 3kqx s ILE 264 CO 0.31 -0.01 0.33 2.29 0.24 0.00 0.00 174.94 178.10 3kqx n LYS 265 N -3.46 2.26 -3.84 0.37 -0.00 -0.09 -4.62 118.16 108.78 3kqx n LYS 265 Ca 0.13 -0.04 -0.13 0.00 -0.00 0.00 0.00 58.31 58.28 3kqx n LYS 265 Cb 0.51 -1.08 -0.14 0.00 -0.00 0.00 0.00 35.03 34.31 3kqx n LYS 265 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.40 176.39 3kqx s HIS 266 N -2.26 -0.02 -0.08 5.58 3.76 -1.00 -1.18 115.29 120.08 3kqx s HIS 266 Ca 0.00 0.10 0.02 0.00 -0.15 0.00 0.00 55.06 55.03 3kqx s HIS 266 Cb 0.07 -0.04 0.02 0.00 1.11 0.00 0.00 32.58 33.74 3kqx s HIS 266 CO 0.41 -0.03 -0.11 -1.17 -0.85 0.00 0.00 174.74 172.98 3kqx s LEU 267 N 0.24 1.55 -0.02 0.89 2.96 -0.53 -1.82 118.68 121.94 3kqx s LEU 267 Ca -0.02 -0.31 0.05 0.00 -0.22 0.00 0.00 54.13 53.63 3kqx s LEU 267 Cb -0.03 -0.86 -0.03 0.00 0.50 0.00 0.00 46.19 45.78 3kqx s LEU 267 CO -0.01 -0.00 -0.17 -0.83 -1.32 0.00 0.00 176.35 174.01 3kqx s GLY 268 N 0.94 1.49 -0.10 7.98 0.00 -0.25 -0.70 107.32 116.68 3kqx s GLY 268 Ca -0.09 -1.05 0.01 0.00 0.00 0.00 0.00 44.72 43.58 3kqx s GLY 268 CO 0.00 -0.87 -0.11 0.14 0.00 0.00 0.00 173.10 172.26 3kqx s VAL 269 N -0.75 1.19 -0.34 1.40 1.01 0.15 -0.48 120.40 122.57 3kqx s VAL 269 Ca 0.12 -0.43 -0.11 0.00 0.00 0.00 0.00 61.98 61.56 3kqx s VAL 269 Cb -0.10 -1.14 0.01 0.00 0.00 0.00 0.00 36.38 35.14 3kqx s VAL 269 CO 0.01 0.39 0.19 -0.31 0.00 0.00 0.00 175.10 175.38 3kqx s TYR 270 N 1.30 3.21 0.00 5.22 1.51 0.21 -0.03 117.35 128.77 3kqx s TYR 270 Ca -0.02 -0.69 0.00 0.00 -1.01 0.00 0.00 57.07 55.35 3kqx s TYR 270 Cb -0.14 -2.41 0.00 0.00 -0.11 0.00 0.00 41.96 39.30 3kqx s TYR 270 CO -0.04 -0.53 0.00 1.51 -1.11 0.00 0.00 175.55 175.38 3kqx n ILE 271 N 5.01 0.00 0.00 2.71 3.06 -0.41 -0.41 119.36 129.32 3kqx n ILE 271 Ca -0.13 0.02 0.00 0.00 -2.50 0.00 0.00 62.75 60.14 3kqx n ILE 271 Cb 0.48 -0.92 0.00 0.00 0.54 0.00 0.00 39.64 39.74 3kqx n ILE 271 CO 0.00 0.00 0.00 -3.20 -2.50 0.00 0.00 176.55 170.85 3kqx n ASN 272 N -2.18 0.00 -3.34 9.51 2.85 -1.26 -4.25 115.26 116.59 3kqx n ASN 272 Ca 0.00 0.00 -0.22 0.00 -0.11 0.00 0.00 54.58 54.25 3kqx n ASN 272 Cb 0.00 0.00 0.07 0.00 1.24 0.00 0.00 39.78 41.09 3kqx n ASN 272 CO 0.00 0.00 0.00 0.59 -2.11 0.00 0.00 177.26 175.74 3kqx n ASN 273 N 0.00 -5.86 -0.34 1.20 3.02 -1.26 -4.91 115.26 107.11 3kqx n ASN 273 Ca 0.00 -0.50 0.18 0.00 -0.03 0.00 0.00 54.58 54.23 3kqx n ASN 273 Cb 0.00 -4.67 0.39 0.00 -0.61 0.00 0.00 39.78 34.89 3kqx n ASN 273 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3kqx h ALA 274 N 0.93 1.84 0.00 5.41 0.00 -1.92 0.39 119.26 125.91 3kqx h ALA 274 Ca -0.52 0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.49 3kqx h ALA 274 Cb 1.34 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.13 3kqx h ALA 274 CO 0.51 -0.29 0.00 0.38 0.00 0.00 0.00 179.25 179.86 3kqx h ASP 275 N 0.59 0.00 -0.56 0.00 3.04 -1.94 -0.64 116.42 116.91 3kqx h ASP 275 Ca 0.63 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 54.42 3kqx h ASP 275 Cb 1.21 0.00 -0.03 0.00 -1.04 0.00 0.00 39.33 39.47 3kqx h ASP 275 CO -0.43 0.00 0.35 0.74 -2.04 0.00 0.00 179.24 177.86 3kqx h THR 276 N 0.00 1.15 -0.00 1.15 2.02 -0.58 -3.35 112.91 113.30 3kqx h THR 276 Ca 0.00 -0.31 0.00 0.00 0.77 0.00 0.00 66.41 66.87 3kqx h THR 276 Cb 0.32 0.34 0.00 0.00 -1.74 0.00 0.00 68.15 67.08 3kqx h THR 276 CO 0.00 0.15 -0.85 -1.22 0.37 0.00 0.00 175.52 173.97 3kqx n TYR 277 N -4.43 0.00 -0.25 3.16 4.01 -0.26 -4.54 117.16 114.84 3kqx n TYR 277 Ca 0.05 0.00 -0.07 0.00 -0.16 0.00 0.00 57.90 57.73 3kqx n TYR 277 Cb 0.06 0.00 0.05 0.00 -0.31 0.00 0.00 39.34 39.14 3kqx n TYR 277 CO 0.00 0.00 0.00 0.87 -0.46 0.00 0.00 176.86 177.27 3kqx h LYS 278 N 0.65 1.05 0.00 -0.72 6.56 -1.67 -0.27 116.57 122.18 3kqx h LYS 278 Ca 0.00 -0.20 0.00 0.00 -1.06 0.00 0.00 60.65 59.39 3kqx h LYS 278 Cb 0.57 -0.17 0.00 0.00 -0.57 0.00 0.00 32.23 32.06 3kqx h LYS 278 CO 0.00 0.88 0.00 1.05 -2.06 0.00 0.00 179.45 179.32 3kqx h GLU 279 N 1.00 0.00 0.00 3.15 -0.00 -1.84 -2.33 114.58 114.56 3kqx h GLU 279 Ca 0.23 0.00 -0.10 0.00 -0.00 0.00 0.00 59.36 59.49 3kqx h GLU 279 Cb 0.23 0.00 -0.01 0.00 -0.00 0.00 0.00 28.75 28.96 3kqx h GLU 279 CO -0.02 0.00 -0.46 0.93 -0.00 0.00 0.00 179.01 179.46 3kqx h GLU 280 N 0.00 0.00 0.63 1.06 4.39 -1.34 -3.33 114.58 115.99 3kqx h GLU 280 Ca 0.00 0.00 -0.03 0.00 0.34 0.00 0.00 59.36 59.67 3kqx h GLU 280 Cb 0.01 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 28.66 3kqx h GLU 280 CO 0.00 0.46 -0.38 0.28 -1.16 0.00 0.00 179.01 178.21 3kqx h VAL 281 N 0.00 0.22 -0.02 3.13 2.07 -1.49 0.87 116.25 121.03 3kqx h VAL 281 Ca -0.00 0.00 -0.13 0.00 0.82 0.00 0.00 66.70 67.39 3kqx h VAL 281 Cb 1.23 0.22 -0.02 0.00 -1.52 0.00 0.00 31.29 31.21 3kqx h VAL 281 CO 0.06 0.00 -0.60 -0.33 0.02 0.00 0.00 177.57 176.72 3kqx h GLU 282 N -0.95 0.06 -0.84 1.57 4.39 -1.76 -1.81 114.58 115.23 3kqx h GLU 282 Ca -0.08 -0.04 0.02 0.00 0.34 0.00 0.00 59.36 59.60 3kqx h GLU 282 Cb 0.77 0.01 -0.05 0.00 -0.10 0.00 0.00 28.75 29.38 3kqx h GLU 282 CO 0.08 0.64 0.55 -0.22 -1.16 0.00 0.00 179.01 178.90 3kqx h LYS 283 N 0.04 1.06 -0.45 2.33 3.64 -1.63 -1.99 116.57 119.58 3kqx h LYS 283 Ca -0.01 -0.06 -0.08 0.00 -1.27 0.00 0.00 60.65 59.23 3kqx h LYS 283 Cb 1.07 -0.24 -0.02 0.00 -0.41 0.00 0.00 32.23 32.63 3kqx h LYS 283 CO 0.08 0.70 -0.05 0.00 -2.27 0.00 0.00 179.45 177.92 3kqx h ALA 284 N 1.33 1.07 -0.28 5.00 0.00 -0.27 -0.82 119.26 125.29 3kqx h ALA 284 Ca 0.32 -0.28 -0.16 0.00 0.00 0.00 0.00 54.91 54.79 3kqx h ALA 284 Cb -0.06 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.54 3kqx h ALA 284 CO -0.09 0.58 -0.46 -0.09 0.00 0.00 0.00 179.25 179.19 3kqx h ARG 285 N 0.71 0.72 -0.38 0.00 2.43 -1.02 0.27 114.38 117.12 3kqx h ARG 285 Ca 0.13 -0.41 -0.08 0.00 -0.81 0.00 0.00 59.98 58.82 3kqx h ARG 285 Cb 0.50 0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 30.07 3kqx h ARG 285 CO 0.03 1.03 -0.07 0.28 -1.51 0.00 0.00 179.97 179.72 3kqx h VAL 286 N 0.58 1.27 -0.75 0.20 2.07 -1.18 -2.17 116.25 116.26 3kqx h VAL 286 Ca 0.03 -1.13 -0.03 0.00 0.82 0.00 0.00 66.70 66.39 3kqx h VAL 286 Cb 1.02 1.24 -0.03 0.00 -1.52 0.00 0.00 31.29 32.00 3kqx h VAL 286 CO 0.10 0.38 0.35 1.88 0.02 0.00 0.00 177.57 180.30 3kqx h TYR 287 N 0.52 1.10 -0.87 1.57 -1.99 -0.92 -1.63 116.97 114.74 3kqx h TYR 287 Ca 0.10 -0.06 0.09 0.00 2.00 0.00 0.00 58.73 60.86 3kqx h TYR 287 Cb 0.58 -0.34 -0.07 0.00 2.00 0.00 0.00 36.73 38.90 3kqx h TYR 287 CO 0.05 0.81 0.52 -0.92 -0.00 0.00 0.00 178.16 178.62 3kqx h TYR 288 N 1.06 0.96 0.23 4.88 3.20 -0.34 -2.37 116.97 124.59 3kqx h TYR 288 Ca 0.26 0.03 -0.33 0.00 3.14 0.00 0.00 58.73 61.83 3kqx h TYR 288 Cb 0.13 -0.30 0.03 0.00 1.54 0.00 0.00 36.73 38.14 3kqx h TYR 288 CO 0.01 0.41 -1.43 0.35 -1.64 0.00 0.00 178.16 175.87 3kqx h PHE 289 N 0.89 0.92 -0.98 -3.82 3.57 -0.66 -0.52 116.94 116.34 3kqx h PHE 289 Ca 0.41 -0.66 0.18 0.00 3.53 0.00 0.00 57.97 61.43 3kqx h PHE 289 Cb 0.34 -0.04 -0.09 0.00 2.79 0.00 0.00 35.95 38.94 3kqx h PHE 289 CO -0.04 1.52 0.61 0.78 -2.23 0.00 0.00 178.31 178.95 3kqx h GLY 290 N 0.38 1.55 0.63 2.40 0.00 -1.30 0.95 103.07 107.68 3kqx h GLY 290 Ca -0.23 -0.34 -0.05 0.00 0.00 0.00 0.00 47.33 46.71 3kqx h GLY 290 CO 0.26 0.00 -0.14 -0.84 0.00 0.00 0.00 176.54 175.83 3kqx h THR 291 N 0.74 1.40 -0.44 4.70 2.02 -1.25 -1.98 112.91 118.10 3kqx h THR 291 Ca 0.54 -1.41 -0.13 0.00 0.77 0.00 0.00 66.41 66.18 3kqx h THR 291 Cb 0.86 2.14 -0.01 0.00 -1.74 0.00 0.00 68.15 69.40 3kqx h THR 291 CO -0.31 0.40 -0.22 0.22 0.37 0.00 0.00 175.52 175.98 3kqx h TYR 292 N -0.23 1.06 -0.28 3.16 3.20 -0.37 -0.86 116.97 122.64 3kqx h TYR 292 Ca 0.01 -0.26 0.03 0.00 3.14 0.00 0.00 58.73 61.64 3kqx h TYR 292 Cb 0.71 -0.24 -0.03 0.00 1.54 0.00 0.00 36.73 38.70 3kqx h TYR 292 CO 0.11 1.06 0.09 -0.92 -1.64 0.00 0.00 178.16 176.87 3kqx h TYR 293 N 0.75 0.17 -0.55 -3.82 3.20 0.84 0.85 116.97 118.41 3kqx h TYR 293 Ca 0.10 0.01 -0.05 0.00 3.14 0.00 0.00 58.73 61.93 3kqx h TYR 293 Cb 0.79 -0.04 -0.03 0.00 1.54 0.00 0.00 36.73 39.00 3kqx h TYR 293 CO 0.06 0.08 0.15 0.00 -1.64 0.00 0.00 178.16 176.80 3kqx h ALA 294 N 1.18 1.24 -0.47 1.82 0.00 -1.05 -2.19 119.26 119.80 3kqx h ALA 294 Ca 0.12 -0.19 -0.12 0.00 0.00 0.00 0.00 54.91 54.72 3kqx h ALA 294 Cb 0.09 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 3kqx h ALA 294 CO -0.13 0.53 -0.20 1.03 0.00 0.00 0.00 179.25 180.48 3kqx h SER 295 N 0.80 0.96 -0.28 0.00 0.87 -0.62 -1.59 113.55 113.69 3kqx h SER 295 Ca 0.18 -0.35 0.05 0.00 -1.23 0.00 0.00 61.79 60.44 3kqx h SER 295 Cb 0.26 -0.26 -0.04 0.00 -0.44 0.00 0.00 62.40 61.92 3kqx h SER 295 CO -0.01 1.12 -0.00 1.56 -0.53 0.00 0.00 176.83 178.97 3kqx h GLN 296 N 0.82 0.08 -0.50 2.24 4.20 -0.49 0.67 115.11 122.12 3kqx h GLN 296 Ca 0.11 -0.00 -0.04 0.00 0.06 0.00 0.00 58.65 58.77 3kqx h GLN 296 Cb 0.76 -0.02 -0.02 0.00 0.30 0.00 0.00 27.48 28.50 3kqx h GLN 296 CO 0.06 0.05 0.14 -0.07 -0.67 0.00 0.00 178.83 178.35 3kqx h LEU 297 N 0.08 0.75 -0.27 1.46 3.38 -1.06 -1.70 115.31 117.94 3kqx h LEU 297 Ca 0.13 -0.22 -0.01 0.00 0.09 0.00 0.00 57.88 57.87 3kqx h LEU 297 Cb 0.18 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.72 3kqx h LEU 297 CO -0.23 0.77 0.12 0.40 0.09 0.00 0.00 178.44 179.59 3kqx h ILE 298 N 0.69 1.16 -0.06 1.22 2.04 -0.99 -3.14 117.51 118.43 3kqx h ILE 298 Ca 0.16 -0.46 -0.12 0.00 1.00 0.00 0.00 64.86 65.45 3kqx h ILE 298 Cb 0.30 0.97 -0.01 0.00 -0.74 0.00 0.00 36.82 37.33 3kqx h ILE 298 CO -0.00 0.16 -0.50 0.00 0.00 0.00 0.00 178.15 177.80 3kqx h ALA 299 N 0.97 1.04 -1.30 1.87 0.00 -0.86 -3.41 119.26 117.58 3kqx h ALA 299 Ca 0.09 -0.47 -0.69 0.00 0.00 0.00 0.00 54.91 53.84 3kqx h ALA 299 Cb 0.14 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.84 3kqx h ALA 299 CO -0.01 0.65 1.22 0.00 0.00 0.00 0.00 179.25 181.11 3kqx n ALA 300 N -2.46 0.63 -0.70 0.00 0.00 -0.64 -4.91 120.51 112.43 3kqx n ALA 300 Ca -0.02 0.13 -0.24 0.00 0.00 0.00 0.00 53.44 53.32 3kqx n ALA 300 Cb 0.54 -2.42 0.11 0.00 0.00 0.00 0.00 19.45 17.67 3kqx n ALA 300 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 3kqx n PRO 301 N 7.13 -1.30 0.10 0.00 -0.02 -1.26 -4.48 135.00 135.17 3kqx n PRO 301 Ca 0.35 -0.38 0.13 0.00 -2.02 0.00 0.00 63.50 61.58 3kqx n PRO 301 Cb 0.19 -1.36 0.44 0.00 -0.02 0.00 0.00 33.50 32.75 3kqx n PRO 301 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 3kqx n SER 302 N 0.27 0.70 0.08 2.55 7.64 -1.26 -1.75 113.62 121.85 3kqx n SER 302 Ca 0.02 0.59 -0.11 0.00 1.01 0.00 0.00 58.87 60.38 3kqx n SER 302 Cb 0.46 -0.77 -0.13 0.00 -1.01 0.00 0.00 64.21 62.76 3kqx n SER 302 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 3kqx h ASN 303 N 0.00 0.20 0.19 6.43 -1.07 -1.93 -3.36 115.58 116.04 3kqx h ASN 303 Ca 0.00 -0.21 -0.34 0.00 0.07 0.00 0.00 56.30 55.81 3kqx h ASN 303 Cb 0.62 -0.06 -0.06 0.00 -2.07 0.00 0.00 38.32 36.75 3kqx h ASN 303 CO 0.00 1.17 -2.11 -1.22 0.07 0.00 0.00 177.43 175.34 3kqx n TYR 304 N -3.43 0.53 -3.72 4.14 4.01 -1.20 -4.56 117.16 112.93 3kqx n TYR 304 Ca -0.04 0.17 -0.37 0.00 -0.16 0.00 0.00 57.90 57.49 3kqx n TYR 304 Cb 0.98 -1.09 -0.10 0.00 -0.31 0.00 0.00 39.34 38.82 3kqx n TYR 304 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 3kqx s ASN 306 N 1.68 3.69 0.39 0.00 2.20 -1.26 -4.44 114.94 117.20 3kqx s ASN 306 Ca 0.10 -1.64 0.11 0.00 -0.94 0.00 0.00 52.86 50.50 3kqx s ASN 306 Cb -0.22 0.44 0.91 0.00 -2.00 0.00 0.00 41.25 40.38 3kqx s ASN 306 CO -0.04 -0.84 1.91 -0.65 -2.94 0.00 0.00 177.10 174.54 3kqx h PRO 307 N 1.52 0.56 -0.04 3.55 0.11 -1.87 0.41 132.00 136.24 3kqx h PRO 307 Ca -0.41 -0.03 -0.03 0.00 0.11 0.00 0.00 66.00 65.63 3kqx h PRO 307 Cb 1.30 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 32.28 3kqx h PRO 307 CO 0.70 0.37 -0.11 0.28 -0.21 0.00 0.00 178.00 179.03 3kqx h VAL 308 N 0.58 1.44 -0.11 3.15 2.07 -1.94 -2.44 116.25 118.99 3kqx h VAL 308 Ca 0.38 -1.47 -0.14 0.00 0.82 0.00 0.00 66.70 66.29 3kqx h VAL 308 Cb 0.68 2.31 -0.01 0.00 -1.52 0.00 0.00 31.29 32.75 3kqx h VAL 308 CO -0.15 0.40 -0.56 0.77 0.02 0.00 0.00 177.57 178.05 3kqx h SER 309 N -0.38 0.36 -0.31 0.57 4.64 -1.81 -0.18 113.55 116.44 3kqx h SER 309 Ca -0.00 -0.20 -0.10 0.00 -0.47 0.00 0.00 61.79 61.02 3kqx h SER 309 Cb 0.70 -0.10 -0.01 0.00 -0.31 0.00 0.00 62.40 62.68 3kqx h SER 309 CO 0.02 0.85 -0.20 0.25 -0.87 0.00 0.00 176.83 176.88 3kqx h LEU 310 N 0.25 0.70 -1.00 5.97 6.46 -1.01 -0.62 115.31 126.06 3kqx h LEU 310 Ca 0.00 -0.43 -0.10 0.00 -0.12 0.00 0.00 57.88 57.23 3kqx h LEU 310 Cb 1.06 -0.20 -0.01 0.00 -0.73 0.00 0.00 40.66 40.79 3kqx h LEU 310 CO 0.09 0.98 -0.33 0.77 -0.62 0.00 0.00 178.44 179.33 3kqx h SER 311 N 0.43 0.31 -0.73 1.25 4.64 -1.22 -2.34 113.55 115.88 3kqx h SER 311 Ca 0.06 -0.11 -0.07 0.00 -0.47 0.00 0.00 61.79 61.20 3kqx h SER 311 Cb 0.74 -0.08 -0.03 0.00 -0.31 0.00 0.00 62.40 62.72 3kqx h SER 311 CO 0.05 0.63 0.20 0.78 -0.87 0.00 0.00 176.83 177.63 3kqx h ASN 312 N 0.26 1.09 -0.34 4.97 2.35 -0.92 -2.42 115.58 120.58 3kqx h ASN 312 Ca 0.03 -0.22 -0.05 0.00 -0.55 0.00 0.00 56.30 55.51 3kqx h ASN 312 Cb 0.71 -0.29 -0.02 0.00 0.05 0.00 0.00 38.32 38.78 3kqx h ASN 312 CO 0.05 1.03 0.06 0.00 -1.65 0.00 0.00 177.43 176.92 3kqx h ALA 313 N 1.11 1.30 -0.23 -0.83 0.00 -0.85 -1.96 119.26 117.80 3kqx h ALA 313 Ca 0.23 -0.20 -0.17 0.00 0.00 0.00 0.00 54.91 54.77 3kqx h ALA 313 Cb 0.35 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.95 3kqx h ALA 313 CO -0.00 0.48 -0.55 0.00 0.00 0.00 0.00 179.25 179.18 3kqx h ALA 314 N 1.43 0.60 -0.21 0.00 0.00 -1.24 -0.69 119.26 119.16 3kqx h ALA 314 Ca 0.14 -0.51 0.02 0.00 0.00 0.00 0.00 54.91 54.55 3kqx h ALA 314 Cb 0.31 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.00 3kqx h ALA 314 CO 0.01 0.69 0.08 0.28 0.00 0.00 0.00 179.25 180.30 3kqx h VAL 315 N 0.53 0.96 -0.46 0.00 2.07 -1.26 -0.46 116.25 117.63 3kqx h VAL 315 Ca 0.01 -0.06 0.00 0.00 0.82 0.00 0.00 66.70 67.47 3kqx h VAL 315 Cb 1.12 0.76 -0.02 0.00 -1.52 0.00 0.00 31.29 31.63 3kqx h VAL 315 CO 0.11 0.03 0.30 -0.08 0.02 0.00 0.00 177.57 177.96 3kqx h GLU 316 N 0.18 0.60 -0.27 1.57 4.81 -1.17 0.20 114.58 120.50 3kqx h GLU 316 Ca 0.09 -0.04 0.04 0.00 -0.13 0.00 0.00 59.36 59.32 3kqx h GLU 316 Cb 0.05 -0.14 -0.03 0.00 0.63 0.00 0.00 28.75 29.26 3kqx h GLU 316 CO -0.08 0.40 0.07 1.25 -0.73 0.00 0.00 179.01 179.92 3kqx h LEU 317 N 0.62 0.04 -0.27 1.64 5.85 -0.84 -1.81 115.31 120.54 3kqx h LEU 317 Ca 0.17 0.04 0.02 0.00 0.84 0.00 0.00 57.88 58.94 3kqx h LEU 317 Cb -0.07 0.05 -0.02 0.00 0.37 0.00 0.00 40.66 40.98 3kqx h LEU 317 CO -0.04 0.06 0.14 0.00 -0.34 0.00 0.00 178.44 178.26 3kqx h ALA 318 N 1.19 0.33 -0.77 1.25 0.00 -0.31 -1.73 119.26 119.22 3kqx h ALA 318 Ca 0.12 0.01 0.06 0.00 0.00 0.00 0.00 54.91 55.10 3kqx h ALA 318 Cb 0.12 -0.05 -0.05 0.00 0.00 0.00 0.00 17.79 17.81 3kqx h ALA 318 CO -0.15 -0.25 0.51 1.96 0.00 0.00 0.00 179.25 181.31 3kqx h GLN 319 N 0.29 0.83 -0.06 0.00 4.20 -0.31 0.23 115.11 120.30 3kqx h GLN 319 Ca 0.11 -0.05 -0.14 0.00 0.06 0.00 0.00 58.65 58.64 3kqx h GLN 319 Cb 0.03 -0.19 -0.01 0.00 0.30 0.00 0.00 27.48 27.60 3kqx h GLN 319 CO -0.07 0.55 -0.58 0.87 -0.67 0.00 0.00 178.83 178.93 3kqx h LYS 320 N 0.85 0.17 -0.08 1.46 1.57 -0.76 -3.10 116.57 116.69 3kqx h LYS 320 Ca 0.33 -0.11 0.00 0.00 -1.87 0.00 0.00 60.65 58.99 3kqx h LYS 320 Cb 0.19 0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.52 3kqx h LYS 320 CO -0.11 0.70 0.00 1.28 -0.57 0.00 0.00 179.45 180.75 3kqx n LEU 321 N -3.88 2.78 -3.28 2.94 4.77 -0.61 -4.97 117.00 114.74 3kqx n LEU 321 Ca -0.02 -0.97 -0.24 0.00 -0.03 0.00 0.00 56.01 54.75 3kqx n LEU 321 Cb 0.59 -0.03 0.02 0.00 -2.33 0.00 0.00 43.42 41.67 3kqx n LEU 321 CO 0.43 0.49 0.00 0.59 -1.33 0.00 0.00 177.39 177.57 3kqx n ASN 322 N 1.15 -4.97 -4.81 -1.43 5.03 0.71 -4.98 115.26 105.96 3kqx n ASN 322 Ca 0.16 -0.39 -0.33 0.00 0.87 0.00 0.00 54.58 54.88 3kqx n ASN 322 Cb 0.55 -4.03 -0.06 0.00 -1.02 0.00 0.00 39.78 35.22 3kqx n ASN 322 CO 0.00 0.00 0.00 -0.76 -1.83 0.00 0.00 177.26 174.67 3kqx s LEU 323 N -6.68 3.93 0.41 3.41 1.43 -0.55 -5.02 118.68 115.61 3kqx s LEU 323 Ca 0.39 1.77 -0.25 0.00 -1.03 0.00 0.00 54.13 55.01 3kqx s LEU 323 Cb -0.19 -4.52 -0.08 0.00 0.03 0.00 0.00 46.19 41.42 3kqx s LEU 323 CO 0.48 -0.47 1.22 -1.83 0.23 0.00 0.00 176.35 175.97 3kqx s GLU 324 N -3.15 3.96 0.02 1.70 4.04 -0.91 -4.60 118.70 119.77 3kqx s GLU 324 Ca 0.63 1.94 -0.02 0.00 0.04 0.00 0.00 54.97 57.56 3kqx s GLU 324 Cb -0.12 -2.66 -0.02 0.00 0.02 0.00 0.00 34.13 31.36 3kqx s GLU 324 CO 0.16 -0.43 0.01 1.52 -1.84 0.00 0.00 175.26 174.68 3kqx s TYR 325 N -1.38 0.24 -0.17 4.83 -0.85 -1.26 -1.35 117.35 117.41 3kqx s TYR 325 Ca 0.58 -0.50 -0.12 0.00 -0.52 0.00 0.00 57.07 56.50 3kqx s TYR 325 Cb -0.33 -0.18 0.05 0.00 0.38 0.00 0.00 41.96 41.88 3kqx s TYR 325 CO 0.42 -0.24 0.43 0.21 -1.52 0.00 0.00 175.55 174.85 3kqx s LYS 326 N -1.74 0.46 -0.21 -3.49 2.20 -0.46 -5.01 119.74 111.49 3kqx s LYS 326 Ca -0.13 0.71 0.01 0.00 -0.36 0.00 0.00 55.97 56.20 3kqx s LYS 326 Cb -0.07 0.11 0.03 0.00 -1.51 0.00 0.00 37.83 36.39 3kqx s LYS 326 CO -0.02 -0.11 -0.16 0.42 -0.36 0.00 0.00 175.35 175.13 3kqx s ILE 327 N 0.83 2.25 -0.08 5.43 -1.09 -1.26 -1.83 121.20 125.45 3kqx s ILE 327 Ca -0.05 -1.07 -0.22 0.00 -2.23 0.00 0.00 60.65 57.08 3kqx s ILE 327 Cb -0.06 -2.06 -0.04 0.00 -1.58 0.00 0.00 42.46 38.73 3kqx s ILE 327 CO -0.06 0.37 0.64 -0.76 -1.23 0.00 0.00 174.94 173.90 3kqx s LEU 328 N 1.27 4.31 0.00 2.97 1.02 -0.60 -4.90 118.68 122.75 3kqx s LEU 328 Ca 0.02 1.10 0.05 0.00 0.02 0.00 0.00 54.13 55.31 3kqx s LEU 328 Cb -0.15 -2.98 0.05 0.00 0.02 0.00 0.00 46.19 43.13 3kqx s LEU 328 CO -0.10 -0.08 0.38 0.61 0.02 0.00 0.00 176.35 177.19 3kqx n GLY 329 N 3.11 2.16 0.23 -3.19 0.00 -1.26 -1.25 105.19 105.00 3kqx n GLY 329 Ca -0.03 -2.20 -0.02 0.00 0.00 0.00 0.00 46.02 43.78 3kqx n GLY 329 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3kqx h VAL 330 N 0.18 0.89 -0.95 1.61 2.07 -1.96 -1.27 116.25 116.81 3kqx h VAL 330 Ca -0.16 -0.18 0.04 0.00 0.82 0.00 0.00 66.70 67.23 3kqx h VAL 330 Cb 0.67 0.32 -0.06 0.00 -1.52 0.00 0.00 31.29 30.71 3kqx h VAL 330 CO 0.23 0.10 0.62 0.11 0.02 0.00 0.00 177.57 178.65 3kqx h LYS 331 N 0.52 1.14 -0.07 1.57 6.56 -1.96 -1.04 116.57 123.29 3kqx h LYS 331 Ca 0.28 -0.07 -0.20 0.00 -1.06 0.00 0.00 60.65 59.60 3kqx h LYS 331 Cb 0.24 -0.26 -0.00 0.00 -0.57 0.00 0.00 32.23 31.64 3kqx h LYS 331 CO -0.22 0.76 -0.78 0.93 -2.06 0.00 0.00 179.45 178.08 3kqx h GLU 332 N 1.18 0.46 -0.30 3.15 5.08 -1.66 -2.50 114.58 119.99 3kqx h GLU 332 Ca 0.39 -0.40 -0.11 0.00 -1.00 0.00 0.00 59.36 58.24 3kqx h GLU 332 Cb 0.05 0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.38 3kqx h GLU 332 CO -0.13 1.04 -0.27 -0.07 -1.00 0.00 0.00 179.01 178.58 3kqx h LEU 333 N 0.30 0.61 -0.40 1.33 3.38 -0.81 -1.36 115.31 118.36 3kqx h LEU 333 Ca -0.04 -0.22 -0.04 0.00 0.09 0.00 0.00 57.88 57.66 3kqx h LEU 333 Cb 1.37 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 41.94 3kqx h LEU 333 CO 0.14 0.86 0.08 -0.33 0.09 0.00 0.00 178.44 179.27 3kqx h GLU 334 N 0.52 0.66 -0.55 1.13 5.08 -1.18 -1.36 114.58 118.88 3kqx h GLU 334 Ca 0.07 -0.17 -0.06 0.00 -1.00 0.00 0.00 59.36 58.20 3kqx h GLU 334 Cb 0.74 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.88 3kqx h GLU 334 CO 0.06 0.70 0.09 0.93 -1.00 0.00 0.00 179.01 179.79 3kqx h GLU 335 N 0.51 0.87 0.00 2.33 5.08 -1.13 -0.17 114.58 122.07 3kqx h GLU 335 Ca 0.12 -0.20 0.00 0.00 -1.00 0.00 0.00 59.36 58.28 3kqx h GLU 335 Cb 0.35 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.48 3kqx h GLU 335 CO 0.01 0.81 0.00 1.28 -1.00 0.00 0.00 179.01 180.11 3kqx n LEU 336 N -4.25 0.00 -3.89 1.33 4.77 -0.54 -4.94 117.00 109.48 3kqx n LEU 336 Ca 0.04 0.00 -0.29 0.00 -0.03 0.00 0.00 56.01 55.73 3kqx n LEU 336 Cb 0.26 0.00 0.02 0.00 -2.33 0.00 0.00 43.42 41.37 3kqx n LEU 336 CO 0.41 0.00 0.06 0.29 -1.33 0.00 0.00 177.39 176.82 3kqx n LYS 337 N -0.79 -5.24 -1.99 3.23 5.02 -0.08 -4.70 118.16 113.60 3kqx n LYS 337 Ca 0.13 0.58 -0.42 0.00 -2.02 0.00 0.00 58.31 56.58 3kqx n LYS 337 Cb 0.06 -5.38 0.00 0.00 -0.02 0.00 0.00 35.03 29.69 3kqx n LYS 337 CO 0.00 0.00 0.00 -1.33 -0.52 0.00 0.00 177.40 175.55 3kqx n MET 338 N -4.59 3.20 0.23 1.97 2.81 -0.57 -2.67 117.12 117.50 3kqx n MET 338 Ca -0.03 -3.01 0.12 0.00 -1.81 0.00 0.00 57.70 52.97 3kqx n MET 338 Cb 0.56 -3.12 0.43 0.00 -0.71 0.00 0.00 33.22 30.38 3kqx n MET 338 CO 0.00 0.00 0.00 0.78 1.51 0.00 0.00 175.97 178.26 3kqx h GLY 339 N 9.02 0.00 0.69 3.03 0.00 -1.78 -1.73 103.07 112.30 3kqx h GLY 339 Ca 0.49 0.00 -0.05 0.00 0.00 0.00 0.00 47.33 47.77 3kqx h GLY 339 CO 1.77 0.00 -0.13 0.00 0.00 0.00 0.00 176.54 178.18 3kqx h ALA 340 N 1.86 0.17 -0.07 3.60 0.00 -1.86 -1.29 119.26 121.67 3kqx h ALA 340 Ca -0.00 -0.32 -0.01 0.00 0.00 0.00 0.00 54.91 54.58 3kqx h ALA 340 Cb 0.78 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.54 3kqx h ALA 340 CO 0.02 0.04 -0.01 -0.92 0.00 0.00 0.00 179.25 178.38 3kqx h TYR 341 N -0.12 0.13 -0.17 0.00 3.20 -1.68 -2.90 116.97 115.43 3kqx h TYR 341 Ca 0.02 -0.03 -0.01 0.00 3.14 0.00 0.00 58.73 61.85 3kqx h TYR 341 Cb 0.67 -0.03 -0.01 0.00 1.54 0.00 0.00 36.73 38.90 3kqx h TYR 341 CO 0.09 0.42 0.07 -0.07 -1.64 0.00 0.00 178.16 177.03 3kqx h LEU 342 N -0.19 0.20 -0.59 2.82 3.38 -1.39 -2.24 115.31 117.30 3kqx h LEU 342 Ca 0.02 -0.01 0.05 0.00 0.09 0.00 0.00 57.88 58.03 3kqx h LEU 342 Cb 0.37 -0.05 -0.05 0.00 0.09 0.00 0.00 40.66 41.02 3kqx h LEU 342 CO 0.00 0.18 0.32 0.28 0.09 0.00 0.00 178.44 179.31 3kqx h SER 343 N 0.23 0.47 -0.46 -0.43 0.02 -1.06 -2.39 113.55 109.93 3kqx h SER 343 Ca 0.06 0.03 -0.05 0.00 -0.84 0.00 0.00 61.79 60.99 3kqx h SER 343 Cb 0.04 -0.06 -0.02 0.00 0.14 0.00 0.00 62.40 62.50 3kqx h SER 343 CO -0.01 0.31 0.09 0.58 -1.14 0.00 0.00 176.83 176.67 3kqx h VAL 344 N 0.60 1.24 0.00 2.27 2.07 -1.22 -2.73 116.25 118.48 3kqx h VAL 344 Ca 0.26 -0.87 0.00 0.00 0.82 0.00 0.00 66.70 66.91 3kqx h VAL 344 Cb 0.14 0.93 0.00 0.00 -1.52 0.00 0.00 31.29 30.84 3kqx h VAL 344 CO -0.16 0.31 0.00 0.61 0.02 0.00 0.00 177.57 178.34 3kqx n GLY 345 N -0.55 -1.39 0.32 2.17 0.00 -1.10 -4.23 105.19 100.41 3kqx n GLY 345 Ca 0.01 -0.07 0.12 0.00 0.00 0.00 0.00 46.02 46.07 3kqx n GLY 345 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3kqx h LYS 346 N 0.00 0.06 0.00 1.61 1.57 -1.10 -0.71 116.57 118.00 3kqx h LYS 346 Ca 0.00 -0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3kqx h LYS 346 Cb 0.46 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.75 3kqx h LYS 346 CO 0.00 0.04 0.00 0.41 -0.57 0.00 0.00 179.45 179.33 3kqx n GLY 347 N -1.46 -0.97 3.90 3.86 0.00 -1.25 -4.50 105.19 104.77 3kqx n GLY 347 Ca 0.20 -0.16 -0.33 0.00 0.00 0.00 0.00 46.02 45.73 3kqx n GLY 347 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3kqx s SER 348 N -1.81 6.43 0.00 1.61 0.15 -0.28 -4.54 113.70 115.26 3kqx s SER 348 Ca 0.37 0.44 0.21 0.00 0.70 0.00 0.00 55.95 57.67 3kqx s SER 348 Cb 0.17 -2.04 0.91 0.00 -1.71 0.00 0.00 66.02 63.35 3kqx s SER 348 CO 0.29 0.23 1.67 1.15 1.20 0.00 0.00 173.24 177.78 3kqx n MET 349 N 0.87 0.02 -3.76 5.44 0.00 -1.26 -4.72 117.12 113.72 3kqx n MET 349 Ca -0.10 0.14 -0.36 0.00 0.00 0.00 0.00 57.70 57.38 3kqx n MET 349 Cb 0.52 -1.50 -0.10 0.00 0.00 0.00 0.00 33.22 32.15 3kqx n MET 349 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 175.97 176.68 3kqx s TYR 350 N -2.97 3.30 0.45 3.17 1.51 -1.26 -4.89 117.35 116.66 3kqx s TYR 350 Ca 0.11 0.15 -0.25 0.00 -1.01 0.00 0.00 57.07 56.07 3kqx s TYR 350 Cb 0.14 -2.21 -0.08 0.00 -0.11 0.00 0.00 41.96 39.70 3kqx s TYR 350 CO 0.38 0.08 1.38 -2.14 -1.11 0.00 0.00 175.55 174.14 3kqx s PRO 351 N 0.85 3.67 0.44 -1.71 0.02 -1.26 -4.82 135.00 132.19 3kqx s PRO 351 Ca 0.06 2.32 -0.25 0.00 0.02 0.00 0.00 61.00 63.15 3kqx s PRO 351 Cb -0.13 -2.61 -0.09 0.00 0.02 0.00 0.00 34.50 31.69 3kqx s PRO 351 CO 0.03 -0.79 1.33 0.09 -0.33 0.00 0.00 177.00 177.32 3kqx n ASN 352 N -0.25 2.82 -3.68 2.53 4.13 -1.26 -4.56 115.26 114.98 3kqx n ASN 352 Ca 0.06 1.10 -0.22 0.00 1.68 0.00 0.00 54.58 57.20 3kqx n ASN 352 Cb 0.43 -1.54 -0.18 0.00 -1.54 0.00 0.00 39.78 36.95 3kqx n ASN 352 CO 0.00 0.00 0.00 -0.54 0.28 0.00 0.00 177.26 177.00 3kqx s LYS 353 N -2.33 0.08 -0.27 3.52 -0.14 -0.84 -4.07 119.74 115.70 3kqx s LYS 353 Ca 0.62 0.24 -0.13 0.00 -1.36 0.00 0.00 55.97 55.33 3kqx s LYS 353 Cb -0.48 -0.83 -0.04 0.00 -1.68 0.00 0.00 37.83 34.79 3kqx s LYS 353 CO 0.57 -0.38 0.31 0.12 -0.76 0.00 0.00 175.35 175.20 3kqx s PHE 354 N 2.12 3.24 -0.05 3.18 2.19 -0.38 -1.54 117.98 126.76 3kqx s PHE 354 Ca 0.04 0.31 -0.18 0.00 0.33 0.00 0.00 56.93 57.44 3kqx s PHE 354 Cb -0.13 -2.50 -0.05 0.00 -1.31 0.00 0.00 43.02 39.04 3kqx s PHE 354 CO -0.04 -0.19 0.49 0.42 1.83 0.00 0.00 175.22 177.73 3kqx s ILE 355 N 1.90 5.05 -0.24 3.12 1.01 0.21 -1.56 121.20 130.69 3kqx s ILE 355 Ca 0.12 1.00 -0.04 0.00 0.00 0.00 0.00 60.65 61.73 3kqx s ILE 355 Cb -0.16 -3.82 0.08 0.00 0.01 0.00 0.00 42.46 38.58 3kqx s ILE 355 CO 0.10 0.44 0.12 -2.28 0.00 0.00 0.00 174.94 173.31 3kqx s HIS 356 N -0.17 0.26 0.16 3.97 2.46 -0.76 -0.88 115.29 120.33 3kqx s HIS 356 Ca 0.26 -0.65 0.06 0.00 0.47 0.00 0.00 55.06 55.21 3kqx s HIS 356 Cb -0.17 -0.82 -0.04 0.00 -0.13 0.00 0.00 32.58 31.43 3kqx s HIS 356 CO 0.13 -0.71 0.04 -0.51 -2.47 0.00 0.00 174.74 171.23 3kqx s LEU 357 N 2.12 3.48 -0.04 8.88 1.02 0.09 -1.36 118.68 132.87 3kqx s LEU 357 Ca 0.06 -0.29 -0.01 0.00 0.02 0.00 0.00 54.13 53.91 3kqx s LEU 357 Cb -0.16 -2.13 0.03 0.00 0.02 0.00 0.00 46.19 43.95 3kqx s LEU 357 CO -0.26 0.09 0.08 0.28 0.02 0.00 0.00 176.35 176.57 3kqx s THR 358 N -1.68 -0.05 -0.25 5.49 -1.32 -0.46 -0.39 115.64 116.98 3kqx s THR 358 Ca 0.28 0.17 -0.08 0.00 -1.21 0.00 0.00 61.69 60.85 3kqx s THR 358 Cb -0.10 -0.15 -0.03 0.00 -1.51 0.00 0.00 72.50 70.71 3kqx s THR 358 CO 0.20 0.07 0.10 -0.47 -2.21 0.00 0.00 174.62 172.30 3kqx s TYR 359 N 0.96 3.12 -0.12 9.09 5.04 0.97 -2.13 117.35 134.27 3kqx s TYR 359 Ca -0.08 -0.30 -0.06 0.00 -2.44 0.00 0.00 57.07 54.19 3kqx s TYR 359 Cb -0.11 -2.27 -0.04 0.00 0.35 0.00 0.00 41.96 39.90 3kqx s TYR 359 CO -0.04 -0.31 0.11 0.15 -1.34 0.00 0.00 175.55 174.12 3kqx s LYS 360 N 1.62 3.40 0.21 4.97 1.02 -1.26 -0.87 119.74 128.83 3kqx s LYS 360 Ca 0.06 -0.19 -0.12 0.00 0.02 0.00 0.00 55.97 55.74 3kqx s LYS 360 Cb -0.15 -3.12 -0.07 0.00 -0.52 0.00 0.00 37.83 33.96 3kqx s LYS 360 CO 0.05 0.73 0.58 0.45 -0.92 0.00 0.00 175.35 176.24 3kqx s SER 361 N -0.90 6.73 0.09 2.83 0.15 -0.94 -4.96 113.70 116.70 3kqx s SER 361 Ca 0.14 1.03 0.18 0.00 0.70 0.00 0.00 55.95 58.00 3kqx s SER 361 Cb -0.12 -2.27 0.75 0.00 -1.71 0.00 0.00 66.02 62.67 3kqx s SER 361 CO 0.03 -0.02 1.55 2.29 1.20 0.00 0.00 173.24 178.29 3kqx n LYS 362 N 0.20 0.07 -2.06 5.44 0.00 -1.26 -4.80 118.16 115.74 3kqx n LYS 362 Ca -0.01 0.31 -0.28 0.00 -0.00 0.00 0.00 58.31 58.32 3kqx n LYS 362 Cb 0.52 -1.63 0.14 0.00 -0.00 0.00 0.00 35.03 34.07 3kqx n LYS 362 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.40 177.60 3kqx s GLY 363 N -3.19 1.74 0.21 2.58 0.00 -1.26 -4.89 107.32 102.50 3kqx s GLY 363 Ca 0.06 -1.16 -0.31 0.00 0.00 0.00 0.00 44.72 43.31 3kqx s GLY 363 CO 0.31 -0.51 1.55 -0.35 0.00 0.00 0.00 173.10 174.10 3kqx s ASP 364 N -4.77 6.56 -0.67 1.64 2.15 -1.26 -4.62 116.67 115.70 3kqx s ASP 364 Ca 0.69 2.69 -0.24 0.00 0.43 0.00 0.00 52.55 56.12 3kqx s ASP 364 Cb -0.06 -2.61 0.06 0.00 -0.30 0.00 0.00 42.92 40.01 3kqx s ASP 364 CO 0.50 -0.82 1.04 0.54 -0.17 0.00 0.00 175.17 176.27 3kqx s VAL 365 N 0.70 4.18 -0.41 1.11 0.11 -1.26 -4.12 120.40 120.70 3kqx s VAL 365 Ca 0.67 -0.09 0.23 0.00 -2.93 0.00 0.00 61.98 59.86 3kqx s VAL 365 Cb -0.44 -4.73 0.07 0.00 -1.53 0.00 0.00 36.38 29.75 3kqx s VAL 365 CO 0.37 -1.52 1.22 0.11 -3.33 0.00 0.00 175.10 171.95 3kqx h LYS 366 N 9.65 0.00 -2.97 1.54 1.79 -1.55 -3.47 116.57 121.57 3kqx h LYS 366 Ca -0.28 0.00 -0.16 0.00 -2.18 0.00 0.00 60.65 58.03 3kqx h LYS 366 Cb 1.07 0.00 -0.27 0.00 -1.58 0.00 0.00 32.23 31.45 3kqx h LYS 366 CO 1.20 0.00 -0.40 0.15 -1.08 0.00 0.00 179.45 179.32 3kqx s LYS 367 N -3.27 0.31 -0.18 3.15 -0.14 -1.13 -5.06 119.74 113.42 3kqx s LYS 367 Ca 0.03 0.50 -0.03 0.00 -1.36 0.00 0.00 55.97 55.11 3kqx s LYS 367 Cb 0.10 0.06 -0.02 0.00 -1.68 0.00 0.00 37.83 36.29 3kqx s LYS 367 CO 0.75 -0.09 -0.07 0.15 -0.76 0.00 0.00 175.35 175.33 3kqx s LYS 368 N 0.65 3.46 0.05 1.68 1.02 -1.26 -1.15 119.74 124.19 3kqx s LYS 368 Ca -0.04 -0.61 0.08 0.00 0.02 0.00 0.00 55.97 55.41 3kqx s LYS 368 Cb -0.05 -2.87 -0.03 0.00 -0.52 0.00 0.00 37.83 34.36 3kqx s LYS 368 CO -0.04 0.04 -0.22 0.42 -0.92 0.00 0.00 175.35 174.63 3kqx s ILE 369 N 0.85 1.78 -0.11 2.17 1.01 -0.03 0.54 121.20 127.41 3kqx s ILE 369 Ca -0.02 -1.30 0.02 0.00 0.00 0.00 0.00 60.65 59.35 3kqx s ILE 369 Cb -0.15 -1.55 0.01 0.00 0.01 0.00 0.00 42.46 40.79 3kqx s ILE 369 CO 0.01 0.19 -0.15 0.00 0.00 0.00 0.00 174.94 174.99 3kqx s ALA 370 N -0.86 1.72 -0.24 9.38 0.00 -0.46 -0.77 121.76 130.54 3kqx s ALA 370 Ca 0.08 -0.75 -0.06 0.00 0.00 0.00 0.00 51.96 51.23 3kqx s ALA 370 Cb -0.09 -0.85 -0.02 0.00 0.00 0.00 0.00 23.12 22.16 3kqx s ALA 370 CO 0.02 -0.08 0.02 -0.51 0.00 0.00 0.00 175.76 175.21 3kqx s LEU 371 N 1.00 3.22 -0.15 0.00 1.43 0.54 -0.90 118.68 123.81 3kqx s LEU 371 Ca -0.06 -0.28 0.01 0.00 -1.03 0.00 0.00 54.13 52.77 3kqx s LEU 371 Cb -0.15 -1.85 -0.00 0.00 0.03 0.00 0.00 46.19 44.22 3kqx s LEU 371 CO -0.02 -0.03 -0.17 -0.69 0.23 0.00 0.00 176.35 175.67 3kqx s VAL 372 N 1.55 2.53 -0.07 -1.59 1.01 -0.12 -0.41 120.40 123.31 3kqx s VAL 372 Ca 0.06 -0.82 0.04 0.00 0.00 0.00 0.00 61.98 61.26 3kqx s VAL 372 Cb -0.15 -2.05 -0.02 0.00 0.00 0.00 0.00 36.38 34.16 3kqx s VAL 372 CO 0.01 0.52 -0.18 -0.83 0.00 0.00 0.00 175.10 174.63 3kqx s GLY 373 N 0.76 1.45 0.07 4.51 0.00 0.17 -0.95 107.32 113.33 3kqx s GLY 373 Ca -0.07 -0.99 -0.31 0.00 0.00 0.00 0.00 44.72 43.36 3kqx s GLY 373 CO 0.01 -0.61 1.58 1.25 0.00 0.00 0.00 173.10 175.33 3kqx s LYS 374 N -0.31 4.22 -0.57 2.90 2.20 -0.65 -4.10 119.74 123.43 3kqx s LYS 374 Ca 0.02 2.26 0.06 0.00 -0.36 0.00 0.00 55.97 57.95 3kqx s LYS 374 Cb -0.13 -3.51 0.32 0.00 -1.51 0.00 0.00 37.83 33.01 3kqx s LYS 374 CO 0.02 -0.67 0.89 0.41 -0.36 0.00 0.00 175.35 175.64 3kqx n GLY 375 N 3.87 5.23 3.55 5.54 0.00 -1.26 -1.13 105.19 120.99 3kqx n GLY 375 Ca 0.15 -2.65 -0.42 0.00 0.00 0.00 0.00 46.02 43.09 3kqx n GLY 375 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3kqx s ILE 376 N -3.88 4.83 -0.24 -0.61 -1.09 -0.89 -1.92 121.20 117.40 3kqx s ILE 376 Ca 0.46 0.45 0.21 0.00 -2.23 0.00 0.00 60.65 59.54 3kqx s ILE 376 Cb 0.26 -4.15 0.23 0.00 -1.58 0.00 0.00 42.46 37.22 3kqx s ILE 376 CO -0.11 -0.45 1.59 0.71 -1.23 0.00 0.00 174.94 175.45 3kqx h THR 377 N 5.78 0.38 -2.69 2.92 1.35 -1.38 -1.58 112.91 117.68 3kqx h THR 377 Ca -0.26 -1.44 -0.12 0.00 -0.55 0.00 0.00 66.41 64.04 3kqx h THR 377 Cb 1.10 2.11 -0.25 0.00 -1.73 0.00 0.00 68.15 69.38 3kqx h THR 377 CO 0.87 0.21 -0.27 0.12 -0.25 0.00 0.00 175.52 176.20 3kqx s PHE 378 N -3.19 -0.53 -0.42 4.73 5.36 -1.26 -4.47 117.98 118.20 3kqx s PHE 378 Ca 0.05 1.19 0.01 0.00 -0.96 0.00 0.00 56.93 57.22 3kqx s PHE 378 Cb 0.07 0.21 0.11 0.00 -0.34 0.00 0.00 43.02 43.07 3kqx s PHE 378 CO 0.69 -0.28 0.18 0.34 -1.46 0.00 0.00 175.22 174.68 3kqx s ASP 379 N 0.81 4.92 0.16 6.13 2.15 -1.21 -1.44 116.67 128.20 3kqx s ASP 379 Ca -0.05 -2.31 0.21 0.00 0.43 0.00 0.00 52.55 50.83 3kqx s ASP 379 Cb -0.06 -1.72 0.87 0.00 -0.30 0.00 0.00 42.92 41.71 3kqx s ASP 379 CO -0.06 -0.41 1.65 -1.54 -0.17 0.00 0.00 175.17 174.64 3kqx n SER 380 N 4.12 0.43 0.00 -0.34 3.41 -0.74 -4.86 113.62 115.64 3kqx n SER 380 Ca 0.02 0.59 0.00 0.00 -0.26 0.00 0.00 58.87 59.23 3kqx n SER 380 Cb 0.40 -0.69 0.00 0.00 -0.26 0.00 0.00 64.21 63.66 3kqx n SER 380 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3kqx n GLY 381 N 0.22 2.33 7.00 5.00 0.00 -1.26 -1.17 105.19 117.31 3kqx n GLY 381 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.05 3kqx n GLY 381 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3kqx n GLY 382 N -2.00 0.42 0.27 -0.02 0.00 -1.26 -2.13 105.19 100.48 3kqx n GLY 382 Ca 0.00 -0.86 0.08 0.00 0.00 0.00 0.00 46.02 45.24 3kqx n GLY 382 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 3kqx h TYR 383 N 0.00 0.09 0.00 1.61 0.05 -1.83 -2.26 116.97 114.62 3kqx h TYR 383 Ca 0.00 0.00 -0.67 0.00 0.05 0.00 0.00 58.73 58.11 3kqx h TYR 383 Cb 0.00 -0.03 -0.01 0.00 1.01 0.00 0.00 36.73 37.70 3kqx h TYR 383 CO 0.00 0.05 3.23 0.09 -1.05 0.00 0.00 178.16 180.48 3kqx n ASN 384 N -4.52 5.14 -4.77 3.88 4.13 -1.22 -5.00 115.26 112.91 3kqx n ASN 384 Ca -0.01 -2.72 -0.38 0.00 1.68 0.00 0.00 54.58 53.15 3kqx n ASN 384 Cb 0.11 -1.54 -0.00 0.00 -1.54 0.00 0.00 39.78 36.80 3kqx n ASN 384 CO 0.00 0.00 0.00 -0.22 0.28 0.00 0.00 177.26 177.32 3kqx s LEU 385 N 1.42 4.04 -1.14 3.41 2.96 -0.85 -4.48 118.68 124.04 3kqx s LEU 385 Ca 0.54 2.42 -0.22 0.00 -0.22 0.00 0.00 54.13 56.65 3kqx s LEU 385 Cb 0.15 -4.17 -0.08 0.00 0.50 0.00 0.00 46.19 42.59 3kqx s LEU 385 CO -0.06 -0.96 1.91 0.29 -1.32 0.00 0.00 176.35 176.21 3kqx n LYS 386 N -0.40 1.82 -0.00 1.98 5.02 -0.32 -4.44 118.16 121.81 3kqx n LYS 386 Ca 0.07 -2.48 0.04 0.00 -2.02 0.00 0.00 58.31 53.92 3kqx n LYS 386 Cb 0.47 -3.56 -0.05 0.00 -0.02 0.00 0.00 35.03 31.86 3kqx n LYS 386 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3kqx n ALA 387 N 12.36 2.75 -1.76 7.82 0.00 -1.26 -4.64 120.51 135.78 3kqx n ALA 387 Ca 0.46 -0.21 -0.40 0.00 0.00 0.00 0.00 53.44 53.29 3kqx n ALA 387 Cb 0.45 -0.29 -0.04 0.00 0.00 0.00 0.00 19.45 19.58 3kqx n ALA 387 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3kqx s ALA 388 N -2.08 3.35 0.06 0.00 0.00 -1.26 -4.96 121.76 116.88 3kqx s ALA 388 Ca 0.01 0.93 -0.37 0.00 0.00 0.00 0.00 51.96 52.53 3kqx s ALA 388 Cb 0.06 -3.35 -0.18 0.00 0.00 0.00 0.00 23.12 19.65 3kqx s ALA 388 CO 0.33 -0.28 1.22 -2.30 0.00 0.00 0.00 175.76 174.74 3kqx n PRO 389 N 0.86 0.73 -0.16 0.00 -0.02 -1.26 -1.29 135.00 133.86 3kqx n PRO 389 Ca 0.00 0.26 0.00 0.00 -2.02 0.00 0.00 63.50 61.75 3kqx n PRO 389 Cb 0.45 -1.84 0.00 0.00 -0.02 0.00 0.00 33.50 32.09 3kqx n PRO 389 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3kqx n GLY 390 N 2.13 1.01 0.07 -1.23 0.00 -1.26 -4.93 105.19 100.98 3kqx n GLY 390 Ca 0.19 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.34 3kqx n GLY 390 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3kqx n SER 391 N 0.00 0.63 -3.64 1.61 3.41 -0.41 -4.97 113.62 110.24 3kqx n SER 391 Ca 0.00 0.43 -0.21 0.00 -0.26 0.00 0.00 58.87 58.83 3kqx n SER 391 Cb 0.00 -0.49 0.05 0.00 -0.26 0.00 0.00 64.21 63.51 3kqx n SER 391 CO 0.00 0.00 0.00 0.23 -0.16 0.00 0.00 175.04 175.11 3kqx n MET 392 N -2.06 -5.56 0.18 4.33 2.81 -1.26 -4.87 117.12 110.69 3kqx n MET 392 Ca 0.05 0.69 0.06 0.00 -1.81 0.00 0.00 57.70 56.69 3kqx n MET 392 Cb 0.41 -5.42 0.53 0.00 -0.71 0.00 0.00 33.22 28.04 3kqx n MET 392 CO 0.00 0.00 0.00 0.97 1.51 0.00 0.00 175.97 178.45 3kqx h ILE 393 N -1.94 1.07 0.00 2.02 2.10 -1.93 -0.39 117.51 118.44 3kqx h ILE 393 Ca -0.60 -0.27 0.00 0.00 1.08 0.00 0.00 64.86 65.07 3kqx h ILE 393 Cb 1.36 0.99 0.00 0.00 -1.09 0.00 0.00 36.82 38.08 3kqx h ILE 393 CO 0.56 0.09 0.00 -2.24 -1.08 0.00 0.00 178.15 175.47 3kqx h ASP 394 N 0.15 0.00 0.75 2.19 2.03 -1.95 -2.17 116.42 117.41 3kqx h ASP 394 Ca 0.04 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.34 3kqx h ASP 394 Cb 0.10 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.60 3kqx h ASP 394 CO 0.00 0.00 -0.16 -0.11 -1.03 0.00 0.00 179.24 177.94 3kqx n LEU 395 N -2.72 0.20 0.00 0.15 7.94 -0.16 -4.55 117.00 117.87 3kqx n LEU 395 Ca -0.00 0.28 0.14 0.00 -1.11 0.00 0.00 56.01 55.32 3kqx n LEU 395 Cb 0.17 -0.38 0.79 0.00 0.53 0.00 0.00 43.42 44.53 3kqx n LEU 395 CO 0.20 0.05 1.00 0.23 -1.11 0.00 0.00 177.39 177.75 3kqx n MET 396 N -1.42 0.72 0.19 1.96 2.81 -0.82 -1.02 117.12 119.54 3kqx n MET 396 Ca 0.08 0.01 0.13 0.00 -1.81 0.00 0.00 57.70 56.11 3kqx n MET 396 Cb 0.33 -1.50 0.67 0.00 -0.71 0.00 0.00 33.22 32.01 3kqx n MET 396 CO 0.00 0.00 0.00 1.57 1.51 0.00 0.00 175.97 179.05 3kqx h LYS 397 N 0.00 0.00 -0.01 0.03 2.10 -1.80 -2.88 116.57 114.02 3kqx h LYS 397 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 3kqx h LYS 397 Cb 0.09 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.42 3kqx h LYS 397 CO 0.00 0.00 -0.08 1.97 -2.00 0.00 0.00 179.45 179.34 3kqx n PHE 398 N -2.37 0.00 1.46 0.07 -0.00 -0.19 -4.03 117.46 112.40 3kqx n PHE 398 Ca -0.02 0.00 0.06 0.00 -0.00 0.00 0.00 57.45 57.49 3kqx n PHE 398 Cb 0.05 -0.08 0.36 0.00 -0.00 0.00 0.00 39.48 39.81 3kqx n PHE 398 CO 0.00 0.00 0.00 -3.47 -0.00 0.00 0.00 176.76 173.29 3kqx n ASP 399 N -0.49 0.00 -1.26 5.98 2.03 -1.09 -1.47 116.55 120.25 3kqx n ASP 399 Ca 0.17 -1.08 0.08 0.00 0.52 0.00 0.00 54.79 54.49 3kqx n ASP 399 Cb 0.29 0.00 0.30 0.00 -0.72 0.00 0.00 41.12 41.00 3kqx n ASP 399 CO 0.00 0.00 0.00 1.15 -1.92 0.00 0.00 177.20 176.43 3kqx n MET 400 N -0.76 3.56 -0.22 -0.67 0.00 -0.59 -2.09 117.12 116.34 3kqx n MET 400 Ca 0.09 -2.80 0.10 0.00 0.00 0.00 0.00 57.70 55.09 3kqx n MET 400 Cb 0.04 -1.85 0.39 0.00 0.00 0.00 0.00 33.22 31.79 3kqx n MET 400 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 175.97 176.74 3kqx h SER 401 N 2.97 0.62 -0.14 3.17 0.02 -1.42 -0.59 113.55 118.18 3kqx h SER 401 Ca 0.00 0.02 -0.04 0.00 -0.84 0.00 0.00 61.79 60.93 3kqx h SER 401 Cb 1.44 -0.10 -0.00 0.00 0.14 0.00 0.00 62.40 63.87 3kqx h SER 401 CO 0.24 0.35 -0.06 1.23 -1.14 0.00 0.00 176.83 177.45 3kqx h GLY 402 N 0.68 0.31 -0.04 -3.77 0.00 -1.74 -0.27 103.07 98.24 3kqx h GLY 402 Ca 0.38 -0.28 0.14 0.00 0.00 0.00 0.00 47.33 47.57 3kqx h GLY 402 CO -0.15 0.25 0.07 0.00 0.00 0.00 0.00 176.54 176.71 3kqx h ALA 404 N 1.57 1.01 -0.56 0.00 0.00 -0.92 -0.61 119.26 119.74 3kqx h ALA 404 Ca 0.35 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 55.14 3kqx h ALA 404 Cb 0.57 -0.32 -0.03 0.00 0.00 0.00 0.00 17.79 18.02 3kqx h ALA 404 CO -0.51 0.50 0.30 0.00 0.00 0.00 0.00 179.25 179.54 3kqx h ALA 405 N 1.24 0.72 -0.70 0.00 0.00 -0.55 -0.16 119.26 119.81 3kqx h ALA 405 Ca 0.28 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 55.07 3kqx h ALA 405 Cb 0.00 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.53 3kqx h ALA 405 CO -0.05 0.24 0.37 0.28 0.00 0.00 0.00 179.25 180.09 3kqx h VAL 406 N 0.75 1.22 -0.31 0.00 2.07 -0.84 -0.87 116.25 118.28 3kqx h VAL 406 Ca 0.20 -0.59 -0.15 0.00 0.82 0.00 0.00 66.70 66.97 3kqx h VAL 406 Cb 0.06 0.32 -0.00 0.00 -1.52 0.00 0.00 31.29 30.15 3kqx h VAL 406 CO -0.03 0.25 -0.40 -0.07 0.02 0.00 0.00 177.57 177.34 3kqx h LEU 407 N 0.97 0.88 -0.89 2.57 4.07 -0.90 -0.70 115.31 121.32 3kqx h LEU 407 Ca 0.24 -0.50 -0.08 0.00 0.08 0.00 0.00 57.88 57.63 3kqx h LEU 407 Cb 0.07 -0.25 -0.02 0.00 1.08 0.00 0.00 40.66 41.54 3kqx h LEU 407 CO -0.04 1.20 -0.03 1.23 -1.08 0.00 0.00 178.44 179.73 3kqx h GLY 408 N 0.58 0.85 1.04 0.83 0.00 -0.98 -1.25 103.07 104.14 3kqx h GLY 408 Ca 0.04 -0.58 -0.06 0.00 0.00 0.00 0.00 47.33 46.72 3kqx h GLY 408 CO 0.09 0.54 0.17 0.00 0.00 0.00 0.00 176.54 177.34 3kqx h ALA 410 N 1.07 1.30 -0.05 0.00 0.00 -0.74 0.58 119.26 121.42 3kqx h ALA 410 Ca 0.21 -0.02 0.03 0.00 0.00 0.00 0.00 54.91 55.13 3kqx h ALA 410 Cb 0.36 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 17.83 3kqx h ALA 410 CO 0.00 0.40 -0.13 -0.92 0.00 0.00 0.00 179.25 178.60 3kqx h TYR 411 N 1.11 -0.33 -0.41 0.00 3.20 -0.73 -0.14 116.97 119.67 3kqx h TYR 411 Ca 0.41 0.01 -0.06 0.00 3.14 0.00 0.00 58.73 62.23 3kqx h TYR 411 Cb 0.15 0.16 -0.01 0.00 1.54 0.00 0.00 36.73 38.56 3kqx h TYR 411 CO -0.01 -0.20 0.01 0.00 -1.64 0.00 0.00 178.16 176.33 3kqx h VAL 413 N 0.54 1.15 0.00 0.00 2.07 -0.84 0.10 116.25 119.27 3kqx h VAL 413 Ca 0.12 -0.41 0.00 0.00 0.82 0.00 0.00 66.70 67.23 3kqx h VAL 413 Cb 0.46 0.82 0.00 0.00 -1.52 0.00 0.00 31.29 31.05 3kqx h VAL 413 CO 0.02 0.15 0.00 1.23 0.02 0.00 0.00 177.57 178.99 3kqx h GLY 414 N 0.40 0.00 0.00 2.17 0.00 -0.98 -0.89 103.07 103.77 3kqx h GLY 414 Ca 0.11 0.00 -0.21 0.00 0.00 0.00 0.00 47.33 47.23 3kqx h GLY 414 CO -0.02 0.00 -1.23 2.41 0.00 0.00 0.00 176.54 177.71 3kqx n THR 415 N -3.00 1.52 0.70 4.70 -1.04 -0.95 -4.39 114.28 111.83 3kqx n THR 415 Ca 0.00 -0.01 0.13 0.00 -2.04 0.00 0.00 64.05 62.13 3kqx n THR 415 Cb 0.27 -2.08 0.33 0.00 -1.82 0.00 0.00 70.33 67.03 3kqx n THR 415 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 3kqx n LEU 416 N -4.45 0.62 -3.43 -4.42 4.77 0.00 -4.98 117.00 105.11 3kqx n LEU 416 Ca -0.30 0.36 -0.21 0.00 -0.03 0.00 0.00 56.01 55.83 3kqx n LEU 416 Cb 0.64 -0.28 0.06 0.00 -2.33 0.00 0.00 43.42 41.51 3kqx n LEU 416 CO 0.17 -0.07 -0.01 0.29 -1.33 0.00 0.00 177.39 176.44 3kqx n LYS 417 N -2.00 -2.14 -1.56 3.23 5.02 -0.34 -4.96 118.16 115.41 3kqx n LYS 417 Ca 0.05 0.71 -0.35 0.00 -2.02 0.00 0.00 58.31 56.70 3kqx n LYS 417 Cb 0.41 -5.21 0.08 0.00 -0.02 0.00 0.00 35.03 30.29 3kqx n LYS 417 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 3kqx s PRO 418 N -5.05 2.30 0.31 1.97 0.04 -1.26 -4.96 135.00 128.35 3kqx s PRO 418 Ca 0.43 1.87 0.01 0.00 0.04 0.00 0.00 61.00 63.35 3kqx s PRO 418 Cb -0.09 -1.84 -0.03 0.00 0.04 0.00 0.00 34.50 32.57 3kqx s PRO 418 CO 0.79 -1.74 0.50 -1.21 0.04 0.00 0.00 177.00 175.37 3kqx s GLU 419 N -3.70 3.49 -0.41 4.56 2.02 -1.26 -4.58 118.70 118.81 3kqx s GLU 419 Ca 0.77 -0.41 0.00 0.00 0.02 0.00 0.00 54.97 55.36 3kqx s GLU 419 Cb -0.32 -2.72 0.00 0.00 0.10 0.00 0.00 34.13 31.19 3kqx s GLU 419 CO 0.43 0.23 0.00 0.09 0.02 0.00 0.00 175.26 176.03 3kqx n ASN 420 N -1.56 -4.61 -4.15 -0.19 3.02 -1.26 -4.88 115.26 101.63 3kqx n ASN 420 Ca -0.05 0.10 -0.24 0.00 -0.03 0.00 0.00 54.58 54.36 3kqx n ASN 420 Cb 0.56 -2.45 -0.15 0.00 -0.61 0.00 0.00 39.78 37.13 3kqx n ASN 420 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 3kqx s VAL 421 N -1.76 1.29 -0.16 2.41 0.11 -1.26 -1.26 120.40 119.76 3kqx s VAL 421 Ca 0.00 -0.75 -0.05 0.00 -2.93 0.00 0.00 61.98 58.25 3kqx s VAL 421 Cb 0.00 -1.08 -0.03 0.00 -1.53 0.00 0.00 36.38 33.74 3kqx s VAL 421 CO 0.00 0.32 -0.01 -0.70 -3.33 0.00 0.00 175.10 171.38 3kqx s GLU 422 N -0.50 3.73 -0.08 1.54 2.12 -0.30 -2.21 118.70 123.00 3kqx s GLU 422 Ca 0.06 -0.46 0.02 0.00 0.36 0.00 0.00 54.97 54.94 3kqx s GLU 422 Cb -0.07 -2.99 0.02 0.00 0.26 0.00 0.00 34.13 31.35 3kqx s GLU 422 CO -0.00 0.28 -0.12 0.42 -0.54 0.00 0.00 175.26 175.29 3kqx s ILE 423 N 0.30 1.18 -0.18 -3.70 1.01 -0.05 -0.85 121.20 118.90 3kqx s ILE 423 Ca -0.01 -0.48 -0.06 0.00 0.00 0.00 0.00 60.65 60.10 3kqx s ILE 423 Cb -0.14 -1.09 -0.03 0.00 0.01 0.00 0.00 42.46 41.21 3kqx s ILE 423 CO 0.02 0.37 0.03 -1.00 0.00 0.00 0.00 174.94 174.36 3kqx s HIS 424 N 0.87 3.15 -0.27 3.97 3.76 0.05 -0.02 115.29 126.80 3kqx s HIS 424 Ca -0.10 -0.12 -0.06 0.00 -0.15 0.00 0.00 55.06 54.62 3kqx s HIS 424 Cb -0.15 -2.06 0.00 0.00 1.11 0.00 0.00 32.58 31.47 3kqx s HIS 424 CO 0.01 0.02 0.05 -0.06 -0.85 0.00 0.00 174.74 173.91 3kqx s PHE 425 N 0.56 3.11 0.00 1.40 0.08 0.48 -0.34 117.98 123.26 3kqx s PHE 425 Ca 0.01 -0.90 0.05 0.00 0.12 0.00 0.00 56.93 56.22 3kqx s PHE 425 Cb -0.13 -2.22 -0.02 0.00 -0.57 0.00 0.00 43.02 40.08 3kqx s PHE 425 CO 0.02 -0.54 -0.17 -0.51 -0.10 0.00 0.00 175.22 173.92 3kqx s LEU 426 N 1.51 2.07 -0.23 -0.37 1.43 0.45 -0.73 118.68 122.82 3kqx s LEU 426 Ca 0.04 -0.36 -0.11 0.00 -1.03 0.00 0.00 54.13 52.67 3kqx s LEU 426 Cb -0.16 -0.83 0.08 0.00 0.03 0.00 0.00 46.19 45.30 3kqx s LEU 426 CO 0.02 0.17 0.54 -0.55 0.23 0.00 0.00 176.35 176.75 3kqx s SER 427 N -0.62 -0.70 -0.83 2.29 0.15 -0.06 -0.65 113.70 113.27 3kqx s SER 427 Ca 0.06 1.21 -0.23 0.00 0.70 0.00 0.00 55.95 57.69 3kqx s SER 427 Cb -0.07 1.28 0.07 0.00 -1.71 0.00 0.00 66.02 65.59 3kqx s SER 427 CO 0.00 -0.22 1.20 0.00 1.20 0.00 0.00 173.24 175.42 3kqx s ALA 428 N 1.89 2.97 -0.08 5.45 0.00 -1.26 0.68 121.76 131.42 3kqx s ALA 428 Ca -0.08 -2.03 -0.17 0.00 0.00 0.00 0.00 51.96 49.68 3kqx s ALA 428 Cb -0.08 -4.17 -0.05 0.00 0.00 0.00 0.00 23.12 18.82 3kqx s ALA 428 CO -0.16 -3.16 0.45 0.08 0.00 0.00 0.00 175.76 172.96 3kqx s VAL 429 N 4.43 5.13 0.22 0.00 1.01 -0.59 -4.06 120.40 126.54 3kqx s VAL 429 Ca 0.34 0.90 -0.15 0.00 0.00 0.00 0.00 61.98 63.07 3kqx s VAL 429 Cb -0.08 -3.78 0.06 0.00 0.00 0.00 0.00 36.38 32.58 3kqx s VAL 429 CO 0.02 0.42 0.75 0.00 0.00 0.00 0.00 175.10 176.29 3kqx s GLU 431 N -2.05 0.99 -0.55 0.00 2.12 -1.26 -1.08 118.70 116.86 3kqx s GLU 431 Ca 0.16 -0.33 -0.15 0.00 0.36 0.00 0.00 54.97 55.01 3kqx s GLU 431 Cb -0.03 -0.92 0.13 0.00 0.26 0.00 0.00 34.13 33.57 3kqx s GLU 431 CO 0.07 0.14 0.51 1.21 -0.54 0.00 0.00 175.26 176.64 3kqx s ASN 432 N 0.12 6.19 0.36 -1.70 2.47 -0.52 -4.41 114.94 117.45 3kqx s ASN 432 Ca -0.02 -1.85 0.07 0.00 0.42 0.00 0.00 52.86 51.48 3kqx s ASN 432 Cb -0.08 -2.20 -0.07 0.00 -1.45 0.00 0.00 41.25 37.45 3kqx s ASN 432 CO 0.00 -0.83 -0.01 -0.04 -3.72 0.00 0.00 177.10 172.51 3kqx s MET 433 N 1.50 1.80 -0.14 0.43 -1.94 -1.26 -1.80 119.30 117.89 3kqx s MET 433 Ca 0.04 -1.99 -0.03 0.00 -1.71 0.00 0.00 55.69 52.00 3kqx s MET 433 Cb -0.29 -1.39 -0.03 0.00 2.01 0.00 0.00 34.83 35.13 3kqx s MET 433 CO 0.02 -0.04 -0.04 0.08 -0.01 0.00 0.00 175.02 175.03 3kqx s VAL 434 N -2.88 3.87 -0.07 -6.03 1.01 -1.26 -4.60 120.40 110.44 3kqx s VAL 434 Ca 0.34 -0.37 -0.31 0.00 0.00 0.00 0.00 61.98 61.64 3kqx s VAL 434 Cb 0.08 -2.68 0.12 0.00 0.00 0.00 0.00 36.38 33.89 3kqx s VAL 434 CO 0.16 0.51 1.03 -0.55 0.00 0.00 0.00 175.10 176.25 3kqx s SER 435 N 0.20 -0.26 0.63 3.32 0.15 -1.26 -4.97 113.70 111.50 3kqx s SER 435 Ca -0.02 -0.02 0.34 0.00 0.70 0.00 0.00 55.95 56.95 3kqx s SER 435 Cb -0.14 0.29 1.94 0.00 -1.71 0.00 0.00 66.02 66.40 3kqx s SER 435 CO 0.03 -0.47 2.19 0.07 1.20 0.00 0.00 173.24 176.26 3kqx h LYS 436 N 2.00 0.00 -0.01 5.44 2.10 -1.98 -2.73 116.57 121.40 3kqx h LYS 436 Ca -0.17 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.48 3kqx h LYS 436 Cb 1.21 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.54 3kqx h LYS 436 CO 0.27 0.00 -0.40 0.09 -2.00 0.00 0.00 179.45 177.41 3kqx n ASN 437 N -3.45 1.23 -4.74 7.07 5.03 -1.26 -5.01 115.26 114.13 3kqx n ASN 437 Ca -0.01 -0.99 -0.34 0.00 0.87 0.00 0.00 54.58 54.10 3kqx n ASN 437 Cb 0.20 0.30 0.07 0.00 -1.02 0.00 0.00 39.78 39.33 3kqx n ASN 437 CO 0.00 0.00 0.00 -0.44 -1.83 0.00 0.00 177.26 174.99 3kqx s SER 438 N -2.59 4.67 0.71 6.41 0.01 -1.03 -3.77 113.70 118.11 3kqx s SER 438 Ca 0.20 2.29 -0.13 0.00 1.31 0.00 0.00 55.95 59.62 3kqx s SER 438 Cb 0.18 -2.58 0.02 0.00 0.21 0.00 0.00 66.02 63.85 3kqx s SER 438 CO 0.58 -1.94 1.09 -0.72 0.41 0.00 0.00 173.24 172.66 3kqx s TYR 439 N -1.95 2.67 0.17 2.43 1.13 -1.26 -4.88 117.35 115.66 3kqx s TYR 439 Ca 0.74 1.54 0.09 0.00 -1.41 0.00 0.00 57.07 58.03 3kqx s TYR 439 Cb -0.28 -3.08 -0.04 0.00 -1.10 0.00 0.00 41.96 37.46 3kqx s TYR 439 CO 0.41 -1.66 -0.14 1.03 -2.51 0.00 0.00 175.55 172.68 3kqx s ARG 440 N -4.52 1.89 0.17 -3.49 0.52 -1.26 -4.66 118.95 107.60 3kqx s ARG 440 Ca 0.63 -1.30 -0.33 0.00 -0.52 0.00 0.00 55.73 54.21 3kqx s ARG 440 Cb -0.18 -2.09 -0.15 0.00 0.52 0.00 0.00 34.95 33.05 3kqx s ARG 440 CO 0.49 0.44 1.27 -2.30 0.02 0.00 0.00 175.30 175.22 3kqx n PRO 441 N 0.24 1.42 0.00 3.54 -0.02 -1.26 -1.85 135.00 137.07 3kqx n PRO 441 Ca -0.12 0.51 0.00 0.00 -2.02 0.00 0.00 63.50 61.87 3kqx n PRO 441 Cb 0.55 -2.08 0.00 0.00 -0.02 0.00 0.00 33.50 31.95 3kqx n PRO 441 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3kqx n GLY 442 N 2.23 3.37 3.67 -1.23 0.00 0.21 -5.01 105.19 108.44 3kqx n GLY 442 Ca 0.15 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.78 3kqx n GLY 442 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3kqx n ASP 443 N 0.00 1.67 -4.19 1.61 9.92 -0.77 -4.55 116.55 120.24 3kqx n ASP 443 Ca 0.00 0.91 -0.34 0.00 -0.53 0.00 0.00 54.79 54.84 3kqx n ASP 443 Cb 0.00 -1.46 -0.15 0.00 -0.64 0.00 0.00 41.12 38.86 3kqx n ASP 443 CO 0.00 0.00 0.00 -0.63 0.13 0.00 0.00 177.20 176.70 3kqx s ILE 444 N -1.38 2.56 0.24 0.53 1.01 -1.26 -0.66 121.20 122.25 3kqx s ILE 444 Ca 0.72 -0.78 0.10 0.00 0.00 0.00 0.00 60.65 60.70 3kqx s ILE 444 Cb -0.44 -2.12 -0.05 0.00 0.01 0.00 0.00 42.46 39.86 3kqx s ILE 444 CO 0.49 0.49 -0.18 0.27 0.00 0.00 0.00 174.94 176.01 3kqx s ILE 445 N 1.36 2.15 -0.23 2.92 -4.36 -0.59 -4.93 121.20 117.52 3kqx s ILE 445 Ca 0.05 -2.29 0.00 0.00 -0.26 0.00 0.00 60.65 58.15 3kqx s ILE 445 Cb -0.14 -2.17 0.03 0.00 1.25 0.00 0.00 42.46 41.44 3kqx s ILE 445 CO -0.09 -0.46 -0.12 -0.89 0.24 0.00 0.00 174.94 173.62 3kqx s THR 446 N -2.64 2.44 1.02 8.37 2.01 -1.26 -0.39 115.64 125.19 3kqx s THR 446 Ca 0.26 -1.15 -0.12 0.00 0.31 0.00 0.00 61.69 60.99 3kqx s THR 446 Cb -0.03 -2.22 0.20 0.00 0.01 0.00 0.00 72.50 70.45 3kqx s THR 446 CO 0.11 0.25 1.08 0.00 -0.69 0.00 0.00 174.62 175.37 3kqx s ALA 447 N 1.26 0.65 -0.63 7.40 0.00 -0.45 -2.55 121.76 127.44 3kqx s ALA 447 Ca -0.01 0.08 0.18 0.00 0.00 0.00 0.00 51.96 52.22 3kqx s ALA 447 Cb -0.16 -3.28 0.81 0.00 0.00 0.00 0.00 23.12 20.49 3kqx s ALA 447 CO -0.07 -3.11 1.56 -1.13 0.00 0.00 0.00 175.76 173.01 3kqx n SER 448 N -4.43 0.40 -0.68 0.00 3.41 -1.09 -1.29 113.62 109.95 3kqx n SER 448 Ca 0.07 0.62 0.09 0.00 -0.26 0.00 0.00 58.87 59.39 3kqx n SER 448 Cb 0.54 -0.70 0.29 0.00 -0.26 0.00 0.00 64.21 64.08 3kqx n SER 448 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 3kqx n ASN 449 N -1.97 2.01 0.00 4.04 6.94 -1.26 -4.93 115.26 120.08 3kqx n ASN 449 Ca 0.02 -1.84 0.00 0.00 -0.02 0.00 0.00 54.58 52.74 3kqx n ASN 449 Cb 0.16 -0.17 0.00 0.00 -2.36 0.00 0.00 39.78 37.40 3kqx n ASN 449 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 3kqx n GLY 450 N 1.17 0.85 3.67 4.83 0.00 -0.41 -5.04 105.19 110.26 3kqx n GLY 450 Ca 0.16 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.75 3kqx n GLY 450 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3kqx s LYS 451 N -0.29 4.27 0.31 1.61 1.02 -1.26 -4.80 119.74 120.59 3kqx s LYS 451 Ca 0.00 1.79 -0.28 0.00 0.02 0.00 0.00 55.97 57.50 3kqx s LYS 451 Cb 0.00 -3.70 -0.09 0.00 -0.52 0.00 0.00 37.83 33.51 3kqx s LYS 451 CO 0.00 -0.63 1.03 0.95 -0.92 0.00 0.00 175.35 175.78 3kqx s THR 452 N 3.03 3.78 -0.05 2.17 -4.23 -1.26 -1.34 115.64 117.74 3kqx s THR 452 Ca 0.59 1.62 0.02 0.00 -1.18 0.00 0.00 61.69 62.75 3kqx s THR 452 Cb -0.26 -3.97 0.01 0.00 1.34 0.00 0.00 72.50 69.63 3kqx s THR 452 CO 0.21 0.26 -0.10 -0.63 -0.54 0.00 0.00 174.62 173.81 3kqx s ILE 453 N -1.37 0.97 -0.28 2.99 1.01 0.48 -2.26 121.20 122.73 3kqx s ILE 453 Ca 0.48 -0.41 -0.18 0.00 0.00 0.00 0.00 60.65 60.55 3kqx s ILE 453 Cb -0.26 -0.89 -0.02 0.00 0.01 0.00 0.00 42.46 41.30 3kqx s ILE 453 CO 0.33 0.31 0.52 -0.70 0.00 0.00 0.00 174.94 175.40 3kqx s GLU 454 N 0.55 3.97 -0.26 2.79 2.12 -0.23 -1.54 118.70 126.09 3kqx s GLU 454 Ca -0.11 0.23 -0.29 0.00 0.36 0.00 0.00 54.97 55.16 3kqx s GLU 454 Cb -0.14 -3.69 0.00 0.00 0.26 0.00 0.00 34.13 30.57 3kqx s GLU 454 CO 0.02 -0.43 1.16 0.08 -0.54 0.00 0.00 175.26 175.56 3kqx s VAL 455 N 2.35 4.41 -0.32 3.70 1.01 0.17 -1.70 120.40 130.03 3kqx s VAL 455 Ca 0.21 1.66 0.19 0.00 0.00 0.00 0.00 61.98 64.03 3kqx s VAL 455 Cb -0.15 -4.24 -0.26 0.00 0.00 0.00 0.00 36.38 31.73 3kqx s VAL 455 CO 0.10 -0.33 0.54 0.61 0.00 0.00 0.00 175.10 176.02 3kqx n GLY 456 N 3.79 -0.80 3.30 4.51 0.00 -1.26 0.67 105.19 115.39 3kqx n GLY 456 Ca 0.13 -0.47 -0.02 0.00 0.00 0.00 0.00 46.02 45.66 3kqx n GLY 456 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3kqx s ASN 457 N -3.65 -0.82 0.00 1.61 3.84 -1.26 -4.72 114.94 109.94 3kqx s ASN 457 Ca -0.02 1.03 0.20 0.00 0.21 0.00 0.00 52.86 54.29 3kqx s ASN 457 Cb 0.13 1.88 0.92 0.00 -0.55 0.00 0.00 41.25 43.63 3kqx s ASN 457 CO 0.77 -0.25 1.65 0.35 -2.79 0.00 0.00 177.10 176.83 3kqx n THR 458 N 5.42 0.54 1.41 -5.21 -2.24 -1.26 -1.61 114.28 111.32 3kqx n THR 458 Ca -0.07 0.13 0.13 0.00 -2.27 0.00 0.00 64.05 61.98 3kqx n THR 458 Cb 0.50 -0.79 0.47 0.00 -2.10 0.00 0.00 70.33 68.41 3kqx n THR 458 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 3kqx n ASP 459 N -1.43 1.66 -2.78 3.42 2.03 -0.90 -3.78 116.55 114.78 3kqx n ASP 459 Ca 0.06 -1.57 -0.37 0.00 0.52 0.00 0.00 54.79 53.44 3kqx n ASP 459 Cb 0.21 -0.02 0.02 0.00 -0.72 0.00 0.00 41.12 40.62 3kqx n ASP 459 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3kqx n ALA 460 N 0.30 6.48 0.16 -1.67 0.00 -0.64 -4.67 120.51 120.48 3kqx n ALA 460 Ca 0.18 -3.82 0.09 0.00 0.00 0.00 0.00 53.44 49.89 3kqx n ALA 460 Cb 0.37 -2.01 0.08 0.00 0.00 0.00 0.00 19.45 17.90 3kqx n ALA 460 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 177.50 178.55 3kqx h GLU 461 N 2.91 0.00 -0.53 0.00 9.09 -1.79 -3.35 114.58 120.90 3kqx h GLU 461 Ca 0.53 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.94 3kqx h GLU 461 Cb 0.23 0.00 -0.03 0.00 -1.65 0.00 0.00 28.75 27.30 3kqx h GLU 461 CO 1.32 0.13 0.34 0.78 0.05 0.00 0.00 179.01 181.63 3kqx h GLY 462 N 3.87 0.76 2.00 1.06 0.00 -1.92 -2.34 103.07 106.50 3kqx h GLY 462 Ca -0.01 -0.30 -0.06 0.00 0.00 0.00 0.00 47.33 46.95 3kqx h GLY 462 CO 0.02 0.30 -0.28 0.07 0.00 0.00 0.00 176.54 176.65 3kqx h ARG 463 N 0.72 0.00 0.18 4.80 0.11 -1.95 -1.60 114.38 116.64 3kqx h ARG 463 Ca 0.19 0.00 -0.01 0.00 0.10 0.00 0.00 59.98 60.26 3kqx h ARG 463 Cb -0.04 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.04 3kqx h ARG 463 CO -0.04 0.28 -0.09 -0.07 0.10 0.00 0.00 179.97 180.15 3kqx h LEU 464 N 0.00 -0.20 -0.76 0.08 3.38 -1.58 -1.29 115.31 114.94 3kqx h LEU 464 Ca -0.00 -0.08 -0.03 0.00 0.09 0.00 0.00 57.88 57.85 3kqx h LEU 464 Cb 0.51 0.05 -0.03 0.00 0.09 0.00 0.00 40.66 41.28 3kqx h LEU 464 CO 0.04 -0.05 0.35 0.71 0.09 0.00 0.00 178.44 179.58 3kqx h THR 465 N -0.35 1.25 -0.55 0.22 1.35 -1.31 -3.04 112.91 110.47 3kqx h THR 465 Ca -0.02 -0.72 -0.10 0.00 -0.55 0.00 0.00 66.41 65.02 3kqx h THR 465 Cb 0.27 0.31 -0.02 0.00 -1.73 0.00 0.00 68.15 66.99 3kqx h THR 465 CO 0.04 0.30 -0.04 -0.07 -0.25 0.00 0.00 175.52 175.50 3kqx h LEU 466 N 1.08 0.97 -0.53 3.87 3.38 -1.35 -2.04 115.31 120.68 3kqx h LEU 466 Ca 0.26 -0.28 0.11 0.00 0.09 0.00 0.00 57.88 58.05 3kqx h LEU 466 Cb 0.15 -0.26 -0.11 0.00 0.09 0.00 0.00 40.66 40.53 3kqx h LEU 466 CO -0.03 1.04 -0.20 0.00 0.09 0.00 0.00 178.44 179.35 3kqx h ALA 467 N 1.05 0.23 -0.16 1.53 0.00 -1.12 0.40 119.26 121.20 3kqx h ALA 467 Ca 0.15 0.19 -0.13 0.00 0.00 0.00 0.00 54.91 55.12 3kqx h ALA 467 Cb 0.58 0.51 -0.01 0.00 0.00 0.00 0.00 17.79 18.87 3kqx h ALA 467 CO 0.03 -0.51 -0.48 -0.44 0.00 0.00 0.00 179.25 177.86 3kqx h ASP 468 N -0.07 0.44 -0.49 0.00 3.32 -1.49 -2.33 116.42 115.79 3kqx h ASP 468 Ca 0.25 -0.21 -0.08 0.00 0.02 0.00 0.00 57.03 57.01 3kqx h ASP 468 Cb 0.46 -0.12 -0.02 0.00 0.22 0.00 0.00 39.33 39.86 3kqx h ASP 468 CO -0.58 0.85 0.01 0.00 -1.72 0.00 0.00 179.24 177.79 3kqx h ALA 469 N 1.17 0.99 -0.48 3.45 0.00 -0.59 -2.29 119.26 121.51 3kqx h ALA 469 Ca 0.02 -0.28 -0.09 0.00 0.00 0.00 0.00 54.91 54.55 3kqx h ALA 469 Cb 0.96 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.52 3kqx h ALA 469 CO 0.08 0.62 -0.06 -0.07 0.00 0.00 0.00 179.25 179.82 3kqx h LEU 470 N 0.85 0.88 -0.41 0.00 3.38 -0.06 -0.76 115.31 119.19 3kqx h LEU 470 Ca 0.16 -0.34 -0.02 0.00 0.09 0.00 0.00 57.88 57.77 3kqx h LEU 470 Cb 0.49 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.99 3kqx h LEU 470 CO 0.02 1.01 0.16 -0.37 0.09 0.00 0.00 178.44 179.36 3kqx h VAL 471 N 0.74 1.20 -0.38 1.22 -1.51 -1.33 -1.20 116.25 114.99 3kqx h VAL 471 Ca 0.13 -0.61 0.07 0.00 -1.23 0.00 0.00 66.70 65.06 3kqx h VAL 471 Cb 0.60 0.83 -0.07 0.00 -2.13 0.00 0.00 31.29 30.52 3kqx h VAL 471 CO 0.04 0.22 -0.05 0.22 -1.23 0.00 0.00 177.57 176.77 3kqx h TYR 472 N 0.53 -0.11 -0.61 5.19 3.20 -1.31 -0.63 116.97 123.23 3kqx h TYR 472 Ca 0.14 0.03 0.02 0.00 3.14 0.00 0.00 58.73 62.06 3kqx h TYR 472 Cb 0.19 0.11 -0.03 0.00 1.54 0.00 0.00 36.73 38.54 3kqx h TYR 472 CO 0.00 -0.12 0.39 0.00 -1.64 0.00 0.00 178.16 176.79 3kqx h ALA 473 N 1.36 0.78 -0.04 1.82 0.00 -0.83 -2.30 119.26 120.05 3kqx h ALA 473 Ca 0.18 -0.03 -0.16 0.00 0.00 0.00 0.00 54.91 54.91 3kqx h ALA 473 Cb 0.27 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 3kqx h ALA 473 CO -0.35 0.15 -0.68 1.49 0.00 0.00 0.00 179.25 179.87 3kqx h GLU 474 N 0.78 0.18 0.00 0.00 4.81 -0.92 -2.40 114.58 117.03 3kqx h GLU 474 Ca 0.23 -0.14 -0.02 0.00 -0.13 0.00 0.00 59.36 59.30 3kqx h GLU 474 Cb -0.03 0.03 -0.00 0.00 0.63 0.00 0.00 28.75 29.37 3kqx h GLU 474 CO -0.08 0.79 -0.10 0.87 -0.73 0.00 0.00 179.01 179.76 3kqx h LYS 475 N 0.12 0.00 0.00 1.92 1.57 -0.58 -2.16 116.57 117.45 3kqx h LYS 475 Ca -0.01 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.77 3kqx h LYS 475 Cb 1.21 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.52 3kqx h LYS 475 CO 0.10 0.10 0.00 1.28 -0.57 0.00 0.00 179.45 180.36 3kqx n LEU 476 N -3.76 0.00 -2.13 2.94 4.32 -0.90 -4.92 117.00 112.55 3kqx n LEU 476 Ca -0.02 0.45 -0.09 0.00 -0.02 0.00 0.00 56.01 56.34 3kqx n LEU 476 Cb 0.21 -0.45 0.04 0.00 -1.62 0.00 0.00 43.42 41.59 3kqx n LEU 476 CO 0.30 -0.31 0.06 0.61 -1.22 0.00 0.00 177.39 176.83 3kqx n GLY 477 N -0.53 0.09 3.96 -0.72 0.00 -0.81 -5.05 105.19 102.12 3kqx n GLY 477 Ca 0.03 -0.21 -0.23 0.00 0.00 0.00 0.00 46.02 45.61 3kqx n GLY 477 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3kqx s VAL 478 N -3.17 2.45 -0.03 1.61 -7.23 -1.26 -4.96 120.40 107.81 3kqx s VAL 478 Ca 0.04 -0.50 0.04 0.00 -1.81 0.00 0.00 61.98 59.75 3kqx s VAL 478 Cb -0.02 -2.94 -0.25 0.00 0.56 0.00 0.00 36.38 33.73 3kqx s VAL 478 CO 0.35 0.00 0.71 0.44 -0.31 0.00 0.00 175.10 176.29 3kqx h ASP 479 N -0.27 0.18 -3.73 4.85 3.32 -0.30 -3.48 116.42 117.00 3kqx h ASP 479 Ca -0.42 -0.33 -0.28 0.00 0.02 0.00 0.00 57.03 56.02 3kqx h ASP 479 Cb 1.30 -0.06 -0.29 0.00 0.22 0.00 0.00 39.33 40.49 3kqx h ASP 479 CO 0.53 1.29 -0.73 -0.31 -1.72 0.00 0.00 179.24 178.30 3kqx s TYR 480 N -2.61 0.18 -0.15 4.55 2.02 -1.06 -3.95 117.35 116.33 3kqx s TYR 480 Ca -0.09 -0.02 0.01 0.00 -0.37 0.00 0.00 57.07 56.61 3kqx s TYR 480 Cb 0.08 -0.16 0.00 0.00 -0.40 0.00 0.00 41.96 41.48 3kqx s TYR 480 CO 0.82 -0.03 -0.18 0.42 -1.57 0.00 0.00 175.55 175.01 3kqx s ILE 481 N 0.19 2.37 -0.15 2.71 1.01 -0.31 -1.35 121.20 125.67 3kqx s ILE 481 Ca -0.02 -0.87 0.02 0.00 0.00 0.00 0.00 60.65 59.78 3kqx s ILE 481 Cb -0.03 -1.98 0.01 0.00 0.01 0.00 0.00 42.46 40.47 3kqx s ILE 481 CO -0.01 0.53 -0.20 -0.69 0.00 0.00 0.00 174.94 174.58 3kqx s VAL 482 N 0.86 1.95 0.17 2.92 1.01 -0.08 -1.27 120.40 125.95 3kqx s VAL 482 Ca -0.05 -0.90 0.07 0.00 0.00 0.00 0.00 61.98 61.10 3kqx s VAL 482 Cb -0.15 -1.74 -0.04 0.00 0.00 0.00 0.00 36.38 34.44 3kqx s VAL 482 CO -0.02 0.53 0.02 1.51 0.00 0.00 0.00 175.10 177.14 3kqx s ASP 483 N 1.01 4.91 -0.04 3.32 1.47 -0.20 -0.94 116.67 126.20 3kqx s ASP 483 Ca -0.03 -0.34 -0.01 0.00 1.18 0.00 0.00 52.55 53.35 3kqx s ASP 483 Cb -0.15 -1.10 0.03 0.00 -0.34 0.00 0.00 42.92 41.37 3kqx s ASP 483 CO -0.05 0.09 0.08 -0.51 0.68 0.00 0.00 175.17 175.46 3kqx s ILE 484 N -1.70 -0.06 -0.24 2.11 2.07 -0.12 -0.98 121.20 122.27 3kqx s ILE 484 Ca 0.28 0.21 -0.19 0.00 -1.41 0.00 0.00 60.65 59.54 3kqx s ILE 484 Cb -0.10 -0.15 0.07 0.00 0.13 0.00 0.00 42.46 42.41 3kqx s ILE 484 CO 0.19 0.09 0.62 0.00 -1.91 0.00 0.00 174.94 173.93 3kqx s ALA 485 N 1.18 -1.59 -1.38 1.50 0.00 -0.42 -1.64 121.76 119.41 3kqx s ALA 485 Ca -0.08 1.91 -0.16 0.00 0.00 0.00 0.00 51.96 53.63 3kqx s ALA 485 Cb -0.12 -1.12 0.04 0.00 0.00 0.00 0.00 23.12 21.92 3kqx s ALA 485 CO -0.04 -0.31 2.03 0.25 0.00 0.00 0.00 175.76 177.68 3kqx n THR 486 N 3.27 3.56 -0.08 0.00 -2.24 -1.26 -0.49 114.28 117.04 3kqx n THR 486 Ca -0.16 -3.36 -0.14 0.00 -2.27 0.00 0.00 64.05 58.11 3kqx n THR 486 Cb 0.56 -2.50 -0.10 0.00 -2.10 0.00 0.00 70.33 66.20 3kqx n THR 486 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 3kqx h LEU 487 N 11.21 0.00 -7.87 3.22 5.85 -1.91 -3.44 115.31 122.37 3kqx h LEU 487 Ca 0.51 -0.62 -0.49 0.00 0.84 0.00 0.00 57.88 58.12 3kqx h LEU 487 Cb 0.73 0.00 -0.34 0.00 0.37 0.00 0.00 40.66 41.42 3kqx h LEU 487 CO 1.72 1.10 -0.80 0.42 -0.34 0.00 0.00 178.44 180.53 3kqx s THR 488 N -2.20 0.98 -0.09 1.05 -4.23 -1.26 -4.93 115.64 104.96 3kqx s THR 488 Ca -0.20 -0.36 0.30 0.00 -1.18 0.00 0.00 61.69 60.25 3kqx s THR 488 Cb 0.01 -0.93 0.33 0.00 1.34 0.00 0.00 72.50 73.24 3kqx s THR 488 CO 0.53 0.33 1.89 1.23 -0.54 0.00 0.00 174.62 178.06 3kqx h GLY 489 N 7.28 0.00 1.21 3.99 0.00 -1.94 -1.74 103.07 111.85 3kqx h GLY 489 Ca -0.32 0.00 0.10 0.00 0.00 0.00 0.00 47.33 47.11 3kqx h GLY 489 CO 0.46 0.00 0.30 0.00 0.00 0.00 0.00 176.54 177.30 3kqx h ALA 490 N 2.10 2.13 -0.92 3.60 0.00 -1.97 -0.07 119.26 124.14 3kqx h ALA 490 Ca 0.00 -0.01 0.24 0.00 0.00 0.00 0.00 54.91 55.14 3kqx h ALA 490 Cb 0.35 0.03 -0.06 0.00 0.00 0.00 0.00 17.79 18.11 3kqx h ALA 490 CO 0.00 -0.48 0.63 0.52 0.00 0.00 0.00 179.25 179.92 3kqx h MET 491 N 0.00 0.21 -0.42 0.00 2.86 -1.70 0.13 114.93 116.00 3kqx h MET 491 Ca 0.16 -0.01 0.07 0.00 -2.06 0.00 0.00 59.70 57.86 3kqx h MET 491 Cb 0.76 -0.05 -0.02 0.00 0.06 0.00 0.00 31.60 32.35 3kqx h MET 491 CO -0.00 0.14 0.29 -0.07 1.06 0.00 0.00 176.91 178.33 3kqx h LEU 492 N 0.22 0.25 0.00 1.22 3.38 -1.21 -1.16 115.31 118.01 3kqx h LEU 492 Ca 0.47 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.44 3kqx h LEU 492 Cb 1.47 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 42.17 3kqx h LEU 492 CO -0.11 0.16 -0.78 -1.22 0.09 0.00 0.00 178.44 176.58 3kqx n TYR 493 N -4.47 0.32 -0.08 1.13 4.02 0.41 -3.38 117.16 115.11 3kqx n TYR 493 Ca 0.06 0.09 -0.09 0.00 -0.01 0.00 0.00 57.90 57.95 3kqx n TYR 493 Cb 0.29 -0.48 -0.03 0.00 -0.02 0.00 0.00 39.34 39.10 3kqx n TYR 493 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 176.86 174.72 3kqx n SER 494 N -1.93 1.89 -0.01 7.72 3.41 -0.98 -4.82 113.62 118.90 3kqx n SER 494 Ca 0.03 0.32 0.09 0.00 -0.26 0.00 0.00 58.87 59.05 3kqx n SER 494 Cb 0.42 -0.72 -0.14 0.00 -0.26 0.00 0.00 64.21 63.50 3kqx n SER 494 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3kqx n LEU 495 N -4.39 0.00 0.00 1.04 4.77 -0.73 -5.10 117.00 112.58 3kqx n LEU 495 Ca -0.15 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.83 3kqx n LEU 495 Cb 0.51 0.01 0.00 0.00 -2.33 0.00 0.00 43.42 41.60 3kqx n LEU 495 CO 0.19 0.01 0.00 0.61 -1.33 0.00 0.00 177.39 176.87 3kqx n GLY 496 N 1.46 -0.07 0.35 -0.72 0.00 -0.52 -4.36 105.19 101.33 3kqx n GLY 496 Ca -0.04 -1.45 0.11 0.00 0.00 0.00 0.00 46.02 44.64 3kqx n GLY 496 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3kqx n THR 497 N 0.00 0.00 -0.11 2.61 -2.24 -1.26 -4.34 114.28 108.94 3kqx n THR 497 Ca 0.00 -0.18 -0.15 0.00 -2.27 0.00 0.00 64.05 61.44 3kqx n THR 497 Cb 0.00 1.12 -0.11 0.00 -2.10 0.00 0.00 70.33 69.24 3kqx n THR 497 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 3kqx n SER 498 N -0.44 2.16 -4.49 3.42 2.88 -1.26 -4.20 113.62 111.69 3kqx n SER 498 Ca 0.08 -0.11 -0.34 0.00 -1.33 0.00 0.00 58.87 57.17 3kqx n SER 498 Cb 0.43 -0.28 -0.12 0.00 -0.75 0.00 0.00 64.21 63.48 3kqx n SER 498 CO 0.00 0.00 0.00 -0.31 -1.23 0.00 0.00 175.04 173.50 3kqx s TYR 499 N -2.45 2.98 0.72 0.66 4.12 -1.26 -4.53 117.35 117.59 3kqx s TYR 499 Ca -0.29 -0.32 -0.11 0.00 0.02 0.00 0.00 57.07 56.37 3kqx s TYR 499 Cb 0.08 -1.92 0.02 0.00 -1.52 0.00 0.00 41.96 38.62 3kqx s TYR 499 CO 0.53 -0.03 1.07 0.00 0.02 0.00 0.00 175.55 177.14 3kqx s ALA 500 N 0.25 2.56 -0.09 3.71 0.00 -0.75 -4.61 121.76 122.84 3kqx s ALA 500 Ca -0.04 0.09 -0.05 0.00 0.00 0.00 0.00 51.96 51.97 3kqx s ALA 500 Cb -0.14 -3.19 -0.04 0.00 0.00 0.00 0.00 23.12 19.75 3kqx s ALA 500 CO 0.03 -1.37 0.11 0.20 0.00 0.00 0.00 175.76 174.73 3kqx s GLY 501 N -3.73 2.08 -0.07 0.00 0.00 -1.15 -0.67 107.32 103.78 3kqx s GLY 501 Ca 0.59 -0.71 0.03 0.00 0.00 0.00 0.00 44.72 44.62 3kqx s GLY 501 CO 0.55 -0.49 -0.16 0.54 0.00 0.00 0.00 173.10 173.55 3kqx s VAL 502 N -1.05 1.38 0.14 1.40 0.11 -0.23 -0.24 120.40 121.92 3kqx s VAL 502 Ca 0.17 -0.63 0.08 0.00 -2.93 0.00 0.00 61.98 58.67 3kqx s VAL 502 Cb -0.12 -1.23 -0.04 0.00 -1.53 0.00 0.00 36.38 33.46 3kqx s VAL 502 CO 0.06 0.41 -0.19 -0.36 -3.33 0.00 0.00 175.10 171.69 3kqx s PHE 503 N 0.50 1.82 0.16 1.54 0.08 -0.22 -1.03 117.98 120.83 3kqx s PHE 503 Ca -0.14 -0.45 -0.24 0.00 0.12 0.00 0.00 56.93 56.22 3kqx s PHE 503 Cb -0.16 -0.94 0.07 0.00 -0.57 0.00 0.00 43.02 41.43 3kqx s PHE 503 CO 0.05 0.29 1.01 0.20 -0.10 0.00 0.00 175.22 176.66 3kqx s GLY 504 N -2.41 -0.12 0.00 4.36 0.00 -1.26 -0.02 107.32 107.86 3kqx s GLY 504 Ca 0.13 0.00 0.23 0.00 0.00 0.00 0.00 44.72 45.08 3kqx s GLY 504 CO 0.06 0.75 1.40 1.16 0.00 0.00 0.00 173.10 176.47 3kqx n ASN 505 N -0.73 3.40 -3.64 1.64 0.23 -0.49 -4.81 115.26 110.87 3kqx n ASN 505 Ca -0.05 -1.99 -0.11 0.00 -0.53 0.00 0.00 54.58 51.90 3kqx n ASN 505 Cb 0.60 -0.23 -0.11 0.00 -2.08 0.00 0.00 39.78 37.96 3kqx n ASN 505 CO 0.00 0.00 0.00 0.21 -0.93 0.00 0.00 177.26 176.54 3kqx s ASN 506 N -1.53 0.09 0.13 0.53 3.84 -1.26 -4.89 114.94 111.86 3kqx s ASN 506 Ca 0.38 0.74 -0.14 0.00 0.21 0.00 0.00 52.86 54.05 3kqx s ASN 506 Cb 0.23 1.03 -0.01 0.00 -0.55 0.00 0.00 41.25 41.94 3kqx s ASN 506 CO 0.32 -0.24 1.56 -0.08 -2.79 0.00 0.00 177.10 175.87 3kqx h GLU 507 N 8.23 0.77 -0.63 0.43 4.81 -1.96 -1.79 114.58 124.45 3kqx h GLU 507 Ca -0.15 -0.27 -0.09 0.00 -0.13 0.00 0.00 59.36 58.72 3kqx h GLU 507 Cb 1.11 -0.06 -0.02 0.00 0.63 0.00 0.00 28.75 30.41 3kqx h GLU 507 CO 0.14 0.87 0.04 1.05 -0.73 0.00 0.00 179.01 180.38 3kqx h GLU 508 N 0.60 1.08 -0.40 1.92 9.09 -1.98 0.15 114.58 125.04 3kqx h GLU 508 Ca 0.11 -0.32 0.01 0.00 0.05 0.00 0.00 59.36 59.21 3kqx h GLU 508 Cb 0.55 -0.11 -0.02 0.00 -1.65 0.00 0.00 28.75 27.52 3kqx h GLU 508 CO 0.03 1.03 0.25 1.25 0.05 0.00 0.00 179.01 181.62 3kqx h LEU 509 N 0.99 0.42 -0.39 3.06 5.85 -1.96 -1.21 115.31 122.06 3kqx h LEU 509 Ca 0.18 -0.01 0.01 0.00 0.84 0.00 0.00 57.88 58.91 3kqx h LEU 509 Cb 0.52 -0.10 -0.02 0.00 0.37 0.00 0.00 40.66 41.43 3kqx h LEU 509 CO 0.02 0.31 0.24 0.40 -0.34 0.00 0.00 178.44 179.07 3kqx h ILE 510 N 0.51 1.06 -0.79 4.05 1.08 -0.82 -1.02 117.51 121.58 3kqx h ILE 510 Ca 0.15 -0.17 0.08 0.00 -0.39 0.00 0.00 64.86 64.53 3kqx h ILE 510 Cb -0.03 0.53 -0.05 0.00 -3.07 0.00 0.00 36.82 34.19 3kqx h ILE 510 CO -0.05 0.09 0.52 0.78 -0.69 0.00 0.00 178.15 178.80 3kqx h ASN 511 N 0.49 0.72 -0.56 1.72 2.35 -0.54 -0.59 115.58 119.17 3kqx h ASN 511 Ca 0.15 0.01 -0.11 0.00 -0.55 0.00 0.00 56.30 55.80 3kqx h ASN 511 Cb -0.02 -0.14 -0.02 0.00 0.05 0.00 0.00 38.32 38.19 3kqx h ASN 511 CO -0.06 0.45 -0.10 0.11 -1.65 0.00 0.00 177.43 176.19 3kqx h LYS 512 N 0.81 1.05 -0.28 0.81 1.57 -0.33 -1.71 116.57 118.49 3kqx h LYS 512 Ca 0.35 -0.39 0.01 0.00 -1.87 0.00 0.00 60.65 58.75 3kqx h LYS 512 Cb 0.31 -0.07 -0.02 0.00 0.08 0.00 0.00 32.23 32.53 3kqx h LYS 512 CO -0.13 1.08 0.17 0.82 -0.57 0.00 0.00 179.45 180.83 3kqx h ILE 513 N 0.93 1.04 -0.56 1.86 1.08 -0.54 -0.80 117.51 120.52 3kqx h ILE 513 Ca 0.15 -0.12 -0.02 0.00 -0.39 0.00 0.00 64.86 64.47 3kqx h ILE 513 Cb 0.67 0.66 -0.03 0.00 -3.07 0.00 0.00 36.82 35.06 3kqx h ILE 513 CO 0.05 0.06 0.25 -0.07 -0.69 0.00 0.00 178.15 177.75 3kqx h LEU 514 N 0.35 0.72 -0.41 1.44 3.38 -0.96 -0.80 115.31 119.04 3kqx h LEU 514 Ca 0.11 -0.08 -0.04 0.00 0.09 0.00 0.00 57.88 57.97 3kqx h LEU 514 Cb -0.02 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.53 3kqx h LEU 514 CO -0.04 0.63 0.12 -0.61 0.09 0.00 0.00 178.44 178.62 3kqx h GLN 515 N 0.79 0.65 -0.37 1.13 5.75 -1.05 -1.58 115.11 120.43 3kqx h GLN 515 Ca 0.19 -0.15 -0.01 0.00 -0.15 0.00 0.00 58.65 58.54 3kqx h GLN 515 Cb 0.12 -0.09 -0.02 0.00 1.07 0.00 0.00 27.48 28.56 3kqx h GLN 515 CO -0.02 0.65 0.19 0.77 -2.65 0.00 0.00 178.83 177.77 3kqx h SER 516 N 0.52 0.44 -0.66 -0.69 0.02 -0.54 -1.84 113.55 110.80 3kqx h SER 516 Ca 0.13 -0.03 -0.06 0.00 -0.84 0.00 0.00 61.79 61.00 3kqx h SER 516 Cb 0.28 -0.11 -0.03 0.00 0.14 0.00 0.00 62.40 62.68 3kqx h SER 516 CO -0.00 0.37 0.19 -1.28 -1.14 0.00 0.00 176.83 174.97 3kqx h SER 517 N 0.51 0.97 -0.68 3.07 0.87 -0.58 0.18 113.55 117.89 3kqx h SER 517 Ca 0.13 -0.22 -0.06 0.00 -1.23 0.00 0.00 61.79 60.41 3kqx h SER 517 Cb 0.03 -0.26 -0.03 0.00 -0.44 0.00 0.00 62.40 61.70 3kqx h SER 517 CO -0.02 0.93 0.18 0.11 -0.53 0.00 0.00 176.83 177.50 3kqx h LYS 518 N 0.96 1.07 0.03 2.24 1.57 -0.54 -1.19 116.57 120.72 3kqx h LYS 518 Ca 0.21 -0.25 -0.27 0.00 -1.87 0.00 0.00 60.65 58.47 3kqx h LYS 518 Cb 0.32 -0.14 -0.03 0.00 0.08 0.00 0.00 32.23 32.45 3kqx h LYS 518 CO -0.00 0.95 -1.42 1.79 -0.57 0.00 0.00 179.45 180.19 3kqx h THR 519 N 1.00 1.22 0.00 -0.16 1.35 -1.09 -3.14 112.91 112.09 3kqx h THR 519 Ca 0.21 -2.98 0.00 0.00 -0.55 0.00 0.00 66.41 63.10 3kqx h THR 519 Cb 0.35 2.65 0.00 0.00 -1.73 0.00 0.00 68.15 69.42 3kqx h THR 519 CO -0.00 0.74 0.00 0.77 -0.25 0.00 0.00 175.52 176.78 3kqx h SER 520 N 0.02 0.00 -2.92 5.36 4.64 -0.70 -3.47 113.55 116.49 3kqx h SER 520 Ca -0.18 0.00 -0.36 0.00 -0.47 0.00 0.00 61.79 60.78 3kqx h SER 520 Cb 1.93 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 63.98 3kqx h SER 520 CO 0.12 0.00 -0.44 0.59 -0.87 0.00 0.00 176.83 176.22 3kqx n ASN 521 N -2.42 -5.18 -4.34 4.97 3.02 -0.46 -4.82 115.26 106.02 3kqx n ASN 521 Ca 0.04 0.12 -0.38 0.00 -0.03 0.00 0.00 54.58 54.32 3kqx n ASN 521 Cb 0.35 -4.39 -0.12 0.00 -0.61 0.00 0.00 39.78 35.01 3kqx n ASN 521 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 3kqx s GLU 522 N -4.79 2.92 0.09 3.52 2.02 -1.17 -4.93 118.70 116.35 3kqx s GLU 522 Ca 0.00 -0.99 -0.28 0.00 0.02 0.00 0.00 54.97 53.72 3kqx s GLU 522 Cb 0.00 -3.52 -0.06 0.00 0.10 0.00 0.00 34.13 30.65 3kqx s GLU 522 CO 0.00 -0.57 0.89 -1.25 0.02 0.00 0.00 175.26 174.34 3kqx s PRO 523 N 1.50 4.63 0.12 0.39 0.04 -1.26 -4.58 135.00 135.83 3kqx s PRO 523 Ca 0.01 1.31 0.04 0.00 0.04 0.00 0.00 61.00 62.40 3kqx s PRO 523 Cb -0.18 -3.37 -0.04 0.00 0.04 0.00 0.00 34.50 30.95 3kqx s PRO 523 CO 0.04 0.25 -0.10 0.08 0.04 0.00 0.00 177.00 177.31 3kqx s VAL 524 N -0.08 1.05 -0.01 -0.36 1.01 -1.26 -1.82 120.40 118.93 3kqx s VAL 524 Ca 0.43 -1.80 -0.01 0.00 0.00 0.00 0.00 61.98 60.61 3kqx s VAL 524 Cb -0.22 -1.55 0.01 0.00 0.00 0.00 0.00 36.38 34.62 3kqx s VAL 524 CO 0.27 -0.61 0.03 0.86 0.00 0.00 0.00 175.10 175.65 3kqx s TRP 525 N -2.73 -0.01 -0.11 5.22 -0.11 0.16 -4.91 118.94 116.45 3kqx s TRP 525 Ca 0.10 0.10 -0.30 0.00 1.22 0.00 0.00 56.10 57.22 3kqx s TRP 525 Cb -0.01 -0.09 -0.02 0.00 -1.50 0.00 0.00 33.47 31.85 3kqx s TRP 525 CO 0.00 -0.05 1.22 -0.46 -4.62 0.00 0.00 176.95 173.04 3kqx s TRP 526 N 0.46 3.05 0.02 5.86 -0.00 -1.26 -1.07 118.94 126.01 3kqx s TRP 526 Ca -0.04 1.14 0.08 0.00 -0.00 0.00 0.00 56.10 57.28 3kqx s TRP 526 Cb -0.05 -3.45 -0.03 0.00 -0.00 0.00 0.00 33.47 29.94 3kqx s TRP 526 CO -0.01 -1.43 -0.22 -0.51 -0.00 0.00 0.00 176.95 174.78 3kqx s LEU 527 N 2.80 2.38 0.52 5.86 1.43 -0.19 -4.91 118.68 126.57 3kqx s LEU 527 Ca 0.55 -0.47 -0.20 0.00 -1.03 0.00 0.00 54.13 52.98 3kqx s LEU 527 Cb -0.23 -1.41 -0.07 0.00 0.03 0.00 0.00 46.19 44.51 3kqx s LEU 527 CO 0.18 0.28 1.09 -2.16 0.23 0.00 0.00 176.35 175.97 3kqx s PRO 528 N -1.17 3.54 -0.53 1.29 0.04 -1.26 -4.38 135.00 132.53 3kqx s PRO 528 Ca 0.13 1.50 -0.17 0.00 0.04 0.00 0.00 61.00 62.49 3kqx s PRO 528 Cb -0.10 -2.04 0.10 0.00 0.04 0.00 0.00 34.50 32.49 3kqx s PRO 528 CO 0.03 -0.67 0.55 0.42 0.04 0.00 0.00 177.00 177.36 3kqx s ILE 529 N -1.87 5.06 -0.50 0.56 1.01 -1.26 -4.82 121.20 119.37 3kqx s ILE 529 Ca 0.70 -1.09 -0.22 0.00 0.00 0.00 0.00 60.65 60.04 3kqx s ILE 529 Cb -0.21 -4.32 0.04 0.00 0.01 0.00 0.00 42.46 37.98 3kqx s ILE 529 CO 0.24 -0.86 0.77 -0.63 0.00 0.00 0.00 174.94 174.46 3kqx s ILE 530 N 2.07 4.66 0.39 2.92 1.01 -1.26 -4.92 121.20 126.06 3kqx s ILE 530 Ca 0.07 0.05 0.19 0.00 0.00 0.00 0.00 60.65 60.96 3kqx s ILE 530 Cb -0.25 -4.37 0.19 0.00 0.01 0.00 0.00 42.46 38.04 3kqx s ILE 530 CO 0.06 -0.86 1.95 0.78 0.00 0.00 0.00 174.94 176.87 3kqx h ASN 531 N 9.08 0.00 -1.42 3.58 2.35 -1.99 -2.19 115.58 124.99 3kqx h ASN 531 Ca -0.26 0.00 0.41 0.00 -0.55 0.00 0.00 56.30 55.90 3kqx h ASN 531 Cb 1.09 0.00 -0.07 0.00 0.05 0.00 0.00 38.32 39.39 3kqx h ASN 531 CO 0.99 0.23 1.01 -0.08 -1.65 0.00 0.00 177.43 177.94 3kqx h GLU 532 N 0.00 0.03 0.00 0.81 4.81 -2.05 -0.47 114.58 117.71 3kqx h GLU 532 Ca -0.00 -0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 3kqx h GLU 532 Cb 0.47 -0.01 0.00 0.00 0.63 0.00 0.00 28.75 29.85 3kqx h GLU 532 CO 0.03 0.02 -0.28 0.66 -0.73 0.00 0.00 179.01 178.71 3kqx n TYR 533 N -4.17 0.07 -0.16 0.92 0.53 -0.82 -4.15 117.16 109.38 3kqx n TYR 533 Ca 0.32 0.02 0.11 0.00 -1.02 0.00 0.00 57.90 57.33 3kqx n TYR 533 Cb 1.46 -0.41 0.43 0.00 -1.03 0.00 0.00 39.34 39.79 3kqx n TYR 533 CO 0.00 0.00 0.00 -0.09 -1.02 0.00 0.00 176.86 175.75 3kqx h ARG 534 N 0.00 0.57 0.00 -0.72 9.65 -1.25 -0.44 114.38 122.19 3kqx h ARG 534 Ca 0.00 -0.03 -0.00 0.00 -1.10 0.00 0.00 59.98 58.84 3kqx h ARG 534 Cb 0.53 -0.13 -0.00 0.00 -1.39 0.00 0.00 29.97 28.98 3kqx h ARG 534 CO 0.00 0.38 -0.01 0.00 2.80 0.00 0.00 179.97 183.14 3kqx h ALA 535 N 1.64 1.43 0.00 2.80 0.00 -1.78 -1.15 119.26 122.20 3kqx h ALA 535 Ca 0.34 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.24 3kqx h ALA 535 Cb 0.52 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.31 3kqx h ALA 535 CO -0.12 0.01 0.00 0.25 0.00 0.00 0.00 179.25 179.39 3kqx n THR 536 N -3.72 0.77 1.05 0.00 -2.24 -0.17 -2.15 114.28 107.82 3kqx n THR 536 Ca -0.03 0.12 0.09 0.00 -2.27 0.00 0.00 64.05 61.96 3kqx n THR 536 Cb 0.09 -1.01 0.30 0.00 -2.10 0.00 0.00 70.33 67.61 3kqx n THR 536 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 3kqx n LEU 537 N -2.17 1.85 -4.64 3.22 4.77 -0.43 -4.54 117.00 115.06 3kqx n LEU 537 Ca 0.03 -0.83 -0.43 0.00 -0.03 0.00 0.00 56.01 54.75 3kqx n LEU 537 Cb 0.27 -0.16 -0.02 0.00 -2.33 0.00 0.00 43.42 41.18 3kqx n LEU 537 CO 0.22 0.41 1.20 0.20 -1.33 0.00 0.00 177.39 178.09 3kqx s ASN 538 N -1.38 6.66 0.26 -1.43 0.01 -0.91 -0.73 114.94 117.42 3kqx s ASN 538 Ca 0.30 1.50 -0.15 0.00 -0.71 0.00 0.00 52.86 53.80 3kqx s ASN 538 Cb 0.16 -2.54 -0.08 0.00 0.41 0.00 0.00 41.25 39.20 3kqx s ASN 538 CO 0.23 -1.04 0.67 -0.55 -1.51 0.00 0.00 177.10 174.91 3kqx s SER 539 N 3.01 6.82 0.30 -1.22 0.15 -1.26 -4.76 113.70 116.75 3kqx s SER 539 Ca 0.61 1.21 0.06 0.00 0.70 0.00 0.00 55.95 58.53 3kqx s SER 539 Cb -0.21 -2.34 0.49 0.00 -1.71 0.00 0.00 66.02 62.25 3kqx s SER 539 CO 0.23 -0.08 1.74 0.50 1.20 0.00 0.00 173.24 176.83 3kqx h LYS 540 N 2.76 0.31 0.00 5.44 1.63 -1.97 -3.40 116.57 121.34 3kqx h LYS 540 Ca -0.48 -0.13 -0.13 0.00 -0.85 0.00 0.00 60.65 59.07 3kqx h LYS 540 Cb 1.18 -0.02 -0.02 0.00 -0.60 0.00 0.00 32.23 32.77 3kqx h LYS 540 CO 0.66 0.60 -1.44 0.66 -3.45 0.00 0.00 179.45 176.48 3kqx n TYR 541 N -4.10 0.00 -2.31 1.91 4.01 -1.26 -5.06 117.16 110.35 3kqx n TYR 541 Ca -0.01 0.00 -0.25 0.00 -0.16 0.00 0.00 57.90 57.48 3kqx n TYR 541 Cb 0.42 -0.29 0.06 0.00 -0.31 0.00 0.00 39.34 39.22 3kqx n TYR 541 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 3kqx s ALA 542 N -2.15 3.35 0.34 -0.72 0.00 -1.26 -5.00 121.76 116.31 3kqx s ALA 542 Ca -0.11 -1.03 0.03 0.00 0.00 0.00 0.00 51.96 50.86 3kqx s ALA 542 Cb 0.04 -2.47 0.64 0.00 0.00 0.00 0.00 23.12 21.33 3kqx s ALA 542 CO 0.15 -1.16 1.95 -0.44 0.00 0.00 0.00 175.76 176.26 3kqx h ASP 543 N -0.43 0.77 -4.73 0.00 3.32 -1.82 -3.38 116.42 110.15 3kqx h ASP 543 Ca -0.44 -0.00 -0.09 0.00 0.02 0.00 0.00 57.03 56.52 3kqx h ASP 543 Cb 1.31 -0.17 -0.20 0.00 0.22 0.00 0.00 39.33 40.49 3kqx h ASP 543 CO 0.58 0.51 -0.08 -0.51 -1.72 0.00 0.00 179.24 178.02 3kqx s ILE 544 N -5.77 0.02 0.29 0.35 2.07 -0.96 -4.46 121.20 112.75 3kqx s ILE 544 Ca -0.10 -0.20 -0.13 0.00 -1.41 0.00 0.00 60.65 58.81 3kqx s ILE 544 Cb 0.19 -0.77 -0.08 0.00 0.13 0.00 0.00 42.46 41.93 3kqx s ILE 544 CO 0.78 -0.11 0.67 0.20 -1.91 0.00 0.00 174.94 174.57 3kqx s ASN 545 N -0.88 6.71 0.19 4.50 0.01 0.09 -1.07 114.94 124.50 3kqx s ASN 545 Ca -0.09 1.14 -0.04 0.00 -0.71 0.00 0.00 52.86 53.16 3kqx s ASN 545 Cb -0.03 -2.32 0.12 0.00 0.41 0.00 0.00 41.25 39.44 3kqx s ASN 545 CO 0.05 -0.16 1.54 -0.61 -1.51 0.00 0.00 177.10 176.41 3kqx h GLN 546 N 2.33 0.66 -5.05 -0.60 4.15 -1.66 -3.46 115.11 111.48 3kqx h GLN 546 Ca -0.47 -0.36 -0.37 0.00 0.77 0.00 0.00 58.65 58.22 3kqx h GLN 546 Cb 1.17 0.02 -0.14 0.00 0.21 0.00 0.00 27.48 28.74 3kqx h GLN 546 CO 0.67 0.97 -0.66 0.96 -1.93 0.00 0.00 178.83 178.84 3kqx s ILE 547 N -4.23 0.97 0.16 2.39 -4.36 -1.26 -4.92 121.20 109.96 3kqx s ILE 547 Ca -0.08 -2.03 -0.15 0.00 -0.26 0.00 0.00 60.65 58.13 3kqx s ILE 547 Cb 0.12 -2.34 -0.07 0.00 1.25 0.00 0.00 42.46 41.42 3kqx s ILE 547 CO 0.84 -0.32 0.58 -0.55 0.24 0.00 0.00 174.94 175.74 3kqx s SER 548 N -3.29 6.87 0.00 4.36 0.15 -1.26 -4.74 113.70 115.78 3kqx s SER 548 Ca 0.28 1.14 0.22 0.00 0.70 0.00 0.00 55.95 58.30 3kqx s SER 548 Cb 0.06 -2.31 -0.02 0.00 -1.71 0.00 0.00 66.02 62.03 3kqx s SER 548 CO 0.08 0.09 1.05 -1.54 1.20 0.00 0.00 173.24 174.12 3kqx n SER 549 N 0.77 1.26 -0.07 5.45 3.41 -1.26 -4.72 113.62 118.46 3kqx n SER 549 Ca -0.05 -1.07 -0.11 0.00 -0.26 0.00 0.00 58.87 57.38 3kqx n SER 549 Cb 0.52 0.71 -0.06 0.00 -0.26 0.00 0.00 64.21 65.12 3kqx n SER 549 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 3kqx n SER 550 N -1.00 2.24 -4.70 4.04 3.41 -1.26 -5.02 113.62 111.33 3kqx n SER 550 Ca 0.06 0.02 -0.42 0.00 -0.26 0.00 0.00 58.87 58.27 3kqx n SER 550 Cb 0.37 -0.28 -0.03 0.00 -0.26 0.00 0.00 64.21 64.02 3kqx n SER 550 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 3kqx s VAL 551 N -2.26 4.08 -1.48 -3.33 1.01 -1.26 -4.93 120.40 112.24 3kqx s VAL 551 Ca -0.18 1.47 0.24 0.00 0.00 0.00 0.00 61.98 63.51 3kqx s VAL 551 Cb 0.06 -3.95 0.02 0.00 0.00 0.00 0.00 36.38 32.51 3kqx s VAL 551 CO 0.28 0.08 1.25 0.29 0.00 0.00 0.00 175.10 176.99 3kqx n LYS 552 N 4.36 0.55 -1.81 2.72 5.02 -1.26 -4.58 118.16 123.15 3kqx n LYS 552 Ca 0.10 -0.40 -0.42 0.00 -2.02 0.00 0.00 58.31 55.57 3kqx n LYS 552 Cb 0.46 -1.49 -0.00 0.00 -0.02 0.00 0.00 35.03 33.98 3kqx n LYS 552 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3kqx n ALA 553 N -0.88 5.12 0.20 7.82 0.00 -1.26 -4.77 120.51 126.74 3kqx n ALA 553 Ca 0.08 -3.84 0.06 0.00 0.00 0.00 0.00 53.44 49.74 3kqx n ALA 553 Cb 0.37 -3.55 0.55 0.00 0.00 0.00 0.00 19.45 16.81 3kqx n ALA 553 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 3kqx h SER 554 N 6.35 0.09 -0.34 0.00 0.02 -1.99 -1.76 113.55 115.92 3kqx h SER 554 Ca 0.54 -0.01 -0.12 0.00 -0.84 0.00 0.00 61.79 61.37 3kqx h SER 554 Cb 0.68 -0.02 -0.01 0.00 0.14 0.00 0.00 62.40 63.18 3kqx h SER 554 CO 1.83 0.14 -0.21 0.28 -1.14 0.00 0.00 176.83 177.73 3kqx h SER 555 N 0.10 0.84 -0.29 3.07 0.02 -1.94 -0.70 113.55 114.64 3kqx h SER 555 Ca 0.02 -0.30 -0.08 0.00 -0.84 0.00 0.00 61.79 60.60 3kqx h SER 555 Cb 0.12 -0.23 -0.01 0.00 0.14 0.00 0.00 62.40 62.42 3kqx h SER 555 CO 0.00 1.03 -0.12 0.40 -1.14 0.00 0.00 176.83 177.00 3kqx h ILE 556 N 0.72 1.29 -0.63 3.27 2.04 -1.75 -2.73 117.51 119.72 3kqx h ILE 556 Ca 0.10 -1.20 -0.01 0.00 1.00 0.00 0.00 64.86 64.75 3kqx h ILE 556 Cb 0.73 1.45 -0.03 0.00 -0.74 0.00 0.00 36.82 38.23 3kqx h ILE 556 CO 0.06 0.38 0.34 0.58 0.00 0.00 0.00 178.15 179.51 3kqx h VAL 557 N 0.36 1.20 -0.63 1.67 2.07 -1.20 -0.86 116.25 118.85 3kqx h VAL 557 Ca 0.07 -0.51 -0.06 0.00 0.82 0.00 0.00 66.70 67.03 3kqx h VAL 557 Cb 0.63 0.39 -0.03 0.00 -1.52 0.00 0.00 31.29 30.76 3kqx h VAL 557 CO 0.04 0.22 0.17 0.00 0.02 0.00 0.00 177.57 178.02 3kqx h ALA 558 N 1.16 1.12 -0.47 1.67 0.00 -1.17 -0.25 119.26 121.32 3kqx h ALA 558 Ca 0.22 -0.22 -0.06 0.00 0.00 0.00 0.00 54.91 54.86 3kqx h ALA 558 Cb 0.04 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 3kqx h ALA 558 CO -0.04 0.60 0.07 0.77 0.00 0.00 0.00 179.25 180.65 3kqx h SER 559 N 0.93 0.76 -0.88 0.00 0.02 -1.14 -1.55 113.55 111.70 3kqx h SER 559 Ca 0.20 -0.27 0.03 0.00 -0.84 0.00 0.00 61.79 60.92 3kqx h SER 559 Cb 0.30 -0.20 -0.05 0.00 0.14 0.00 0.00 62.40 62.59 3kqx h SER 559 CO -0.00 0.83 0.57 -0.07 -1.14 0.00 0.00 176.83 177.02 3kqx h LEU 560 N 0.65 0.95 0.06 5.07 3.38 -0.71 0.16 115.31 124.87 3kqx h LEU 560 Ca 0.14 -0.01 0.01 0.00 0.09 0.00 0.00 57.88 58.12 3kqx h LEU 560 Cb 0.40 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.92 3kqx h LEU 560 CO 0.01 0.65 -0.11 0.15 0.09 0.00 0.00 178.44 179.23 3kqx h PHE 561 N 1.11 -0.29 -0.53 1.13 3.04 -0.85 -2.91 116.94 117.63 3kqx h PHE 561 Ca 0.35 0.01 -0.05 0.00 3.98 0.00 0.00 57.97 62.25 3kqx h PHE 561 Cb -0.01 0.12 -0.02 0.00 2.56 0.00 0.00 35.95 38.60 3kqx h PHE 561 CO -0.02 -0.17 0.13 -0.07 -2.02 0.00 0.00 178.31 176.16 3kqx h LEU 562 N -0.22 0.75 -2.05 0.59 3.38 -1.07 -2.51 115.31 114.18 3kqx h LEU 562 Ca 0.02 -0.13 -0.01 0.00 0.09 0.00 0.00 57.88 57.85 3kqx h LEU 562 Cb 0.24 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 40.80 3kqx h LEU 562 CO -0.07 0.74 -0.06 0.50 0.09 0.00 0.00 178.44 179.64 3kqx h LYS 563 N 0.78 0.00 0.00 1.13 3.64 -0.77 -0.20 116.57 121.15 3kqx h LYS 563 Ca 0.17 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.55 3kqx h LYS 563 Cb 0.28 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.10 3kqx h LYS 563 CO -0.00 0.06 0.00 0.93 -2.27 0.00 0.00 179.45 178.17 3kqx h GLU 564 N 0.00 0.00 -0.66 1.90 4.39 -1.36 -2.89 114.58 115.96 3kqx h GLU 564 Ca -0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 3kqx h GLU 564 Cb 0.12 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.77 3kqx h GLU 564 CO 0.01 0.00 0.00 1.19 -1.16 0.00 0.00 179.01 179.05 3kqx n PHE 565 N -2.40 0.87 -3.94 4.33 3.01 -0.09 -4.80 117.46 114.44 3kqx n PHE 565 Ca 0.00 -0.44 -0.30 0.00 1.01 0.00 0.00 57.45 57.72 3kqx n PHE 565 Cb 0.15 -0.00 -0.16 0.00 -0.01 0.00 0.00 39.48 39.46 3kqx n PHE 565 CO 0.00 0.00 0.00 0.08 1.01 0.00 0.00 176.76 177.85 3kqx s VAL 566 N -1.11 1.44 -0.12 -4.37 1.01 -1.09 -4.11 120.40 112.05 3kqx s VAL 566 Ca 0.47 -0.97 -0.22 0.00 0.00 0.00 0.00 61.98 61.26 3kqx s VAL 566 Cb 0.25 -1.61 -0.27 0.00 0.00 0.00 0.00 36.38 34.75 3kqx s VAL 566 CO 0.33 0.06 0.65 1.56 0.00 0.00 0.00 175.10 177.71 3kqx h GLN 567 N 8.01 0.15 0.00 2.72 4.20 -1.87 -3.44 115.11 124.88 3kqx h GLN 567 Ca -0.23 -0.25 -0.15 0.00 0.06 0.00 0.00 58.65 58.08 3kqx h GLN 567 Cb 1.09 0.09 -0.27 0.00 0.30 0.00 0.00 27.48 28.69 3kqx h GLN 567 CO 0.43 1.12 -0.73 0.09 -0.67 0.00 0.00 178.83 179.07 3kqx n ASN 568 N -4.26 0.26 -4.07 1.46 3.02 -1.26 -5.08 115.26 105.33 3kqx n ASN 568 Ca -0.19 -1.97 -0.21 0.00 -0.03 0.00 0.00 54.58 52.18 3kqx n ASN 568 Cb 0.72 -0.09 -0.15 0.00 -0.61 0.00 0.00 39.78 39.65 3kqx n ASN 568 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 3kqx s THR 569 N 0.00 0.96 -0.03 3.41 2.01 -1.26 -5.11 115.64 115.62 3kqx s THR 569 Ca 0.20 -0.51 -0.37 0.00 0.31 0.00 0.00 61.69 61.32 3kqx s THR 569 Cb 0.23 -0.81 -0.16 0.00 0.01 0.00 0.00 72.50 71.77 3kqx s THR 569 CO -0.10 0.28 1.55 0.00 -0.69 0.00 0.00 174.62 175.66 3kqx n ALA 570 N 2.87 -0.24 -3.00 7.40 0.00 -1.25 -4.90 120.51 121.38 3kqx n ALA 570 Ca -0.15 0.44 -0.12 0.00 0.00 0.00 0.00 53.44 53.61 3kqx n ALA 570 Cb 0.55 -2.20 -0.13 0.00 0.00 0.00 0.00 19.45 17.68 3kqx n ALA 570 CO 0.00 0.00 0.00 -0.46 0.00 0.00 0.00 177.50 177.04 3kqx s TRP 571 N 1.84 -0.13 0.10 0.00 -0.00 -1.26 -1.16 118.94 118.33 3kqx s TRP 571 Ca 0.89 0.32 0.03 0.00 -0.00 0.00 0.00 56.10 57.33 3kqx s TRP 571 Cb -0.93 0.04 -0.04 0.00 -0.00 0.00 0.00 33.47 32.55 3kqx s TRP 571 CO 0.52 -0.06 -0.08 0.00 -0.00 0.00 0.00 176.95 177.33 3kqx s ALA 572 N 0.07 1.04 -0.05 5.86 0.00 -0.39 -1.39 121.76 126.90 3kqx s ALA 572 Ca -0.00 -1.29 -0.01 0.00 0.00 0.00 0.00 51.96 50.66 3kqx s ALA 572 Cb -0.01 0.11 0.03 0.00 0.00 0.00 0.00 23.12 23.25 3kqx s ALA 572 CO 0.00 -0.16 0.00 -1.58 0.00 0.00 0.00 175.76 174.03 3kqx s HIS 573 N -3.16 0.45 -0.29 0.00 5.04 0.97 -1.03 115.29 117.26 3kqx s HIS 573 Ca 0.10 -0.04 -0.05 0.00 -1.54 0.00 0.00 55.06 53.52 3kqx s HIS 573 Cb 0.02 -0.59 0.02 0.00 0.04 0.00 0.00 32.58 32.07 3kqx s HIS 573 CO -0.03 -0.22 0.05 0.42 -2.34 0.00 0.00 174.74 172.63 3kqx s ILE 574 N 1.52 3.62 -0.44 0.89 1.01 -0.15 -1.05 121.20 126.60 3kqx s ILE 574 Ca -0.02 -0.90 -0.19 0.00 0.00 0.00 0.00 60.65 59.54 3kqx s ILE 574 Cb -0.13 -2.91 0.03 0.00 0.01 0.00 0.00 42.46 39.45 3kqx s ILE 574 CO -0.03 0.04 0.54 -0.62 0.00 0.00 0.00 174.94 174.87 3kqx s ASP 575 N 1.43 6.25 -0.20 3.58 -1.08 0.67 -1.30 116.67 126.01 3kqx s ASP 575 Ca 0.01 -0.57 0.15 0.00 -0.52 0.00 0.00 52.55 51.62 3kqx s ASP 575 Cb -0.18 -2.27 0.58 0.00 -1.46 0.00 0.00 42.92 39.59 3kqx s ASP 575 CO 0.01 -0.69 1.49 2.30 0.52 0.00 0.00 175.17 178.79 3kqx n ILE 576 N 5.62 2.41 -0.35 4.11 -5.35 0.36 -2.93 119.36 123.22 3kqx n ILE 576 Ca -0.05 -1.88 0.04 0.00 -0.27 0.00 0.00 62.75 60.59 3kqx n ILE 576 Cb 0.47 -0.27 0.21 0.00 -1.74 0.00 0.00 39.64 38.31 3kqx n ILE 576 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3kqx h ALA 577 N 2.04 1.46 0.00 -1.28 0.00 -1.84 -1.28 119.26 118.35 3kqx h ALA 577 Ca 0.03 -0.01 -0.21 0.00 0.00 0.00 0.00 54.91 54.72 3kqx h ALA 577 Cb 1.58 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 19.06 3kqx h ALA 577 CO 0.30 0.38 -1.00 0.78 0.00 0.00 0.00 179.25 179.70 3kqx h GLY 578 N 1.11 0.00 -0.58 0.00 0.00 -1.82 -3.37 103.07 98.40 3kqx h GLY 578 Ca 0.44 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.77 3kqx h GLY 578 CO -0.19 0.00 -0.63 3.33 0.00 0.00 0.00 176.54 179.05 3kqx n VAL 579 N -3.32 0.00 -0.11 4.60 0.24 -1.03 -4.32 118.33 114.38 3kqx n VAL 579 Ca -0.01 -0.18 -0.11 0.00 -2.04 0.00 0.00 64.34 62.00 3kqx n VAL 579 Cb 0.93 1.15 -0.03 0.00 -1.47 0.00 0.00 33.84 34.42 3kqx n VAL 579 CO 0.00 0.00 0.00 -1.28 -2.14 0.00 0.00 176.83 173.41 3kqx h SER 580 N 1.42 0.58 -3.01 -1.34 0.87 -1.41 -3.43 113.55 107.23 3kqx h SER 580 Ca 0.00 -0.34 -0.62 0.00 -1.23 0.00 0.00 61.79 59.60 3kqx h SER 580 Cb 0.62 -0.16 -0.08 0.00 -0.44 0.00 0.00 62.40 62.34 3kqx h SER 580 CO 0.00 0.78 -0.35 0.86 -0.53 0.00 0.00 176.83 177.59 3kqx s TRP 581 N -4.89 3.58 -0.68 2.24 -0.11 -1.26 -1.14 118.94 116.67 3kqx s TRP 581 Ca -0.13 0.67 -0.21 0.00 1.22 0.00 0.00 56.10 57.64 3kqx s TRP 581 Cb 0.09 -2.19 0.09 0.00 -1.50 0.00 0.00 33.47 29.95 3kqx s TRP 581 CO 0.78 0.51 0.93 1.21 -4.62 0.00 0.00 176.95 175.76 3kqx s ASN 582 N -0.44 6.23 0.31 5.86 3.84 0.75 -4.87 114.94 126.62 3kqx s ASN 582 Ca 0.17 -1.22 0.01 0.00 0.21 0.00 0.00 52.86 52.04 3kqx s ASN 582 Cb -0.14 -2.39 0.50 0.00 -0.55 0.00 0.00 41.25 38.68 3kqx s ASN 582 CO 0.06 -1.33 1.87 -0.26 -2.79 0.00 0.00 177.10 174.66 3kqx h PHE 583 N 9.40 0.75 -0.55 0.43 -1.00 -1.97 -0.26 116.94 123.74 3kqx h PHE 583 Ca -0.23 -0.05 -0.09 0.00 2.81 0.00 0.00 57.97 60.40 3kqx h PHE 583 Cb 1.07 -0.23 -0.02 0.00 3.61 0.00 0.00 35.95 40.38 3kqx h PHE 583 CO 0.97 0.62 -0.02 0.87 -1.61 0.00 0.00 178.31 179.14 3kqx h LYS 584 N 0.72 0.98 -0.00 1.51 1.57 -1.95 -3.21 116.57 116.20 3kqx h LYS 584 Ca 0.17 -0.32 0.00 0.00 -1.87 0.00 0.00 60.65 58.62 3kqx h LYS 584 Cb 0.23 -0.08 0.00 0.00 0.08 0.00 0.00 32.23 32.46 3kqx h LYS 584 CO -0.01 0.99 -0.58 0.00 -0.57 0.00 0.00 179.45 179.29 3kqx n ALA 585 N -2.47 3.78 -3.54 3.86 0.00 -1.13 -4.98 120.51 116.03 3kqx n ALA 585 Ca 0.02 -0.48 -0.21 0.00 0.00 0.00 0.00 53.44 52.77 3kqx n ALA 585 Cb 0.35 -0.98 0.08 0.00 0.00 0.00 0.00 19.45 18.90 3kqx n ALA 585 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3kqx n ARG 586 N -1.07 -7.42 -3.83 0.00 1.74 -0.13 -5.01 116.66 100.94 3kqx n ARG 586 Ca 0.07 0.83 -0.09 0.00 -0.77 0.00 0.00 57.85 57.89 3kqx n ARG 586 Cb 0.36 -5.87 -0.04 0.00 -1.02 0.00 0.00 32.46 25.88 3kqx n ARG 586 CO 0.00 0.00 0.00 -1.59 -1.52 0.00 0.00 177.63 174.52 3kqx s LYS 587 N -5.95 1.46 0.64 5.56 -2.85 -1.12 -5.03 119.74 112.45 3kqx s LYS 587 Ca 0.36 -0.99 -0.15 0.00 -1.00 0.00 0.00 55.97 54.19 3kqx s LYS 587 Cb -0.16 0.51 -0.01 0.00 -2.06 0.00 0.00 37.83 36.11 3kqx s LYS 587 CO 0.73 -0.62 1.08 -2.14 0.10 0.00 0.00 175.35 174.50 3kqx s PRO 588 N -3.92 3.04 0.16 1.78 0.02 -1.26 -0.18 135.00 134.64 3kqx s PRO 588 Ca 0.13 1.23 0.24 0.00 0.02 0.00 0.00 61.00 62.62 3kqx s PRO 588 Cb -0.01 -1.99 0.23 0.00 0.02 0.00 0.00 34.50 32.74 3kqx s PRO 588 CO 0.01 -1.04 1.24 0.87 -0.33 0.00 0.00 177.00 177.76 3kqx h LYS 589 N 0.07 0.00 -3.88 5.54 1.57 -1.42 -3.43 116.57 115.02 3kqx h LYS 589 Ca -0.46 0.00 -0.36 0.00 -1.87 0.00 0.00 60.65 57.96 3kqx h LYS 589 Cb 1.23 0.00 0.05 0.00 0.08 0.00 0.00 32.23 33.59 3kqx h LYS 589 CO 0.56 0.00 -0.53 0.41 -0.57 0.00 0.00 179.45 179.32 3kqx n GLY 590 N 1.27 -0.37 3.75 3.86 0.00 -1.26 -4.92 105.19 107.52 3kqx n GLY 590 Ca 0.02 0.01 -0.41 0.00 0.00 0.00 0.00 46.02 45.64 3kqx n GLY 590 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 3kqx s PHE 591 N -3.09 2.91 0.00 1.61 5.36 -1.26 -3.25 117.98 120.25 3kqx s PHE 591 Ca 0.25 0.97 0.00 0.00 -0.96 0.00 0.00 56.93 57.19 3kqx s PHE 591 Cb -0.11 -3.91 0.00 0.00 -0.34 0.00 0.00 43.02 38.66 3kqx s PHE 591 CO 0.31 -2.95 0.00 0.41 -1.46 0.00 0.00 175.22 171.53 3kqx n GLY 592 N 2.04 2.17 0.13 13.12 0.00 -1.26 -4.74 105.19 116.65 3kqx n GLY 592 Ca 0.07 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.98 3kqx n GLY 592 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3kqx h VAL 593 N 0.00 1.21 -0.19 1.61 2.07 -1.75 -1.55 116.25 117.65 3kqx h VAL 593 Ca 0.00 -0.69 -0.04 0.00 0.82 0.00 0.00 66.70 66.79 3kqx h VAL 593 Cb 0.00 1.26 -0.01 0.00 -1.52 0.00 0.00 31.29 31.03 3kqx h VAL 593 CO 0.00 0.22 -0.05 0.03 0.02 0.00 0.00 177.57 177.79 3kqx h ARG 594 N 0.16 0.37 -0.32 1.57 3.08 -1.91 -1.59 114.38 115.74 3kqx h ARG 594 Ca 0.07 -0.14 0.07 0.00 0.07 0.00 0.00 59.98 60.05 3kqx h ARG 594 Cb 0.28 -0.02 -0.08 0.00 0.08 0.00 0.00 29.97 30.24 3kqx h ARG 594 CO 0.00 0.63 -0.24 1.25 -1.07 0.00 0.00 179.97 180.55 3kqx h LEU 595 N 0.09 -0.77 -0.72 3.04 5.85 -1.86 0.91 115.31 121.84 3kqx h LEU 595 Ca 0.05 0.15 -0.05 0.00 0.84 0.00 0.00 57.88 58.87 3kqx h LEU 595 Cb 0.49 0.38 -0.03 0.00 0.37 0.00 0.00 40.66 41.87 3kqx h LEU 595 CO 0.02 -0.27 0.25 -0.07 -0.34 0.00 0.00 178.44 178.03 3kqx h LEU 596 N -0.20 1.03 0.06 2.25 3.38 -1.25 -1.11 115.31 119.48 3kqx h LEU 596 Ca 0.16 -0.20 -0.00 0.00 0.09 0.00 0.00 57.88 57.93 3kqx h LEU 596 Cb 0.46 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 40.94 3kqx h LEU 596 CO -0.44 0.95 -0.03 0.74 0.09 0.00 0.00 178.44 179.75 3kqx h THR 597 N 1.05 1.06 -0.96 0.22 2.02 -0.99 -1.56 112.91 113.76 3kqx h THR 597 Ca 0.24 -0.42 0.12 0.00 0.77 0.00 0.00 66.41 67.12 3kqx h THR 597 Cb 0.27 1.34 -0.08 0.00 -1.74 0.00 0.00 68.15 67.94 3kqx h THR 597 CO -0.01 0.11 0.61 -0.33 0.37 0.00 0.00 175.52 176.26 3kqx h GLU 598 N -0.27 0.87 0.05 6.66 4.39 -0.76 0.47 114.58 125.98 3kqx h GLU 598 Ca -0.01 -0.05 0.01 0.00 0.34 0.00 0.00 59.36 59.65 3kqx h GLU 598 Cb 0.24 -0.20 -0.02 0.00 -0.10 0.00 0.00 28.75 28.67 3kqx h GLU 598 CO 0.01 0.58 -0.13 0.35 -1.16 0.00 0.00 179.01 178.66 3kqx h PHE 599 N 0.90 -0.33 -0.64 4.33 3.57 -0.85 0.67 116.94 124.59 3kqx h PHE 599 Ca 0.47 0.01 -0.06 0.00 3.53 0.00 0.00 57.97 61.92 3kqx h PHE 599 Cb 0.55 0.14 -0.03 0.00 2.79 0.00 0.00 35.95 39.40 3kqx h PHE 599 CO -0.00 -0.19 0.17 -0.39 -2.23 0.00 0.00 178.31 175.66 3kqx h VAL 600 N -0.24 1.25 -0.32 1.41 -1.51 -0.65 -2.89 116.25 113.31 3kqx h VAL 600 Ca 0.03 -0.91 -0.13 0.00 -1.23 0.00 0.00 66.70 64.46 3kqx h VAL 600 Cb 0.27 0.62 -0.01 0.00 -2.13 0.00 0.00 31.29 30.04 3kqx h VAL 600 CO -0.09 0.34 -0.35 -0.07 -1.23 0.00 0.00 177.57 176.18 3kqx h LEU 601 N 0.94 0.75 0.34 4.19 4.07 -0.77 -3.30 115.31 121.54 3kqx h LEU 601 Ca 0.20 -0.32 -0.02 0.00 0.08 0.00 0.00 57.88 57.83 3kqx h LEU 601 Cb 0.34 -0.21 0.00 0.00 1.08 0.00 0.00 40.66 41.87 3kqx h LEU 601 CO -0.00 1.03 -0.16 0.78 -1.08 0.00 0.00 178.44 179.01 3kqx h ASN 602 N 0.60 -0.39 -0.02 -0.43 4.21 -0.82 -3.51 115.58 115.24 3kqx h ASN 602 Ca 0.06 -0.14 0.00 0.00 1.21 0.00 0.00 56.30 57.44 3kqx h ASN 602 Cb 0.87 0.10 0.00 0.00 -1.12 0.00 0.00 38.32 38.17 3kqx h ASN 602 CO 0.08 -0.06 0.00 -0.90 -1.29 0.00 0.00 177.43 175.25