#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wwu s LYS 81 N 0.00 4.35 0.05 5.55 1.02 -1.26 -4.44 119.74 125.01 2wwu s LYS 81 Ca 0.00 0.72 -0.32 0.00 0.02 0.00 0.00 55.97 56.39 2wwu s LYS 81 Cb 0.00 -3.39 -0.11 0.00 -0.52 0.00 0.00 37.83 33.81 2wwu s LYS 81 CO 0.00 0.24 1.87 2.41 -0.92 0.00 0.00 175.35 178.96 2wwu n THR 82 N 3.20 0.52 0.00 2.17 -1.04 0.13 -2.58 114.28 116.68 2wwu n THR 82 Ca -0.05 -0.09 0.00 0.00 -2.04 0.00 0.00 64.05 61.86 2wwu n THR 82 Cb 0.51 -2.08 0.00 0.00 -1.82 0.00 0.00 70.33 66.94 2wwu n THR 82 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2wwu n GLY 83 N 4.31 2.01 3.50 3.41 0.00 -1.26 -4.31 105.19 112.86 2wwu n GLY 83 Ca 0.20 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.91 2wwu n GLY 83 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2wwu n SER 84 N 0.00 -1.16 0.25 1.61 3.41 -1.07 -4.60 113.62 112.07 2wwu n SER 84 Ca 0.00 0.17 0.10 0.00 -0.26 0.00 0.00 58.87 58.88 2wwu n SER 84 Cb 0.00 -1.29 0.66 0.00 -0.26 0.00 0.00 64.21 63.32 2wwu n SER 84 CO 0.00 0.00 0.00 -0.65 -0.16 0.00 0.00 175.04 174.23 2wwu h PRO 85 N -2.06 0.00 0.23 4.33 0.11 -1.95 -1.85 132.00 130.81 2wwu h PRO 85 Ca -0.50 0.00 -0.31 0.00 0.11 0.00 0.00 66.00 65.31 2wwu h PRO 85 Cb 1.30 0.00 0.04 0.00 0.11 0.00 0.00 31.00 32.45 2wwu h PRO 85 CO 0.41 0.13 -1.35 1.79 -0.21 0.00 0.00 178.00 178.77 2wwu h THR 86 N 0.00 1.32 -0.57 -1.15 1.35 -1.92 -1.77 112.91 110.17 2wwu h THR 86 Ca -0.00 -2.66 0.10 0.00 -0.55 0.00 0.00 66.41 63.29 2wwu h THR 86 Cb 0.28 3.08 -0.07 0.00 -1.73 0.00 0.00 68.15 69.71 2wwu h THR 86 CO 0.02 0.79 0.17 0.15 -0.25 0.00 0.00 175.52 176.39 2wwu h PHE 87 N 0.04 0.28 -0.35 4.73 3.57 -1.73 -0.85 116.94 122.62 2wwu h PHE 87 Ca -0.24 0.03 -0.06 0.00 3.53 0.00 0.00 57.97 61.23 2wwu h PHE 87 Cb 2.06 -0.04 -0.01 0.00 2.79 0.00 0.00 35.95 40.75 2wwu h PHE 87 CO 0.14 0.04 -0.02 0.28 -2.23 0.00 0.00 178.31 176.52 2wwu h VAL 88 N 0.32 1.26 -0.95 1.41 2.07 -1.34 0.26 116.25 119.28 2wwu h VAL 88 Ca 0.29 -1.02 0.08 0.00 0.82 0.00 0.00 66.70 66.87 2wwu h VAL 88 Cb 0.39 1.23 -0.07 0.00 -1.52 0.00 0.00 31.29 31.32 2wwu h VAL 88 CO -0.34 0.34 0.61 0.03 0.02 0.00 0.00 177.57 178.23 2wwu h ARG 89 N 0.44 1.01 -0.10 1.57 -0.00 -1.02 -0.49 114.38 115.79 2wwu h ARG 89 Ca 0.10 -0.06 -0.10 0.00 -0.50 0.00 0.00 59.98 59.42 2wwu h ARG 89 Cb 0.49 -0.23 0.00 0.00 0.00 0.00 0.00 29.97 30.23 2wwu h ARG 89 CO 0.02 0.67 -0.33 0.93 0.00 0.00 0.00 179.97 181.26 2wwu h GLU 90 N 1.04 0.40 -0.96 0.04 5.08 -0.96 -3.21 114.58 116.02 2wwu h GLU 90 Ca 0.42 -0.30 0.12 0.00 -1.00 0.00 0.00 59.36 58.61 2wwu h GLU 90 Cb 0.27 0.05 -0.08 0.00 0.50 0.00 0.00 28.75 29.49 2wwu h GLU 90 CO -0.18 0.92 0.58 1.25 -1.00 0.00 0.00 179.01 180.59 2wwu h LEU 91 N -0.05 0.84 -1.18 1.33 6.46 -0.45 -2.59 115.31 119.68 2wwu h LEU 91 Ca -0.01 0.05 -0.03 0.00 -0.12 0.00 0.00 57.88 57.77 2wwu h LEU 91 Cb 0.96 -0.11 -0.03 0.00 -0.73 0.00 0.00 40.66 40.76 2wwu h LEU 91 CO 0.07 0.44 0.20 0.03 -0.62 0.00 0.00 178.44 178.56 2wwu h ARG 92 N 0.91 0.78 0.00 1.25 3.08 -1.10 -1.84 114.38 117.45 2wwu h ARG 92 Ca 0.48 -0.12 0.00 0.00 0.07 0.00 0.00 59.98 60.41 2wwu h ARG 92 Cb 0.50 -0.14 0.00 0.00 0.08 0.00 0.00 29.97 30.41 2wwu h ARG 92 CO -0.28 0.65 -0.10 -1.13 -1.07 0.00 0.00 179.97 178.04 2wwu n SER 93 N -4.33 0.19 -4.79 7.04 3.41 -0.98 -4.86 113.62 109.29 2wwu n SER 93 Ca 0.04 0.37 -0.35 0.00 -0.26 0.00 0.00 58.87 58.68 2wwu n SER 93 Cb 0.17 -0.39 -0.04 0.00 -0.26 0.00 0.00 64.21 63.69 2wwu n SER 93 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 2wwu s ARG 94 N -3.02 3.92 -0.23 4.33 0.52 -0.70 -5.01 118.95 118.78 2wwu s ARG 94 Ca 0.13 1.38 -0.08 0.00 -0.52 0.00 0.00 55.73 56.64 2wwu s ARG 94 Cb 0.18 -2.22 -0.11 0.00 0.52 0.00 0.00 34.95 33.32 2wwu s ARG 94 CO 0.57 -0.33 -0.27 -2.37 0.02 0.00 0.00 175.30 172.92 2wwu n THR 95 N -0.71 1.27 -4.61 0.02 5.66 -1.26 -5.06 114.28 109.59 2wwu n THR 95 Ca 0.08 -0.37 0.00 0.00 -3.05 0.00 0.00 64.05 60.71 2wwu n THR 95 Cb 0.52 -1.67 0.00 0.00 -1.55 0.00 0.00 70.33 67.63 2wwu n THR 95 CO 0.00 0.00 0.00 0.49 -3.05 0.00 0.00 175.07 172.51 2wwu n PHE 96 N -3.80 -1.45 -3.03 1.09 3.72 -1.26 -4.67 117.46 108.05 2wwu n PHE 96 Ca -0.44 0.00 -0.37 0.00 -0.05 0.00 0.00 57.45 56.59 2wwu n PHE 96 Cb 0.85 0.17 -0.06 0.00 -0.94 0.00 0.00 39.48 39.50 2wwu n PHE 96 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 176.76 176.20 2wwu s ASP 97 N -4.00 7.15 0.15 4.37 1.01 -0.66 -4.90 116.67 119.79 2wwu s ASP 97 Ca 0.00 1.52 -0.30 0.00 0.71 0.00 0.00 52.55 54.47 2wwu s ASP 97 Cb 0.00 -2.46 -0.08 0.00 1.01 0.00 0.00 42.92 41.39 2wwu s ASP 97 CO 0.00 0.05 1.30 -0.55 0.21 0.00 0.00 175.17 176.18 2wwu s SER 98 N -1.56 6.93 0.62 0.27 0.15 -1.26 -0.91 113.70 117.94 2wwu s SER 98 Ca 0.43 2.29 0.35 0.00 0.70 0.00 0.00 55.95 59.72 2wwu s SER 98 Cb -0.18 -2.60 2.01 0.00 -1.71 0.00 0.00 66.02 63.55 2wwu s SER 98 CO 0.22 -0.53 2.27 0.77 1.20 0.00 0.00 173.24 177.17 2wwu h SER 99 N 6.00 0.00 0.26 5.45 4.64 -1.82 -2.28 113.55 125.81 2wwu h SER 99 Ca -0.43 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.89 2wwu h SER 99 Cb 1.21 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.30 2wwu h SER 99 CO 0.80 0.00 0.00 0.44 -0.87 0.00 0.00 176.83 177.20 2wwu h ASP 100 N 0.00 0.00 1.34 4.97 3.32 -1.90 -1.20 116.42 122.95 2wwu h ASP 100 Ca 0.01 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.06 2wwu h ASP 100 Cb 0.08 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.63 2wwu h ASP 100 CO -0.00 0.00 0.00 -0.33 -1.72 0.00 0.00 179.24 177.19 2wwu h GLU 101 N 0.00 0.00 0.00 3.56 5.08 -1.80 -3.40 114.58 118.02 2wwu h GLU 101 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2wwu h GLU 101 Cb 0.13 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.38 2wwu h GLU 101 CO 0.00 0.00 -0.30 1.33 -1.00 0.00 0.00 179.01 179.04 2wwu n VAL 102 N -2.68 0.00 -2.35 3.13 0.24 -0.58 -5.09 118.33 111.00 2wwu n VAL 102 Ca 0.03 0.00 -0.34 0.00 -2.04 0.00 0.00 64.34 62.00 2wwu n VAL 102 Cb 0.38 -0.21 -0.02 0.00 -1.47 0.00 0.00 33.84 32.52 2wwu n VAL 102 CO 0.00 0.00 0.00 0.27 -2.14 0.00 0.00 176.83 174.96 2wwu s ILE 103 N -1.17 3.79 0.07 1.34 -4.36 -0.56 -4.58 121.20 115.73 2wwu s ILE 103 Ca 0.00 1.01 -0.01 0.00 -0.26 0.00 0.00 60.65 61.39 2wwu s ILE 103 Cb 0.00 -3.43 -0.04 0.00 1.25 0.00 0.00 42.46 40.24 2wwu s ILE 103 CO 0.00 -0.35 0.23 -0.76 0.24 0.00 0.00 174.94 174.30 2wwu s LEU 104 N -3.88 4.35 -0.43 0.37 1.43 -0.79 -4.94 118.68 114.79 2wwu s LEU 104 Ca 0.66 0.32 0.10 0.00 -1.03 0.00 0.00 54.13 54.18 2wwu s LEU 104 Cb -0.16 -2.99 0.35 0.00 0.03 0.00 0.00 46.19 43.42 2wwu s LEU 104 CO 0.27 0.16 0.80 0.29 0.23 0.00 0.00 176.35 178.10 2wwu n LYS 105 N 0.30 1.66 -1.22 1.70 5.02 -1.26 -1.16 118.16 123.19 2wwu n LYS 105 Ca -0.05 -3.82 -0.30 0.00 -2.02 0.00 0.00 58.31 52.13 2wwu n LYS 105 Cb 0.51 -1.85 0.13 0.00 -0.02 0.00 0.00 35.03 33.80 2wwu n LYS 105 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 2wwu s PRO 106 N -2.77 1.46 0.76 1.97 0.04 -1.26 -4.92 135.00 130.28 2wwu s PRO 106 Ca 0.42 0.87 -0.12 0.00 0.04 0.00 0.00 61.00 62.22 2wwu s PRO 106 Cb 0.33 -1.83 0.05 0.00 0.04 0.00 0.00 34.50 33.09 2wwu s PRO 106 CO -0.09 -2.12 1.12 0.95 0.04 0.00 0.00 177.00 176.90 2wwu s THR 107 N -2.94 2.99 0.24 1.26 -4.23 -1.26 -4.54 115.64 107.16 2wwu s THR 107 Ca 0.63 0.32 -0.05 0.00 -1.18 0.00 0.00 61.69 61.41 2wwu s THR 107 Cb -0.18 -3.26 0.22 0.00 1.34 0.00 0.00 72.50 70.63 2wwu s THR 107 CO 0.57 -0.42 1.70 1.23 -0.54 0.00 0.00 174.62 177.16 2wwu h GLY 108 N -0.87 1.03 2.00 3.99 0.00 -1.74 -1.27 103.07 106.21 2wwu h GLY 108 Ca -0.46 -0.06 -0.04 0.00 0.00 0.00 0.00 47.33 46.77 2wwu h GLY 108 CO 0.63 -0.17 -0.20 3.43 0.00 0.00 0.00 176.54 180.24 2wwu h ASN 109 N 0.31 0.00 1.38 0.19 2.35 -1.73 -2.66 115.58 115.43 2wwu h ASN 109 Ca 0.41 0.00 -0.12 0.00 -0.55 0.00 0.00 56.30 56.04 2wwu h ASN 109 Cb 0.67 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 39.02 2wwu h ASN 109 CO -0.47 0.20 -0.63 1.56 -1.65 0.00 0.00 177.43 176.44 2wwu h GLN 110 N 0.00 0.00 -5.99 0.81 4.20 -1.62 -3.42 115.11 109.10 2wwu h GLN 110 Ca -0.00 0.00 -0.61 0.00 0.06 0.00 0.00 58.65 58.10 2wwu h GLN 110 Cb 0.37 0.00 -0.09 0.00 0.30 0.00 0.00 27.48 28.06 2wwu h GLN 110 CO 0.03 0.52 1.69 -1.17 -0.67 0.00 0.00 178.83 179.23 2wwu s LEU 111 N -6.42 3.59 0.48 1.46 2.96 -0.89 -4.68 118.68 115.18 2wwu s LEU 111 Ca 0.03 -1.76 0.04 0.00 -0.22 0.00 0.00 54.13 52.22 2wwu s LEU 111 Cb 0.08 -2.57 -0.03 0.00 0.50 0.00 0.00 46.19 44.17 2wwu s LEU 111 CO 0.76 -1.50 0.06 0.42 -1.32 0.00 0.00 176.35 174.77 2wwu s THR 112 N 5.13 1.53 0.15 3.68 -4.23 -1.26 -4.78 115.64 115.87 2wwu s THR 112 Ca 0.50 -1.92 -0.13 0.00 -1.18 0.00 0.00 61.69 58.96 2wwu s THR 112 Cb 0.01 -2.46 0.04 0.00 1.34 0.00 0.00 72.50 71.43 2wwu s THR 112 CO -0.03 0.00 1.66 0.58 -0.54 0.00 0.00 174.62 176.29 2wwu h VAL 113 N 1.41 1.24 -0.50 2.29 2.07 -1.94 -1.82 116.25 118.99 2wwu h VAL 113 Ca -0.43 -0.85 -0.00 0.00 0.82 0.00 0.00 66.70 66.23 2wwu h VAL 113 Cb 1.29 0.81 -0.02 0.00 -1.52 0.00 0.00 31.29 31.84 2wwu h VAL 113 CO 0.74 0.31 0.30 -0.08 0.02 0.00 0.00 177.57 178.86 2wwu h GLU 114 N 0.72 0.68 -0.42 1.57 4.81 -1.95 0.12 114.58 120.11 2wwu h GLU 114 Ca 0.16 -0.06 0.09 0.00 -0.13 0.00 0.00 59.36 59.42 2wwu h GLU 114 Cb 0.33 -0.14 -0.09 0.00 0.63 0.00 0.00 28.75 29.48 2wwu h GLU 114 CO 0.00 0.50 -0.15 0.35 -0.73 0.00 0.00 179.01 178.98 2wwu h PHE 115 N 0.67 -0.36 0.00 0.92 3.57 -1.76 0.16 116.94 120.14 2wwu h PHE 115 Ca 0.18 0.04 -0.11 0.00 3.53 0.00 0.00 57.97 61.61 2wwu h PHE 115 Cb -0.01 0.22 -0.02 0.00 2.79 0.00 0.00 35.95 38.94 2wwu h PHE 115 CO -0.03 -0.23 -0.55 -0.07 -2.23 0.00 0.00 178.31 175.20 2wwu h LEU 116 N -0.06 0.00 -0.28 0.59 3.38 -0.82 0.19 115.31 118.31 2wwu h LEU 116 Ca 0.20 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 58.06 2wwu h LEU 116 Cb 0.37 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.12 2wwu h LEU 116 CO -0.46 0.55 -0.26 -0.33 0.09 0.00 0.00 178.44 178.02 2wwu h GLU 117 N 0.00 0.67 0.05 1.13 5.08 0.05 0.37 114.58 121.93 2wwu h GLU 117 Ca -0.01 -0.35 -0.00 0.00 -1.00 0.00 0.00 59.36 58.01 2wwu h GLU 117 Cb 0.98 0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.24 2wwu h GLU 117 CO 0.07 0.95 -0.02 0.93 -1.00 0.00 0.00 179.01 179.94 2wwu h GLU 118 N 0.40 -0.06 0.00 2.33 5.08 -0.58 -3.25 114.58 118.50 2wwu h GLU 118 Ca 0.05 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.41 2wwu h GLU 118 Cb 0.82 0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.08 2wwu h GLU 118 CO 0.07 0.43 0.00 -0.91 -1.00 0.00 0.00 179.01 177.59 2wwu h ASN 119 N -0.58 0.00 -3.61 1.42 2.35 -0.71 -3.50 115.58 110.96 2wwu h ASN 119 Ca -0.01 0.00 0.27 0.00 -0.55 0.00 0.00 56.30 56.02 2wwu h ASN 119 Cb 0.52 0.00 -0.11 0.00 0.05 0.00 0.00 38.32 38.78 2wwu h ASN 119 CO 0.01 0.00 -0.68 -0.24 -1.65 0.00 0.00 177.43 174.87 2wwu n SER 120 N -2.46 -6.42 -3.33 5.81 2.88 0.12 -4.69 113.62 105.52 2wwu n SER 120 Ca 0.04 0.78 -0.27 0.00 -1.33 0.00 0.00 58.87 58.09 2wwu n SER 120 Cb 0.38 -3.47 -0.07 0.00 -0.75 0.00 0.00 64.21 60.30 2wwu n SER 120 CO 0.00 0.00 0.00 0.33 -1.23 0.00 0.00 175.04 174.14 2wwu n PHE 121 N -3.84 3.52 0.13 0.66 7.35 -1.25 -4.72 117.46 119.30 2wwu n PHE 121 Ca -0.03 -4.11 0.02 0.00 -0.76 0.00 0.00 57.45 52.57 2wwu n PHE 121 Cb 0.50 -0.54 0.01 0.00 0.35 0.00 0.00 39.48 39.80 2wwu n PHE 121 CO 0.00 0.00 0.00 -1.13 -0.76 0.00 0.00 176.76 174.87 2wwu n SER 122 N 0.69 1.03 -4.21 -2.13 3.41 -1.26 -4.67 113.62 106.48 2wwu n SER 122 Ca 0.30 -1.02 -0.15 0.00 -0.26 0.00 0.00 58.87 57.74 2wwu n SER 122 Cb 0.41 0.20 -0.11 0.00 -0.26 0.00 0.00 64.21 64.46 2wwu n SER 122 CO 0.00 0.00 0.00 0.68 -0.16 0.00 0.00 175.04 175.56 2wwu s VAL 123 N -0.46 1.06 0.71 -3.33 -7.23 -1.26 -4.95 120.40 104.94 2wwu s VAL 123 Ca 0.03 -1.77 -0.15 0.00 -1.81 0.00 0.00 61.98 58.28 2wwu s VAL 123 Cb 0.02 -1.52 0.03 0.00 0.56 0.00 0.00 36.38 35.47 2wwu s VAL 123 CO 0.05 -0.59 1.19 -2.84 -0.31 0.00 0.00 175.10 172.61 2wwu s PRO 124 N -3.04 2.31 -0.11 4.82 0.02 -1.26 -4.65 135.00 133.09 2wwu s PRO 124 Ca 0.09 1.71 0.01 0.00 0.02 0.00 0.00 61.00 62.82 2wwu s PRO 124 Cb -0.02 -1.86 0.02 0.00 0.02 0.00 0.00 34.50 32.66 2wwu s PRO 124 CO 0.01 -1.69 -0.12 0.42 -0.33 0.00 0.00 177.00 175.29 2wwu s ILE 125 N -2.01 1.29 -0.22 2.83 1.01 -0.38 -1.88 121.20 121.84 2wwu s ILE 125 Ca 0.73 -0.48 -0.02 0.00 0.00 0.00 0.00 60.65 60.88 2wwu s ILE 125 Cb -0.28 -1.23 0.01 0.00 0.01 0.00 0.00 42.46 40.98 2wwu s ILE 125 CO 0.44 0.41 -0.09 -0.22 0.00 0.00 0.00 174.94 175.47 2wwu s LEU 126 N 1.33 2.81 -0.30 2.97 2.96 -0.31 -0.11 118.68 128.03 2wwu s LEU 126 Ca -0.01 -0.64 -0.09 0.00 -0.22 0.00 0.00 54.13 53.18 2wwu s LEU 126 Cb -0.14 -1.64 -0.00 0.00 0.50 0.00 0.00 46.19 44.91 2wwu s LEU 126 CO -0.06 -0.06 0.13 -0.69 -1.32 0.00 0.00 176.35 174.36 2wwu s VAL 127 N 1.37 4.41 0.08 1.68 1.01 0.37 -4.20 120.40 125.13 2wwu s VAL 127 Ca 0.03 -0.49 -0.22 0.00 0.00 0.00 0.00 61.98 61.31 2wwu s VAL 127 Cb -0.15 -3.25 -0.12 0.00 0.00 0.00 0.00 36.38 32.86 2wwu s VAL 127 CO -0.06 0.08 1.65 -0.07 0.00 0.00 0.00 175.10 176.70 2wwu h LEU 128 N 8.31 0.13 -8.92 3.92 3.38 -1.85 -1.27 115.31 119.01 2wwu h LEU 128 Ca -0.32 -0.11 -0.69 0.00 0.09 0.00 0.00 57.88 56.85 2wwu h LEU 128 Cb 1.14 -0.03 -0.23 0.00 0.09 0.00 0.00 40.66 41.63 2wwu h LEU 128 CO 0.61 0.21 -0.83 -0.54 0.09 0.00 0.00 178.44 177.98 2wwu s LYS 129 N -5.74 1.92 0.37 1.13 1.02 -1.26 -3.85 119.74 113.33 2wwu s LYS 129 Ca -0.14 -1.06 0.27 0.00 0.02 0.00 0.00 55.97 55.06 2wwu s LYS 129 Cb 0.06 -2.11 0.95 0.00 -0.52 0.00 0.00 37.83 36.21 2wwu s LYS 129 CO 0.68 0.52 1.79 1.57 -0.92 0.00 0.00 175.35 178.99 2wwu h LYS 130 N 4.46 0.00 -6.27 1.68 2.10 -1.85 -3.39 116.57 113.30 2wwu h LYS 130 Ca -0.48 0.00 -0.68 0.00 -2.00 0.00 0.00 60.65 57.49 2wwu h LYS 130 Cb 1.15 0.00 0.05 0.00 -0.90 0.00 0.00 32.23 32.53 2wwu h LYS 130 CO 0.46 0.00 0.51 -0.25 -2.00 0.00 0.00 179.45 178.17 2wwu n ASP 131 N -2.66 1.77 0.00 7.07 9.92 -1.26 -1.07 116.55 130.33 2wwu n ASP 131 Ca 0.03 1.11 0.00 0.00 -0.53 0.00 0.00 54.79 55.40 2wwu n ASP 131 Cb 0.35 -1.19 0.00 0.00 -0.64 0.00 0.00 41.12 39.63 2wwu n ASP 131 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2wwu n GLY 132 N 2.72 2.56 0.13 0.44 0.00 -1.26 -3.05 105.19 106.72 2wwu n GLY 132 Ca 0.19 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.34 2wwu n GLY 132 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2wwu n LEU 133 N 0.00 0.77 -0.42 0.99 4.77 -0.23 -4.17 117.00 118.70 2wwu n LEU 133 Ca 0.00 0.64 -0.05 0.00 -0.03 0.00 0.00 56.01 56.57 2wwu n LEU 133 Cb 0.00 -0.48 -0.02 0.00 -2.33 0.00 0.00 43.42 40.58 2wwu n LEU 133 CO 0.00 -0.44 -0.05 0.61 -1.33 0.00 0.00 177.39 176.18 2wwu n GLY 134 N 0.48 0.79 3.87 -0.72 0.00 -1.26 -1.07 105.19 107.27 2wwu n GLY 134 Ca 0.03 -0.51 -0.31 0.00 0.00 0.00 0.00 46.02 45.23 2wwu n GLY 134 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2wwu s MET 135 N -2.12 3.42 -0.05 1.61 -1.94 -1.26 -4.35 119.30 114.61 2wwu s MET 135 Ca 0.00 0.67 0.03 0.00 -1.71 0.00 0.00 55.69 54.69 2wwu s MET 135 Cb 0.00 -2.07 0.01 0.00 2.01 0.00 0.00 34.83 34.78 2wwu s MET 135 CO 0.00 -0.68 -0.14 0.99 -0.01 0.00 0.00 175.02 175.18 2wwu s THR 136 N -3.22 1.26 0.02 2.05 2.01 -0.43 -4.90 115.64 112.43 2wwu s THR 136 Ca 0.56 -0.59 -0.08 0.00 0.31 0.00 0.00 61.69 61.89 2wwu s THR 136 Cb -0.11 -1.12 0.00 0.00 0.01 0.00 0.00 72.50 71.28 2wwu s THR 136 CO 0.53 0.38 0.15 -0.76 -0.69 0.00 0.00 174.62 174.23 2wwu s LEU 137 N 0.35 1.54 1.07 4.42 1.43 -1.24 -0.26 118.68 126.00 2wwu s LEU 137 Ca -0.10 -0.29 -0.13 0.00 -1.03 0.00 0.00 54.13 52.59 2wwu s LEU 137 Cb -0.13 0.74 0.23 0.00 0.03 0.00 0.00 46.19 47.06 2wwu s LEU 137 CO 0.03 -0.44 1.06 -2.16 0.23 0.00 0.00 176.35 175.08 2wwu s PRO 138 N -1.85 -0.18 0.90 1.29 0.04 -1.24 -4.99 135.00 128.96 2wwu s PRO 138 Ca -0.11 0.68 -0.12 0.00 0.04 0.00 0.00 61.00 61.50 2wwu s PRO 138 Cb -0.05 -1.65 0.13 0.00 0.04 0.00 0.00 34.50 32.97 2wwu s PRO 138 CO -0.01 -3.19 1.09 -1.54 0.04 0.00 0.00 177.00 173.40 2wwu s SER 139 N -3.02 3.40 0.00 6.66 1.04 -1.26 -4.87 113.70 115.65 2wwu s SER 139 Ca 0.67 1.48 0.07 0.00 0.48 0.00 0.00 55.95 58.64 2wwu s SER 139 Cb -0.21 -2.16 0.34 0.00 0.10 0.00 0.00 66.02 64.09 2wwu s SER 139 CO 0.61 -2.69 1.02 -2.65 0.98 0.00 0.00 173.24 170.51 2wwu n PRO 140 N -3.91 0.12 0.00 4.02 -0.02 -1.26 -1.63 135.00 132.31 2wwu n PRO 140 Ca 0.07 0.18 0.14 0.00 -2.02 0.00 0.00 63.50 61.86 2wwu n PRO 140 Cb 0.55 -1.50 0.52 0.00 -0.02 0.00 0.00 33.50 33.05 2wwu n PRO 140 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 2wwu n SER 141 N -1.23 0.29 -4.64 2.55 3.41 -1.26 -4.80 113.62 107.95 2wwu n SER 141 Ca 0.03 -0.08 -0.40 0.00 -0.26 0.00 0.00 58.87 58.16 2wwu n SER 141 Cb 0.05 -0.14 0.02 0.00 -0.26 0.00 0.00 64.21 63.87 2wwu n SER 141 CO 0.00 0.00 0.00 0.33 -0.16 0.00 0.00 175.04 175.21 2wwu n PHE 142 N -1.31 1.42 -4.40 7.33 7.35 -0.64 -5.01 117.46 122.19 2wwu n PHE 142 Ca 0.09 0.52 -0.20 0.00 -0.76 0.00 0.00 57.45 57.10 2wwu n PHE 142 Cb 0.31 -2.26 -0.10 0.00 0.35 0.00 0.00 39.48 37.79 2wwu n PHE 142 CO 0.00 0.00 0.00 0.95 -0.76 0.00 0.00 176.76 176.95 2wwu s THR 143 N -1.30 0.79 0.28 -2.13 -4.23 -1.26 -5.01 115.64 102.79 2wwu s THR 143 Ca 0.65 -2.00 -0.01 0.00 -1.18 0.00 0.00 61.69 59.15 2wwu s THR 143 Cb -0.51 -2.64 0.28 0.00 1.34 0.00 0.00 72.50 70.96 2wwu s THR 143 CO 0.55 0.00 1.89 0.58 -0.54 0.00 0.00 174.62 177.10 2wwu h VAL 144 N 2.16 1.06 -0.47 2.29 2.07 -1.99 -0.81 116.25 120.55 2wwu h VAL 144 Ca -0.38 -0.38 0.02 0.00 0.82 0.00 0.00 66.70 66.77 2wwu h VAL 144 Cb 1.25 -0.15 -0.03 0.00 -1.52 0.00 0.00 31.29 30.85 2wwu h VAL 144 CO 0.63 0.20 0.29 -0.09 0.02 0.00 0.00 177.57 178.62 2wwu h ARG 145 N 1.11 0.57 -0.62 1.57 9.65 -1.97 -1.62 114.38 123.07 2wwu h ARG 145 Ca 0.43 -0.03 0.07 0.00 -1.10 0.00 0.00 59.98 59.34 2wwu h ARG 145 Cb 0.23 -0.13 -0.06 0.00 -1.39 0.00 0.00 29.97 28.62 2wwu h ARG 145 CO -0.18 0.38 0.31 -0.44 2.80 0.00 0.00 179.97 182.85 2wwu h ASP 146 N 0.59 0.43 -0.28 -3.80 3.32 -1.73 -1.16 116.42 113.80 2wwu h ASP 146 Ca 0.18 0.04 0.04 0.00 0.02 0.00 0.00 57.03 57.32 2wwu h ASP 146 Cb -0.02 -0.04 -0.04 0.00 0.22 0.00 0.00 39.33 39.46 2wwu h ASP 146 CO -0.07 0.28 0.03 0.58 -1.72 0.00 0.00 179.24 178.34 2wwu h VAL 147 N 0.58 0.83 -0.78 -1.35 2.07 -0.80 -0.87 116.25 115.93 2wwu h VAL 147 Ca 0.29 -0.04 0.09 0.00 0.82 0.00 0.00 66.70 67.86 2wwu h VAL 147 Cb 0.23 0.70 -0.07 0.00 -1.52 0.00 0.00 31.29 30.63 2wwu h VAL 147 CO -0.21 0.02 0.43 -0.08 0.02 0.00 0.00 177.57 177.76 2wwu h GLU 148 N 0.12 0.71 -0.66 1.57 4.81 -0.75 0.76 114.58 121.14 2wwu h GLU 148 Ca 0.13 -0.04 -0.04 0.00 -0.13 0.00 0.00 59.36 59.27 2wwu h GLU 148 Cb 0.16 -0.16 -0.03 0.00 0.63 0.00 0.00 28.75 29.35 2wwu h GLU 148 CO -0.20 0.47 0.24 1.25 -0.73 0.00 0.00 179.01 180.04 2wwu h HIS 149 N 0.74 1.03 0.00 0.92 2.76 -0.24 0.19 115.15 120.55 2wwu h HIS 149 Ca 0.38 -0.09 -0.03 0.00 -2.20 0.00 0.00 60.37 58.43 2wwu h HIS 149 Cb 0.34 -0.30 -0.00 0.00 1.55 0.00 0.00 27.41 29.00 2wwu h HIS 149 CO -0.07 0.82 -0.37 1.88 -1.30 0.00 0.00 177.93 178.88 2wwu h TYR 150 N 0.95 0.00 0.00 5.26 0.05 -0.67 -3.37 116.97 119.19 2wwu h TYR 150 Ca 0.22 0.00 -0.32 0.00 0.05 0.00 0.00 58.73 58.67 2wwu h TYR 150 Cb 0.25 0.00 -0.06 0.00 1.01 0.00 0.00 36.73 37.93 2wwu h TYR 150 CO 0.02 0.11 -2.23 0.28 -1.05 0.00 0.00 178.16 175.29 2wwu n VAL 151 N -3.02 1.23 0.00 -2.88 0.31 0.21 -2.71 118.33 111.48 2wwu n VAL 151 Ca 0.02 -0.58 0.00 0.00 -0.01 0.00 0.00 64.34 63.77 2wwu n VAL 151 Cb 0.58 -0.99 0.00 0.00 -0.91 0.00 0.00 33.84 32.52 2wwu n VAL 151 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2wwu n GLY 152 N 2.25 2.85 0.40 2.92 0.00 0.66 -4.72 105.19 109.54 2wwu n GLY 152 Ca -0.35 -1.33 0.20 0.00 0.00 0.00 0.00 46.02 44.54 2wwu n GLY 152 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2wwu h SER 153 N 0.00 0.17 0.10 1.61 0.02 -1.93 -2.74 113.55 110.78 2wwu h SER 153 Ca 0.00 0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.96 2wwu h SER 153 Cb 0.00 -0.02 0.00 0.00 0.14 0.00 0.00 62.40 62.52 2wwu h SER 153 CO 0.00 0.08 -0.18 0.47 -1.14 0.00 0.00 176.83 176.06 2wwu n ASP 154 N -4.41 1.49 -4.70 3.07 8.00 -1.26 -1.55 116.55 117.19 2wwu n ASP 154 Ca 0.14 -1.27 -0.42 0.00 0.71 0.00 0.00 54.79 53.95 2wwu n ASP 154 Cb 0.66 0.12 -0.03 0.00 -0.02 0.00 0.00 41.12 41.86 2wwu n ASP 154 CO 0.00 0.00 0.00 -0.75 -0.39 0.00 0.00 177.20 176.06 2wwu s LYS 155 N -2.29 4.15 0.10 -1.24 2.47 -1.03 -4.74 119.74 117.15 2wwu s LYS 155 Ca 0.28 2.55 -0.30 0.00 -1.56 0.00 0.00 55.97 56.94 2wwu s LYS 155 Cb 0.20 -3.41 -0.06 0.00 -1.46 0.00 0.00 37.83 33.10 2wwu s LYS 155 CO 0.45 -0.79 1.09 -1.21 0.16 0.00 0.00 175.35 175.05 2wwu s GLU 156 N 2.16 4.55 -0.00 4.03 0.41 -1.26 -0.29 118.70 128.29 2wwu s GLU 156 Ca 0.77 1.65 0.04 0.00 -0.41 0.00 0.00 54.97 57.02 2wwu s GLU 156 Cb -0.46 -3.34 -0.01 0.00 -1.78 0.00 0.00 34.13 28.53 2wwu s GLU 156 CO 0.34 -0.03 -0.12 0.96 -0.49 0.00 0.00 175.26 175.92 2wwu s ILE 157 N 0.42 0.94 0.01 -1.63 -4.36 0.14 -4.92 121.20 111.81 2wwu s ILE 157 Ca 0.52 -0.56 -0.30 0.00 -0.26 0.00 0.00 60.65 60.05 2wwu s ILE 157 Cb -0.27 -0.80 -0.05 0.00 1.25 0.00 0.00 42.46 42.59 2wwu s ILE 157 CO 0.31 0.23 1.28 -1.81 0.24 0.00 0.00 174.94 175.19 2wwu s ASP 158 N -0.38 6.98 0.02 4.36 1.01 -1.26 -1.40 116.67 126.00 2wwu s ASP 158 Ca 0.04 2.01 0.08 0.00 0.71 0.00 0.00 52.55 55.39 2wwu s ASP 158 Cb -0.05 -2.57 -0.02 0.00 1.01 0.00 0.00 42.92 41.29 2wwu s ASP 158 CO -0.00 -0.60 -0.25 -0.69 0.21 0.00 0.00 175.17 173.84 2wwu s VAL 159 N 1.83 1.98 -0.18 -1.27 1.01 -0.02 -4.56 120.40 119.19 2wwu s VAL 159 Ca 0.60 -1.24 -0.04 0.00 0.00 0.00 0.00 61.98 61.30 2wwu s VAL 159 Cb -0.29 -1.68 -0.02 0.00 0.00 0.00 0.00 36.38 34.38 2wwu s VAL 159 CO 0.26 0.40 -0.04 0.27 0.00 0.00 0.00 175.10 175.99 2wwu s ILE 160 N -0.72 3.63 -0.67 2.22 -4.36 -0.41 -2.23 121.20 118.66 2wwu s ILE 160 Ca 0.10 -0.43 -0.27 0.00 -0.26 0.00 0.00 60.65 59.79 2wwu s ILE 160 Cb -0.10 -2.61 0.02 0.00 1.25 0.00 0.00 42.46 41.02 2wwu s ILE 160 CO 0.01 0.46 1.32 -0.62 0.24 0.00 0.00 174.94 176.35 2wwu s ASP 161 N 0.86 6.16 0.00 4.36 -1.08 -0.82 -0.70 116.67 125.45 2wwu s ASP 161 Ca -0.01 -0.17 0.03 0.00 -0.52 0.00 0.00 52.55 51.88 2wwu s ASP 161 Cb -0.15 -2.55 0.18 0.00 -1.46 0.00 0.00 42.92 38.94 2wwu s ASP 161 CO 0.01 -1.78 0.51 0.52 0.52 0.00 0.00 175.17 174.95 2wwu n VAL 162 N 6.57 0.00 -0.08 1.11 0.31 0.44 -2.31 118.33 124.36 2wwu n VAL 162 Ca 0.07 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.40 2wwu n VAL 162 Cb 0.49 -0.59 0.00 0.00 -0.91 0.00 0.00 33.84 32.83 2wwu n VAL 162 CO 0.00 0.00 0.00 0.41 -1.32 0.00 0.00 176.83 175.92 2wwu n THR 163 N -0.71 1.03 -2.96 2.52 -1.04 -1.26 -4.54 114.28 107.32 2wwu n THR 163 Ca 0.02 -0.22 -0.12 0.00 -2.04 0.00 0.00 64.05 61.69 2wwu n THR 163 Cb 0.01 -1.17 -0.03 0.00 -1.82 0.00 0.00 70.33 67.32 2wwu n THR 163 CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 2wwu n ARG 164 N 1.47 -0.96 0.00 -2.82 3.00 -0.98 -4.73 116.66 111.64 2wwu n ARG 164 Ca 0.00 0.04 0.00 0.00 -0.01 0.00 0.00 57.85 57.88 2wwu n ARG 164 Cb 0.29 -1.34 0.00 0.00 0.00 0.00 0.00 32.46 31.41 2wwu n ARG 164 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2wwu n GLN 165 N -2.09 0.00 -4.34 5.56 10.64 -1.07 -4.99 117.38 121.10 2wwu n GLN 165 Ca -0.07 0.00 -0.19 0.00 -1.83 0.00 0.00 57.00 54.91 2wwu n GLN 165 Cb 0.22 -0.14 -0.10 0.00 -0.86 0.00 0.00 30.24 29.36 2wwu n GLN 165 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 2wwu s ALA 166 N -2.72 1.97 0.11 2.61 0.00 -1.26 -5.01 121.76 117.45 2wwu s ALA 166 Ca 0.00 -1.62 0.02 0.00 0.00 0.00 0.00 51.96 50.36 2wwu s ALA 166 Cb 0.00 -0.09 -0.04 0.00 0.00 0.00 0.00 23.12 22.99 2wwu s ALA 166 CO 0.00 0.08 0.18 -0.51 0.00 0.00 0.00 175.76 175.51 2wwu s ASP 167 N -3.20 5.98 0.10 0.00 1.11 -1.26 -1.94 116.67 117.46 2wwu s ASP 167 Ca 0.21 0.10 -0.26 0.00 0.18 0.00 0.00 52.55 52.78 2wwu s ASP 167 Cb -0.01 -1.73 0.08 0.00 1.07 0.00 0.00 42.92 42.33 2wwu s ASP 167 CO 0.06 0.12 0.85 0.00 1.18 0.00 0.00 175.17 177.38 2wwu s LYS 169 N -3.35 3.70 -0.09 0.00 -0.14 -1.26 -0.84 119.74 117.76 2wwu s LYS 169 Ca 0.07 0.14 -0.16 0.00 -1.36 0.00 0.00 55.97 54.66 2wwu s LYS 169 Cb -0.02 -2.62 0.03 0.00 -1.68 0.00 0.00 37.83 33.55 2wwu s LYS 169 CO -0.05 0.22 0.38 -1.64 -0.76 0.00 0.00 175.35 173.50 2wwu s MET 170 N -3.35 0.59 0.26 1.68 -1.94 -0.49 -4.91 119.30 111.14 2wwu s MET 170 Ca 0.46 0.22 -0.30 0.00 -1.71 0.00 0.00 55.69 54.37 2wwu s MET 170 Cb -0.11 0.28 -0.09 0.00 2.01 0.00 0.00 34.83 36.92 2wwu s MET 170 CO 0.27 -0.13 1.17 0.15 -0.01 0.00 0.00 175.02 176.48 2wwu s LYS 171 N -0.53 4.54 0.27 2.03 1.02 -1.26 0.24 119.74 126.04 2wwu s LYS 171 Ca -0.06 1.90 -0.00 0.00 0.02 0.00 0.00 55.97 57.83 2wwu s LYS 171 Cb -0.04 -3.19 0.59 0.00 -0.52 0.00 0.00 37.83 34.67 2wwu s LYS 171 CO 0.03 0.04 1.71 1.25 -0.92 0.00 0.00 175.35 177.45 2wwu h LEU 172 N 4.25 0.29 -1.44 3.17 5.85 -0.61 -0.43 115.31 126.39 2wwu h LEU 172 Ca -0.46 0.13 -0.02 0.00 0.84 0.00 0.00 57.88 58.37 2wwu h LEU 172 Cb 1.21 0.12 -0.02 0.00 0.37 0.00 0.00 40.66 42.34 2wwu h LEU 172 CO 0.69 0.05 0.17 1.23 -0.34 0.00 0.00 178.44 180.25 2wwu h GLY 173 N 0.42 0.59 1.50 3.75 0.00 -1.55 0.12 103.07 107.90 2wwu h GLY 173 Ca 0.48 -0.27 -0.13 0.00 0.00 0.00 0.00 47.33 47.42 2wwu h GLY 173 CO -0.47 0.26 -0.37 -0.55 0.00 0.00 0.00 176.54 175.40 2wwu h ASP 174 N 0.55 0.58 -0.28 0.19 3.32 -1.36 -0.99 116.42 118.44 2wwu h ASP 174 Ca 0.14 -0.25 -0.05 0.00 0.02 0.00 0.00 57.03 56.89 2wwu h ASP 174 Cb 0.09 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 39.47 2wwu h ASP 174 CO -0.02 0.90 -0.02 0.15 -1.72 0.00 0.00 179.24 178.53 2wwu h PHE 175 N 0.47 0.56 -0.57 4.55 3.57 -0.56 -1.35 116.94 123.60 2wwu h PHE 175 Ca 0.05 -0.10 0.08 0.00 3.53 0.00 0.00 57.97 61.52 2wwu h PHE 175 Cb 0.86 -0.14 -0.07 0.00 2.79 0.00 0.00 35.95 39.39 2wwu h PHE 175 CO 0.03 0.67 0.22 0.28 -2.23 0.00 0.00 178.31 177.28 2wwu h VAL 176 N 0.28 0.80 -0.05 1.41 2.07 -0.73 0.46 116.25 120.49 2wwu h VAL 176 Ca 0.08 -0.14 0.04 0.00 0.82 0.00 0.00 66.70 67.49 2wwu h VAL 176 Cb 0.46 0.36 -0.05 0.00 -1.52 0.00 0.00 31.29 30.55 2wwu h VAL 176 CO 0.02 0.07 -0.23 0.50 0.02 0.00 0.00 177.57 177.95 2wwu h LYS 177 N 0.40 -0.32 -0.45 1.57 3.64 -1.05 -1.04 116.57 119.32 2wwu h LYS 177 Ca 0.28 0.02 0.06 0.00 -1.27 0.00 0.00 60.65 59.74 2wwu h LYS 177 Cb 0.32 0.07 -0.05 0.00 -0.41 0.00 0.00 32.23 32.17 2wwu h LYS 177 CO -0.28 -0.21 0.16 -0.92 -2.27 0.00 0.00 179.45 175.93 2wwu h TYR 178 N -0.33 0.29 0.41 1.91 3.20 -0.34 -0.31 116.97 121.80 2wwu h TYR 178 Ca 0.08 0.02 -0.01 0.00 3.14 0.00 0.00 58.73 61.96 2wwu h TYR 178 Cb 0.44 -0.06 -0.02 0.00 1.54 0.00 0.00 36.73 38.63 2wwu h TYR 178 CO -0.29 0.11 -0.38 -0.92 -1.64 0.00 0.00 178.16 175.03 2wwu h TYR 179 N 0.34 -1.06 0.00 -3.82 3.20 0.33 -2.67 116.97 113.29 2wwu h TYR 179 Ca 0.21 0.01 0.00 0.00 3.14 0.00 0.00 58.73 62.09 2wwu h TYR 179 Cb 0.21 0.41 0.00 0.00 1.54 0.00 0.00 36.73 38.88 2wwu h TYR 179 CO -0.15 -0.52 0.00 1.88 -1.64 0.00 0.00 178.16 177.73 2wwu h TYR 180 N -0.79 0.00 -0.16 -3.82 0.05 -1.12 -2.25 116.97 108.87 2wwu h TYR 180 Ca -0.05 0.00 -0.00 0.00 0.05 0.00 0.00 58.73 58.72 2wwu h TYR 180 Cb 0.67 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.41 2wwu h TYR 180 CO -0.19 0.00 0.09 0.66 -1.05 0.00 0.00 178.16 177.67 2wwu h SER 181 N 0.00 0.19 0.00 3.88 4.64 -0.69 -3.46 113.55 118.11 2wwu h SER 181 Ca 0.00 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.31 2wwu h SER 181 Cb 0.45 -0.05 0.00 0.00 -0.31 0.00 0.00 62.40 62.49 2wwu h SER 181 CO 0.00 0.16 0.00 0.61 -0.87 0.00 0.00 176.83 176.73 2wwu n GLY 182 N -1.45 2.08 3.63 -0.77 0.00 -0.85 -4.97 105.19 102.85 2wwu n GLY 182 Ca -0.01 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 2wwu n GLY 182 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2wwu s LYS 183 N -0.04 3.87 -0.30 1.61 0.00 -1.26 -4.89 119.74 118.74 2wwu s LYS 183 Ca 0.00 1.18 0.09 0.00 0.00 0.00 0.00 55.97 57.24 2wwu s LYS 183 Cb 0.00 -3.89 0.52 0.00 0.00 0.00 0.00 37.83 34.45 2wwu s LYS 183 CO 0.00 -1.17 1.49 -2.13 0.00 0.00 0.00 175.35 173.53 2wwu n ARG 184 N 7.41 1.90 -0.31 1.78 3.00 -1.26 -4.55 116.66 124.63 2wwu n ARG 184 Ca 0.15 -3.17 -0.03 0.00 -0.00 0.00 0.00 57.85 54.80 2wwu n ARG 184 Cb 0.47 -1.84 0.13 0.00 0.00 0.00 0.00 32.46 31.22 2wwu n ARG 184 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 177.63 178.68 2wwu h GLU 185 N 1.04 1.20 -5.89 -0.14 4.11 -2.02 -3.38 114.58 109.50 2wwu h GLU 185 Ca 0.24 -0.12 -0.67 0.00 0.07 0.00 0.00 59.36 58.87 2wwu h GLU 185 Cb 1.72 -0.24 -0.15 0.00 0.50 0.00 0.00 28.75 30.57 2wwu h GLU 185 CO 0.42 0.86 -0.61 0.15 0.07 0.00 0.00 179.01 179.90 2wwu s LYS 186 N -5.84 3.08 -0.45 1.06 3.01 -1.26 -5.08 119.74 114.26 2wwu s LYS 186 Ca -0.12 -0.40 -0.13 0.00 -1.01 0.00 0.00 55.97 54.32 2wwu s LYS 186 Cb 0.17 -2.84 0.07 0.00 -1.01 0.00 0.00 37.83 34.23 2wwu s LYS 186 CO 0.82 0.67 0.33 0.08 0.51 0.00 0.00 175.35 177.75 2wwu s VAL 187 N -0.77 4.77 -0.15 3.17 1.01 -1.26 -5.03 120.40 122.13 2wwu s VAL 187 Ca 0.12 -1.21 -0.05 0.00 0.00 0.00 0.00 61.98 60.84 2wwu s VAL 187 Cb -0.12 -3.87 -0.03 0.00 0.00 0.00 0.00 36.38 32.36 2wwu s VAL 187 CO 0.02 -0.54 0.01 -0.76 0.00 0.00 0.00 175.10 173.83 2wwu s LEU 188 N 1.54 3.53 -0.10 3.92 1.43 -1.26 0.17 118.68 127.91 2wwu s LEU 188 Ca 0.04 0.00 0.04 0.00 -1.03 0.00 0.00 54.13 53.18 2wwu s LEU 188 Cb -0.24 -1.86 0.00 0.00 0.03 0.00 0.00 46.19 44.12 2wwu s LEU 188 CO 0.05 0.21 -0.23 0.21 0.23 0.00 0.00 176.35 176.81 2wwu s ASN 189 N 0.15 3.02 -0.30 2.29 2.47 0.13 -4.28 114.94 118.43 2wwu s ASN 189 Ca 0.01 -0.55 -0.04 0.00 0.42 0.00 0.00 52.86 52.70 2wwu s ASN 189 Cb -0.13 -1.38 0.03 0.00 -1.45 0.00 0.00 41.25 38.32 2wwu s ASN 189 CO 0.02 0.15 0.04 -0.69 -3.72 0.00 0.00 177.10 172.89 2wwu s VAL 190 N 0.37 3.47 0.00 -5.21 1.01 -0.77 -1.28 120.40 117.98 2wwu s VAL 190 Ca -0.18 -1.02 0.00 0.00 0.00 0.00 0.00 61.98 60.78 2wwu s VAL 190 Cb -0.18 -2.86 0.00 0.00 0.00 0.00 0.00 36.38 33.34 2wwu s VAL 190 CO 0.08 0.01 0.31 2.30 0.00 0.00 0.00 175.10 177.80 2wwu n ILE 191 N 4.76 0.00 -2.36 2.22 -5.35 -1.26 -0.54 119.36 116.82 2wwu n ILE 191 Ca -0.14 -0.34 0.02 0.00 -0.27 0.00 0.00 62.75 62.02 2wwu n ILE 191 Cb 0.46 1.30 0.06 0.00 -1.74 0.00 0.00 39.64 39.72 2wwu n ILE 191 CO 0.00 0.00 0.00 -1.54 -1.76 0.00 0.00 176.55 173.25 2wwu n SER 192 N -0.06 1.51 -4.56 7.28 3.41 -1.26 -4.79 113.62 115.16 2wwu n SER 192 Ca 0.00 -2.48 -0.36 0.00 -0.26 0.00 0.00 58.87 55.77 2wwu n SER 192 Cb 0.07 -0.38 -0.04 0.00 -0.26 0.00 0.00 64.21 63.61 2wwu n SER 192 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 2wwu s LEU 193 N -1.60 3.27 -0.23 1.04 2.96 -1.22 -4.86 118.68 118.04 2wwu s LEU 193 Ca 0.35 -0.51 -0.27 0.00 -0.22 0.00 0.00 54.13 53.48 2wwu s LEU 193 Cb 0.37 -2.55 0.00 0.00 0.50 0.00 0.00 46.19 44.51 2wwu s LEU 193 CO -0.11 -2.19 0.95 -0.70 -1.32 0.00 0.00 176.35 172.97 2wwu s GLU 194 N 6.33 4.23 -0.05 1.98 -6.30 -1.26 -1.02 118.70 122.61 2wwu s GLU 194 Ca 0.57 1.18 0.11 0.00 -2.50 0.00 0.00 54.97 54.33 2wwu s GLU 194 Cb -0.07 -3.64 0.30 0.00 0.00 0.00 0.00 34.13 30.71 2wwu s GLU 194 CO 0.07 -0.58 1.23 1.97 0.02 0.00 0.00 175.26 177.97 2wwu n PHE 195 N 6.17 0.44 -0.17 5.30 1.16 -0.75 -4.68 117.46 124.93 2wwu n PHE 195 Ca 0.09 -0.64 0.25 0.00 -1.87 0.00 0.00 57.45 55.28 2wwu n PHE 195 Cb 0.47 -0.11 0.66 0.00 -1.61 0.00 0.00 39.48 38.89 2wwu n PHE 195 CO 0.00 0.00 0.00 0.77 -1.87 0.00 0.00 176.76 175.66 2wwu h SER 196 N 1.38 0.11 -0.76 5.98 0.02 -1.92 -1.36 113.55 117.00 2wwu h SER 196 Ca 0.00 0.01 -0.26 0.00 -0.84 0.00 0.00 61.79 60.70 2wwu h SER 196 Cb 0.88 -0.01 -0.15 0.00 0.14 0.00 0.00 62.40 63.26 2wwu h SER 196 CO 0.05 0.04 0.31 0.47 -1.14 0.00 0.00 176.83 176.57 2wwu n ASP 197 N -4.35 4.57 -4.45 3.07 8.00 -1.26 -4.75 116.55 117.38 2wwu n ASP 197 Ca 0.17 -3.31 -0.22 0.00 0.71 0.00 0.00 54.79 52.15 2wwu n ASP 197 Cb 0.84 -0.75 -0.11 0.00 -0.02 0.00 0.00 41.12 41.08 2wwu n ASP 197 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 2wwu s THR 198 N -3.05 1.29 0.52 -3.53 -4.23 -0.51 -5.03 115.64 101.09 2wwu s THR 198 Ca 0.55 -2.02 0.17 0.00 -1.18 0.00 0.00 61.69 59.22 2wwu s THR 198 Cb 0.44 -2.74 0.28 0.00 1.34 0.00 0.00 72.50 71.82 2wwu s THR 198 CO 0.13 -0.05 2.15 0.03 -0.54 0.00 0.00 174.62 176.33 2wwu h ARG 199 N 2.13 0.00 -0.47 3.99 3.08 -1.79 -0.42 114.38 120.90 2wwu h ARG 199 Ca -0.41 0.00 0.14 0.00 0.07 0.00 0.00 59.98 59.78 2wwu h ARG 199 Cb 1.24 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 31.27 2wwu h ARG 199 CO 0.70 0.00 0.39 1.25 -1.07 0.00 0.00 179.97 181.24 2wwu h LEU 200 N 0.00 0.00 -1.52 3.04 5.85 -1.78 -1.98 115.31 118.93 2wwu h LEU 200 Ca 0.02 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.74 2wwu h LEU 200 Cb 0.07 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.07 2wwu h LEU 200 CO -0.00 0.00 0.32 -1.28 -0.34 0.00 0.00 178.44 177.14 2wwu h SER 201 N 0.00 0.56 0.60 1.25 0.87 -1.16 -0.97 113.55 114.71 2wwu h SER 201 Ca 0.22 -0.02 -0.01 0.00 -1.23 0.00 0.00 61.79 60.76 2wwu h SER 201 Cb 1.00 -0.14 -0.00 0.00 -0.44 0.00 0.00 62.40 62.82 2wwu h SER 201 CO -0.00 0.41 -0.05 0.78 -0.53 0.00 0.00 176.83 177.44 2wwu h ASN 202 N 0.66 0.00 0.48 6.23 2.35 -1.53 -2.96 115.58 120.82 2wwu h ASN 202 Ca 0.18 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.93 2wwu h ASN 202 Cb -0.07 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.30 2wwu h ASN 202 CO -0.04 0.05 -0.67 0.18 -1.65 0.00 0.00 177.43 175.30 2wwu n LEU 203 N -3.25 0.60 -4.01 1.61 4.32 -0.37 -4.85 117.00 111.05 2wwu n LEU 203 Ca -0.01 -0.03 -0.29 0.00 -0.02 0.00 0.00 56.01 55.66 2wwu n LEU 203 Cb 0.24 -0.19 -0.17 0.00 -1.62 0.00 0.00 43.42 41.69 2wwu n LEU 203 CO 0.27 0.10 -0.48 -0.69 -1.22 0.00 0.00 177.39 175.37 2wwu s VAL 204 N -3.06 1.45 -0.09 4.08 1.01 -1.12 -3.59 120.40 119.08 2wwu s VAL 204 Ca 0.09 -0.57 0.02 0.00 0.00 0.00 0.00 61.98 61.51 2wwu s VAL 204 Cb 0.16 -1.36 -0.02 0.00 0.00 0.00 0.00 36.38 35.16 2wwu s VAL 204 CO 0.74 0.44 -0.13 -0.70 0.00 0.00 0.00 175.10 175.45 2wwu s GLU 205 N 1.37 2.91 0.72 2.72 2.56 0.64 -4.90 118.70 124.72 2wwu s GLU 205 Ca 0.01 -0.67 -0.11 0.00 0.00 0.00 0.00 54.97 54.20 2wwu s GLU 205 Cb -0.13 -2.52 0.02 0.00 2.00 0.00 0.00 34.13 33.50 2wwu s GLU 205 CO -0.07 0.46 1.09 0.95 -0.56 0.00 0.00 175.26 177.13 2wwu s THR 206 N -0.29 3.48 0.35 -1.70 -4.23 -1.26 -1.31 115.64 110.66 2wwu s THR 206 Ca 0.03 0.48 -0.28 0.00 -1.18 0.00 0.00 61.69 60.73 2wwu s THR 206 Cb -0.13 -3.42 -0.12 0.00 1.34 0.00 0.00 72.50 70.18 2wwu s THR 206 CO 0.03 -0.63 1.44 -2.65 -0.54 0.00 0.00 174.62 172.27 2wwu n PRO 207 N -3.08 2.49 -0.28 3.99 -0.02 -1.26 -4.35 135.00 132.49 2wwu n PRO 207 Ca 0.07 0.88 0.08 0.00 -2.02 0.00 0.00 63.50 62.51 2wwu n PRO 207 Cb 0.57 -2.57 0.32 0.00 -0.02 0.00 0.00 33.50 31.80 2wwu n PRO 207 CO 0.00 0.00 0.00 -0.22 1.98 0.00 0.00 175.50 177.26 2wwu h LYS 208 N 3.16 0.80 -0.83 -0.52 1.63 -1.30 -1.84 116.57 117.68 2wwu h LYS 208 Ca -0.49 -0.05 -0.02 0.00 -0.85 0.00 0.00 60.65 59.25 2wwu h LYS 208 Cb 1.25 -0.18 -0.04 0.00 -0.60 0.00 0.00 32.23 32.66 2wwu h LYS 208 CO 0.66 0.53 0.43 0.97 -3.45 0.00 0.00 179.45 178.60 2wwu h ILE 209 N 0.83 1.25 -0.21 2.00 6.09 -1.86 -0.13 117.51 125.47 2wwu h ILE 209 Ca 0.42 -0.64 -0.03 0.00 -1.37 0.00 0.00 64.86 63.24 2wwu h ILE 209 Cb 0.49 0.15 -0.01 0.00 0.47 0.00 0.00 36.82 37.92 2wwu h ILE 209 CO -0.18 0.28 0.03 0.58 -3.07 0.00 0.00 178.15 175.79 2wwu h VAL 210 N 1.16 1.23 -0.18 2.19 2.07 -1.71 -0.89 116.25 120.12 2wwu h VAL 210 Ca 0.29 -0.77 -0.02 0.00 0.82 0.00 0.00 66.70 67.02 2wwu h VAL 210 Cb 0.06 1.34 -0.01 0.00 -1.52 0.00 0.00 31.29 31.15 2wwu h VAL 210 CO -0.04 0.24 0.02 0.03 0.02 0.00 0.00 177.57 177.84 2wwu h ARG 211 N 0.14 0.25 -0.10 1.57 3.08 -1.01 0.16 114.38 118.47 2wwu h ARG 211 Ca 0.06 -0.03 -0.24 0.00 0.07 0.00 0.00 59.98 59.85 2wwu h ARG 211 Cb 0.33 -0.05 0.01 0.00 0.08 0.00 0.00 29.97 30.35 2wwu h ARG 211 CO 0.01 0.26 -0.86 0.87 -1.07 0.00 0.00 179.97 179.17 2wwu h LYS 212 N 0.25 0.75 0.12 0.04 1.79 -0.76 -3.35 116.57 115.41 2wwu h LYS 212 Ca 0.06 -0.67 -0.27 0.00 -2.18 0.00 0.00 60.65 57.59 2wwu h LYS 212 Cb 0.14 0.16 0.00 0.00 -1.58 0.00 0.00 32.23 30.95 2wwu h LYS 212 CO 0.00 1.26 -1.26 -0.07 -1.08 0.00 0.00 179.45 178.30 2wwu h LEU 213 N 0.48 0.39 -9.38 2.94 3.38 -0.67 -3.48 115.31 108.97 2wwu h LEU 213 Ca -0.08 -0.43 -0.61 0.00 0.09 0.00 0.00 57.88 56.85 2wwu h LEU 213 Cb 1.50 -0.13 0.04 0.00 0.09 0.00 0.00 40.66 42.16 2wwu h LEU 213 CO 0.17 1.34 0.88 -0.24 0.09 0.00 0.00 178.44 180.69 2wwu n SER 214 N -3.51 3.06 -0.02 -0.43 2.88 0.53 -4.55 113.62 111.57 2wwu n SER 214 Ca -0.09 1.05 -0.11 0.00 -1.33 0.00 0.00 58.87 58.39 2wwu n SER 214 Cb 1.02 -1.37 -0.05 0.00 -0.75 0.00 0.00 64.21 63.07 2wwu n SER 214 CO 0.00 0.00 0.00 -0.50 -1.23 0.00 0.00 175.04 173.31 2wwu h TRP 215 N 7.08 0.19 -0.69 0.66 4.06 -1.21 -2.01 115.95 124.04 2wwu h TRP 215 Ca -0.47 -0.00 -0.04 0.00 2.06 0.00 0.00 58.89 60.45 2wwu h TRP 215 Cb 1.27 -0.06 -0.03 0.00 -1.00 0.00 0.00 29.16 29.34 2wwu h TRP 215 CO 0.72 0.16 0.28 0.28 -3.56 0.00 0.00 178.44 176.32 2wwu h VAL 216 N 0.17 1.24 -0.69 1.49 2.07 -1.91 0.27 116.25 118.89 2wwu h VAL 216 Ca 0.05 -0.76 -0.06 0.00 0.82 0.00 0.00 66.70 66.75 2wwu h VAL 216 Cb 0.02 0.46 -0.03 0.00 -1.52 0.00 0.00 31.29 30.22 2wwu h VAL 216 CO -0.01 0.30 0.20 -0.08 0.02 0.00 0.00 177.57 178.01 2wwu h GLU 217 N 0.98 1.08 0.00 1.57 4.57 -1.90 -3.23 114.58 117.65 2wwu h GLU 217 Ca 0.23 -0.23 -0.12 0.00 -1.18 0.00 0.00 59.36 58.06 2wwu h GLU 217 Cb 0.21 -0.16 -0.02 0.00 -0.16 0.00 0.00 28.75 28.62 2wwu h GLU 217 CO -0.02 0.93 -1.74 0.09 -1.18 0.00 0.00 179.01 177.09 2wwu n ASN 218 N -4.25 1.95 0.00 1.04 3.02 -0.76 -4.76 115.26 111.49 2wwu n ASN 218 Ca 0.05 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.60 2wwu n ASN 218 Cb 0.23 1.19 0.00 0.00 -0.61 0.00 0.00 39.78 40.59 2wwu n ASN 218 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 2wwu n LEU 219 N -2.22 0.40 -4.62 3.41 4.77 0.92 -4.95 117.00 114.70 2wwu n LEU 219 Ca -0.12 -0.67 -0.43 0.00 -0.03 0.00 0.00 56.01 54.76 2wwu n LEU 219 Cb 0.64 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.71 2wwu n LEU 219 CO 0.27 0.10 0.96 0.86 -1.33 0.00 0.00 177.39 178.25 2wwu s TRP 220 N -0.53 3.02 0.33 -1.77 -0.11 -1.08 -4.85 118.94 113.94 2wwu s TRP 220 Ca 0.00 0.97 -0.29 0.00 1.22 0.00 0.00 56.10 58.01 2wwu s TRP 220 Cb 0.00 -3.95 -0.10 0.00 -1.50 0.00 0.00 33.47 27.91 2wwu s TRP 220 CO 0.00 -0.96 1.29 -2.14 -4.62 0.00 0.00 176.95 170.52 2wwu s PRO 221 N 3.92 4.38 0.27 5.86 0.02 -1.26 -4.93 135.00 143.27 2wwu s PRO 221 Ca 0.45 2.17 -0.01 0.00 0.02 0.00 0.00 61.00 63.64 2wwu s PRO 221 Cb -0.10 -3.08 0.46 0.00 0.02 0.00 0.00 34.50 31.80 2wwu s PRO 221 CO 0.22 -0.15 1.87 1.05 -0.33 0.00 0.00 177.00 179.66 2wwu h GLU 222 N 3.42 1.08 0.00 5.54 9.09 -2.00 -2.83 114.58 128.88 2wwu h GLU 222 Ca -0.49 -0.07 -0.05 0.00 0.05 0.00 0.00 59.36 58.81 2wwu h GLU 222 Cb 1.22 -0.24 -0.01 0.00 -1.65 0.00 0.00 28.75 28.07 2wwu h GLU 222 CO 0.66 0.72 -0.23 1.05 0.05 0.00 0.00 179.01 181.25 2wwu h GLU 223 N 1.12 0.00 -6.37 1.06 9.09 -2.03 -3.45 114.58 114.00 2wwu h GLU 223 Ca 0.45 0.00 -0.64 0.00 0.05 0.00 0.00 59.36 59.22 2wwu h GLU 223 Cb 0.26 0.00 0.08 0.00 -1.65 0.00 0.00 28.75 27.45 2wwu h GLU 223 CO -0.20 0.23 0.25 0.00 0.05 0.00 0.00 179.01 179.35 2wwu n VAL 225 N 1.29 1.35 -2.51 0.00 0.24 -1.26 -4.97 118.33 112.48 2wwu n VAL 225 Ca 0.14 -1.15 -0.32 0.00 -2.04 0.00 0.00 64.34 60.96 2wwu n VAL 225 Cb 0.26 0.32 -0.04 0.00 -1.47 0.00 0.00 33.84 32.91 2wwu n VAL 225 CO 0.00 0.00 0.00 -0.36 -2.14 0.00 0.00 176.83 174.33 2wwu s PHE 226 N -1.42 3.42 0.09 6.34 0.08 -1.26 -5.01 117.98 120.22 2wwu s PHE 226 Ca 0.39 1.50 -0.31 0.00 0.12 0.00 0.00 56.93 58.63 2wwu s PHE 226 Cb 0.23 -2.80 -0.09 0.00 -0.57 0.00 0.00 43.02 39.79 2wwu s PHE 226 CO 0.21 -0.30 1.70 -2.00 -0.10 0.00 0.00 175.22 174.74 2wwu s GLU 227 N -3.84 4.18 -0.13 0.44 2.12 -1.26 -4.96 118.70 115.24 2wwu s GLU 227 Ca 0.60 2.41 -0.27 0.00 0.36 0.00 0.00 54.97 58.07 2wwu s GLU 227 Cb -0.10 -3.58 -0.02 0.00 0.26 0.00 0.00 34.13 30.70 2wwu s GLU 227 CO 0.27 -0.76 0.88 0.50 -0.54 0.00 0.00 175.26 175.60 2wwu s ARG 228 N 2.60 4.36 0.29 4.30 3.52 -1.26 -4.76 118.95 128.00 2wwu s ARG 228 Ca 0.76 1.13 -0.29 0.00 -0.13 0.00 0.00 55.73 57.20 2wwu s ARG 228 Cb -0.42 -3.55 -0.13 0.00 -1.56 0.00 0.00 34.95 29.29 2wwu s ARG 228 CO 0.33 -0.27 1.26 -2.30 -0.81 0.00 0.00 175.30 173.51 2wwu n PRO 229 N 4.96 1.88 -3.69 5.12 -0.02 -1.26 -4.95 135.00 137.04 2wwu n PRO 229 Ca 0.05 0.66 -0.27 0.00 -2.02 0.00 0.00 63.50 61.92 2wwu n PRO 229 Cb 0.49 -2.22 -0.11 0.00 -0.02 0.00 0.00 33.50 31.65 2wwu n PRO 229 CO 0.00 0.00 0.00 -1.71 1.98 0.00 0.00 175.50 175.77 2wwu n ASN 230 N 1.33 1.95 -1.29 2.55 5.15 -1.26 -4.90 115.26 118.78 2wwu n ASN 230 Ca 0.08 -2.97 0.04 0.00 -0.60 0.00 0.00 54.58 51.14 2wwu n ASN 230 Cb 0.33 -0.69 0.05 0.00 -0.53 0.00 0.00 39.78 38.95 2wwu n ASN 230 CO 0.00 0.00 0.00 1.33 1.40 0.00 0.00 177.26 179.99 2wwu n VAL 231 N 2.11 0.38 0.06 3.44 0.24 -1.26 -4.86 118.33 118.44 2wwu n VAL 231 Ca 0.24 -1.33 0.01 0.00 -2.04 0.00 0.00 64.34 61.21 2wwu n VAL 231 Cb 0.40 0.76 -0.05 0.00 -1.47 0.00 0.00 33.84 33.48 2wwu n VAL 231 CO 0.00 0.00 0.00 1.56 -2.14 0.00 0.00 176.83 176.25 2wwu h GLN 232 N 0.94 0.00 -3.17 7.34 4.20 -1.90 -0.91 115.11 121.61 2wwu h GLN 232 Ca -0.18 0.00 -0.50 0.00 0.06 0.00 0.00 58.65 58.03 2wwu h GLN 232 Cb 1.72 0.00 -0.40 0.00 0.30 0.00 0.00 27.48 29.10 2wwu h GLN 232 CO 0.08 0.36 -0.76 0.15 -0.67 0.00 0.00 178.83 177.99 2wwu s LYS 233 N -2.94 0.31 0.02 1.46 1.02 -1.26 -4.17 119.74 114.18 2wwu s LYS 233 Ca -0.01 -0.36 0.05 0.00 0.02 0.00 0.00 55.97 55.67 2wwu s LYS 233 Cb 0.08 -1.77 -0.03 0.00 -0.52 0.00 0.00 37.83 35.59 2wwu s LYS 233 CO 0.79 -0.77 -0.12 0.71 -0.92 0.00 0.00 175.35 175.05 2wwu s TYR 234 N 2.01 2.74 -0.13 3.18 2.02 0.13 -1.81 117.35 125.49 2wwu s TYR 234 Ca 0.03 -0.14 -0.03 0.00 -0.37 0.00 0.00 57.07 56.57 2wwu s TYR 234 Cb -0.16 -1.55 -0.03 0.00 -0.40 0.00 0.00 41.96 39.82 2wwu s TYR 234 CO -0.16 0.31 -0.03 0.00 -1.57 0.00 0.00 175.55 174.10 2wwu s LEU 236 N -0.03 2.24 -0.20 0.00 1.02 0.11 -3.40 118.68 118.42 2wwu s LEU 236 Ca 0.02 -0.48 -0.02 0.00 0.02 0.00 0.00 54.13 53.66 2wwu s LEU 236 Cb -0.13 -1.44 0.06 0.00 0.02 0.00 0.00 46.19 44.69 2wwu s LEU 236 CO 0.02 0.20 0.02 -0.04 0.02 0.00 0.00 176.35 176.58 2wwu s MET 237 N 0.12 0.78 -0.14 1.70 -1.94 0.30 -0.87 119.30 119.25 2wwu s MET 237 Ca -0.11 -0.49 -0.01 0.00 -1.71 0.00 0.00 55.69 53.37 2wwu s MET 237 Cb -0.16 -2.16 0.04 0.00 2.01 0.00 0.00 34.83 34.56 2wwu s MET 237 CO 0.06 -0.63 -0.03 -1.12 -0.01 0.00 0.00 175.02 173.29 2wwu s SER 238 N 1.80 2.48 0.74 3.03 0.01 0.11 -1.85 113.70 120.03 2wwu s SER 238 Ca -0.02 -0.51 -0.11 0.00 1.31 0.00 0.00 55.95 56.63 2wwu s SER 238 Cb -0.17 -0.75 0.04 0.00 0.21 0.00 0.00 66.02 65.35 2wwu s SER 238 CO -0.08 -0.20 1.08 0.68 0.41 0.00 0.00 173.24 175.14 2wwu s VAL 239 N 1.75 3.49 0.24 3.43 -7.23 -1.26 0.05 120.40 120.88 2wwu s VAL 239 Ca 0.02 0.50 -0.29 0.00 -1.81 0.00 0.00 61.98 60.40 2wwu s VAL 239 Cb -0.14 -3.05 -0.15 0.00 0.56 0.00 0.00 36.38 33.60 2wwu s VAL 239 CO -0.07 -0.62 0.97 -1.14 -0.31 0.00 0.00 175.10 173.93 2wwu n ARG 240 N -3.34 1.05 -0.98 4.82 0.63 -1.26 -1.67 116.66 115.90 2wwu n ARG 240 Ca 0.09 0.37 0.00 0.00 -0.92 0.00 0.00 57.85 57.39 2wwu n ARG 240 Cb 0.53 -1.71 0.00 0.00 0.45 0.00 0.00 32.46 31.73 2wwu n ARG 240 CO 0.00 0.00 0.00 -0.25 -2.51 0.00 0.00 177.63 174.87 2wwu n ASP 241 N 1.57 -3.17 -4.76 6.15 8.00 0.19 -4.95 116.55 119.57 2wwu n ASP 241 Ca 0.13 0.00 -0.40 0.00 0.71 0.00 0.00 54.79 55.23 2wwu n ASP 241 Cb 0.28 -1.09 0.02 0.00 -0.02 0.00 0.00 41.12 40.31 2wwu n ASP 241 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 2wwu s SER 242 N -2.11 5.88 -0.02 -2.24 0.01 -0.67 -4.85 113.70 109.70 2wwu s SER 242 Ca 0.00 2.85 0.00 0.00 1.31 0.00 0.00 55.95 60.11 2wwu s SER 242 Cb 0.00 -2.65 0.03 0.00 0.21 0.00 0.00 66.02 63.61 2wwu s SER 242 CO 0.00 -1.16 0.02 -0.47 0.41 0.00 0.00 173.24 172.04 2wwu s TYR 243 N -1.23 0.06 -0.17 2.43 5.04 -1.26 -0.89 117.35 121.34 2wwu s TYR 243 Ca 0.61 0.10 -0.01 0.00 -2.44 0.00 0.00 57.07 55.33 2wwu s TYR 243 Cb -0.42 -0.23 -0.01 0.00 0.35 0.00 0.00 41.96 41.65 2wwu s TYR 243 CO 0.54 -0.08 -0.11 0.99 -1.34 0.00 0.00 175.55 175.55 2wwu s THR 244 N 0.93 3.05 0.84 4.34 2.01 0.09 -4.84 115.64 122.07 2wwu s THR 244 Ca -0.08 -0.63 -0.11 0.00 0.31 0.00 0.00 61.69 61.18 2wwu s THR 244 Cb -0.11 -2.32 0.09 0.00 0.01 0.00 0.00 72.50 70.17 2wwu s THR 244 CO -0.02 0.49 1.09 -0.62 -0.69 0.00 0.00 174.62 174.87 2wwu s ASP 245 N 0.87 4.02 0.15 3.53 2.15 -1.26 -1.02 116.67 125.11 2wwu s ASP 245 Ca -0.03 1.52 -0.34 0.00 0.43 0.00 0.00 52.55 54.13 2wwu s ASP 245 Cb -0.15 -2.22 -0.15 0.00 -0.30 0.00 0.00 42.92 40.10 2wwu s ASP 245 CO 0.00 -2.30 1.45 0.49 -0.17 0.00 0.00 175.17 174.64 2wwu n PHE 246 N -3.67 1.95 -3.81 -5.34 3.72 -1.25 -4.51 117.46 104.55 2wwu n PHE 246 Ca 0.07 0.44 -0.09 0.00 -0.05 0.00 0.00 57.45 57.82 2wwu n PHE 246 Cb 0.55 -2.45 -0.04 0.00 -0.94 0.00 0.00 39.48 36.61 2wwu n PHE 246 CO 0.00 0.00 0.00 -3.38 -0.05 0.00 0.00 176.76 173.33 2wwu s HIS 247 N 0.55 -0.03 -0.13 1.38 -3.43 -0.35 -4.87 115.29 108.40 2wwu s HIS 247 Ca 0.78 -0.33 -0.06 0.00 -0.80 0.00 0.00 55.06 54.66 2wwu s HIS 247 Cb -0.77 0.41 -0.04 0.00 -1.43 0.00 0.00 32.58 30.75 2wwu s HIS 247 CO 0.43 -0.99 0.08 0.42 -2.00 0.00 0.00 174.74 172.68 2wwu s ILE 248 N -3.91 4.97 0.41 -5.38 1.01 -1.26 -1.39 121.20 115.65 2wwu s ILE 248 Ca 0.12 0.01 -0.26 0.00 0.00 0.00 0.00 60.65 60.52 2wwu s ILE 248 Cb -0.02 -3.17 -0.09 0.00 0.01 0.00 0.00 42.46 39.19 2wwu s ILE 248 CO 0.01 0.57 1.40 -1.81 0.00 0.00 0.00 174.94 175.11 2wwu s ASP 249 N -0.57 6.18 0.50 3.58 1.01 -1.26 -4.89 116.67 121.22 2wwu s ASP 249 Ca 0.11 2.88 -0.22 0.00 0.71 0.00 0.00 52.55 56.02 2wwu s ASP 249 Cb -0.12 -2.65 -0.07 0.00 1.01 0.00 0.00 42.92 41.08 2wwu s ASP 249 CO 0.02 -0.97 1.15 2.22 0.21 0.00 0.00 175.17 177.81 2wwu n PHE 250 N 0.14 1.61 -1.46 4.23 1.16 -1.26 -2.38 117.46 119.50 2wwu n PHE 250 Ca 0.03 0.48 -0.16 0.00 -1.87 0.00 0.00 57.45 55.93 2wwu n PHE 250 Cb 0.41 -2.28 -0.07 0.00 -1.61 0.00 0.00 39.48 35.94 2wwu n PHE 250 CO 0.00 0.00 0.00 0.41 -1.87 0.00 0.00 176.76 175.30 2wwu n GLY 251 N 1.01 1.59 2.45 4.97 0.00 -1.26 -1.84 105.19 112.11 2wwu n GLY 251 Ca 0.10 -0.17 -0.18 0.00 0.00 0.00 0.00 46.02 45.78 2wwu n GLY 251 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wwu n GLY 252 N -0.72 1.01 3.81 -0.02 0.00 -1.00 -4.59 105.19 103.69 2wwu n GLY 252 Ca -0.16 -0.16 -0.31 0.00 0.00 0.00 0.00 46.02 45.39 2wwu n GLY 252 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2wwu s THR 253 N -2.74 3.95 0.39 2.61 -4.23 -0.76 -4.61 115.64 110.25 2wwu s THR 253 Ca 0.00 0.65 0.03 0.00 -1.18 0.00 0.00 61.69 61.19 2wwu s THR 253 Cb 0.00 -3.35 -0.01 0.00 1.34 0.00 0.00 72.50 70.48 2wwu s THR 253 CO 0.00 -0.81 0.58 -0.44 -0.54 0.00 0.00 174.62 173.41 2wwu s SER 254 N -3.69 5.93 -0.00 3.99 0.01 0.36 -4.37 113.70 115.93 2wwu s SER 254 Ca 0.59 0.13 -0.06 0.00 1.31 0.00 0.00 55.95 57.91 2wwu s SER 254 Cb -0.14 -1.48 0.00 0.00 0.21 0.00 0.00 66.02 64.61 2wwu s SER 254 CO 0.54 -0.55 0.12 0.54 0.41 0.00 0.00 173.24 174.30 2wwu s VAL 255 N -2.38 0.08 0.06 3.43 0.11 -0.80 -1.06 120.40 119.84 2wwu s VAL 255 Ca 0.46 -0.65 0.09 0.00 -2.93 0.00 0.00 61.98 58.95 2wwu s VAL 255 Cb -0.10 -0.39 -0.03 0.00 -1.53 0.00 0.00 36.38 34.33 2wwu s VAL 255 CO 0.35 -0.36 -0.25 -1.66 -3.33 0.00 0.00 175.10 169.86 2wwu s TRP 256 N -1.26 2.16 -0.04 1.54 1.48 -0.83 -0.36 118.94 121.63 2wwu s TRP 256 Ca -0.13 -0.40 0.01 0.00 -1.06 0.00 0.00 56.10 54.52 2wwu s TRP 256 Cb -0.07 -1.27 0.02 0.00 -1.16 0.00 0.00 33.47 30.99 2wwu s TRP 256 CO 0.01 0.15 -0.04 0.71 -4.06 0.00 0.00 176.95 173.72 2wwu s TYR 257 N -0.85 0.67 -0.22 1.66 2.02 0.40 -2.12 117.35 118.91 2wwu s TYR 257 Ca 0.11 -0.17 -0.00 0.00 -0.37 0.00 0.00 57.07 56.64 2wwu s TYR 257 Cb -0.10 -0.59 0.02 0.00 -0.40 0.00 0.00 41.96 40.89 2wwu s TYR 257 CO 0.03 -0.16 -0.13 -1.58 -1.57 0.00 0.00 175.55 172.14 2wwu s HIS 258 N 0.79 2.96 -0.41 2.71 5.65 0.23 -0.44 115.29 126.78 2wwu s HIS 258 Ca -0.10 -1.64 -0.28 0.00 0.25 0.00 0.00 55.06 53.28 2wwu s HIS 258 Cb -0.13 -1.98 0.02 0.00 -1.18 0.00 0.00 32.58 29.31 2wwu s HIS 258 CO 0.00 -0.77 1.07 0.08 -0.65 0.00 0.00 174.74 174.48 2wwu s VAL 259 N 1.29 4.38 -0.03 0.89 1.01 -0.99 -0.69 120.40 126.26 2wwu s VAL 259 Ca 0.02 1.37 -0.21 0.00 0.00 0.00 0.00 61.98 63.15 2wwu s VAL 259 Cb -0.15 -4.49 -0.30 0.00 0.00 0.00 0.00 36.38 31.44 2wwu s VAL 259 CO -0.08 -0.75 0.94 0.25 0.00 0.00 0.00 175.10 175.46 2wwu h LEU 260 N 10.64 0.49 -7.67 3.92 5.85 -1.59 0.39 115.31 127.34 2wwu h LEU 260 Ca -0.22 -0.91 -0.11 0.00 0.84 0.00 0.00 57.88 57.47 2wwu h LEU 260 Cb 1.06 -0.16 -0.18 0.00 0.37 0.00 0.00 40.66 41.75 2wwu h LEU 260 CO 1.07 1.36 -0.36 -1.59 -0.34 0.00 0.00 178.44 178.58 2wwu s LYS 261 N -2.60 0.67 2.29 1.25 -2.85 -0.97 -4.24 119.74 113.29 2wwu s LYS 261 Ca -0.13 -0.50 0.00 0.00 -1.00 0.00 0.00 55.97 54.34 2wwu s LYS 261 Cb 0.01 0.29 0.00 0.00 -2.06 0.00 0.00 37.83 36.07 2wwu s LYS 261 CO 0.83 -0.19 0.00 0.41 0.10 0.00 0.00 175.35 176.50 2wwu n GLY 262 N 0.89 0.05 3.44 0.59 0.00 -1.26 -1.74 105.19 107.17 2wwu n GLY 262 Ca -0.20 -1.28 -0.16 0.00 0.00 0.00 0.00 46.02 44.39 2wwu n GLY 262 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2wwu s GLU 263 N 0.00 1.00 0.02 1.61 2.12 -1.26 -2.62 118.70 119.56 2wwu s GLU 263 Ca 0.00 0.04 0.05 0.00 0.36 0.00 0.00 54.97 55.42 2wwu s GLU 263 Cb 0.00 0.46 -0.02 0.00 0.26 0.00 0.00 34.13 34.84 2wwu s GLU 263 CO 0.00 -0.33 -0.16 0.15 -0.54 0.00 0.00 175.26 174.39 2wwu s LYS 264 N -1.61 1.16 -0.24 4.30 1.02 -0.00 -4.18 119.74 120.19 2wwu s LYS 264 Ca -0.10 -0.70 -0.04 0.00 0.02 0.00 0.00 55.97 55.16 2wwu s LYS 264 Cb -0.01 -1.17 -0.00 0.00 -0.52 0.00 0.00 37.83 36.13 2wwu s LYS 264 CO 0.05 0.31 -0.02 0.42 -0.92 0.00 0.00 175.35 175.19 2wwu s ILE 265 N -0.62 3.44 -0.16 2.17 1.01 0.36 0.35 121.20 127.76 2wwu s ILE 265 Ca 0.05 -0.57 -0.09 0.00 0.00 0.00 0.00 60.65 60.04 2wwu s ILE 265 Cb -0.07 -2.62 -0.05 0.00 0.01 0.00 0.00 42.46 39.73 2wwu s ILE 265 CO 0.01 0.34 0.15 -0.36 0.00 0.00 0.00 174.94 175.08 2wwu s PHE 266 N 1.47 3.51 -0.34 3.97 0.08 0.10 -0.92 117.98 125.85 2wwu s PHE 266 Ca 0.05 0.45 -0.06 0.00 0.12 0.00 0.00 56.93 57.49 2wwu s PHE 266 Cb -0.15 -2.07 0.05 0.00 -0.57 0.00 0.00 43.02 40.28 2wwu s PHE 266 CO -0.02 0.51 0.10 0.71 -0.10 0.00 0.00 175.22 176.42 2wwu s TYR 267 N -0.32 3.28 -0.14 0.36 2.02 0.07 -0.12 117.35 122.50 2wwu s TYR 267 Ca 0.12 -1.56 -0.03 0.00 -0.37 0.00 0.00 57.07 55.23 2wwu s TYR 267 Cb -0.12 -2.35 -0.03 0.00 -0.40 0.00 0.00 41.96 39.07 2wwu s TYR 267 CO 0.01 -0.76 -0.03 -0.51 -1.57 0.00 0.00 175.55 172.69 2wwu s LEU 268 N 1.36 3.29 -0.06 -1.29 1.43 0.60 -1.93 118.68 122.09 2wwu s LEU 268 Ca -0.01 -0.08 0.02 0.00 -1.03 0.00 0.00 54.13 53.03 2wwu s LEU 268 Cb -0.20 -1.78 0.01 0.00 0.03 0.00 0.00 46.19 44.25 2wwu s LEU 268 CO 0.02 0.21 -0.11 -0.63 0.23 0.00 0.00 176.35 176.07 2wwu s ILE 269 N 0.09 1.03 0.27 -0.59 1.01 0.58 -0.89 121.20 122.70 2wwu s ILE 269 Ca -0.00 -0.42 -0.29 0.00 0.00 0.00 0.00 60.65 59.93 2wwu s ILE 269 Cb -0.13 -0.95 -0.10 0.00 0.01 0.00 0.00 42.46 41.29 2wwu s ILE 269 CO 0.03 0.33 1.25 -0.60 0.00 0.00 0.00 174.94 175.95 2wwu s ARG 270 N 0.68 4.45 -1.02 2.79 3.52 -1.26 -1.47 118.95 126.63 2wwu s ARG 270 Ca -0.14 2.05 -0.06 0.00 -0.13 0.00 0.00 55.73 57.45 2wwu s ARG 270 Cb -0.15 -3.14 -0.01 0.00 -1.56 0.00 0.00 34.95 30.09 2wwu s ARG 270 CO 0.03 -0.10 2.81 -0.35 -0.81 0.00 0.00 175.30 176.88 2wwu n PRO 271 N 1.48 3.52 -1.48 5.12 -0.04 -1.26 -4.73 135.00 137.61 2wwu n PRO 271 Ca 0.02 -2.53 -0.33 0.00 -0.04 0.00 0.00 63.50 60.62 2wwu n PRO 271 Cb 0.43 -2.48 0.08 0.00 -0.04 0.00 0.00 33.50 31.49 2wwu n PRO 271 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 2wwu s THR 272 N -0.20 2.97 0.24 0.52 -4.23 -1.26 -4.75 115.64 108.93 2wwu s THR 272 Ca 0.61 0.41 -0.05 0.00 -1.18 0.00 0.00 61.69 61.48 2wwu s THR 272 Cb 0.25 -2.89 0.22 0.00 1.34 0.00 0.00 72.50 71.42 2wwu s THR 272 CO -0.10 -0.32 1.70 0.78 -0.54 0.00 0.00 174.62 176.14 2wwu h ASN 273 N -0.48 0.08 -0.43 3.99 2.35 -1.99 0.54 115.58 119.64 2wwu h ASN 273 Ca -0.46 0.13 0.01 0.00 -0.55 0.00 0.00 56.30 55.44 2wwu h ASN 273 Cb 1.25 0.16 -0.03 0.00 0.05 0.00 0.00 38.32 39.76 2wwu h ASN 273 CO 0.51 0.00 0.27 0.00 -1.65 0.00 0.00 177.43 176.56 2wwu h ALA 274 N 1.58 0.55 -0.31 -0.83 0.00 -1.97 -1.91 119.26 116.38 2wwu h ALA 274 Ca 0.41 -0.02 -0.10 0.00 0.00 0.00 0.00 54.91 55.20 2wwu h ALA 274 Cb 0.67 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 2wwu h ALA 274 CO -0.47 -0.04 -0.22 -0.91 0.00 0.00 0.00 179.25 177.61 2wwu h ASN 275 N 0.54 0.59 -0.88 0.00 2.35 -1.56 -2.59 115.58 114.04 2wwu h ASN 275 Ca 0.17 -0.20 -0.03 0.00 -0.55 0.00 0.00 56.30 55.70 2wwu h ASN 275 Cb -0.01 -0.16 -0.04 0.00 0.05 0.00 0.00 38.32 38.15 2wwu h ASN 275 CO -0.06 0.81 0.45 -0.07 -1.65 0.00 0.00 177.43 176.90 2wwu h LEU 276 N 0.52 1.13 -0.39 1.61 3.38 -0.69 -0.20 115.31 120.67 2wwu h LEU 276 Ca 0.08 -0.12 -0.02 0.00 0.09 0.00 0.00 57.88 57.91 2wwu h LEU 276 Cb 0.66 -0.29 -0.02 0.00 0.09 0.00 0.00 40.66 41.11 2wwu h LEU 276 CO 0.05 0.93 0.18 0.74 0.09 0.00 0.00 178.44 180.43 2wwu h THR 277 N 1.24 1.17 -0.80 0.22 2.02 -1.06 -0.13 112.91 115.58 2wwu h THR 277 Ca 0.30 -0.50 -0.03 0.00 0.77 0.00 0.00 66.41 66.95 2wwu h THR 277 Cb 0.08 0.79 -0.04 0.00 -1.74 0.00 0.00 68.15 67.24 2wwu h THR 277 CO -0.04 0.19 0.38 -0.07 0.37 0.00 0.00 175.52 176.35 2wwu h LEU 278 N 0.49 1.03 -0.29 2.58 3.38 -1.29 -2.00 115.31 119.21 2wwu h LEU 278 Ca 0.13 -0.12 -0.03 0.00 0.09 0.00 0.00 57.88 57.95 2wwu h LEU 278 Cb 0.13 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.60 2wwu h LEU 278 CO -0.02 0.87 0.07 0.15 0.09 0.00 0.00 178.44 179.60 2wwu h PHE 279 N 1.13 0.49 -0.76 1.13 3.57 -0.45 0.71 116.94 122.76 2wwu h PHE 279 Ca 0.27 -0.06 -0.02 0.00 3.53 0.00 0.00 57.97 61.69 2wwu h PHE 279 Cb 0.11 -0.14 -0.04 0.00 2.79 0.00 0.00 35.95 38.68 2wwu h PHE 279 CO 0.01 0.54 0.40 0.93 -2.23 0.00 0.00 178.31 177.96 2wwu h GLU 280 N 0.30 1.08 -0.30 1.11 5.08 -0.93 0.18 114.58 121.11 2wwu h GLU 280 Ca 0.09 -0.14 -0.01 0.00 -1.00 0.00 0.00 59.36 58.30 2wwu h GLU 280 Cb 0.29 -0.20 -0.01 0.00 0.50 0.00 0.00 28.75 29.33 2wwu h GLU 280 CO 0.00 0.81 0.15 0.00 -1.00 0.00 0.00 179.01 178.98 2wwu h TRP 282 N 0.35 0.76 0.00 0.00 7.01 -0.42 -0.87 115.95 122.78 2wwu h TRP 282 Ca 0.10 -0.12 -0.04 0.00 2.11 0.00 0.00 58.89 60.94 2wwu h TRP 282 Cb 0.09 -0.20 -0.01 0.00 -2.10 0.00 0.00 29.16 26.95 2wwu h TRP 282 CO -0.02 0.76 -0.18 0.77 -2.79 0.00 0.00 178.44 176.97 2wwu h SER 283 N 0.64 0.00 0.02 2.65 0.02 -0.45 -2.92 113.55 113.52 2wwu h SER 283 Ca 0.12 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.07 2wwu h SER 283 Cb 0.52 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.06 2wwu h SER 283 CO 0.03 0.18 -1.79 -1.20 -1.14 0.00 0.00 176.83 172.91 2wwu n SER 284 N -3.76 0.21 -4.74 3.07 7.64 -1.00 -4.99 113.62 110.05 2wwu n SER 284 Ca -0.02 -0.18 -0.37 0.00 1.01 0.00 0.00 58.87 59.31 2wwu n SER 284 Cb 0.29 1.77 0.06 0.00 -1.01 0.00 0.00 64.21 65.32 2wwu n SER 284 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 2wwu s SER 285 N -4.25 4.77 0.40 6.43 1.04 -0.36 -4.91 113.70 116.82 2wwu s SER 285 Ca -0.05 2.67 0.22 0.00 0.48 0.00 0.00 55.95 59.27 2wwu s SER 285 Cb 0.14 -2.62 0.61 0.00 0.10 0.00 0.00 66.02 64.24 2wwu s SER 285 CO 0.90 -1.90 1.69 0.77 0.98 0.00 0.00 173.24 175.68 2wwu h SER 286 N 0.79 0.00 -0.76 7.02 4.64 -1.91 -3.08 113.55 120.25 2wwu h SER 286 Ca -0.51 0.00 -0.51 0.00 -0.47 0.00 0.00 61.79 60.30 2wwu h SER 286 Cb 1.33 0.00 -0.30 0.00 -0.31 0.00 0.00 62.40 63.11 2wwu h SER 286 CO 0.54 0.25 0.01 -0.46 -0.87 0.00 0.00 176.83 176.30 2wwu n ASN 287 N -3.27 5.29 -0.32 4.97 6.94 -1.26 -4.75 115.26 122.85 2wwu n ASN 287 Ca 0.01 -3.77 0.10 0.00 -0.02 0.00 0.00 54.58 50.90 2wwu n ASN 287 Cb 0.53 -0.65 0.27 0.00 -2.36 0.00 0.00 39.78 37.56 2wwu n ASN 287 CO 0.00 0.00 0.00 -0.61 -1.03 0.00 0.00 177.26 175.62 2wwu h GLN 288 N 1.80 0.67 0.00 -3.83 4.15 -1.79 -1.30 115.11 114.81 2wwu h GLN 288 Ca 0.44 -0.04 0.00 0.00 0.77 0.00 0.00 58.65 59.82 2wwu h GLN 288 Cb 1.38 -0.15 0.00 0.00 0.21 0.00 0.00 27.48 28.92 2wwu h GLN 288 CO 0.99 0.44 0.00 0.27 -1.93 0.00 0.00 178.83 178.60 2wwu n ASN 289 N -4.83 0.00 -0.14 -0.69 6.94 -1.26 -2.41 115.26 112.87 2wwu n ASN 289 Ca 0.20 -0.37 0.02 0.00 -0.02 0.00 0.00 54.58 54.41 2wwu n ASN 289 Cb 0.50 -0.10 0.01 0.00 -2.36 0.00 0.00 39.78 37.83 2wwu n ASN 289 CO 0.00 0.00 0.00 -0.62 -1.03 0.00 0.00 177.26 175.61 2wwu n GLU 290 N -1.10 -0.07 -4.02 -3.83 1.02 -0.50 0.21 120.64 112.35 2wwu n GLU 290 Ca 0.12 -0.68 -0.34 0.00 -0.02 0.00 0.00 57.16 56.24 2wwu n GLU 290 Cb 0.09 -1.05 -0.15 0.00 -0.02 0.00 0.00 31.44 30.32 2wwu n GLU 290 CO 0.00 0.00 0.00 -1.64 1.18 0.00 0.00 177.13 176.67 2wwu s MET 291 N -0.38 3.24 -0.47 3.49 -1.94 -1.01 -4.84 119.30 117.38 2wwu s MET 291 Ca 0.04 -0.70 -0.29 0.00 -1.71 0.00 0.00 55.69 53.04 2wwu s MET 291 Cb 0.03 -2.84 0.02 0.00 2.01 0.00 0.00 34.83 34.05 2wwu s MET 291 CO 0.05 -0.19 1.24 0.12 -0.01 0.00 0.00 175.02 176.24 2wwu s PHE 292 N 1.37 2.64 0.42 -0.03 5.36 -1.26 -4.90 117.98 121.58 2wwu s PHE 292 Ca 0.05 0.66 0.10 0.00 -0.96 0.00 0.00 56.93 56.77 2wwu s PHE 292 Cb -0.14 -4.41 0.92 0.00 -0.34 0.00 0.00 43.02 39.05 2wwu s PHE 292 CO -0.06 -1.55 2.02 0.35 -1.46 0.00 0.00 175.22 174.52 2wwu h PHE 293 N 9.80 0.50 0.00 10.12 3.57 -1.97 -1.83 116.94 137.13 2wwu h PHE 293 Ca -0.25 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.27 2wwu h PHE 293 Cb 1.07 -0.17 0.00 0.00 2.79 0.00 0.00 35.95 39.65 2wwu h PHE 293 CO 0.99 0.28 0.03 0.78 -2.23 0.00 0.00 178.31 178.16 2wwu h GLY 294 N 0.51 0.00 2.00 2.40 0.00 -1.97 -0.57 103.07 105.44 2wwu h GLY 294 Ca 0.21 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 47.50 2wwu h GLY 294 CO -0.05 0.00 -0.17 -0.55 0.00 0.00 0.00 176.54 175.76 2wwu h ASP 295 N 0.00 0.00 0.32 0.19 3.32 -1.74 -3.28 116.42 115.22 2wwu h ASP 295 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2wwu h ASP 295 Cb 0.07 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.62 2wwu h ASP 295 CO 0.00 0.17 -0.09 0.00 -1.72 0.00 0.00 179.24 177.61 2wwu n GLN 296 N -3.16 0.76 -4.36 3.56 6.02 -0.22 -4.91 117.38 115.08 2wwu n GLN 296 Ca 0.03 -0.24 -0.24 0.00 -0.01 0.00 0.00 57.00 56.54 2wwu n GLN 296 Cb 0.57 -1.49 -0.08 0.00 1.02 0.00 0.00 30.24 30.25 2wwu n GLN 296 CO 0.00 0.00 0.00 0.14 -1.01 0.00 0.00 177.06 176.19 2wwu s VAL 297 N -2.40 2.96 0.15 5.09 -7.23 -1.24 -5.04 120.40 112.69 2wwu s VAL 297 Ca 0.31 -2.08 -0.16 0.00 -1.81 0.00 0.00 61.98 58.24 2wwu s VAL 297 Cb 0.20 -2.66 0.02 0.00 0.56 0.00 0.00 36.38 34.50 2wwu s VAL 297 CO 0.45 -0.34 1.78 -0.78 -0.31 0.00 0.00 175.10 175.91 2wwu h ASP 298 N 1.99 0.51 -3.35 4.85 3.58 -1.90 -3.43 116.42 118.66 2wwu h ASP 298 Ca -0.43 -0.05 -0.39 0.00 0.42 0.00 0.00 57.03 56.58 2wwu h ASP 298 Cb 1.25 -0.13 -0.37 0.00 1.72 0.00 0.00 39.33 41.81 2wwu h ASP 298 CO 0.62 0.41 -0.76 -0.54 -2.88 0.00 0.00 179.24 176.09 2wwu s LYS 299 N -6.00 0.39 -0.21 0.28 -0.14 -1.26 -5.07 119.74 107.73 2wwu s LYS 299 Ca -0.13 0.14 0.01 0.00 -1.36 0.00 0.00 55.97 54.63 2wwu s LYS 299 Cb 0.11 -0.72 0.05 0.00 -1.68 0.00 0.00 37.83 35.59 2wwu s LYS 299 CO 0.73 -0.24 -0.08 0.00 -0.76 0.00 0.00 175.35 175.00 2wwu s TYR 301 N 1.41 3.47 -0.22 0.00 2.02 -0.07 -1.65 117.35 122.32 2wwu s TYR 301 Ca -0.03 0.46 -0.15 0.00 -0.37 0.00 0.00 57.07 56.98 2wwu s TYR 301 Cb -0.17 -2.17 -0.04 0.00 -0.40 0.00 0.00 41.96 39.18 2wwu s TYR 301 CO -0.07 0.38 0.37 0.21 -1.57 0.00 0.00 175.55 174.87 2wwu s LYS 302 N 0.05 4.13 -0.21 -0.62 2.20 -0.08 -0.29 119.74 124.91 2wwu s LYS 302 Ca 0.12 0.13 -0.00 0.00 -0.36 0.00 0.00 55.97 55.86 2wwu s LYS 302 Cb -0.12 -3.56 0.06 0.00 -1.51 0.00 0.00 37.83 32.69 2wwu s LYS 302 CO 0.01 -0.08 -0.03 0.00 -0.36 0.00 0.00 175.35 174.89 2wwu s SER 304 N 1.56 7.06 -0.32 0.00 0.01 -1.26 -0.72 113.70 120.03 2wwu s SER 304 Ca -0.03 1.32 -0.07 0.00 1.31 0.00 0.00 55.95 58.48 2wwu s SER 304 Cb -0.18 -2.51 0.03 0.00 0.21 0.00 0.00 66.02 63.57 2wwu s SER 304 CO -0.07 -0.55 0.10 -0.69 0.41 0.00 0.00 173.24 172.43 2wwu s VAL 305 N 2.73 3.88 0.48 3.43 1.01 0.15 -4.99 120.40 127.09 2wwu s VAL 305 Ca 0.42 -0.95 0.08 0.00 0.00 0.00 0.00 61.98 61.54 2wwu s VAL 305 Cb -0.16 -3.12 0.03 0.00 0.00 0.00 0.00 36.38 33.14 2wwu s VAL 305 CO 0.10 -0.08 0.62 -0.54 0.00 0.00 0.00 175.10 175.19 2wwu s LYS 306 N 1.45 2.59 0.12 2.72 1.02 -1.26 -0.82 119.74 125.55 2wwu s LYS 306 Ca 0.00 -1.45 -0.35 0.00 0.02 0.00 0.00 55.97 54.19 2wwu s LYS 306 Cb -0.19 -2.65 -0.16 0.00 -0.52 0.00 0.00 37.83 34.31 2wwu s LYS 306 CO 0.03 -0.48 1.25 0.94 -0.92 0.00 0.00 175.35 176.17 2wwu n GLN 307 N -1.95 1.09 -0.06 1.68 7.27 -1.08 -1.14 117.38 123.21 2wwu n GLN 307 Ca 0.10 0.39 0.00 0.00 0.07 0.00 0.00 57.00 57.56 2wwu n GLN 307 Cb 0.60 -1.97 0.00 0.00 2.41 0.00 0.00 30.24 31.29 2wwu n GLN 307 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 2wwu n GLY 308 N 2.28 2.48 3.88 1.69 0.00 0.14 -5.02 105.19 110.64 2wwu n GLY 308 Ca 0.17 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.88 2wwu n GLY 308 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2wwu s GLN 309 N -0.14 3.80 -0.11 1.61 -0.21 -0.29 -3.99 119.66 120.34 2wwu s GLN 309 Ca 0.00 0.31 0.02 0.00 0.02 0.00 0.00 55.36 55.71 2wwu s GLN 309 Cb 0.00 -2.58 0.01 0.00 1.00 0.00 0.00 33.01 31.44 2wwu s GLN 309 CO 0.00 0.23 -0.15 0.99 -2.12 0.00 0.00 175.29 174.23 2wwu s THR 310 N -1.96 1.51 -0.10 -0.19 2.01 -0.48 -2.35 115.64 114.07 2wwu s THR 310 Ca 0.48 -0.65 -0.01 0.00 0.31 0.00 0.00 61.69 61.82 2wwu s THR 310 Cb -0.11 -1.38 -0.03 0.00 0.01 0.00 0.00 72.50 71.00 2wwu s THR 310 CO 0.23 0.44 -0.05 -0.22 -0.69 0.00 0.00 174.62 174.33 2wwu s LEU 311 N 0.96 3.21 -0.19 4.42 2.96 0.41 -0.47 118.68 129.98 2wwu s LEU 311 Ca -0.07 -0.06 -0.01 0.00 -0.22 0.00 0.00 54.13 53.77 2wwu s LEU 311 Cb -0.15 -1.73 0.01 0.00 0.50 0.00 0.00 46.19 44.82 2wwu s LEU 311 CO -0.01 0.29 -0.13 -0.36 -1.32 0.00 0.00 176.35 174.81 2wwu s PHE 312 N -0.35 2.85 -0.23 5.38 0.08 0.84 -0.45 117.98 126.10 2wwu s PHE 312 Ca 0.05 -1.31 -0.08 0.00 0.12 0.00 0.00 56.93 55.71 2wwu s PHE 312 Cb -0.12 -1.99 -0.04 0.00 -0.57 0.00 0.00 43.02 40.30 2wwu s PHE 312 CO 0.02 -0.68 0.08 0.42 -0.10 0.00 0.00 175.22 174.97 2wwu s ILE 313 N 1.32 4.65 0.85 0.64 1.01 0.51 -1.25 121.20 128.93 2wwu s ILE 313 Ca 0.04 -0.07 -0.11 0.00 0.00 0.00 0.00 60.65 60.52 2wwu s ILE 313 Cb -0.14 -3.15 0.10 0.00 0.01 0.00 0.00 42.46 39.29 2wwu s ILE 313 CO -0.08 0.38 1.09 -2.84 0.00 0.00 0.00 174.94 173.49 2wwu s PRO 314 N 1.11 1.63 0.03 2.79 0.02 -1.26 -1.90 135.00 137.42 2wwu s PRO 314 Ca 0.05 0.97 -0.39 0.00 0.02 0.00 0.00 61.00 61.65 2wwu s PRO 314 Cb -0.14 -1.84 -0.19 0.00 0.02 0.00 0.00 34.50 32.35 2wwu s PRO 314 CO 0.04 -2.02 1.14 2.41 -0.33 0.00 0.00 177.00 178.23 2wwu n THR 315 N -3.75 0.04 0.00 0.99 -1.04 -1.26 -2.86 114.28 106.39 2wwu n THR 315 Ca 0.08 -0.01 0.00 0.00 -2.04 0.00 0.00 64.05 62.08 2wwu n THR 315 Cb 0.54 -0.24 0.00 0.00 -1.82 0.00 0.00 70.33 68.81 2wwu n THR 315 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2wwu n GLY 316 N 1.80 2.89 3.68 3.41 0.00 -1.26 -4.90 105.19 110.80 2wwu n GLY 316 Ca 0.19 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.76 2wwu n GLY 316 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 2wwu n TRP 317 N -2.00 2.44 -2.77 1.61 7.02 -1.14 -4.51 117.44 118.10 2wwu n TRP 317 Ca 0.00 0.00 -0.42 0.00 -1.02 0.00 0.00 57.50 56.06 2wwu n TRP 317 Cb 0.00 -2.66 -0.03 0.00 -2.42 0.00 0.00 31.31 26.20 2wwu n TRP 317 CO 0.00 0.00 0.00 0.42 -2.02 0.00 0.00 177.69 176.09 2wwu s ILE 318 N 2.60 4.82 0.01 -0.99 1.01 -0.54 -4.47 121.20 123.63 2wwu s ILE 318 Ca 0.84 1.87 -0.14 0.00 0.00 0.00 0.00 60.65 63.22 2wwu s ILE 318 Cb -0.59 -4.24 0.02 0.00 0.01 0.00 0.00 42.46 37.66 2wwu s ILE 318 CO 0.41 -0.00 0.30 -1.38 0.00 0.00 0.00 174.94 174.28 2wwu s HIS 319 N 2.16 -0.15 0.20 3.97 -3.43 -0.49 -0.31 115.29 117.25 2wwu s HIS 319 Ca 0.44 0.15 0.11 0.00 -0.80 0.00 0.00 55.06 54.96 2wwu s HIS 319 Cb -0.17 0.09 -0.04 0.00 -1.43 0.00 0.00 32.58 31.02 2wwu s HIS 319 CO 0.15 -0.43 -0.22 0.00 -2.00 0.00 0.00 174.74 172.24 2wwu s ALA 320 N -1.75 2.61 -0.10 -1.38 0.00 -0.81 -1.21 121.76 119.12 2wwu s ALA 320 Ca -0.11 -1.66 -0.00 0.00 0.00 0.00 0.00 51.96 50.20 2wwu s ALA 320 Cb -0.04 -0.36 0.02 0.00 0.00 0.00 0.00 23.12 22.74 2wwu s ALA 320 CO 0.02 0.41 -0.07 0.08 0.00 0.00 0.00 175.76 176.20 2wwu s VAL 321 N -1.79 0.95 -0.18 0.00 1.01 -0.19 -0.75 120.40 119.46 2wwu s VAL 321 Ca 0.22 -0.27 -0.08 0.00 0.00 0.00 0.00 61.98 61.86 2wwu s VAL 321 Cb -0.08 -0.97 -0.04 0.00 0.00 0.00 0.00 36.38 35.29 2wwu s VAL 321 CO 0.11 0.35 0.08 -0.22 0.00 0.00 0.00 175.10 175.42 2wwu s LEU 322 N 1.53 3.93 -0.48 3.92 2.96 -0.10 -0.73 118.68 129.72 2wwu s LEU 322 Ca 0.01 0.15 -0.13 0.00 -0.22 0.00 0.00 54.13 53.94 2wwu s LEU 322 Cb -0.13 -1.99 0.10 0.00 0.50 0.00 0.00 46.19 44.66 2wwu s LEU 322 CO -0.06 0.20 0.38 -0.89 -1.32 0.00 0.00 176.35 174.67 2wwu s THR 323 N 0.19 4.83 0.10 3.68 2.01 -0.06 -0.48 115.64 125.90 2wwu s THR 323 Ca 0.05 -1.36 0.12 0.00 0.31 0.00 0.00 61.69 60.82 2wwu s THR 323 Cb -0.12 -4.00 -0.02 0.00 0.01 0.00 0.00 72.50 68.37 2wwu s THR 323 CO 0.00 -0.66 1.50 1.55 -0.69 0.00 0.00 174.62 176.32 2wwu h PRO 324 N 8.66 0.00 -4.15 4.92 0.14 -1.87 0.55 132.00 140.25 2wwu h PRO 324 Ca -0.26 0.00 -0.13 0.00 0.14 0.00 0.00 66.00 65.74 2wwu h PRO 324 Cb 1.10 0.00 -0.17 0.00 0.14 0.00 0.00 31.00 32.07 2wwu h PRO 324 CO 0.89 0.65 -0.67 0.14 0.14 0.00 0.00 178.00 179.14 2wwu s VAL 325 N -3.18 0.19 -0.05 1.56 -7.23 -1.26 -4.40 120.40 106.03 2wwu s VAL 325 Ca 0.01 -1.53 -0.39 0.00 -1.81 0.00 0.00 61.98 58.26 2wwu s VAL 325 Cb 0.10 -1.15 -0.18 0.00 0.56 0.00 0.00 36.38 35.71 2wwu s VAL 325 CO 0.76 -0.84 1.30 0.47 -0.31 0.00 0.00 175.10 176.47 2wwu n ASP 326 N 0.54 1.01 -4.02 4.85 8.00 -1.26 -4.32 116.55 121.34 2wwu n ASP 326 Ca -0.17 1.14 -0.20 0.00 0.71 0.00 0.00 54.79 56.27 2wwu n ASP 326 Cb 0.59 -1.04 -0.15 0.00 -0.02 0.00 0.00 41.12 40.50 2wwu n ASP 326 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2wwu s LEU 328 N -0.06 1.98 0.12 0.00 0.20 -0.71 -0.71 118.68 119.50 2wwu s LEU 328 Ca 0.01 -0.50 -0.08 0.00 0.69 0.00 0.00 54.13 54.24 2wwu s LEU 328 Cb -0.06 -1.27 -0.01 0.00 -0.43 0.00 0.00 46.19 44.42 2wwu s LEU 328 CO -0.00 0.12 0.22 0.00 -0.29 0.00 0.00 176.35 176.40 2wwu s ALA 329 N 0.50 -0.08 0.16 5.97 0.00 -0.05 -1.45 121.76 126.82 2wwu s ALA 329 Ca -0.16 -0.77 0.08 0.00 0.00 0.00 0.00 51.96 51.11 2wwu s ALA 329 Cb -0.17 0.66 -0.04 0.00 0.00 0.00 0.00 23.12 23.57 2wwu s ALA 329 CO 0.06 -0.57 -0.17 -0.06 0.00 0.00 0.00 175.76 175.02 2wwu s PHE 330 N -3.91 1.75 0.21 0.00 0.08 0.13 0.06 117.98 116.30 2wwu s PHE 330 Ca 0.11 -0.49 -0.21 0.00 0.12 0.00 0.00 56.93 56.46 2wwu s PHE 330 Cb 0.04 -0.87 0.07 0.00 -0.57 0.00 0.00 43.02 41.69 2wwu s PHE 330 CO -0.06 0.30 1.01 0.20 -0.10 0.00 0.00 175.22 176.58 2wwu s GLY 331 N -2.68 0.14 -0.00 4.36 0.00 -0.63 0.76 107.32 109.27 2wwu s GLY 331 Ca 0.15 -0.38 -0.29 0.00 0.00 0.00 0.00 44.72 44.20 2wwu s GLY 331 CO 0.06 2.15 0.99 -0.32 0.00 0.00 0.00 173.10 175.98 2wwu s GLY 332 N -3.37 -0.38 -0.01 0.20 0.00 -0.90 0.22 107.32 103.08 2wwu s GLY 332 Ca 0.21 0.90 0.08 0.00 0.00 0.00 0.00 44.72 45.91 2wwu s GLY 332 CO 0.06 0.28 -0.26 -1.31 0.00 0.00 0.00 173.10 171.88 2wwu s ASN 333 N -2.57 3.00 0.04 1.64 -0.87 -0.35 -1.97 114.94 113.87 2wwu s ASN 333 Ca 0.08 -0.48 -0.10 0.00 -1.57 0.00 0.00 52.86 50.79 2wwu s ASN 333 Cb -0.01 -0.32 0.01 0.00 -0.02 0.00 0.00 41.25 40.91 2wwu s ASN 333 CO -0.06 0.30 0.21 0.72 -2.57 0.00 0.00 177.10 175.70 2wwu s PHE 334 N -0.63 0.04 0.20 2.20 -0.12 -0.22 -4.52 117.98 114.92 2wwu s PHE 334 Ca 0.10 -0.26 0.06 0.00 -0.05 0.00 0.00 56.93 56.78 2wwu s PHE 334 Cb -0.10 -0.02 -0.04 0.00 -0.63 0.00 0.00 43.02 42.24 2wwu s PHE 334 CO -0.00 -0.44 0.17 -0.51 -0.05 0.00 0.00 175.22 174.38 2wwu s LEU 335 N -2.11 3.84 0.00 -1.99 1.43 -1.26 -0.49 118.68 118.10 2wwu s LEU 335 Ca -0.05 -0.16 -0.10 0.00 -1.03 0.00 0.00 54.13 52.80 2wwu s LEU 335 Cb -0.01 -2.42 0.04 0.00 0.03 0.00 0.00 46.19 43.83 2wwu s LEU 335 CO -0.04 0.02 0.68 0.00 0.23 0.00 0.00 176.35 177.24 2wwu n HIS 336 N -0.71 -2.02 -0.08 0.29 1.44 -1.26 -0.62 115.22 112.26 2wwu n HIS 336 Ca -0.08 -2.09 0.10 0.00 -2.01 0.00 0.00 57.72 53.64 2wwu n HIS 336 Cb 0.56 0.79 0.23 0.00 0.12 0.00 0.00 29.99 31.69 2wwu n HIS 336 CO 0.00 0.00 0.00 0.43 -2.81 0.00 0.00 176.34 173.96 2wwu n SER 337 N -1.56 3.44 0.12 4.39 7.64 -1.26 -4.57 113.62 121.81 2wwu n SER 337 Ca -0.05 -1.96 -0.01 0.00 1.01 0.00 0.00 58.87 57.86 2wwu n SER 337 Cb 0.60 -0.33 0.06 0.00 -1.01 0.00 0.00 64.21 63.53 2wwu n SER 337 CO 0.00 0.00 0.00 -0.07 -3.01 0.00 0.00 175.04 171.96 2wwu h LEU 338 N 3.63 0.00 -5.55 -3.43 3.38 -1.97 -3.39 115.31 107.99 2wwu h LEU 338 Ca 0.00 0.00 -0.39 0.00 0.09 0.00 0.00 57.88 57.58 2wwu h LEU 338 Cb 0.89 0.00 -0.28 0.00 0.09 0.00 0.00 40.66 41.36 2wwu h LEU 338 CO 0.00 0.67 -0.84 -0.46 0.09 0.00 0.00 178.44 177.90 2wwu n ASN 339 N -3.43 -1.02 -0.11 -0.43 6.94 -1.26 -4.89 115.26 111.06 2wwu n ASN 339 Ca 0.00 -3.09 -0.01 0.00 -0.02 0.00 0.00 54.58 51.46 2wwu n ASN 339 Cb 0.74 0.50 0.24 0.00 -2.36 0.00 0.00 39.78 38.91 2wwu n ASN 339 CO 0.00 0.00 0.00 0.40 -1.03 0.00 0.00 177.26 176.63 2wwu h ILE 340 N 2.27 1.20 -0.35 1.53 2.04 -1.84 -1.52 117.51 120.84 2wwu h ILE 340 Ca -0.02 -0.64 0.03 0.00 1.00 0.00 0.00 64.86 65.23 2wwu h ILE 340 Cb 0.98 0.57 -0.03 0.00 -0.74 0.00 0.00 36.82 37.60 2wwu h ILE 340 CO 0.38 0.25 0.17 -0.08 0.00 0.00 0.00 178.15 178.87 2wwu h GLU 341 N 0.77 0.34 -0.64 2.37 4.81 -1.87 -0.20 114.58 120.17 2wwu h GLU 341 Ca 0.18 -0.02 -0.06 0.00 -0.13 0.00 0.00 59.36 59.33 2wwu h GLU 341 Cb 0.17 -0.08 -0.03 0.00 0.63 0.00 0.00 28.75 29.45 2wwu h GLU 341 CO -0.02 0.22 0.14 1.98 -0.73 0.00 0.00 179.01 180.61 2wwu h MET 342 N 0.35 1.01 -0.09 1.92 4.05 -1.75 -1.55 114.93 118.87 2wwu h MET 342 Ca 0.15 -0.23 0.01 0.00 -0.28 0.00 0.00 59.70 59.34 2wwu h MET 342 Cb 0.06 -0.14 -0.01 0.00 -0.80 0.00 0.00 31.60 30.72 2wwu h MET 342 CO -0.11 0.90 0.04 0.37 0.23 0.00 0.00 176.91 178.35 2wwu h GLN 343 N 0.96 0.09 -0.52 0.39 4.15 -0.58 0.15 115.11 119.75 2wwu h GLN 343 Ca 0.20 -0.01 0.01 0.00 0.77 0.00 0.00 58.65 59.63 2wwu h GLN 343 Cb 0.36 -0.02 -0.03 0.00 0.21 0.00 0.00 27.48 28.00 2wwu h GLN 343 CO 0.00 0.06 0.32 -0.07 -1.93 0.00 0.00 178.83 177.21 2wwu h LEU 344 N 0.09 0.54 0.05 -2.39 3.38 -0.88 0.95 115.31 117.05 2wwu h LEU 344 Ca 0.04 -0.01 -0.00 0.00 0.09 0.00 0.00 57.88 58.00 2wwu h LEU 344 Cb 0.01 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 40.63 2wwu h LEU 344 CO -0.03 0.39 -0.02 0.50 0.09 0.00 0.00 178.44 179.37 2wwu h LYS 345 N 0.66 -0.06 -0.80 1.13 3.64 -1.09 -0.36 116.57 119.68 2wwu h LYS 345 Ca 0.20 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.58 2wwu h LYS 345 Cb -0.03 0.01 -0.04 0.00 -0.41 0.00 0.00 32.23 31.77 2wwu h LYS 345 CO -0.07 0.01 0.47 0.00 -2.27 0.00 0.00 179.45 177.59 2wwu h ALA 346 N 0.83 1.02 -0.00 5.00 0.00 -0.51 -1.12 119.26 124.47 2wwu h ALA 346 Ca -0.01 -0.10 0.01 0.00 0.00 0.00 0.00 54.91 54.82 2wwu h ALA 346 Cb 0.10 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 2wwu h ALA 346 CO 0.01 0.50 -0.06 -0.92 0.00 0.00 0.00 179.25 178.78 2wwu h TYR 347 N 1.10 -0.16 -0.46 0.00 3.20 -0.49 -0.53 116.97 119.63 2wwu h TYR 347 Ca 0.29 0.01 0.00 0.00 3.14 0.00 0.00 58.73 62.16 2wwu h TYR 347 Cb -0.02 0.07 -0.02 0.00 1.54 0.00 0.00 36.73 38.30 2wwu h TYR 347 CO -0.00 -0.10 0.29 0.93 -1.64 0.00 0.00 178.16 177.64 2wwu h GLU 348 N -0.11 0.62 -0.10 1.82 4.39 -0.69 -0.83 114.58 119.67 2wwu h GLU 348 Ca 0.03 -0.05 -0.01 0.00 0.34 0.00 0.00 59.36 59.67 2wwu h GLU 348 Cb 0.15 -0.13 -0.00 0.00 -0.10 0.00 0.00 28.75 28.66 2wwu h GLU 348 CO -0.07 0.43 0.01 0.82 -1.16 0.00 0.00 179.01 179.04 2wwu h ILE 349 N 0.62 1.23 -0.40 3.13 2.04 -1.08 -2.72 117.51 120.33 2wwu h ILE 349 Ca 0.17 -0.73 -0.08 0.00 1.00 0.00 0.00 64.86 65.22 2wwu h ILE 349 Cb -0.04 1.52 -0.02 0.00 -0.74 0.00 0.00 36.82 37.54 2wwu h ILE 349 CO -0.03 0.21 -0.07 -0.08 0.00 0.00 0.00 178.15 178.17 2wwu h GLU 350 N -0.07 0.68 -0.52 2.37 4.22 -1.00 -1.03 114.58 119.23 2wwu h GLU 350 Ca 0.03 -0.20 0.06 0.00 0.08 0.00 0.00 59.36 59.34 2wwu h GLU 350 Cb 0.32 -0.07 -0.05 0.00 0.50 0.00 0.00 28.75 29.44 2wwu h GLU 350 CO 0.00 0.75 0.21 -0.22 -2.18 0.00 0.00 179.01 177.58 2wwu h LYS 351 N 0.63 0.40 -0.30 1.92 3.64 -1.13 0.17 116.57 121.90 2wwu h LYS 351 Ca 0.12 -0.02 -0.15 0.00 -1.27 0.00 0.00 60.65 59.32 2wwu h LYS 351 Cb 0.50 -0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 32.22 2wwu h LYS 351 CO 0.03 0.27 -0.42 0.00 -2.27 0.00 0.00 179.45 177.05 2wwu h ARG 352 N 0.42 0.74 0.00 1.90 3.08 -1.08 -3.32 114.38 116.12 2wwu h ARG 352 Ca 0.24 -0.40 -0.07 0.00 0.07 0.00 0.00 59.98 59.82 2wwu h ARG 352 Cb 0.23 0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.28 2wwu h ARG 352 CO -0.22 1.02 -1.12 -0.07 -1.07 0.00 0.00 179.97 178.51 2wwu h LEU 353 N 0.60 0.00 -9.96 3.04 4.07 -0.94 -3.48 115.31 108.64 2wwu h LEU 353 Ca 0.04 0.00 -0.55 0.00 0.08 0.00 0.00 57.88 57.46 2wwu h LEU 353 Cb 0.98 0.00 0.12 0.00 1.08 0.00 0.00 40.66 42.84 2wwu h LEU 353 CO 0.09 0.25 0.69 -0.24 -1.08 0.00 0.00 178.44 178.14 2wwu n SER 354 N -2.79 3.29 -0.89 -0.43 2.88 0.56 -4.91 113.62 111.33 2wwu n SER 354 Ca -0.04 1.13 0.08 0.00 -1.33 0.00 0.00 58.87 58.71 2wwu n SER 354 Cb 0.67 -1.59 0.21 0.00 -0.75 0.00 0.00 64.21 62.75 2wwu n SER 354 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16 2wwu n THR 355 N -0.14 1.03 -2.04 2.46 -2.24 -1.26 -5.01 114.28 107.08 2wwu n THR 355 Ca 0.05 -1.02 -0.39 0.00 -2.27 0.00 0.00 64.05 60.43 2wwu n THR 355 Cb 0.41 0.48 0.01 0.00 -2.10 0.00 0.00 70.33 69.13 2wwu n THR 355 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2wwu s ALA 356 N -1.04 3.07 -0.31 6.98 0.00 -1.26 -4.94 121.76 124.26 2wwu s ALA 356 Ca 0.32 1.18 0.24 0.00 0.00 0.00 0.00 51.96 53.70 2wwu s ALA 356 Cb 0.17 -3.48 0.50 0.00 0.00 0.00 0.00 23.12 20.31 2wwu s ALA 356 CO 0.21 -0.92 1.66 -0.44 0.00 0.00 0.00 175.76 176.28 2wwu h ASP 357 N 2.20 0.00 -3.81 0.00 3.32 -2.05 -3.46 116.42 112.62 2wwu h ASP 357 Ca -0.50 0.00 -0.53 0.00 0.02 0.00 0.00 57.03 56.02 2wwu h ASP 357 Cb 1.26 0.00 -0.19 0.00 0.22 0.00 0.00 39.33 40.62 2wwu h ASP 357 CO 0.61 0.05 -0.80 -0.76 -1.72 0.00 0.00 179.24 176.62 2wwu s LEU 358 N -6.24 2.38 -0.44 1.55 1.43 -1.26 -5.10 118.68 111.01 2wwu s LEU 358 Ca 0.06 -0.79 -0.29 0.00 -1.03 0.00 0.00 54.13 52.07 2wwu s LEU 358 Cb 0.06 -0.83 0.02 0.00 0.03 0.00 0.00 46.19 45.47 2wwu s LEU 358 CO 0.65 -0.01 1.16 -0.36 0.23 0.00 0.00 176.35 178.02 2wwu s PHE 359 N -1.73 2.84 0.12 0.29 0.08 -1.26 -4.89 117.98 113.43 2wwu s PHE 359 Ca 0.12 0.81 0.26 0.00 0.12 0.00 0.00 56.93 58.23 2wwu s PHE 359 Cb -0.07 -4.27 0.98 0.00 -0.57 0.00 0.00 43.02 39.09 2wwu s PHE 359 CO 0.06 -1.25 1.85 0.00 -0.10 0.00 0.00 175.22 175.77 2wwu h ARG 360 N 9.13 0.00 -3.16 0.44 3.08 -1.98 -3.29 114.38 118.60 2wwu h ARG 360 Ca -0.23 0.00 -0.64 0.00 0.07 0.00 0.00 59.98 59.18 2wwu h ARG 360 Cb 1.07 0.00 -0.40 0.00 0.08 0.00 0.00 29.97 30.71 2wwu h ARG 360 CO 1.10 0.18 -0.46 0.12 -1.07 0.00 0.00 179.97 179.85 2wwu s PHE 361 N -3.65 3.64 0.63 3.04 5.36 -1.26 -4.62 117.98 121.13 2wwu s PHE 361 Ca 0.01 -3.26 -0.17 0.00 -0.96 0.00 0.00 56.93 52.55 2wwu s PHE 361 Cb 0.10 -2.85 -0.01 0.00 -0.34 0.00 0.00 43.02 39.92 2wwu s PHE 361 CO 0.62 -0.60 1.15 -1.25 -1.46 0.00 0.00 175.22 173.68 2wwu s PRO 362 N -1.39 2.83 -1.27 10.12 0.04 -1.24 -3.84 135.00 140.24 2wwu s PRO 362 Ca 0.25 1.60 -0.03 0.00 0.04 0.00 0.00 61.00 62.86 2wwu s PRO 362 Cb -0.06 -1.94 0.00 0.00 0.04 0.00 0.00 34.50 32.55 2wwu s PRO 362 CO -0.15 -1.27 0.45 0.09 0.04 0.00 0.00 177.00 176.16 2wwu n ASN 363 N -2.06 -5.22 -0.15 6.66 5.03 -1.26 -4.51 115.26 113.75 2wwu n ASN 363 Ca 0.12 -0.21 -0.03 0.00 0.87 0.00 0.00 54.58 55.32 2wwu n ASN 363 Cb 0.51 -4.08 0.03 0.00 -1.02 0.00 0.00 39.78 35.22 2wwu n ASN 363 CO 0.00 0.00 0.00 0.15 -1.83 0.00 0.00 177.26 175.58 2wwu h PHE 364 N -1.03 -0.21 -0.76 3.10 3.57 -1.98 -2.50 116.94 117.13 2wwu h PHE 364 Ca -0.42 0.04 -0.06 0.00 3.53 0.00 0.00 57.97 61.06 2wwu h PHE 364 Cb 1.29 0.16 -0.03 0.00 2.79 0.00 0.00 35.95 40.17 2wwu h PHE 364 CO 0.42 -0.18 0.26 0.93 -2.23 0.00 0.00 178.31 177.51 2wwu h GLU 365 N 0.02 1.17 -0.14 1.11 5.08 -1.90 -1.89 114.58 118.02 2wwu h GLU 365 Ca 0.23 -0.24 0.05 0.00 -1.00 0.00 0.00 59.36 58.40 2wwu h GLU 365 Cb 0.34 -0.18 -0.06 0.00 0.50 0.00 0.00 28.75 29.36 2wwu h GLU 365 CO -0.46 0.97 -0.25 1.15 -1.00 0.00 0.00 179.01 179.43 2wwu h THR 366 N 1.12 0.41 -0.46 1.13 2.02 -1.51 -0.52 112.91 115.11 2wwu h THR 366 Ca 0.25 0.00 -0.04 0.00 0.77 0.00 0.00 66.41 67.39 2wwu h THR 366 Cb 0.28 0.41 -0.02 0.00 -1.74 0.00 0.00 68.15 67.07 2wwu h THR 366 CO -0.01 0.00 0.12 -0.29 0.37 0.00 0.00 175.52 175.71 2wwu h ILE 367 N -0.30 1.20 -0.66 3.11 6.09 -1.20 -1.86 117.51 123.88 2wwu h ILE 367 Ca 0.10 -0.70 0.09 0.00 -1.37 0.00 0.00 64.86 62.98 2wwu h ILE 367 Cb 0.46 0.72 -0.07 0.00 0.47 0.00 0.00 36.82 38.40 2wwu h ILE 367 CO -0.32 0.26 0.31 0.00 -3.07 0.00 0.00 178.15 175.33 2wwu h TRP 369 N 0.55 0.52 -0.49 0.00 4.06 -0.33 0.16 115.95 120.42 2wwu h TRP 369 Ca 0.33 -0.00 -0.04 0.00 2.06 0.00 0.00 58.89 61.23 2wwu h TRP 369 Cb 0.34 -0.17 -0.02 0.00 -1.00 0.00 0.00 29.16 28.31 2wwu h TRP 369 CO -0.12 0.38 0.13 1.88 -3.56 0.00 0.00 178.44 177.15 2wwu h TYR 370 N 0.52 0.75 -0.13 0.49 0.05 -0.87 -2.16 116.97 115.62 2wwu h TYR 370 Ca 0.14 -0.06 -0.15 0.00 0.05 0.00 0.00 58.73 58.71 2wwu h TYR 370 Cb 0.01 -0.23 -0.01 0.00 1.01 0.00 0.00 36.73 37.51 2wwu h TYR 370 CO -0.03 0.63 -0.56 0.28 -1.05 0.00 0.00 178.16 177.43 2wwu h VAL 371 N 0.72 1.34 -0.57 -2.88 2.07 -0.30 -2.26 116.25 114.37 2wwu h VAL 371 Ca 0.16 -1.84 0.07 0.00 0.82 0.00 0.00 66.70 65.92 2wwu h VAL 371 Cb 0.25 1.85 -0.06 0.00 -1.52 0.00 0.00 31.29 31.81 2wwu h VAL 371 CO -0.01 0.56 0.24 1.23 0.02 0.00 0.00 177.57 179.62 2wwu h GLY 372 N 1.23 0.80 1.09 2.17 0.00 -0.06 0.82 103.07 109.11 2wwu h GLY 372 Ca 0.00 -0.15 -0.14 0.00 0.00 0.00 0.00 47.33 47.05 2wwu h GLY 372 CO 0.10 0.04 -0.28 1.70 0.00 0.00 0.00 176.54 178.09 2wwu h LYS 373 N 0.45 0.93 -0.72 4.80 1.63 -1.21 -0.95 116.57 121.50 2wwu h LYS 373 Ca 0.27 -0.44 -0.03 0.00 -0.85 0.00 0.00 60.65 59.61 2wwu h LYS 373 Cb 0.27 -0.01 -0.03 0.00 -0.60 0.00 0.00 32.23 31.86 2wwu h LYS 373 CO -0.24 1.10 0.34 1.25 -3.45 0.00 0.00 179.45 178.45 2wwu h HIS 374 N 0.75 1.02 -0.24 1.91 2.76 -0.97 -0.24 115.15 120.13 2wwu h HIS 374 Ca 0.08 -0.04 -0.17 0.00 -2.20 0.00 0.00 60.37 58.04 2wwu h HIS 374 Cb 0.86 -0.32 -0.00 0.00 1.55 0.00 0.00 27.41 29.50 2wwu h HIS 374 CO 0.06 0.74 -0.55 0.82 -1.30 0.00 0.00 177.93 177.71 2wwu h ILE 375 N 1.02 1.30 -0.42 6.26 2.04 -0.55 -0.33 117.51 126.83 2wwu h ILE 375 Ca 0.25 -1.76 0.06 0.00 1.00 0.00 0.00 64.86 64.41 2wwu h ILE 375 Cb 0.11 1.69 -0.05 0.00 -0.74 0.00 0.00 36.82 37.83 2wwu h ILE 375 CO -0.03 0.56 0.12 0.25 0.00 0.00 0.00 178.15 179.05 2wwu h LEU 376 N 0.55 0.10 -0.75 1.44 5.85 -0.78 -0.53 115.31 121.18 2wwu h LEU 376 Ca 0.01 0.06 0.04 0.00 0.84 0.00 0.00 57.88 58.82 2wwu h LEU 376 Cb 1.12 0.06 -0.05 0.00 0.37 0.00 0.00 40.66 42.16 2wwu h LEU 376 CO 0.11 0.09 0.47 0.44 -0.34 0.00 0.00 178.44 179.21 2wwu h ASP 377 N 0.27 0.77 -0.02 1.25 3.32 -0.56 -0.11 116.42 121.34 2wwu h ASP 377 Ca 0.20 0.00 0.01 0.00 0.02 0.00 0.00 57.03 57.26 2wwu h ASP 377 Cb 0.21 -0.16 -0.02 0.00 0.22 0.00 0.00 39.33 39.58 2wwu h ASP 377 CO -0.22 0.52 -0.06 0.40 -1.72 0.00 0.00 179.24 178.16 2wwu h ILE 378 N 0.91 0.85 -0.72 0.35 2.04 -0.50 -0.82 117.51 119.62 2wwu h ILE 378 Ca 0.31 0.00 0.03 0.00 1.00 0.00 0.00 64.86 66.19 2wwu h ILE 378 Cb 0.04 0.85 -0.04 0.00 -0.74 0.00 0.00 36.82 36.93 2wwu h ILE 378 CO -0.12 0.00 0.46 -0.26 0.00 0.00 0.00 178.15 178.22 2wwu h PHE 379 N -0.09 0.86 -0.49 1.37 0.04 -0.42 -0.49 116.94 117.72 2wwu h PHE 379 Ca 0.03 0.02 0.00 0.00 2.80 0.00 0.00 57.97 60.83 2wwu h PHE 379 Cb 0.13 -0.28 -0.02 0.00 2.20 0.00 0.00 35.95 37.98 2wwu h PHE 379 CO -0.14 0.50 0.32 0.00 -0.60 0.00 0.00 178.31 178.39 2wwu h ARG 380 N 0.90 0.65 -0.07 1.51 3.08 -0.82 -1.37 114.38 118.27 2wwu h ARG 380 Ca 0.28 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 60.29 2wwu h ARG 380 Cb -0.01 -0.14 -0.01 0.00 0.08 0.00 0.00 29.97 29.89 2wwu h ARG 380 CO -0.10 0.44 0.03 0.78 -1.07 0.00 0.00 179.97 180.06 2wwu h GLY 381 N 0.67 0.09 1.10 0.04 0.00 -0.60 0.57 103.07 104.93 2wwu h GLY 381 Ca 0.18 -0.02 0.01 0.00 0.00 0.00 0.00 47.33 47.49 2wwu h GLY 381 CO -0.04 0.02 0.59 1.41 0.00 0.00 0.00 176.54 178.52 2wwu h LEU 382 N 0.07 1.06 -0.17 3.11 3.38 -0.83 -1.05 115.31 120.87 2wwu h LEU 382 Ca 0.03 -0.04 -0.15 0.00 0.09 0.00 0.00 57.88 57.81 2wwu h LEU 382 Cb 0.01 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 40.50 2wwu h LEU 382 CO -0.02 0.78 -0.46 -0.09 0.09 0.00 0.00 178.44 178.73 2wwu h ARG 383 N 1.24 0.62 -0.77 1.13 2.43 -1.00 0.42 114.38 118.45 2wwu h ARG 383 Ca 0.33 -0.43 0.14 0.00 -0.81 0.00 0.00 59.98 59.21 2wwu h ARG 383 Cb -0.12 0.07 -0.05 0.00 -0.42 0.00 0.00 29.97 29.45 2wwu h ARG 383 CO -0.07 1.05 0.51 1.49 -1.51 0.00 0.00 179.97 181.45 2wwu h GLU 384 N 0.29 0.47 -0.61 0.20 4.57 -0.37 -1.32 114.58 117.80 2wwu h GLU 384 Ca -0.01 -0.03 0.00 0.00 -1.18 0.00 0.00 59.36 58.14 2wwu h GLU 384 Cb 1.08 -0.11 0.00 0.00 -0.16 0.00 0.00 28.75 29.56 2wwu h GLU 384 CO 0.10 0.31 0.00 0.09 -1.18 0.00 0.00 179.01 178.33 2wwu n ASN 385 N -4.49 5.29 -3.96 1.04 3.02 -0.45 -4.96 115.26 110.75 2wwu n ASN 385 Ca 0.15 -2.70 -0.28 0.00 -0.03 0.00 0.00 54.58 51.72 2wwu n ASN 385 Cb 0.50 -0.64 -0.01 0.00 -0.61 0.00 0.00 39.78 39.03 2wwu n ASN 385 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 2wwu n ARG 386 N 0.87 -3.85 -4.45 3.52 3.00 -0.50 -4.99 116.66 110.25 2wwu n ARG 386 Ca 0.27 0.46 -0.22 0.00 -0.01 0.00 0.00 57.85 58.35 2wwu n ARG 386 Cb 1.06 -4.88 -0.10 0.00 0.00 0.00 0.00 32.46 28.53 2wwu n ARG 386 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.63 178.66 2wwu s ARG 387 N -6.55 1.61 0.01 5.56 0.52 0.14 -5.01 118.95 115.23 2wwu s ARG 387 Ca 0.25 -1.82 0.03 0.00 -0.52 0.00 0.00 55.73 53.67 2wwu s ARG 387 Cb -0.13 -1.27 -0.03 0.00 0.52 0.00 0.00 34.95 34.03 2wwu s ARG 387 CO 0.88 0.06 -0.06 -1.01 0.02 0.00 0.00 175.30 175.18 2wwu s HIS 388 N -2.93 2.89 0.57 -0.53 3.76 -1.26 -4.17 115.29 113.62 2wwu s HIS 388 Ca 0.30 -0.04 -0.15 0.00 -0.15 0.00 0.00 55.06 55.02 2wwu s HIS 388 Cb 0.04 -1.60 -0.05 0.00 1.11 0.00 0.00 32.58 32.08 2wwu s HIS 388 CO 0.13 0.39 1.02 -1.25 -0.85 0.00 0.00 174.74 174.18 2wwu s PRO 389 N -1.53 3.63 0.52 8.40 0.05 -1.26 -5.04 135.00 139.77 2wwu s PRO 389 Ca 0.18 0.98 -0.21 0.00 0.05 0.00 0.00 61.00 62.00 2wwu s PRO 389 Cb -0.11 -2.09 -0.06 0.00 0.05 0.00 0.00 34.50 32.30 2wwu s PRO 389 CO 0.09 -0.54 1.22 0.00 0.05 0.00 0.00 177.00 177.82 2wwu s ALA 390 N -2.72 2.81 0.27 8.56 0.00 -1.26 -4.90 121.76 124.53 2wwu s ALA 390 Ca 0.59 1.04 0.00 0.00 0.00 0.00 0.00 51.96 53.60 2wwu s ALA 390 Cb -0.12 -3.44 0.56 0.00 0.00 0.00 0.00 23.12 20.12 2wwu s ALA 390 CO 0.39 -0.96 1.78 1.03 0.00 0.00 0.00 175.76 178.00 2wwu h SER 391 N 1.57 0.67 -0.24 0.00 0.87 -1.99 -1.47 113.55 112.96 2wwu h SER 391 Ca -0.50 0.08 -0.04 0.00 -1.23 0.00 0.00 61.79 60.10 2wwu h SER 391 Cb 1.27 -0.04 -0.02 0.00 -0.44 0.00 0.00 62.40 63.18 2wwu h SER 391 CO 0.58 0.30 0.03 0.10 -0.53 0.00 0.00 176.83 177.31 2wwu h TYR 392 N 0.74 0.53 -0.48 2.24 -0.00 -1.92 -1.71 116.97 116.37 2wwu h TYR 392 Ca 0.49 -0.04 -0.11 0.00 0.00 0.00 0.00 58.73 59.07 2wwu h TYR 392 Cb 0.64 -0.16 -0.01 0.00 0.00 0.00 0.00 36.73 37.20 2wwu h TYR 392 CO -0.05 0.50 -0.12 1.25 -0.00 0.00 0.00 178.16 179.73 2wwu h LEU 393 N 0.50 0.94 -0.27 0.10 5.85 -1.57 -0.69 115.31 120.16 2wwu h LEU 393 Ca 0.11 -0.36 0.02 0.00 0.84 0.00 0.00 57.88 58.49 2wwu h LEU 393 Cb 0.27 -0.26 -0.02 0.00 0.37 0.00 0.00 40.66 41.03 2wwu h LEU 393 CO 0.00 1.08 0.14 0.58 -0.34 0.00 0.00 178.44 179.91 2wwu h VAL 394 N 0.78 1.00 -0.53 1.05 2.07 -1.11 0.45 116.25 119.96 2wwu h VAL 394 Ca 0.12 -0.10 -0.08 0.00 0.82 0.00 0.00 66.70 67.46 2wwu h VAL 394 Cb 0.67 0.68 -0.02 0.00 -1.52 0.00 0.00 31.29 31.11 2wwu h VAL 394 CO 0.05 0.05 0.01 0.45 0.02 0.00 0.00 177.57 178.15 2wwu h HIS 395 N 0.29 1.01 -0.41 1.57 3.86 -1.25 -1.64 115.15 118.57 2wwu h HIS 395 Ca 0.11 -0.17 -0.02 0.00 -1.16 0.00 0.00 60.37 59.13 2wwu h HIS 395 Cb 0.03 -0.26 -0.02 0.00 1.06 0.00 0.00 27.41 28.22 2wwu h HIS 395 CO -0.09 0.92 0.17 0.78 0.86 0.00 0.00 177.93 180.57 2wwu h GLY 396 N 0.80 0.66 0.88 2.45 0.00 -0.94 -1.54 103.07 105.37 2wwu h GLY 396 Ca 0.15 -0.35 0.03 0.00 0.00 0.00 0.00 47.33 47.16 2wwu h GLY 396 CO 0.03 0.33 0.61 -1.33 0.00 0.00 0.00 176.54 176.18 2wwu h GLY 397 N 0.52 1.38 0.94 4.60 0.00 -0.79 -0.47 103.07 109.25 2wwu h GLY 397 Ca 0.14 -0.47 -0.01 0.00 0.00 0.00 0.00 47.33 46.98 2wwu h GLY 397 CO -0.01 0.40 0.15 0.50 0.00 0.00 0.00 176.54 177.58 2wwu h LYS 398 N 1.19 0.47 -0.32 4.80 1.57 -0.98 -1.04 116.57 122.27 2wwu h LYS 398 Ca 0.37 -0.07 -0.13 0.00 -1.87 0.00 0.00 60.65 58.96 2wwu h LYS 398 Cb -0.00 -0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.21 2wwu h LYS 398 CO -0.12 0.44 -0.32 0.00 -0.57 0.00 0.00 179.45 178.89 2wwu h ALA 399 N 1.00 0.85 -0.42 3.86 0.00 -0.98 -1.44 119.26 122.14 2wwu h ALA 399 Ca 0.11 -0.41 0.01 0.00 0.00 0.00 0.00 54.91 54.62 2wwu h ALA 399 Cb 0.13 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 2wwu h ALA 399 CO -0.01 0.63 0.27 1.25 0.00 0.00 0.00 179.25 181.39 2wwu h LEU 400 N 0.58 0.47 -1.23 0.00 5.85 -1.02 -1.42 115.31 118.54 2wwu h LEU 400 Ca 0.07 -0.01 -0.07 0.00 0.84 0.00 0.00 57.88 58.71 2wwu h LEU 400 Cb 0.82 -0.11 -0.01 0.00 0.37 0.00 0.00 40.66 41.72 2wwu h LEU 400 CO 0.07 0.34 -0.17 -1.13 -0.34 0.00 0.00 178.44 177.20 2wwu h ASN 401 N 0.56 0.30 -0.40 1.25 -1.24 -0.70 0.12 115.58 115.47 2wwu h ASN 401 Ca 0.15 -0.08 -0.02 0.00 0.71 0.00 0.00 56.30 57.07 2wwu h ASN 401 Cb -0.06 -0.08 -0.02 0.00 0.73 0.00 0.00 38.32 38.89 2wwu h ASN 401 CO -0.04 0.50 0.16 -0.07 -1.29 0.00 0.00 177.43 176.69 2wwu h LEU 402 N 0.29 0.55 -0.18 0.34 3.38 -0.92 -1.55 115.31 117.21 2wwu h LEU 402 Ca 0.05 -0.16 0.01 0.00 0.09 0.00 0.00 57.88 57.87 2wwu h LEU 402 Cb 0.48 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.08 2wwu h LEU 402 CO 0.03 0.56 0.10 0.00 0.09 0.00 0.00 178.44 179.22 2wwu h ALA 403 N 1.01 0.22 -0.61 1.53 0.00 -0.20 -1.25 119.26 119.95 2wwu h ALA 403 Ca 0.13 -0.00 0.11 0.00 0.00 0.00 0.00 54.91 55.15 2wwu h ALA 403 Cb 0.18 -0.04 -0.08 0.00 0.00 0.00 0.00 17.79 17.85 2wwu h ALA 403 CO -0.01 -0.32 0.18 0.74 0.00 0.00 0.00 179.25 179.83 2wwu h PHE 404 N 0.21 0.29 -0.34 0.00 0.04 -0.60 0.12 116.94 116.67 2wwu h PHE 404 Ca 0.07 0.03 -0.02 0.00 2.80 0.00 0.00 57.97 60.86 2wwu h PHE 404 Cb 0.00 -0.04 -0.02 0.00 2.20 0.00 0.00 35.95 38.10 2wwu h PHE 404 CO -0.08 0.02 0.14 0.00 -0.60 0.00 0.00 178.31 177.78 2wwu h ARG 405 N 0.32 0.51 -0.74 1.51 3.08 -0.99 -2.82 114.38 115.26 2wwu h ARG 405 Ca 0.32 -0.09 0.02 0.00 0.07 0.00 0.00 59.98 60.30 2wwu h ARG 405 Cb 0.45 -0.08 -0.04 0.00 0.08 0.00 0.00 29.97 30.37 2wwu h ARG 405 CO -0.37 0.50 0.48 0.00 -1.07 0.00 0.00 179.97 179.51 2wwu h ALA 406 N 0.98 0.96 0.00 0.04 0.00 -0.33 -2.03 119.26 118.87 2wwu h ALA 406 Ca 0.11 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.99 2wwu h ALA 406 Cb 0.18 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 17.70 2wwu h ALA 406 CO -0.01 0.30 0.00 -1.49 0.00 0.00 0.00 179.25 178.05 2wwu h TRP 407 N 0.95 0.00 -0.08 0.00 6.55 -0.67 -3.16 115.95 119.54 2wwu h TRP 407 Ca 0.29 0.00 0.00 0.00 0.95 0.00 0.00 58.89 60.13 2wwu h TRP 407 Cb -0.04 0.00 0.00 0.00 -0.86 0.00 0.00 29.16 28.26 2wwu h TRP 407 CO -0.03 0.00 0.00 0.25 -1.05 0.00 0.00 178.44 177.61 2wwu n THR 408 N -2.86 1.00 -1.73 1.49 -2.24 -0.95 -3.54 114.28 105.46 2wwu n THR 408 Ca 0.00 -1.00 -0.37 0.00 -2.27 0.00 0.00 64.05 60.41 2wwu n THR 408 Cb 0.25 0.50 0.07 0.00 -2.10 0.00 0.00 70.33 69.05 2wwu n THR 408 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 2wwu n ARG 409 N -0.26 1.18 -0.32 -0.78 1.74 -0.81 -4.67 116.66 112.74 2wwu n ARG 409 Ca 0.03 0.46 0.18 0.00 -0.77 0.00 0.00 57.85 57.75 2wwu n ARG 409 Cb 0.29 -2.53 0.38 0.00 -1.02 0.00 0.00 32.46 29.59 2wwu n ARG 409 CO 0.00 0.00 0.00 1.57 -1.52 0.00 0.00 177.63 177.68 2wwu h LYS 410 N 0.64 0.33 0.00 5.56 5.09 -1.93 0.17 116.57 126.44 2wwu h LYS 410 Ca -0.51 -0.02 0.00 0.00 0.09 0.00 0.00 60.65 60.21 2wwu h LYS 410 Cb 1.34 -0.07 0.00 0.00 0.10 0.00 0.00 32.23 33.59 2wwu h LYS 410 CO 0.53 0.22 -0.78 -0.85 -2.09 0.00 0.00 179.45 176.48 2wwu n GLU 411 N -5.08 0.18 -0.09 0.07 0.00 -1.26 -4.02 120.64 110.44 2wwu n GLU 411 Ca 0.26 0.02 -0.09 0.00 0.00 0.00 0.00 57.16 57.35 2wwu n GLU 411 Cb 0.81 -1.58 -0.14 0.00 0.00 0.00 0.00 31.44 30.53 2wwu n GLU 411 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 2wwu n ALA 412 N -1.70 1.56 -0.33 -1.84 0.00 -0.55 -4.60 120.51 113.05 2wwu n ALA 412 Ca 0.03 -1.17 0.15 0.00 0.00 0.00 0.00 53.44 52.46 2wwu n ALA 412 Cb 0.40 -0.12 0.29 0.00 0.00 0.00 0.00 19.45 20.02 2wwu n ALA 412 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 2wwu h LEU 413 N 0.00 -0.42 -1.58 0.00 5.85 -0.75 0.12 115.31 118.53 2wwu h LEU 413 Ca -0.48 0.27 0.23 0.00 0.84 0.00 0.00 57.88 58.74 2wwu h LEU 413 Cb 2.09 0.46 -0.07 0.00 0.37 0.00 0.00 40.66 43.51 2wwu h LEU 413 CO 0.02 -0.34 0.63 -0.65 -0.34 0.00 0.00 178.44 177.76 2wwu h PRO 414 N 0.02 0.31 -0.40 5.25 0.11 -1.81 -0.27 132.00 135.22 2wwu h PRO 414 Ca 0.60 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.69 2wwu h PRO 414 Cb 1.24 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.28 2wwu h PRO 414 CO -0.89 0.21 0.00 -0.25 -0.21 0.00 0.00 178.00 176.85 2wwu n ASP 415 N -4.48 2.16 0.00 -2.05 8.00 0.43 -4.27 116.55 116.35 2wwu n ASP 415 Ca 0.21 -1.99 0.00 0.00 0.71 0.00 0.00 54.79 53.71 2wwu n ASP 415 Cb 0.80 -0.27 0.00 0.00 -0.02 0.00 0.00 41.12 41.63 2wwu n ASP 415 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 2wwu n HIS 416 N 0.68 0.00 -0.28 1.24 8.25 -0.58 -4.85 115.22 119.68 2wwu n HIS 416 Ca 0.14 0.00 0.11 0.00 -0.26 0.00 0.00 57.72 57.71 2wwu n HIS 416 Cb 0.34 0.00 0.35 0.00 1.12 0.00 0.00 29.99 31.80 2wwu n HIS 416 CO 0.00 0.00 0.00 1.49 0.64 0.00 0.00 176.34 178.47 2wwu h GLU 417 N 0.00 0.73 0.00 -0.41 4.57 -1.27 -0.73 114.58 117.47 2wwu h GLU 417 Ca 0.00 -0.04 -0.00 0.00 -1.18 0.00 0.00 59.36 58.13 2wwu h GLU 417 Cb 0.01 -0.16 -0.00 0.00 -0.16 0.00 0.00 28.75 28.44 2wwu h GLU 417 CO 0.00 0.48 -0.01 0.38 -1.18 0.00 0.00 179.01 178.68 2wwu h ASP 418 N 0.75 0.00 0.31 1.04 2.03 -1.84 -2.22 116.42 116.50 2wwu h ASP 418 Ca 0.45 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.75 2wwu h ASP 418 Cb 0.66 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.16 2wwu h ASP 418 CO -0.21 0.01 -0.91 -0.62 -1.03 0.00 0.00 179.24 176.48 2wwu n GLU 419 N -3.35 0.14 -2.66 4.15 -0.58 -0.28 -4.89 120.64 113.16 2wwu n GLU 419 Ca -0.03 -0.01 -0.43 0.00 -0.42 0.00 0.00 57.16 56.28 2wwu n GLU 419 Cb 0.11 -1.54 -0.02 0.00 -0.57 0.00 0.00 31.44 29.42 2wwu n GLU 419 CO 0.00 0.00 0.00 0.42 -0.48 0.00 0.00 177.13 177.07 2wwu s ILE 420 N -3.10 4.72 0.32 -3.67 1.01 -0.84 -3.52 121.20 116.13 2wwu s ILE 420 Ca 0.07 2.00 -0.29 0.00 0.00 0.00 0.00 60.65 62.43 2wwu s ILE 420 Cb 0.16 -4.29 -0.11 0.00 0.01 0.00 0.00 42.46 38.22 2wwu s ILE 420 CO 0.80 -0.03 1.57 -2.84 0.00 0.00 0.00 174.94 174.44 2wwu s PRO 421 N 2.25 4.10 0.03 2.79 0.02 -1.26 -4.87 135.00 138.06 2wwu s PRO 421 Ca 0.48 2.60 0.10 0.00 0.02 0.00 0.00 61.00 64.20 2wwu s PRO 421 Cb -0.18 -3.00 0.44 0.00 0.02 0.00 0.00 34.50 31.78 2wwu s PRO 421 CO 0.16 -0.62 1.32 0.39 -0.33 0.00 0.00 177.00 177.92 2wwu n GLU 422 N 1.58 0.02 0.00 5.54 -0.58 -1.26 -1.23 120.64 124.72 2wwu n GLU 422 Ca 0.06 0.37 0.13 0.00 -0.42 0.00 0.00 57.16 57.30 2wwu n GLU 422 Cb 0.38 -1.55 0.47 0.00 -0.57 0.00 0.00 31.44 30.17 2wwu n GLU 422 CO 0.00 0.00 0.00 0.25 -0.48 0.00 0.00 177.13 176.90 2wwu n THR 423 N -1.58 0.00 -3.70 2.62 -2.24 -1.26 -4.89 114.28 103.22 2wwu n THR 423 Ca 0.02 -0.06 -0.36 0.00 -2.27 0.00 0.00 64.05 61.37 2wwu n THR 423 Cb 0.10 0.09 -0.09 0.00 -2.10 0.00 0.00 70.33 68.33 2wwu n THR 423 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 2wwu s VAL 424 N -2.64 5.28 -0.78 2.28 1.01 -0.36 -5.03 120.40 120.17 2wwu s VAL 424 Ca 0.22 0.15 -0.17 0.00 0.00 0.00 0.00 61.98 62.18 2wwu s VAL 424 Cb 0.19 -3.45 0.15 0.00 0.00 0.00 0.00 36.38 33.27 2wwu s VAL 424 CO 0.54 0.37 0.86 -0.13 0.00 0.00 0.00 175.10 176.74 2wwu s ARG 425 N 0.90 3.40 0.18 2.72 0.52 -1.26 -4.90 118.95 120.51 2wwu s ARG 425 Ca 0.07 -1.81 -0.12 0.00 -0.52 0.00 0.00 55.73 53.35 2wwu s ARG 425 Cb -0.13 -4.53 0.09 0.00 0.52 0.00 0.00 34.95 30.90 2wwu s ARG 425 CO 0.03 -1.54 1.77 1.79 0.02 0.00 0.00 175.30 177.37 2wwu h THR 426 N 5.55 1.21 -0.63 0.02 1.35 -1.95 -0.66 112.91 117.79 2wwu h THR 426 Ca -0.02 -0.57 0.00 0.00 -0.55 0.00 0.00 66.41 65.27 2wwu h THR 426 Cb 1.05 0.46 -0.03 0.00 -1.73 0.00 0.00 68.15 67.90 2wwu h THR 426 CO 1.00 0.24 0.41 0.58 -0.25 0.00 0.00 175.52 177.49 2wwu h VAL 427 N 0.84 1.17 -0.18 6.82 2.07 -1.99 -0.57 116.25 124.41 2wwu h VAL 427 Ca 0.21 -0.33 -0.22 0.00 0.82 0.00 0.00 66.70 67.19 2wwu h VAL 427 Cb 0.09 0.26 0.01 0.00 -1.52 0.00 0.00 31.29 30.13 2wwu h VAL 427 CO -0.03 0.17 -0.73 -0.61 0.02 0.00 0.00 177.57 176.39 2wwu h GLN 428 N 0.86 0.80 -0.47 1.57 5.75 -1.93 -1.92 115.11 119.77 2wwu h GLN 428 Ca 0.23 -0.62 0.02 0.00 -0.15 0.00 0.00 58.65 58.13 2wwu h GLN 428 Cb -0.08 0.12 -0.03 0.00 1.07 0.00 0.00 27.48 28.56 2wwu h GLN 428 CO -0.05 1.23 0.28 1.25 -2.65 0.00 0.00 178.83 178.90 2wwu h LEU 429 N 0.56 0.45 -0.21 -2.39 5.85 -0.77 0.04 115.31 118.84 2wwu h LEU 429 Ca -0.04 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.68 2wwu h LEU 429 Cb 1.36 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 42.28 2wwu h LEU 429 CO 0.15 0.32 0.10 0.40 -0.34 0.00 0.00 178.44 179.08 2wwu h ILE 430 N 0.56 1.13 -0.27 4.05 2.04 -1.12 -0.03 117.51 123.87 2wwu h ILE 430 Ca 0.19 -0.37 0.01 0.00 1.00 0.00 0.00 64.86 65.68 2wwu h ILE 430 Cb 0.01 0.99 -0.02 0.00 -0.74 0.00 0.00 36.82 37.07 2wwu h ILE 430 CO -0.09 0.13 0.16 0.50 0.00 0.00 0.00 178.15 178.86 2wwu h LYS 431 N 0.21 0.33 -0.48 2.37 3.64 -1.11 -1.41 116.57 120.12 2wwu h LYS 431 Ca 0.07 -0.02 -0.09 0.00 -1.27 0.00 0.00 60.65 59.34 2wwu h LYS 431 Cb 0.11 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 31.84 2wwu h LYS 431 CO -0.01 0.22 -0.06 -0.44 -2.27 0.00 0.00 179.45 176.88 2wwu h ASP 432 N 0.34 0.89 -0.37 4.20 3.32 -0.86 -1.47 116.42 122.46 2wwu h ASP 432 Ca 0.10 -0.34 0.01 0.00 0.02 0.00 0.00 57.03 56.83 2wwu h ASP 432 Cb -0.02 -0.24 -0.02 0.00 0.22 0.00 0.00 39.33 39.27 2wwu h ASP 432 CO -0.04 1.02 0.22 0.25 -1.72 0.00 0.00 179.24 178.96 2wwu h LEU 433 N 0.74 0.35 -0.52 1.55 5.85 -0.90 -0.88 115.31 121.50 2wwu h LEU 433 Ca 0.13 0.00 0.03 0.00 0.84 0.00 0.00 57.88 58.88 2wwu h LEU 433 Cb 0.60 -0.07 -0.04 0.00 0.37 0.00 0.00 40.66 41.52 2wwu h LEU 433 CO 0.04 0.26 0.31 0.00 -0.34 0.00 0.00 178.44 178.70 2wwu h ALA 434 N 1.16 0.67 0.48 1.25 0.00 -1.02 -0.38 119.26 121.42 2wwu h ALA 434 Ca 0.14 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.03 2wwu h ALA 434 Cb -0.00 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.66 2wwu h ALA 434 CO -0.06 0.01 -0.23 -0.09 0.00 0.00 0.00 179.25 178.87 2wwu h ARG 435 N 0.61 -0.62 -0.96 0.00 2.43 -0.89 -0.73 114.38 114.22 2wwu h ARG 435 Ca 0.21 0.04 0.07 0.00 -0.81 0.00 0.00 59.98 59.50 2wwu h ARG 435 Cb 0.04 0.14 -0.07 0.00 -0.42 0.00 0.00 29.97 29.67 2wwu h ARG 435 CO -0.11 -0.41 0.62 0.93 -1.51 0.00 0.00 179.97 179.50 2wwu h GLU 436 N -0.65 1.05 -0.55 0.20 4.39 -0.97 -1.75 114.58 116.31 2wwu h GLU 436 Ca -0.07 -0.06 -0.09 0.00 0.34 0.00 0.00 59.36 59.48 2wwu h GLU 436 Cb 0.50 -0.24 -0.02 0.00 -0.10 0.00 0.00 28.75 28.89 2wwu h GLU 436 CO 0.11 0.69 -0.02 0.82 -1.16 0.00 0.00 179.01 179.45 2wwu h ILE 437 N 1.08 1.26 -0.48 3.13 2.04 -0.85 -2.87 117.51 120.82 2wwu h ILE 437 Ca 0.42 -1.13 -0.05 0.00 1.00 0.00 0.00 64.86 65.10 2wwu h ILE 437 Cb 0.23 0.86 -0.02 0.00 -0.74 0.00 0.00 36.82 37.15 2wwu h ILE 437 CO -0.17 0.40 0.08 0.03 0.00 0.00 0.00 178.15 178.49 2wwu h ARG 438 N 0.88 0.74 -0.07 2.37 3.08 -0.29 -2.35 114.38 118.74 2wwu h ARG 438 Ca 0.16 -0.16 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2wwu h ARG 438 Cb 0.55 -0.11 0.00 0.00 0.08 0.00 0.00 29.97 30.49 2wwu h ARG 438 CO 0.03 0.70 0.00 1.28 -1.07 0.00 0.00 179.97 180.91 2wwu n LEU 439 N -4.27 0.07 0.00 3.04 4.77 -0.80 -3.32 117.00 116.50 2wwu n LEU 439 Ca 0.03 -0.04 0.00 0.00 -0.03 0.00 0.00 56.01 55.97 2wwu n LEU 439 Cb 0.24 -0.04 0.00 0.00 -2.33 0.00 0.00 43.42 41.29 2wwu n LEU 439 CO 0.40 0.02 0.00 0.52 -1.33 0.00 0.00 177.39 177.00 2wwu n VAL 440 N -0.45 0.00 -2.66 4.08 0.31 -0.91 -5.02 118.33 113.69 2wwu n VAL 440 Ca 0.00 -0.18 -0.42 0.00 -0.01 0.00 0.00 64.34 63.72 2wwu n VAL 440 Cb 0.02 1.03 -0.03 0.00 -0.91 0.00 0.00 33.84 33.95 2wwu n VAL 440 CO 0.00 0.00 0.00 -1.61 -1.32 0.00 0.00 176.83 173.90 2wwu s GLU 441 N -0.35 4.49 0.00 5.55 2.02 -1.05 -5.04 118.70 124.32 2wwu s GLU 441 Ca 0.00 1.46 0.00 0.00 0.02 0.00 0.00 54.97 56.45 2wwu s GLU 441 Cb 0.00 -3.48 0.00 0.00 0.10 0.00 0.00 34.13 30.75 2wwu s GLU 441 CO 0.00 -0.18 0.00 -0.40 0.02 0.00 0.00 175.26 174.70