#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2b3k s ARG 91 N 0.00 3.16 0.45 2.98 3.52 -1.26 -5.06 118.95 122.73 2b3k s ARG 91 Ca 0.00 -0.89 -0.24 0.00 -0.13 0.00 0.00 55.73 54.48 2b3k s ARG 91 Cb 0.00 -3.92 -0.07 0.00 -1.56 0.00 0.00 34.95 29.40 2b3k s ARG 91 CO 0.00 -0.64 1.23 0.71 -0.81 0.00 0.00 175.30 175.78 2b3k s TYR 92 N 1.70 2.81 -0.62 5.12 2.02 -1.26 -4.94 117.35 122.18 2b3k s TYR 92 Ca 0.05 1.49 0.25 0.00 -0.37 0.00 0.00 57.07 58.49 2b3k s TYR 92 Cb -0.18 -3.51 0.48 0.00 -0.40 0.00 0.00 41.96 38.35 2b3k s TYR 92 CO 0.10 -1.81 1.50 1.79 -1.57 0.00 0.00 175.55 175.55 2b3k h THR 93 N 2.01 0.00 -0.51 -0.71 1.35 -1.87 -3.48 112.91 109.70 2b3k h THR 93 Ca -0.50 -0.59 0.00 0.00 -0.55 0.00 0.00 66.41 64.78 2b3k h THR 93 Cb 1.25 1.36 0.00 0.00 -1.73 0.00 0.00 68.15 69.03 2b3k h THR 93 CO 0.61 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 176.49 2b3k n GLY 94 N 1.29 4.74 0.13 5.82 0.00 -1.26 -3.34 105.19 112.56 2b3k n GLY 94 Ca 0.04 -1.10 0.02 0.00 0.00 0.00 0.00 46.02 44.97 2b3k n GLY 94 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2b3k h LYS 95 N 0.00 0.00 -6.97 1.61 1.57 -1.93 -3.47 116.57 107.38 2b3k h LYS 95 Ca 0.00 0.00 -0.53 0.00 -1.87 0.00 0.00 60.65 58.25 2b3k h LYS 95 Cb 0.00 0.00 0.08 0.00 0.08 0.00 0.00 32.23 32.39 2b3k h LYS 95 CO 0.00 0.46 0.59 -1.17 -0.57 0.00 0.00 179.45 178.76 2b3k s LEU 96 N -6.29 4.14 0.02 2.94 2.96 -1.26 -5.05 118.68 116.14 2b3k s LEU 96 Ca 0.02 2.61 -0.01 0.00 -0.22 0.00 0.00 54.13 56.53 2b3k s LEU 96 Cb 0.08 -4.00 -0.02 0.00 0.50 0.00 0.00 46.19 42.75 2b3k s LEU 96 CO 0.76 -0.94 -0.01 -0.13 -1.32 0.00 0.00 176.35 174.71 2b3k s ARG 97 N -2.39 0.34 0.52 1.98 1.81 -1.26 -4.91 118.95 115.04 2b3k s ARG 97 Ca 0.60 -0.63 -0.20 0.00 -1.72 0.00 0.00 55.73 53.78 2b3k s ARG 97 Cb -0.37 0.12 -0.07 0.00 -0.45 0.00 0.00 34.95 34.19 2b3k s ARG 97 CO 0.46 -0.06 1.08 -1.25 -0.68 0.00 0.00 175.30 174.85 2b3k s PRO 98 N -1.59 3.56 -0.44 3.54 0.04 -1.26 -4.99 135.00 133.86 2b3k s PRO 98 Ca -0.15 1.47 0.01 0.00 0.04 0.00 0.00 61.00 62.37 2b3k s PRO 98 Cb -0.09 -2.05 0.12 0.00 0.04 0.00 0.00 34.50 32.52 2b3k s PRO 98 CO -0.01 -0.65 0.19 -1.01 0.04 0.00 0.00 177.00 175.55 2b3k s HIS 99 N -1.92 3.55 0.41 0.56 3.76 -1.26 -5.05 115.29 115.34 2b3k s HIS 99 Ca 0.70 -2.86 0.06 0.00 -0.15 0.00 0.00 55.06 52.81 2b3k s HIS 99 Cb -0.20 -3.02 0.01 0.00 1.11 0.00 0.00 32.58 30.48 2b3k s HIS 99 CO 0.24 -0.90 0.57 0.71 -0.85 0.00 0.00 174.74 174.51 2b3k s TYR 100 N 0.57 2.94 0.67 1.40 2.02 -1.26 -1.74 117.35 121.95 2b3k s TYR 100 Ca 0.12 -0.25 -0.11 0.00 -0.37 0.00 0.00 57.07 56.46 2b3k s TYR 100 Cb -0.22 -2.29 -0.00 0.00 -0.40 0.00 0.00 41.96 39.05 2b3k s TYR 100 CO -0.05 -0.33 1.07 -1.25 -1.57 0.00 0.00 175.55 173.42 2b3k s PRO 101 N -4.35 3.07 0.22 -1.71 0.04 -1.26 -4.94 135.00 126.07 2b3k s PRO 101 Ca 0.52 0.52 -0.12 0.00 0.04 0.00 0.00 61.00 61.95 2b3k s PRO 101 Cb -0.10 -2.05 -0.08 0.00 0.04 0.00 0.00 34.50 32.31 2b3k s PRO 101 CO 0.33 -0.88 0.59 -0.51 0.04 0.00 0.00 177.00 176.57 2b3k s LEU 102 N -5.29 4.20 0.64 -3.56 1.43 -1.26 -4.69 118.68 110.15 2b3k s LEU 102 Ca 0.57 1.05 -0.15 0.00 -1.03 0.00 0.00 54.13 54.57 2b3k s LEU 102 Cb -0.11 -3.64 -0.01 0.00 0.03 0.00 0.00 46.19 42.45 2b3k s LEU 102 CO 0.52 -0.05 1.09 -0.04 0.23 0.00 0.00 176.35 178.11 2b3k s MET 103 N -2.59 2.96 0.55 1.70 -1.94 -1.26 -4.95 119.30 113.77 2b3k s MET 103 Ca 0.46 1.33 -0.20 0.00 -1.71 0.00 0.00 55.69 55.56 2b3k s MET 103 Cb -0.12 -1.98 -0.06 0.00 2.01 0.00 0.00 34.83 34.68 2b3k s MET 103 CO 0.20 -1.12 1.04 -2.30 -0.01 0.00 0.00 175.02 172.84 2b3k n PRO 104 N -2.32 1.14 -1.64 2.03 -0.02 -1.26 -4.83 135.00 128.10 2b3k n PRO 104 Ca 0.10 0.43 -0.45 0.00 -2.02 0.00 0.00 63.50 61.56 2b3k n PRO 104 Cb 0.52 -2.21 -0.02 0.00 -0.02 0.00 0.00 33.50 31.77 2b3k n PRO 104 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 2b3k n THR 105 N -1.33 1.36 -2.72 3.45 -2.24 -1.26 -4.92 114.28 106.62 2b3k n THR 105 Ca 0.12 -0.34 -0.42 0.00 -2.27 0.00 0.00 64.05 61.14 2b3k n THR 105 Cb 0.45 -1.30 -0.04 0.00 -2.10 0.00 0.00 70.33 67.35 2b3k n THR 105 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 2b3k s ARG 106 N -0.93 4.63 0.47 -0.78 0.52 -1.26 -5.04 118.95 116.55 2b3k s ARG 106 Ca 0.64 1.43 -0.14 0.00 -0.52 0.00 0.00 55.73 57.15 2b3k s ARG 106 Cb -0.68 -3.42 -0.07 0.00 0.52 0.00 0.00 34.95 31.30 2b3k s ARG 106 CO 0.55 0.08 0.89 -1.25 0.02 0.00 0.00 175.30 175.59 2b3k s PRO 107 N 0.53 3.88 -0.18 3.54 0.04 -1.26 -5.06 135.00 136.48 2b3k s PRO 107 Ca 0.50 0.75 -0.02 0.00 0.04 0.00 0.00 61.00 62.27 2b3k s PRO 107 Cb -0.22 -2.24 -0.01 0.00 0.04 0.00 0.00 34.50 32.07 2b3k s PRO 107 CO 0.29 -0.17 -0.10 0.08 0.04 0.00 0.00 177.00 177.14 2b3k s VAL 108 N -2.52 3.03 0.24 -0.36 1.01 -1.26 -5.08 120.40 115.46 2b3k s VAL 108 Ca 0.56 -0.63 -0.29 0.00 0.00 0.00 0.00 61.98 61.62 2b3k s VAL 108 Cb -0.10 -2.32 -0.15 0.00 0.00 0.00 0.00 36.38 33.80 2b3k s VAL 108 CO 0.31 0.48 0.87 -2.65 0.00 0.00 0.00 175.10 174.11 2b3k n PRO 109 N 4.29 0.86 0.15 2.72 -0.02 -1.26 -4.81 135.00 136.93 2b3k n PRO 109 Ca -0.19 0.30 0.11 0.00 -2.02 0.00 0.00 63.50 61.71 2b3k n PRO 109 Cb 0.51 -1.57 0.56 0.00 -0.02 0.00 0.00 33.50 32.98 2b3k n PRO 109 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 2b3k n SER 110 N 1.57 0.58 0.04 2.55 3.41 -1.26 -1.73 113.62 118.78 2b3k n SER 110 Ca 0.13 0.74 0.12 0.00 -0.26 0.00 0.00 58.87 59.60 2b3k n SER 110 Cb 0.28 -0.83 0.50 0.00 -0.26 0.00 0.00 64.21 63.90 2b3k n SER 110 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2b3k n TYR 111 N -2.25 0.28 -3.16 7.33 0.18 -1.26 -4.70 117.16 113.58 2b3k n TYR 111 Ca -0.01 0.09 -0.39 0.00 1.88 0.00 0.00 57.90 59.47 2b3k n TYR 111 Cb 0.08 -0.65 -0.05 0.00 -0.38 0.00 0.00 39.34 38.34 2b3k n TYR 111 CO 0.00 0.00 0.00 0.42 -2.08 0.00 0.00 176.86 175.20 2b3k s ILE 112 N -3.05 5.09 0.25 -3.48 1.01 -0.70 -5.02 121.20 115.29 2b3k s ILE 112 Ca 0.11 1.20 -0.30 0.00 0.00 0.00 0.00 60.65 61.65 2b3k s ILE 112 Cb 0.15 -3.93 -0.11 0.00 0.01 0.00 0.00 42.46 38.58 2b3k s ILE 112 CO 0.47 0.24 1.55 -1.58 0.00 0.00 0.00 174.94 175.63 2b3k s GLN 113 N 1.03 4.19 0.06 2.79 0.74 -1.26 -4.97 119.66 122.23 2b3k s GLN 113 Ca 0.31 2.45 0.06 0.00 0.05 0.00 0.00 55.36 58.23 2b3k s GLN 113 Cb -0.16 -3.08 -0.04 0.00 1.10 0.00 0.00 33.01 30.83 2b3k s GLN 113 CO 0.13 -0.57 -0.11 1.03 -0.55 0.00 0.00 175.29 175.22 2b3k s ARG 114 N -0.01 2.23 0.72 1.67 0.52 -1.26 -4.45 118.95 118.38 2b3k s ARG 114 Ca 0.64 -0.92 -0.11 0.00 -0.52 0.00 0.00 55.73 54.82 2b3k s ARG 114 Cb -0.45 -2.33 0.03 0.00 0.52 0.00 0.00 34.95 32.71 2b3k s ARG 114 CO 0.42 0.54 1.07 -1.25 0.02 0.00 0.00 175.30 176.10 2b3k s PRO 115 N -1.76 2.70 0.28 3.54 0.04 -1.26 -4.95 135.00 133.59 2b3k s PRO 115 Ca 0.18 0.88 0.01 0.00 0.04 0.00 0.00 61.00 62.11 2b3k s PRO 115 Cb -0.11 -1.97 0.54 0.00 0.04 0.00 0.00 34.50 33.00 2b3k s PRO 115 CO 0.09 -1.25 1.84 0.38 0.04 0.00 0.00 177.00 178.11 2b3k h ASP 116 N -0.83 0.94 0.83 6.66 3.04 -1.97 -2.05 116.42 123.05 2b3k h ASP 116 Ca -0.45 0.04 0.00 0.00 -3.24 0.00 0.00 57.03 53.39 2b3k h ASP 116 Cb 1.23 -0.15 0.00 0.00 -1.04 0.00 0.00 39.33 39.37 2b3k h ASP 116 CO 0.57 0.52 0.00 0.10 -2.04 0.00 0.00 179.24 178.39 2b3k h TYR 117 N 1.02 0.00 -0.41 4.15 -0.00 -1.88 -3.24 116.97 116.62 2b3k h TYR 117 Ca 0.49 0.00 0.10 0.00 0.00 0.00 0.00 58.73 59.32 2b3k h TYR 117 Cb 0.44 0.00 -0.02 0.00 0.00 0.00 0.00 36.73 37.15 2b3k h TYR 117 CO -0.00 0.00 0.29 0.00 -0.00 0.00 0.00 178.16 178.44 2b3k h ALA 118 N 2.17 2.24 -0.25 0.10 0.00 -1.65 -2.41 119.26 119.47 2b3k h ALA 118 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2b3k h ALA 118 Cb 0.42 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.20 2b3k h ALA 118 CO 0.00 -0.35 0.00 -0.25 0.00 0.00 0.00 179.25 178.65 2b3k n ASP 119 N -4.44 2.63 -4.73 0.00 8.00 -1.22 -4.97 116.55 111.81 2b3k n ASP 119 Ca 0.06 -1.95 -0.40 0.00 0.71 0.00 0.00 54.79 53.20 2b3k n ASP 119 Cb 0.41 -0.16 -0.05 0.00 -0.02 0.00 0.00 41.12 41.30 2b3k n ASP 119 CO 0.00 0.00 0.00 -2.28 -0.39 0.00 0.00 177.20 174.53 2b3k s HIS 120 N -0.98 3.74 0.46 1.24 2.46 -0.91 -4.95 115.29 116.36 2b3k s HIS 120 Ca 0.17 1.59 0.21 0.00 0.47 0.00 0.00 55.06 57.50 2b3k s HIS 120 Cb 0.09 -2.93 1.20 0.00 -0.13 0.00 0.00 32.58 30.82 2b3k s HIS 120 CO 0.12 0.21 1.90 -1.00 -2.47 0.00 0.00 174.74 173.50 2b3k h PRO 121 N 5.81 0.26 -0.47 2.88 0.13 -1.93 0.11 132.00 138.79 2b3k h PRO 121 Ca -0.43 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 2b3k h PRO 121 Cb 1.21 -0.06 0.00 0.00 0.13 0.00 0.00 31.00 32.28 2b3k h PRO 121 CO 0.72 0.17 0.00 1.28 -0.23 0.00 0.00 178.00 179.94 2b3k n LEU 122 N -4.43 3.30 -1.48 1.56 4.77 -1.26 -4.94 117.00 114.51 2b3k n LEU 122 Ca 0.16 -1.89 -0.14 0.00 -0.03 0.00 0.00 56.01 54.11 2b3k n LEU 122 Cb 0.69 -0.31 -0.02 0.00 -2.33 0.00 0.00 43.42 41.45 2b3k n LEU 122 CO 0.34 0.81 -0.17 0.61 -1.33 0.00 0.00 177.39 177.64 2b3k n GLY 123 N 1.03 0.31 3.80 -0.72 0.00 0.03 -3.49 105.19 106.15 2b3k n GLY 123 Ca 0.17 -0.30 -0.36 0.00 0.00 0.00 0.00 46.02 45.53 2b3k n GLY 123 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2b3k s MET 124 N -4.25 4.38 -0.46 1.61 -1.94 -1.26 0.33 119.30 117.71 2b3k s MET 124 Ca 0.00 1.11 -0.10 0.00 -1.71 0.00 0.00 55.69 54.99 2b3k s MET 124 Cb 0.00 -2.69 0.10 0.00 2.01 0.00 0.00 34.83 34.25 2b3k s MET 124 CO 0.00 0.25 0.33 0.45 -0.01 0.00 0.00 175.02 176.04 2b3k s SER 125 N -1.78 5.73 0.32 3.03 0.15 -1.26 -3.87 113.70 116.02 2b3k s SER 125 Ca 0.50 -1.73 -0.00 0.00 0.70 0.00 0.00 55.95 55.42 2b3k s SER 125 Cb -0.16 -2.02 0.51 0.00 -1.71 0.00 0.00 66.02 62.65 2b3k s SER 125 CO 0.21 -0.65 1.95 -0.33 1.20 0.00 0.00 173.24 175.62 2b3k h GLU 126 N 8.47 0.91 -0.76 5.44 5.08 -1.95 -0.29 114.58 131.49 2b3k h GLU 126 Ca -0.23 -0.09 -0.02 0.00 -1.00 0.00 0.00 59.36 58.03 2b3k h GLU 126 Cb 1.08 -0.19 -0.04 0.00 0.50 0.00 0.00 28.75 30.10 2b3k h GLU 126 CO 0.84 0.66 0.40 0.66 -1.00 0.00 0.00 179.01 180.56 2b3k h SER 127 N 0.93 0.96 -0.14 1.42 4.64 -1.99 0.20 113.55 119.56 2b3k h SER 127 Ca 0.24 -0.11 -0.06 0.00 -0.47 0.00 0.00 61.79 61.39 2b3k h SER 127 Cb -0.01 -0.24 -0.00 0.00 -0.31 0.00 0.00 62.40 61.83 2b3k h SER 127 CO -0.04 0.79 -0.15 -0.33 -0.87 0.00 0.00 176.83 176.23 2b3k h GLU 128 N 1.05 0.35 -0.60 4.77 5.08 -1.76 -3.19 114.58 120.28 2b3k h GLU 128 Ca 0.26 -0.19 -0.00 0.00 -1.00 0.00 0.00 59.36 58.43 2b3k h GLU 128 Cb 0.05 0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.28 2b3k h GLU 128 CO -0.04 0.74 0.36 1.96 -1.00 0.00 0.00 179.01 181.04 2b3k h GLN 129 N -0.02 0.81 0.00 2.33 4.20 -0.86 -0.80 115.11 120.77 2b3k h GLN 129 Ca 0.02 -0.06 0.00 0.00 0.06 0.00 0.00 58.65 58.67 2b3k h GLN 129 Cb 0.68 -0.17 0.00 0.00 0.30 0.00 0.00 27.48 28.29 2b3k h GLN 129 CO 0.04 0.56 0.05 0.00 -0.67 0.00 0.00 178.83 178.81 2b3k h ALA 130 N 1.58 1.05 -0.19 3.87 0.00 -0.94 -0.44 119.26 124.19 2b3k h ALA 130 Ca 0.22 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.13 2b3k h ALA 130 Cb -0.04 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.75 2b3k h ALA 130 CO -0.04 -0.05 0.00 1.28 0.00 0.00 0.00 179.25 180.44 2b3k n LEU 131 N -3.00 2.45 -4.67 0.00 4.77 -0.33 -5.01 117.00 111.20 2b3k n LEU 131 Ca -0.03 -1.50 -0.46 0.00 -0.03 0.00 0.00 56.01 53.98 2b3k n LEU 131 Cb 0.12 -0.12 -0.04 0.00 -2.33 0.00 0.00 43.42 41.05 2b3k n LEU 131 CO 0.18 0.55 1.29 1.17 -1.33 0.00 0.00 177.39 179.25 2b3k n LYS 132 N 0.58 2.21 -0.12 3.23 4.81 -0.18 -1.48 118.16 127.21 2b3k n LYS 132 Ca 0.09 0.80 0.00 0.00 -0.87 0.00 0.00 58.31 58.33 2b3k n LYS 132 Cb 0.36 -2.60 0.00 0.00 0.02 0.00 0.00 35.03 32.81 2b3k n LYS 132 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2b3k n GLY 133 N 3.72 0.91 3.81 3.14 0.00 -1.26 -5.05 105.19 110.45 2b3k n GLY 133 Ca 0.18 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.83 2b3k n GLY 133 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2b3k s THR 134 N -2.47 5.13 -2.14 2.61 -4.23 -0.55 -4.99 115.64 109.00 2b3k s THR 134 Ca 0.00 0.76 0.17 0.00 -1.18 0.00 0.00 61.69 61.45 2b3k s THR 134 Cb 0.00 -3.69 0.16 0.00 1.34 0.00 0.00 72.50 70.31 2b3k s THR 134 CO 0.00 0.52 1.07 -1.54 -0.54 0.00 0.00 174.62 174.14 2b3k n SER 135 N 2.32 2.51 -4.74 3.99 3.41 -1.26 -4.64 113.62 115.21 2b3k n SER 135 Ca -0.13 -1.74 -0.41 0.00 -0.26 0.00 0.00 58.87 56.32 2b3k n SER 135 Cb 0.52 -0.02 -0.03 0.00 -0.26 0.00 0.00 64.21 64.42 2b3k n SER 135 CO 0.00 0.00 0.00 -1.58 -0.16 0.00 0.00 175.04 173.30 2b3k s GLN 136 N -1.43 4.35 -0.18 4.33 0.74 -1.26 -4.85 119.66 121.36 2b3k s GLN 136 Ca 0.21 2.13 -0.06 0.00 0.05 0.00 0.00 55.36 57.69 2b3k s GLN 136 Cb 0.15 -3.17 -0.04 0.00 1.10 0.00 0.00 33.01 31.05 2b3k s GLN 136 CO 0.22 -0.31 0.03 0.42 -0.55 0.00 0.00 175.29 175.10 2b3k s ILE 137 N 0.14 4.47 0.41 -2.34 1.01 -1.26 -4.73 121.20 118.90 2b3k s ILE 137 Ca 0.58 -0.15 -0.26 0.00 0.00 0.00 0.00 60.65 60.82 2b3k s ILE 137 Cb -0.38 -3.00 -0.09 0.00 0.01 0.00 0.00 42.46 39.00 2b3k s ILE 137 CO 0.39 0.46 1.36 -0.75 0.00 0.00 0.00 174.94 176.40 2b3k s LYS 138 N 0.46 3.91 -0.33 2.79 2.20 -1.26 -5.00 119.74 122.51 2b3k s LYS 138 Ca 0.01 2.28 -0.08 0.00 -0.36 0.00 0.00 55.97 57.82 2b3k s LYS 138 Cb -0.13 -2.76 0.02 0.00 -1.51 0.00 0.00 37.83 33.45 2b3k s LYS 138 CO 0.01 -0.58 0.12 -0.51 -0.36 0.00 0.00 175.35 174.03 2b3k s LEU 139 N -2.46 4.24 0.32 5.43 1.43 -1.26 -4.49 118.68 121.89 2b3k s LEU 139 Ca 0.57 -0.94 -0.29 0.00 -1.03 0.00 0.00 54.13 52.45 2b3k s LEU 139 Cb -0.41 -1.91 -0.10 0.00 0.03 0.00 0.00 46.19 43.80 2b3k s LEU 139 CO 0.53 -0.29 1.24 -0.76 0.23 0.00 0.00 176.35 177.30 2b3k s LEU 140 N 1.48 4.44 0.75 1.79 1.02 -0.76 -5.03 118.68 122.37 2b3k s LEU 140 Ca 0.01 2.55 -0.09 0.00 0.02 0.00 0.00 54.13 56.62 2b3k s LEU 140 Cb -0.19 -3.68 0.08 0.00 0.02 0.00 0.00 46.19 42.43 2b3k s LEU 140 CO 0.04 -0.44 1.08 -0.94 0.02 0.00 0.00 176.35 176.11 2b3k s SER 141 N -0.65 4.59 0.40 2.29 1.04 -1.26 -4.81 113.70 115.30 2b3k s SER 141 Ca 0.48 0.50 0.07 0.00 0.48 0.00 0.00 55.95 57.49 2b3k s SER 141 Cb -0.37 -1.06 0.84 0.00 0.10 0.00 0.00 66.02 65.54 2b3k s SER 141 CO 0.49 -1.78 2.04 0.28 0.98 0.00 0.00 173.24 175.25 2b3k h SER 142 N -0.80 0.50 -0.23 7.02 0.02 -1.99 0.41 113.55 118.48 2b3k h SER 142 Ca -0.45 -0.01 -0.06 0.00 -0.84 0.00 0.00 61.79 60.44 2b3k h SER 142 Cb 1.31 -0.12 -0.01 0.00 0.14 0.00 0.00 62.40 63.72 2b3k h SER 142 CO 0.60 0.36 -0.08 -0.08 -1.14 0.00 0.00 176.83 176.49 2b3k h GLU 143 N 0.59 0.47 -0.61 3.45 4.81 -2.00 -2.20 114.58 119.09 2b3k h GLU 143 Ca 0.18 -0.19 -0.00 0.00 -0.13 0.00 0.00 59.36 59.22 2b3k h GLU 143 Cb -0.01 -0.02 -0.03 0.00 0.63 0.00 0.00 28.75 29.32 2b3k h GLU 143 CO -0.04 0.71 0.36 -0.44 -0.73 0.00 0.00 179.01 178.88 2b3k h ASP 144 N 0.19 0.73 -0.52 1.04 3.32 -1.65 -1.60 116.42 117.94 2b3k h ASP 144 Ca 0.06 -0.06 -0.01 0.00 0.02 0.00 0.00 57.03 57.04 2b3k h ASP 144 Cb 0.55 -0.19 -0.02 0.00 0.22 0.00 0.00 39.33 39.89 2b3k h ASP 144 CO 0.03 0.58 0.29 0.40 -1.72 0.00 0.00 179.24 178.82 2b3k h ILE 145 N 0.82 1.17 -0.73 0.35 2.04 -0.89 0.83 117.51 121.10 2b3k h ILE 145 Ca 0.22 -0.41 -0.04 0.00 1.00 0.00 0.00 64.86 65.62 2b3k h ILE 145 Cb -0.02 0.50 -0.03 0.00 -0.74 0.00 0.00 36.82 36.53 2b3k h ILE 145 CO -0.04 0.18 0.29 -0.33 0.00 0.00 0.00 178.15 178.25 2b3k h GLU 146 N 0.69 1.08 -0.55 2.37 4.39 -1.13 0.13 114.58 121.57 2b3k h GLU 146 Ca 0.18 -0.19 -0.03 0.00 0.34 0.00 0.00 59.36 59.66 2b3k h GLU 146 Cb 0.03 -0.18 -0.02 0.00 -0.10 0.00 0.00 28.75 28.47 2b3k h GLU 146 CO -0.03 0.88 0.21 0.78 -1.16 0.00 0.00 179.01 179.69 2b3k h GLY 147 N 1.11 0.88 1.09 -3.84 0.00 -0.67 -1.53 103.07 100.11 2b3k h GLY 147 Ca 0.24 -0.48 -0.12 0.00 0.00 0.00 0.00 47.33 46.97 2b3k h GLY 147 CO -0.02 0.46 -0.11 -0.33 0.00 0.00 0.00 176.54 176.53 2b3k h MET 148 N 0.74 1.03 -0.98 4.80 2.86 -0.35 -2.14 114.93 120.89 2b3k h MET 148 Ca 0.18 -0.39 0.01 0.00 -2.06 0.00 0.00 59.70 57.44 2b3k h MET 148 Cb 0.21 -0.06 -0.05 0.00 0.06 0.00 0.00 31.60 31.76 2b3k h MET 148 CO -0.01 1.08 0.63 0.00 1.06 0.00 0.00 176.91 179.66 2b3k h ARG 149 N 0.91 1.30 0.19 1.72 3.08 -0.46 -1.07 114.38 120.05 2b3k h ARG 149 Ca 0.14 -0.09 -0.01 0.00 0.07 0.00 0.00 59.98 60.09 2b3k h ARG 149 Cb 0.68 -0.29 0.00 0.00 0.08 0.00 0.00 29.97 30.45 2b3k h ARG 149 CO 0.05 0.88 -0.09 1.25 -1.07 0.00 0.00 179.97 180.99 2b3k h LEU 150 N 1.33 -0.21 -1.04 3.04 5.85 -1.11 -2.30 115.31 120.87 2b3k h LEU 150 Ca 0.36 -0.26 -0.05 0.00 0.84 0.00 0.00 57.88 58.77 2b3k h LEU 150 Cb -0.13 0.06 -0.03 0.00 0.37 0.00 0.00 40.66 40.93 2b3k h LEU 150 CO -0.07 0.17 0.15 1.62 -0.34 0.00 0.00 178.44 179.97 2b3k h VAL 151 N -0.63 1.22 -0.25 1.05 3.04 -1.32 -1.51 116.25 117.85 2b3k h VAL 151 Ca -0.03 -0.79 -0.10 0.00 -1.01 0.00 0.00 66.70 64.78 2b3k h VAL 151 Cb 0.46 0.64 -0.01 0.00 -2.01 0.00 0.00 31.29 30.36 2b3k h VAL 151 CO 0.04 0.30 -0.27 0.00 -1.01 0.00 0.00 177.57 176.63 2b3k h ARG 153 N 0.43 0.97 -0.43 0.00 2.43 -0.80 -1.62 114.38 115.36 2b3k h ARG 153 Ca 0.06 -0.30 -0.10 0.00 -0.81 0.00 0.00 59.98 58.83 2b3k h ARG 153 Cb 0.69 -0.09 -0.02 0.00 -0.42 0.00 0.00 29.97 30.13 2b3k h ARG 153 CO 0.05 0.96 -0.16 -0.07 -1.51 0.00 0.00 179.97 179.25 2b3k h LEU 154 N 0.86 0.80 -0.63 3.80 3.38 -0.96 -2.00 115.31 120.56 2b3k h LEU 154 Ca 0.16 -0.26 -0.03 0.00 0.09 0.00 0.00 57.88 57.84 2b3k h LEU 154 Cb 0.51 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 41.01 2b3k h LEU 154 CO 0.02 0.96 0.27 0.00 0.09 0.00 0.00 178.44 179.79 2b3k h ALA 155 N 1.11 0.81 -0.68 1.53 0.00 -0.75 -1.63 119.26 119.64 2b3k h ALA 155 Ca 0.11 -0.16 -0.00 0.00 0.00 0.00 0.00 54.91 54.86 2b3k h ALA 155 Cb 0.66 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 18.17 2b3k h ALA 155 CO 0.05 0.41 0.41 -0.09 0.00 0.00 0.00 179.25 180.04 2b3k h ARG 156 N 0.87 0.93 -0.95 0.00 9.65 -1.05 -0.56 114.38 123.27 2b3k h ARG 156 Ca 0.21 -0.08 0.07 0.00 -1.10 0.00 0.00 59.98 59.08 2b3k h ARG 156 Cb 0.18 -0.20 -0.07 0.00 -1.39 0.00 0.00 29.97 28.49 2b3k h ARG 156 CO -0.02 0.66 0.60 0.93 2.80 0.00 0.00 179.97 184.94 2b3k h GLU 157 N 0.93 1.05 -0.19 0.20 5.08 -0.71 -0.89 114.58 120.06 2b3k h GLU 157 Ca 0.25 -0.06 -0.17 0.00 -1.00 0.00 0.00 59.36 58.37 2b3k h GLU 157 Cb -0.03 -0.24 -0.00 0.00 0.50 0.00 0.00 28.75 28.98 2b3k h GLU 157 CO -0.05 0.70 -0.59 0.28 -1.00 0.00 0.00 179.01 178.35 2b3k h VAL 158 N 1.08 1.31 -0.57 3.13 2.07 -0.61 -2.07 116.25 120.59 2b3k h VAL 158 Ca 0.42 -1.84 -0.06 0.00 0.82 0.00 0.00 66.70 66.03 2b3k h VAL 158 Cb 0.20 1.80 -0.03 0.00 -1.52 0.00 0.00 31.29 31.74 2b3k h VAL 158 CO -0.18 0.58 0.11 0.25 0.02 0.00 0.00 177.57 178.34 2b3k h LEU 159 N 0.47 0.85 -1.26 2.57 5.85 -0.63 -1.74 115.31 121.43 2b3k h LEU 159 Ca -0.00 -0.17 -0.05 0.00 0.84 0.00 0.00 57.88 58.49 2b3k h LEU 159 Cb 1.16 -0.22 -0.02 0.00 0.37 0.00 0.00 40.66 41.95 2b3k h LEU 159 CO 0.11 0.85 -0.05 0.44 -0.34 0.00 0.00 178.44 179.46 2b3k h ASP 160 N 0.86 0.42 -0.27 1.25 3.32 -0.93 0.46 116.42 121.53 2b3k h ASP 160 Ca 0.18 -0.08 -0.02 0.00 0.02 0.00 0.00 57.03 57.13 2b3k h ASP 160 Cb 0.35 -0.11 -0.01 0.00 0.22 0.00 0.00 39.33 39.78 2b3k h ASP 160 CO 0.00 0.52 0.09 0.58 -1.72 0.00 0.00 179.24 178.72 2b3k h VAL 161 N 0.43 1.19 -0.82 -1.35 2.07 -0.66 -2.37 116.25 114.74 2b3k h VAL 161 Ca 0.09 -0.61 0.02 0.00 0.82 0.00 0.00 66.70 67.02 2b3k h VAL 161 Cb 0.36 1.08 -0.04 0.00 -1.52 0.00 0.00 31.29 31.17 2b3k h VAL 161 CO 0.02 0.20 0.54 0.00 0.02 0.00 0.00 177.57 178.35 2b3k h ALA 162 N 0.93 1.06 -0.83 1.67 0.00 -0.60 -2.48 119.26 119.00 2b3k h ALA 162 Ca 0.09 -0.05 0.06 0.00 0.00 0.00 0.00 54.91 55.01 2b3k h ALA 162 Cb 0.23 -0.32 -0.05 0.00 0.00 0.00 0.00 17.79 17.65 2b3k h ALA 162 CO -0.00 0.42 0.54 0.00 0.00 0.00 0.00 179.25 180.21 2b3k h ALA 163 N 1.32 1.56 0.00 0.00 0.00 -0.67 -1.28 119.26 120.18 2b3k h ALA 163 Ca 0.31 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.19 2b3k h ALA 163 Cb -0.08 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.45 2b3k h ALA 163 CO -0.08 0.33 0.00 0.41 0.00 0.00 0.00 179.25 179.90 2b3k n GLY 164 N -1.42 -0.95 0.13 0.00 0.00 -0.92 -2.76 105.19 99.28 2b3k n GLY 164 Ca 0.12 -0.07 0.09 0.00 0.00 0.00 0.00 46.02 46.16 2b3k n GLY 164 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2b3k n MET 165 N -1.39 1.20 -2.04 1.61 2.81 -0.49 -4.94 117.12 113.88 2b3k n MET 165 Ca 0.06 -0.28 -0.43 0.00 -1.81 0.00 0.00 57.70 55.25 2b3k n MET 165 Cb 0.16 -1.35 -0.03 0.00 -0.71 0.00 0.00 33.22 31.29 2b3k n MET 165 CO 0.00 0.00 0.00 0.42 1.51 0.00 0.00 175.97 177.90 2b3k s ILE 166 N -2.53 3.55 -0.06 2.02 -1.09 -1.11 -4.86 121.20 117.11 2b3k s ILE 166 Ca 0.09 0.58 -0.29 0.00 -2.23 0.00 0.00 60.65 58.80 2b3k s ILE 166 Cb 0.14 -3.68 0.10 0.00 -1.58 0.00 0.00 42.46 37.45 2b3k s ILE 166 CO 0.66 -0.39 0.88 -1.59 -1.23 0.00 0.00 174.94 173.27 2b3k s LYS 167 N 5.32 0.80 0.35 2.79 -2.85 -1.26 -4.86 119.74 120.03 2b3k s LYS 167 Ca 0.77 -0.06 -0.28 0.00 -1.00 0.00 0.00 55.97 55.40 2b3k s LYS 167 Cb -0.23 0.37 -0.12 0.00 -2.06 0.00 0.00 37.83 35.79 2b3k s LYS 167 CO 0.33 -0.30 1.22 -2.30 0.10 0.00 0.00 175.35 174.39 2b3k n PRO 168 N 0.29 1.92 0.00 1.78 -0.02 -1.26 -2.63 135.00 135.08 2b3k n PRO 168 Ca -0.11 0.67 0.00 0.00 -2.02 0.00 0.00 63.50 62.04 2b3k n PRO 168 Cb 0.60 -2.23 0.00 0.00 -0.02 0.00 0.00 33.50 31.85 2b3k n PRO 168 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2b3k n GLY 169 N 0.88 3.13 3.74 -1.23 0.00 -0.16 -4.93 105.19 106.62 2b3k n GLY 169 Ca 0.06 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.67 2b3k n GLY 169 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2b3k s VAL 170 N -2.50 4.05 0.34 1.61 1.01 -1.08 -4.51 120.40 119.33 2b3k s VAL 170 Ca 0.00 1.85 -0.06 0.00 0.00 0.00 0.00 61.98 63.77 2b3k s VAL 170 Cb 0.00 -4.18 -0.05 0.00 0.00 0.00 0.00 36.38 32.15 2b3k s VAL 170 CO 0.00 0.35 0.63 0.42 0.00 0.00 0.00 175.10 176.50 2b3k s THR 171 N -0.51 4.97 0.43 3.92 -4.23 -1.26 0.45 115.64 119.40 2b3k s THR 171 Ca 0.46 0.14 0.14 0.00 -1.18 0.00 0.00 61.69 61.26 2b3k s THR 171 Cb -0.27 -3.76 0.17 0.00 1.34 0.00 0.00 72.50 69.98 2b3k s THR 171 CO 0.33 -0.45 1.96 0.71 -0.54 0.00 0.00 174.62 176.64 2b3k h THR 172 N 1.12 1.15 -0.31 3.99 1.35 -1.58 -1.80 112.91 116.83 2b3k h THR 172 Ca -0.48 -0.75 -0.06 0.00 -0.55 0.00 0.00 66.41 64.57 2b3k h THR 172 Cb 1.19 1.41 -0.02 0.00 -1.73 0.00 0.00 68.15 69.01 2b3k h THR 172 CO 0.65 0.21 -0.06 -0.33 -0.25 0.00 0.00 175.52 175.74 2b3k h GLU 173 N 0.00 0.50 -0.46 4.72 5.08 -1.47 -0.49 114.58 122.47 2b3k h GLU 173 Ca -0.00 -0.12 -0.12 0.00 -1.00 0.00 0.00 59.36 58.12 2b3k h GLU 173 Cb 0.39 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.56 2b3k h GLU 173 CO 0.03 0.58 -0.17 0.93 -1.00 0.00 0.00 179.01 179.37 2b3k h GLU 174 N 0.47 0.89 -0.37 2.33 5.08 -1.61 -0.59 114.58 120.79 2b3k h GLU 174 Ca 0.10 -0.35 -0.02 0.00 -1.00 0.00 0.00 59.36 58.09 2b3k h GLU 174 Cb 0.41 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.59 2b3k h GLU 174 CO 0.02 0.99 0.16 0.82 -1.00 0.00 0.00 179.01 180.00 2b3k h ILE 175 N 0.78 1.18 -0.92 3.13 2.04 -1.02 -2.21 117.51 120.49 2b3k h ILE 175 Ca 0.11 -0.53 0.00 0.00 1.00 0.00 0.00 64.86 65.44 2b3k h ILE 175 Cb 0.71 0.85 -0.04 0.00 -0.74 0.00 0.00 36.82 37.59 2b3k h ILE 175 CO 0.05 0.19 0.58 -0.78 0.00 0.00 0.00 178.15 178.20 2b3k h ASP 176 N 0.45 1.07 -0.59 1.72 3.58 -0.86 -0.68 116.42 121.11 2b3k h ASP 176 Ca 0.12 -0.04 -0.01 0.00 0.42 0.00 0.00 57.03 57.52 2b3k h ASP 176 Cb 0.15 -0.27 -0.03 0.00 1.72 0.00 0.00 39.33 40.91 2b3k h ASP 176 CO -0.01 0.80 0.33 -0.74 -2.88 0.00 0.00 179.24 176.73 2b3k h HIS 177 N 1.25 0.80 -0.66 0.28 2.76 -0.84 0.65 115.15 119.38 2b3k h HIS 177 Ca 0.33 -0.02 -0.05 0.00 -2.20 0.00 0.00 60.37 58.43 2b3k h HIS 177 Cb -0.11 -0.26 -0.03 0.00 1.55 0.00 0.00 27.41 28.57 2b3k h HIS 177 CO -0.00 0.57 0.20 0.00 -1.30 0.00 0.00 177.93 177.40 2b3k h ALA 178 N 1.16 0.87 -0.30 5.26 0.00 -0.90 -1.79 119.26 123.55 2b3k h ALA 178 Ca 0.21 -0.22 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 2b3k h ALA 178 Cb 0.03 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.55 2b3k h ALA 178 CO -0.03 0.55 0.14 0.28 0.00 0.00 0.00 179.25 180.19 2b3k h VAL 179 N 0.97 1.16 -0.22 0.00 2.07 -0.67 -0.58 116.25 118.98 2b3k h VAL 179 Ca 0.21 -0.45 0.05 0.00 0.82 0.00 0.00 66.70 67.33 2b3k h VAL 179 Cb 0.31 0.90 -0.05 0.00 -1.52 0.00 0.00 31.29 30.93 2b3k h VAL 179 CO -0.01 0.16 -0.08 -0.74 0.02 0.00 0.00 177.57 176.93 2b3k h HIS 180 N 0.35 -0.17 -0.21 1.57 2.76 -0.64 -0.64 115.15 118.16 2b3k h HIS 180 Ca 0.10 0.02 -0.08 0.00 -2.20 0.00 0.00 60.37 58.21 2b3k h HIS 180 Cb 0.12 0.11 -0.01 0.00 1.55 0.00 0.00 27.41 29.18 2b3k h HIS 180 CO -0.02 -0.12 -0.23 -0.07 -1.30 0.00 0.00 177.93 176.18 2b3k h LEU 181 N -0.03 0.39 -0.96 0.26 3.38 -1.19 -2.44 115.31 114.71 2b3k h LEU 181 Ca 0.11 -0.12 -0.10 0.00 0.09 0.00 0.00 57.88 57.86 2b3k h LEU 181 Cb 0.20 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 40.83 2b3k h LEU 181 CO -0.24 0.63 -0.32 0.00 0.09 0.00 0.00 178.44 178.59 2b3k h ALA 182 N 1.41 1.12 0.01 1.53 0.00 -0.32 -0.15 119.26 122.85 2b3k h ALA 182 Ca 0.06 -0.37 -0.00 0.00 0.00 0.00 0.00 54.91 54.60 2b3k h ALA 182 Cb 0.61 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.29 2b3k h ALA 182 CO 0.04 0.56 -0.01 0.00 0.00 0.00 0.00 179.25 179.85 2b3k h ILE 184 N -0.41 1.13 0.00 0.00 5.03 -1.27 -0.27 117.51 121.72 2b3k h ILE 184 Ca -0.00 -0.36 -0.02 0.00 -0.12 0.00 0.00 64.86 64.36 2b3k h ILE 184 Cb 0.39 -0.01 -0.00 0.00 -3.03 0.00 0.00 36.82 34.17 2b3k h ILE 184 CO 0.00 0.19 -0.08 0.00 -0.68 0.00 0.00 178.15 177.59 2b3k h ALA 185 N 1.50 1.29 -0.54 1.87 0.00 -0.97 -1.43 119.26 120.97 2b3k h ALA 185 Ca 0.34 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.18 2b3k h ALA 185 Cb 0.05 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.82 2b3k h ALA 185 CO -0.10 0.10 0.00 0.54 0.00 0.00 0.00 179.25 179.79 2b3k n ARG 186 N -3.60 3.96 -3.83 0.00 1.74 -0.27 -4.93 116.66 109.73 2b3k n ARG 186 Ca -0.02 -2.93 -0.28 0.00 -0.77 0.00 0.00 57.85 53.85 2b3k n ARG 186 Cb 0.20 -1.98 0.04 0.00 -1.02 0.00 0.00 32.46 29.70 2b3k n ARG 186 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 2b3k n ASN 187 N 0.63 -4.93 -4.33 0.55 3.02 -0.54 -4.99 115.26 104.67 2b3k n ASN 187 Ca 0.25 -0.73 -0.24 0.00 -0.03 0.00 0.00 54.58 53.83 2b3k n ASN 187 Cb 0.97 -4.18 -0.12 0.00 -0.61 0.00 0.00 39.78 35.85 2b3k n ASN 187 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2b3k s TYR 189 N -1.57 3.58 -0.69 0.00 5.04 -0.61 -3.49 117.35 119.60 2b3k s TYR 189 Ca 0.13 0.64 -0.27 0.00 -2.44 0.00 0.00 57.07 55.13 2b3k s TYR 189 Cb -0.08 -2.15 0.02 0.00 0.35 0.00 0.00 41.96 40.10 2b3k s TYR 189 CO 0.06 0.54 1.42 -1.25 -1.34 0.00 0.00 175.55 174.98 2b3k s PRO 190 N -0.52 3.08 0.38 4.97 0.04 -1.26 -0.91 135.00 140.79 2b3k s PRO 190 Ca 0.17 0.01 0.22 0.00 0.04 0.00 0.00 61.00 61.43 2b3k s PRO 190 Cb -0.13 -4.22 1.27 0.00 0.04 0.00 0.00 34.50 31.46 2b3k s PRO 190 CO 0.06 -2.25 1.63 0.77 0.04 0.00 0.00 177.00 177.25 2b3k h SER 191 N 11.18 0.37 0.42 6.66 0.02 -1.49 -0.53 113.55 130.18 2b3k h SER 191 Ca -0.27 0.19 -0.03 0.00 -0.84 0.00 0.00 61.79 60.83 2b3k h SER 191 Cb 1.08 0.16 -0.00 0.00 0.14 0.00 0.00 62.40 63.78 2b3k h SER 191 CO 1.26 -0.22 -0.15 -0.65 -1.14 0.00 0.00 176.83 175.92 2b3k h PRO 192 N 0.16 0.00 -6.09 3.45 0.11 -1.78 -3.39 132.00 124.46 2b3k h PRO 192 Ca 0.79 0.00 -0.58 0.00 0.11 0.00 0.00 66.00 66.32 2b3k h PRO 192 Cb 2.12 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 33.23 2b3k h PRO 192 CO -0.57 0.15 1.41 -1.17 -0.21 0.00 0.00 178.00 177.61 2b3k s LEU 193 N -7.35 3.64 -0.62 2.35 2.96 -0.21 -1.60 118.68 117.85 2b3k s LEU 193 Ca -0.02 1.96 0.00 0.00 -0.22 0.00 0.00 54.13 55.85 2b3k s LEU 193 Cb 0.13 -3.52 0.00 0.00 0.50 0.00 0.00 46.19 43.30 2b3k s LEU 193 CO 0.61 -1.76 0.00 -3.20 -1.32 0.00 0.00 176.35 170.68 2b3k n ASN 194 N 10.73 -4.49 -4.61 3.68 5.15 0.68 -4.78 115.26 121.62 2b3k n ASN 194 Ca 0.27 0.14 -0.43 0.00 -0.60 0.00 0.00 54.58 53.96 2b3k n ASN 194 Cb 0.44 -2.50 -0.02 0.00 -0.53 0.00 0.00 39.78 37.17 2b3k n ASN 194 CO 0.00 0.00 0.00 -0.47 1.40 0.00 0.00 177.26 178.19 2b3k s TYR 195 N -1.95 2.17 -1.56 1.20 5.04 -0.63 -2.01 117.35 119.60 2b3k s TYR 195 Ca 0.00 0.64 -0.15 0.00 -2.44 0.00 0.00 57.07 55.13 2b3k s TYR 195 Cb 0.00 -4.14 0.10 0.00 0.35 0.00 0.00 41.96 38.28 2b3k s TYR 195 CO 0.00 -2.50 0.88 0.66 -1.34 0.00 0.00 175.55 173.25 2b3k n TYR 196 N 9.08 -2.10 -1.18 4.97 4.02 0.15 -1.40 117.16 130.71 2b3k n TYR 196 Ca 0.19 0.83 -0.06 0.00 -0.01 0.00 0.00 57.90 58.84 2b3k n TYR 196 Cb 0.47 -3.59 -0.03 0.00 -0.02 0.00 0.00 39.34 36.17 2b3k n TYR 196 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 176.86 175.94 2b3k n ASN 197 N -2.72 -4.36 -4.71 7.72 5.03 -0.85 -4.86 115.26 110.52 2b3k n ASN 197 Ca 0.05 0.15 -0.43 0.00 0.87 0.00 0.00 54.58 55.22 2b3k n ASN 197 Cb 0.52 -2.41 -0.03 0.00 -1.02 0.00 0.00 39.78 36.84 2b3k n ASN 197 CO 0.00 0.00 0.00 0.33 -1.83 0.00 0.00 177.26 175.76 2b3k n PHE 198 N -2.62 2.63 1.04 3.10 7.35 -0.49 -4.74 117.46 123.72 2b3k n PHE 198 Ca -0.06 0.10 0.13 0.00 -0.76 0.00 0.00 57.45 56.86 2b3k n PHE 198 Cb 0.31 -2.64 0.60 0.00 0.35 0.00 0.00 39.48 38.10 2b3k n PHE 198 CO 0.00 0.00 0.00 -0.35 -0.76 0.00 0.00 176.76 175.65 2b3k n PRO 199 N 3.79 0.14 -4.35 -7.13 -0.04 -1.26 -0.23 135.00 125.93 2b3k n PRO 199 Ca 0.16 0.04 -0.27 0.00 -0.04 0.00 0.00 63.50 63.40 2b3k n PRO 199 Cb 0.33 -1.50 -0.06 0.00 -0.04 0.00 0.00 33.50 32.23 2b3k n PRO 199 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 2b3k n LYS 200 N -1.42 0.72 0.00 0.54 4.76 -1.26 -4.73 118.16 116.77 2b3k n LYS 200 Ca 0.09 -3.31 0.12 0.00 -2.87 0.00 0.00 58.31 52.33 2b3k n LYS 200 Cb 0.27 1.37 0.10 0.00 -1.84 0.00 0.00 35.03 34.93 2b3k n LYS 200 CO 0.00 0.00 0.00 0.43 -1.37 0.00 0.00 177.40 176.46 2b3k n SER 201 N -1.43 2.16 -3.79 4.39 7.64 -1.26 -2.61 113.62 118.71 2b3k n SER 201 Ca -0.12 -1.58 -0.07 0.00 1.01 0.00 0.00 58.87 58.11 2b3k n SER 201 Cb 0.58 0.28 -0.02 0.00 -1.01 0.00 0.00 64.21 64.04 2b3k n SER 201 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2b3k s THR 204 N 0.07 1.88 -0.27 0.00 -4.23 -0.44 -0.92 115.64 111.74 2b3k s THR 204 Ca -0.01 -1.19 -0.01 0.00 -1.18 0.00 0.00 61.69 59.30 2b3k s THR 204 Cb -0.14 -1.92 0.04 0.00 1.34 0.00 0.00 72.50 71.82 2b3k s THR 204 CO 0.03 0.17 -0.05 -0.44 -0.54 0.00 0.00 174.62 173.79 2b3k s SER 205 N 1.28 4.49 -0.14 3.99 0.01 -0.03 -3.91 113.70 119.40 2b3k s SER 205 Ca -0.02 -1.07 -0.07 0.00 1.31 0.00 0.00 55.95 56.10 2b3k s SER 205 Cb -0.17 -1.66 -0.04 0.00 0.21 0.00 0.00 66.02 64.36 2b3k s SER 205 CO -0.08 -0.18 0.10 -0.69 0.41 0.00 0.00 173.24 172.80 2b3k s VAL 206 N 1.27 5.13 0.00 3.43 1.01 -1.26 -0.88 120.40 129.11 2b3k s VAL 206 Ca -0.03 0.08 0.00 0.00 0.00 0.00 0.00 61.98 62.03 2b3k s VAL 206 Cb -0.18 -3.25 0.00 0.00 0.00 0.00 0.00 36.38 32.95 2b3k s VAL 206 CO -0.04 0.56 0.00 0.59 0.00 0.00 0.00 175.10 176.21 2b3k n ASN 207 N 2.53 0.00 0.00 3.32 3.02 -0.66 -0.92 115.26 122.55 2b3k n ASN 207 Ca -0.18 0.00 0.08 0.00 -0.03 0.00 0.00 54.58 54.44 2b3k n ASN 207 Cb 0.54 0.00 0.40 0.00 -0.61 0.00 0.00 39.78 40.10 2b3k n ASN 207 CO 0.00 0.00 0.00 -1.84 -2.62 0.00 0.00 177.26 172.80 2b3k n GLU 208 N 0.00 0.21 -2.54 3.52 0.00 -1.26 -1.57 120.64 119.00 2b3k n GLU 208 Ca 0.00 0.14 -0.43 0.00 0.00 0.00 0.00 57.16 56.87 2b3k n GLU 208 Cb 0.00 -1.50 -0.02 0.00 0.00 0.00 0.00 31.44 29.92 2b3k n GLU 208 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.13 177.21 2b3k s VAL 209 N -2.61 4.47 0.02 3.84 1.01 -0.10 -1.88 120.40 125.15 2b3k s VAL 209 Ca 0.14 1.77 -0.21 0.00 0.00 0.00 0.00 61.98 63.68 2b3k s VAL 209 Cb 0.11 -4.16 -0.17 0.00 0.00 0.00 0.00 36.38 32.15 2b3k s VAL 209 CO 0.25 -0.18 1.26 0.40 0.00 0.00 0.00 175.10 176.83 2b3k h ILE 210 N 5.50 1.39 -1.81 2.22 2.04 -0.28 -3.40 117.51 123.17 2b3k h ILE 210 Ca -0.23 -1.50 0.26 0.00 1.00 0.00 0.00 64.86 64.40 2b3k h ILE 210 Cb 1.08 2.12 -0.11 0.00 -0.74 0.00 0.00 36.82 39.17 2b3k h ILE 210 CO 0.98 0.43 0.69 0.00 0.00 0.00 0.00 178.15 180.25 2b3k n HIS 212 N -0.46 -0.50 -2.03 0.00 8.25 -1.26 -2.01 115.22 117.21 2b3k n HIS 212 Ca -0.07 0.00 -0.41 0.00 -0.26 0.00 0.00 57.72 56.98 2b3k n HIS 212 Cb 0.62 -3.32 -0.01 0.00 1.12 0.00 0.00 29.99 28.40 2b3k n HIS 212 CO 0.00 0.00 0.00 0.20 0.64 0.00 0.00 176.34 177.18 2b3k s GLY 213 N -2.45 2.98 -0.24 -1.41 0.00 -1.25 -3.63 107.32 101.31 2b3k s GLY 213 Ca 0.00 1.34 -0.15 0.00 0.00 0.00 0.00 44.72 45.90 2b3k s GLY 213 CO 0.00 1.98 0.39 -0.42 0.00 0.00 0.00 173.10 175.05 2b3k s ILE 214 N -1.15 5.18 0.20 0.90 1.01 -1.26 -1.32 121.20 124.75 2b3k s ILE 214 Ca 0.51 0.64 -0.33 0.00 0.00 0.00 0.00 60.65 61.48 2b3k s ILE 214 Cb -0.41 -3.72 -0.14 0.00 0.01 0.00 0.00 42.46 38.20 2b3k s ILE 214 CO 0.55 0.19 1.42 -2.65 0.00 0.00 0.00 174.94 174.45 2b3k n PRO 215 N 5.01 1.89 -0.39 2.79 -0.02 -1.26 -4.87 135.00 138.14 2b3k n PRO 215 Ca -0.08 0.68 0.00 0.00 -2.02 0.00 0.00 63.50 62.07 2b3k n PRO 215 Cb 0.51 -2.34 0.00 0.00 -0.02 0.00 0.00 33.50 31.64 2b3k n PRO 215 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 2b3k n ASP 216 N 2.52 0.00 -0.08 2.55 5.68 -1.26 -4.61 116.55 121.34 2b3k n ASP 216 Ca 0.14 -0.21 0.09 0.00 -0.50 0.00 0.00 54.79 54.31 2b3k n ASP 216 Cb 0.29 0.00 0.52 0.00 -1.14 0.00 0.00 41.12 40.78 2b3k n ASP 216 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 2b3k n ARG 217 N 0.00 1.11 -2.52 0.11 1.74 -0.71 -1.34 116.66 115.05 2b3k n ARG 217 Ca 0.00 -0.17 -0.42 0.00 -0.77 0.00 0.00 57.85 56.49 2b3k n ARG 217 Cb 0.00 -1.30 -0.03 0.00 -1.02 0.00 0.00 32.46 30.11 2b3k n ARG 217 CO 0.00 0.00 0.00 0.50 -1.52 0.00 0.00 177.63 176.61 2b3k s ARG 218 N -1.97 4.38 0.21 5.56 3.52 -1.26 -4.90 118.95 124.50 2b3k s ARG 218 Ca 0.28 1.61 -0.30 0.00 -0.13 0.00 0.00 55.73 57.19 2b3k s ARG 218 Cb 0.13 -3.53 -0.08 0.00 -1.56 0.00 0.00 34.95 29.91 2b3k s ARG 218 CO 0.22 -0.39 1.09 -2.14 -0.81 0.00 0.00 175.30 173.27 2b3k s PRO 219 N 2.02 4.63 0.51 5.12 0.02 -1.26 -3.05 135.00 142.99 2b3k s PRO 219 Ca 0.54 1.72 -0.23 0.00 0.02 0.00 0.00 61.00 63.06 2b3k s PRO 219 Cb -0.24 -3.25 -0.06 0.00 0.02 0.00 0.00 34.50 30.97 2b3k s PRO 219 CO 0.22 0.15 1.34 -0.51 -0.33 0.00 0.00 177.00 177.87 2b3k s LEU 220 N -0.76 3.94 -0.01 -5.54 1.43 0.17 -4.75 118.68 113.16 2b3k s LEU 220 Ca 0.47 2.72 0.04 0.00 -1.03 0.00 0.00 54.13 56.33 2b3k s LEU 220 Cb -0.30 -4.19 -0.03 0.00 0.03 0.00 0.00 46.19 41.70 2b3k s LEU 220 CO 0.36 -1.37 -0.10 -1.10 0.23 0.00 0.00 176.35 174.37 2b3k s GLN 221 N -2.76 2.49 0.14 1.70 -0.21 -1.26 -0.99 119.66 118.77 2b3k s GLN 221 Ca 0.68 -0.73 -0.35 0.00 0.02 0.00 0.00 55.36 54.98 2b3k s GLN 221 Cb -0.39 -2.43 -0.15 0.00 1.00 0.00 0.00 33.01 31.03 2b3k s GLN 221 CO 0.47 0.61 1.39 -1.91 -2.12 0.00 0.00 175.29 173.73 2b3k n GLU 222 N 1.84 1.52 0.00 2.91 4.07 -1.26 -0.97 120.64 128.75 2b3k n GLU 222 Ca -0.16 0.55 0.00 0.00 -0.06 0.00 0.00 57.16 57.48 2b3k n GLU 222 Cb 0.52 -2.21 0.00 0.00 -0.06 0.00 0.00 31.44 29.70 2b3k n GLU 222 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2b3k n GLY 223 N 2.67 2.76 3.78 8.31 0.00 -0.21 -4.99 105.19 117.51 2b3k n GLY 223 Ca 0.17 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.88 2b3k n GLY 223 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2b3k s ASP 224 N -1.22 4.74 -0.03 1.61 1.01 -0.14 -4.72 116.67 117.92 2b3k s ASP 224 Ca 0.00 1.81 0.07 0.00 0.71 0.00 0.00 52.55 55.14 2b3k s ASP 224 Cb 0.00 -2.52 -0.02 0.00 1.01 0.00 0.00 42.92 41.39 2b3k s ASP 224 CO 0.00 -1.88 -0.24 0.27 0.21 0.00 0.00 175.17 173.53 2b3k s ILE 225 N -2.85 1.96 -0.02 0.77 -4.36 -1.26 -1.19 121.20 114.25 2b3k s ILE 225 Ca 0.61 -1.04 0.00 0.00 -0.26 0.00 0.00 60.65 59.96 2b3k s ILE 225 Cb -0.17 -1.64 0.02 0.00 1.25 0.00 0.00 42.46 41.92 2b3k s ILE 225 CO 0.54 0.55 0.02 0.54 0.24 0.00 0.00 174.94 176.83 2b3k s VAL 226 N -0.39 0.01 -0.14 8.37 0.11 -0.38 -1.65 120.40 126.31 2b3k s VAL 226 Ca 0.04 0.14 -0.07 0.00 -2.93 0.00 0.00 61.98 59.16 2b3k s VAL 226 Cb -0.11 -0.11 -0.04 0.00 -1.53 0.00 0.00 36.38 34.59 2b3k s VAL 226 CO 0.01 0.08 0.10 0.21 -3.33 0.00 0.00 175.10 172.17 2b3k s ASN 227 N 0.81 5.99 -0.19 3.54 3.84 -0.06 0.03 114.94 128.90 2b3k s ASN 227 Ca -0.07 0.28 -0.01 0.00 0.21 0.00 0.00 52.86 53.27 2b3k s ASN 227 Cb -0.10 -1.95 0.01 0.00 -0.55 0.00 0.00 41.25 38.66 2b3k s ASN 227 CO -0.02 0.31 -0.14 -0.69 -2.79 0.00 0.00 177.10 173.76 2b3k s VAL 228 N -0.41 2.59 -0.18 -5.21 1.01 -0.92 -0.85 120.40 116.43 2b3k s VAL 228 Ca 0.11 -0.77 -0.04 0.00 0.00 0.00 0.00 61.98 61.27 2b3k s VAL 228 Cb -0.12 -2.12 -0.02 0.00 0.00 0.00 0.00 36.38 34.12 2b3k s VAL 228 CO 0.02 0.50 -0.02 -0.62 0.00 0.00 0.00 175.10 174.97 2b3k s ASP 229 N 1.24 4.75 -0.03 3.32 -1.08 -0.09 -2.90 116.67 121.88 2b3k s ASP 229 Ca 0.03 -0.19 0.07 0.00 -0.52 0.00 0.00 52.55 51.93 2b3k s ASP 229 Cb -0.14 -1.80 -0.02 0.00 -1.46 0.00 0.00 42.92 39.51 2b3k s ASP 229 CO -0.07 0.10 -0.25 -0.63 0.52 0.00 0.00 175.17 174.84 2b3k s ILE 230 N 0.79 2.13 -0.10 4.11 -1.09 -0.03 -2.15 121.20 124.86 2b3k s ILE 230 Ca -0.00 -1.07 -0.05 0.00 -2.23 0.00 0.00 60.65 57.30 2b3k s ILE 230 Cb -0.14 -1.75 0.05 0.00 -1.58 0.00 0.00 42.46 39.03 2b3k s ILE 230 CO 0.02 0.58 0.23 -0.89 -1.23 0.00 0.00 174.94 173.64 2b3k s THR 231 N -0.47 -0.10 0.19 2.92 2.01 -1.26 -1.31 115.64 117.62 2b3k s THR 231 Ca 0.06 0.18 0.10 0.00 0.31 0.00 0.00 61.69 62.34 2b3k s THR 231 Cb -0.11 -0.36 -0.04 0.00 0.01 0.00 0.00 72.50 71.99 2b3k s THR 231 CO 0.01 0.07 -0.14 -0.76 -0.69 0.00 0.00 174.62 173.11 2b3k s LEU 232 N 1.44 2.79 -0.12 4.42 1.02 -0.41 -1.32 118.68 126.49 2b3k s LEU 232 Ca -0.07 -0.69 0.01 0.00 0.02 0.00 0.00 54.13 53.40 2b3k s LEU 232 Cb -0.11 -1.48 0.02 0.00 0.02 0.00 0.00 46.19 44.64 2b3k s LEU 232 CO -0.08 0.11 -0.14 -0.47 0.02 0.00 0.00 176.35 175.78 2b3k s TYR 233 N -1.73 2.01 -0.06 0.29 5.04 -0.09 -0.70 117.35 122.12 2b3k s TYR 233 Ca 0.24 -1.03 -0.02 0.00 -2.44 0.00 0.00 57.07 53.82 2b3k s TYR 233 Cb -0.08 -1.48 0.04 0.00 0.35 0.00 0.00 41.96 40.79 2b3k s TYR 233 CO 0.13 -0.55 0.12 0.50 -1.34 0.00 0.00 175.55 174.41 2b3k s ARG 234 N 1.23 0.02 -1.60 4.97 6.06 0.16 -1.58 118.95 128.21 2b3k s ARG 234 Ca -0.01 0.42 -0.15 0.00 -2.50 0.00 0.00 55.73 53.48 2b3k s ARG 234 Cb -0.14 -0.29 0.11 0.00 0.06 0.00 0.00 34.95 34.70 2b3k s ARG 234 CO -0.06 -0.25 0.87 -1.71 -2.50 0.00 0.00 175.30 171.66 2b3k n ASN 235 N 4.82 -3.90 0.00 -2.12 5.15 -1.26 -1.62 115.26 116.32 2b3k n ASN 235 Ca -0.14 -0.89 0.00 0.00 -0.60 0.00 0.00 54.58 52.95 2b3k n ASN 235 Cb 0.50 -3.38 0.00 0.00 -0.53 0.00 0.00 39.78 36.38 2b3k n ASN 235 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2b3k n GLY 236 N -1.58 0.78 3.32 8.20 0.00 -1.26 -5.06 105.19 109.60 2b3k n GLY 236 Ca 0.03 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.76 2b3k n GLY 236 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2b3k s TYR 237 N -2.92 2.22 -0.06 1.61 2.02 -0.64 -4.05 117.35 115.54 2b3k s TYR 237 Ca 0.00 -0.41 -0.02 0.00 -0.37 0.00 0.00 57.07 56.27 2b3k s TYR 237 Cb 0.00 -1.35 -0.03 0.00 -0.40 0.00 0.00 41.96 40.17 2b3k s TYR 237 CO 0.00 0.08 0.03 -1.01 -1.57 0.00 0.00 175.55 173.08 2b3k s HIS 238 N -0.75 3.21 -0.07 2.71 3.76 0.19 -0.67 115.29 123.67 2b3k s HIS 238 Ca 0.11 0.21 0.02 0.00 -0.15 0.00 0.00 55.06 55.25 2b3k s HIS 238 Cb -0.10 -1.78 0.01 0.00 1.11 0.00 0.00 32.58 31.83 2b3k s HIS 238 CO 0.01 0.51 -0.12 0.20 -0.85 0.00 0.00 174.74 174.49 2b3k s GLY 239 N -1.14 0.82 -0.04 -2.22 0.00 0.12 -4.47 107.32 100.40 2b3k s GLY 239 Ca 0.16 -0.45 0.02 0.00 0.00 0.00 0.00 44.72 44.45 2b3k s GLY 239 CO 0.05 0.17 -0.09 -0.35 0.00 0.00 0.00 173.10 172.88 2b3k s ASP 240 N 0.75 1.36 0.18 1.64 2.15 -1.26 -1.29 116.67 120.20 2b3k s ASP 240 Ca -0.13 -0.21 -0.23 0.00 0.43 0.00 0.00 52.55 52.41 2b3k s ASP 240 Cb -0.16 -0.53 0.06 0.00 -0.30 0.00 0.00 42.92 41.99 2b3k s ASP 240 CO 0.03 0.03 0.63 -1.48 -0.17 0.00 0.00 175.17 174.21 2b3k s LEU 241 N 0.53 -0.50 0.08 -1.34 2.34 -0.42 -3.18 118.68 116.19 2b3k s LEU 241 Ca -0.09 -0.13 -0.20 0.00 0.06 0.00 0.00 54.13 53.77 2b3k s LEU 241 Cb -0.13 2.61 0.05 0.00 -0.56 0.00 0.00 46.19 48.16 2b3k s LEU 241 CO 0.02 -1.04 0.48 0.54 -1.06 0.00 0.00 176.35 175.29 2b3k s ASN 242 N -2.78 -0.38 0.02 1.48 2.20 -1.01 -0.85 114.94 113.62 2b3k s ASN 242 Ca 0.03 -0.01 -0.04 0.00 -0.94 0.00 0.00 52.86 51.90 2b3k s ASN 242 Cb -0.02 0.49 -0.01 0.00 -2.00 0.00 0.00 41.25 39.71 2b3k s ASN 242 CO -0.09 -0.78 0.07 -1.61 -2.94 0.00 0.00 177.10 171.75 2b3k s GLU 243 N -2.98 0.46 -0.13 3.55 2.02 -1.14 -1.65 118.70 118.83 2b3k s GLU 243 Ca -0.02 -0.58 -0.07 0.00 0.02 0.00 0.00 54.97 54.32 2b3k s GLU 243 Cb -0.00 0.18 -0.04 0.00 0.10 0.00 0.00 34.13 34.37 2b3k s GLU 243 CO -0.06 -0.10 0.13 0.99 0.02 0.00 0.00 175.26 176.23 2b3k s THR 244 N -1.79 5.38 0.24 3.63 2.01 -1.20 -2.16 115.64 121.76 2b3k s THR 244 Ca -0.12 0.16 0.11 0.00 0.31 0.00 0.00 61.69 62.15 2b3k s THR 244 Cb -0.06 -3.35 -0.05 0.00 0.01 0.00 0.00 72.50 69.05 2b3k s THR 244 CO -0.01 0.60 -0.21 -0.36 -0.69 0.00 0.00 174.62 173.95 2b3k s PHE 245 N -0.85 2.23 -0.05 4.92 0.08 0.10 -4.47 117.98 119.94 2b3k s PHE 245 Ca 0.14 -0.36 -0.10 0.00 0.12 0.00 0.00 56.93 56.73 2b3k s PHE 245 Cb -0.12 -1.02 -0.05 0.00 -0.57 0.00 0.00 43.02 41.27 2b3k s PHE 245 CO 0.03 0.61 0.26 -0.06 -0.10 0.00 0.00 175.22 175.96 2b3k s PHE 246 N -2.25 3.64 -0.44 0.36 0.08 -1.26 -1.25 117.98 116.85 2b3k s PHE 246 Ca 0.26 0.71 -0.11 0.00 0.12 0.00 0.00 56.93 57.91 2b3k s PHE 246 Cb -0.06 -2.08 0.08 0.00 -0.57 0.00 0.00 43.02 40.40 2b3k s PHE 246 CO 0.12 0.68 0.32 0.08 -0.10 0.00 0.00 175.22 176.32 2b3k s VAL 247 N -1.10 4.54 0.00 -0.44 1.01 -0.33 -4.90 120.40 119.18 2b3k s VAL 247 Ca 0.20 -1.36 0.00 0.00 0.00 0.00 0.00 61.98 60.82 2b3k s VAL 247 Cb -0.14 -3.79 0.00 0.00 0.00 0.00 0.00 36.38 32.45 2b3k s VAL 247 CO 0.10 -0.57 0.00 0.61 0.00 0.00 0.00 175.10 175.23 2b3k n GLY 248 N 5.01 1.77 3.75 4.51 0.00 -1.26 -1.05 105.19 117.91 2b3k n GLY 248 Ca -0.11 -0.59 -0.39 0.00 0.00 0.00 0.00 46.02 44.93 2b3k n GLY 248 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2b3k s GLU 249 N 0.00 4.43 0.30 1.61 0.41 -1.26 -4.79 118.70 119.40 2b3k s GLU 249 Ca 0.00 0.93 0.10 0.00 -0.41 0.00 0.00 54.97 55.58 2b3k s GLU 249 Cb 0.00 -3.37 -0.06 0.00 -1.78 0.00 0.00 34.13 28.93 2b3k s GLU 249 CO 0.00 0.28 -0.13 0.14 -0.49 0.00 0.00 175.26 175.07 2b3k s VAL 250 N 0.01 2.18 0.87 2.63 -7.23 -1.26 -2.67 120.40 114.92 2b3k s VAL 250 Ca 0.36 -2.26 -0.12 0.00 -1.81 0.00 0.00 61.98 58.15 2b3k s VAL 250 Cb -0.19 -2.45 0.11 0.00 0.56 0.00 0.00 36.38 34.41 2b3k s VAL 250 CO 0.20 -0.31 1.17 1.51 -0.31 0.00 0.00 175.10 177.35 2b3k s ASP 251 N -3.53 3.97 0.43 4.85 1.47 -1.26 -4.86 116.67 117.74 2b3k s ASP 251 Ca 0.30 0.84 0.09 0.00 1.18 0.00 0.00 52.55 54.97 2b3k s ASP 251 Cb 0.00 -1.35 0.95 0.00 -0.34 0.00 0.00 42.92 42.18 2b3k s ASP 251 CO 0.14 -2.25 2.07 0.44 0.68 0.00 0.00 175.17 176.25 2b3k h ASP 252 N -1.29 0.38 -0.61 2.11 3.32 -2.01 -2.07 116.42 116.25 2b3k h ASP 252 Ca -0.48 -0.01 -0.05 0.00 0.02 0.00 0.00 57.03 56.51 2b3k h ASP 252 Cb 1.33 -0.09 -0.03 0.00 0.22 0.00 0.00 39.33 40.76 2b3k h ASP 252 CO 0.63 0.27 0.18 1.23 -1.72 0.00 0.00 179.24 179.83 2b3k h GLY 253 N 0.44 1.03 1.02 2.75 0.00 -1.99 -1.63 103.07 104.69 2b3k h GLY 253 Ca 0.13 -0.62 -0.06 0.00 0.00 0.00 0.00 47.33 46.79 2b3k h GLY 253 CO -0.03 0.58 0.16 0.00 0.00 0.00 0.00 176.54 177.25 2b3k h ALA 254 N 1.06 0.81 -0.48 3.60 0.00 -1.76 -1.07 119.26 121.42 2b3k h ALA 254 Ca 0.20 -0.22 -0.03 0.00 0.00 0.00 0.00 54.91 54.85 2b3k h ALA 254 Cb 0.31 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.84 2b3k h ALA 254 CO -0.00 0.51 0.19 0.00 0.00 0.00 0.00 179.25 179.94 2b3k h ARG 255 N 0.89 0.71 -0.53 0.00 3.08 -1.18 -1.75 114.38 115.60 2b3k h ARG 255 Ca 0.19 -0.13 -0.05 0.00 0.07 0.00 0.00 59.98 60.07 2b3k h ARG 255 Cb 0.34 -0.12 -0.02 0.00 0.08 0.00 0.00 29.97 30.25 2b3k h ARG 255 CO 0.00 0.64 0.15 -0.22 -1.07 0.00 0.00 179.97 179.47 2b3k h LYS 256 N 0.63 0.83 0.14 0.04 3.64 -1.15 -0.80 116.57 119.90 2b3k h LYS 256 Ca 0.16 -0.19 -0.01 0.00 -1.27 0.00 0.00 60.65 59.35 2b3k h LYS 256 Cb 0.20 -0.12 0.00 0.00 -0.41 0.00 0.00 32.23 31.90 2b3k h LYS 256 CO -0.01 0.77 -0.07 1.25 -2.27 0.00 0.00 179.45 179.12 2b3k h LEU 257 N 0.73 -0.16 -0.42 5.20 5.85 -1.05 -0.64 115.31 124.81 2b3k h LEU 257 Ca 0.17 -0.11 -0.03 0.00 0.84 0.00 0.00 57.88 58.75 2b3k h LEU 257 Cb 0.30 0.04 -0.02 0.00 0.37 0.00 0.00 40.66 41.35 2b3k h LEU 257 CO -0.00 0.01 0.15 0.58 -0.34 0.00 0.00 178.44 178.84 2b3k h VAL 258 N -0.33 1.21 -0.34 1.05 2.07 -1.30 -1.09 116.25 117.52 2b3k h VAL 258 Ca -0.02 -0.66 0.00 0.00 0.82 0.00 0.00 66.70 66.84 2b3k h VAL 258 Cb 0.26 0.85 -0.02 0.00 -1.52 0.00 0.00 31.29 30.87 2b3k h VAL 258 CO 0.03 0.24 0.22 -0.61 0.02 0.00 0.00 177.57 177.47 2b3k h GLN 259 N 0.54 0.46 -0.74 1.57 5.75 -1.11 -1.73 115.11 119.84 2b3k h GLN 259 Ca 0.14 -0.03 -0.03 0.00 -0.15 0.00 0.00 58.65 58.57 2b3k h GLN 259 Cb 0.22 -0.10 -0.03 0.00 1.07 0.00 0.00 27.48 28.64 2b3k h GLN 259 CO -0.01 0.32 0.33 1.15 -2.65 0.00 0.00 178.83 177.97 2b3k h THR 260 N 0.46 1.25 -0.49 2.39 2.02 -0.96 -1.59 112.91 115.98 2b3k h THR 260 Ca 0.12 -0.72 -0.01 0.00 0.77 0.00 0.00 66.41 66.57 2b3k h THR 260 Cb -0.03 0.34 -0.02 0.00 -1.74 0.00 0.00 68.15 66.70 2b3k h THR 260 CO -0.03 0.30 0.25 0.74 0.37 0.00 0.00 175.52 177.16 2b3k h THR 261 N 1.05 1.18 -0.79 3.16 2.02 -0.96 -0.02 112.91 118.55 2b3k h THR 261 Ca 0.25 -0.47 -0.02 0.00 0.77 0.00 0.00 66.41 66.94 2b3k h THR 261 Cb 0.16 0.60 -0.04 0.00 -1.74 0.00 0.00 68.15 67.13 2b3k h THR 261 CO -0.03 0.19 0.41 0.22 0.37 0.00 0.00 175.52 176.69 2b3k h TYR 262 N 0.64 1.10 -0.40 3.16 3.20 -1.08 -2.16 116.97 121.43 2b3k h TYR 262 Ca 0.17 -0.04 -0.06 0.00 3.14 0.00 0.00 58.73 61.94 2b3k h TYR 262 Cb 0.08 -0.35 -0.02 0.00 1.54 0.00 0.00 36.73 37.98 2b3k h TYR 262 CO -0.01 0.78 -0.02 0.93 -1.64 0.00 0.00 178.16 178.19 2b3k h GLU 263 N 1.10 0.64 -0.40 1.82 5.08 -0.72 -1.83 114.58 120.27 2b3k h GLU 263 Ca 0.27 -0.16 -0.01 0.00 -1.00 0.00 0.00 59.36 58.47 2b3k h GLU 263 Cb 0.06 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.21 2b3k h GLU 263 CO -0.04 0.68 0.23 0.00 -1.00 0.00 0.00 179.01 178.88 2b3k h LEU 265 N 0.52 0.41 -0.88 0.00 5.85 -1.02 -2.41 115.31 117.77 2b3k h LEU 265 Ca 0.14 -0.18 -0.10 0.00 0.84 0.00 0.00 57.88 58.58 2b3k h LEU 265 Cb 0.03 -0.11 -0.01 0.00 0.37 0.00 0.00 40.66 40.94 2b3k h LEU 265 CO -0.02 0.48 -0.26 0.24 -0.34 0.00 0.00 178.44 178.53 2b3k h MET 266 N 0.31 0.53 -0.31 1.25 2.86 -1.13 -0.44 114.93 118.00 2b3k h MET 266 Ca 0.10 -0.21 -0.08 0.00 -2.06 0.00 0.00 59.70 57.45 2b3k h MET 266 Cb 0.20 -0.03 -0.02 0.00 0.06 0.00 0.00 31.60 31.82 2b3k h MET 266 CO -0.01 0.74 -0.17 1.96 1.06 0.00 0.00 176.91 180.50 2b3k h GLN 267 N 0.46 0.55 -0.27 1.72 4.20 -0.88 -0.21 115.11 120.69 2b3k h GLN 267 Ca 0.07 -0.18 -0.08 0.00 0.06 0.00 0.00 58.65 58.52 2b3k h GLN 267 Cb 0.69 -0.05 -0.01 0.00 0.30 0.00 0.00 27.48 28.42 2b3k h GLN 267 CO 0.05 0.70 -0.15 0.00 -0.67 0.00 0.00 178.83 178.76 2b3k h ALA 268 N 1.33 0.38 -0.66 3.87 0.00 -0.96 -3.04 119.26 120.17 2b3k h ALA 268 Ca 0.08 -0.33 -0.03 0.00 0.00 0.00 0.00 54.91 54.64 2b3k h ALA 268 Cb 0.57 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.24 2b3k h ALA 268 CO 0.04 0.27 0.29 0.82 0.00 0.00 0.00 179.25 180.66 2b3k h ILE 269 N 0.30 1.22 0.00 0.00 2.04 -0.77 -1.75 117.51 118.55 2b3k h ILE 269 Ca 0.06 -0.66 0.00 0.00 1.00 0.00 0.00 64.86 65.25 2b3k h ILE 269 Cb 0.67 0.41 0.00 0.00 -0.74 0.00 0.00 36.82 37.16 2b3k h ILE 269 CO 0.04 0.27 0.00 0.44 0.00 0.00 0.00 178.15 178.90 2b3k h ASP 270 N 0.94 0.00 0.42 1.72 3.32 -0.96 -1.94 116.42 119.92 2b3k h ASP 270 Ca 0.23 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.28 2b3k h ASP 270 Cb 0.14 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.69 2b3k h ASP 270 CO -0.02 0.00 -0.47 0.00 -1.72 0.00 0.00 179.24 177.03 2b3k n ALA 271 N -2.01 3.50 -2.45 3.45 0.00 -0.66 -4.91 120.51 117.42 2b3k n ALA 271 Ca -0.01 -0.37 -0.42 0.00 0.00 0.00 0.00 53.44 52.64 2b3k n ALA 271 Cb 0.18 -1.11 -0.03 0.00 0.00 0.00 0.00 19.45 18.49 2b3k n ALA 271 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2b3k s VAL 272 N -2.89 4.19 -0.24 0.00 1.01 -0.73 -4.91 120.40 116.83 2b3k s VAL 272 Ca 0.14 1.54 -0.37 0.00 0.00 0.00 0.00 61.98 63.29 2b3k s VAL 272 Cb 0.18 -3.99 0.15 0.00 0.00 0.00 0.00 36.38 32.72 2b3k s VAL 272 CO 0.67 0.04 1.31 -1.59 0.00 0.00 0.00 175.10 175.53 2b3k s LYS 273 N 1.79 0.15 0.31 2.72 -2.85 -1.26 -3.79 119.74 116.80 2b3k s LYS 273 Ca 0.57 -0.06 -0.29 0.00 -1.00 0.00 0.00 55.97 55.19 2b3k s LYS 273 Cb -0.26 0.07 -0.13 0.00 -2.06 0.00 0.00 37.83 35.45 2b3k s LYS 273 CO 0.25 -0.07 1.26 -2.30 0.10 0.00 0.00 175.35 174.59 2b3k n PRO 274 N -0.06 1.94 0.00 1.78 -0.02 -1.26 -2.63 135.00 134.75 2b3k n PRO 274 Ca 0.03 0.68 0.00 0.00 -2.02 0.00 0.00 63.50 62.19 2b3k n PRO 274 Cb 0.57 -2.24 0.00 0.00 -0.02 0.00 0.00 33.50 31.81 2b3k n PRO 274 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2b3k n GLY 275 N 1.19 2.34 3.76 -1.23 0.00 -0.21 -4.97 105.19 106.08 2b3k n GLY 275 Ca 0.07 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.70 2b3k n GLY 275 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2b3k s VAL 276 N -2.64 4.56 0.21 1.61 1.01 -1.08 -4.76 120.40 119.31 2b3k s VAL 276 Ca 0.00 1.70 -0.30 0.00 0.00 0.00 0.00 61.98 63.38 2b3k s VAL 276 Cb 0.00 -4.14 -0.08 0.00 0.00 0.00 0.00 36.38 32.16 2b3k s VAL 276 CO 0.00 0.43 1.06 -0.13 0.00 0.00 0.00 175.10 176.45 2b3k s ARG 277 N -0.51 4.67 0.54 2.72 0.52 -1.26 -0.15 118.95 125.48 2b3k s ARG 277 Ca 0.38 1.67 0.20 0.00 -0.52 0.00 0.00 55.73 57.46 2b3k s ARG 277 Cb -0.22 -3.26 1.40 0.00 0.52 0.00 0.00 34.95 33.39 2b3k s ARG 277 CO 0.25 0.21 2.16 1.88 0.02 0.00 0.00 175.30 179.82 2b3k h TYR 278 N 4.63 0.00 0.00 -0.53 0.05 -1.74 -1.15 116.97 118.23 2b3k h TYR 278 Ca -0.45 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.33 2b3k h TYR 278 Cb 1.21 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.95 2b3k h TYR 278 CO 0.61 0.00 0.00 2.89 -1.05 0.00 0.00 178.16 180.61 2b3k n ARG 279 N -4.36 0.10 0.11 4.88 1.85 -1.26 -2.89 116.66 115.08 2b3k n ARG 279 Ca -0.02 0.34 -0.04 0.00 -1.00 0.00 0.00 57.85 57.13 2b3k n ARG 279 Cb 0.13 -1.69 0.07 0.00 -1.05 0.00 0.00 32.46 29.92 2b3k n ARG 279 CO 0.00 0.00 0.00 1.49 -0.01 0.00 0.00 177.63 179.11 2b3k h GLU 280 N 0.00 0.05 -0.98 2.89 4.57 -1.59 -3.30 114.58 116.22 2b3k h GLU 280 Ca 0.00 -0.05 0.09 0.00 -1.18 0.00 0.00 59.36 58.22 2b3k h GLU 280 Cb 0.31 0.01 -0.07 0.00 -0.16 0.00 0.00 28.75 28.84 2b3k h GLU 280 CO 0.00 0.77 0.62 -0.07 -1.18 0.00 0.00 179.01 179.14 2b3k h LEU 281 N 0.03 0.95 -1.34 1.64 3.38 -1.69 -1.74 115.31 116.55 2b3k h LEU 281 Ca -0.01 0.03 -0.03 0.00 0.09 0.00 0.00 57.88 57.95 2b3k h LEU 281 Cb 1.31 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 41.87 2b3k h LEU 281 CO 0.10 0.57 0.11 1.23 0.09 0.00 0.00 178.44 180.53 2b3k h GLY 282 N 1.06 0.60 1.00 0.83 0.00 -1.63 -1.10 103.07 103.83 2b3k h GLY 282 Ca 0.45 -0.30 -0.05 0.00 0.00 0.00 0.00 47.33 47.42 2b3k h GLY 282 CO -0.21 0.29 0.15 3.43 0.00 0.00 0.00 176.54 180.19 2b3k h ASN 283 N 0.55 0.84 -0.09 0.19 2.35 -1.45 -1.40 115.58 116.56 2b3k h ASN 283 Ca 0.13 -0.22 -0.01 0.00 -0.55 0.00 0.00 56.30 55.65 2b3k h ASN 283 Cb 0.19 -0.22 -0.00 0.00 0.05 0.00 0.00 38.32 38.33 2b3k h ASN 283 CO -0.01 0.85 0.03 0.40 -1.65 0.00 0.00 177.43 177.05 2b3k h ILE 284 N 0.80 1.16 0.28 2.81 2.04 -1.22 -2.17 117.51 121.21 2b3k h ILE 284 Ca 0.18 -0.49 -0.01 0.00 1.00 0.00 0.00 64.86 65.53 2b3k h ILE 284 Cb 0.32 1.32 0.00 0.00 -0.74 0.00 0.00 36.82 37.73 2b3k h ILE 284 CO -0.00 0.14 -0.14 0.40 0.00 0.00 0.00 178.15 178.56 2b3k h ILE 285 N -0.03 0.73 -0.86 -0.67 2.04 -1.10 -2.92 117.51 114.70 2b3k h ILE 285 Ca 0.03 -0.04 -0.01 0.00 1.00 0.00 0.00 64.86 65.84 2b3k h ILE 285 Cb 0.20 0.75 -0.04 0.00 -0.74 0.00 0.00 36.82 36.99 2b3k h ILE 285 CO -0.00 0.01 0.50 -0.61 0.00 0.00 0.00 178.15 178.05 2b3k h GLN 286 N -0.40 1.18 -0.50 2.37 4.15 -1.30 -1.71 115.11 118.90 2b3k h GLN 286 Ca -0.04 -0.12 0.09 0.00 0.77 0.00 0.00 58.65 59.35 2b3k h GLN 286 Cb 0.31 -0.24 -0.07 0.00 0.21 0.00 0.00 27.48 27.68 2b3k h GLN 286 CO 0.06 0.84 0.08 -0.22 -1.93 0.00 0.00 178.83 177.66 2b3k h LYS 287 N 1.20 0.20 -0.17 1.69 3.64 -1.27 0.22 116.57 122.08 2b3k h LYS 287 Ca 0.31 -0.01 -0.21 0.00 -1.27 0.00 0.00 60.65 59.47 2b3k h LYS 287 Cb -0.02 -0.05 0.01 0.00 -0.41 0.00 0.00 32.23 31.76 2b3k h LYS 287 CO -0.05 0.13 -0.71 1.25 -2.27 0.00 0.00 179.45 177.80 2b3k h HIS 288 N 0.21 0.98 -0.30 1.91 2.76 -1.29 -2.39 115.15 117.02 2b3k h HIS 288 Ca 0.25 -0.41 -0.05 0.00 -2.20 0.00 0.00 60.37 57.96 2b3k h HIS 288 Cb 0.35 -0.16 -0.01 0.00 1.55 0.00 0.00 27.41 29.14 2b3k h HIS 288 CO -0.25 1.23 0.01 0.00 -1.30 0.00 0.00 177.93 177.62 2b3k h ALA 289 N 0.67 0.41 -0.36 5.26 0.00 -0.82 -2.95 119.26 121.46 2b3k h ALA 289 Ca -0.03 -0.23 -0.05 0.00 0.00 0.00 0.00 54.91 54.60 2b3k h ALA 289 Cb 1.32 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.98 2b3k h ALA 289 CO 0.14 0.15 0.01 0.37 0.00 0.00 0.00 179.25 179.92 2b3k h GLN 290 N 0.33 0.57 0.00 0.00 4.15 -0.60 -0.56 115.11 118.99 2b3k h GLN 290 Ca 0.09 -0.12 -0.00 0.00 0.77 0.00 0.00 58.65 59.38 2b3k h GLN 290 Cb 0.42 -0.08 -0.00 0.00 0.21 0.00 0.00 27.48 28.03 2b3k h GLN 290 CO 0.01 0.59 -0.01 0.00 -1.93 0.00 0.00 178.83 177.49 2b3k h ALA 291 N 1.47 1.03 -0.45 3.38 0.00 -1.26 -1.81 119.26 121.62 2b3k h ALA 291 Ca 0.12 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.02 2b3k h ALA 291 Cb 0.34 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.13 2b3k h ALA 291 CO 0.01 0.01 0.00 0.09 0.00 0.00 0.00 179.25 179.36 2b3k n ASN 292 N -3.14 3.59 -0.48 0.00 3.02 -0.54 -4.97 115.26 112.74 2b3k n ASN 292 Ca -0.01 -2.26 -0.05 0.00 -0.03 0.00 0.00 54.58 52.23 2b3k n ASN 292 Cb 0.19 -0.39 -0.01 0.00 -0.61 0.00 0.00 39.78 38.96 2b3k n ASN 292 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2b3k n GLY 293 N 0.62 0.47 3.61 7.41 0.00 -0.68 -5.05 105.19 111.58 2b3k n GLY 293 Ca 0.18 -0.76 -0.24 0.00 0.00 0.00 0.00 46.02 45.21 2b3k n GLY 293 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2b3k s PHE 294 N -2.22 2.58 0.32 1.61 0.08 -0.33 -4.84 117.98 115.19 2b3k s PHE 294 Ca 0.00 -0.30 0.08 0.00 0.12 0.00 0.00 56.93 56.83 2b3k s PHE 294 Cb 0.00 -1.24 -0.04 0.00 -0.57 0.00 0.00 43.02 41.17 2b3k s PHE 294 CO 0.00 0.59 0.19 -1.54 -0.10 0.00 0.00 175.22 174.36 2b3k s SER 295 N -3.66 4.98 -0.19 1.36 1.04 -0.58 -3.46 113.70 113.19 2b3k s SER 295 Ca 0.32 -0.61 -0.02 0.00 0.48 0.00 0.00 55.95 56.12 2b3k s SER 295 Cb -0.04 -0.90 -0.01 0.00 0.10 0.00 0.00 66.02 65.17 2b3k s SER 295 CO 0.19 -0.26 -0.08 -0.69 0.98 0.00 0.00 173.24 173.38 2b3k s VAL 296 N -2.34 3.20 0.33 5.02 1.01 -1.26 -1.06 120.40 125.29 2b3k s VAL 296 Ca 0.38 -0.57 -0.29 0.00 0.00 0.00 0.00 61.98 61.50 2b3k s VAL 296 Cb -0.05 -2.42 -0.11 0.00 0.00 0.00 0.00 36.38 33.80 2b3k s VAL 296 CO 0.24 0.46 1.55 -0.69 0.00 0.00 0.00 175.10 176.66 2b3k s VAL 297 N 1.11 2.08 -0.22 2.92 1.01 -0.60 -4.79 120.40 121.90 2b3k s VAL 297 Ca 0.01 0.07 0.12 0.00 0.00 0.00 0.00 61.98 62.18 2b3k s VAL 297 Cb -0.15 -3.04 -0.16 0.00 0.00 0.00 0.00 36.38 33.03 2b3k s VAL 297 CO -0.02 0.01 0.35 0.54 0.00 0.00 0.00 175.10 175.99 2b3k n ARG 298 N 1.48 1.44 0.01 2.72 1.74 -1.26 -4.63 116.66 118.17 2b3k n ARG 298 Ca 0.05 -0.07 0.13 0.00 -0.77 0.00 0.00 57.85 57.20 2b3k n ARG 298 Cb 0.38 -1.20 0.50 0.00 -1.02 0.00 0.00 32.46 31.13 2b3k n ARG 298 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 2b3k n SER 299 N -1.67 0.22 -4.11 0.55 7.64 -1.26 -4.82 113.62 110.18 2b3k n SER 299 Ca -0.00 0.34 -0.21 0.00 1.01 0.00 0.00 58.87 60.01 2b3k n SER 299 Cb 0.26 -0.35 -0.15 0.00 -1.01 0.00 0.00 64.21 62.96 2b3k n SER 299 CO 0.00 0.00 0.00 -0.31 -3.01 0.00 0.00 175.04 171.72 2b3k s TYR 300 N -3.02 1.19 0.27 1.43 2.02 -1.26 -5.16 117.35 112.82 2b3k s TYR 300 Ca 0.13 -0.26 0.02 0.00 -0.37 0.00 0.00 57.07 56.58 2b3k s TYR 300 Cb 0.18 -0.75 -0.05 0.00 -0.40 0.00 0.00 41.96 40.94 2b3k s TYR 300 CO 0.58 -0.00 0.10 0.00 -1.57 0.00 0.00 175.55 174.65 2b3k s GLY 302 N -3.34 1.58 0.09 0.00 0.00 0.78 -4.79 107.32 101.64 2b3k s GLY 302 Ca 0.37 -0.58 -0.24 0.00 0.00 0.00 0.00 44.72 44.27 2b3k s GLY 302 CO 0.14 0.06 0.58 -2.38 0.00 0.00 0.00 173.10 171.50 2b3k s HIS 303 N -3.18 -0.52 0.69 1.90 -0.00 -1.18 -0.98 115.29 112.02 2b3k s HIS 303 Ca 0.66 0.50 -0.14 0.00 -0.00 0.00 0.00 55.06 56.07 2b3k s HIS 303 Cb -0.15 0.46 0.02 0.00 -0.00 0.00 0.00 32.58 32.91 2b3k s HIS 303 CO 0.55 -0.74 1.13 0.20 -0.00 0.00 0.00 174.74 175.88 2b3k s GLY 304 N -2.25 2.15 -0.28 -1.38 0.00 0.62 -0.60 107.32 105.58 2b3k s GLY 304 Ca -0.03 0.61 -0.21 0.00 0.00 0.00 0.00 44.72 45.09 2b3k s GLY 304 CO -0.06 0.97 0.74 -1.50 0.00 0.00 0.00 173.10 173.25 2b3k s ILE 305 N -2.31 0.00 0.00 0.90 2.07 -1.16 -1.96 121.20 118.74 2b3k s ILE 305 Ca 0.68 0.00 0.00 0.00 -1.41 0.00 0.00 60.65 59.92 2b3k s ILE 305 Cb -0.22 -1.00 0.00 0.00 0.13 0.00 0.00 42.46 41.37 2b3k s ILE 305 CO 0.44 0.00 0.00 0.00 -1.91 0.00 0.00 174.94 173.47 2b3k n HIS 306 N 3.33 0.00 0.47 3.50 1.44 -1.26 -4.58 115.22 118.12 2b3k n HIS 306 Ca -0.16 0.00 0.13 0.00 -2.01 0.00 0.00 57.72 55.68 2b3k n HIS 306 Cb 0.57 0.00 0.42 0.00 0.12 0.00 0.00 29.99 31.09 2b3k n HIS 306 CO 0.00 0.00 0.00 0.87 -2.81 0.00 0.00 176.34 174.40 2b3k h LYS 307 N 0.00 0.00 -6.60 -1.40 1.57 -1.92 0.55 116.57 108.77 2b3k h LYS 307 Ca 0.00 0.00 -0.67 0.00 -1.87 0.00 0.00 60.65 58.11 2b3k h LYS 307 Cb 0.00 0.00 -0.17 0.00 0.08 0.00 0.00 32.23 32.14 2b3k h LYS 307 CO 0.00 0.00 -0.76 -0.51 -0.57 0.00 0.00 179.45 177.61 2b3k s LEU 308 N -4.93 2.93 -0.03 2.94 1.43 -1.26 -4.84 118.68 114.92 2b3k s LEU 308 Ca 0.08 -0.43 -0.25 0.00 -1.03 0.00 0.00 54.13 52.49 2b3k s LEU 308 Cb 0.10 -1.74 -0.20 0.00 0.03 0.00 0.00 46.19 44.38 2b3k s LEU 308 CO 0.55 0.18 1.21 0.15 0.23 0.00 0.00 176.35 178.68 2b3k h PHE 309 N 3.71 0.07 -3.30 0.29 3.04 -1.88 -3.40 116.94 115.46 2b3k h PHE 309 Ca -0.49 -0.02 -0.47 0.00 3.98 0.00 0.00 57.97 60.97 2b3k h PHE 309 Cb 1.17 -0.01 -0.36 0.00 2.56 0.00 0.00 35.95 39.30 2b3k h PHE 309 CO 0.60 0.60 -0.79 -1.01 -2.02 0.00 0.00 178.31 175.69 2b3k s HIS 310 N -3.98 1.04 0.09 0.41 3.76 -1.26 -4.53 115.29 110.82 2b3k s HIS 310 Ca -0.16 -0.40 -0.03 0.00 -0.15 0.00 0.00 55.06 54.32 2b3k s HIS 310 Cb 0.02 -0.93 0.01 0.00 1.11 0.00 0.00 32.58 32.78 2b3k s HIS 310 CO 0.69 -0.35 0.17 -2.37 -0.85 0.00 0.00 174.74 172.04 2b3k n THR 311 N 4.64 0.00 -1.85 1.30 5.66 -0.83 -4.94 114.28 118.25 2b3k n THR 311 Ca -0.15 -0.26 -0.40 0.00 -3.05 0.00 0.00 64.05 60.20 2b3k n THR 311 Cb 0.50 0.23 0.01 0.00 -1.55 0.00 0.00 70.33 69.53 2b3k n THR 311 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2b3k s ALA 312 N -1.34 3.25 0.43 1.79 0.00 -1.26 -0.28 121.76 124.35 2b3k s ALA 312 Ca 0.04 1.42 -0.05 0.00 0.00 0.00 0.00 51.96 53.37 2b3k s ALA 312 Cb -0.01 -3.57 -0.04 0.00 0.00 0.00 0.00 23.12 19.50 2b3k s ALA 312 CO 0.03 -1.11 0.72 -1.25 0.00 0.00 0.00 175.76 174.15 2b3k s PRO 313 N -2.41 3.57 -0.13 0.00 0.04 -1.26 -3.87 135.00 130.94 2b3k s PRO 313 Ca 0.60 0.13 -0.21 0.00 0.04 0.00 0.00 61.00 61.56 2b3k s PRO 313 Cb -0.42 -2.45 -0.03 0.00 0.04 0.00 0.00 34.50 31.63 2b3k s PRO 313 CO 0.55 -0.09 0.59 1.21 0.04 0.00 0.00 177.00 179.30 2b3k s ASN 314 N -3.88 6.77 -0.45 6.66 2.47 -1.26 -1.54 114.94 123.71 2b3k s ASN 314 Ca 0.46 0.93 0.04 0.00 0.42 0.00 0.00 52.86 54.71 2b3k s ASN 314 Cb -0.10 -2.34 0.12 0.00 -1.45 0.00 0.00 41.25 37.47 2b3k s ASN 314 CO 0.40 -0.13 0.18 -0.69 -3.72 0.00 0.00 177.10 173.15 2b3k s VAL 315 N 1.11 2.45 0.59 -5.21 1.01 -0.15 -4.65 120.40 115.55 2b3k s VAL 315 Ca 0.30 -2.94 -0.18 0.00 0.00 0.00 0.00 61.98 59.15 2b3k s VAL 315 Cb -0.16 -2.74 -0.03 0.00 0.00 0.00 0.00 36.38 33.44 2b3k s VAL 315 CO 0.13 -0.73 1.18 -2.84 0.00 0.00 0.00 175.10 172.84 2b3k s PRO 316 N 0.17 3.01 0.00 2.72 0.02 -1.26 -0.16 135.00 139.50 2b3k s PRO 316 Ca 0.15 1.73 0.20 0.00 0.02 0.00 0.00 61.00 63.10 2b3k s PRO 316 Cb -0.23 -1.95 0.19 0.00 0.02 0.00 0.00 34.50 32.53 2b3k s PRO 316 CO -0.03 -1.15 1.16 0.72 -0.33 0.00 0.00 177.00 177.36 2b3k n HIS 317 N -1.64 0.07 -3.93 6.54 8.25 -1.26 -3.62 115.22 119.64 2b3k n HIS 317 Ca 0.13 -0.04 -0.21 0.00 -0.26 0.00 0.00 57.72 57.33 2b3k n HIS 317 Cb 0.50 -0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.58 2b3k n HIS 317 CO 0.00 0.00 0.00 1.52 0.64 0.00 0.00 176.34 178.50 2b3k s TYR 318 N -1.60 3.14 0.53 4.41 -0.85 -1.26 -3.69 117.35 118.04 2b3k s TYR 318 Ca 0.25 -0.15 -0.19 0.00 -0.52 0.00 0.00 57.07 56.46 2b3k s TYR 318 Cb 0.17 -1.61 -0.06 0.00 0.38 0.00 0.00 41.96 40.84 2b3k s TYR 318 CO 0.25 0.35 1.07 0.00 -1.52 0.00 0.00 175.55 175.71 2b3k s ALA 319 N -2.15 2.77 -1.30 9.51 0.00 -1.15 -4.02 121.76 125.43 2b3k s ALA 319 Ca 0.37 0.63 -0.01 0.00 0.00 0.00 0.00 51.96 52.94 2b3k s ALA 319 Cb -0.08 -3.28 0.01 0.00 0.00 0.00 0.00 23.12 19.76 2b3k s ALA 319 CO 0.27 -0.59 0.81 1.63 0.00 0.00 0.00 175.76 177.88 2b3k n LYS 320 N -1.34 -5.49 -2.79 0.00 5.02 -1.26 -4.93 118.16 107.37 2b3k n LYS 320 Ca 0.10 0.68 -0.20 0.00 -2.02 0.00 0.00 58.31 56.87 2b3k n LYS 320 Cb 0.52 -5.39 0.03 0.00 -0.02 0.00 0.00 35.03 30.16 2b3k n LYS 320 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 2b3k s ASN 321 N -4.25 5.44 -0.45 4.39 2.20 -1.26 -5.03 114.94 115.97 2b3k s ASN 321 Ca 0.07 -0.11 0.04 0.00 -0.94 0.00 0.00 52.86 51.92 2b3k s ASN 321 Cb -0.03 -0.87 0.50 0.00 -2.00 0.00 0.00 41.25 38.85 2b3k s ASN 321 CO 0.79 -0.99 1.68 2.29 -2.94 0.00 0.00 177.10 177.93 2b3k n LYS 322 N -2.17 2.60 -1.70 3.55 2.85 -1.26 -4.93 118.16 117.11 2b3k n LYS 322 Ca 0.07 -3.42 -0.43 0.00 -1.05 0.00 0.00 58.31 53.48 2b3k n LYS 322 Cb 0.59 -2.15 -0.02 0.00 -0.65 0.00 0.00 35.03 32.81 2b3k n LYS 322 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 2b3k n ALA 323 N -0.96 1.54 -2.75 0.58 0.00 -1.26 -4.97 120.51 112.69 2b3k n ALA 323 Ca 0.51 0.39 -0.36 0.00 0.00 0.00 0.00 53.44 53.97 2b3k n ALA 323 Cb 1.00 -2.32 -0.07 0.00 0.00 0.00 0.00 19.45 18.06 2b3k n ALA 323 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2b3k s VAL 324 N -0.34 5.38 0.00 0.00 1.01 -1.26 -4.33 120.40 120.85 2b3k s VAL 324 Ca 0.63 0.35 0.00 0.00 0.00 0.00 0.00 61.98 62.96 2b3k s VAL 324 Cb -0.59 -3.52 0.00 0.00 0.00 0.00 0.00 36.38 32.28 2b3k s VAL 324 CO 0.53 0.48 0.00 0.61 0.00 0.00 0.00 175.10 176.72 2b3k n GLY 325 N 2.99 3.47 3.06 4.51 0.00 -1.26 -4.78 105.19 113.17 2b3k n GLY 325 Ca -0.16 -1.84 -0.24 0.00 0.00 0.00 0.00 46.02 43.79 2b3k n GLY 325 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2b3k s VAL 326 N -2.60 1.12 0.46 1.61 1.01 -1.26 -2.10 120.40 118.64 2b3k s VAL 326 Ca 0.00 -0.53 -0.25 0.00 0.00 0.00 0.00 61.98 61.21 2b3k s VAL 326 Cb 0.00 -0.99 -0.08 0.00 0.00 0.00 0.00 36.38 35.32 2b3k s VAL 326 CO 0.00 0.34 1.37 -0.04 0.00 0.00 0.00 175.10 176.77 2b3k s MET 327 N 0.25 3.63 -0.06 2.72 -1.94 0.79 -4.86 119.30 119.82 2b3k s MET 327 Ca -0.06 2.28 -0.12 0.00 -1.71 0.00 0.00 55.69 56.08 2b3k s MET 327 Cb -0.11 -2.58 0.02 0.00 2.01 0.00 0.00 34.83 34.17 2b3k s MET 327 CO 0.02 -0.81 0.29 0.15 -0.01 0.00 0.00 175.02 174.66 2b3k s LYS 328 N -2.52 0.50 -0.01 2.03 1.02 -1.26 -1.04 119.74 118.46 2b3k s LYS 328 Ca 0.63 0.08 -0.36 0.00 0.02 0.00 0.00 55.97 56.33 2b3k s LYS 328 Cb -0.41 0.23 -0.14 0.00 -0.52 0.00 0.00 37.83 36.99 2b3k s LYS 328 CO 0.52 -0.11 1.63 0.45 -0.92 0.00 0.00 175.35 176.92 2b3k n SER 329 N 2.07 2.69 0.00 2.83 2.88 -1.26 -1.58 113.62 121.24 2b3k n SER 329 Ca -0.18 1.06 0.00 0.00 -1.33 0.00 0.00 58.87 58.43 2b3k n SER 329 Cb 0.57 -1.30 0.00 0.00 -0.75 0.00 0.00 64.21 62.73 2b3k n SER 329 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2b3k n GLY 330 N 3.60 0.89 3.77 0.46 0.00 0.88 -4.88 105.19 109.91 2b3k n GLY 330 Ca 0.21 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.85 2b3k n GLY 330 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2b3k s HIS 331 N -2.03 3.70 -0.07 1.61 3.76 -0.62 -1.83 115.29 119.82 2b3k s HIS 331 Ca 0.00 1.79 0.01 0.00 -0.15 0.00 0.00 55.06 56.71 2b3k s HIS 331 Cb 0.00 -2.97 0.02 0.00 1.11 0.00 0.00 32.58 30.74 2b3k s HIS 331 CO 0.00 0.14 -0.08 0.08 -0.85 0.00 0.00 174.74 174.03 2b3k s VAL 332 N -1.51 0.85 0.28 -0.90 1.01 -1.26 -0.56 120.40 118.30 2b3k s VAL 332 Ca 0.49 -0.28 -0.20 0.00 0.00 0.00 0.00 61.98 62.00 2b3k s VAL 332 Cb -0.21 -0.83 0.02 0.00 0.00 0.00 0.00 36.38 35.36 2b3k s VAL 332 CO 0.27 0.30 0.69 0.72 0.00 0.00 0.00 175.10 177.08 2b3k s PHE 333 N 1.02 -0.10 0.26 5.22 -0.12 -0.58 -2.98 117.98 120.70 2b3k s PHE 333 Ca -0.09 -0.36 0.09 0.00 -0.05 0.00 0.00 56.93 56.52 2b3k s PHE 333 Cb -0.14 0.65 -0.04 0.00 -0.63 0.00 0.00 43.02 42.85 2b3k s PHE 333 CO -0.00 -1.23 0.03 0.95 -0.05 0.00 0.00 175.22 174.92 2b3k s THR 334 N -3.84 3.63 -0.09 -4.49 -4.23 0.23 -0.16 115.64 106.69 2b3k s THR 334 Ca 0.13 -1.80 0.01 0.00 -1.18 0.00 0.00 61.69 58.85 2b3k s THR 334 Cb -0.05 -2.94 0.02 0.00 1.34 0.00 0.00 72.50 70.87 2b3k s THR 334 CO 0.08 -0.35 -0.10 -0.63 -0.54 0.00 0.00 174.62 173.08 2b3k s ILE 335 N -2.25 1.06 -0.41 2.99 1.01 -1.10 -3.13 121.20 119.38 2b3k s ILE 335 Ca 0.31 -0.37 0.09 0.00 0.00 0.00 0.00 60.65 60.68 2b3k s ILE 335 Cb -0.07 -1.02 0.29 0.00 0.01 0.00 0.00 42.46 41.67 2b3k s ILE 335 CO 0.21 0.36 0.71 -1.84 0.00 0.00 0.00 174.94 174.37 2b3k n GLU 336 N 4.40 0.84 -1.77 2.79 0.28 -1.26 -2.76 120.64 123.15 2b3k n GLU 336 Ca -0.18 -2.90 -0.42 0.00 -0.16 0.00 0.00 57.16 53.51 2b3k n GLU 336 Cb 0.51 -1.38 -0.02 0.00 1.43 0.00 0.00 31.44 31.97 2b3k n GLU 336 CO 0.00 0.00 0.00 -1.25 -0.16 0.00 0.00 177.13 175.72 2b3k s PRO 337 N -1.12 4.13 -0.27 3.44 0.04 -1.21 -4.77 135.00 135.24 2b3k s PRO 337 Ca 0.35 2.57 -0.04 0.00 0.04 0.00 0.00 61.00 63.92 2b3k s PRO 337 Cb 0.25 -3.05 0.02 0.00 0.04 0.00 0.00 34.50 31.75 2b3k s PRO 337 CO -0.12 -0.68 0.00 -1.64 0.04 0.00 0.00 177.00 174.61 2b3k s MET 338 N 0.32 2.95 -0.05 4.56 -1.94 -1.26 -3.37 119.30 120.51 2b3k s MET 338 Ca 0.69 -0.92 0.02 0.00 -1.71 0.00 0.00 55.69 53.77 2b3k s MET 338 Cb -0.48 -3.16 -0.03 0.00 2.01 0.00 0.00 34.83 33.17 2b3k s MET 338 CO 0.40 -0.42 -0.11 0.42 -0.01 0.00 0.00 175.02 175.30 2b3k s ILE 339 N 1.40 3.37 0.11 2.53 -1.09 -0.20 -1.56 121.20 125.76 2b3k s ILE 339 Ca 0.01 -0.62 0.11 0.00 -2.23 0.00 0.00 60.65 57.92 2b3k s ILE 339 Cb -0.17 -2.35 -0.04 0.00 -1.58 0.00 0.00 42.46 38.32 2b3k s ILE 339 CO -0.01 0.59 -0.27 0.00 -1.23 0.00 0.00 174.94 174.02 2b3k h GLU 341 N 4.07 0.78 0.00 0.00 5.08 -1.45 -1.54 114.58 121.51 2b3k h GLU 341 Ca -0.50 -0.30 0.00 0.00 -1.00 0.00 0.00 59.36 57.56 2b3k h GLU 341 Cb 1.17 -0.05 0.00 0.00 0.50 0.00 0.00 28.75 30.37 2b3k h GLU 341 CO 0.40 0.91 0.00 0.41 -1.00 0.00 0.00 179.01 179.73 2b3k n GLY 342 N -0.30 1.15 3.81 -3.84 0.00 -1.26 -4.75 105.19 100.00 2b3k n GLY 342 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.73 2b3k n GLY 342 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2b3k s GLY 343 N 0.00 1.62 0.05 -0.02 0.00 -1.26 -3.90 107.32 103.81 2b3k s GLY 343 Ca 0.00 -0.27 0.25 0.00 0.00 0.00 0.00 44.72 44.71 2b3k s GLY 343 CO 0.00 0.18 1.48 -2.67 0.00 0.00 0.00 173.10 172.09 2b3k n TRP 344 N -3.47 0.25 -1.73 1.90 4.27 -1.26 -4.83 117.44 112.57 2b3k n TRP 344 Ca 0.07 0.07 -0.42 0.00 -3.89 0.00 0.00 57.50 53.33 2b3k n TRP 344 Cb 0.57 -0.47 -0.02 0.00 -1.36 0.00 0.00 31.31 30.03 2b3k n TRP 344 CO 0.00 0.00 0.00 1.04 -2.29 0.00 0.00 177.69 176.44 2b3k n GLN 345 N -1.76 2.54 -4.37 -2.67 3.00 -1.26 -4.44 117.38 108.42 2b3k n GLN 345 Ca 0.05 0.90 -0.21 0.00 -0.01 0.00 0.00 57.00 57.73 2b3k n GLN 345 Cb 0.38 -2.66 -0.11 0.00 0.00 0.00 0.00 30.24 27.85 2b3k n GLN 345 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.06 177.22 2b3k s ASP 346 N 0.48 2.90 0.13 1.08 -4.77 -1.26 -1.21 116.67 114.02 2b3k s ASP 346 Ca 0.66 -0.95 -0.08 0.00 -3.30 0.00 0.00 52.55 48.87 2b3k s ASP 346 Cb -0.53 -0.19 -0.01 0.00 -1.09 0.00 0.00 42.92 41.10 2b3k s ASP 346 CO 0.48 -0.05 0.22 -1.83 0.70 0.00 0.00 175.17 174.69 2b3k s GLU 347 N -3.24 1.01 -0.07 2.11 -1.05 -0.33 -4.80 118.70 112.33 2b3k s GLU 347 Ca 0.22 -1.11 0.01 0.00 -0.15 0.00 0.00 54.97 53.93 2b3k s GLU 347 Cb -0.04 0.35 -0.03 0.00 -0.44 0.00 0.00 34.13 33.97 2b3k s GLU 347 CO 0.09 -0.34 -0.07 0.99 0.95 0.00 0.00 175.26 176.87 2b3k s THR 348 N -3.93 3.67 0.91 1.83 2.01 -1.26 -0.75 115.64 118.12 2b3k s THR 348 Ca 0.13 -0.49 -0.11 0.00 0.31 0.00 0.00 61.69 61.53 2b3k s THR 348 Cb 0.04 -2.50 0.14 0.00 0.01 0.00 0.00 72.50 70.19 2b3k s THR 348 CO -0.04 0.59 1.09 0.26 -0.69 0.00 0.00 174.62 175.83 2b3k s TRP 349 N -0.74 2.19 0.55 4.92 0.52 0.40 -4.89 118.94 121.89 2b3k s TRP 349 Ca 0.11 1.32 0.40 0.00 0.02 0.00 0.00 56.10 57.96 2b3k s TRP 349 Cb -0.11 -3.16 2.19 0.00 -1.15 0.00 0.00 33.47 31.24 2b3k s TRP 349 CO 0.01 -2.51 2.23 -1.35 0.02 0.00 0.00 176.95 175.36 2b3k h PRO 350 N -1.64 0.00 0.00 4.98 0.11 -2.00 -1.08 132.00 132.37 2b3k h PRO 350 Ca -0.49 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.62 2b3k h PRO 350 Cb 1.28 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.39 2b3k h PRO 350 CO 0.53 0.00 0.00 -0.40 -0.21 0.00 0.00 178.00 177.92 2b3k n ASP 351 N -2.94 0.00 0.00 -2.05 5.68 -1.26 -4.86 116.55 111.11 2b3k n ASP 351 Ca -0.03 0.11 0.00 0.00 -0.50 0.00 0.00 54.79 54.37 2b3k n ASP 351 Cb 0.10 -0.31 0.00 0.00 -1.14 0.00 0.00 41.12 39.76 2b3k n ASP 351 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2b3k n GLY 352 N 0.14 1.49 1.12 6.12 0.00 -0.41 -4.82 105.19 108.84 2b3k n GLY 352 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.09 2b3k n GLY 352 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 2b3k n TRP 353 N -2.00 0.00 -1.62 1.61 7.02 -1.26 -4.96 117.44 116.23 2b3k n TRP 353 Ca 0.00 0.00 -0.43 0.00 -1.02 0.00 0.00 57.50 56.05 2b3k n TRP 353 Cb 0.00 0.10 -0.03 0.00 -2.42 0.00 0.00 31.31 28.96 2b3k n TRP 353 CO 0.00 0.00 0.00 0.99 -2.02 0.00 0.00 177.69 176.66 2b3k s THR 354 N -1.99 3.00 -0.19 -0.99 2.01 -1.24 -4.67 115.64 111.57 2b3k s THR 354 Ca 0.00 0.00 -0.12 0.00 0.31 0.00 0.00 61.69 61.88 2b3k s THR 354 Cb 0.00 -3.00 -0.05 0.00 0.01 0.00 0.00 72.50 69.46 2b3k s THR 354 CO 0.00 -0.00 0.24 0.00 -0.69 0.00 0.00 174.62 174.17 2b3k s ALA 355 N 7.10 3.62 0.13 7.40 0.00 -0.85 -0.45 121.76 138.71 2b3k s ALA 355 Ca 0.97 -0.61 0.05 0.00 0.00 0.00 0.00 51.96 52.37 2b3k s ALA 355 Cb -0.36 -2.35 -0.04 0.00 0.00 0.00 0.00 23.12 20.36 2b3k s ALA 355 CO 0.37 0.01 -0.12 0.14 0.00 0.00 0.00 175.76 176.16 2b3k s VAL 356 N 0.66 1.22 0.32 0.00 -7.23 0.07 0.45 120.40 115.89 2b3k s VAL 356 Ca 0.13 -1.87 -0.29 0.00 -1.81 0.00 0.00 61.98 58.14 2b3k s VAL 356 Cb -0.13 -1.66 -0.10 0.00 0.56 0.00 0.00 36.38 35.05 2b3k s VAL 356 CO 0.03 -0.59 1.29 0.42 -0.31 0.00 0.00 175.10 175.94 2b3k s THR 357 N -2.73 2.78 0.31 5.32 -4.23 -0.79 -1.19 115.64 115.12 2b3k s THR 357 Ca 0.12 0.78 0.20 0.00 -1.18 0.00 0.00 61.69 61.61 2b3k s THR 357 Cb -0.01 -3.50 0.18 0.00 1.34 0.00 0.00 72.50 70.51 2b3k s THR 357 CO 0.02 0.18 1.88 0.03 -0.54 0.00 0.00 174.62 176.19 2b3k h ARG 358 N 3.51 0.00 -0.02 3.99 3.08 -1.47 -2.65 114.38 120.82 2b3k h ARG 358 Ca -0.49 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.56 2b3k h ARG 358 Cb 1.22 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.27 2b3k h ARG 358 CO 0.66 0.28 -0.02 -0.40 -1.07 0.00 0.00 179.97 179.43 2b3k n ASP 359 N -3.75 1.63 0.00 7.04 5.68 -1.26 -4.82 116.55 121.07 2b3k n ASP 359 Ca -0.01 -1.52 0.00 0.00 -0.50 0.00 0.00 54.79 52.76 2b3k n ASP 359 Cb 0.38 0.01 0.00 0.00 -1.14 0.00 0.00 41.12 40.37 2b3k n ASP 359 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2b3k n GLY 360 N 1.20 0.43 3.93 6.12 0.00 -1.00 -4.89 105.19 110.98 2b3k n GLY 360 Ca 0.18 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.94 2b3k n GLY 360 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2b3k s LYS 361 N -0.44 2.17 0.53 1.61 1.02 -1.26 -4.70 119.74 118.68 2b3k s LYS 361 Ca 0.00 -0.23 -0.17 0.00 0.02 0.00 0.00 55.97 55.59 2b3k s LYS 361 Cb 0.00 -2.15 -0.07 0.00 -0.52 0.00 0.00 37.83 35.09 2b3k s LYS 361 CO 0.00 -1.27 1.01 1.03 -0.92 0.00 0.00 175.35 175.19 2b3k s ARG 362 N -5.28 3.78 0.05 1.68 0.52 -1.26 -4.14 118.95 114.29 2b3k s ARG 362 Ca 0.60 1.04 0.03 0.00 -0.52 0.00 0.00 55.73 56.88 2b3k s ARG 362 Cb -0.11 -2.11 -0.02 0.00 0.52 0.00 0.00 34.95 33.23 2b3k s ARG 362 CO 0.45 -0.42 -0.09 0.45 0.02 0.00 0.00 175.30 175.71 2b3k s SER 363 N -2.93 1.06 0.08 0.23 0.15 -0.60 -1.13 113.70 110.56 2b3k s SER 363 Ca 0.61 -0.53 0.03 0.00 0.70 0.00 0.00 55.95 56.75 2b3k s SER 363 Cb -0.12 0.00 -0.04 0.00 -1.71 0.00 0.00 66.02 64.16 2b3k s SER 363 CO 0.32 -0.15 -0.08 0.00 1.20 0.00 0.00 173.24 174.53 2b3k s ALA 364 N -1.26 0.94 0.02 5.45 0.00 -0.14 -4.72 121.76 122.05 2b3k s ALA 364 Ca -0.07 -1.15 -0.14 0.00 0.00 0.00 0.00 51.96 50.59 2b3k s ALA 364 Cb -0.09 0.08 0.02 0.00 0.00 0.00 0.00 23.12 23.13 2b3k s ALA 364 CO 0.01 -0.11 0.31 -1.14 0.00 0.00 0.00 175.76 174.83 2b3k s GLN 365 N -2.90 0.76 0.00 0.00 0.74 -1.26 -1.03 119.66 115.96 2b3k s GLN 365 Ca 0.04 -0.37 -0.04 0.00 0.05 0.00 0.00 55.36 55.04 2b3k s GLN 365 Cb -0.01 0.33 -0.01 0.00 1.10 0.00 0.00 33.01 34.42 2b3k s GLN 365 CO -0.02 -0.23 0.06 -0.06 -0.55 0.00 0.00 175.29 174.50 2b3k s PHE 366 N -2.05 0.10 -0.11 1.67 0.08 -1.22 -3.20 117.98 113.26 2b3k s PHE 366 Ca -0.08 -0.23 -0.11 0.00 0.12 0.00 0.00 56.93 56.63 2b3k s PHE 366 Cb -0.03 -0.09 0.03 0.00 -0.57 0.00 0.00 43.02 42.36 2b3k s PHE 366 CO -0.00 -0.21 0.31 -2.00 -0.10 0.00 0.00 175.22 173.22 2b3k s GLU 367 N -1.16 0.39 0.07 0.44 2.12 -0.66 -3.36 118.70 116.54 2b3k s GLU 367 Ca -0.13 0.37 0.03 0.00 0.36 0.00 0.00 54.97 55.60 2b3k s GLU 367 Cb -0.07 0.19 -0.03 0.00 0.26 0.00 0.00 34.13 34.47 2b3k s GLU 367 CO 0.00 -0.05 -0.08 -1.01 -0.54 0.00 0.00 175.26 173.58 2b3k s HIS 368 N 0.03 0.85 -0.19 5.30 3.76 -1.11 -2.40 115.29 121.53 2b3k s HIS 368 Ca -0.01 -0.65 -0.09 0.00 -0.15 0.00 0.00 55.06 54.15 2b3k s HIS 368 Cb -0.02 -0.49 -0.05 0.00 1.11 0.00 0.00 32.58 33.13 2b3k s HIS 368 CO 0.01 -0.08 0.11 0.99 -0.85 0.00 0.00 174.74 174.92 2b3k s THR 369 N -2.27 5.19 0.06 1.30 2.01 -1.19 -2.69 115.64 118.05 2b3k s THR 369 Ca 0.00 0.11 0.09 0.00 0.31 0.00 0.00 61.69 62.20 2b3k s THR 369 Cb -0.04 -3.36 -0.03 0.00 0.01 0.00 0.00 72.50 69.08 2b3k s THR 369 CO -0.01 0.46 -0.24 -0.76 -0.69 0.00 0.00 174.62 173.38 2b3k s LEU 370 N 0.30 2.34 -0.18 4.42 1.43 0.77 -1.78 118.68 125.98 2b3k s LEU 370 Ca 0.07 -0.57 -0.01 0.00 -1.03 0.00 0.00 54.13 52.59 2b3k s LEU 370 Cb -0.11 -1.35 0.00 0.00 0.03 0.00 0.00 46.19 44.75 2b3k s LEU 370 CO -0.01 0.24 -0.13 -0.22 0.23 0.00 0.00 176.35 176.46 2b3k s LEU 371 N -1.46 2.50 -0.05 1.79 2.96 -0.35 -1.53 118.68 122.54 2b3k s LEU 371 Ca 0.13 -0.49 -0.30 0.00 -0.22 0.00 0.00 54.13 53.25 2b3k s LEU 371 Cb -0.10 -1.59 -0.02 0.00 0.50 0.00 0.00 46.19 44.97 2b3k s LEU 371 CO 0.04 0.03 1.03 -0.69 -1.32 0.00 0.00 176.35 175.44 2b3k s VAL 372 N 1.13 4.72 0.00 1.68 1.01 0.27 0.11 120.40 129.32 2b3k s VAL 372 Ca 0.01 1.97 0.00 0.00 0.00 0.00 0.00 61.98 63.96 2b3k s VAL 372 Cb -0.14 -4.27 0.00 0.00 0.00 0.00 0.00 36.38 31.97 2b3k s VAL 372 CO -0.05 0.06 0.00 0.35 0.00 0.00 0.00 175.10 175.47 2b3k n THR 373 N 4.30 0.00 0.01 3.92 -2.24 -0.20 -0.08 114.28 119.99 2b3k n THR 373 Ca 0.08 0.00 -0.22 0.00 -2.27 0.00 0.00 64.05 61.64 2b3k n THR 373 Cb 0.49 -0.33 -0.14 0.00 -2.10 0.00 0.00 70.33 68.26 2b3k n THR 373 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 2b3k h ASP 374 N 0.00 0.40 0.07 3.42 3.32 -1.96 -3.35 116.42 118.31 2b3k h ASP 374 Ca 0.00 -0.87 -0.10 0.00 0.02 0.00 0.00 57.03 56.09 2b3k h ASP 374 Cb 0.00 -0.13 0.01 0.00 0.22 0.00 0.00 39.33 39.43 2b3k h ASP 374 CO 0.00 1.70 -0.42 0.71 -1.72 0.00 0.00 179.24 179.51 2b3k h THR 375 N -0.19 1.63 0.00 0.35 1.35 -1.98 -3.42 112.91 110.66 2b3k h THR 375 Ca -0.35 -2.39 0.00 0.00 -0.55 0.00 0.00 66.41 63.12 2b3k h THR 375 Cb 1.85 3.23 0.00 0.00 -1.73 0.00 0.00 68.15 71.50 2b3k h THR 375 CO 0.06 0.65 0.00 0.61 -0.25 0.00 0.00 175.52 176.60 2b3k n GLY 376 N 1.57 0.09 3.37 5.82 0.00 -1.26 -4.76 105.19 110.02 2b3k n GLY 376 Ca -0.12 0.45 -0.13 0.00 0.00 0.00 0.00 46.02 46.22 2b3k n GLY 376 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2b3k s GLU 378 N -2.74 3.71 -0.80 0.00 2.12 0.12 -4.88 118.70 116.21 2b3k s GLU 378 Ca -0.04 -0.48 -0.22 0.00 0.36 0.00 0.00 54.97 54.60 2b3k s GLU 378 Cb -0.00 -3.12 0.08 0.00 0.26 0.00 0.00 34.13 31.35 2b3k s GLU 378 CO -0.04 0.07 1.12 0.42 -0.54 0.00 0.00 175.26 176.29 2b3k s ILE 379 N 0.86 4.33 0.50 -3.70 1.01 -1.26 -1.21 121.20 121.72 2b3k s ILE 379 Ca 0.02 -0.72 0.22 0.00 0.00 0.00 0.00 60.65 60.16 2b3k s ILE 379 Cb -0.14 -4.79 0.28 0.00 0.01 0.00 0.00 42.46 37.81 2b3k s ILE 379 CO 0.02 -1.59 2.12 -0.07 0.00 0.00 0.00 174.94 175.43 2b3k h LEU 380 N 11.44 0.00 -3.25 2.97 3.38 -1.72 -2.67 115.31 125.46 2b3k h LEU 380 Ca -0.08 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.89 2b3k h LEU 380 Cb 1.04 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.79 2b3k h LEU 380 CO 1.20 0.07 0.00 0.35 0.09 0.00 0.00 178.44 180.16 2b3k n THR 381 N -4.11 2.09 -1.07 0.22 -2.24 -1.24 -3.96 114.28 103.96 2b3k n THR 381 Ca -0.03 -1.35 -0.30 0.00 -2.27 0.00 0.00 64.05 60.10 2b3k n THR 381 Cb 0.16 -0.01 0.13 0.00 -2.10 0.00 0.00 70.33 68.51 2b3k n THR 381 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2b3k s ARG 382 N -2.17 1.46 0.28 -0.78 1.70 -1.01 -4.79 118.95 113.64 2b3k s ARG 382 Ca 0.49 1.12 -0.28 0.00 -0.47 0.00 0.00 55.73 56.58 2b3k s ARG 382 Cb 0.34 -1.81 -0.09 0.00 -0.57 0.00 0.00 34.95 32.82 2b3k s ARG 382 CO 0.19 -2.19 0.94 1.03 -1.08 0.00 0.00 175.30 174.20 2b3k s ARG 383 N -4.83 4.73 -0.02 3.89 0.52 -1.26 -4.95 118.95 117.03 2b3k s ARG 383 Ca 0.64 1.42 0.17 0.00 -0.52 0.00 0.00 55.73 57.43 2b3k s ARG 383 Cb -0.19 -3.06 -0.24 0.00 0.52 0.00 0.00 34.95 31.98 2b3k s ARG 383 CO 0.57 0.41 0.47 1.28 0.02 0.00 0.00 175.30 178.05 2b3k n LEU 384 N 1.06 0.21 -0.16 2.53 4.77 -1.26 -4.54 117.00 119.61 2b3k n LEU 384 Ca -0.00 -0.14 0.09 0.00 -0.03 0.00 0.00 56.01 55.93 2b3k n LEU 384 Cb 0.48 0.00 0.14 0.00 -2.33 0.00 0.00 43.42 41.71 2b3k n LEU 384 CO 0.47 0.05 0.58 -0.90 -1.33 0.00 0.00 177.39 176.27 2b3k n ASP 385 N -1.90 2.50 -3.64 -1.43 5.75 -1.26 -5.01 116.55 111.56 2b3k n ASP 385 Ca -0.01 -2.97 -0.10 0.00 -0.01 0.00 0.00 54.79 51.70 2b3k n ASP 385 Cb 0.40 -0.40 -0.07 0.00 -1.03 0.00 0.00 41.12 40.02 2b3k n ASP 385 CO 0.00 0.00 0.00 -0.55 -0.11 0.00 0.00 177.20 176.54 2b3k s SER 386 N -2.58 -0.66 0.36 -1.12 0.15 -1.26 -5.06 113.70 103.53 2b3k s SER 386 Ca 0.30 1.20 0.16 0.00 0.70 0.00 0.00 55.95 58.31 2b3k s SER 386 Cb 0.26 1.23 0.67 0.00 -1.71 0.00 0.00 66.02 66.47 2b3k s SER 386 CO 0.04 -0.20 1.76 0.00 1.20 0.00 0.00 173.24 176.03 2b3k h ALA 387 N 5.17 1.12 -2.10 5.45 0.00 -1.95 -3.43 119.26 123.53 2b3k h ALA 387 Ca -0.29 -0.38 -0.49 0.00 0.00 0.00 0.00 54.91 53.76 2b3k h ALA 387 Cb 1.18 -0.07 -0.14 0.00 0.00 0.00 0.00 17.79 18.76 2b3k h ALA 387 CO 0.10 0.52 -0.68 1.03 0.00 0.00 0.00 179.25 180.22 2b3k s ARG 388 N -3.81 1.52 0.93 0.00 0.52 -1.26 -5.05 118.95 111.79 2b3k s ARG 388 Ca -0.01 -1.76 -0.11 0.00 -0.52 0.00 0.00 55.73 53.33 2b3k s ARG 388 Cb 0.12 -1.14 0.15 0.00 0.52 0.00 0.00 34.95 34.60 2b3k s ARG 388 CO 0.71 0.05 1.09 -1.25 0.02 0.00 0.00 175.30 175.92 2b3k s PRO 389 N -3.72 0.97 0.35 3.54 0.04 -1.26 -4.87 135.00 130.05 2b3k s PRO 389 Ca 0.29 1.06 0.04 0.00 0.04 0.00 0.00 61.00 62.43 2b3k s PRO 389 Cb 0.03 -1.76 0.69 0.00 0.04 0.00 0.00 34.50 33.50 2b3k s PRO 389 CO 0.11 -2.50 1.96 0.45 0.04 0.00 0.00 177.00 177.06 2b3k h HIS 390 N -1.75 0.82 0.00 0.56 3.86 -1.96 -2.60 115.15 114.08 2b3k h HIS 390 Ca -0.49 0.02 0.00 0.00 -1.16 0.00 0.00 60.37 58.74 2b3k h HIS 390 Cb 1.28 -0.27 0.00 0.00 1.06 0.00 0.00 27.41 29.48 2b3k h HIS 390 CO 0.44 0.44 0.00 0.27 0.86 0.00 0.00 177.93 179.94 2b3k h PHE 391 N 0.82 0.00 -0.44 2.45 -5.15 -1.92 -1.82 116.94 110.88 2b3k h PHE 391 Ca 0.32 0.00 -0.31 0.00 -0.20 0.00 0.00 57.97 57.77 2b3k h PHE 391 Cb 0.20 0.00 -0.23 0.00 0.22 0.00 0.00 35.95 36.14 2b3k h PHE 391 CO -0.00 0.00 -0.54 0.00 -2.00 0.00 0.00 178.31 175.77 2b3k n MET 392 N -2.96 2.63 0.00 6.09 0.00 -0.98 -4.95 117.12 116.95 2b3k n MET 392 Ca -0.02 -3.70 0.00 0.00 0.00 0.00 0.00 57.70 53.98 2b3k n MET 392 Cb 0.14 -1.99 0.00 0.00 0.00 0.00 0.00 33.22 31.37 2b3k n MET 392 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 175.97 176.40