#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1tj2 s SER 89 N 0.00 1.21 0.17 1.08 1.04 -1.26 -4.65 113.70 111.30 1tj2 s SER 89 Ca 0.00 1.54 -0.15 0.00 0.48 0.00 0.00 55.95 57.82 1tj2 s SER 89 Cb 0.00 -2.29 0.13 0.00 0.10 0.00 0.00 66.02 63.96 1tj2 s SER 89 CO 0.00 -4.06 1.72 0.58 0.98 0.00 0.00 173.24 172.46 1tj2 h VAL 90 N -2.53 0.77 -0.18 5.02 2.07 -2.05 -0.40 116.25 118.95 1tj2 h VAL 90 Ca -0.60 -0.07 -0.13 0.00 0.82 0.00 0.00 66.70 66.72 1tj2 h VAL 90 Cb 1.33 0.54 0.00 0.00 -1.52 0.00 0.00 31.29 31.64 1tj2 h VAL 90 CO 0.50 0.04 -0.40 0.77 0.02 0.00 0.00 177.57 178.50 1tj2 h SER 91 N 0.21 0.66 -0.64 0.57 4.64 -1.96 -2.23 113.55 114.81 1tj2 h SER 91 Ca 0.21 -0.56 0.04 0.00 -0.47 0.00 0.00 61.79 61.01 1tj2 h SER 91 Cb 0.26 -0.19 -0.05 0.00 -0.31 0.00 0.00 62.40 62.11 1tj2 h SER 91 CO -0.28 1.10 0.37 0.03 -0.87 0.00 0.00 176.83 177.18 1tj2 h ARG 92 N 0.25 0.68 -0.81 4.77 2.47 -1.89 -2.31 114.38 117.54 1tj2 h ARG 92 Ca 0.00 -0.04 -0.03 0.00 -1.26 0.00 0.00 59.98 58.65 1tj2 h ARG 92 Cb 1.01 -0.15 -0.04 0.00 -1.65 0.00 0.00 29.97 29.14 1tj2 h ARG 92 CO 0.09 0.45 0.38 0.00 0.56 0.00 0.00 179.97 181.45 1tj2 h ALA 93 N 1.31 1.14 0.00 0.04 0.00 -1.04 -2.26 119.26 118.44 1tj2 h ALA 93 Ca 0.27 -0.17 -0.09 0.00 0.00 0.00 0.00 54.91 54.93 1tj2 h ALA 93 Cb 0.11 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 1tj2 h ALA 93 CO -0.15 0.65 -0.45 0.00 0.00 0.00 0.00 179.25 179.30 1tj2 h ALA 94 N 1.25 1.18 0.29 0.00 0.00 -1.04 -1.33 119.26 119.62 1tj2 h ALA 94 Ca 0.28 -0.41 -0.01 0.00 0.00 0.00 0.00 54.91 54.77 1tj2 h ALA 94 Cb 0.13 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.86 1tj2 h ALA 94 CO -0.03 0.56 -0.14 0.82 0.00 0.00 0.00 179.25 180.45 1tj2 h ILE 95 N 0.00 0.74 -0.72 0.00 2.04 -1.03 -2.83 117.51 115.72 1tj2 h ILE 95 Ca -0.00 -0.32 0.12 0.00 1.00 0.00 0.00 64.86 65.66 1tj2 h ILE 95 Cb 0.83 0.92 -0.09 0.00 -0.74 0.00 0.00 36.82 37.74 1tj2 h ILE 95 CO 0.06 0.07 0.30 0.74 0.00 0.00 0.00 178.15 179.31 1tj2 h THR 96 N -0.57 0.72 0.00 -0.27 2.02 -1.00 -1.79 112.91 112.02 1tj2 h THR 96 Ca -0.04 -0.16 0.00 0.00 0.77 0.00 0.00 66.41 66.98 1tj2 h THR 96 Cb 0.41 0.21 0.00 0.00 -1.74 0.00 0.00 68.15 67.03 1tj2 h THR 96 CO 0.07 0.09 0.00 0.00 0.37 0.00 0.00 175.52 176.04 1tj2 h ALA 97 N 1.50 1.00 -0.00 6.16 0.00 -1.16 -2.61 119.26 124.14 1tj2 h ALA 97 Ca 0.38 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.29 1tj2 h ALA 97 Cb 0.52 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.31 1tj2 h ALA 97 CO -0.36 0.00 -0.34 0.00 0.00 0.00 0.00 179.25 178.55 1tj2 n ALA 98 N -2.05 3.24 -0.26 0.00 0.00 -0.69 -4.67 120.51 116.07 1tj2 n ALA 98 Ca 0.02 -0.37 -0.06 0.00 0.00 0.00 0.00 53.44 53.03 1tj2 n ALA 98 Cb 0.35 -1.14 -0.04 0.00 0.00 0.00 0.00 19.45 18.61 1tj2 n ALA 98 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 177.50 178.48 1tj2 n TYR 99 N -1.00 -0.21 -2.54 0.00 -0.00 -0.99 -2.63 117.16 109.79 1tj2 n TYR 99 Ca 0.10 0.78 -0.09 0.00 -0.00 0.00 0.00 57.90 58.69 1tj2 n TYR 99 Cb 0.34 -0.59 0.04 0.00 -0.00 0.00 0.00 39.34 39.13 1tj2 n TYR 99 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.86 177.40 1tj2 n ARG 100 N -4.81 2.42 -2.04 2.98 1.74 -1.26 -4.29 116.66 111.39 1tj2 n ARG 100 Ca 0.02 -3.75 -0.37 0.00 -0.77 0.00 0.00 57.85 52.98 1tj2 n ARG 100 Cb 0.18 -1.85 0.01 0.00 -1.02 0.00 0.00 32.46 29.78 1tj2 n ARG 100 CO 0.00 0.00 0.00 -0.98 -1.52 0.00 0.00 177.63 175.13 1tj2 s ARG 101 N -3.73 3.44 0.39 5.56 1.70 -1.08 -4.59 118.95 120.65 1tj2 s ARG 101 Ca 0.36 1.97 -0.25 0.00 -0.47 0.00 0.00 55.73 57.34 1tj2 s ARG 101 Cb 0.35 -2.30 -0.12 0.00 -0.57 0.00 0.00 34.95 32.31 1tj2 s ARG 101 CO -0.01 -0.87 0.91 -2.30 -1.08 0.00 0.00 175.30 171.95 1tj2 n PRO 102 N -0.80 1.17 -0.08 3.89 -0.02 -1.26 -4.73 135.00 133.16 1tj2 n PRO 102 Ca 0.09 0.42 -0.09 0.00 -2.02 0.00 0.00 63.50 61.90 1tj2 n PRO 102 Cb 0.47 -1.88 0.06 0.00 -0.02 0.00 0.00 33.50 32.13 1tj2 n PRO 102 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 1tj2 h GLU 103 N 1.47 0.77 -0.95 -0.52 4.81 -1.90 -1.15 114.58 117.11 1tj2 h GLU 103 Ca -0.42 -0.36 0.05 0.00 -0.13 0.00 0.00 59.36 58.50 1tj2 h GLU 103 Cb 1.35 -0.01 -0.06 0.00 0.63 0.00 0.00 28.75 30.66 1tj2 h GLU 103 CO 0.57 0.98 0.62 1.79 -0.73 0.00 0.00 179.01 182.23 1tj2 h THR 104 N 0.65 1.11 -0.01 0.32 1.35 -1.42 -0.15 112.91 114.76 1tj2 h THR 104 Ca 0.07 -0.39 -0.00 0.00 -0.55 0.00 0.00 66.41 65.54 1tj2 h THR 104 Cb 0.85 -0.12 -0.00 0.00 -1.73 0.00 0.00 68.15 67.15 1tj2 h THR 104 CO 0.07 0.21 -0.01 -0.08 -0.25 0.00 0.00 175.52 175.46 1tj2 h GLU 105 N 1.13 0.02 -0.18 4.72 4.81 -1.71 -1.72 114.58 121.65 1tj2 h GLU 105 Ca 0.40 -0.01 -0.03 0.00 -0.13 0.00 0.00 59.36 59.58 1tj2 h GLU 105 Cb 0.12 -0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.49 1tj2 h GLU 105 CO -0.14 0.45 -0.01 0.00 -0.73 0.00 0.00 179.01 178.58 1tj2 h ALA 106 N 0.57 0.25 -0.56 2.92 0.00 -0.95 -2.19 119.26 119.30 1tj2 h ALA 106 Ca 0.00 -0.22 -0.04 0.00 0.00 0.00 0.00 54.91 54.66 1tj2 h ALA 106 Cb 0.44 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.14 1tj2 h ALA 106 CO 0.00 -0.02 0.20 0.28 0.00 0.00 0.00 179.25 179.71 1tj2 h VAL 107 N 0.08 1.23 -0.66 0.00 2.07 -1.13 -2.41 116.25 115.42 1tj2 h VAL 107 Ca 0.05 -0.75 0.05 0.00 0.82 0.00 0.00 66.70 66.88 1tj2 h VAL 107 Cb 0.42 0.67 -0.05 0.00 -1.52 0.00 0.00 31.29 30.80 1tj2 h VAL 107 CO 0.01 0.28 0.37 0.28 0.02 0.00 0.00 177.57 178.54 1tj2 h SER 108 N 0.78 0.56 0.21 0.57 0.02 -1.17 -2.22 113.55 112.29 1tj2 h SER 108 Ca 0.18 0.03 -0.06 0.00 -0.84 0.00 0.00 61.79 61.10 1tj2 h SER 108 Cb 0.24 -0.08 -0.01 0.00 0.14 0.00 0.00 62.40 62.69 1tj2 h SER 108 CO -0.01 0.36 -0.25 0.24 -1.14 0.00 0.00 176.83 176.03 1tj2 h MET 109 N 0.69 0.08 0.00 3.45 2.86 -1.18 -3.14 114.93 117.70 1tj2 h MET 109 Ca 0.29 -0.02 -0.08 0.00 -2.06 0.00 0.00 59.70 57.83 1tj2 h MET 109 Cb 0.17 -0.01 -0.01 0.00 0.06 0.00 0.00 31.60 31.81 1tj2 h MET 109 CO -0.17 0.33 -0.38 -0.07 1.06 0.00 0.00 176.91 177.68 1tj2 h LEU 110 N 0.07 0.00 0.27 1.22 3.38 -0.91 -3.40 115.31 115.94 1tj2 h LEU 110 Ca 0.01 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.98 1tj2 h LEU 110 Cb 0.49 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.22 1tj2 h LEU 110 CO 0.03 0.38 -0.23 -0.07 0.09 0.00 0.00 178.44 178.64 1tj2 h LEU 111 N 0.00 -0.61 -0.85 1.67 3.38 -1.44 -0.08 115.31 117.37 1tj2 h LEU 111 Ca -0.00 0.05 -0.12 0.00 0.09 0.00 0.00 57.88 57.90 1tj2 h LEU 111 Cb 1.16 0.21 -0.01 0.00 0.09 0.00 0.00 40.66 42.10 1tj2 h LEU 111 CO 0.05 -0.35 -0.51 -0.33 0.09 0.00 0.00 178.44 177.39 1tj2 h GLU 112 N -0.52 0.15 -0.23 1.13 4.39 -1.80 -0.86 114.58 116.85 1tj2 h GLU 112 Ca -0.01 -0.09 -0.04 0.00 0.34 0.00 0.00 59.36 59.56 1tj2 h GLU 112 Cb 0.47 0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 29.11 1tj2 h GLU 112 CO -0.03 0.63 -0.04 1.96 -1.16 0.00 0.00 179.01 180.37 1tj2 h GLN 113 N 0.12 0.34 0.00 2.33 4.20 -1.66 -3.14 115.11 117.30 1tj2 h GLN 113 Ca 0.00 -0.07 0.00 0.00 0.06 0.00 0.00 58.65 58.65 1tj2 h GLN 113 Cb 0.95 -0.05 0.00 0.00 0.30 0.00 0.00 27.48 28.67 1tj2 h GLN 113 CO 0.07 0.41 -0.77 0.00 -0.67 0.00 0.00 178.83 177.87 1tj2 h ALA 114 N 1.63 0.58 -2.42 3.87 0.00 -0.28 -3.39 119.26 119.26 1tj2 h ALA 114 Ca 0.07 0.00 -0.54 0.00 0.00 0.00 0.00 54.91 54.45 1tj2 h ALA 114 Cb 0.29 0.00 0.01 0.00 0.00 0.00 0.00 17.79 18.10 1tj2 h ALA 114 CO 0.01 0.00 0.99 0.50 0.00 0.00 0.00 179.25 180.75 1tj2 s ARG 115 N -3.29 4.21 -0.00 0.00 3.52 -0.40 -4.71 118.95 118.28 1tj2 s ARG 115 Ca 0.02 2.27 -0.30 0.00 -0.13 0.00 0.00 55.73 57.59 1tj2 s ARG 115 Cb 0.10 -3.65 -0.04 0.00 -1.56 0.00 0.00 34.95 29.80 1tj2 s ARG 115 CO 0.76 -0.73 1.13 -0.51 -0.81 0.00 0.00 175.30 175.14 1tj2 s LEU 116 N 2.80 4.33 0.25 -0.88 1.02 -1.26 -4.99 118.68 119.95 1tj2 s LEU 116 Ca 0.73 1.83 -0.30 0.00 0.02 0.00 0.00 54.13 56.41 1tj2 s LEU 116 Cb -0.38 -3.57 -0.14 0.00 0.02 0.00 0.00 46.19 42.12 1tj2 s LEU 116 CO 0.31 -0.45 1.21 -2.65 0.02 0.00 0.00 176.35 174.79 1tj2 n PRO 117 N 4.41 1.64 -0.02 1.29 -0.02 -1.26 -4.43 135.00 136.60 1tj2 n PRO 117 Ca 0.09 0.58 -0.01 0.00 -2.02 0.00 0.00 63.50 62.14 1tj2 n PRO 117 Cb 0.48 -2.10 -0.01 0.00 -0.02 0.00 0.00 33.50 31.85 1tj2 n PRO 117 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1tj2 n GLN 118 N 1.34 -0.02 -0.04 -0.52 0.00 -1.26 -0.98 117.38 115.90 1tj2 n GLN 118 Ca 0.11 0.10 -0.12 0.00 0.00 0.00 0.00 57.00 57.08 1tj2 n GLN 118 Cb 0.31 -0.14 0.00 0.00 0.00 0.00 0.00 30.24 30.41 1tj2 n GLN 118 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.06 176.06 1tj2 h PRO 119 N 0.00 0.74 -0.79 2.61 0.13 -2.01 -2.63 132.00 130.05 1tj2 h PRO 119 Ca 0.01 -0.46 0.03 0.00 -0.87 0.00 0.00 66.00 64.71 1tj2 h PRO 119 Cb 0.02 0.05 -0.05 0.00 0.13 0.00 0.00 31.00 31.16 1tj2 h PRO 119 CO -0.05 1.09 0.51 0.28 -0.23 0.00 0.00 178.00 179.59 1tj2 h VAL 120 N 0.57 1.12 -0.68 1.56 2.07 -1.39 -2.73 116.25 116.77 1tj2 h VAL 120 Ca 0.01 -0.34 0.00 0.00 0.82 0.00 0.00 66.70 67.20 1tj2 h VAL 120 Cb 1.12 0.05 -0.03 0.00 -1.52 0.00 0.00 31.29 30.90 1tj2 h VAL 120 CO 0.11 0.18 0.43 0.00 0.02 0.00 0.00 177.57 178.32 1tj2 h ALA 121 N 1.33 1.49 0.07 1.67 0.00 -0.75 -1.36 119.26 121.72 1tj2 h ALA 121 Ca 0.32 -0.06 -0.29 0.00 0.00 0.00 0.00 54.91 54.88 1tj2 h ALA 121 Cb 0.01 -0.28 0.03 0.00 0.00 0.00 0.00 17.79 17.55 1tj2 h ALA 121 CO -0.11 0.46 -1.17 1.05 0.00 0.00 0.00 179.25 179.48 1tj2 h GLU 122 N 0.92 0.64 -0.32 0.00 9.09 -1.36 -1.30 114.58 122.26 1tj2 h GLU 122 Ca 0.25 -0.79 -0.05 0.00 0.05 0.00 0.00 59.36 58.81 1tj2 h GLU 122 Cb -0.08 0.25 -0.02 0.00 -1.65 0.00 0.00 28.75 27.25 1tj2 h GLU 122 CO -0.05 1.35 -0.03 1.96 0.05 0.00 0.00 179.01 182.30 1tj2 h GLN 123 N 0.32 0.50 -0.27 1.06 1.08 -1.37 -1.37 115.11 115.05 1tj2 h GLN 123 Ca -0.16 -0.11 -0.10 0.00 -1.45 0.00 0.00 58.65 56.82 1tj2 h GLN 123 Cb 1.83 -0.07 -0.01 0.00 -0.05 0.00 0.00 27.48 29.19 1tj2 h GLN 123 CO 0.22 0.55 -0.22 0.00 -0.95 0.00 0.00 178.83 178.43 1tj2 h ALA 124 N 1.50 0.40 -0.86 3.87 0.00 -1.17 -2.02 119.26 120.97 1tj2 h ALA 124 Ca 0.10 -0.37 0.01 0.00 0.00 0.00 0.00 54.91 54.66 1tj2 h ALA 124 Cb 0.35 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 18.01 1tj2 h ALA 124 CO 0.01 0.35 0.57 1.25 0.00 0.00 0.00 179.25 181.43 1tj2 h HIS 125 N 0.37 1.07 -0.16 0.00 -0.00 -0.96 0.22 115.15 115.69 1tj2 h HIS 125 Ca 0.05 0.03 -0.07 0.00 -0.00 0.00 0.00 60.37 60.38 1tj2 h HIS 125 Cb 0.77 -0.36 -0.00 0.00 -0.00 0.00 0.00 27.41 27.82 1tj2 h HIS 125 CO 0.07 0.66 -0.18 -0.22 -0.00 0.00 0.00 177.93 178.26 1tj2 h LYS 126 N 1.15 0.40 -0.52 5.26 3.64 -1.14 -0.56 116.57 124.80 1tj2 h LYS 126 Ca 0.32 -0.22 -0.08 0.00 -1.27 0.00 0.00 60.65 59.40 1tj2 h LYS 126 Cb -0.10 0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 31.71 1tj2 h LYS 126 CO -0.08 0.79 0.00 1.25 -2.27 0.00 0.00 179.45 179.14 1tj2 h LEU 127 N 0.03 0.89 -0.20 5.20 5.85 -1.25 -2.13 115.31 123.70 1tj2 h LEU 127 Ca 0.02 -0.30 -0.00 0.00 0.84 0.00 0.00 57.88 58.43 1tj2 h LEU 127 Cb 0.72 -0.24 -0.01 0.00 0.37 0.00 0.00 40.66 41.51 1tj2 h LEU 127 CO 0.04 0.98 0.10 0.00 -0.34 0.00 0.00 178.44 179.22 1tj2 h ALA 128 N 0.94 0.25 -0.48 1.25 0.00 -0.89 -0.98 119.26 119.36 1tj2 h ALA 128 Ca 0.15 -0.07 0.09 0.00 0.00 0.00 0.00 54.91 55.09 1tj2 h ALA 128 Cb 0.52 -0.08 -0.08 0.00 0.00 0.00 0.00 17.79 18.15 1tj2 h ALA 128 CO 0.03 -0.21 -0.05 -0.92 0.00 0.00 0.00 179.25 178.09 1tj2 h TYR 129 N 0.21 -0.13 -0.05 0.00 3.20 -0.99 -1.43 116.97 117.78 1tj2 h TYR 129 Ca 0.07 0.04 -0.00 0.00 3.14 0.00 0.00 58.73 61.97 1tj2 h TYR 129 Cb 0.08 0.13 -0.00 0.00 1.54 0.00 0.00 36.73 38.48 1tj2 h TYR 129 CO -0.03 -0.15 0.01 1.96 -1.64 0.00 0.00 178.16 178.31 1tj2 h GLN 130 N 0.06 0.08 -0.63 1.82 4.20 -0.96 0.18 115.11 119.85 1tj2 h GLN 130 Ca 0.24 -0.02 0.06 0.00 0.06 0.00 0.00 58.65 58.99 1tj2 h GLN 130 Cb 0.36 -0.01 -0.06 0.00 0.30 0.00 0.00 27.48 28.07 1tj2 h GLN 130 CO -0.44 0.27 0.33 -0.07 -0.67 0.00 0.00 178.83 178.25 1tj2 h LEU 131 N -0.13 0.47 -0.20 1.46 3.38 -1.05 -1.06 115.31 118.18 1tj2 h LEU 131 Ca 0.02 0.04 -0.22 0.00 0.09 0.00 0.00 57.88 57.81 1tj2 h LEU 131 Cb 0.23 -0.05 0.01 0.00 0.09 0.00 0.00 40.66 40.93 1tj2 h LEU 131 CO -0.00 0.30 -0.76 0.00 0.09 0.00 0.00 178.44 178.07 1tj2 h ALA 132 N 1.34 0.36 -0.02 1.53 0.00 -0.95 -2.37 119.26 119.15 1tj2 h ALA 132 Ca 0.29 -0.60 0.03 0.00 0.00 0.00 0.00 54.91 54.63 1tj2 h ALA 132 Cb 0.21 -0.02 -0.04 0.00 0.00 0.00 0.00 17.79 17.94 1tj2 h ALA 132 CO -0.20 0.69 -0.20 0.22 0.00 0.00 0.00 179.25 179.77 1tj2 h ASP 133 N 0.52 -0.60 -0.41 0.00 1.82 -0.39 -1.74 116.42 115.62 1tj2 h ASP 133 Ca -0.05 0.09 -0.01 0.00 -0.39 0.00 0.00 57.03 56.67 1tj2 h ASP 133 Cb 1.38 0.25 -0.02 0.00 0.68 0.00 0.00 39.33 41.62 1tj2 h ASP 133 CO 0.15 -0.27 0.23 0.11 -1.61 0.00 0.00 179.24 177.86 1tj2 h LYS 134 N -0.31 0.60 -0.12 0.28 1.57 -1.16 -1.92 116.57 115.51 1tj2 h LYS 134 Ca 0.07 -0.06 -0.03 0.00 -1.87 0.00 0.00 60.65 58.76 1tj2 h LYS 134 Cb 0.40 -0.12 -0.00 0.00 0.08 0.00 0.00 32.23 32.58 1tj2 h LYS 134 CO -0.20 0.46 -0.04 1.25 -0.57 0.00 0.00 179.45 180.34 1tj2 h LEU 135 N 0.61 0.25 -0.53 2.94 5.85 -1.02 -2.72 115.31 120.68 1tj2 h LEU 135 Ca 0.16 -0.39 -0.10 0.00 0.84 0.00 0.00 57.88 58.39 1tj2 h LEU 135 Cb 0.04 -0.07 -0.02 0.00 0.37 0.00 0.00 40.66 40.98 1tj2 h LEU 135 CO -0.02 0.58 -0.04 -0.09 -0.34 0.00 0.00 178.44 178.53 1tj2 h ARG 136 N -0.09 0.97 -1.13 1.25 2.43 -1.23 -3.32 114.38 113.26 1tj2 h ARG 136 Ca 0.03 -0.33 -0.62 0.00 -0.81 0.00 0.00 59.98 58.25 1tj2 h ARG 136 Cb 0.48 -0.08 -0.38 0.00 -0.42 0.00 0.00 29.97 29.58 1tj2 h ARG 136 CO 0.01 1.00 -0.18 0.09 -1.51 0.00 0.00 179.97 179.38 1tj2 n ASN 137 N -4.24 5.84 0.25 -3.80 5.03 -0.73 -4.28 115.26 113.33 1tj2 n ASN 137 Ca 0.01 -3.76 -0.13 0.00 0.87 0.00 0.00 54.58 51.57 1tj2 n ASN 137 Cb 0.36 -0.60 -0.07 0.00 -1.02 0.00 0.00 39.78 38.44 1tj2 n ASN 137 CO 0.00 0.00 0.00 -0.61 -1.83 0.00 0.00 177.26 174.82 1tj2 h GLN 138 N 2.33 -0.65 -2.00 3.52 4.15 -1.58 -3.20 115.11 117.68 1tj2 h GLN 138 Ca 0.43 0.04 -0.74 0.00 0.77 0.00 0.00 58.65 59.15 1tj2 h GLN 138 Cb 1.05 0.15 -0.30 0.00 0.21 0.00 0.00 27.48 28.59 1tj2 h GLN 138 CO 1.06 -0.35 0.74 1.63 -1.93 0.00 0.00 178.83 179.97 1tj2 n LYS 139 N -5.25 3.40 -4.19 1.69 5.02 -1.26 -4.87 118.16 112.71 1tj2 n LYS 139 Ca -0.10 -3.95 -0.34 0.00 -2.02 0.00 0.00 58.31 51.90 1tj2 n LYS 139 Cb 0.31 -2.31 -0.03 0.00 -0.02 0.00 0.00 35.03 32.98 1tj2 n LYS 139 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 1tj2 n ASN 140 N -0.42 -2.58 0.22 4.39 5.15 -1.21 -4.86 115.26 115.95 1tj2 n ASN 140 Ca 0.49 -1.03 0.06 0.00 -0.60 0.00 0.00 54.58 53.51 1tj2 n ASN 140 Cb 0.30 -2.74 0.51 0.00 -0.53 0.00 0.00 39.78 37.32 1tj2 n ASN 140 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1tj2 h ALA 141 N 0.90 1.50 0.00 5.20 0.00 -1.79 -2.27 119.26 122.80 1tj2 h ALA 141 Ca -0.60 -0.20 -0.23 0.00 0.00 0.00 0.00 54.91 53.88 1tj2 h ALA 141 Cb 1.38 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 19.09 1tj2 h ALA 141 CO 0.75 0.28 -2.10 0.43 0.00 0.00 0.00 179.25 178.61 1tj2 n SER 142 N -4.08 0.16 0.16 0.00 7.64 -1.26 -3.80 113.62 112.44 1tj2 n SER 142 Ca -0.02 0.07 0.13 0.00 1.01 0.00 0.00 58.87 60.06 1tj2 n SER 142 Cb 0.29 1.13 0.55 0.00 -1.01 0.00 0.00 64.21 65.18 1tj2 n SER 142 CO 0.00 0.00 0.00 1.23 -3.01 0.00 0.00 175.04 173.26 1tj2 h GLY 143 N 3.94 0.00 0.56 0.23 0.00 -1.91 -2.21 103.07 103.68 1tj2 h GLY 143 Ca -0.32 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.01 1tj2 h GLY 143 CO 0.02 0.00 -1.16 0.54 0.00 0.00 0.00 176.54 175.95 1tj2 n ARG 144 N -2.37 0.39 -0.09 4.80 1.74 -0.87 -3.40 116.66 116.86 1tj2 n ARG 144 Ca 0.01 -0.01 -0.07 0.00 -0.77 0.00 0.00 57.85 57.01 1tj2 n ARG 144 Cb 0.20 -1.62 0.10 0.00 -1.02 0.00 0.00 32.46 30.13 1tj2 n ARG 144 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1tj2 h ALA 145 N 2.39 0.92 0.00 7.54 0.00 -1.51 -3.07 119.26 125.53 1tj2 h ALA 145 Ca 0.00 -0.35 0.00 0.00 0.00 0.00 0.00 54.91 54.56 1tj2 h ALA 145 Cb 0.81 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.43 1tj2 h ALA 145 CO 0.00 0.62 0.29 0.78 0.00 0.00 0.00 179.25 180.94 1tj2 h GLY 146 N 0.97 0.00 -2.17 0.00 0.00 -1.49 -3.52 103.07 96.85 1tj2 h GLY 146 Ca 0.11 0.00 -0.58 0.00 0.00 0.00 0.00 47.33 46.85 1tj2 h GLY 146 CO 0.05 0.00 -0.73 1.06 0.00 0.00 0.00 176.54 176.92 1tj2 s MET 147 N -3.85 1.67 0.00 4.80 1.00 -1.16 -5.12 119.30 116.63 1tj2 s MET 147 Ca -0.03 -1.80 0.00 0.00 0.00 0.00 0.00 55.69 53.86 1tj2 s MET 147 Cb 0.07 -1.62 0.00 0.00 0.00 0.00 0.00 34.83 33.28 1tj2 s MET 147 CO 0.23 0.23 0.00 0.41 0.00 0.00 0.00 175.02 175.89 1tj2 n GLY 162 N -0.64 3.86 0.17 -0.03 0.00 -1.26 -5.08 105.19 102.21 1tj2 n GLY 162 Ca -0.05 -0.82 0.01 0.00 0.00 0.00 0.00 46.02 45.15 1tj2 n GLY 162 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1tj2 h VAL 163 N 0.00 1.33 -0.09 1.61 2.07 -2.06 -2.43 116.25 116.67 1tj2 h VAL 163 Ca 0.00 -1.62 -0.00 0.00 0.82 0.00 0.00 66.70 65.90 1tj2 h VAL 163 Cb 0.00 1.87 -0.00 0.00 -1.52 0.00 0.00 31.29 31.64 1tj2 h VAL 163 CO 0.00 0.46 0.05 0.00 0.02 0.00 0.00 177.57 178.10 1tj2 h ALA 164 N 1.53 0.11 -0.73 1.67 0.00 -2.06 -2.67 119.26 117.11 1tj2 h ALA 164 Ca -0.00 -0.05 0.01 0.00 0.00 0.00 0.00 54.91 54.86 1tj2 h ALA 164 Cb 0.84 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 18.55 1tj2 h ALA 164 CO 0.06 -0.35 0.49 1.25 0.00 0.00 0.00 179.25 180.70 1tj2 h LEU 165 N 0.05 0.84 -0.71 0.00 5.85 -1.97 -2.84 115.31 116.53 1tj2 h LEU 165 Ca 0.03 -0.02 -0.13 0.00 0.84 0.00 0.00 57.88 58.60 1tj2 h LEU 165 Cb 0.07 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 40.88 1tj2 h LEU 165 CO -0.01 0.61 -0.42 0.24 -0.34 0.00 0.00 178.44 178.53 1tj2 h MET 166 N 0.99 0.50 -0.23 1.25 2.86 -1.33 0.05 114.93 119.02 1tj2 h MET 166 Ca 0.27 -0.25 -0.06 0.00 -2.06 0.00 0.00 59.70 57.59 1tj2 h MET 166 Cb -0.11 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.54 1tj2 h MET 166 CO -0.06 0.83 -0.13 0.00 1.06 0.00 0.00 176.91 178.61 1tj2 h LEU 168 N 0.36 0.44 -1.46 0.00 7.12 -1.30 -2.41 115.31 118.06 1tj2 h LEU 168 Ca 0.07 -0.74 0.01 0.00 0.13 0.00 0.00 57.88 57.35 1tj2 h LEU 168 Cb 0.45 -0.13 -0.03 0.00 -0.53 0.00 0.00 40.66 40.42 1tj2 h LEU 168 CO 0.03 1.11 0.36 0.00 -0.13 0.00 0.00 178.44 179.81 1tj2 h ALA 169 N 0.33 1.61 -0.09 1.25 0.00 -0.87 -0.75 119.26 120.73 1tj2 h ALA 169 Ca -0.05 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.81 1tj2 h ALA 169 Cb 1.17 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.73 1tj2 h ALA 169 CO 0.09 0.36 0.02 1.49 0.00 0.00 0.00 179.25 181.21 1tj2 h GLU 170 N 0.74 0.16 -0.65 0.00 4.81 -1.02 -1.82 114.58 116.80 1tj2 h GLU 170 Ca 0.20 -0.04 -0.03 0.00 -0.13 0.00 0.00 59.36 59.36 1tj2 h GLU 170 Cb -0.09 -0.02 -0.03 0.00 0.63 0.00 0.00 28.75 29.25 1tj2 h GLU 170 CO -0.04 0.37 0.28 0.00 -0.73 0.00 0.00 179.01 178.88 1tj2 h ALA 171 N 0.78 1.26 -0.49 2.92 0.00 -1.04 -2.06 119.26 120.64 1tj2 h ALA 171 Ca 0.03 -0.16 -0.09 0.00 0.00 0.00 0.00 54.91 54.70 1tj2 h ALA 171 Cb 0.29 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 1tj2 h ALA 171 CO 0.00 0.55 -0.04 -0.07 0.00 0.00 0.00 179.25 179.69 1tj2 h LEU 172 N 0.93 0.82 -0.78 0.00 3.38 -1.08 -2.69 115.31 115.89 1tj2 h LEU 172 Ca 0.22 -0.22 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1tj2 h LEU 172 Cb 0.15 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 40.68 1tj2 h LEU 172 CO -0.02 0.91 0.00 -0.07 0.09 0.00 0.00 178.44 179.34 1tj2 h LEU 173 N 0.77 0.00 -0.39 1.67 3.38 -0.64 -2.50 115.31 117.61 1tj2 h LEU 173 Ca 0.14 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.11 1tj2 h LEU 173 Cb 0.52 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.27 1tj2 h LEU 173 CO 0.03 0.00 -0.07 0.54 0.09 0.00 0.00 178.44 179.03 1tj2 n ARG 174 N -2.61 1.02 -2.50 1.13 1.74 -0.98 -4.74 116.66 109.71 1tj2 n ARG 174 Ca 0.02 -0.39 -0.43 0.00 -0.77 0.00 0.00 57.85 56.29 1tj2 n ARG 174 Cb 0.31 -1.49 -0.02 0.00 -1.02 0.00 0.00 32.46 30.24 1tj2 n ARG 174 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1tj2 s ILE 175 N -2.25 4.36 0.34 0.55 1.01 -0.94 -4.94 121.20 119.32 1tj2 s ILE 175 Ca 0.35 1.61 0.03 0.00 0.00 0.00 0.00 60.65 62.64 1tj2 s ILE 175 Cb 0.21 -4.17 0.18 0.00 0.01 0.00 0.00 42.46 38.68 1tj2 s ILE 175 CO 0.42 -0.29 1.90 -0.65 0.00 0.00 0.00 174.94 176.32 1tj2 h PRO 176 N 8.32 0.60 -5.18 2.79 0.11 -1.89 -3.43 132.00 133.33 1tj2 h PRO 176 Ca -0.24 -0.11 -0.64 0.00 0.11 0.00 0.00 66.00 65.12 1tj2 h PRO 176 Cb 1.09 -0.10 -0.24 0.00 0.11 0.00 0.00 31.00 31.86 1tj2 h PRO 176 CO 1.00 0.57 -0.68 -0.51 -0.21 0.00 0.00 178.00 178.16 1tj2 s ASP 177 N -6.68 4.67 0.44 -2.05 -0.00 -1.26 -5.00 116.67 106.79 1tj2 s ASP 177 Ca -0.08 -0.22 0.16 0.00 -0.00 0.00 0.00 52.55 52.41 1tj2 s ASP 177 Cb 0.16 -1.78 1.08 0.00 -0.00 0.00 0.00 42.92 42.38 1tj2 s ASP 177 CO 0.77 0.10 1.97 0.50 -0.00 0.00 0.00 175.17 178.50 1tj2 h LYS 178 N 7.24 0.35 0.41 8.23 3.64 -1.99 -1.82 116.57 132.63 1tj2 h LYS 178 Ca -0.34 -0.02 -0.02 0.00 -1.27 0.00 0.00 60.65 59.00 1tj2 h LYS 178 Cb 1.18 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 32.93 1tj2 h LYS 178 CO 0.61 0.23 -0.20 0.00 -2.27 0.00 0.00 179.45 177.82 1tj2 h ALA 179 N 1.69 -0.55 -0.58 5.00 0.00 -1.97 0.25 119.26 123.11 1tj2 h ALA 179 Ca 0.29 -0.17 0.07 0.00 0.00 0.00 0.00 54.91 55.10 1tj2 h ALA 179 Cb 0.66 0.21 -0.06 0.00 0.00 0.00 0.00 17.79 18.60 1tj2 h ALA 179 CO -0.08 -0.70 0.25 1.15 0.00 0.00 0.00 179.25 179.88 1tj2 h THR 180 N -0.76 0.86 0.34 0.00 2.02 -1.92 0.84 112.91 114.28 1tj2 h THR 180 Ca -0.06 -0.16 -0.00 0.00 0.77 0.00 0.00 66.41 66.96 1tj2 h THR 180 Cb 0.53 0.35 -0.02 0.00 -1.74 0.00 0.00 68.15 67.26 1tj2 h THR 180 CO 0.09 0.09 -0.33 -0.09 0.37 0.00 0.00 175.52 175.65 1tj2 h ARG 181 N 0.47 -0.67 -0.77 6.66 2.43 -1.04 -1.34 114.38 120.12 1tj2 h ARG 181 Ca 0.28 0.05 0.01 0.00 -0.81 0.00 0.00 59.98 59.50 1tj2 h ARG 181 Cb 0.27 0.15 -0.04 0.00 -0.42 0.00 0.00 29.97 29.94 1tj2 h ARG 181 CO -0.24 -0.44 0.51 -0.44 -1.51 0.00 0.00 179.97 177.84 1tj2 h ASP 182 N -0.69 0.89 -0.23 -3.80 3.32 -0.56 -2.85 116.42 112.49 1tj2 h ASP 182 Ca -0.02 -0.03 -0.01 0.00 0.02 0.00 0.00 57.03 56.99 1tj2 h ASP 182 Cb 0.62 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.94 1tj2 h ASP 182 CO -0.05 0.65 0.11 0.00 -1.72 0.00 0.00 179.24 178.23 1tj2 h ALA 183 N 1.28 1.68 -3.00 3.45 0.00 -0.70 -3.51 119.26 118.46 1tj2 h ALA 183 Ca 0.28 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.11 1tj2 h ALA 183 Cb -0.11 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.56 1tj2 h ALA 183 CO -0.06 0.26 0.00 -0.11 0.00 0.00 0.00 179.25 179.34 1tj2 n LEU 184 N -4.42 0.00 -0.08 0.00 7.94 -0.52 -5.08 117.00 114.84 1tj2 n LEU 184 Ca 0.01 0.00 -0.17 0.00 -1.11 0.00 0.00 56.01 54.74 1tj2 n LEU 184 Cb 0.13 0.00 -0.06 0.00 0.53 0.00 0.00 43.42 44.02 1tj2 n LEU 184 CO 0.36 0.00 -1.00 -0.38 -1.11 0.00 0.00 177.39 175.26 1tj2 n ILE 244 N 0.00 1.05 0.08 1.96 2.08 -1.26 -5.12 119.36 118.16 1tj2 n ILE 244 Ca 0.00 -0.17 0.09 0.00 0.56 0.00 0.00 62.75 63.23 1tj2 n ILE 244 Cb 0.00 -1.80 0.55 0.00 -0.75 0.00 0.00 39.64 37.64 1tj2 n ILE 244 CO 0.00 0.00 0.00 0.03 0.56 0.00 0.00 176.55 177.14 1tj2 h ARG 245 N -0.64 0.26 0.17 0.38 2.47 -2.06 -2.15 114.38 112.80 1tj2 h ARG 245 Ca -0.38 -0.02 -0.31 0.00 -1.26 0.00 0.00 59.98 58.02 1tj2 h ARG 245 Cb 1.27 -0.06 0.03 0.00 -1.65 0.00 0.00 29.97 29.56 1tj2 h ARG 245 CO -0.23 0.17 -1.32 1.57 0.56 0.00 0.00 179.97 180.72 1tj2 h LYS 246 N 0.26 0.54 -0.02 0.04 5.09 -2.05 -2.79 116.57 117.64 1tj2 h LYS 246 Ca 0.13 -0.80 -0.07 0.00 0.09 0.00 0.00 60.65 59.99 1tj2 h LYS 246 Cb 0.18 0.28 -0.01 0.00 0.10 0.00 0.00 32.23 32.78 1tj2 h LYS 246 CO -0.03 1.37 -0.31 0.78 -2.09 0.00 0.00 179.45 179.17 1tj2 h GLY 247 N 0.47 0.05 0.49 0.07 0.00 -1.92 -1.97 103.07 100.26 1tj2 h GLY 247 Ca -0.20 -0.04 -0.01 0.00 0.00 0.00 0.00 47.33 47.08 1tj2 h GLY 247 CO 0.25 0.03 -0.03 -2.08 0.00 0.00 0.00 176.54 174.71 1tj2 h VAL 248 N 0.04 1.43 -0.92 4.60 2.07 -1.48 -2.11 116.25 119.88 1tj2 h VAL 248 Ca 0.00 -1.31 0.01 0.00 0.82 0.00 0.00 66.70 66.22 1tj2 h VAL 248 Cb 0.58 2.28 -0.05 0.00 -1.52 0.00 0.00 31.29 32.58 1tj2 h VAL 248 CO 0.04 0.35 0.60 -0.78 0.02 0.00 0.00 177.57 177.80 1tj2 h ASP 249 N -0.48 1.06 -0.09 0.57 1.82 -1.34 -1.50 116.42 116.46 1tj2 h ASP 249 Ca 0.00 -0.03 -0.09 0.00 -0.39 0.00 0.00 57.03 56.52 1tj2 h ASP 249 Cb 0.58 -0.27 0.00 0.00 0.68 0.00 0.00 39.33 40.33 1tj2 h ASP 249 CO 0.01 0.77 -0.28 -0.03 -1.61 0.00 0.00 179.24 178.10 1tj2 h MET 250 N 1.25 0.34 -0.33 0.28 4.05 -1.41 -2.56 114.93 116.56 1tj2 h MET 250 Ca 0.34 -0.25 -0.02 0.00 -0.28 0.00 0.00 59.70 59.48 1tj2 h MET 250 Cb -0.13 0.04 -0.02 0.00 -0.80 0.00 0.00 31.60 30.69 1tj2 h MET 250 CO -0.07 0.88 0.10 0.00 0.23 0.00 0.00 176.91 178.05 1tj2 h ALA 251 N 0.47 1.57 -0.13 0.39 0.00 -1.26 -1.22 119.26 119.08 1tj2 h ALA 251 Ca -0.01 -0.12 -0.00 0.00 0.00 0.00 0.00 54.91 54.78 1tj2 h ALA 251 Cb 0.91 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.55 1tj2 h ALA 251 CO 0.06 0.33 0.07 1.98 0.00 0.00 0.00 179.25 181.69 1tj2 h MET 252 N 0.47 0.19 -0.62 0.00 -1.53 -1.23 -1.13 114.93 111.08 1tj2 h MET 252 Ca 0.11 -0.02 -0.06 0.00 -3.44 0.00 0.00 59.70 56.29 1tj2 h MET 252 Cb 0.14 -0.04 -0.03 0.00 -0.55 0.00 0.00 31.60 31.13 1tj2 h MET 252 CO -0.01 0.22 0.16 0.00 0.14 0.00 0.00 176.91 177.42 1tj2 h ARG 253 N 0.11 0.95 -0.04 0.39 3.08 -0.99 -1.29 114.38 116.58 1tj2 h ARG 253 Ca 0.05 -0.20 -0.01 0.00 0.07 0.00 0.00 59.98 59.89 1tj2 h ARG 253 Cb 0.09 -0.14 -0.00 0.00 0.08 0.00 0.00 29.97 30.00 1tj2 h ARG 253 CO -0.01 0.84 -0.01 -0.07 -1.07 0.00 0.00 179.97 179.65 1tj2 h LEU 254 N 0.91 0.08 -0.67 3.04 4.07 -1.13 -2.33 115.31 119.29 1tj2 h LEU 254 Ca 0.20 -0.37 -0.08 0.00 0.08 0.00 0.00 57.88 57.71 1tj2 h LEU 254 Cb 0.31 -0.02 -0.01 0.00 1.08 0.00 0.00 40.66 42.01 1tj2 h LEU 254 CO -0.00 0.44 -0.36 0.24 -1.08 0.00 0.00 178.44 177.67 1tj2 h MET 255 N -0.27 0.00 0.00 1.13 2.86 -1.22 -3.31 114.93 114.12 1tj2 h MET 255 Ca 0.01 0.00 -0.13 0.00 -2.06 0.00 0.00 59.70 57.52 1tj2 h MET 255 Cb 0.40 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.04 1tj2 h MET 255 CO 0.00 0.36 -0.83 0.78 1.06 0.00 0.00 176.91 178.29 1tj2 h GLY 256 N 2.57 0.00 0.65 8.32 0.00 -1.13 -3.37 103.07 110.12 1tj2 h GLY 256 Ca -0.00 0.00 0.10 0.00 0.00 0.00 0.00 47.33 47.43 1tj2 h GLY 256 CO 0.05 0.00 0.60 1.05 0.00 0.00 0.00 176.54 178.24 1tj2 h GLU 257 N 0.00 0.93 0.00 4.80 4.11 -1.51 -0.79 114.58 122.11 1tj2 h GLU 257 Ca -0.05 -0.06 -0.01 0.00 0.07 0.00 0.00 59.36 59.31 1tj2 h GLU 257 Cb 1.48 -0.21 -0.00 0.00 0.50 0.00 0.00 28.75 30.52 1tj2 h GLU 257 CO 0.06 0.61 -0.04 -0.56 0.07 0.00 0.00 179.01 179.16 1tj2 h GLN 258 N 0.96 0.00 -0.02 1.06 3.07 -1.83 -2.34 115.11 116.01 1tj2 h GLN 258 Ca 0.44 0.00 0.00 0.00 0.09 0.00 0.00 58.65 59.18 1tj2 h GLN 258 Cb 0.40 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.96 1tj2 h GLN 258 CO -0.20 0.04 -0.13 1.19 0.09 0.00 0.00 178.83 179.81 1tj2 n PHE 259 N -3.78 0.00 -3.94 0.06 3.01 -0.31 -3.87 117.46 108.63 1tj2 n PHE 259 Ca -0.03 0.00 -0.35 0.00 1.01 0.00 0.00 57.45 58.08 1tj2 n PHE 259 Cb 0.13 -0.02 -0.12 0.00 -0.01 0.00 0.00 39.48 39.45 1tj2 n PHE 259 CO 0.00 0.00 0.00 0.08 1.01 0.00 0.00 176.76 177.85 1tj2 s VAL 260 N -2.18 4.12 0.10 -4.37 1.01 -0.88 -4.32 120.40 113.88 1tj2 s VAL 260 Ca 0.29 -0.25 0.01 0.00 0.00 0.00 0.00 61.98 62.03 1tj2 s VAL 260 Cb 0.20 -2.89 -0.25 0.00 0.00 0.00 0.00 36.38 33.44 1tj2 s VAL 260 CO 0.40 0.40 1.20 0.71 0.00 0.00 0.00 175.10 177.81 1tj2 h THR 261 N 5.42 1.60 -2.01 3.92 1.35 -1.49 -3.49 112.91 118.22 1tj2 h THR 261 Ca -0.37 -3.24 0.20 0.00 -0.55 0.00 0.00 66.41 62.46 1tj2 h THR 261 Cb 1.18 2.90 -0.12 0.00 -1.73 0.00 0.00 68.15 70.37 1tj2 h THR 261 CO 0.61 0.93 0.61 -0.83 -0.25 0.00 0.00 175.52 176.59 1tj2 s GLY 262 N -4.68 -0.34 0.08 5.82 0.00 -1.22 -4.57 107.32 102.41 1tj2 s GLY 262 Ca -0.02 0.71 0.00 0.00 0.00 0.00 0.00 44.72 45.41 1tj2 s GLY 262 CO 0.85 0.20 1.15 0.83 0.00 0.00 0.00 173.10 176.13 1tj2 h GLU 263 N 2.00 0.16 -5.12 2.90 4.39 -1.91 -0.69 114.58 116.31 1tj2 h GLU 263 Ca -0.23 -0.28 -0.35 0.00 0.34 0.00 0.00 59.36 58.85 1tj2 h GLU 263 Cb 1.22 0.10 -0.15 0.00 -0.10 0.00 0.00 28.75 29.83 1tj2 h GLU 263 CO 0.27 1.11 -0.71 0.95 -1.16 0.00 0.00 179.01 179.47 1tj2 s THR 264 N -2.67 1.22 0.19 1.13 -4.23 -1.26 -3.37 115.64 106.64 1tj2 s THR 264 Ca -0.03 -2.07 -0.09 0.00 -1.18 0.00 0.00 61.69 58.32 1tj2 s THR 264 Cb 0.08 -1.93 0.08 0.00 1.34 0.00 0.00 72.50 72.08 1tj2 s THR 264 CO 0.86 -0.68 1.66 -0.29 -0.54 0.00 0.00 174.62 175.63 1tj2 h ILE 265 N 2.72 1.27 -0.87 2.99 6.09 -1.94 -2.19 117.51 125.57 1tj2 h ILE 265 Ca -0.37 -1.11 0.06 0.00 -1.37 0.00 0.00 64.86 62.07 1tj2 h ILE 265 Cb 1.20 0.72 -0.06 0.00 0.47 0.00 0.00 36.82 39.15 1tj2 h ILE 265 CO 0.63 0.41 0.57 0.00 -3.07 0.00 0.00 178.15 176.69 1tj2 h ALA 266 N 1.02 1.54 0.06 0.18 0.00 -1.97 0.16 119.26 120.25 1tj2 h ALA 266 Ca 0.19 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.07 1tj2 h ALA 266 Cb 0.51 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.04 1tj2 h ALA 266 CO 0.02 0.33 -0.03 1.49 0.00 0.00 0.00 179.25 181.07 1tj2 h GLU 267 N 0.98 -0.07 -0.37 0.00 4.81 -1.87 -0.90 114.58 117.17 1tj2 h GLU 267 Ca 0.37 0.00 0.07 0.00 -0.13 0.00 0.00 59.36 59.68 1tj2 h GLU 267 Cb 0.20 0.02 -0.06 0.00 0.63 0.00 0.00 28.75 29.53 1tj2 h GLU 267 CO -0.14 0.28 -0.04 0.00 -0.73 0.00 0.00 179.01 178.38 1tj2 h ALA 268 N 0.49 0.30 -0.61 2.92 0.00 -1.18 -2.77 119.26 118.40 1tj2 h ALA 268 Ca -0.01 0.12 -0.09 0.00 0.00 0.00 0.00 54.91 54.94 1tj2 h ALA 268 Cb 0.38 0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.37 1tj2 h ALA 268 CO 0.01 -0.42 0.03 -0.07 0.00 0.00 0.00 179.25 178.80 1tj2 h LEU 269 N 0.06 1.02 -1.96 0.00 3.38 -0.72 -2.61 115.31 114.47 1tj2 h LEU 269 Ca 0.18 -0.27 0.00 0.00 0.09 0.00 0.00 57.88 57.88 1tj2 h LEU 269 Cb 0.26 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 40.74 1tj2 h LEU 269 CO -0.34 1.05 0.00 0.00 0.09 0.00 0.00 178.44 179.24 1tj2 h ALA 270 N 1.06 1.00 -0.65 1.53 0.00 -0.88 -1.33 119.26 119.98 1tj2 h ALA 270 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.09 1tj2 h ALA 270 Cb 0.51 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.30 1tj2 h ALA 270 CO 0.02 0.00 0.00 0.09 0.00 0.00 0.00 179.25 179.36 1tj2 n ASN 271 N -2.91 4.46 0.06 0.00 5.03 -0.99 -4.56 115.26 116.35 1tj2 n ASN 271 Ca -0.01 -2.33 0.03 0.00 0.87 0.00 0.00 54.58 53.14 1tj2 n ASN 271 Cb 0.18 -0.55 -0.05 0.00 -1.02 0.00 0.00 39.78 38.34 1tj2 n ASN 271 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1tj2 h ALA 272 N 4.17 0.63 -0.69 5.41 0.00 -1.25 -3.36 119.26 124.18 1tj2 h ALA 272 Ca 0.00 -0.63 0.07 0.00 0.00 0.00 0.00 54.91 54.36 1tj2 h ALA 272 Cb 1.31 0.18 -0.06 0.00 0.00 0.00 0.00 17.79 19.22 1tj2 h ALA 272 CO 0.18 0.70 0.36 0.07 0.00 0.00 0.00 179.25 180.56 1tj2 h ARG 273 N 0.00 0.63 -0.23 0.00 -0.00 -1.80 -2.40 114.38 110.57 1tj2 h ARG 273 Ca -0.11 -0.04 0.06 0.00 -0.00 0.00 0.00 59.98 59.89 1tj2 h ARG 273 Cb 1.44 -0.14 -0.07 0.00 -0.00 0.00 0.00 29.97 31.20 1tj2 h ARG 273 CO 0.04 0.42 -0.24 -0.22 -0.00 0.00 0.00 179.97 179.97 1tj2 h LYS 274 N 0.65 -0.24 0.00 0.08 3.64 -1.93 -0.63 116.57 118.14 1tj2 h LYS 274 Ca 0.32 0.02 -0.11 0.00 -1.27 0.00 0.00 60.65 59.61 1tj2 h LYS 274 Cb 0.27 0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 32.12 1tj2 h LYS 274 CO -0.22 -0.16 -1.04 -0.07 -2.27 0.00 0.00 179.45 175.69 1tj2 h LEU 275 N -0.25 0.00 -1.73 5.20 3.38 -1.84 -3.32 115.31 116.76 1tj2 h LEU 275 Ca 0.13 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.07 1tj2 h LEU 275 Cb 0.45 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.20 1tj2 h LEU 275 CO -0.38 0.41 -0.14 -0.33 0.09 0.00 0.00 178.44 178.09 1tj2 h GLU 276 N 0.00 0.00 0.00 1.13 5.08 -0.89 -0.52 114.58 119.38 1tj2 h GLU 276 Ca -0.08 0.00 -0.10 0.00 -1.00 0.00 0.00 59.36 58.18 1tj2 h GLU 276 Cb 1.39 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.62 1tj2 h GLU 276 CO 0.04 0.14 -0.46 0.93 -1.00 0.00 0.00 179.01 178.66 1tj2 h GLU 277 N 0.00 0.00 0.00 2.33 5.08 -1.23 -2.84 114.58 117.93 1tj2 h GLU 277 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1tj2 h GLU 277 Cb 0.25 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.50 1tj2 h GLU 277 CO 0.02 0.46 -0.07 1.63 -1.00 0.00 0.00 179.01 180.05 1tj2 n LYS 278 N -3.34 0.02 0.00 2.33 5.02 -0.62 -4.91 118.16 116.66 1tj2 n LYS 278 Ca 0.01 0.01 0.00 0.00 -2.02 0.00 0.00 58.31 56.31 1tj2 n LYS 278 Cb 0.65 -1.52 0.00 0.00 -0.02 0.00 0.00 35.03 34.14 1tj2 n LYS 278 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1tj2 n GLY 279 N 1.49 1.25 3.85 0.72 0.00 -0.96 -4.00 105.19 107.54 1tj2 n GLY 279 Ca 0.07 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.77 1tj2 n GLY 279 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1tj2 s PHE 280 N -2.00 3.48 0.49 1.61 0.40 -0.30 -4.25 117.98 117.41 1tj2 s PHE 280 Ca 0.00 1.43 0.03 0.00 -0.60 0.00 0.00 56.93 57.78 1tj2 s PHE 280 Cb 0.00 -2.78 -0.02 0.00 0.51 0.00 0.00 43.02 40.73 1tj2 s PHE 280 CO 0.00 -0.47 0.04 1.03 0.70 0.00 0.00 175.22 176.52 1tj2 s ARG 281 N -4.35 2.16 0.04 0.44 0.52 -0.32 -4.10 118.95 113.34 1tj2 s ARG 281 Ca 0.58 -2.30 0.03 0.00 -0.52 0.00 0.00 55.73 53.53 1tj2 s ARG 281 Cb -0.10 -1.61 -0.02 0.00 0.52 0.00 0.00 34.95 33.73 1tj2 s ARG 281 CO 0.37 -0.32 -0.10 0.71 0.02 0.00 0.00 175.30 175.99 1tj2 s TYR 282 N -2.83 0.85 -0.19 -0.53 1.51 -1.26 -0.69 117.35 114.21 1tj2 s TYR 282 Ca 0.15 -0.42 0.00 0.00 -1.01 0.00 0.00 57.07 55.79 1tj2 s TYR 282 Cb 0.03 -0.50 0.05 0.00 -0.11 0.00 0.00 41.96 41.42 1tj2 s TYR 282 CO 0.08 -0.03 -0.08 0.45 -1.11 0.00 0.00 175.55 174.87 1tj2 s SER 283 N -1.36 3.27 -0.07 2.29 0.15 0.31 -1.29 113.70 117.00 1tj2 s SER 283 Ca -0.05 -0.86 -0.21 0.00 0.70 0.00 0.00 55.95 55.53 1tj2 s SER 283 Cb -0.09 -1.10 -0.04 0.00 -1.71 0.00 0.00 66.02 63.08 1tj2 s SER 283 CO 0.01 -0.18 0.60 -0.31 1.20 0.00 0.00 173.24 174.56 1tj2 s TYR 284 N 1.49 3.59 -0.35 3.44 1.51 -0.60 -0.44 117.35 125.99 1tj2 s TYR 284 Ca -0.01 1.12 -0.05 0.00 -1.01 0.00 0.00 57.07 57.12 1tj2 s TYR 284 Cb -0.16 -2.67 0.06 0.00 -0.11 0.00 0.00 41.96 39.07 1tj2 s TYR 284 CO -0.08 0.18 0.10 0.34 -1.11 0.00 0.00 175.55 174.99 1tj2 s ASP 285 N 0.48 5.22 -0.51 2.29 3.68 -0.31 -1.26 116.67 126.26 1tj2 s ASP 285 Ca 0.32 -1.33 -0.28 0.00 2.13 0.00 0.00 52.55 53.39 1tj2 s ASP 285 Cb -0.17 -1.83 -0.01 0.00 -1.45 0.00 0.00 42.92 39.46 1tj2 s ASP 285 CO 0.15 -0.36 1.68 -0.04 0.13 0.00 0.00 175.17 176.74 1tj2 s MET 286 N 1.33 3.07 0.40 4.34 -1.94 -1.26 0.20 119.30 125.43 1tj2 s MET 286 Ca -0.01 0.80 -0.26 0.00 -1.71 0.00 0.00 55.69 54.51 1tj2 s MET 286 Cb -0.20 -4.24 -0.11 0.00 2.01 0.00 0.00 34.83 32.29 1tj2 s MET 286 CO 0.01 -2.19 1.27 1.28 -0.01 0.00 0.00 175.02 175.37 1tj2 n LEU 287 N 10.90 3.83 0.00 -0.03 4.77 -0.09 -4.90 117.00 131.49 1tj2 n LEU 287 Ca 0.18 1.14 0.00 0.00 -0.03 0.00 0.00 56.01 57.30 1tj2 n LEU 287 Cb 0.50 -1.49 0.00 0.00 -2.33 0.00 0.00 43.42 40.09 1tj2 n LEU 287 CO 0.70 -0.62 0.00 0.61 -1.33 0.00 0.00 177.39 176.75 1tj2 n GLY 288 N 0.81 4.40 3.81 -0.72 0.00 -1.24 -4.88 105.19 107.36 1tj2 n GLY 288 Ca 0.06 -1.03 -0.08 0.00 0.00 0.00 0.00 46.02 44.97 1tj2 n GLY 288 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1tj2 s GLU 289 N -4.85 1.92 -1.36 1.61 -1.05 -1.26 -4.68 118.70 109.04 1tj2 s GLU 289 Ca 0.00 -1.18 -0.02 0.00 -0.15 0.00 0.00 54.97 53.62 1tj2 s GLU 289 Cb 0.00 0.60 0.01 0.00 -0.44 0.00 0.00 34.13 34.31 1tj2 s GLU 289 CO 0.00 -0.88 0.71 0.00 0.95 0.00 0.00 175.26 176.04 1tj2 n ALA 290 N -0.48 -1.90 -1.66 -0.84 0.00 -1.20 -4.79 120.51 109.64 1tj2 n ALA 290 Ca -0.05 -0.12 -0.51 0.00 0.00 0.00 0.00 53.44 52.76 1tj2 n ALA 290 Cb 0.60 -2.29 -0.06 0.00 0.00 0.00 0.00 19.45 17.70 1tj2 n ALA 290 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1tj2 n ALA 291 N -4.35 0.18 -0.01 0.00 0.00 -0.81 -4.83 120.51 110.68 1tj2 n ALA 291 Ca -0.25 0.42 -0.08 0.00 0.00 0.00 0.00 53.44 53.53 1tj2 n ALA 291 Cb 0.65 -2.27 -0.14 0.00 0.00 0.00 0.00 19.45 17.70 1tj2 n ALA 291 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 1tj2 h LEU 292 N 6.57 0.00 -9.39 0.00 3.38 -1.88 0.84 115.31 114.82 1tj2 h LEU 292 Ca -0.47 0.00 -0.58 0.00 0.09 0.00 0.00 57.88 56.93 1tj2 h LEU 292 Cb 1.30 0.00 -0.14 0.00 0.09 0.00 0.00 40.66 41.91 1tj2 h LEU 292 CO 0.89 0.98 -0.65 0.42 0.09 0.00 0.00 178.44 180.17 1tj2 s THR 293 N -2.62 1.92 0.22 0.22 -4.23 -1.26 -4.20 115.64 105.68 1tj2 s THR 293 Ca -0.04 -2.11 -0.09 0.00 -1.18 0.00 0.00 61.69 58.27 1tj2 s THR 293 Cb 0.08 -2.70 0.17 0.00 1.34 0.00 0.00 72.50 71.39 1tj2 s THR 293 CO 0.82 -0.15 1.86 0.00 -0.54 0.00 0.00 174.62 176.61 1tj2 h ALA 294 N 2.03 1.01 -0.61 3.99 0.00 -1.96 -2.04 119.26 121.68 1tj2 h ALA 294 Ca -0.42 -0.02 -0.07 0.00 0.00 0.00 0.00 54.91 54.39 1tj2 h ALA 294 Cb 1.24 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 18.76 1tj2 h ALA 294 CO 0.72 0.27 0.09 0.00 0.00 0.00 0.00 179.25 180.33 1tj2 h ALA 295 N 1.33 1.01 -0.81 0.00 0.00 -1.99 -1.98 119.26 116.82 1tj2 h ALA 295 Ca 0.31 -0.26 -0.02 0.00 0.00 0.00 0.00 54.91 54.94 1tj2 h ALA 295 Cb 0.04 -0.24 -0.04 0.00 0.00 0.00 0.00 17.79 17.55 1tj2 h ALA 295 CO -0.12 0.63 0.43 -0.44 0.00 0.00 0.00 179.25 179.75 1tj2 h ASP 296 N 0.94 1.02 0.72 0.00 3.45 -1.78 -1.55 116.42 119.22 1tj2 h ASP 296 Ca 0.19 -0.09 -0.19 0.00 0.43 0.00 0.00 57.03 57.36 1tj2 h ASP 296 Cb 0.42 -0.26 -0.02 0.00 -0.56 0.00 0.00 39.33 38.91 1tj2 h ASP 296 CO 0.01 0.83 -0.88 0.00 -1.57 0.00 0.00 179.24 177.63 1tj2 h ALA 297 N 1.33 0.54 -0.10 3.45 0.00 -1.33 -1.99 119.26 121.17 1tj2 h ALA 297 Ca 0.28 -0.75 -0.01 0.00 0.00 0.00 0.00 54.91 54.42 1tj2 h ALA 297 Cb 0.05 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 17.73 1tj2 h ALA 297 CO -0.04 0.99 0.01 0.37 0.00 0.00 0.00 179.25 180.58 1tj2 h GLN 298 N 0.05 0.17 -0.47 0.00 5.75 -1.09 -2.04 115.11 117.48 1tj2 h GLN 298 Ca -0.03 -0.05 -0.04 0.00 -0.15 0.00 0.00 58.65 58.38 1tj2 h GLN 298 Cb 1.52 -0.02 -0.02 0.00 1.07 0.00 0.00 27.48 30.03 1tj2 h GLN 298 CO 0.12 0.40 0.14 0.00 -2.65 0.00 0.00 178.83 176.84 1tj2 h ALA 299 N 0.77 1.36 -0.53 3.38 0.00 -1.17 -1.71 119.26 121.36 1tj2 h ALA 299 Ca 0.03 -0.16 -0.08 0.00 0.00 0.00 0.00 54.91 54.70 1tj2 h ALA 299 Cb 0.31 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 1tj2 h ALA 299 CO 0.00 0.46 0.04 1.88 0.00 0.00 0.00 179.25 181.63 1tj2 h TYR 300 N 0.68 0.99 -0.72 0.00 0.05 -1.33 -1.65 116.97 114.98 1tj2 h TYR 300 Ca 0.16 -0.16 0.10 0.00 0.05 0.00 0.00 58.73 58.88 1tj2 h TYR 300 Cb 0.21 -0.26 -0.07 0.00 1.01 0.00 0.00 36.73 37.62 1tj2 h TYR 300 CO 0.01 0.90 0.36 1.98 -1.05 0.00 0.00 178.16 180.36 1tj2 h MET 301 N 0.79 0.58 -0.08 4.88 4.05 -0.76 -0.35 114.93 124.04 1tj2 h MET 301 Ca 0.16 -0.04 -0.24 0.00 -0.28 0.00 0.00 59.70 59.30 1tj2 h MET 301 Cb 0.48 -0.13 0.01 0.00 -0.80 0.00 0.00 31.60 31.16 1tj2 h MET 301 CO 0.02 0.39 -0.88 0.28 0.23 0.00 0.00 176.91 176.95 1tj2 h VAL 302 N 0.60 1.30 -0.28 -5.77 2.07 -1.10 -1.67 116.25 111.40 1tj2 h VAL 302 Ca 0.36 -2.12 -0.04 0.00 0.82 0.00 0.00 66.70 65.72 1tj2 h VAL 302 Cb 0.40 2.16 -0.02 0.00 -1.52 0.00 0.00 31.29 32.32 1tj2 h VAL 302 CO -0.28 0.66 0.01 -1.28 0.02 0.00 0.00 177.57 176.70 1tj2 h SER 303 N 0.44 0.38 -0.16 0.57 0.87 -0.96 -1.17 113.55 113.53 1tj2 h SER 303 Ca -0.08 -0.06 -0.21 0.00 -1.23 0.00 0.00 61.79 60.22 1tj2 h SER 303 Cb 1.51 -0.10 0.01 0.00 -0.44 0.00 0.00 62.40 63.38 1tj2 h SER 303 CO 0.17 0.44 -0.69 1.88 -0.53 0.00 0.00 176.83 178.11 1tj2 h TYR 304 N 0.41 1.03 0.23 2.24 0.05 -0.82 -1.46 116.97 118.64 1tj2 h TYR 304 Ca 0.09 -0.42 -0.01 0.00 0.05 0.00 0.00 58.73 58.44 1tj2 h TYR 304 Cb 0.25 -0.17 0.00 0.00 1.01 0.00 0.00 36.73 37.82 1tj2 h TYR 304 CO 0.01 1.25 -0.11 1.96 -1.05 0.00 0.00 178.16 180.21 1tj2 h GLN 305 N 0.57 -0.30 -0.37 4.88 4.20 -1.14 -1.66 115.11 121.29 1tj2 h GLN 305 Ca -0.03 0.02 0.08 0.00 0.06 0.00 0.00 58.65 58.78 1tj2 h GLN 305 Cb 1.30 0.07 -0.07 0.00 0.30 0.00 0.00 27.48 29.08 1tj2 h GLN 305 CO 0.14 -0.18 -0.11 0.37 -0.67 0.00 0.00 178.83 178.39 1tj2 h GLN 306 N -0.33 -0.02 -0.98 1.46 4.15 -1.24 -1.97 115.11 116.18 1tj2 h GLN 306 Ca -0.03 0.00 0.04 0.00 0.77 0.00 0.00 58.65 59.43 1tj2 h GLN 306 Cb 0.25 0.00 -0.06 0.00 0.21 0.00 0.00 27.48 27.89 1tj2 h GLN 306 CO 0.05 -0.01 0.64 0.00 -1.93 0.00 0.00 178.83 177.58 1tj2 h ALA 307 N 1.33 1.29 -0.41 3.38 0.00 -1.13 -1.87 119.26 121.85 1tj2 h ALA 307 Ca 0.18 -0.05 -0.13 0.00 0.00 0.00 0.00 54.91 54.92 1tj2 h ALA 307 Cb 0.29 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 1tj2 h ALA 307 CO -0.39 0.53 -0.25 0.82 0.00 0.00 0.00 179.25 179.96 1tj2 h ILE 308 N 1.24 1.27 -0.00 0.00 2.04 -0.78 0.13 117.51 121.40 1tj2 h ILE 308 Ca 0.39 -1.39 0.01 0.00 1.00 0.00 0.00 64.86 64.87 1tj2 h ILE 308 Cb -0.00 1.22 -0.01 0.00 -0.74 0.00 0.00 36.82 37.29 1tj2 h ILE 308 CO -0.12 0.47 -0.05 0.45 0.00 0.00 0.00 178.15 178.89 1tj2 h HIS 309 N 0.72 -0.13 -0.60 1.37 3.86 -0.94 0.43 115.15 119.87 1tj2 h HIS 309 Ca 0.09 0.00 -0.05 0.00 -1.16 0.00 0.00 60.37 59.26 1tj2 h HIS 309 Cb 0.79 0.06 -0.03 0.00 1.06 0.00 0.00 27.41 29.29 1tj2 h HIS 309 CO 0.04 -0.08 0.18 0.00 0.86 0.00 0.00 177.93 178.93 1tj2 h ALA 310 N 0.91 0.78 -0.24 2.45 0.00 -1.01 -1.34 119.26 120.80 1tj2 h ALA 310 Ca 0.02 -0.21 -0.12 0.00 0.00 0.00 0.00 54.91 54.61 1tj2 h ALA 310 Cb 0.12 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 17.68 1tj2 h ALA 310 CO -0.06 0.46 -0.30 0.82 0.00 0.00 0.00 179.25 180.17 1tj2 h ILE 311 N 0.85 1.31 -0.03 0.00 2.04 -0.68 -1.47 117.51 119.53 1tj2 h ILE 311 Ca 0.19 -1.48 -0.08 0.00 1.00 0.00 0.00 64.86 64.49 1tj2 h ILE 311 Cb 0.30 1.70 -0.01 0.00 -0.74 0.00 0.00 36.82 38.06 1tj2 h ILE 311 CO -0.00 0.47 -0.36 1.23 0.00 0.00 0.00 178.15 179.48 1tj2 h GLY 312 N 0.34 0.07 1.29 5.37 0.00 -0.85 0.69 103.07 109.98 1tj2 h GLY 312 Ca 0.03 -0.06 -0.26 0.00 0.00 0.00 0.00 47.33 47.05 1tj2 h GLY 312 CO 0.07 0.05 -1.02 0.50 0.00 0.00 0.00 176.54 176.14 1tj2 h LYS 313 N 0.06 0.64 -0.09 4.80 1.57 -1.15 -2.47 116.57 119.92 1tj2 h LYS 313 Ca 0.00 -0.69 -0.12 0.00 -1.87 0.00 0.00 60.65 57.97 1tj2 h LYS 313 Cb 0.67 0.20 -0.01 0.00 0.08 0.00 0.00 32.23 33.17 1tj2 h LYS 313 CO 0.05 1.28 -0.50 0.00 -0.57 0.00 0.00 179.45 179.71 1tj2 h ALA 314 N 0.48 0.99 -0.38 3.86 0.00 -0.84 -3.12 119.26 120.25 1tj2 h ALA 314 Ca -0.12 -0.47 -0.01 0.00 0.00 0.00 0.00 54.91 54.31 1tj2 h ALA 314 Cb 1.67 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 19.36 1tj2 h ALA 314 CO 0.20 0.66 0.20 1.03 0.00 0.00 0.00 179.25 181.33 1tj2 h SER 315 N 0.18 0.48 -6.05 0.00 0.87 0.43 -3.47 113.55 105.99 1tj2 h SER 315 Ca 0.01 -0.10 -0.43 0.00 -1.23 0.00 0.00 61.79 60.04 1tj2 h SER 315 Cb 0.95 -0.12 0.06 0.00 -0.44 0.00 0.00 62.40 62.85 1tj2 h SER 315 CO 0.08 0.44 -0.73 -3.20 -0.53 0.00 0.00 176.83 172.89 1tj2 n ASN 316 N -4.74 -5.11 0.00 6.23 4.05 -0.94 -2.18 115.26 112.57 1tj2 n ASN 316 Ca -0.00 -0.67 0.00 0.00 0.45 0.00 0.00 54.58 54.36 1tj2 n ASN 316 Cb 0.09 -4.47 0.00 0.00 1.23 0.00 0.00 39.78 36.62 1tj2 n ASN 316 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1tj2 n GLY 317 N -1.80 0.85 0.34 8.20 0.00 -1.26 -4.94 105.19 106.58 1tj2 n GLY 317 Ca -0.01 0.00 0.23 0.00 0.00 0.00 0.00 46.02 46.23 1tj2 n GLY 317 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1tj2 h ARG 318 N 3.90 0.00 0.00 1.61 3.08 -1.77 -3.48 114.38 117.72 1tj2 h ARG 318 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1tj2 h ARG 318 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.05 1tj2 h ARG 318 CO 0.00 0.00 0.00 0.41 -1.07 0.00 0.00 179.97 179.31 1tj2 n GLY 319 N -1.08 -2.79 0.22 0.04 0.00 -1.25 -3.68 105.19 96.64 1tj2 n GLY 319 Ca -0.03 -1.71 0.10 0.00 0.00 0.00 0.00 46.02 44.38 1tj2 n GLY 319 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 173.32 173.48 1tj2 h ILE 320 N 0.00 0.39 0.00 -0.61 3.07 -1.85 -0.37 117.51 118.14 1tj2 h ILE 320 Ca 0.00 -1.18 -0.09 0.00 1.55 0.00 0.00 64.86 65.14 1tj2 h ILE 320 Cb 0.00 1.89 -0.01 0.00 -0.27 0.00 0.00 36.82 38.43 1tj2 h ILE 320 CO 0.00 0.18 -0.72 1.88 -1.05 0.00 0.00 178.15 178.44 1tj2 h TYR 321 N 0.00 0.00 0.13 0.16 -1.99 -1.92 -3.41 116.97 109.93 1tj2 h TYR 321 Ca -0.00 0.00 -0.29 0.00 2.00 0.00 0.00 58.73 60.44 1tj2 h TYR 321 Cb 0.87 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.60 1tj2 h TYR 321 CO 0.00 0.61 -1.36 0.93 -0.00 0.00 0.00 178.16 178.33 1tj2 h GLU 322 N -1.00 0.27 -7.29 4.88 4.39 -1.70 -3.47 114.58 110.66 1tj2 h GLU 322 Ca -0.13 -0.46 -0.50 0.00 0.34 0.00 0.00 59.36 58.61 1tj2 h GLU 322 Cb 0.79 0.17 0.06 0.00 -0.10 0.00 0.00 28.75 29.67 1tj2 h GLU 322 CO -0.08 1.18 0.34 0.20 -1.16 0.00 0.00 179.01 179.48 1tj2 s GLY 323 N -4.77 1.62 0.72 -3.84 0.00 -0.15 -4.86 107.32 96.03 1tj2 s GLY 323 Ca -0.06 -0.31 -0.14 0.00 0.00 0.00 0.00 44.72 44.21 1tj2 s GLY 323 CO 0.87 -0.03 1.15 2.56 0.00 0.00 0.00 173.10 177.65 1tj2 s PRO 324 N -5.13 2.34 0.21 2.90 0.04 -1.26 -4.74 135.00 129.34 1tj2 s PRO 324 Ca 0.54 1.52 0.02 0.00 0.04 0.00 0.00 61.00 63.13 1tj2 s PRO 324 Cb -0.11 -1.88 -0.01 0.00 0.04 0.00 0.00 34.50 32.54 1tj2 s PRO 324 CO 0.51 -1.64 0.06 0.41 0.04 0.00 0.00 177.00 176.38 1tj2 n GLY 325 N -0.18 3.70 3.30 0.56 0.00 -0.41 -4.16 105.19 108.01 1tj2 n GLY 325 Ca 0.12 -2.05 -0.24 0.00 0.00 0.00 0.00 46.02 43.84 1tj2 n GLY 325 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1tj2 s ILE 326 N -2.25 1.77 -0.07 -0.61 2.07 0.14 -1.55 121.20 120.70 1tj2 s ILE 326 Ca 0.09 -1.61 0.05 0.00 -1.41 0.00 0.00 60.65 57.77 1tj2 s ILE 326 Cb 0.00 -1.62 -0.01 0.00 0.13 0.00 0.00 42.46 40.96 1tj2 s ILE 326 CO 0.06 -0.08 -0.22 -0.44 -1.91 0.00 0.00 174.94 172.35 1tj2 s SER 327 N -2.02 3.32 0.09 4.50 0.01 -0.39 -0.86 113.70 118.36 1tj2 s SER 327 Ca 0.08 -0.44 0.07 0.00 1.31 0.00 0.00 55.95 56.97 1tj2 s SER 327 Cb -0.09 -0.94 -0.03 0.00 0.21 0.00 0.00 66.02 65.16 1tj2 s SER 327 CO 0.05 0.25 -0.18 0.27 0.41 0.00 0.00 173.24 174.03 1tj2 s ILE 328 N -0.18 1.50 -0.23 1.44 -4.36 -0.03 -4.28 121.20 115.06 1tj2 s ILE 328 Ca -0.02 -1.48 -0.05 0.00 -0.26 0.00 0.00 60.65 58.83 1tj2 s ILE 328 Cb -0.14 -1.40 -0.01 0.00 1.25 0.00 0.00 42.46 42.16 1tj2 s ILE 328 CO 0.04 -0.13 0.00 -0.54 0.24 0.00 0.00 174.94 174.54 1tj2 s LYS 329 N -1.90 3.46 0.51 0.37 1.02 -1.26 -0.73 119.74 121.21 1tj2 s LYS 329 Ca 0.04 -0.58 0.20 0.00 0.02 0.00 0.00 55.97 55.64 1tj2 s LYS 329 Cb -0.10 -3.13 1.28 0.00 -0.52 0.00 0.00 37.83 35.36 1tj2 s LYS 329 CO 0.04 -0.20 2.05 -0.07 -0.92 0.00 0.00 175.35 176.25 1tj2 h LEU 330 N 8.16 0.06 -1.93 3.17 3.38 -1.98 -1.31 115.31 124.87 1tj2 h LEU 330 Ca -0.40 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.55 1tj2 h LEU 330 Cb 1.16 -0.01 -0.00 0.00 0.09 0.00 0.00 40.66 41.90 1tj2 h LEU 330 CO 0.59 0.04 -0.12 0.77 0.09 0.00 0.00 178.44 179.82 1tj2 h SER 331 N 0.07 0.00 1.29 -0.43 4.64 -1.94 -1.27 113.55 115.91 1tj2 h SER 331 Ca 0.16 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.48 1tj2 h SER 331 Cb 0.53 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.62 1tj2 h SER 331 CO -0.01 0.12 0.00 0.00 -0.87 0.00 0.00 176.83 176.06 1tj2 h ALA 332 N 1.88 1.00 0.00 5.18 0.00 -1.50 -2.15 119.26 123.67 1tj2 h ALA 332 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1tj2 h ALA 332 Cb 0.29 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.08 1tj2 h ALA 332 CO 0.02 0.00 -1.15 1.28 0.00 0.00 0.00 179.25 179.39 1tj2 n LEU 333 N -2.76 0.80 -3.86 0.00 4.77 -0.48 -4.35 117.00 111.11 1tj2 n LEU 333 Ca 0.03 -0.38 -0.17 0.00 -0.03 0.00 0.00 56.01 55.45 1tj2 n LEU 333 Cb 0.37 -0.01 -0.16 0.00 -2.33 0.00 0.00 43.42 41.29 1tj2 n LEU 333 CO 0.28 0.20 -0.39 -2.28 -1.33 0.00 0.00 177.39 173.87 1tj2 s HIS 334 N -3.09 0.46 0.21 -1.77 2.46 -1.22 -4.77 115.29 107.56 1tj2 s HIS 334 Ca 0.05 -0.07 -0.31 0.00 0.47 0.00 0.00 55.06 55.20 1tj2 s HIS 334 Cb 0.16 -0.45 -0.10 0.00 -0.13 0.00 0.00 32.58 32.05 1tj2 s HIS 334 CO 0.87 -0.12 1.52 -1.25 -2.47 0.00 0.00 174.74 173.28 1tj2 s PRO 335 N 0.77 4.23 -1.45 2.88 0.04 -1.26 -2.83 135.00 137.38 1tj2 s PRO 335 Ca -0.09 2.35 -0.11 0.00 0.04 0.00 0.00 61.00 63.19 1tj2 s PRO 335 Cb -0.12 -3.13 0.05 0.00 0.04 0.00 0.00 34.50 31.35 1tj2 s PRO 335 CO -0.01 -0.53 1.06 0.54 0.04 0.00 0.00 177.00 178.10 1tj2 n ARG 336 N 3.17 -6.52 -0.32 4.56 5.12 0.29 -4.83 116.66 118.12 1tj2 n ARG 336 Ca 0.10 0.69 0.20 0.00 -1.93 0.00 0.00 57.85 56.92 1tj2 n ARG 336 Cb 0.39 -5.65 0.41 0.00 -1.16 0.00 0.00 32.46 26.45 1tj2 n ARG 336 CO 0.00 0.00 0.00 -0.92 -1.93 0.00 0.00 177.63 174.78 1tj2 h TYR 337 N -2.33 0.73 -0.86 -1.55 3.20 -1.73 -1.93 116.97 112.50 1tj2 h TYR 337 Ca -0.58 0.04 0.21 0.00 3.14 0.00 0.00 58.73 61.54 1tj2 h TYR 337 Cb 1.37 -0.16 -0.06 0.00 1.54 0.00 0.00 36.73 39.42 1tj2 h TYR 337 CO 0.54 -0.19 0.58 0.66 -1.64 0.00 0.00 178.16 178.11 1tj2 h SER 338 N 0.29 0.30 -0.13 -2.11 4.64 -1.90 -1.40 113.55 113.24 1tj2 h SER 338 Ca 0.67 0.03 0.00 0.00 -0.47 0.00 0.00 61.79 62.02 1tj2 h SER 338 Cb 1.48 -0.03 0.00 0.00 -0.31 0.00 0.00 62.40 63.54 1tj2 h SER 338 CO -0.63 0.12 0.00 0.54 -0.87 0.00 0.00 176.83 176.00 1tj2 n ARG 339 N -4.45 2.70 -2.02 4.77 1.74 -0.76 -4.97 116.66 113.66 1tj2 n ARG 339 Ca 0.18 -1.65 -0.40 0.00 -0.77 0.00 0.00 57.85 55.22 1tj2 n ARG 339 Cb 0.73 -1.10 -0.01 0.00 -1.02 0.00 0.00 32.46 31.06 1tj2 n ARG 339 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1tj2 s ALA 340 N -0.95 3.33 0.39 7.54 0.00 -0.53 -5.00 121.76 126.53 1tj2 s ALA 340 Ca 0.09 1.29 -0.07 0.00 0.00 0.00 0.00 51.96 53.27 1tj2 s ALA 340 Cb 0.05 -3.51 -0.05 0.00 0.00 0.00 0.00 23.12 19.61 1tj2 s ALA 340 CO 0.06 -0.85 0.70 -0.65 0.00 0.00 0.00 175.76 175.02 1tj2 s GLN 341 N -2.17 3.66 0.25 0.00 -1.52 -1.26 -4.95 119.66 113.68 1tj2 s GLN 341 Ca 0.55 0.22 -0.03 0.00 -1.95 0.00 0.00 55.36 54.15 1tj2 s GLN 341 Cb -0.40 -2.48 0.52 0.00 -0.22 0.00 0.00 33.01 30.43 1tj2 s GLN 341 CO 0.52 0.00 1.67 -0.92 -0.25 0.00 0.00 175.29 176.31 1tj2 h TYR 342 N 1.08 0.28 -0.26 0.91 3.20 -2.00 -2.29 116.97 117.90 1tj2 h TYR 342 Ca -0.47 0.05 -0.20 0.00 3.14 0.00 0.00 58.73 61.25 1tj2 h TYR 342 Cb 1.19 -0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.46 1tj2 h TYR 342 CO 0.59 -0.12 -0.61 -0.44 -1.64 0.00 0.00 178.16 175.94 1tj2 h ASP 343 N 0.25 0.97 0.23 -2.11 3.45 -1.99 -2.34 116.42 114.88 1tj2 h ASP 343 Ca 0.45 -0.55 -0.09 0.00 0.43 0.00 0.00 57.03 57.26 1tj2 h ASP 343 Cb 0.80 -0.28 -0.01 0.00 -0.56 0.00 0.00 39.33 39.27 1tj2 h ASP 343 CO -0.55 1.35 -0.36 0.03 -1.57 0.00 0.00 179.24 178.14 1tj2 h ARG 344 N 0.64 0.19 -0.04 3.56 2.47 -1.90 -2.26 114.38 117.04 1tj2 h ARG 344 Ca -0.00 -0.08 -0.03 0.00 -1.26 0.00 0.00 59.98 58.62 1tj2 h ARG 344 Cb 1.22 -0.01 0.00 0.00 -1.65 0.00 0.00 29.97 29.53 1tj2 h ARG 344 CO 0.13 0.53 -0.07 0.28 0.56 0.00 0.00 179.97 181.39 1tj2 h VAL 345 N 0.16 1.43 -0.51 2.04 2.07 -1.21 -1.25 116.25 118.98 1tj2 h VAL 345 Ca 0.02 -1.38 -0.00 0.00 0.82 0.00 0.00 66.70 66.16 1tj2 h VAL 345 Cb 0.71 2.25 -0.03 0.00 -1.52 0.00 0.00 31.29 32.71 1tj2 h VAL 345 CO 0.05 0.37 0.32 0.24 0.02 0.00 0.00 177.57 178.57 1tj2 h MET 346 N -0.40 0.68 -0.19 1.57 2.86 -1.46 0.42 114.93 118.41 1tj2 h MET 346 Ca 0.00 -0.05 -0.19 0.00 -2.06 0.00 0.00 59.70 57.40 1tj2 h MET 346 Cb 0.64 -0.15 0.01 0.00 0.06 0.00 0.00 31.60 32.16 1tj2 h MET 346 CO 0.02 0.47 -0.62 0.93 1.06 0.00 0.00 176.91 178.77 1tj2 h GLU 347 N 0.69 0.75 0.00 1.72 5.08 -1.30 -3.36 114.58 118.17 1tj2 h GLU 347 Ca 0.18 -0.55 -0.18 0.00 -1.00 0.00 0.00 59.36 57.81 1tj2 h GLU 347 Cb -0.04 0.10 -0.03 0.00 0.50 0.00 0.00 28.75 29.28 1tj2 h GLU 347 CO -0.04 1.17 -1.60 0.39 -1.00 0.00 0.00 179.01 177.94 1tj2 n GLU 348 N -4.05 0.23 0.11 2.33 1.02 -0.48 -4.55 120.64 115.24 1tj2 n GLU 348 Ca -0.07 0.10 -0.13 0.00 -0.02 0.00 0.00 57.16 57.04 1tj2 n GLU 348 Cb 0.66 -0.88 -0.08 0.00 -0.02 0.00 0.00 31.44 31.12 1tj2 n GLU 348 CO 0.00 0.00 0.00 1.25 1.18 0.00 0.00 177.13 179.56 1tj2 h LEU 349 N -0.38 -0.25 -0.48 -4.62 6.46 -0.34 -3.30 115.31 112.40 1tj2 h LEU 349 Ca -0.27 -0.23 0.10 0.00 -0.12 0.00 0.00 57.88 57.36 1tj2 h LEU 349 Cb 1.24 0.06 -0.09 0.00 -0.73 0.00 0.00 40.66 41.14 1tj2 h LEU 349 CO -0.16 0.12 -0.14 0.22 -0.62 0.00 0.00 178.44 177.85 1tj2 h TYR 350 N -0.65 -0.31 -0.70 1.25 5.03 -1.36 0.72 116.97 120.95 1tj2 h TYR 350 Ca -0.03 0.05 0.11 0.00 2.58 0.00 0.00 58.73 61.43 1tj2 h TYR 350 Cb 0.46 0.21 -0.05 0.00 1.55 0.00 0.00 36.73 38.91 1tj2 h TYR 350 CO 0.03 -0.23 0.46 -1.35 -1.32 0.00 0.00 178.16 175.76 1tj2 h PRO 351 N -0.02 0.50 -0.30 1.82 0.11 -1.76 -0.19 132.00 132.14 1tj2 h PRO 351 Ca 0.23 -0.03 -0.17 0.00 0.11 0.00 0.00 66.00 66.14 1tj2 h PRO 351 Cb 0.38 -0.11 -0.00 0.00 0.11 0.00 0.00 31.00 31.37 1tj2 h PRO 351 CO -0.51 0.33 -0.50 0.00 -0.21 0.00 0.00 178.00 177.11 1tj2 h ARG 352 N 0.51 0.84 0.16 1.05 3.08 -0.96 -1.97 114.38 117.09 1tj2 h ARG 352 Ca 0.33 -0.51 -0.01 0.00 0.07 0.00 0.00 59.98 59.86 1tj2 h ARG 352 Cb 0.58 0.05 0.00 0.00 0.08 0.00 0.00 29.97 30.68 1tj2 h ARG 352 CO -0.11 1.14 -0.08 1.25 -1.07 0.00 0.00 179.97 181.11 1tj2 h LEU 353 N 0.66 -0.18 -0.61 3.04 5.85 -0.82 -1.54 115.31 121.70 1tj2 h LEU 353 Ca 0.03 -0.08 0.12 0.00 0.84 0.00 0.00 57.88 58.79 1tj2 h LEU 353 Cb 1.10 0.05 -0.10 0.00 0.37 0.00 0.00 40.66 42.07 1tj2 h LEU 353 CO 0.11 -0.03 0.06 0.50 -0.34 0.00 0.00 178.44 178.74 1tj2 h LYS 354 N -0.32 0.17 -0.30 1.25 3.64 -1.08 -1.22 116.57 118.71 1tj2 h LYS 354 Ca -0.02 -0.01 -0.04 0.00 -1.27 0.00 0.00 60.65 59.31 1tj2 h LYS 354 Cb 0.25 -0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 32.02 1tj2 h LYS 354 CO 0.04 0.11 0.05 1.03 -2.27 0.00 0.00 179.45 178.41 1tj2 h SER 355 N 0.17 0.48 -0.48 4.20 0.87 -1.22 -1.39 113.55 116.19 1tj2 h SER 355 Ca 0.32 -0.26 -0.02 0.00 -1.23 0.00 0.00 61.79 60.61 1tj2 h SER 355 Cb 0.51 -0.13 -0.03 0.00 -0.44 0.00 0.00 62.40 62.32 1tj2 h SER 355 CO -0.48 0.62 0.24 -0.07 -0.53 0.00 0.00 176.83 176.61 1tj2 h LEU 356 N 0.33 0.66 -0.13 2.23 3.38 -0.96 -2.52 115.31 118.29 1tj2 h LEU 356 Ca 0.09 -0.06 -0.11 0.00 0.09 0.00 0.00 57.88 57.89 1tj2 h LEU 356 Cb 0.34 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 40.92 1tj2 h LEU 356 CO 0.01 0.57 -0.34 0.74 0.09 0.00 0.00 178.44 179.50 1tj2 h THR 357 N 0.73 1.37 -0.66 0.22 2.02 -0.94 -0.92 112.91 114.73 1tj2 h THR 357 Ca 0.18 -1.63 0.06 0.00 0.77 0.00 0.00 66.41 65.79 1tj2 h THR 357 Cb 0.09 2.07 -0.06 0.00 -1.74 0.00 0.00 68.15 68.52 1tj2 h THR 357 CO -0.02 0.49 0.36 -0.07 0.37 0.00 0.00 175.52 176.64 1tj2 h LEU 358 N 0.06 0.52 -0.33 2.58 3.38 -1.20 -0.52 115.31 119.79 1tj2 h LEU 358 Ca -0.01 0.03 0.01 0.00 0.09 0.00 0.00 57.88 58.00 1tj2 h LEU 358 Cb 0.95 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 41.62 1tj2 h LEU 358 CO 0.07 0.33 0.21 0.25 0.09 0.00 0.00 178.44 179.40 1tj2 h LEU 359 N 0.65 0.36 -1.44 1.67 5.85 -1.31 -1.50 115.31 119.60 1tj2 h LEU 359 Ca 0.30 -0.01 0.02 0.00 0.84 0.00 0.00 57.88 59.03 1tj2 h LEU 359 Cb 0.21 -0.09 -0.03 0.00 0.37 0.00 0.00 40.66 41.12 1tj2 h LEU 359 CO -0.19 0.26 0.39 0.00 -0.34 0.00 0.00 178.44 178.56 1tj2 h ALA 360 N 1.12 1.62 -0.12 1.25 0.00 -0.54 -1.29 119.26 121.30 1tj2 h ALA 360 Ca 0.12 -0.04 -0.11 0.00 0.00 0.00 0.00 54.91 54.88 1tj2 h ALA 360 Cb -0.04 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.51 1tj2 h ALA 360 CO -0.03 0.33 -0.43 -0.09 0.00 0.00 0.00 179.25 179.04 1tj2 h ARG 361 N 0.76 0.28 -0.50 0.00 1.12 -0.73 -0.30 114.38 115.00 1tj2 h ARG 361 Ca 0.22 -0.14 -0.04 0.00 -1.11 0.00 0.00 59.98 58.92 1tj2 h ARG 361 Cb -0.02 0.00 -0.02 0.00 -0.01 0.00 0.00 29.97 29.91 1tj2 h ARG 361 CO -0.05 0.66 0.16 1.96 -3.11 0.00 0.00 179.97 179.59 1tj2 h GLN 362 N 0.23 0.74 -0.02 0.20 4.20 -0.19 -2.11 115.11 118.17 1tj2 h GLN 362 Ca 0.02 -0.13 0.00 0.00 0.06 0.00 0.00 58.65 58.60 1tj2 h GLN 362 Cb 0.85 -0.12 0.00 0.00 0.30 0.00 0.00 27.48 28.51 1tj2 h GLN 362 CO 0.07 0.64 -0.07 0.66 -0.67 0.00 0.00 178.83 179.46 1tj2 n TYR 363 N -4.32 0.00 -3.83 2.96 4.02 -1.05 -4.97 117.16 109.97 1tj2 n TYR 363 Ca 0.04 0.00 -0.29 0.00 -0.01 0.00 0.00 57.90 57.64 1tj2 n TYR 363 Cb 0.19 -0.02 0.01 0.00 -0.02 0.00 0.00 39.34 39.49 1tj2 n TYR 363 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 176.86 172.38 1tj2 n ASP 364 N 0.14 -2.61 -4.47 7.72 2.03 -0.25 -4.58 116.55 114.53 1tj2 n ASP 364 Ca 0.17 -1.02 -0.29 0.00 0.52 0.00 0.00 54.79 54.17 1tj2 n ASP 364 Cb 0.39 -3.16 -0.11 0.00 -0.72 0.00 0.00 41.12 37.51 1tj2 n ASP 364 CO 0.00 0.00 0.00 0.27 -1.92 0.00 0.00 177.20 175.55 1tj2 s ILE 365 N -3.72 2.73 0.34 5.18 -4.36 -0.46 -3.46 121.20 117.45 1tj2 s ILE 365 Ca 0.22 -1.62 -0.29 0.00 -0.26 0.00 0.00 60.65 58.71 1tj2 s ILE 365 Cb -0.08 -2.26 -0.10 0.00 1.25 0.00 0.00 42.46 41.26 1tj2 s ILE 365 CO 0.88 0.05 1.32 -0.83 0.24 0.00 0.00 174.94 176.60 1tj2 s GLY 366 N -2.26 3.00 -0.18 6.27 0.00 -1.26 -4.48 107.32 108.41 1tj2 s GLY 366 Ca 0.18 1.29 -0.01 0.00 0.00 0.00 0.00 44.72 46.18 1tj2 s GLY 366 CO 0.10 1.94 -0.03 -1.50 0.00 0.00 0.00 173.10 173.60 1tj2 s ILE 367 N -1.14 1.06 -0.15 0.90 2.07 -0.75 -0.68 121.20 122.50 1tj2 s ILE 367 Ca 0.49 -0.71 -0.06 0.00 -1.41 0.00 0.00 60.65 58.97 1tj2 s ILE 367 Cb -0.40 -1.31 -0.04 0.00 0.13 0.00 0.00 42.46 40.84 1tj2 s ILE 367 CO 0.54 0.02 0.05 0.21 -1.91 0.00 0.00 174.94 173.85 1tj2 s ASN 368 N 1.64 5.55 -0.44 4.50 3.84 -0.04 -0.49 114.94 129.49 1tj2 s ASN 368 Ca -0.01 0.12 -0.19 0.00 0.21 0.00 0.00 52.86 52.99 1tj2 s ASN 368 Cb -0.16 -1.85 0.03 0.00 -0.55 0.00 0.00 41.25 38.72 1tj2 s ASN 368 CO -0.07 0.25 0.57 -0.63 -2.79 0.00 0.00 177.10 174.43 1tj2 s ILE 369 N -0.09 4.92 0.50 -5.21 1.01 -0.13 -0.85 121.20 121.35 1tj2 s ILE 369 Ca 0.06 -0.14 -0.22 0.00 0.00 0.00 0.00 60.65 60.35 1tj2 s ILE 369 Cb -0.12 -4.17 -0.06 0.00 0.01 0.00 0.00 42.46 38.12 1tj2 s ILE 369 CO 0.01 -0.58 1.24 -1.81 0.00 0.00 0.00 174.94 173.81 1tj2 s ASP 370 N 2.05 5.76 -0.01 3.58 -0.00 0.09 -1.94 116.67 126.20 1tj2 s ASP 370 Ca 0.18 2.48 -0.17 0.00 -0.00 0.00 0.00 52.55 55.04 1tj2 s ASP 370 Cb -0.16 -2.61 -0.06 0.00 -0.00 0.00 0.00 42.92 40.09 1tj2 s ASP 370 CO 0.16 -1.21 0.48 0.00 -0.00 0.00 0.00 175.17 174.60 1tj2 s ALA 371 N -1.46 3.59 0.00 5.23 0.00 -1.26 -4.67 121.76 123.19 1tj2 s ALA 371 Ca 0.68 -0.12 0.00 0.00 0.00 0.00 0.00 51.96 52.51 1tj2 s ALA 371 Cb -0.33 -2.55 0.00 0.00 0.00 0.00 0.00 23.12 20.24 1tj2 s ALA 371 CO 0.39 0.31 0.00 0.39 0.00 0.00 0.00 175.76 176.85 1tj2 n GLU 372 N 2.34 1.01 -2.00 0.00 1.02 -1.26 -4.95 120.64 116.80 1tj2 n GLU 372 Ca -0.11 0.00 -0.34 0.00 -0.02 0.00 0.00 57.16 56.70 1tj2 n GLU 372 Cb 0.52 0.00 0.02 0.00 -0.02 0.00 0.00 31.44 31.96 1tj2 n GLU 372 CO 0.00 0.00 0.00 -1.83 1.18 0.00 0.00 177.13 176.48 1tj2 s GLU 373 N 4.34 3.11 0.46 3.49 1.03 -1.26 -4.93 118.70 124.94 1tj2 s GLU 373 Ca 0.00 1.41 0.23 0.00 0.03 0.00 0.00 54.97 56.64 1tj2 s GLU 373 Cb 0.00 -1.99 1.08 0.00 -0.80 0.00 0.00 34.13 32.42 1tj2 s GLU 373 CO 0.00 -1.00 1.92 0.66 -1.33 0.00 0.00 175.26 175.50 1tj2 h SER 374 N 0.52 0.00 0.40 0.83 4.64 -1.99 -2.28 113.55 115.67 1tj2 h SER 374 Ca -0.48 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.84 1tj2 h SER 374 Cb 1.24 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.33 1tj2 h SER 374 CO 0.56 0.22 0.00 -0.90 -0.87 0.00 0.00 176.83 175.84 1tj2 n ASP 375 N -3.61 0.00 -0.48 4.97 3.85 -1.26 -2.22 116.55 117.80 1tj2 n ASP 375 Ca -0.01 -0.23 0.11 0.00 -0.71 0.00 0.00 54.79 53.96 1tj2 n ASP 375 Cb 0.36 -0.23 0.04 0.00 -1.35 0.00 0.00 41.12 39.94 1tj2 n ASP 375 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.20 176.73 1tj2 n ARG 376 N -1.23 1.20 -0.09 0.11 5.12 -0.86 -4.58 116.66 116.34 1tj2 n ARG 376 Ca 0.14 -0.97 -0.06 0.00 -1.93 0.00 0.00 57.85 55.02 1tj2 n ARG 376 Cb 0.18 -1.48 -0.00 0.00 -1.16 0.00 0.00 32.46 30.00 1tj2 n ARG 376 CO 0.00 0.00 0.00 1.25 -1.93 0.00 0.00 177.63 176.95 1tj2 h LEU 377 N 2.37 -0.28 -0.31 0.55 5.85 -1.54 -2.19 115.31 119.76 1tj2 h LEU 377 Ca 0.00 0.09 0.02 0.00 0.84 0.00 0.00 57.88 58.83 1tj2 h LEU 377 Cb 0.74 0.19 -0.02 0.00 0.37 0.00 0.00 40.66 41.93 1tj2 h LEU 377 CO 0.00 -0.10 0.16 -0.33 -0.34 0.00 0.00 178.44 177.84 1tj2 h GLU 378 N 0.01 0.33 -0.22 1.25 4.39 -1.81 -1.44 114.58 117.09 1tj2 h GLU 378 Ca 0.15 -0.02 -0.10 0.00 0.34 0.00 0.00 59.36 59.73 1tj2 h GLU 378 Cb 0.23 -0.07 -0.01 0.00 -0.10 0.00 0.00 28.75 28.79 1tj2 h GLU 378 CO -0.32 0.22 -0.30 0.97 -1.16 0.00 0.00 179.01 178.42 1tj2 h ILE 379 N 0.34 1.27 -0.46 3.13 6.09 -1.83 -1.90 117.51 124.15 1tj2 h ILE 379 Ca 0.12 -1.34 -0.03 0.00 -1.37 0.00 0.00 64.86 62.25 1tj2 h ILE 379 Cb 0.02 1.43 -0.02 0.00 0.47 0.00 0.00 36.82 38.72 1tj2 h ILE 379 CO -0.07 0.42 0.15 0.77 -3.07 0.00 0.00 178.15 176.34 1tj2 h SER 380 N 0.38 0.61 -0.19 2.19 4.64 -0.73 -1.22 113.55 119.23 1tj2 h SER 380 Ca 0.05 -0.08 -0.13 0.00 -0.47 0.00 0.00 61.79 61.16 1tj2 h SER 380 Cb 0.72 -0.16 -0.01 0.00 -0.31 0.00 0.00 62.40 62.64 1tj2 h SER 380 CO 0.05 0.58 -0.32 -0.07 -0.87 0.00 0.00 176.83 176.20 1tj2 h LEU 381 N 0.66 0.72 -0.76 5.97 3.38 -0.67 -0.79 115.31 123.82 1tj2 h LEU 381 Ca 0.16 -0.30 -0.05 0.00 0.09 0.00 0.00 57.88 57.78 1tj2 h LEU 381 Cb 0.19 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 40.70 1tj2 h LEU 381 CO -0.01 0.99 0.29 0.44 0.09 0.00 0.00 178.44 180.24 1tj2 h ASP 382 N 0.59 1.06 -0.31 -0.43 3.45 -0.81 -1.19 116.42 118.78 1tj2 h ASP 382 Ca 0.06 -0.18 -0.07 0.00 0.43 0.00 0.00 57.03 57.27 1tj2 h ASP 382 Cb 0.84 -0.28 -0.01 0.00 -0.56 0.00 0.00 39.33 39.32 1tj2 h ASP 382 CO 0.07 0.96 -0.09 -0.07 -1.57 0.00 0.00 179.24 178.53 1tj2 h LEU 383 N 1.11 0.61 -0.27 1.55 3.38 -1.07 -2.94 115.31 117.68 1tj2 h LEU 383 Ca 0.25 -0.38 0.00 0.00 0.09 0.00 0.00 57.88 57.85 1tj2 h LEU 383 Cb 0.24 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.81 1tj2 h LEU 383 CO -0.02 0.85 0.18 0.25 0.09 0.00 0.00 178.44 179.79 1tj2 h LEU 384 N 0.37 0.31 -0.18 1.67 6.46 -1.01 -1.80 115.31 121.13 1tj2 h LEU 384 Ca 0.08 -0.01 0.05 0.00 -0.12 0.00 0.00 57.88 57.88 1tj2 h LEU 384 Cb 0.59 -0.08 -0.06 0.00 -0.73 0.00 0.00 40.66 40.38 1tj2 h LEU 384 CO 0.03 0.22 -0.22 -0.08 -0.62 0.00 0.00 178.44 177.78 1tj2 h GLU 385 N 0.36 -0.25 -0.43 1.25 4.57 -1.21 -0.94 114.58 117.94 1tj2 h GLU 385 Ca 0.10 0.02 -0.03 0.00 -1.18 0.00 0.00 59.36 58.26 1tj2 h GLU 385 Cb -0.04 0.06 -0.02 0.00 -0.16 0.00 0.00 28.75 28.59 1tj2 h GLU 385 CO -0.02 -0.16 0.14 -0.22 -1.18 0.00 0.00 179.01 177.56 1tj2 h LYS 386 N -0.25 0.67 -0.94 1.92 3.64 -1.44 -2.91 116.57 117.26 1tj2 h LYS 386 Ca 0.12 -0.14 0.06 0.00 -1.27 0.00 0.00 60.65 59.41 1tj2 h LYS 386 Cb 0.43 -0.10 -0.06 0.00 -0.41 0.00 0.00 32.23 32.09 1tj2 h LYS 386 CO -0.33 0.66 0.61 1.25 -2.27 0.00 0.00 179.45 179.37 1tj2 h LEU 387 N 0.56 0.97 -0.92 5.20 5.85 -0.79 -1.72 115.31 124.47 1tj2 h LEU 387 Ca 0.14 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.86 1tj2 h LEU 387 Cb 0.26 -0.20 0.00 0.00 0.37 0.00 0.00 40.66 41.09 1tj2 h LEU 387 CO -0.00 0.63 0.00 0.00 -0.34 0.00 0.00 178.44 178.72 1tj2 n PHE 389 N -2.54 1.00 -2.09 0.00 3.01 -0.65 -4.87 117.46 111.33 1tj2 n PHE 389 Ca 0.02 -0.56 -0.42 0.00 1.01 0.00 0.00 57.45 57.49 1tj2 n PHE 389 Cb 0.27 -0.11 -0.03 0.00 -0.01 0.00 0.00 39.48 39.60 1tj2 n PHE 389 CO 0.00 0.00 0.00 -1.21 1.01 0.00 0.00 176.76 176.56 1tj2 s GLU 390 N -1.40 4.26 0.35 -1.08 0.41 -0.98 -4.92 118.70 115.33 1tj2 s GLU 390 Ca 0.42 2.15 0.06 0.00 -0.41 0.00 0.00 54.97 57.19 1tj2 s GLU 390 Cb 0.25 -3.48 0.74 0.00 -1.78 0.00 0.00 34.13 29.86 1tj2 s GLU 390 CO 0.24 -0.60 1.91 -1.35 -0.49 0.00 0.00 175.26 174.97 1tj2 h PRO 391 N 7.69 0.75 0.00 0.39 0.11 -1.92 -1.86 132.00 137.16 1tj2 h PRO 391 Ca -0.41 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.66 1tj2 h PRO 391 Cb 1.19 -0.17 0.00 0.00 0.11 0.00 0.00 31.00 32.13 1tj2 h PRO 391 CO 0.90 0.50 0.00 0.39 -0.21 0.00 0.00 178.00 179.58 1tj2 n GLU 392 N -4.52 0.13 -0.13 1.05 1.02 -1.26 -1.88 120.64 115.05 1tj2 n GLU 392 Ca 0.14 0.41 0.07 0.00 -0.02 0.00 0.00 57.16 57.75 1tj2 n GLU 392 Cb 0.33 -1.77 0.13 0.00 -0.02 0.00 0.00 31.44 30.11 1tj2 n GLU 392 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 1tj2 n LEU 393 N -2.02 2.71 -4.76 -4.62 4.77 -0.71 -4.98 117.00 107.39 1tj2 n LEU 393 Ca 0.02 -1.61 -0.41 0.00 -0.03 0.00 0.00 56.01 53.97 1tj2 n LEU 393 Cb 0.18 -0.17 -0.01 0.00 -2.33 0.00 0.00 43.42 41.10 1tj2 n LEU 393 CO 0.16 0.62 1.18 0.00 -1.33 0.00 0.00 177.39 178.03 1tj2 n ALA 394 N 0.72 2.42 -0.75 -1.18 0.00 -0.79 -2.35 120.51 118.58 1tj2 n ALA 394 Ca 0.11 0.36 0.00 0.00 0.00 0.00 0.00 53.44 53.91 1tj2 n ALA 394 Cb 0.41 -2.43 0.00 0.00 0.00 0.00 0.00 19.45 17.42 1tj2 n ALA 394 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1tj2 n GLY 395 N 1.29 1.17 3.55 0.00 0.00 -1.26 -5.00 105.19 104.93 1tj2 n GLY 395 Ca 0.05 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.73 1tj2 n GLY 395 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 1tj2 s TRP 396 N -3.37 3.05 -0.23 1.61 -0.00 -0.99 -5.01 118.94 113.99 1tj2 s TRP 396 Ca 0.00 -0.15 0.13 0.00 -0.00 0.00 0.00 56.10 56.08 1tj2 s TRP 396 Cb 0.00 -1.90 0.48 0.00 -0.00 0.00 0.00 33.47 32.05 1tj2 s TRP 396 CO 0.00 0.11 1.40 0.09 -0.00 0.00 0.00 176.95 178.55 1tj2 n ASN 397 N 3.11 2.86 -0.08 5.86 3.02 -1.26 -4.64 115.26 124.12 1tj2 n ASN 397 Ca -0.18 -3.46 0.13 0.00 -0.03 0.00 0.00 54.58 51.05 1tj2 n ASN 397 Cb 0.53 -0.57 0.42 0.00 -0.61 0.00 0.00 39.78 39.55 1tj2 n ASN 397 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1tj2 n GLY 398 N -0.97 -1.09 3.69 7.41 0.00 -1.26 -4.39 105.19 108.58 1tj2 n GLY 398 Ca 0.26 -0.30 -0.42 0.00 0.00 0.00 0.00 46.02 45.56 1tj2 n GLY 398 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1tj2 s ILE 399 N -2.78 3.94 0.12 -0.61 1.01 -1.26 -1.81 121.20 119.82 1tj2 s ILE 399 Ca 0.18 1.32 0.08 0.00 0.00 0.00 0.00 60.65 62.24 1tj2 s ILE 399 Cb 0.19 -3.85 -0.04 0.00 0.01 0.00 0.00 42.46 38.77 1tj2 s ILE 399 CO 0.58 0.02 -0.15 -0.83 0.00 0.00 0.00 174.94 174.56 1tj2 s GLY 400 N 1.58 1.73 -0.10 6.18 0.00 0.35 -1.69 107.32 115.38 1tj2 s GLY 400 Ca 0.60 -1.34 -0.07 0.00 0.00 0.00 0.00 44.72 43.92 1tj2 s GLY 400 CO 0.25 -1.32 0.24 -0.12 0.00 0.00 0.00 173.10 172.15 1tj2 s PHE 401 N -1.22 -0.29 0.02 1.90 5.36 -0.01 -0.95 117.98 122.79 1tj2 s PHE 401 Ca 0.20 0.70 -0.17 0.00 -0.96 0.00 0.00 56.93 56.69 1tj2 s PHE 401 Cb -0.11 0.07 -0.06 0.00 -0.34 0.00 0.00 43.02 42.58 1tj2 s PHE 401 CO 0.12 -0.18 0.49 0.08 -1.46 0.00 0.00 175.22 174.27 1tj2 s VAL 402 N 0.69 4.92 0.00 3.12 1.01 -0.82 -1.67 120.40 127.66 1tj2 s VAL 402 Ca -0.05 1.03 0.07 0.00 0.00 0.00 0.00 61.98 63.03 1tj2 s VAL 402 Cb -0.06 -3.81 -0.02 0.00 0.00 0.00 0.00 36.38 32.49 1tj2 s VAL 402 CO -0.04 0.53 -0.21 0.27 0.00 0.00 0.00 175.10 175.65 1tj2 s ILE 403 N -0.86 1.70 -0.40 2.22 -4.36 -0.35 -4.54 121.20 114.62 1tj2 s ILE 403 Ca 0.27 -1.00 -0.11 0.00 -0.26 0.00 0.00 60.65 59.54 1tj2 s ILE 403 Cb -0.18 -1.43 0.04 0.00 1.25 0.00 0.00 42.46 42.15 1tj2 s ILE 403 CO 0.16 0.41 0.24 -1.10 0.24 0.00 0.00 174.94 174.89 1tj2 s GLN 404 N -0.69 2.80 0.32 0.37 -0.21 -1.26 -1.25 119.66 119.73 1tj2 s GLN 404 Ca 0.08 -1.19 0.24 0.00 0.02 0.00 0.00 55.36 54.51 1tj2 s GLN 404 Cb -0.08 -3.80 1.15 0.00 1.00 0.00 0.00 33.01 31.28 1tj2 s GLN 404 CO -0.00 -0.79 1.72 0.00 -2.12 0.00 0.00 175.29 174.10 1tj2 h ALA 405 N 8.48 1.00 0.00 6.09 0.00 0.20 -2.23 119.26 132.79 1tj2 h ALA 405 Ca -0.25 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.66 1tj2 h ALA 405 Cb 1.10 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.89 1tj2 h ALA 405 CO 0.71 0.00 0.00 2.48 0.00 0.00 0.00 179.25 182.44 1tj2 n TYR 406 N -2.31 0.00 -3.23 0.00 0.18 -0.20 -4.57 117.16 107.04 1tj2 n TYR 406 Ca -0.00 0.00 -0.39 0.00 1.88 0.00 0.00 57.90 59.39 1tj2 n TYR 406 Cb 0.12 -0.33 -0.06 0.00 -0.38 0.00 0.00 39.34 38.69 1tj2 n TYR 406 CO 0.00 0.00 0.00 -0.65 -2.08 0.00 0.00 176.86 174.13 1tj2 s GLN 407 N -2.66 4.27 0.43 -3.48 -0.21 -0.84 -1.63 119.66 115.55 1tj2 s GLN 407 Ca 0.19 0.77 0.16 0.00 0.02 0.00 0.00 55.36 56.51 1tj2 s GLN 407 Cb 0.15 -3.27 1.06 0.00 1.00 0.00 0.00 33.01 31.95 1tj2 s GLN 407 CO 0.35 0.54 1.92 0.87 -2.12 0.00 0.00 175.29 176.85 1tj2 h LYS 408 N 4.88 0.39 0.00 2.91 1.57 -1.68 -2.49 116.57 122.16 1tj2 h LYS 408 Ca -0.48 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.28 1tj2 h LYS 408 Cb 1.21 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 33.43 1tj2 h LYS 408 CO 0.66 0.26 0.00 0.00 -0.57 0.00 0.00 179.45 179.80 1tj2 h ARG 409 N 0.40 0.00 -0.45 3.15 3.08 -1.81 -3.39 114.38 115.36 1tj2 h ARG 409 Ca 0.38 0.00 0.08 0.00 0.07 0.00 0.00 59.98 60.51 1tj2 h ARG 409 Cb 0.89 0.00 -0.10 0.00 0.08 0.00 0.00 29.97 30.84 1tj2 h ARG 409 CO -0.12 0.00 -0.39 0.00 -1.07 0.00 0.00 179.97 178.39 1tj2 h PRO 411 N -0.28 0.52 -0.00 0.00 0.13 -1.83 -1.34 132.00 129.20 1tj2 h PRO 411 Ca 0.16 -0.03 -0.18 0.00 -0.87 0.00 0.00 66.00 65.08 1tj2 h PRO 411 Cb 0.57 -0.12 -0.02 0.00 0.13 0.00 0.00 31.00 31.56 1tj2 h PRO 411 CO -0.60 0.35 -0.84 -0.07 -0.23 0.00 0.00 178.00 176.62 1tj2 h LEU 412 N 0.54 0.17 -0.80 1.56 -0.00 -1.07 -2.65 115.31 113.07 1tj2 h LEU 412 Ca 0.27 -0.14 -0.04 0.00 -0.00 0.00 0.00 57.88 57.97 1tj2 h LEU 412 Cb 0.37 -0.05 -0.04 0.00 -0.00 0.00 0.00 40.66 40.94 1tj2 h LEU 412 CO -0.08 0.93 0.33 0.58 -0.00 0.00 0.00 178.44 180.20 1tj2 h VAL 413 N 0.08 1.26 -0.86 1.22 2.07 -0.24 -2.15 116.25 117.63 1tj2 h VAL 413 Ca -0.03 -0.80 0.01 0.00 0.82 0.00 0.00 66.70 66.69 1tj2 h VAL 413 Cb 1.45 0.30 -0.04 0.00 -1.52 0.00 0.00 31.29 31.48 1tj2 h VAL 413 CO 0.12 0.33 0.57 0.40 0.02 0.00 0.00 177.57 179.01 1tj2 h ILE 414 N 1.15 1.22 -0.78 4.57 2.04 -1.02 0.84 117.51 125.53 1tj2 h ILE 414 Ca 0.27 -0.41 -0.05 0.00 1.00 0.00 0.00 64.86 65.67 1tj2 h ILE 414 Cb 0.20 -0.04 -0.03 0.00 -0.74 0.00 0.00 36.82 36.20 1tj2 h ILE 414 CO -0.02 0.22 0.29 0.44 0.00 0.00 0.00 178.15 179.07 1tj2 h ASP 415 N 1.17 1.09 -0.24 1.72 3.32 -1.13 -0.26 116.42 122.09 1tj2 h ASP 415 Ca 0.31 -0.18 0.00 0.00 0.02 0.00 0.00 57.03 57.19 1tj2 h ASP 415 Cb -0.13 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 39.12 1tj2 h ASP 415 CO -0.07 0.98 0.15 0.22 -1.72 0.00 0.00 179.24 178.80 1tj2 h TYR 416 N 1.14 0.31 -0.75 4.55 3.20 -0.82 -2.43 116.97 122.17 1tj2 h TYR 416 Ca 0.26 0.00 -0.05 0.00 3.14 0.00 0.00 58.73 62.08 1tj2 h TYR 416 Cb 0.24 -0.10 -0.03 0.00 1.54 0.00 0.00 36.73 38.38 1tj2 h TYR 416 CO 0.02 0.21 0.27 -0.07 -1.64 0.00 0.00 178.16 176.95 1tj2 h LEU 417 N 0.31 1.07 -0.43 2.82 3.38 -0.25 0.69 115.31 122.91 1tj2 h LEU 417 Ca 0.09 -0.19 0.01 0.00 0.09 0.00 0.00 57.88 57.87 1tj2 h LEU 417 Cb -0.01 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.44 1tj2 h LEU 417 CO -0.02 0.98 0.28 0.40 0.09 0.00 0.00 178.44 180.17 1tj2 h ILE 418 N 1.10 1.10 -0.34 1.22 2.04 -0.95 0.16 117.51 121.83 1tj2 h ILE 418 Ca 0.25 -0.19 -0.09 0.00 1.00 0.00 0.00 64.86 65.82 1tj2 h ILE 418 Cb 0.27 0.48 -0.02 0.00 -0.74 0.00 0.00 36.82 36.81 1tj2 h ILE 418 CO -0.01 0.10 -0.17 -0.78 0.00 0.00 0.00 178.15 177.29 1tj2 h ASP 419 N 0.57 0.63 -0.36 1.72 1.82 -1.12 -2.52 116.42 117.15 1tj2 h ASP 419 Ca 0.16 -0.20 -0.12 0.00 -0.39 0.00 0.00 57.03 56.48 1tj2 h ASP 419 Cb -0.05 -0.17 -0.01 0.00 0.68 0.00 0.00 39.33 39.77 1tj2 h ASP 419 CO -0.04 0.81 -0.23 0.25 -1.61 0.00 0.00 179.24 178.42 1tj2 h LEU 420 N 0.57 0.88 -0.80 2.28 5.85 -0.29 -0.89 115.31 122.90 1tj2 h LEU 420 Ca 0.09 -0.33 -0.04 0.00 0.84 0.00 0.00 57.88 58.45 1tj2 h LEU 420 Cb 0.62 -0.24 -0.04 0.00 0.37 0.00 0.00 40.66 41.37 1tj2 h LEU 420 CO 0.04 1.07 0.36 0.00 -0.34 0.00 0.00 178.44 179.57 1tj2 h ALA 421 N 0.99 1.04 0.34 1.25 0.00 -0.56 -0.92 119.26 121.40 1tj2 h ALA 421 Ca 0.10 -0.18 -0.02 0.00 0.00 0.00 0.00 54.91 54.82 1tj2 h ALA 421 Cb 0.77 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 18.25 1tj2 h ALA 421 CO 0.06 0.63 -0.16 1.15 0.00 0.00 0.00 179.25 180.93 1tj2 h THR 422 N 1.15 0.67 -0.55 0.00 2.02 -1.24 -1.41 112.91 113.55 1tj2 h THR 422 Ca 0.27 -0.34 -0.08 0.00 0.77 0.00 0.00 66.41 67.04 1tj2 h THR 422 Cb 0.16 0.85 -0.02 0.00 -1.74 0.00 0.00 68.15 67.40 1tj2 h THR 422 CO -0.03 0.07 0.04 0.03 0.37 0.00 0.00 175.52 175.99 1tj2 h ARG 423 N -0.65 0.91 -0.21 6.66 3.08 -1.06 -2.32 114.38 120.79 1tj2 h ARG 423 Ca -0.05 -0.25 0.00 0.00 0.07 0.00 0.00 59.98 59.76 1tj2 h ARG 423 Cb 0.46 -0.11 0.00 0.00 0.08 0.00 0.00 29.97 30.41 1tj2 h ARG 423 CO 0.08 0.88 0.00 -1.13 -1.07 0.00 0.00 179.97 178.73 1tj2 n SER 424 N -4.21 2.09 -3.48 7.04 3.41 -0.36 -4.98 113.62 113.14 1tj2 n SER 424 Ca 0.03 -1.78 -0.23 0.00 -0.26 0.00 0.00 58.87 56.63 1tj2 n SER 424 Cb 0.30 -0.13 0.06 0.00 -0.26 0.00 0.00 64.21 64.17 1tj2 n SER 424 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1tj2 n ARG 425 N 0.61 -1.96 -3.69 4.33 1.74 -0.66 -4.86 116.66 112.17 1tj2 n ARG 425 Ca 0.17 0.66 -0.10 0.00 -0.77 0.00 0.00 57.85 57.81 1tj2 n ARG 425 Cb 0.40 -5.00 -0.04 0.00 -1.02 0.00 0.00 32.46 26.80 1tj2 n ARG 425 CO 0.00 0.00 0.00 -0.98 -1.52 0.00 0.00 177.63 175.13 1tj2 s ARG 426 N -5.23 1.25 -0.31 5.56 1.70 -0.62 -4.50 118.95 116.80 1tj2 s ARG 426 Ca 0.44 -0.80 -0.12 0.00 -0.47 0.00 0.00 55.73 54.79 1tj2 s ARG 426 Cb -0.11 0.50 -0.03 0.00 -0.57 0.00 0.00 34.95 34.74 1tj2 s ARG 426 CO 0.80 -0.52 0.20 0.50 -1.08 0.00 0.00 175.30 175.21 1tj2 s ARG 427 N -3.85 3.69 0.12 3.89 3.52 -1.26 -4.55 118.95 120.51 1tj2 s ARG 427 Ca 0.07 -0.50 -0.25 0.00 -0.13 0.00 0.00 55.73 54.91 1tj2 s ARG 427 Cb 0.00 -3.70 -0.07 0.00 -1.56 0.00 0.00 34.95 29.62 1tj2 s ARG 427 CO -0.07 -0.32 0.78 -0.51 -0.81 0.00 0.00 175.30 174.38 1tj2 s LEU 428 N 1.73 4.54 -0.33 -0.88 1.43 -0.25 -4.62 118.68 120.29 1tj2 s LEU 428 Ca 0.06 1.58 -0.27 0.00 -1.03 0.00 0.00 54.13 54.48 1tj2 s LEU 428 Cb -0.17 -3.28 0.01 0.00 0.03 0.00 0.00 46.19 42.78 1tj2 s LEU 428 CO 0.10 0.13 0.95 -0.04 0.23 0.00 0.00 176.35 177.72 1tj2 s MET 429 N -0.69 3.97 -0.21 1.70 -1.94 -0.68 -0.38 119.30 121.07 1tj2 s MET 429 Ca 0.37 0.79 0.02 0.00 -1.71 0.00 0.00 55.69 55.16 1tj2 s MET 429 Cb -0.22 -3.76 0.04 0.00 2.01 0.00 0.00 34.83 32.90 1tj2 s MET 429 CO 0.25 -0.86 -0.15 0.42 -0.01 0.00 0.00 175.02 174.67 1tj2 s ILE 430 N 3.41 2.03 -0.33 2.53 -1.09 -0.37 -0.83 121.20 126.56 1tj2 s ILE 430 Ca 0.40 -1.18 -0.21 0.00 -2.23 0.00 0.00 60.65 57.43 1tj2 s ILE 430 Cb -0.13 -1.98 -0.00 0.00 -1.58 0.00 0.00 42.46 38.77 1tj2 s ILE 430 CO 0.16 0.29 0.65 -0.60 -1.23 0.00 0.00 174.94 174.21 1tj2 s ARG 431 N 1.24 3.80 -0.24 2.79 3.52 -0.67 -0.52 118.95 128.87 1tj2 s ARG 431 Ca -0.01 0.21 -0.16 0.00 -0.13 0.00 0.00 55.73 55.64 1tj2 s ARG 431 Cb -0.16 -3.77 -0.04 0.00 -1.56 0.00 0.00 34.95 29.43 1tj2 s ARG 431 CO -0.10 -0.66 0.41 -1.17 -0.81 0.00 0.00 175.30 172.97 1tj2 s LEU 432 N 2.70 4.08 0.39 -0.88 2.96 -0.04 -1.21 118.68 126.68 1tj2 s LEU 432 Ca 0.26 0.42 0.05 0.00 -0.22 0.00 0.00 54.13 54.64 1tj2 s LEU 432 Cb -0.15 -2.51 -0.07 0.00 0.50 0.00 0.00 46.19 43.97 1tj2 s LEU 432 CO 0.13 -0.17 0.03 0.68 -1.32 0.00 0.00 176.35 175.71 1tj2 s VAL 433 N 1.85 1.61 -0.05 1.68 -7.23 -0.38 -1.82 120.40 116.06 1tj2 s VAL 433 Ca 0.18 -2.00 -0.01 0.00 -1.81 0.00 0.00 61.98 58.34 1tj2 s VAL 433 Cb -0.15 -2.83 -0.00 0.00 0.56 0.00 0.00 36.38 33.96 1tj2 s VAL 433 CO 0.09 0.00 -0.02 0.11 -0.31 0.00 0.00 175.10 174.97 1tj2 h LYS 434 N 1.83 0.00 0.00 4.82 1.57 -1.84 0.34 116.57 123.29 1tj2 h LYS 434 Ca -0.43 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.35 1tj2 h LYS 434 Cb 1.25 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.56 1tj2 h LYS 434 CO 0.76 0.00 0.00 0.41 -0.57 0.00 0.00 179.45 180.05 1tj2 n GLY 435 N 1.85 3.73 0.19 3.86 0.00 -1.26 -1.03 105.19 112.52 1tj2 n GLY 435 Ca -0.01 -0.92 0.08 0.00 0.00 0.00 0.00 46.02 45.17 1tj2 n GLY 435 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1tj2 n ALA 436 N -1.31 3.71 -1.24 4.61 0.00 -1.26 -4.59 120.51 120.43 1tj2 n ALA 436 Ca 0.00 -0.51 0.04 0.00 0.00 0.00 0.00 53.44 52.96 1tj2 n ALA 436 Cb 0.00 -0.60 0.21 0.00 0.00 0.00 0.00 19.45 19.06 1tj2 n ALA 436 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1tj2 n TYR 437 N -0.76 0.75 -0.10 0.00 4.02 -1.26 -4.83 117.16 114.98 1tj2 n TYR 437 Ca 0.05 -1.24 -0.08 0.00 -0.01 0.00 0.00 57.90 56.62 1tj2 n TYR 437 Cb 0.31 -0.35 -0.01 0.00 -0.02 0.00 0.00 39.34 39.27 1tj2 n TYR 437 CO 0.00 0.00 0.00 2.35 -1.01 0.00 0.00 176.86 178.20 1tj2 h TRP 438 N 1.10 0.38 -0.29 -0.72 7.01 -2.00 0.06 115.95 121.49 1tj2 h TRP 438 Ca 0.09 0.01 0.03 0.00 2.11 0.00 0.00 58.89 61.13 1tj2 h TRP 438 Cb 1.42 -0.12 -0.03 0.00 -2.10 0.00 0.00 29.16 28.32 1tj2 h TRP 438 CO 0.65 0.23 0.12 -0.44 -2.79 0.00 0.00 178.44 176.20 1tj2 h ASP 439 N 0.41 0.15 -0.30 2.65 3.32 -1.98 -1.82 116.42 118.86 1tj2 h ASP 439 Ca 0.13 0.02 -0.07 0.00 0.02 0.00 0.00 57.03 57.13 1tj2 h ASP 439 Cb -0.01 -0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.51 1tj2 h ASP 439 CO -0.05 0.12 -0.03 0.28 -1.72 0.00 0.00 179.24 177.84 1tj2 h SER 440 N 0.26 0.63 -0.64 6.45 0.02 -1.86 -2.31 113.55 116.10 1tj2 h SER 440 Ca 0.12 -0.15 -0.02 0.00 -0.84 0.00 0.00 61.79 60.90 1tj2 h SER 440 Cb 0.07 -0.17 -0.03 0.00 0.14 0.00 0.00 62.40 62.41 1tj2 h SER 440 CO -0.11 0.73 0.32 -0.33 -1.14 0.00 0.00 176.83 176.30 1tj2 h GLU 441 N 0.62 0.91 -0.12 3.45 4.39 -0.38 -0.17 114.58 123.29 1tj2 h GLU 441 Ca 0.12 -0.13 -0.00 0.00 0.34 0.00 0.00 59.36 59.70 1tj2 h GLU 441 Cb 0.44 -0.17 -0.01 0.00 -0.10 0.00 0.00 28.75 28.91 1tj2 h GLU 441 CO 0.02 0.72 0.07 0.82 -1.16 0.00 0.00 179.01 179.47 1tj2 h ILE 442 N 0.88 1.08 -0.28 3.13 1.08 -1.13 -1.35 117.51 120.91 1tj2 h ILE 442 Ca 0.22 -0.22 -0.00 0.00 -0.39 0.00 0.00 64.86 64.47 1tj2 h ILE 442 Cb 0.09 1.01 -0.01 0.00 -3.07 0.00 0.00 36.82 34.84 1tj2 h ILE 442 CO -0.03 0.07 0.17 0.11 -0.69 0.00 0.00 178.15 177.78 1tj2 h LYS 443 N 0.11 0.39 -0.26 2.37 1.57 -1.26 -1.84 116.57 117.63 1tj2 h LYS 443 Ca 0.04 -0.04 0.06 0.00 -1.87 0.00 0.00 60.65 58.84 1tj2 h LYS 443 Cb 0.06 -0.08 -0.06 0.00 0.08 0.00 0.00 32.23 32.23 1tj2 h LYS 443 CO -0.01 0.31 -0.12 -0.09 -0.57 0.00 0.00 179.45 178.98 1tj2 h ARG 444 N 0.35 -0.07 -0.01 3.15 9.65 -0.94 -0.98 114.38 125.53 1tj2 h ARG 444 Ca 0.10 0.01 -0.09 0.00 -1.10 0.00 0.00 59.98 58.90 1tj2 h ARG 444 Cb 0.03 0.02 -0.01 0.00 -1.39 0.00 0.00 29.97 28.61 1tj2 h ARG 444 CO -0.02 -0.05 -0.42 0.00 2.80 0.00 0.00 179.97 182.29 1tj2 h ALA 445 N 1.15 1.30 0.00 2.80 0.00 -1.08 -0.73 119.26 122.70 1tj2 h ALA 445 Ca 0.14 -0.38 -0.11 0.00 0.00 0.00 0.00 54.91 54.56 1tj2 h ALA 445 Cb 0.29 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.99 1tj2 h ALA 445 CO -0.32 0.53 -0.52 1.96 0.00 0.00 0.00 179.25 180.90 1tj2 h GLN 446 N 0.02 0.00 0.10 0.00 4.20 -0.86 -2.66 115.11 115.91 1tj2 h GLN 446 Ca -0.00 0.00 -0.28 0.00 0.06 0.00 0.00 58.65 58.43 1tj2 h GLN 446 Cb 0.74 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.52 1tj2 h GLN 446 CO 0.05 0.52 -1.34 0.52 -0.67 0.00 0.00 178.83 177.92 1tj2 h MET 447 N 0.00 0.21 0.00 1.46 2.86 -0.80 -3.32 114.93 115.34 1tj2 h MET 447 Ca -0.01 -0.37 0.00 0.00 -2.06 0.00 0.00 59.70 57.27 1tj2 h MET 447 Cb 1.14 0.14 0.00 0.00 0.06 0.00 0.00 31.60 32.94 1tj2 h MET 447 CO 0.07 1.12 0.00 -0.44 1.06 0.00 0.00 176.91 178.72 1tj2 h ASP 448 N 0.06 0.00 -6.29 1.22 3.45 -1.05 -3.48 116.42 110.34 1tj2 h ASP 448 Ca -0.17 0.00 -0.47 0.00 0.43 0.00 0.00 57.03 56.82 1tj2 h ASP 448 Cb 1.96 0.00 -0.03 0.00 -0.56 0.00 0.00 39.33 40.71 1tj2 h ASP 448 CO 0.17 0.00 -0.76 0.61 -1.57 0.00 0.00 179.24 177.69 1tj2 n GLY 449 N 0.42 -0.48 1.82 2.75 0.00 -1.01 -5.01 105.19 103.68 1tj2 n GLY 449 Ca 0.02 0.19 -0.11 0.00 0.00 0.00 0.00 46.02 46.12 1tj2 n GLY 449 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1tj2 n LEU 450 N -4.66 0.00 0.32 0.99 4.77 -1.26 -4.65 117.00 112.50 1tj2 n LEU 450 Ca 0.01 -0.94 0.21 0.00 -0.03 0.00 0.00 56.01 55.26 1tj2 n LEU 450 Cb 0.54 -0.33 1.02 0.00 -2.33 0.00 0.00 43.42 42.31 1tj2 n LEU 450 CO 0.75 -0.76 1.11 1.05 -1.33 0.00 0.00 177.39 178.21 1tj2 h GLU 451 N 0.00 0.00 0.00 3.23 9.09 -1.95 -3.37 114.58 121.59 1tj2 h GLU 451 Ca -0.16 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.25 1tj2 h GLU 451 Cb 0.57 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.67 1tj2 h GLU 451 CO 0.16 0.00 0.00 0.41 0.05 0.00 0.00 179.01 179.63 1tj2 n GLY 452 N -0.64 -1.25 3.88 1.06 0.00 -1.26 -4.83 105.19 102.15 1tj2 n GLY 452 Ca -0.02 -0.87 -0.34 0.00 0.00 0.00 0.00 46.02 44.78 1tj2 n GLY 452 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1tj2 s TYR 453 N -2.81 3.58 -0.93 1.61 1.51 -1.26 -4.92 117.35 114.13 1tj2 s TYR 453 Ca 0.00 0.59 0.28 0.00 -1.01 0.00 0.00 57.07 56.92 1tj2 s TYR 453 Cb 0.00 -2.00 1.11 0.00 -0.11 0.00 0.00 41.96 40.96 1tj2 s TYR 453 CO 0.00 0.60 1.87 -0.35 -1.11 0.00 0.00 175.55 176.56 1tj2 n PRO 454 N 1.08 0.07 -4.44 -1.71 -0.04 -1.26 -4.46 135.00 124.23 1tj2 n PRO 454 Ca -0.11 0.07 -0.25 0.00 -0.04 0.00 0.00 63.50 63.17 1tj2 n PRO 454 Cb 0.53 -1.58 -0.09 0.00 -0.04 0.00 0.00 33.50 32.31 1tj2 n PRO 454 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 1tj2 s VAL 455 N -3.03 2.50 0.72 0.52 -7.23 -1.26 -2.08 120.40 110.54 1tj2 s VAL 455 Ca 0.13 -2.14 -0.12 0.00 -1.81 0.00 0.00 61.98 58.04 1tj2 s VAL 455 Cb 0.17 -2.65 0.03 0.00 0.56 0.00 0.00 36.38 34.49 1tj2 s VAL 455 CO 0.53 -0.25 1.09 -0.31 -0.31 0.00 0.00 175.10 175.86 1tj2 s TYR 456 N -2.54 2.70 -0.51 2.82 1.51 -0.64 -4.88 117.35 115.81 1tj2 s TYR 456 Ca 0.33 1.53 0.14 0.00 -1.01 0.00 0.00 57.07 58.06 1tj2 s TYR 456 Cb -0.00 -3.05 -0.17 0.00 -0.11 0.00 0.00 41.96 38.62 1tj2 s TYR 456 CO 0.17 -1.63 0.53 0.25 -1.11 0.00 0.00 175.55 173.77 1tj2 n THR 457 N -3.05 0.00 -4.81 -0.71 -2.24 -1.26 -4.94 114.28 97.26 1tj2 n THR 457 Ca 0.09 -0.21 -0.33 0.00 -2.27 0.00 0.00 64.05 61.34 1tj2 n THR 457 Cb 0.53 0.79 -0.14 0.00 -2.10 0.00 0.00 70.33 69.41 1tj2 n THR 457 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1tj2 s ARG 458 N -2.52 3.00 0.35 -0.78 0.52 -1.26 -4.44 118.95 113.82 1tj2 s ARG 458 Ca 0.03 -0.68 0.04 0.00 -0.52 0.00 0.00 55.73 54.59 1tj2 s ARG 458 Cb 0.10 -2.53 0.65 0.00 0.52 0.00 0.00 34.95 33.69 1tj2 s ARG 458 CO 0.59 0.40 1.96 -0.22 0.02 0.00 0.00 175.30 178.05 1tj2 h LYS 459 N 6.07 0.67 -0.35 3.54 3.11 -1.97 -1.26 116.57 126.39 1tj2 h LYS 459 Ca -0.35 -0.08 0.00 0.00 -2.81 0.00 0.00 60.65 57.41 1tj2 h LYS 459 Cb 1.19 -0.13 -0.02 0.00 -1.00 0.00 0.00 32.23 32.27 1tj2 h LYS 459 CO 0.53 0.53 0.22 -0.24 -2.81 0.00 0.00 179.45 177.69 1tj2 h VAL 460 N 0.67 1.09 -0.52 2.00 3.04 -1.97 -1.69 116.25 118.88 1tj2 h VAL 460 Ca 0.17 -0.19 -0.11 0.00 -1.01 0.00 0.00 66.70 65.55 1tj2 h VAL 460 Cb 0.09 0.59 -0.02 0.00 -2.01 0.00 0.00 31.29 29.95 1tj2 h VAL 460 CO -0.02 0.09 -0.12 1.88 -1.01 0.00 0.00 177.57 178.39 1tj2 h TYR 461 N 0.47 1.09 -0.52 3.17 0.05 -1.60 -1.47 116.97 118.17 1tj2 h TYR 461 Ca 0.13 -0.23 0.04 0.00 0.05 0.00 0.00 58.73 58.72 1tj2 h TYR 461 Cb -0.04 -0.27 -0.04 0.00 1.01 0.00 0.00 36.73 37.39 1tj2 h TYR 461 CO 0.00 1.03 0.28 1.15 -1.05 0.00 0.00 178.16 179.56 1tj2 h THR 462 N 0.87 0.98 -0.55 -2.88 2.02 -1.31 0.52 112.91 112.56 1tj2 h THR 462 Ca 0.13 -0.19 0.05 0.00 0.77 0.00 0.00 66.41 67.17 1tj2 h THR 462 Cb 0.67 0.40 -0.05 0.00 -1.74 0.00 0.00 68.15 67.44 1tj2 h THR 462 CO 0.05 0.10 0.30 0.44 0.37 0.00 0.00 175.52 176.77 1tj2 h ASP 463 N 0.54 0.44 -0.43 4.18 3.32 -0.90 -0.51 116.42 123.06 1tj2 h ASP 463 Ca 0.22 0.03 -0.03 0.00 0.02 0.00 0.00 57.03 57.27 1tj2 h ASP 463 Cb 0.10 -0.06 -0.02 0.00 0.22 0.00 0.00 39.33 39.57 1tj2 h ASP 463 CO -0.14 0.30 0.17 0.58 -1.72 0.00 0.00 179.24 178.43 1tj2 h VAL 464 N 0.57 1.20 -0.47 -1.35 2.07 -0.95 -2.40 116.25 114.93 1tj2 h VAL 464 Ca 0.24 -0.63 0.04 0.00 0.82 0.00 0.00 66.70 67.17 1tj2 h VAL 464 Cb 0.13 0.82 -0.04 0.00 -1.52 0.00 0.00 31.29 30.67 1tj2 h VAL 464 CO -0.15 0.23 0.22 -1.28 0.02 0.00 0.00 177.57 176.61 1tj2 h SER 465 N 0.55 0.31 -0.60 0.57 0.87 -0.35 -0.91 113.55 113.97 1tj2 h SER 465 Ca 0.14 0.03 0.06 0.00 -1.23 0.00 0.00 61.79 60.79 1tj2 h SER 465 Cb 0.20 -0.02 -0.05 0.00 -0.44 0.00 0.00 62.40 62.08 1tj2 h SER 465 CO -0.01 0.22 0.32 0.22 -0.53 0.00 0.00 176.83 177.04 1tj2 h TYR 466 N 0.44 0.58 -0.29 2.24 3.20 -0.96 0.13 116.97 122.31 1tj2 h TYR 466 Ca 0.21 0.02 -0.06 0.00 3.14 0.00 0.00 58.73 62.04 1tj2 h TYR 466 Cb 0.13 -0.17 -0.01 0.00 1.54 0.00 0.00 36.73 38.22 1tj2 h TYR 466 CO -0.11 0.27 -0.07 -0.07 -1.64 0.00 0.00 178.16 176.54 1tj2 h LEU 467 N 0.60 0.56 -0.65 2.82 3.38 -1.03 0.13 115.31 121.12 1tj2 h LEU 467 Ca 0.27 -0.36 -0.00 0.00 0.09 0.00 0.00 57.88 57.88 1tj2 h LEU 467 Cb 0.18 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 40.74 1tj2 h LEU 467 CO -0.18 0.80 0.40 0.00 0.09 0.00 0.00 178.44 179.55 1tj2 h ALA 468 N 0.78 0.82 -0.54 1.53 0.00 -0.90 -2.21 119.26 118.75 1tj2 h ALA 468 Ca 0.07 -0.07 -0.09 0.00 0.00 0.00 0.00 54.91 54.83 1tj2 h ALA 468 Cb 0.55 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.06 1tj2 h ALA 468 CO 0.03 0.28 -0.02 0.00 0.00 0.00 0.00 179.25 179.54 1tj2 h ALA 470 N 1.10 0.74 -0.44 0.00 0.00 -0.55 -1.37 119.26 118.74 1tj2 h ALA 470 Ca 0.15 -0.10 0.05 0.00 0.00 0.00 0.00 54.91 55.01 1tj2 h ALA 470 Cb 0.54 -0.23 -0.05 0.00 0.00 0.00 0.00 17.79 18.06 1tj2 h ALA 470 CO 0.03 0.26 0.17 0.87 0.00 0.00 0.00 179.25 180.58 1tj2 h LYS 471 N 0.78 0.34 -0.96 0.00 1.57 -1.26 -0.59 116.57 116.45 1tj2 h LYS 471 Ca 0.20 -0.02 0.05 0.00 -1.87 0.00 0.00 60.65 59.01 1tj2 h LYS 471 Cb 0.05 -0.08 -0.06 0.00 0.08 0.00 0.00 32.23 32.22 1tj2 h LYS 471 CO -0.03 0.23 0.62 0.87 -0.57 0.00 0.00 179.45 180.56 1tj2 h LYS 472 N 0.35 1.13 -0.24 3.15 1.57 -1.04 -2.39 116.57 119.11 1tj2 h LYS 472 Ca 0.20 -0.07 -0.08 0.00 -1.87 0.00 0.00 60.65 58.84 1tj2 h LYS 472 Cb 0.18 -0.26 -0.01 0.00 0.08 0.00 0.00 32.23 32.23 1tj2 h LYS 472 CO -0.19 0.75 -0.16 -0.07 -0.57 0.00 0.00 179.45 179.21 1tj2 h LEU 473 N 1.17 0.56 -1.76 2.94 3.38 -0.77 -3.15 115.31 117.67 1tj2 h LEU 473 Ca 0.39 -0.44 0.00 0.00 0.09 0.00 0.00 57.88 57.93 1tj2 h LEU 473 Cb 0.07 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 40.66 1tj2 h LEU 473 CO -0.14 0.87 0.00 -0.07 0.09 0.00 0.00 178.44 179.19 1tj2 h LEU 474 N 0.24 0.00 -0.66 1.67 3.38 -0.97 -2.74 115.31 116.23 1tj2 h LEU 474 Ca 0.05 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.02 1tj2 h LEU 474 Cb 0.69 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.44 1tj2 h LEU 474 CO 0.04 0.00 0.00 0.00 0.09 0.00 0.00 178.44 178.57 1tj2 h ALA 475 N 2.00 1.00 -2.19 1.53 0.00 -1.39 -3.36 119.26 116.85 1tj2 h ALA 475 Ca 0.00 0.00 -0.55 0.00 0.00 0.00 0.00 54.91 54.36 1tj2 h ALA 475 Cb 0.41 0.00 -0.41 0.00 0.00 0.00 0.00 17.79 17.79 1tj2 h ALA 475 CO 0.00 0.00 -0.83 1.33 0.00 0.00 0.00 179.25 179.75 1tj2 n VAL 476 N -2.45 1.95 0.31 0.00 0.24 -1.03 -4.92 118.33 112.43 1tj2 n VAL 476 Ca 0.03 -5.23 0.18 0.00 -2.04 0.00 0.00 64.34 57.28 1tj2 n VAL 476 Cb 0.30 -1.05 1.03 0.00 -1.47 0.00 0.00 33.84 32.65 1tj2 n VAL 476 CO 0.00 0.00 0.00 1.55 -2.14 0.00 0.00 176.83 176.24 1tj2 h PRO 477 N 3.03 0.00 0.00 7.34 0.13 -1.76 -0.32 132.00 140.43 1tj2 h PRO 477 Ca 0.12 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 65.20 1tj2 h PRO 477 Cb 0.66 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.79 1tj2 h PRO 477 CO 0.71 0.00 -0.24 -2.95 -0.23 0.00 0.00 178.00 175.29 1tj2 h ASN 478 N 0.00 0.00 0.00 1.44 -1.07 -1.96 -3.34 115.58 110.65 1tj2 h ASN 478 Ca -0.00 0.00 -0.06 0.00 0.07 0.00 0.00 56.30 56.31 1tj2 h ASN 478 Cb 0.02 0.00 -0.01 0.00 -2.07 0.00 0.00 38.32 36.25 1tj2 h ASN 478 CO 0.00 0.24 -1.73 0.18 0.07 0.00 0.00 177.43 176.20 1tj2 n LEU 479 N -3.47 0.00 -3.79 6.14 4.77 -0.21 -4.46 117.00 115.97 1tj2 n LEU 479 Ca -0.00 0.00 -0.13 0.00 -0.03 0.00 0.00 56.01 55.85 1tj2 n LEU 479 Cb 0.42 0.08 -0.13 0.00 -2.33 0.00 0.00 43.42 41.45 1tj2 n LEU 479 CO 0.34 0.08 -0.21 -0.63 -1.33 0.00 0.00 177.39 175.64 1tj2 s ILE 480 N -2.85 -0.02 -0.46 -0.08 1.01 -0.71 -1.09 121.20 117.00 1tj2 s ILE 480 Ca -0.06 0.07 -0.12 0.00 0.00 0.00 0.00 60.65 60.53 1tj2 s ILE 480 Cb 0.08 -0.22 0.09 0.00 0.01 0.00 0.00 42.46 42.42 1tj2 s ILE 480 CO 0.59 0.03 0.36 -0.47 0.00 0.00 0.00 174.94 175.45 1tj2 s TYR 481 N 0.48 3.31 0.21 3.97 5.04 0.49 -4.33 117.35 126.52 1tj2 s TYR 481 Ca -0.03 -1.34 -0.30 0.00 -2.44 0.00 0.00 57.07 52.96 1tj2 s TYR 481 Cb -0.05 -3.24 -0.08 0.00 0.35 0.00 0.00 41.96 38.94 1tj2 s TYR 481 CO -0.02 -0.88 1.06 -2.14 -1.34 0.00 0.00 175.55 172.23 1tj2 s PRO 482 N 1.52 4.66 -0.29 4.97 0.02 -1.26 -1.24 135.00 143.38 1tj2 s PRO 482 Ca 0.04 1.68 0.02 0.00 0.02 0.00 0.00 61.00 62.76 1tj2 s PRO 482 Cb -0.25 -3.26 0.08 0.00 0.02 0.00 0.00 34.50 31.09 1tj2 s PRO 482 CO 0.03 0.20 -0.01 -0.65 -0.33 0.00 0.00 177.00 176.25 1tj2 s GLN 483 N -0.79 1.61 -0.69 5.54 -0.21 0.32 -2.04 119.66 123.41 1tj2 s GLN 483 Ca 0.46 -1.44 -0.17 0.00 0.02 0.00 0.00 55.36 54.23 1tj2 s GLN 483 Cb -0.29 -2.84 0.14 0.00 1.00 0.00 0.00 33.01 31.02 1tj2 s GLN 483 CO 0.36 -0.77 0.74 -0.06 -2.12 0.00 0.00 175.29 173.44 1tj2 s PHE 484 N 1.15 3.25 -0.38 0.91 0.40 0.05 -0.86 117.98 122.50 1tj2 s PHE 484 Ca 0.02 -1.34 -0.28 0.00 -0.60 0.00 0.00 56.93 54.73 1tj2 s PHE 484 Cb -0.19 -3.97 0.02 0.00 0.51 0.00 0.00 43.02 39.39 1tj2 s PHE 484 CO -0.09 -1.20 1.05 0.00 0.70 0.00 0.00 175.22 175.68 1tj2 s ALA 485 N 1.86 3.36 -0.13 5.36 0.00 -0.75 -1.43 121.76 130.03 1tj2 s ALA 485 Ca 0.14 -0.32 -0.30 0.00 0.00 0.00 0.00 51.96 51.49 1tj2 s ALA 485 Cb -0.19 -3.70 0.12 0.00 0.00 0.00 0.00 23.12 19.35 1tj2 s ALA 485 CO -0.00 -1.77 0.94 -0.08 0.00 0.00 0.00 175.76 174.85 1tj2 s THR 486 N 3.84 0.00 -0.83 0.00 -1.32 -0.91 -4.61 115.64 111.81 1tj2 s THR 486 Ca 0.44 0.00 0.10 0.00 -1.21 0.00 0.00 61.69 61.01 1tj2 s THR 486 Cb -0.11 -1.00 0.28 0.00 -1.51 0.00 0.00 72.50 70.16 1tj2 s THR 486 CO 0.21 0.00 1.23 1.41 -2.21 0.00 0.00 174.62 175.27 1tj2 n HIS 487 N 0.68 0.42 -3.53 9.09 8.25 -1.26 -4.72 115.22 124.15 1tj2 n HIS 487 Ca -0.11 -0.50 -0.38 0.00 -0.26 0.00 0.00 57.72 56.46 1tj2 n HIS 487 Cb 0.58 -0.03 -0.09 0.00 1.12 0.00 0.00 29.99 31.56 1tj2 n HIS 487 CO 0.00 0.00 0.00 1.21 0.64 0.00 0.00 176.34 178.19 1tj2 s ASN 488 N -1.01 6.18 0.28 0.41 3.84 -1.26 -4.80 114.94 118.58 1tj2 s ASN 488 Ca 0.21 0.20 -0.02 0.00 0.21 0.00 0.00 52.86 53.46 1tj2 s ASN 488 Cb 0.11 -2.16 0.39 0.00 -0.55 0.00 0.00 41.25 39.04 1tj2 s ASN 488 CO 0.14 -0.05 1.83 0.00 -2.79 0.00 0.00 177.10 176.23 1tj2 h ALA 489 N 7.86 1.21 -0.02 1.71 0.00 -1.94 -0.48 119.26 127.59 1tj2 h ALA 489 Ca -0.35 -0.20 -0.00 0.00 0.00 0.00 0.00 54.91 54.35 1tj2 h ALA 489 Cb 1.17 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 18.73 1tj2 h ALA 489 CO 0.64 0.55 -0.00 1.25 0.00 0.00 0.00 179.25 181.69 1tj2 h HIS 490 N 0.83 0.05 -0.38 0.00 -0.00 -1.89 -0.95 115.15 112.80 1tj2 h HIS 490 Ca 0.18 -0.01 0.08 0.00 -0.00 0.00 0.00 60.37 60.63 1tj2 h HIS 490 Cb 0.28 -0.01 -0.08 0.00 -0.00 0.00 0.00 27.41 27.60 1tj2 h HIS 490 CO 0.02 0.35 -0.14 1.15 -0.00 0.00 0.00 177.93 179.30 1tj2 h THR 491 N -0.27 0.52 -0.18 6.26 2.02 -1.91 0.25 112.91 119.61 1tj2 h THR 491 Ca 0.01 0.00 0.03 0.00 0.77 0.00 0.00 66.41 67.22 1tj2 h THR 491 Cb 0.33 0.52 -0.03 0.00 -1.74 0.00 0.00 68.15 67.23 1tj2 h THR 491 CO 0.00 0.00 -0.04 0.25 0.37 0.00 0.00 175.52 176.10 1tj2 h LEU 492 N -0.07 -0.15 -1.01 2.58 6.46 -1.11 -1.74 115.31 120.28 1tj2 h LEU 492 Ca 0.19 0.05 -0.07 0.00 -0.12 0.00 0.00 57.88 57.93 1tj2 h LEU 492 Cb 0.35 0.10 -0.02 0.00 -0.73 0.00 0.00 40.66 40.37 1tj2 h LEU 492 CO -0.43 -0.05 -0.03 0.00 -0.62 0.00 0.00 178.44 177.31 1tj2 h ALA 493 N 1.17 1.18 -0.27 1.25 0.00 -0.26 -1.14 119.26 121.19 1tj2 h ALA 493 Ca 0.08 -0.25 -0.04 0.00 0.00 0.00 0.00 54.91 54.70 1tj2 h ALA 493 Cb 0.13 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 1tj2 h ALA 493 CO -0.18 0.53 0.02 0.00 0.00 0.00 0.00 179.25 179.63 1tj2 h ALA 494 N 1.33 0.36 -0.19 0.00 0.00 -0.30 -2.13 119.26 118.34 1tj2 h ALA 494 Ca 0.13 -0.21 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 1tj2 h ALA 494 Cb 0.44 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 1tj2 h ALA 494 CO 0.02 0.08 0.10 0.82 0.00 0.00 0.00 179.25 180.27 1tj2 h ILE 495 N 0.26 1.12 -0.75 0.00 5.03 -1.07 0.85 117.51 122.96 1tj2 h ILE 495 Ca 0.08 -0.33 0.17 0.00 -0.12 0.00 0.00 64.86 64.66 1tj2 h ILE 495 Cb 0.39 0.99 -0.13 0.00 -3.03 0.00 0.00 36.82 35.05 1tj2 h ILE 495 CO 0.01 0.11 0.04 0.22 -0.68 0.00 0.00 178.15 177.85 1tj2 h TYR 496 N 0.19 0.01 0.07 1.37 5.03 -1.12 0.96 116.97 123.49 1tj2 h TYR 496 Ca 0.07 0.05 -0.26 0.00 2.58 0.00 0.00 58.73 61.17 1tj2 h TYR 496 Cb 0.09 0.11 0.02 0.00 1.55 0.00 0.00 36.73 38.51 1tj2 h TYR 496 CO -0.03 -0.21 -1.06 1.96 -1.32 0.00 0.00 178.16 177.50 1tj2 h GLN 497 N 0.13 0.59 0.00 1.82 1.08 -1.11 -3.23 115.11 114.39 1tj2 h GLN 497 Ca 0.41 -0.73 -0.02 0.00 -1.45 0.00 0.00 58.65 56.87 1tj2 h GLN 497 Cb 0.73 0.23 -0.00 0.00 -0.05 0.00 0.00 27.48 28.39 1tj2 h GLN 497 CO -0.63 1.31 -0.08 -0.07 -0.95 0.00 0.00 178.83 178.41 1tj2 h LEU 498 N 0.19 0.00 -0.60 1.46 3.38 -0.36 -1.56 115.31 117.82 1tj2 h LEU 498 Ca -0.15 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.82 1tj2 h LEU 498 Cb 1.74 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.49 1tj2 h LEU 498 CO 0.20 0.08 0.00 0.00 0.09 0.00 0.00 178.44 178.81 1tj2 n ALA 499 N -2.47 1.69 -0.05 1.53 0.00 0.29 -4.98 120.51 116.52 1tj2 n ALA 499 Ca -0.03 0.07 0.00 0.00 0.00 0.00 0.00 53.44 53.48 1tj2 n ALA 499 Cb 0.16 -1.38 -0.00 0.00 0.00 0.00 0.00 19.45 18.23 1tj2 n ALA 499 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1tj2 n GLY 500 N 0.05 -2.15 3.82 0.00 0.00 -0.59 -4.84 105.19 101.48 1tj2 n GLY 500 Ca 0.02 -1.46 -0.31 0.00 0.00 0.00 0.00 46.02 44.27 1tj2 n GLY 500 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1tj2 s GLN 501 N -0.47 2.90 -0.61 1.61 -0.21 -1.26 -4.29 119.66 117.33 1tj2 s GLN 501 Ca 0.00 0.97 -0.01 0.00 0.02 0.00 0.00 55.36 56.33 1tj2 s GLN 501 Cb 0.00 -1.98 0.00 0.00 1.00 0.00 0.00 33.01 32.03 1tj2 s GLN 501 CO 0.00 -1.13 0.52 0.09 -2.12 0.00 0.00 175.29 172.65 1tj2 n ASN 502 N -3.15 -2.57 -4.51 5.90 5.03 -1.26 -4.99 115.26 109.71 1tj2 n ASN 502 Ca 0.08 -0.30 -0.45 0.00 0.87 0.00 0.00 54.58 54.78 1tj2 n ASN 502 Cb 0.53 -2.77 -0.02 0.00 -1.02 0.00 0.00 39.78 36.51 1tj2 n ASN 502 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1tj2 n TYR 503 N -2.85 0.43 -4.00 3.10 9.36 -1.26 -5.04 117.16 116.90 1tj2 n TYR 503 Ca -0.10 0.78 -0.12 0.00 3.32 0.00 0.00 57.90 61.77 1tj2 n TYR 503 Cb 0.57 -2.12 -0.13 0.00 -0.63 0.00 0.00 39.34 37.04 1tj2 n TYR 503 CO 0.00 0.00 0.00 1.52 0.22 0.00 0.00 176.86 178.60 1tj2 s TYR 504 N -1.10 0.29 0.29 2.98 -0.85 -1.26 -5.07 117.35 112.63 1tj2 s TYR 504 Ca 0.61 -0.26 0.04 0.00 -0.52 0.00 0.00 57.07 56.94 1tj2 s TYR 504 Cb -0.76 -0.19 0.65 0.00 0.38 0.00 0.00 41.96 42.04 1tj2 s TYR 504 CO 0.58 -0.07 1.80 -1.35 -1.52 0.00 0.00 175.55 174.99 1tj2 h PRO 505 N 5.41 0.83 0.00 -3.49 0.11 -1.96 0.11 132.00 133.00 1tj2 h PRO 505 Ca -0.29 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.77 1tj2 h PRO 505 Cb 1.20 -0.19 0.00 0.00 0.11 0.00 0.00 31.00 32.13 1tj2 h PRO 505 CO 0.46 0.55 0.00 0.41 -0.21 0.00 0.00 178.00 179.21 1tj2 n GLY 506 N -1.33 -0.67 0.09 -0.55 0.00 -1.26 -3.59 105.19 97.87 1tj2 n GLY 506 Ca 0.21 -0.08 -0.14 0.00 0.00 0.00 0.00 46.02 46.01 1tj2 n GLY 506 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 1tj2 h GLN 507 N 0.00 0.12 -2.06 1.61 4.15 -1.18 -3.48 115.11 114.27 1tj2 h GLN 507 Ca 0.00 -0.10 0.20 0.00 0.77 0.00 0.00 58.65 59.52 1tj2 h GLN 507 Cb 0.00 0.02 -0.12 0.00 0.21 0.00 0.00 27.48 27.59 1tj2 h GLN 507 CO 0.00 0.75 0.59 1.52 -1.93 0.00 0.00 178.83 179.76 1tj2 s TYR 508 N -3.60 -0.16 0.20 3.99 -0.85 -1.24 -4.28 117.35 111.41 1tj2 s TYR 508 Ca -0.16 -0.04 0.02 0.00 -0.52 0.00 0.00 57.07 56.37 1tj2 s TYR 508 Cb 0.01 0.59 -0.05 0.00 0.38 0.00 0.00 41.96 42.89 1tj2 s TYR 508 CO 0.71 -0.59 0.02 -1.83 -1.52 0.00 0.00 175.55 172.34 1tj2 s GLU 509 N -2.99 1.21 0.50 -3.49 -1.05 -0.86 -4.81 118.70 107.21 1tj2 s GLU 509 Ca 0.11 -1.60 -0.03 0.00 -0.15 0.00 0.00 54.97 53.29 1tj2 s GLU 509 Cb 0.00 -0.32 -0.01 0.00 -0.44 0.00 0.00 34.13 33.37 1tj2 s GLU 509 CO -0.02 -0.16 0.77 -0.06 0.95 0.00 0.00 175.26 176.74 1tj2 s PHE 510 N -3.64 3.32 0.03 4.83 0.40 -0.72 -0.77 117.98 121.43 1tj2 s PHE 510 Ca 0.28 0.51 -0.01 0.00 -0.60 0.00 0.00 56.93 57.10 1tj2 s PHE 510 Cb 0.06 -2.44 -0.03 0.00 0.51 0.00 0.00 43.02 41.13 1tj2 s PHE 510 CO 0.07 -0.48 -0.02 -0.65 0.70 0.00 0.00 175.22 174.83 1tj2 s GLN 511 N -4.74 0.44 0.09 0.44 -0.21 -0.51 -1.28 119.66 113.90 1tj2 s GLN 511 Ca 0.50 -0.85 -0.09 0.00 0.02 0.00 0.00 55.36 54.93 1tj2 s GLN 511 Cb -0.10 0.16 0.00 0.00 1.00 0.00 0.00 33.01 34.07 1tj2 s GLN 511 CO 0.42 -0.08 0.21 0.00 -2.12 0.00 0.00 175.29 173.72 1tj2 s LEU 513 N -2.86 4.43 0.28 0.00 1.43 -1.26 -0.58 118.68 120.13 1tj2 s LEU 513 Ca 0.05 1.16 -0.30 0.00 -1.03 0.00 0.00 54.13 54.01 1tj2 s LEU 513 Cb 0.05 -3.06 -0.12 0.00 0.03 0.00 0.00 46.19 43.08 1tj2 s LEU 513 CO -0.11 0.19 1.52 1.57 0.23 0.00 0.00 176.35 179.76 1tj2 n HIS 514 N 1.29 2.59 -0.77 0.29 -0.00 -0.77 -2.01 115.22 115.85 1tj2 n HIS 514 Ca -0.08 0.33 0.00 0.00 -0.00 0.00 0.00 57.72 57.97 1tj2 n HIS 514 Cb 0.51 -2.54 0.00 0.00 -0.00 0.00 0.00 29.99 27.96 1tj2 n HIS 514 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 1tj2 n GLY 515 N 2.11 0.83 0.00 1.57 0.00 -1.25 -4.47 105.19 103.98 1tj2 n GLY 515 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.11 1tj2 n GLY 515 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1tj2 n MET 516 N -2.15 0.89 0.00 1.61 2.00 -0.85 -4.91 117.12 113.70 1tj2 n MET 516 Ca 0.00 0.00 0.08 0.00 0.00 0.00 0.00 57.70 57.78 1tj2 n MET 516 Cb 0.00 -0.85 -0.04 0.00 0.00 0.00 0.00 33.22 32.33 1tj2 n MET 516 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1tj2 n GLY 517 N 2.67 -0.24 0.22 3.03 0.00 -1.10 -4.66 105.19 105.11 1tj2 n GLY 517 Ca 0.00 -0.45 -0.04 0.00 0.00 0.00 0.00 46.02 45.54 1tj2 n GLY 517 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1tj2 h GLU 518 N 0.88 0.52 -0.74 1.61 3.07 -1.91 -0.76 114.58 117.25 1tj2 h GLU 518 Ca 0.00 -0.03 0.00 0.00 -0.50 0.00 0.00 59.36 58.83 1tj2 h GLU 518 Cb 0.45 -0.12 -0.04 0.00 -0.84 0.00 0.00 28.75 28.21 1tj2 h GLU 518 CO 0.00 0.35 0.48 -1.35 -1.40 0.00 0.00 179.01 177.08 1tj2 h PRO 519 N 0.54 0.98 -0.35 2.33 0.11 -1.99 0.17 132.00 133.79 1tj2 h PRO 519 Ca 0.24 -0.07 -0.02 0.00 0.11 0.00 0.00 66.00 66.27 1tj2 h PRO 519 Cb 0.15 -0.22 -0.02 0.00 0.11 0.00 0.00 31.00 31.03 1tj2 h PRO 519 CO -0.17 0.67 0.15 1.25 -0.21 0.00 0.00 178.00 179.68 1tj2 h LEU 520 N 1.01 0.48 0.00 2.35 5.85 -1.73 -3.28 115.31 119.99 1tj2 h LEU 520 Ca 0.27 -0.16 0.00 0.00 0.84 0.00 0.00 57.88 58.83 1tj2 h LEU 520 Cb -0.09 -0.13 0.00 0.00 0.37 0.00 0.00 40.66 40.81 1tj2 h LEU 520 CO -0.06 0.51 -0.33 -1.22 -0.34 0.00 0.00 178.44 177.01 1tj2 n TYR 521 N -4.69 0.63 0.29 1.25 4.02 -0.34 -2.37 117.16 115.95 1tj2 n TYR 521 Ca -0.01 0.18 0.17 0.00 -0.01 0.00 0.00 57.90 58.23 1tj2 n TYR 521 Cb 0.13 -0.73 0.90 0.00 -0.02 0.00 0.00 39.34 39.63 1tj2 n TYR 521 CO 0.00 0.00 0.00 0.93 -1.01 0.00 0.00 176.86 176.78 1tj2 h GLU 522 N 0.00 0.00 -0.00 -0.72 4.39 -0.73 0.44 114.58 117.95 1tj2 h GLU 522 Ca 0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 1tj2 h GLU 522 Cb 0.71 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.36 1tj2 h GLU 522 CO 0.00 0.05 -0.12 1.04 -1.16 0.00 0.00 179.01 178.81 1tj2 n GLN 523 N -3.44 0.54 -0.01 2.33 6.02 -1.00 -4.62 117.38 117.20 1tj2 n GLN 523 Ca -0.02 -0.17 -0.05 0.00 -0.01 0.00 0.00 57.00 56.75 1tj2 n GLN 523 Cb 0.17 -1.50 -0.02 0.00 1.02 0.00 0.00 30.24 29.92 1tj2 n GLN 523 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 177.06 176.33 1tj2 n VAL 524 N -1.08 0.90 -2.79 5.09 0.31 -0.01 -2.71 118.33 118.04 1tj2 n VAL 524 Ca 0.13 0.13 -0.42 0.00 -0.01 0.00 0.00 64.34 64.17 1tj2 n VAL 524 Cb 0.29 -1.71 -0.03 0.00 -0.91 0.00 0.00 33.84 31.48 1tj2 n VAL 524 CO 0.00 0.00 0.00 -0.89 -1.32 0.00 0.00 176.83 174.62 1tj2 s THR 525 N -2.20 4.80 -4.39 2.52 2.01 -0.30 -0.82 115.64 117.25 1tj2 s THR 525 Ca -0.09 1.81 0.00 0.00 0.31 0.00 0.00 61.69 63.72 1tj2 s THR 525 Cb 0.02 -4.22 0.00 0.00 0.01 0.00 0.00 72.50 68.32 1tj2 s THR 525 CO 0.12 -0.05 0.00 0.61 -0.69 0.00 0.00 174.62 174.61 1tj2 n GLY 526 N 3.39 0.98 3.79 4.40 0.00 -1.26 -4.79 105.19 111.71 1tj2 n GLY 526 Ca 0.08 -1.99 -0.36 0.00 0.00 0.00 0.00 46.02 43.75 1tj2 n GLY 526 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1tj2 s LYS 527 N -1.22 4.19 0.48 1.61 1.02 -1.26 -2.23 119.74 122.33 1tj2 s LYS 527 Ca 0.00 1.45 0.14 0.00 0.02 0.00 0.00 55.97 57.58 1tj2 s LYS 527 Cb 0.00 -2.51 1.12 0.00 -0.52 0.00 0.00 37.83 35.92 1tj2 s LYS 527 CO 0.00 -0.10 2.08 0.28 -0.92 0.00 0.00 175.35 176.69 1tj2 h VAL 528 N 2.17 1.06 0.00 3.17 2.07 -1.91 -2.32 116.25 120.50 1tj2 h VAL 528 Ca -0.48 -0.24 0.00 0.00 0.82 0.00 0.00 66.70 66.80 1tj2 h VAL 528 Cb 1.21 1.05 0.00 0.00 -1.52 0.00 0.00 31.29 32.03 1tj2 h VAL 528 CO 0.62 0.08 0.00 0.00 0.02 0.00 0.00 177.57 178.29 1tj2 h ALA 529 N 1.90 1.00 -0.45 1.67 0.00 -1.92 -1.51 119.26 119.94 1tj2 h ALA 529 Ca 0.02 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.90 1tj2 h ALA 529 Cb 0.11 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 1tj2 h ALA 529 CO 0.00 0.00 0.04 -0.25 0.00 0.00 0.00 179.25 179.04 1tj2 n ASP 530 N -2.72 4.49 -0.87 0.00 8.00 -0.95 -4.92 116.55 119.57 1tj2 n ASP 530 Ca 0.03 -2.74 -0.09 0.00 0.71 0.00 0.00 54.79 52.70 1tj2 n ASP 530 Cb 0.35 -0.65 -0.02 0.00 -0.02 0.00 0.00 41.12 40.78 1tj2 n ASP 530 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1tj2 n GLY 531 N 0.38 0.52 3.89 0.44 0.00 -0.57 -4.96 105.19 104.89 1tj2 n GLY 531 Ca 0.23 -0.56 -0.20 0.00 0.00 0.00 0.00 46.02 45.48 1tj2 n GLY 531 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1tj2 s LYS 532 N -3.64 2.78 0.31 1.61 -0.14 -0.91 -4.91 119.74 114.83 1tj2 s LYS 532 Ca 0.00 -1.27 0.25 0.00 -1.36 0.00 0.00 55.97 53.59 1tj2 s LYS 532 Cb 0.00 -2.54 0.57 0.00 -1.68 0.00 0.00 37.83 34.17 1tj2 s LYS 532 CO 0.00 0.04 1.67 -0.07 -0.76 0.00 0.00 175.35 176.22 1tj2 h LEU 533 N 1.12 0.00 -1.73 3.17 3.38 -1.28 -3.34 115.31 116.63 1tj2 h LEU 533 Ca -0.44 -0.01 -0.33 0.00 0.09 0.00 0.00 57.88 57.19 1tj2 h LEU 533 Cb 1.26 0.00 0.16 0.00 0.09 0.00 0.00 40.66 42.17 1tj2 h LEU 533 CO 0.57 0.00 -0.78 -3.20 0.09 0.00 0.00 178.44 175.12 1tj2 n ASN 534 N -2.64 -2.32 -4.24 -0.43 4.05 -0.00 -4.89 115.26 104.79 1tj2 n ASN 534 Ca 0.05 -0.65 -0.31 0.00 0.45 0.00 0.00 54.58 54.12 1tj2 n ASN 534 Cb 0.48 -5.04 -0.17 0.00 1.23 0.00 0.00 39.78 36.28 1tj2 n ASN 534 CO 0.00 0.00 0.00 -0.13 -3.05 0.00 0.00 177.26 174.08 1tj2 s ARG 535 N -5.34 2.66 0.47 1.20 1.81 -0.83 -4.89 118.95 114.04 1tj2 s ARG 535 Ca 0.04 -0.87 -0.22 0.00 -1.72 0.00 0.00 55.73 52.95 1tj2 s ARG 535 Cb -0.01 -2.16 -0.07 0.00 -0.45 0.00 0.00 34.95 32.25 1tj2 s ARG 535 CO 0.74 0.30 1.11 -1.25 -0.68 0.00 0.00 175.30 175.53 1tj2 s PRO 536 N 0.03 3.75 -0.04 3.54 0.04 -1.26 -3.20 135.00 137.85 1tj2 s PRO 536 Ca -0.09 1.62 0.01 0.00 0.04 0.00 0.00 61.00 62.58 1tj2 s PRO 536 Cb -0.15 -2.29 0.02 0.00 0.04 0.00 0.00 34.50 32.12 1tj2 s PRO 536 CO 0.05 -0.52 -0.04 0.00 0.04 0.00 0.00 177.00 176.53 1tj2 s ARG 538 N 0.77 3.84 -0.14 0.00 3.52 -0.40 -1.17 118.95 125.35 1tj2 s ARG 538 Ca -0.10 -0.39 -0.20 0.00 -0.13 0.00 0.00 55.73 54.91 1tj2 s ARG 538 Cb -0.13 -3.47 -0.03 0.00 -1.56 0.00 0.00 34.95 29.76 1tj2 s ARG 538 CO 0.00 -0.13 0.59 0.42 -0.81 0.00 0.00 175.30 175.38 1tj2 s ILE 539 N 1.52 5.08 -0.29 4.11 1.01 0.13 -1.49 121.20 131.29 1tj2 s ILE 539 Ca 0.06 1.16 -0.26 0.00 0.00 0.00 0.00 60.65 61.61 1tj2 s ILE 539 Cb -0.15 -3.92 0.01 0.00 0.01 0.00 0.00 42.46 38.41 1tj2 s ILE 539 CO 0.06 0.21 0.94 -0.47 0.00 0.00 0.00 174.94 175.68 1tj2 s TYR 540 N 1.25 3.23 -0.38 3.97 5.04 0.26 -0.53 117.35 130.18 1tj2 s TYR 540 Ca 0.30 1.11 0.04 0.00 -2.44 0.00 0.00 57.07 56.07 1tj2 s TYR 540 Cb -0.16 -3.36 0.11 0.00 0.35 0.00 0.00 41.96 38.90 1tj2 s TYR 540 CO 0.12 -0.59 0.10 0.00 -1.34 0.00 0.00 175.55 173.83 1tj2 s ALA 541 N 3.22 2.94 0.30 3.97 0.00 0.42 -1.84 121.76 130.77 1tj2 s ALA 541 Ca 0.39 -2.67 -0.29 0.00 0.00 0.00 0.00 51.96 49.39 1tj2 s ALA 541 Cb -0.14 -2.00 -0.10 0.00 0.00 0.00 0.00 23.12 20.88 1tj2 s ALA 541 CO 0.11 -1.76 1.31 -2.14 0.00 0.00 0.00 175.76 173.29 1tj2 s PRO 542 N 0.66 4.36 -0.12 0.00 0.02 -1.26 -1.16 135.00 137.50 1tj2 s PRO 542 Ca 0.12 2.18 -0.01 0.00 0.02 0.00 0.00 61.00 63.32 1tj2 s PRO 542 Cb -0.20 -3.10 0.03 0.00 0.02 0.00 0.00 34.50 31.25 1tj2 s PRO 542 CO -0.07 -0.21 -0.06 0.08 -0.33 0.00 0.00 177.00 176.42 1tj2 s VAL 543 N -0.81 0.95 0.00 3.83 1.01 0.13 -1.29 120.40 124.21 1tj2 s VAL 543 Ca 0.51 -0.31 0.00 0.00 0.00 0.00 0.00 61.98 62.18 1tj2 s VAL 543 Cb -0.39 -1.03 0.00 0.00 0.00 0.00 0.00 36.38 34.96 1tj2 s VAL 543 CO 0.49 0.29 0.00 0.61 0.00 0.00 0.00 175.10 176.49 1tj2 n GLY 544 N 4.96 1.51 3.95 4.51 0.00 -0.27 -0.91 105.19 118.94 1tj2 n GLY 544 Ca -0.12 -1.01 -0.27 0.00 0.00 0.00 0.00 46.02 44.63 1tj2 n GLY 544 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1tj2 s THR 545 N -2.00 2.13 0.58 2.61 -4.23 -1.25 -4.22 115.64 109.26 1tj2 s THR 545 Ca 0.00 -0.27 0.29 0.00 -1.18 0.00 0.00 61.69 60.52 1tj2 s THR 545 Cb 0.00 -2.86 0.39 0.00 1.34 0.00 0.00 72.50 71.37 1tj2 s THR 545 CO 0.00 0.00 1.93 1.12 -0.54 0.00 0.00 174.62 177.13 1tj2 h HIS 546 N -0.95 0.00 0.00 3.99 2.07 -2.00 -2.00 115.15 116.25 1tj2 h HIS 546 Ca -0.42 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.10 1tj2 h HIS 546 Cb 1.27 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.25 1tj2 h HIS 546 CO -0.36 0.00 0.00 -0.85 -3.07 0.00 0.00 177.93 173.65 1tj2 n GLU 547 N -3.81 0.14 -0.06 5.12 0.00 -1.26 -3.24 120.64 117.52 1tj2 n GLU 547 Ca 0.08 0.09 0.03 0.00 0.00 0.00 0.00 57.16 57.36 1tj2 n GLU 547 Cb 0.63 -1.50 0.06 0.00 0.00 0.00 0.00 31.44 30.63 1tj2 n GLU 547 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.13 177.38 1tj2 n THR 548 N -1.41 0.72 0.01 3.84 -2.24 -0.75 -4.79 114.28 109.66 1tj2 n THR 548 Ca 0.08 -0.86 0.11 0.00 -2.27 0.00 0.00 64.05 61.10 1tj2 n THR 548 Cb 0.23 0.67 -0.13 0.00 -2.10 0.00 0.00 70.33 69.00 1tj2 n THR 548 CO 0.00 0.00 0.00 -0.11 -0.57 0.00 0.00 175.07 174.39 1tj2 n LEU 549 N 0.08 0.20 0.26 3.22 7.94 -1.20 -3.73 117.00 123.77 1tj2 n LEU 549 Ca 0.05 0.08 -0.16 0.00 -1.11 0.00 0.00 56.01 54.86 1tj2 n LEU 549 Cb 0.28 -0.00 -0.08 0.00 0.53 0.00 0.00 43.42 44.15 1tj2 n LEU 549 CO 0.04 -0.03 0.61 0.25 -1.11 0.00 0.00 177.39 177.14 1tj2 h LEU 550 N 0.00 -1.06 -0.57 -1.96 5.85 -1.87 -1.00 115.31 114.70 1tj2 h LEU 550 Ca -0.01 0.09 -0.03 0.00 0.84 0.00 0.00 57.88 58.76 1tj2 h LEU 550 Cb 1.03 0.35 -0.03 0.00 0.37 0.00 0.00 40.66 42.39 1tj2 h LEU 550 CO 0.00 -0.55 0.22 0.00 -0.34 0.00 0.00 178.44 177.77 1tj2 h ALA 551 N -0.45 0.74 -0.27 1.25 0.00 -1.98 -1.16 119.26 117.39 1tj2 h ALA 551 Ca -0.04 -0.17 -0.01 0.00 0.00 0.00 0.00 54.91 54.70 1tj2 h ALA 551 Cb 0.73 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.28 1tj2 h ALA 551 CO -0.05 0.36 0.15 -0.92 0.00 0.00 0.00 179.25 178.80 1tj2 h TYR 552 N 0.79 0.38 -0.77 0.00 3.20 -1.82 -2.43 116.97 116.31 1tj2 h TYR 552 Ca 0.19 -0.01 0.03 0.00 3.14 0.00 0.00 58.73 62.09 1tj2 h TYR 552 Cb 0.21 -0.12 -0.05 0.00 1.54 0.00 0.00 36.73 38.31 1tj2 h TYR 552 CO 0.01 0.32 0.49 1.25 -1.64 0.00 0.00 178.16 178.58 1tj2 h LEU 553 N 0.33 0.80 -0.75 2.82 7.12 -0.79 -1.76 115.31 123.08 1tj2 h LEU 553 Ca 0.10 0.00 -0.03 0.00 0.13 0.00 0.00 57.88 58.08 1tj2 h LEU 553 Cb 0.06 -0.17 -0.03 0.00 -0.53 0.00 0.00 40.66 39.99 1tj2 h LEU 553 CO -0.02 0.55 0.35 0.58 -0.13 0.00 0.00 178.44 179.77 1tj2 h VAL 554 N 0.94 1.24 -0.68 1.05 2.07 -1.00 0.13 116.25 120.00 1tj2 h VAL 554 Ca 0.31 -0.69 -0.03 0.00 0.82 0.00 0.00 66.70 67.11 1tj2 h VAL 554 Cb 0.03 0.32 -0.03 0.00 -1.52 0.00 0.00 31.29 30.09 1tj2 h VAL 554 CO -0.12 0.29 0.30 0.03 0.02 0.00 0.00 177.57 178.09 1tj2 h ARG 555 N 1.05 0.98 -0.28 1.57 3.08 -0.95 -1.28 114.38 118.55 1tj2 h ARG 555 Ca 0.25 -0.15 -0.08 0.00 0.07 0.00 0.00 59.98 60.08 1tj2 h ARG 555 Cb 0.13 -0.18 -0.02 0.00 0.08 0.00 0.00 29.97 29.99 1tj2 h ARG 555 CO -0.03 0.78 -0.16 0.00 -1.07 0.00 0.00 179.97 179.49 1tj2 h ARG 556 N 0.97 0.50 -0.32 0.04 2.47 -0.44 -0.83 114.38 116.78 1tj2 h ARG 556 Ca 0.23 -0.16 -0.10 0.00 -1.26 0.00 0.00 59.98 58.70 1tj2 h ARG 556 Cb 0.14 -0.05 -0.01 0.00 -1.65 0.00 0.00 29.97 28.41 1tj2 h ARG 556 CO -0.03 0.65 -0.20 -0.07 0.56 0.00 0.00 179.97 180.88 1tj2 h LEU 557 N 0.46 0.72 -0.66 3.04 3.38 -0.21 -0.37 115.31 121.67 1tj2 h LEU 557 Ca 0.08 -0.43 -0.00 0.00 0.09 0.00 0.00 57.88 57.62 1tj2 h LEU 557 Cb 0.55 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 41.06 1tj2 h LEU 557 CO 0.04 1.00 0.41 -0.07 0.09 0.00 0.00 178.44 179.90 1tj2 h LEU 558 N 0.45 0.79 0.05 1.67 3.38 -1.17 0.39 115.31 120.87 1tj2 h LEU 558 Ca 0.06 -0.05 -0.00 0.00 0.09 0.00 0.00 57.88 57.98 1tj2 h LEU 558 Cb 0.75 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 41.30 1tj2 h LEU 558 CO 0.06 0.60 -0.03 -0.08 0.09 0.00 0.00 178.44 179.09 1tj2 h GLU 559 N 0.90 -0.07 0.00 1.13 4.81 -0.97 -2.62 114.58 117.75 1tj2 h GLU 559 Ca 0.24 0.00 -0.10 0.00 -0.13 0.00 0.00 59.36 59.38 1tj2 h GLU 559 Cb -0.05 0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.33 1tj2 h GLU 559 CO -0.05 0.08 -0.45 -0.91 -0.73 0.00 0.00 179.01 176.95 1tj2 h ASN 560 N -0.20 0.00 0.39 1.04 2.35 -0.97 -3.28 115.58 114.92 1tj2 h ASN 560 Ca -0.01 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.74 1tj2 h ASN 560 Cb 0.18 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.55 1tj2 h ASN 560 CO 0.01 0.45 -0.73 0.61 -1.65 0.00 0.00 177.43 176.13 1tj2 n GLY 561 N 0.20 -1.19 3.71 2.83 0.00 0.12 -4.27 105.19 106.59 1tj2 n GLY 561 Ca -0.01 -0.41 -0.42 0.00 0.00 0.00 0.00 46.02 45.18 1tj2 n GLY 561 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1tj2 s ALA 562 N -3.05 3.25 0.14 4.61 0.00 -0.99 -4.93 121.76 120.79 1tj2 s ALA 562 Ca 0.09 0.65 0.34 0.00 0.00 0.00 0.00 51.96 53.04 1tj2 s ALA 562 Cb 0.16 -3.37 1.62 0.00 0.00 0.00 0.00 23.12 21.53 1tj2 s ALA 562 CO 0.76 -0.27 2.02 -2.95 0.00 0.00 0.00 175.76 175.32 1tj2 h ASN 563 N 6.58 0.00 0.85 0.00 -1.07 -1.92 -1.71 115.58 118.31 1tj2 h ASN 563 Ca -0.42 0.00 0.00 0.00 0.07 0.00 0.00 56.30 55.95 1tj2 h ASN 563 Cb 1.22 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 37.47 1tj2 h ASN 563 CO 0.76 0.00 -0.29 0.35 0.07 0.00 0.00 177.43 178.32 1tj2 n THR 564 N -2.83 0.14 -2.43 6.14 -2.24 -1.26 -4.52 114.28 107.28 1tj2 n THR 564 Ca -0.01 -0.08 -0.41 0.00 -2.27 0.00 0.00 64.05 61.28 1tj2 n THR 564 Cb 0.18 -0.17 -0.04 0.00 -2.10 0.00 0.00 70.33 68.20 1tj2 n THR 564 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 1tj2 s SER 565 N -3.41 7.17 0.25 3.42 0.01 -0.65 -4.93 113.70 115.57 1tj2 s SER 565 Ca 0.11 2.23 -0.03 0.00 1.31 0.00 0.00 55.95 59.57 1tj2 s SER 565 Cb 0.17 -2.61 0.47 0.00 0.21 0.00 0.00 66.02 64.25 1tj2 s SER 565 CO 0.63 -0.27 1.77 0.15 0.41 0.00 0.00 173.24 175.93 1tj2 h PHE 566 N 4.68 0.74 0.00 2.43 3.57 -1.90 0.12 116.94 126.59 1tj2 h PHE 566 Ca -0.45 0.03 -0.04 0.00 3.53 0.00 0.00 57.97 61.04 1tj2 h PHE 566 Cb 1.21 -0.21 -0.01 0.00 2.79 0.00 0.00 35.95 39.74 1tj2 h PHE 566 CO 0.61 0.21 -0.20 -0.39 -2.23 0.00 0.00 178.31 176.30 1tj2 h VAL 567 N 0.64 0.59 0.06 1.41 -1.51 -1.90 -0.33 116.25 115.21 1tj2 h VAL 567 Ca 0.43 -0.96 -0.09 0.00 -1.23 0.00 0.00 66.70 64.85 1tj2 h VAL 567 Cb 0.56 1.64 0.01 0.00 -2.13 0.00 0.00 31.29 31.36 1tj2 h VAL 567 CO -0.33 0.20 -0.40 -1.13 -1.23 0.00 0.00 177.57 174.68 1tj2 h ASN 568 N 0.00 0.24 0.23 4.19 -0.73 -1.55 -3.37 115.58 114.60 1tj2 h ASN 568 Ca -0.00 -0.95 -0.06 0.00 1.87 0.00 0.00 56.30 57.16 1tj2 h ASN 568 Cb 0.62 -0.08 -0.01 0.00 0.27 0.00 0.00 38.32 39.12 1tj2 h ASN 568 CO 0.03 1.17 -0.26 0.03 -0.37 0.00 0.00 177.43 178.03 1tj2 h ARG 569 N -0.64 0.05 -0.43 6.67 3.08 -0.73 -2.93 114.38 119.44 1tj2 h ARG 569 Ca -0.07 -0.01 -0.06 0.00 0.07 0.00 0.00 59.98 59.91 1tj2 h ARG 569 Cb 1.29 -0.01 -0.02 0.00 0.08 0.00 0.00 29.97 31.32 1tj2 h ARG 569 CO 0.08 0.31 0.01 0.97 -1.07 0.00 0.00 179.97 180.26 1tj2 h ILE 570 N 0.05 1.23 0.00 2.04 6.09 -1.23 -2.46 117.51 123.22 1tj2 h ILE 570 Ca 0.01 -0.91 -0.04 0.00 -1.37 0.00 0.00 64.86 62.55 1tj2 h ILE 570 Cb 0.48 0.89 -0.01 0.00 0.47 0.00 0.00 36.82 38.66 1tj2 h ILE 570 CO 0.03 0.32 -0.18 0.00 -3.07 0.00 0.00 178.15 175.25 1tj2 h ALA 571 N 1.36 0.99 -1.05 0.18 0.00 -1.67 -3.41 119.26 115.65 1tj2 h ALA 571 Ca 0.13 -0.16 -0.41 0.00 0.00 0.00 0.00 54.91 54.47 1tj2 h ALA 571 Cb 0.39 -0.03 -0.05 0.00 0.00 0.00 0.00 17.79 18.10 1tj2 h ALA 571 CO 0.01 0.23 1.03 0.34 0.00 0.00 0.00 179.25 180.86 1tj2 s ASP 572 N -6.11 5.36 0.25 0.00 -1.08 -0.93 -4.84 116.67 109.31 1tj2 s ASP 572 Ca 0.01 -0.38 0.18 0.00 -0.52 0.00 0.00 52.55 51.85 1tj2 s ASP 572 Cb 0.09 -2.55 0.93 0.00 -1.46 0.00 0.00 42.92 39.93 1tj2 s ASP 572 CO 0.63 -2.46 1.55 0.41 0.52 0.00 0.00 175.17 175.82 1tj2 n THR 573 N 7.48 1.17 0.07 1.71 -1.04 -1.26 -2.18 114.28 120.23 1tj2 n THR 573 Ca 0.31 0.60 -0.17 0.00 -2.04 0.00 0.00 64.05 62.75 1tj2 n THR 573 Cb 0.49 -1.58 -0.14 0.00 -1.82 0.00 0.00 70.33 67.28 1tj2 n THR 573 CO 0.00 0.00 0.00 0.77 -0.64 0.00 0.00 175.07 175.20 1tj2 h SER 574 N 0.00 0.41 -2.90 8.00 4.64 -1.93 -3.45 113.55 118.33 1tj2 h SER 574 Ca 0.00 -0.54 -0.56 0.00 -0.47 0.00 0.00 61.79 60.22 1tj2 h SER 574 Cb 0.06 -0.13 -0.04 0.00 -0.31 0.00 0.00 62.40 61.99 1tj2 h SER 574 CO 0.00 1.44 1.00 -0.22 -0.87 0.00 0.00 176.83 178.18 1tj2 s LEU 575 N -7.02 4.06 0.62 5.97 2.96 -0.93 -4.98 118.68 119.36 1tj2 s LEU 575 Ca -0.08 1.63 -0.17 0.00 -0.22 0.00 0.00 54.13 55.28 1tj2 s LEU 575 Cb 0.07 -3.54 -0.02 0.00 0.50 0.00 0.00 46.19 43.20 1tj2 s LEU 575 CO 0.86 -0.97 1.16 -2.16 -1.32 0.00 0.00 176.35 173.92 1tj2 s PRO 576 N 4.00 2.88 0.25 0.98 0.04 -1.26 -4.84 135.00 137.06 1tj2 s PRO 576 Ca 0.61 1.63 -0.03 0.00 0.04 0.00 0.00 61.00 63.25 1tj2 s PRO 576 Cb -0.23 -1.94 0.50 0.00 0.04 0.00 0.00 34.50 32.87 1tj2 s PRO 576 CO 0.22 -1.23 1.70 -0.07 0.04 0.00 0.00 177.00 177.66 1tj2 h LEU 577 N 0.53 0.13 -1.28 -3.56 3.38 -1.96 -2.33 115.31 110.22 1tj2 h LEU 577 Ca -0.49 0.14 -0.00 0.00 0.09 0.00 0.00 57.88 57.62 1tj2 h LEU 577 Cb 1.27 0.16 -0.03 0.00 0.09 0.00 0.00 40.66 42.15 1tj2 h LEU 577 CO 0.54 0.00 0.41 0.44 0.09 0.00 0.00 178.44 179.93 1tj2 h ASP 578 N 0.33 0.79 -0.22 -0.43 3.45 -1.96 -1.80 116.42 116.59 1tj2 h ASP 578 Ca 0.44 -0.04 -0.18 0.00 0.43 0.00 0.00 57.03 57.68 1tj2 h ASP 578 Cb 0.74 -0.20 -0.00 0.00 -0.56 0.00 0.00 39.33 39.31 1tj2 h ASP 578 CO -0.49 0.60 -0.54 -0.33 -1.57 0.00 0.00 179.24 176.92 1tj2 h GLU 579 N 0.92 0.81 -0.50 3.56 5.08 -1.80 -2.82 114.58 119.83 1tj2 h GLU 579 Ca 0.24 -0.51 0.02 0.00 -1.00 0.00 0.00 59.36 58.12 1tj2 h GLU 579 Cb -0.05 0.06 -0.03 0.00 0.50 0.00 0.00 28.75 29.22 1tj2 h GLU 579 CO -0.05 1.14 0.31 1.25 -1.00 0.00 0.00 179.01 180.66 1tj2 h LEU 580 N 0.63 0.51 -3.88 1.33 5.85 -1.04 -2.88 115.31 115.82 1tj2 h LEU 580 Ca 0.02 0.00 -0.37 0.00 0.84 0.00 0.00 57.88 58.36 1tj2 h LEU 580 Cb 1.13 -0.11 -0.22 0.00 0.37 0.00 0.00 40.66 41.83 1tj2 h LEU 580 CO 0.12 0.36 0.48 1.33 -0.34 0.00 0.00 178.44 180.38 1tj2 n VAL 581 N -4.79 3.09 -2.05 1.05 0.24 -0.74 -4.90 118.33 110.24 1tj2 n VAL 581 Ca 0.03 -1.78 -0.39 0.00 -2.04 0.00 0.00 64.34 60.17 1tj2 n VAL 581 Cb 0.06 -0.42 0.00 0.00 -1.47 0.00 0.00 33.84 32.02 1tj2 n VAL 581 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1tj2 s ALA 582 N -3.15 3.17 0.01 2.33 0.00 -1.07 -4.87 121.76 118.17 1tj2 s ALA 582 Ca 0.56 1.21 -0.30 0.00 0.00 0.00 0.00 51.96 53.43 1tj2 s ALA 582 Cb 0.46 -3.48 -0.06 0.00 0.00 0.00 0.00 23.12 20.04 1tj2 s ALA 582 CO 0.12 -0.87 1.49 0.34 0.00 0.00 0.00 175.76 176.85 1tj2 s ASP 583 N -0.85 6.76 0.28 0.00 -1.08 -1.26 -4.94 116.67 115.59 1tj2 s ASP 583 Ca 0.60 2.22 -0.01 0.00 -0.52 0.00 0.00 52.55 54.84 1tj2 s ASP 583 Cb -0.37 -2.56 0.41 0.00 -1.46 0.00 0.00 42.92 38.94 1tj2 s ASP 583 CO 0.47 -0.79 1.83 -0.65 0.52 0.00 0.00 175.17 176.55 1tj2 h PRO 584 N 8.14 0.82 -0.38 4.34 0.11 -1.92 -1.10 132.00 142.00 1tj2 h PRO 584 Ca -0.39 -0.16 -0.00 0.00 0.11 0.00 0.00 66.00 65.55 1tj2 h PRO 584 Cb 1.18 -0.12 -0.02 0.00 0.11 0.00 0.00 31.00 32.15 1tj2 h PRO 584 CO 0.92 0.73 0.23 0.28 -0.21 0.00 0.00 178.00 179.95 1tj2 h VAL 585 N 0.79 1.12 -0.72 3.15 2.07 -1.91 -1.01 116.25 119.75 1tj2 h VAL 585 Ca 0.17 -0.29 -0.07 0.00 0.82 0.00 0.00 66.70 67.34 1tj2 h VAL 585 Cb 0.29 0.63 -0.03 0.00 -1.52 0.00 0.00 31.29 30.66 1tj2 h VAL 585 CO -0.00 0.12 0.19 0.74 0.02 0.00 0.00 177.57 178.64 1tj2 h THR 586 N 0.50 1.26 -0.91 2.57 2.02 -1.91 -0.97 112.91 115.47 1tj2 h THR 586 Ca 0.14 -0.97 0.03 0.00 0.77 0.00 0.00 66.41 66.38 1tj2 h THR 586 Cb 0.00 0.51 -0.05 0.00 -1.74 0.00 0.00 68.15 66.87 1tj2 h THR 586 CO -0.03 0.37 0.60 0.00 0.37 0.00 0.00 175.52 176.83 1tj2 h ALA 587 N 1.10 1.42 -0.29 6.16 0.00 -0.96 -0.99 119.26 125.69 1tj2 h ALA 587 Ca 0.23 -0.05 -0.19 0.00 0.00 0.00 0.00 54.91 54.91 1tj2 h ALA 587 Cb 0.36 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 17.83 1tj2 h ALA 587 CO 0.00 0.50 -0.54 0.28 0.00 0.00 0.00 179.25 179.48 1tj2 h VAL 588 N 1.14 1.27 0.00 0.00 2.07 -0.12 -1.97 116.25 118.65 1tj2 h VAL 588 Ca 0.36 -1.72 -0.07 0.00 0.82 0.00 0.00 66.70 66.09 1tj2 h VAL 588 Cb 0.00 1.62 -0.01 0.00 -1.52 0.00 0.00 31.29 31.38 1tj2 h VAL 588 CO -0.11 0.56 -0.32 -0.33 0.02 0.00 0.00 177.57 177.40 1tj2 h GLU 589 N 0.68 0.00 -0.09 1.57 5.08 -1.07 -0.54 114.58 120.21 1tj2 h GLU 589 Ca 0.02 0.00 -0.05 0.00 -1.00 0.00 0.00 59.36 58.32 1tj2 h GLU 589 Cb 1.15 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.40 1tj2 h GLU 589 CO 0.12 0.32 -0.15 -0.22 -1.00 0.00 0.00 179.01 178.08 1tj2 h LYS 590 N 0.00 0.26 -0.80 2.33 3.64 -0.96 -2.28 116.57 118.76 1tj2 h LYS 590 Ca -0.00 -0.16 0.06 0.00 -1.27 0.00 0.00 60.65 59.28 1tj2 h LYS 590 Cb 0.57 0.02 -0.06 0.00 -0.41 0.00 0.00 32.23 32.35 1tj2 h LYS 590 CO 0.04 0.74 0.49 -0.07 -2.27 0.00 0.00 179.45 178.37 1tj2 h LEU 591 N -0.19 0.76 -1.15 5.20 3.38 -1.25 -1.89 115.31 120.16 1tj2 h LEU 591 Ca 0.01 0.02 -0.05 0.00 0.09 0.00 0.00 57.88 57.95 1tj2 h LEU 591 Cb 0.72 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 41.31 1tj2 h LEU 591 CO 0.03 0.48 0.07 0.00 0.09 0.00 0.00 178.44 179.12 1tj2 h ALA 592 N 1.39 1.31 0.04 1.53 0.00 -0.95 0.50 119.26 123.09 1tj2 h ALA 592 Ca 0.35 -0.19 -0.24 0.00 0.00 0.00 0.00 54.91 54.83 1tj2 h ALA 592 Cb 0.17 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.78 1tj2 h ALA 592 CO -0.17 0.48 -1.03 0.37 0.00 0.00 0.00 179.25 178.90 1tj2 h GLN 593 N 0.64 0.32 -0.27 0.00 -0.00 -1.16 -1.08 115.11 113.57 1tj2 h GLN 593 Ca 0.14 -0.41 -0.15 0.00 -0.00 0.00 0.00 58.65 58.23 1tj2 h GLN 593 Cb 0.29 0.13 -0.01 0.00 0.00 0.00 0.00 27.48 27.90 1tj2 h GLN 593 CO 0.00 1.11 -0.46 0.37 0.00 0.00 0.00 178.83 179.86 1tj2 h GLN 594 N 0.16 0.70 0.00 1.69 4.15 -1.00 -3.37 115.11 117.43 1tj2 h GLN 594 Ca -0.09 -0.39 0.00 0.00 0.77 0.00 0.00 58.65 58.94 1tj2 h GLN 594 Cb 1.69 0.03 0.00 0.00 0.21 0.00 0.00 27.48 29.41 1tj2 h GLN 594 CO 0.17 1.01 -1.84 0.39 -1.93 0.00 0.00 178.83 176.63 1tj2 n GLU 595 N -4.01 0.58 0.00 1.69 1.02 0.14 -5.01 120.64 115.05 1tj2 n GLU 595 Ca -0.03 -0.17 0.00 0.00 -0.02 0.00 0.00 57.16 56.95 1tj2 n GLU 595 Cb 0.56 -1.45 0.00 0.00 -0.02 0.00 0.00 31.44 30.53 1tj2 n GLU 595 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1tj2 n GLY 596 N 1.42 0.60 3.46 0.62 0.00 -0.43 -5.05 105.19 105.81 1tj2 n GLY 596 Ca -0.03 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.82 1tj2 n GLY 596 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1tj2 s GLN 597 N -0.60 0.98 0.01 1.61 0.74 -1.08 -5.00 119.66 116.32 1tj2 s GLN 597 Ca 0.00 0.15 -0.27 0.00 0.05 0.00 0.00 55.36 55.30 1tj2 s GLN 597 Cb 0.00 0.46 -0.04 0.00 1.10 0.00 0.00 33.01 34.52 1tj2 s GLN 597 CO 0.00 -0.30 0.84 0.99 -0.55 0.00 0.00 175.29 176.27 1tj2 s THR 598 N -1.25 4.82 -0.16 -0.34 2.01 -1.26 -4.26 115.64 115.21 1tj2 s THR 598 Ca -0.11 1.77 0.00 0.00 0.31 0.00 0.00 61.69 63.66 1tj2 s THR 598 Cb -0.01 -4.19 0.00 0.00 0.01 0.00 0.00 72.50 68.31 1tj2 s THR 598 CO 0.09 0.27 0.00 0.61 -0.69 0.00 0.00 174.62 174.89 1tj2 n GLY 599 N 2.71 0.31 3.77 4.40 0.00 -1.26 -4.40 105.19 110.72 1tj2 n GLY 599 Ca 0.01 -0.83 -0.40 0.00 0.00 0.00 0.00 46.02 44.80 1tj2 n GLY 599 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1tj2 s LEU 600 N -0.51 4.32 0.97 0.99 1.43 -1.26 -1.36 118.68 123.27 1tj2 s LEU 600 Ca 0.00 2.60 -0.11 0.00 -1.03 0.00 0.00 54.13 55.59 1tj2 s LEU 600 Cb 0.00 -3.80 0.15 0.00 0.03 0.00 0.00 46.19 42.57 1tj2 s LEU 600 CO 0.00 -0.65 0.95 -2.65 0.23 0.00 0.00 176.35 174.23 1tj2 n PRO 601 N 0.47 -0.76 -1.62 1.29 -0.02 -1.26 -4.89 135.00 128.20 1tj2 n PRO 601 Ca 0.02 -0.17 -0.49 0.00 -2.02 0.00 0.00 63.50 60.85 1tj2 n PRO 601 Cb 0.43 -2.23 -0.05 0.00 -0.02 0.00 0.00 33.50 31.64 1tj2 n PRO 601 CO 0.00 0.00 0.00 1.58 1.98 0.00 0.00 175.50 179.06 1tj2 n HIS 602 N -4.25 1.77 0.24 6.00 -0.00 -1.26 -4.84 115.22 112.86 1tj2 n HIS 602 Ca 0.09 0.52 0.14 0.00 0.46 0.00 0.00 57.72 58.93 1tj2 n HIS 602 Cb 0.53 -2.39 0.79 0.00 -0.12 0.00 0.00 29.99 28.80 1tj2 n HIS 602 CO 0.00 0.00 0.00 -1.00 0.46 0.00 0.00 176.34 175.80 1tj2 h PRO 603 N 4.58 0.00 -0.06 1.57 0.13 -1.95 -1.96 132.00 134.31 1tj2 h PRO 603 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 1tj2 h PRO 603 Cb 1.31 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.44 1tj2 h PRO 603 CO 0.78 0.00 0.00 1.63 -0.23 0.00 0.00 178.00 180.18 1tj2 n LYS 604 N -4.09 1.88 -3.76 0.86 5.02 -1.26 -4.56 118.16 112.25 1tj2 n LYS 604 Ca -0.01 -1.29 -0.28 0.00 -2.02 0.00 0.00 58.31 54.72 1tj2 n LYS 604 Cb 0.19 -1.46 -0.11 0.00 -0.02 0.00 0.00 35.03 33.62 1tj2 n LYS 604 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1tj2 s ILE 605 N -1.94 2.20 0.81 -0.18 1.01 -0.74 -5.10 121.20 117.27 1tj2 s ILE 605 Ca 0.35 -3.84 -0.11 0.00 0.00 0.00 0.00 60.65 57.05 1tj2 s ILE 605 Cb 0.20 -2.46 0.08 0.00 0.01 0.00 0.00 42.46 40.29 1tj2 s ILE 605 CO 0.32 -1.07 1.09 -2.16 0.00 0.00 0.00 174.94 173.12 1tj2 s PRO 606 N -1.05 1.95 0.65 2.79 0.04 -1.26 -4.51 135.00 133.61 1tj2 s PRO 606 Ca 0.27 0.80 -0.17 0.00 0.04 0.00 0.00 61.00 61.93 1tj2 s PRO 606 Cb -0.02 -1.89 -0.03 0.00 0.04 0.00 0.00 34.50 32.60 1tj2 s PRO 606 CO -0.17 -1.76 1.02 1.28 0.04 0.00 0.00 177.00 177.41 1tj2 n LEU 607 N -3.55 4.06 -0.21 -3.56 4.77 -1.26 -4.90 117.00 112.35 1tj2 n LEU 607 Ca 0.07 0.76 0.02 0.00 -0.03 0.00 0.00 56.01 56.83 1tj2 n LEU 607 Cb 0.55 -1.42 0.13 0.00 -2.33 0.00 0.00 43.42 40.35 1tj2 n LEU 607 CO 0.56 -1.79 0.95 -0.65 -1.33 0.00 0.00 177.39 175.13 1tj2 h PRO 608 N 0.25 0.31 0.00 3.23 0.11 -1.85 -2.07 132.00 131.98 1tj2 h PRO 608 Ca -0.49 -0.02 -0.00 0.00 0.11 0.00 0.00 66.00 65.60 1tj2 h PRO 608 Cb 1.35 -0.07 -0.00 0.00 0.11 0.00 0.00 31.00 32.39 1tj2 h PRO 608 CO 0.50 0.20 -0.01 0.00 -0.21 0.00 0.00 178.00 178.48 1tj2 h ARG 609 N 0.31 0.00 -0.01 1.05 3.08 -1.83 -3.46 114.38 113.52 1tj2 h ARG 609 Ca 0.34 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.39 1tj2 h ARG 609 Cb 0.50 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.55 1tj2 h ARG 609 CO -0.40 0.01 0.00 -0.25 -1.07 0.00 0.00 179.97 178.26