#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3gq9 h PHE 89 N 0.00 0.52 -0.71 1.57 3.57 -2.06 -2.73 116.94 117.11 3gq9 h PHE 89 Ca 0.00 -0.07 0.10 0.00 3.53 0.00 0.00 57.97 61.53 3gq9 h PHE 89 Cb 0.00 -0.15 -0.07 0.00 2.79 0.00 0.00 35.95 38.52 3gq9 h PHE 89 CO 0.00 0.56 0.34 0.00 -2.23 0.00 0.00 178.31 176.98 3gq9 h ALA 90 N 0.90 0.98 -0.82 2.41 0.00 -2.05 -0.75 119.26 119.93 3gq9 h ALA 90 Ca 0.10 0.06 0.08 0.00 0.00 0.00 0.00 54.91 55.15 3gq9 h ALA 90 Cb 0.31 -0.02 -0.07 0.00 0.00 0.00 0.00 17.79 18.01 3gq9 h ALA 90 CO 0.00 -0.08 0.48 -0.44 0.00 0.00 0.00 179.25 179.22 3gq9 h ASP 91 N 0.57 0.72 -0.39 0.00 3.32 -1.97 -0.39 116.42 118.29 3gq9 h ASP 91 Ca 0.36 0.03 -0.07 0.00 0.02 0.00 0.00 57.03 57.37 3gq9 h ASP 91 Cb 0.40 -0.11 -0.01 0.00 0.22 0.00 0.00 39.33 39.83 3gq9 h ASP 91 CO -0.29 0.43 -0.04 -0.07 -1.72 0.00 0.00 179.24 177.55 3gq9 h LEU 92 N 0.84 0.71 -0.21 1.55 3.38 -0.90 -1.19 115.31 119.49 3gq9 h LEU 92 Ca 0.38 -0.34 0.02 0.00 0.09 0.00 0.00 57.88 58.03 3gq9 h LEU 92 Cb 0.27 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.81 3gq9 h LEU 92 CO -0.21 0.88 0.06 0.58 0.09 0.00 0.00 178.44 179.84 3gq9 h VAL 93 N 0.53 0.93 -0.61 1.22 2.07 -0.87 -2.44 116.25 117.08 3gq9 h VAL 93 Ca 0.10 -0.05 0.08 0.00 0.82 0.00 0.00 66.70 67.65 3gq9 h VAL 93 Cb 0.54 0.76 -0.06 0.00 -1.52 0.00 0.00 31.29 31.01 3gq9 h VAL 93 CO 0.03 0.03 0.28 0.40 0.02 0.00 0.00 177.57 178.33 3gq9 h ILE 94 N 0.16 0.86 -1.00 4.57 2.04 -0.98 -1.17 117.51 121.99 3gq9 h ILE 94 Ca 0.09 -0.17 0.12 0.00 1.00 0.00 0.00 64.86 65.90 3gq9 h ILE 94 Cb 0.07 0.31 -0.08 0.00 -0.74 0.00 0.00 36.82 36.37 3gq9 h ILE 94 CO -0.10 0.09 0.63 1.56 0.00 0.00 0.00 178.15 180.33 3gq9 h GLN 95 N 0.51 0.96 -0.14 2.37 4.20 -0.93 0.39 115.11 122.47 3gq9 h GLN 95 Ca 0.29 -0.06 -0.02 0.00 0.06 0.00 0.00 58.65 58.92 3gq9 h GLN 95 Cb 0.28 -0.22 -0.01 0.00 0.30 0.00 0.00 27.48 27.84 3gq9 h GLN 95 CO -0.24 0.64 0.01 0.28 -0.67 0.00 0.00 178.83 178.85 3gq9 h VAL 96 N 0.99 1.24 0.12 -0.54 2.07 -0.84 -1.83 116.25 117.46 3gq9 h VAL 96 Ca 0.49 -0.77 0.01 0.00 0.82 0.00 0.00 66.70 67.26 3gq9 h VAL 96 Cb 0.48 1.47 -0.02 0.00 -1.52 0.00 0.00 31.29 31.71 3gq9 h VAL 96 CO -0.26 0.23 -0.16 0.40 0.02 0.00 0.00 177.57 177.79 3gq9 h ILE 97 N -0.00 0.64 -0.48 4.57 2.04 -0.52 -1.96 117.51 121.80 3gq9 h ILE 97 Ca 0.04 0.00 0.10 0.00 1.00 0.00 0.00 64.86 66.00 3gq9 h ILE 97 Cb 0.33 0.64 -0.09 0.00 -0.74 0.00 0.00 36.82 36.96 3gq9 h ILE 97 CO 0.00 0.00 -0.16 0.44 0.00 0.00 0.00 178.15 178.44 3gq9 h ASP 98 N -0.32 -0.57 0.15 1.72 3.32 -0.25 -1.48 116.42 119.00 3gq9 h ASP 98 Ca 0.01 0.16 -0.01 0.00 0.02 0.00 0.00 57.03 57.21 3gq9 h ASP 98 Cb 0.33 0.34 -0.00 0.00 0.22 0.00 0.00 39.33 40.22 3gq9 h ASP 98 CO -0.07 -0.20 -0.07 -0.08 -1.72 0.00 0.00 179.24 177.11 3gq9 h GLU 99 N -0.05 0.00 0.00 3.56 4.57 -1.00 -1.81 114.58 119.85 3gq9 h GLU 99 Ca 0.23 0.00 -0.05 0.00 -1.18 0.00 0.00 59.36 58.36 3gq9 h GLU 99 Cb 0.40 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 28.98 3gq9 h GLU 99 CO -0.52 0.07 -0.22 -0.07 -1.18 0.00 0.00 179.01 177.09 3gq9 h LEU 100 N 0.00 0.00 -2.56 1.64 3.38 -0.49 -3.47 115.31 113.81 3gq9 h LEU 100 Ca -0.00 0.00 -0.46 0.00 0.09 0.00 0.00 57.88 57.51 3gq9 h LEU 100 Cb 0.16 0.00 0.02 0.00 0.09 0.00 0.00 40.66 40.94 3gq9 h LEU 100 CO 0.01 0.22 -0.91 0.29 0.09 0.00 0.00 178.44 178.14 3gq9 n LYS 101 N -4.26 -2.41 0.13 1.13 5.02 -0.68 -4.89 118.16 112.20 3gq9 n LYS 101 Ca -0.02 0.44 0.01 0.00 -2.02 0.00 0.00 58.31 56.72 3gq9 n LYS 101 Cb 0.28 -4.35 0.33 0.00 -0.02 0.00 0.00 35.03 31.26 3gq9 n LYS 101 CO 0.00 0.00 0.00 1.96 -0.52 0.00 0.00 177.40 178.84 3gq9 h GLN 102 N -1.89 0.16 -0.01 1.97 4.20 -1.86 -3.08 115.11 114.60 3gq9 h GLN 102 Ca -0.65 -0.06 0.00 0.00 0.06 0.00 0.00 58.65 58.01 3gq9 h GLN 102 Cb 1.37 -0.01 0.00 0.00 0.30 0.00 0.00 27.48 29.14 3gq9 h GLN 102 CO 0.55 0.45 -0.10 1.19 -0.67 0.00 0.00 178.83 180.25 3gq9 n PHE 103 N -4.14 0.00 0.00 2.96 3.01 -1.26 -5.08 117.46 112.94 3gq9 n PHE 103 Ca -0.01 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.45 3gq9 n PHE 103 Cb 0.38 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.85 3gq9 n PHE 103 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3gq9 n GLY 104 N 0.83 0.43 3.41 1.37 0.00 -1.17 -4.64 105.19 105.42 3gq9 n GLY 104 Ca 0.07 -1.74 -0.34 0.00 0.00 0.00 0.00 46.02 44.01 3gq9 n GLY 104 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3gq9 s VAL 105 N 0.00 3.49 0.33 1.61 -7.23 0.30 -4.30 120.40 114.60 3gq9 s VAL 105 Ca 0.00 -0.49 -0.28 0.00 -1.81 0.00 0.00 61.98 59.40 3gq9 s VAL 105 Cb 0.00 -2.53 -0.09 0.00 0.56 0.00 0.00 36.38 34.32 3gq9 s VAL 105 CO 0.00 0.48 1.17 -0.55 -0.31 0.00 0.00 175.10 175.90 3gq9 s SER 106 N 0.66 6.93 0.52 4.85 0.15 -1.26 -0.52 113.70 125.03 3gq9 s SER 106 Ca -0.04 2.40 0.19 0.00 0.70 0.00 0.00 55.95 59.20 3gq9 s SER 106 Cb -0.15 -2.63 1.35 0.00 -1.71 0.00 0.00 66.02 62.88 3gq9 s SER 106 CO 0.02 -0.40 2.14 -0.37 1.20 0.00 0.00 173.24 175.84 3gq9 h VAL 107 N 2.85 0.90 0.00 4.45 -1.51 -1.63 -1.86 116.25 119.46 3gq9 h VAL 107 Ca -0.48 -0.15 -0.02 0.00 -1.23 0.00 0.00 66.70 64.82 3gq9 h VAL 107 Cb 1.22 1.08 -0.00 0.00 -2.13 0.00 0.00 31.29 31.46 3gq9 h VAL 107 CO 0.65 0.04 -0.11 0.11 -1.23 0.00 0.00 177.57 177.03 3gq9 h LYS 108 N 0.00 0.00 0.00 5.19 1.57 -1.85 -0.57 116.57 120.92 3gq9 h LYS 108 Ca -0.00 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.77 3gq9 h LYS 108 Cb 0.08 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.39 3gq9 h LYS 108 CO 0.01 0.11 -0.04 1.15 -0.57 0.00 0.00 179.45 180.10 3gq9 h THR 109 N 0.00 0.99 -0.70 -0.16 2.02 -1.66 -2.36 112.91 111.05 3gq9 h THR 109 Ca -0.00 -0.15 0.00 0.00 0.77 0.00 0.00 66.41 67.03 3gq9 h THR 109 Cb 0.23 1.08 0.00 0.00 -1.74 0.00 0.00 68.15 67.72 3gq9 h THR 109 CO 0.01 0.04 0.00 -1.22 0.37 0.00 0.00 175.52 174.73 3gq9 n TYR 110 N -4.42 1.28 0.00 3.16 4.02 -0.25 -4.92 117.16 116.03 3gq9 n TYR 110 Ca -0.03 -0.55 0.00 0.00 -0.01 0.00 0.00 57.90 57.31 3gq9 n TYR 110 Cb 0.13 -0.14 0.00 0.00 -0.02 0.00 0.00 39.34 39.31 3gq9 n TYR 110 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3gq9 n GLY 111 N 1.39 0.95 3.75 2.72 0.00 -0.89 -4.23 105.19 108.88 3gq9 n GLY 111 Ca 0.25 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.86 3gq9 n GLY 111 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3gq9 s ALA 112 N -2.00 3.59 -0.18 4.61 0.00 -1.03 -4.92 121.76 121.83 3gq9 s ALA 112 Ca 0.00 1.28 0.01 0.00 0.00 0.00 0.00 51.96 53.25 3gq9 s ALA 112 Cb 0.00 -3.53 -0.22 0.00 0.00 0.00 0.00 23.12 19.37 3gq9 s ALA 112 CO 0.00 -0.69 0.11 1.63 0.00 0.00 0.00 175.76 176.81 3gq9 n LYS 113 N 2.18 0.70 -3.67 0.00 4.76 -1.26 -4.40 118.16 116.47 3gq9 n LYS 113 Ca 0.06 0.19 -0.24 0.00 -2.87 0.00 0.00 58.31 55.45 3gq9 n LYS 113 Cb 0.41 -1.62 0.06 0.00 -1.84 0.00 0.00 35.03 32.04 3gq9 n LYS 113 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3gq9 n GLY 114 N 2.05 -0.44 0.69 0.72 0.00 -1.26 -4.91 105.19 102.04 3gq9 n GLY 114 Ca -0.37 0.18 0.06 0.00 0.00 0.00 0.00 46.02 45.90 3gq9 n GLY 114 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3gq9 n ASP 115 N -3.00 2.91 0.00 1.61 5.68 -1.11 -2.64 116.55 120.00 3gq9 n ASP 115 Ca -0.11 -1.93 0.00 0.00 -0.50 0.00 0.00 54.79 52.25 3gq9 n ASP 115 Cb 0.60 -0.22 0.00 0.00 -1.14 0.00 0.00 41.12 40.35 3gq9 n ASP 115 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3gq9 n GLY 116 N 0.65 0.61 1.70 6.12 0.00 -0.05 -4.75 105.19 109.46 3gq9 n GLY 116 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.14 3gq9 n GLY 116 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3gq9 n VAL 117 N -2.35 0.14 -2.10 1.61 0.31 -1.26 -4.91 118.33 109.78 3gq9 n VAL 117 Ca 0.00 0.05 -0.41 0.00 -0.01 0.00 0.00 64.34 63.97 3gq9 n VAL 117 Cb 0.05 -0.81 -0.02 0.00 -0.91 0.00 0.00 33.84 32.14 3gq9 n VAL 117 CO 0.00 0.00 0.00 -0.89 -1.32 0.00 0.00 176.83 174.62 3gq9 s THR 118 N -2.00 2.74 -0.27 2.52 2.01 -1.26 -4.93 115.64 114.46 3gq9 s THR 118 Ca 0.00 0.70 -0.29 0.00 0.31 0.00 0.00 61.69 62.41 3gq9 s THR 118 Cb 0.00 -3.45 -0.02 0.00 0.01 0.00 0.00 72.50 69.04 3gq9 s THR 118 CO 0.00 0.15 1.59 -0.62 -0.69 0.00 0.00 174.62 175.05 3gq9 s ASP 119 N -0.22 6.33 0.00 3.53 2.15 -1.26 -4.00 116.67 123.20 3gq9 s ASP 119 Ca 0.52 1.45 0.20 0.00 0.43 0.00 0.00 52.55 55.15 3gq9 s ASP 119 Cb -0.40 -2.53 0.55 0.00 -0.30 0.00 0.00 42.92 40.24 3gq9 s ASP 119 CO 0.50 -1.33 1.46 0.47 -0.17 0.00 0.00 175.17 176.10 3gq9 n ASP 120 N 8.70 3.69 -0.26 -0.34 8.00 0.10 -4.68 116.55 131.76 3gq9 n ASP 120 Ca 0.19 -1.99 -0.00 0.00 0.71 0.00 0.00 54.79 53.69 3gq9 n ASP 120 Cb 0.46 -0.41 0.12 0.00 -0.02 0.00 0.00 41.12 41.27 3gq9 n ASP 120 CO 0.00 0.00 0.00 -0.29 -0.39 0.00 0.00 177.20 176.52 3gq9 h ILE 121 N 3.87 0.98 -0.68 0.53 6.09 -1.91 -2.27 117.51 124.12 3gq9 h ILE 121 Ca 0.00 -0.27 -0.03 0.00 -1.37 0.00 0.00 64.86 63.19 3gq9 h ILE 121 Cb 0.94 0.13 -0.03 0.00 0.47 0.00 0.00 36.82 38.32 3gq9 h ILE 121 CO 0.00 0.14 0.29 0.03 -3.07 0.00 0.00 178.15 175.54 3gq9 h ARG 122 N 0.78 0.99 -0.54 2.19 2.47 -1.96 0.04 114.38 118.35 3gq9 h ARG 122 Ca 0.34 -0.15 -0.03 0.00 -1.26 0.00 0.00 59.98 58.88 3gq9 h ARG 122 Cb 0.22 -0.17 -0.02 0.00 -1.65 0.00 0.00 29.97 28.34 3gq9 h ARG 122 CO -0.19 0.79 0.23 0.00 0.56 0.00 0.00 179.97 181.36 3gq9 h ALA 123 N 1.34 0.69 -0.10 0.04 0.00 -1.60 -0.25 119.26 119.38 3gq9 h ALA 123 Ca 0.23 -0.14 -0.00 0.00 0.00 0.00 0.00 54.91 54.99 3gq9 h ALA 123 Cb 0.16 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 17.73 3gq9 h ALA 123 CO -0.02 0.28 0.05 0.74 0.00 0.00 0.00 179.25 180.30 3gq9 h PHE 124 N 0.72 0.15 -0.55 0.00 -1.00 -0.93 -0.41 116.94 114.92 3gq9 h PHE 124 Ca 0.18 -0.01 -0.00 0.00 2.81 0.00 0.00 57.97 60.95 3gq9 h PHE 124 Cb 0.16 -0.05 -0.03 0.00 3.61 0.00 0.00 35.95 39.65 3gq9 h PHE 124 CO 0.00 0.20 0.33 0.93 -1.61 0.00 0.00 178.31 178.16 3gq9 h GLU 125 N 0.05 0.75 -0.26 1.51 5.08 -0.87 0.72 114.58 121.56 3gq9 h GLU 125 Ca 0.04 -0.07 -0.02 0.00 -1.00 0.00 0.00 59.36 58.31 3gq9 h GLU 125 Cb 0.11 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 29.19 3gq9 h GLU 125 CO -0.00 0.55 0.10 0.87 -1.00 0.00 0.00 179.01 179.53 3gq9 h LYS 126 N 0.74 0.39 -0.61 2.33 1.57 -0.99 -0.58 116.57 119.42 3gq9 h LYS 126 Ca 0.20 -0.07 -0.00 0.00 -1.87 0.00 0.00 60.65 58.90 3gq9 h LYS 126 Cb -0.01 -0.06 -0.03 0.00 0.08 0.00 0.00 32.23 32.21 3gq9 h LYS 126 CO -0.04 0.43 0.37 0.00 -0.57 0.00 0.00 179.45 179.63 3gq9 h ALA 127 N 0.95 0.78 -0.31 3.86 0.00 -0.86 -2.72 119.26 120.96 3gq9 h ALA 127 Ca 0.09 -0.08 -0.12 0.00 0.00 0.00 0.00 54.91 54.80 3gq9 h ALA 127 Cb 0.18 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 3gq9 h ALA 127 CO -0.01 0.26 -0.28 0.82 0.00 0.00 0.00 179.25 180.04 3gq9 h ILE 128 N 0.83 1.28 0.00 0.00 2.04 -0.73 -2.77 117.51 118.16 3gq9 h ILE 128 Ca 0.22 -1.39 0.00 0.00 1.00 0.00 0.00 64.86 64.69 3gq9 h ILE 128 Cb -0.01 1.35 0.00 0.00 -0.74 0.00 0.00 36.82 37.41 3gq9 h ILE 128 CO -0.04 0.45 0.00 -1.84 0.00 0.00 0.00 178.15 176.72 3gq9 n GLU 129 N -4.09 0.38 0.24 2.37 0.28 -0.24 -3.98 120.64 115.60 3gq9 n GLU 129 Ca -0.01 0.01 0.15 0.00 -0.16 0.00 0.00 57.16 57.16 3gq9 n GLU 129 Cb 0.45 -1.50 0.52 0.00 1.43 0.00 0.00 31.44 32.34 3gq9 n GLU 129 CO 0.00 0.00 0.00 0.66 -0.16 0.00 0.00 177.13 177.63 3gq9 h SER 130 N 0.00 0.00 0.00 -1.84 4.64 -1.18 -3.47 113.55 111.70 3gq9 h SER 130 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3gq9 h SER 130 Cb 0.29 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.38 3gq9 h SER 130 CO 0.00 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.57 3gq9 n GLY 131 N 0.37 1.23 3.91 -0.77 0.00 -1.26 -5.07 105.19 103.60 3gq9 n GLY 131 Ca 0.02 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.75 3gq9 n GLY 131 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3gq9 s PHE 132 N -2.62 3.47 0.28 1.61 0.40 -1.26 -5.06 117.98 114.81 3gq9 s PHE 132 Ca 0.00 0.60 -0.30 0.00 -0.60 0.00 0.00 56.93 56.63 3gq9 s PHE 132 Cb 0.00 -2.07 -0.12 0.00 0.51 0.00 0.00 43.02 41.34 3gq9 s PHE 132 CO 0.00 0.22 1.54 -2.30 0.70 0.00 0.00 175.22 175.38 3gq9 n PRO 133 N -0.81 2.52 -4.03 0.24 -0.02 -1.26 -4.75 135.00 126.89 3gq9 n PRO 133 Ca -0.02 0.90 -0.35 0.00 -2.02 0.00 0.00 63.50 62.00 3gq9 n PRO 133 Cb 0.54 -2.64 -0.09 0.00 -0.02 0.00 0.00 33.50 31.29 3gq9 n PRO 133 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 3gq9 s VAL 134 N -0.01 4.91 -0.08 -1.45 1.01 0.72 -0.54 120.40 124.96 3gq9 s VAL 134 Ca 0.65 -0.00 0.02 0.00 0.00 0.00 0.00 61.98 62.65 3gq9 s VAL 134 Cb -0.54 -3.17 -0.02 0.00 0.00 0.00 0.00 36.38 32.65 3gq9 s VAL 134 CO 0.49 0.53 -0.12 -0.47 0.00 0.00 0.00 175.10 175.52 3gq9 s TYR 135 N -0.21 2.78 -0.28 5.22 5.04 0.33 -1.24 117.35 128.99 3gq9 s TYR 135 Ca 0.08 -0.24 -0.02 0.00 -2.44 0.00 0.00 57.07 54.45 3gq9 s TYR 135 Cb -0.12 -1.71 0.04 0.00 0.35 0.00 0.00 41.96 40.52 3gq9 s TYR 135 CO 0.01 0.12 -0.02 0.08 -1.34 0.00 0.00 175.55 174.40 3gq9 s VAL 136 N -0.46 3.03 0.00 3.14 1.01 0.81 -1.52 120.40 126.42 3gq9 s VAL 136 Ca 0.06 -1.19 0.00 0.00 0.00 0.00 0.00 61.98 60.85 3gq9 s VAL 136 Cb -0.12 -2.65 0.00 0.00 0.00 0.00 0.00 36.38 33.61 3gq9 s VAL 136 CO 0.02 0.02 0.00 -0.81 0.00 0.00 0.00 175.10 174.33 3gq9 n PRO 137 N 4.66 0.48 -1.67 2.72 -0.04 -1.26 -0.70 135.00 139.19 3gq9 n PRO 137 Ca -0.15 0.00 -0.43 0.00 -0.04 0.00 0.00 63.50 62.88 3gq9 n PRO 137 Cb 0.45 0.00 -0.01 0.00 -0.04 0.00 0.00 33.50 33.90 3gq9 n PRO 137 CO 0.00 0.00 0.00 0.98 -0.04 0.00 0.00 175.50 176.44 3gq9 n TYR 138 N -1.42 2.05 0.00 0.54 9.36 -1.26 -4.20 117.16 122.22 3gq9 n TYR 138 Ca 0.00 0.58 0.00 0.00 3.32 0.00 0.00 57.90 61.80 3gq9 n TYR 138 Cb 0.00 -2.38 0.00 0.00 -0.63 0.00 0.00 39.34 36.33 3gq9 n TYR 138 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 3gq9 n GLY 139 N 0.92 3.20 3.29 2.98 0.00 -0.67 -4.93 105.19 109.98 3gq9 n GLY 139 Ca 0.06 -1.39 -0.39 0.00 0.00 0.00 0.00 46.02 44.30 3gq9 n GLY 139 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3gq9 s THR 140 N -2.00 4.11 -0.49 2.61 2.01 -1.08 -1.03 115.64 119.76 3gq9 s THR 140 Ca 0.00 -1.16 -0.16 0.00 0.31 0.00 0.00 61.69 60.67 3gq9 s THR 140 Cb 0.00 -3.38 0.08 0.00 0.01 0.00 0.00 72.50 69.20 3gq9 s THR 140 CO 0.00 -0.30 0.46 -0.36 -0.69 0.00 0.00 174.62 173.73 3gq9 s PHE 141 N 1.44 3.20 0.32 4.92 0.40 0.13 -0.88 117.98 127.52 3gq9 s PHE 141 Ca 0.01 -0.89 -0.26 0.00 -0.60 0.00 0.00 56.93 55.18 3gq9 s PHE 141 Cb -0.20 -3.34 -0.10 0.00 0.51 0.00 0.00 43.02 39.89 3gq9 s PHE 141 CO 0.03 -0.89 0.95 -1.64 0.70 0.00 0.00 175.22 174.38 3gq9 s MET 142 N 1.87 4.59 0.00 0.44 -1.94 -1.26 -1.67 119.30 121.34 3gq9 s MET 142 Ca 0.06 1.35 0.00 0.00 -1.71 0.00 0.00 55.69 55.40 3gq9 s MET 142 Cb -0.24 -2.83 -0.00 0.00 2.01 0.00 0.00 34.83 33.77 3gq9 s MET 142 CO 0.07 0.28 -0.01 0.14 -0.01 0.00 0.00 175.02 175.49 3gq9 s VAL 143 N -1.58 0.07 -1.82 -6.03 -7.23 -0.59 0.01 120.40 103.23 3gq9 s VAL 143 Ca 0.50 -0.09 0.26 0.00 -1.81 0.00 0.00 61.98 60.84 3gq9 s VAL 143 Cb -0.19 -0.08 0.27 0.00 0.56 0.00 0.00 36.38 36.94 3gq9 s VAL 143 CO 0.25 -0.01 1.55 -1.54 -0.31 0.00 0.00 175.10 175.03 3gq9 n SER 144 N 2.97 1.12 -3.86 4.85 3.41 -1.26 -1.37 113.62 119.48 3gq9 n SER 144 Ca -0.13 -0.97 -0.08 0.00 -0.26 0.00 0.00 58.87 57.43 3gq9 n SER 144 Cb 0.59 0.15 -0.04 0.00 -0.26 0.00 0.00 64.21 64.66 3gq9 n SER 144 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3gq9 s ARG 145 N -2.47 1.59 0.52 4.33 1.70 -1.26 -4.71 118.95 118.65 3gq9 s ARG 145 Ca 0.25 -1.03 -0.22 0.00 -0.47 0.00 0.00 55.73 54.25 3gq9 s ARG 145 Cb 0.19 0.54 -0.06 0.00 -0.57 0.00 0.00 34.95 35.06 3gq9 s ARG 145 CO 0.51 -0.70 1.35 0.20 -1.08 0.00 0.00 175.30 175.59 3gq9 s GLY 146 N -2.94 2.88 -0.38 3.88 0.00 -1.26 -4.97 107.32 104.53 3gq9 s GLY 146 Ca 0.14 1.32 -0.24 0.00 0.00 0.00 0.00 44.72 45.94 3gq9 s GLY 146 CO 0.05 1.85 0.81 -0.42 0.00 0.00 0.00 173.10 175.39 3gq9 s ILE 147 N -1.31 4.68 -0.16 0.90 1.01 0.37 -4.97 121.20 121.72 3gq9 s ILE 147 Ca 0.69 0.85 -0.14 0.00 0.00 0.00 0.00 60.65 62.05 3gq9 s ILE 147 Cb -0.40 -4.26 -0.05 0.00 0.01 0.00 0.00 42.46 37.77 3gq9 s ILE 147 CO 0.48 -0.51 0.31 -0.54 0.00 0.00 0.00 174.94 174.67 3gq9 s LYS 148 N 3.22 4.25 -0.22 2.79 1.02 -1.26 -1.95 119.74 127.60 3gq9 s LYS 148 Ca 0.32 0.12 -0.05 0.00 0.02 0.00 0.00 55.97 56.38 3gq9 s LYS 148 Cb -0.13 -3.42 -0.02 0.00 -0.52 0.00 0.00 37.83 33.74 3gq9 s LYS 148 CO 0.19 0.24 0.00 -0.51 -0.92 0.00 0.00 175.35 174.35 3gq9 s LEU 149 N 0.46 3.20 0.83 3.17 1.43 0.54 -4.75 118.68 123.55 3gq9 s LEU 149 Ca 0.17 -0.25 -0.10 0.00 -1.03 0.00 0.00 54.13 52.92 3gq9 s LEU 149 Cb -0.13 -1.82 0.14 0.00 0.03 0.00 0.00 46.19 44.40 3gq9 s LEU 149 CO 0.04 0.02 1.16 -2.16 0.23 0.00 0.00 176.35 175.65 3gq9 s PRO 150 N 1.25 1.38 0.78 1.29 0.04 -1.26 0.52 135.00 139.00 3gq9 s PRO 150 Ca 0.04 -0.48 -0.14 0.00 0.04 0.00 0.00 61.00 60.46 3gq9 s PRO 150 Cb -0.15 -2.05 0.07 0.00 0.04 0.00 0.00 34.50 32.42 3gq9 s PRO 150 CO 0.01 -1.83 1.20 -1.12 0.04 0.00 0.00 177.00 175.30 3gq9 s SER 151 N -4.73 3.83 -1.34 6.66 0.01 -1.26 -3.70 113.70 113.16 3gq9 s SER 151 Ca 0.68 2.33 -0.03 0.00 1.31 0.00 0.00 55.95 60.23 3gq9 s SER 151 Cb -0.07 -2.58 0.02 0.00 0.21 0.00 0.00 66.02 63.60 3gq9 s SER 151 CO 0.49 -2.51 0.79 0.59 0.41 0.00 0.00 173.24 173.01 3gq9 n ASN 152 N -3.14 -2.06 -4.70 2.44 3.02 0.54 -4.94 115.26 106.42 3gq9 n ASN 152 Ca 0.13 -0.79 -0.35 0.00 -0.03 0.00 0.00 54.58 53.54 3gq9 n ASN 152 Cb 0.51 -4.13 -0.09 0.00 -0.61 0.00 0.00 39.78 35.46 3gq9 n ASN 152 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 3gq9 s THR 153 N -3.57 5.02 -0.22 3.41 2.01 -0.82 -4.99 115.64 116.47 3gq9 s THR 153 Ca 0.14 0.04 -0.01 0.00 0.31 0.00 0.00 61.69 62.18 3gq9 s THR 153 Cb -0.07 -3.25 0.02 0.00 0.01 0.00 0.00 72.50 69.20 3gq9 s THR 153 CO 0.81 0.48 -0.09 -0.69 -0.69 0.00 0.00 174.62 174.44 3gq9 s VAL 154 N 0.11 2.77 -0.19 3.82 1.01 -1.26 -1.05 120.40 125.61 3gq9 s VAL 154 Ca 0.07 -0.89 -0.00 0.00 0.00 0.00 0.00 61.98 61.16 3gq9 s VAL 154 Cb -0.12 -2.32 0.05 0.00 0.00 0.00 0.00 36.38 33.99 3gq9 s VAL 154 CO 0.00 0.34 -0.05 -0.22 0.00 0.00 0.00 175.10 175.16 3gq9 s LEU 155 N 1.35 1.86 -0.07 3.92 2.96 -0.14 -0.20 118.68 128.36 3gq9 s LEU 155 Ca 0.03 -0.81 0.03 0.00 -0.22 0.00 0.00 54.13 53.15 3gq9 s LEU 155 Cb -0.15 -0.98 0.01 0.00 0.50 0.00 0.00 46.19 45.56 3gq9 s LEU 155 CO -0.06 -0.20 -0.15 -0.89 -1.32 0.00 0.00 176.35 173.73 3gq9 s THR 156 N 1.57 1.30 0.55 3.68 2.01 -0.37 -1.39 115.64 123.00 3gq9 s THR 156 Ca -0.01 -0.59 0.08 0.00 0.31 0.00 0.00 61.69 61.48 3gq9 s THR 156 Cb -0.16 -1.16 0.06 0.00 0.01 0.00 0.00 72.50 71.24 3gq9 s THR 156 CO -0.07 0.39 0.60 -0.83 -0.69 0.00 0.00 174.62 174.02 3gq9 s GLY 157 N 0.51 2.03 0.06 4.40 0.00 0.19 -0.13 107.32 114.38 3gq9 s GLY 157 Ca -0.13 -1.73 0.22 0.00 0.00 0.00 0.00 44.72 43.08 3gq9 s GLY 157 CO 0.04 -1.80 1.71 0.00 0.00 0.00 0.00 173.10 173.05 3gq9 n ALA 158 N -2.00 1.99 0.00 3.20 0.00 0.13 -4.73 120.51 119.10 3gq9 n ALA 158 Ca 0.07 -0.05 0.00 0.00 0.00 0.00 0.00 53.44 53.46 3gq9 n ALA 158 Cb 0.63 -1.37 0.00 0.00 0.00 0.00 0.00 19.45 18.71 3gq9 n ALA 158 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3gq9 n GLY 159 N 0.72 3.51 3.71 0.00 0.00 -0.21 -4.75 105.19 108.16 3gq9 n GLY 159 Ca 0.05 -1.75 -0.41 0.00 0.00 0.00 0.00 46.02 43.91 3gq9 n GLY 159 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3gq9 n LYS 160 N -1.74 2.05 -2.03 1.61 5.02 -1.26 -1.17 118.16 120.63 3gq9 n LYS 160 Ca 0.00 0.73 -0.15 0.00 -2.02 0.00 0.00 58.31 56.87 3gq9 n LYS 160 Cb 0.00 -2.39 -0.03 0.00 -0.02 0.00 0.00 35.03 32.60 3gq9 n LYS 160 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 3gq9 n ARG 161 N 0.24 -1.77 0.00 1.97 1.74 -1.26 -4.70 116.66 112.88 3gq9 n ARG 161 Ca 0.06 0.78 0.00 0.00 -0.77 0.00 0.00 57.85 57.92 3gq9 n ARG 161 Cb 0.38 -5.26 0.00 0.00 -1.02 0.00 0.00 32.46 26.56 3gq9 n ARG 161 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 3gq9 n ASN 162 N -1.40 0.00 -4.62 0.55 2.85 -0.74 -4.96 115.26 106.95 3gq9 n ASN 162 Ca -0.17 0.00 -0.42 0.00 -0.11 0.00 0.00 54.58 53.88 3gq9 n ASN 162 Cb 0.58 0.00 -0.04 0.00 1.24 0.00 0.00 39.78 41.56 3gq9 n ASN 162 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 3gq9 s ALA 163 N -2.00 3.47 -0.08 5.20 0.00 -0.32 -1.67 121.76 126.37 3gq9 s ALA 163 Ca 0.00 -0.34 0.03 0.00 0.00 0.00 0.00 51.96 51.66 3gq9 s ALA 163 Cb 0.00 -3.50 0.01 0.00 0.00 0.00 0.00 23.12 19.62 3gq9 s ALA 163 CO 0.00 -1.45 -0.18 0.08 0.00 0.00 0.00 175.76 174.21 3gq9 s VAL 164 N 3.36 1.59 -0.11 0.00 1.01 -0.20 -0.92 120.40 125.13 3gq9 s VAL 164 Ca 0.38 -0.75 0.01 0.00 0.00 0.00 0.00 61.98 61.62 3gq9 s VAL 164 Cb -0.13 -1.40 -0.01 0.00 0.00 0.00 0.00 36.38 34.84 3gq9 s VAL 164 CO 0.16 0.46 -0.16 -0.63 0.00 0.00 0.00 175.10 174.92 3gq9 s ILE 165 N 0.44 2.78 -0.11 2.22 1.01 0.58 0.22 121.20 128.34 3gq9 s ILE 165 Ca -0.15 -0.77 -0.07 0.00 0.00 0.00 0.00 60.65 59.66 3gq9 s ILE 165 Cb -0.16 -2.13 0.04 0.00 0.01 0.00 0.00 42.46 40.21 3gq9 s ILE 165 CO 0.06 0.54 0.27 -0.60 0.00 0.00 0.00 174.94 175.21 3gq9 s ARG 166 N 0.21 0.26 0.33 2.79 3.52 -0.67 0.12 118.95 125.50 3gq9 s ARG 166 Ca -0.10 0.49 -0.29 0.00 -0.13 0.00 0.00 55.73 55.71 3gq9 s ARG 166 Cb -0.16 -0.01 -0.10 0.00 -1.56 0.00 0.00 34.95 33.12 3gq9 s ARG 166 CO 0.06 -0.12 1.39 -0.06 -0.81 0.00 0.00 175.30 175.77 3gq9 s PHE 167 N 0.85 2.90 0.58 5.12 2.99 -1.06 -1.55 117.98 127.82 3gq9 s PHE 167 Ca -0.06 1.25 -0.18 0.00 0.00 0.00 0.00 56.93 57.94 3gq9 s PHE 167 Cb -0.07 -3.82 -0.04 0.00 0.00 0.00 0.00 43.02 39.09 3gq9 s PHE 167 CO -0.06 -2.40 1.10 -1.64 -0.00 0.00 0.00 175.22 172.23 3gq9 s MET 168 N -1.54 3.23 0.57 0.44 -1.94 -0.47 -4.73 119.30 114.87 3gq9 s MET 168 Ca 0.53 1.46 0.29 0.00 -1.71 0.00 0.00 55.69 56.25 3gq9 s MET 168 Cb -0.42 -2.00 1.48 0.00 2.01 0.00 0.00 34.83 35.89 3gq9 s MET 168 CO 0.54 -0.92 1.93 -0.44 -0.01 0.00 0.00 175.02 176.12 3gq9 h ASP 169 N 0.79 0.00 0.44 3.03 3.32 -1.94 -2.28 116.42 119.78 3gq9 h ASP 169 Ca -0.49 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.56 3gq9 h ASP 169 Cb 1.25 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.80 3gq9 h ASP 169 CO 0.56 0.00 -0.28 -1.54 -1.72 0.00 0.00 179.24 176.26 3gq9 n SER 170 N -3.92 0.60 -4.73 6.45 3.41 -1.26 -4.91 113.62 109.27 3gq9 n SER 170 Ca 0.10 -0.44 -0.42 0.00 -0.26 0.00 0.00 58.87 57.85 3gq9 n SER 170 Cb 0.68 0.06 -0.03 0.00 -0.26 0.00 0.00 64.21 64.67 3gq9 n SER 170 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 3gq9 s VAL 171 N -2.73 2.35 0.00 -3.33 1.01 -0.86 -5.01 120.40 111.83 3gq9 s VAL 171 Ca 0.19 0.26 0.00 0.00 0.00 0.00 0.00 61.98 62.43 3gq9 s VAL 171 Cb 0.19 -3.17 0.00 0.00 0.00 0.00 0.00 36.38 33.40 3gq9 s VAL 171 CO 0.58 0.03 0.00 0.61 0.00 0.00 0.00 175.10 176.31 3gq9 n GLY 172 N 3.47 0.66 3.69 4.51 0.00 -1.26 -5.01 105.19 111.24 3gq9 n GLY 172 Ca 0.13 -1.44 -0.26 0.00 0.00 0.00 0.00 46.02 44.45 3gq9 n GLY 172 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3gq9 s ARG 173 N 0.00 2.48 0.00 1.61 1.81 -1.26 -4.78 118.95 118.80 3gq9 s ARG 173 Ca 0.00 -1.12 0.00 0.00 -1.72 0.00 0.00 55.73 52.89 3gq9 s ARG 173 Cb 0.00 -2.38 0.00 0.00 -0.45 0.00 0.00 34.95 32.12 3gq9 s ARG 173 CO 0.00 0.44 0.00 0.41 -0.68 0.00 0.00 175.30 175.47 3gq9 n GLY 174 N -0.30 2.18 3.45 -3.53 0.00 -1.26 -5.10 105.19 100.62 3gq9 n GLY 174 Ca -0.09 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.60 3gq9 n GLY 174 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3gq9 s GLU 175 N -0.10 2.60 0.63 1.61 2.02 -1.26 -4.40 118.70 119.80 3gq9 s GLU 175 Ca 0.00 -0.71 -0.16 0.00 0.02 0.00 0.00 54.97 54.11 3gq9 s GLU 175 Cb 0.00 -2.38 -0.01 0.00 0.10 0.00 0.00 34.13 31.83 3gq9 s GLU 175 CO 0.00 0.56 1.12 -1.12 0.02 0.00 0.00 175.26 175.84 3gq9 s SER 176 N -0.57 5.22 0.21 -0.19 0.01 -1.26 -3.86 113.70 113.27 3gq9 s SER 176 Ca 0.08 2.07 -0.08 0.00 1.31 0.00 0.00 55.95 59.33 3gq9 s SER 176 Cb -0.11 -2.56 0.16 0.00 0.21 0.00 0.00 66.02 63.72 3gq9 s SER 176 CO 0.01 -1.56 1.80 0.25 0.41 0.00 0.00 173.24 174.15 3gq9 h LEU 177 N 0.32 1.08 -7.46 2.44 6.46 -1.32 -3.40 115.31 113.44 3gq9 h LEU 177 Ca -0.48 -0.15 -0.26 0.00 -0.12 0.00 0.00 57.88 56.87 3gq9 h LEU 177 Cb 1.25 -0.28 -0.32 0.00 -0.73 0.00 0.00 40.66 40.58 3gq9 h LEU 177 CO 0.55 0.93 -0.63 -0.32 -0.62 0.00 0.00 178.44 178.35 3gq9 s MET 178 N -5.63 0.06 0.10 1.25 0.00 -0.62 -0.48 119.30 113.98 3gq9 s MET 178 Ca -0.12 0.32 -0.25 0.00 0.00 0.00 0.00 55.69 55.63 3gq9 s MET 178 Cb 0.16 -0.19 0.08 0.00 0.00 0.00 0.00 34.83 34.87 3gq9 s MET 178 CO 0.83 -0.16 0.67 1.52 0.00 0.00 0.00 175.02 177.88 3gq9 s TYR 179 N 1.12 -0.52 0.35 4.11 1.13 -0.82 -0.91 117.35 121.82 3gq9 s TYR 179 Ca -0.09 0.41 -0.27 0.00 -1.41 0.00 0.00 57.07 55.71 3gq9 s TYR 179 Cb -0.12 0.54 -0.09 0.00 -1.10 0.00 0.00 41.96 41.19 3gq9 s TYR 179 CO -0.05 -0.76 1.15 0.54 -2.51 0.00 0.00 175.55 173.93 3gq9 s ASN 180 N -2.49 6.83 0.16 -0.18 2.20 -1.21 -0.34 114.94 119.91 3gq9 s ASN 180 Ca 0.00 2.34 -0.20 0.00 -0.94 0.00 0.00 52.86 54.06 3gq9 s ASN 180 Cb -0.01 -2.62 0.06 0.00 -2.00 0.00 0.00 41.25 36.68 3gq9 s ASN 180 CO -0.09 -0.46 1.65 -0.08 -2.94 0.00 0.00 177.10 175.17 3gq9 h GLU 181 N 3.11 -0.13 -4.99 3.55 4.81 -0.23 -3.36 114.58 117.35 3gq9 h GLU 181 Ca -0.48 0.01 -0.68 0.00 -0.13 0.00 0.00 59.36 58.08 3gq9 h GLU 181 Cb 1.22 0.03 -0.18 0.00 0.63 0.00 0.00 28.75 30.46 3gq9 h GLU 181 CO 0.64 -0.09 0.58 1.21 -0.73 0.00 0.00 179.01 180.62 3gq9 s ASN 182 N -5.12 6.44 0.44 1.04 3.84 -1.26 -4.87 114.94 115.45 3gq9 s ASN 182 Ca -0.14 -1.70 0.21 0.00 0.21 0.00 0.00 52.86 51.43 3gq9 s ASN 182 Cb 0.13 -2.37 1.03 0.00 -0.55 0.00 0.00 41.25 39.49 3gq9 s ASN 182 CO 0.69 -1.14 1.91 0.58 -2.79 0.00 0.00 177.10 176.35 3gq9 h VAL 183 N 5.81 0.82 0.01 -5.21 2.07 -1.88 -1.04 116.25 116.83 3gq9 h VAL 183 Ca -0.04 -0.99 -0.40 0.00 0.82 0.00 0.00 66.70 66.08 3gq9 h VAL 183 Cb 1.05 1.60 -0.06 0.00 -1.52 0.00 0.00 31.29 32.36 3gq9 h VAL 183 CO 1.10 0.24 -2.29 0.35 0.02 0.00 0.00 177.57 176.99 3gq9 n THR 184 N -3.72 1.54 0.36 2.57 -2.24 -1.26 -0.23 114.28 111.31 3gq9 n THR 184 Ca -0.01 -0.42 0.04 0.00 -2.27 0.00 0.00 64.05 61.39 3gq9 n THR 184 Cb 0.36 -1.75 0.01 0.00 -2.10 0.00 0.00 70.33 66.85 3gq9 n THR 184 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 3gq9 n THR 185 N -3.90 0.00 -0.13 4.28 -2.24 -1.25 -4.14 114.28 106.89 3gq9 n THR 185 Ca -0.47 -0.44 0.00 0.00 -2.27 0.00 0.00 64.05 60.87 3gq9 n THR 185 Cb 0.91 1.12 0.00 0.00 -2.10 0.00 0.00 70.33 70.26 3gq9 n THR 185 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3gq9 n GLY 186 N 0.71 -2.56 3.47 3.38 0.00 -0.39 -4.84 105.19 104.96 3gq9 n GLY 186 Ca 0.04 -1.62 -0.25 0.00 0.00 0.00 0.00 46.02 44.19 3gq9 n GLY 186 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3gq9 s ASN 187 N -1.80 2.63 0.00 1.61 0.01 -1.25 -4.68 114.94 111.46 3gq9 s ASN 187 Ca 0.00 -1.73 0.02 0.00 -0.71 0.00 0.00 52.86 50.45 3gq9 s ASN 187 Cb 0.00 0.57 -0.01 0.00 0.41 0.00 0.00 41.25 42.23 3gq9 s ASN 187 CO 0.00 -0.99 -0.07 -1.61 -1.51 0.00 0.00 177.10 172.91 3gq9 s GLU 188 N -3.63 0.56 -0.60 -0.60 2.02 -1.26 -1.60 118.70 113.59 3gq9 s GLU 188 Ca 0.26 -0.34 -0.02 0.00 0.02 0.00 0.00 54.97 54.88 3gq9 s GLU 188 Cb 0.02 -0.51 0.00 0.00 0.10 0.00 0.00 34.13 33.74 3gq9 s GLU 188 CO 0.17 0.14 0.59 0.09 0.02 0.00 0.00 175.26 176.27 3gq9 n ASN 189 N 2.65 -7.07 -4.10 -0.19 3.02 -0.35 -0.34 115.26 108.87 3gq9 n ASN 189 Ca -0.15 0.03 -0.31 0.00 -0.03 0.00 0.00 54.58 54.12 3gq9 n ASN 189 Cb 0.57 -4.77 -0.16 0.00 -0.61 0.00 0.00 39.78 34.81 3gq9 n ASN 189 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 3gq9 s ILE 190 N -2.90 1.83 -0.25 2.41 1.01 -0.64 -1.80 121.20 120.86 3gq9 s ILE 190 Ca 0.04 -0.82 0.02 0.00 0.00 0.00 0.00 60.65 59.88 3gq9 s ILE 190 Cb -0.01 -1.65 0.06 0.00 0.01 0.00 0.00 42.46 40.87 3gq9 s ILE 190 CO 0.65 0.50 -0.07 -0.36 0.00 0.00 0.00 174.94 175.67 3gq9 s PHE 191 N 1.07 2.72 -0.13 3.97 0.40 -0.21 -1.21 117.98 124.59 3gq9 s PHE 191 Ca -0.02 -1.98 0.02 0.00 -0.60 0.00 0.00 56.93 54.34 3gq9 s PHE 191 Cb -0.14 -1.73 -0.00 0.00 0.51 0.00 0.00 43.02 41.65 3gq9 s PHE 191 CO -0.06 -0.82 -0.19 -0.51 0.70 0.00 0.00 175.22 174.35 3gq9 s LEU 192 N 1.29 2.35 -0.11 -0.37 1.43 0.13 -0.97 118.68 122.42 3gq9 s LEU 192 Ca -0.06 -0.49 -0.11 0.00 -1.03 0.00 0.00 54.13 52.44 3gq9 s LEU 192 Cb -0.19 -1.51 0.03 0.00 0.03 0.00 0.00 46.19 44.55 3gq9 s LEU 192 CO -0.06 0.13 0.31 -0.55 0.23 0.00 0.00 176.35 176.41 3gq9 s SER 193 N 0.55 -0.31 -0.81 2.29 0.15 -0.48 -0.97 113.70 114.11 3gq9 s SER 193 Ca -0.11 0.57 -0.04 0.00 0.70 0.00 0.00 55.95 57.07 3gq9 s SER 193 Cb -0.16 0.61 -0.05 0.00 -1.71 0.00 0.00 66.02 64.70 3gq9 s SER 193 CO 0.04 -0.14 0.72 -1.20 1.20 0.00 0.00 173.24 173.86 3gq9 n SER 194 N 2.76 -5.91 -3.58 5.45 7.64 -0.62 -0.64 113.62 118.73 3gq9 n SER 194 Ca -0.14 -0.50 -0.10 0.00 1.01 0.00 0.00 58.87 59.14 3gq9 n SER 194 Cb 0.58 -4.35 -0.02 0.00 -1.01 0.00 0.00 64.21 59.41 3gq9 n SER 194 CO 0.00 0.00 0.00 0.72 -3.01 0.00 0.00 175.04 172.75 3gq9 s PHE 195 N -3.27 -0.41 -0.12 1.43 -0.12 -1.13 -1.04 117.98 113.31 3gq9 s PHE 195 Ca 0.32 0.11 -0.13 0.00 -0.05 0.00 0.00 56.93 57.18 3gq9 s PHE 195 Cb -0.04 0.61 -0.05 0.00 -0.63 0.00 0.00 43.02 42.91 3gq9 s PHE 195 CO 0.60 -0.99 0.29 0.99 -0.05 0.00 0.00 175.22 176.07 3gq9 s THR 196 N -3.81 5.28 -0.28 -4.49 2.01 -0.09 -1.95 115.64 112.31 3gq9 s THR 196 Ca 0.05 0.55 -0.09 0.00 0.31 0.00 0.00 61.69 62.51 3gq9 s THR 196 Cb -0.03 -3.61 -0.02 0.00 0.01 0.00 0.00 72.50 68.85 3gq9 s THR 196 CO -0.06 0.46 0.12 -0.76 -0.69 0.00 0.00 174.62 173.69 3gq9 s LEU 197 N -0.08 3.79 -0.37 4.42 1.43 0.94 -0.31 118.68 128.51 3gq9 s LEU 197 Ca 0.18 -0.31 -0.04 0.00 -1.03 0.00 0.00 54.13 52.93 3gq9 s LEU 197 Cb -0.14 -1.98 0.08 0.00 0.03 0.00 0.00 46.19 44.18 3gq9 s LEU 197 CO 0.06 -0.10 0.14 -0.62 0.23 0.00 0.00 176.35 176.05 3gq9 s ASP 198 N 1.63 5.21 0.09 2.29 3.68 0.12 -1.09 116.67 128.61 3gq9 s ASP 198 Ca 0.06 -1.59 0.20 0.00 2.13 0.00 0.00 52.55 53.35 3gq9 s ASP 198 Cb -0.16 -1.82 0.84 0.00 -1.45 0.00 0.00 42.92 40.32 3gq9 s ASP 198 CO 0.06 -0.43 1.64 0.61 0.13 0.00 0.00 175.17 177.18 3gq9 n GLY 199 N 4.68 -1.22 3.94 2.66 0.00 -0.69 -2.55 105.19 112.01 3gq9 n GLY 199 Ca -0.08 -0.02 -0.29 0.00 0.00 0.00 0.00 46.02 45.63 3gq9 n GLY 199 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3gq9 n ASN 200 N -1.78 -3.00 -0.11 1.61 4.05 -1.10 -4.53 115.26 110.40 3gq9 n ASN 200 Ca 0.04 -0.87 0.16 0.00 0.45 0.00 0.00 54.58 54.35 3gq9 n ASN 200 Cb 0.24 -3.56 0.55 0.00 1.23 0.00 0.00 39.78 38.23 3gq9 n ASN 200 CO 0.00 0.00 0.00 -1.13 -3.05 0.00 0.00 177.26 173.08 3gq9 h ASN 201 N -1.89 0.29 -0.96 1.20 -1.24 -1.72 -2.46 115.58 108.81 3gq9 h ASN 201 Ca -0.60 0.01 0.27 0.00 0.71 0.00 0.00 56.30 56.70 3gq9 h ASN 201 Cb 1.37 -0.05 -0.04 0.00 0.73 0.00 0.00 38.32 40.34 3gq9 h ASN 201 CO 0.66 0.16 0.68 0.11 -1.29 0.00 0.00 177.43 177.76 3gq9 h LYS 202 N 0.31 0.03 0.00 6.67 1.57 -1.84 -0.38 116.57 122.93 3gq9 h LYS 202 Ca 0.32 -0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.10 3gq9 h LYS 202 Cb 0.81 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 33.12 3gq9 h LYS 202 CO -0.08 0.02 0.00 0.07 -0.57 0.00 0.00 179.45 178.89 3gq9 h ARG 203 N 0.03 0.00 -0.08 3.15 0.11 -1.79 -1.74 114.38 114.06 3gq9 h ARG 203 Ca 0.46 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.54 3gq9 h ARG 203 Cb 1.79 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.87 3gq9 h ARG 203 CO -0.02 0.00 0.00 1.28 0.10 0.00 0.00 179.97 181.33 3gq9 n LEU 204 N -2.94 2.22 0.00 0.08 4.77 -0.15 -5.03 117.00 115.95 3gq9 n LEU 204 Ca -0.02 -0.79 0.00 0.00 -0.03 0.00 0.00 56.01 55.17 3gq9 n LEU 204 Cb 0.13 -0.04 0.00 0.00 -2.33 0.00 0.00 43.42 41.18 3gq9 n LEU 204 CO 0.20 0.40 0.00 0.61 -1.33 0.00 0.00 177.39 177.27 3gq9 n GLY 205 N 1.26 -2.31 3.95 -0.72 0.00 -0.65 -4.93 105.19 101.79 3gq9 n GLY 205 Ca 0.17 -1.60 -0.25 0.00 0.00 0.00 0.00 46.02 44.34 3gq9 n GLY 205 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3gq9 s GLN 206 N -0.42 3.44 0.00 1.61 -1.52 -1.26 -4.46 119.66 117.05 3gq9 s GLN 206 Ca 0.00 -0.61 0.00 0.00 -1.95 0.00 0.00 55.36 52.80 3gq9 s GLN 206 Cb 0.00 -2.95 0.00 0.00 -0.22 0.00 0.00 33.01 29.84 3gq9 s GLN 206 CO 0.00 0.50 0.00 0.41 -0.25 0.00 0.00 175.29 175.95 3gq9 n GLY 207 N -0.67 0.42 3.78 3.09 0.00 -1.26 -5.04 105.19 105.51 3gq9 n GLY 207 Ca -0.07 -0.71 -0.36 0.00 0.00 0.00 0.00 46.02 44.88 3gq9 n GLY 207 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3gq9 s ILE 208 N -2.00 5.18 0.14 -0.61 -1.09 -1.26 -5.10 121.20 116.46 3gq9 s ILE 208 Ca 0.00 0.09 0.00 0.00 -2.23 0.00 0.00 60.65 58.52 3gq9 s ILE 208 Cb 0.00 -3.28 -0.00 0.00 -1.58 0.00 0.00 42.46 37.59 3gq9 s ILE 208 CO 0.00 0.55 0.01 -0.24 -1.23 0.00 0.00 174.94 174.03 3gq9 n SER 209 N 2.60 2.00 -4.76 3.58 2.88 -1.26 -4.82 113.62 113.85 3gq9 n SER 209 Ca -0.18 -1.63 -0.39 0.00 -1.33 0.00 0.00 58.87 55.33 3gq9 n SER 209 Cb 0.54 0.16 0.01 0.00 -0.75 0.00 0.00 64.21 64.17 3gq9 n SER 209 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 3gq9 s GLY 210 N -1.78 2.91 0.51 0.46 0.00 -1.22 -4.87 107.32 103.34 3gq9 s GLY 210 Ca 0.02 1.36 0.30 0.00 0.00 0.00 0.00 44.72 46.39 3gq9 s GLY 210 CO 0.01 1.94 1.93 1.19 0.00 0.00 0.00 173.10 178.17 3gq9 h ILE 211 N 2.17 0.20 0.00 0.90 2.10 -1.96 -3.46 117.51 117.46 3gq9 h ILE 211 Ca -0.50 -0.72 0.00 0.00 1.08 0.00 0.00 64.86 64.71 3gq9 h ILE 211 Cb 1.27 1.60 0.00 0.00 -1.09 0.00 0.00 36.82 38.60 3gq9 h ILE 211 CO 0.61 0.07 0.00 0.61 -1.08 0.00 0.00 178.15 178.36 3gq9 n GLY 212 N 0.08 2.72 7.00 8.18 0.00 -1.26 -5.08 105.19 116.83 3gq9 n GLY 212 Ca 0.00 0.03 0.00 0.00 0.00 0.00 0.00 46.02 46.06 3gq9 n GLY 212 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3gq9 n GLY 213 N -0.27 3.02 0.34 -0.02 0.00 -1.26 -2.51 105.19 104.50 3gq9 n GLY 213 Ca 0.00 -0.26 0.05 0.00 0.00 0.00 0.00 46.02 45.82 3gq9 n GLY 213 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3gq9 n SER 214 N 1.94 1.01 -4.76 1.61 3.41 0.52 -4.88 113.62 112.46 3gq9 n SER 214 Ca 0.00 -1.86 -0.40 0.00 -0.26 0.00 0.00 58.87 56.35 3gq9 n SER 214 Cb 0.00 -0.11 -0.03 0.00 -0.26 0.00 0.00 64.21 63.81 3gq9 n SER 214 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 3gq9 s ARG 215 N -1.79 4.45 0.00 4.33 0.52 -1.04 -4.17 118.95 121.25 3gq9 s ARG 215 Ca 0.19 1.96 0.00 0.00 -0.52 0.00 0.00 55.73 57.35 3gq9 s ARG 215 Cb 0.10 -3.07 0.00 0.00 0.52 0.00 0.00 34.95 32.50 3gq9 s ARG 215 CO 0.14 -0.01 0.00 0.39 0.02 0.00 0.00 175.30 175.84 3gq9 n GLU 216 N 0.87 0.00 -1.89 3.54 1.02 -1.25 -4.34 120.64 118.60 3gq9 n GLU 216 Ca 0.00 0.08 -0.29 0.00 -0.02 0.00 0.00 57.16 56.93 3gq9 n GLU 216 Cb 0.44 -3.04 0.08 0.00 -0.02 0.00 0.00 31.44 28.91 3gq9 n GLU 216 CO 0.00 0.00 0.00 -1.12 1.18 0.00 0.00 177.13 177.19 3gq9 s SER 217 N -2.84 4.65 0.13 1.62 0.01 -1.26 -1.27 113.70 114.74 3gq9 s SER 217 Ca 0.00 0.85 -0.13 0.00 1.31 0.00 0.00 55.95 57.98 3gq9 s SER 217 Cb 0.00 -1.40 -0.02 0.00 0.21 0.00 0.00 66.02 64.81 3gq9 s SER 217 CO 0.00 -1.82 1.53 0.78 0.41 0.00 0.00 173.24 174.14 3gq9 h ASN 218 N -1.00 0.83 -3.31 2.44 4.21 -1.02 -1.87 115.58 115.87 3gq9 h ASN 218 Ca -0.46 -0.38 -0.41 0.00 1.21 0.00 0.00 56.30 56.26 3gq9 h ASN 218 Cb 1.32 -0.23 -0.37 0.00 -1.12 0.00 0.00 38.32 37.91 3gq9 h ASN 218 CO 0.65 1.02 -0.76 -0.22 -1.29 0.00 0.00 177.43 176.83 3gq9 s LEU 219 N -9.20 0.67 -0.12 1.61 2.96 -0.56 -1.58 118.68 112.45 3gq9 s LEU 219 Ca -0.12 -0.06 0.02 0.00 -0.22 0.00 0.00 54.13 53.75 3gq9 s LEU 219 Cb 0.11 -0.38 0.01 0.00 0.50 0.00 0.00 46.19 46.43 3gq9 s LEU 219 CO 0.83 -0.18 -0.19 -0.44 -1.32 0.00 0.00 176.35 175.06 3gq9 s SER 220 N 1.78 2.78 -0.22 3.68 0.01 -0.09 -1.14 113.70 120.50 3gq9 s SER 220 Ca 0.02 -0.52 -0.00 0.00 1.31 0.00 0.00 55.95 56.76 3gq9 s SER 220 Cb -0.13 -1.27 0.02 0.00 0.21 0.00 0.00 66.02 64.86 3gq9 s SER 220 CO -0.04 0.05 -0.12 -0.63 0.41 0.00 0.00 173.24 172.91 3gq9 s ILE 221 N 0.87 2.50 -0.17 1.44 -1.09 0.11 -3.28 121.20 121.58 3gq9 s ILE 221 Ca -0.08 -0.99 0.01 0.00 -2.23 0.00 0.00 60.65 57.36 3gq9 s ILE 221 Cb -0.15 -2.19 0.03 0.00 -1.58 0.00 0.00 42.46 38.57 3gq9 s ILE 221 CO -0.01 0.35 -0.15 -0.13 -1.23 0.00 0.00 174.94 173.77 3gq9 s ARG 222 N 1.30 2.45 -1.81 2.79 0.52 -1.26 -0.09 118.95 122.86 3gq9 s ARG 222 Ca 0.02 -0.73 0.00 0.00 -0.52 0.00 0.00 55.73 54.49 3gq9 s ARG 222 Cb -0.15 -2.34 0.00 0.00 0.52 0.00 0.00 34.95 32.97 3gq9 s ARG 222 CO -0.08 -0.28 0.00 0.00 0.02 0.00 0.00 175.30 174.96 3gq9 n ALA 223 N 4.69 -0.49 -2.68 2.13 0.00 -0.45 -4.13 120.51 119.58 3gq9 n ALA 223 Ca -0.18 0.21 -0.33 0.00 0.00 0.00 0.00 53.44 53.14 3gq9 n ALA 223 Cb 0.49 -2.05 -0.05 0.00 0.00 0.00 0.00 19.45 17.84 3gq9 n ALA 223 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3gq9 s HIS 225 N -1.50 2.89 -0.35 0.00 3.76 -0.63 -0.49 115.29 118.98 3gq9 s HIS 225 Ca 0.35 -0.22 -0.00 0.00 -0.15 0.00 0.00 55.06 55.04 3gq9 s HIS 225 Cb -0.13 -1.78 -0.00 0.00 1.11 0.00 0.00 32.58 31.78 3gq9 s HIS 225 CO 0.21 0.11 0.33 0.09 -0.85 0.00 0.00 174.74 174.63 3gq9 n ASN 226 N 2.80 -4.67 -4.13 1.40 3.02 -0.49 -1.21 115.26 111.99 3gq9 n ASN 226 Ca -0.18 -0.04 -0.30 0.00 -0.03 0.00 0.00 54.58 54.03 3gq9 n ASN 226 Cb 0.53 -2.99 -0.17 0.00 -0.61 0.00 0.00 39.78 36.54 3gq9 n ASN 226 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 3gq9 s VAL 227 N -3.00 1.75 -0.19 2.41 1.01 -0.67 -1.61 120.40 120.09 3gq9 s VAL 227 Ca 0.01 -0.81 0.01 0.00 0.00 0.00 0.00 61.98 61.18 3gq9 s VAL 227 Cb -0.00 -1.55 0.03 0.00 0.00 0.00 0.00 36.38 34.85 3gq9 s VAL 227 CO 0.35 0.49 -0.19 -0.31 0.00 0.00 0.00 175.10 175.44 3gq9 s TYR 228 N 0.70 2.85 -0.22 5.22 1.51 -0.35 -1.13 117.35 125.93 3gq9 s TYR 228 Ca -0.12 -1.73 0.02 0.00 -1.01 0.00 0.00 57.07 54.23 3gq9 s TYR 228 Cb -0.16 -1.92 0.04 0.00 -0.11 0.00 0.00 41.96 39.81 3gq9 s TYR 228 CO 0.02 -0.82 -0.13 0.42 -1.11 0.00 0.00 175.55 173.93 3gq9 s ILE 229 N 1.27 2.02 -0.03 2.71 1.01 0.11 -0.70 121.20 127.59 3gq9 s ILE 229 Ca 0.03 -1.30 0.01 0.00 0.00 0.00 0.00 60.65 59.39 3gq9 s ILE 229 Cb -0.14 -2.03 0.02 0.00 0.01 0.00 0.00 42.46 40.32 3gq9 s ILE 229 CO -0.12 0.18 -0.02 -0.60 0.00 0.00 0.00 174.94 174.38 3gq9 s ARG 230 N 1.22 0.42 -1.45 2.79 6.06 -0.15 -0.71 118.95 127.13 3gq9 s ARG 230 Ca -0.03 -0.01 -0.10 0.00 -2.50 0.00 0.00 55.73 53.09 3gq9 s ARG 230 Cb -0.17 -0.52 0.05 0.00 0.06 0.00 0.00 34.95 34.37 3gq9 s ARG 230 CO -0.08 -0.08 0.96 -0.25 -2.50 0.00 0.00 175.30 173.35 3gq9 n ASP 231 N 3.88 -4.21 -4.63 -2.12 8.00 -0.53 -1.59 116.55 115.35 3gq9 n ASP 231 Ca -0.24 -0.75 -0.34 0.00 0.71 0.00 0.00 54.79 54.17 3gq9 n ASP 231 Cb 0.52 -4.12 -0.10 0.00 -0.02 0.00 0.00 41.12 37.40 3gq9 n ASP 231 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3gq9 s ILE 232 N -3.38 4.78 -0.25 0.53 -1.09 -1.25 -2.56 121.20 117.97 3gq9 s ILE 232 Ca 0.50 -0.04 -0.08 0.00 -2.23 0.00 0.00 60.65 58.80 3gq9 s ILE 232 Cb -0.24 -3.15 -0.03 0.00 -1.58 0.00 0.00 42.46 37.45 3gq9 s ILE 232 CO 0.81 0.46 0.09 -0.70 -1.23 0.00 0.00 174.94 174.38 3gq9 s GLU 233 N 0.34 3.74 -0.27 2.79 2.12 -0.82 -1.12 118.70 125.48 3gq9 s GLU 233 Ca 0.03 -0.44 -0.05 0.00 0.36 0.00 0.00 54.97 54.88 3gq9 s GLU 233 Cb -0.12 -3.38 0.01 0.00 0.26 0.00 0.00 34.13 30.89 3gq9 s GLU 233 CO 0.00 -0.15 0.02 0.00 -0.54 0.00 0.00 175.26 174.59 3gq9 s ALA 234 N 1.55 2.93 0.21 6.30 0.00 0.15 -0.04 121.76 132.87 3gq9 s ALA 234 Ca 0.06 -1.40 0.08 0.00 0.00 0.00 0.00 51.96 50.70 3gq9 s ALA 234 Cb -0.15 -1.95 -0.05 0.00 0.00 0.00 0.00 23.12 20.97 3gq9 s ALA 234 CO 0.05 -0.80 -0.15 0.14 0.00 0.00 0.00 175.76 174.99 3gq9 s VAL 235 N 1.45 1.81 -1.26 0.00 -7.23 -0.25 -1.36 120.40 113.58 3gq9 s VAL 235 Ca 0.02 -2.20 -0.25 0.00 -1.81 0.00 0.00 61.98 57.75 3gq9 s VAL 235 Cb -0.17 -2.04 0.03 0.00 0.56 0.00 0.00 36.38 34.76 3gq9 s VAL 235 CO -0.00 -0.55 0.60 -0.67 -0.31 0.00 0.00 175.10 174.17 3gq9 n ASP 236 N -0.33 -3.48 -4.82 4.85 2.03 -1.17 -1.71 116.55 111.93 3gq9 n ASP 236 Ca -0.08 -1.22 -0.38 0.00 0.52 0.00 0.00 54.79 53.63 3gq9 n ASP 236 Cb 0.60 -2.13 -0.06 0.00 -0.72 0.00 0.00 41.12 38.81 3gq9 n ASP 236 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3gq9 h THR 238 N 3.79 0.91 0.00 0.00 2.02 -1.85 -2.98 112.91 114.80 3gq9 h THR 238 Ca -0.50 -1.18 0.00 0.00 0.77 0.00 0.00 66.41 65.50 3gq9 h THR 238 Cb 1.21 1.54 0.00 0.00 -1.74 0.00 0.00 68.15 69.16 3gq9 h THR 238 CO 0.64 0.24 0.00 -0.11 0.37 0.00 0.00 175.52 176.65 3gq9 n LEU 239 N -4.90 0.00 -4.98 2.58 7.94 -0.39 -3.27 117.00 113.97 3gq9 n LEU 239 Ca -0.08 0.00 -0.20 0.00 -1.11 0.00 0.00 56.01 54.63 3gq9 n LEU 239 Cb 0.27 0.00 -0.00 0.00 0.53 0.00 0.00 43.42 44.22 3gq9 n LEU 239 CO 0.26 0.00 0.11 -1.00 -1.11 0.00 0.00 177.39 175.64 3gq9 s HIS 240 N 1.24 3.12 -0.03 1.96 3.76 -1.26 -0.90 115.29 123.18 3gq9 s HIS 240 Ca 0.00 -0.15 -0.09 0.00 -0.15 0.00 0.00 55.06 54.67 3gq9 s HIS 240 Cb 0.00 -2.08 -0.05 0.00 1.11 0.00 0.00 32.58 31.56 3gq9 s HIS 240 CO 0.00 -0.10 0.50 0.78 -0.85 0.00 0.00 174.74 175.07 3gq9 h GLY 241 N 0.78 -0.35 -6.54 -2.22 0.00 -0.87 -1.11 103.07 92.77 3gq9 h GLY 241 Ca -0.46 0.13 -0.48 0.00 0.00 0.00 0.00 47.33 46.52 3gq9 h GLY 241 CO 0.53 -0.13 -0.79 -0.42 0.00 0.00 0.00 176.54 175.74 3gq9 s ILE 242 N -2.68 0.80 -0.10 2.60 1.01 -0.44 -1.50 121.20 120.88 3gq9 s ILE 242 Ca -0.05 -0.19 0.02 0.00 0.00 0.00 0.00 60.65 60.43 3gq9 s ILE 242 Cb 0.00 -0.83 0.02 0.00 0.01 0.00 0.00 42.46 41.66 3gq9 s ILE 242 CO 0.15 0.31 -0.14 -0.62 0.00 0.00 0.00 174.94 174.64 3gq9 s ASP 243 N 1.47 2.35 -0.22 3.58 3.68 -0.29 -1.02 116.67 126.21 3gq9 s ASP 243 Ca -0.01 -0.40 -0.06 0.00 2.13 0.00 0.00 52.55 54.21 3gq9 s ASP 243 Cb -0.13 -1.04 -0.02 0.00 -1.45 0.00 0.00 42.92 40.28 3gq9 s ASP 243 CO -0.04 0.00 0.01 -0.63 0.13 0.00 0.00 175.17 174.65 3gq9 s ILE 244 N 1.02 3.92 0.29 4.11 -1.09 -0.36 -0.71 121.20 128.37 3gq9 s ILE 244 Ca -0.06 -0.31 0.00 0.00 -2.23 0.00 0.00 60.65 58.05 3gq9 s ILE 244 Cb -0.15 -2.80 -0.02 0.00 -1.58 0.00 0.00 42.46 37.91 3gq9 s ILE 244 CO -0.02 0.39 0.31 0.28 -1.23 0.00 0.00 174.94 174.68 3gq9 s THR 245 N 1.37 0.00 0.98 2.92 -1.32 0.87 0.01 115.64 120.48 3gq9 s THR 245 Ca 0.05 -1.83 -0.16 0.00 -1.21 0.00 0.00 61.69 58.53 3gq9 s THR 245 Cb -0.15 -2.51 0.21 0.00 -1.51 0.00 0.00 72.50 68.55 3gq9 s THR 245 CO 0.01 0.00 1.34 0.00 -2.21 0.00 0.00 174.62 173.76 3gq9 s GLY 247 N -4.93 2.84 0.00 0.00 0.00 -0.24 -3.85 107.32 101.15 3gq9 s GLY 247 Ca 0.75 1.20 0.00 0.00 0.00 0.00 0.00 44.72 46.67 3gq9 s GLY 247 CO 0.53 1.67 0.00 0.61 0.00 0.00 0.00 173.10 175.91 3gq9 n GLY 248 N 0.67 2.65 0.21 0.20 0.00 0.68 -4.91 105.19 104.68 3gq9 n GLY 248 Ca 0.11 -1.64 -0.14 0.00 0.00 0.00 0.00 46.02 44.36 3gq9 n GLY 248 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3gq9 h LEU 249 N 0.00 0.75-10.26 0.99 3.38 -1.89 -3.44 115.31 104.84 3gq9 h LEU 249 Ca 0.00 -0.48 -0.49 0.00 0.09 0.00 0.00 57.88 57.00 3gq9 h LEU 249 Cb 0.00 -0.22 0.05 0.00 0.09 0.00 0.00 40.66 40.58 3gq9 h LEU 249 CO 0.00 1.25 0.39 -1.81 0.09 0.00 0.00 178.44 178.36 3gq9 s ASP 250 N -7.03 6.21 0.09 -0.43 1.01 -1.26 -0.35 116.67 114.90 3gq9 s ASP 250 Ca -0.08 1.58 -0.24 0.00 0.71 0.00 0.00 52.55 54.52 3gq9 s ASP 250 Cb 0.10 -2.50 -0.07 0.00 1.01 0.00 0.00 42.92 41.46 3gq9 s ASP 250 CO 0.87 -0.87 0.72 -0.31 0.21 0.00 0.00 175.17 175.79 3gq9 s TYR 251 N -2.79 3.80 0.16 4.23 1.51 -1.26 -4.74 117.35 118.26 3gq9 s TYR 251 Ca 0.59 1.47 -0.28 0.00 -1.01 0.00 0.00 57.07 57.84 3gq9 s TYR 251 Cb -0.12 -2.73 -0.07 0.00 -0.11 0.00 0.00 41.96 38.93 3gq9 s TYR 251 CO 0.41 0.42 0.87 -1.25 -1.11 0.00 0.00 175.55 174.89 3gq9 s PRO 252 N -0.62 4.67 -0.64 -1.71 0.04 -1.26 -5.02 135.00 130.46 3gq9 s PRO 252 Ca 0.35 1.31 0.04 0.00 0.04 0.00 0.00 61.00 62.74 3gq9 s PRO 252 Cb -0.21 -3.31 0.16 0.00 0.04 0.00 0.00 34.50 31.17 3gq9 s PRO 252 CO 0.23 0.43 0.41 0.71 0.04 0.00 0.00 177.00 178.82 3gq9 s TYR 253 N -0.72 3.42 -2.79 0.56 1.51 -1.26 -4.92 117.35 113.16 3gq9 s TYR 253 Ca 0.40 -3.22 0.24 0.00 -1.01 0.00 0.00 57.07 53.48 3gq9 s TYR 253 Cb -0.24 -2.82 0.17 0.00 -0.11 0.00 0.00 41.96 38.97 3gq9 s TYR 253 CO 0.28 -0.65 1.24 1.28 -1.11 0.00 0.00 175.55 176.59 3gq9 n LEU 254 N 2.54 2.76 0.00 -1.29 4.77 -1.09 -4.91 117.00 119.78 3gq9 n LEU 254 Ca 0.13 -0.94 0.00 0.00 -0.03 0.00 0.00 56.01 55.18 3gq9 n LEU 254 Cb 0.34 -0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.43 3gq9 n LEU 254 CO 0.31 0.47 0.00 0.61 -1.33 0.00 0.00 177.39 177.45 3gq9 n GLY 255 N 1.36 1.52 3.73 -0.72 0.00 -0.20 -4.87 105.19 106.01 3gq9 n GLY 255 Ca 0.13 -1.86 -0.36 0.00 0.00 0.00 0.00 46.02 43.93 3gq9 n GLY 255 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3gq9 s ASP 256 N -0.50 4.58 -0.56 1.61 2.15 -1.26 -3.42 116.67 119.27 3gq9 s ASP 256 Ca 0.00 2.50 0.00 0.00 0.43 0.00 0.00 52.55 55.48 3gq9 s ASP 256 Cb 0.00 -2.61 0.00 0.00 -0.30 0.00 0.00 42.92 40.01 3gq9 s ASP 256 CO 0.00 -2.01 0.00 0.61 -0.17 0.00 0.00 175.17 173.60 3gq9 n GLY 257 N 0.68 0.69 3.62 2.66 0.00 -1.26 -4.86 105.19 106.72 3gq9 n GLY 257 Ca 0.15 -0.79 -0.25 0.00 0.00 0.00 0.00 46.02 45.13 3gq9 n GLY 257 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3gq9 s THR 258 N -2.22 2.51 -0.13 2.61 -4.23 -1.23 -5.09 115.64 107.86 3gq9 s THR 258 Ca 0.00 -2.00 -0.00 0.00 -1.18 0.00 0.00 61.69 58.51 3gq9 s THR 258 Cb 0.00 -2.79 0.03 0.00 1.34 0.00 0.00 72.50 71.08 3gq9 s THR 258 CO 0.00 -0.18 -0.10 -0.89 -0.54 0.00 0.00 174.62 172.91 3gq9 s THR 259 N -2.55 1.25 0.37 3.99 2.01 -1.26 -4.74 115.64 114.71 3gq9 s THR 259 Ca 0.35 -0.46 -0.26 0.00 0.31 0.00 0.00 61.69 61.63 3gq9 s THR 259 Cb 0.01 -1.24 -0.09 0.00 0.01 0.00 0.00 72.50 71.20 3gq9 s THR 259 CO 0.19 0.38 1.13 0.00 -0.69 0.00 0.00 174.62 175.63 3gq9 s ALA 260 N 1.61 3.20 0.82 7.40 0.00 -1.26 -5.01 121.76 128.51 3gq9 s ALA 260 Ca 0.05 0.89 -0.11 0.00 0.00 0.00 0.00 51.96 52.79 3gq9 s ALA 260 Cb -0.13 -3.34 0.09 0.00 0.00 0.00 0.00 23.12 19.73 3gq9 s ALA 260 CO -0.09 -0.38 1.12 -1.25 0.00 0.00 0.00 175.76 175.17 3gq9 s PRO 261 N -2.16 1.81 -1.12 0.00 0.04 -1.26 -4.30 135.00 128.01 3gq9 s PRO 261 Ca 0.54 1.38 -0.11 0.00 0.04 0.00 0.00 61.00 62.86 3gq9 s PRO 261 Cb -0.29 -1.83 -0.04 0.00 0.04 0.00 0.00 34.50 32.38 3gq9 s PRO 261 CO 0.37 -2.01 0.85 0.09 0.04 0.00 0.00 177.00 176.34 3gq9 n ASN 262 N -3.65 -5.38 -4.77 6.66 3.02 -1.26 -4.13 115.26 105.75 3gq9 n ASN 262 Ca 0.11 -0.83 -0.33 0.00 -0.03 0.00 0.00 54.58 53.49 3gq9 n ASN 262 Cb 0.52 -4.40 0.06 0.00 -0.61 0.00 0.00 39.78 35.36 3gq9 n ASN 262 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 3gq9 s PRO 263 N -5.20 2.67 0.55 3.52 0.04 -1.26 -1.07 135.00 134.24 3gq9 s PRO 263 Ca 0.40 1.36 -0.17 0.00 0.04 0.00 0.00 61.00 62.62 3gq9 s PRO 263 Cb -0.09 -1.94 -0.06 0.00 0.04 0.00 0.00 34.50 32.45 3gq9 s PRO 263 CO 0.79 -1.35 1.04 -1.12 0.04 0.00 0.00 177.00 176.40 3gq9 s SER 264 N -2.72 6.11 -0.21 6.66 0.01 -1.23 -4.21 113.70 118.10 3gq9 s SER 264 Ca 0.66 1.80 -0.19 0.00 1.31 0.00 0.00 55.95 59.53 3gq9 s SER 264 Cb -0.20 -2.54 0.06 0.00 0.21 0.00 0.00 66.02 63.55 3gq9 s SER 264 CO 0.44 -0.94 0.56 -0.70 0.41 0.00 0.00 173.24 173.01 3gq9 s GLU 265 N -3.83 0.65 -0.53 12.44 2.12 0.36 -1.76 118.70 128.16 3gq9 s GLU 265 Ca 0.64 0.80 -0.05 0.00 0.36 0.00 0.00 54.97 56.71 3gq9 s GLU 265 Cb -0.15 0.30 0.01 0.00 0.26 0.00 0.00 34.13 34.55 3gq9 s GLU 265 CO 0.31 -0.08 0.56 -1.71 -0.54 0.00 0.00 175.26 173.80 3gq9 n ASN 266 N 2.88 -7.00 -4.33 -1.70 5.15 -1.03 -1.39 115.26 107.84 3gq9 n ASN 266 Ca -0.14 0.14 -0.30 0.00 -0.60 0.00 0.00 54.58 53.68 3gq9 n ASN 266 Cb 0.56 -4.71 -0.15 0.00 -0.53 0.00 0.00 39.78 34.95 3gq9 n ASN 266 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 3gq9 s ILE 267 N -2.76 2.09 -0.07 -1.44 -1.09 -0.42 -1.67 121.20 115.84 3gq9 s ILE 267 Ca 0.08 -1.28 -0.00 0.00 -2.23 0.00 0.00 60.65 57.22 3gq9 s ILE 267 Cb -0.02 -1.77 0.02 0.00 -1.58 0.00 0.00 42.46 39.11 3gq9 s ILE 267 CO 0.64 0.44 -0.04 0.26 -1.23 0.00 0.00 174.94 175.02 3gq9 s TRP 268 N -0.73 0.94 -0.19 3.97 0.52 -0.28 -1.69 118.94 121.48 3gq9 s TRP 268 Ca 0.11 -0.35 0.01 0.00 0.02 0.00 0.00 56.10 55.89 3gq9 s TRP 268 Cb -0.10 -0.89 0.03 0.00 -1.15 0.00 0.00 33.47 31.36 3gq9 s TRP 268 CO 0.01 -0.34 -0.15 0.42 0.02 0.00 0.00 176.95 176.91 3gq9 s ILE 269 N 1.56 1.83 -0.02 2.03 1.01 -0.20 0.09 121.20 127.49 3gq9 s ILE 269 Ca -0.00 -0.96 -0.01 0.00 0.00 0.00 0.00 60.65 59.67 3gq9 s ILE 269 Cb -0.13 -1.77 0.01 0.00 0.01 0.00 0.00 42.46 40.58 3gq9 s ILE 269 CO -0.04 0.34 0.06 -1.61 0.00 0.00 0.00 174.94 173.69 3gq9 s GLU 270 N 1.35 0.04 -1.43 2.79 2.02 0.11 -0.89 118.70 122.69 3gq9 s GLU 270 Ca 0.02 0.13 -0.05 0.00 0.02 0.00 0.00 54.97 55.09 3gq9 s GLU 270 Cb -0.15 -0.06 0.02 0.00 0.10 0.00 0.00 34.13 34.05 3gq9 s GLU 270 CO -0.10 -0.06 0.42 0.09 0.02 0.00 0.00 175.26 175.63 3gq9 n ASN 271 N 3.45 -5.06 -4.96 -0.19 3.02 -0.58 -1.45 115.26 109.48 3gq9 n ASN 271 Ca -0.17 -0.22 -0.22 0.00 -0.03 0.00 0.00 54.58 53.93 3gq9 n ASN 271 Cb 0.57 -4.15 -0.02 0.00 -0.61 0.00 0.00 39.78 35.56 3gq9 n ASN 271 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3gq9 s GLU 273 N -3.80 0.97 -0.03 0.00 2.12 -0.27 -0.74 118.70 116.94 3gq9 s GLU 273 Ca 0.34 -0.43 0.01 0.00 0.36 0.00 0.00 54.97 55.25 3gq9 s GLU 273 Cb -0.10 -0.94 0.01 0.00 0.26 0.00 0.00 34.13 33.37 3gq9 s GLU 273 CO 0.29 0.26 -0.06 0.00 -0.54 0.00 0.00 175.26 175.21 3gq9 s ALA 274 N -0.29 0.67 0.15 6.30 0.00 -0.30 0.33 121.76 128.62 3gq9 s ALA 274 Ca 0.05 -0.13 -0.16 0.00 0.00 0.00 0.00 51.96 51.72 3gq9 s ALA 274 Cb -0.05 -0.35 0.03 0.00 0.00 0.00 0.00 23.12 22.75 3gq9 s ALA 274 CO -0.00 0.04 0.42 -0.08 0.00 0.00 0.00 175.76 176.14 3gq9 s THR 275 N 0.61 0.06 -1.43 0.00 -1.32 -0.46 -1.24 115.64 111.87 3gq9 s THR 275 Ca -0.08 -0.69 -0.08 0.00 -1.21 0.00 0.00 61.69 59.63 3gq9 s THR 275 Cb -0.12 -1.32 0.01 0.00 -1.51 0.00 0.00 72.50 69.57 3gq9 s THR 275 CO 0.00 -0.26 1.01 0.61 -2.21 0.00 0.00 174.62 173.77 3gq9 n GLY 276 N -0.25 -0.54 3.97 6.08 0.00 -0.30 -3.06 105.19 111.08 3gq9 n GLY 276 Ca -0.14 0.22 -0.21 0.00 0.00 0.00 0.00 46.02 45.89 3gq9 n GLY 276 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 3gq9 s PHE 277 N -3.28 3.30 -0.12 1.61 -0.71 -1.26 -1.31 117.98 116.21 3gq9 s PHE 277 Ca 0.51 0.05 0.17 0.00 -1.04 0.00 0.00 56.93 56.62 3gq9 s PHE 277 Cb -0.23 -1.95 -0.20 0.00 -1.21 0.00 0.00 43.02 39.43 3gq9 s PHE 277 CO 0.63 0.03 0.57 0.41 -1.34 0.00 0.00 175.22 175.53 3gq9 n GLY 278 N -1.72 -1.10 0.00 1.99 0.00 -0.08 -0.43 105.19 103.85 3gq9 n GLY 278 Ca -0.03 -0.22 0.00 0.00 0.00 0.00 0.00 46.02 45.77 3gq9 n GLY 278 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3gq9 n ASP 279 N -2.79 0.00 -4.47 1.61 4.64 -0.69 -4.61 116.55 110.25 3gq9 n ASP 279 Ca -0.16 0.00 -0.28 0.00 -1.38 0.00 0.00 54.79 52.98 3gq9 n ASP 279 Cb 0.91 0.00 -0.11 0.00 -1.04 0.00 0.00 41.12 40.87 3gq9 n ASP 279 CO 0.00 0.00 0.00 -1.81 -0.82 0.00 0.00 177.20 174.57 3gq9 s ASP 280 N 1.00 3.71 -0.01 1.67 1.01 -1.26 -3.35 116.67 119.43 3gq9 s ASP 280 Ca 0.00 -0.72 -0.09 0.00 0.71 0.00 0.00 52.55 52.45 3gq9 s ASP 280 Cb 0.00 -0.42 -0.05 0.00 1.01 0.00 0.00 42.92 43.46 3gq9 s ASP 280 CO 0.00 0.14 0.60 1.23 0.21 0.00 0.00 175.17 177.35 3gq9 h GLY 281 N 3.34 -0.34 -5.94 0.21 0.00 -1.16 -2.52 103.07 96.66 3gq9 h GLY 281 Ca -0.48 0.12 -0.57 0.00 0.00 0.00 0.00 47.33 46.41 3gq9 h GLY 281 CO 0.48 -0.12 -0.83 -0.42 0.00 0.00 0.00 176.54 175.64 3gq9 s ILE 282 N -2.79 1.41 0.01 2.60 1.01 -0.67 -1.33 121.20 121.45 3gq9 s ILE 282 Ca -0.05 -0.60 -0.03 0.00 0.00 0.00 0.00 60.65 59.97 3gq9 s ILE 282 Cb 0.00 -1.29 -0.01 0.00 0.01 0.00 0.00 42.46 41.18 3gq9 s ILE 282 CO 0.14 0.42 0.04 0.28 0.00 0.00 0.00 174.94 175.82 3gq9 s THR 283 N 0.89 0.10 0.00 2.92 -1.32 -0.19 -1.18 115.64 116.86 3gq9 s THR 283 Ca -0.09 -0.84 0.06 0.00 -1.21 0.00 0.00 61.69 59.61 3gq9 s THR 283 Cb -0.15 -0.35 -0.02 0.00 -1.51 0.00 0.00 72.50 70.47 3gq9 s THR 283 CO 0.00 -0.46 -0.18 0.42 -2.21 0.00 0.00 174.62 172.19 3gq9 s THR 284 N -1.48 1.46 -0.01 5.08 -4.23 -0.56 -1.23 115.64 114.67 3gq9 s THR 284 Ca -0.15 -0.89 0.01 0.00 -1.18 0.00 0.00 61.69 59.47 3gq9 s THR 284 Cb -0.09 -1.23 0.01 0.00 1.34 0.00 0.00 72.50 72.53 3gq9 s THR 284 CO -0.00 0.32 -0.02 -1.00 -0.54 0.00 0.00 174.62 173.38 3gq9 s HIS 285 N -0.55 0.30 -1.42 3.99 3.76 0.10 -1.11 115.29 120.37 3gq9 s HIS 285 Ca 0.07 -0.04 -0.11 0.00 -0.15 0.00 0.00 55.06 54.82 3gq9 s HIS 285 Cb -0.07 -0.25 0.08 0.00 1.11 0.00 0.00 32.58 33.45 3gq9 s HIS 285 CO 0.00 -0.04 0.65 0.72 -0.85 0.00 0.00 174.74 175.22 3gq9 n HIS 286 N 3.31 -1.91 -4.07 1.40 8.25 0.85 -3.41 115.22 119.65 3gq9 n HIS 286 Ca -0.17 0.62 -0.10 0.00 -0.26 0.00 0.00 57.72 57.81 3gq9 n HIS 286 Cb 0.56 -3.28 -0.08 0.00 1.12 0.00 0.00 29.99 28.31 3gq9 n HIS 286 CO 0.00 0.00 0.00 -1.12 0.64 0.00 0.00 176.34 175.86 3gq9 s SER 287 N -2.92 0.15 0.06 0.41 0.01 -1.22 -4.02 113.70 106.17 3gq9 s SER 287 Ca 0.50 -1.08 -0.14 0.00 1.31 0.00 0.00 55.95 56.55 3gq9 s SER 287 Cb -0.26 0.38 0.02 0.00 0.21 0.00 0.00 66.02 66.37 3gq9 s SER 287 CO 0.62 -0.84 0.31 0.00 0.41 0.00 0.00 173.24 173.74 3gq9 s GLN 288 N -4.03 0.85 -0.52 12.44 -2.07 -0.72 -1.75 119.66 123.85 3gq9 s GLN 288 Ca 0.23 -0.56 -0.00 0.00 -1.82 0.00 0.00 55.36 53.21 3gq9 s GLN 288 Cb 0.05 0.36 0.00 0.00 -1.09 0.00 0.00 33.01 32.34 3gq9 s GLN 288 CO 0.03 -0.28 0.50 0.66 -1.32 0.00 0.00 175.29 174.88 3gq9 n TYR 289 N 0.43 -2.15 -4.28 9.60 0.53 -0.59 -2.60 117.16 118.11 3gq9 n TYR 289 Ca -0.18 0.82 -0.20 0.00 -1.02 0.00 0.00 57.90 57.32 3gq9 n TYR 289 Cb 0.60 -3.37 -0.16 0.00 -1.03 0.00 0.00 39.34 35.38 3gq9 n TYR 289 CO 0.00 0.00 0.00 0.42 -1.02 0.00 0.00 176.86 176.26 3gq9 s ILE 290 N -2.98 0.66 -0.14 -0.72 1.01 -0.99 -1.30 121.20 116.73 3gq9 s ILE 290 Ca 0.00 -0.24 0.02 0.00 0.00 0.00 0.00 60.65 60.44 3gq9 s ILE 290 Cb -0.00 -0.63 0.01 0.00 0.01 0.00 0.00 42.46 41.84 3gq9 s ILE 290 CO 0.54 0.23 -0.20 0.20 0.00 0.00 0.00 174.94 175.71 3gq9 s ASN 291 N 0.58 3.26 -0.26 3.58 0.01 -0.68 -0.87 114.94 120.56 3gq9 s ASN 291 Ca -0.08 -0.56 0.00 0.00 -0.71 0.00 0.00 52.86 51.51 3gq9 s ASN 291 Cb -0.12 -1.47 0.04 0.00 0.41 0.00 0.00 41.25 40.11 3gq9 s ASN 291 CO 0.01 0.09 -0.08 -0.63 -1.51 0.00 0.00 177.10 174.98 3gq9 s ILE 292 N 0.76 2.54 -0.05 0.60 1.01 0.54 -1.03 121.20 125.58 3gq9 s ILE 292 Ca -0.08 -1.35 0.02 0.00 0.00 0.00 0.00 60.65 59.24 3gq9 s ILE 292 Cb -0.16 -2.39 0.01 0.00 0.01 0.00 0.00 42.46 39.94 3gq9 s ILE 292 CO -0.00 0.07 -0.10 -0.76 0.00 0.00 0.00 174.94 174.14 3gq9 s LEU 293 N 1.21 1.64 -1.54 2.97 1.43 -0.07 -1.21 118.68 123.12 3gq9 s LEU 293 Ca -0.04 -0.23 -0.04 0.00 -1.03 0.00 0.00 54.13 52.79 3gq9 s LEU 293 Cb -0.18 -0.67 0.01 0.00 0.03 0.00 0.00 46.19 45.38 3gq9 s LEU 293 CO -0.05 0.03 0.41 0.59 0.23 0.00 0.00 176.35 177.57 3gq9 n ASN 294 N 3.66 -5.62 -4.97 2.29 3.02 -0.77 -1.53 115.26 111.33 3gq9 n ASN 294 Ca -0.22 -0.20 -0.21 0.00 -0.03 0.00 0.00 54.58 53.92 3gq9 n ASN 294 Cb 0.52 -4.60 -0.01 0.00 -0.61 0.00 0.00 39.78 35.08 3gq9 n ASN 294 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3gq9 s TYR 296 N -2.09 1.56 -0.12 0.00 5.04 0.08 -1.08 117.35 120.73 3gq9 s TYR 296 Ca 0.39 -0.91 0.03 0.00 -2.44 0.00 0.00 57.07 54.13 3gq9 s TYR 296 Cb -0.09 -1.26 0.01 0.00 0.35 0.00 0.00 41.96 40.97 3gq9 s TYR 296 CO 0.31 -0.57 -0.20 -1.12 -1.34 0.00 0.00 175.55 172.63 3gq9 s SER 297 N 1.68 2.88 0.07 4.32 0.01 -0.71 -1.15 113.70 120.80 3gq9 s SER 297 Ca 0.03 -0.54 -0.21 0.00 1.31 0.00 0.00 55.95 56.54 3gq9 s SER 297 Cb -0.14 -1.32 0.05 0.00 0.21 0.00 0.00 66.02 64.82 3gq9 s SER 297 CO -0.08 0.08 0.49 -1.38 0.41 0.00 0.00 173.24 172.76 3gq9 s HIS 298 N 0.77 -0.38 -0.62 2.43 -3.43 -0.37 -1.70 115.29 111.99 3gq9 s HIS 298 Ca -0.09 0.34 -0.09 0.00 -0.80 0.00 0.00 55.06 54.42 3gq9 s HIS 298 Cb -0.16 0.33 0.01 0.00 -1.43 0.00 0.00 32.58 31.33 3gq9 s HIS 298 CO 0.00 -0.66 0.65 -0.25 -2.00 0.00 0.00 174.74 172.49 3gq9 n ASP 299 N 0.27 -7.31 -4.75 7.38 8.00 -0.52 -3.64 116.55 115.98 3gq9 n ASP 299 Ca -0.18 0.01 -0.33 0.00 0.71 0.00 0.00 54.79 55.01 3gq9 n ASP 299 Cb 0.61 -4.60 0.08 0.00 -0.02 0.00 0.00 41.12 37.19 3gq9 n ASP 299 CO 0.00 0.00 0.00 -2.84 -0.39 0.00 0.00 177.20 173.97 3gq9 s PRO 300 N -3.06 2.38 0.17 -0.24 0.02 -1.26 -1.15 135.00 131.86 3gq9 s PRO 300 Ca 0.11 1.47 -0.04 0.00 0.02 0.00 0.00 61.00 62.57 3gq9 s PRO 300 Cb -0.03 -1.89 0.05 0.00 0.02 0.00 0.00 34.50 32.65 3gq9 s PRO 300 CO 0.79 -1.59 1.45 0.00 -0.33 0.00 0.00 177.00 177.31 3gq9 h ARG 301 N -0.40 0.54 -6.40 5.54 3.08 -0.99 -3.45 114.38 112.30 3gq9 h ARG 301 Ca -0.46 -0.39 -0.46 0.00 0.07 0.00 0.00 59.98 58.73 3gq9 h ARG 301 Cb 1.26 0.06 0.01 0.00 0.08 0.00 0.00 29.97 31.38 3gq9 h ARG 301 CO 0.51 1.01 -0.25 -0.51 -1.07 0.00 0.00 179.97 179.67 3gq9 s LEU 302 N -8.22 3.39 -0.15 3.04 1.43 -1.25 -5.01 118.68 111.91 3gq9 s LEU 302 Ca -0.07 -0.66 0.14 0.00 -1.03 0.00 0.00 54.13 52.51 3gq9 s LEU 302 Cb 0.11 -2.17 0.38 0.00 0.03 0.00 0.00 46.19 44.54 3gq9 s LEU 302 CO 0.85 -0.91 1.19 0.35 0.23 0.00 0.00 176.35 178.06 3gq9 n THR 303 N -1.88 1.70 -0.16 5.49 -2.24 -1.26 -4.86 114.28 111.06 3gq9 n THR 303 Ca 0.08 -2.57 0.00 0.00 -2.27 0.00 0.00 64.05 59.29 3gq9 n THR 303 Cb 0.61 -0.01 0.00 0.00 -2.10 0.00 0.00 70.33 68.83 3gq9 n THR 303 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3gq9 n ALA 304 N -0.86 0.00 -1.55 6.98 0.00 -1.26 -1.16 120.51 122.65 3gq9 n ALA 304 Ca 0.16 0.00 -0.41 0.00 0.00 0.00 0.00 53.44 53.19 3gq9 n ALA 304 Cb 0.76 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 20.19 3gq9 n ALA 304 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 3gq9 n ASN 305 N 0.00 4.77 -4.26 0.00 5.15 -1.26 -4.14 115.26 115.52 3gq9 n ASN 305 Ca 0.00 -2.75 -0.40 0.00 -0.60 0.00 0.00 54.58 50.83 3gq9 n ASN 305 Cb 0.00 -1.56 -0.10 0.00 -0.53 0.00 0.00 39.78 37.59 3gq9 n ASN 305 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3gq9 s ASN 307 N 2.14 4.58 -0.01 0.00 0.01 -1.21 -0.75 114.94 119.70 3gq9 s ASN 307 Ca 0.03 -0.48 -0.23 0.00 -0.71 0.00 0.00 52.86 51.47 3gq9 s ASN 307 Cb -0.23 -0.90 -0.15 0.00 0.41 0.00 0.00 41.25 40.38 3gq9 s ASN 307 CO 0.02 0.08 1.05 1.23 -1.51 0.00 0.00 177.10 177.98 3gq9 h GLY 308 N 2.69 -0.48 -6.26 0.66 0.00 -1.19 -1.18 103.07 97.30 3gq9 h GLY 308 Ca -0.47 0.18 -0.56 0.00 0.00 0.00 0.00 47.33 46.49 3gq9 h GLY 308 CO 0.57 -0.18 -0.82 -1.36 0.00 0.00 0.00 176.54 174.75 3gq9 s PHE 309 N -4.20 1.76 -0.31 5.60 0.40 -0.46 -1.67 117.98 119.09 3gq9 s PHE 309 Ca -0.13 -0.86 0.02 0.00 -0.60 0.00 0.00 56.93 55.36 3gq9 s PHE 309 Cb 0.01 -1.33 0.09 0.00 0.51 0.00 0.00 43.02 42.30 3gq9 s PHE 309 CO 0.47 -0.50 0.04 -2.00 0.70 0.00 0.00 175.22 173.94 3gq9 s GLU 310 N 1.28 1.30 -0.69 0.44 2.56 -0.33 -0.43 118.70 122.84 3gq9 s GLU 310 Ca -0.02 -1.51 -0.19 0.00 0.00 0.00 0.00 54.97 53.26 3gq9 s GLU 310 Cb -0.14 -2.76 0.12 0.00 2.00 0.00 0.00 34.13 33.36 3gq9 s GLU 310 CO -0.05 -0.89 0.81 0.42 -0.56 0.00 0.00 175.26 174.99 3gq9 s ILE 311 N 1.18 4.86 0.10 -3.70 -1.09 0.74 -1.49 121.20 121.81 3gq9 s ILE 311 Ca 0.08 -1.24 0.01 0.00 -2.23 0.00 0.00 60.65 57.27 3gq9 s ILE 311 Cb -0.18 -4.56 0.01 0.00 -1.58 0.00 0.00 42.46 36.14 3gq9 s ILE 311 CO -0.13 -1.21 0.05 -0.67 -1.23 0.00 0.00 174.94 171.76 3gq9 n ASP 312 N 6.18 1.64 0.00 3.58 -0.08 -0.26 -1.23 116.55 126.37 3gq9 n ASP 312 Ca -0.00 -1.39 0.00 0.00 -1.51 0.00 0.00 54.79 51.89 3gq9 n ASP 312 Cb 0.44 0.02 0.00 0.00 2.34 0.00 0.00 41.12 43.92 3gq9 n ASP 312 CO 0.00 0.00 0.00 0.47 0.12 0.00 0.00 177.20 177.79 3gq9 n ASP 313 N -1.68 0.00 0.00 1.67 8.00 -1.19 -1.32 116.55 122.02 3gq9 n ASP 313 Ca -0.02 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.48 3gq9 n ASP 313 Cb 0.12 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.22 3gq9 n ASP 313 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3gq9 n GLY 314 N 0.00 1.57 3.76 0.44 0.00 -0.09 -0.10 105.19 110.77 3gq9 n GLY 314 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.67 3gq9 n GLY 314 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3gq9 s SER 315 N -3.28 5.33 -0.02 1.61 0.01 -0.44 -3.29 113.70 113.62 3gq9 s SER 315 Ca 0.00 2.20 -0.29 0.00 1.31 0.00 0.00 55.95 59.17 3gq9 s SER 315 Cb 0.00 -2.58 0.08 0.00 0.21 0.00 0.00 66.02 63.73 3gq9 s SER 315 CO 0.00 -1.49 0.72 0.00 0.41 0.00 0.00 173.24 172.88 3gq9 s ARG 316 N -3.54 1.02 -0.94 12.44 3.03 -0.72 -1.95 118.95 128.29 3gq9 s ARG 316 Ca 0.73 0.06 -0.05 0.00 2.03 0.00 0.00 55.73 58.50 3gq9 s ARG 316 Cb -0.25 0.48 -0.06 0.00 -1.03 0.00 0.00 34.95 34.09 3gq9 s ARG 316 CO 0.33 -0.36 0.82 0.72 -1.13 0.00 0.00 175.30 175.69 3gq9 n HIS 317 N 0.55 -2.16 -5.18 5.89 8.25 -0.76 -3.30 115.22 118.50 3gq9 n HIS 317 Ca -0.17 0.77 -0.30 0.00 -0.26 0.00 0.00 57.72 57.76 3gq9 n HIS 317 Cb 0.59 -4.02 -0.16 0.00 1.12 0.00 0.00 29.99 27.52 3gq9 n HIS 317 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 3gq9 s VAL 318 N -3.34 1.90 -0.14 1.59 1.01 -1.19 -1.54 120.40 118.70 3gq9 s VAL 318 Ca 0.37 -1.00 -0.00 0.00 0.00 0.00 0.00 61.98 61.35 3gq9 s VAL 318 Cb -0.05 -1.59 -0.01 0.00 0.00 0.00 0.00 36.38 34.73 3gq9 s VAL 318 CO 0.65 0.53 -0.13 -0.69 0.00 0.00 0.00 175.10 175.47 3gq9 s VAL 319 N -0.30 3.00 -0.12 2.92 1.01 -0.05 -1.08 120.40 125.78 3gq9 s VAL 319 Ca 0.02 -0.67 -0.01 0.00 0.00 0.00 0.00 61.98 61.31 3gq9 s VAL 319 Cb -0.12 -2.26 -0.02 0.00 0.00 0.00 0.00 36.38 33.98 3gq9 s VAL 319 CO 0.02 0.52 -0.10 -0.76 0.00 0.00 0.00 175.10 174.78 3gq9 s LEU 320 N 0.45 2.92 -0.11 3.92 1.02 -0.13 -0.33 118.68 126.42 3gq9 s LEU 320 Ca -0.10 -0.23 -0.07 0.00 0.02 0.00 0.00 54.13 53.76 3gq9 s LEU 320 Cb -0.16 -1.66 0.04 0.00 0.02 0.00 0.00 46.19 44.43 3gq9 s LEU 320 CO 0.05 0.20 0.26 -0.55 0.02 0.00 0.00 176.35 176.33 3gq9 s SER 321 N 0.15 -0.28 -1.84 2.29 0.15 -0.35 0.07 113.70 113.88 3gq9 s SER 321 Ca -0.05 0.54 0.00 0.00 0.70 0.00 0.00 55.95 57.14 3gq9 s SER 321 Cb -0.14 0.47 0.00 0.00 -1.71 0.00 0.00 66.02 64.64 3gq9 s SER 321 CO 0.04 -0.14 0.00 0.59 1.20 0.00 0.00 173.24 174.93 3gq9 n ASN 322 N 3.74 -5.68 -4.92 5.45 3.02 -0.74 -1.85 115.26 114.28 3gq9 n ASN 322 Ca -0.20 0.12 -0.27 0.00 -0.03 0.00 0.00 54.58 54.20 3gq9 n ASN 322 Cb 0.55 -4.80 0.06 0.00 -0.61 0.00 0.00 39.78 34.98 3gq9 n ASN 322 CO 0.00 0.00 0.00 0.20 -2.62 0.00 0.00 177.26 174.84 3gq9 s ASN 323 N -2.22 5.11 -0.01 6.41 0.01 -1.26 -3.44 114.94 119.54 3gq9 s ASN 323 Ca 0.00 0.63 0.04 0.00 -0.71 0.00 0.00 52.86 52.81 3gq9 s ASN 323 Cb 0.00 -1.39 -0.01 0.00 0.41 0.00 0.00 41.25 40.26 3gq9 s ASN 323 CO 0.00 -1.42 -0.12 -0.60 -1.51 0.00 0.00 177.10 173.45 3gq9 s ARG 324 N -5.20 1.02 0.12 -0.60 3.52 -0.24 -2.12 118.95 115.45 3gq9 s ARG 324 Ca 0.58 -0.42 0.09 0.00 -0.13 0.00 0.00 55.73 55.85 3gq9 s ARG 324 Cb -0.11 -0.97 -0.04 0.00 -1.56 0.00 0.00 34.95 32.27 3gq9 s ARG 324 CO 0.46 0.23 -0.18 -1.54 -0.81 0.00 0.00 175.30 173.46 3gq9 s SER 325 N -0.17 3.90 -0.11 -2.12 1.04 -0.53 -1.73 113.70 113.97 3gq9 s SER 325 Ca 0.03 -0.57 -0.06 0.00 0.48 0.00 0.00 55.95 55.84 3gq9 s SER 325 Cb -0.06 -0.55 0.05 0.00 0.10 0.00 0.00 66.02 65.56 3gq9 s SER 325 CO -0.00 0.17 0.26 -0.75 0.98 0.00 0.00 173.24 173.90 3gq9 s LYS 326 N -2.19 0.21 -0.80 4.02 2.20 -0.69 -1.04 119.74 121.46 3gq9 s LYS 326 Ca 0.18 0.58 -0.00 0.00 -0.36 0.00 0.00 55.97 56.37 3gq9 s LYS 326 Cb -0.10 -0.10 0.00 0.00 -1.51 0.00 0.00 37.83 36.11 3gq9 s LYS 326 CO 0.10 -0.18 0.02 0.41 -0.36 0.00 0.00 175.35 175.35 3gq9 n GLY 327 N 4.38 -0.01 2.83 5.54 0.00 -0.53 -1.44 105.19 115.96 3gq9 n GLY 327 Ca -0.23 -0.48 -0.18 0.00 0.00 0.00 0.00 46.02 45.13 3gq9 n GLY 327 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3gq9 n TYR 329 N -1.55 0.00 -3.36 0.00 9.36 0.07 -1.76 117.16 119.92 3gq9 n TYR 329 Ca 0.01 0.00 -0.38 0.00 3.32 0.00 0.00 57.90 60.85 3gq9 n TYR 329 Cb 0.46 -0.20 -0.06 0.00 -0.63 0.00 0.00 39.34 38.91 3gq9 n TYR 329 CO 0.00 0.00 0.00 0.20 0.22 0.00 0.00 176.86 177.28 3gq9 s GLY 330 N -1.10 2.58 -0.01 2.98 0.00 -1.26 -0.54 107.32 109.97 3gq9 s GLY 330 Ca 0.00 -0.07 -0.02 0.00 0.00 0.00 0.00 44.72 44.63 3gq9 s GLY 330 CO 0.00 0.31 0.33 -1.33 0.00 0.00 0.00 173.10 172.42 3gq9 h GLY 331 N 4.42 -0.09 -6.81 0.20 0.00 -0.75 -1.06 103.07 98.98 3gq9 h GLY 331 Ca -0.50 0.03 -0.66 0.00 0.00 0.00 0.00 47.33 46.20 3gq9 h GLY 331 CO 0.63 -0.03 -0.74 -0.42 0.00 0.00 0.00 176.54 175.98 3gq9 s ILE 332 N -1.85 3.12 -0.17 2.60 1.01 -0.27 -1.35 121.20 124.29 3gq9 s ILE 332 Ca -0.01 -0.68 -0.07 0.00 0.00 0.00 0.00 60.65 59.89 3gq9 s ILE 332 Cb 0.00 -2.46 -0.04 0.00 0.01 0.00 0.00 42.46 39.97 3gq9 s ILE 332 CO 0.04 0.37 0.05 -0.70 0.00 0.00 0.00 174.94 174.70 3gq9 s GLU 333 N 1.42 3.84 -0.22 2.79 2.12 0.43 -1.65 118.70 127.44 3gq9 s GLU 333 Ca 0.04 -0.35 0.02 0.00 0.36 0.00 0.00 54.97 55.04 3gq9 s GLU 333 Cb -0.15 -3.15 0.04 0.00 0.26 0.00 0.00 34.13 31.13 3gq9 s GLU 333 CO -0.04 0.33 -0.16 0.42 -0.54 0.00 0.00 175.26 175.27 3gq9 s ILE 334 N 0.19 2.08 0.17 -3.70 1.01 -0.69 -0.18 121.20 120.08 3gq9 s ILE 334 Ca 0.04 -1.24 -0.06 0.00 0.00 0.00 0.00 60.65 59.38 3gq9 s ILE 334 Cb -0.12 -2.03 0.03 0.00 0.01 0.00 0.00 42.46 40.34 3gq9 s ILE 334 CO 0.01 0.28 0.34 2.29 0.00 0.00 0.00 174.94 177.85 3gq9 n LYS 335 N 4.54 0.48 -3.83 2.79 2.85 -0.37 -1.47 118.16 123.16 3gq9 n LYS 335 Ca -0.18 -0.95 -0.10 0.00 -1.05 0.00 0.00 58.31 56.04 3gq9 n LYS 335 Cb 0.46 1.19 -0.07 0.00 -0.65 0.00 0.00 35.03 35.96 3gq9 n LYS 335 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 3gq9 s ALA 336 N -1.46 -0.35 1.02 0.58 0.00 -1.20 -2.46 121.76 117.88 3gq9 s ALA 336 Ca 0.07 -0.43 -0.12 0.00 0.00 0.00 0.00 51.96 51.47 3gq9 s ALA 336 Cb -0.02 0.43 0.20 0.00 0.00 0.00 0.00 23.12 23.73 3gq9 s ALA 336 CO 0.05 -0.47 1.08 -1.01 0.00 0.00 0.00 175.76 175.40 3gq9 s HIS 337 N -3.41 1.88 0.34 0.00 3.76 -1.26 -1.66 115.29 114.93 3gq9 s HIS 337 Ca 0.01 1.20 0.03 0.00 -0.15 0.00 0.00 55.06 56.15 3gq9 s HIS 337 Cb 0.03 -3.19 0.61 0.00 1.11 0.00 0.00 32.58 31.14 3gq9 s HIS 337 CO -0.09 -3.07 1.95 0.78 -0.85 0.00 0.00 174.74 173.47 3gq9 h GLY 338 N -2.04 0.79 -3.92 -2.22 0.00 -1.91 -2.99 103.07 90.78 3gq9 h GLY 338 Ca -0.54 -0.36 -0.58 0.00 0.00 0.00 0.00 47.33 45.85 3gq9 h GLY 338 CO 0.53 0.34 0.75 1.22 0.00 0.00 0.00 176.54 179.38 3gq9 n ASP 339 N -4.38 6.14 -3.65 0.19 8.00 -1.26 -4.53 116.55 117.06 3gq9 n ASP 339 Ca 0.04 -3.64 -0.12 0.00 0.71 0.00 0.00 54.79 51.79 3gq9 n ASP 339 Cb 0.12 -0.93 -0.05 0.00 -0.02 0.00 0.00 41.12 40.24 3gq9 n ASP 339 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3gq9 s ALA 340 N -3.42 -0.97 0.20 2.24 0.00 -1.13 -1.03 121.76 117.65 3gq9 s ALA 340 Ca 0.58 0.13 -0.30 0.00 0.00 0.00 0.00 51.96 52.37 3gq9 s ALA 340 Cb 0.47 0.52 -0.08 0.00 0.00 0.00 0.00 23.12 24.03 3gq9 s ALA 340 CO 0.03 -0.55 1.01 -1.25 0.00 0.00 0.00 175.76 175.00 3gq9 s PRO 341 N -3.15 4.72 0.57 0.00 0.04 -1.22 -4.06 135.00 131.89 3gq9 s PRO 341 Ca -0.01 1.58 -0.19 0.00 0.04 0.00 0.00 61.00 62.42 3gq9 s PRO 341 Cb 0.01 -3.29 -0.04 0.00 0.04 0.00 0.00 34.50 31.21 3gq9 s PRO 341 CO -0.07 0.28 1.20 0.00 0.04 0.00 0.00 177.00 178.45 3gq9 s ALA 342 N -0.64 2.63 0.35 8.56 0.00 -1.26 -0.91 121.76 130.49 3gq9 s ALA 342 Ca 0.45 0.99 -0.28 0.00 0.00 0.00 0.00 51.96 53.12 3gq9 s ALA 342 Cb -0.27 -3.44 -0.12 0.00 0.00 0.00 0.00 23.12 19.29 3gq9 s ALA 342 CO 0.33 -1.05 1.32 0.00 0.00 0.00 0.00 175.76 176.37 3gq9 n ALA 343 N -1.40 1.48 -2.63 0.00 0.00 -1.03 -4.52 120.51 112.42 3gq9 n ALA 343 Ca 0.12 0.36 -0.11 0.00 0.00 0.00 0.00 53.44 53.81 3gq9 n ALA 343 Cb 0.49 -2.28 -0.11 0.00 0.00 0.00 0.00 19.45 17.55 3gq9 n ALA 343 CO 0.00 0.00 0.00 1.52 0.00 0.00 0.00 177.50 179.02 3gq9 s TYR 344 N -1.10 0.64 -0.86 0.00 1.13 -0.82 -4.35 117.35 111.98 3gq9 s TYR 344 Ca 0.55 -0.67 -0.03 0.00 -1.41 0.00 0.00 57.07 55.51 3gq9 s TYR 344 Cb -0.55 -0.39 -0.02 0.00 -1.10 0.00 0.00 41.96 39.89 3gq9 s TYR 344 CO 0.62 -0.15 0.77 -1.71 -2.51 0.00 0.00 175.55 172.57 3gq9 n ASN 345 N 0.97 -7.16 -4.30 -0.18 5.15 -0.66 -2.30 115.26 106.77 3gq9 n ASN 345 Ca -0.19 -0.37 -0.31 0.00 -0.60 0.00 0.00 54.58 53.10 3gq9 n ASN 345 Cb 0.57 -4.99 -0.16 0.00 -0.53 0.00 0.00 39.78 34.67 3gq9 n ASN 345 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 3gq9 s ILE 346 N -3.15 2.16 -0.08 -1.44 -1.09 -0.76 -1.83 121.20 115.01 3gq9 s ILE 346 Ca 0.17 -1.04 0.04 0.00 -2.23 0.00 0.00 60.65 57.59 3gq9 s ILE 346 Cb -0.03 -1.78 -0.01 0.00 -1.58 0.00 0.00 42.46 39.07 3gq9 s ILE 346 CO 0.76 0.57 -0.23 -0.55 -1.23 0.00 0.00 174.94 174.26 3gq9 s SER 347 N -0.33 3.19 -0.33 3.58 0.15 -0.24 -1.56 113.70 118.17 3gq9 s SER 347 Ca 0.02 -0.51 -0.01 0.00 0.70 0.00 0.00 55.95 56.14 3gq9 s SER 347 Cb -0.12 -1.19 0.07 0.00 -1.71 0.00 0.00 66.02 63.06 3gq9 s SER 347 CO 0.02 0.20 0.05 -0.63 1.20 0.00 0.00 173.24 174.08 3gq9 s ILE 348 N 0.12 2.95 -1.08 6.45 1.01 0.21 -0.96 121.20 129.90 3gq9 s ILE 348 Ca -0.11 -1.64 -0.04 0.00 0.00 0.00 0.00 60.65 58.85 3gq9 s ILE 348 Cb -0.16 -2.82 0.31 0.00 0.01 0.00 0.00 42.46 39.80 3gq9 s ILE 348 CO 0.06 -0.29 1.57 -3.20 0.00 0.00 0.00 174.94 173.08 3gq9 n ASN 349 N 4.57 6.58 0.00 3.58 5.15 0.11 -0.84 115.26 134.41 3gq9 n ASN 349 Ca -0.09 -3.46 0.00 0.00 -0.60 0.00 0.00 54.58 50.43 3gq9 n ASN 349 Cb 0.43 -1.26 0.00 0.00 -0.53 0.00 0.00 39.78 38.42 3gq9 n ASN 349 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 3gq9 n GLY 350 N 1.11 -1.01 3.50 8.20 0.00 -0.13 -3.51 105.19 113.35 3gq9 n GLY 350 Ca 0.30 -1.27 -0.17 0.00 0.00 0.00 0.00 46.02 44.88 3gq9 n GLY 350 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 3gq9 s HIS 351 N -1.28 -0.63 -0.16 1.61 2.46 -1.06 -1.79 115.29 114.43 3gq9 s HIS 351 Ca 0.00 0.95 0.01 0.00 0.47 0.00 0.00 55.06 56.49 3gq9 s HIS 351 Cb 0.00 0.44 0.02 0.00 -0.13 0.00 0.00 32.58 32.91 3gq9 s HIS 351 CO 0.00 -0.66 -0.18 1.41 -2.47 0.00 0.00 174.74 172.85 3gq9 s MET 352 N -1.73 2.67 -0.20 2.88 1.75 -0.90 -0.96 119.30 122.81 3gq9 s MET 352 Ca -0.08 -0.71 -0.04 0.00 -1.25 0.00 0.00 55.69 53.61 3gq9 s MET 352 Cb -0.00 -2.34 -0.02 0.00 2.84 0.00 0.00 34.83 35.31 3gq9 s MET 352 CO 0.05 -0.20 -0.04 0.45 -0.65 0.00 0.00 175.02 174.64 3gq9 s SER 353 N 1.32 4.50 -0.23 1.11 0.15 -0.28 -1.45 113.70 118.82 3gq9 s SER 353 Ca 0.03 -0.30 0.00 0.00 0.70 0.00 0.00 55.95 56.39 3gq9 s SER 353 Cb -0.13 -1.76 0.03 0.00 -1.71 0.00 0.00 66.02 62.45 3gq9 s SER 353 CO -0.11 0.04 -0.12 -0.69 1.20 0.00 0.00 173.24 173.57 3gq9 s VAL 354 N 1.11 2.46 -1.43 4.45 1.01 -0.21 -0.70 120.40 127.09 3gq9 s VAL 354 Ca 0.02 -1.13 -0.11 0.00 0.00 0.00 0.00 61.98 60.75 3gq9 s VAL 354 Cb -0.15 -2.23 0.08 0.00 0.00 0.00 0.00 36.38 34.09 3gq9 s VAL 354 CO 0.00 0.25 0.67 -0.62 0.00 0.00 0.00 175.10 175.41 3gq9 n GLU 355 N 4.60 -4.04 -2.04 2.72 1.02 0.18 -1.46 120.64 121.62 3gq9 n GLU 355 Ca -0.17 0.53 -0.28 0.00 -0.02 0.00 0.00 57.16 57.22 3gq9 n GLU 355 Cb 0.47 -5.30 0.08 0.00 -0.02 0.00 0.00 31.44 26.66 3gq9 n GLU 355 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 3gq9 s ASP 356 N -2.94 4.73 -0.13 1.62 1.01 -1.26 -3.12 116.67 116.59 3gq9 s ASP 356 Ca 0.51 0.67 -0.22 0.00 0.71 0.00 0.00 52.55 54.22 3gq9 s ASP 356 Cb -0.26 -1.27 -0.20 0.00 1.01 0.00 0.00 42.92 42.20 3gq9 s ASP 356 CO 0.63 -1.71 0.61 0.58 0.21 0.00 0.00 175.17 175.48 3gq9 h VAL 357 N -0.81 1.36 -3.28 -1.27 2.07 -0.24 -1.74 116.25 112.34 3gq9 h VAL 357 Ca -0.45 -1.99 -0.61 0.00 0.82 0.00 0.00 66.70 64.46 3gq9 h VAL 357 Cb 1.32 2.56 -0.40 0.00 -1.52 0.00 0.00 31.29 33.25 3gq9 h VAL 357 CO 0.63 0.46 -0.74 -0.13 0.02 0.00 0.00 177.57 177.81 3gq9 s ARG 358 N -2.13 1.03 0.17 1.57 0.52 0.30 -1.00 118.95 119.40 3gq9 s ARG 358 Ca -0.15 -1.46 -0.17 0.00 -0.52 0.00 0.00 55.73 53.44 3gq9 s ARG 358 Cb -0.02 -2.39 0.10 0.00 0.52 0.00 0.00 34.95 33.16 3gq9 s ARG 358 CO 0.53 -1.00 1.68 0.77 0.02 0.00 0.00 175.30 177.29 3gq9 h SER 359 N 7.73 -0.30 -3.26 0.23 0.02 -1.51 -2.35 113.55 114.12 3gq9 h SER 359 Ca -0.09 0.11 -0.57 0.00 -0.84 0.00 0.00 61.79 60.39 3gq9 h SER 359 Cb 1.00 0.22 -0.37 0.00 0.14 0.00 0.00 62.40 63.39 3gq9 h SER 359 CO 0.49 -0.10 -0.81 -0.31 -1.14 0.00 0.00 176.83 174.96 3gq9 s TYR 360 N -6.20 1.94 -0.28 3.45 1.51 -1.08 -1.11 117.35 115.57 3gq9 s TYR 360 Ca -0.14 -1.16 -0.02 0.00 -1.01 0.00 0.00 57.07 54.74 3gq9 s TYR 360 Cb 0.14 -1.44 0.09 0.00 -0.11 0.00 0.00 41.96 40.64 3gq9 s TYR 360 CO 0.71 -0.64 0.09 1.21 -1.11 0.00 0.00 175.55 175.81 3gq9 s ASN 361 N 1.56 3.73 -0.17 2.29 3.04 -0.66 -1.07 114.94 123.66 3gq9 s ASN 361 Ca 0.02 -1.41 -0.02 0.00 0.04 0.00 0.00 52.86 51.49 3gq9 s ASN 361 Cb -0.14 -0.73 -0.01 0.00 -1.54 0.00 0.00 41.25 38.83 3gq9 s ASN 361 CO -0.09 -0.40 -0.08 -0.36 -3.04 0.00 0.00 177.10 173.14 3gq9 s PHE 362 N 1.75 2.91 0.14 0.43 2.99 0.02 -1.70 117.98 124.51 3gq9 s PHE 362 Ca 0.07 -0.73 -0.24 0.00 0.00 0.00 0.00 56.93 56.03 3gq9 s PHE 362 Cb -0.17 -1.97 0.07 0.00 0.00 0.00 0.00 43.02 40.95 3gq9 s PHE 362 CO -0.24 -0.33 0.67 -0.98 -0.00 0.00 0.00 175.22 174.34 3gq9 s ARG 363 N 0.83 1.24 -0.30 0.44 1.70 -0.54 -0.67 118.95 121.65 3gq9 s ARG 363 Ca -0.03 -0.49 -0.02 0.00 -0.47 0.00 0.00 55.73 54.72 3gq9 s ARG 363 Cb -0.15 0.55 0.10 0.00 -0.57 0.00 0.00 34.95 34.88 3gq9 s ARG 363 CO 0.01 -0.55 0.11 -1.58 -1.08 0.00 0.00 175.30 172.21 3gq9 s HIS 364 N -3.64 1.13 0.27 5.89 2.46 -1.26 -3.22 115.29 116.92 3gq9 s HIS 364 Ca 0.03 -1.36 -0.30 0.00 0.47 0.00 0.00 55.06 53.90 3gq9 s HIS 364 Cb -0.01 -1.37 -0.14 0.00 -0.13 0.00 0.00 32.58 30.93 3gq9 s HIS 364 CO -0.10 -0.85 1.24 -0.89 -2.47 0.00 0.00 174.74 171.67 3gq9 n ILE 365 N 5.02 1.49 -0.78 0.89 5.41 -0.67 -1.16 119.36 129.56 3gq9 n ILE 365 Ca -0.04 -0.37 0.00 0.00 1.00 0.00 0.00 62.75 63.34 3gq9 n ILE 365 Cb 0.42 -1.28 0.00 0.00 -0.71 0.00 0.00 39.64 38.07 3gq9 n ILE 365 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 3gq9 n GLY 366 N 1.53 1.24 1.49 7.39 0.00 -1.26 -3.07 105.19 112.51 3gq9 n GLY 366 Ca 0.10 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.11 3gq9 n GLY 366 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 3gq9 n HIS 367 N -2.00 0.63 -0.06 1.61 8.25 -0.30 -4.74 115.22 118.61 3gq9 n HIS 367 Ca 0.00 -1.37 -0.05 0.00 -0.26 0.00 0.00 57.72 56.05 3gq9 n HIS 367 Cb 0.00 -0.23 -0.11 0.00 1.12 0.00 0.00 29.99 30.77 3gq9 n HIS 367 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 3gq9 n HIS 368 N -0.41 0.00 -2.40 4.41 8.25 -1.26 -4.49 115.22 119.33 3gq9 n HIS 368 Ca 0.16 0.00 -0.37 0.00 -0.26 0.00 0.00 57.72 57.25 3gq9 n HIS 368 Cb 0.91 -0.64 -0.03 0.00 1.12 0.00 0.00 29.99 31.36 3gq9 n HIS 368 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3gq9 s ALA 369 N -2.45 3.08 0.29 -1.41 0.00 -1.26 -4.03 121.76 115.98 3gq9 s ALA 369 Ca -0.07 0.84 0.23 0.00 0.00 0.00 0.00 51.96 52.96 3gq9 s ALA 369 Cb 0.05 -3.33 1.06 0.00 0.00 0.00 0.00 23.12 20.90 3gq9 s ALA 369 CO 0.58 -0.42 1.91 0.00 0.00 0.00 0.00 175.76 177.83 3gq9 h ALA 370 N 2.45 1.17 -0.50 0.00 0.00 -1.97 -3.11 119.26 117.31 3gq9 h ALA 370 Ca -0.49 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.21 3gq9 h ALA 370 Cb 1.23 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.98 3gq9 h ALA 370 CO 0.62 0.29 0.00 0.25 0.00 0.00 0.00 179.25 180.41 3gq9 n THR 371 N -3.61 0.85 -4.34 0.00 -2.24 -1.26 -4.86 114.28 98.80 3gq9 n THR 371 Ca -0.01 -0.72 -0.18 0.00 -2.27 0.00 0.00 64.05 60.87 3gq9 n THR 371 Cb 0.36 0.25 -0.10 0.00 -2.10 0.00 0.00 70.33 68.75 3gq9 n THR 371 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3gq9 s ALA 372 N -1.43 1.92 0.67 6.98 0.00 -1.18 -5.14 121.76 123.59 3gq9 s ALA 372 Ca 0.35 -1.73 -0.14 0.00 0.00 0.00 0.00 51.96 50.44 3gq9 s ALA 372 Cb 0.19 0.21 0.00 0.00 0.00 0.00 0.00 23.12 23.53 3gq9 s ALA 372 CO 0.22 -0.11 1.09 -1.25 0.00 0.00 0.00 175.76 175.71 3gq9 s PRO 373 N -3.76 2.82 0.58 0.00 0.04 -1.26 -4.84 135.00 128.57 3gq9 s PRO 373 Ca 0.25 1.25 -0.20 0.00 0.04 0.00 0.00 61.00 62.34 3gq9 s PRO 373 Cb 0.03 -1.96 -0.04 0.00 0.04 0.00 0.00 34.50 32.57 3gq9 s PRO 373 CO 0.08 -1.21 1.20 0.94 0.04 0.00 0.00 177.00 178.04 3gq9 n GLN 374 N -2.64 1.30 -1.75 4.56 -0.06 -1.26 -4.81 117.38 112.72 3gq9 n GLN 374 Ca 0.09 0.49 -0.42 0.00 -2.00 0.00 0.00 57.00 55.17 3gq9 n GLN 374 Cb 0.53 -2.40 -0.02 0.00 -4.06 0.00 0.00 30.24 24.28 3gq9 n GLN 374 CO 0.00 0.00 0.00 0.45 -0.20 0.00 0.00 177.06 177.31 3gq9 s SER 375 N -1.10 6.35 0.00 1.69 0.15 -1.26 -4.90 113.70 114.63 3gq9 s SER 375 Ca 0.75 2.97 0.27 0.00 0.70 0.00 0.00 55.95 60.63 3gq9 s SER 375 Cb -0.42 -2.63 0.81 0.00 -1.71 0.00 0.00 66.02 62.07 3gq9 s SER 375 CO 0.47 -0.94 1.60 1.33 1.20 0.00 0.00 173.24 176.90 3gq9 n VAL 376 N 2.41 0.00 -0.04 4.45 0.24 -1.26 -4.38 118.33 119.75 3gq9 n VAL 376 Ca 0.09 -0.13 -0.03 0.00 -2.04 0.00 0.00 64.34 62.23 3gq9 n VAL 376 Cb 0.37 0.37 -0.07 0.00 -1.47 0.00 0.00 33.84 33.04 3gq9 n VAL 376 CO 0.00 0.00 0.00 -1.54 -2.14 0.00 0.00 176.83 173.15 3gq9 n SER 377 N -0.62 2.89 -4.56 -1.34 3.41 -1.26 -4.89 113.62 107.25 3gq9 n SER 377 Ca 0.13 0.00 -0.34 0.00 -0.26 0.00 0.00 58.87 58.40 3gq9 n SER 377 Cb 0.34 0.77 -0.04 0.00 -0.26 0.00 0.00 64.21 65.03 3gq9 n SER 377 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3gq9 s ALA 378 N -2.25 2.19 -0.02 7.33 0.00 -1.26 -4.46 121.76 123.29 3gq9 s ALA 378 Ca -0.04 -1.91 -0.14 0.00 0.00 0.00 0.00 51.96 49.88 3gq9 s ALA 378 Cb 0.03 -4.55 0.02 0.00 0.00 0.00 0.00 23.12 18.62 3gq9 s ALA 378 CO 0.35 -4.24 0.29 0.15 0.00 0.00 0.00 175.76 172.31 3gq9 s LYS 379 N 5.99 0.62 -0.23 0.00 1.02 -1.26 -0.97 119.74 124.91 3gq9 s LYS 379 Ca 0.59 -0.17 -0.01 0.00 0.02 0.00 0.00 55.97 56.40 3gq9 s LYS 379 Cb -0.03 0.27 0.00 0.00 -0.52 0.00 0.00 37.83 37.55 3gq9 s LYS 379 CO -0.04 -0.16 0.02 0.09 -0.92 0.00 0.00 175.35 174.34 3gq9 n ASN 380 N 1.43 -6.43 -3.97 2.83 4.13 -0.55 -1.90 115.26 110.80 3gq9 n ASN 380 Ca -0.21 1.02 -0.26 0.00 1.68 0.00 0.00 54.58 56.81 3gq9 n ASN 380 Cb 0.56 -4.19 -0.17 0.00 -1.54 0.00 0.00 39.78 34.44 3gq9 n ASN 380 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 3gq9 s ILE 381 N -1.25 1.14 -0.20 2.41 1.01 -0.45 -1.66 121.20 122.20 3gq9 s ILE 381 Ca 0.01 -0.42 -0.01 0.00 0.00 0.00 0.00 60.65 60.24 3gq9 s ILE 381 Cb -0.00 -1.10 0.01 0.00 0.01 0.00 0.00 42.46 41.39 3gq9 s ILE 381 CO 0.58 0.37 -0.14 -0.69 0.00 0.00 0.00 174.94 175.06 3gq9 s VAL 382 N 1.21 2.53 -0.06 2.92 1.01 -0.60 -0.72 120.40 126.68 3gq9 s VAL 382 Ca -0.04 -0.85 0.01 0.00 0.00 0.00 0.00 61.98 61.10 3gq9 s VAL 382 Cb -0.14 -2.13 0.02 0.00 0.00 0.00 0.00 36.38 34.13 3gq9 s VAL 382 CO -0.03 0.45 -0.05 0.00 0.00 0.00 0.00 175.10 175.46 3gq9 s ALA 383 N 1.34 0.83 0.06 5.51 0.00 -0.03 -0.62 121.76 128.85 3gq9 s ALA 383 Ca 0.04 -0.17 0.01 0.00 0.00 0.00 0.00 51.96 51.84 3gq9 s ALA 383 Cb -0.14 -0.53 -0.03 0.00 0.00 0.00 0.00 23.12 22.42 3gq9 s ALA 383 CO -0.09 -0.08 -0.05 -1.54 0.00 0.00 0.00 175.76 174.00 3gq9 s SER 384 N 1.07 0.77 -1.25 0.00 1.04 -0.02 -1.63 113.70 113.67 3gq9 s SER 384 Ca -0.08 -0.84 -0.12 0.00 0.48 0.00 0.00 55.95 55.39 3gq9 s SER 384 Cb -0.14 0.11 -0.00 0.00 0.10 0.00 0.00 66.02 66.09 3gq9 s SER 384 CO -0.01 -0.43 0.64 -3.20 0.98 0.00 0.00 173.24 171.23 3gq9 n ASN 385 N 0.53 -3.04 -4.74 7.02 2.85 -0.53 -0.95 115.26 116.40 3gq9 n ASN 385 Ca -0.16 -1.00 -0.37 0.00 -0.11 0.00 0.00 54.58 52.93 3gq9 n ASN 385 Cb 0.59 -3.29 -0.06 0.00 1.24 0.00 0.00 39.78 38.25 3gq9 n ASN 385 CO 0.00 0.00 0.00 -0.76 -2.11 0.00 0.00 177.26 174.39 3gq9 s LEU 386 N -6.70 4.30 -0.10 1.20 1.43 0.04 -2.57 118.68 116.28 3gq9 s LEU 386 Ca 0.26 0.75 0.02 0.00 -1.03 0.00 0.00 54.13 54.13 3gq9 s LEU 386 Cb -0.09 -2.59 -0.01 0.00 0.03 0.00 0.00 46.19 43.52 3gq9 s LEU 386 CO 0.87 0.08 -0.17 -0.69 0.23 0.00 0.00 176.35 176.66 3gq9 s VAL 387 N 0.32 2.71 -0.06 -1.59 1.01 -0.13 -0.95 120.40 121.71 3gq9 s VAL 387 Ca 0.23 -0.80 0.01 0.00 0.00 0.00 0.00 61.98 61.42 3gq9 s VAL 387 Cb -0.15 -2.09 0.02 0.00 0.00 0.00 0.00 36.38 34.16 3gq9 s VAL 387 CO 0.09 0.55 -0.08 -0.55 0.00 0.00 0.00 175.10 175.11 3gq9 s SER 388 N 0.07 1.51 -0.13 3.32 0.15 -0.04 -1.12 113.70 117.46 3gq9 s SER 388 Ca -0.07 -0.23 0.01 0.00 0.70 0.00 0.00 55.95 56.36 3gq9 s SER 388 Cb -0.15 -0.67 0.02 0.00 -1.71 0.00 0.00 66.02 63.51 3gq9 s SER 388 CO 0.05 -0.03 -0.15 -0.63 1.20 0.00 0.00 173.24 173.68 3gq9 s ILE 389 N 0.94 1.54 -1.35 6.45 1.01 0.12 -0.80 121.20 129.11 3gq9 s ILE 389 Ca -0.10 -0.64 -0.08 0.00 0.00 0.00 0.00 60.65 59.82 3gq9 s ILE 389 Cb -0.15 -1.42 0.00 0.00 0.01 0.00 0.00 42.46 40.90 3gq9 s ILE 389 CO 0.01 0.45 0.47 0.54 0.00 0.00 0.00 174.94 176.41 3gq9 n ARG 390 N 4.43 -2.25 -1.97 2.79 1.74 0.50 -0.65 116.66 121.25 3gq9 n ARG 390 Ca -0.18 0.34 -0.41 0.00 -0.77 0.00 0.00 57.85 56.83 3gq9 n ARG 390 Cb 0.51 -4.12 -0.01 0.00 -1.02 0.00 0.00 32.46 27.82 3gq9 n ARG 390 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 3gq9 s PRO 391 N -6.62 4.24 0.22 5.56 0.04 -1.26 -3.91 135.00 133.26 3gq9 s PRO 391 Ca 0.15 2.39 -0.22 0.00 0.04 0.00 0.00 61.00 63.36 3gq9 s PRO 391 Cb -0.06 -3.02 0.04 0.00 0.04 0.00 0.00 34.50 31.50 3gq9 s PRO 391 CO 0.90 -0.36 0.71 0.54 0.04 0.00 0.00 177.00 178.84 3gq9 s ASN 392 N -0.30 -0.35 -0.40 6.66 2.20 -0.65 -4.30 114.94 117.79 3gq9 s ASN 392 Ca 0.51 -0.38 0.09 0.00 -0.94 0.00 0.00 52.86 52.14 3gq9 s ASN 392 Cb -0.43 0.65 0.44 0.00 -2.00 0.00 0.00 41.25 39.91 3gq9 s ASN 392 CO 0.57 -1.16 1.06 -3.20 -2.94 0.00 0.00 177.10 171.44 3gq9 n ASN 393 N -0.43 3.65 0.06 3.54 2.85 -1.26 -3.49 115.26 120.18 3gq9 n ASN 393 Ca -0.08 -3.38 0.05 0.00 -0.11 0.00 0.00 54.58 51.05 3gq9 n ASN 393 Cb 0.61 -0.48 0.47 0.00 1.24 0.00 0.00 39.78 41.62 3gq9 n ASN 393 CO 0.00 0.00 0.00 0.11 -2.11 0.00 0.00 177.26 175.26 3gq9 h LYS 394 N 2.70 0.42 0.00 1.20 1.57 -1.96 -2.30 116.57 118.20 3gq9 h LYS 394 Ca 0.17 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.93 3gq9 h LYS 394 Cb 1.03 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 33.24 3gq9 h LYS 394 CO 0.73 0.28 0.00 0.54 -0.57 0.00 0.00 179.45 180.43 3gq9 n ARG 395 N -4.49 0.12 -2.03 3.15 1.74 -1.26 -4.94 116.66 108.95 3gq9 n ARG 395 Ca 0.02 0.10 -0.03 0.00 -0.77 0.00 0.00 57.85 57.16 3gq9 n ARG 395 Cb 0.07 -1.64 -0.00 0.00 -1.02 0.00 0.00 32.46 29.87 3gq9 n ARG 395 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3gq9 n GLY 396 N 1.41 0.26 3.63 -0.13 0.00 -0.87 -4.99 105.19 104.51 3gq9 n GLY 396 Ca 0.06 -0.77 -0.41 0.00 0.00 0.00 0.00 46.02 44.91 3gq9 n GLY 396 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3gq9 n PHE 397 N -3.97 1.35 -3.66 1.61 3.01 -1.26 -3.64 117.46 110.91 3gq9 n PHE 397 Ca -0.04 0.53 -0.22 0.00 1.01 0.00 0.00 57.45 58.73 3gq9 n PHE 397 Cb 0.51 -2.25 0.04 0.00 -0.01 0.00 0.00 39.48 37.77 3gq9 n PHE 397 CO 0.00 0.00 0.00 1.04 1.01 0.00 0.00 176.76 178.81 3gq9 n GLN 398 N -0.04 -4.25 -3.80 -1.08 1.13 -0.31 -1.84 117.38 107.18 3gq9 n GLN 398 Ca 0.09 0.62 -0.24 0.00 -1.94 0.00 0.00 57.00 55.53 3gq9 n GLN 398 Cb 0.40 -5.11 0.02 0.00 0.11 0.00 0.00 30.24 25.67 3gq9 n GLN 398 CO 0.00 0.00 0.00 -0.25 -1.44 0.00 0.00 177.06 175.37 3gq9 n ASP 399 N -3.03 -2.03 -3.64 1.08 8.00 -1.25 -2.16 116.55 113.52 3gq9 n ASP 399 Ca -0.26 -0.84 -0.25 0.00 0.71 0.00 0.00 54.79 54.15 3gq9 n ASP 399 Cb 0.66 -3.85 0.07 0.00 -0.02 0.00 0.00 41.12 37.98 3gq9 n ASP 399 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 3gq9 n ASN 400 N -2.98 -6.03 -4.52 -2.24 3.02 -0.76 -4.94 115.26 96.80 3gq9 n ASN 400 Ca -0.20 -0.58 -0.42 0.00 -0.03 0.00 0.00 54.58 53.34 3gq9 n ASN 400 Cb 0.64 -4.76 0.00 0.00 -0.61 0.00 0.00 39.78 35.05 3gq9 n ASN 400 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3gq9 n ALA 401 N -4.86 -0.80 -1.79 5.41 0.00 -0.92 -4.93 120.51 112.62 3gq9 n ALA 401 Ca 0.01 0.23 -0.40 0.00 0.00 0.00 0.00 53.44 53.28 3gq9 n ALA 401 Cb 0.55 -1.91 -0.05 0.00 0.00 0.00 0.00 19.45 18.04 3gq9 n ALA 401 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 3gq9 s THR 402 N -1.32 3.92 0.72 0.00 -4.23 -1.26 -4.77 115.64 108.69 3gq9 s THR 402 Ca 0.63 1.90 -0.14 0.00 -1.18 0.00 0.00 61.69 62.90 3gq9 s THR 402 Cb -0.62 -4.21 0.03 0.00 1.34 0.00 0.00 72.50 69.05 3gq9 s THR 402 CO 0.58 0.44 1.15 -2.84 -0.54 0.00 0.00 174.62 173.41 3gq9 s PRO 403 N -1.16 2.35 -0.05 3.99 0.02 -1.26 -4.86 135.00 134.03 3gq9 s PRO 403 Ca 0.43 1.52 -0.09 0.00 0.02 0.00 0.00 61.00 62.88 3gq9 s PRO 403 Cb -0.28 -1.88 0.02 0.00 0.02 0.00 0.00 34.50 32.38 3gq9 s PRO 403 CO 0.35 -1.63 0.21 1.03 -0.33 0.00 0.00 177.00 176.63 3gq9 s ARG 404 N -4.14 0.39 0.04 5.54 1.81 -0.17 -4.60 118.95 117.83 3gq9 s ARG 404 Ca 0.69 0.01 -0.18 0.00 -1.72 0.00 0.00 55.73 54.54 3gq9 s ARG 404 Cb -0.24 0.18 -0.18 0.00 -0.45 0.00 0.00 34.95 34.26 3gq9 s ARG 404 CO 0.46 -0.08 1.22 0.28 -0.68 0.00 0.00 175.30 176.50 3gq9 h VAL 405 N 4.49 1.37 -3.03 3.52 2.07 -0.83 -2.39 116.25 121.44 3gq9 h VAL 405 Ca -0.28 -1.86 -0.17 0.00 0.82 0.00 0.00 66.70 65.21 3gq9 h VAL 405 Cb 1.19 2.22 -0.28 0.00 -1.52 0.00 0.00 31.29 32.90 3gq9 h VAL 405 CO 0.38 0.56 -0.44 -0.22 0.02 0.00 0.00 177.57 177.87 3gq9 s LEU 406 N -8.56 0.61 -0.11 2.57 2.96 -1.10 -2.64 118.68 112.42 3gq9 s LEU 406 Ca -0.13 0.55 -0.02 0.00 -0.22 0.00 0.00 54.13 54.32 3gq9 s LEU 406 Cb 0.06 0.85 0.04 0.00 0.50 0.00 0.00 46.19 47.63 3gq9 s LEU 406 CO 0.83 -0.14 0.00 0.00 -1.32 0.00 0.00 176.35 175.73 3gq9 s ALA 407 N 0.81 0.85 -0.15 5.97 0.00 -0.24 -1.05 121.76 127.96 3gq9 s ALA 407 Ca -0.06 -0.32 -0.01 0.00 0.00 0.00 0.00 51.96 51.58 3gq9 s ALA 407 Cb -0.07 -0.88 -0.01 0.00 0.00 0.00 0.00 23.12 22.17 3gq9 s ALA 407 CO -0.05 -0.64 -0.12 0.08 0.00 0.00 0.00 175.76 175.03 3gq9 s VAL 408 N 1.91 3.03 0.05 0.00 1.01 0.22 -0.80 120.40 125.82 3gq9 s VAL 408 Ca 0.03 -0.66 -0.04 0.00 0.00 0.00 0.00 61.98 61.32 3gq9 s VAL 408 Cb -0.13 -2.29 -0.02 0.00 0.00 0.00 0.00 36.38 33.94 3gq9 s VAL 408 CO -0.06 0.51 0.04 -0.94 0.00 0.00 0.00 175.10 174.65 3gq9 s SER 409 N 0.56 0.30 0.00 3.32 1.04 0.15 -1.68 113.70 117.39 3gq9 s SER 409 Ca -0.08 -0.73 0.00 0.00 0.48 0.00 0.00 55.95 55.62 3gq9 s SER 409 Cb -0.16 0.22 0.00 0.00 0.10 0.00 0.00 66.02 66.18 3gq9 s SER 409 CO 0.03 -0.55 0.00 0.00 0.98 0.00 0.00 173.24 173.70 3gq9 n ALA 410 N 0.48 0.00 -1.77 5.32 0.00 0.88 -3.85 120.51 121.57 3gq9 n ALA 410 Ca -0.17 0.00 -0.39 0.00 0.00 0.00 0.00 53.44 52.88 3gq9 n ALA 410 Cb 0.60 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 20.01 3gq9 n ALA 410 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 3gq9 s TYR 411 N 0.00 3.42 -0.09 0.00 1.51 -1.26 -4.44 117.35 116.48 3gq9 s TYR 411 Ca 0.00 1.67 -0.10 0.00 -1.01 0.00 0.00 57.07 57.63 3gq9 s TYR 411 Cb 0.00 -3.23 -0.05 0.00 -0.11 0.00 0.00 41.96 38.58 3gq9 s TYR 411 CO 0.00 -0.63 0.24 -0.47 -1.11 0.00 0.00 175.55 173.57 3gq9 s TYR 412 N -1.38 3.61 -0.33 2.71 5.04 -0.14 -0.97 117.35 125.90 3gq9 s TYR 412 Ca 0.51 0.66 -0.02 0.00 -2.44 0.00 0.00 57.07 55.78 3gq9 s TYR 412 Cb -0.28 -2.11 -0.02 0.00 0.35 0.00 0.00 41.96 39.91 3gq9 s TYR 412 CO 0.35 0.62 0.29 0.41 -1.34 0.00 0.00 175.55 175.89 3gq9 n GLY 413 N 2.20 0.18 3.35 8.97 0.00 -0.82 -1.48 105.19 117.58 3gq9 n GLY 413 Ca -0.17 -0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.50 3gq9 n GLY 413 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3gq9 s VAL 414 N -3.11 3.51 -0.22 1.61 1.01 -1.12 -1.34 120.40 120.73 3gq9 s VAL 414 Ca 0.13 -0.46 -0.01 0.00 0.00 0.00 0.00 61.98 61.65 3gq9 s VAL 414 Cb -0.02 -2.58 0.02 0.00 0.00 0.00 0.00 36.38 33.80 3gq9 s VAL 414 CO 0.24 0.43 -0.11 -0.69 0.00 0.00 0.00 175.10 174.96 3gq9 s VAL 415 N 1.25 2.61 -0.15 2.92 1.01 0.10 -1.02 120.40 127.12 3gq9 s VAL 415 Ca 0.03 -0.93 0.01 0.00 0.00 0.00 0.00 61.98 61.09 3gq9 s VAL 415 Cb -0.14 -2.23 -0.00 0.00 0.00 0.00 0.00 36.38 34.00 3gq9 s VAL 415 CO -0.01 0.36 -0.16 -0.63 0.00 0.00 0.00 175.10 174.66 3gq9 s ILE 416 N 1.33 2.66 -0.06 2.22 -1.09 0.62 -0.85 121.20 126.02 3gq9 s ILE 416 Ca 0.02 -0.78 -0.01 0.00 -2.23 0.00 0.00 60.65 57.65 3gq9 s ILE 416 Cb -0.15 -2.11 0.03 0.00 -1.58 0.00 0.00 42.46 38.65 3gq9 s ILE 416 CO -0.08 0.52 0.02 0.21 -1.23 0.00 0.00 174.94 174.39 3gq9 s ASN 417 N 0.72 1.34 -0.01 3.58 2.47 -0.65 -1.24 114.94 121.15 3gq9 s ASN 417 Ca -0.07 -0.03 -0.00 0.00 0.42 0.00 0.00 52.86 53.18 3gq9 s ASN 417 Cb -0.16 -0.32 0.00 0.00 -1.45 0.00 0.00 41.25 39.32 3gq9 s ASN 417 CO 0.01 -0.20 0.01 0.61 -3.72 0.00 0.00 177.10 173.81 3gq9 n GLY 418 N 5.11 -0.69 3.06 1.21 0.00 -0.07 -1.58 105.19 112.22 3gq9 n GLY 418 Ca -0.07 -0.09 -0.29 0.00 0.00 0.00 0.00 46.02 45.57 3gq9 n GLY 418 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3gq9 s LEU 419 N -1.05 1.73 -0.15 0.99 2.96 0.06 -0.78 118.68 122.44 3gq9 s LEU 419 Ca 0.00 -0.43 0.02 0.00 -0.22 0.00 0.00 54.13 53.50 3gq9 s LEU 419 Cb -0.00 -1.10 0.01 0.00 0.50 0.00 0.00 46.19 45.60 3gq9 s LEU 419 CO 0.01 0.02 -0.20 0.28 -1.32 0.00 0.00 176.35 175.14 3gq9 s THR 420 N 0.99 1.96 -0.12 3.68 -1.32 -0.13 -1.02 115.64 119.68 3gq9 s THR 420 Ca -0.06 -0.90 0.01 0.00 -1.21 0.00 0.00 61.69 59.52 3gq9 s THR 420 Cb -0.15 -1.76 -0.02 0.00 -1.51 0.00 0.00 72.50 69.07 3gq9 s THR 420 CO -0.02 0.53 -0.14 -0.83 -2.21 0.00 0.00 174.62 171.95 3gq9 s GLY 421 N 1.05 1.52 -0.01 6.08 0.00 -0.27 -0.86 107.32 114.83 3gq9 s GLY 421 Ca -0.02 -0.91 0.00 0.00 0.00 0.00 0.00 44.72 43.80 3gq9 s GLY 421 CO -0.06 -0.29 -0.00 -0.47 0.00 0.00 0.00 173.10 172.28 3gq9 s TYR 422 N 0.19 0.17 0.02 1.90 5.04 0.02 -1.19 117.35 123.50 3gq9 s TYR 422 Ca -0.08 0.01 -0.02 0.00 -2.44 0.00 0.00 57.07 54.54 3gq9 s TYR 422 Cb -0.15 -0.22 -0.02 0.00 0.35 0.00 0.00 41.96 41.92 3gq9 s TYR 422 CO 0.05 -0.06 0.02 -0.08 -1.34 0.00 0.00 175.55 174.14 3gq9 s THR 423 N 0.51 0.12 -0.78 4.34 -1.32 -0.59 -0.37 115.64 117.55 3gq9 s THR 423 Ca -0.05 -1.00 0.08 0.00 -1.21 0.00 0.00 61.69 59.51 3gq9 s THR 423 Cb -0.07 -0.52 0.18 0.00 -1.51 0.00 0.00 72.50 70.58 3gq9 s THR 423 CO -0.01 -0.55 1.07 -0.90 -2.21 0.00 0.00 174.62 172.02 3gq9 n ASP 424 N 1.29 2.41 -3.63 8.08 5.75 -1.26 -4.30 116.55 124.88 3gq9 n ASP 424 Ca -0.22 -1.82 -0.29 0.00 -0.01 0.00 0.00 54.79 52.45 3gq9 n ASP 424 Cb 0.56 -0.12 -0.15 0.00 -1.03 0.00 0.00 41.12 40.38 3gq9 n ASP 424 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 3gq9 s ASP 425 N -0.91 3.63 0.50 -1.12 -1.08 -1.26 -5.01 116.67 111.41 3gq9 s ASP 425 Ca 0.15 -1.36 0.33 0.00 -0.52 0.00 0.00 52.55 51.15 3gq9 s ASP 425 Cb 0.08 -0.57 1.82 0.00 -1.46 0.00 0.00 42.92 42.79 3gq9 s ASP 425 CO 0.11 -0.42 2.03 -0.65 0.52 0.00 0.00 175.17 176.76 3gq9 h PRO 426 N 8.27 0.00 -0.01 4.34 0.11 -1.91 -2.87 132.00 139.93 3gq9 h PRO 426 Ca -0.17 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.94 3gq9 h PRO 426 Cb 1.03 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.14 3gq9 h PRO 426 CO 0.44 0.00 -0.45 0.09 -0.21 0.00 0.00 178.00 177.87 3gq9 n ASN 427 N -2.68 1.05 0.03 -2.05 3.02 -1.26 -4.00 115.26 109.37 3gq9 n ASN 427 Ca -0.02 -0.84 -0.18 0.00 -0.03 0.00 0.00 54.58 53.51 3gq9 n ASN 427 Cb 0.06 0.32 -0.08 0.00 -0.61 0.00 0.00 39.78 39.47 3gq9 n ASN 427 CO 0.00 0.00 0.00 -0.07 -2.62 0.00 0.00 177.26 174.57 3gq9 h LEU 428 N 0.95 0.86 -7.59 3.41 3.38 -1.83 -3.42 115.31 111.07 3gq9 h LEU 428 Ca 0.00 -0.65 -0.58 0.00 0.09 0.00 0.00 57.88 56.74 3gq9 h LEU 428 Cb 0.55 -0.26 -0.38 0.00 0.09 0.00 0.00 40.66 40.65 3gq9 h LEU 428 CO 0.00 1.45 -0.79 -0.22 0.09 0.00 0.00 178.44 178.97 3gq9 s LEU 429 N -8.14 2.03 0.00 1.67 0.20 -1.26 -4.42 118.68 108.76 3gq9 s LEU 429 Ca -0.09 -0.93 0.00 0.00 0.69 0.00 0.00 54.13 53.80 3gq9 s LEU 429 Cb 0.08 -1.01 0.00 0.00 -0.43 0.00 0.00 46.19 44.83 3gq9 s LEU 429 CO 0.91 -0.22 0.50 0.35 -0.29 0.00 0.00 176.35 177.59 3gq9 n THR 430 N 4.79 0.13 0.00 3.68 -2.24 -1.26 -4.12 114.28 115.27 3gq9 n THR 430 Ca -0.12 -0.49 0.00 0.00 -2.27 0.00 0.00 64.05 61.18 3gq9 n THR 430 Cb 0.46 1.07 0.00 0.00 -2.10 0.00 0.00 70.33 69.76 3gq9 n THR 430 CO 0.00 0.00 0.00 1.21 -0.57 0.00 0.00 175.07 175.71 3gq9 n GLU 431 N -0.07 0.00 -3.95 -0.78 2.13 -1.26 -2.52 120.64 114.19 3gq9 n GLU 431 Ca 0.00 0.00 -0.16 0.00 0.66 0.00 0.00 57.16 57.66 3gq9 n GLU 431 Cb 0.08 -0.04 -0.16 0.00 0.27 0.00 0.00 31.44 31.59 3gq9 n GLU 431 CO 0.00 0.00 0.00 0.99 -0.41 0.00 0.00 177.13 177.71 3gq9 s THR 432 N 0.00 0.19 -0.06 6.31 2.01 -1.26 -1.83 115.64 121.00 3gq9 s THR 432 Ca 0.00 0.04 -0.26 0.00 0.31 0.00 0.00 61.69 61.78 3gq9 s THR 432 Cb 0.00 -0.26 -0.22 0.00 0.01 0.00 0.00 72.50 72.03 3gq9 s THR 432 CO 0.00 0.13 1.09 0.58 -0.69 0.00 0.00 174.62 175.73 3gq9 h VAL 433 N 6.03 1.53 -3.36 3.82 2.07 -1.18 -3.41 116.25 121.75 3gq9 h VAL 433 Ca -0.40 -1.63 -0.47 0.00 0.82 0.00 0.00 66.70 65.01 3gq9 h VAL 433 Cb 1.15 2.60 -0.35 0.00 -1.52 0.00 0.00 31.29 33.17 3gq9 h VAL 433 CO 0.48 0.43 -0.79 -0.69 0.02 0.00 0.00 177.57 177.02 3gq9 s VAL 434 N -3.49 0.82 -0.01 2.57 1.01 0.06 -0.18 120.40 121.19 3gq9 s VAL 434 Ca -0.17 -0.25 0.05 0.00 0.00 0.00 0.00 61.98 61.62 3gq9 s VAL 434 Cb 0.00 -0.82 -0.01 0.00 0.00 0.00 0.00 36.38 35.55 3gq9 s VAL 434 CO 0.70 0.30 -0.17 -0.94 0.00 0.00 0.00 175.10 174.99 3gq9 s SER 435 N 1.14 1.98 -0.28 3.32 1.04 -0.22 -0.55 113.70 120.13 3gq9 s SER 435 Ca -0.07 -0.31 -0.01 0.00 0.48 0.00 0.00 55.95 56.05 3gq9 s SER 435 Cb -0.14 -0.24 0.09 0.00 0.10 0.00 0.00 66.02 65.82 3gq9 s SER 435 CO -0.01 0.20 0.06 -0.69 0.98 0.00 0.00 173.24 173.78 3gq9 s VAL 436 N -0.37 1.03 0.24 5.02 1.01 -0.15 -0.61 120.40 126.58 3gq9 s VAL 436 Ca 0.06 -1.29 -0.03 0.00 0.00 0.00 0.00 61.98 60.72 3gq9 s VAL 436 Cb -0.07 -1.65 0.01 0.00 0.00 0.00 0.00 36.38 34.67 3gq9 s VAL 436 CO -0.00 -0.49 0.37 0.00 0.00 0.00 0.00 175.10 174.97 3gq9 n GLN 437 N 4.81 0.53 -3.59 2.72 6.02 -0.68 -1.10 117.38 126.08 3gq9 n GLN 437 Ca -0.04 -1.75 -0.24 0.00 -0.01 0.00 0.00 57.00 54.96 3gq9 n GLN 437 Cb 0.43 1.78 0.05 0.00 1.02 0.00 0.00 30.24 33.51 3gq9 n GLN 437 CO 0.00 0.00 0.00 1.19 -1.01 0.00 0.00 177.06 177.24 3gq9 n PHE 438 N -0.37 -2.03 -0.90 1.08 3.01 -1.26 -1.47 117.46 115.51 3gq9 n PHE 438 Ca -0.01 0.67 0.00 0.00 1.01 0.00 0.00 57.45 59.12 3gq9 n PHE 438 Cb 0.38 -3.89 0.00 0.00 -0.01 0.00 0.00 39.48 35.96 3gq9 n PHE 438 CO 0.00 0.00 0.00 0.54 1.01 0.00 0.00 176.76 178.31 3gq9 n ARG 439 N -3.99 -0.12 -1.75 -1.08 1.74 -1.26 -0.08 116.66 110.12 3gq9 n ARG 439 Ca -0.15 0.03 -0.42 0.00 -0.77 0.00 0.00 57.85 56.54 3gq9 n ARG 439 Cb 0.63 -3.13 -0.01 0.00 -1.02 0.00 0.00 32.46 28.93 3gq9 n ARG 439 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3gq9 n ALA 440 N 1.00 2.49 -2.89 7.54 0.00 -0.54 -4.18 120.51 123.93 3gq9 n ALA 440 Ca 0.00 0.37 -0.11 0.00 0.00 0.00 0.00 53.44 53.70 3gq9 n ALA 440 Cb 0.03 -2.45 -0.08 0.00 0.00 0.00 0.00 19.45 16.95 3gq9 n ALA 440 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.50 176.52 3gq9 s ARG 441 N -0.87 0.70 -1.13 0.00 1.70 -0.14 -4.76 118.95 114.45 3gq9 s ARG 441 Ca 0.62 -0.60 -0.12 0.00 -0.47 0.00 0.00 55.73 55.15 3gq9 s ARG 441 Cb -0.49 0.29 -0.03 0.00 -0.57 0.00 0.00 34.95 34.15 3gq9 s ARG 441 CO 0.52 -0.20 0.84 0.09 -1.08 0.00 0.00 175.30 175.46 3gq9 n ASN 442 N 0.70 -5.27 -4.46 -2.89 3.02 -0.96 -1.95 115.26 103.46 3gq9 n ASN 442 Ca -0.19 -0.86 -0.32 0.00 -0.03 0.00 0.00 54.58 53.18 3gq9 n ASN 442 Cb 0.59 -4.23 -0.13 0.00 -0.61 0.00 0.00 39.78 35.40 3gq9 n ASN 442 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3gq9 s SER 444 N -1.08 1.71 -0.12 0.00 0.01 -0.19 -1.77 113.70 112.26 3gq9 s SER 444 Ca 0.13 -0.28 0.02 0.00 1.31 0.00 0.00 55.95 57.13 3gq9 s SER 444 Cb -0.11 -0.58 0.01 0.00 0.21 0.00 0.00 66.02 65.55 3gq9 s SER 444 CO 0.03 0.08 -0.16 -0.76 0.41 0.00 0.00 173.24 172.84 3gq9 s LEU 445 N 0.31 1.78 -0.01 2.44 1.43 0.57 -0.28 118.68 124.93 3gq9 s LEU 445 Ca -0.07 -0.46 0.01 0.00 -1.03 0.00 0.00 54.13 52.57 3gq9 s LEU 445 Cb -0.12 -1.15 0.01 0.00 0.03 0.00 0.00 46.19 44.96 3gq9 s LEU 445 CO 0.02 0.02 -0.01 0.21 0.23 0.00 0.00 176.35 176.82 3gq9 s ASN 446 N 0.99 0.29 -0.22 2.29 3.84 -0.37 -1.09 114.94 120.66 3gq9 s ASN 446 Ca -0.06 -0.03 -0.01 0.00 0.21 0.00 0.00 52.86 52.98 3gq9 s ASN 446 Cb -0.15 -0.10 -0.01 0.00 -0.55 0.00 0.00 41.25 40.45 3gq9 s ASN 446 CO -0.02 -0.03 0.20 0.61 -2.79 0.00 0.00 177.10 175.07 3gq9 n GLY 447 N 3.52 -0.17 3.25 1.21 0.00 -0.80 -0.89 105.19 111.31 3gq9 n GLY 447 Ca -0.19 -0.04 -0.31 0.00 0.00 0.00 0.00 46.02 45.48 3gq9 n GLY 447 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3gq9 s VAL 448 N -3.04 2.03 -0.15 1.61 1.01 -0.70 -0.76 120.40 120.40 3gq9 s VAL 448 Ca 0.05 -1.04 0.00 0.00 0.00 0.00 0.00 61.98 60.99 3gq9 s VAL 448 Cb -0.01 -1.73 0.03 0.00 0.00 0.00 0.00 36.38 34.67 3gq9 s VAL 448 CO 0.19 0.56 -0.11 -0.69 0.00 0.00 0.00 175.10 175.06 3gq9 s VAL 449 N -0.01 1.37 -0.18 2.92 1.01 -0.19 -0.67 120.40 124.65 3gq9 s VAL 449 Ca -0.08 -0.60 -0.00 0.00 0.00 0.00 0.00 61.98 61.30 3gq9 s VAL 449 Cb -0.15 -1.37 0.01 0.00 0.00 0.00 0.00 36.38 34.86 3gq9 s VAL 449 CO 0.05 0.34 -0.15 -0.76 0.00 0.00 0.00 175.10 174.58 3gq9 s LEU 450 N 1.55 2.39 -0.07 3.92 1.43 -0.71 -1.11 118.68 126.09 3gq9 s LEU 450 Ca 0.03 -0.53 0.02 0.00 -1.03 0.00 0.00 54.13 52.61 3gq9 s LEU 450 Cb -0.14 -1.56 0.02 0.00 0.03 0.00 0.00 46.19 44.55 3gq9 s LEU 450 CO -0.09 0.03 -0.10 -0.89 0.23 0.00 0.00 176.35 175.53 3gq9 s THR 451 N 1.13 0.99 0.00 5.49 2.01 -0.33 -0.33 115.64 124.60 3gq9 s THR 451 Ca 0.01 -0.37 0.00 0.00 0.31 0.00 0.00 61.69 61.63 3gq9 s THR 451 Cb -0.14 -0.94 0.00 0.00 0.01 0.00 0.00 72.50 71.42 3gq9 s THR 451 CO -0.06 0.33 0.00 0.61 -0.69 0.00 0.00 174.62 174.81 3gq9 n GLY 452 N 4.06 0.28 2.30 4.40 0.00 -0.23 -1.54 105.19 114.47 3gq9 n GLY 452 Ca -0.21 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.51 3gq9 n GLY 452 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3gq9 n PHE 453 N -2.00 1.66 1.43 1.61 3.01 -1.03 -4.24 117.46 117.90 3gq9 n PHE 453 Ca 0.00 -2.38 0.14 0.00 1.01 0.00 0.00 57.45 56.21 3gq9 n PHE 453 Cb 0.00 -1.88 0.73 0.00 -0.01 0.00 0.00 39.48 38.32 3gq9 n PHE 453 CO 0.00 0.00 0.00 -1.13 1.01 0.00 0.00 176.76 176.64 3gq9 n SER 454 N 2.31 0.00 -0.24 4.37 3.41 -0.34 -2.27 113.62 120.86 3gq9 n SER 454 Ca 0.60 -0.34 0.09 0.00 -0.26 0.00 0.00 58.87 58.96 3gq9 n SER 454 Cb 0.48 -0.20 0.16 0.00 -0.26 0.00 0.00 64.21 64.39 3gq9 n SER 454 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 3gq9 n ASN 455 N -1.20 2.13 -4.89 4.04 5.15 -1.26 -2.11 115.26 117.13 3gq9 n ASN 455 Ca 0.15 -3.34 -0.32 0.00 -0.60 0.00 0.00 54.58 50.47 3gq9 n ASN 455 Cb 0.18 -0.46 -0.05 0.00 -0.53 0.00 0.00 39.78 38.92 3gq9 n ASN 455 CO 0.00 0.00 0.00 -0.94 1.40 0.00 0.00 177.26 177.72 3gq9 s SER 456 N -2.98 6.55 0.05 1.20 1.04 -0.96 -4.48 113.70 114.12 3gq9 s SER 456 Ca 0.34 0.68 -0.19 0.00 0.48 0.00 0.00 55.95 57.26 3gq9 s SER 456 Cb 0.31 -2.13 -0.13 0.00 0.10 0.00 0.00 66.02 64.17 3gq9 s SER 456 CO -0.00 0.08 1.35 -0.08 0.98 0.00 0.00 173.24 175.57 3gq9 h GLU 457 N 3.07 0.46 -5.56 4.02 4.57 -1.06 -1.37 114.58 118.70 3gq9 h GLU 457 Ca -0.47 -0.25 -0.53 0.00 -1.18 0.00 0.00 59.36 56.92 3gq9 h GLU 457 Cb 1.17 0.01 -0.29 0.00 -0.16 0.00 0.00 28.75 29.48 3gq9 h GLU 457 CO 0.70 0.83 -0.83 -0.80 -1.18 0.00 0.00 179.01 177.74 3gq9 s ASN 458 N -6.28 1.97 -0.01 1.04 0.01 -0.77 -0.77 114.94 110.12 3gq9 s ASN 458 Ca -0.14 -0.30 -0.01 0.00 -0.71 0.00 0.00 52.86 51.70 3gq9 s ASN 458 Cb 0.06 -0.24 -0.00 0.00 0.41 0.00 0.00 41.25 41.48 3gq9 s ASN 458 CO 0.78 0.20 0.11 1.23 -1.51 0.00 0.00 177.10 177.91 3gq9 h GLY 459 N 5.76 -0.02 -5.45 0.66 0.00 -0.63 -1.80 103.07 101.58 3gq9 h GLY 459 Ca -0.36 0.01 -0.67 0.00 0.00 0.00 0.00 47.33 46.31 3gq9 h GLY 459 CO 0.48 -0.01 -0.82 -0.42 0.00 0.00 0.00 176.54 175.78 3gq9 s ILE 460 N -1.31 2.62 -0.09 2.60 1.01 0.32 -0.76 121.20 125.59 3gq9 s ILE 460 Ca -0.00 -0.82 0.01 0.00 0.00 0.00 0.00 60.65 59.83 3gq9 s ILE 460 Cb 0.00 -2.06 0.02 0.00 0.01 0.00 0.00 42.46 40.43 3gq9 s ILE 460 CO 0.01 0.54 -0.10 -0.47 0.00 0.00 0.00 174.94 174.92 3gq9 s TYR 461 N 0.28 1.48 -0.05 3.97 5.04 0.29 -0.03 117.35 128.33 3gq9 s TYR 461 Ca -0.13 -0.64 0.03 0.00 -2.44 0.00 0.00 57.07 53.89 3gq9 s TYR 461 Cb -0.16 -1.15 0.01 0.00 0.35 0.00 0.00 41.96 41.00 3gq9 s TYR 461 CO 0.07 -0.39 -0.13 0.08 -1.34 0.00 0.00 175.55 173.84 3gq9 s VAL 462 N 1.13 1.15 0.02 3.14 1.01 -0.41 -0.97 120.40 125.47 3gq9 s VAL 462 Ca -0.06 -0.53 0.04 0.00 0.00 0.00 0.00 61.98 61.43 3gq9 s VAL 462 Cb -0.14 -1.03 -0.02 0.00 0.00 0.00 0.00 36.38 35.20 3gq9 s VAL 462 CO -0.02 0.35 -0.11 -0.63 0.00 0.00 0.00 175.10 174.69 3gq9 s ILE 463 N 0.34 0.87 0.00 2.22 1.01 -0.26 -0.03 121.20 125.36 3gq9 s ILE 463 Ca -0.08 -0.75 0.00 0.00 0.00 0.00 0.00 60.65 59.82 3gq9 s ILE 463 Cb -0.13 -0.79 0.00 0.00 0.01 0.00 0.00 42.46 41.56 3gq9 s ILE 463 CO 0.02 0.04 0.00 0.61 0.00 0.00 0.00 174.94 175.62 3gq9 n GLY 464 N 2.25 5.86 0.83 6.18 0.00 -0.62 -4.34 105.19 115.35 3gq9 n GLY 464 Ca -0.17 -1.94 0.02 0.00 0.00 0.00 0.00 46.02 43.93 3gq9 n GLY 464 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3gq9 n GLY 465 N 3.60 1.12 3.94 -0.02 0.00 -0.88 -4.36 105.19 108.59 3gq9 n GLY 465 Ca 0.00 -0.42 -0.31 0.00 0.00 0.00 0.00 46.02 45.30 3gq9 n GLY 465 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3gq9 n SER 466 N 0.05 -4.48 -4.81 1.61 7.64 0.19 -4.94 113.62 108.87 3gq9 n SER 466 Ca 0.04 -0.81 -0.38 0.00 1.01 0.00 0.00 58.87 58.73 3gq9 n SER 466 Cb 0.85 -3.76 -0.06 0.00 -1.01 0.00 0.00 64.21 60.23 3gq9 n SER 466 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 3gq9 s ARG 467 N -6.63 4.22 0.35 1.43 0.52 -1.26 -5.04 118.95 112.54 3gq9 s ARG 467 Ca 0.64 0.77 -0.27 0.00 -0.52 0.00 0.00 55.73 56.35 3gq9 s ARG 467 Cb -0.33 -3.13 -0.09 0.00 0.52 0.00 0.00 34.95 31.92 3gq9 s ARG 467 CO 0.84 0.57 1.21 0.20 0.02 0.00 0.00 175.30 178.13 3gq9 s GLY 468 N -1.30 2.96 0.00 -3.53 0.00 -1.26 -2.65 107.32 101.54 3gq9 s GLY 468 Ca 0.34 1.07 0.00 0.00 0.00 0.00 0.00 44.72 46.12 3gq9 s GLY 468 CO 0.20 1.65 0.00 0.61 0.00 0.00 0.00 173.10 175.57 3gq9 n GLY 469 N 0.82 0.55 3.88 0.20 0.00 -1.26 -5.02 105.19 104.37 3gq9 n GLY 469 Ca 0.01 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.74 3gq9 n GLY 469 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3gq9 s ASP 470 N -2.30 6.39 -0.10 1.61 -1.08 -1.08 -4.88 116.67 115.22 3gq9 s ASP 470 Ca 0.00 1.22 -0.30 0.00 -0.52 0.00 0.00 52.55 52.95 3gq9 s ASP 470 Cb 0.00 -2.37 0.08 0.00 -1.46 0.00 0.00 42.92 39.17 3gq9 s ASP 470 CO 0.00 -0.60 0.73 0.00 0.52 0.00 0.00 175.17 175.82 3gq9 s ALA 471 N -2.72 -1.79 -0.07 3.66 0.00 -1.26 -4.63 121.76 114.94 3gq9 s ALA 471 Ca 0.52 1.47 0.00 0.00 0.00 0.00 0.00 51.96 53.96 3gq9 s ALA 471 Cb -0.10 -0.30 0.02 0.00 0.00 0.00 0.00 23.12 22.74 3gq9 s ALA 471 CO 0.41 -0.36 -0.06 0.54 0.00 0.00 0.00 175.76 176.29 3gq9 s VAL 472 N -0.89 0.75 -0.20 0.00 0.11 -0.77 -2.26 120.40 117.14 3gq9 s VAL 472 Ca -0.08 -0.19 -0.04 0.00 -2.93 0.00 0.00 61.98 58.74 3gq9 s VAL 472 Cb -0.01 -0.78 -0.02 0.00 -1.53 0.00 0.00 36.38 34.05 3gq9 s VAL 472 CO 0.07 0.30 -0.03 0.21 -3.33 0.00 0.00 175.10 172.31 3gq9 s ASN 473 N 1.28 4.52 -0.17 3.54 2.47 -0.73 -1.55 114.94 124.29 3gq9 s ASN 473 Ca -0.04 -0.29 0.00 0.00 0.42 0.00 0.00 52.86 52.95 3gq9 s ASN 473 Cb -0.14 -1.76 0.04 0.00 -1.45 0.00 0.00 41.25 37.94 3gq9 s ASN 473 CO -0.02 0.05 -0.09 -0.63 -3.72 0.00 0.00 177.10 172.68 3gq9 s ILE 474 N 1.09 1.40 0.02 -5.21 1.01 0.49 -0.31 121.20 119.69 3gq9 s ILE 474 Ca 0.02 -0.77 -0.01 0.00 0.00 0.00 0.00 60.65 59.88 3gq9 s ILE 474 Cb -0.15 -1.49 -0.02 0.00 0.01 0.00 0.00 42.46 40.82 3gq9 s ILE 474 CO 0.00 0.21 -0.01 -0.94 0.00 0.00 0.00 174.94 174.20 3gq9 s SER 475 N 1.51 0.21 -1.00 3.58 1.04 -0.25 -1.01 113.70 117.78 3gq9 s SER 475 Ca 0.01 -0.45 -0.06 0.00 0.48 0.00 0.00 55.95 55.92 3gq9 s SER 475 Cb -0.15 0.11 -0.05 0.00 0.10 0.00 0.00 66.02 66.03 3gq9 s SER 475 CO -0.08 -0.30 0.87 0.59 0.98 0.00 0.00 173.24 175.30 3gq9 n ASN 476 N 1.64 -6.71 -4.24 7.02 3.02 -0.51 -2.07 115.26 113.41 3gq9 n ASN 476 Ca -0.23 -0.63 -0.32 0.00 -0.03 0.00 0.00 54.58 53.37 3gq9 n ASN 476 Cb 0.55 -5.02 -0.17 0.00 -0.61 0.00 0.00 39.78 34.54 3gq9 n ASN 476 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 3gq9 s VAL 477 N -3.32 2.05 -0.03 2.41 1.01 -0.55 -1.73 120.40 120.24 3gq9 s VAL 477 Ca 0.38 -1.03 0.05 0.00 0.00 0.00 0.00 61.98 61.37 3gq9 s VAL 477 Cb -0.06 -1.76 -0.01 0.00 0.00 0.00 0.00 36.38 34.56 3gq9 s VAL 477 CO 0.76 0.56 -0.17 0.28 0.00 0.00 0.00 175.10 176.53 3gq9 s THR 478 N 0.15 1.36 -0.12 3.92 -1.32 0.15 -0.97 115.64 118.80 3gq9 s THR 478 Ca -0.13 -0.70 0.03 0.00 -1.21 0.00 0.00 61.69 59.68 3gq9 s THR 478 Cb -0.16 -1.15 0.01 0.00 -1.51 0.00 0.00 72.50 69.68 3gq9 s THR 478 CO 0.07 0.39 -0.21 -0.76 -2.21 0.00 0.00 174.62 171.90 3gq9 s LEU 479 N -0.11 2.00 -0.40 9.08 1.43 -0.02 -1.74 118.68 128.93 3gq9 s LEU 479 Ca 0.00 -0.55 -0.02 0.00 -1.03 0.00 0.00 54.13 52.53 3gq9 s LEU 479 Cb -0.10 -1.34 0.11 0.00 0.03 0.00 0.00 46.19 44.89 3gq9 s LEU 479 CO 0.01 0.08 0.18 0.21 0.23 0.00 0.00 176.35 177.06 3gq9 s ASN 480 N 0.76 5.20 -1.41 2.29 3.04 0.55 -0.88 114.94 124.49 3gq9 s ASN 480 Ca -0.10 -2.01 -0.00 0.00 0.04 0.00 0.00 52.86 50.79 3gq9 s ASN 480 Cb -0.16 -1.81 0.00 0.00 -1.54 0.00 0.00 41.25 37.74 3gq9 s ASN 480 CO 0.00 -0.52 0.39 0.59 -3.04 0.00 0.00 177.10 174.53 3gq9 n ASN 481 N 4.57 -0.22 -3.70 -4.21 3.02 0.11 -1.06 115.26 113.77 3gq9 n ASN 481 Ca -0.02 -1.02 -0.30 0.00 -0.03 0.00 0.00 54.58 53.21 3gq9 n ASN 481 Cb 0.41 -2.97 -0.14 0.00 -0.61 0.00 0.00 39.78 36.47 3gq9 n ASN 481 CO 0.00 0.00 0.00 -0.44 -2.62 0.00 0.00 177.26 174.20 3gq9 s SER 482 N -4.38 3.79 0.00 6.41 0.01 -1.26 -1.20 113.70 117.08 3gq9 s SER 482 Ca 0.00 -2.01 0.00 0.00 1.31 0.00 0.00 55.95 55.26 3gq9 s SER 482 Cb -0.00 -0.86 0.00 0.00 0.21 0.00 0.00 66.02 65.37 3gq9 s SER 482 CO 0.89 -0.36 0.00 0.61 0.41 0.00 0.00 173.24 174.80 3gq9 n GLY 483 N 4.35 1.67 0.37 3.44 0.00 -1.09 -4.24 105.19 109.68 3gq9 n GLY 483 Ca 0.03 -1.10 0.06 0.00 0.00 0.00 0.00 46.02 45.01 3gq9 n GLY 483 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 3gq9 h ARG 484 N 0.00 0.99 -4.86 1.61 3.08 -0.84 -3.25 114.38 111.12 3gq9 h ARG 484 Ca 0.00 -0.06 -0.67 0.00 0.07 0.00 0.00 59.98 59.32 3gq9 h ARG 484 Cb 0.00 -0.22 -0.24 0.00 0.08 0.00 0.00 29.97 29.58 3gq9 h ARG 484 CO 0.00 0.66 -0.61 0.71 -1.07 0.00 0.00 179.97 179.65 3gq9 s TYR 485 N -5.94 3.12 0.02 3.04 1.51 0.05 -0.38 117.35 118.76 3gq9 s TYR 485 Ca -0.12 -0.70 -0.27 0.00 -1.01 0.00 0.00 57.07 54.97 3gq9 s TYR 485 Cb 0.21 -2.26 -0.16 0.00 -0.11 0.00 0.00 41.96 39.64 3gq9 s TYR 485 CO 0.81 -0.48 1.21 0.78 -1.11 0.00 0.00 175.55 176.76 3gq9 h GLY 486 N 8.25 -0.84 -7.23 0.71 0.00 -0.65 0.59 103.07 103.90 3gq9 h GLY 486 Ca -0.34 0.31 -0.58 0.00 0.00 0.00 0.00 47.33 46.72 3gq9 h GLY 486 CO 0.60 -0.30 -0.79 0.14 0.00 0.00 0.00 176.54 176.18 3gq9 s VAL 487 N -4.86 1.27 -0.18 4.60 1.01 0.88 -0.52 120.40 122.61 3gq9 s VAL 487 Ca -0.15 -0.86 -0.01 0.00 0.00 0.00 0.00 61.98 60.96 3gq9 s VAL 487 Cb 0.02 -1.49 -0.00 0.00 0.00 0.00 0.00 36.38 34.91 3gq9 s VAL 487 CO 0.48 0.04 -0.12 -0.55 0.00 0.00 0.00 175.10 174.96 3gq9 s SER 488 N 1.54 3.83 -0.19 3.32 0.15 0.95 -1.00 113.70 122.31 3gq9 s SER 488 Ca -0.02 -0.46 -0.05 0.00 0.70 0.00 0.00 55.95 56.12 3gq9 s SER 488 Cb -0.17 -1.62 -0.02 0.00 -1.71 0.00 0.00 66.02 62.50 3gq9 s SER 488 CO -0.07 0.03 -0.01 -0.63 1.20 0.00 0.00 173.24 173.76 3gq9 s ILE 489 N 1.13 3.94 0.00 6.45 -1.09 0.54 -1.29 121.20 130.88 3gq9 s ILE 489 Ca 0.01 -0.32 0.00 0.00 -2.23 0.00 0.00 60.65 58.11 3gq9 s ILE 489 Cb -0.14 -2.77 0.00 0.00 -1.58 0.00 0.00 42.46 37.96 3gq9 s ILE 489 CO -0.04 0.44 0.00 0.61 -1.23 0.00 0.00 174.94 174.73 3gq9 n GLY 490 N 4.09 2.21 3.74 6.18 0.00 0.96 -1.66 105.19 120.70 3gq9 n GLY 490 Ca -0.17 -2.01 -0.31 0.00 0.00 0.00 0.00 46.02 43.53 3gq9 n GLY 490 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3gq9 s SER 491 N -0.89 3.96 0.00 1.61 1.04 -1.26 -3.90 113.70 114.26 3gq9 s SER 491 Ca 0.00 1.78 0.00 0.00 0.48 0.00 0.00 55.95 58.21 3gq9 s SER 491 Cb 0.00 -2.43 0.00 0.00 0.10 0.00 0.00 66.02 63.69 3gq9 s SER 491 CO 0.00 -2.37 0.00 0.61 0.98 0.00 0.00 173.24 172.46 3gq9 n GLY 492 N -0.96 0.54 3.42 7.32 0.00 -1.26 -1.59 105.19 112.66 3gq9 n GLY 492 Ca 0.09 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.71 3gq9 n GLY 492 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3gq9 s ILE 493 N -2.32 4.64 -0.10 -0.61 -1.09 -1.25 0.56 121.20 121.02 3gq9 s ILE 493 Ca 0.00 -0.60 0.18 0.00 -2.23 0.00 0.00 60.65 58.00 3gq9 s ILE 493 Cb 0.00 -3.47 -0.26 0.00 -1.58 0.00 0.00 42.46 37.15 3gq9 s ILE 493 CO 0.00 -0.07 0.24 -0.62 -1.23 0.00 0.00 174.94 173.26 3gq9 n GLU 494 N 5.00 0.83 -3.88 2.79 -0.58 -1.26 -4.74 120.64 118.81 3gq9 n GLU 494 Ca -0.13 -0.09 -0.30 0.00 -0.42 0.00 0.00 57.16 56.21 3gq9 n GLU 494 Cb 0.48 -1.46 -0.15 0.00 -0.57 0.00 0.00 31.44 29.74 3gq9 n GLU 494 CO 0.00 0.00 0.00 -0.80 -0.48 0.00 0.00 177.13 175.85 3gq9 s ASN 495 N -4.70 4.38 -0.02 1.62 0.01 -1.26 -4.91 114.94 110.06 3gq9 s ASN 495 Ca -0.08 -1.99 0.03 0.00 -0.71 0.00 0.00 52.86 50.11 3gq9 s ASN 495 Cb 0.09 -1.27 -0.00 0.00 0.41 0.00 0.00 41.25 40.47 3gq9 s ASN 495 CO 0.77 -0.38 -0.10 0.68 -1.51 0.00 0.00 177.10 176.55 3gq9 s VAL 496 N 1.13 0.83 -0.16 1.60 -7.23 -1.26 -1.85 120.40 113.46 3gq9 s VAL 496 Ca 0.11 -0.42 0.02 0.00 -1.81 0.00 0.00 61.98 59.88 3gq9 s VAL 496 Cb -0.19 -0.71 0.01 0.00 0.56 0.00 0.00 36.38 36.05 3gq9 s VAL 496 CO -0.15 0.25 -0.20 -0.55 -0.31 0.00 0.00 175.10 174.14 3gq9 s SER 497 N -0.03 3.19 -0.25 4.85 0.15 -0.60 -1.02 113.70 120.00 3gq9 s SER 497 Ca 0.00 -0.60 -0.00 0.00 0.70 0.00 0.00 55.95 56.05 3gq9 s SER 497 Cb -0.06 -1.47 0.07 0.00 -1.71 0.00 0.00 66.02 62.84 3gq9 s SER 497 CO 0.00 0.05 0.01 -0.63 1.20 0.00 0.00 173.24 173.87 3gq9 s ILE 498 N 0.97 1.22 -0.02 6.45 1.01 0.42 -0.38 121.20 130.89 3gq9 s ILE 498 Ca -0.03 -1.18 0.03 0.00 0.00 0.00 0.00 60.65 59.46 3gq9 s ILE 498 Cb -0.15 -1.66 -0.00 0.00 0.01 0.00 0.00 42.46 40.66 3gq9 s ILE 498 CO -0.05 -0.28 -0.09 0.42 0.00 0.00 0.00 174.94 174.94 3gq9 s THR 499 N 1.51 0.76 -0.90 2.92 -4.23 -0.18 -2.02 115.64 113.50 3gq9 s THR 499 Ca -0.00 -0.38 -0.04 0.00 -1.18 0.00 0.00 61.69 60.09 3gq9 s THR 499 Cb -0.18 -0.66 -0.03 0.00 1.34 0.00 0.00 72.50 72.97 3gq9 s THR 499 CO -0.10 0.23 0.80 0.59 -0.54 0.00 0.00 174.62 175.59 3gq9 n ASN 500 N 3.09 -7.08 -4.48 3.99 3.02 -0.36 -1.42 115.26 112.02 3gq9 n ASN 500 Ca -0.16 -0.43 -0.33 0.00 -0.03 0.00 0.00 54.58 53.62 3gq9 n ASN 500 Cb 0.55 -5.07 -0.12 0.00 -0.61 0.00 0.00 39.78 34.53 3gq9 n ASN 500 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 3gq9 s ILE 501 N -3.20 3.64 0.07 2.41 -1.09 -0.88 -1.48 121.20 120.68 3gq9 s ILE 501 Ca 0.23 -0.46 0.04 0.00 -2.23 0.00 0.00 60.65 58.23 3gq9 s ILE 501 Cb -0.04 -2.56 -0.03 0.00 -1.58 0.00 0.00 42.46 38.26 3gq9 s ILE 501 CO 0.76 0.52 -0.12 -0.94 -1.23 0.00 0.00 174.94 173.93 3gq9 s SER 502 N 0.12 1.44 -0.06 3.58 1.04 -0.15 -1.53 113.70 118.14 3gq9 s SER 502 Ca -0.03 -0.65 -0.19 0.00 0.48 0.00 0.00 55.95 55.56 3gq9 s SER 502 Cb -0.14 -0.02 0.04 0.00 0.10 0.00 0.00 66.02 66.00 3gq9 s SER 502 CO 0.03 -0.15 0.43 -0.83 0.98 0.00 0.00 173.24 173.70 3gq9 s GLY 503 N -1.89 -0.30 -0.18 7.32 0.00 -0.62 -0.84 107.32 110.81 3gq9 s GLY 503 Ca -0.02 0.78 -0.02 0.00 0.00 0.00 0.00 44.72 45.47 3gq9 s GLY 503 CO 0.01 0.55 -0.10 -0.42 0.00 0.00 0.00 173.10 173.14 3gq9 s ILE 504 N -0.92 3.03 -0.11 0.90 1.01 -0.06 -2.01 121.20 123.03 3gq9 s ILE 504 Ca -0.10 -0.63 0.01 0.00 0.00 0.00 0.00 60.65 59.93 3gq9 s ILE 504 Cb -0.04 -2.33 0.02 0.00 0.01 0.00 0.00 42.46 40.12 3gq9 s ILE 504 CO 0.05 0.48 0.76 0.61 0.00 0.00 0.00 174.94 176.83 3gq9 n GLY 505 N 4.33 0.60 0.28 6.18 0.00 0.42 -0.71 105.19 116.29 3gq9 n GLY 505 Ca -0.19 -0.03 0.17 0.00 0.00 0.00 0.00 46.02 45.97 3gq9 n GLY 505 CO 0.00 0.00 0.00 1.29 0.00 0.00 0.00 173.32 174.61 3gq9 h ASP 506 N 0.20 0.00 -0.12 1.61 3.04 -1.72 -1.57 116.42 117.87 3gq9 h ASP 506 Ca 0.00 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.79 3gq9 h ASP 506 Cb 0.26 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 38.55 3gq9 h ASP 506 CO 0.00 0.04 0.00 0.61 -2.04 0.00 0.00 179.24 177.85 3gq9 n GLY 507 N -0.21 0.85 3.79 7.15 0.00 -1.26 -4.97 105.19 110.54 3gq9 n GLY 507 Ca -0.00 -0.62 -0.38 0.00 0.00 0.00 0.00 46.02 45.02 3gq9 n GLY 507 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3gq9 s ILE 508 N -1.87 4.43 -0.58 -0.61 1.01 -0.59 -4.89 121.20 118.09 3gq9 s ILE 508 Ca 0.33 1.56 -0.27 0.00 0.00 0.00 0.00 60.65 62.27 3gq9 s ILE 508 Cb 0.21 -4.03 0.00 0.00 0.01 0.00 0.00 42.46 38.65 3gq9 s ILE 508 CO 0.31 0.39 1.56 0.21 0.00 0.00 0.00 174.94 177.41 3gq9 s ASN 509 N -1.35 5.85 -1.09 3.58 3.04 -0.90 -4.20 114.94 119.87 3gq9 s ASN 509 Ca 0.39 0.28 -0.06 0.00 0.04 0.00 0.00 52.86 53.51 3gq9 s ASN 509 Cb -0.20 -2.54 -0.05 0.00 -1.54 0.00 0.00 41.25 36.91 3gq9 s ASN 509 CO 0.24 -1.93 0.91 -1.20 -3.04 0.00 0.00 177.10 172.08 3gq9 n SER 510 N 10.58 -5.76 -4.74 -4.21 7.64 -1.26 -4.89 113.62 110.97 3gq9 n SER 510 Ca 0.14 -0.73 -0.35 0.00 1.01 0.00 0.00 58.87 58.95 3gq9 n SER 510 Cb 0.50 -5.01 0.06 0.00 -1.01 0.00 0.00 64.21 58.75 3gq9 n SER 510 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 3gq9 s PRO 511 N -4.70 2.57 0.03 1.43 0.04 -1.26 -4.87 135.00 128.24 3gq9 s PRO 511 Ca 0.39 1.69 -0.02 0.00 0.04 0.00 0.00 61.00 63.10 3gq9 s PRO 511 Cb -0.06 -1.89 -0.01 0.00 0.04 0.00 0.00 34.50 32.58 3gq9 s PRO 511 CO 0.75 -1.49 -0.03 0.28 0.04 0.00 0.00 177.00 176.55 3gq9 n VAL 512 N -2.27 0.80 -3.73 -0.36 0.31 0.49 -4.57 118.33 109.00 3gq9 n VAL 512 Ca 0.13 0.26 -0.13 0.00 -0.01 0.00 0.00 64.34 64.58 3gq9 n VAL 512 Cb 0.50 -1.48 -0.10 0.00 -0.91 0.00 0.00 33.84 31.86 3gq9 n VAL 512 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3gq9 s ALA 513 N -2.15 -1.03 0.12 3.52 0.00 -0.91 -2.48 121.76 118.83 3gq9 s ALA 513 Ca -0.03 1.09 -0.16 0.00 0.00 0.00 0.00 51.96 52.86 3gq9 s ALA 513 Cb 0.00 -0.58 -0.02 0.00 0.00 0.00 0.00 23.12 22.52 3gq9 s ALA 513 CO 0.04 -0.21 1.65 1.25 0.00 0.00 0.00 175.76 178.49 3gq9 h LEU 514 N 5.23 0.53 -7.89 0.00 5.85 -1.06 -1.16 115.31 116.81 3gq9 h LEU 514 Ca -0.27 -0.19 -0.40 0.00 0.84 0.00 0.00 57.88 57.85 3gq9 h LEU 514 Cb 1.18 -0.14 -0.31 0.00 0.37 0.00 0.00 40.66 41.76 3gq9 h LEU 514 CO 0.26 0.58 -0.78 -0.69 -0.34 0.00 0.00 178.44 177.48 3gq9 s VAL 515 N -5.44 0.64 -0.02 1.05 1.01 0.12 -0.08 120.40 117.67 3gq9 s VAL 515 Ca -0.13 -0.26 0.01 0.00 0.00 0.00 0.00 61.98 61.60 3gq9 s VAL 515 Cb 0.10 -0.59 0.01 0.00 0.00 0.00 0.00 36.38 35.89 3gq9 s VAL 515 CO 0.75 0.22 -0.05 -0.55 0.00 0.00 0.00 175.10 175.47 3gq9 s SER 516 N 0.37 0.70 0.05 3.32 0.15 -0.17 -0.52 113.70 117.59 3gq9 s SER 516 Ca -0.05 -0.10 0.05 0.00 0.70 0.00 0.00 55.95 56.55 3gq9 s SER 516 Cb -0.09 -0.18 -0.02 0.00 -1.71 0.00 0.00 66.02 64.01 3gq9 s SER 516 CO 0.00 0.02 -0.14 0.42 1.20 0.00 0.00 173.24 174.74 3gq9 s THR 517 N 0.24 1.12 -0.14 6.45 -4.23 -0.25 -0.34 115.64 118.49 3gq9 s THR 517 Ca -0.03 -1.08 -0.25 0.00 -1.18 0.00 0.00 61.69 59.16 3gq9 s THR 517 Cb -0.06 -1.03 -0.25 0.00 1.34 0.00 0.00 72.50 72.49 3gq9 s THR 517 CO -0.00 -0.05 0.64 0.40 -0.54 0.00 0.00 174.62 175.07 3gq9 h ILE 518 N 4.45 1.47 -4.23 2.99 1.08 -1.54 -0.78 117.51 120.95 3gq9 h ILE 518 Ca -0.39 -2.35 -0.49 0.00 -0.39 0.00 0.00 64.86 61.24 3gq9 h ILE 518 Cb 1.18 3.03 0.06 0.00 -3.07 0.00 0.00 36.82 38.02 3gq9 h ILE 518 CO 0.43 0.57 0.38 0.20 -0.69 0.00 0.00 178.15 179.04 3gq9 s ASN 519 N -6.57 5.90 0.24 1.72 0.01 -1.26 -4.22 114.94 110.77 3gq9 s ASN 519 Ca -0.21 1.70 0.24 0.00 -0.71 0.00 0.00 52.86 53.89 3gq9 s ASN 519 Cb 0.00 -2.52 0.43 0.00 0.41 0.00 0.00 41.25 39.58 3gq9 s ASN 519 CO 0.70 -1.09 1.49 0.77 -1.51 0.00 0.00 177.10 177.46 3gq9 h SER 520 N 0.26 0.00 -1.48 -1.22 4.64 -1.92 -3.36 113.55 110.46 3gq9 h SER 520 Ca -0.46 -0.06 -0.59 0.00 -0.47 0.00 0.00 61.79 60.21 3gq9 h SER 520 Cb 1.21 0.00 -0.42 0.00 -0.31 0.00 0.00 62.40 62.88 3gq9 h SER 520 CO 0.58 0.03 -0.69 -0.46 -0.87 0.00 0.00 176.83 175.43 3gq9 n ASN 521 N -2.49 4.80 -4.79 4.97 6.94 -1.26 -4.89 115.26 118.54 3gq9 n ASN 521 Ca 0.04 -3.73 -0.33 0.00 -0.02 0.00 0.00 54.58 50.54 3gq9 n ASN 521 Cb 0.48 -0.47 0.01 0.00 -2.36 0.00 0.00 39.78 37.44 3gq9 n ASN 521 CO 0.00 0.00 0.00 -2.16 -1.03 0.00 0.00 177.26 174.07 3gq9 s PRO 522 N -3.56 3.25 -0.20 -0.53 0.04 -1.26 -4.78 135.00 127.96 3gq9 s PRO 522 Ca 0.48 1.35 -0.15 0.00 0.04 0.00 0.00 61.00 62.72 3gq9 s PRO 522 Cb 0.40 -2.01 -0.04 0.00 0.04 0.00 0.00 34.50 32.89 3gq9 s PRO 522 CO -0.18 -0.89 0.37 -1.21 0.04 0.00 0.00 177.00 175.13 3gq9 s GLU 523 N -3.82 4.18 -0.01 4.56 2.02 -0.19 -4.71 118.70 120.73 3gq9 s GLU 523 Ca 0.67 0.16 -0.01 0.00 0.02 0.00 0.00 54.97 55.80 3gq9 s GLU 523 Cb -0.19 -3.52 0.01 0.00 0.10 0.00 0.00 34.13 30.53 3gq9 s GLU 523 CO 0.34 0.01 0.03 0.42 0.02 0.00 0.00 175.26 176.08 3gq9 s ILE 524 N 1.16 -0.01 0.16 -1.63 1.01 -0.85 -0.43 121.20 120.61 3gq9 s ILE 524 Ca 0.18 0.04 -0.21 0.00 0.00 0.00 0.00 60.65 60.66 3gq9 s ILE 524 Cb -0.14 -0.06 0.06 0.00 0.01 0.00 0.00 42.46 42.32 3gq9 s ILE 524 CO 0.07 0.02 0.55 -0.94 0.00 0.00 0.00 174.94 174.64 3gq9 s SER 525 N 0.22 -0.44 -0.68 3.58 1.04 -0.86 -0.65 113.70 115.90 3gq9 s SER 525 Ca -0.02 -0.15 -0.03 0.00 0.48 0.00 0.00 55.95 56.23 3gq9 s SER 525 Cb -0.03 0.57 0.00 0.00 0.10 0.00 0.00 66.02 66.67 3gq9 s SER 525 CO -0.01 -0.97 0.59 0.61 0.98 0.00 0.00 173.24 174.44 3gq9 n GLY 526 N -0.34 0.14 3.78 7.32 0.00 -1.26 -1.22 105.19 113.61 3gq9 n GLY 526 Ca -0.15 -0.19 -0.38 0.00 0.00 0.00 0.00 46.02 45.29 3gq9 n GLY 526 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3gq9 s LEU 527 N -4.27 4.44 -0.06 0.99 1.43 -1.26 -2.08 118.68 117.87 3gq9 s LEU 527 Ca 0.23 1.10 -0.02 0.00 -1.03 0.00 0.00 54.13 54.40 3gq9 s LEU 527 Cb -0.10 -2.81 0.04 0.00 0.03 0.00 0.00 46.19 43.34 3gq9 s LEU 527 CO 0.38 0.18 0.13 -0.55 0.23 0.00 0.00 176.35 176.71 3gq9 s SER 528 N -0.48 0.06 0.03 2.29 0.15 -0.58 -4.87 113.70 110.31 3gq9 s SER 528 Ca 0.28 0.26 -0.08 0.00 0.70 0.00 0.00 55.95 57.11 3gq9 s SER 528 Cb -0.18 0.15 0.00 0.00 -1.71 0.00 0.00 66.02 64.28 3gq9 s SER 528 CO 0.16 -0.16 0.17 -0.55 1.20 0.00 0.00 173.24 174.05 3gq9 s SER 529 N 1.33 0.06 -0.03 5.45 0.15 -1.26 -1.59 113.70 117.82 3gq9 s SER 529 Ca -0.07 -0.38 -0.02 0.00 0.70 0.00 0.00 55.95 56.18 3gq9 s SER 529 Cb -0.12 0.26 0.01 0.00 -1.71 0.00 0.00 66.02 64.47 3gq9 s SER 529 CO -0.05 -0.52 0.06 -0.51 1.20 0.00 0.00 173.24 173.42 3gq9 s ILE 530 N -2.41 -0.01 0.00 6.45 2.07 -0.85 -4.90 121.20 121.54 3gq9 s ILE 530 Ca -0.06 0.03 0.00 0.00 -1.41 0.00 0.00 60.65 59.21 3gq9 s ILE 530 Cb -0.02 -0.10 0.00 0.00 0.13 0.00 0.00 42.46 42.47 3gq9 s ILE 530 CO -0.03 0.01 0.00 0.61 -1.91 0.00 0.00 174.94 173.62 3gq9 n GLY 531 N 3.24 0.94 3.71 1.50 0.00 -1.26 -0.44 105.19 112.88 3gq9 n GLY 531 Ca -0.15 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.52 3gq9 n GLY 531 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3gq9 s TYR 532 N -3.57 3.39 0.43 1.61 1.51 -1.26 -3.98 117.35 115.48 3gq9 s TYR 532 Ca 0.00 0.30 0.09 0.00 -1.01 0.00 0.00 57.07 56.46 3gq9 s TYR 532 Cb 0.00 -2.19 0.95 0.00 -0.11 0.00 0.00 41.96 40.61 3gq9 s TYR 532 CO 0.00 0.23 2.07 -1.35 -1.11 0.00 0.00 175.55 175.39 3gq9 h PRO 533 N 6.89 0.37 -6.19 -1.71 0.11 -1.81 -3.41 132.00 126.26 3gq9 h PRO 533 Ca -0.40 -0.03 -0.61 0.00 0.11 0.00 0.00 66.00 65.06 3gq9 h PRO 533 Cb 1.16 -0.08 -0.28 0.00 0.11 0.00 0.00 31.00 31.91 3gq9 h PRO 533 CO 0.73 0.27 -0.86 0.99 -0.21 0.00 0.00 178.00 178.93 3gq9 s THR 534 N -5.30 1.74 -0.08 -1.15 2.01 -1.04 -5.05 115.64 106.78 3gq9 s THR 534 Ca -0.07 -1.09 -0.03 0.00 0.31 0.00 0.00 61.69 60.80 3gq9 s THR 534 Cb 0.17 -1.48 -0.01 0.00 0.01 0.00 0.00 72.50 71.19 3gq9 s THR 534 CO 0.72 0.36 -0.07 0.58 -0.69 0.00 0.00 174.62 175.52 3gq9 h VAL 535 N 4.46 0.00 -3.34 3.82 2.07 -1.80 -2.74 116.25 118.73 3gq9 h VAL 535 Ca -0.42 -0.64 -0.64 0.00 0.82 0.00 0.00 66.70 65.83 3gq9 h VAL 535 Cb 1.15 0.00 -0.33 0.00 -1.52 0.00 0.00 31.29 30.58 3gq9 h VAL 535 CO 0.46 0.00 -0.86 0.00 0.02 0.00 0.00 177.57 177.19 3gq9 s ALA 536 N -2.78 1.94 -0.34 1.67 0.00 -0.39 -0.70 121.76 121.16 3gq9 s ALA 536 Ca -0.06 -0.84 -0.03 0.00 0.00 0.00 0.00 51.96 51.04 3gq9 s ALA 536 Cb 0.01 -0.78 0.07 0.00 0.00 0.00 0.00 23.12 22.42 3gq9 s ALA 536 CO 0.08 0.19 0.07 0.50 0.00 0.00 0.00 175.76 176.61 3gq9 s ARG 537 N 0.51 2.33 -0.35 0.00 3.52 0.32 -0.03 118.95 125.25 3gq9 s ARG 537 Ca -0.16 -1.41 -0.09 0.00 -0.13 0.00 0.00 55.73 53.94 3gq9 s ARG 537 Cb -0.17 -3.34 0.03 0.00 -1.56 0.00 0.00 34.95 29.91 3gq9 s ARG 537 CO 0.06 -0.75 0.16 0.08 -0.81 0.00 0.00 175.30 174.04 3gq9 s VAL 538 N 1.24 4.25 -1.56 7.11 1.01 0.49 -1.09 120.40 131.86 3gq9 s VAL 538 Ca -0.01 -0.93 -0.04 0.00 0.00 0.00 0.00 61.98 61.00 3gq9 s VAL 538 Cb -0.21 -3.37 0.04 0.00 0.00 0.00 0.00 36.38 32.85 3gq9 s VAL 538 CO -0.01 -0.18 0.24 0.00 0.00 0.00 0.00 175.10 175.14 3gq9 n ALA 539 N 4.92 -1.86 0.00 5.51 0.00 -0.30 -1.09 120.51 127.69 3gq9 n ALA 539 Ca -0.12 -0.32 0.00 0.00 0.00 0.00 0.00 53.44 52.99 3gq9 n ALA 539 Cb 0.46 -1.38 0.00 0.00 0.00 0.00 0.00 19.45 18.53 3gq9 n ALA 539 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3gq9 n GLY 540 N -2.16 2.86 3.71 0.00 0.00 -1.26 -5.03 105.19 103.31 3gq9 n GLY 540 Ca -0.24 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.42 3gq9 n GLY 540 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3gq9 s THR 541 N -2.31 5.35 0.05 2.61 2.01 -0.25 -5.07 115.64 118.03 3gq9 s THR 541 Ca 0.00 0.35 -0.17 0.00 0.31 0.00 0.00 61.69 62.17 3gq9 s THR 541 Cb 0.00 -3.55 -0.06 0.00 0.01 0.00 0.00 72.50 68.90 3gq9 s THR 541 CO 0.00 0.39 0.50 -1.81 -0.69 0.00 0.00 174.62 173.01 3gq9 s ASP 542 N 0.56 6.95 -0.20 3.53 1.01 -1.26 -0.38 116.67 126.88 3gq9 s ASP 542 Ca 0.12 1.13 -0.02 0.00 0.71 0.00 0.00 52.55 54.49 3gq9 s ASP 542 Cb -0.12 -2.31 0.06 0.00 1.01 0.00 0.00 42.92 41.55 3gq9 s ASP 542 CO 0.02 0.29 0.00 -0.31 0.21 0.00 0.00 175.17 175.38 3gq9 s TYR 543 N -1.11 1.47 -0.64 4.23 1.51 0.96 -5.00 117.35 118.77 3gq9 s TYR 543 Ca 0.27 -1.11 0.07 0.00 -1.01 0.00 0.00 57.07 55.29 3gq9 s TYR 543 Cb -0.18 -1.21 -0.01 0.00 -0.11 0.00 0.00 41.96 40.45 3gq9 s TYR 543 CO 0.17 -0.65 0.51 0.09 -1.11 0.00 0.00 175.55 174.56 3gq9 n ASN 544 N 4.93 0.95 -0.15 2.29 3.02 -1.26 -1.26 115.26 123.78 3gq9 n ASN 544 Ca -0.10 -0.97 0.09 0.00 -0.03 0.00 0.00 54.58 53.57 3gq9 n ASN 544 Cb 0.46 0.54 0.14 0.00 -0.61 0.00 0.00 39.78 40.32 3gq9 n ASN 544 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 3gq9 n ASP 545 N -0.42 2.21 0.00 6.41 8.00 -1.26 -4.83 116.55 126.66 3gq9 n ASP 545 Ca 0.03 -3.15 0.00 0.00 0.71 0.00 0.00 54.79 52.38 3gq9 n ASP 545 Cb 0.15 -0.44 0.00 0.00 -0.02 0.00 0.00 41.12 40.82 3gq9 n ASP 545 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3gq9 n GLY 546 N -1.36 2.40 3.40 0.44 0.00 -1.26 -5.12 105.19 103.69 3gq9 n GLY 546 Ca 0.16 -1.69 -0.15 0.00 0.00 0.00 0.00 46.02 44.34 3gq9 n GLY 546 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 3gq9 s LEU 547 N 0.00 0.02 -0.13 0.99 2.34 -1.26 -5.03 118.68 115.61 3gq9 s LEU 547 Ca 0.00 0.64 -0.01 0.00 0.06 0.00 0.00 54.13 54.82 3gq9 s LEU 547 Cb 0.00 1.91 0.03 0.00 -0.56 0.00 0.00 46.19 47.57 3gq9 s LEU 547 CO 0.00 -0.42 -0.04 -0.89 -1.06 0.00 0.00 176.35 173.94 3gq9 s THR 548 N -0.76 0.85 -0.12 5.48 2.01 -1.26 -4.08 115.64 117.76 3gq9 s THR 548 Ca -0.08 -0.31 0.01 0.00 0.31 0.00 0.00 61.69 61.61 3gq9 s THR 548 Cb -0.03 -0.99 0.02 0.00 0.01 0.00 0.00 72.50 71.51 3gq9 s THR 548 CO 0.05 0.22 -0.14 -0.76 -0.69 0.00 0.00 174.62 173.30 3gq9 s LEU 549 N 1.76 1.63 0.16 4.42 1.43 0.18 -4.97 118.68 123.30 3gq9 s LEU 549 Ca 0.03 -0.42 0.09 0.00 -1.03 0.00 0.00 54.13 52.80 3gq9 s LEU 549 Cb -0.14 -1.07 -0.04 0.00 0.03 0.00 0.00 46.19 44.97 3gq9 s LEU 549 CO -0.07 -0.03 -0.20 -0.36 0.23 0.00 0.00 176.35 175.92 3gq9 s PHE 550 N 1.23 1.91 0.28 0.29 0.40 -1.26 -2.00 117.98 118.82 3gq9 s PHE 550 Ca -0.02 -0.44 0.09 0.00 -0.60 0.00 0.00 56.93 55.96 3gq9 s PHE 550 Cb -0.14 -0.96 -0.04 0.00 0.51 0.00 0.00 43.02 42.39 3gq9 s PHE 550 CO -0.05 0.35 0.06 -0.80 0.70 0.00 0.00 175.22 175.48 3gq9 s ASN 551 N -2.57 4.77 0.00 1.36 0.01 -1.26 -5.03 114.94 112.22 3gq9 s ASN 551 Ca 0.15 -0.58 0.00 0.00 -0.71 0.00 0.00 52.86 51.72 3gq9 s ASN 551 Cb -0.07 -0.94 0.00 0.00 0.41 0.00 0.00 41.25 40.65 3gq9 s ASN 551 CO 0.07 -0.06 0.00 0.61 -1.51 0.00 0.00 177.10 176.21 3gq9 n GLY 552 N -1.00 -2.54 3.60 0.66 0.00 -1.26 -4.84 105.19 99.82 3gq9 n GLY 552 Ca -0.06 -1.62 -0.48 0.00 0.00 0.00 0.00 46.02 43.86 3gq9 n GLY 552 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3gq9 n ALA 553 N -0.57 -0.34 -2.58 4.61 0.00 -1.24 -4.80 120.51 115.59 3gq9 n ALA 553 Ca 0.00 0.46 -0.32 0.00 0.00 0.00 0.00 53.44 53.57 3gq9 n ALA 553 Cb 0.00 -2.09 -0.14 0.00 0.00 0.00 0.00 19.45 17.22 3gq9 n ALA 553 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.50 177.62 3gq9 s PHE 554 N -0.08 2.63 -0.06 0.00 5.36 -1.13 -5.01 117.98 119.68 3gq9 s PHE 554 Ca 0.73 -0.36 -0.04 0.00 -0.96 0.00 0.00 56.93 56.31 3gq9 s PHE 554 Cb -0.81 -1.64 0.03 0.00 -0.34 0.00 0.00 43.02 40.26 3gq9 s PHE 554 CO 0.51 0.03 0.14 0.50 -1.46 0.00 0.00 175.22 174.95 3gq9 s ARG 555 N -0.46 0.12 0.05 10.12 3.52 -1.26 -2.02 118.95 129.01 3gq9 s ARG 555 Ca 0.06 0.31 0.01 0.00 -0.13 0.00 0.00 55.73 55.97 3gq9 s ARG 555 Cb -0.12 -0.09 -0.03 0.00 -1.56 0.00 0.00 34.95 33.15 3gq9 s ARG 555 CO 0.02 -0.11 -0.05 0.00 -0.81 0.00 0.00 175.30 174.34 3gq9 s ALA 556 N 0.79 0.53 -1.72 6.12 0.00 -0.94 -4.90 121.76 121.64 3gq9 s ALA 556 Ca -0.06 -0.96 -0.16 0.00 0.00 0.00 0.00 51.96 50.78 3gq9 s ALA 556 Cb -0.08 0.15 0.15 0.00 0.00 0.00 0.00 23.12 23.34 3gq9 s ALA 556 CO -0.04 -0.19 0.57 -1.13 0.00 0.00 0.00 175.76 174.97 3gq9 n SER 557 N 0.83 -1.83 -3.56 0.00 3.41 -1.26 -2.16 113.62 109.05 3gq9 n SER 557 Ca -0.19 -1.14 -0.15 0.00 -0.26 0.00 0.00 58.87 57.14 3gq9 n SER 557 Cb 0.58 -2.18 -0.12 0.00 -0.26 0.00 0.00 64.21 62.22 3gq9 n SER 557 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 3gq9 s THR 558 N -3.50 -0.41 -0.16 6.66 2.01 -1.26 -2.65 115.64 116.32 3gq9 s THR 558 Ca 0.60 0.09 0.20 0.00 0.31 0.00 0.00 61.69 62.88 3gq9 s THR 558 Cb -0.34 -0.58 0.19 0.00 0.01 0.00 0.00 72.50 71.78 3gq9 s THR 558 CO 0.97 -0.03 1.59 0.71 -0.69 0.00 0.00 174.62 177.17 3gq9 h THR 559 N 6.28 0.54 -2.94 -0.82 1.35 -1.92 -3.45 112.91 111.94 3gq9 h THR 559 Ca -0.16 -1.60 -0.07 0.00 -0.55 0.00 0.00 66.41 64.03 3gq9 h THR 559 Cb 1.13 2.14 -0.16 0.00 -1.73 0.00 0.00 68.15 69.53 3gq9 h THR 559 CO 0.21 0.28 -0.05 -0.94 -0.25 0.00 0.00 175.52 174.77 3gq9 s SER 560 N -6.31 -0.34 0.23 5.36 1.04 -1.26 -5.10 113.70 107.32 3gq9 s SER 560 Ca 0.04 0.06 -0.22 0.00 0.48 0.00 0.00 55.95 56.31 3gq9 s SER 560 Cb 0.07 0.45 0.04 0.00 0.10 0.00 0.00 66.02 66.68 3gq9 s SER 560 CO 0.69 -0.69 0.67 -0.94 0.98 0.00 0.00 173.24 173.96 3gq9 s SER 561 N -2.00 -0.38 0.00 7.02 1.04 -1.26 -4.25 113.70 113.87 3gq9 s SER 561 Ca -0.05 -0.37 0.00 0.00 0.48 0.00 0.00 55.95 56.01 3gq9 s SER 561 Cb -0.01 0.68 0.00 0.00 0.10 0.00 0.00 66.02 66.79 3gq9 s SER 561 CO -0.02 -1.19 0.00 0.61 0.98 0.00 0.00 173.24 173.61 3gq9 n GLY 562 N -0.43 -0.01 3.77 7.32 0.00 0.09 -4.95 105.19 110.99 3gq9 n GLY 562 Ca -0.09 -1.58 -0.41 0.00 0.00 0.00 0.00 46.02 43.94 3gq9 n GLY 562 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3gq9 s LYS 563 N 0.08 4.23 -0.11 1.61 2.47 -1.26 -4.81 119.74 121.94 3gq9 s LYS 563 Ca 0.00 2.39 0.02 0.00 -1.56 0.00 0.00 55.97 56.82 3gq9 s LYS 563 Cb 0.00 -3.03 0.01 0.00 -1.46 0.00 0.00 37.83 33.36 3gq9 s LYS 563 CO 0.00 -0.38 -0.16 0.42 0.16 0.00 0.00 175.35 175.39 3gq9 s ILE 564 N -0.95 1.56 0.69 5.43 1.01 -1.26 -1.63 121.20 126.05 3gq9 s ILE 564 Ca 0.52 -0.67 -0.15 0.00 0.00 0.00 0.00 60.65 60.35 3gq9 s ILE 564 Cb -0.43 -1.42 0.02 0.00 0.01 0.00 0.00 42.46 40.64 3gq9 s ILE 564 CO 0.56 0.45 1.14 -2.28 0.00 0.00 0.00 174.94 174.81 3gq9 s HIS 565 N 1.00 2.41 -0.11 3.97 5.65 0.05 -4.72 115.29 123.54 3gq9 s HIS 565 Ca -0.06 1.58 0.27 0.00 0.25 0.00 0.00 55.06 57.10 3gq9 s HIS 565 Cb -0.15 -3.26 1.34 0.00 -1.18 0.00 0.00 32.58 29.33 3gq9 s HIS 565 CO -0.02 -2.01 1.83 0.66 -0.65 0.00 0.00 174.74 174.55 3gq9 h SER 566 N -0.17 0.00 -1.04 9.88 4.64 -1.91 -0.83 113.55 124.11 3gq9 h SER 566 Ca -0.47 0.00 -0.61 0.00 -0.47 0.00 0.00 61.79 60.24 3gq9 h SER 566 Cb 1.26 0.00 -0.38 0.00 -0.31 0.00 0.00 62.40 62.98 3gq9 h SER 566 CO 0.52 0.00 -0.17 -0.62 -0.87 0.00 0.00 176.83 175.69 3gq9 n GLU 567 N -2.48 3.26 -4.21 4.77 1.02 -1.26 -3.72 120.64 118.03 3gq9 n GLU 567 Ca -0.00 -3.92 -0.17 0.00 -0.02 0.00 0.00 57.16 53.05 3gq9 n GLU 567 Cb 0.13 -2.28 -0.07 0.00 -0.02 0.00 0.00 31.44 29.20 3gq9 n GLU 567 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 3gq9 s GLY 568 N -2.88 1.97 0.07 0.62 0.00 -0.32 -0.36 107.32 106.42 3gq9 s GLY 568 Ca 0.55 -1.85 -0.26 0.00 0.00 0.00 0.00 44.72 43.16 3gq9 s GLY 568 CO -0.05 -1.29 0.70 -0.11 0.00 0.00 0.00 173.10 172.35 3gq9 s PHE 569 N -3.35 -0.50 -0.04 1.90 -0.71 -1.12 -2.85 117.98 111.32 3gq9 s PHE 569 Ca 0.37 0.44 0.01 0.00 -1.04 0.00 0.00 56.93 56.71 3gq9 s PHE 569 Cb 0.02 0.53 0.02 0.00 -1.21 0.00 0.00 43.02 42.38 3gq9 s PHE 569 CO 0.24 -0.71 -0.02 0.42 -1.34 0.00 0.00 175.22 173.81 3gq9 s ILE 570 N -3.06 0.36 0.05 -4.49 1.01 -0.86 -2.03 121.20 112.18 3gq9 s ILE 570 Ca -0.00 -0.02 0.02 0.00 0.00 0.00 0.00 60.65 60.65 3gq9 s ILE 570 Cb -0.01 -0.42 -0.03 0.00 0.01 0.00 0.00 42.46 42.01 3gq9 s ILE 570 CO -0.08 0.19 -0.08 -0.04 0.00 0.00 0.00 174.94 174.93 3gq9 s MET 571 N 0.97 0.57 -1.42 2.79 -1.94 -0.42 -2.21 119.30 117.65 3gq9 s MET 571 Ca -0.10 -0.83 -0.10 0.00 -1.71 0.00 0.00 55.69 52.95 3gq9 s MET 571 Cb -0.14 -0.31 0.04 0.00 2.01 0.00 0.00 34.83 36.44 3gq9 s MET 571 CO -0.01 0.05 1.04 0.41 -0.01 0.00 0.00 175.02 176.51 3gq9 n GLY 572 N 1.29 -0.49 3.39 -0.03 0.00 -0.92 -1.33 105.19 107.10 3gq9 n GLY 572 Ca -0.22 0.21 -0.20 0.00 0.00 0.00 0.00 46.02 45.82 3gq9 n GLY 572 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3gq9 s SER 573 N -3.47 2.38 0.36 1.61 0.01 -1.08 -2.55 113.70 110.96 3gq9 s SER 573 Ca 0.54 -1.21 0.05 0.00 1.31 0.00 0.00 55.95 56.63 3gq9 s SER 573 Cb -0.25 -0.10 0.05 0.00 0.21 0.00 0.00 66.02 65.93 3gq9 s SER 573 CO 0.78 -0.42 0.39 0.35 0.41 0.00 0.00 173.24 174.75 3gq9 n THR 574 N -0.52 0.00 -0.82 1.44 -2.24 -0.46 -4.36 114.28 107.31 3gq9 n THR 574 Ca -0.05 -1.29 -0.32 0.00 -2.27 0.00 0.00 64.05 60.12 3gq9 n THR 574 Cb 0.64 -0.47 0.15 0.00 -2.10 0.00 0.00 70.33 68.55 3gq9 n THR 574 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 3gq9 n SER 575 N -2.27 0.29 0.00 3.42 3.41 -1.26 -4.11 113.62 113.10 3gq9 n SER 575 Ca 0.05 0.47 0.00 0.00 -0.26 0.00 0.00 58.87 59.13 3gq9 n SER 575 Cb 0.39 -1.46 0.00 0.00 -0.26 0.00 0.00 64.21 62.88 3gq9 n SER 575 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3gq9 n GLY 576 N 0.50 0.72 3.90 5.00 0.00 -1.26 -1.94 105.19 112.10 3gq9 n GLY 576 Ca 0.12 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.86 3gq9 n GLY 576 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3gq9 s GLU 578 N -4.11 0.87 -0.43 0.00 -1.05 -0.92 -0.73 118.70 112.32 3gq9 s GLU 578 Ca 0.47 0.08 0.03 0.00 -0.15 0.00 0.00 54.97 55.41 3gq9 s GLU 578 Cb -0.10 0.40 0.16 0.00 -0.44 0.00 0.00 34.13 34.15 3gq9 s GLU 578 CO 0.36 -0.25 0.33 0.00 0.95 0.00 0.00 175.26 176.64 3gq9 s ALA 579 N -1.19 1.59 -2.30 -0.84 0.00 -0.65 -0.16 121.76 118.21 3gq9 s ALA 579 Ca -0.12 -2.50 0.27 0.00 0.00 0.00 0.00 51.96 49.61 3gq9 s ALA 579 Cb -0.02 -1.66 0.79 0.00 0.00 0.00 0.00 23.12 22.22 3gq9 s ALA 579 CO 0.07 -2.01 1.59 -1.13 0.00 0.00 0.00 175.76 174.28 3gq9 n SER 580 N 2.98 1.57 -4.43 0.00 3.41 -0.40 -0.77 113.62 115.99 3gq9 n SER 580 Ca 0.25 -1.38 -0.22 0.00 -0.26 0.00 0.00 58.87 57.26 3gq9 n SER 580 Cb 0.44 0.07 -0.10 0.00 -0.26 0.00 0.00 64.21 64.36 3gq9 n SER 580 CO 0.00 0.00 0.00 0.68 -0.16 0.00 0.00 175.04 175.56 3gq9 s VAL 581 N -2.18 1.15 0.28 -3.33 -7.23 -1.26 -4.50 120.40 103.33 3gq9 s VAL 581 Ca 0.31 -2.00 -0.30 0.00 -1.81 0.00 0.00 61.98 58.18 3gq9 s VAL 581 Cb 0.20 -2.75 -0.13 0.00 0.56 0.00 0.00 36.38 34.26 3gq9 s VAL 581 CO 0.40 0.00 1.38 -0.24 -0.31 0.00 0.00 175.10 176.33 3gq9 n SER 582 N -0.75 2.86 -3.52 4.85 2.88 -1.26 -2.85 113.62 115.81 3gq9 n SER 582 Ca -0.03 1.17 -0.19 0.00 -1.33 0.00 0.00 58.87 58.49 3gq9 n SER 582 Cb 0.66 -1.46 0.06 0.00 -0.75 0.00 0.00 64.21 62.73 3gq9 n SER 582 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 3gq9 n LYS 583 N 1.53 -5.34 -4.21 -1.46 5.02 0.52 -3.48 118.16 110.73 3gq9 n LYS 583 Ca 0.09 0.75 -0.19 0.00 -2.02 0.00 0.00 58.31 56.94 3gq9 n LYS 583 Cb 0.34 -5.54 -0.12 0.00 -0.02 0.00 0.00 35.03 29.68 3gq9 n LYS 583 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 3gq9 s SER 584 N -4.24 1.66 0.06 4.39 1.04 -1.13 -0.33 113.70 115.16 3gq9 s SER 584 Ca 0.06 -0.58 -0.24 0.00 0.48 0.00 0.00 55.95 55.67 3gq9 s SER 584 Cb -0.01 -0.06 0.06 0.00 0.10 0.00 0.00 66.02 66.11 3gq9 s SER 584 CO 0.77 -0.05 0.58 -0.83 0.98 0.00 0.00 173.24 174.68 3gq9 s GLY 585 N -1.60 -0.52 -0.07 7.32 0.00 -1.18 -2.77 107.32 108.50 3gq9 s GLY 585 Ca -0.01 0.70 0.02 0.00 0.00 0.00 0.00 44.72 45.43 3gq9 s GLY 585 CO 0.02 0.38 -0.12 0.14 0.00 0.00 0.00 173.10 173.52 3gq9 s VAL 586 N -2.64 1.13 0.06 1.40 1.01 -0.86 -1.80 120.40 118.70 3gq9 s VAL 586 Ca -0.04 -0.46 0.10 0.00 0.00 0.00 0.00 61.98 61.58 3gq9 s VAL 586 Cb -0.01 -1.04 -0.03 0.00 0.00 0.00 0.00 36.38 35.30 3gq9 s VAL 586 CO -0.03 0.36 -0.26 -0.76 0.00 0.00 0.00 175.10 174.40 3gq9 s LEU 587 N 0.80 2.20 -1.54 3.92 1.43 0.62 -1.30 118.68 124.81 3gq9 s LEU 587 Ca -0.12 -0.62 -0.08 0.00 -1.03 0.00 0.00 54.13 52.28 3gq9 s LEU 587 Cb -0.15 -1.25 0.07 0.00 0.03 0.00 0.00 46.19 44.88 3gq9 s LEU 587 CO 0.02 0.24 0.53 0.35 0.23 0.00 0.00 176.35 177.72 3gq9 n THR 588 N 1.59 -2.03 -4.36 5.49 -2.24 -0.44 -2.41 114.28 109.88 3gq9 n THR 588 Ca -0.17 -0.30 -0.19 0.00 -2.27 0.00 0.00 64.05 61.13 3gq9 n THR 588 Cb 0.52 -2.10 -0.10 0.00 -2.10 0.00 0.00 70.33 66.55 3gq9 n THR 588 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 3gq9 s SER 589 N -3.93 1.63 0.01 3.42 0.01 -1.25 -2.36 113.70 111.23 3gq9 s SER 589 Ca 0.31 -1.43 0.04 0.00 1.31 0.00 0.00 55.95 56.18 3gq9 s SER 589 Cb -0.17 0.16 -0.01 0.00 0.21 0.00 0.00 66.02 66.21 3gq9 s SER 589 CO 0.92 -0.74 -0.12 -0.94 0.41 0.00 0.00 173.24 172.77 3gq9 s SER 590 N -3.38 1.38 -1.69 2.44 1.04 -0.40 -1.36 113.70 111.74 3gq9 s SER 590 Ca 0.36 -0.30 -0.10 0.00 0.48 0.00 0.00 55.95 56.39 3gq9 s SER 590 Cb 0.07 -0.12 0.10 0.00 0.10 0.00 0.00 66.02 66.17 3gq9 s SER 590 CO 0.15 0.08 0.25 -1.20 0.98 0.00 0.00 173.24 173.50 3gq9 n SER 591 N 2.44 -0.19 -4.21 7.02 7.64 -0.82 -1.71 113.62 123.79 3gq9 n SER 591 Ca -0.16 -1.26 -0.29 0.00 1.01 0.00 0.00 58.87 58.17 3gq9 n SER 591 Cb 0.56 -1.59 -0.16 0.00 -1.01 0.00 0.00 64.21 62.01 3gq9 n SER 591 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 3gq9 s SER 592 N -3.91 2.59 -0.03 6.43 0.01 -1.24 -3.05 113.70 114.50 3gq9 s SER 592 Ca 0.35 -0.42 0.03 0.00 1.31 0.00 0.00 55.95 57.21 3gq9 s SER 592 Cb -0.20 -0.64 -0.00 0.00 0.21 0.00 0.00 66.02 65.39 3gq9 s SER 592 CO 1.01 0.21 -0.12 -0.54 0.41 0.00 0.00 173.24 174.21 3gq9 s LYS 593 N -0.14 1.19 -0.07 12.44 1.02 -0.24 -2.17 119.74 131.76 3gq9 s LYS 593 Ca -0.01 -0.42 0.03 0.00 0.02 0.00 0.00 55.97 55.59 3gq9 s LYS 593 Cb -0.12 -1.10 0.01 0.00 -0.52 0.00 0.00 37.83 36.10 3gq9 s LYS 593 CO 0.02 0.18 -0.16 -0.08 -0.92 0.00 0.00 175.35 174.39 3gq9 s THR 594 N 0.04 1.44 -0.17 2.17 -1.32 0.78 -1.50 115.64 117.08 3gq9 s THR 594 Ca -0.01 -0.67 0.14 0.00 -1.21 0.00 0.00 61.69 59.94 3gq9 s THR 594 Cb -0.09 -1.28 0.37 0.00 -1.51 0.00 0.00 72.50 69.99 3gq9 s THR 594 CO 0.01 0.42 1.19 -1.54 -2.21 0.00 0.00 174.62 172.49 3gq9 n SER 595 N 3.67 1.81 -4.50 8.08 3.41 -0.25 -1.28 113.62 124.56 3gq9 n SER 595 Ca -0.21 -3.51 -0.39 0.00 -0.26 0.00 0.00 58.87 54.49 3gq9 n SER 595 Cb 0.52 -0.48 -0.11 0.00 -0.26 0.00 0.00 64.21 63.88 3gq9 n SER 595 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 3gq9 s SER 596 N -3.00 5.84 -0.02 4.04 0.15 -1.20 -4.76 113.70 114.75 3gq9 s SER 596 Ca 0.35 -0.40 -0.30 0.00 0.70 0.00 0.00 55.95 56.30 3gq9 s SER 596 Cb 0.34 -2.08 -0.06 0.00 -1.71 0.00 0.00 66.02 62.51 3gq9 s SER 596 CO -0.04 -0.19 1.49 -0.70 1.20 0.00 0.00 173.24 175.00 3gq9 s GLU 597 N 1.68 4.24 -0.23 5.44 2.12 -1.24 -3.42 118.70 127.29 3gq9 s GLU 597 Ca 0.06 2.05 -0.07 0.00 0.36 0.00 0.00 54.97 57.37 3gq9 s GLU 597 Cb -0.17 -3.70 0.01 0.00 0.26 0.00 0.00 34.13 30.53 3gq9 s GLU 597 CO 0.09 -0.68 0.26 0.54 -0.54 0.00 0.00 175.26 174.93 3gq9 n ARG 598 N 5.98 -1.51 -3.76 4.30 1.74 0.55 -2.04 116.66 121.92 3gq9 n ARG 598 Ca 0.15 1.52 -0.10 0.00 -0.77 0.00 0.00 57.85 58.65 3gq9 n ARG 598 Cb 0.43 -3.80 -0.04 0.00 -1.02 0.00 0.00 32.46 28.03 3gq9 n ARG 598 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 3gq9 s SER 599 N -1.69 -0.23 -0.16 0.55 1.04 -0.56 -0.85 113.70 111.80 3gq9 s SER 599 Ca 0.11 -0.52 -0.09 0.00 0.48 0.00 0.00 55.95 55.93 3gq9 s SER 599 Cb -0.03 0.56 0.06 0.00 0.10 0.00 0.00 66.02 66.71 3gq9 s SER 599 CO 0.44 -1.04 0.40 -0.22 0.98 0.00 0.00 173.24 173.80 3gq9 s LEU 600 N -2.88 0.01 -0.14 2.42 2.96 -0.63 -3.09 118.68 117.33 3gq9 s LEU 600 Ca 0.10 0.85 -0.01 0.00 -0.22 0.00 0.00 54.13 54.85 3gq9 s LEU 600 Cb -0.01 1.30 -0.02 0.00 0.50 0.00 0.00 46.19 47.97 3gq9 s LEU 600 CO -0.03 -0.18 -0.12 -0.63 -1.32 0.00 0.00 176.35 174.07 3gq9 s ILE 601 N 1.25 3.15 0.04 6.68 1.01 -0.75 -1.31 121.20 131.28 3gq9 s ILE 601 Ca -0.08 -0.62 0.01 0.00 0.00 0.00 0.00 60.65 59.95 3gq9 s ILE 601 Cb -0.08 -2.34 -0.03 0.00 0.01 0.00 0.00 42.46 40.02 3gq9 s ILE 601 CO -0.11 0.51 -0.05 0.00 0.00 0.00 0.00 174.94 175.30 3gq9 s ALA 602 N 0.45 0.45 -1.46 9.38 0.00 -0.06 -0.28 121.76 130.24 3gq9 s ALA 602 Ca -0.09 -0.88 -0.10 0.00 0.00 0.00 0.00 51.96 50.89 3gq9 s ALA 602 Cb -0.16 0.15 0.06 0.00 0.00 0.00 0.00 23.12 23.17 3gq9 s ALA 602 CO 0.04 -0.18 0.76 0.41 0.00 0.00 0.00 175.76 176.80 3gq9 n GLY 603 N 1.01 -0.50 3.39 0.00 0.00 -0.99 -1.56 105.19 106.53 3gq9 n GLY 603 Ca -0.20 0.15 -0.19 0.00 0.00 0.00 0.00 46.02 45.78 3gq9 n GLY 603 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3gq9 s SER 604 N -2.99 2.13 0.05 1.61 0.01 -1.19 -3.04 113.70 110.28 3gq9 s SER 604 Ca 0.51 -1.28 0.04 0.00 1.31 0.00 0.00 55.95 56.52 3gq9 s SER 604 Cb -0.25 -0.04 -0.03 0.00 0.21 0.00 0.00 66.02 65.91 3gq9 s SER 604 CO 0.62 -0.53 -0.11 -0.94 0.41 0.00 0.00 173.24 172.69 3gq9 s SER 605 N -3.39 1.24 -1.71 2.44 1.04 -0.19 -1.28 113.70 111.86 3gq9 s SER 605 Ca 0.32 -0.57 -0.12 0.00 0.48 0.00 0.00 55.95 56.06 3gq9 s SER 605 Cb 0.07 -0.01 0.12 0.00 0.10 0.00 0.00 66.02 66.30 3gq9 s SER 605 CO 0.12 -0.14 0.33 0.35 0.98 0.00 0.00 173.24 174.88 3gq9 n THR 606 N 1.41 -0.64 -4.32 2.02 -2.24 -0.70 -1.35 114.28 108.47 3gq9 n THR 606 Ca -0.22 -0.25 -0.25 0.00 -2.27 0.00 0.00 64.05 61.07 3gq9 n THR 606 Cb 0.54 -0.88 -0.08 0.00 -2.10 0.00 0.00 70.33 67.81 3gq9 n THR 606 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 3gq9 s SER 607 N -3.81 4.30 -0.11 3.42 0.01 -1.23 -3.40 113.70 112.86 3gq9 s SER 607 Ca 0.42 -0.67 -0.07 0.00 1.31 0.00 0.00 55.95 56.94 3gq9 s SER 607 Cb -0.24 -0.72 0.04 0.00 0.21 0.00 0.00 66.02 65.31 3gq9 s SER 607 CO 1.00 0.05 0.28 -0.70 0.41 0.00 0.00 173.24 174.28 3gq9 s GLU 608 N -3.33 0.27 -0.17 12.44 2.12 0.29 -1.08 118.70 129.23 3gq9 s GLU 608 Ca 0.29 0.53 -0.01 0.00 0.36 0.00 0.00 54.97 56.14 3gq9 s GLU 608 Cb -0.07 -0.03 -0.00 0.00 0.26 0.00 0.00 34.13 34.29 3gq9 s GLU 608 CO 0.17 -0.13 -0.12 0.00 -0.54 0.00 0.00 175.26 174.64 3gq9 s ALA 609 N 0.97 2.58 -0.00 6.30 0.00 -0.56 -1.01 121.76 130.04 3gq9 s ALA 609 Ca -0.07 -1.08 0.00 0.00 0.00 0.00 0.00 51.96 50.82 3gq9 s ALA 609 Cb -0.08 -1.35 0.00 0.00 0.00 0.00 0.00 23.12 21.69 3gq9 s ALA 609 CO -0.07 -0.14 0.60 0.36 0.00 0.00 0.00 175.76 176.51 3gq9 n LYS 610 N 4.26 0.15 0.00 0.00 2.85 0.21 -1.09 118.16 124.54 3gq9 n LYS 610 Ca -0.19 -0.63 0.00 0.00 -1.05 0.00 0.00 58.31 56.44 3gq9 n LYS 610 Cb 0.51 -0.53 0.00 0.00 -0.65 0.00 0.00 35.03 34.36 3gq9 n LYS 610 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 3gq9 n GLY 611 N -0.03 0.54 3.17 2.58 0.00 -1.21 -4.73 105.19 105.50 3gq9 n GLY 611 Ca 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.93 3gq9 n GLY 611 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3gq9 s THR 612 N 2.73 0.15 -1.47 2.61 -4.23 -1.26 -3.66 115.64 110.51 3gq9 s THR 612 Ca 0.00 -1.26 -0.08 0.00 -1.18 0.00 0.00 61.69 59.18 3gq9 s THR 612 Cb 0.00 -1.28 0.06 0.00 1.34 0.00 0.00 72.50 72.61 3gq9 s THR 612 CO 0.00 -0.69 0.75 -1.22 -0.54 0.00 0.00 174.62 172.92 3gq9 n TYR 613 N 0.13 -1.96 -3.92 3.99 4.02 -0.03 -0.52 117.16 118.86 3gq9 n TYR 613 Ca -0.16 0.84 -0.37 0.00 -0.01 0.00 0.00 57.90 58.20 3gq9 n TYR 613 Cb 0.61 -3.87 -0.06 0.00 -0.02 0.00 0.00 39.34 36.00 3gq9 n TYR 613 CO 0.00 0.00 0.00 -0.80 -1.01 0.00 0.00 176.86 175.05 3gq9 s ASN 614 N -3.83 6.29 -0.09 7.72 0.01 -0.89 -3.45 114.94 120.70 3gq9 s ASN 614 Ca 0.35 0.43 0.02 0.00 -0.71 0.00 0.00 52.86 52.95 3gq9 s ASN 614 Cb -0.18 -2.01 0.01 0.00 0.41 0.00 0.00 41.25 39.48 3gq9 s ASN 614 CO 0.85 0.40 -0.13 -0.89 -1.51 0.00 0.00 177.10 175.82 3gq9 s THR 615 N -1.03 1.31 -0.12 1.60 2.01 -1.18 -1.61 115.64 116.61 3gq9 s THR 615 Ca 0.16 -0.55 -0.01 0.00 0.31 0.00 0.00 61.69 61.60 3gq9 s THR 615 Cb -0.12 -1.20 0.03 0.00 0.01 0.00 0.00 72.50 71.22 3gq9 s THR 615 CO 0.05 0.40 -0.04 -0.63 -0.69 0.00 0.00 174.62 173.71 3gq9 s ILE 616 N 0.89 0.80 -0.04 1.82 1.01 -0.43 -1.23 121.20 124.03 3gq9 s ILE 616 Ca -0.10 -0.24 0.03 0.00 0.00 0.00 0.00 60.65 60.34 3gq9 s ILE 616 Cb -0.15 -0.93 0.00 0.00 0.01 0.00 0.00 42.46 41.39 3gq9 s ILE 616 CO 0.01 0.25 -0.12 -0.76 0.00 0.00 0.00 174.94 174.32 3gq9 s LEU 617 N 1.79 1.81 -1.40 2.97 1.43 -0.45 -0.88 118.68 123.94 3gq9 s LEU 617 Ca 0.04 -0.25 -0.04 0.00 -1.03 0.00 0.00 54.13 52.85 3gq9 s LEU 617 Cb -0.13 -0.71 0.03 0.00 0.03 0.00 0.00 46.19 45.41 3gq9 s LEU 617 CO -0.07 0.09 0.72 0.61 0.23 0.00 0.00 176.35 177.93 3gq9 n GLY 618 N 3.30 -0.33 3.29 -3.19 0.00 -0.60 -1.47 105.19 106.19 3gq9 n GLY 618 Ca -0.19 0.15 -0.16 0.00 0.00 0.00 0.00 46.02 45.82 3gq9 n GLY 618 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3gq9 s SER 619 N -4.06 2.17 -0.07 1.61 0.01 -1.21 -3.27 113.70 108.88 3gq9 s SER 619 Ca 0.20 -1.01 0.01 0.00 1.31 0.00 0.00 55.95 56.46 3gq9 s SER 619 Cb -0.10 -0.07 0.02 0.00 0.21 0.00 0.00 66.02 66.08 3gq9 s SER 619 CO 0.84 -0.25 -0.09 -0.22 0.41 0.00 0.00 173.24 173.92 3gq9 s LEU 620 N -3.22 1.44 -1.39 2.44 0.20 -0.30 -1.02 118.68 116.82 3gq9 s LEU 620 Ca 0.19 -0.26 -0.09 0.00 0.69 0.00 0.00 54.13 54.66 3gq9 s LEU 620 Cb 0.01 -0.75 0.02 0.00 -0.43 0.00 0.00 46.19 45.04 3gq9 s LEU 620 CO 0.04 -0.03 1.13 0.61 -0.29 0.00 0.00 176.35 177.81 3gq9 n GLY 621 N 4.19 -0.54 3.85 7.98 0.00 -0.45 -0.07 105.19 120.14 3gq9 n GLY 621 Ca -0.20 0.24 -0.37 0.00 0.00 0.00 0.00 46.02 45.70 3gq9 n GLY 621 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3gq9 s ALA 622 N -3.31 3.84 -0.07 4.61 0.00 -1.25 -2.64 121.76 122.94 3gq9 s ALA 622 Ca 0.58 -0.65 0.02 0.00 0.00 0.00 0.00 51.96 51.91 3gq9 s ALA 622 Cb -0.26 -1.99 0.01 0.00 0.00 0.00 0.00 23.12 20.88 3gq9 s ALA 622 CO 0.72 0.54 -0.13 0.08 0.00 0.00 0.00 175.76 176.97 3gq9 s VAL 623 N -0.80 1.20 -0.26 0.00 1.01 -0.49 -0.55 120.40 120.51 3gq9 s VAL 623 Ca 0.14 -0.51 0.01 0.00 0.00 0.00 0.00 61.98 61.62 3gq9 s VAL 623 Cb -0.12 -1.10 0.05 0.00 0.00 0.00 0.00 36.38 35.22 3gq9 s VAL 623 CO 0.03 0.37 -0.08 0.00 0.00 0.00 0.00 175.10 175.42 3gq9 s ALA 624 N 0.68 2.63 -0.12 5.51 0.00 -0.18 -0.98 121.76 129.31 3gq9 s ALA 624 Ca -0.14 -1.70 0.15 0.00 0.00 0.00 0.00 51.96 50.26 3gq9 s ALA 624 Cb -0.16 -1.67 0.33 0.00 0.00 0.00 0.00 23.12 21.62 3gq9 s ALA 624 CO 0.04 -1.13 1.16 -0.40 0.00 0.00 0.00 175.76 175.43 3gq9 n ASP 625 N 4.52 1.50 -4.10 0.00 5.68 -0.99 -0.62 116.55 122.53 3gq9 n ASP 625 Ca -0.14 -3.04 -0.08 0.00 -0.50 0.00 0.00 54.79 51.03 3gq9 n ASP 625 Cb 0.43 -0.41 -0.10 0.00 -1.14 0.00 0.00 41.12 39.90 3gq9 n ASP 625 CO 0.00 0.00 0.00 -0.70 -1.33 0.00 0.00 177.20 175.17 3gq9 s GLU 626 N -2.03 0.67 0.18 0.11 2.56 -1.26 -4.39 118.70 114.54 3gq9 s GLU 626 Ca 0.30 -1.26 -0.33 0.00 0.00 0.00 0.00 54.97 53.68 3gq9 s GLU 626 Cb 0.30 0.20 -0.14 0.00 2.00 0.00 0.00 34.13 36.49 3gq9 s GLU 626 CO -0.05 -0.13 1.58 0.00 -0.56 0.00 0.00 175.26 176.09 3gq9 n GLN 627 N 0.07 2.22 -0.97 4.30 10.64 -1.26 -1.80 117.38 130.58 3gq9 n GLN 627 Ca -0.13 0.80 0.00 0.00 -1.83 0.00 0.00 57.00 55.84 3gq9 n GLN 627 Cb 0.61 -2.57 0.00 0.00 -0.86 0.00 0.00 30.24 27.43 3gq9 n GLN 627 CO 0.00 0.00 0.00 1.19 -1.83 0.00 0.00 177.06 176.42 3gq9 n PHE 628 N 3.29 0.00 -2.45 2.61 3.01 0.32 -1.32 117.46 122.93 3gq9 n PHE 628 Ca 0.16 0.00 -0.34 0.00 1.01 0.00 0.00 57.45 58.28 3gq9 n PHE 628 Cb 0.30 -1.37 -0.02 0.00 -0.01 0.00 0.00 39.48 38.37 3gq9 n PHE 628 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 3gq9 s ALA 629 N -1.35 2.82 0.08 4.37 0.00 -0.74 -3.73 121.76 123.21 3gq9 s ALA 629 Ca 0.00 0.69 -0.21 0.00 0.00 0.00 0.00 51.96 52.43 3gq9 s ALA 629 Cb 0.00 -3.29 0.05 0.00 0.00 0.00 0.00 23.12 19.88 3gq9 s ALA 629 CO 0.00 -0.46 0.51 0.00 0.00 0.00 0.00 175.76 175.81 3gq9 s ALA 630 N -1.90 -1.31 -0.02 0.00 0.00 -0.34 -3.11 121.76 115.08 3gq9 s ALA 630 Ca 0.69 0.45 -0.02 0.00 0.00 0.00 0.00 51.96 53.08 3gq9 s ALA 630 Cb -0.19 0.55 0.01 0.00 0.00 0.00 0.00 23.12 23.49 3gq9 s ALA 630 CO 0.22 -0.59 0.06 -0.51 0.00 0.00 0.00 175.76 174.94 3gq9 s LEU 631 N -2.29 1.57 -0.05 0.00 1.02 -0.36 -1.09 118.68 117.48 3gq9 s LEU 631 Ca -0.02 0.11 0.02 0.00 0.02 0.00 0.00 54.13 54.26 3gq9 s LEU 631 Cb -0.00 0.15 0.01 0.00 0.02 0.00 0.00 46.19 46.37 3gq9 s LEU 631 CO -0.06 -0.05 -0.09 -0.63 0.02 0.00 0.00 176.35 175.54 3gq9 s ILE 632 N 0.33 0.86 -1.28 -0.59 1.01 -0.35 -1.34 121.20 119.83 3gq9 s ILE 632 Ca -0.02 -0.33 -0.06 0.00 0.00 0.00 0.00 60.65 60.23 3gq9 s ILE 632 Cb -0.04 -0.81 -0.01 0.00 0.01 0.00 0.00 42.46 41.62 3gq9 s ILE 632 CO -0.01 0.29 0.63 -1.20 0.00 0.00 0.00 174.94 174.65 3gq9 n SER 633 N 3.78 -2.20 -4.26 3.58 7.64 -0.54 -2.06 113.62 119.55 3gq9 n SER 633 Ca -0.23 -0.94 -0.23 0.00 1.01 0.00 0.00 58.87 58.48 3gq9 n SER 633 Cb 0.52 -3.55 -0.13 0.00 -1.01 0.00 0.00 64.21 60.04 3gq9 n SER 633 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3gq9 s ALA 634 N -3.71 1.67 -0.04 -0.43 0.00 -1.25 -2.14 121.76 115.86 3gq9 s ALA 634 Ca 0.15 -1.17 0.04 0.00 0.00 0.00 0.00 51.96 50.98 3gq9 s ALA 634 Cb -0.05 -0.23 -0.00 0.00 0.00 0.00 0.00 23.12 22.84 3gq9 s ALA 634 CO 0.85 0.33 -0.15 -1.12 0.00 0.00 0.00 175.76 175.66 3gq9 s SER 635 N -1.77 1.95 -1.37 0.00 0.01 0.42 -1.15 113.70 111.79 3gq9 s SER 635 Ca 0.05 -0.32 -0.00 0.00 1.31 0.00 0.00 55.95 56.99 3gq9 s SER 635 Cb -0.10 -0.53 -0.00 0.00 0.21 0.00 0.00 66.02 65.60 3gq9 s SER 635 CO 0.04 0.14 0.52 0.00 0.41 0.00 0.00 173.24 174.34 3gq9 n GLN 636 N 3.17 -3.84 -4.10 12.44 1.13 0.90 -0.84 117.38 126.23 3gq9 n GLN 636 Ca -0.18 0.48 -0.11 0.00 -1.94 0.00 0.00 57.00 55.25 3gq9 n GLN 636 Cb 0.53 -4.76 -0.11 0.00 0.11 0.00 0.00 30.24 26.02 3gq9 n GLN 636 CO 0.00 0.00 0.00 -1.12 -1.44 0.00 0.00 177.06 174.50 3gq9 s SER 637 N -4.36 0.92 -0.06 1.08 0.01 -1.08 -2.31 113.70 107.90 3gq9 s SER 637 Ca 0.01 -0.76 -0.01 0.00 1.31 0.00 0.00 55.95 56.50 3gq9 s SER 637 Cb -0.00 0.07 0.03 0.00 0.21 0.00 0.00 66.02 66.33 3gq9 s SER 637 CO 0.86 -0.34 -0.01 -0.60 0.41 0.00 0.00 173.24 173.56 3gq9 s ARG 638 N -2.65 0.57 -0.38 12.44 3.52 -0.12 -1.40 118.95 130.94 3gq9 s ARG 638 Ca -0.00 0.07 -0.13 0.00 -0.13 0.00 0.00 55.73 55.53 3gq9 s ARG 638 Cb -0.03 -0.83 0.01 0.00 -1.56 0.00 0.00 34.95 32.54 3gq9 s ARG 638 CO -0.02 -0.22 0.25 0.00 -0.81 0.00 0.00 175.30 174.49 3gq9 s ALA 639 N 1.57 3.41 -0.25 6.12 0.00 -0.15 -1.38 121.76 131.07 3gq9 s ALA 639 Ca -0.01 -1.61 0.06 0.00 0.00 0.00 0.00 51.96 50.40 3gq9 s ALA 639 Cb -0.13 -2.71 0.15 0.00 0.00 0.00 0.00 23.12 20.43 3gq9 s ALA 639 CO -0.03 -1.28 1.11 0.43 0.00 0.00 0.00 175.76 175.99 3gq9 n SER 640 N 5.09 2.40 -4.93 0.00 7.64 0.72 -2.35 113.62 122.18 3gq9 n SER 640 Ca -0.12 -2.23 -0.26 0.00 1.01 0.00 0.00 58.87 57.28 3gq9 n SER 640 Cb 0.48 -0.15 -0.02 0.00 -1.01 0.00 0.00 64.21 63.50 3gq9 n SER 640 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 3gq9 s GLY 641 N -1.33 1.59 -0.09 0.23 0.00 -1.23 -4.64 107.32 101.84 3gq9 s GLY 641 Ca 0.13 -0.87 -0.30 0.00 0.00 0.00 0.00 44.72 43.69 3gq9 s GLY 641 CO 0.05 -0.82 1.58 0.21 0.00 0.00 0.00 173.10 174.12 3gq9 s ASN 642 N -3.54 6.69 -1.58 1.64 2.47 -1.25 -2.59 114.94 116.78 3gq9 s ASN 642 Ca 0.39 2.09 -0.03 0.00 0.42 0.00 0.00 52.86 55.73 3gq9 s ASN 642 Cb -0.10 -2.53 0.01 0.00 -1.45 0.00 0.00 41.25 37.17 3gq9 s ASN 642 CO 0.31 -0.92 0.40 1.41 -3.72 0.00 0.00 177.10 174.57 3gq9 n HIS 643 N 7.16 -1.66 -3.49 0.43 8.25 -0.43 -0.19 115.22 125.28 3gq9 n HIS 643 Ca 0.17 0.34 -0.40 0.00 -0.26 0.00 0.00 57.72 57.58 3gq9 n HIS 643 Cb 0.43 -4.16 -0.10 0.00 1.12 0.00 0.00 29.99 27.29 3gq9 n HIS 643 CO 0.00 0.00 0.00 1.21 0.64 0.00 0.00 176.34 178.19 3gq9 s ASN 644 N -2.48 6.11 -0.14 0.41 2.47 -1.07 -3.59 114.94 116.65 3gq9 s ASN 644 Ca 0.21 -0.15 -0.03 0.00 0.42 0.00 0.00 52.86 53.31 3gq9 s ASN 644 Cb -0.09 -2.16 -0.03 0.00 -1.45 0.00 0.00 41.25 37.52 3gq9 s ASN 644 CO 0.26 -0.20 -0.05 -0.22 -3.72 0.00 0.00 177.10 173.16 3gq9 s LEU 645 N 1.87 3.18 -0.14 3.21 2.96 -0.42 -1.20 118.68 128.13 3gq9 s LEU 645 Ca 0.09 -0.14 -0.04 0.00 -0.22 0.00 0.00 54.13 53.83 3gq9 s LEU 645 Cb -0.17 -1.75 -0.03 0.00 0.50 0.00 0.00 46.19 44.74 3gq9 s LEU 645 CO 0.11 0.20 -0.01 -0.63 -1.32 0.00 0.00 176.35 174.70 3gq9 s ILE 646 N 0.19 4.20 0.00 6.68 1.01 -0.25 -0.44 121.20 132.59 3gq9 s ILE 646 Ca -0.03 -0.26 0.06 0.00 0.00 0.00 0.00 60.65 60.42 3gq9 s ILE 646 Cb -0.14 -2.83 -0.02 0.00 0.01 0.00 0.00 42.46 39.48 3gq9 s ILE 646 CO 0.03 0.52 -0.19 -0.76 0.00 0.00 0.00 174.94 174.54 3gq9 s LEU 647 N 0.03 2.07 -1.22 2.97 1.43 -0.69 -1.22 118.68 122.05 3gq9 s LEU 647 Ca 0.02 -0.39 -0.14 0.00 -1.03 0.00 0.00 54.13 52.60 3gq9 s LEU 647 Cb -0.13 -0.94 -0.01 0.00 0.03 0.00 0.00 46.19 45.14 3gq9 s LEU 647 CO 0.02 0.20 0.69 -1.20 0.23 0.00 0.00 176.35 176.29 3gq9 n SER 648 N 2.40 -3.65 -4.13 2.29 7.64 -0.88 -4.46 113.62 112.83 3gq9 n SER 648 Ca -0.16 -1.00 -0.09 0.00 1.01 0.00 0.00 58.87 58.64 3gq9 n SER 648 Cb 0.54 -3.35 -0.10 0.00 -1.01 0.00 0.00 64.21 60.28 3gq9 n SER 648 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 3gq9 s SER 649 N -3.78 0.82 -0.03 6.43 0.01 -0.96 -4.53 113.70 111.65 3gq9 s SER 649 Ca 0.31 -1.01 0.01 0.00 1.31 0.00 0.00 55.95 56.57 3gq9 s SER 649 Cb -0.11 0.15 0.01 0.00 0.21 0.00 0.00 66.02 66.28 3gq9 s SER 649 CO 0.86 -0.54 -0.05 -0.47 0.41 0.00 0.00 173.24 173.46 3gq9 s TYR 650 N -3.77 0.65 -1.06 2.43 5.04 -0.80 -0.43 117.35 119.39 3gq9 s TYR 650 Ca 0.10 -0.15 -0.04 0.00 -2.44 0.00 0.00 57.07 54.54 3gq9 s TYR 650 Cb 0.07 -0.52 0.00 0.00 0.35 0.00 0.00 41.96 41.86 3gq9 s TYR 650 CO -0.07 -0.10 0.91 0.41 -1.34 0.00 0.00 175.55 175.36 3gq9 n GLY 651 N 3.54 -0.26 3.25 8.97 0.00 -0.02 -0.51 105.19 120.16 3gq9 n GLY 651 Ca -0.20 0.05 -0.23 0.00 0.00 0.00 0.00 46.02 45.64 3gq9 n GLY 651 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3gq9 s ILE 652 N -3.28 1.56 -0.16 -0.61 -4.36 -1.19 -3.73 121.20 109.42 3gq9 s ILE 652 Ca 0.28 -1.36 0.01 0.00 -0.26 0.00 0.00 60.65 59.31 3gq9 s ILE 652 Cb -0.12 -1.41 0.02 0.00 1.25 0.00 0.00 42.46 42.21 3gq9 s ILE 652 CO 0.60 -0.00 -0.16 0.20 0.24 0.00 0.00 174.94 175.82 3gq9 s ASN 653 N -1.60 2.86 0.11 4.36 0.01 -1.26 -0.94 114.94 118.48 3gq9 s ASN 653 Ca 0.05 -0.56 0.09 0.00 -0.71 0.00 0.00 52.86 51.73 3gq9 s ASN 653 Cb -0.09 -1.27 -0.04 0.00 0.41 0.00 0.00 41.25 40.26 3gq9 s ASN 653 CO 0.03 -0.05 -0.19 0.42 -1.51 0.00 0.00 177.10 175.80 3gq9 s THR 654 N 1.42 2.75 0.00 1.60 -4.23 -0.48 -4.97 115.64 111.74 3gq9 s THR 654 Ca 0.05 -1.53 0.00 0.00 -1.18 0.00 0.00 61.69 59.03 3gq9 s THR 654 Cb -0.13 -2.25 0.00 0.00 1.34 0.00 0.00 72.50 71.46 3gq9 s THR 654 CO -0.11 0.11 0.43 0.35 -0.54 0.00 0.00 174.62 174.85 3gq9 n THR 655 N 0.85 0.15 -2.59 3.99 -2.24 -1.26 -0.20 114.28 112.98 3gq9 n THR 655 Ca -0.16 -0.20 -0.33 0.00 -2.27 0.00 0.00 64.05 61.09 3gq9 n THR 655 Cb 0.53 1.22 -0.05 0.00 -2.10 0.00 0.00 70.33 69.93 3gq9 n THR 655 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 3gq9 s GLY 656 N -0.15 2.33 -0.02 3.38 0.00 -1.26 -4.11 107.32 107.49 3gq9 s GLY 656 Ca 0.00 0.41 -0.21 0.00 0.00 0.00 0.00 44.72 44.92 3gq9 s GLY 656 CO 0.00 0.70 0.60 -0.56 0.00 0.00 0.00 173.10 173.85 3gq9 s SER 657 N -2.36 6.95 -1.33 1.64 0.01 -1.26 -3.81 113.70 113.53 3gq9 s SER 657 Ca 0.63 1.13 -0.01 0.00 1.31 0.00 0.00 55.95 59.01 3gq9 s SER 657 Cb -0.12 -2.36 -0.00 0.00 0.21 0.00 0.00 66.02 63.75 3gq9 s SER 657 CO 0.21 0.06 0.59 -1.22 0.41 0.00 0.00 173.24 173.29 3gq9 n TYR 658 N 2.97 -1.81 -4.81 2.43 4.02 0.73 -4.53 117.16 116.15 3gq9 n TYR 658 Ca -0.06 0.78 -0.25 0.00 -0.01 0.00 0.00 57.90 58.36 3gq9 n TYR 658 Cb 0.51 -4.09 -0.16 0.00 -0.02 0.00 0.00 39.34 35.58 3gq9 n TYR 658 CO 0.00 0.00 0.00 0.15 -1.01 0.00 0.00 176.86 176.00 3gq9 s LYS 659 N -6.19 1.57 -0.19 -0.72 -0.14 -1.24 -0.83 119.74 112.01 3gq9 s LYS 659 Ca 0.03 -0.60 -0.11 0.00 -1.36 0.00 0.00 55.97 53.93 3gq9 s LYS 659 Cb -0.01 -1.43 -0.05 0.00 -1.68 0.00 0.00 37.83 34.66 3gq9 s LYS 659 CO 0.84 0.29 0.19 0.08 -0.76 0.00 0.00 175.35 175.99 3gq9 s VAL 660 N -0.15 5.37 0.13 3.17 1.01 -0.54 -1.31 120.40 128.09 3gq9 s VAL 660 Ca 0.01 0.31 0.06 0.00 0.00 0.00 0.00 61.98 62.36 3gq9 s VAL 660 Cb -0.09 -3.53 -0.04 0.00 0.00 0.00 0.00 36.38 32.72 3gq9 s VAL 660 CO 0.01 0.41 -0.14 0.20 0.00 0.00 0.00 175.10 175.58 3gq9 s ASN 661 N 0.48 2.10 0.07 3.32 0.01 0.42 -0.83 114.94 120.50 3gq9 s ASN 661 Ca 0.11 -0.84 -0.05 0.00 -0.71 0.00 0.00 52.86 51.36 3gq9 s ASN 661 Cb -0.12 -0.08 -0.02 0.00 0.41 0.00 0.00 41.25 41.44 3gq9 s ASN 661 CO 0.01 -0.15 0.09 -0.83 -1.51 0.00 0.00 177.10 174.71 3gq9 s GLY 662 N -2.58 0.26 -0.05 0.66 0.00 -1.00 -1.70 107.32 102.90 3gq9 s GLY 662 Ca 0.11 -0.85 -0.26 0.00 0.00 0.00 0.00 44.72 43.72 3gq9 s GLY 662 CO 0.03 -1.00 1.18 0.61 0.00 0.00 0.00 173.10 173.92 3gq9 n GLY 663 N 0.12 0.18 2.85 0.20 0.00 -1.26 -0.70 105.19 106.59 3gq9 n GLY 663 Ca -0.15 -1.00 -0.12 0.00 0.00 0.00 0.00 46.02 44.74 3gq9 n GLY 663 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 3gq9 s PHE 664 N -2.07 -0.74 0.00 1.61 5.36 -1.24 -1.91 117.98 118.99 3gq9 s PHE 664 Ca 0.28 0.25 0.00 0.00 -0.96 0.00 0.00 56.93 56.50 3gq9 s PHE 664 Cb -0.00 -0.24 0.00 0.00 -0.34 0.00 0.00 43.02 42.44 3gq9 s PHE 664 CO -0.02 -0.89 0.00 0.39 -1.46 0.00 0.00 175.22 173.25 3gq9 n GLU 665 N 5.34 0.00 -3.52 10.12 1.02 0.34 -4.85 120.64 129.08 3gq9 n GLU 665 Ca -0.02 0.00 -0.12 0.00 -0.02 0.00 0.00 57.16 57.01 3gq9 n GLU 665 Cb 0.48 -2.50 -0.03 0.00 -0.02 0.00 0.00 31.44 29.37 3gq9 n GLU 665 CO 0.00 0.00 0.00 -1.59 1.18 0.00 0.00 177.13 176.72 3gq9 s LYS 666 N 0.00 1.16 0.13 3.49 -2.85 -1.26 -4.84 119.74 115.58 3gq9 s LYS 666 Ca 0.00 -0.51 -0.31 0.00 -1.00 0.00 0.00 55.97 54.14 3gq9 s LYS 666 Cb 0.00 0.53 -0.09 0.00 -2.06 0.00 0.00 37.83 36.21 3gq9 s LYS 666 CO 0.00 -0.48 1.56 0.42 0.10 0.00 0.00 175.35 176.95 3gq9 s ILE 667 N -3.55 2.85 -0.04 3.79 1.01 -1.26 -4.39 121.20 119.61 3gq9 s ILE 667 Ca 0.01 0.55 0.02 0.00 0.00 0.00 0.00 60.65 61.22 3gq9 s ILE 667 Cb 0.00 -3.35 -0.03 0.00 0.01 0.00 0.00 42.46 39.09 3gq9 s ILE 667 CO -0.11 0.03 0.07 0.59 0.00 0.00 0.00 174.94 175.52 3gq9 n ASN 668 N 4.40 2.73 -3.63 3.58 5.03 0.13 -4.83 115.26 122.67 3gq9 n ASN 668 Ca 0.14 -0.22 -0.11 0.00 0.87 0.00 0.00 54.58 55.26 3gq9 n ASN 668 Cb 0.40 1.06 -0.05 0.00 -1.02 0.00 0.00 39.78 40.17 3gq9 n ASN 668 CO 0.00 0.00 0.00 -1.66 -1.83 0.00 0.00 177.26 173.77 3gq9 s TRP 669 N -1.78 -0.22 -0.11 3.10 1.48 -0.77 -1.12 118.94 119.53 3gq9 s TRP 669 Ca -0.00 -0.08 -0.08 0.00 -1.06 0.00 0.00 56.10 54.88 3gq9 s TRP 669 Cb 0.02 0.26 0.04 0.00 -1.16 0.00 0.00 33.47 32.62 3gq9 s TRP 669 CO 0.09 -0.69 0.28 -2.00 -4.06 0.00 0.00 176.95 170.57 3gq9 s GLU 670 N -3.69 0.28 -0.29 3.25 2.12 0.05 -2.37 118.70 118.04 3gq9 s GLU 670 Ca 0.02 0.49 -0.07 0.00 0.36 0.00 0.00 54.97 55.77 3gq9 s GLU 670 Cb 0.02 0.02 0.01 0.00 0.26 0.00 0.00 34.13 34.43 3gq9 s GLU 670 CO -0.11 -0.10 0.09 -0.51 -0.54 0.00 0.00 175.26 174.08 3gq9 s LEU 671 N 0.76 3.85 -0.57 2.70 1.43 -0.01 -1.17 118.68 125.68 3gq9 s LEU 671 Ca -0.05 -0.66 -0.13 0.00 -1.03 0.00 0.00 54.13 52.26 3gq9 s LEU 671 Cb -0.06 -1.90 0.14 0.00 0.03 0.00 0.00 46.19 44.40 3gq9 s LEU 671 CO -0.05 -0.18 0.49 -0.62 0.23 0.00 0.00 176.35 176.21 3gq9 s ASP 672 N 1.52 6.06 0.42 2.29 3.68 0.84 -1.47 116.67 130.01 3gq9 s ASP 672 Ca 0.03 -2.03 0.18 0.00 2.13 0.00 0.00 52.55 52.86 3gq9 s ASP 672 Cb -0.17 -2.12 0.93 0.00 -1.45 0.00 0.00 42.92 40.10 3gq9 s ASP 672 CO 0.03 -0.73 1.88 0.28 0.13 0.00 0.00 175.17 176.76 3gq9 h SER 673 N 8.47 0.00 -0.03 -0.34 0.02 -1.27 0.23 113.55 120.63 3gq9 h SER 673 Ca -0.19 0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 60.75 3gq9 h SER 673 Cb 1.07 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.61 3gq9 h SER 673 CO 0.92 0.29 -0.00 0.25 -1.14 0.00 0.00 176.83 177.14 3gq9 h LEU 674 N 0.00 0.05 -1.16 5.07 5.85 -1.78 -3.36 115.31 119.98 3gq9 h LEU 674 Ca -0.00 -0.35 0.00 0.00 0.84 0.00 0.00 57.88 58.37 3gq9 h LEU 674 Cb 0.61 -0.01 0.00 0.00 0.37 0.00 0.00 40.66 41.63 3gq9 h LEU 674 CO 0.04 0.38 -0.10 0.59 -0.34 0.00 0.00 178.44 179.01 3gq9 n ASN 675 N -4.89 1.69 -2.57 1.25 3.02 -1.23 -5.01 115.26 107.51 3gq9 n ASN 675 Ca -0.08 -1.34 -0.16 0.00 -0.03 0.00 0.00 54.58 52.97 3gq9 n ASN 675 Cb 0.20 0.21 0.05 0.00 -0.61 0.00 0.00 39.78 39.63 3gq9 n ASN 675 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3gq9 n GLY 676 N 0.80 -0.07 3.61 7.41 0.00 0.05 -5.03 105.19 111.95 3gq9 n GLY 676 Ca 0.06 -0.05 -0.33 0.00 0.00 0.00 0.00 46.02 45.70 3gq9 n GLY 676 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3gq9 s ARG 677 N -5.86 2.68 -0.13 1.61 0.52 -1.11 -4.97 118.95 111.69 3gq9 s ARG 677 Ca 0.39 -0.63 0.02 0.00 -0.52 0.00 0.00 55.73 54.99 3gq9 s ARG 677 Cb -0.17 -2.57 0.00 0.00 0.52 0.00 0.00 34.95 32.72 3gq9 s ARG 677 CO 0.48 0.63 -0.20 0.42 0.02 0.00 0.00 175.30 176.65 3gq9 s ILE 678 N -0.95 2.33 -0.06 1.52 1.01 -1.26 -0.11 121.20 123.68 3gq9 s ILE 678 Ca 0.16 -0.91 0.02 0.00 0.00 0.00 0.00 60.65 59.93 3gq9 s ILE 678 Cb -0.11 -1.94 0.01 0.00 0.01 0.00 0.00 42.46 40.43 3gq9 s ILE 678 CO 0.06 0.54 -0.12 -0.54 0.00 0.00 0.00 174.94 174.88 3gq9 s LYS 679 N 0.57 1.61 0.07 2.79 1.02 -0.32 -5.00 119.74 120.48 3gq9 s LYS 679 Ca -0.12 -0.41 0.08 0.00 0.02 0.00 0.00 55.97 55.54 3gq9 s LYS 679 Cb -0.16 -1.35 -0.04 0.00 -0.52 0.00 0.00 37.83 35.76 3gq9 s LYS 679 CO 0.04 0.05 -0.17 0.00 -0.92 0.00 0.00 175.35 174.34 3gq9 s ALA 680 N 0.58 2.66 0.12 5.17 0.00 -1.26 -0.77 121.76 128.25 3gq9 s ALA 680 Ca -0.13 -1.24 -0.15 0.00 0.00 0.00 0.00 51.96 50.44 3gq9 s ALA 680 Cb -0.15 -0.73 -0.03 0.00 0.00 0.00 0.00 23.12 22.22 3gq9 s ALA 680 CO 0.03 0.58 1.57 -0.09 0.00 0.00 0.00 175.76 177.85 3gq9 h ARG 681 N 4.22 0.68 0.00 0.00 2.43 -1.44 -3.44 114.38 116.83 3gq9 h ARG 681 Ca -0.48 -0.22 0.00 0.00 -0.81 0.00 0.00 59.98 58.47 3gq9 h ARG 681 Cb 1.16 -0.06 0.00 0.00 -0.42 0.00 0.00 29.97 30.65 3gq9 h ARG 681 CO 0.47 0.78 0.00 -3.47 -1.51 0.00 0.00 179.97 176.24 3gq9 n ASP 682 N -4.46 0.00 -4.59 -3.80 2.03 -1.26 -5.09 116.55 99.37 3gq9 n ASP 682 Ca -0.01 0.00 -0.28 0.00 0.52 0.00 0.00 54.79 55.02 3gq9 n ASP 682 Cb 0.28 0.00 -0.09 0.00 -0.72 0.00 0.00 41.12 40.59 3gq9 n ASP 682 CO 0.00 0.00 0.00 0.42 -1.92 0.00 0.00 177.20 175.70 3gq9 s THR 683 N 1.31 3.37 -0.16 5.18 -4.23 -1.26 -5.11 115.64 114.73 3gq9 s THR 683 Ca 0.00 -1.48 0.00 0.00 -1.18 0.00 0.00 61.69 59.04 3gq9 s THR 683 Cb 0.00 -2.64 0.00 0.00 1.34 0.00 0.00 72.50 71.20 3gq9 s THR 683 CO 0.00 -0.04 -0.16 0.68 -0.54 0.00 0.00 174.62 174.56 3gq9 s VAL 684 N -1.54 2.51 0.02 2.29 -7.23 -1.26 -4.84 120.40 110.34 3gq9 s VAL 684 Ca 0.24 -0.81 -0.03 0.00 -1.81 0.00 0.00 61.98 59.56 3gq9 s VAL 684 Cb -0.10 -2.06 -0.01 0.00 0.56 0.00 0.00 36.38 34.77 3gq9 s VAL 684 CO 0.15 0.52 0.05 0.42 -0.31 0.00 0.00 175.10 175.93 3gq9 s THR 685 N 0.93 0.11 0.39 5.32 -4.23 -1.26 -5.16 115.64 111.73 3gq9 s THR 685 Ca -0.03 -0.87 0.05 0.00 -1.18 0.00 0.00 61.69 59.66 3gq9 s THR 685 Cb -0.15 -0.43 0.05 0.00 1.34 0.00 0.00 72.50 73.31 3gq9 s THR 685 CO -0.02 -0.48 0.41 0.61 -0.54 0.00 0.00 174.62 174.60 3gq9 n GLY 686 N 1.41 2.42 2.29 3.99 0.00 -1.26 -4.76 105.19 109.28 3gq9 n GLY 686 Ca -0.23 -2.23 -0.12 0.00 0.00 0.00 0.00 46.02 43.44 3gq9 n GLY 686 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3gq9 n GLY 687 N 0.28 0.56 3.86 -0.02 0.00 -1.26 -5.00 105.19 103.61 3gq9 n GLY 687 Ca 0.05 -0.41 -0.32 0.00 0.00 0.00 0.00 46.02 45.34 3gq9 n GLY 687 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3gq9 s ASN 688 N -2.65 6.67 0.31 1.61 0.01 -1.26 -5.10 114.94 114.53 3gq9 s ASN 688 Ca 0.00 1.15 0.06 0.00 -0.71 0.00 0.00 52.86 53.37 3gq9 s ASN 688 Cb 0.00 -2.32 -0.06 0.00 0.41 0.00 0.00 41.25 39.27 3gq9 s ASN 688 CO 0.00 -0.23 -0.03 0.42 -1.51 0.00 0.00 177.10 175.75 3gq9 s THR 689 N -2.05 1.67 -0.69 1.60 -4.23 -1.26 -5.09 115.64 105.59 3gq9 s THR 689 Ca 0.52 -2.09 0.04 0.00 -1.18 0.00 0.00 61.69 58.98 3gq9 s THR 689 Cb -0.10 -2.62 0.31 0.00 1.34 0.00 0.00 72.50 71.42 3gq9 s THR 689 CO 0.22 -0.18 1.05 0.79 -0.54 0.00 0.00 174.62 175.95 3gq9 n TRP 690 N -0.68 3.66 -1.65 3.99 8.01 -1.26 -5.28 117.44 124.23 3gq9 n TRP 690 Ca -0.05 -3.76 0.00 0.00 -1.31 0.00 0.00 57.50 52.38 3gq9 n TRP 690 Cb 0.65 -0.65 0.00 0.00 -2.01 0.00 0.00 31.31 29.29 3gq9 n TRP 690 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 177.69 175.55