#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2b4k s ASP 51 N 0.00 6.14 0.32 4.39 3.68 -1.26 -4.90 116.67 125.04 2b4k s ASP 51 Ca 0.00 1.59 0.10 0.00 2.13 0.00 0.00 52.55 56.37 2b4k s ASP 51 Cb 0.00 -2.53 0.54 0.00 -1.45 0.00 0.00 42.92 39.48 2b4k s ASP 51 CO 0.00 -1.46 1.73 1.55 0.13 0.00 0.00 175.17 177.12 2b4k h PRO 52 N 11.83 0.07 0.00 4.34 0.13 -2.05 -0.23 132.00 146.09 2b4k h PRO 52 Ca -0.35 -0.04 0.00 0.00 -0.87 0.00 0.00 66.00 64.74 2b4k h PRO 52 Cb 1.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.30 2b4k h PRO 52 CO 1.00 0.52 0.00 1.28 -0.23 0.00 0.00 178.00 180.57 2b4k n LEU 53 N -4.00 0.00 0.00 1.56 4.77 -1.26 -3.01 117.00 115.06 2b4k n LEU 53 Ca -0.02 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.96 2b4k n LEU 53 Cb 0.49 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.58 2b4k n LEU 53 CO 0.41 0.00 0.00 -1.20 -1.33 0.00 0.00 177.39 175.27 2b4k n SER 54 N -0.55 0.00 -3.87 -1.43 7.64 -1.14 -5.06 113.62 109.20 2b4k n SER 54 Ca 0.02 0.00 -0.26 0.00 1.01 0.00 0.00 58.87 59.65 2b4k n SER 54 Cb 0.01 0.00 -0.17 0.00 -1.01 0.00 0.00 64.21 63.04 2b4k n SER 54 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 2b4k s VAL 55 N 0.00 0.83 -0.20 0.44 1.01 -0.11 -5.08 120.40 117.28 2b4k s VAL 55 Ca 0.00 -0.17 0.01 0.00 0.00 0.00 0.00 61.98 61.82 2b4k s VAL 55 Cb 0.00 -0.89 0.03 0.00 0.00 0.00 0.00 36.38 35.52 2b4k s VAL 55 CO 0.00 0.33 -0.16 -1.58 0.00 0.00 0.00 175.10 173.70 2b4k s GLN 56 N 1.76 2.87 0.00 2.72 2.00 -1.26 -4.23 119.66 123.52 2b4k s GLN 56 Ca 0.04 -0.92 0.11 0.00 -2.00 0.00 0.00 55.36 52.60 2b4k s GLN 56 Cb -0.13 -2.70 0.02 0.00 0.80 0.00 0.00 33.01 31.00 2b4k s GLN 56 CO -0.07 -0.29 0.72 0.25 -0.50 0.00 0.00 175.29 175.40 2b4k n THR 57 N 4.61 0.00 -0.29 -0.34 -2.24 -1.26 -4.96 114.28 109.79 2b4k n THR 57 Ca -0.19 -0.41 0.00 0.00 -2.27 0.00 0.00 64.05 61.18 2b4k n THR 57 Cb 0.48 1.16 0.00 0.00 -2.10 0.00 0.00 70.33 69.87 2b4k n THR 57 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2b4k n GLY 58 N 0.87 1.77 3.23 3.38 0.00 -1.26 -5.11 105.19 108.06 2b4k n GLY 58 Ca 0.05 -1.74 -0.32 0.00 0.00 0.00 0.00 46.02 44.01 2b4k n GLY 58 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2b4k s SER 59 N -1.00 3.05 0.08 1.61 0.15 -1.26 -4.99 113.70 111.33 2b4k s SER 59 Ca 0.00 -0.54 0.11 0.00 0.70 0.00 0.00 55.95 56.22 2b4k s SER 59 Cb 0.00 -1.25 0.49 0.00 -1.71 0.00 0.00 66.02 63.54 2b4k s SER 59 CO 0.00 0.18 1.33 0.47 1.20 0.00 0.00 173.24 176.42 2b4k n ASP 60 N 3.39 0.16 -4.61 5.45 8.00 -1.26 -4.43 116.55 123.25 2b4k n ASP 60 Ca -0.19 0.56 -0.40 0.00 0.71 0.00 0.00 54.79 55.47 2b4k n ASP 60 Cb 0.53 -0.59 -0.07 0.00 -0.02 0.00 0.00 41.12 40.97 2b4k n ASP 60 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 2b4k s ILE 61 N -3.12 5.04 0.43 0.53 1.01 -1.26 -5.03 121.20 118.80 2b4k s ILE 61 Ca 0.02 0.87 -0.25 0.00 0.00 0.00 0.00 60.65 61.29 2b4k s ILE 61 Cb 0.05 -3.86 -0.09 0.00 0.01 0.00 0.00 42.46 38.56 2b4k s ILE 61 CO 0.16 0.04 1.26 -2.65 0.00 0.00 0.00 174.94 173.75 2b4k n PRO 62 N 5.60 1.87 0.23 2.79 -0.02 -1.26 -4.88 135.00 139.33 2b4k n PRO 62 Ca -0.03 0.67 0.06 0.00 -2.02 0.00 0.00 63.50 62.17 2b4k n PRO 62 Cb 0.49 -2.37 0.52 0.00 -0.02 0.00 0.00 33.50 32.12 2b4k n PRO 62 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2b4k h ALA 63 N 1.99 1.60 -2.88 3.55 0.00 -1.96 -3.44 119.26 118.12 2b4k h ALA 63 Ca -0.48 -0.18 -0.45 0.00 0.00 0.00 0.00 54.91 53.81 2b4k h ALA 63 Cb 1.30 -0.03 -0.13 0.00 0.00 0.00 0.00 17.79 18.93 2b4k h ALA 63 CO 0.59 0.24 -0.50 -1.54 0.00 0.00 0.00 179.25 178.05 2b4k s SER 64 N -6.86 1.52 -0.16 0.00 1.04 -1.26 -5.18 113.70 102.80 2b4k s SER 64 Ca -0.04 -1.72 -0.07 0.00 0.48 0.00 0.00 55.95 54.61 2b4k s SER 64 Cb 0.15 0.54 0.07 0.00 0.10 0.00 0.00 66.02 66.88 2b4k s SER 64 CO 0.68 -1.05 0.35 0.68 0.98 0.00 0.00 173.24 174.88 2b4k s VAL 65 N -3.50 -0.31 -0.53 5.02 -7.23 -1.26 -5.11 120.40 107.47 2b4k s VAL 65 Ca 0.40 0.17 0.04 0.00 -1.81 0.00 0.00 61.98 60.78 2b4k s VAL 65 Cb 0.03 -0.54 0.15 0.00 0.56 0.00 0.00 36.38 36.57 2b4k s VAL 65 CO 0.26 0.07 0.33 -1.00 -0.31 0.00 0.00 175.10 174.45 2b4k s HIS 66 N 2.00 2.63 -0.03 2.82 3.76 -1.26 -5.10 115.29 120.10 2b4k s HIS 66 Ca -0.04 -2.86 -0.30 0.00 -0.15 0.00 0.00 55.06 51.70 2b4k s HIS 66 Cb -0.11 -2.24 -0.03 0.00 1.11 0.00 0.00 32.58 31.31 2b4k s HIS 66 CO -0.11 -0.71 1.17 -1.64 -0.85 0.00 0.00 174.74 172.60 2b4k s MET 67 N -0.37 4.39 0.22 1.40 -1.94 -1.26 -4.92 119.30 116.82 2b4k s MET 67 Ca 0.21 1.65 0.22 0.00 -1.71 0.00 0.00 55.69 56.06 2b4k s MET 67 Cb -0.16 -3.51 0.93 0.00 2.01 0.00 0.00 34.83 34.10 2b4k s MET 67 CO -0.07 -0.37 1.66 -2.30 -0.01 0.00 0.00 175.02 173.93 2b4k n PRO 68 N 4.86 0.16 0.11 2.03 -0.02 -1.26 -2.89 135.00 137.99 2b4k n PRO 68 Ca 0.10 0.42 0.08 0.00 -2.02 0.00 0.00 63.50 62.08 2b4k n PRO 68 Cb 0.47 -1.82 0.55 0.00 -0.02 0.00 0.00 33.50 32.68 2b4k n PRO 68 CO 0.00 0.00 0.00 1.79 1.98 0.00 0.00 175.50 179.27 2b4k h THR 69 N 0.00 1.00 -0.64 3.45 1.35 -2.00 -1.35 112.91 114.73 2b4k h THR 69 Ca 0.00 -0.08 0.17 0.00 -0.55 0.00 0.00 66.41 65.95 2b4k h THR 69 Cb 0.31 0.74 -0.03 0.00 -1.73 0.00 0.00 68.15 67.45 2b4k h THR 69 CO 0.00 0.04 0.45 0.44 -0.25 0.00 0.00 175.52 176.21 2b4k h ASP 70 N 0.24 0.07 0.85 5.36 5.19 -1.94 0.52 116.42 126.70 2b4k h ASP 70 Ca 0.10 0.00 -0.24 0.00 -0.62 0.00 0.00 57.03 56.28 2b4k h ASP 70 Cb 0.12 -0.01 -0.03 0.00 0.18 0.00 0.00 39.33 39.59 2b4k h ASP 70 CO -0.02 0.03 -1.17 1.56 -3.12 0.00 0.00 179.24 176.52 2b4k h GLN 71 N 0.07 0.04 0.00 3.56 1.08 -1.49 -3.28 115.11 115.09 2b4k h GLN 71 Ca 0.31 -0.07 0.00 0.00 -1.45 0.00 0.00 58.65 57.44 2b4k h GLN 71 Cb 1.12 0.03 0.00 0.00 -0.05 0.00 0.00 27.48 28.58 2b4k h GLN 71 CO -0.02 0.94 0.00 0.37 -0.95 0.00 0.00 178.83 179.17 2b4k h GLN 72 N 0.01 0.00 -7.37 1.46 4.15 -0.87 -3.45 115.11 109.04 2b4k h GLN 72 Ca -0.08 0.00 -0.44 0.00 0.77 0.00 0.00 58.65 58.90 2b4k h GLN 72 Cb 1.84 0.00 0.17 0.00 0.21 0.00 0.00 27.48 29.70 2b4k h GLN 72 CO 0.13 0.00 0.17 1.03 -1.93 0.00 0.00 178.83 178.23 2b4k s ARG 73 N -3.32 -0.10 -0.18 1.69 0.52 -0.96 -4.94 118.95 111.66 2b4k s ARG 73 Ca 0.05 0.33 0.13 0.00 -0.52 0.00 0.00 55.73 55.73 2b4k s ARG 73 Cb 0.10 -1.69 0.38 0.00 0.52 0.00 0.00 34.95 34.26 2b4k s ARG 73 CO 0.45 -3.05 1.20 -0.40 0.02 0.00 0.00 175.30 173.52 2b4k n ASP 74 N -4.36 1.86 -3.27 0.23 3.85 -1.15 -5.01 116.55 108.69 2b4k n ASP 74 Ca 0.07 -3.63 -0.09 0.00 -0.71 0.00 0.00 54.79 50.43 2b4k n ASP 74 Cb 0.58 -0.50 0.00 0.00 -1.35 0.00 0.00 41.12 39.86 2b4k n ASP 74 CO 0.00 0.00 0.00 -0.72 -1.01 0.00 0.00 177.20 175.47 2b4k s TYR 75 N -3.05 0.12 -0.02 2.11 1.13 -1.26 -1.22 117.35 115.15 2b4k s TYR 75 Ca 0.36 -0.68 0.04 0.00 -1.41 0.00 0.00 57.07 55.37 2b4k s TYR 75 Cb 0.34 0.70 -0.00 0.00 -1.10 0.00 0.00 41.96 41.90 2b4k s TYR 75 CO -0.04 -1.42 -0.13 0.42 -2.51 0.00 0.00 175.55 171.87 2b4k s ILE 76 N -2.91 1.05 -0.32 -3.49 1.01 0.14 -4.72 121.20 111.96 2b4k s ILE 76 Ca 0.16 -0.54 -0.05 0.00 0.00 0.00 0.00 60.65 60.22 2b4k s ILE 76 Cb -0.05 -0.90 0.03 0.00 0.01 0.00 0.00 42.46 41.56 2b4k s ILE 76 CO 0.11 0.31 0.07 -0.75 0.00 0.00 0.00 174.94 174.68 2b4k s LYS 77 N -0.08 2.71 -0.22 2.79 2.20 -1.26 -0.74 119.74 125.13 2b4k s LYS 77 Ca 0.01 -1.11 -0.10 0.00 -0.36 0.00 0.00 55.97 54.41 2b4k s LYS 77 Cb -0.08 -3.37 -0.05 0.00 -1.51 0.00 0.00 37.83 32.83 2b4k s LYS 77 CO 0.00 -0.59 0.13 0.50 -0.36 0.00 0.00 175.35 175.03 2b4k s ARG 78 N 1.40 4.04 -0.25 4.03 3.52 0.22 -4.93 118.95 126.97 2b4k s ARG 78 Ca -0.01 -0.29 -0.05 0.00 -0.13 0.00 0.00 55.73 55.25 2b4k s ARG 78 Cb -0.19 -3.44 0.00 0.00 -1.56 0.00 0.00 34.95 29.77 2b4k s ARG 78 CO 0.02 0.13 0.01 -1.21 -0.81 0.00 0.00 175.30 173.43 2b4k s GLU 79 N 0.84 3.20 0.08 5.12 2.02 -1.26 0.59 118.70 129.28 2b4k s GLU 79 Ca 0.07 -0.76 0.04 0.00 0.02 0.00 0.00 54.97 54.33 2b4k s GLU 79 Cb -0.13 -3.16 -0.03 0.00 0.10 0.00 0.00 34.13 30.91 2b4k s GLU 79 CO 0.02 -0.32 -0.11 0.14 0.02 0.00 0.00 175.26 175.01 2b4k s VAL 80 N 1.47 0.92 -1.02 2.63 -7.23 -0.39 -4.98 120.40 111.80 2b4k s VAL 80 Ca 0.04 -1.41 -0.05 0.00 -1.81 0.00 0.00 61.98 58.75 2b4k s VAL 80 Cb -0.16 -1.10 0.27 0.00 0.56 0.00 0.00 36.38 35.95 2b4k s VAL 80 CO -0.01 -0.40 1.12 0.23 -0.31 0.00 0.00 175.10 175.73 2b4k n MET 81 N 1.00 3.53 -1.69 4.82 2.81 -1.26 0.03 117.12 126.36 2b4k n MET 81 Ca -0.19 -4.51 -0.43 0.00 -1.81 0.00 0.00 57.70 50.76 2b4k n MET 81 Cb 0.56 -2.49 -0.03 0.00 -0.71 0.00 0.00 33.22 30.55 2b4k n MET 81 CO 0.00 0.00 0.00 0.28 1.51 0.00 0.00 175.97 177.76 2b4k n VAL 82 N 2.07 0.39 -3.08 2.03 0.31 -0.57 -4.42 118.33 115.07 2b4k n VAL 82 Ca 0.24 -0.07 -0.39 0.00 -0.01 0.00 0.00 64.34 64.11 2b4k n VAL 82 Cb 0.37 -2.11 -0.06 0.00 -0.91 0.00 0.00 33.84 31.12 2b4k n VAL 82 CO 0.00 0.00 0.00 -2.16 -1.32 0.00 0.00 176.83 173.35 2b4k s PRO 83 N 2.86 4.45 0.42 5.55 0.04 -1.26 0.77 135.00 147.82 2b4k s PRO 83 Ca 0.83 1.02 0.00 0.00 0.04 0.00 0.00 61.00 62.89 2b4k s PRO 83 Cb -0.49 -3.25 -0.01 0.00 0.04 0.00 0.00 34.50 30.79 2b4k s PRO 83 CO 0.38 0.59 0.64 -1.64 0.04 0.00 0.00 177.00 177.02 2b4k s MET 84 N -1.16 3.20 0.46 4.56 -1.94 0.67 -4.87 119.30 120.23 2b4k s MET 84 Ca 0.34 -0.41 0.27 0.00 -1.71 0.00 0.00 55.69 54.17 2b4k s MET 84 Cb -0.22 -2.58 1.32 0.00 2.01 0.00 0.00 34.83 35.36 2b4k s MET 84 CO 0.24 -0.15 1.77 0.07 -0.01 0.00 0.00 175.02 176.93 2b4k h ARG 85 N 0.48 0.20 -0.31 2.03 0.11 -1.91 0.50 114.38 115.48 2b4k h ARG 85 Ca -0.47 -0.01 0.00 0.00 0.10 0.00 0.00 59.98 59.60 2b4k h ARG 85 Cb 1.24 -0.05 0.00 0.00 1.11 0.00 0.00 29.97 32.28 2b4k h ARG 85 CO 0.59 0.13 0.00 -0.40 0.10 0.00 0.00 179.97 180.39 2b4k n ASP 86 N -4.46 1.31 -0.00 0.08 5.75 -1.26 -4.88 116.55 113.09 2b4k n ASP 86 Ca 0.27 -2.04 -0.00 0.00 -0.01 0.00 0.00 54.79 53.01 2b4k n ASP 86 Cb 1.09 -0.20 -0.00 0.00 -1.03 0.00 0.00 41.12 40.98 2b4k n ASP 86 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2b4k n GLY 87 N 0.75 0.48 3.66 6.12 0.00 0.17 -5.02 105.19 111.34 2b4k n GLY 87 Ca 0.07 -0.16 -0.38 0.00 0.00 0.00 0.00 46.02 45.56 2b4k n GLY 87 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2b4k s VAL 88 N -1.99 5.25 0.17 1.61 1.01 -1.25 -4.78 120.40 120.42 2b4k s VAL 88 Ca 0.00 0.51 -0.20 0.00 0.00 0.00 0.00 61.98 62.29 2b4k s VAL 88 Cb 0.00 -3.65 -0.08 0.00 0.00 0.00 0.00 36.38 32.66 2b4k s VAL 88 CO 0.00 0.27 0.67 -0.54 0.00 0.00 0.00 175.10 175.50 2b4k s LYS 89 N 1.36 4.25 -0.10 2.72 1.02 -1.26 -0.24 119.74 127.49 2b4k s LYS 89 Ca 0.15 0.83 0.03 0.00 0.02 0.00 0.00 55.97 57.00 2b4k s LYS 89 Cb -0.15 -3.03 -0.01 0.00 -0.52 0.00 0.00 37.83 34.13 2b4k s LYS 89 CO 0.07 0.49 -0.21 -0.51 -0.92 0.00 0.00 175.35 174.27 2b4k s LEU 90 N -1.64 2.24 0.07 3.17 1.43 0.23 -1.94 118.68 122.25 2b4k s LEU 90 Ca 0.38 -0.49 -0.31 0.00 -1.03 0.00 0.00 54.13 52.68 2b4k s LEU 90 Cb -0.18 -1.45 -0.09 0.00 0.03 0.00 0.00 46.19 44.49 2b4k s LEU 90 CO 0.21 0.18 1.80 -0.47 0.23 0.00 0.00 176.35 178.30 2b4k s TYR 91 N 0.26 2.00 -0.09 0.29 5.04 -1.26 -1.51 117.35 122.08 2b4k s TYR 91 Ca -0.15 -0.02 0.01 0.00 -2.44 0.00 0.00 57.07 54.47 2b4k s TYR 91 Cb -0.17 -4.12 0.02 0.00 0.35 0.00 0.00 41.96 38.04 2b4k s TYR 91 CO 0.07 -4.69 -0.09 0.99 -1.34 0.00 0.00 175.55 170.49 2b4k s THR 92 N 3.22 1.05 -0.26 4.34 2.01 0.10 -0.97 115.64 125.13 2b4k s THR 92 Ca 0.80 -0.36 -0.10 0.00 0.31 0.00 0.00 61.69 62.34 2b4k s THR 92 Cb -0.43 -1.01 -0.04 0.00 0.01 0.00 0.00 72.50 71.03 2b4k s THR 92 CO 0.36 0.35 0.14 -0.69 -0.69 0.00 0.00 174.62 174.09 2b4k s VAL 93 N 1.19 4.98 -0.25 3.82 1.01 -0.48 -1.26 120.40 129.42 2b4k s VAL 93 Ca -0.05 0.06 -0.03 0.00 0.00 0.00 0.00 61.98 61.96 2b4k s VAL 93 Cb -0.14 -3.35 0.01 0.00 0.00 0.00 0.00 36.38 32.90 2b4k s VAL 93 CO -0.02 0.30 -0.03 -0.63 0.00 0.00 0.00 175.10 174.72 2b4k s ILE 94 N 1.54 3.23 -0.33 2.22 1.01 0.20 -1.82 121.20 127.25 2b4k s ILE 94 Ca 0.07 -0.80 -0.09 0.00 0.00 0.00 0.00 60.65 59.83 2b4k s ILE 94 Cb -0.15 -2.59 0.01 0.00 0.01 0.00 0.00 42.46 39.74 2b4k s ILE 94 CO 0.07 0.25 0.14 -0.69 0.00 0.00 0.00 174.94 174.71 2b4k s VAL 95 N 1.41 4.34 -0.15 2.92 1.01 0.10 0.70 120.40 130.73 2b4k s VAL 95 Ca 0.02 -0.70 0.01 0.00 0.00 0.00 0.00 61.98 61.31 2b4k s VAL 95 Cb -0.16 -3.31 0.00 0.00 0.00 0.00 0.00 36.38 32.91 2b4k s VAL 95 CO -0.03 -0.05 -0.17 -0.63 0.00 0.00 0.00 175.10 174.23 2b4k s ILE 96 N 1.54 2.51 0.42 2.22 1.01 0.08 -1.26 121.20 127.74 2b4k s ILE 96 Ca 0.03 -0.82 -0.25 0.00 0.00 0.00 0.00 60.65 59.61 2b4k s ILE 96 Cb -0.18 -2.05 -0.10 0.00 0.01 0.00 0.00 42.46 40.14 2b4k s ILE 96 CO 0.05 0.52 1.21 -2.65 0.00 0.00 0.00 174.94 174.07 2b4k n PRO 97 N 4.11 1.78 -1.67 2.79 -0.02 -1.26 0.27 135.00 141.00 2b4k n PRO 97 Ca -0.19 0.63 -0.43 0.00 -2.02 0.00 0.00 63.50 61.49 2b4k n PRO 97 Cb 0.52 -2.30 -0.01 0.00 -0.02 0.00 0.00 33.50 31.68 2b4k n PRO 97 CO 0.00 0.00 0.00 1.17 1.98 0.00 0.00 175.50 178.65 2b4k n LYS 98 N 0.04 1.97 -3.85 -0.52 3.00 -0.36 -2.88 118.16 115.57 2b4k n LYS 98 Ca 0.07 0.69 -0.31 0.00 -0.00 0.00 0.00 58.31 58.77 2b4k n LYS 98 Cb 0.39 -2.26 0.01 0.00 0.00 0.00 0.00 35.03 33.17 2b4k n LYS 98 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.40 177.67 2b4k n ASN 99 N 1.21 -4.25 -4.09 3.14 6.94 -1.26 -4.96 115.26 111.99 2b4k n ASN 99 Ca 0.07 -1.03 -0.32 0.00 -0.02 0.00 0.00 54.58 53.28 2b4k n ASN 99 Cb 0.34 -1.48 -0.16 0.00 -2.36 0.00 0.00 39.78 36.11 2b4k n ASN 99 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2b4k s ALA 100 N -3.17 2.11 0.13 -2.53 0.00 -1.14 -5.12 121.76 112.04 2b4k s ALA 100 Ca 0.16 -1.05 0.09 0.00 0.00 0.00 0.00 51.96 51.16 2b4k s ALA 100 Cb -0.09 -1.07 -0.04 0.00 0.00 0.00 0.00 23.12 21.92 2b4k s ALA 100 CO 0.87 -0.27 -0.22 1.03 0.00 0.00 0.00 175.76 177.17 2b4k s ARG 101 N 1.23 1.23 -1.49 0.00 1.81 -1.26 -4.63 118.95 115.84 2b4k s ARG 101 Ca 0.01 -1.28 -0.12 0.00 -1.72 0.00 0.00 55.73 52.62 2b4k s ARG 101 Cb -0.14 -1.49 0.07 0.00 -0.45 0.00 0.00 34.95 32.94 2b4k s ARG 101 CO -0.09 0.34 1.01 0.09 -0.68 0.00 0.00 175.30 175.96 2b4k n ASN 102 N 0.81 -4.88 -4.87 0.23 4.13 -0.31 -4.94 115.26 105.43 2b4k n ASN 102 Ca -0.17 -0.74 -0.37 0.00 1.68 0.00 0.00 54.58 54.98 2b4k n ASN 102 Cb 0.54 -4.10 -0.06 0.00 -1.54 0.00 0.00 39.78 34.62 2b4k n ASN 102 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2b4k s ALA 103 N -3.33 3.82 0.71 5.41 0.00 -0.71 -4.31 121.76 123.36 2b4k s ALA 103 Ca 0.61 -0.51 -0.11 0.00 0.00 0.00 0.00 51.96 51.95 2b4k s ALA 103 Cb -0.30 -2.11 0.02 0.00 0.00 0.00 0.00 23.12 20.73 2b4k s ALA 103 CO 0.81 0.59 1.07 -1.25 0.00 0.00 0.00 175.76 176.99 2b4k s PRO 104 N -1.26 2.73 -0.13 0.00 0.04 -1.26 -0.83 135.00 134.29 2b4k s PRO 104 Ca 0.21 1.06 -0.02 0.00 0.04 0.00 0.00 61.00 62.30 2b4k s PRO 104 Cb -0.14 -1.96 -0.03 0.00 0.04 0.00 0.00 34.50 32.42 2b4k s PRO 104 CO 0.10 -1.27 -0.06 0.42 0.04 0.00 0.00 177.00 176.23 2b4k s ILE 105 N -2.92 3.69 -0.42 0.56 1.01 -0.29 -0.43 121.20 122.39 2b4k s ILE 105 Ca 0.60 -0.45 -0.09 0.00 0.00 0.00 0.00 60.65 60.71 2b4k s ILE 105 Cb -0.15 -2.57 0.08 0.00 0.01 0.00 0.00 42.46 39.82 2b4k s ILE 105 CO 0.53 0.53 0.27 -0.22 0.00 0.00 0.00 174.94 176.05 2b4k s LEU 106 N 0.04 5.20 -0.13 2.97 2.96 0.94 0.78 118.68 131.43 2b4k s LEU 106 Ca -0.01 -1.54 -0.06 0.00 -0.22 0.00 0.00 54.13 52.30 2b4k s LEU 106 Cb -0.14 -1.99 -0.04 0.00 0.50 0.00 0.00 46.19 44.53 2b4k s LEU 106 CO 0.03 -0.55 0.07 -0.22 -1.32 0.00 0.00 176.35 174.36 2b4k s LEU 107 N 1.42 3.96 -0.06 -0.68 2.96 0.12 -0.82 118.68 125.57 2b4k s LEU 107 Ca 0.03 0.24 -0.00 0.00 -0.22 0.00 0.00 54.13 54.18 2b4k s LEU 107 Cb -0.23 -1.96 0.02 0.00 0.50 0.00 0.00 46.19 44.52 2b4k s LEU 107 CO 0.02 0.32 -0.02 -0.89 -1.32 0.00 0.00 176.35 174.45 2b4k s THR 108 N -0.49 0.50 -0.26 3.68 2.01 0.31 -2.38 115.64 119.01 2b4k s THR 108 Ca 0.10 -0.02 -0.09 0.00 0.31 0.00 0.00 61.69 61.99 2b4k s THR 108 Cb -0.12 -0.58 -0.04 0.00 0.01 0.00 0.00 72.50 71.77 2b4k s THR 108 CO 0.02 0.25 0.14 -0.13 -0.69 0.00 0.00 174.62 174.21 2b4k s ARG 109 N 1.48 3.86 0.03 4.92 0.52 -1.26 -0.25 118.95 128.25 2b4k s ARG 109 Ca -0.02 -0.37 0.03 0.00 -0.52 0.00 0.00 55.73 54.85 2b4k s ARG 109 Cb -0.13 -3.50 -0.02 0.00 0.52 0.00 0.00 34.95 31.82 2b4k s ARG 109 CO -0.03 -0.13 -0.09 -0.08 0.02 0.00 0.00 175.30 174.98 2b4k s THR 110 N 1.56 0.70 -0.38 0.02 -1.32 0.63 -4.54 115.64 112.30 2b4k s THR 110 Ca 0.07 -0.84 0.07 0.00 -1.21 0.00 0.00 61.69 59.77 2b4k s THR 110 Cb -0.15 -0.68 0.56 0.00 -1.51 0.00 0.00 72.50 70.72 2b4k s THR 110 CO 0.07 -0.13 1.57 -0.81 -2.21 0.00 0.00 174.62 173.12 2b4k n PRO 111 N 1.98 2.94 -2.65 7.08 -0.04 -1.26 -1.77 135.00 141.28 2b4k n PRO 111 Ca -0.19 -2.33 -0.21 0.00 -0.04 0.00 0.00 63.50 60.73 2b4k n PRO 111 Cb 0.56 -1.99 0.00 0.00 -0.04 0.00 0.00 33.50 32.03 2b4k n PRO 111 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2b4k n TYR 112 N -0.14 2.56 -2.82 0.54 4.01 -1.26 -4.95 117.16 115.09 2b4k n TYR 112 Ca 0.33 -3.18 -0.03 0.00 -0.16 0.00 0.00 57.90 54.86 2b4k n TYR 112 Cb 1.18 -0.25 0.00 0.00 -0.31 0.00 0.00 39.34 39.97 2b4k n TYR 112 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 2b4k n ASN 113 N -0.27 -7.80 -0.05 7.72 5.15 -1.26 -4.48 115.26 114.27 2b4k n ASN 113 Ca 0.28 1.08 0.09 0.00 -0.60 0.00 0.00 54.58 55.43 2b4k n ASN 113 Cb 0.67 -4.86 0.47 0.00 -0.53 0.00 0.00 39.78 35.53 2b4k n ASN 113 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2b4k h ALA 114 N 2.85 1.89 -0.42 5.20 0.00 -1.86 0.71 119.26 127.63 2b4k h ALA 114 Ca -0.02 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.87 2b4k h ALA 114 Cb 0.37 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.03 2b4k h ALA 114 CO 0.12 0.02 0.27 -0.22 0.00 0.00 0.00 179.25 179.44 2b4k h LYS 115 N 0.47 0.55 0.00 0.00 3.64 -1.89 -1.70 116.57 117.65 2b4k h LYS 115 Ca 0.23 -0.04 -0.18 0.00 -1.27 0.00 0.00 60.65 59.39 2b4k h LYS 115 Cb 0.31 -0.12 -0.02 0.00 -0.41 0.00 0.00 32.23 31.98 2b4k h LYS 115 CO -0.06 0.38 -0.85 0.78 -2.27 0.00 0.00 179.45 177.42 2b4k h GLY 116 N 0.56 0.04 1.00 5.01 0.00 -1.66 -3.27 103.07 104.76 2b4k h GLY 116 Ca 0.15 -0.08 -0.02 0.00 0.00 0.00 0.00 47.33 47.38 2b4k h GLY 116 CO -0.03 0.07 0.32 3.21 0.00 0.00 0.00 176.54 180.11 2b4k h ARG 117 N 0.02 0.96 -1.57 4.80 2.47 -0.52 -2.35 114.38 118.19 2b4k h ARG 117 Ca -0.02 -0.14 -0.57 0.00 -1.26 0.00 0.00 59.98 58.00 2b4k h ARG 117 Cb 1.49 -0.17 -0.22 0.00 -1.65 0.00 0.00 29.97 29.42 2b4k h ARG 117 CO 0.11 0.76 0.70 0.00 0.56 0.00 0.00 179.97 182.10 2b4k n ALA 118 N -2.36 6.10 -2.71 0.04 0.00 -0.67 -4.20 120.51 116.71 2b4k n ALA 118 Ca 0.05 -3.06 -0.01 0.00 0.00 0.00 0.00 53.44 50.42 2b4k n ALA 118 Cb 0.13 -1.80 0.10 0.00 0.00 0.00 0.00 19.45 17.87 2b4k n ALA 118 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2b4k n ASN 119 N -0.12 -0.50 -0.37 0.00 3.02 -0.80 -4.72 115.26 111.76 2b4k n ASN 119 Ca 0.50 -2.15 -0.02 0.00 -0.03 0.00 0.00 54.58 52.88 2b4k n ASN 119 Cb 0.52 0.31 0.03 0.00 -0.61 0.00 0.00 39.78 40.04 2b4k n ASN 119 CO 0.00 0.00 0.00 -0.09 -2.62 0.00 0.00 177.26 174.55 2b4k h ARG 120 N 1.49 -0.01 -4.51 3.52 2.43 -0.20 -2.62 114.38 114.47 2b4k h ARG 120 Ca -0.35 0.00 -0.69 0.00 -0.81 0.00 0.00 59.98 58.13 2b4k h ARG 120 Cb 1.30 0.00 -0.36 0.00 -0.42 0.00 0.00 29.97 30.49 2b4k h ARG 120 CO -0.07 -0.01 -0.58 0.08 -1.51 0.00 0.00 179.97 177.88 2b4k s VAL 121 N -5.93 3.11 -0.42 0.20 1.01 -1.11 -5.02 120.40 112.23 2b4k s VAL 121 Ca -0.14 -2.12 -0.45 0.00 0.00 0.00 0.00 61.98 59.28 2b4k s VAL 121 Cb 0.20 -3.15 -0.18 0.00 0.00 0.00 0.00 36.38 33.24 2b4k s VAL 121 CO 0.71 -0.68 1.67 -0.81 0.00 0.00 0.00 175.10 175.99 2b4k n PRO 122 N 4.52 0.41 -3.99 2.72 -0.04 -0.99 -1.31 135.00 136.32 2b4k n PRO 122 Ca -0.01 0.15 -0.27 0.00 -0.04 0.00 0.00 63.50 63.33 2b4k n PRO 122 Cb 0.41 -1.72 -0.02 0.00 -0.04 0.00 0.00 33.50 32.13 2b4k n PRO 122 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 2b4k n ASN 123 N 4.60 -0.77 -4.79 3.54 4.13 -1.26 -4.94 115.26 115.76 2b4k n ASN 123 Ca 0.30 -1.01 -0.32 0.00 1.68 0.00 0.00 54.58 55.23 2b4k n ASN 123 Cb 0.01 -3.01 0.04 0.00 -1.54 0.00 0.00 39.78 35.28 2b4k n ASN 123 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2b4k s ALA 124 N -3.87 2.58 -1.74 5.41 0.00 -0.42 -4.92 121.76 118.80 2b4k s ALA 124 Ca 0.11 0.32 0.25 0.00 0.00 0.00 0.00 51.96 52.64 2b4k s ALA 124 Cb -0.06 -3.24 1.38 0.00 0.00 0.00 0.00 23.12 21.20 2b4k s ALA 124 CO 0.89 -1.19 1.84 1.28 0.00 0.00 0.00 175.76 178.58 2b4k n LEU 125 N -2.67 0.00 -4.30 0.00 4.77 -1.26 -4.77 117.00 108.77 2b4k n LEU 125 Ca 0.09 0.13 -0.19 0.00 -0.03 0.00 0.00 56.01 56.00 2b4k n LEU 125 Cb 0.53 -0.13 -0.11 0.00 -2.33 0.00 0.00 43.42 41.38 2b4k n LEU 125 CO 0.51 -0.03 -0.46 0.42 -1.33 0.00 0.00 177.39 176.50 2b4k s THR 126 N -2.26 1.61 0.04 -5.08 -4.23 -1.26 -2.94 115.64 101.51 2b4k s THR 126 Ca 0.31 -1.92 -0.17 0.00 -1.18 0.00 0.00 61.69 58.73 2b4k s THR 126 Cb 0.17 -1.78 -0.22 0.00 1.34 0.00 0.00 72.50 72.01 2b4k s THR 126 CO 0.33 -0.43 1.17 -0.03 -0.54 0.00 0.00 174.62 175.12 2b4k h MET 127 N 3.17 0.54 -0.73 3.99 4.05 -1.86 -2.55 114.93 121.54 2b4k h MET 127 Ca -0.40 -0.53 0.12 0.00 -0.28 0.00 0.00 59.70 58.61 2b4k h MET 127 Cb 1.20 0.14 -0.05 0.00 -0.80 0.00 0.00 31.60 32.10 2b4k h MET 127 CO 0.54 1.16 0.49 -0.09 0.23 0.00 0.00 176.91 179.23 2b4k h ARG 128 N 0.12 0.49 -0.03 0.39 9.65 -1.95 -1.31 114.38 121.74 2b4k h ARG 128 Ca -0.08 -0.03 -0.20 0.00 -1.10 0.00 0.00 59.98 58.58 2b4k h ARG 128 Cb 1.38 -0.11 0.01 0.00 -1.39 0.00 0.00 29.97 29.86 2b4k h ARG 128 CO 0.14 0.33 -0.75 0.93 2.80 0.00 0.00 179.97 183.42 2b4k h GLU 129 N 0.51 0.56 -0.05 0.20 5.08 -1.94 -3.34 114.58 115.60 2b4k h GLU 129 Ca 0.35 -0.56 -0.15 0.00 -1.00 0.00 0.00 59.36 58.00 2b4k h GLU 129 Cb 0.67 0.15 -0.01 0.00 0.50 0.00 0.00 28.75 30.05 2b4k h GLU 129 CO -0.12 1.18 -0.63 -0.24 -1.00 0.00 0.00 179.01 178.21 2b4k h VAL 130 N 0.15 1.41 -3.22 3.13 3.04 -0.92 -2.94 116.25 116.90 2b4k h VAL 130 Ca -0.08 -2.07 -0.55 0.00 -1.01 0.00 0.00 66.70 62.99 2b4k h VAL 130 Cb 1.42 2.08 -0.03 0.00 -2.01 0.00 0.00 31.29 32.75 2b4k h VAL 130 CO 0.15 0.60 -0.22 -0.76 -1.01 0.00 0.00 177.57 176.34 2b4k s LEU 131 N -7.80 4.18 0.88 3.16 1.43 -0.57 0.38 118.68 120.35 2b4k s LEU 131 Ca -0.03 0.69 -0.13 0.00 -1.03 0.00 0.00 54.13 53.62 2b4k s LEU 131 Cb 0.12 -3.45 0.03 0.00 0.03 0.00 0.00 46.19 42.92 2b4k s LEU 131 CO 0.79 -0.05 0.55 -2.65 0.23 0.00 0.00 176.35 175.22 2b4k n PRO 132 N -0.31 -0.11 -0.24 1.29 -0.02 -1.26 -4.75 135.00 129.59 2b4k n PRO 132 Ca -0.02 0.02 0.03 0.00 -2.02 0.00 0.00 63.50 61.51 2b4k n PRO 132 Cb 0.53 -1.94 0.15 0.00 -0.02 0.00 0.00 33.50 32.23 2b4k n PRO 132 CO 0.00 0.00 0.00 0.37 1.98 0.00 0.00 175.50 177.85 2b4k h GLN 133 N -1.24 0.49 -0.68 -0.52 4.15 -1.90 -1.95 115.11 113.46 2b4k h GLN 133 Ca -0.44 -0.03 0.00 0.00 0.77 0.00 0.00 58.65 58.95 2b4k h GLN 133 Cb 1.30 -0.11 0.00 0.00 0.21 0.00 0.00 27.48 28.88 2b4k h GLN 133 CO 0.38 0.32 0.00 0.41 -1.93 0.00 0.00 178.83 178.01 2b4k n GLY 134 N -1.31 0.99 0.03 2.39 0.00 -0.92 -1.83 105.19 104.53 2b4k n GLY 134 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.14 2b4k n GLY 134 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2b4k n ASP 135 N 0.13 1.18 -0.20 1.61 8.00 -0.73 -4.78 116.55 121.76 2b4k n ASP 135 Ca 0.00 -1.15 0.00 0.00 0.71 0.00 0.00 54.79 54.35 2b4k n ASP 135 Cb 0.17 -0.00 0.09 0.00 -0.02 0.00 0.00 41.12 41.36 2b4k n ASP 135 CO 0.00 0.00 0.00 -2.24 -0.39 0.00 0.00 177.20 174.57 2b4k h ASP 136 N 0.14 -0.27 0.35 -2.24 2.03 -1.50 0.20 116.42 115.13 2b4k h ASP 136 Ca 0.00 0.15 -0.05 0.00 -0.73 0.00 0.00 57.03 56.39 2b4k h ASP 136 Cb 0.09 0.26 -0.01 0.00 -0.83 0.00 0.00 39.33 38.84 2b4k h ASP 136 CO 0.00 -0.11 -0.25 -0.37 -1.03 0.00 0.00 179.24 177.48 2b4k h VAL 137 N 0.12 1.03 0.00 4.15 -1.51 -1.86 0.71 116.25 118.88 2b4k h VAL 137 Ca 0.31 -0.92 -0.06 0.00 -1.23 0.00 0.00 66.70 64.80 2b4k h VAL 137 Cb 0.50 1.52 -0.01 0.00 -2.13 0.00 0.00 31.29 31.16 2b4k h VAL 137 CO -0.51 0.25 -0.66 -0.26 -1.23 0.00 0.00 177.57 175.15 2b4k h PHE 138 N 0.00 0.00 0.10 5.19 0.04 -1.32 -2.19 116.94 118.77 2b4k h PHE 138 Ca -0.00 0.00 -0.23 0.00 2.80 0.00 0.00 57.97 60.54 2b4k h PHE 138 Cb 0.50 0.00 0.02 0.00 2.20 0.00 0.00 35.95 38.67 2b4k h PHE 138 CO 0.00 0.26 -0.96 0.28 -0.60 0.00 0.00 178.31 177.29 2b4k h VAL 139 N 0.00 1.39 0.00 -0.55 2.07 -0.18 -1.65 116.25 117.33 2b4k h VAL 139 Ca -0.03 -2.40 -0.00 0.00 0.82 0.00 0.00 66.70 65.09 2b4k h VAL 139 Cb 1.23 2.85 -0.00 0.00 -1.52 0.00 0.00 31.29 33.85 2b4k h VAL 139 CO 0.03 0.71 -0.02 -0.33 0.02 0.00 0.00 177.57 177.98 2b4k h GLU 140 N -0.03 0.00 -0.51 1.57 5.08 -0.87 -2.41 114.58 117.41 2b4k h GLU 140 Ca -0.15 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.21 2b4k h GLU 140 Cb 1.69 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.94 2b4k h GLU 140 CO 0.18 0.02 0.00 0.41 -1.00 0.00 0.00 179.01 178.62 2b4k n GLY 141 N -1.07 2.05 2.25 -3.84 0.00 -0.83 -4.97 105.19 98.78 2b4k n GLY 141 Ca -0.03 -0.73 -0.12 0.00 0.00 0.00 0.00 46.02 45.14 2b4k n GLY 141 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2b4k n GLY 142 N 1.47 0.11 3.82 -0.02 0.00 -0.91 -5.01 105.19 104.66 2b4k n GLY 142 Ca 0.21 -0.39 -0.32 0.00 0.00 0.00 0.00 46.02 45.52 2b4k n GLY 142 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2b4k s TYR 143 N -2.58 3.16 -0.24 1.61 1.51 -0.63 -4.66 117.35 115.52 2b4k s TYR 143 Ca 0.00 1.46 -0.15 0.00 -1.01 0.00 0.00 57.07 57.37 2b4k s TYR 143 Cb 0.00 -2.91 -0.04 0.00 -0.11 0.00 0.00 41.96 38.90 2b4k s TYR 143 CO 0.00 -0.97 0.38 0.42 -1.11 0.00 0.00 175.55 174.27 2b4k s ILE 144 N -2.71 5.19 -0.18 2.71 1.01 0.43 -4.58 121.20 123.07 2b4k s ILE 144 Ca 0.60 0.63 -0.14 0.00 0.00 0.00 0.00 60.65 61.74 2b4k s ILE 144 Cb -0.14 -3.71 -0.04 0.00 0.01 0.00 0.00 42.46 38.58 2b4k s ILE 144 CO 0.42 0.21 0.31 -0.60 0.00 0.00 0.00 174.94 175.29 2b4k s ARG 145 N 1.67 4.22 -0.09 2.79 6.06 -0.39 -0.04 118.95 133.17 2b4k s ARG 145 Ca 0.17 0.10 0.02 0.00 -2.50 0.00 0.00 55.73 53.52 2b4k s ARG 145 Cb -0.15 -3.47 0.01 0.00 0.06 0.00 0.00 34.95 31.41 2b4k s ARG 145 CO 0.09 0.15 -0.15 0.08 -2.50 0.00 0.00 175.30 172.96 2b4k s VAL 146 N 0.75 1.41 -0.16 7.11 1.01 0.00 0.03 120.40 130.55 2b4k s VAL 146 Ca 0.17 -0.62 0.01 0.00 0.00 0.00 0.00 61.98 61.53 2b4k s VAL 146 Cb -0.14 -1.28 0.02 0.00 0.00 0.00 0.00 36.38 34.99 2b4k s VAL 146 CO 0.05 0.42 -0.16 -0.36 0.00 0.00 0.00 175.10 175.05 2b4k s PHE 147 N 0.74 2.39 -0.09 5.22 0.40 -0.76 -0.53 117.98 125.36 2b4k s PHE 147 Ca -0.12 -1.39 0.02 0.00 -0.60 0.00 0.00 56.93 54.83 2b4k s PHE 147 Cb -0.16 -1.70 -0.02 0.00 0.51 0.00 0.00 43.02 41.65 2b4k s PHE 147 CO 0.03 -0.72 -0.13 -1.14 0.70 0.00 0.00 175.22 173.95 2b4k s GLN 148 N 1.42 2.90 -0.19 0.44 0.74 0.65 -1.38 119.66 124.23 2b4k s GLN 148 Ca 0.04 -0.69 -0.29 0.00 0.05 0.00 0.00 55.36 54.48 2b4k s GLN 148 Cb -0.13 -2.50 -0.00 0.00 1.10 0.00 0.00 33.01 31.48 2b4k s GLN 148 CO -0.11 0.45 1.15 -0.51 -0.55 0.00 0.00 175.29 175.71 2b4k s ASP 149 N -0.26 7.03 0.73 6.67 1.01 -0.15 -0.27 116.67 131.43 2b4k s ASP 149 Ca 0.02 1.54 -0.14 0.00 0.71 0.00 0.00 52.55 54.68 2b4k s ASP 149 Cb -0.13 -2.54 0.04 0.00 1.01 0.00 0.00 42.92 41.30 2b4k s ASP 149 CO 0.03 -0.70 1.14 0.27 0.21 0.00 0.00 175.17 176.11 2b4k s ILE 150 N 3.28 2.85 -0.04 0.77 -4.36 -0.73 -4.18 121.20 118.79 2b4k s ILE 150 Ca 0.49 0.37 -0.39 0.00 -0.26 0.00 0.00 60.65 60.86 2b4k s ILE 150 Cb -0.18 -2.84 -0.18 0.00 1.25 0.00 0.00 42.46 40.50 2b4k s ILE 150 CO 0.11 -0.27 1.29 -1.14 0.24 0.00 0.00 174.94 175.17 2b4k n ARG 151 N -2.88 0.56 -0.95 0.37 0.63 -1.26 -1.35 116.66 111.78 2b4k n ARG 151 Ca 0.11 0.20 0.00 0.00 -0.92 0.00 0.00 57.85 57.25 2b4k n ARG 151 Cb 0.52 -1.78 0.00 0.00 0.45 0.00 0.00 32.46 31.65 2b4k n ARG 151 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2b4k n GLY 152 N 2.40 0.91 3.36 5.14 0.00 0.41 -4.30 105.19 113.12 2b4k n GLY 152 Ca 0.21 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.92 2b4k n GLY 152 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2b4k s LYS 153 N -0.05 2.05 1.32 1.61 -0.14 -0.45 -4.13 119.74 119.94 2b4k s LYS 153 Ca 0.00 -0.97 0.00 0.00 -1.36 0.00 0.00 55.97 53.64 2b4k s LYS 153 Cb 0.00 -2.08 0.00 0.00 -1.68 0.00 0.00 37.83 34.07 2b4k s LYS 153 CO 0.00 0.55 0.00 0.66 -0.76 0.00 0.00 175.35 175.80 2b4k n TYR 154 N 2.06 0.00 0.20 3.18 4.02 0.22 -1.29 117.16 125.55 2b4k n TYR 154 Ca -0.16 0.00 0.08 0.00 -0.01 0.00 0.00 57.90 57.80 2b4k n TYR 154 Cb 0.52 0.00 0.31 0.00 -0.02 0.00 0.00 39.34 40.15 2b4k n TYR 154 CO 0.00 0.00 0.00 0.78 -1.01 0.00 0.00 176.86 176.63 2b4k h GLY 155 N 0.00 0.00 -0.68 2.72 0.00 -1.93 -3.43 103.07 99.75 2b4k h GLY 155 Ca 0.00 0.00 -0.47 0.00 0.00 0.00 0.00 47.33 46.86 2b4k h GLY 155 CO 0.00 0.00 0.37 -0.56 0.00 0.00 0.00 176.54 176.35 2b4k s SER 156 N -6.29 4.21 0.42 0.19 0.01 -0.41 -4.32 113.70 107.51 2b4k s SER 156 Ca 0.02 0.86 0.04 0.00 1.31 0.00 0.00 55.95 58.18 2b4k s SER 156 Cb 0.09 -1.40 0.04 0.00 0.21 0.00 0.00 66.02 64.97 2b4k s SER 156 CO 0.67 -2.10 0.34 0.00 0.41 0.00 0.00 173.24 172.57 2b4k n GLN 157 N -3.46 0.86 0.00 12.44 6.02 -0.82 -4.39 117.38 128.03 2b4k n GLN 157 Ca 0.07 -2.59 0.00 0.00 -0.01 0.00 0.00 57.00 54.47 2b4k n GLN 157 Cb 0.60 0.23 0.00 0.00 1.02 0.00 0.00 30.24 32.10 2b4k n GLN 157 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2b4k n GLY 158 N -0.07 -3.05 3.75 1.08 0.00 -1.26 -0.45 105.19 105.18 2b4k n GLY 158 Ca -0.00 -1.89 -0.35 0.00 0.00 0.00 0.00 46.02 43.78 2b4k n GLY 158 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2b4k s ASP 159 N -1.80 6.24 -0.04 1.61 1.01 -1.26 -3.91 116.67 118.51 2b4k s ASP 159 Ca 0.00 0.26 -0.24 0.00 0.71 0.00 0.00 52.55 53.28 2b4k s ASP 159 Cb 0.00 -2.09 -0.04 0.00 1.01 0.00 0.00 42.92 41.80 2b4k s ASP 159 CO 0.00 0.20 0.73 -0.47 0.21 0.00 0.00 175.17 175.84 2b4k s TYR 160 N 0.22 3.61 -0.18 4.23 6.04 -1.26 -4.33 117.35 125.68 2b4k s TYR 160 Ca 0.09 1.32 -0.00 0.00 0.04 0.00 0.00 57.07 58.52 2b4k s TYR 160 Cb -0.11 -2.83 0.05 0.00 -1.04 0.00 0.00 41.96 38.03 2b4k s TYR 160 CO -0.01 0.12 -0.05 0.08 -1.54 0.00 0.00 175.55 174.14 2b4k s VAL 161 N 0.65 1.21 -0.31 3.14 1.01 -1.26 -5.06 120.40 119.78 2b4k s VAL 161 Ca 0.39 -0.78 -0.42 0.00 0.00 0.00 0.00 61.98 61.17 2b4k s VAL 161 Cb -0.18 -1.41 -0.17 0.00 0.00 0.00 0.00 36.38 34.61 2b4k s VAL 161 CO 0.20 0.07 1.68 0.80 0.00 0.00 0.00 175.10 177.85 2b4k n MET 162 N 4.83 0.85 -4.13 2.72 1.56 -1.26 -0.55 117.12 121.13 2b4k n MET 162 Ca -0.12 0.31 -0.35 0.00 -0.27 0.00 0.00 57.70 57.27 2b4k n MET 162 Cb 0.47 -1.94 -0.04 0.00 2.15 0.00 0.00 33.22 33.86 2b4k n MET 162 CO 0.00 0.00 0.00 0.25 -0.73 0.00 0.00 175.97 175.49 2b4k n THR 163 N 4.31 -2.26 -1.50 1.12 -2.24 -1.26 -4.68 114.28 107.77 2b4k n THR 163 Ca 0.27 -0.57 -0.63 0.00 -2.27 0.00 0.00 64.05 60.86 2b4k n THR 163 Cb 0.08 -1.94 -0.10 0.00 -2.10 0.00 0.00 70.33 66.27 2b4k n THR 163 CO 0.00 0.00 0.00 -1.14 -0.57 0.00 0.00 175.07 173.36 2b4k n ARG 164 N -4.68 0.00 -1.73 -0.78 0.63 0.28 -4.85 116.66 105.54 2b4k n ARG 164 Ca -0.24 0.00 -0.36 0.00 -0.92 0.00 0.00 57.85 56.33 2b4k n ARG 164 Cb 0.65 -1.45 0.07 0.00 0.45 0.00 0.00 32.46 32.17 2b4k n ARG 164 CO 0.00 0.00 0.00 -2.14 -2.51 0.00 0.00 177.63 172.98 2b4k s PRO 165 N 4.07 2.55 1.14 -0.14 0.02 -1.26 -4.61 135.00 136.77 2b4k s PRO 165 Ca 1.07 1.91 -0.14 0.00 0.02 0.00 0.00 61.00 63.87 2b4k s PRO 165 Cb -1.45 -1.86 0.23 0.00 0.02 0.00 0.00 34.50 31.43 2b4k s PRO 165 CO 0.73 -1.56 0.78 -0.35 -0.33 0.00 0.00 177.00 176.28 2b4k n PRO 166 N -2.04 -2.04 -1.69 5.54 -0.04 -1.26 -4.70 135.00 128.77 2b4k n PRO 166 Ca 0.15 -0.56 -0.43 0.00 -0.04 0.00 0.00 63.50 62.61 2b4k n PRO 166 Cb 0.49 -2.07 -0.03 0.00 -0.04 0.00 0.00 33.50 31.85 2b4k n PRO 166 CO 0.00 0.00 0.00 1.58 -0.04 0.00 0.00 175.50 177.04 2b4k n HIS 167 N -4.76 2.59 -2.31 0.54 -0.00 -1.26 -4.09 115.22 105.94 2b4k n HIS 167 Ca 0.03 -0.12 0.00 0.00 -0.00 0.00 0.00 57.72 57.64 2b4k n HIS 167 Cb 0.56 -2.72 0.00 0.00 -0.00 0.00 0.00 29.99 27.83 2b4k n HIS 167 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 2b4k n GLY 168 N 4.19 -0.51 0.26 1.57 0.00 0.04 -4.90 105.19 105.84 2b4k n GLY 168 Ca 0.18 -0.93 0.13 0.00 0.00 0.00 0.00 46.02 45.40 2b4k n GLY 168 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2b4k h PRO 169 N 0.00 0.00 -0.01 1.61 0.11 -1.97 0.15 132.00 131.89 2b4k h PRO 169 Ca 0.00 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 2b4k h PRO 169 Cb 0.00 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.11 2b4k h PRO 169 CO 0.00 0.00 -0.06 1.28 -0.21 0.00 0.00 178.00 179.01 2b4k n LEU 170 N -2.56 1.68 -3.26 2.35 4.77 -1.26 -4.84 117.00 113.89 2b4k n LEU 170 Ca -0.02 -0.93 -0.05 0.00 -0.03 0.00 0.00 56.01 54.98 2b4k n LEU 170 Cb 0.29 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.34 2b4k n LEU 170 CO 0.11 0.33 0.00 0.21 -1.33 0.00 0.00 177.39 176.71 2b4k s ASN 171 N -1.00 -0.59 0.00 -1.43 2.47 0.53 -4.76 114.94 110.17 2b4k s ASN 171 Ca 0.11 -0.94 0.23 0.00 0.42 0.00 0.00 52.86 52.68 2b4k s ASN 171 Cb 0.08 1.48 1.08 0.00 -1.45 0.00 0.00 41.25 42.45 2b4k s ASN 171 CO 0.16 -0.22 1.73 -0.81 -3.72 0.00 0.00 177.10 174.25 2b4k n PRO 172 N 4.49 1.39 -1.65 0.43 -0.04 -1.18 -0.78 135.00 137.66 2b4k n PRO 172 Ca 0.10 -0.58 -0.29 0.00 -0.04 0.00 0.00 63.50 62.69 2b4k n PRO 172 Cb 0.53 -1.39 0.13 0.00 -0.04 0.00 0.00 33.50 32.72 2b4k n PRO 172 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 2b4k s THR 173 N -1.92 1.98 -0.83 0.52 -4.23 -1.26 -4.96 115.64 104.94 2b4k s THR 173 Ca 0.34 0.00 0.27 0.00 -1.18 0.00 0.00 61.69 61.12 2b4k s THR 173 Cb 0.17 -2.83 0.25 0.00 1.34 0.00 0.00 72.50 71.44 2b4k s THR 173 CO 0.28 0.00 1.80 0.29 -0.54 0.00 0.00 174.62 176.45 2b4k n LYS 174 N -3.68 0.16 -4.40 3.99 5.02 -1.26 -4.87 118.16 113.12 2b4k n LYS 174 Ca 0.08 0.13 -0.26 0.00 -2.02 0.00 0.00 58.31 56.24 2b4k n LYS 174 Cb 0.60 -1.68 -0.10 0.00 -0.02 0.00 0.00 35.03 33.82 2b4k n LYS 174 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 2b4k s THR 175 N -3.06 2.64 0.03 -0.18 -4.23 -1.26 -4.96 115.64 104.62 2b4k s THR 175 Ca 0.12 -2.07 -0.01 0.00 -1.18 0.00 0.00 61.69 58.54 2b4k s THR 175 Cb 0.15 -2.32 0.01 0.00 1.34 0.00 0.00 72.50 71.67 2b4k s THR 175 CO 0.58 -0.23 0.08 -0.90 -0.54 0.00 0.00 174.62 173.61 2b4k n ASP 176 N -0.15 -0.21 0.28 3.99 5.68 -1.26 -4.85 116.55 120.03 2b4k n ASP 176 Ca -0.09 -1.14 0.18 0.00 -0.50 0.00 0.00 54.79 53.23 2b4k n ASP 176 Cb 0.57 0.35 0.72 0.00 -1.14 0.00 0.00 41.12 41.62 2b4k n ASP 176 CO 0.00 0.00 0.00 -0.33 -1.33 0.00 0.00 177.20 175.54 2b4k h GLU 177 N 0.00 0.00 0.15 0.11 4.39 -1.86 -2.07 114.58 115.30 2b4k h GLU 177 Ca -0.03 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.66 2b4k h GLU 177 Cb 0.12 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.77 2b4k h GLU 177 CO 0.04 0.00 -0.07 1.15 -1.16 0.00 0.00 179.01 178.97 2b4k h THR 178 N 0.00 0.83 -0.60 1.13 2.02 -1.92 -2.66 112.91 111.70 2b4k h THR 178 Ca 0.00 -1.18 0.01 0.00 0.77 0.00 0.00 66.41 66.01 2b4k h THR 178 Cb 0.48 1.41 -0.03 0.00 -1.74 0.00 0.00 68.15 68.27 2b4k h THR 178 CO 0.00 0.22 0.39 0.71 0.37 0.00 0.00 175.52 177.22 2b4k h THR 179 N -0.89 1.16 -0.54 3.16 1.35 -1.87 0.67 112.91 115.95 2b4k h THR 179 Ca -0.02 -0.29 0.04 0.00 -0.55 0.00 0.00 66.41 65.59 2b4k h THR 179 Cb 0.52 0.28 -0.04 0.00 -1.73 0.00 0.00 68.15 67.17 2b4k h THR 179 CO 0.03 0.15 0.29 0.44 -0.25 0.00 0.00 175.52 176.19 2b4k h ASP 180 N 0.81 0.45 -0.52 5.36 5.19 -1.48 0.45 116.42 126.68 2b4k h ASP 180 Ca 0.22 0.02 -0.10 0.00 -0.62 0.00 0.00 57.03 56.55 2b4k h ASP 180 Cb -0.09 -0.07 -0.02 0.00 0.18 0.00 0.00 39.33 39.33 2b4k h ASP 180 CO -0.05 0.31 -0.06 0.00 -3.12 0.00 0.00 179.24 176.32 2b4k h ALA 181 N 1.27 0.71 0.07 3.45 0.00 -1.16 0.11 119.26 123.72 2b4k h ALA 181 Ca 0.23 -0.32 0.02 0.00 0.00 0.00 0.00 54.91 54.83 2b4k h ALA 181 Cb 0.10 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.68 2b4k h ALA 181 CO -0.14 0.58 -0.17 2.35 0.00 0.00 0.00 179.25 181.87 2b4k h TRP 182 N 0.83 -0.44 -0.49 0.00 7.01 0.06 -0.05 115.95 122.87 2b4k h TRP 182 Ca 0.14 0.01 -0.00 0.00 2.11 0.00 0.00 58.89 61.15 2b4k h TRP 182 Cb 0.61 0.19 -0.02 0.00 -2.10 0.00 0.00 29.16 27.83 2b4k h TRP 182 CO 0.04 -0.25 0.30 -0.44 -2.79 0.00 0.00 178.44 175.31 2b4k h ASP 183 N -0.32 0.58 -0.01 2.65 3.32 0.02 -1.81 116.42 120.85 2b4k h ASP 183 Ca 0.03 -0.05 0.03 0.00 0.02 0.00 0.00 57.03 57.06 2b4k h ASP 183 Cb 0.35 -0.15 -0.03 0.00 0.22 0.00 0.00 39.33 39.72 2b4k h ASP 183 CO -0.11 0.46 -0.16 0.74 -1.72 0.00 0.00 179.24 178.45 2b4k h THR 184 N 0.66 0.61 -0.31 0.35 2.02 -0.42 -1.37 112.91 114.45 2b4k h THR 184 Ca 0.18 0.00 0.03 0.00 0.77 0.00 0.00 66.41 67.39 2b4k h THR 184 Cb -0.03 0.61 -0.03 0.00 -1.74 0.00 0.00 68.15 66.96 2b4k h THR 184 CO -0.03 0.00 0.10 0.58 0.37 0.00 0.00 175.52 176.54 2b4k h VAL 185 N -0.26 0.91 -0.17 3.16 2.07 -0.86 0.79 116.25 121.89 2b4k h VAL 185 Ca 0.05 -0.08 0.05 0.00 0.82 0.00 0.00 66.70 67.54 2b4k h VAL 185 Cb 0.33 0.65 -0.06 0.00 -1.52 0.00 0.00 31.29 30.69 2b4k h VAL 185 CO -0.16 0.04 -0.29 -0.78 0.02 0.00 0.00 177.57 176.41 2b4k h ASP 186 N 0.24 -0.90 -0.49 0.57 1.82 -1.00 -0.86 116.42 115.80 2b4k h ASP 186 Ca 0.14 0.14 0.04 0.00 -0.39 0.00 0.00 57.03 56.96 2b4k h ASP 186 Cb 0.11 0.40 -0.04 0.00 0.68 0.00 0.00 39.33 40.48 2b4k h ASP 186 CO -0.14 -0.33 0.26 -0.25 -1.61 0.00 0.00 179.24 177.17 2b4k h TRP 187 N -0.34 0.47 -0.86 0.28 7.01 -0.88 -2.40 115.95 119.23 2b4k h TRP 187 Ca 0.11 0.02 0.09 0.00 2.11 0.00 0.00 58.89 61.22 2b4k h TRP 187 Cb 0.51 -0.14 -0.07 0.00 -2.10 0.00 0.00 29.16 27.35 2b4k h TRP 187 CO -0.40 0.24 0.51 -0.07 -2.79 0.00 0.00 178.44 175.94 2b4k h LEU 188 N 0.51 0.75 0.00 0.65 3.38 0.11 0.10 115.31 120.81 2b4k h LEU 188 Ca 0.21 0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.22 2b4k h LEU 188 Cb 0.10 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 40.74 2b4k h LEU 188 CO -0.13 0.43 -0.03 1.33 0.09 0.00 0.00 178.44 180.13 2b4k n VAL 189 N -4.70 0.14 0.57 1.22 0.24 -0.42 -2.62 118.33 112.76 2b4k n VAL 189 Ca 0.14 -0.07 0.07 0.00 -2.04 0.00 0.00 64.34 62.44 2b4k n VAL 189 Cb 0.27 -0.49 0.03 0.00 -1.47 0.00 0.00 33.84 32.18 2b4k n VAL 189 CO 0.00 0.00 0.00 1.41 -2.14 0.00 0.00 176.83 176.10 2b4k n HIS 190 N -1.68 0.00 -1.58 6.34 8.25 -0.39 -4.58 115.22 121.57 2b4k n HIS 190 Ca 0.07 0.00 0.01 0.00 -0.26 0.00 0.00 57.72 57.54 2b4k n HIS 190 Cb 0.36 0.00 0.01 0.00 1.12 0.00 0.00 29.99 31.49 2b4k n HIS 190 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 2b4k n ASN 191 N 0.28 0.31 -3.68 0.41 3.02 0.22 -4.93 115.26 110.89 2b4k n ASN 191 Ca 0.07 -1.86 -0.28 0.00 -0.03 0.00 0.00 54.58 52.47 2b4k n ASN 191 Cb 0.30 -0.17 -0.12 0.00 -0.61 0.00 0.00 39.78 39.19 2b4k n ASN 191 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2b4k s VAL 192 N -0.32 1.64 0.51 2.41 1.01 -1.08 -4.96 120.40 119.62 2b4k s VAL 192 Ca 0.03 -3.30 0.32 0.00 0.00 0.00 0.00 61.98 59.03 2b4k s VAL 192 Cb 0.03 -2.11 0.35 0.00 0.00 0.00 0.00 36.38 34.66 2b4k s VAL 192 CO 0.00 -1.06 2.20 1.55 0.00 0.00 0.00 175.10 177.79 2b4k h PRO 193 N 5.79 0.00 0.00 2.72 0.13 -1.91 -0.28 132.00 138.45 2b4k h PRO 193 Ca 0.15 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.28 2b4k h PRO 193 Cb 0.85 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.98 2b4k h PRO 193 CO 0.54 0.04 0.00 0.93 -0.23 0.00 0.00 178.00 179.29 2b4k h GLU 194 N 0.00 0.00 -6.89 0.86 3.07 -1.93 -3.41 114.58 106.28 2b4k h GLU 194 Ca -0.00 0.00 -0.47 0.00 -0.50 0.00 0.00 59.36 58.39 2b4k h GLU 194 Cb 0.16 0.00 0.04 0.00 -0.84 0.00 0.00 28.75 28.11 2b4k h GLU 194 CO 0.01 0.00 0.04 -1.54 -1.40 0.00 0.00 179.01 176.12 2b4k s SER 195 N -4.80 5.88 -0.06 1.42 1.04 -0.12 -1.17 113.70 115.89 2b4k s SER 195 Ca 0.05 0.60 0.14 0.00 0.48 0.00 0.00 55.95 57.22 2b4k s SER 195 Cb 0.10 -1.80 0.51 0.00 0.10 0.00 0.00 66.02 64.93 2b4k s SER 195 CO 0.50 -0.78 1.39 -0.46 0.98 0.00 0.00 173.24 174.87 2b4k n ASN 196 N -2.29 3.42 -0.01 7.02 6.94 -0.01 -4.20 115.26 126.14 2b4k n ASN 196 Ca 0.02 -2.25 -0.00 0.00 -0.02 0.00 0.00 54.58 52.32 2b4k n ASN 196 Cb 0.57 -0.46 -0.00 0.00 -2.36 0.00 0.00 39.78 37.53 2b4k n ASN 196 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 2b4k n GLY 197 N 1.00 0.33 3.52 4.83 0.00 -1.26 -4.99 105.19 108.61 2b4k n GLY 197 Ca 0.18 -0.01 -0.34 0.00 0.00 0.00 0.00 46.02 45.86 2b4k n GLY 197 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2b4k s ARG 198 N -0.74 3.43 -0.02 1.61 0.52 -1.26 -4.84 118.95 117.65 2b4k s ARG 198 Ca 0.00 -0.53 0.06 0.00 -0.52 0.00 0.00 55.73 54.74 2b4k s ARG 198 Cb 0.00 -2.82 -0.02 0.00 0.52 0.00 0.00 34.95 32.62 2b4k s ARG 198 CO 0.00 0.35 -0.21 0.08 0.02 0.00 0.00 175.30 175.54 2b4k s VAL 199 N 0.05 2.51 -0.04 3.52 1.01 -0.80 -1.14 120.40 125.51 2b4k s VAL 199 Ca -0.01 -0.99 0.05 0.00 0.00 0.00 0.00 61.98 61.03 2b4k s VAL 199 Cb -0.14 -1.94 -0.00 0.00 0.00 0.00 0.00 36.38 34.30 2b4k s VAL 199 CO 0.03 0.54 -0.18 -0.83 0.00 0.00 0.00 175.10 174.66 2b4k s GLY 200 N -0.79 0.97 -0.03 4.51 0.00 0.23 -1.61 107.32 110.61 2b4k s GLY 200 Ca 0.11 -0.75 0.03 0.00 0.00 0.00 0.00 44.72 44.12 2b4k s GLY 200 CO 0.00 -0.41 -0.11 1.06 0.00 0.00 0.00 173.10 173.64 2b4k s MET 201 N -0.02 2.50 0.35 2.90 -1.94 -0.58 0.11 119.30 122.61 2b4k s MET 201 Ca -0.03 -0.72 -0.14 0.00 -1.71 0.00 0.00 55.69 53.10 2b4k s MET 201 Cb -0.11 -2.42 0.03 0.00 2.01 0.00 0.00 34.83 34.34 2b4k s MET 201 CO 0.02 0.61 0.69 -0.08 -0.01 0.00 0.00 175.02 176.25 2b4k s THR 202 N -0.84 0.00 0.00 2.05 -1.32 -1.00 -0.48 115.64 114.04 2b4k s THR 202 Ca 0.14 -1.15 0.00 0.00 -1.21 0.00 0.00 61.69 59.46 2b4k s THR 202 Cb -0.11 -2.61 0.00 0.00 -1.51 0.00 0.00 72.50 68.27 2b4k s THR 202 CO 0.03 0.00 0.00 0.61 -2.21 0.00 0.00 174.62 173.05 2b4k n GLY 203 N -0.51 4.02 3.47 6.08 0.00 -1.25 -4.37 105.19 112.63 2b4k n GLY 203 Ca -0.05 -1.05 -0.30 0.00 0.00 0.00 0.00 46.02 44.61 2b4k n GLY 203 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2b4k s SER 204 N 0.00 3.87 1.59 1.61 0.15 -1.25 -0.93 113.70 118.75 2b4k s SER 204 Ca 0.00 -0.45 0.00 0.00 0.70 0.00 0.00 55.95 56.20 2b4k s SER 204 Cb 0.00 -0.62 0.00 0.00 -1.71 0.00 0.00 66.02 63.69 2b4k s SER 204 CO 0.00 0.23 0.00 -1.20 1.20 0.00 0.00 173.24 173.47 2b4k n SER 205 N 1.32 0.00 -0.04 5.45 7.64 -0.26 -1.84 113.62 125.89 2b4k n SER 205 Ca -0.16 0.00 0.04 0.00 1.01 0.00 0.00 58.87 59.76 2b4k n SER 205 Cb 0.52 0.00 0.40 0.00 -1.01 0.00 0.00 64.21 64.13 2b4k n SER 205 CO 0.00 0.00 0.00 0.22 -3.01 0.00 0.00 175.04 172.25 2b4k h TYR 206 N 0.00 0.58 0.00 1.43 -0.00 -1.91 0.12 116.97 117.18 2b4k h TYR 206 Ca 0.00 0.01 0.00 0.00 -0.00 0.00 0.00 58.73 58.74 2b4k h TYR 206 Cb 0.00 -0.20 0.00 0.00 -0.00 0.00 0.00 36.73 36.53 2b4k h TYR 206 CO 0.00 0.36 0.00 0.93 -0.00 0.00 0.00 178.16 179.45 2b4k h GLU 207 N 0.62 0.00 0.04 1.82 5.08 -1.60 -1.34 114.58 119.20 2b4k h GLU 207 Ca 0.18 0.00 -0.31 0.00 -1.00 0.00 0.00 59.36 58.23 2b4k h GLU 207 Cb -0.02 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.19 2b4k h GLU 207 CO -0.04 0.00 -1.78 0.78 -1.00 0.00 0.00 179.01 176.97 2b4k h GLY 208 N 1.43 0.10 0.73 -3.84 0.00 -0.72 -3.34 103.07 97.43 2b4k h GLY 208 Ca 0.00 -0.26 0.05 0.00 0.00 0.00 0.00 47.33 47.12 2b4k h GLY 208 CO 0.00 0.23 0.34 -2.75 0.00 0.00 0.00 176.54 174.36 2b4k h PHE 209 N 0.02 0.63 0.00 5.60 3.57 -0.12 -1.00 116.94 125.64 2b4k h PHE 209 Ca -0.32 0.02 -0.03 0.00 3.53 0.00 0.00 57.97 61.17 2b4k h PHE 209 Cb 2.02 -0.19 -0.00 0.00 2.79 0.00 0.00 35.95 40.56 2b4k h PHE 209 CO 0.03 0.32 -0.13 1.79 -2.23 0.00 0.00 178.31 178.09 2b4k h THR 210 N 0.65 1.01 -0.13 4.41 1.35 -1.59 -0.85 112.91 117.77 2b4k h THR 210 Ca 0.27 -0.45 -0.22 0.00 -0.55 0.00 0.00 66.41 65.46 2b4k h THR 210 Cb 0.14 1.25 0.01 0.00 -1.73 0.00 0.00 68.15 67.81 2b4k h THR 210 CO -0.16 0.12 -0.79 0.58 -0.25 0.00 0.00 175.52 175.03 2b4k h VAL 211 N 0.00 1.29 -0.42 6.82 2.07 -1.35 -1.97 116.25 122.68 2b4k h VAL 211 Ca -0.00 -2.00 -0.01 0.00 0.82 0.00 0.00 66.70 65.51 2b4k h VAL 211 Cb 0.24 2.06 -0.02 0.00 -1.52 0.00 0.00 31.29 32.05 2b4k h VAL 211 CO 0.02 0.63 0.21 0.58 0.02 0.00 0.00 177.57 179.03 2b4k h VAL 212 N 0.47 1.17 -0.64 2.57 2.07 -0.60 -0.84 116.25 120.45 2b4k h VAL 212 Ca -0.06 -0.47 0.01 0.00 0.82 0.00 0.00 66.70 67.00 2b4k h VAL 212 Cb 1.42 0.71 -0.03 0.00 -1.52 0.00 0.00 31.29 31.87 2b4k h VAL 212 CO 0.16 0.18 0.42 0.24 0.02 0.00 0.00 177.57 178.60 2b4k h MET 213 N 0.54 0.82 -0.49 1.57 2.86 -1.17 -1.78 114.93 117.29 2b4k h MET 213 Ca 0.15 -0.05 -0.09 0.00 -2.06 0.00 0.00 59.70 57.65 2b4k h MET 213 Cb 0.10 -0.19 -0.02 0.00 0.06 0.00 0.00 31.60 31.56 2b4k h MET 213 CO -0.02 0.54 -0.04 0.00 1.06 0.00 0.00 176.91 178.46 2b4k h ALA 214 N 1.61 0.67 0.00 6.32 0.00 -0.72 -2.80 119.26 124.33 2b4k h ALA 214 Ca 0.24 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.84 2b4k h ALA 214 Cb -0.07 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.54 2b4k h ALA 214 CO -0.05 0.51 0.00 -0.07 0.00 0.00 0.00 179.25 179.64 2b4k h LEU 215 N 0.75 0.00 0.78 0.00 3.38 -0.26 -2.21 115.31 117.74 2b4k h LEU 215 Ca 0.13 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 58.07 2b4k h LEU 215 Cb 0.57 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.33 2b4k h LEU 215 CO 0.03 0.00 -0.37 -0.07 0.09 0.00 0.00 178.44 178.12 2b4k h LEU 216 N 0.00 -0.88 -6.53 1.67 3.38 -1.34 -3.39 115.31 108.22 2b4k h LEU 216 Ca 0.00 0.03 -0.60 0.00 0.09 0.00 0.00 57.88 57.40 2b4k h LEU 216 Cb 0.08 0.23 -0.39 0.00 0.09 0.00 0.00 40.66 40.67 2b4k h LEU 216 CO 0.00 -0.59 -0.87 -0.67 0.09 0.00 0.00 178.44 176.40 2b4k n ASP 217 N -5.03 0.47 -4.84 -0.43 2.03 -1.14 -4.90 116.55 102.71 2b4k n ASP 217 Ca -0.13 -2.61 -0.32 0.00 0.52 0.00 0.00 54.79 52.25 2b4k n ASP 217 Cb 0.41 -0.61 -0.04 0.00 -0.72 0.00 0.00 41.12 40.16 2b4k n ASP 217 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 2b4k s PRO 218 N -0.40 3.97 0.18 -0.67 0.04 -0.84 -4.80 135.00 132.48 2b4k s PRO 218 Ca 0.31 0.98 -0.30 0.00 0.04 0.00 0.00 61.00 62.03 2b4k s PRO 218 Cb 0.02 -2.14 -0.08 0.00 0.04 0.00 0.00 34.50 32.35 2b4k s PRO 218 CO -0.19 -0.25 1.10 -1.58 0.04 0.00 0.00 177.00 176.12 2b4k s HIS 219 N -2.56 3.60 0.39 0.56 2.46 -1.26 -4.93 115.29 113.55 2b4k s HIS 219 Ca 0.59 1.61 0.24 0.00 0.47 0.00 0.00 55.06 57.97 2b4k s HIS 219 Cb -0.10 -3.27 1.33 0.00 -0.13 0.00 0.00 32.58 30.41 2b4k s HIS 219 CO 0.29 -0.58 1.62 -1.00 -2.47 0.00 0.00 174.74 172.60 2b4k h PRO 220 N 5.10 0.11 0.00 2.88 0.13 -1.96 0.33 132.00 138.59 2b4k h PRO 220 Ca -0.44 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 2b4k h PRO 220 Cb 1.21 -0.02 0.00 0.00 0.13 0.00 0.00 31.00 32.32 2b4k h PRO 220 CO 0.72 0.07 0.00 0.00 -0.23 0.00 0.00 178.00 178.57 2b4k h ALA 221 N 1.78 1.00 -1.61 -0.56 0.00 -1.91 -3.39 119.26 114.56 2b4k h ALA 221 Ca 0.81 0.00 -0.54 0.00 0.00 0.00 0.00 54.91 55.18 2b4k h ALA 221 Cb 2.27 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 20.01 2b4k h ALA 221 CO -0.57 0.00 1.15 -1.17 0.00 0.00 0.00 179.25 178.66 2b4k s LEU 222 N -5.62 3.40 0.08 0.00 2.96 0.12 -1.90 118.68 117.73 2b4k s LEU 222 Ca -0.01 0.41 0.21 0.00 -0.22 0.00 0.00 54.13 54.52 2b4k s LEU 222 Cb 0.10 -3.05 -0.15 0.00 0.50 0.00 0.00 46.19 43.59 2b4k s LEU 222 CO 0.41 -1.79 0.76 0.29 -1.32 0.00 0.00 176.35 174.71 2b4k n LYS 223 N 8.69 0.63 -3.60 1.98 4.76 -0.63 -4.91 118.16 125.08 2b4k n LYS 223 Ca 0.15 0.02 -0.16 0.00 -2.87 0.00 0.00 58.31 55.45 2b4k n LYS 223 Cb 0.49 -1.70 -0.07 0.00 -1.84 0.00 0.00 35.03 31.91 2b4k n LYS 223 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 2b4k s VAL 224 N -3.29 0.02 0.01 -0.18 0.11 -1.25 -4.22 120.40 111.59 2b4k s VAL 224 Ca -0.04 -0.13 0.00 0.00 -2.93 0.00 0.00 61.98 58.88 2b4k s VAL 224 Cb 0.11 -0.88 -0.01 0.00 -1.53 0.00 0.00 36.38 34.07 2b4k s VAL 224 CO 0.84 -0.07 -0.01 0.00 -3.33 0.00 0.00 175.10 172.52 2b4k s ALA 225 N -1.07 0.06 -0.37 1.54 0.00 -0.75 -1.53 121.76 119.64 2b4k s ALA 225 Ca -0.11 -0.27 0.02 0.00 0.00 0.00 0.00 51.96 51.60 2b4k s ALA 225 Cb -0.02 0.07 0.15 0.00 0.00 0.00 0.00 23.12 23.32 2b4k s ALA 225 CO 0.07 -0.07 0.28 0.00 0.00 0.00 0.00 175.76 176.05 2b4k s ALA 226 N -0.65 0.61 0.05 0.00 0.00 0.37 -1.84 121.76 120.30 2b4k s ALA 226 Ca -0.07 -1.72 -0.31 0.00 0.00 0.00 0.00 51.96 49.87 2b4k s ALA 226 Cb -0.04 -1.73 -0.06 0.00 0.00 0.00 0.00 23.12 21.28 2b4k s ALA 226 CO -0.00 -2.10 1.29 -2.14 0.00 0.00 0.00 175.76 172.80 2b4k s PRO 227 N 0.99 4.37 -0.23 0.00 0.02 -1.23 -3.82 135.00 135.09 2b4k s PRO 227 Ca 0.20 1.88 -0.05 0.00 0.02 0.00 0.00 61.00 63.06 2b4k s PRO 227 Cb -0.16 -3.38 -0.01 0.00 0.02 0.00 0.00 34.50 30.97 2b4k s PRO 227 CO -0.03 -0.38 -0.01 -1.21 -0.33 0.00 0.00 177.00 175.04 2b4k s GLU 228 N 1.42 3.41 -0.92 5.54 2.02 -0.10 -1.93 118.70 128.13 2b4k s GLU 228 Ca 0.61 -0.62 -0.22 0.00 0.02 0.00 0.00 54.97 54.76 2b4k s GLU 228 Cb -0.31 -3.11 0.03 0.00 0.10 0.00 0.00 34.13 30.84 2b4k s GLU 228 CO 0.28 -0.22 0.54 0.43 0.02 0.00 0.00 175.26 176.31 2b4k n SER 229 N 4.83 -3.45 -4.87 -0.19 7.64 0.44 -1.81 113.62 116.22 2b4k n SER 229 Ca -0.17 -1.01 -0.30 0.00 1.01 0.00 0.00 58.87 58.40 2b4k n SER 229 Cb 0.51 -1.28 0.05 0.00 -1.01 0.00 0.00 64.21 62.47 2b4k n SER 229 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 2b4k s PRO 230 N -6.44 2.88 -0.62 1.43 0.04 -1.26 -1.10 135.00 129.93 2b4k s PRO 230 Ca 0.31 0.56 -0.21 0.00 0.04 0.00 0.00 61.00 61.71 2b4k s PRO 230 Cb -0.17 -2.01 0.09 0.00 0.04 0.00 0.00 34.50 32.44 2b4k s PRO 230 CO 0.78 -1.04 0.82 -1.64 0.04 0.00 0.00 177.00 175.96 2b4k s MET 231 N -5.28 3.08 -0.22 4.56 -1.94 -1.18 -4.37 119.30 113.95 2b4k s MET 231 Ca 0.58 -1.06 -0.15 0.00 -1.71 0.00 0.00 55.69 53.35 2b4k s MET 231 Cb -0.12 -4.24 -0.09 0.00 2.01 0.00 0.00 34.83 32.40 2b4k s MET 231 CO 0.53 -1.65 -0.33 0.28 -0.01 0.00 0.00 175.02 173.83 2b4k n VAL 232 N 5.73 1.46 -3.59 -6.03 0.31 -1.26 -4.64 118.33 110.31 2b4k n VAL 232 Ca -0.07 -0.14 -0.28 0.00 -0.01 0.00 0.00 64.34 63.85 2b4k n VAL 232 Cb 0.44 -2.05 -0.11 0.00 -0.91 0.00 0.00 33.84 31.20 2b4k n VAL 232 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 2b4k s ASP 233 N -6.72 2.87 0.00 4.52 3.68 -1.26 -1.95 116.67 117.81 2b4k s ASP 233 Ca -0.32 -3.07 0.00 0.00 2.13 0.00 0.00 52.55 51.28 2b4k s ASP 233 Cb 0.10 -0.85 0.00 0.00 -1.45 0.00 0.00 42.92 40.72 2b4k s ASP 233 CO 0.43 -0.18 0.55 0.61 0.13 0.00 0.00 175.17 176.71 2b4k n GLY 234 N 2.91 -0.07 0.23 2.66 0.00 -1.26 -2.52 105.19 107.13 2b4k n GLY 234 Ca 0.21 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 46.08 2b4k n GLY 234 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 173.32 175.19 2b4k n TRP 235 N -1.05 0.00 0.40 1.61 -0.00 -1.26 -0.29 117.44 116.84 2b4k n TRP 235 Ca 0.00 0.00 -0.16 0.00 -0.00 0.00 0.00 57.50 57.34 2b4k n TRP 235 Cb 0.00 -0.65 -0.07 0.00 -0.00 0.00 0.00 31.31 30.59 2b4k n TRP 235 CO 0.00 0.00 0.00 0.52 -0.00 0.00 0.00 177.69 178.21 2b4k h MET 236 N -0.26 -0.99 0.00 5.87 2.86 -1.65 -3.25 114.93 117.51 2b4k h MET 236 Ca -0.41 0.07 -0.13 0.00 -2.06 0.00 0.00 59.70 57.16 2b4k h MET 236 Cb 1.51 0.22 -0.12 0.00 0.06 0.00 0.00 31.60 33.28 2b4k h MET 236 CO -0.15 -0.66 -0.25 0.41 1.06 0.00 0.00 176.91 177.32 2b4k n GLY 237 N -1.00 0.96 0.00 8.32 0.00 -1.18 0.18 105.19 112.47 2b4k n GLY 237 Ca -0.13 -0.06 0.00 0.00 0.00 0.00 0.00 46.02 45.83 2b4k n GLY 237 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2b4k n ASP 238 N -0.58 0.00 -0.14 1.61 10.43 -1.08 -2.56 116.55 124.23 2b4k n ASP 238 Ca -0.21 0.00 -0.28 0.00 2.57 0.00 0.00 54.79 56.86 2b4k n ASP 238 Cb 0.73 0.00 -0.09 0.00 1.84 0.00 0.00 41.12 43.60 2b4k n ASP 238 CO 0.00 0.00 0.00 0.47 -1.07 0.00 0.00 177.20 176.60 2b4k n ASP 239 N 0.00 1.96 -0.06 -2.24 8.00 -1.24 -4.35 116.55 118.62 2b4k n ASP 239 Ca 0.00 0.34 -0.11 0.00 0.71 0.00 0.00 54.79 55.73 2b4k n ASP 239 Cb 0.00 -0.82 -0.10 0.00 -0.02 0.00 0.00 41.12 40.18 2b4k n ASP 239 CO 0.00 0.00 0.00 -0.50 -0.39 0.00 0.00 177.20 176.31 2b4k h TRP 240 N -1.00 -0.01 -3.55 1.24 -0.00 -1.76 -3.44 115.95 107.43 2b4k h TRP 240 Ca -0.65 -0.00 -0.52 0.00 -0.00 0.00 0.00 58.89 57.71 2b4k h TRP 240 Cb 1.57 0.00 -0.19 0.00 -0.00 0.00 0.00 29.16 30.54 2b4k h TRP 240 CO -0.11 0.78 -0.80 -0.06 -0.00 0.00 0.00 178.44 178.25 2b4k s PHE 241 N -2.25 1.77 -0.32 0.49 0.40 0.60 -1.31 117.98 117.35 2b4k s PHE 241 Ca -0.15 -0.46 0.02 0.00 -0.60 0.00 0.00 56.93 55.74 2b4k s PHE 241 Cb -0.02 -0.92 0.10 0.00 0.51 0.00 0.00 43.02 42.69 2b4k s PHE 241 CO 0.56 0.27 0.06 -1.01 0.70 0.00 0.00 175.22 175.80 2b4k s HIS 242 N -1.73 2.90 -1.46 0.36 3.76 -0.43 -3.09 115.29 115.60 2b4k s HIS 242 Ca 0.12 -2.44 -0.11 0.00 -0.15 0.00 0.00 55.06 52.48 2b4k s HIS 242 Cb -0.07 -2.37 0.05 0.00 1.11 0.00 0.00 32.58 31.30 2b4k s HIS 242 CO 0.05 -0.91 0.98 0.66 -0.85 0.00 0.00 174.74 174.67 2b4k n TYR 243 N 4.50 -2.44 0.00 1.40 4.01 0.49 -1.63 117.16 123.49 2b4k n TYR 243 Ca 0.00 0.87 0.00 0.00 -0.16 0.00 0.00 57.90 58.61 2b4k n TYR 243 Cb 0.42 -4.35 0.00 0.00 -0.31 0.00 0.00 39.34 35.11 2b4k n TYR 243 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2b4k n GLY 244 N -1.75 3.32 3.67 2.72 0.00 -1.25 -2.66 105.19 109.24 2b4k n GLY 244 Ca 0.01 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.60 2b4k n GLY 244 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2b4k s ALA 245 N -2.45 3.57 0.24 4.61 0.00 -0.65 -4.95 121.76 122.13 2b4k s ALA 245 Ca 0.00 0.39 -0.30 0.00 0.00 0.00 0.00 51.96 52.06 2b4k s ALA 245 Cb 0.00 -3.53 -0.09 0.00 0.00 0.00 0.00 23.12 19.50 2b4k s ALA 245 CO 0.00 -0.91 1.24 0.12 0.00 0.00 0.00 175.76 176.21 2b4k s PHE 246 N 2.77 3.33 -0.62 0.00 5.36 -1.26 -1.32 117.98 126.23 2b4k s PHE 246 Ca 0.50 1.42 -0.15 0.00 -0.96 0.00 0.00 56.93 57.74 2b4k s PHE 246 Cb -0.20 -3.51 0.16 0.00 -0.34 0.00 0.00 43.02 39.13 2b4k s PHE 246 CO 0.15 -1.42 0.57 1.03 -1.46 0.00 0.00 175.22 174.09 2b4k s ARG 247 N -0.78 3.16 0.40 10.12 0.52 -0.43 -2.12 118.95 129.82 2b4k s ARG 247 Ca 0.51 -1.93 0.16 0.00 -0.52 0.00 0.00 55.73 53.96 2b4k s ARG 247 Cb -0.35 -4.33 0.89 0.00 0.52 0.00 0.00 34.95 31.68 2b4k s ARG 247 CO 0.41 -1.32 1.43 1.96 0.02 0.00 0.00 175.30 177.80 2b4k h GLN 248 N 8.56 0.00 0.00 3.54 4.20 -0.99 -1.61 115.11 128.81 2b4k h GLN 248 Ca -0.18 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.53 2b4k h GLN 248 Cb 1.08 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.86 2b4k h GLN 248 CO 0.96 0.00 0.00 0.41 -0.67 0.00 0.00 178.83 179.53 2b4k n GLY 249 N -1.27 -0.74 0.13 3.46 0.00 -1.26 -3.23 105.19 102.28 2b4k n GLY 249 Ca -0.01 -0.12 -0.12 0.00 0.00 0.00 0.00 46.02 45.78 2b4k n GLY 249 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2b4k h ALA 250 N 3.16 0.37 -0.85 4.61 0.00 -1.65 -3.32 119.26 121.58 2b4k h ALA 250 Ca 0.00 -0.76 0.14 0.00 0.00 0.00 0.00 54.91 54.29 2b4k h ALA 250 Cb 0.06 -0.04 -0.09 0.00 0.00 0.00 0.00 17.79 17.72 2b4k h ALA 250 CO 0.00 0.91 0.44 0.74 0.00 0.00 0.00 179.25 181.34 2b4k h PHE 251 N 0.14 0.78 -0.27 0.00 0.04 -1.81 0.13 116.94 115.95 2b4k h PHE 251 Ca -0.07 0.03 -0.02 0.00 2.80 0.00 0.00 57.97 60.71 2b4k h PHE 251 Cb 1.64 -0.22 -0.01 0.00 2.20 0.00 0.00 35.95 39.56 2b4k h PHE 251 CO 0.05 0.21 0.08 -0.44 -0.60 0.00 0.00 178.31 177.61 2b4k h ASP 252 N 0.65 0.40 -0.79 2.17 5.19 -1.81 -2.28 116.42 119.95 2b4k h ASP 252 Ca 0.45 -0.21 0.04 0.00 -0.62 0.00 0.00 57.03 56.70 2b4k h ASP 252 Cb 0.61 -0.10 -0.05 0.00 0.18 0.00 0.00 39.33 39.96 2b4k h ASP 252 CO -0.34 0.50 0.50 0.22 -3.12 0.00 0.00 179.24 176.99 2b4k h TYR 253 N 0.28 0.93 -0.08 4.55 5.03 -1.25 0.94 116.97 127.36 2b4k h TYR 253 Ca 0.09 0.03 0.03 0.00 2.58 0.00 0.00 58.73 61.45 2b4k h TYR 253 Cb 0.24 -0.30 -0.03 0.00 1.55 0.00 0.00 36.73 38.19 2b4k h TYR 253 CO 0.01 0.51 -0.08 0.74 -1.32 0.00 0.00 178.16 178.02 2b4k h PHE 254 N 0.95 -0.21 -0.12 -3.82 0.05 -0.56 -0.00 116.94 113.23 2b4k h PHE 254 Ca 0.33 0.01 -0.12 0.00 3.82 0.00 0.00 57.97 62.01 2b4k h PHE 254 Cb 0.06 0.10 -0.01 0.00 2.00 0.00 0.00 35.95 38.10 2b4k h PHE 254 CO -0.03 -0.13 -0.45 0.28 -0.18 0.00 0.00 178.31 177.80 2b4k h VAL 255 N -0.11 1.32 -0.00 -0.55 2.07 -1.00 -0.75 116.25 117.23 2b4k h VAL 255 Ca 0.06 -1.61 -0.16 0.00 0.82 0.00 0.00 66.70 65.81 2b4k h VAL 255 Cb 0.20 1.73 -0.02 0.00 -1.52 0.00 0.00 31.29 31.67 2b4k h VAL 255 CO -0.15 0.48 -0.75 -1.28 0.02 0.00 0.00 177.57 175.89 2b4k h SER 256 N 0.23 0.02 0.00 0.57 0.87 -0.46 -3.21 113.55 111.57 2b4k h SER 256 Ca 0.02 -0.02 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 2b4k h SER 256 Cb 0.88 -0.01 0.00 0.00 -0.44 0.00 0.00 62.40 62.83 2b4k h SER 256 CO 0.07 0.76 -1.01 0.00 -0.53 0.00 0.00 176.83 176.13 2b4k n GLN 257 N -3.66 1.62 -0.01 2.24 1.13 -0.05 -3.45 117.38 115.20 2b4k n GLN 257 Ca -0.01 -0.04 0.00 0.00 -1.94 0.00 0.00 57.00 55.01 2b4k n GLN 257 Cb 0.73 -1.25 0.00 0.00 0.11 0.00 0.00 30.24 29.84 2b4k n GLN 257 CO 0.00 0.00 0.00 -1.33 -1.44 0.00 0.00 177.06 174.29 2b4k n MET 258 N -1.56 2.14 0.09 -1.09 2.81 -0.29 -4.71 117.12 114.50 2b4k n MET 258 Ca 0.01 -1.28 -0.22 0.00 -1.81 0.00 0.00 57.70 54.40 2b4k n MET 258 Cb 0.28 -0.88 -0.14 0.00 -0.71 0.00 0.00 33.22 31.77 2b4k n MET 258 CO 0.00 0.00 0.00 1.15 1.51 0.00 0.00 175.97 178.63 2b4k h THR 259 N 0.85 1.32 -3.86 2.03 2.02 -1.72 -3.47 112.91 110.09 2b4k h THR 259 Ca 0.00 -2.47 -0.12 0.00 0.77 0.00 0.00 66.41 64.59 2b4k h THR 259 Cb 0.66 2.80 -0.17 0.00 -1.74 0.00 0.00 68.15 69.70 2b4k h THR 259 CO 0.00 0.74 -0.53 0.00 0.37 0.00 0.00 175.52 176.11 2b4k s ALA 260 N -2.88 -0.01 0.35 6.16 0.00 -1.26 -5.04 121.76 119.07 2b4k s ALA 260 Ca -0.10 -0.64 0.08 0.00 0.00 0.00 0.00 51.96 51.30 2b4k s ALA 260 Cb 0.05 0.28 0.79 0.00 0.00 0.00 0.00 23.12 24.24 2b4k s ALA 260 CO 0.92 -0.35 1.86 -0.09 0.00 0.00 0.00 175.76 178.10 2b4k h ARG 261 N 3.50 0.70 0.00 0.00 2.43 -1.90 -3.42 114.38 115.69 2b4k h ARG 261 Ca -0.33 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 58.80 2b4k h ARG 261 Cb 1.18 -0.16 0.00 0.00 -0.42 0.00 0.00 29.97 30.57 2b4k h ARG 261 CO 0.53 0.46 0.00 0.41 -1.51 0.00 0.00 179.97 179.86 2b4k n GLY 262 N -1.42 0.64 3.85 2.80 0.00 -1.26 0.69 105.19 110.48 2b4k n GLY 262 Ca 0.18 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.88 2b4k n GLY 262 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2b4k s GLY 263 N 0.00 1.85 0.26 -0.02 0.00 -1.26 -4.73 107.32 103.43 2b4k s GLY 263 Ca 0.00 0.08 0.02 0.00 0.00 0.00 0.00 44.72 44.82 2b4k s GLY 263 CO 0.00 0.36 0.16 -0.32 0.00 0.00 0.00 173.10 173.30 2b4k s GLY 264 N -3.60 1.83 0.35 0.20 0.00 -1.22 -4.56 107.32 100.32 2b4k s GLY 264 Ca 0.58 -1.81 0.08 0.00 0.00 0.00 0.00 44.72 43.57 2b4k s GLY 264 CO 0.44 -1.49 0.14 -1.31 0.00 0.00 0.00 173.10 170.89 2b4k s ASN 265 N -3.28 4.64 1.04 1.64 0.01 -1.26 -4.89 114.94 112.84 2b4k s ASN 265 Ca 0.38 -0.81 -0.15 0.00 -0.71 0.00 0.00 52.86 51.58 2b4k s ASN 265 Cb 0.06 -0.70 0.20 0.00 0.41 0.00 0.00 41.25 41.22 2b4k s ASN 265 CO 0.17 -0.32 1.10 0.47 -1.51 0.00 0.00 177.10 177.01 2b4k n ASP 266 N -1.15 -0.26 -4.58 -1.22 10.43 -1.26 -3.90 116.55 114.60 2b4k n ASP 266 Ca -0.03 -1.35 -0.41 0.00 2.57 0.00 0.00 54.79 55.57 2b4k n ASP 266 Cb 0.62 -0.86 -0.07 0.00 1.84 0.00 0.00 41.12 42.64 2b4k n ASP 266 CO 0.00 0.00 0.00 -0.63 -1.07 0.00 0.00 177.20 175.50 2b4k s ILE 267 N -3.34 4.99 0.26 0.53 1.01 -1.26 -4.99 121.20 118.40 2b4k s ILE 267 Ca 0.64 0.64 -0.30 0.00 0.00 0.00 0.00 60.65 61.63 2b4k s ILE 267 Cb -0.02 -3.95 -0.14 0.00 0.01 0.00 0.00 42.46 38.35 2b4k s ILE 267 CO 0.45 -0.13 1.13 -2.65 0.00 0.00 0.00 174.94 173.73 2b4k n PRO 268 N 5.77 1.46 -4.20 2.79 -0.02 -1.26 -4.98 135.00 134.55 2b4k n PRO 268 Ca -0.03 0.51 -0.26 0.00 -2.02 0.00 0.00 63.50 61.70 2b4k n PRO 268 Cb 0.49 -1.97 -0.08 0.00 -0.02 0.00 0.00 33.50 31.92 2b4k n PRO 268 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 2b4k s ARG 269 N -1.12 2.42 -0.19 -0.52 1.81 -1.26 -5.04 118.95 115.05 2b4k s ARG 269 Ca 0.63 -1.11 -0.20 0.00 -1.72 0.00 0.00 55.73 53.34 2b4k s ARG 269 Cb -0.72 -2.36 -0.17 0.00 -0.45 0.00 0.00 34.95 31.24 2b4k s ARG 269 CO 0.57 0.45 0.22 -0.09 -0.68 0.00 0.00 175.30 175.77 2b4k h ARG 270 N 2.67 0.00 -6.57 3.54 9.65 -1.97 -3.48 114.38 118.22 2b4k h ARG 270 Ca -0.47 0.00 -0.46 0.00 -1.10 0.00 0.00 59.98 57.95 2b4k h ARG 270 Cb 1.20 0.00 0.03 0.00 -1.39 0.00 0.00 29.97 29.81 2b4k h ARG 270 CO 0.58 0.85 -0.16 0.34 2.80 0.00 0.00 179.97 184.38 2b4k s ASP 271 N -6.60 5.31 0.01 -3.80 -1.08 -1.26 -5.03 116.67 104.21 2b4k s ASP 271 Ca -0.25 -0.67 0.22 0.00 -0.52 0.00 0.00 52.55 51.33 2b4k s ASP 271 Cb 0.04 -0.08 -0.17 0.00 -1.46 0.00 0.00 42.92 41.25 2b4k s ASP 271 CO 0.54 -1.13 0.82 0.00 0.52 0.00 0.00 175.17 175.93 2b4k n ALA 272 N -2.10 3.80 -2.98 3.66 0.00 -1.26 -4.83 120.51 116.80 2b4k n ALA 272 Ca 0.13 -0.52 -0.38 0.00 0.00 0.00 0.00 53.44 52.67 2b4k n ALA 272 Cb 0.61 -0.83 -0.12 0.00 0.00 0.00 0.00 19.45 19.11 2b4k n ALA 272 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2b4k s ASP 273 N -3.70 5.42 0.53 0.00 3.68 -1.26 -4.38 116.67 116.96 2b4k s ASP 273 Ca 0.02 -0.65 0.30 0.00 2.13 0.00 0.00 52.55 54.36 2b4k s ASP 273 Cb 0.15 -1.96 1.46 0.00 -1.45 0.00 0.00 42.92 41.12 2b4k s ASP 273 CO 0.86 -0.22 2.05 0.44 0.13 0.00 0.00 175.17 178.43 2b4k h ASP 274 N 8.32 0.00 -0.45 -0.34 3.45 -1.48 0.30 116.42 126.22 2b4k h ASP 274 Ca -0.31 0.00 -0.02 0.00 0.43 0.00 0.00 57.03 57.13 2b4k h ASP 274 Cb 1.13 0.00 -0.02 0.00 -0.56 0.00 0.00 39.33 39.88 2b4k h ASP 274 CO 0.62 0.10 0.21 0.22 -1.57 0.00 0.00 179.24 178.82 2b4k h TYR 275 N 0.00 0.65 0.01 4.55 5.03 -1.93 0.12 116.97 125.41 2b4k h TYR 275 Ca -0.00 -0.03 -0.25 0.00 2.58 0.00 0.00 58.73 61.02 2b4k h TYR 275 Cb 0.40 -0.20 0.01 0.00 1.55 0.00 0.00 36.73 38.49 2b4k h TYR 275 CO 0.00 0.53 -1.03 1.15 -1.32 0.00 0.00 178.16 177.49 2b4k h THR 276 N 0.59 1.33 -0.47 1.81 2.02 -1.62 -2.89 112.91 113.68 2b4k h THR 276 Ca 0.15 -2.37 -0.01 0.00 0.77 0.00 0.00 66.41 64.96 2b4k h THR 276 Cb 0.13 2.44 -0.02 0.00 -1.74 0.00 0.00 68.15 68.95 2b4k h THR 276 CO -0.02 0.72 0.27 0.78 0.37 0.00 0.00 175.52 177.64 2b4k h ASN 277 N 0.31 0.58 0.56 4.18 2.35 -0.21 -1.76 115.58 121.59 2b4k h ASN 277 Ca -0.11 -0.08 -0.24 0.00 -0.55 0.00 0.00 56.30 55.31 2b4k h ASN 277 Cb 1.68 -0.15 -0.00 0.00 0.05 0.00 0.00 38.32 39.90 2b4k h ASN 277 CO 0.19 0.49 -1.09 -0.26 -1.65 0.00 0.00 177.43 175.11 2b4k h PHE 278 N 0.62 0.46 0.56 1.19 -1.00 -0.86 -3.17 116.94 114.75 2b4k h PHE 278 Ca 0.17 -0.30 -0.03 0.00 2.81 0.00 0.00 57.97 60.62 2b4k h PHE 278 Cb 0.03 -0.03 0.01 0.00 3.61 0.00 0.00 35.95 39.56 2b4k h PHE 278 CO -0.02 1.18 -0.27 1.25 -1.61 0.00 0.00 178.31 178.83 2b4k h LEU 279 N 0.12 -0.64 -1.92 1.54 6.46 -1.48 -1.40 115.31 117.99 2b4k h LEU 279 Ca -0.10 -0.04 0.30 0.00 -0.12 0.00 0.00 57.88 57.92 2b4k h LEU 279 Cb 1.77 0.17 -0.05 0.00 -0.73 0.00 0.00 40.66 41.82 2b4k h LEU 279 CO 0.18 -0.31 0.74 0.50 -0.62 0.00 0.00 178.44 178.93 2b4k h LYS 280 N -0.98 0.05 -0.03 1.25 1.63 -1.44 0.17 116.57 117.22 2b4k h LYS 280 Ca -0.08 -0.00 -0.15 0.00 -0.85 0.00 0.00 60.65 59.57 2b4k h LYS 280 Cb 0.64 -0.01 0.01 0.00 -0.60 0.00 0.00 32.23 32.27 2b4k h LYS 280 CO 0.13 0.03 -0.58 0.00 -3.45 0.00 0.00 179.45 175.58 2b4k h ALA 281 N 1.49 0.11 0.00 5.00 0.00 -1.47 -3.50 119.26 120.90 2b4k h ALA 281 Ca 0.51 -0.55 0.00 0.00 0.00 0.00 0.00 54.91 54.86 2b4k h ALA 281 Cb 1.93 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.74 2b4k h ALA 281 CO -0.04 0.36 0.00 0.41 0.00 0.00 0.00 179.25 179.98 2b4k n GLY 282 N 0.97 1.26 3.92 0.00 0.00 0.59 -4.73 105.19 107.19 2b4k n GLY 282 Ca -0.10 -0.82 -0.26 0.00 0.00 0.00 0.00 46.02 44.84 2b4k n GLY 282 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2b4k s SER 283 N -4.00 6.21 0.22 1.61 1.04 -1.26 -4.76 113.70 112.76 2b4k s SER 283 Ca 0.00 0.78 -0.08 0.00 0.48 0.00 0.00 55.95 57.12 2b4k s SER 283 Cb 0.00 -2.13 0.19 0.00 0.10 0.00 0.00 66.02 64.17 2b4k s SER 283 CO 0.00 -0.55 1.86 0.00 0.98 0.00 0.00 173.24 175.53 2b4k h ALA 284 N 0.33 1.08 -0.73 5.32 0.00 -1.83 -1.89 119.26 121.55 2b4k h ALA 284 Ca -0.47 -0.11 -0.05 0.00 0.00 0.00 0.00 54.91 54.28 2b4k h ALA 284 Cb 1.21 -0.34 -0.03 0.00 0.00 0.00 0.00 17.79 18.63 2b4k h ALA 284 CO 0.61 0.56 0.27 0.78 0.00 0.00 0.00 179.25 181.47 2b4k h GLY 285 N 1.16 1.18 1.76 0.00 0.00 -1.51 -0.15 103.07 105.50 2b4k h GLY 285 Ca 0.30 -0.65 -0.04 0.00 0.00 0.00 0.00 47.33 46.94 2b4k h GLY 285 CO -0.05 0.61 -0.05 0.23 0.00 0.00 0.00 176.54 177.28 2b4k h SER 286 N 1.06 0.29 0.02 0.19 0.87 -1.53 0.60 113.55 115.06 2b4k h SER 286 Ca 0.24 -0.05 -0.00 0.00 -1.23 0.00 0.00 61.79 60.75 2b4k h SER 286 Cb 0.24 -0.07 0.00 0.00 -0.44 0.00 0.00 62.40 62.12 2b4k h SER 286 CO -0.02 0.38 -0.01 0.15 -0.53 0.00 0.00 176.83 176.81 2b4k h PHE 287 N 0.30 -0.03 -0.44 2.24 3.57 -0.71 -3.01 116.94 118.86 2b4k h PHE 287 Ca 0.07 -0.00 0.09 0.00 3.53 0.00 0.00 57.97 61.65 2b4k h PHE 287 Cb 0.29 0.01 -0.08 0.00 2.79 0.00 0.00 35.95 38.96 2b4k h PHE 287 CO 0.01 0.59 -0.05 0.00 -2.23 0.00 0.00 178.31 176.62 2b4k h ALA 288 N 0.27 0.36 -0.18 2.41 0.00 -0.63 0.10 119.26 121.59 2b4k h ALA 288 Ca -0.00 0.15 0.04 0.00 0.00 0.00 0.00 54.91 55.10 2b4k h ALA 288 Cb 0.63 0.28 -0.04 0.00 0.00 0.00 0.00 17.79 18.65 2b4k h ALA 288 CO 0.00 -0.42 -0.08 1.15 0.00 0.00 0.00 179.25 179.90 2b4k h THR 289 N 0.05 0.73 -0.85 0.00 2.02 -0.98 0.12 112.91 114.01 2b4k h THR 289 Ca 0.22 0.00 0.01 0.00 0.77 0.00 0.00 66.41 67.41 2b4k h THR 289 Cb 0.33 0.73 -0.04 0.00 -1.74 0.00 0.00 68.15 67.42 2b4k h THR 289 CO -0.41 0.00 0.56 1.56 0.37 0.00 0.00 175.52 177.60 2b4k h GLN 290 N -0.06 1.11 0.00 6.66 4.20 -1.25 0.21 115.11 125.98 2b4k h GLN 290 Ca 0.10 -0.07 0.00 0.00 0.06 0.00 0.00 58.65 58.74 2b4k h GLN 290 Cb 0.21 -0.25 0.00 0.00 0.30 0.00 0.00 27.48 27.74 2b4k h GLN 290 CO -0.22 0.73 0.00 0.00 -0.67 0.00 0.00 178.83 178.67 2b4k h ALA 291 N 1.32 1.00 -0.38 3.87 0.00 0.07 -3.45 119.26 121.69 2b4k h ALA 291 Ca 0.32 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 55.22 2b4k h ALA 291 Cb -0.11 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.68 2b4k h ALA 291 CO -0.07 0.00 -0.01 0.41 0.00 0.00 0.00 179.25 179.58 2b4k n GLY 292 N -0.64 0.56 0.09 0.00 0.00 0.06 -4.95 105.19 100.31 2b4k n GLY 292 Ca 0.00 -0.81 0.12 0.00 0.00 0.00 0.00 46.02 45.33 2b4k n GLY 292 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2b4k h LEU 293 N -0.01 0.00 -0.59 0.99 3.38 -1.20 -3.35 115.31 114.53 2b4k h LEU 293 Ca -0.01 -0.13 0.00 0.00 0.09 0.00 0.00 57.88 57.83 2b4k h LEU 293 Cb 1.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.75 2b4k h LEU 293 CO 0.01 0.06 0.13 0.47 0.09 0.00 0.00 178.44 179.20 2b4k n ASP 294 N -2.37 0.23 -1.10 -0.43 8.00 -1.26 -0.09 116.55 119.53 2b4k n ASP 294 Ca 0.02 0.53 0.12 0.00 0.71 0.00 0.00 54.79 56.17 2b4k n ASP 294 Cb 0.48 -0.54 0.22 0.00 -0.02 0.00 0.00 41.12 41.27 2b4k n ASP 294 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2b4k n GLN 295 N -1.78 2.44 -3.36 -1.24 10.64 -1.26 -4.86 117.38 117.97 2b4k n GLN 295 Ca -0.01 -2.18 -0.43 0.00 -1.83 0.00 0.00 57.00 52.56 2b4k n GLN 295 Cb 0.14 -1.50 -0.09 0.00 -0.86 0.00 0.00 30.24 27.93 2b4k n GLN 295 CO 0.00 0.00 0.00 0.71 -1.83 0.00 0.00 177.06 175.94 2b4k s TYR 296 N -1.55 3.19 0.35 2.61 2.02 0.87 -4.99 117.35 119.85 2b4k s TYR 296 Ca 0.38 -0.45 0.17 0.00 -0.37 0.00 0.00 57.07 56.80 2b4k s TYR 296 Cb 0.22 -2.82 1.20 0.00 -0.40 0.00 0.00 41.96 40.17 2b4k s TYR 296 CO 0.31 -0.67 1.61 -1.35 -1.57 0.00 0.00 175.55 173.88 2b4k h PRO 297 N 8.70 0.10 -0.27 -1.71 0.11 -1.89 -0.94 132.00 136.10 2b4k h PRO 297 Ca -0.27 -0.01 -0.10 0.00 0.11 0.00 0.00 66.00 65.74 2b4k h PRO 297 Cb 1.11 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 32.19 2b4k h PRO 297 CO 0.78 0.07 -0.21 0.35 -0.21 0.00 0.00 178.00 178.78 2b4k h PHE 298 N 0.11 0.73 -0.45 0.65 3.57 -1.95 -2.72 116.94 116.89 2b4k h PHE 298 Ca 0.78 -0.21 -0.05 0.00 3.53 0.00 0.00 57.97 62.03 2b4k h PHE 298 Cb 1.95 -0.16 -0.02 0.00 2.79 0.00 0.00 35.95 40.51 2b4k h PHE 298 CO -0.06 0.91 0.07 2.35 -2.23 0.00 0.00 178.31 179.35 2b4k h TRP 299 N 0.35 0.72 -0.64 0.41 -0.00 -1.53 -0.77 115.95 114.49 2b4k h TRP 299 Ca 0.05 -0.07 0.08 0.00 -0.00 0.00 0.00 58.89 58.95 2b4k h TRP 299 Cb 0.76 -0.21 -0.06 0.00 -0.00 0.00 0.00 29.16 29.64 2b4k h TRP 299 CO 0.07 0.63 0.31 1.96 -0.00 0.00 0.00 178.44 181.41 2b4k h GLN 300 N 0.67 0.53 0.02 2.65 4.20 -1.18 0.11 115.11 122.10 2b4k h GLN 300 Ca 0.15 -0.03 -0.00 0.00 0.06 0.00 0.00 58.65 58.82 2b4k h GLN 300 Cb 0.31 -0.12 0.00 0.00 0.30 0.00 0.00 27.48 27.97 2b4k h GLN 300 CO 0.00 0.35 -0.01 0.00 -0.67 0.00 0.00 178.83 178.51 2b4k h ARG 301 N 0.55 -0.02 -0.51 1.46 3.08 -1.03 -2.45 114.38 115.45 2b4k h ARG 301 Ca 0.30 0.00 0.07 0.00 0.07 0.00 0.00 59.98 60.43 2b4k h ARG 301 Cb 0.29 0.00 -0.06 0.00 0.08 0.00 0.00 29.97 30.28 2b4k h ARG 301 CO -0.24 0.36 0.17 1.98 -1.07 0.00 0.00 179.97 181.16 2b4k h MET 302 N -0.40 0.32 -0.09 0.04 4.05 -0.83 0.21 114.93 118.24 2b4k h MET 302 Ca -0.00 -0.02 0.03 0.00 -0.28 0.00 0.00 59.70 59.42 2b4k h MET 302 Cb 0.39 -0.07 -0.00 0.00 -0.80 0.00 0.00 31.60 31.11 2b4k h MET 302 CO 0.00 0.21 0.07 1.25 0.23 0.00 0.00 176.91 178.67 2b4k h HIS 303 N 0.33 0.00 -0.00 1.39 -0.00 -0.75 0.71 115.15 116.83 2b4k h HIS 303 Ca 0.25 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.62 2b4k h HIS 303 Cb 0.29 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 27.70 2b4k h HIS 303 CO -0.18 0.00 -0.27 0.00 -0.00 0.00 0.00 177.93 177.49 2b4k n ALA 304 N -2.51 3.03 -3.24 5.26 0.00 -0.03 -4.38 120.51 118.65 2b4k n ALA 304 Ca -0.01 -0.28 -0.24 0.00 0.00 0.00 0.00 53.44 52.91 2b4k n ALA 304 Cb 0.18 -1.25 -0.07 0.00 0.00 0.00 0.00 19.45 18.31 2b4k n ALA 304 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 2b4k n HIS 305 N -1.28 0.80 0.39 0.00 8.25 0.24 -4.93 115.22 118.69 2b4k n HIS 305 Ca 0.09 -3.74 0.14 0.00 -0.26 0.00 0.00 57.72 53.94 2b4k n HIS 305 Cb 0.32 -0.41 0.45 0.00 1.12 0.00 0.00 29.99 31.47 2b4k n HIS 305 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 2b4k h PRO 306 N 3.93 0.00 -6.06 -0.41 0.13 -1.75 -3.46 132.00 124.38 2b4k h PRO 306 Ca 0.11 0.00 -0.54 0.00 -0.87 0.00 0.00 66.00 64.70 2b4k h PRO 306 Cb 0.82 0.00 -0.07 0.00 0.13 0.00 0.00 31.00 31.88 2b4k h PRO 306 CO 0.57 0.00 -0.50 0.00 -0.23 0.00 0.00 178.00 177.83 2b4k s ALA 307 N -3.33 3.61 -0.85 -0.56 0.00 -1.26 -4.93 121.76 114.44 2b4k s ALA 307 Ca 0.06 -1.90 -0.07 0.00 0.00 0.00 0.00 51.96 50.05 2b4k s ALA 307 Cb 0.09 -0.70 -0.06 0.00 0.00 0.00 0.00 23.12 22.45 2b4k s ALA 307 CO 0.54 -0.05 2.02 0.98 0.00 0.00 0.00 175.76 179.26 2b4k n TYR 308 N -1.23 1.32 -1.48 0.00 9.36 0.11 -4.78 117.16 120.46 2b4k n TYR 308 Ca -0.02 -1.86 0.00 0.00 3.32 0.00 0.00 57.90 59.35 2b4k n TYR 308 Cb 0.62 -1.61 0.00 0.00 -0.63 0.00 0.00 39.34 37.72 2b4k n TYR 308 CO 0.00 0.00 0.00 -0.40 0.22 0.00 0.00 176.86 176.68 2b4k n ASP 309 N 4.55 0.00 -0.31 2.98 3.85 -1.26 -4.03 116.55 122.32 2b4k n ASP 309 Ca 0.42 -0.69 0.07 0.00 -0.71 0.00 0.00 54.79 53.88 2b4k n ASP 309 Cb 0.15 0.00 0.23 0.00 -1.35 0.00 0.00 41.12 40.14 2b4k n ASP 309 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 2b4k h ALA 310 N -1.20 1.34 -0.78 2.12 0.00 -1.97 0.13 119.26 118.90 2b4k h ALA 310 Ca 0.00 0.06 0.11 0.00 0.00 0.00 0.00 54.91 55.08 2b4k h ALA 310 Cb 0.00 -0.08 -0.05 0.00 0.00 0.00 0.00 17.79 17.66 2b4k h ALA 310 CO 0.00 0.00 0.51 0.35 0.00 0.00 0.00 179.25 180.12 2b4k h PHE 311 N 0.73 0.73 0.05 0.00 3.57 -1.93 0.89 116.94 120.98 2b4k h PHE 311 Ca 0.47 0.02 -0.36 0.00 3.53 0.00 0.00 57.97 61.63 2b4k h PHE 311 Cb 0.60 -0.23 -0.05 0.00 2.79 0.00 0.00 35.95 39.06 2b4k h PHE 311 CO -0.06 0.33 -2.13 0.91 -2.23 0.00 0.00 178.31 175.13 2b4k n TRP 312 N -4.51 0.69 -0.10 0.41 7.02 -0.74 -4.11 117.44 116.11 2b4k n TRP 312 Ca 0.14 0.17 0.01 0.00 -1.02 0.00 0.00 57.50 56.80 2b4k n TRP 312 Cb 0.36 -1.10 0.30 0.00 -2.42 0.00 0.00 31.31 28.45 2b4k n TRP 312 CO 0.00 0.00 0.00 0.37 -2.02 0.00 0.00 177.69 176.04 2b4k h GLN 313 N 0.03 0.75 -0.04 -0.99 4.15 -0.55 -1.62 115.11 116.84 2b4k h GLN 313 Ca -0.46 -0.08 0.00 0.00 0.77 0.00 0.00 58.65 58.88 2b4k h GLN 313 Cb 2.02 -0.15 0.00 0.00 0.21 0.00 0.00 27.48 29.56 2b4k h GLN 313 CO 0.03 0.56 0.00 0.41 -1.93 0.00 0.00 178.83 177.90 2b4k n GLY 314 N -1.25 -0.72 0.05 2.39 0.00 0.29 -3.05 105.19 102.88 2b4k n GLY 314 Ca 0.05 -0.14 0.01 0.00 0.00 0.00 0.00 46.02 45.93 2b4k n GLY 314 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2b4k n GLN 315 N -0.48 1.42 -2.18 1.61 6.02 -0.63 -4.74 117.38 118.41 2b4k n GLN 315 Ca 0.10 -0.42 -0.34 0.00 -0.01 0.00 0.00 57.00 56.34 2b4k n GLN 315 Cb 0.10 -0.89 -0.04 0.00 1.02 0.00 0.00 30.24 30.43 2b4k n GLN 315 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2b4k s ALA 316 N -0.44 2.07 0.32 -1.58 0.00 -1.10 -4.67 121.76 116.37 2b4k s ALA 316 Ca 0.02 -1.40 0.27 0.00 0.00 0.00 0.00 51.96 50.85 2b4k s ALA 316 Cb 0.01 -4.46 1.32 0.00 0.00 0.00 0.00 23.12 20.00 2b4k s ALA 316 CO 0.03 -4.23 2.00 -0.07 0.00 0.00 0.00 175.76 173.49 2b4k h LEU 317 N 16.18 0.00 -0.35 0.00 3.38 -1.74 -2.69 115.31 130.10 2b4k h LEU 317 Ca -0.01 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.94 2b4k h LEU 317 Cb 1.05 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.79 2b4k h LEU 317 CO 1.26 0.14 0.17 -2.24 0.09 0.00 0.00 178.44 177.86 2b4k h ASP 318 N 0.00 0.45 -0.25 -0.43 -0.00 -1.88 -0.05 116.42 114.25 2b4k h ASP 318 Ca -0.00 -0.12 -0.15 0.00 -0.00 0.00 0.00 57.03 56.76 2b4k h ASP 318 Cb 0.46 -0.12 -0.00 0.00 -0.00 0.00 0.00 39.33 39.67 2b4k h ASP 318 CO 0.02 0.45 -0.42 0.11 -0.00 0.00 0.00 179.24 179.40 2b4k h LYS 319 N 0.43 0.73 -0.09 4.15 6.56 -1.87 -3.06 116.57 123.42 2b4k h LYS 319 Ca 0.12 -0.45 -0.01 0.00 -1.06 0.00 0.00 60.65 59.25 2b4k h LYS 319 Cb 0.11 0.05 -0.00 0.00 -0.57 0.00 0.00 32.23 31.82 2b4k h LYS 319 CO -0.02 1.07 0.01 0.82 -2.06 0.00 0.00 179.45 179.28 2b4k h ILE 320 N 0.46 1.22 -0.67 1.86 2.04 -1.39 -3.06 117.51 117.97 2b4k h ILE 320 Ca 0.02 -0.67 0.06 0.00 1.00 0.00 0.00 64.86 65.27 2b4k h ILE 320 Cb 1.02 1.49 -0.06 0.00 -0.74 0.00 0.00 36.82 38.53 2b4k h ILE 320 CO 0.10 0.19 0.36 0.25 0.00 0.00 0.00 178.15 179.05 2b4k h LEU 321 N -0.09 0.53 -2.31 1.44 5.85 -1.08 -0.66 115.31 119.00 2b4k h LEU 321 Ca 0.03 0.03 -0.00 0.00 0.84 0.00 0.00 57.88 58.78 2b4k h LEU 321 Cb 0.29 -0.07 -0.00 0.00 0.37 0.00 0.00 40.66 41.25 2b4k h LEU 321 CO 0.00 0.34 -0.00 0.00 -0.34 0.00 0.00 178.44 178.44 2b4k h ALA 322 N 1.36 1.69 0.00 1.25 0.00 -1.51 -0.33 119.26 121.71 2b4k h ALA 322 Ca 0.30 -0.00 -0.08 0.00 0.00 0.00 0.00 54.91 55.13 2b4k h ALA 322 Cb 0.21 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 2b4k h ALA 322 CO -0.19 0.00 -0.39 1.96 0.00 0.00 0.00 179.25 180.63 2b4k h GLN 323 N 0.00 0.00 0.00 0.00 4.20 -1.02 -3.25 115.11 115.04 2b4k h GLN 323 Ca -0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 2b4k h GLN 323 Cb 0.00 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.78 2b4k h GLN 323 CO 0.00 0.39 0.00 0.54 -0.67 0.00 0.00 178.83 179.09 2b4k n ARG 324 N -3.26 0.17 -3.56 1.46 5.12 -0.14 -4.96 116.66 111.49 2b4k n ARG 324 Ca 0.02 0.04 -0.19 0.00 -1.93 0.00 0.00 57.85 55.78 2b4k n ARG 324 Cb 0.64 -1.50 0.01 0.00 -1.16 0.00 0.00 32.46 30.45 2b4k n ARG 324 CO 0.00 0.00 0.00 1.63 -1.93 0.00 0.00 177.63 177.33 2b4k n LYS 325 N -1.41 -1.36 -1.91 5.56 4.01 -1.23 -4.95 118.16 116.87 2b4k n LYS 325 Ca 0.09 0.90 -0.32 0.00 -0.51 0.00 0.00 58.31 58.47 2b4k n LYS 325 Cb 0.27 -3.66 0.02 0.00 -0.51 0.00 0.00 35.03 31.15 2b4k n LYS 325 CO 0.00 0.00 0.00 -1.25 -1.11 0.00 0.00 177.40 175.04 2b4k s PRO 326 N -4.64 3.30 0.00 1.97 0.04 -1.26 -5.00 135.00 129.41 2b4k s PRO 326 Ca 0.10 1.04 0.00 0.00 0.04 0.00 0.00 61.00 62.18 2b4k s PRO 326 Cb -0.04 -2.04 0.00 0.00 0.04 0.00 0.00 34.50 32.46 2b4k s PRO 326 CO 0.85 -0.81 0.07 0.25 0.04 0.00 0.00 177.00 177.39 2b4k n THR 327 N -2.41 0.00 -2.50 1.26 -2.24 -1.26 -4.29 114.28 102.83 2b4k n THR 327 Ca 0.08 -0.43 -0.42 0.00 -2.27 0.00 0.00 64.05 61.01 2b4k n THR 327 Cb 0.53 1.02 -0.03 0.00 -2.10 0.00 0.00 70.33 69.76 2b4k n THR 327 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 2b4k s VAL 328 N -0.72 4.33 -0.03 2.28 1.01 -1.26 -4.69 120.40 121.33 2b4k s VAL 328 Ca 0.00 1.66 -0.36 0.00 0.00 0.00 0.00 61.98 63.28 2b4k s VAL 328 Cb 0.00 -4.06 -0.14 0.00 0.00 0.00 0.00 36.38 32.17 2b4k s VAL 328 CO 0.00 0.03 1.67 -2.65 0.00 0.00 0.00 175.10 174.15 2b4k n PRO 329 N 4.84 1.73 -4.46 2.72 -0.02 -1.26 -4.79 135.00 133.77 2b4k n PRO 329 Ca 0.10 0.63 -0.29 0.00 -2.02 0.00 0.00 63.50 61.92 2b4k n PRO 329 Cb 0.47 -2.38 -0.13 0.00 -0.02 0.00 0.00 33.50 31.44 2b4k n PRO 329 CO 0.00 0.00 0.00 -1.64 1.98 0.00 0.00 175.50 175.84 2b4k s MET 330 N 2.44 1.58 -0.44 -0.52 -1.94 -0.82 -1.81 119.30 117.79 2b4k s MET 330 Ca 0.89 -1.26 0.02 0.00 -1.71 0.00 0.00 55.69 53.63 2b4k s MET 330 Cb -0.83 -1.97 0.14 0.00 2.01 0.00 0.00 34.83 34.18 2b4k s MET 330 CO 0.50 0.47 0.27 -1.17 -0.01 0.00 0.00 175.02 175.08 2b4k s LEU 331 N -1.93 2.39 0.03 -0.03 0.20 -0.76 -2.81 118.68 115.77 2b4k s LEU 331 Ca 0.15 -2.71 -0.30 0.00 0.69 0.00 0.00 54.13 51.95 2b4k s LEU 331 Cb -0.10 -0.89 -0.05 0.00 -0.43 0.00 0.00 46.19 44.72 2b4k s LEU 331 CO 0.06 -0.25 1.12 0.26 -0.29 0.00 0.00 176.35 177.26 2b4k s TRP 332 N 0.29 3.51 0.03 5.38 0.52 -0.44 -3.55 118.94 124.68 2b4k s TRP 332 Ca 0.20 1.44 0.03 0.00 0.02 0.00 0.00 56.10 57.79 2b4k s TRP 332 Cb -0.18 -3.31 -0.02 0.00 -1.15 0.00 0.00 33.47 28.80 2b4k s TRP 332 CO -0.04 -0.83 -0.09 -2.00 0.02 0.00 0.00 176.95 174.01 2b4k s GLU 333 N 1.09 0.59 -0.04 4.98 -6.30 -0.81 0.02 118.70 118.23 2b4k s GLU 333 Ca 0.56 -0.62 -0.29 0.00 -2.50 0.00 0.00 54.97 52.12 2b4k s GLU 333 Cb -0.26 -0.47 0.09 0.00 0.00 0.00 0.00 34.13 33.50 2b4k s GLU 333 CO 0.28 0.11 0.81 1.14 0.02 0.00 0.00 175.26 177.62 2b4k s GLN 334 N -1.14 0.90 0.40 4.30 -2.07 -0.94 0.17 119.66 121.27 2b4k s GLN 334 Ca -0.04 -0.04 -0.18 0.00 -1.82 0.00 0.00 55.36 53.28 2b4k s GLN 334 Cb -0.08 0.42 -0.10 0.00 -1.09 0.00 0.00 33.01 32.17 2b4k s GLN 334 CO 0.00 -0.33 0.87 0.20 -1.32 0.00 0.00 175.29 174.71 2b4k s GLY 335 N -1.75 2.32 0.41 2.60 0.00 -1.26 -3.57 107.32 106.06 2b4k s GLY 335 Ca -0.02 0.22 0.11 0.00 0.00 0.00 0.00 44.72 45.03 2b4k s GLY 335 CO -0.01 0.47 1.94 1.41 0.00 0.00 0.00 173.10 176.91 2b4k h LEU 336 N 1.91 0.14 -3.76 0.66 3.38 -0.61 -2.29 115.31 114.74 2b4k h LEU 336 Ca -0.48 -0.03 -0.50 0.00 0.09 0.00 0.00 57.88 56.96 2b4k h LEU 336 Cb 1.18 -0.04 -0.29 0.00 0.09 0.00 0.00 40.66 41.60 2b4k h LEU 336 CO 0.63 0.31 0.09 0.79 0.09 0.00 0.00 178.44 180.35 2b4k n TRP 337 N -4.29 2.54 -1.79 1.13 8.01 -0.90 -4.92 117.44 117.22 2b4k n TRP 337 Ca -0.01 -2.32 -0.43 0.00 -1.31 0.00 0.00 57.50 53.43 2b4k n TRP 337 Cb 0.26 -0.82 -0.03 0.00 -2.01 0.00 0.00 31.31 28.71 2b4k n TRP 337 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.69 177.02 2b4k s ASP 338 N -2.51 6.04 0.00 -0.99 2.15 -0.86 -4.16 116.67 116.33 2b4k s ASP 338 Ca 0.55 2.03 0.24 0.00 0.43 0.00 0.00 52.55 55.80 2b4k s ASP 338 Cb 0.45 -2.52 0.59 0.00 -0.30 0.00 0.00 42.92 41.14 2b4k s ASP 338 CO 0.02 -1.47 1.48 0.00 -0.17 0.00 0.00 175.17 175.03 2b4k n GLN 339 N 8.05 2.06 0.00 4.34 0.00 -1.26 -4.26 117.38 126.30 2b4k n GLN 339 Ca 0.23 -1.56 0.00 0.00 0.00 0.00 0.00 57.00 55.68 2b4k n GLN 339 Cb 0.44 -1.46 0.00 0.00 0.00 0.00 0.00 30.24 29.22 2b4k n GLN 339 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.06 177.45 2b4k n GLU 340 N 0.84 0.97 -3.26 2.61 1.02 -1.26 -4.94 120.64 116.61 2b4k n GLU 340 Ca 0.17 0.00 -0.25 0.00 -0.02 0.00 0.00 57.16 57.06 2b4k n GLU 340 Cb 0.48 -0.97 -0.08 0.00 -0.02 0.00 0.00 31.44 30.85 2b4k n GLU 340 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 2b4k n ASP 341 N -2.30 0.10 0.14 1.62 9.92 -1.26 -3.69 116.55 121.06 2b4k n ASP 341 Ca 0.00 -2.62 0.03 0.00 -0.53 0.00 0.00 54.79 51.67 2b4k n ASP 341 Cb 0.47 -0.62 0.03 0.00 -0.64 0.00 0.00 41.12 40.36 2b4k n ASP 341 CO 0.00 0.00 0.00 -0.03 0.13 0.00 0.00 177.20 177.30 2b4k h MET 342 N 4.49 0.00 0.06 -1.24 4.05 -1.74 -3.38 114.93 117.17 2b4k h MET 342 Ca 0.13 0.00 -0.00 0.00 -0.28 0.00 0.00 59.70 59.55 2b4k h MET 342 Cb 0.88 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.68 2b4k h MET 342 CO 0.45 0.43 -0.03 2.35 0.23 0.00 0.00 176.91 180.33 2b4k h TRP 343 N 0.00 -0.07 0.00 1.39 2.91 -1.83 -3.44 115.95 114.91 2b4k h TRP 343 Ca -0.02 -0.00 0.00 0.00 1.13 0.00 0.00 58.89 60.00 2b4k h TRP 343 Cb 1.36 0.02 0.00 0.00 -0.51 0.00 0.00 29.16 30.04 2b4k h TRP 343 CO 0.00 -0.05 0.00 0.41 -1.03 0.00 0.00 178.44 177.77 2b4k n GLY 344 N 1.57 0.00 0.08 2.65 0.00 -1.26 -1.95 105.19 106.28 2b4k n GLY 344 Ca -0.01 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 45.99 2b4k n GLY 344 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2b4k n ALA 345 N -0.31 -0.12 -0.33 4.61 0.00 -1.26 -0.87 120.51 122.23 2b4k n ALA 345 Ca 0.00 0.16 0.07 0.00 0.00 0.00 0.00 53.44 53.68 2b4k n ALA 345 Cb 0.00 0.32 0.27 0.00 0.00 0.00 0.00 19.45 20.04 2b4k n ALA 345 CO 0.00 0.00 0.00 0.97 0.00 0.00 0.00 177.50 178.47 2b4k h ILE 346 N 0.00 0.94 -0.15 0.00 2.10 -1.84 -0.24 117.51 118.32 2b4k h ILE 346 Ca 0.03 -0.32 -0.14 0.00 1.08 0.00 0.00 64.86 65.51 2b4k h ILE 346 Cb 0.08 -0.08 -0.01 0.00 -1.09 0.00 0.00 36.82 35.72 2b4k h ILE 346 CO -0.18 0.17 -0.52 0.45 -1.08 0.00 0.00 178.15 176.99 2b4k h HIS 347 N 0.94 0.53 -0.06 2.19 3.86 -0.56 -1.66 115.15 120.39 2b4k h HIS 347 Ca 0.46 -0.18 -0.13 0.00 -1.16 0.00 0.00 60.37 59.36 2b4k h HIS 347 Cb 0.46 -0.10 0.01 0.00 1.06 0.00 0.00 27.41 28.84 2b4k h HIS 347 CO -0.00 0.86 -0.45 0.00 0.86 0.00 0.00 177.93 179.19 2b4k h ALA 348 N 1.11 0.14 -0.49 2.45 0.00 -0.37 -1.56 119.26 120.54 2b4k h ALA 348 Ca 0.01 -0.50 0.00 0.00 0.00 0.00 0.00 54.91 54.42 2b4k h ALA 348 Cb 1.02 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.79 2b4k h ALA 348 CO 0.09 0.29 0.31 2.35 0.00 0.00 0.00 179.25 182.30 2b4k h TRP 349 N -0.06 0.63 -0.08 0.00 7.01 -1.04 -1.39 115.95 121.01 2b4k h TRP 349 Ca -0.04 0.01 -0.18 0.00 2.11 0.00 0.00 58.89 60.79 2b4k h TRP 349 Cb 1.12 -0.21 0.01 0.00 -2.10 0.00 0.00 29.16 27.99 2b4k h TRP 349 CO 0.13 0.41 -0.67 0.37 -2.79 0.00 0.00 178.44 175.89 2b4k h GLN 350 N 0.67 0.59 -1.00 2.65 5.75 -1.27 -1.91 115.11 120.58 2b4k h GLN 350 Ca 0.18 -0.53 0.04 0.00 -0.15 0.00 0.00 58.65 58.19 2b4k h GLN 350 Cb -0.05 0.13 -0.06 0.00 1.07 0.00 0.00 27.48 28.56 2b4k h GLN 350 CO -0.04 1.15 0.65 0.00 -2.65 0.00 0.00 178.83 177.95 2b4k h ALA 351 N 0.45 1.34 -0.12 3.38 0.00 -0.74 0.87 119.26 124.43 2b4k h ALA 351 Ca -0.06 -0.04 -0.09 0.00 0.00 0.00 0.00 54.91 54.72 2b4k h ALA 351 Cb 1.32 -0.35 0.00 0.00 0.00 0.00 0.00 17.79 18.77 2b4k h ALA 351 CO 0.14 0.53 -0.27 -0.07 0.00 0.00 0.00 179.25 179.57 2b4k h LEU 352 N 1.25 0.45 -0.76 0.00 3.38 -1.29 -1.77 115.31 116.57 2b4k h LEU 352 Ca 0.40 -0.57 0.08 0.00 0.09 0.00 0.00 57.88 57.89 2b4k h LEU 352 Cb 0.03 -0.13 -0.07 0.00 0.09 0.00 0.00 40.66 40.58 2b4k h LEU 352 CO -0.13 0.94 0.42 0.50 0.09 0.00 0.00 178.44 180.26 2b4k h LYS 353 N -0.02 0.70 -0.15 1.13 3.64 -0.93 0.14 116.57 121.08 2b4k h LYS 353 Ca 0.00 -0.04 -0.06 0.00 -1.27 0.00 0.00 60.65 59.27 2b4k h LYS 353 Cb 0.87 -0.16 -0.01 0.00 -0.41 0.00 0.00 32.23 32.52 2b4k h LYS 353 CO 0.06 0.47 -0.19 -0.44 -2.27 0.00 0.00 179.45 177.08 2b4k h ASP 354 N 0.72 0.25 -0.09 4.20 3.32 -0.78 -2.13 116.42 121.92 2b4k h ASP 354 Ca 0.36 -0.06 0.00 0.00 0.02 0.00 0.00 57.03 57.35 2b4k h ASP 354 Cb 0.31 -0.07 0.00 0.00 0.22 0.00 0.00 39.33 39.80 2b4k h ASP 354 CO -0.23 0.46 0.00 0.00 -1.72 0.00 0.00 179.24 177.74 2b4k n ALA 355 N -2.48 2.52 -3.68 3.45 0.00 -0.01 -4.91 120.51 115.39 2b4k n ALA 355 Ca -0.01 -0.21 -0.24 0.00 0.00 0.00 0.00 53.44 52.98 2b4k n ALA 355 Cb 0.32 -1.09 0.03 0.00 0.00 0.00 0.00 19.45 18.71 2b4k n ALA 355 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2b4k n ASP 356 N -0.28 -2.61 -4.71 0.00 4.64 -0.80 -4.87 116.55 107.92 2b4k n ASP 356 Ca 0.08 -0.88 -0.42 0.00 -1.38 0.00 0.00 54.79 52.19 2b4k n ASP 356 Cb 0.11 -3.87 -0.03 0.00 -1.04 0.00 0.00 41.12 36.29 2b4k n ASP 356 CO 0.00 0.00 0.00 0.54 -0.82 0.00 0.00 177.20 176.92 2b4k s VAL 357 N -3.63 2.48 -1.37 5.18 0.11 -0.95 -4.91 120.40 117.32 2b4k s VAL 357 Ca 0.16 0.25 -0.07 0.00 -2.93 0.00 0.00 61.98 59.39 2b4k s VAL 357 Cb -0.05 -3.16 0.10 0.00 -1.53 0.00 0.00 36.38 31.74 2b4k s VAL 357 CO 0.83 0.01 2.35 0.29 -3.33 0.00 0.00 175.10 175.25 2b4k n LYS 358 N 4.51 4.15 -3.57 1.54 4.76 -1.26 -4.84 118.16 123.44 2b4k n LYS 358 Ca 0.15 -3.24 -0.05 0.00 -2.87 0.00 0.00 58.31 52.30 2b4k n LYS 358 Cb 0.38 -2.76 -0.02 0.00 -1.84 0.00 0.00 35.03 30.79 2b4k n LYS 358 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2b4k s ALA 359 N -0.07 -1.98 0.32 7.82 0.00 -1.26 -4.76 121.76 121.82 2b4k s ALA 359 Ca 0.53 1.28 -0.28 0.00 0.00 0.00 0.00 51.96 53.49 2b4k s ALA 359 Cb 0.16 0.12 -0.13 0.00 0.00 0.00 0.00 23.12 23.28 2b4k s ALA 359 CO -0.07 -0.68 1.23 -2.30 0.00 0.00 0.00 175.76 173.95 2b4k n PRO 360 N -0.19 1.91 -2.94 0.00 -0.02 -1.26 -4.92 135.00 127.59 2b4k n PRO 360 Ca -0.03 0.67 -0.11 0.00 -2.02 0.00 0.00 63.50 62.00 2b4k n PRO 360 Cb 0.60 -2.20 -0.02 0.00 -0.02 0.00 0.00 33.50 31.86 2b4k n PRO 360 CO 0.00 0.00 0.00 -1.71 1.98 0.00 0.00 175.50 175.77 2b4k n ASN 361 N 1.04 -2.49 -4.84 2.55 5.15 -1.25 -1.94 115.26 113.47 2b4k n ASN 361 Ca 0.07 -2.81 -0.36 0.00 -0.60 0.00 0.00 54.58 50.88 2b4k n ASN 361 Cb 0.34 1.07 -0.07 0.00 -0.53 0.00 0.00 39.78 40.60 2b4k n ASN 361 CO 0.00 0.00 0.00 -0.89 1.40 0.00 0.00 177.26 177.77 2b4k s THR 362 N 0.55 5.21 -0.14 -0.44 2.01 -1.12 -4.83 115.64 116.87 2b4k s THR 362 Ca 0.31 0.04 -0.05 0.00 0.31 0.00 0.00 61.69 62.30 2b4k s THR 362 Cb 0.04 -3.28 -0.03 0.00 0.01 0.00 0.00 72.50 69.24 2b4k s THR 362 CO -0.11 0.57 0.02 -0.22 -0.69 0.00 0.00 174.62 174.19 2b4k s LEU 363 N -1.14 3.62 -0.08 4.42 2.96 -0.10 -1.33 118.68 127.03 2b4k s LEU 363 Ca 0.16 0.07 0.03 0.00 -0.22 0.00 0.00 54.13 54.17 2b4k s LEU 363 Cb -0.12 -1.87 0.00 0.00 0.50 0.00 0.00 46.19 44.70 2b4k s LEU 363 CO 0.06 0.25 -0.19 -0.69 -1.32 0.00 0.00 176.35 174.46 2b4k s VAL 364 N -0.11 1.64 -0.11 1.68 1.01 0.10 0.25 120.40 124.87 2b4k s VAL 364 Ca 0.05 -0.78 -0.03 0.00 0.00 0.00 0.00 61.98 61.22 2b4k s VAL 364 Cb -0.12 -1.44 0.04 0.00 0.00 0.00 0.00 36.38 34.86 2b4k s VAL 364 CO 0.02 0.47 0.05 -0.04 0.00 0.00 0.00 175.10 175.60 2b4k s MET 365 N 0.43 0.24 0.49 2.72 -1.94 -0.84 -2.22 119.30 118.19 2b4k s MET 365 Ca -0.16 0.05 0.07 0.00 -1.71 0.00 0.00 55.69 53.94 2b4k s MET 365 Cb -0.17 -1.28 0.01 0.00 2.01 0.00 0.00 34.83 35.41 2b4k s MET 365 CO 0.06 -0.48 0.43 0.20 -0.01 0.00 0.00 175.02 175.22 2b4k s GLY 366 N 2.06 2.20 -0.31 -0.03 0.00 -1.23 -0.91 107.32 109.10 2b4k s GLY 366 Ca 0.03 -1.68 -0.07 0.00 0.00 0.00 0.00 44.72 43.01 2b4k s GLY 366 CO -0.06 -1.81 3.49 -1.55 0.00 0.00 0.00 173.10 173.18 2b4k n PRO 367 N -1.70 2.33 -4.35 2.90 -0.04 -1.26 -0.22 135.00 132.65 2b4k n PRO 367 Ca 0.03 -1.25 -0.24 0.00 -0.04 0.00 0.00 63.50 62.00 2b4k n PRO 367 Cb 0.63 -2.15 -0.08 0.00 -0.04 0.00 0.00 33.50 31.85 2b4k n PRO 367 CO 0.00 0.00 0.00 -1.58 -0.04 0.00 0.00 175.50 173.88 2b4k s TRP 368 N 1.17 2.53 0.62 0.54 0.51 -1.26 -4.78 118.94 118.28 2b4k s TRP 368 Ca 0.67 -0.35 -0.03 0.00 -2.12 0.00 0.00 56.10 54.27 2b4k s TRP 368 Cb 0.29 -1.29 0.13 0.00 -0.81 0.00 0.00 33.47 31.80 2b4k s TRP 368 CO -0.01 0.57 0.85 2.89 -0.51 0.00 0.00 176.95 180.74 2b4k n ARG 369 N -0.86 -0.23 -1.67 4.98 -4.01 -1.26 -2.11 116.66 111.50 2b4k n ARG 369 Ca -0.05 -2.01 -0.46 0.00 -1.04 0.00 0.00 57.85 54.30 2b4k n ARG 369 Cb 0.61 -0.66 -0.04 0.00 -3.04 0.00 0.00 32.46 29.33 2b4k n ARG 369 CO 0.00 0.00 0.00 1.58 -3.04 0.00 0.00 177.63 176.17 2b4k n HIS 370 N -2.77 2.28 -1.05 2.89 -0.00 -1.26 -0.85 115.22 114.46 2b4k n HIS 370 Ca 0.13 0.29 -0.02 0.00 -0.00 0.00 0.00 57.72 58.12 2b4k n HIS 370 Cb 0.46 -2.53 -0.01 0.00 -0.00 0.00 0.00 29.99 27.91 2b4k n HIS 370 CO 0.00 0.00 0.00 0.43 -0.00 0.00 0.00 176.34 176.77 2b4k n SER 371 N 3.19 -5.59 0.26 0.26 7.64 -1.26 -4.84 113.62 113.28 2b4k n SER 371 Ca 0.16 0.04 0.17 0.00 1.01 0.00 0.00 58.87 60.26 2b4k n SER 371 Cb 0.29 -3.25 0.87 0.00 -1.01 0.00 0.00 64.21 61.12 2b4k n SER 371 CO 0.00 0.00 0.00 1.23 -3.01 0.00 0.00 175.04 173.26 2b4k h GLY 372 N 0.00 0.00 1.83 0.23 0.00 -1.34 -2.61 103.07 101.18 2b4k h GLY 372 Ca -0.04 0.00 -0.05 0.00 0.00 0.00 0.00 47.33 47.25 2b4k h GLY 372 CO 0.05 0.00 -0.13 -0.24 0.00 0.00 0.00 176.54 176.22 2b4k h VAL 373 N 0.00 1.17 -0.49 4.60 3.04 -1.88 -2.81 116.25 119.87 2b4k h VAL 373 Ca 0.00 -0.77 -0.17 0.00 -1.01 0.00 0.00 66.70 64.75 2b4k h VAL 373 Cb 0.13 1.22 -0.10 0.00 -2.01 0.00 0.00 31.29 30.53 2b4k h VAL 373 CO 0.00 0.24 0.22 0.59 -1.01 0.00 0.00 177.57 177.61 2b4k n ASN 374 N -4.28 3.66 0.00 3.17 3.02 -0.98 -4.66 115.26 115.18 2b4k n ASN 374 Ca -0.01 -2.79 0.00 0.00 -0.03 0.00 0.00 54.58 51.75 2b4k n ASN 374 Cb 0.26 -0.66 0.00 0.00 -0.61 0.00 0.00 39.78 38.77 2b4k n ASN 374 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 2b4k n TYR 375 N -0.10 0.00 -3.70 3.10 4.02 -1.06 -2.17 117.16 117.25 2b4k n TYR 375 Ca 0.28 0.00 -0.36 0.00 -0.01 0.00 0.00 57.90 57.80 2b4k n TYR 375 Cb 1.04 0.00 -0.06 0.00 -0.02 0.00 0.00 39.34 40.31 2b4k n TYR 375 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 176.86 177.06 2b4k s ASN 376 N 1.26 6.57 -0.19 7.72 3.84 -1.26 -4.33 114.94 128.55 2b4k s ASN 376 Ca 0.00 0.67 0.14 0.00 0.21 0.00 0.00 52.86 53.88 2b4k s ASN 376 Cb 0.00 -2.14 0.44 0.00 -0.55 0.00 0.00 41.25 39.00 2b4k s ASN 376 CO 0.00 0.31 1.20 0.61 -2.79 0.00 0.00 177.10 176.42 2b4k n GLY 377 N 1.51 4.31 0.10 1.21 0.00 -1.26 -4.74 105.19 106.32 2b4k n GLY 377 Ca -0.14 -1.46 -0.15 0.00 0.00 0.00 0.00 46.02 44.27 2b4k n GLY 377 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2b4k h SER 378 N 1.34 0.32 -5.13 1.61 0.02 -1.89 -2.58 113.55 107.25 2b4k h SER 378 Ca 0.01 -0.42 -0.14 0.00 -0.84 0.00 0.00 61.79 60.40 2b4k h SER 378 Cb 1.30 -0.10 -0.15 0.00 0.14 0.00 0.00 62.40 63.59 2b4k h SER 378 CO 0.18 1.34 -0.68 0.42 -1.14 0.00 0.00 176.83 176.95 2b4k s THR 379 N -2.63 0.30 -0.23 -2.27 -4.23 -1.26 -0.02 115.64 105.30 2b4k s THR 379 Ca -0.06 -1.84 -0.03 0.00 -1.18 0.00 0.00 61.69 58.58 2b4k s THR 379 Cb 0.07 -1.58 0.12 0.00 1.34 0.00 0.00 72.50 72.45 2b4k s THR 379 CO 0.85 -0.95 0.31 -0.22 -0.54 0.00 0.00 174.62 174.08 2b4k s LEU 380 N -2.95 -0.42 0.00 4.79 2.96 -1.05 -5.00 118.68 117.01 2b4k s LEU 380 Ca 0.09 -0.00 0.00 0.00 -0.22 0.00 0.00 54.13 54.00 2b4k s LEU 380 Cb 0.07 0.80 0.00 0.00 0.50 0.00 0.00 46.19 47.57 2b4k s LEU 380 CO -0.08 -0.31 0.00 0.61 -1.32 0.00 0.00 176.35 175.24 2b4k n GLY 381 N 5.34 2.71 0.08 7.98 0.00 -1.26 -1.68 105.19 118.36 2b4k n GLY 381 Ca -0.04 -0.37 0.13 0.00 0.00 0.00 0.00 46.02 45.74 2b4k n GLY 381 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2b4k n PRO 382 N 13.64 0.18 -2.29 1.61 -0.04 -1.26 -4.87 135.00 141.97 2b4k n PRO 382 Ca 0.00 0.18 -0.36 0.00 -0.04 0.00 0.00 63.50 63.28 2b4k n PRO 382 Cb 0.00 -1.72 -0.01 0.00 -0.04 0.00 0.00 33.50 31.73 2b4k n PRO 382 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2b4k s LEU 383 N -4.08 3.96 -0.06 1.53 1.43 -0.67 -5.06 118.68 115.73 2b4k s LEU 383 Ca 0.11 2.24 0.03 0.00 -1.03 0.00 0.00 54.13 55.48 2b4k s LEU 383 Cb 0.14 -4.32 0.00 0.00 0.03 0.00 0.00 46.19 42.04 2b4k s LEU 383 CO 0.55 -0.94 -0.15 -1.61 0.23 0.00 0.00 176.35 174.43 2b4k s GLU 384 N -2.83 1.80 0.44 1.70 2.02 -1.26 -2.54 118.70 118.04 2b4k s GLU 384 Ca 0.65 -0.53 0.06 0.00 0.02 0.00 0.00 54.97 55.17 2b4k s GLU 384 Cb -0.27 -1.51 -0.05 0.00 0.10 0.00 0.00 34.13 32.41 2b4k s GLU 384 CO 0.32 0.14 0.10 -0.06 0.02 0.00 0.00 175.26 175.79 2b4k s PHE 385 N 0.32 2.33 -1.05 1.61 0.08 0.97 -5.01 117.98 117.23 2b4k s PHE 385 Ca -0.09 -0.72 -0.21 0.00 0.12 0.00 0.00 56.93 56.03 2b4k s PHE 385 Cb -0.13 -1.82 0.07 0.00 -0.57 0.00 0.00 43.02 40.57 2b4k s PHE 385 CO 0.03 0.23 1.43 -1.21 -0.10 0.00 0.00 175.22 175.60 2b4k s GLU 386 N -3.87 3.68 0.42 0.44 0.41 -1.26 -4.85 118.70 113.68 2b4k s GLU 386 Ca 0.31 -1.44 0.00 0.00 -0.41 0.00 0.00 54.97 53.43 2b4k s GLU 386 Cb 0.05 -5.29 0.00 0.00 -1.78 0.00 0.00 34.13 27.11 2b4k s GLU 386 CO 0.17 -2.12 0.00 0.41 -0.49 0.00 0.00 175.26 173.23 2b4k n GLY 387 N 6.27 -2.16 3.57 -1.39 0.00 -1.26 -4.49 105.19 105.73 2b4k n GLY 387 Ca 0.34 -1.47 -0.35 0.00 0.00 0.00 0.00 46.02 44.54 2b4k n GLY 387 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2b4k s ASP 388 N -2.99 5.88 0.48 1.61 -1.08 -1.26 -3.56 116.67 115.76 2b4k s ASP 388 Ca 0.00 -1.37 0.15 0.00 -0.52 0.00 0.00 52.55 50.81 2b4k s ASP 388 Cb 0.00 -2.57 1.16 0.00 -1.46 0.00 0.00 42.92 40.05 2b4k s ASP 388 CO 0.00 -2.10 2.08 0.71 0.52 0.00 0.00 175.17 176.38 2b4k h THR 389 N 6.69 0.97 0.06 1.71 1.35 -1.68 0.27 112.91 122.27 2b4k h THR 389 Ca 0.20 -0.06 -0.00 0.00 -0.55 0.00 0.00 66.41 66.00 2b4k h THR 389 Cb 0.98 0.77 0.00 0.00 -1.73 0.00 0.00 68.15 68.17 2b4k h THR 389 CO 1.33 0.03 -0.03 0.00 -0.25 0.00 0.00 175.52 176.60 2b4k h ALA 390 N 1.86 -0.09 -0.45 6.62 0.00 -1.85 -2.50 119.26 122.85 2b4k h ALA 390 Ca 0.11 -0.20 -0.01 0.00 0.00 0.00 0.00 54.91 54.81 2b4k h ALA 390 Cb 0.22 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.02 2b4k h ALA 390 CO -0.02 -0.34 0.25 1.25 0.00 0.00 0.00 179.25 180.39 2b4k h HIS 391 N -0.50 0.61 -0.64 0.00 6.17 -1.60 -1.95 115.15 117.24 2b4k h HIS 391 Ca -0.01 -0.01 0.11 0.00 0.71 0.00 0.00 60.37 61.17 2b4k h HIS 391 Cb 0.43 -0.20 -0.12 0.00 2.52 0.00 0.00 27.41 30.05 2b4k h HIS 391 CO 0.06 0.46 -0.36 1.96 0.71 0.00 0.00 177.93 180.76 2b4k h GLN 392 N 0.59 -0.15 -0.52 5.26 4.20 -0.47 0.69 115.11 124.71 2b4k h GLN 392 Ca 0.16 0.01 -0.03 0.00 0.06 0.00 0.00 58.65 58.85 2b4k h GLN 392 Cb 0.05 0.03 -0.02 0.00 0.30 0.00 0.00 27.48 27.84 2b4k h GLN 392 CO -0.03 -0.10 0.21 -0.92 -0.67 0.00 0.00 178.83 177.33 2b4k h TYR 393 N -0.15 0.79 -0.85 2.96 5.03 -1.17 0.06 116.97 123.64 2b4k h TYR 393 Ca 0.24 -0.06 0.07 0.00 2.58 0.00 0.00 58.73 61.56 2b4k h TYR 393 Cb 0.56 -0.24 -0.06 0.00 1.55 0.00 0.00 36.73 38.55 2b4k h TYR 393 CO -0.68 0.65 0.55 0.00 -1.32 0.00 0.00 178.16 177.36 2b4k h ARG 394 N 0.70 0.88 0.11 1.82 3.08 -0.32 0.00 114.38 120.66 2b4k h ARG 394 Ca 0.17 -0.05 -0.36 0.00 0.07 0.00 0.00 59.98 59.81 2b4k h ARG 394 Cb 0.19 -0.20 -0.02 0.00 0.08 0.00 0.00 29.97 30.02 2b4k h ARG 394 CO -0.01 0.58 -1.98 -2.13 -1.07 0.00 0.00 179.97 175.35 2b4k n ARG 395 N -4.50 0.75 0.02 0.04 0.63 0.07 -1.72 116.66 111.95 2b4k n ARG 395 Ca 0.13 0.26 -0.02 0.00 -0.92 0.00 0.00 57.85 57.30 2b4k n ARG 395 Cb 0.24 -1.71 -0.10 0.00 0.45 0.00 0.00 32.46 31.34 2b4k n ARG 395 CO 0.00 0.00 0.00 -0.44 -2.51 0.00 0.00 177.63 174.68 2b4k h ASP 396 N 0.06 0.00 0.00 6.15 3.45 -0.98 -3.40 116.42 121.71 2b4k h ASP 396 Ca -0.42 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.04 2b4k h ASP 396 Cb 2.03 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 40.80 2b4k h ASP 396 CO 0.08 0.70 -0.06 0.52 -1.57 0.00 0.00 179.24 178.92 2b4k n VAL 397 N -2.95 1.02 0.03 -1.35 0.31 -0.39 -4.68 118.33 110.31 2b4k n VAL 397 Ca -0.11 0.32 -0.08 0.00 -0.01 0.00 0.00 64.34 64.46 2b4k n VAL 397 Cb 0.90 -1.53 -0.05 0.00 -0.91 0.00 0.00 33.84 32.25 2b4k n VAL 397 CO 0.00 0.00 0.00 0.15 -1.32 0.00 0.00 176.83 175.66 2b4k h PHE 398 N -0.06 -0.78 0.20 3.52 3.57 -1.20 -1.47 116.94 120.71 2b4k h PHE 398 Ca 0.00 0.03 0.01 0.00 3.53 0.00 0.00 57.97 61.54 2b4k h PHE 398 Cb 0.06 0.34 -0.04 0.00 2.79 0.00 0.00 35.95 39.10 2b4k h PHE 398 CO -0.03 -0.28 -0.37 -0.09 -2.23 0.00 0.00 178.31 175.32 2b4k h ARG 399 N -0.33 -0.62 -0.89 1.11 9.65 -1.55 -1.55 114.38 120.19 2b4k h ARG 399 Ca 0.01 0.04 0.08 0.00 -1.10 0.00 0.00 59.98 59.01 2b4k h ARG 399 Cb 0.36 0.14 -0.07 0.00 -1.39 0.00 0.00 29.97 29.01 2b4k h ARG 399 CO -0.18 -0.42 0.55 -1.35 2.80 0.00 0.00 179.97 181.38 2b4k h PRO 400 N -0.65 0.94 0.07 0.20 0.11 -1.76 0.13 132.00 131.03 2b4k h PRO 400 Ca 0.01 -0.06 0.01 0.00 0.11 0.00 0.00 66.00 66.08 2b4k h PRO 400 Cb 0.64 -0.21 -0.02 0.00 0.11 0.00 0.00 31.00 31.52 2b4k h PRO 400 CO -0.17 0.62 -0.13 0.35 -0.21 0.00 0.00 178.00 178.46 2b4k h PHE 401 N 0.96 -0.34 -0.71 0.65 3.04 -0.99 -1.58 116.94 117.97 2b4k h PHE 401 Ca 0.41 0.01 -0.01 0.00 3.98 0.00 0.00 57.97 62.35 2b4k h PHE 401 Cb 0.26 0.14 -0.03 0.00 2.56 0.00 0.00 35.95 38.88 2b4k h PHE 401 CO -0.03 -0.20 0.41 0.74 -2.02 0.00 0.00 178.31 177.21 2b4k h PHE 402 N -0.26 0.96 -0.64 0.41 -1.00 -0.65 -2.75 116.94 113.01 2b4k h PHE 402 Ca 0.03 -0.01 0.11 0.00 2.81 0.00 0.00 57.97 60.90 2b4k h PHE 402 Cb 0.28 -0.31 -0.08 0.00 3.61 0.00 0.00 35.95 39.45 2b4k h PHE 402 CO -0.16 0.67 0.23 -0.44 -1.61 0.00 0.00 178.31 177.00 2b4k h ASP 403 N 0.97 0.21 -0.61 2.17 3.45 -0.33 0.72 116.42 123.00 2b4k h ASP 403 Ca 0.25 0.09 0.13 0.00 0.43 0.00 0.00 57.03 57.93 2b4k h ASP 403 Cb 0.01 0.08 -0.11 0.00 -0.56 0.00 0.00 39.33 38.74 2b4k h ASP 403 CO -0.04 0.11 -0.10 -0.08 -1.57 0.00 0.00 179.24 177.56 2b4k h GLU 404 N 0.40 0.03 0.00 3.56 4.81 -0.99 0.80 114.58 123.19 2b4k h GLU 404 Ca 0.33 -0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.56 2b4k h GLU 404 Cb 0.44 -0.01 0.00 0.00 0.63 0.00 0.00 28.75 29.81 2b4k h GLU 404 CO -0.34 0.02 -0.93 1.88 -0.73 0.00 0.00 179.01 178.92 2b4k h TYR 405 N 0.04 0.00 0.00 0.92 -1.99 -1.51 -3.40 116.97 111.03 2b4k h TYR 405 Ca 0.30 0.00 -0.28 0.00 2.00 0.00 0.00 58.73 60.76 2b4k h TYR 405 Cb 0.48 0.00 -0.05 0.00 2.00 0.00 0.00 36.73 39.16 2b4k h TYR 405 CO -0.45 0.00 -2.11 1.28 -0.00 0.00 0.00 178.16 176.87 2b4k n LEU 406 N -2.71 0.00 -4.08 3.88 4.77 0.20 -4.75 117.00 114.31 2b4k n LEU 406 Ca 0.00 0.00 -0.36 0.00 -0.03 0.00 0.00 56.01 55.63 2b4k n LEU 406 Cb 0.55 0.37 -0.09 0.00 -2.33 0.00 0.00 43.42 41.92 2b4k n LEU 406 CO 0.40 0.37 0.10 -0.54 -1.33 0.00 0.00 177.39 176.39 2b4k s LYS 407 N -2.48 2.72 0.14 3.23 1.02 0.27 -4.60 119.74 120.03 2b4k s LYS 407 Ca -0.08 -2.76 -0.35 0.00 0.02 0.00 0.00 55.97 52.80 2b4k s LYS 407 Cb 0.06 -3.76 -0.16 0.00 -0.52 0.00 0.00 37.83 33.45 2b4k s LYS 407 CO 0.69 -1.20 1.34 -2.30 -0.92 0.00 0.00 175.35 172.96 2b4k n PRO 408 N 3.12 1.41 0.00 -1.68 -0.02 -1.26 -1.56 135.00 135.01 2b4k n PRO 408 Ca 0.12 0.51 0.00 0.00 -2.02 0.00 0.00 63.50 62.10 2b4k n PRO 408 Cb 0.37 -2.13 0.00 0.00 -0.02 0.00 0.00 33.50 31.72 2b4k n PRO 408 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2b4k n GLY 409 N 2.50 0.87 3.75 -1.23 0.00 -1.26 -5.07 105.19 104.74 2b4k n GLY 409 Ca 0.17 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.85 2b4k n GLY 409 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2b4k s SER 410 N -1.81 4.59 0.31 1.61 0.01 -0.60 -4.97 113.70 112.84 2b4k s SER 410 Ca 0.00 2.12 -0.29 0.00 1.31 0.00 0.00 55.95 59.09 2b4k s SER 410 Cb 0.00 -2.56 -0.10 0.00 0.21 0.00 0.00 66.02 63.57 2b4k s SER 410 CO 0.00 -1.98 1.31 0.00 0.41 0.00 0.00 173.24 172.98 2b4k s ALA 411 N -2.28 3.51 0.38 1.44 0.00 -1.26 -4.85 121.76 118.70 2b4k s ALA 411 Ca 0.69 1.24 -0.18 0.00 0.00 0.00 0.00 51.96 53.71 2b4k s ALA 411 Cb -0.23 -3.48 -0.10 0.00 0.00 0.00 0.00 23.12 19.30 2b4k s ALA 411 CO 0.45 -0.62 0.86 -1.12 0.00 0.00 0.00 175.76 175.33 2b4k s SER 412 N -0.34 6.87 0.02 0.00 0.01 -1.26 -4.48 113.70 114.52 2b4k s SER 412 Ca 0.50 1.52 0.05 0.00 1.31 0.00 0.00 55.95 59.33 2b4k s SER 412 Cb -0.39 -2.47 -0.03 0.00 0.21 0.00 0.00 66.02 63.33 2b4k s SER 412 CO 0.50 -0.29 -0.10 0.68 0.41 0.00 0.00 173.24 174.44 2b4k s VAL 413 N -2.09 3.40 -0.64 3.43 -7.23 -1.26 -5.08 120.40 110.94 2b4k s VAL 413 Ca 0.58 -0.92 0.02 0.00 -1.81 0.00 0.00 61.98 59.85 2b4k s VAL 413 Cb -0.10 -2.48 0.16 0.00 0.56 0.00 0.00 36.38 34.52 2b4k s VAL 413 CO 0.15 0.36 0.43 -1.00 -0.31 0.00 0.00 175.10 174.72 2b4k s HIS 414 N -1.00 3.42 0.40 2.82 3.76 -1.26 -5.07 115.29 118.36 2b4k s HIS 414 Ca 0.17 -3.09 -0.22 0.00 -0.15 0.00 0.00 55.06 51.76 2b4k s HIS 414 Cb -0.11 -2.94 -0.11 0.00 1.11 0.00 0.00 32.58 30.54 2b4k s HIS 414 CO 0.08 -0.71 0.96 -0.51 -0.85 0.00 0.00 174.74 173.70 2b4k s LEU 415 N -0.67 4.04 0.00 0.89 1.02 -1.26 -5.08 118.68 117.63 2b4k s LEU 415 Ca 0.20 1.75 0.00 0.00 0.02 0.00 0.00 54.13 56.10 2b4k s LEU 415 Cb -0.17 -4.40 0.00 0.00 0.02 0.00 0.00 46.19 41.64 2b4k s LEU 415 CO -0.06 -0.31 0.00 -0.81 0.02 0.00 0.00 176.35 175.19 2b4k n PRO 416 N -0.33 0.75 0.04 1.29 -0.04 -1.26 -5.00 135.00 130.44 2b4k n PRO 416 Ca 0.06 0.00 -0.13 0.00 -0.04 0.00 0.00 63.50 63.39 2b4k n PRO 416 Cb 0.53 0.00 -0.09 0.00 -0.04 0.00 0.00 33.50 33.90 2b4k n PRO 416 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 2b4k h ASP 417 N 0.00 -0.09 -3.86 3.54 3.32 -0.54 -3.41 116.42 115.37 2b4k h ASP 417 Ca 0.00 -0.36 -0.34 0.00 0.02 0.00 0.00 57.03 56.35 2b4k h ASP 417 Cb 0.00 0.02 -0.29 0.00 0.22 0.00 0.00 39.33 39.28 2b4k h ASP 417 CO 0.00 0.32 -0.76 0.00 -1.72 0.00 0.00 179.24 177.08 2b4k s ALA 418 N -4.53 0.50 -0.36 3.45 0.00 -0.93 -0.92 121.76 118.97 2b4k s ALA 418 Ca -0.15 -0.21 -0.00 0.00 0.00 0.00 0.00 51.96 51.59 2b4k s ALA 418 Cb 0.02 -0.16 0.09 0.00 0.00 0.00 0.00 23.12 23.07 2b4k s ALA 418 CO 0.63 0.10 0.10 0.42 0.00 0.00 0.00 175.76 177.01 2b4k s ILE 419 N 0.02 2.88 -0.01 0.00 1.01 0.14 -1.18 121.20 124.06 2b4k s ILE 419 Ca 0.00 -1.97 0.07 0.00 0.00 0.00 0.00 60.65 58.75 2b4k s ILE 419 Cb -0.04 -2.93 -0.02 0.00 0.01 0.00 0.00 42.46 39.48 2b4k s ILE 419 CO -0.00 -0.51 -0.21 -0.63 0.00 0.00 0.00 174.94 173.59 2b4k s ILE 420 N 1.09 1.68 0.17 2.92 1.01 -0.66 -1.98 121.20 125.43 2b4k s ILE 420 Ca 0.05 -0.95 -0.28 0.00 0.00 0.00 0.00 60.65 59.47 2b4k s ILE 420 Cb -0.21 -1.40 -0.08 0.00 0.01 0.00 0.00 42.46 40.78 2b4k s ILE 420 CO -0.05 0.44 0.88 -0.47 0.00 0.00 0.00 174.94 175.74 2b4k s TYR 421 N -0.54 3.90 -0.41 3.97 5.04 -0.08 0.27 117.35 129.50 2b4k s TYR 421 Ca 0.08 1.76 -0.21 0.00 -2.44 0.00 0.00 57.07 56.26 2b4k s TYR 421 Cb -0.08 -2.92 0.02 0.00 0.35 0.00 0.00 41.96 39.32 2b4k s TYR 421 CO -0.00 0.39 0.67 1.21 -1.34 0.00 0.00 175.55 176.48 2b4k s ASN 422 N -0.76 6.38 0.00 4.32 3.84 0.25 -4.75 114.94 124.23 2b4k s ASN 422 Ca 0.41 -0.09 0.16 0.00 0.21 0.00 0.00 52.86 53.54 2b4k s ASN 422 Cb -0.24 -2.34 0.94 0.00 -0.55 0.00 0.00 41.25 39.06 2b4k s ASN 422 CO 0.29 -0.73 1.57 0.35 -2.79 0.00 0.00 177.10 175.79 2b4k n THR 423 N 5.79 0.00 -0.03 -5.21 -2.24 -0.61 -1.07 114.28 110.91 2b4k n THR 423 Ca -0.01 0.00 -0.07 0.00 -2.27 0.00 0.00 64.05 61.71 2b4k n THR 423 Cb 0.48 -0.28 -0.03 0.00 -2.10 0.00 0.00 70.33 68.41 2b4k n THR 423 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2b4k n GLY 424 N 0.69 -0.11 0.08 3.38 0.00 -1.26 -4.67 105.19 103.30 2b4k n GLY 424 Ca 0.12 -0.04 0.13 0.00 0.00 0.00 0.00 46.02 46.23 2b4k n GLY 424 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2b4k n ASP 425 N -3.08 0.69 -3.28 1.61 8.00 -1.24 -4.75 116.55 114.50 2b4k n ASP 425 Ca -0.13 0.37 -0.16 0.00 0.71 0.00 0.00 54.79 55.58 2b4k n ASP 425 Cb 0.61 -0.39 0.07 0.00 -0.02 0.00 0.00 41.12 41.38 2b4k n ASP 425 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2b4k n GLN 426 N -2.11 -2.13 -3.70 -1.24 1.13 -0.23 -5.03 117.38 104.08 2b4k n GLN 426 Ca 0.05 0.85 -0.02 0.00 -1.94 0.00 0.00 57.00 55.94 2b4k n GLN 426 Cb 0.42 -5.68 -0.01 0.00 0.11 0.00 0.00 30.24 25.08 2b4k n GLN 426 CO 0.00 0.00 0.00 -1.59 -1.44 0.00 0.00 177.06 174.03 2b4k s LYS 427 N -4.49 0.92 0.12 -1.09 -2.85 -1.18 -4.77 119.74 106.40 2b4k s LYS 427 Ca 0.45 -0.50 -0.22 0.00 -1.00 0.00 0.00 55.97 54.70 2b4k s LYS 427 Cb -0.07 0.32 -0.07 0.00 -2.06 0.00 0.00 37.83 35.95 2b4k s LYS 427 CO 0.75 -0.42 0.67 -1.58 0.10 0.00 0.00 175.35 174.87 2b4k s TRP 428 N -3.01 3.85 -0.16 1.78 0.52 -1.26 0.85 118.94 121.51 2b4k s TRP 428 Ca 0.12 1.45 0.00 0.00 0.02 0.00 0.00 56.10 57.70 2b4k s TRP 428 Cb 0.00 -2.63 0.00 0.00 -1.15 0.00 0.00 33.47 29.70 2b4k s TRP 428 CO -0.00 0.54 -0.16 -0.51 0.02 0.00 0.00 176.95 176.84 2b4k s ASP 429 N -1.16 3.56 -0.40 2.95 1.01 0.14 -4.87 116.67 117.90 2b4k s ASP 429 Ca 0.33 -0.50 -0.13 0.00 0.71 0.00 0.00 52.55 52.95 2b4k s ASP 429 Cb -0.21 -1.55 0.03 0.00 1.01 0.00 0.00 42.92 42.20 2b4k s ASP 429 CO 0.23 0.07 0.27 -0.31 0.21 0.00 0.00 175.17 175.64 2b4k s TYR 430 N 0.88 3.25 -0.36 4.23 2.02 -1.26 -1.65 117.35 124.46 2b4k s TYR 430 Ca -0.04 -0.78 -0.10 0.00 -0.37 0.00 0.00 57.07 55.77 2b4k s TYR 430 Cb -0.15 -2.59 0.02 0.00 -0.40 0.00 0.00 41.96 38.84 2b4k s TYR 430 CO -0.02 -0.64 0.18 0.71 -1.57 0.00 0.00 175.55 174.22 2b4k s TYR 431 N 1.62 3.23 0.18 2.71 4.12 -0.33 -4.97 117.35 123.92 2b4k s TYR 431 Ca 0.04 -0.96 -0.13 0.00 0.02 0.00 0.00 57.07 56.03 2b4k s TYR 431 Cb -0.20 -2.40 0.17 0.00 -1.52 0.00 0.00 41.96 38.01 2b4k s TYR 431 CO 0.08 -0.63 1.73 -0.09 0.02 0.00 0.00 175.55 176.67 2b4k h ARG 432 N 8.39 0.26 -3.74 -0.62 2.43 -1.93 -1.07 114.38 118.10 2b4k h ARG 432 Ca -0.26 -0.02 -0.53 0.00 -0.81 0.00 0.00 59.98 58.36 2b4k h ARG 432 Cb 1.11 -0.06 -0.39 0.00 -0.42 0.00 0.00 29.97 30.21 2b4k h ARG 432 CO 0.65 0.17 -0.77 0.45 -1.51 0.00 0.00 179.97 178.96 2b4k s SER 433 N -5.34 2.89 0.01 -3.80 0.15 -1.26 -1.95 113.70 104.39 2b4k s SER 433 Ca -0.13 -0.77 0.03 0.00 0.70 0.00 0.00 55.95 55.77 2b4k s SER 433 Cb 0.15 -0.69 -0.01 0.00 -1.71 0.00 0.00 66.02 63.75 2b4k s SER 433 CO 0.72 -0.27 -0.08 0.86 1.20 0.00 0.00 173.24 175.67 2b4k s TRP 434 N 1.78 0.71 0.54 3.44 -0.00 -1.26 -4.07 118.94 120.09 2b4k s TRP 434 Ca -0.01 -0.21 -0.08 0.00 -0.00 0.00 0.00 56.10 55.81 2b4k s TRP 434 Cb -0.17 -0.45 -0.04 0.00 -0.00 0.00 0.00 33.47 32.82 2b4k s TRP 434 CO -0.07 -0.02 0.89 -2.14 -0.00 0.00 0.00 176.95 175.61 2b4k s PRO 435 N -0.49 3.55 0.13 5.86 0.02 -1.26 -4.85 135.00 137.95 2b4k s PRO 435 Ca 0.01 0.42 0.13 0.00 0.02 0.00 0.00 61.00 61.58 2b4k s PRO 435 Cb -0.04 -2.25 -0.10 0.00 0.02 0.00 0.00 34.50 32.12 2b4k s PRO 435 CO -0.00 -0.37 1.10 0.66 -0.33 0.00 0.00 177.00 178.06 2b4k h SER 436 N -0.01 0.00 -4.38 2.53 4.64 -1.84 -3.43 113.55 111.06 2b4k h SER 436 Ca -0.46 0.00 -0.62 0.00 -0.47 0.00 0.00 61.79 60.25 2b4k h SER 436 Cb 1.20 0.00 -0.30 0.00 -0.31 0.00 0.00 62.40 62.99 2b4k h SER 436 CO 0.62 0.72 -0.86 0.68 -0.87 0.00 0.00 176.83 177.11 2b4k s VAL 437 N -2.84 1.68 0.14 0.95 -7.23 -1.26 -0.89 120.40 110.95 2b4k s VAL 437 Ca -0.00 -0.90 -0.18 0.00 -1.81 0.00 0.00 61.98 59.09 2b4k s VAL 437 Cb 0.09 -1.40 0.06 0.00 0.56 0.00 0.00 36.38 35.68 2b4k s VAL 437 CO 0.79 0.48 0.85 0.00 -0.31 0.00 0.00 175.10 176.91 2b4k h GLU 439 N 0.00 0.49 -3.53 0.00 5.08 -1.93 -3.28 114.58 111.41 2b4k h GLU 439 Ca -0.22 -0.23 -0.38 0.00 -1.00 0.00 0.00 59.36 57.53 2b4k h GLU 439 Cb 0.97 -0.00 -0.37 0.00 0.50 0.00 0.00 28.75 29.84 2b4k h GLU 439 CO 0.29 0.79 -0.75 -1.12 -1.00 0.00 0.00 179.01 177.22 2b4k s SER 440 N -6.22 1.04 0.00 1.42 0.01 -1.26 -4.87 113.70 103.82 2b4k s SER 440 Ca -0.13 0.01 0.00 0.00 1.31 0.00 0.00 55.95 57.13 2b4k s SER 440 Cb 0.07 -0.24 0.00 0.00 0.21 0.00 0.00 66.02 66.06 2b4k s SER 440 CO 0.78 -0.19 0.00 0.59 0.41 0.00 0.00 173.24 174.82 2b4k n ASN 441 N 4.92 0.00 -4.89 2.44 4.13 -1.26 -5.05 115.26 115.55 2b4k n ASN 441 Ca -0.11 0.00 -0.30 0.00 1.68 0.00 0.00 54.58 55.85 2b4k n ASN 441 Cb 0.50 0.00 0.03 0.00 -1.54 0.00 0.00 39.78 38.77 2b4k n ASN 441 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2b4k h THR 443 N -0.38 0.79 -1.24 0.00 2.02 -1.54 -3.44 112.91 109.12 2b4k h THR 443 Ca -0.45 -0.15 -0.64 0.00 0.77 0.00 0.00 66.41 65.94 2b4k h THR 443 Cb 1.23 0.31 -0.13 0.00 -1.74 0.00 0.00 68.15 67.82 2b4k h THR 443 CO 0.62 0.08 -0.51 -0.83 0.37 0.00 0.00 175.52 175.25 2b4k s GLY 444 N -3.13 2.89 0.38 2.16 0.00 -0.07 -5.02 107.32 104.54 2b4k s GLY 444 Ca -0.13 -0.68 0.08 0.00 0.00 0.00 0.00 44.72 43.99 2b4k s GLY 444 CO 0.75 -2.06 0.29 -0.32 0.00 0.00 0.00 173.10 171.76 2b4k s GLY 445 N -3.78 2.05 0.53 0.20 0.00 -1.26 -1.82 107.32 103.25 2b4k s GLY 445 Ca 0.12 -1.86 -0.18 0.00 0.00 0.00 0.00 44.72 42.80 2b4k s GLY 445 CO 0.07 -1.71 1.05 1.08 0.00 0.00 0.00 173.10 173.59 2b4k s LEU 446 N -4.01 3.70 -0.35 0.66 1.43 -1.24 -4.56 118.68 114.32 2b4k s LEU 446 Ca 0.43 1.90 -0.09 0.00 -1.03 0.00 0.00 54.13 55.34 2b4k s LEU 446 Cb -0.03 -4.55 0.02 0.00 0.03 0.00 0.00 46.19 41.67 2b4k s LEU 446 CO 0.26 -0.96 0.15 -0.89 0.23 0.00 0.00 176.35 175.14 2b4k s THR 447 N -2.16 4.28 -0.00 5.49 2.01 0.17 -4.88 115.64 120.55 2b4k s THR 447 Ca 0.66 -0.85 -0.30 0.00 0.31 0.00 0.00 61.69 61.51 2b4k s THR 447 Cb -0.17 -3.35 -0.07 0.00 0.01 0.00 0.00 72.50 68.93 2b4k s THR 447 CO 0.27 -0.14 1.62 -2.84 -0.69 0.00 0.00 174.62 172.84 2b4k s PRO 448 N 1.51 4.20 -0.58 4.92 0.02 -1.26 -1.50 135.00 142.31 2b4k s PRO 448 Ca 0.01 2.21 -0.17 0.00 0.02 0.00 0.00 61.00 63.08 2b4k s PRO 448 Cb -0.19 -3.79 0.13 0.00 0.02 0.00 0.00 34.50 30.68 2b4k s PRO 448 CO 0.05 -0.77 0.58 -1.17 -0.33 0.00 0.00 177.00 175.37 2b4k s LEU 449 N 3.29 6.02 0.34 -5.54 2.96 0.05 -4.61 118.68 121.19 2b4k s LEU 449 Ca 0.72 -1.78 -0.27 0.00 -0.22 0.00 0.00 54.13 52.59 2b4k s LEU 449 Cb -0.35 -2.24 -0.09 0.00 0.50 0.00 0.00 46.19 44.01 2b4k s LEU 449 CO 0.30 -0.90 1.09 -0.31 -1.32 0.00 0.00 176.35 175.21 2b4k s TYR 450 N 1.77 3.40 0.31 5.38 2.02 0.13 -1.75 117.35 128.62 2b4k s TYR 450 Ca 0.07 1.66 -0.22 0.00 -0.37 0.00 0.00 57.07 58.21 2b4k s TYR 450 Cb -0.27 -3.24 -0.09 0.00 -0.40 0.00 0.00 41.96 37.96 2b4k s TYR 450 CO 0.03 -0.68 0.85 -0.51 -1.57 0.00 0.00 175.55 173.67 2b4k s LEU 451 N -2.02 4.22 0.09 -1.29 1.02 -0.76 -0.75 118.68 119.20 2b4k s LEU 451 Ca 0.51 1.60 -0.04 0.00 0.02 0.00 0.00 54.13 56.22 2b4k s LEU 451 Cb -0.28 -4.00 -0.03 0.00 0.02 0.00 0.00 46.19 41.90 2b4k s LEU 451 CO 0.36 -0.12 0.09 0.00 0.02 0.00 0.00 176.35 176.70 2b4k s ALA 452 N -1.75 0.32 0.44 4.21 0.00 -0.01 -4.20 121.76 120.76 2b4k s ALA 452 Ca 0.51 -1.07 -0.25 0.00 0.00 0.00 0.00 51.96 51.15 2b4k s ALA 452 Cb -0.15 0.54 -0.08 0.00 0.00 0.00 0.00 23.12 23.43 2b4k s ALA 452 CO 0.20 -0.47 1.37 0.16 0.00 0.00 0.00 175.76 177.02 2b4k s ASP 453 N -2.94 6.03 0.00 0.00 1.47 -1.26 -2.43 116.67 117.54 2b4k s ASP 453 Ca 0.12 2.79 0.00 0.00 1.18 0.00 0.00 52.55 56.64 2b4k s ASP 453 Cb 0.06 -2.65 0.00 0.00 -0.34 0.00 0.00 42.92 40.00 2b4k s ASP 453 CO -0.06 -1.06 0.00 0.61 0.68 0.00 0.00 175.17 175.34 2b4k n GLY 454 N 0.62 1.00 3.70 2.12 0.00 -1.26 -4.35 105.19 107.02 2b4k n GLY 454 Ca 0.05 -0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.83 2b4k n GLY 454 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2b4k n HIS 455 N -2.00 -2.31 -4.70 1.61 8.25 -1.13 -4.97 115.22 109.97 2b4k n HIS 455 Ca 0.00 0.92 -0.31 0.00 -0.26 0.00 0.00 57.72 58.07 2b4k n HIS 455 Cb 0.00 -4.53 -0.08 0.00 1.12 0.00 0.00 29.99 26.50 2b4k n HIS 455 CO 0.00 0.00 0.00 0.20 0.64 0.00 0.00 176.34 177.18 2b4k s GLY 456 N -3.79 2.90 -0.03 -1.41 0.00 -1.02 -1.88 107.32 102.11 2b4k s GLY 456 Ca 0.35 -0.67 0.02 0.00 0.00 0.00 0.00 44.72 44.42 2b4k s GLY 456 CO 0.79 -2.11 -0.08 1.08 0.00 0.00 0.00 173.10 172.78 2b4k s LEU 457 N -3.80 1.74 0.00 0.66 1.43 -1.06 -0.83 118.68 116.82 2b4k s LEU 457 Ca 0.11 -0.17 -0.08 0.00 -1.03 0.00 0.00 54.13 52.97 2b4k s LEU 457 Cb 0.02 -0.51 0.00 0.00 0.03 0.00 0.00 46.19 45.74 2b4k s LEU 457 CO 0.06 0.05 0.14 -0.55 0.23 0.00 0.00 176.35 176.28 2b4k s SER 458 N 0.28 0.02 0.00 2.29 0.15 0.07 -4.49 113.70 112.02 2b4k s SER 458 Ca -0.04 -0.21 0.30 0.00 0.70 0.00 0.00 55.95 56.70 2b4k s SER 458 Cb -0.09 0.21 1.70 0.00 -1.71 0.00 0.00 66.02 66.13 2b4k s SER 458 CO 0.00 -0.38 2.11 0.49 1.20 0.00 0.00 173.24 176.66 2b4k n PHE 459 N 1.41 0.00 -3.51 3.44 3.01 -1.26 -0.69 117.46 119.86 2b4k n PHE 459 Ca -0.23 -0.00 -0.42 0.00 1.01 0.00 0.00 57.45 57.81 2b4k n PHE 459 Cb 0.56 0.00 -0.09 0.00 -0.01 0.00 0.00 39.48 39.94 2b4k n PHE 459 CO 0.00 0.00 0.00 0.99 1.01 0.00 0.00 176.76 178.76 2b4k s THR 460 N -2.00 4.61 -0.48 4.37 2.01 -1.26 -4.83 115.64 118.06 2b4k s THR 460 Ca 0.45 -1.34 -0.43 0.00 0.31 0.00 0.00 61.69 60.68 2b4k s THR 460 Cb 0.21 -3.83 -0.18 0.00 0.01 0.00 0.00 72.50 68.71 2b4k s THR 460 CO 0.35 -0.58 2.08 1.57 -0.69 0.00 0.00 174.62 177.35 2b4k n HIS 461 N 5.03 1.29 -1.72 4.92 -0.00 -1.26 -4.81 115.22 118.67 2b4k n HIS 461 Ca -0.11 0.76 -0.43 0.00 0.46 0.00 0.00 57.72 58.40 2b4k n HIS 461 Cb 0.43 -2.31 -0.03 0.00 -0.12 0.00 0.00 29.99 27.96 2b4k n HIS 461 CO 0.00 0.00 0.00 -2.14 0.46 0.00 0.00 176.34 174.66 2b4k s PRO 462 N 5.63 3.45 0.16 1.57 0.02 -1.26 -4.87 135.00 139.70 2b4k s PRO 462 Ca 1.17 2.06 -0.15 0.00 0.02 0.00 0.00 61.00 64.10 2b4k s PRO 462 Cb -1.43 -4.27 0.05 0.00 0.02 0.00 0.00 34.50 28.88 2b4k s PRO 462 CO 0.66 -1.74 1.79 0.00 -0.33 0.00 0.00 177.00 177.39 2b4k h ALA 463 N 13.37 0.52 -2.61 -1.55 0.00 -1.95 -2.04 119.26 125.00 2b4k h ALA 463 Ca -0.41 -0.00 -0.50 0.00 0.00 0.00 0.00 54.91 53.99 2b4k h ALA 463 Cb 1.22 -0.10 0.06 0.00 0.00 0.00 0.00 17.79 18.97 2b4k h ALA 463 CO 0.97 -0.10 0.45 0.00 0.00 0.00 0.00 179.25 180.56 2b4k s ALA 464 N -6.15 2.86 0.69 0.00 0.00 -1.26 -3.72 121.76 114.18 2b4k s ALA 464 Ca -0.13 0.84 -0.11 0.00 0.00 0.00 0.00 51.96 52.56 2b4k s ALA 464 Cb 0.12 -3.35 0.00 0.00 0.00 0.00 0.00 23.12 19.89 2b4k s ALA 464 CO 0.72 -0.64 1.08 -0.51 0.00 0.00 0.00 175.76 176.41 2b4k s ASP 465 N -1.59 5.55 0.00 0.00 1.01 -1.26 -3.22 116.67 117.16 2b4k s ASP 465 Ca 0.67 1.27 0.00 0.00 0.71 0.00 0.00 52.55 55.20 2b4k s ASP 465 Cb -0.25 -2.14 0.00 0.00 1.01 0.00 0.00 42.92 41.54 2b4k s ASP 465 CO 0.30 -1.29 0.00 0.61 0.21 0.00 0.00 175.17 175.00 2b4k n GLY 466 N -2.75 0.59 3.56 0.21 0.00 -0.59 -4.94 105.19 101.27 2b4k n GLY 466 Ca 0.07 -0.82 -0.15 0.00 0.00 0.00 0.00 46.02 45.11 2b4k n GLY 466 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2b4k s ALA 467 N -2.00 -1.82 -0.03 4.61 0.00 -1.26 -0.22 121.76 121.04 2b4k s ALA 467 Ca 0.00 1.53 0.05 0.00 0.00 0.00 0.00 51.96 53.54 2b4k s ALA 467 Cb 0.00 -0.44 -0.01 0.00 0.00 0.00 0.00 23.12 22.67 2b4k s ALA 467 CO 0.00 -0.34 -0.18 -0.51 0.00 0.00 0.00 175.76 174.73 2b4k s ASP 468 N -0.80 2.15 0.28 0.00 -0.00 -0.81 -4.95 116.67 112.54 2b4k s ASP 468 Ca -0.06 -0.34 0.10 0.00 -0.00 0.00 0.00 52.55 52.24 2b4k s ASP 468 Cb -0.01 -0.44 -0.05 0.00 -0.00 0.00 0.00 42.92 42.42 2b4k s ASP 468 CO 0.06 0.18 -0.05 -0.44 -0.00 0.00 0.00 175.17 174.92 2b4k s SER 469 N -0.17 4.23 0.09 0.27 0.01 -1.26 -0.08 113.70 116.79 2b4k s SER 469 Ca 0.01 -0.81 -0.17 0.00 1.31 0.00 0.00 55.95 56.29 2b4k s SER 469 Cb -0.10 -0.64 0.04 0.00 0.21 0.00 0.00 66.02 65.53 2b4k s SER 469 CO 0.01 -0.04 0.42 -0.72 0.41 0.00 0.00 173.24 173.32 2b4k s TYR 470 N -2.41 -0.24 -0.35 2.43 -0.85 0.56 -4.94 117.35 111.54 2b4k s TYR 470 Ca 0.32 0.05 -0.07 0.00 -0.52 0.00 0.00 57.07 56.84 2b4k s TYR 470 Cb -0.05 0.26 0.04 0.00 0.38 0.00 0.00 41.96 42.59 2b4k s TYR 470 CO 0.19 -0.66 0.14 0.08 -1.52 0.00 0.00 175.55 173.78 2b4k s VAL 471 N -3.26 3.91 -0.64 -3.49 1.01 -1.26 -0.32 120.40 116.35 2b4k s VAL 471 Ca -0.00 -1.15 -0.23 0.00 0.00 0.00 0.00 61.98 60.59 2b4k s VAL 471 Cb 0.01 -3.24 0.06 0.00 0.00 0.00 0.00 36.38 33.21 2b4k s VAL 471 CO -0.08 -0.23 0.96 -0.55 0.00 0.00 0.00 175.10 175.20 2b4k s SER 472 N 1.51 6.20 -0.38 3.32 0.15 -0.91 -4.50 113.70 119.08 2b4k s SER 472 Ca -0.01 -0.86 -0.14 0.00 0.70 0.00 0.00 55.95 55.64 2b4k s SER 472 Cb -0.20 -2.42 0.00 0.00 -1.71 0.00 0.00 66.02 61.69 2b4k s SER 472 CO 0.03 -1.40 0.28 -0.62 1.20 0.00 0.00 173.24 172.73 2b4k s ASP 473 N 3.51 6.09 0.50 5.45 3.68 -1.26 -2.90 116.67 131.74 2b4k s ASP 473 Ca 0.24 -0.68 0.34 0.00 2.13 0.00 0.00 52.55 54.57 2b4k s ASP 473 Cb -0.16 -2.15 1.74 0.00 -1.45 0.00 0.00 42.92 40.90 2b4k s ASP 473 CO 0.12 -0.36 2.02 -0.65 0.13 0.00 0.00 175.17 176.43 2b4k h PRO 474 N 8.57 0.00 0.00 4.34 0.11 -1.92 -0.52 132.00 142.58 2b4k h PRO 474 Ca -0.29 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.82 2b4k h PRO 474 Cb 1.14 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.25 2b4k h PRO 474 CO 0.69 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 178.48 2b4k n ALA 475 N -1.95 2.11 -3.24 -0.75 0.00 -1.26 -3.95 120.51 111.47 2b4k n ALA 475 Ca -0.02 0.01 -0.25 0.00 0.00 0.00 0.00 53.44 53.18 2b4k n ALA 475 Cb 0.10 -1.45 -0.08 0.00 0.00 0.00 0.00 19.45 18.03 2b4k n ALA 475 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 2b4k n HIS 476 N -2.26 -0.37 -2.54 0.00 8.25 -0.21 -5.13 115.22 112.97 2b4k n HIS 476 Ca 0.05 -3.53 -0.35 0.00 -0.26 0.00 0.00 57.72 53.63 2b4k n HIS 476 Cb 0.38 -0.24 -0.04 0.00 1.12 0.00 0.00 29.99 31.21 2b4k n HIS 476 CO 0.00 0.00 0.00 -1.25 0.64 0.00 0.00 176.34 175.73 2b4k s PRO 477 N -0.97 3.88 -0.01 -0.41 0.04 -1.22 -4.64 135.00 131.67 2b4k s PRO 477 Ca 0.35 1.40 -0.30 0.00 0.04 0.00 0.00 61.00 62.49 2b4k s PRO 477 Cb 0.14 -2.20 -0.05 0.00 0.04 0.00 0.00 34.50 32.43 2b4k s PRO 477 CO -0.13 -0.37 1.45 0.08 0.04 0.00 0.00 177.00 178.08 2b4k s VAL 478 N -1.90 3.68 0.13 -0.36 1.01 -1.26 -4.77 120.40 116.93 2b4k s VAL 478 Ca 0.65 1.02 -0.31 0.00 0.00 0.00 0.00 61.98 63.34 2b4k s VAL 478 Cb -0.18 -3.66 -0.09 0.00 0.00 0.00 0.00 36.38 32.46 2b4k s VAL 478 CO 0.22 -0.02 1.47 -2.84 0.00 0.00 0.00 175.10 173.93 2b4k s PRO 479 N 2.73 4.27 0.42 2.72 0.02 -1.26 0.70 135.00 144.60 2b4k s PRO 479 Ca 0.65 2.20 0.14 0.00 0.02 0.00 0.00 61.00 64.01 2b4k s PRO 479 Cb -0.32 -3.23 0.91 0.00 0.02 0.00 0.00 34.50 31.89 2b4k s PRO 479 CO 0.26 -0.52 1.94 0.27 -0.33 0.00 0.00 177.00 178.63 2b4k h PHE 480 N 6.86 0.01 -3.64 6.54 -0.00 -0.89 -3.43 116.94 122.39 2b4k h PHE 480 Ca -0.42 -0.00 -0.15 0.00 -0.00 0.00 0.00 57.97 57.40 2b4k h PHE 480 Cb 1.21 -0.00 -0.21 0.00 -0.00 0.00 0.00 35.95 36.95 2b4k h PHE 480 CO 0.66 0.24 -0.55 0.96 -0.00 0.00 0.00 178.31 179.63 2b4k s ILE 481 N -4.52 0.09 0.23 0.88 -4.36 -1.26 -5.04 121.20 107.22 2b4k s ILE 481 Ca -0.04 -0.76 -0.25 0.00 -0.26 0.00 0.00 60.65 59.35 2b4k s ILE 481 Cb 0.15 -0.40 -0.16 0.00 1.25 0.00 0.00 42.46 43.31 2b4k s ILE 481 CO 0.71 -0.42 0.39 -1.20 0.24 0.00 0.00 174.94 174.66 2b4k n SER 482 N 1.47 -1.53 -4.81 4.36 7.64 -1.26 -4.78 113.62 114.71 2b4k n SER 482 Ca -0.23 0.99 -0.34 0.00 1.01 0.00 0.00 58.87 60.30 2b4k n SER 482 Cb 0.55 -0.88 -0.06 0.00 -1.01 0.00 0.00 64.21 62.82 2b4k n SER 482 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 2b4k s ARG 483 N -0.94 4.17 -0.03 1.43 0.52 -1.26 -4.05 118.95 118.79 2b4k s ARG 483 Ca 0.59 1.23 -0.09 0.00 -0.52 0.00 0.00 55.73 56.94 2b4k s ARG 483 Cb -0.81 -2.26 -0.05 0.00 0.52 0.00 0.00 34.95 32.35 2b4k s ARG 483 CO 0.54 -0.09 0.28 -1.25 0.02 0.00 0.00 175.30 174.79 2b4k s PRO 484 N -3.01 3.65 -0.07 3.54 0.04 -1.26 -5.19 135.00 132.70 2b4k s PRO 484 Ca 0.61 0.07 0.03 0.00 0.04 0.00 0.00 61.00 61.76 2b4k s PRO 484 Cb -0.13 -3.15 0.01 0.00 0.04 0.00 0.00 34.50 31.27 2b4k s PRO 484 CO 0.17 0.70 -0.16 0.12 0.04 0.00 0.00 177.00 177.87 2b4k s PHE 485 N -1.15 1.77 -0.05 0.56 5.36 -1.26 -4.99 117.98 118.22 2b4k s PHE 485 Ca 0.23 -0.65 0.05 0.00 -0.96 0.00 0.00 56.93 55.59 2b4k s PHE 485 Cb -0.14 -1.24 -0.02 0.00 -0.34 0.00 0.00 43.02 41.28 2b4k s PHE 485 CO 0.12 -0.29 -0.18 0.00 -1.46 0.00 0.00 175.22 173.40 2b4k s ALA 486 N 0.48 2.50 0.32 11.12 0.00 -1.26 -1.21 121.76 133.72 2b4k s ALA 486 Ca -0.14 -1.01 0.29 0.00 0.00 0.00 0.00 51.96 51.10 2b4k s ALA 486 Cb -0.16 -0.86 1.61 0.00 0.00 0.00 0.00 23.12 23.71 2b4k s ALA 486 CO 0.05 0.51 1.89 0.74 0.00 0.00 0.00 175.76 178.95 2b4k h PHE 487 N 5.55 0.00 0.00 0.00 -1.00 -1.96 0.15 116.94 119.68 2b4k h PHE 487 Ca -0.43 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.35 2b4k h PHE 487 Cb 1.15 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.71 2b4k h PHE 487 CO 0.47 0.00 0.00 0.00 -1.61 0.00 0.00 178.31 177.17 2b4k h ALA 488 N 1.69 1.00 -0.80 2.45 0.00 -1.98 -3.40 119.26 118.23 2b4k h ALA 488 Ca 0.00 0.00 -0.62 0.00 0.00 0.00 0.00 54.91 54.29 2b4k h ALA 488 Cb 0.27 0.00 -0.07 0.00 0.00 0.00 0.00 17.79 17.99 2b4k h ALA 488 CO 0.00 0.00 2.01 -0.65 0.00 0.00 0.00 179.25 180.61 2b4k s GLN 489 N -3.29 3.73 0.35 0.00 -0.21 0.53 -4.77 119.66 116.00 2b4k s GLN 489 Ca 0.06 -1.85 0.03 0.00 0.02 0.00 0.00 55.36 53.62 2b4k s GLN 489 Cb 0.08 -5.49 0.63 0.00 1.00 0.00 0.00 33.01 29.23 2b4k s GLN 489 CO 0.60 -2.55 1.95 0.66 -2.12 0.00 0.00 175.29 173.83 2b4k h SER 490 N 7.96 0.62 -0.25 5.90 4.64 -1.85 -1.61 113.55 128.95 2b4k h SER 490 Ca 0.41 -0.06 0.07 0.00 -0.47 0.00 0.00 61.79 61.74 2b4k h SER 490 Cb 0.88 -0.16 -0.01 0.00 -0.31 0.00 0.00 62.40 62.81 2b4k h SER 490 CO 1.42 0.54 0.26 0.77 -0.87 0.00 0.00 176.83 178.94 2b4k h SER 491 N 0.69 0.00 0.04 4.97 4.64 -1.97 -1.41 113.55 120.51 2b4k h SER 491 Ca 0.17 0.00 -0.33 0.00 -0.47 0.00 0.00 61.79 61.16 2b4k h SER 491 Cb 0.09 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 62.12 2b4k h SER 491 CO -0.02 0.00 -2.30 0.54 -0.87 0.00 0.00 176.83 174.18 2b4k n ARG 492 N -3.87 0.68 -0.05 4.77 1.74 -0.72 -4.50 116.66 114.72 2b4k n ARG 492 Ca 0.03 -0.00 -0.16 0.00 -0.77 0.00 0.00 57.85 56.96 2b4k n ARG 492 Cb 0.40 -1.54 -0.05 0.00 -1.02 0.00 0.00 32.46 30.25 2b4k n ARG 492 CO 0.00 0.00 0.00 2.35 -1.52 0.00 0.00 177.63 178.46 2b4k h TRP 493 N 0.00 1.07 0.12 -1.55 2.91 -0.54 -3.17 115.95 114.79 2b4k h TRP 493 Ca -0.48 -0.42 0.01 0.00 1.13 0.00 0.00 58.89 59.13 2b4k h TRP 493 Cb 2.12 -0.19 -0.02 0.00 -0.51 0.00 0.00 29.16 30.56 2b4k h TRP 493 CO 0.00 1.25 -0.19 0.87 -1.03 0.00 0.00 178.44 179.34 2b4k h LYS 494 N 0.61 -0.35 -0.67 2.65 1.57 -1.51 -3.02 116.57 115.85 2b4k h LYS 494 Ca -0.01 0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.79 2b4k h LYS 494 Cb 1.26 0.08 0.00 0.00 0.08 0.00 0.00 32.23 33.65 2b4k h LYS 494 CO 0.14 -0.23 0.00 -0.35 -0.57 0.00 0.00 179.45 178.43 2b4k n PRO 495 N -5.31 3.77 0.29 3.15 -0.04 -1.26 -4.54 135.00 131.06 2b4k n PRO 495 Ca -0.07 -2.36 0.15 0.00 -0.04 0.00 0.00 63.50 61.19 2b4k n PRO 495 Cb 0.23 -2.01 0.90 0.00 -0.04 0.00 0.00 33.50 32.58 2b4k n PRO 495 CO 0.00 0.00 0.00 0.11 -0.04 0.00 0.00 175.50 175.57 2b4k h TRP 496 N 3.08 0.00 0.00 0.54 5.08 -1.50 -2.68 115.95 120.47 2b4k h TRP 496 Ca 0.00 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.97 2b4k h TRP 496 Cb 1.52 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 27.68 2b4k h TRP 496 CO 0.78 0.00 0.00 -0.07 -1.28 0.00 0.00 178.44 177.87 2b4k h LEU 497 N 0.00 0.00 -2.58 0.11 3.38 -1.84 -2.90 115.31 111.48 2b4k h LEU 497 Ca 0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.98 2b4k h LEU 497 Cb 0.06 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.81 2b4k h LEU 497 CO -0.00 0.00 0.00 1.33 0.09 0.00 0.00 178.44 179.86 2b4k n VAL 498 N -2.45 0.79 -1.74 1.22 0.24 -1.01 -4.65 118.33 110.73 2b4k n VAL 498 Ca 0.03 -0.89 -0.36 0.00 -2.04 0.00 0.00 64.34 61.08 2b4k n VAL 498 Cb 0.32 0.67 0.06 0.00 -1.47 0.00 0.00 33.84 33.41 2b4k n VAL 498 CO 0.00 0.00 0.00 -1.10 -2.14 0.00 0.00 176.83 173.59 2b4k s GLN 499 N -1.03 2.57 0.05 7.34 -1.52 -1.10 -4.71 119.66 121.26 2b4k s GLN 499 Ca 0.26 1.89 -0.31 0.00 -1.95 0.00 0.00 55.36 55.25 2b4k s GLN 499 Cb 0.14 -1.87 -0.07 0.00 -0.22 0.00 0.00 33.01 30.99 2b4k s GLN 499 CO 0.19 -1.53 1.53 0.34 -0.25 0.00 0.00 175.29 175.57 2b4k s ASP 500 N -1.66 6.71 -0.47 5.90 3.68 -1.26 -4.48 116.67 125.10 2b4k s ASP 500 Ca 0.78 2.33 -0.01 0.00 2.13 0.00 0.00 52.55 57.79 2b4k s ASP 500 Cb -0.33 -2.56 0.38 0.00 -1.45 0.00 0.00 42.92 38.96 2b4k s ASP 500 CO 0.39 -0.80 1.96 0.00 0.13 0.00 0.00 175.17 176.85 2b4k n GLN 501 N 5.33 2.21 0.00 4.34 1.13 -0.60 -4.31 117.38 125.48 2b4k n GLN 501 Ca 0.14 -2.46 -0.11 0.00 -1.94 0.00 0.00 57.00 52.64 2b4k n GLN 501 Cb 0.42 -1.96 -0.14 0.00 0.11 0.00 0.00 30.24 28.67 2b4k n GLN 501 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2b4k h ARG 502 N 1.55 0.06 -0.09 -1.09 3.08 -1.91 -3.22 114.38 112.75 2b4k h ARG 502 Ca 0.47 -0.11 -0.00 0.00 0.07 0.00 0.00 59.98 60.41 2b4k h ARG 502 Cb 1.19 0.04 -0.00 0.00 0.08 0.00 0.00 29.97 31.28 2b4k h ARG 502 CO 1.14 0.71 0.05 1.49 -1.07 0.00 0.00 179.97 182.29 2b4k h GLU 503 N 0.02 0.12 -0.61 0.04 4.81 -2.00 -2.43 114.58 114.53 2b4k h GLU 503 Ca -0.27 -0.01 0.04 0.00 -0.13 0.00 0.00 59.36 59.00 2b4k h GLU 503 Cb 1.99 -0.03 -0.05 0.00 0.63 0.00 0.00 28.75 31.30 2b4k h GLU 503 CO 0.09 0.12 0.34 0.00 -0.73 0.00 0.00 179.01 178.84 2b4k h ALA 504 N 0.99 0.80 -0.44 2.92 0.00 -1.88 -2.18 119.26 119.47 2b4k h ALA 504 Ca 0.03 0.01 0.07 0.00 0.00 0.00 0.00 54.91 55.02 2b4k h ALA 504 Cb 0.03 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 2b4k h ALA 504 CO -0.01 0.03 0.30 1.49 0.00 0.00 0.00 179.25 181.07 2b4k h GLU 505 N 0.65 0.27 0.00 0.00 4.81 -1.48 -0.40 114.58 118.43 2b4k h GLU 505 Ca 0.26 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.48 2b4k h GLU 505 Cb 0.12 -0.06 0.00 0.00 0.63 0.00 0.00 28.75 29.44 2b4k h GLU 505 CO -0.15 0.18 0.00 -1.13 -0.73 0.00 0.00 179.01 177.18 2b4k n SER 506 N -4.47 0.00 -4.83 1.04 3.41 -0.82 -4.82 113.62 103.12 2b4k n SER 506 Ca 0.06 -0.04 -0.35 0.00 -0.26 0.00 0.00 58.87 58.28 2b4k n SER 506 Cb 0.31 -0.31 -0.06 0.00 -0.26 0.00 0.00 64.21 63.90 2b4k n SER 506 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 2b4k s ARG 507 N -2.61 4.09 0.00 4.33 0.52 -0.16 -4.97 118.95 120.14 2b4k s ARG 507 Ca 0.25 0.65 0.26 0.00 -0.52 0.00 0.00 55.73 56.37 2b4k s ARG 507 Cb 0.18 -2.86 1.22 0.00 0.52 0.00 0.00 34.95 34.01 2b4k s ARG 507 CO 0.43 0.41 1.85 -0.35 0.02 0.00 0.00 175.30 177.66 2b4k n PRO 508 N 0.64 0.21 -0.96 3.54 -0.04 -1.26 -3.34 135.00 133.79 2b4k n PRO 508 Ca -0.03 0.05 -0.10 0.00 -0.04 0.00 0.00 63.50 63.38 2b4k n PRO 508 Cb 0.52 -1.50 0.22 0.00 -0.04 0.00 0.00 33.50 32.70 2b4k n PRO 508 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 2b4k n ASP 509 N -1.38 3.57 -3.51 3.54 3.85 -1.26 -4.07 116.55 117.28 2b4k n ASP 509 Ca 0.10 -3.52 -0.21 0.00 -0.71 0.00 0.00 54.79 50.44 2b4k n ASP 509 Cb 0.25 -0.72 -0.14 0.00 -1.35 0.00 0.00 41.12 39.16 2b4k n ASP 509 CO 0.00 0.00 0.00 -0.69 -1.01 0.00 0.00 177.20 175.50 2b4k s VAL 510 N -3.17 -0.25 0.14 2.12 1.01 -1.21 -4.51 120.40 114.54 2b4k s VAL 510 Ca 0.51 -0.26 -0.29 0.00 0.00 0.00 0.00 61.98 61.94 2b4k s VAL 510 Cb 0.43 -0.73 -0.07 0.00 0.00 0.00 0.00 36.38 36.01 2b4k s VAL 510 CO 0.07 -0.33 0.91 0.54 0.00 0.00 0.00 175.10 176.30 2b4k s VAL 511 N 2.26 4.40 -0.03 2.92 0.11 -0.69 -4.83 120.40 124.54 2b4k s VAL 511 Ca 0.06 1.98 0.02 0.00 -2.93 0.00 0.00 61.98 61.11 2b4k s VAL 511 Cb -0.16 -4.28 0.01 0.00 -1.53 0.00 0.00 36.38 30.42 2b4k s VAL 511 CO -0.17 0.40 -0.07 -0.89 -3.33 0.00 0.00 175.10 171.04 2b4k s THR 512 N -0.46 0.63 0.02 5.04 2.01 -1.26 -1.08 115.64 120.54 2b4k s THR 512 Ca 0.43 -0.26 0.06 0.00 0.31 0.00 0.00 61.69 62.23 2b4k s THR 512 Cb -0.24 -0.59 -0.02 0.00 0.01 0.00 0.00 72.50 71.67 2b4k s THR 512 CO 0.29 0.21 -0.19 -0.31 -0.69 0.00 0.00 174.62 173.94 2b4k s TYR 513 N 0.33 1.63 0.01 4.92 1.51 0.41 -4.81 117.35 121.36 2b4k s TYR 513 Ca -0.05 -0.34 -0.09 0.00 -1.01 0.00 0.00 57.07 55.58 2b4k s TYR 513 Cb -0.09 -1.00 0.01 0.00 -0.11 0.00 0.00 41.96 40.76 2b4k s TYR 513 CO 0.00 0.04 0.19 -1.83 -1.11 0.00 0.00 175.55 172.84 2b4k s GLU 514 N -0.89 0.60 0.64 -0.62 -1.05 -0.79 -0.04 118.70 116.55 2b4k s GLU 514 Ca 0.06 -0.45 -0.06 0.00 -0.15 0.00 0.00 54.97 54.37 2b4k s GLU 514 Cb -0.08 0.25 0.03 0.00 -0.44 0.00 0.00 34.13 33.89 2b4k s GLU 514 CO 0.01 -0.16 0.95 0.95 0.95 0.00 0.00 175.26 177.96 2b4k s THR 515 N -1.82 3.06 0.60 1.83 -4.23 -0.17 -2.56 115.64 112.36 2b4k s THR 515 Ca -0.11 -0.12 -0.17 0.00 -1.18 0.00 0.00 61.69 60.12 2b4k s THR 515 Cb -0.05 -3.26 -0.03 0.00 1.34 0.00 0.00 72.50 70.51 2b4k s THR 515 CO 0.00 -0.27 1.09 -1.61 -0.54 0.00 0.00 174.62 173.30 2b4k s GLU 516 N -5.10 3.14 -0.35 3.99 2.02 -1.26 -4.61 118.70 116.54 2b4k s GLU 516 Ca 0.57 1.39 -0.39 0.00 0.02 0.00 0.00 54.97 56.55 2b4k s GLU 516 Cb -0.11 -2.00 -0.14 0.00 0.10 0.00 0.00 34.13 31.98 2b4k s GLU 516 CO 0.45 -0.98 2.00 0.28 0.02 0.00 0.00 175.26 177.03 2b4k n VAL 517 N -1.96 0.21 -1.64 2.63 0.31 -1.26 -4.74 118.33 111.88 2b4k n VAL 517 Ca 0.10 -0.13 -0.47 0.00 -0.01 0.00 0.00 64.34 63.83 2b4k n VAL 517 Cb 0.52 -1.28 -0.04 0.00 -0.91 0.00 0.00 33.84 32.13 2b4k n VAL 517 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 2b4k n LEU 518 N 7.61 2.56 -0.06 7.52 4.77 0.54 -4.80 117.00 135.13 2b4k n LEU 518 Ca 0.37 1.12 -0.20 0.00 -0.03 0.00 0.00 56.01 57.27 2b4k n LEU 518 Cb 0.14 -1.35 -0.13 0.00 -2.33 0.00 0.00 43.42 39.76 2b4k n LEU 518 CO 0.80 -0.68 -0.35 0.44 -1.33 0.00 0.00 177.39 176.28 2b4k h ASP 519 N 4.62 0.15 -4.19 -1.43 5.19 -1.90 -2.35 116.42 116.51 2b4k h ASP 519 Ca -0.45 -0.73 -0.58 0.00 -0.62 0.00 0.00 57.03 54.65 2b4k h ASP 519 Cb 1.29 -0.05 -0.23 0.00 0.18 0.00 0.00 39.33 40.52 2b4k h ASP 519 CO 0.79 1.47 -0.84 -1.83 -3.12 0.00 0.00 179.24 175.71 2b4k s GLU 520 N -2.39 1.24 0.46 3.56 -1.05 -1.26 -4.82 118.70 114.44 2b4k s GLU 520 Ca -0.24 -1.12 -0.24 0.00 -0.15 0.00 0.00 54.97 53.23 2b4k s GLU 520 Cb 0.04 -1.48 -0.07 0.00 -0.44 0.00 0.00 34.13 32.18 2b4k s GLU 520 CO 0.68 0.36 1.27 -1.25 0.95 0.00 0.00 175.26 177.26 2b4k s PRO 521 N -1.70 3.69 -0.19 -4.83 0.04 -1.26 -4.75 135.00 125.99 2b4k s PRO 521 Ca 0.07 2.05 -0.05 0.00 0.04 0.00 0.00 61.00 63.11 2b4k s PRO 521 Cb -0.10 -2.52 -0.03 0.00 0.04 0.00 0.00 34.50 31.90 2b4k s PRO 521 CO 0.04 -0.69 0.01 0.08 0.04 0.00 0.00 177.00 176.48 2b4k s VAL 522 N -1.36 4.13 -0.16 -0.36 1.01 -0.81 -4.96 120.40 117.88 2b4k s VAL 522 Ca 0.63 -0.26 -0.07 0.00 0.00 0.00 0.00 61.98 62.28 2b4k s VAL 522 Cb -0.36 -2.86 -0.04 0.00 0.00 0.00 0.00 36.38 33.12 2b4k s VAL 522 CO 0.44 0.43 0.07 -0.60 0.00 0.00 0.00 175.10 175.44 2b4k s ARG 523 N 0.85 3.77 -0.02 2.72 3.52 -1.26 -1.08 118.95 127.45 2b4k s ARG 523 Ca 0.01 -0.32 0.03 0.00 -0.13 0.00 0.00 55.73 55.33 2b4k s ARG 523 Cb -0.14 -3.16 -0.00 0.00 -1.56 0.00 0.00 34.95 30.09 2b4k s ARG 523 CO 0.02 0.41 -0.10 0.14 -0.81 0.00 0.00 175.30 174.96 2b4k s VAL 524 N -0.01 0.84 -0.24 7.11 -7.23 -0.61 -1.22 120.40 119.03 2b4k s VAL 524 Ca 0.06 -0.43 -0.06 0.00 -1.81 0.00 0.00 61.98 59.75 2b4k s VAL 524 Cb -0.12 -0.73 0.12 0.00 0.56 0.00 0.00 36.38 36.22 2b4k s VAL 524 CO 0.01 0.25 0.48 -0.55 -0.31 0.00 0.00 175.10 174.98 2b4k s SER 525 N -0.05 -0.49 0.00 4.85 0.15 -0.24 -1.34 113.70 116.57 2b4k s SER 525 Ca 0.01 0.92 0.00 0.00 0.70 0.00 0.00 55.95 57.58 2b4k s SER 525 Cb -0.06 1.61 0.00 0.00 -1.71 0.00 0.00 66.02 65.86 2b4k s SER 525 CO 0.00 -0.25 0.00 0.61 1.20 0.00 0.00 173.24 174.80 2b4k n GLY 526 N 5.40 0.99 3.42 9.45 0.00 -0.36 -4.65 105.19 119.44 2b4k n GLY 526 Ca -0.07 -1.89 -0.40 0.00 0.00 0.00 0.00 46.02 43.66 2b4k n GLY 526 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2b4k s VAL 527 N -2.69 4.73 0.53 1.61 1.01 -1.26 -0.53 120.40 123.81 2b4k s VAL 527 Ca 0.00 -0.63 -0.20 0.00 0.00 0.00 0.00 61.98 61.15 2b4k s VAL 527 Cb 0.00 -3.54 -0.06 0.00 0.00 0.00 0.00 36.38 32.77 2b4k s VAL 527 CO 0.00 -0.12 1.12 -2.84 0.00 0.00 0.00 175.10 173.26 2b4k s PRO 528 N 1.60 3.42 -0.02 2.72 0.02 -1.26 -4.68 135.00 136.80 2b4k s PRO 528 Ca 0.04 1.59 0.06 0.00 0.02 0.00 0.00 61.00 62.70 2b4k s PRO 528 Cb -0.18 -2.03 -0.01 0.00 0.02 0.00 0.00 34.50 32.30 2b4k s PRO 528 CO 0.07 -0.79 -0.19 0.08 -0.33 0.00 0.00 177.00 175.84 2b4k s VAL 529 N -1.79 1.51 -0.47 3.83 1.01 -0.32 -1.00 120.40 123.18 2b4k s VAL 529 Ca 0.72 -0.81 -0.19 0.00 0.00 0.00 0.00 61.98 61.71 2b4k s VAL 529 Cb -0.23 -1.26 0.04 0.00 0.00 0.00 0.00 36.38 34.93 2b4k s VAL 529 CO 0.26 0.43 0.56 0.00 0.00 0.00 0.00 175.10 176.35 2b4k s ALA 530 N -0.35 3.40 -0.68 5.51 0.00 0.11 0.73 121.76 130.48 2b4k s ALA 530 Ca 0.05 -1.61 -0.16 0.00 0.00 0.00 0.00 51.96 50.23 2b4k s ALA 530 Cb -0.08 -3.24 0.15 0.00 0.00 0.00 0.00 23.12 19.95 2b4k s ALA 530 CO -0.00 -1.83 0.70 0.34 0.00 0.00 0.00 175.76 174.97 2b4k s ASP 531 N 2.31 6.41 -0.13 0.00 2.15 0.18 -2.59 116.67 125.00 2b4k s ASP 531 Ca 0.15 -2.01 0.01 0.00 0.43 0.00 0.00 52.55 51.14 2b4k s ASP 531 Cb -0.18 -2.25 -0.01 0.00 -0.30 0.00 0.00 42.92 40.18 2b4k s ASP 531 CO 0.13 -0.86 -0.18 -0.22 -0.17 0.00 0.00 175.17 173.88 2b4k s LEU 532 N 1.53 2.42 -0.54 -1.34 2.96 0.12 0.53 118.68 124.36 2b4k s LEU 532 Ca 0.13 -0.45 -0.03 0.00 -0.22 0.00 0.00 54.13 53.56 2b4k s LEU 532 Cb -0.20 -1.53 0.14 0.00 0.50 0.00 0.00 46.19 45.11 2b4k s LEU 532 CO -0.01 0.14 0.35 -0.36 -1.32 0.00 0.00 176.35 175.14 2b4k s PHE 533 N 0.50 3.47 0.07 5.38 0.08 -1.26 0.36 117.98 126.58 2b4k s PHE 533 Ca -0.12 -2.62 0.05 0.00 0.12 0.00 0.00 56.93 54.36 2b4k s PHE 533 Cb -0.16 -3.20 -0.03 0.00 -0.57 0.00 0.00 43.02 39.06 2b4k s PHE 533 CO 0.05 -0.89 -0.14 0.00 -0.10 0.00 0.00 175.22 174.14 2b4k s ALA 534 N 0.38 1.12 0.03 5.36 0.00 -0.67 -1.50 121.76 126.48 2b4k s ALA 534 Ca 0.14 -0.97 0.08 0.00 0.00 0.00 0.00 51.96 51.20 2b4k s ALA 534 Cb -0.21 -0.09 -0.02 0.00 0.00 0.00 0.00 23.12 22.80 2b4k s ALA 534 CO -0.04 0.15 -0.22 0.00 0.00 0.00 0.00 175.76 175.66 2b4k s ALA 535 N -1.27 1.85 0.03 0.00 0.00 -0.13 -1.93 121.76 120.30 2b4k s ALA 535 Ca -0.03 -1.07 0.07 0.00 0.00 0.00 0.00 51.96 50.93 2b4k s ALA 535 Cb -0.10 -0.38 -0.02 0.00 0.00 0.00 0.00 23.12 22.61 2b4k s ALA 535 CO 0.02 0.43 -0.22 -0.08 0.00 0.00 0.00 175.76 175.91 2b4k s THR 536 N -0.75 1.73 -1.21 0.00 -1.32 -1.26 -0.07 115.64 112.75 2b4k s THR 536 Ca 0.08 -1.17 0.19 0.00 -1.21 0.00 0.00 61.69 59.58 2b4k s THR 536 Cb -0.09 -1.49 0.24 0.00 -1.51 0.00 0.00 72.50 69.65 2b4k s THR 536 CO 0.01 0.28 1.59 -1.54 -2.21 0.00 0.00 174.62 172.75 2b4k n SER 537 N 1.96 0.00 -0.88 8.08 3.41 -0.35 -0.99 113.62 124.86 2b4k n SER 537 Ca -0.17 0.26 0.00 0.00 -0.26 0.00 0.00 58.87 58.70 2b4k n SER 537 Cb 0.53 -0.39 0.00 0.00 -0.26 0.00 0.00 64.21 64.09 2b4k n SER 537 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2b4k n GLY 538 N 0.37 1.45 0.32 5.00 0.00 -1.26 -4.50 105.19 106.57 2b4k n GLY 538 Ca 0.07 -1.99 0.05 0.00 0.00 0.00 0.00 46.02 44.14 2b4k n GLY 538 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2b4k n THR 539 N -0.29 0.00 -3.67 2.61 -2.24 0.77 -3.93 114.28 107.53 2b4k n THR 539 Ca 0.00 -0.46 -0.10 0.00 -2.27 0.00 0.00 64.05 61.22 2b4k n THR 539 Cb 0.00 1.17 -0.04 0.00 -2.10 0.00 0.00 70.33 69.36 2b4k n THR 539 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2b4k s ASP 540 N -1.02 -0.24 -0.27 3.42 -1.08 -0.80 -0.06 116.67 116.63 2b4k s ASP 540 Ca 0.10 -0.38 -0.28 0.00 -0.52 0.00 0.00 52.55 51.47 2b4k s ASP 540 Cb 0.08 0.50 0.17 0.00 -1.46 0.00 0.00 42.92 42.22 2b4k s ASP 540 CO 0.17 -0.91 1.29 -0.44 0.52 0.00 0.00 175.17 175.80 2b4k s SER 541 N -2.83 -0.14 -0.10 -0.34 0.01 -1.26 -4.10 113.70 104.94 2b4k s SER 541 Ca 0.05 0.19 -0.06 0.00 1.31 0.00 0.00 55.95 57.45 2b4k s SER 541 Cb 0.01 0.17 -0.04 0.00 0.21 0.00 0.00 66.02 66.37 2b4k s SER 541 CO -0.09 -0.10 0.13 -1.81 0.41 0.00 0.00 173.24 171.78 2b4k s ASP 542 N -0.65 6.22 -0.24 2.44 1.01 -1.26 0.96 116.67 125.15 2b4k s ASP 542 Ca 0.06 0.41 0.02 0.00 0.71 0.00 0.00 52.55 53.75 2b4k s ASP 542 Cb -0.02 -1.98 0.05 0.00 1.01 0.00 0.00 42.92 41.98 2b4k s ASP 542 CO -0.08 0.39 -0.13 0.26 0.21 0.00 0.00 175.17 175.82 2b4k s TRP 543 N -1.04 3.12 -0.27 4.23 0.52 0.22 -4.15 118.94 121.56 2b4k s TRP 543 Ca 0.16 -2.09 -0.10 0.00 0.02 0.00 0.00 56.10 54.10 2b4k s TRP 543 Cb -0.12 -1.94 -0.04 0.00 -1.15 0.00 0.00 33.47 30.22 2b4k s TRP 543 CO 0.05 -0.85 0.16 0.08 0.02 0.00 0.00 176.95 176.41 2b4k s VAL 544 N 1.17 5.06 -0.11 4.03 1.01 0.27 -0.32 120.40 131.50 2b4k s VAL 544 Ca -0.04 0.08 0.01 0.00 0.00 0.00 0.00 61.98 62.02 2b4k s VAL 544 Cb -0.18 -3.40 -0.02 0.00 0.00 0.00 0.00 36.38 32.79 2b4k s VAL 544 CO -0.07 0.28 -0.13 -0.69 0.00 0.00 0.00 175.10 174.48 2b4k s VAL 545 N 1.70 3.05 -0.19 2.92 1.01 -0.59 -2.07 120.40 126.23 2b4k s VAL 545 Ca 0.07 -0.68 0.01 0.00 0.00 0.00 0.00 61.98 61.38 2b4k s VAL 545 Cb -0.16 -2.26 0.04 0.00 0.00 0.00 0.00 36.38 34.00 2b4k s VAL 545 CO 0.09 0.54 -0.11 -0.54 0.00 0.00 0.00 175.10 175.08 2b4k s LYS 546 N 0.15 2.05 -0.24 2.72 1.02 0.35 -2.10 119.74 123.69 2b4k s LYS 546 Ca -0.07 -0.79 -0.20 0.00 0.02 0.00 0.00 55.97 54.93 2b4k s LYS 546 Cb -0.15 -2.36 -0.02 0.00 -0.52 0.00 0.00 37.83 34.78 2b4k s LYS 546 CO 0.05 -0.40 0.61 -1.17 -0.92 0.00 0.00 175.35 173.52 2b4k s LEU 547 N 1.42 4.08 0.03 3.17 2.96 0.24 -1.59 118.68 128.98 2b4k s LEU 547 Ca -0.00 0.71 0.07 0.00 -0.22 0.00 0.00 54.13 54.68 2b4k s LEU 547 Cb -0.16 -2.83 -0.02 0.00 0.50 0.00 0.00 46.19 43.68 2b4k s LEU 547 CO -0.09 -0.33 -0.19 -0.63 -1.32 0.00 0.00 176.35 173.79 2b4k s ILE 548 N 2.33 1.53 -0.39 6.68 1.01 0.18 -1.45 121.20 131.09 2b4k s ILE 548 Ca 0.26 -1.08 -0.10 0.00 0.00 0.00 0.00 60.65 59.74 2b4k s ILE 548 Cb -0.16 -1.33 0.05 0.00 0.01 0.00 0.00 42.46 41.04 2b4k s ILE 548 CO 0.09 0.22 0.21 -0.62 0.00 0.00 0.00 174.94 174.84 2b4k s ASP 549 N -1.01 5.63 -0.13 3.58 3.68 0.31 -0.61 116.67 128.11 2b4k s ASP 549 Ca 0.06 -1.24 -0.29 0.00 2.13 0.00 0.00 52.55 53.21 2b4k s ASP 549 Cb -0.08 -1.98 -0.01 0.00 -1.45 0.00 0.00 42.92 39.40 2b4k s ASP 549 CO 0.01 -0.44 1.02 -0.69 0.13 0.00 0.00 175.17 175.20 2b4k s VAL 550 N 1.48 4.75 0.80 1.11 1.01 -0.67 -1.91 120.40 126.96 2b4k s VAL 550 Ca 0.02 2.03 -0.11 0.00 0.00 0.00 0.00 61.98 63.92 2b4k s VAL 550 Cb -0.21 -4.31 0.07 0.00 0.00 0.00 0.00 36.38 31.94 2b4k s VAL 550 CO 0.04 -0.04 1.09 -1.10 0.00 0.00 0.00 175.10 175.09 2b4k s GLN 551 N 2.30 2.06 0.39 2.72 -1.52 0.23 -2.61 119.66 123.24 2b4k s GLN 551 Ca 0.47 1.11 -0.25 0.00 -1.95 0.00 0.00 55.36 54.75 2b4k s GLN 551 Cb -0.18 -1.88 -0.11 0.00 -0.22 0.00 0.00 33.01 30.62 2b4k s GLN 551 CO 0.15 -1.77 1.02 -2.30 -0.25 0.00 0.00 175.29 172.14 2b4k n PRO 552 N -3.60 1.38 -0.35 2.91 -0.02 -1.26 -3.57 135.00 130.50 2b4k n PRO 552 Ca 0.09 0.49 0.09 0.00 -2.02 0.00 0.00 63.50 62.15 2b4k n PRO 552 Cb 0.53 -2.01 0.20 0.00 -0.02 0.00 0.00 33.50 32.20 2b4k n PRO 552 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2b4k h ALA 553 N 1.67 0.86 -3.78 3.55 0.00 -1.92 0.43 119.26 120.07 2b4k h ALA 553 Ca -0.44 0.37 -0.49 0.00 0.00 0.00 0.00 54.91 54.35 2b4k h ALA 553 Cb 1.34 0.69 -0.31 0.00 0.00 0.00 0.00 17.79 19.50 2b4k h ALA 553 CO 0.58 -0.46 -0.81 -1.64 0.00 0.00 0.00 179.25 176.92 2b4k s MET 554 N -6.16 1.37 -0.57 0.00 -1.94 -1.26 -2.76 119.30 107.99 2b4k s MET 554 Ca -0.14 -0.43 0.04 0.00 -1.71 0.00 0.00 55.69 53.45 2b4k s MET 554 Cb 0.28 -1.22 0.15 0.00 2.01 0.00 0.00 34.83 36.05 2b4k s MET 554 CO 0.78 0.14 0.36 0.95 -0.01 0.00 0.00 175.02 177.25 2b4k s THR 555 N 0.22 2.20 0.54 2.05 -4.23 -1.26 -4.92 115.64 110.24 2b4k s THR 555 Ca -0.05 -3.48 0.23 0.00 -1.18 0.00 0.00 61.69 57.21 2b4k s THR 555 Cb -0.11 -2.48 0.36 0.00 1.34 0.00 0.00 72.50 71.60 2b4k s THR 555 CO 0.02 -0.96 2.05 1.55 -0.54 0.00 0.00 174.62 176.74 2b4k h PRO 556 N 5.98 0.00 -0.05 3.99 0.13 -1.98 0.37 132.00 140.45 2b4k h PRO 556 Ca 0.07 0.00 -0.17 0.00 -0.87 0.00 0.00 66.00 65.03 2b4k h PRO 556 Cb 0.84 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.96 2b4k h PRO 556 CO 0.62 0.00 -0.71 -0.44 -0.23 0.00 0.00 178.00 177.24 2b4k h ASP 557 N 0.00 0.31 -2.22 1.44 3.32 -2.06 -3.37 116.42 113.84 2b4k h ASP 557 Ca 0.16 -0.20 -0.57 0.00 0.02 0.00 0.00 57.03 56.43 2b4k h ASP 557 Cb 0.65 -0.09 -0.38 0.00 0.22 0.00 0.00 39.33 39.74 2b4k h ASP 557 CO -0.00 0.92 -1.00 -0.67 -1.72 0.00 0.00 179.24 176.76 2b4k n ASP 558 N -3.80 -0.38 -0.33 6.45 2.03 -0.46 -5.03 116.55 115.03 2b4k n ASP 558 Ca -0.03 -2.47 0.22 0.00 0.52 0.00 0.00 54.79 53.02 2b4k n ASP 558 Cb 0.69 -0.52 0.44 0.00 -0.72 0.00 0.00 41.12 41.01 2b4k n ASP 558 CO 0.00 0.00 0.00 -0.65 -1.92 0.00 0.00 177.20 174.63 2b4k h PRO 559 N 5.16 0.26 -0.11 -0.67 0.11 -1.16 -1.38 132.00 134.21 2b4k h PRO 559 Ca 0.21 -0.02 0.03 0.00 0.11 0.00 0.00 66.00 66.34 2b4k h PRO 559 Cb 0.91 -0.06 -0.00 0.00 0.11 0.00 0.00 31.00 31.95 2b4k h PRO 559 CO 0.39 0.17 0.15 1.57 -0.21 0.00 0.00 178.00 180.07 2b4k h LYS 560 N 0.27 0.00 0.00 1.05 2.10 -1.96 -0.99 116.57 117.04 2b4k h LYS 560 Ca 0.70 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.35 2b4k h LYS 560 Cb 1.57 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.90 2b4k h LYS 560 CO -0.64 0.00 -0.09 -1.33 -2.00 0.00 0.00 179.45 175.39 2b4k n MET 561 N -3.66 0.16 -1.49 0.07 2.81 -0.52 -4.73 117.12 109.76 2b4k n MET 561 Ca -0.00 0.11 -0.49 0.00 -1.81 0.00 0.00 57.70 55.51 2b4k n MET 561 Cb 0.25 -1.67 -0.06 0.00 -0.71 0.00 0.00 33.22 31.03 2b4k n MET 561 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2b4k n GLY 562 N 1.39 0.63 2.63 3.03 0.00 -0.38 -0.67 105.19 111.83 2b4k n GLY 562 Ca 0.06 0.90 0.00 0.00 0.00 0.00 0.00 46.02 46.98 2b4k n GLY 562 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2b4k n GLY 563 N 6.29 0.62 3.66 -0.02 0.00 0.14 -4.86 105.19 111.02 2b4k n GLY 563 Ca 0.38 0.00 -0.48 0.00 0.00 0.00 0.00 46.02 45.92 2b4k n GLY 563 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 2b4k n TYR 564 N -2.44 2.09 -3.01 1.61 9.36 0.16 -4.54 117.16 120.38 2b4k n TYR 564 Ca 0.00 0.33 -0.44 0.00 3.32 0.00 0.00 57.90 61.10 2b4k n TYR 564 Cb 0.04 -2.51 -0.03 0.00 -0.63 0.00 0.00 39.34 36.22 2b4k n TYR 564 CO 0.00 0.00 0.00 -1.21 0.22 0.00 0.00 176.86 175.87 2b4k s GLU 565 N 1.50 3.55 -0.27 2.98 2.02 -1.26 -0.60 118.70 126.61 2b4k s GLU 565 Ca 0.84 -1.83 -0.16 0.00 0.02 0.00 0.00 54.97 53.84 2b4k s GLU 565 Cb -0.77 -4.76 -0.03 0.00 0.10 0.00 0.00 34.13 28.67 2b4k s GLU 565 CO 0.44 -1.67 0.44 -1.17 0.02 0.00 0.00 175.26 173.32 2b4k s LEU 566 N 2.28 4.07 -0.18 1.80 2.96 -0.80 -1.56 118.68 127.24 2b4k s LEU 566 Ca 0.28 0.35 -0.27 0.00 -0.22 0.00 0.00 54.13 54.27 2b4k s LEU 566 Cb -0.07 -2.53 -0.01 0.00 0.50 0.00 0.00 46.19 44.08 2b4k s LEU 566 CO -0.08 -0.25 0.94 -2.16 -1.32 0.00 0.00 176.35 173.48 2b4k s PRO 567 N 2.19 4.30 0.05 0.98 0.04 -1.26 0.11 135.00 141.41 2b4k s PRO 567 Ca 0.18 1.20 0.18 0.00 0.04 0.00 0.00 61.00 62.60 2b4k s PRO 567 Cb -0.16 -3.59 -0.14 0.00 0.04 0.00 0.00 34.50 30.65 2b4k s PRO 567 CO 0.10 -0.44 0.76 1.33 0.04 0.00 0.00 177.00 178.79 2b4k n VAL 568 N 4.92 0.98 -3.65 -0.36 0.24 -0.53 -4.74 118.33 115.19 2b4k n VAL 568 Ca 0.08 -0.66 -0.10 0.00 -2.04 0.00 0.00 64.34 61.62 2b4k n VAL 568 Cb 0.48 -0.57 -0.08 0.00 -1.47 0.00 0.00 33.84 32.20 2b4k n VAL 568 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 2b4k s SER 569 N -5.55 -0.79 0.03 -1.34 0.15 -1.07 -4.91 113.70 100.22 2b4k s SER 569 Ca -0.04 1.35 -0.28 0.00 0.70 0.00 0.00 55.95 57.69 2b4k s SER 569 Cb 0.09 1.27 0.07 0.00 -1.71 0.00 0.00 66.02 65.74 2b4k s SER 569 CO 0.82 -0.23 0.66 0.00 1.20 0.00 0.00 173.24 175.69 2b4k s MET 570 N 1.21 1.13 0.19 5.44 0.23 -1.26 0.79 119.30 127.02 2b4k s MET 570 Ca -0.07 -0.04 -0.23 0.00 -1.03 0.00 0.00 55.69 54.31 2b4k s MET 570 Cb -0.05 0.53 0.05 0.00 -1.53 0.00 0.00 34.83 33.82 2b4k s MET 570 CO -0.12 -0.42 0.77 0.34 -2.03 0.00 0.00 175.02 173.56 2b4k s ASP 571 N -1.83 -0.32 0.07 -1.18 3.68 -0.89 -4.59 116.67 111.60 2b4k s ASP 571 Ca -0.06 -0.35 0.07 0.00 2.13 0.00 0.00 52.55 54.35 2b4k s ASP 571 Cb -0.00 0.60 -0.04 0.00 -1.45 0.00 0.00 42.92 42.03 2b4k s ASP 571 CO 0.00 -1.07 -0.16 -0.51 0.13 0.00 0.00 175.17 173.56 2b4k s ILE 572 N -3.64 2.94 -0.07 4.11 2.07 -1.26 -1.55 121.20 123.80 2b4k s ILE 572 Ca 0.08 -1.27 -0.01 0.00 -1.41 0.00 0.00 60.65 58.04 2b4k s ILE 572 Cb -0.03 -2.29 0.03 0.00 0.13 0.00 0.00 42.46 40.29 2b4k s ILE 572 CO -0.01 0.23 0.00 0.12 -1.91 0.00 0.00 174.94 173.38 2b4k s PHE 573 N -1.04 0.65 -0.29 3.50 5.36 0.57 -4.45 117.98 122.28 2b4k s PHE 573 Ca 0.17 -0.15 -0.29 0.00 -0.96 0.00 0.00 56.93 55.69 2b4k s PHE 573 Cb -0.11 -0.77 0.01 0.00 -0.34 0.00 0.00 43.02 41.80 2b4k s PHE 573 CO 0.08 -0.31 1.22 0.50 -1.46 0.00 0.00 175.22 175.25 2b4k s ARG 574 N 1.89 4.00 0.41 10.12 3.52 -1.09 0.70 118.95 138.50 2b4k s ARG 574 Ca 0.04 1.23 0.13 0.00 -0.13 0.00 0.00 55.73 57.00 2b4k s ARG 574 Cb -0.12 -3.82 0.99 0.00 -1.56 0.00 0.00 34.95 30.44 2b4k s ARG 574 CO -0.05 -1.00 1.93 0.78 -0.81 0.00 0.00 175.30 176.15 2b4k h GLY 575 N 10.48 0.75 1.90 8.12 0.00 0.25 -2.37 103.07 122.20 2b4k h GLY 575 Ca -0.24 -0.20 0.00 0.00 0.00 0.00 0.00 47.33 46.89 2b4k h GLY 575 CO 1.03 0.09 0.03 -0.96 0.00 0.00 0.00 176.54 176.73 2b4k n ARG 576 N -4.48 0.11 -0.69 4.80 1.85 -1.26 -1.08 116.66 115.90 2b4k n ARG 576 Ca 0.13 0.61 0.02 0.00 -1.00 0.00 0.00 57.85 57.61 2b4k n ARG 576 Cb 0.45 -1.91 0.27 0.00 -1.05 0.00 0.00 32.46 30.23 2b4k n ARG 576 CO 0.00 0.00 0.00 0.66 -0.01 0.00 0.00 177.63 178.28 2b4k n TYR 577 N -2.11 1.44 -0.37 2.89 4.02 -0.89 -1.89 117.16 120.24 2b4k n TYR 577 Ca -0.01 -1.09 -0.01 0.00 -0.01 0.00 0.00 57.90 56.78 2b4k n TYR 577 Cb 0.06 -0.46 0.13 0.00 -0.02 0.00 0.00 39.34 39.05 2b4k n TYR 577 CO 0.00 0.00 0.00 -0.09 -1.01 0.00 0.00 176.86 175.76 2b4k h ARG 578 N 2.02 1.26 0.07 -0.72 2.43 -1.28 -3.27 114.38 114.90 2b4k h ARG 578 Ca 0.11 -0.08 -0.37 0.00 -0.81 0.00 0.00 59.98 58.83 2b4k h ARG 578 Cb 1.76 -0.28 -0.04 0.00 -0.42 0.00 0.00 29.97 30.99 2b4k h ARG 578 CO 0.41 0.83 -2.14 1.63 -1.51 0.00 0.00 179.97 179.19 2b4k n LYS 579 N -4.42 0.71 -3.60 0.20 5.02 -1.26 -4.94 118.16 109.87 2b4k n LYS 579 Ca 0.13 0.24 -0.13 0.00 -2.02 0.00 0.00 58.31 56.53 2b4k n LYS 579 Cb 0.07 -1.64 -0.12 0.00 -0.02 0.00 0.00 35.03 33.32 2b4k n LYS 579 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 2b4k s ASP 580 N -6.87 0.42 0.58 4.39 3.68 -1.23 -5.00 116.67 112.64 2b4k s ASP 580 Ca -0.27 0.48 0.31 0.00 2.13 0.00 0.00 52.55 55.19 2b4k s ASP 580 Cb 0.08 0.78 1.78 0.00 -1.45 0.00 0.00 42.92 44.11 2b4k s ASP 580 CO 0.70 -0.26 2.22 -0.26 0.13 0.00 0.00 175.17 177.70 2b4k h PHE 581 N 8.27 0.00 0.13 -5.34 0.04 -1.92 -2.48 116.94 115.63 2b4k h PHE 581 Ca -0.15 0.00 -0.31 0.00 2.80 0.00 0.00 57.97 60.31 2b4k h PHE 581 Cb 1.12 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 39.27 2b4k h PHE 581 CO 0.30 0.03 -1.54 0.00 -0.60 0.00 0.00 178.31 176.50 2b4k h ALA 582 N 1.97 0.25 -3.56 2.45 0.00 -1.93 0.35 119.26 118.79 2b4k h ALA 582 Ca -0.00 -1.10 -0.65 0.00 0.00 0.00 0.00 54.91 53.16 2b4k h ALA 582 Cb 0.09 0.28 -0.40 0.00 0.00 0.00 0.00 17.79 17.76 2b4k h ALA 582 CO 0.00 1.11 -0.70 0.15 0.00 0.00 0.00 179.25 179.82 2b4k s LYS 583 N -2.61 1.57 0.41 0.00 -0.14 -0.93 -4.52 119.74 113.52 2b4k s LYS 583 Ca -0.09 -2.05 -0.25 0.00 -1.36 0.00 0.00 55.97 52.22 2b4k s LYS 583 Cb 0.07 -3.15 -0.08 0.00 -1.68 0.00 0.00 37.83 32.98 2b4k s LYS 583 CO 0.86 -1.00 1.25 -1.25 -0.76 0.00 0.00 175.35 174.45 2b4k s PRO 584 N 0.59 3.97 -0.17 -1.68 0.04 -1.25 -4.25 135.00 132.25 2b4k s PRO 584 Ca 0.13 2.02 -0.13 0.00 0.04 0.00 0.00 61.00 63.05 2b4k s PRO 584 Cb -0.21 -2.70 0.05 0.00 0.04 0.00 0.00 34.50 31.68 2b4k s PRO 584 CO -0.06 -0.45 0.45 -2.00 0.04 0.00 0.00 177.00 174.98 2b4k s GLU 585 N -2.29 0.49 0.40 4.56 2.12 -0.79 -5.05 118.70 118.14 2b4k s GLU 585 Ca 0.58 0.71 -0.24 0.00 0.36 0.00 0.00 54.97 56.38 2b4k s GLU 585 Cb -0.35 0.15 -0.12 0.00 0.26 0.00 0.00 34.13 34.08 2b4k s GLU 585 CO 0.44 -0.10 0.85 0.00 -0.54 0.00 0.00 175.26 175.91 2b4k n ALA 586 N 3.40 -0.49 -1.90 6.30 0.00 -1.26 -4.64 120.51 121.92 2b4k n ALA 586 Ca -0.17 0.23 -0.32 0.00 0.00 0.00 0.00 53.44 53.17 2b4k n ALA 586 Cb 0.56 -1.96 -0.05 0.00 0.00 0.00 0.00 19.45 18.00 2b4k n ALA 586 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2b4k s LEU 587 N 0.36 3.81 -0.32 0.00 1.43 0.91 -5.01 118.68 119.87 2b4k s LEU 587 Ca 0.63 1.54 -0.29 0.00 -1.03 0.00 0.00 54.13 54.98 2b4k s LEU 587 Cb -0.59 -4.43 0.02 0.00 0.03 0.00 0.00 46.19 41.21 2b4k s LEU 587 CO 0.57 -0.44 1.09 -1.58 0.23 0.00 0.00 176.35 176.22 2b4k s GLN 588 N -3.59 4.05 0.27 1.70 0.74 -1.26 -4.60 119.66 116.97 2b4k s GLN 588 Ca 0.59 1.09 -0.30 0.00 0.05 0.00 0.00 55.36 56.78 2b4k s GLN 588 Cb -0.10 -3.75 -0.13 0.00 1.10 0.00 0.00 33.01 30.14 2b4k s GLN 588 CO 0.23 -0.92 1.42 -0.35 -0.55 0.00 0.00 175.29 175.12 2b4k n PRO 589 N 6.91 2.17 -0.95 1.67 -0.04 -1.25 -2.26 135.00 141.25 2b4k n PRO 589 Ca 0.12 0.77 0.00 0.00 -0.04 0.00 0.00 63.50 64.35 2b4k n PRO 589 Cb 0.47 -2.44 0.00 0.00 -0.04 0.00 0.00 33.50 31.49 2b4k n PRO 589 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 2b4k n ASP 590 N 1.92 -5.44 -4.83 3.54 8.00 -0.16 -4.96 116.55 114.61 2b4k n ASP 590 Ca 0.10 0.00 -0.37 0.00 0.71 0.00 0.00 54.79 55.23 2b4k n ASP 590 Cb 0.33 -3.39 -0.06 0.00 -0.02 0.00 0.00 41.12 37.97 2b4k n ASP 590 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2b4k s ALA 591 N -0.99 3.79 -0.18 2.24 0.00 -0.96 -4.90 121.76 120.76 2b4k s ALA 591 Ca 0.00 -0.57 -0.29 0.00 0.00 0.00 0.00 51.96 51.10 2b4k s ALA 591 Cb 0.00 -2.11 -0.02 0.00 0.00 0.00 0.00 23.12 20.99 2b4k s ALA 591 CO 0.00 0.47 1.39 0.99 0.00 0.00 0.00 175.76 178.61 2b4k s THR 592 N -0.65 4.05 0.14 0.00 2.01 -1.26 -4.27 115.64 115.65 2b4k s THR 592 Ca 0.15 1.24 0.09 0.00 0.31 0.00 0.00 61.69 63.48 2b4k s THR 592 Cb -0.13 -3.90 -0.04 0.00 0.01 0.00 0.00 72.50 68.44 2b4k s THR 592 CO 0.04 -0.22 -0.14 -0.76 -0.69 0.00 0.00 174.62 172.85 2b4k s LEU 593 N 4.03 2.85 -0.24 4.42 1.43 -0.81 -4.92 118.68 125.44 2b4k s LEU 593 Ca 0.61 -0.54 -0.16 0.00 -1.03 0.00 0.00 54.13 53.01 2b4k s LEU 593 Cb -0.23 -1.63 -0.03 0.00 0.03 0.00 0.00 46.19 44.33 2b4k s LEU 593 CO 0.21 0.15 0.42 -2.28 0.23 0.00 0.00 176.35 175.08 2b4k s HIS 594 N -1.35 3.29 -0.10 0.29 5.65 -1.26 -1.67 115.29 120.14 2b4k s HIS 594 Ca 0.21 0.54 0.02 0.00 0.25 0.00 0.00 55.06 56.08 2b4k s HIS 594 Cb -0.10 -2.60 -0.01 0.00 -1.18 0.00 0.00 32.58 28.69 2b4k s HIS 594 CO 0.12 -0.17 -0.16 0.71 -0.65 0.00 0.00 174.74 174.59 2b4k s TYR 595 N 1.89 2.71 -0.26 3.88 2.02 0.16 -5.01 117.35 122.73 2b4k s TYR 595 Ca 0.18 -0.61 -0.03 0.00 -0.37 0.00 0.00 57.07 56.24 2b4k s TYR 595 Cb -0.15 -1.75 0.09 0.00 -0.40 0.00 0.00 41.96 39.74 2b4k s TYR 595 CO 0.09 -0.16 0.10 -1.58 -1.57 0.00 0.00 175.55 172.43 2b4k s HIS 596 N 0.07 0.77 0.10 2.71 5.65 -1.25 -0.70 115.29 122.63 2b4k s HIS 596 Ca -0.07 -1.01 -0.01 0.00 0.25 0.00 0.00 55.06 54.23 2b4k s HIS 596 Cb -0.15 -1.10 -0.04 0.00 -1.18 0.00 0.00 32.58 30.11 2b4k s HIS 596 CO 0.05 -0.76 0.01 -0.59 -0.65 0.00 0.00 174.74 172.80 2b4k s PHE 597 N 1.94 0.75 -0.01 3.88 -0.12 -1.07 -4.98 117.98 118.37 2b4k s PHE 597 Ca 0.06 -1.14 -0.15 0.00 -0.05 0.00 0.00 56.93 55.65 2b4k s PHE 597 Cb -0.16 -0.46 -0.06 0.00 -0.63 0.00 0.00 43.02 41.71 2b4k s PHE 597 CO -0.25 -0.43 0.41 0.95 -0.05 0.00 0.00 175.22 175.85 2b4k s THR 598 N -3.96 5.04 0.18 -4.49 -4.23 -1.26 0.09 115.64 107.01 2b4k s THR 598 Ca 0.17 0.85 0.05 0.00 -1.18 0.00 0.00 61.69 61.57 2b4k s THR 598 Cb 0.08 -3.72 -0.04 0.00 1.34 0.00 0.00 72.50 70.16 2b4k s THR 598 CO -0.03 0.56 0.18 -0.76 -0.54 0.00 0.00 174.62 174.03 2b4k s LEU 599 N -0.95 3.89 0.16 4.79 1.43 -0.17 -4.92 118.68 122.91 2b4k s LEU 599 Ca 0.24 -0.11 -0.32 0.00 -1.03 0.00 0.00 54.13 52.90 2b4k s LEU 599 Cb -0.17 -2.47 -0.17 0.00 0.03 0.00 0.00 46.19 43.41 2b4k s LEU 599 CO 0.13 0.04 0.93 -2.65 0.23 0.00 0.00 176.35 175.03 2b4k n PRO 600 N -0.59 0.60 -1.12 1.29 -0.02 -1.26 -4.04 135.00 129.86 2b4k n PRO 600 Ca -0.08 0.21 -0.35 0.00 -2.02 0.00 0.00 63.50 61.26 2b4k n PRO 600 Cb 0.55 -1.54 0.10 0.00 -0.02 0.00 0.00 33.50 32.59 2b4k n PRO 600 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2b4k n ALA 601 N 0.89 -1.22 -2.28 3.55 0.00 -1.26 -4.50 120.51 115.69 2b4k n ALA 601 Ca 0.16 -0.35 -0.11 0.00 0.00 0.00 0.00 53.44 53.14 2b4k n ALA 601 Cb 0.22 -1.98 -0.10 0.00 0.00 0.00 0.00 19.45 17.59 2b4k n ALA 601 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 2b4k s VAL 602 N -2.07 0.74 -0.49 0.00 -7.23 0.31 -4.92 120.40 106.74 2b4k s VAL 602 Ca 0.66 -1.82 0.06 0.00 -1.81 0.00 0.00 61.98 59.08 2b4k s VAL 602 Cb -0.30 -1.55 0.22 0.00 0.56 0.00 0.00 36.38 35.31 2b4k s VAL 602 CO 0.57 -0.78 0.78 -3.20 -0.31 0.00 0.00 175.10 172.17 2b4k n ASN 603 N 0.17 -2.90 -4.24 4.85 5.15 -1.25 -1.22 115.26 115.82 2b4k n ASN 603 Ca -0.14 -3.08 -0.14 0.00 -0.60 0.00 0.00 54.58 50.63 2b4k n ASN 603 Cb 0.60 1.59 -0.10 0.00 -0.53 0.00 0.00 39.78 41.34 2b4k n ASN 603 CO 0.00 0.00 0.00 -2.28 1.40 0.00 0.00 177.26 176.38 2b4k s HIS 604 N 0.66 1.27 -0.13 1.20 2.46 -0.45 -1.57 115.29 118.73 2b4k s HIS 604 Ca 0.31 -1.26 -0.02 0.00 0.47 0.00 0.00 55.06 54.56 2b4k s HIS 604 Cb 0.12 -0.69 0.04 0.00 -0.13 0.00 0.00 32.58 31.93 2b4k s HIS 604 CO -0.16 -0.48 0.03 0.08 -2.47 0.00 0.00 174.74 171.74 2b4k s VAL 605 N -3.96 0.36 -0.96 0.89 1.01 -1.26 -1.57 120.40 114.91 2b4k s VAL 605 Ca 0.36 -0.16 -0.24 0.00 0.00 0.00 0.00 61.98 61.94 2b4k s VAL 605 Cb 0.07 -0.72 0.04 0.00 0.00 0.00 0.00 36.38 35.77 2b4k s VAL 605 CO 0.11 0.01 1.48 -0.36 0.00 0.00 0.00 175.10 176.34 2b4k s PHE 606 N 1.95 2.41 0.93 5.22 0.40 -0.24 -4.63 117.98 124.02 2b4k s PHE 606 Ca 0.02 -0.56 -0.12 0.00 -0.60 0.00 0.00 56.93 55.68 2b4k s PHE 606 Cb -0.15 -4.62 0.15 0.00 0.51 0.00 0.00 43.02 38.92 2b4k s PHE 606 CO -0.07 -1.95 1.09 0.00 0.70 0.00 0.00 175.22 175.00 2b4k s ALA 607 N 5.65 1.32 0.14 5.36 0.00 -1.26 -1.92 121.76 131.05 2b4k s ALA 607 Ca 0.47 -0.13 -0.34 0.00 0.00 0.00 0.00 51.96 51.96 2b4k s ALA 607 Cb -0.02 -3.18 -0.14 0.00 0.00 0.00 0.00 23.12 19.78 2b4k s ALA 607 CO -0.05 -2.54 1.59 1.17 0.00 0.00 0.00 175.76 175.93 2b4k n LYS 608 N -4.00 2.11 0.00 0.00 4.81 -1.26 -1.62 118.16 118.20 2b4k n LYS 608 Ca 0.06 0.76 0.00 0.00 -0.87 0.00 0.00 58.31 58.27 2b4k n LYS 608 Cb 0.56 -2.53 0.00 0.00 0.02 0.00 0.00 35.03 33.07 2b4k n LYS 608 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2b4k n GLY 609 N 3.44 2.92 1.56 3.14 0.00 -0.89 -4.96 105.19 110.41 2b4k n GLY 609 Ca 0.17 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.10 2b4k n GLY 609 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2b4k n HIS 610 N -1.81 -3.32 -3.84 1.61 8.25 -0.64 -3.98 115.22 111.49 2b4k n HIS 610 Ca 0.00 -0.67 -0.11 0.00 -0.26 0.00 0.00 57.72 56.68 2b4k n HIS 610 Cb 0.00 -0.31 -0.08 0.00 1.12 0.00 0.00 29.99 30.71 2b4k n HIS 610 CO 0.00 0.00 0.00 1.03 0.64 0.00 0.00 176.34 178.01 2b4k s ARG 611 N -3.58 0.69 -0.12 -0.41 0.52 -1.07 -0.34 118.95 114.64 2b4k s ARG 611 Ca 0.27 -0.59 -0.15 0.00 -0.52 0.00 0.00 55.73 54.74 2b4k s ARG 611 Cb -0.01 0.29 -0.05 0.00 0.52 0.00 0.00 34.95 35.70 2b4k s ARG 611 CO 0.18 -0.20 0.37 0.42 0.02 0.00 0.00 175.30 176.09 2b4k s ILE 612 N -2.44 5.22 -0.01 1.52 1.01 -1.26 -1.67 121.20 123.57 2b4k s ILE 612 Ca -0.06 0.72 0.03 0.00 0.00 0.00 0.00 60.65 61.35 2b4k s ILE 612 Cb -0.02 -3.70 -0.01 0.00 0.01 0.00 0.00 42.46 38.75 2b4k s ILE 612 CO -0.03 0.41 -0.11 -0.32 0.00 0.00 0.00 174.94 174.89 2b4k s MET 613 N 0.18 0.95 -0.08 2.79 1.75 0.22 -0.99 119.30 124.11 2b4k s MET 613 Ca 0.21 -0.39 0.05 0.00 -1.25 0.00 0.00 55.69 54.30 2b4k s MET 613 Cb -0.14 -0.91 -0.00 0.00 2.84 0.00 0.00 34.83 36.62 2b4k s MET 613 CO 0.08 0.22 -0.24 0.08 -0.65 0.00 0.00 175.02 174.51 2b4k s VAL 614 N -0.19 2.06 -0.05 10.11 1.01 0.94 0.48 120.40 134.77 2b4k s VAL 614 Ca 0.03 -1.04 0.05 0.00 0.00 0.00 0.00 61.98 61.02 2b4k s VAL 614 Cb -0.05 -1.77 -0.01 0.00 0.00 0.00 0.00 36.38 34.56 2b4k s VAL 614 CO -0.00 0.56 -0.20 -1.10 0.00 0.00 0.00 175.10 174.36 2b4k s GLN 615 N 0.14 2.06 -0.07 2.72 -0.21 -0.62 -0.44 119.66 123.23 2b4k s GLN 615 Ca -0.13 -0.72 0.01 0.00 0.02 0.00 0.00 55.36 54.54 2b4k s GLN 615 Cb -0.16 -1.78 0.02 0.00 1.00 0.00 0.00 33.01 32.09 2b4k s GLN 615 CO 0.07 0.30 -0.09 0.42 -2.12 0.00 0.00 175.29 173.87 2b4k s ILE 616 N -0.06 0.94 0.25 1.08 1.01 -0.24 -0.49 121.20 123.68 2b4k s ILE 616 Ca -0.03 -0.32 -0.04 0.00 0.00 0.00 0.00 60.65 60.26 2b4k s ILE 616 Cb -0.12 -0.91 -0.02 0.00 0.01 0.00 0.00 42.46 41.41 2b4k s ILE 616 CO 0.03 0.33 0.29 0.00 0.00 0.00 0.00 174.94 175.58 2b4k s GLN 617 N 1.06 1.45 -0.08 2.79 -2.07 -0.88 -1.71 119.66 120.23 2b4k s GLN 617 Ca -0.08 -1.58 0.11 0.00 -1.82 0.00 0.00 55.36 52.00 2b4k s GLN 617 Cb -0.14 0.36 0.27 0.00 -1.09 0.00 0.00 33.01 32.40 2b4k s GLN 617 CO -0.01 -0.54 1.19 0.43 -1.32 0.00 0.00 175.29 175.04 2b4k n SER 618 N -0.58 2.73 -3.71 12.60 7.64 -1.26 -0.57 113.62 130.47 2b4k n SER 618 Ca 0.01 -2.54 -0.10 0.00 1.01 0.00 0.00 58.87 57.25 2b4k n SER 618 Cb 0.64 -0.30 -0.06 0.00 -1.01 0.00 0.00 64.21 63.49 2b4k n SER 618 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 2b4k s SER 619 N -1.74 -0.13 -0.44 6.43 1.04 -1.26 -4.31 113.70 113.29 2b4k s SER 619 Ca 0.24 -0.36 0.07 0.00 0.48 0.00 0.00 55.95 56.37 2b4k s SER 619 Cb 0.18 0.42 0.18 0.00 0.10 0.00 0.00 66.02 66.90 2b4k s SER 619 CO 0.06 -0.77 0.61 0.26 0.98 0.00 0.00 173.24 174.38 2b4k s TRP 620 N -3.53 -1.32 -0.01 5.02 0.51 -1.23 -4.50 118.94 113.87 2b4k s TRP 620 Ca 0.02 -0.33 -0.00 0.00 -2.12 0.00 0.00 56.10 53.67 2b4k s TRP 620 Cb 0.02 0.14 -0.04 0.00 -0.81 0.00 0.00 33.47 32.79 2b4k s TRP 620 CO -0.10 -1.16 0.06 0.12 -0.51 0.00 0.00 176.95 175.36 2b4k s PHE 621 N 1.35 3.23 -0.59 -1.98 5.36 0.22 -0.61 117.98 124.95 2b4k s PHE 621 Ca 0.22 0.18 0.15 0.00 -0.96 0.00 0.00 56.93 56.51 2b4k s PHE 621 Cb -0.04 -1.72 0.75 0.00 -0.34 0.00 0.00 43.02 41.66 2b4k s PHE 621 CO -0.06 0.53 1.65 -0.35 -1.46 0.00 0.00 175.22 175.52 2b4k n PRO 622 N 1.28 4.32 0.04 10.12 -0.04 -1.26 -0.24 135.00 149.21 2b4k n PRO 622 Ca -0.14 -2.88 -0.11 0.00 -0.04 0.00 0.00 63.50 60.33 2b4k n PRO 622 Cb 0.53 -2.11 -0.05 0.00 -0.04 0.00 0.00 33.50 31.83 2b4k n PRO 622 CO 0.00 0.00 0.00 1.25 -0.04 0.00 0.00 175.50 176.71 2b4k h LEU 623 N 3.81 -0.20 -9.08 1.53 5.85 -1.93 -3.40 115.31 111.90 2b4k h LEU 623 Ca 0.00 0.03 -0.63 0.00 0.84 0.00 0.00 57.88 58.12 2b4k h LEU 623 Cb 1.73 0.09 -0.17 0.00 0.37 0.00 0.00 40.66 42.68 2b4k h LEU 623 CO 0.38 -0.10 -0.60 -0.31 -0.34 0.00 0.00 178.44 177.47 2b4k s TYR 624 N -6.17 3.18 0.41 1.25 2.02 0.22 -0.50 117.35 117.75 2b4k s TYR 624 Ca -0.14 0.00 -0.26 0.00 -0.37 0.00 0.00 57.07 56.30 2b4k s TYR 624 Cb 0.08 -1.99 -0.09 0.00 -0.40 0.00 0.00 41.96 39.56 2b4k s TYR 624 CO 0.66 0.18 1.34 0.16 -1.57 0.00 0.00 175.55 176.32 2b4k s ASP 625 N 0.09 6.26 0.23 2.29 3.84 -0.90 -4.35 116.67 124.13 2b4k s ASP 625 Ca 0.03 2.74 -0.31 0.00 -0.00 0.00 0.00 52.55 55.01 2b4k s ASP 625 Cb -0.13 -2.64 -0.11 0.00 -1.38 0.00 0.00 42.92 38.66 2b4k s ASP 625 CO 0.01 -0.89 1.54 -0.13 -0.00 0.00 0.00 175.17 175.70 2b4k s ARG 626 N -2.24 4.20 -0.19 2.11 0.52 -1.26 -4.81 118.95 117.29 2b4k s ARG 626 Ca 0.57 2.41 -0.29 0.00 -0.52 0.00 0.00 55.73 57.90 2b4k s ARG 626 Cb -0.40 -3.10 0.00 0.00 0.52 0.00 0.00 34.95 31.97 2b4k s ARG 626 CO 0.52 -0.56 1.01 1.21 0.02 0.00 0.00 175.30 177.50 2b4k s ASN 627 N 0.70 7.12 0.00 0.23 3.84 -1.26 -4.90 114.94 120.67 2b4k s ASN 627 Ca 0.65 1.40 0.01 0.00 0.21 0.00 0.00 52.86 55.12 2b4k s ASN 627 Cb -0.45 -2.53 0.06 0.00 -0.55 0.00 0.00 41.25 37.78 2b4k s ASN 627 CO 0.40 -0.58 0.76 -2.65 -2.79 0.00 0.00 177.10 172.24 2b4k n PRO 628 N 5.87 0.02 -0.26 0.43 -0.02 -1.26 -4.77 135.00 135.01 2b4k n PRO 628 Ca 0.10 0.20 0.00 0.00 -2.02 0.00 0.00 63.50 61.78 2b4k n PRO 628 Cb 0.47 -1.50 0.00 0.00 -0.02 0.00 0.00 33.50 32.45 2b4k n PRO 628 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 2b4k n GLN 629 N -1.21 0.00 -5.17 -0.52 1.13 -1.26 -0.27 117.38 110.09 2b4k n GLN 629 Ca 0.01 0.00 -0.32 0.00 -1.94 0.00 0.00 57.00 54.75 2b4k n GLN 629 Cb 0.01 -3.95 -0.16 0.00 0.11 0.00 0.00 30.24 26.24 2b4k n GLN 629 CO 0.00 0.00 0.00 0.21 -1.44 0.00 0.00 177.06 175.83 2b4k s LYS 630 N -0.40 2.96 -0.21 -1.09 2.20 -1.26 -0.17 119.74 121.77 2b4k s LYS 630 Ca 0.00 -0.86 -0.29 0.00 -0.36 0.00 0.00 55.97 54.46 2b4k s LYS 630 Cb 0.00 -2.31 -0.04 0.00 -1.51 0.00 0.00 37.83 33.97 2b4k s LYS 630 CO 0.00 0.24 1.80 0.12 -0.36 0.00 0.00 175.35 177.15 2b4k s PHE 631 N 0.19 1.78 0.20 4.03 5.36 -1.26 -4.70 117.98 123.59 2b4k s PHE 631 Ca -0.14 0.44 0.09 0.00 -0.96 0.00 0.00 56.93 56.37 2b4k s PHE 631 Cb -0.17 -4.04 -0.04 0.00 -0.34 0.00 0.00 43.02 38.44 2b4k s PHE 631 CO 0.07 -3.45 -0.07 0.14 -1.46 0.00 0.00 175.22 170.45 2b4k s VAL 632 N 6.01 3.25 0.25 3.12 -7.23 -1.26 -5.04 120.40 119.49 2b4k s VAL 632 Ca 0.80 -1.72 -0.06 0.00 -1.81 0.00 0.00 61.98 59.19 2b4k s VAL 632 Cb -0.28 -2.64 0.24 0.00 0.56 0.00 0.00 36.38 34.26 2b4k s VAL 632 CO 0.33 -0.17 1.91 -0.65 -0.31 0.00 0.00 175.10 176.20 2b4k h PRO 633 N 2.67 1.21 -2.17 4.82 0.11 -1.99 -3.40 132.00 133.26 2b4k h PRO 633 Ca -0.46 -0.07 -0.33 0.00 0.11 0.00 0.00 66.00 65.25 2b4k h PRO 633 Cb 1.22 -0.27 -0.33 0.00 0.11 0.00 0.00 31.00 31.72 2b4k h PRO 633 CO 0.56 0.80 -0.63 1.21 -0.21 0.00 0.00 178.00 179.73 2b4k s ASN 634 N -6.01 1.66 0.42 -2.05 3.84 -1.26 -5.03 114.94 106.51 2b4k s ASN 634 Ca -0.13 -0.72 0.25 0.00 0.21 0.00 0.00 52.86 52.47 2b4k s ASN 634 Cb 0.18 0.50 1.29 0.00 -0.55 0.00 0.00 41.25 42.68 2b4k s ASN 634 CO 0.81 -0.39 1.69 0.40 -2.79 0.00 0.00 177.10 176.82 2b4k h ILE 635 N 6.27 0.30 -1.00 -5.21 2.04 -1.99 0.19 117.51 118.11 2b4k h ILE 635 Ca -0.14 -0.07 0.24 0.00 1.00 0.00 0.00 64.86 65.89 2b4k h ILE 635 Cb 1.08 0.07 -0.09 0.00 -0.74 0.00 0.00 36.82 37.14 2b4k h ILE 635 CO 0.33 0.04 0.64 -0.26 0.00 0.00 0.00 178.15 178.90 2b4k h PHE 636 N 0.21 0.72 -0.60 1.37 0.05 -1.96 -0.49 116.94 116.25 2b4k h PHE 636 Ca 0.72 0.02 -0.24 0.00 3.82 0.00 0.00 57.97 62.30 2b4k h PHE 636 Cb 2.11 -0.21 -0.14 0.00 2.00 0.00 0.00 35.95 39.71 2b4k h PHE 636 CO -0.00 0.12 0.20 -0.25 -0.18 0.00 0.00 178.31 178.19 2b4k n ASP 637 N -4.63 3.70 -4.72 2.17 8.00 0.68 -1.31 116.55 120.44 2b4k n ASP 637 Ca 0.23 -3.45 -0.43 0.00 0.71 0.00 0.00 54.79 51.86 2b4k n ASP 637 Cb 0.77 -0.70 -0.03 0.00 -0.02 0.00 0.00 41.12 41.15 2b4k n ASP 637 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2b4k n ALA 638 N -0.74 2.36 -2.07 2.24 0.00 -0.19 -4.97 120.51 117.14 2b4k n ALA 638 Ca 0.40 0.40 -0.30 0.00 0.00 0.00 0.00 53.44 53.93 2b4k n ALA 638 Cb 1.26 -2.45 -0.02 0.00 0.00 0.00 0.00 19.45 18.24 2b4k n ALA 638 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 2b4k s LYS 639 N 0.28 3.72 0.27 0.00 1.02 -1.26 -4.47 119.74 119.30 2b4k s LYS 639 Ca 0.70 0.57 -0.01 0.00 0.02 0.00 0.00 55.97 57.25 2b4k s LYS 639 Cb -0.54 -2.27 0.59 0.00 -0.52 0.00 0.00 37.83 35.10 2b4k s LYS 639 CO 0.41 -0.24 1.67 -1.35 -0.92 0.00 0.00 175.35 174.93 2b4k h PRO 640 N 0.61 0.27 0.00 -1.68 0.11 -1.97 -0.07 132.00 129.27 2b4k h PRO 640 Ca -0.46 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.63 2b4k h PRO 640 Cb 1.19 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.24 2b4k h PRO 640 CO 0.62 0.18 0.00 0.00 -0.21 0.00 0.00 178.00 178.59 2b4k n ALA 641 N -2.65 2.65 0.18 -0.75 0.00 -1.26 -3.28 120.51 115.40 2b4k n ALA 641 Ca 0.18 -0.19 0.12 0.00 0.00 0.00 0.00 53.44 53.55 2b4k n ALA 641 Cb 0.57 -1.48 0.11 0.00 0.00 0.00 0.00 19.45 18.65 2b4k n ALA 641 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 2b4k h ASP 642 N 0.00 0.00 -2.03 0.00 3.45 -1.37 -3.43 116.42 113.03 2b4k h ASP 642 Ca 0.00 0.00 -0.50 0.00 0.43 0.00 0.00 57.03 56.96 2b4k h ASP 642 Cb 0.00 0.00 -0.04 0.00 -0.56 0.00 0.00 39.33 38.73 2b4k h ASP 642 CO 0.00 0.02 1.29 -0.31 -1.57 0.00 0.00 179.24 178.67 2b4k s TYR 643 N -3.25 1.78 -0.07 4.55 2.02 -1.20 -4.25 117.35 116.93 2b4k s TYR 643 Ca 0.05 0.62 -0.11 0.00 -0.37 0.00 0.00 57.07 57.26 2b4k s TYR 643 Cb 0.06 -4.19 -0.05 0.00 -0.40 0.00 0.00 41.96 37.38 2b4k s TYR 643 CO 0.71 -2.26 0.28 0.99 -1.57 0.00 0.00 175.55 173.70 2b4k s THR 644 N 8.45 5.27 -0.08 -0.71 2.01 0.63 -4.96 115.64 126.25 2b4k s THR 644 Ca 0.61 0.53 -0.26 0.00 0.31 0.00 0.00 61.69 62.88 2b4k s THR 644 Cb -0.12 -3.57 -0.03 0.00 0.01 0.00 0.00 72.50 68.80 2b4k s THR 644 CO 0.19 0.58 0.83 -0.69 -0.69 0.00 0.00 174.62 174.84 2b4k s VAL 645 N -0.93 4.94 0.28 3.82 1.01 -1.26 -4.50 120.40 123.76 2b4k s VAL 645 Ca 0.19 1.70 0.06 0.00 0.00 0.00 0.00 61.98 63.93 2b4k s VAL 645 Cb -0.14 -4.16 -0.06 0.00 0.00 0.00 0.00 36.38 32.02 2b4k s VAL 645 CO 0.08 0.16 -0.05 0.00 0.00 0.00 0.00 175.10 175.29 2b4k s ALA 646 N 1.26 2.30 -0.27 5.51 0.00 -1.14 -4.91 121.76 124.51 2b4k s ALA 646 Ca 0.42 -1.90 -0.05 0.00 0.00 0.00 0.00 51.96 50.44 2b4k s ALA 646 Cb -0.18 0.22 0.01 0.00 0.00 0.00 0.00 23.12 23.17 2b4k s ALA 646 CO 0.19 -0.09 0.03 0.99 0.00 0.00 0.00 175.76 176.88 2b4k s THR 647 N -3.05 3.59 -0.17 0.00 2.01 -1.26 -2.14 115.64 114.62 2b4k s THR 647 Ca 0.30 -0.76 -0.10 0.00 0.31 0.00 0.00 61.69 61.43 2b4k s THR 647 Cb 0.04 -2.82 -0.05 0.00 0.01 0.00 0.00 72.50 69.68 2b4k s THR 647 CO 0.12 0.15 0.16 -1.10 -0.69 0.00 0.00 174.62 173.26 2b4k s GLN 648 N 1.45 4.00 -0.15 4.92 -1.52 0.56 -1.21 119.66 127.70 2b4k s GLN 648 Ca 0.02 -0.13 0.01 0.00 -1.95 0.00 0.00 55.36 53.30 2b4k s GLN 648 Cb -0.17 -3.35 0.02 0.00 -0.22 0.00 0.00 33.01 29.29 2b4k s GLN 648 CO -0.00 0.43 -0.16 -1.12 -0.25 0.00 0.00 175.29 174.19 2b4k s SER 649 N -0.03 2.79 -0.56 5.90 0.01 0.89 -0.32 113.70 122.39 2b4k s SER 649 Ca 0.11 -0.53 -0.18 0.00 1.31 0.00 0.00 55.95 56.67 2b4k s SER 649 Cb -0.12 -1.26 0.11 0.00 0.21 0.00 0.00 66.02 64.96 2b4k s SER 649 CO 0.01 -0.03 0.60 -0.63 0.41 0.00 0.00 173.24 173.60 2b4k s ILE 650 N 1.39 4.99 0.05 1.44 -1.09 0.89 -0.96 121.20 127.92 2b4k s ILE 650 Ca 0.04 -1.15 -0.30 0.00 -2.23 0.00 0.00 60.65 57.02 2b4k s ILE 650 Cb -0.13 -4.40 -0.04 0.00 -1.58 0.00 0.00 42.46 36.31 2b4k s ILE 650 CO -0.11 -0.97 0.99 -2.28 -1.23 0.00 0.00 174.94 171.34 2b4k s HIS 651 N 2.22 3.70 0.11 3.97 5.65 -0.56 -1.93 115.29 128.44 2b4k s HIS 651 Ca 0.08 1.71 0.08 0.00 0.25 0.00 0.00 55.06 57.18 2b4k s HIS 651 Cb -0.26 -3.12 -0.04 0.00 -1.18 0.00 0.00 32.58 27.99 2b4k s HIS 651 CO 0.05 -0.02 -0.19 -3.38 -0.65 0.00 0.00 174.74 170.56 2b4k s HIS 652 N 0.59 1.67 0.01 3.88 -3.43 0.69 -3.10 115.29 115.60 2b4k s HIS 652 Ca 0.50 -0.44 0.00 0.00 -0.80 0.00 0.00 55.06 54.32 2b4k s HIS 652 Cb -0.23 -0.90 0.00 0.00 -1.43 0.00 0.00 32.58 30.02 2b4k s HIS 652 CO 0.29 0.19 0.00 0.41 -2.00 0.00 0.00 174.74 173.63 2b4k n GLY 653 N 0.97 -1.88 7.00 -1.38 0.00 -1.26 -1.55 105.19 107.09 2b4k n GLY 653 Ca -0.19 -1.50 0.00 0.00 0.00 0.00 0.00 46.02 44.34 2b4k n GLY 653 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2b4k n GLY 654 N -2.37 1.04 0.04 -0.02 0.00 -0.77 -2.46 105.19 100.66 2b4k n GLY 654 Ca -0.00 -0.71 0.14 0.00 0.00 0.00 0.00 46.02 45.46 2b4k n GLY 654 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2b4k n LYS 655 N 4.36 1.06 -2.55 1.61 5.02 -1.26 -3.46 118.16 122.95 2b4k n LYS 655 Ca 0.00 -0.09 -0.15 0.00 -2.02 0.00 0.00 58.31 56.05 2b4k n LYS 655 Cb 0.00 -1.46 0.02 0.00 -0.02 0.00 0.00 35.03 33.58 2b4k n LYS 655 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 2b4k n GLU 656 N -0.85 2.28 -2.31 1.97 1.02 -1.14 -5.05 120.64 116.56 2b4k n GLU 656 Ca 0.22 -3.80 -0.36 0.00 -0.02 0.00 0.00 57.16 53.19 2b4k n GLU 656 Cb 0.12 -1.76 -0.04 0.00 -0.02 0.00 0.00 31.44 29.75 2b4k n GLU 656 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2b4k s ALA 657 N -3.44 2.31 0.24 0.62 0.00 -1.03 -4.07 121.76 116.39 2b4k s ALA 657 Ca 0.37 -1.54 -0.31 0.00 0.00 0.00 0.00 51.96 50.47 2b4k s ALA 657 Cb 0.41 -4.44 -0.12 0.00 0.00 0.00 0.00 23.12 18.97 2b4k s ALA 657 CO -0.04 -3.95 1.63 2.41 0.00 0.00 0.00 175.76 175.81 2b4k n THR 658 N 7.13 0.53 -3.64 0.00 -1.04 -1.18 -4.73 114.28 111.34 2b4k n THR 658 Ca 0.26 -0.13 -0.10 0.00 -2.04 0.00 0.00 64.05 62.04 2b4k n THR 658 Cb 0.50 -1.89 -0.03 0.00 -1.82 0.00 0.00 70.33 67.08 2b4k n THR 658 CO 0.00 0.00 0.00 -0.94 -0.64 0.00 0.00 175.07 173.49 2b4k s SER 659 N 0.78 -0.34 -0.33 8.00 1.04 0.19 -1.83 113.70 121.20 2b4k s SER 659 Ca 0.70 -0.33 -0.10 0.00 0.48 0.00 0.00 55.95 56.70 2b4k s SER 659 Cb -0.53 0.58 0.00 0.00 0.10 0.00 0.00 66.02 66.18 2b4k s SER 659 CO 0.41 -1.03 0.18 -0.63 0.98 0.00 0.00 173.24 173.15 2b4k s ILE 660 N -3.83 4.66 -0.84 -1.02 -1.09 -0.72 -0.64 121.20 117.72 2b4k s ILE 660 Ca 0.06 -0.53 -0.25 0.00 -2.23 0.00 0.00 60.65 57.70 2b4k s ILE 660 Cb -0.01 -3.44 -0.01 0.00 -1.58 0.00 0.00 42.46 37.42 2b4k s ILE 660 CO -0.06 -0.03 1.71 -0.76 -1.23 0.00 0.00 174.94 174.58 2b4k s LEU 661 N 1.61 3.27 0.12 2.97 1.43 0.22 -0.77 118.68 127.53 2b4k s LEU 661 Ca 0.04 -0.59 -0.26 0.00 -1.03 0.00 0.00 54.13 52.29 2b4k s LEU 661 Cb -0.18 -2.56 -0.07 0.00 0.03 0.00 0.00 46.19 43.42 2b4k s LEU 661 CO 0.07 -2.24 0.81 -0.76 0.23 0.00 0.00 176.35 174.46 2b4k s LEU 662 N 8.03 4.53 -1.41 1.79 1.43 -0.56 -1.17 118.68 131.31 2b4k s LEU 662 Ca 0.59 1.62 -0.11 0.00 -1.03 0.00 0.00 54.13 55.20 2b4k s LEU 662 Cb -0.07 -3.34 0.08 0.00 0.03 0.00 0.00 46.19 42.89 2b4k s LEU 662 CO 0.04 0.09 2.22 -0.81 0.23 0.00 0.00 176.35 178.13 2b4k n PRO 663 N 2.21 3.43 -2.42 1.29 -0.04 -1.26 0.43 135.00 138.64 2b4k n PRO 663 Ca -0.03 -2.96 -0.41 0.00 -0.04 0.00 0.00 63.50 60.05 2b4k n PRO 663 Cb 0.49 -3.02 -0.04 0.00 -0.04 0.00 0.00 33.50 30.89 2b4k n PRO 663 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 2b4k s VAL 664 N 1.59 3.69 0.23 0.52 1.01 -1.26 -1.08 120.40 125.10 2b4k s VAL 664 Ca 0.48 1.41 0.05 0.00 0.00 0.00 0.00 61.98 63.93 2b4k s VAL 664 Cb 0.14 -3.90 -0.05 0.00 0.00 0.00 0.00 36.38 32.56 2b4k s VAL 664 CO -0.05 0.22 -0.07 0.68 0.00 0.00 0.00 175.10 175.88 2b4k s VAL 665 N -0.01 1.39 -2.98 2.92 -7.23 -0.36 -4.80 120.40 109.33 2b4k s VAL 665 Ca 0.52 -2.10 0.24 0.00 -1.81 0.00 0.00 61.98 58.83 2b4k s VAL 665 Cb -0.31 -2.23 0.20 0.00 0.56 0.00 0.00 36.38 34.59 2b4k s VAL 665 CO 0.36 -0.44 1.28 0.29 -0.31 0.00 0.00 175.10 176.27