#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2j0k s VAL 36 N 0.00 0.92 -0.04 5.15 0.11 -1.26 -1.86 120.40 123.42 2j0k s VAL 36 Ca 0.00 -0.41 -0.02 0.00 -2.93 0.00 0.00 61.98 58.63 2j0k s VAL 36 Cb 0.00 -0.83 0.03 0.00 -1.53 0.00 0.00 36.38 34.05 2j0k s VAL 36 CO 0.00 0.29 0.09 -0.22 -3.33 0.00 0.00 175.10 171.93 2j0k s LEU 37 N 0.36 0.89 -0.34 2.54 2.96 -0.73 -4.99 118.68 119.37 2j0k s LEU 37 Ca -0.07 0.18 -0.13 0.00 -0.22 0.00 0.00 54.13 53.89 2j0k s LEU 37 Cb -0.11 0.16 -0.02 0.00 0.50 0.00 0.00 46.19 46.73 2j0k s LEU 37 CO 0.01 -0.14 0.26 -0.75 -1.32 0.00 0.00 176.35 174.42 2j0k s LYS 38 N 1.11 3.49 -0.31 1.98 2.20 -1.26 -1.94 119.74 125.01 2j0k s LYS 38 Ca -0.09 -0.62 0.02 0.00 -0.36 0.00 0.00 55.97 54.92 2j0k s LYS 38 Cb -0.12 -3.81 0.08 0.00 -1.51 0.00 0.00 37.83 32.47 2j0k s LYS 38 CO -0.05 -0.47 -0.00 0.08 -0.36 0.00 0.00 175.35 174.55 2j0k s VAL 39 N 1.77 2.41 0.50 4.02 1.01 -0.37 -4.14 120.40 125.61 2j0k s VAL 39 Ca 0.07 -1.93 -0.22 0.00 0.00 0.00 0.00 61.98 59.90 2j0k s VAL 39 Cb -0.17 -2.59 -0.06 0.00 0.00 0.00 0.00 36.38 33.56 2j0k s VAL 39 CO 0.11 -0.33 1.19 -0.36 0.00 0.00 0.00 175.10 175.71 2j0k s PHE 40 N 1.04 2.69 0.00 5.22 0.40 0.41 -0.58 117.98 127.15 2j0k s PHE 40 Ca 0.01 1.51 0.00 0.00 -0.60 0.00 0.00 56.93 57.85 2j0k s PHE 40 Cb -0.20 -3.44 0.00 0.00 0.51 0.00 0.00 43.02 39.89 2j0k s PHE 40 CO -0.06 -1.82 0.00 -2.39 0.70 0.00 0.00 175.22 171.65 2j0k n HIS 41 N -0.85 -0.37 -2.15 0.36 1.44 -0.69 -0.87 115.22 112.09 2j0k n HIS 41 Ca 0.09 0.00 -0.09 0.00 -2.01 0.00 0.00 57.72 55.71 2j0k n HIS 41 Cb 0.48 0.00 0.07 0.00 0.12 0.00 0.00 29.99 30.66 2j0k n HIS 41 CO 0.00 0.00 0.00 0.66 -2.81 0.00 0.00 176.34 174.19 2j0k n TYR 42 N 0.00 1.55 -3.33 -1.40 4.02 -1.26 -4.72 117.16 112.02 2j0k n TYR 42 Ca 0.00 -1.87 -0.42 0.00 -0.01 0.00 0.00 57.90 55.59 2j0k n TYR 42 Cb 0.00 -0.28 -0.09 0.00 -0.02 0.00 0.00 39.34 38.95 2j0k n TYR 42 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 176.86 175.79 2j0k s PHE 43 N -3.20 3.18 0.29 -0.72 0.40 -1.26 -3.98 117.98 112.68 2j0k s PHE 43 Ca 0.41 -0.23 -0.29 0.00 -0.60 0.00 0.00 56.93 56.22 2j0k s PHE 43 Cb 0.38 -2.85 -0.10 0.00 0.51 0.00 0.00 43.02 40.96 2j0k s PHE 43 CO -0.02 -0.62 1.45 -2.00 0.70 0.00 0.00 175.22 174.72 2j0k s GLU 44 N 2.14 4.24 -0.12 0.44 2.12 -1.26 -4.92 118.70 121.34 2j0k s GLU 44 Ca 0.13 2.37 -0.09 0.00 0.36 0.00 0.00 54.97 57.74 2j0k s GLU 44 Cb -0.17 -3.06 0.04 0.00 0.26 0.00 0.00 34.13 31.20 2j0k s GLU 44 CO 0.13 -0.43 0.30 1.21 -0.54 0.00 0.00 175.26 175.94 2j0k s ASN 45 N 0.13 -0.34 0.59 -1.70 2.47 -1.26 -5.05 114.94 109.77 2j0k s ASN 45 Ca 0.57 0.63 0.34 0.00 0.42 0.00 0.00 52.86 54.82 2j0k s ASN 45 Cb -0.43 0.58 1.29 0.00 -1.45 0.00 0.00 41.25 41.24 2j0k s ASN 45 CO 0.49 -0.14 1.53 0.77 -3.72 0.00 0.00 177.10 176.04 2j0k h SER 46 N 6.40 0.00 -2.53 -4.21 4.64 -1.97 -3.41 113.55 112.48 2j0k h SER 46 Ca -0.33 0.00 -0.29 0.00 -0.47 0.00 0.00 61.79 60.70 2j0k h SER 46 Cb 1.18 0.00 0.17 0.00 -0.31 0.00 0.00 62.40 63.44 2j0k h SER 46 CO 0.33 0.00 -0.14 -1.54 -0.87 0.00 0.00 176.83 174.61 2j0k n SER 47 N -3.60 -3.75 -4.77 4.97 3.41 -1.26 -4.94 113.62 103.68 2j0k n SER 47 Ca 0.26 -0.70 -0.40 0.00 -0.26 0.00 0.00 58.87 57.77 2j0k n SER 47 Cb 1.46 -0.85 0.00 0.00 -0.26 0.00 0.00 64.21 64.56 2j0k n SER 47 CO 0.00 0.00 0.00 -0.70 -0.16 0.00 0.00 175.04 174.18 2j0k s GLU 48 N -4.51 3.99 0.02 4.33 2.56 -1.26 -4.98 118.70 118.84 2j0k s GLU 48 Ca 0.54 2.37 -0.10 0.00 0.00 0.00 0.00 54.97 57.77 2j0k s GLU 48 Cb -0.09 -2.84 -0.05 0.00 2.00 0.00 0.00 34.13 33.14 2j0k s GLU 48 CO 0.45 -0.55 1.16 -1.35 -0.56 0.00 0.00 175.26 174.40 2j0k h PRO 49 N 2.78 -0.33 0.00 4.30 0.11 -1.92 -2.73 132.00 134.21 2j0k h PRO 49 Ca -0.50 0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.63 2j0k h PRO 49 Cb 1.25 0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.43 2j0k h PRO 49 CO 0.63 -0.22 0.85 1.79 -0.21 0.00 0.00 178.00 180.85 2j0k h THR 50 N -0.34 0.00 -0.56 -1.15 1.35 -1.96 0.69 112.91 110.94 2j0k h THR 50 Ca -0.03 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.83 2j0k h THR 50 Cb 0.27 0.10 0.00 0.00 -1.73 0.00 0.00 68.15 66.79 2j0k h THR 50 CO 0.03 0.00 0.00 0.35 -0.25 0.00 0.00 175.52 175.65 2j0k n THR 51 N -2.44 2.14 -2.80 6.82 -2.24 -1.03 -4.89 114.28 109.84 2j0k n THR 51 Ca -0.00 -1.18 -0.42 0.00 -2.27 0.00 0.00 64.05 60.17 2j0k n THR 51 Cb 0.86 -0.12 -0.04 0.00 -2.10 0.00 0.00 70.33 68.93 2j0k n THR 51 CO 0.00 0.00 0.00 0.26 -0.57 0.00 0.00 175.07 174.76 2j0k s TRP 52 N -2.25 3.12 0.27 4.78 0.51 0.24 -4.92 118.94 120.69 2j0k s TRP 52 Ca 0.49 0.87 -0.15 0.00 -2.12 0.00 0.00 56.10 55.18 2j0k s TRP 52 Cb 0.34 -3.57 0.01 0.00 -0.81 0.00 0.00 33.47 29.45 2j0k s TRP 52 CO 0.18 -0.76 0.58 0.00 -0.51 0.00 0.00 176.95 176.44 2j0k s ALA 53 N 3.40 -0.55 0.25 0.98 0.00 -1.26 -1.71 121.76 122.87 2j0k s ALA 53 Ca 0.38 -0.71 0.09 0.00 0.00 0.00 0.00 51.96 51.72 2j0k s ALA 53 Cb -0.12 0.98 -0.05 0.00 0.00 0.00 0.00 23.12 23.92 2j0k s ALA 53 CO 0.17 -0.92 -0.15 -1.12 0.00 0.00 0.00 175.76 173.74 2j0k s SER 54 N -3.00 2.98 -0.13 0.00 0.01 0.25 -4.90 113.70 108.91 2j0k s SER 54 Ca 0.19 -1.06 -0.02 0.00 1.31 0.00 0.00 55.95 56.37 2j0k s SER 54 Cb -0.03 -0.20 0.04 0.00 0.21 0.00 0.00 66.02 66.04 2j0k s SER 54 CO 0.09 -0.13 0.01 -0.63 0.41 0.00 0.00 173.24 172.99 2j0k s ILE 55 N -2.82 0.48 0.16 1.44 1.09 -1.26 -1.23 121.20 119.06 2j0k s ILE 55 Ca 0.26 -0.22 0.10 0.00 -1.10 0.00 0.00 60.65 59.70 2j0k s ILE 55 Cb -0.01 -0.79 -0.04 0.00 -1.06 0.00 0.00 42.46 40.55 2j0k s ILE 55 CO 0.11 0.05 -0.21 -0.63 -0.10 0.00 0.00 174.94 174.16 2j0k s ILE 56 N 1.90 2.58 -0.19 2.92 1.09 -0.82 -0.43 121.20 128.25 2j0k s ILE 56 Ca 0.02 -1.77 -0.06 0.00 -1.10 0.00 0.00 60.65 57.74 2j0k s ILE 56 Cb -0.14 -2.21 -0.03 0.00 -1.06 0.00 0.00 42.46 39.01 2j0k s ILE 56 CO -0.07 -0.01 0.02 -0.13 -0.10 0.00 0.00 174.94 174.65 2j0k s ARG 57 N -2.41 3.74 -0.19 2.79 0.52 -0.29 -1.78 118.95 121.33 2j0k s ARG 57 Ca 0.19 -0.46 0.01 0.00 -0.52 0.00 0.00 55.73 54.95 2j0k s ARG 57 Cb -0.09 -3.12 0.03 0.00 0.52 0.00 0.00 34.95 32.28 2j0k s ARG 57 CO 0.10 0.11 -0.19 -3.38 0.02 0.00 0.00 175.30 171.96 2j0k s HIS 58 N 0.78 2.83 -0.09 -0.53 -3.43 -0.78 -2.97 115.29 111.10 2j0k s HIS 58 Ca 0.01 -1.73 -0.00 0.00 -0.80 0.00 0.00 55.06 52.54 2j0k s HIS 58 Cb -0.14 -1.91 0.08 0.00 -1.43 0.00 0.00 32.58 29.18 2j0k s HIS 58 CO 0.02 -0.82 1.82 0.41 -2.00 0.00 0.00 174.74 174.18 2j0k n GLY 59 N 4.60 2.88 0.75 -1.38 0.00 -1.23 0.19 105.19 110.98 2j0k n GLY 59 Ca -0.20 -0.31 0.09 0.00 0.00 0.00 0.00 46.02 45.61 2j0k n GLY 59 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2j0k n ASP 60 N 0.95 -4.37 -0.46 1.61 4.64 -1.26 -4.53 116.55 113.14 2j0k n ASP 60 Ca 0.09 0.61 -0.04 0.00 -1.38 0.00 0.00 54.79 54.07 2j0k n ASP 60 Cb 0.56 -2.48 -0.02 0.00 -1.04 0.00 0.00 41.12 38.14 2j0k n ASP 60 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 2j0k n ALA 61 N -3.03 -0.07 -2.69 -1.67 0.00 -1.26 -3.76 120.51 108.03 2j0k n ALA 61 Ca -0.03 0.07 -0.40 0.00 0.00 0.00 0.00 53.44 53.08 2j0k n ALA 61 Cb 0.35 -1.12 -0.05 0.00 0.00 0.00 0.00 19.45 18.64 2j0k n ALA 61 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 2j0k s THR 62 N -1.14 5.03 0.40 0.00 2.01 -1.26 -4.32 115.64 116.36 2j0k s THR 62 Ca 0.00 1.33 0.00 0.00 0.31 0.00 0.00 61.69 63.33 2j0k s THR 62 Cb 0.00 -4.00 -0.02 0.00 0.01 0.00 0.00 72.50 68.49 2j0k s THR 62 CO 0.00 0.18 0.62 1.51 -0.69 0.00 0.00 174.62 176.24 2j0k s ASP 63 N 0.96 6.07 0.29 3.53 -4.77 -1.26 0.14 116.67 121.62 2j0k s ASP 63 Ca 0.33 0.39 0.03 0.00 -3.30 0.00 0.00 52.55 50.01 2j0k s ASP 63 Cb -0.17 -1.80 0.69 0.00 -1.09 0.00 0.00 42.92 40.55 2j0k s ASP 63 CO 0.14 -0.50 1.74 0.58 0.70 0.00 0.00 175.17 177.83 2j0k h VAL 64 N 0.56 0.63 -1.02 2.11 2.07 0.89 0.17 116.25 121.66 2j0k h VAL 64 Ca -0.48 -0.20 0.25 0.00 0.82 0.00 0.00 66.70 67.08 2j0k h VAL 64 Cb 1.23 -0.02 -0.11 0.00 -1.52 0.00 0.00 31.29 30.88 2j0k h VAL 64 CO 0.59 0.11 0.63 -0.09 0.02 0.00 0.00 177.57 178.83 2j0k h ARG 65 N 0.60 0.50 -0.24 1.57 2.43 -1.45 -2.27 114.38 115.52 2j0k h ARG 65 Ca 0.54 -0.03 -0.02 0.00 -0.81 0.00 0.00 59.98 59.67 2j0k h ARG 65 Cb 0.90 -0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 30.33 2j0k h ARG 65 CO -0.43 0.33 0.08 0.78 -1.51 0.00 0.00 179.97 179.23 2j0k h GLY 66 N 0.52 0.39 0.93 2.80 0.00 -0.95 -1.54 103.07 105.22 2j0k h GLY 66 Ca 0.61 -0.22 0.01 0.00 0.00 0.00 0.00 47.33 47.73 2j0k h GLY 66 CO -0.38 0.21 0.00 -2.22 0.00 0.00 0.00 176.54 174.15 2j0k h ILE 67 N 0.22 0.97 0.41 2.60 1.08 -1.44 -2.37 117.51 118.98 2j0k h ILE 67 Ca 0.08 -0.01 -0.01 0.00 -0.39 0.00 0.00 64.86 64.53 2j0k h ILE 67 Cb 0.21 0.94 -0.03 0.00 -3.07 0.00 0.00 36.82 34.88 2j0k h ILE 67 CO -0.00 0.00 -0.45 0.40 -0.69 0.00 0.00 178.15 177.41 2j0k h ILE 68 N 0.02 0.11 -0.94 -0.67 2.04 -1.36 -2.23 117.51 114.48 2j0k h ILE 68 Ca 0.02 0.00 0.20 0.00 1.00 0.00 0.00 64.86 66.08 2j0k h ILE 68 Cb 0.03 0.11 -0.08 0.00 -0.74 0.00 0.00 36.82 36.14 2j0k h ILE 68 CO -0.04 0.00 0.61 -0.61 0.00 0.00 0.00 178.15 178.11 2j0k h GLN 69 N -0.88 0.52 0.00 2.37 4.15 -1.22 -1.97 115.11 118.07 2j0k h GLN 69 Ca -0.04 -0.03 0.00 0.00 0.77 0.00 0.00 58.65 59.35 2j0k h GLN 69 Cb 0.79 -0.12 0.00 0.00 0.21 0.00 0.00 27.48 28.36 2j0k h GLN 69 CO -0.09 0.34 0.00 1.63 -1.93 0.00 0.00 178.83 178.79 2j0k n LYS 70 N -4.59 0.00 -0.35 1.69 4.76 -0.90 -1.77 118.16 117.01 2j0k n LYS 70 Ca 0.21 0.47 0.24 0.00 -2.87 0.00 0.00 58.31 56.36 2j0k n LYS 70 Cb 0.65 -1.37 0.49 0.00 -1.84 0.00 0.00 35.03 32.96 2j0k n LYS 70 CO 0.00 0.00 0.00 0.82 -1.37 0.00 0.00 177.40 176.85 2j0k h ILE 71 N 0.00 0.33 0.00 -0.18 2.04 -1.11 0.32 117.51 118.91 2j0k h ILE 71 Ca 0.00 -0.12 -0.06 0.00 1.00 0.00 0.00 64.86 65.69 2j0k h ILE 71 Cb 0.00 -0.03 -0.01 0.00 -0.74 0.00 0.00 36.82 36.04 2j0k h ILE 71 CO 0.00 0.06 -0.33 -0.37 0.00 0.00 0.00 178.15 177.52 2j0k h VAL 72 N 0.34 0.45 0.00 1.67 -1.51 -1.41 -3.29 116.25 112.50 2j0k h VAL 72 Ca 0.72 -1.65 -0.18 0.00 -1.23 0.00 0.00 66.70 64.35 2j0k h VAL 72 Cb 1.70 2.20 -0.02 0.00 -2.13 0.00 0.00 31.29 33.05 2j0k h VAL 72 CO -0.54 0.26 -0.85 0.44 -1.23 0.00 0.00 177.57 175.65 2j0k h ASP 73 N 0.00 0.12 -0.56 4.19 3.45 0.47 -1.55 116.42 122.52 2j0k h ASP 73 Ca -0.01 -0.10 -0.04 0.00 0.43 0.00 0.00 57.03 57.32 2j0k h ASP 73 Cb 1.21 -0.04 -0.02 0.00 -0.56 0.00 0.00 39.33 39.92 2j0k h ASP 73 CO 0.03 0.91 0.19 0.00 -1.57 0.00 0.00 179.24 178.81 2j0k n HIS 75 N -4.46 0.24 -3.58 0.00 8.25 -1.16 -4.93 115.22 109.59 2j0k n HIS 75 Ca 0.03 -0.12 -0.21 0.00 -0.26 0.00 0.00 57.72 57.16 2j0k n HIS 75 Cb 0.19 0.00 0.07 0.00 1.12 0.00 0.00 29.99 31.37 2j0k n HIS 75 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 2j0k n LYS 76 N 0.08 -6.44 -2.55 -0.41 4.76 -0.81 -4.81 118.16 107.99 2j0k n LYS 76 Ca 0.11 0.77 -0.41 0.00 -2.87 0.00 0.00 58.31 55.91 2j0k n LYS 76 Cb 0.22 -5.68 -0.04 0.00 -1.84 0.00 0.00 35.03 27.69 2j0k n LYS 76 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 2j0k s VAL 77 N -3.42 3.89 -0.11 -0.18 1.01 -0.65 -4.91 120.40 116.03 2j0k s VAL 77 Ca 0.20 1.69 -0.08 0.00 0.00 0.00 0.00 61.98 63.78 2j0k s VAL 77 Cb -0.09 -4.08 -0.07 0.00 0.00 0.00 0.00 36.38 32.14 2j0k s VAL 77 CO 0.76 0.32 0.22 0.11 0.00 0.00 0.00 175.10 176.51 2j0k h LYS 78 N 4.85 -0.00 -3.80 2.72 1.57 -1.91 -3.41 116.57 116.58 2j0k h LYS 78 Ca -0.45 0.00 -0.72 0.00 -1.87 0.00 0.00 60.65 57.61 2j0k h LYS 78 Cb 1.21 0.00 -0.07 0.00 0.08 0.00 0.00 32.23 33.45 2j0k h LYS 78 CO 0.71 0.28 2.86 0.09 -0.57 0.00 0.00 179.45 182.82 2j0k n ASN 79 N -4.73 4.46 0.02 0.86 3.02 -1.26 -4.73 115.26 112.89 2j0k n ASN 79 Ca -0.03 -2.91 0.06 0.00 -0.03 0.00 0.00 54.58 51.67 2j0k n ASN 79 Cb 0.14 -1.60 0.46 0.00 -0.61 0.00 0.00 39.78 38.17 2j0k n ASN 79 CO 0.00 0.00 0.00 0.58 -2.62 0.00 0.00 177.26 175.22 2j0k h VAL 80 N 3.87 1.06 0.00 2.41 2.07 -1.99 -2.05 116.25 121.62 2j0k h VAL 80 Ca 0.54 -0.16 -0.00 0.00 0.82 0.00 0.00 66.70 67.90 2j0k h VAL 80 Cb 0.62 0.55 -0.00 0.00 -1.52 0.00 0.00 31.29 30.94 2j0k h VAL 80 CO 1.81 0.09 -0.00 0.00 0.02 0.00 0.00 177.57 179.48 2j0k h ALA 81 N 1.77 1.08 0.00 1.67 0.00 -1.97 -2.93 119.26 118.88 2j0k h ALA 81 Ca 0.15 -0.00 -0.08 0.00 0.00 0.00 0.00 54.91 54.97 2j0k h ALA 81 Cb 0.03 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 2j0k h ALA 81 CO -0.03 0.01 -0.40 0.00 0.00 0.00 0.00 179.25 178.82 2j0k s TYR 83 N -3.62 3.77 0.27 0.00 1.51 -1.11 -0.63 117.35 117.54 2j0k s TYR 83 Ca -0.00 1.15 0.05 0.00 -1.01 0.00 0.00 57.07 57.26 2j0k s TYR 83 Cb 0.11 -2.42 -0.06 0.00 -0.11 0.00 0.00 41.96 39.49 2j0k s TYR 83 CO 0.70 0.60 -0.01 0.20 -1.11 0.00 0.00 175.55 175.93 2j0k s GLY 84 N -1.05 1.79 -0.24 0.71 0.00 0.38 -4.89 107.32 104.01 2j0k s GLY 84 Ca 0.27 -1.89 -0.07 0.00 0.00 0.00 0.00 44.72 43.03 2j0k s GLY 84 CO 0.17 -1.77 0.05 -2.27 0.00 0.00 0.00 173.10 169.28 2j0k s LEU 85 N -3.40 3.36 -0.13 0.66 2.96 -1.26 -1.49 118.68 119.37 2j0k s LEU 85 Ca 0.31 -0.23 -0.02 0.00 -0.22 0.00 0.00 54.13 53.97 2j0k s LEU 85 Cb 0.06 -1.89 -0.03 0.00 0.50 0.00 0.00 46.19 44.83 2j0k s LEU 85 CO 0.12 -0.02 -0.05 -0.60 -1.32 0.00 0.00 176.35 174.47 2j0k s ARG 86 N 1.55 3.43 -0.14 1.98 3.52 -0.26 -1.91 118.95 127.12 2j0k s ARG 86 Ca 0.06 -0.53 -0.02 0.00 -0.13 0.00 0.00 55.73 55.11 2j0k s ARG 86 Cb -0.15 -2.83 -0.02 0.00 -1.56 0.00 0.00 34.95 30.39 2j0k s ARG 86 CO 0.03 0.35 -0.06 -1.17 -0.81 0.00 0.00 175.30 173.63 2j0k s LEU 87 N 0.05 3.11 -0.12 -0.88 2.96 0.20 -0.94 118.68 123.05 2j0k s LEU 87 Ca -0.00 -0.17 -0.11 0.00 -0.22 0.00 0.00 54.13 53.63 2j0k s LEU 87 Cb -0.13 -1.73 0.03 0.00 0.50 0.00 0.00 46.19 44.86 2j0k s LEU 87 CO 0.03 0.19 0.32 -0.55 -1.32 0.00 0.00 176.35 175.02 2j0k s SER 88 N 0.24 -0.35 0.65 3.68 0.15 0.12 -0.52 113.70 117.67 2j0k s SER 88 Ca -0.04 0.66 -0.14 0.00 0.70 0.00 0.00 55.95 57.13 2j0k s SER 88 Cb -0.14 0.65 -0.01 0.00 -1.71 0.00 0.00 66.02 64.81 2j0k s SER 88 CO 0.04 -0.12 1.07 -2.28 1.20 0.00 0.00 173.24 173.15 2j0k s HIS 89 N 0.33 2.89 -0.29 3.44 2.46 -1.26 0.61 115.29 123.47 2j0k s HIS 89 Ca -0.01 1.51 0.23 0.00 0.47 0.00 0.00 55.06 57.25 2j0k s HIS 89 Cb -0.03 -3.02 0.04 0.00 -0.13 0.00 0.00 32.58 29.44 2j0k s HIS 89 CO -0.01 -1.34 1.08 -0.07 -2.47 0.00 0.00 174.74 171.93 2j0k h LEU 90 N -0.05 0.00 0.00 8.88 3.38 -1.72 -3.40 115.31 122.40 2j0k h LEU 90 Ca -0.46 -0.03 -0.11 0.00 0.09 0.00 0.00 57.88 57.37 2j0k h LEU 90 Cb 1.22 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.96 2j0k h LEU 90 CO 0.56 0.02 -0.88 0.00 0.09 0.00 0.00 178.44 178.23 2j0k n GLN 91 N -2.60 0.50 -2.55 1.13 6.02 -1.26 -4.95 117.38 113.67 2j0k n GLN 91 Ca 0.00 0.55 -0.28 0.00 -0.01 0.00 0.00 57.00 57.26 2j0k n GLN 91 Cb 0.53 -1.72 0.00 0.00 1.02 0.00 0.00 30.24 30.08 2j0k n GLN 91 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 177.06 174.51 2j0k s SER 92 N -6.26 6.23 0.00 1.08 1.04 -1.26 -5.02 113.70 109.50 2j0k s SER 92 Ca -0.21 0.97 0.25 0.00 0.48 0.00 0.00 55.95 57.43 2j0k s SER 92 Cb 0.04 -2.24 0.40 0.00 0.10 0.00 0.00 66.02 64.32 2j0k s SER 92 CO 0.39 -0.63 1.35 -0.62 0.98 0.00 0.00 173.24 174.71 2j0k n GLU 93 N -2.32 1.16 -1.34 4.02 1.02 -1.26 -4.53 120.64 117.39 2j0k n GLU 93 Ca 0.01 -0.85 -0.32 0.00 -0.02 0.00 0.00 57.16 55.98 2j0k n GLU 93 Cb 0.55 -1.48 0.09 0.00 -0.02 0.00 0.00 31.44 30.58 2j0k n GLU 93 CO 0.00 0.00 0.00 -1.83 1.18 0.00 0.00 177.13 176.48 2j0k s GLU 94 N -2.42 2.14 0.01 3.49 -1.05 -1.26 -5.03 118.70 114.58 2j0k s GLU 94 Ca 0.23 1.47 0.01 0.00 -0.15 0.00 0.00 54.97 56.53 2j0k s GLU 94 Cb 0.19 -1.86 -0.01 0.00 -0.44 0.00 0.00 34.13 32.01 2j0k s GLU 94 CO 0.52 -1.77 -0.05 0.08 0.95 0.00 0.00 175.26 174.99 2j0k s VAL 95 N -2.44 0.34 -0.13 1.83 1.01 -1.26 -4.37 120.40 115.37 2j0k s VAL 95 Ca 0.67 -0.42 -0.01 0.00 0.00 0.00 0.00 61.98 62.23 2j0k s VAL 95 Cb -0.22 -0.33 0.03 0.00 0.00 0.00 0.00 36.38 35.85 2j0k s VAL 95 CO 0.49 -0.06 -0.06 -1.00 0.00 0.00 0.00 175.10 174.46 2j0k s HIS 96 N -0.48 1.54 -0.23 5.22 3.76 0.32 -4.90 115.29 120.52 2j0k s HIS 96 Ca -0.02 -0.85 -0.14 0.00 -0.15 0.00 0.00 55.06 53.89 2j0k s HIS 96 Cb -0.04 -1.25 -0.04 0.00 1.11 0.00 0.00 32.58 32.36 2j0k s HIS 96 CO -0.00 -0.55 0.34 -1.58 -0.85 0.00 0.00 174.74 172.10 2j0k s TRP 97 N 1.69 3.32 -0.20 1.40 0.52 -1.26 0.61 118.94 125.03 2j0k s TRP 97 Ca 0.03 0.47 -0.16 0.00 0.02 0.00 0.00 56.10 56.46 2j0k s TRP 97 Cb -0.14 -2.48 -0.04 0.00 -1.15 0.00 0.00 33.47 29.67 2j0k s TRP 97 CO -0.08 -0.05 0.40 -0.51 0.02 0.00 0.00 176.95 176.72 2j0k s LEU 98 N 1.47 4.16 0.37 2.99 1.43 -0.80 -4.91 118.68 123.39 2j0k s LEU 98 Ca 0.15 0.53 -0.25 0.00 -1.03 0.00 0.00 54.13 53.53 2j0k s LEU 98 Cb -0.15 -2.52 -0.12 0.00 0.03 0.00 0.00 46.19 43.43 2j0k s LEU 98 CO 0.08 -0.07 0.87 1.57 0.23 0.00 0.00 176.35 179.03 2j0k n HIS 99 N 4.40 0.70 0.03 0.29 -0.00 -1.26 -4.63 115.22 114.75 2j0k n HIS 99 Ca -0.08 0.63 -0.11 0.00 -0.00 0.00 0.00 57.72 58.16 2j0k n HIS 99 Cb 0.51 -2.16 -0.04 0.00 -0.00 0.00 0.00 29.99 28.30 2j0k n HIS 99 CO 0.00 0.00 0.00 -0.07 -0.00 0.00 0.00 176.34 176.27 2j0k h LEU 100 N 1.45 -0.86 -1.15 0.27 3.38 -1.95 -3.16 115.31 113.28 2j0k h LEU 100 Ca -0.41 0.12 0.00 0.00 0.09 0.00 0.00 57.88 57.68 2j0k h LEU 100 Cb 1.36 0.36 0.00 0.00 0.09 0.00 0.00 40.66 42.47 2j0k h LEU 100 CO 0.57 -0.34 0.00 0.44 0.09 0.00 0.00 178.44 179.20 2j0k h ASP 101 N -0.39 0.00 -3.53 -0.43 3.32 -1.94 -0.65 116.42 112.79 2j0k h ASP 101 Ca 0.08 0.00 -0.52 0.00 0.02 0.00 0.00 57.03 56.61 2j0k h ASP 101 Cb 0.51 0.00 0.05 0.00 0.22 0.00 0.00 39.33 40.11 2j0k h ASP 101 CO -0.29 0.00 0.66 -0.32 -1.72 0.00 0.00 179.24 177.58 2j0k s MET 102 N -3.50 4.37 0.03 3.56 1.75 -1.20 -4.70 119.30 119.60 2j0k s MET 102 Ca 0.02 2.14 -0.30 0.00 -1.25 0.00 0.00 55.69 56.30 2j0k s MET 102 Cb 0.09 -3.14 -0.05 0.00 2.84 0.00 0.00 34.83 34.56 2j0k s MET 102 CO 0.43 -0.25 1.26 0.20 -0.65 0.00 0.00 175.02 176.01 2j0k s GLY 103 N 0.08 2.18 0.34 2.11 0.00 -1.26 -0.06 107.32 110.70 2j0k s GLY 103 Ca 0.55 0.85 0.12 0.00 0.00 0.00 0.00 44.72 46.23 2j0k s GLY 103 CO 0.43 2.21 1.61 -2.08 0.00 0.00 0.00 173.10 175.27 2j0k h VAL 104 N 4.66 0.12 0.27 1.40 2.07 0.88 -2.24 116.25 123.41 2j0k h VAL 104 Ca -0.39 -0.04 -0.01 0.00 0.82 0.00 0.00 66.70 67.08 2j0k h VAL 104 Cb 1.20 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.97 2j0k h VAL 104 CO 0.85 0.02 -0.13 0.28 0.02 0.00 0.00 177.57 178.61 2j0k h SER 105 N 0.10 -0.31 -0.20 0.57 0.02 -1.92 -1.59 113.55 110.23 2j0k h SER 105 Ca 0.72 -0.06 -0.05 0.00 -0.84 0.00 0.00 61.79 61.56 2j0k h SER 105 Cb 1.71 0.08 -0.02 0.00 0.14 0.00 0.00 62.40 64.32 2j0k h SER 105 CO -0.75 -0.13 -0.02 -0.55 -1.14 0.00 0.00 176.83 174.24 2j0k h ASN 106 N -0.46 0.45 0.15 3.07 -1.07 -1.80 0.32 115.58 116.24 2j0k h ASN 106 Ca -0.04 -0.09 0.01 0.00 0.07 0.00 0.00 56.30 56.26 2j0k h ASN 106 Cb 0.35 -0.12 -0.03 0.00 -2.07 0.00 0.00 38.32 36.45 2j0k h ASN 106 CO 0.06 0.54 -0.24 0.58 0.07 0.00 0.00 177.43 178.43 2j0k h VAL 107 N 0.47 0.46 0.37 6.14 2.07 -1.27 0.49 116.25 124.98 2j0k h VAL 107 Ca 0.10 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.61 2j0k h VAL 107 Cb 0.33 0.46 -0.03 0.00 -1.52 0.00 0.00 31.29 30.54 2j0k h VAL 107 CO 0.01 0.00 -0.48 -0.09 0.02 0.00 0.00 177.57 177.03 2j0k h ARG 108 N -0.46 -0.84 -0.64 1.57 9.65 -0.89 -2.61 114.38 120.16 2j0k h ARG 108 Ca 0.02 0.06 0.11 0.00 -1.10 0.00 0.00 59.98 59.06 2j0k h ARG 108 Cb 0.47 0.19 -0.11 0.00 -1.39 0.00 0.00 29.97 29.14 2j0k h ARG 108 CO -0.12 -0.56 -0.23 -1.91 2.80 0.00 0.00 179.97 179.95 2j0k n GLU 109 N -5.29 -0.13 0.00 0.20 2.13 0.11 -0.09 120.64 117.57 2j0k n GLU 109 Ca -0.10 0.99 0.13 0.00 0.66 0.00 0.00 57.16 58.83 2j0k n GLU 109 Cb 0.42 -1.47 0.28 0.00 0.27 0.00 0.00 31.44 30.94 2j0k n GLU 109 CO 0.00 0.00 0.00 0.36 -0.41 0.00 0.00 177.13 177.08 2j0k n LYS 110 N -4.97 1.92 -0.07 5.31 -0.00 0.14 -1.96 118.16 118.53 2j0k n LYS 110 Ca 0.07 -1.42 -0.10 0.00 -0.00 0.00 0.00 58.31 56.87 2j0k n LYS 110 Cb 0.27 -1.47 -0.06 0.00 -0.00 0.00 0.00 35.03 33.77 2j0k n LYS 110 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.40 178.59 2j0k n PHE 111 N 0.70 0.00 -0.35 5.58 3.72 -0.80 -4.52 117.46 121.79 2j0k n PHE 111 Ca 0.16 0.00 0.08 0.00 -0.05 0.00 0.00 57.45 57.64 2j0k n PHE 111 Cb 0.48 -0.53 0.26 0.00 -0.94 0.00 0.00 39.48 38.75 2j0k n PHE 111 CO 0.00 0.00 0.00 1.49 -0.05 0.00 0.00 176.76 178.20 2j0k h GLU 112 N -0.01 0.92 -0.32 -1.08 4.81 -0.61 -1.12 114.58 117.17 2j0k h GLU 112 Ca -0.31 -0.06 0.03 0.00 -0.13 0.00 0.00 59.36 58.90 2j0k h GLU 112 Cb 1.47 -0.21 -0.04 0.00 0.63 0.00 0.00 28.75 30.60 2j0k h GLU 112 CO -0.05 0.61 -0.18 1.28 -0.73 0.00 0.00 179.01 179.94 2j0k n LEU 113 N -4.62 -0.32 0.00 1.64 7.99 -0.83 -2.86 117.00 118.01 2j0k n LEU 113 Ca 0.19 0.57 0.00 0.00 -0.01 0.00 0.00 56.01 56.76 2j0k n LEU 113 Cb 0.38 -0.08 0.00 0.00 -0.11 0.00 0.00 43.42 43.60 2j0k n LEU 113 CO 0.27 -0.47 0.10 0.00 -1.51 0.00 0.00 177.39 175.78 2j0k n ALA 114 N -3.77 -0.02 -2.94 -1.18 0.00 -0.44 -4.96 120.51 107.19 2j0k n ALA 114 Ca 0.01 0.00 -0.26 0.00 0.00 0.00 0.00 53.44 53.19 2j0k n ALA 114 Cb 0.09 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.51 2j0k n ALA 114 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.50 176.49 2j0k s HIS 115 N -0.52 3.47 0.40 0.00 3.76 -1.12 -5.09 115.29 116.20 2j0k s HIS 115 Ca 0.00 0.12 -0.26 0.00 -0.15 0.00 0.00 55.06 54.77 2j0k s HIS 115 Cb 0.00 -1.67 -0.09 0.00 1.11 0.00 0.00 32.58 31.94 2j0k s HIS 115 CO 0.00 0.52 1.28 -2.14 -0.85 0.00 0.00 174.74 173.55 2j0k s PRO 116 N -3.17 3.98 0.56 8.40 0.02 -1.26 -4.13 135.00 139.40 2j0k s PRO 116 Ca 0.34 2.11 0.38 0.00 0.02 0.00 0.00 61.00 63.86 2j0k s PRO 116 Cb -0.11 -2.75 1.50 0.00 0.02 0.00 0.00 34.50 33.16 2j0k s PRO 116 CO 0.28 -0.46 1.67 -1.00 -0.33 0.00 0.00 177.00 177.16 2j0k h PRO 117 N 2.68 0.00 -0.63 5.54 0.13 -1.96 -1.76 132.00 136.01 2j0k h PRO 117 Ca -0.49 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.64 2j0k h PRO 117 Cb 1.24 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.37 2j0k h PRO 117 CO 0.63 0.00 0.00 0.39 -0.23 0.00 0.00 178.00 178.79 2j0k n GLU 118 N -3.90 3.18 -0.05 0.86 4.71 -1.26 -3.00 120.64 121.18 2j0k n GLU 118 Ca 0.29 -2.33 0.02 0.00 -0.01 0.00 0.00 57.16 55.13 2j0k n GLU 118 Cb 1.46 -1.76 0.04 0.00 -1.01 0.00 0.00 31.44 30.17 2j0k n GLU 118 CO 0.00 0.00 0.00 -0.85 0.09 0.00 0.00 177.13 176.37 2j0k n GLU 119 N 0.92 2.50 -3.85 3.49 0.28 -0.66 -5.01 120.64 118.30 2j0k n GLU 119 Ca 0.21 -1.54 -0.31 0.00 -0.16 0.00 0.00 57.16 55.35 2j0k n GLU 119 Cb 0.74 -1.08 -0.04 0.00 1.43 0.00 0.00 31.44 32.48 2j0k n GLU 119 CO 0.00 0.00 0.00 -1.58 -0.16 0.00 0.00 177.13 175.39 2j0k s TRP 120 N -0.91 3.51 -0.05 -1.84 0.23 -1.16 -1.83 118.94 116.90 2j0k s TRP 120 Ca 0.07 0.34 0.02 0.00 -2.03 0.00 0.00 56.10 54.50 2j0k s TRP 120 Cb 0.04 -1.83 0.02 0.00 0.03 0.00 0.00 33.47 31.72 2j0k s TRP 120 CO 0.05 0.56 -0.09 0.21 0.96 0.00 0.00 176.95 178.64 2j0k s LYS 121 N -2.46 1.25 -0.19 4.98 2.20 0.20 -4.93 119.74 120.79 2j0k s LYS 121 Ca 0.35 -0.27 -0.05 0.00 -0.36 0.00 0.00 55.97 55.64 2j0k s LYS 121 Cb -0.13 -1.10 -0.03 0.00 -1.51 0.00 0.00 37.83 35.06 2j0k s LYS 121 CO 0.26 -0.01 0.01 0.71 -0.36 0.00 0.00 175.35 175.96 2j0k s TYR 122 N 0.70 3.08 0.01 4.03 1.51 -1.26 0.14 117.35 125.57 2j0k s TYR 122 Ca -0.12 -0.28 0.03 0.00 -1.01 0.00 0.00 57.07 55.69 2j0k s TYR 122 Cb -0.14 -2.06 -0.01 0.00 -0.11 0.00 0.00 41.96 39.63 2j0k s TYR 122 CO 0.02 -0.10 -0.10 -1.83 -1.11 0.00 0.00 175.55 172.43 2j0k s GLU 123 N 0.72 0.76 0.11 -0.62 -1.05 -0.12 -0.44 118.70 118.06 2j0k s GLU 123 Ca 0.00 -0.52 -0.29 0.00 -0.15 0.00 0.00 54.97 54.01 2j0k s GLU 123 Cb -0.14 -0.72 -0.06 0.00 -0.44 0.00 0.00 34.13 32.77 2j0k s GLU 123 CO 0.02 0.18 0.91 -1.17 0.95 0.00 0.00 175.26 176.15 2j0k s LEU 124 N -0.70 4.51 -0.01 1.83 2.96 -0.04 -1.11 118.68 126.12 2j0k s LEU 124 Ca 0.01 1.73 -0.04 0.00 -0.22 0.00 0.00 54.13 55.62 2j0k s LEU 124 Cb -0.06 -3.50 -0.00 0.00 0.50 0.00 0.00 46.19 43.13 2j0k s LEU 124 CO 0.00 -0.01 0.07 -0.13 -1.32 0.00 0.00 176.35 174.96 2j0k s ARG 125 N -0.20 0.29 -0.13 1.98 0.52 -0.56 -4.58 118.95 116.27 2j0k s ARG 125 Ca 0.44 -0.27 -0.29 0.00 -0.52 0.00 0.00 55.73 55.09 2j0k s ARG 125 Cb -0.23 0.12 -0.02 0.00 0.52 0.00 0.00 34.95 35.34 2j0k s ARG 125 CO 0.28 -0.06 1.16 0.42 0.02 0.00 0.00 175.30 177.12 2j0k s ILE 126 N -0.88 4.43 0.00 1.52 1.01 -1.26 -0.47 121.20 125.55 2j0k s ILE 126 Ca -0.10 1.73 0.00 0.00 0.00 0.00 0.00 60.65 62.28 2j0k s ILE 126 Cb -0.06 -4.11 0.00 0.00 0.01 0.00 0.00 42.46 38.30 2j0k s ILE 126 CO 0.00 -0.07 0.00 -1.14 0.00 0.00 0.00 174.94 173.73 2j0k n ARG 127 N 5.81 2.79 -3.65 2.79 0.63 0.20 -4.94 116.66 120.28 2j0k n ARG 127 Ca 0.12 0.00 -0.39 0.00 -0.92 0.00 0.00 57.85 56.66 2j0k n ARG 127 Cb 0.46 -0.94 -0.12 0.00 0.45 0.00 0.00 32.46 32.31 2j0k n ARG 127 CO 0.00 0.00 0.00 0.71 -2.51 0.00 0.00 177.63 175.83 2j0k s TYR 128 N -1.89 3.19 -0.19 -0.14 1.51 -1.00 -5.04 117.35 113.78 2j0k s TYR 128 Ca 0.00 -0.64 -0.05 0.00 -1.01 0.00 0.00 57.07 55.37 2j0k s TYR 128 Cb 0.00 -2.36 -0.03 0.00 -0.11 0.00 0.00 41.96 39.46 2j0k s TYR 128 CO 0.00 -0.49 0.00 -0.51 -1.11 0.00 0.00 175.55 173.45 2j0k s LEU 129 N 1.60 3.35 1.32 -1.29 1.43 -1.26 -4.40 118.68 119.43 2j0k s LEU 129 Ca 0.04 -0.14 -0.20 0.00 -1.03 0.00 0.00 54.13 52.80 2j0k s LEU 129 Cb -0.17 -1.84 0.33 0.00 0.03 0.00 0.00 46.19 44.54 2j0k s LEU 129 CO 0.06 0.10 0.98 -2.84 0.23 0.00 0.00 176.35 174.88 2j0k s PRO 130 N 0.79 -2.16 -0.01 1.29 0.02 -1.26 -4.41 135.00 129.26 2j0k s PRO 130 Ca 0.01 0.26 -0.23 0.00 0.02 0.00 0.00 61.00 61.05 2j0k s PRO 130 Cb -0.14 -1.46 -0.20 0.00 0.02 0.00 0.00 34.50 32.73 2j0k s PRO 130 CO 0.02 -4.40 1.19 -0.22 -0.33 0.00 0.00 177.00 173.26 2j0k h LYS 131 N -3.08 0.20 -2.02 5.54 1.63 -2.00 -2.55 116.57 114.29 2j0k h LYS 131 Ca -0.48 -0.14 -0.77 0.00 -0.85 0.00 0.00 60.65 58.40 2j0k h LYS 131 Cb 1.33 0.02 -0.27 0.00 -0.60 0.00 0.00 32.23 32.72 2j0k h LYS 131 CO 0.35 0.76 1.05 0.41 -3.45 0.00 0.00 179.45 178.57 2j0k n GLY 132 N 0.57 5.60 0.36 5.01 0.00 -1.26 -4.81 105.19 110.66 2j0k n GLY 132 Ca -0.08 -2.49 -0.03 0.00 0.00 0.00 0.00 46.02 43.42 2j0k n GLY 132 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 173.32 173.59 2j0k h PHE 133 N 3.14 -0.99 0.12 1.61 -5.15 -1.80 0.09 116.94 113.97 2j0k h PHE 133 Ca 0.56 0.09 0.00 0.00 -0.20 0.00 0.00 57.97 58.42 2j0k h PHE 133 Cb 0.06 0.55 -0.02 0.00 0.22 0.00 0.00 35.95 36.77 2j0k h PHE 133 CO 1.19 -0.39 -0.25 -0.07 -2.00 0.00 0.00 178.31 176.79 2j0k h LEU 134 N -0.07 -0.74 -1.79 2.10 3.38 -1.90 -0.68 115.31 115.61 2j0k h LEU 134 Ca 0.30 0.07 0.25 0.00 0.09 0.00 0.00 57.88 58.59 2j0k h LEU 134 Cb 0.58 0.26 -0.05 0.00 0.09 0.00 0.00 40.66 41.54 2j0k h LEU 134 CO -0.84 -0.29 0.65 -1.13 0.09 0.00 0.00 178.44 176.92 2j0k h ASN 135 N -0.41 0.16 -0.13 -0.43 -0.73 -1.61 0.46 115.58 112.89 2j0k h ASN 135 Ca -0.01 0.02 -0.13 0.00 1.87 0.00 0.00 56.30 58.04 2j0k h ASN 135 Cb 0.39 -0.01 0.00 0.00 0.27 0.00 0.00 38.32 38.98 2j0k h ASN 135 CO -0.10 0.05 -0.44 -0.61 -0.37 0.00 0.00 177.43 175.96 2j0k h GLN 136 N 0.16 0.53 0.00 6.67 4.15 -0.51 -3.13 115.11 122.98 2j0k h GLN 136 Ca 0.47 -0.40 -0.01 0.00 0.77 0.00 0.00 58.65 59.48 2j0k h GLN 136 Cb 1.58 0.07 -0.00 0.00 0.21 0.00 0.00 27.48 29.34 2j0k h GLN 136 CO -0.09 1.02 -0.05 0.74 -1.93 0.00 0.00 178.83 178.52 2j0k h PHE 137 N 0.14 0.00 -1.27 3.99 0.05 0.61 -1.94 116.94 118.52 2j0k h PHE 137 Ca -0.02 0.00 0.42 0.00 3.82 0.00 0.00 57.97 62.19 2j0k h PHE 137 Cb 1.07 0.00 -0.13 0.00 2.00 0.00 0.00 35.95 38.89 2j0k h PHE 137 CO 0.11 0.05 0.81 1.15 -0.18 0.00 0.00 178.31 180.24 2j0k h THR 138 N 0.00 0.14 -0.18 -1.55 2.02 -1.32 1.52 112.91 113.53 2j0k h THR 138 Ca -0.00 -0.04 0.00 0.00 0.77 0.00 0.00 66.41 67.14 2j0k h THR 138 Cb 0.10 0.02 0.00 0.00 -1.74 0.00 0.00 68.15 66.53 2j0k h THR 138 CO 0.01 0.02 0.00 -0.62 0.37 0.00 0.00 175.52 175.30 2j0k n GLU 139 N -4.76 1.91 -3.18 6.66 1.02 -0.73 -4.33 120.64 117.23 2j0k n GLU 139 Ca 0.37 -1.36 -0.23 0.00 -0.02 0.00 0.00 57.16 55.91 2j0k n GLU 139 Cb 1.38 -1.43 -0.05 0.00 -0.02 0.00 0.00 31.44 31.31 2j0k n GLU 139 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 2j0k n ASP 140 N 0.60 1.80 -0.26 1.62 4.64 0.52 -5.01 116.55 120.46 2j0k n ASP 140 Ca 0.17 -3.11 -0.02 0.00 -1.38 0.00 0.00 54.79 50.45 2j0k n ASP 140 Cb 0.40 -0.62 0.00 0.00 -1.04 0.00 0.00 41.12 39.86 2j0k n ASP 140 CO 0.00 0.00 0.00 0.29 -0.82 0.00 0.00 177.20 176.67 2j0k n LYS 141 N 0.64 -0.19 0.28 -0.67 4.01 -1.16 -0.09 118.16 120.99 2j0k n LYS 141 Ca 0.26 1.00 0.18 0.00 -0.51 0.00 0.00 58.31 59.23 2j0k n LYS 141 Cb 0.53 -1.47 0.96 0.00 -0.51 0.00 0.00 35.03 34.53 2j0k n LYS 141 CO 0.00 0.00 0.00 -1.35 -1.11 0.00 0.00 177.40 174.94 2j0k h PRO 142 N 0.00 0.00 0.14 1.97 0.11 -1.88 0.23 132.00 132.58 2j0k h PRO 142 Ca 0.19 0.00 -0.35 0.00 0.11 0.00 0.00 66.00 65.96 2j0k h PRO 142 Cb 0.35 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.46 2j0k h PRO 142 CO -0.64 0.00 -1.81 1.15 -0.21 0.00 0.00 178.00 176.50 2j0k h THR 143 N 0.00 0.85 -0.20 -1.15 2.02 -0.81 -0.56 112.91 113.06 2j0k h THR 143 Ca 0.03 -2.51 0.03 0.00 0.77 0.00 0.00 66.41 64.73 2j0k h THR 143 Cb 0.24 2.65 -0.03 0.00 -1.74 0.00 0.00 68.15 69.27 2j0k h THR 143 CO -0.00 0.85 0.01 0.25 0.37 0.00 0.00 175.52 177.00 2j0k h LEU 144 N 0.08 -0.06 0.18 2.58 5.85 -0.48 0.18 115.31 123.65 2j0k h LEU 144 Ca -0.35 0.04 0.01 0.00 0.84 0.00 0.00 57.88 58.41 2j0k h LEU 144 Cb 2.06 0.07 -0.02 0.00 0.37 0.00 0.00 40.66 43.14 2j0k h LEU 144 CO 0.14 -0.00 -0.20 0.78 -0.34 0.00 0.00 178.44 178.82 2j0k h ASN 145 N 0.08 -0.54 -0.26 1.25 4.21 -0.74 0.34 115.58 119.92 2j0k h ASN 145 Ca 0.09 0.05 0.06 0.00 1.21 0.00 0.00 56.30 57.72 2j0k h ASN 145 Cb 0.11 0.19 -0.08 0.00 -1.12 0.00 0.00 38.32 37.42 2j0k h ASN 145 CO -0.15 -0.29 -0.30 0.15 -1.29 0.00 0.00 177.43 175.55 2j0k h PHE 146 N -0.42 -0.82 -0.56 1.19 3.57 -0.83 0.14 116.94 119.21 2j0k h PHE 146 Ca 0.01 0.05 -0.04 0.00 3.53 0.00 0.00 57.97 61.51 2j0k h PHE 146 Cb 0.40 0.40 -0.02 0.00 2.79 0.00 0.00 35.95 39.52 2j0k h PHE 146 CO -0.16 -0.37 0.19 0.35 -2.23 0.00 0.00 178.31 176.09 2j0k h PHE 147 N -0.30 0.88 -0.32 0.41 -0.00 -0.39 0.57 116.94 117.79 2j0k h PHE 147 Ca 0.14 -0.08 0.07 0.00 -0.00 0.00 0.00 57.97 58.09 2j0k h PHE 147 Cb 0.52 -0.26 -0.06 0.00 -0.00 0.00 0.00 35.95 36.15 2j0k h PHE 147 CO -0.45 0.74 -0.09 -0.92 -0.00 0.00 0.00 178.31 177.59 2j0k h TYR 148 N 0.77 -0.19 -0.06 0.41 3.20 0.08 -1.35 116.97 119.83 2j0k h TYR 148 Ca 0.18 0.03 -0.00 0.00 3.14 0.00 0.00 58.73 62.08 2j0k h TYR 148 Cb 0.26 0.14 -0.00 0.00 1.54 0.00 0.00 36.73 38.66 2j0k h TYR 148 CO 0.01 -0.15 0.04 1.96 -1.64 0.00 0.00 178.16 178.38 2j0k h GLN 149 N -0.01 0.08 -0.47 1.82 1.08 -0.23 -0.07 115.11 117.32 2j0k h GLN 149 Ca 0.16 -0.01 0.01 0.00 -1.45 0.00 0.00 58.65 57.36 2j0k h GLN 149 Cb 0.25 -0.02 -0.03 0.00 -0.05 0.00 0.00 27.48 27.64 2j0k h GLN 149 CO -0.34 0.10 0.30 0.37 -0.95 0.00 0.00 178.83 178.31 2j0k h GLN 150 N 0.05 0.60 0.29 1.46 4.15 -0.73 0.25 115.11 121.17 2j0k h GLN 150 Ca 0.02 -0.04 -0.01 0.00 0.77 0.00 0.00 58.65 59.39 2j0k h GLN 150 Cb 0.04 -0.13 0.00 0.00 0.21 0.00 0.00 27.48 27.59 2j0k h GLN 150 CO -0.00 0.40 -0.14 0.28 -1.93 0.00 0.00 178.83 177.43 2j0k h VAL 151 N 0.62 0.74 -0.62 2.39 2.07 -1.14 -2.77 116.25 117.53 2j0k h VAL 151 Ca 0.18 -0.55 0.13 0.00 0.82 0.00 0.00 66.70 67.28 2j0k h VAL 151 Cb -0.05 1.02 -0.10 0.00 -1.52 0.00 0.00 31.29 30.65 2j0k h VAL 151 CO -0.05 0.11 0.03 0.50 0.02 0.00 0.00 177.57 178.17 2j0k h LYS 152 N -0.69 0.14 -0.67 1.57 3.64 -0.82 0.13 116.57 119.87 2j0k h LYS 152 Ca -0.04 -0.01 0.13 0.00 -1.27 0.00 0.00 60.65 59.46 2j0k h LYS 152 Cb 0.48 -0.03 -0.10 0.00 -0.41 0.00 0.00 32.23 32.17 2j0k h LYS 152 CO 0.07 0.09 0.16 -0.97 -2.27 0.00 0.00 179.45 176.52 2j0k h ASN 153 N 0.14 0.03 -0.12 4.20 -1.24 -0.94 0.93 115.58 118.58 2j0k h ASN 153 Ca 0.33 0.13 -0.10 0.00 0.71 0.00 0.00 56.30 57.36 2j0k h ASN 153 Cb 0.53 0.17 -0.01 0.00 0.73 0.00 0.00 38.32 39.73 2j0k h ASN 153 CO -0.51 -0.00 -0.24 0.44 -1.29 0.00 0.00 177.43 175.83 2j0k h ASP 154 N 0.28 0.56 -0.46 1.15 5.19 -0.58 -0.53 116.42 122.04 2j0k h ASP 154 Ca 0.36 -0.19 -0.01 0.00 -0.62 0.00 0.00 57.03 56.57 2j0k h ASP 154 Cb 0.57 -0.15 -0.02 0.00 0.18 0.00 0.00 39.33 39.90 2j0k h ASP 154 CO -0.45 0.80 0.26 0.22 -3.12 0.00 0.00 179.24 176.96 2j0k h TYR 155 N 0.49 0.61 -0.13 4.55 3.20 0.67 0.11 116.97 126.48 2j0k h TYR 155 Ca 0.07 -0.01 -0.01 0.00 3.14 0.00 0.00 58.73 61.92 2j0k h TYR 155 Cb 0.69 -0.20 -0.01 0.00 1.54 0.00 0.00 36.73 38.75 2j0k h TYR 155 CO 0.03 0.45 0.04 0.52 -1.64 0.00 0.00 178.16 177.56 2j0k h MET 156 N 0.60 0.20 -0.26 1.82 2.86 -0.43 -0.82 114.93 118.91 2j0k h MET 156 Ca 0.16 -0.04 -0.11 0.00 -2.06 0.00 0.00 59.70 57.65 2j0k h MET 156 Cb 0.02 -0.03 -0.01 0.00 0.06 0.00 0.00 31.60 31.64 2j0k h MET 156 CO -0.03 0.32 -0.30 -0.07 1.06 0.00 0.00 176.91 177.89 2j0k h LEU 157 N 0.03 0.53 0.00 1.22 4.07 -1.00 -3.36 115.31 116.81 2j0k h LEU 157 Ca 0.04 -0.20 -0.40 0.00 0.08 0.00 0.00 57.88 57.40 2j0k h LEU 157 Cb 0.20 -0.15 -0.06 0.00 1.08 0.00 0.00 40.66 41.74 2j0k h LEU 157 CO -0.00 0.81 -2.32 -0.62 -1.08 0.00 0.00 178.44 175.23 2j0k n GLU 158 N -4.09 0.51 -0.62 1.13 1.02 0.39 -4.86 120.64 114.12 2j0k n GLU 158 Ca -0.01 0.23 0.04 0.00 -0.02 0.00 0.00 57.16 57.40 2j0k n GLU 158 Cb 0.44 -1.36 0.06 0.00 -0.02 0.00 0.00 31.44 30.56 2j0k n GLU 158 CO 0.00 0.00 0.00 0.44 1.18 0.00 0.00 177.13 178.75 2j0k n ILE 159 N -4.09 0.69 -0.07 -3.67 -6.64 -0.91 -4.87 119.36 99.81 2j0k n ILE 159 Ca -0.47 -1.11 -0.12 0.00 -1.77 0.00 0.00 62.75 59.28 2j0k n ILE 159 Cb 0.83 0.35 -0.06 0.00 -1.44 0.00 0.00 39.64 39.32 2j0k n ILE 159 CO 0.00 0.00 0.00 0.00 -1.77 0.00 0.00 176.55 174.78 2j0k h ALA 160 N 0.32 0.27 -0.82 -1.28 0.00 -1.31 -2.78 119.26 113.65 2j0k h ALA 160 Ca -0.05 -0.29 -0.01 0.00 0.00 0.00 0.00 54.91 54.56 2j0k h ALA 160 Cb 1.37 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 19.05 2j0k h ALA 160 CO 0.02 0.10 0.48 -0.44 0.00 0.00 0.00 179.25 179.41 2j0k h ASP 161 N 0.09 1.00 -0.30 0.00 3.45 -1.87 -3.19 116.42 115.60 2j0k h ASP 161 Ca 0.04 -0.07 0.00 0.00 0.43 0.00 0.00 57.03 57.43 2j0k h ASP 161 Cb 0.59 -0.25 0.00 0.00 -0.56 0.00 0.00 39.33 39.11 2j0k h ASP 161 CO 0.03 0.78 0.00 0.00 -1.57 0.00 0.00 179.24 178.48 2j0k n GLN 162 N -4.36 2.32 -2.13 3.56 0.00 -1.23 -4.91 117.38 110.63 2j0k n GLN 162 Ca 0.09 -2.12 -0.32 0.00 0.00 0.00 0.00 57.00 54.65 2j0k n GLN 162 Cb 0.08 -1.46 -0.01 0.00 0.00 0.00 0.00 30.24 28.85 2j0k n GLN 162 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.06 177.60 2j0k s VAL 163 N -1.46 4.34 0.20 -0.39 0.11 -1.05 -5.00 120.40 117.14 2j0k s VAL 163 Ca 0.34 1.01 -0.30 0.00 -2.93 0.00 0.00 61.98 60.10 2j0k s VAL 163 Cb 0.20 -3.63 -0.16 0.00 -1.53 0.00 0.00 36.38 31.26 2j0k s VAL 163 CO 0.29 -0.75 0.82 -0.67 -3.33 0.00 0.00 175.10 171.46 2j0k n ASP 164 N -2.06 0.01 0.26 3.54 4.64 -1.26 -4.82 116.55 116.86 2j0k n ASP 164 Ca 0.07 1.15 0.15 0.00 -1.38 0.00 0.00 54.79 54.78 2j0k n ASP 164 Cb 0.54 -1.08 0.64 0.00 -1.04 0.00 0.00 41.12 40.18 2j0k n ASP 164 CO 0.00 0.00 0.00 -0.61 -0.82 0.00 0.00 177.20 175.77 2j0k h GLN 165 N 1.91 0.00 0.06 -0.67 -0.00 -1.95 -1.65 115.11 112.81 2j0k h GLN 165 Ca -0.36 0.00 -0.27 0.00 -0.00 0.00 0.00 58.65 58.02 2j0k h GLN 165 Cb 1.40 0.00 -0.02 0.00 0.00 0.00 0.00 27.48 28.85 2j0k h GLN 165 CO 0.61 0.08 -1.38 0.93 0.00 0.00 0.00 178.83 179.07 2j0k h GLU 166 N 0.00 0.12 -0.09 1.69 5.08 -1.99 -2.36 114.58 117.04 2j0k h GLU 166 Ca -0.00 -0.21 0.00 0.00 -1.00 0.00 0.00 59.36 58.15 2j0k h GLU 166 Cb 0.55 0.08 -0.00 0.00 0.50 0.00 0.00 28.75 29.87 2j0k h GLU 166 CO 0.01 0.96 0.05 0.82 -1.00 0.00 0.00 179.01 179.86 2j0k h ILE 167 N 0.03 1.04 -0.47 3.13 1.08 -1.87 -0.21 117.51 120.25 2j0k h ILE 167 Ca -0.17 -0.10 -0.01 0.00 -0.39 0.00 0.00 64.86 64.20 2j0k h ILE 167 Cb 1.94 0.95 -0.02 0.00 -3.07 0.00 0.00 36.82 36.61 2j0k h ILE 167 CO 0.14 0.04 0.27 0.00 -0.69 0.00 0.00 178.15 177.90 2j0k h ALA 168 N 1.01 1.59 -0.01 1.87 0.00 -1.35 -1.73 119.26 120.64 2j0k h ALA 168 Ca 0.03 -0.07 -0.00 0.00 0.00 0.00 0.00 54.91 54.87 2j0k h ALA 168 Cb 0.01 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 17.61 2j0k h ALA 168 CO -0.01 0.35 -0.01 -0.07 0.00 0.00 0.00 179.25 179.52 2j0k h LEU 169 N 0.65 0.02 0.29 0.00 3.38 -1.16 -2.62 115.31 115.86 2j0k h LEU 169 Ca 0.17 -0.52 -0.01 0.00 0.09 0.00 0.00 57.88 57.60 2j0k h LEU 169 Cb -0.00 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.74 2j0k h LEU 169 CO -0.03 0.54 -0.14 0.11 0.09 0.00 0.00 178.44 179.01 2j0k h LYS 170 N -0.50 -0.38 -0.41 1.13 1.57 -0.86 -1.97 116.57 115.15 2j0k h LYS 170 Ca 0.00 0.03 0.08 0.00 -1.87 0.00 0.00 60.65 58.89 2j0k h LYS 170 Cb 0.53 0.09 -0.08 0.00 0.08 0.00 0.00 32.23 32.85 2j0k h LYS 170 CO 0.00 -0.24 -0.15 -0.07 -0.57 0.00 0.00 179.45 178.42 2j0k h LEU 171 N -0.40 -0.52 -1.35 2.94 3.38 -1.41 -0.42 115.31 117.52 2j0k h LEU 171 Ca -0.04 0.14 0.01 0.00 0.09 0.00 0.00 57.88 58.08 2j0k h LEU 171 Cb 0.31 0.31 -0.03 0.00 0.09 0.00 0.00 40.66 41.33 2j0k h LEU 171 CO 0.07 -0.18 0.45 1.23 0.09 0.00 0.00 178.44 180.09 2j0k h GLY 172 N -0.06 0.94 1.11 0.83 0.00 -1.32 -1.58 103.07 102.98 2j0k h GLY 172 Ca 0.20 -0.34 -0.12 0.00 0.00 0.00 0.00 47.33 47.06 2j0k h GLY 172 CO -0.45 0.33 -0.14 0.00 0.00 0.00 0.00 176.54 176.27 2j0k h LEU 174 N 0.91 0.73 -0.29 0.00 3.38 -0.46 0.49 115.31 120.08 2j0k h LEU 174 Ca 0.13 -0.12 -0.02 0.00 0.09 0.00 0.00 57.88 57.96 2j0k h LEU 174 Cb 0.72 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.26 2j0k h LEU 174 CO 0.05 0.71 0.10 -0.08 0.09 0.00 0.00 178.44 179.32 2j0k h GLU 175 N 0.77 0.45 -0.80 1.13 4.57 -1.09 -1.08 114.58 118.53 2j0k h GLU 175 Ca 0.17 -0.09 0.06 0.00 -1.18 0.00 0.00 59.36 58.32 2j0k h GLU 175 Cb 0.26 -0.07 -0.06 0.00 -0.16 0.00 0.00 28.75 28.72 2j0k h GLU 175 CO -0.00 0.49 0.48 0.82 -1.18 0.00 0.00 179.01 179.62 2j0k h ILE 176 N 0.31 1.03 0.37 2.32 2.04 -0.74 0.20 117.51 123.04 2j0k h ILE 176 Ca 0.09 -0.30 -0.02 0.00 1.00 0.00 0.00 64.86 65.63 2j0k h ILE 176 Cb 0.23 0.06 0.00 0.00 -0.74 0.00 0.00 36.82 36.37 2j0k h ILE 176 CO -0.00 0.16 -0.18 -0.09 0.00 0.00 0.00 178.15 178.04 2j0k h ARG 177 N 0.89 -0.48 -0.40 2.37 9.65 -0.78 -2.33 114.38 123.30 2j0k h ARG 177 Ca 0.35 0.03 -0.00 0.00 -1.10 0.00 0.00 59.98 59.26 2j0k h ARG 177 Cb 0.16 0.11 -0.02 0.00 -1.39 0.00 0.00 29.97 28.83 2j0k h ARG 177 CO -0.17 -0.21 0.24 -0.09 2.80 0.00 0.00 179.97 182.55 2j0k h ARG 178 N -0.70 0.55 0.66 0.20 2.43 -0.83 -3.19 114.38 113.49 2j0k h ARG 178 Ca -0.05 -0.05 -0.03 0.00 -0.81 0.00 0.00 59.98 59.04 2j0k h ARG 178 Cb 0.49 -0.11 0.01 0.00 -0.42 0.00 0.00 29.97 29.94 2j0k h ARG 178 CO 0.08 0.41 -0.32 1.03 -1.51 0.00 0.00 179.97 179.66 2j0k h SER 179 N 0.53 -0.75 -1.64 -3.80 0.87 -0.64 -3.31 113.55 104.81 2j0k h SER 179 Ca 0.14 0.03 -0.75 0.00 -1.23 0.00 0.00 61.79 59.98 2j0k h SER 179 Cb 0.00 0.19 -0.16 0.00 -0.44 0.00 0.00 62.40 62.00 2j0k h SER 179 CO -0.03 -0.46 1.80 -1.22 -0.53 0.00 0.00 176.83 176.39 2j0k n TYR 180 N -4.84 3.70 -0.27 2.24 4.02 -0.88 -4.78 117.16 116.35 2j0k n TYR 180 Ca -0.11 -3.00 0.01 0.00 -0.01 0.00 0.00 57.90 54.79 2j0k n TYR 180 Cb 0.35 -2.05 0.24 0.00 -0.02 0.00 0.00 39.34 37.86 2j0k n TYR 180 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2j0k n GLY 181 N 3.31 2.66 0.48 2.72 0.00 -1.21 -3.57 105.19 109.57 2j0k n GLY 181 Ca 0.39 -0.62 0.05 0.00 0.00 0.00 0.00 46.02 45.84 2j0k n GLY 181 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2j0k n GLU 182 N 0.25 1.16 -4.05 1.61 4.07 -1.26 -5.01 120.64 117.40 2j0k n GLU 182 Ca 0.22 -1.39 -0.23 0.00 -0.06 0.00 0.00 57.16 55.70 2j0k n GLU 182 Cb 0.94 -1.22 -0.06 0.00 -0.06 0.00 0.00 31.44 31.03 2j0k n GLU 182 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 2j0k s MET 183 N -0.92 2.35 0.13 5.31 0.23 -1.23 -4.80 119.30 120.37 2j0k s MET 183 Ca 0.15 -1.63 -0.12 0.00 -1.03 0.00 0.00 55.69 53.06 2j0k s MET 183 Cb 0.10 -2.14 -0.07 0.00 -1.53 0.00 0.00 34.83 31.19 2j0k s MET 183 CO 0.14 0.02 0.49 1.03 -2.03 0.00 0.00 175.02 174.67 2j0k s ARG 184 N -3.89 3.88 0.40 3.16 1.81 -1.26 -4.98 118.95 118.06 2j0k s ARG 184 Ca 0.40 0.35 0.19 0.00 -1.72 0.00 0.00 55.73 54.94 2j0k s ARG 184 Cb -0.01 -2.93 1.12 0.00 -0.45 0.00 0.00 34.95 32.68 2j0k s ARG 184 CO 0.23 0.49 1.75 0.78 -0.68 0.00 0.00 175.30 177.88 2j0k h GLY 185 N 3.51 1.27 -1.54 -3.53 0.00 -2.00 0.38 103.07 101.16 2j0k h GLY 185 Ca -0.49 -0.20 0.00 0.00 0.00 0.00 0.00 47.33 46.64 2j0k h GLY 185 CO 0.66 -0.17 0.00 1.16 0.00 0.00 0.00 176.54 178.19 2j0k n ASN 186 N -4.65 2.32 0.00 0.19 0.23 -1.26 -4.33 115.26 107.76 2j0k n ASN 186 Ca 0.26 -1.95 0.07 0.00 -0.53 0.00 0.00 54.58 52.43 2j0k n ASN 186 Cb 0.92 -0.26 0.47 0.00 -2.08 0.00 0.00 39.78 38.83 2j0k n ASN 186 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2j0k h ALA 187 N 3.90 1.83 0.00 -2.53 0.00 -0.62 -1.25 119.26 120.59 2j0k h ALA 187 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 2j0k h ALA 187 Cb 0.60 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.26 2j0k h ALA 187 CO 0.00 0.12 0.00 -0.07 0.00 0.00 0.00 179.25 179.30 2j0k h LEU 188 N 0.46 0.00 -2.04 0.00 3.38 -1.77 -2.70 115.31 112.64 2j0k h LEU 188 Ca 0.17 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.14 2j0k h LEU 188 Cb 0.12 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.87 2j0k h LEU 188 CO -0.04 0.00 -0.03 -0.33 0.09 0.00 0.00 178.44 178.13 2j0k h GLU 189 N 0.00 0.00 -6.55 1.13 4.39 -1.53 -3.40 114.58 108.62 2j0k h GLU 189 Ca 0.00 0.00 -0.53 0.00 0.34 0.00 0.00 59.36 59.17 2j0k h GLU 189 Cb 0.71 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.36 2j0k h GLU 189 CO 0.00 0.03 0.46 0.15 -1.16 0.00 0.00 179.01 178.48 2j0k s LYS 190 N -3.92 4.57 0.06 2.33 3.01 -1.02 -4.98 119.74 119.80 2j0k s LYS 190 Ca -0.02 1.62 -0.36 0.00 -1.01 0.00 0.00 55.97 56.21 2j0k s LYS 190 Cb 0.11 -3.35 -0.20 0.00 -1.01 0.00 0.00 37.83 33.38 2j0k s LYS 190 CO 0.51 -0.01 1.59 -0.22 0.51 0.00 0.00 175.35 177.73 2j0k h LYS 191 N 5.94 -1.16 -0.64 1.68 3.64 -1.88 -2.39 116.57 121.76 2j0k h LYS 191 Ca -0.43 0.08 0.06 0.00 -1.27 0.00 0.00 60.65 59.09 2j0k h LYS 191 Cb 1.21 0.26 -0.04 0.00 -0.41 0.00 0.00 32.23 33.26 2j0k h LYS 191 CO 0.75 -0.77 0.42 0.66 -2.27 0.00 0.00 179.45 178.24 2j0k h SER 192 N -1.20 0.57 -0.38 4.20 4.64 -1.95 0.51 113.55 119.94 2j0k h SER 192 Ca -0.12 0.00 0.01 0.00 -0.47 0.00 0.00 61.79 61.21 2j0k h SER 192 Cb 0.92 -0.12 -0.02 0.00 -0.31 0.00 0.00 62.40 62.87 2j0k h SER 192 CO 0.19 0.38 0.23 0.78 -0.87 0.00 0.00 176.83 177.54 2j0k h ASN 193 N 0.65 0.37 -0.64 4.97 2.35 -1.82 0.63 115.58 122.10 2j0k h ASN 193 Ca 0.27 0.00 -0.06 0.00 -0.55 0.00 0.00 56.30 55.97 2j0k h ASN 193 Cb 0.25 -0.08 -0.03 0.00 0.05 0.00 0.00 38.32 38.51 2j0k h ASN 193 CO -0.08 0.27 0.18 0.22 -1.65 0.00 0.00 177.43 176.37 2j0k h TYR 194 N 0.46 1.04 -0.40 1.19 3.20 -0.46 -2.85 116.97 119.15 2j0k h TYR 194 Ca 0.15 -0.11 -0.04 0.00 3.14 0.00 0.00 58.73 61.86 2j0k h TYR 194 Cb -0.00 -0.30 -0.02 0.00 1.54 0.00 0.00 36.73 37.95 2j0k h TYR 194 CO -0.07 0.86 0.06 0.93 -1.64 0.00 0.00 178.16 178.30 2j0k h GLU 195 N 0.92 0.61 -0.44 1.82 5.08 -0.58 0.27 114.58 122.26 2j0k h GLU 195 Ca 0.20 -0.12 0.08 0.00 -1.00 0.00 0.00 59.36 58.53 2j0k h GLU 195 Cb 0.32 -0.09 -0.07 0.00 0.50 0.00 0.00 28.75 29.40 2j0k h GLU 195 CO -0.00 0.59 -0.01 0.28 -1.00 0.00 0.00 179.01 178.86 2j0k h VAL 196 N 0.59 0.65 -0.32 3.13 2.07 -0.65 0.25 116.25 121.96 2j0k h VAL 196 Ca 0.13 -0.03 -0.08 0.00 0.82 0.00 0.00 66.70 67.54 2j0k h VAL 196 Cb 0.29 0.55 -0.01 0.00 -1.52 0.00 0.00 31.29 30.59 2j0k h VAL 196 CO 0.00 0.02 -0.11 -0.07 0.02 0.00 0.00 177.57 177.43 2j0k h LEU 197 N 0.10 0.66 -0.95 2.57 3.38 -1.17 -1.32 115.31 118.58 2j0k h LEU 197 Ca 0.22 -0.38 -0.09 0.00 0.09 0.00 0.00 57.88 57.71 2j0k h LEU 197 Cb 0.32 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.87 2j0k h LEU 197 CO -0.37 0.89 -0.44 -0.08 0.09 0.00 0.00 178.44 178.53 2j0k h GLU 198 N 0.42 0.00 0.00 1.13 4.81 0.03 0.83 114.58 121.80 2j0k h GLU 198 Ca 0.08 0.00 -0.11 0.00 -0.13 0.00 0.00 59.36 59.20 2j0k h GLU 198 Cb 0.62 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.98 2j0k h GLU 198 CO 0.04 0.44 -1.40 1.17 -0.73 0.00 0.00 179.01 178.52 2j0k n LYS 199 N -3.66 0.18 -0.11 1.92 3.00 0.82 -4.51 118.16 115.79 2j0k n LYS 199 Ca -0.01 0.04 -0.20 0.00 -0.00 0.00 0.00 58.31 58.14 2j0k n LYS 199 Cb 0.52 -1.12 -0.07 0.00 0.00 0.00 0.00 35.03 34.37 2j0k n LYS 199 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 2j0k n ASP 200 N -2.75 1.90 -0.03 3.14 8.00 -0.57 -4.62 116.55 121.61 2j0k n ASP 200 Ca -0.13 0.33 -0.14 0.00 0.71 0.00 0.00 54.79 55.56 2j0k n ASP 200 Cb 0.63 -0.76 -0.10 0.00 -0.02 0.00 0.00 41.12 40.87 2j0k n ASP 200 CO 0.00 0.00 0.00 0.58 -0.39 0.00 0.00 177.20 177.39 2j0k h VAL 201 N -0.96 1.46 0.00 2.53 2.07 -1.46 -3.50 116.25 116.38 2j0k h VAL 201 Ca -0.39 -1.56 0.00 0.00 0.82 0.00 0.00 66.70 65.57 2j0k h VAL 201 Cb 1.32 2.37 0.00 0.00 -1.52 0.00 0.00 31.29 33.46 2j0k h VAL 201 CO -0.23 0.43 0.00 0.61 0.02 0.00 0.00 177.57 178.40 2j0k n GLY 202 N 0.60 1.90 0.13 2.17 0.00 0.28 -4.78 105.19 105.50 2j0k n GLY 202 Ca -0.08 -1.46 0.13 0.00 0.00 0.00 0.00 46.02 44.60 2j0k n GLY 202 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2j0k h LEU 203 N 0.00 0.00 -2.44 0.99 3.38 -1.78 -3.19 115.31 112.27 2j0k h LEU 203 Ca 0.00 -0.03 -0.00 0.00 0.09 0.00 0.00 57.88 57.94 2j0k h LEU 203 Cb 0.00 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.75 2j0k h LEU 203 CO 0.00 0.01 -0.02 0.08 0.09 0.00 0.00 178.44 178.60 2j0k h ARG 204 N 0.00 0.00 0.00 1.13 0.11 -1.90 0.58 114.38 114.30 2j0k h ARG 204 Ca 0.00 0.00 -0.04 0.00 0.10 0.00 0.00 59.98 60.04 2j0k h ARG 204 Cb 0.82 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.90 2j0k h ARG 204 CO 0.00 0.02 -0.18 0.00 0.10 0.00 0.00 179.97 179.91 2j0k h ARG 205 N 0.00 0.00 0.00 0.08 -0.00 -1.85 -3.34 114.38 109.27 2j0k h ARG 205 Ca -0.00 0.00 -0.09 0.00 -0.50 0.00 0.00 59.98 59.39 2j0k h ARG 205 Cb 0.16 0.00 -0.02 0.00 0.00 0.00 0.00 29.97 30.12 2j0k h ARG 205 CO 0.00 0.18 -1.44 1.19 0.00 0.00 0.00 179.97 179.91 2j0k n PHE 206 N -4.00 0.00 -4.28 3.04 3.01 -0.02 -5.07 117.46 110.14 2j0k n PHE 206 Ca -0.02 0.00 -0.20 0.00 1.01 0.00 0.00 57.45 58.24 2j0k n PHE 206 Cb 0.26 -0.29 -0.11 0.00 -0.01 0.00 0.00 39.48 39.33 2j0k n PHE 206 CO 0.00 0.00 0.00 -0.06 1.01 0.00 0.00 176.76 177.71 2j0k s PHE 207 N -2.29 1.59 0.47 1.38 0.40 -0.01 -4.00 117.98 115.52 2j0k s PHE 207 Ca -0.03 -0.51 -0.22 0.00 -0.60 0.00 0.00 56.93 55.56 2j0k s PHE 207 Cb 0.03 -0.82 -0.07 0.00 0.51 0.00 0.00 43.02 42.67 2j0k s PHE 207 CO 0.30 0.22 1.15 -2.14 0.70 0.00 0.00 175.22 175.45 2j0k s PRO 208 N -2.69 3.71 0.23 0.24 0.02 -1.26 -4.47 135.00 130.78 2j0k s PRO 208 Ca 0.12 1.73 -0.07 0.00 0.02 0.00 0.00 61.00 62.79 2j0k s PRO 208 Cb -0.05 -2.34 0.39 0.00 0.02 0.00 0.00 34.50 32.52 2j0k s PRO 208 CO 0.05 -0.58 1.68 -0.22 -0.33 0.00 0.00 177.00 177.60 2j0k h LYS 209 N 1.92 0.22 0.00 5.54 3.64 -1.95 -1.70 116.57 124.23 2j0k h LYS 209 Ca -0.49 -0.01 -0.00 0.00 -1.27 0.00 0.00 60.65 58.87 2j0k h LYS 209 Cb 1.25 -0.05 -0.00 0.00 -0.41 0.00 0.00 32.23 33.02 2j0k h LYS 209 CO 0.60 0.15 -0.02 0.66 -2.27 0.00 0.00 179.45 178.56 2j0k h SER 210 N 0.23 0.00 -0.03 4.20 4.64 -1.92 0.24 113.55 120.90 2j0k h SER 210 Ca 0.38 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 61.61 2j0k h SER 210 Cb 0.62 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.72 2j0k h SER 210 CO -0.50 0.02 -0.33 0.25 -0.87 0.00 0.00 176.83 175.40 2j0k h LEU 211 N 0.00 0.34 -1.49 5.97 6.46 -1.68 -3.11 115.31 121.80 2j0k h LEU 211 Ca -0.00 -0.71 -0.03 0.00 -0.12 0.00 0.00 57.88 57.02 2j0k h LEU 211 Cb 0.03 -0.10 -0.01 0.00 -0.73 0.00 0.00 40.66 39.85 2j0k h LEU 211 CO 0.00 1.00 -0.03 -0.07 -0.62 0.00 0.00 178.44 178.72 2j0k h LEU 212 N -0.29 0.26 -1.01 2.25 3.38 -0.85 -2.94 115.31 116.11 2j0k h LEU 212 Ca -0.03 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.90 2j0k h LEU 212 Cb 1.02 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.70 2j0k h LEU 212 CO 0.07 0.34 0.00 0.47 0.09 0.00 0.00 178.44 179.41 2j0k n ASP 213 N -4.34 1.47 0.00 -0.43 10.43 0.75 -4.08 116.55 120.35 2j0k n ASP 213 Ca -0.00 -1.98 0.00 0.00 2.57 0.00 0.00 54.79 55.38 2j0k n ASP 213 Cb 0.21 -0.18 0.00 0.00 1.84 0.00 0.00 41.12 42.99 2j0k n ASP 213 CO 0.00 0.00 0.00 -1.54 -1.07 0.00 0.00 177.20 174.59 2j0k n SER 214 N 0.30 0.19 -3.89 -2.24 3.41 -1.11 -5.02 113.62 105.25 2j0k n SER 214 Ca 0.10 -0.88 -0.15 0.00 -0.26 0.00 0.00 58.87 57.68 2j0k n SER 214 Cb 0.24 0.03 -0.15 0.00 -0.26 0.00 0.00 64.21 64.07 2j0k n SER 214 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2j0k s VAL 215 N -0.03 0.20 0.33 -3.33 0.11 -1.22 -5.09 120.40 111.38 2j0k s VAL 215 Ca 0.00 -0.07 -0.28 0.00 -2.93 0.00 0.00 61.98 58.71 2j0k s VAL 215 Cb 0.00 -0.20 -0.09 0.00 -1.53 0.00 0.00 36.38 34.56 2j0k s VAL 215 CO 0.00 0.08 1.16 -0.75 -3.33 0.00 0.00 175.10 172.26 2j0k s LYS 216 N 0.18 4.38 0.21 1.54 2.20 -1.26 -4.70 119.74 122.29 2j0k s LYS 216 Ca -0.01 1.88 -0.20 0.00 -0.36 0.00 0.00 55.97 57.27 2j0k s LYS 216 Cb -0.04 -2.97 0.17 0.00 -1.51 0.00 0.00 37.83 33.48 2j0k s LYS 216 CO -0.00 -0.05 1.56 0.00 -0.36 0.00 0.00 175.35 176.50 2j0k h ALA 217 N 3.29 -0.00 -0.59 3.13 0.00 -1.99 0.17 119.26 123.28 2j0k h ALA 217 Ca -0.48 0.22 0.03 0.00 0.00 0.00 0.00 54.91 54.68 2j0k h ALA 217 Cb 1.22 1.01 -0.04 0.00 0.00 0.00 0.00 17.79 19.98 2j0k h ALA 217 CO 0.65 -0.69 0.36 0.87 0.00 0.00 0.00 179.25 180.44 2j0k h LYS 218 N -0.05 0.70 0.07 0.00 1.57 -1.99 -0.80 116.57 116.07 2j0k h LYS 218 Ca 0.29 -0.04 -0.00 0.00 -1.87 0.00 0.00 60.65 59.02 2j0k h LYS 218 Cb 0.57 -0.16 0.00 0.00 0.08 0.00 0.00 32.23 32.72 2j0k h LYS 218 CO -0.90 0.46 -0.03 1.15 -0.57 0.00 0.00 179.45 179.56 2j0k h THR 219 N 0.72 1.06 -0.68 -0.16 2.02 -1.15 -2.14 112.91 112.58 2j0k h THR 219 Ca 0.24 -0.45 0.12 0.00 0.77 0.00 0.00 66.41 67.09 2j0k h THR 219 Cb 0.02 1.35 -0.09 0.00 -1.74 0.00 0.00 68.15 67.69 2j0k h THR 219 CO -0.10 0.11 0.23 0.25 0.37 0.00 0.00 175.52 176.39 2j0k h LEU 220 N -0.30 0.19 -0.18 2.58 5.85 -0.71 0.31 115.31 123.05 2j0k h LEU 220 Ca -0.01 0.10 0.05 0.00 0.84 0.00 0.00 57.88 58.86 2j0k h LEU 220 Cb 0.26 0.10 -0.05 0.00 0.37 0.00 0.00 40.66 41.33 2j0k h LEU 220 CO 0.02 0.08 -0.16 -0.09 -0.34 0.00 0.00 178.44 177.95 2j0k h ARG 221 N 0.38 -0.17 -0.90 1.25 2.43 -1.01 -0.40 114.38 115.96 2j0k h ARG 221 Ca 0.36 0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.53 2j0k h ARG 221 Cb 0.52 0.04 -0.04 0.00 -0.42 0.00 0.00 29.97 30.07 2j0k h ARG 221 CO -0.38 -0.11 0.53 -0.22 -1.51 0.00 0.00 179.97 178.27 2j0k h LYS 222 N -0.18 1.24 0.00 0.20 3.64 -0.51 -1.40 116.57 119.56 2j0k h LYS 222 Ca 0.11 -0.12 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 2j0k h LYS 222 Cb 0.35 -0.25 0.00 0.00 -0.41 0.00 0.00 32.23 31.92 2j0k h LYS 222 CO -0.29 0.88 0.00 1.28 -2.27 0.00 0.00 179.45 179.04 2j0k n LEU 223 N -4.37 0.00 -0.29 5.20 4.77 0.97 -1.61 117.00 121.66 2j0k n LEU 223 Ca 0.10 0.79 0.01 0.00 -0.03 0.00 0.00 56.01 56.87 2j0k n LEU 223 Cb 0.07 -0.29 0.05 0.00 -2.33 0.00 0.00 43.42 40.92 2j0k n LEU 223 CO 0.38 -0.29 0.46 -0.38 -1.33 0.00 0.00 177.39 176.23 2j0k n ILE 224 N -1.54 -0.38 -0.08 -0.08 5.41 -0.22 -0.38 119.36 122.08 2j0k n ILE 224 Ca 0.00 1.78 -0.06 0.00 1.00 0.00 0.00 62.75 65.47 2j0k n ILE 224 Cb 0.00 -2.38 0.00 0.00 -0.71 0.00 0.00 39.64 36.55 2j0k n ILE 224 CO 0.00 0.00 0.00 1.56 0.00 0.00 0.00 176.55 178.11 2j0k h GLN 225 N 0.00 0.05 0.69 0.38 4.20 -1.20 0.64 115.11 119.87 2j0k h GLN 225 Ca 0.29 -0.00 -0.03 0.00 0.06 0.00 0.00 58.65 58.96 2j0k h GLN 225 Cb 0.48 -0.01 0.01 0.00 0.30 0.00 0.00 27.48 28.26 2j0k h GLN 225 CO -0.77 0.03 -0.33 1.96 -0.67 0.00 0.00 178.83 179.06 2j0k h GLN 226 N 0.05 -0.89 -0.52 1.46 4.20 0.27 -2.94 115.11 116.75 2j0k h GLN 226 Ca 0.15 0.06 -0.01 0.00 0.06 0.00 0.00 58.65 58.92 2j0k h GLN 226 Cb 0.21 0.20 -0.03 0.00 0.30 0.00 0.00 27.48 28.17 2j0k h GLN 226 CO -0.28 -0.57 0.30 0.00 -0.67 0.00 0.00 178.83 177.61 2j0k h THR 227 N -1.01 1.15 0.00 -0.54 1.03 -0.76 -1.34 112.91 111.45 2j0k h THR 227 Ca -0.09 -0.36 -0.01 0.00 -0.01 0.00 0.00 66.41 65.93 2j0k h THR 227 Cb 0.73 0.44 -0.00 0.00 -1.07 0.00 0.00 68.15 68.25 2j0k h THR 227 CO 0.16 0.16 -0.06 0.15 -0.01 0.00 0.00 175.52 175.92 2j0k h PHE 228 N 0.71 0.00 -0.90 0.00 3.57 0.35 -2.80 116.94 117.88 2j0k h PHE 228 Ca 0.19 0.00 0.09 0.00 3.53 0.00 0.00 57.97 61.77 2j0k h PHE 228 Cb -0.01 0.00 -0.07 0.00 2.79 0.00 0.00 35.95 38.66 2j0k h PHE 228 CO 0.00 0.06 0.55 0.00 -2.23 0.00 0.00 178.31 176.69 2j0k h ARG 229 N 0.00 0.91 0.00 1.11 3.08 -1.06 -2.64 114.38 115.78 2j0k h ARG 229 Ca -0.00 -0.05 -0.04 0.00 0.07 0.00 0.00 59.98 59.95 2j0k h ARG 229 Cb 0.17 -0.21 -0.01 0.00 0.08 0.00 0.00 29.97 30.01 2j0k h ARG 229 CO 0.01 0.60 -0.21 -0.56 -1.07 0.00 0.00 179.97 178.75 2j0k h GLN 230 N 0.94 0.00 -0.39 0.04 3.07 -1.65 -2.51 115.11 114.61 2j0k h GLN 230 Ca 0.42 0.00 0.00 0.00 0.09 0.00 0.00 58.65 59.16 2j0k h GLN 230 Cb 0.31 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.87 2j0k h GLN 230 CO -0.22 0.21 0.00 1.19 0.09 0.00 0.00 178.83 180.10 2j0k n PHE 231 N -4.28 0.50 -0.31 0.06 0.99 -1.02 -4.71 117.46 108.69 2j0k n PHE 231 Ca -0.02 -0.25 0.07 0.00 -0.00 0.00 0.00 57.45 57.24 2j0k n PHE 231 Cb 0.27 0.00 0.22 0.00 -1.00 0.00 0.00 39.48 38.97 2j0k n PHE 231 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 2j0k h ALA 232 N 4.52 1.33 -0.00 4.37 0.00 -1.20 -2.60 119.26 125.66 2j0k h ALA 232 Ca 0.00 0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.98 2j0k h ALA 232 Cb 0.98 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.70 2j0k h ALA 232 CO 0.00 -0.01 -0.66 0.09 0.00 0.00 0.00 179.25 178.67 2j0k n ASN 233 N -4.80 0.69 -4.74 0.00 3.02 -1.26 -4.40 115.26 103.76 2j0k n ASN 233 Ca 0.17 -0.52 -0.42 0.00 -0.03 0.00 0.00 54.58 53.79 2j0k n ASN 233 Cb 0.41 0.49 -0.02 0.00 -0.61 0.00 0.00 39.78 40.05 2j0k n ASN 233 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 2j0k s LEU 234 N -2.99 4.35 0.00 3.41 1.02 -0.98 -5.03 118.68 118.47 2j0k s LEU 234 Ca 0.10 2.90 0.00 0.00 0.02 0.00 0.00 54.13 57.15 2j0k s LEU 234 Cb 0.17 -3.63 0.00 0.00 0.02 0.00 0.00 46.19 42.76 2j0k s LEU 234 CO 0.75 -0.91 0.00 -0.46 0.02 0.00 0.00 176.35 175.75 2j0k n ASN 235 N 2.62 -0.16 0.30 2.29 0.23 -1.26 -4.72 115.26 114.57 2j0k n ASN 235 Ca 0.10 -0.92 -0.16 0.00 -0.53 0.00 0.00 54.58 53.07 2j0k n ASN 235 Cb 0.37 0.00 -0.08 0.00 -2.08 0.00 0.00 39.78 37.99 2j0k n ASN 235 CO 0.00 0.00 0.00 0.03 -0.93 0.00 0.00 177.26 176.36 2j0k h ARG 236 N 0.00 -0.73 -0.91 -3.83 3.08 -1.91 -0.08 114.38 110.00 2j0k h ARG 236 Ca 0.00 0.05 0.21 0.00 0.07 0.00 0.00 59.98 60.31 2j0k h ARG 236 Cb 0.00 0.17 -0.12 0.00 0.08 0.00 0.00 29.97 30.10 2j0k h ARG 236 CO 0.00 -0.43 0.46 1.49 -1.07 0.00 0.00 179.97 180.42 2j0k h GLU 237 N -0.95 0.50 -0.07 0.04 4.81 -1.96 -1.29 114.58 115.65 2j0k h GLU 237 Ca -0.08 -0.03 -0.19 0.00 -0.13 0.00 0.00 59.36 58.94 2j0k h GLU 237 Cb 0.64 -0.11 -0.00 0.00 0.63 0.00 0.00 28.75 29.91 2j0k h GLU 237 CO 0.13 0.33 -0.75 0.93 -0.73 0.00 0.00 179.01 178.92 2j0k h GLU 238 N 0.51 0.38 0.47 1.92 5.08 -1.84 -1.76 114.58 119.33 2j0k h GLU 238 Ca 0.55 -0.32 -0.02 0.00 -1.00 0.00 0.00 59.36 58.57 2j0k h GLU 238 Cb 0.99 0.07 0.00 0.00 0.50 0.00 0.00 28.75 30.31 2j0k h GLU 238 CO -0.47 0.97 -0.22 0.77 -1.00 0.00 0.00 179.01 179.06 2j0k h SER 239 N 0.26 -0.53 -0.73 1.42 0.02 -0.20 -2.81 113.55 110.98 2j0k h SER 239 Ca -0.03 -0.03 0.12 0.00 -0.84 0.00 0.00 61.79 61.00 2j0k h SER 239 Cb 1.33 0.14 -0.08 0.00 0.14 0.00 0.00 62.40 63.92 2j0k h SER 239 CO 0.13 -0.30 0.32 0.40 -1.14 0.00 0.00 176.83 176.23 2j0k h ILE 240 N -0.73 0.74 -0.64 3.27 2.04 -1.15 -0.83 117.51 120.21 2j0k h ILE 240 Ca -0.06 -0.17 -0.07 0.00 1.00 0.00 0.00 64.86 65.56 2j0k h ILE 240 Cb 0.53 0.19 -0.03 0.00 -0.74 0.00 0.00 36.82 36.78 2j0k h ILE 240 CO 0.11 0.09 0.14 -0.07 0.00 0.00 0.00 178.15 178.42 2j0k h LEU 241 N 0.50 0.98 -0.30 1.44 3.38 -1.29 -2.76 115.31 117.26 2j0k h LEU 241 Ca 0.38 -0.24 -0.06 0.00 0.09 0.00 0.00 57.88 58.05 2j0k h LEU 241 Cb 0.51 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.99 2j0k h LEU 241 CO -0.35 0.97 -0.04 0.50 0.09 0.00 0.00 178.44 179.62 2j0k h LYS 242 N 0.95 0.56 -0.68 1.13 1.63 -1.10 -0.86 116.57 118.20 2j0k h LYS 242 Ca 0.20 -0.20 0.10 0.00 -0.85 0.00 0.00 60.65 59.90 2j0k h LYS 242 Cb 0.38 -0.04 -0.12 0.00 -0.60 0.00 0.00 32.23 31.85 2j0k h LYS 242 CO 0.01 0.73 -0.42 0.35 -3.45 0.00 0.00 179.45 176.66 2j0k h PHE 243 N 0.34 -1.23 -0.54 1.91 3.57 -1.07 0.11 116.94 120.02 2j0k h PHE 243 Ca 0.08 0.09 0.02 0.00 3.53 0.00 0.00 57.97 61.69 2j0k h PHE 243 Cb 0.50 0.63 -0.03 0.00 2.79 0.00 0.00 35.95 39.84 2j0k h PHE 243 CO 0.04 -0.41 0.33 0.74 -2.23 0.00 0.00 178.31 176.78 2j0k h PHE 244 N -0.16 0.62 -0.66 0.41 0.05 -1.13 -1.16 116.94 114.90 2j0k h PHE 244 Ca 0.21 0.02 0.08 0.00 3.82 0.00 0.00 57.97 62.10 2j0k h PHE 244 Cb 0.56 -0.20 -0.06 0.00 2.00 0.00 0.00 35.95 38.24 2j0k h PHE 244 CO -0.75 0.35 0.34 1.49 -0.18 0.00 0.00 178.31 179.56 2j0k h GLU 245 N 0.65 0.58 -0.07 1.51 4.81 0.41 -0.60 114.58 121.88 2j0k h GLU 245 Ca 0.22 -0.04 -0.20 0.00 -0.13 0.00 0.00 59.36 59.21 2j0k h GLU 245 Cb 0.01 -0.13 -0.00 0.00 0.63 0.00 0.00 28.75 29.26 2j0k h GLU 245 CO -0.09 0.39 -0.78 0.82 -0.73 0.00 0.00 179.01 178.61 2j0k h ILE 246 N 0.60 1.37 -0.00 2.32 2.04 -0.52 -3.29 117.51 120.03 2j0k h ILE 246 Ca 0.31 -2.19 -0.19 0.00 1.00 0.00 0.00 64.86 63.79 2j0k h ILE 246 Cb 0.28 2.17 -0.01 0.00 -0.74 0.00 0.00 36.82 38.52 2j0k h ILE 246 CO -0.23 0.66 -0.84 0.25 0.00 0.00 0.00 178.15 177.99 2j0k h LEU 247 N 0.29 0.20 -0.47 1.44 5.85 -0.65 -3.37 115.31 118.61 2j0k h LEU 247 Ca -0.04 -0.16 0.08 0.00 0.84 0.00 0.00 57.88 58.59 2j0k h LEU 247 Cb 1.38 -0.06 -0.07 0.00 0.37 0.00 0.00 40.66 42.28 2j0k h LEU 247 CO 0.14 0.95 0.07 -1.28 -0.34 0.00 0.00 178.44 177.98 2j0k h SER 248 N 0.09 -0.06 -0.35 1.25 0.87 -1.20 0.31 113.55 114.47 2j0k h SER 248 Ca -0.03 0.09 0.10 0.00 -1.23 0.00 0.00 61.79 60.72 2j0k h SER 248 Cb 1.46 0.14 -0.01 0.00 -0.44 0.00 0.00 62.40 63.55 2j0k h SER 248 CO 0.13 0.00 0.26 -0.65 -0.53 0.00 0.00 176.83 176.04 2j0k h PRO 249 N 0.19 0.00 0.00 2.24 0.11 -1.76 -3.13 132.00 129.65 2j0k h PRO 249 Ca 0.23 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.34 2j0k h PRO 249 Cb 0.32 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.43 2j0k h PRO 249 CO -0.33 0.00 -1.20 1.55 -0.21 0.00 0.00 178.00 177.81 2j0k n VAL 250 N -4.35 0.00 -3.64 3.15 3.14 -0.35 -4.95 118.33 111.34 2j0k n VAL 250 Ca 0.05 -0.26 -0.18 0.00 -2.96 0.00 0.00 64.34 61.00 2j0k n VAL 250 Cb 0.44 0.53 -0.15 0.00 -1.06 0.00 0.00 33.84 33.60 2j0k n VAL 250 CO 0.00 0.00 0.00 -0.47 -6.46 0.00 0.00 176.83 169.90 2j0k s TYR 251 N -2.64 -0.16 -0.31 1.45 5.04 -0.05 -5.11 117.35 115.57 2j0k s TYR 251 Ca -0.01 0.48 -0.28 0.00 -2.44 0.00 0.00 57.07 54.81 2j0k s TYR 251 Cb 0.09 -0.31 -0.02 0.00 0.35 0.00 0.00 41.96 42.07 2j0k s TYR 251 CO 0.55 -0.33 1.78 0.50 -1.34 0.00 0.00 175.55 176.71 2j0k s ARG 252 N 2.28 3.40 0.00 4.97 3.52 -1.26 -4.41 118.95 127.45 2j0k s ARG 252 Ca 0.04 1.47 0.00 0.00 -0.13 0.00 0.00 55.73 57.11 2j0k s ARG 252 Cb -0.13 -4.18 0.00 0.00 -1.56 0.00 0.00 34.95 29.08 2j0k s ARG 252 CO -0.07 -1.78 0.43 1.97 -0.81 0.00 0.00 175.30 175.05 2j0k n PHE 253 N 10.04 0.00 0.54 5.12 1.16 -1.26 -4.80 117.46 128.26 2j0k n PHE 253 Ca 0.22 -0.08 0.11 0.00 -1.87 0.00 0.00 57.45 55.83 2j0k n PHE 253 Cb 0.46 -0.01 0.26 0.00 -1.61 0.00 0.00 39.48 38.59 2j0k n PHE 253 CO 0.00 0.00 0.00 -0.40 -1.87 0.00 0.00 176.76 174.49 2j0k n ASP 254 N -0.08 2.92 -3.49 5.98 5.68 -1.26 -4.97 116.55 121.32 2j0k n ASP 254 Ca 0.00 -1.92 -0.02 0.00 -0.50 0.00 0.00 54.79 52.35 2j0k n ASP 254 Cb 0.17 -0.23 0.01 0.00 -1.14 0.00 0.00 41.12 39.93 2j0k n ASP 254 CO 0.00 0.00 0.00 -1.59 -1.33 0.00 0.00 177.20 174.28 2j0k s LYS 255 N -1.53 1.14 0.08 0.11 -2.85 -1.26 -4.27 119.74 111.15 2j0k s LYS 255 Ca 0.37 -0.71 0.07 0.00 -1.00 0.00 0.00 55.97 54.70 2j0k s LYS 255 Cb 0.21 0.33 -0.03 0.00 -2.06 0.00 0.00 37.83 36.28 2j0k s LYS 255 CO 0.29 -0.53 -0.18 -1.21 0.10 0.00 0.00 175.35 173.82 2j0k s GLU 256 N -2.36 1.07 0.15 1.78 2.02 -0.17 -4.99 118.70 116.19 2j0k s GLU 256 Ca 0.20 -1.03 0.10 0.00 0.02 0.00 0.00 54.97 54.26 2j0k s GLU 256 Cb -0.02 -1.22 -0.04 0.00 0.10 0.00 0.00 34.13 32.95 2j0k s GLU 256 CO 0.04 0.29 -0.24 0.00 0.02 0.00 0.00 175.26 175.37 2j0k s PHE 258 N -1.39 -0.01 -0.17 0.00 0.40 -0.69 -4.98 117.98 111.14 2j0k s PHE 258 Ca 0.14 0.22 -0.29 0.00 -0.60 0.00 0.00 56.93 56.40 2j0k s PHE 258 Cb -0.09 -0.23 -0.02 0.00 0.51 0.00 0.00 43.02 43.19 2j0k s PHE 258 CO 0.07 -0.12 1.29 0.15 0.70 0.00 0.00 175.22 177.31 2j0k s LYS 259 N 1.22 4.20 0.21 0.44 1.02 -1.26 -0.37 119.74 125.20 2j0k s LYS 259 Ca -0.08 1.66 -0.04 0.00 0.02 0.00 0.00 55.97 57.54 2j0k s LYS 259 Cb -0.13 -3.79 0.02 0.00 -0.52 0.00 0.00 37.83 33.41 2j0k s LYS 259 CO -0.04 -0.75 0.34 0.00 -0.92 0.00 0.00 175.35 173.99 2j0k s ALA 261 N -1.99 1.99 -0.05 0.00 0.00 -0.43 0.65 121.76 121.93 2j0k s ALA 261 Ca 0.13 -0.91 -0.03 0.00 0.00 0.00 0.00 51.96 51.16 2j0k s ALA 261 Cb -0.01 -0.69 -0.04 0.00 0.00 0.00 0.00 23.12 22.38 2j0k s ALA 261 CO 0.10 0.32 0.10 -0.51 0.00 0.00 0.00 175.76 175.77 2j0k s LEU 262 N 0.13 4.04 0.00 0.00 1.43 0.22 -0.74 118.68 123.76 2j0k s LEU 262 Ca -0.11 0.26 0.00 0.00 -1.03 0.00 0.00 54.13 53.26 2j0k s LEU 262 Cb -0.15 -2.19 0.00 0.00 0.03 0.00 0.00 46.19 43.88 2j0k s LEU 262 CO 0.06 0.33 0.00 0.61 0.23 0.00 0.00 176.35 177.57 2j0k n GLY 263 N 1.53 3.05 0.74 -3.19 0.00 -0.51 -0.38 105.19 106.43 2j0k n GLY 263 Ca -0.16 -2.02 0.10 0.00 0.00 0.00 0.00 46.02 43.95 2j0k n GLY 263 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2j0k n SER 264 N 0.00 2.53 0.02 1.61 3.41 -1.26 -4.50 113.62 115.42 2j0k n SER 264 Ca 0.00 -1.76 0.00 0.00 -0.26 0.00 0.00 58.87 56.85 2j0k n SER 264 Cb 0.00 0.10 0.00 0.00 -0.26 0.00 0.00 64.21 64.05 2j0k n SER 264 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 2j0k n SER 265 N 0.90 -0.27 -3.08 4.04 2.88 -1.26 -4.97 113.62 111.86 2j0k n SER 265 Ca 0.11 0.08 -0.22 0.00 -1.33 0.00 0.00 58.87 57.51 2j0k n SER 265 Cb 0.49 0.49 -0.04 0.00 -0.75 0.00 0.00 64.21 64.41 2j0k n SER 265 CO 0.00 0.00 0.00 0.79 -1.23 0.00 0.00 175.04 174.60 2j0k n TRP 266 N -2.61 1.87 -0.13 0.66 8.01 -1.26 -5.10 117.44 118.88 2j0k n TRP 266 Ca 0.00 -3.90 -0.05 0.00 -1.31 0.00 0.00 57.50 52.24 2j0k n TRP 266 Cb 0.00 -0.45 -0.01 0.00 -2.01 0.00 0.00 31.31 28.84 2j0k n TRP 266 CO 0.00 0.00 0.00 -0.89 -1.01 0.00 0.00 177.69 175.79 2j0k n ILE 267 N 0.07 0.00 -4.48 -0.99 5.41 -1.25 -4.91 119.36 113.20 2j0k n ILE 267 Ca 0.28 0.00 -0.33 0.00 1.00 0.00 0.00 62.75 63.70 2j0k n ILE 267 Cb 0.54 -0.04 -0.10 0.00 -0.71 0.00 0.00 39.64 39.33 2j0k n ILE 267 CO 0.00 0.00 0.00 -0.63 0.00 0.00 0.00 176.55 175.92 2j0k s ILE 268 N 0.31 3.72 -0.43 1.39 1.09 0.49 -4.85 121.20 122.90 2j0k s ILE 268 Ca 0.09 -0.68 -0.20 0.00 -1.10 0.00 0.00 60.65 58.76 2j0k s ILE 268 Cb -0.12 -2.59 0.02 0.00 -1.06 0.00 0.00 42.46 38.71 2j0k s ILE 268 CO 0.06 0.45 0.62 -0.55 -0.10 0.00 0.00 174.94 175.42 2j0k s SER 269 N -1.27 6.31 0.30 3.58 0.15 -1.26 0.69 113.70 122.20 2j0k s SER 269 Ca 0.16 -0.37 0.06 0.00 0.70 0.00 0.00 55.95 56.51 2j0k s SER 269 Cb -0.11 -2.31 -0.06 0.00 -1.71 0.00 0.00 66.02 61.83 2j0k s SER 269 CO 0.06 -0.75 -0.03 0.68 1.20 0.00 0.00 173.24 174.39 2j0k s VAL 270 N 2.75 1.59 -0.39 4.45 -7.23 0.21 -4.96 120.40 116.81 2j0k s VAL 270 Ca 0.22 -2.09 -0.12 0.00 -1.81 0.00 0.00 61.98 58.17 2j0k s VAL 270 Cb -0.14 -2.55 0.03 0.00 0.56 0.00 0.00 36.38 34.28 2j0k s VAL 270 CO 0.18 -0.23 0.23 -0.70 -0.31 0.00 0.00 175.10 174.28 2j0k s GLU 271 N -3.76 2.83 0.27 4.82 2.12 -0.95 -0.49 118.70 123.55 2j0k s GLU 271 Ca 0.31 -1.10 -0.30 0.00 0.36 0.00 0.00 54.97 54.25 2j0k s GLU 271 Cb 0.05 -3.79 -0.09 0.00 0.26 0.00 0.00 34.13 30.56 2j0k s GLU 271 CO 0.13 -0.73 1.06 -0.51 -0.54 0.00 0.00 175.26 174.67 2j0k s LEU 272 N 1.57 4.57 -0.12 2.70 1.43 0.50 -1.88 118.68 127.45 2j0k s LEU 272 Ca 0.02 2.19 -0.01 0.00 -1.03 0.00 0.00 54.13 55.31 2j0k s LEU 272 Cb -0.19 -3.63 -0.02 0.00 0.03 0.00 0.00 46.19 42.37 2j0k s LEU 272 CO 0.07 -0.07 -0.09 0.00 0.23 0.00 0.00 176.35 176.49 2j0k s ALA 273 N -1.17 2.82 -0.07 4.21 0.00 0.32 -1.71 121.76 126.17 2j0k s ALA 273 Ca 0.44 -0.88 -0.01 0.00 0.00 0.00 0.00 51.96 51.52 2j0k s ALA 273 Cb -0.30 -1.30 0.03 0.00 0.00 0.00 0.00 23.12 21.54 2j0k s ALA 273 CO 0.39 0.34 -0.02 0.42 0.00 0.00 0.00 175.76 176.89 2j0k s ILE 274 N -0.01 0.46 0.03 0.00 1.01 -0.46 -1.82 121.20 120.41 2j0k s ILE 274 Ca -0.02 0.03 -0.28 0.00 0.00 0.00 0.00 60.65 60.38 2j0k s ILE 274 Cb -0.14 -0.57 0.10 0.00 0.01 0.00 0.00 42.46 41.87 2j0k s ILE 274 CO 0.03 0.25 1.22 -0.83 0.00 0.00 0.00 174.94 175.62 2j0k s GLY 275 N 1.63 -0.25 0.26 6.18 0.00 -1.13 -1.00 107.32 113.01 2j0k s GLY 275 Ca -0.00 0.32 -0.03 0.00 0.00 0.00 0.00 44.72 45.01 2j0k s GLY 275 CO -0.04 1.86 1.90 -0.56 0.00 0.00 0.00 173.10 176.25 2j0k h PRO 276 N 2.00 1.20 0.00 2.90 0.13 -1.77 0.22 132.00 136.68 2j0k h PRO 276 Ca -0.27 -0.07 -0.12 0.00 -0.87 0.00 0.00 66.00 64.67 2j0k h PRO 276 Cb 1.20 -0.27 -0.02 0.00 0.13 0.00 0.00 31.00 32.04 2j0k h PRO 276 CO 0.30 0.80 -0.56 0.93 -0.23 0.00 0.00 178.00 179.24 2j0k h GLU 277 N 1.24 0.00 0.00 0.86 4.39 -1.87 -3.36 114.58 115.84 2j0k h GLU 277 Ca 0.42 0.00 -0.04 0.00 0.34 0.00 0.00 59.36 60.08 2j0k h GLU 277 Cb 0.07 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.71 2j0k h GLU 277 CO -0.14 0.56 -1.50 -0.85 -1.16 0.00 0.00 179.01 175.91 2j0k n GLU 278 N -3.58 0.79 0.00 2.33 0.00 -1.10 -5.06 120.64 114.02 2j0k n GLU 278 Ca -0.00 -0.07 0.00 0.00 0.00 0.00 0.00 57.16 57.08 2j0k n GLU 278 Cb 0.63 -1.24 0.00 0.00 0.00 0.00 0.00 31.44 30.83 2j0k n GLU 278 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2j0k n GLY 279 N 2.04 3.80 3.45 -1.84 0.00 0.05 -4.30 105.19 108.39 2j0k n GLY 279 Ca -0.05 -0.02 -0.38 0.00 0.00 0.00 0.00 46.02 45.56 2j0k n GLY 279 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2j0k s ILE 280 N 0.00 4.63 0.06 -0.61 1.01 0.16 -2.85 121.20 123.61 2j0k s ILE 280 Ca 0.00 -0.37 0.02 0.00 0.00 0.00 0.00 60.65 60.30 2j0k s ILE 280 Cb 0.00 -3.34 -0.03 0.00 0.01 0.00 0.00 42.46 39.10 2j0k s ILE 280 CO 0.00 0.09 -0.07 -0.44 0.00 0.00 0.00 174.94 174.53 2j0k s SER 281 N 1.62 0.87 0.54 3.58 0.01 -0.75 -0.51 113.70 119.06 2j0k s SER 281 Ca 0.05 -0.72 0.04 0.00 1.31 0.00 0.00 55.95 56.63 2j0k s SER 281 Cb -0.17 0.07 0.04 0.00 0.21 0.00 0.00 66.02 66.18 2j0k s SER 281 CO 0.06 -0.32 0.36 0.00 0.41 0.00 0.00 173.24 173.76 2j0k n TYR 282 N 0.91 -0.40 -3.59 2.43 0.18 -0.86 0.12 117.16 115.95 2j0k n TYR 282 Ca -0.19 -2.33 -0.11 0.00 1.88 0.00 0.00 57.90 57.15 2j0k n TYR 282 Cb 0.57 -0.43 -0.06 0.00 -0.38 0.00 0.00 39.34 39.04 2j0k n TYR 282 CO 0.00 0.00 0.00 -0.48 -2.08 0.00 0.00 176.86 174.30 2j0k s LEU 283 N 0.00 -0.44 0.03 -3.48 2.34 -0.79 -1.64 118.68 114.71 2j0k s LEU 283 Ca 0.28 0.61 0.00 0.00 0.06 0.00 0.00 54.13 55.07 2j0k s LEU 283 Cb -0.02 1.96 0.00 0.00 -0.56 0.00 0.00 46.19 47.57 2j0k s LEU 283 CO 0.18 -0.31 0.00 0.35 -1.06 0.00 0.00 176.35 175.50 2j0k n THR 284 N 1.25 0.02 0.00 5.48 -2.24 -1.26 -2.23 114.28 115.30 2j0k n THR 284 Ca -0.12 0.01 0.00 0.00 -2.27 0.00 0.00 64.05 61.67 2j0k n THR 284 Cb 0.57 -0.63 0.00 0.00 -2.10 0.00 0.00 70.33 68.17 2j0k n THR 284 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 2j0k n ASP 285 N -2.68 0.00 -3.55 3.42 8.00 -1.26 -4.89 116.55 115.60 2j0k n ASP 285 Ca 0.00 0.00 -0.00 0.00 0.71 0.00 0.00 54.79 55.50 2j0k n ASP 285 Cb 0.06 0.00 -0.04 0.00 -0.02 0.00 0.00 41.12 41.12 2j0k n ASP 285 CO 0.00 0.00 0.00 -1.59 -0.39 0.00 0.00 177.20 175.22 2j0k s LYS 286 N 0.00 0.46 0.00 -1.24 0.00 -1.26 -5.13 119.74 112.57 2j0k s LYS 286 Ca 0.00 1.13 0.00 0.00 0.00 0.00 0.00 55.97 57.10 2j0k s LYS 286 Cb 0.00 0.66 0.00 0.00 0.00 0.00 0.00 37.83 38.49 2j0k s LYS 286 CO 0.00 -0.15 0.00 0.41 0.00 0.00 0.00 175.35 175.61 2j0k n GLY 287 N 5.19 0.55 0.00 0.59 0.00 -1.26 -5.04 105.19 105.22 2j0k n GLY 287 Ca -0.11 -1.70 0.00 0.00 0.00 0.00 0.00 46.02 44.21 2j0k n GLY 287 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2j0k n ALA 288 N 0.69 -0.15 -2.82 4.61 0.00 -1.26 -4.94 120.51 116.64 2j0k n ALA 288 Ca 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 53.44 53.33 2j0k n ALA 288 Cb 0.00 0.31 0.06 0.00 0.00 0.00 0.00 19.45 19.82 2j0k n ALA 288 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 2j0k n ASN 289 N -2.45 -1.91 -4.79 0.00 6.94 -1.26 -5.12 115.26 106.67 2j0k n ASN 289 Ca 0.00 -3.50 -0.34 0.00 -0.02 0.00 0.00 54.58 50.73 2j0k n ASN 289 Cb 0.00 1.46 0.00 0.00 -2.36 0.00 0.00 39.78 38.88 2j0k n ASN 289 CO 0.00 0.00 0.00 -2.16 -1.03 0.00 0.00 177.26 174.07 2j0k s PRO 290 N -0.08 3.37 -0.34 -0.53 0.04 -1.26 -4.99 135.00 131.22 2j0k s PRO 290 Ca 0.27 1.39 -0.08 0.00 0.04 0.00 0.00 61.00 62.61 2j0k s PRO 290 Cb 0.28 -2.03 0.02 0.00 0.04 0.00 0.00 34.50 32.82 2j0k s PRO 290 CO -0.09 -0.79 0.13 0.99 0.04 0.00 0.00 177.00 177.28 2j0k s THR 291 N -2.12 4.15 0.14 1.26 2.01 -0.65 -4.97 115.64 115.47 2j0k s THR 291 Ca 0.68 -0.86 -0.34 0.00 0.31 0.00 0.00 61.69 61.47 2j0k s THR 291 Cb -0.19 -3.26 -0.14 0.00 0.01 0.00 0.00 72.50 68.92 2j0k s THR 291 CO 0.30 -0.10 1.56 1.57 -0.69 0.00 0.00 174.62 177.26 2j0k n HIS 292 N 4.90 2.18 -0.07 4.92 -0.00 -1.26 -2.02 115.22 123.87 2j0k n HIS 292 Ca -0.13 0.31 -0.12 0.00 0.46 0.00 0.00 57.72 58.24 2j0k n HIS 292 Cb 0.46 -2.52 -0.04 0.00 -0.12 0.00 0.00 29.99 27.77 2j0k n HIS 292 CO 0.00 0.00 0.00 1.28 0.46 0.00 0.00 176.34 178.08 2j0k n LEU 293 N 3.39 1.53 -3.74 0.27 4.77 0.33 -4.92 117.00 118.63 2j0k n LEU 293 Ca 0.17 0.25 -0.11 0.00 -0.03 0.00 0.00 56.01 56.30 2j0k n LEU 293 Cb 0.27 -0.59 -0.07 0.00 -2.33 0.00 0.00 43.42 40.71 2j0k n LEU 293 CO 0.63 -0.08 0.04 0.00 -1.33 0.00 0.00 177.39 176.66 2j0k s ALA 294 N -2.50 -0.66 0.15 -1.18 0.00 -0.72 -5.03 121.76 111.81 2j0k s ALA 294 Ca -0.23 -0.12 -0.00 0.00 0.00 0.00 0.00 51.96 51.61 2j0k s ALA 294 Cb 0.06 0.45 -0.04 0.00 0.00 0.00 0.00 23.12 23.58 2j0k s ALA 294 CO 0.31 -0.49 0.32 -0.51 0.00 0.00 0.00 175.76 175.39 2j0k s ASP 295 N -2.41 6.38 0.21 0.00 -0.00 -1.26 -0.66 116.67 118.93 2j0k s ASP 295 Ca -0.01 0.34 -0.09 0.00 -0.00 0.00 0.00 52.55 52.79 2j0k s ASP 295 Cb 0.01 -1.98 0.22 0.00 -0.00 0.00 0.00 42.92 41.17 2j0k s ASP 295 CO -0.07 0.05 1.83 -0.26 -0.00 0.00 0.00 175.17 176.72 2j0k h PHE 296 N 2.42 0.78 0.00 4.23 0.05 -1.94 -1.57 116.94 120.91 2j0k h PHE 296 Ca -0.47 0.02 0.00 0.00 3.82 0.00 0.00 57.97 61.34 2j0k h PHE 296 Cb 1.18 -0.25 0.00 0.00 2.00 0.00 0.00 35.95 38.88 2j0k h PHE 296 CO 0.57 0.41 0.00 0.27 -0.18 0.00 0.00 178.31 179.39 2j0k n ASN 297 N -4.71 0.00 0.06 2.17 0.23 -1.26 -0.70 115.26 111.04 2j0k n ASN 297 Ca 0.08 0.26 0.12 0.00 -0.53 0.00 0.00 54.58 54.51 2j0k n ASN 297 Cb 0.13 -0.34 0.16 0.00 -2.08 0.00 0.00 39.78 37.64 2j0k n ASN 297 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2j0k n GLN 298 N -1.34 0.28 -2.63 -3.83 6.02 -0.59 -4.90 117.38 110.38 2j0k n GLN 298 Ca 0.03 0.07 -0.43 0.00 -0.01 0.00 0.00 57.00 56.67 2j0k n GLN 298 Cb 0.07 -1.67 -0.02 0.00 1.02 0.00 0.00 30.24 29.63 2j0k n GLN 298 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 2j0k s VAL 299 N -3.17 4.28 -0.23 5.09 1.01 0.12 -0.66 120.40 126.84 2j0k s VAL 299 Ca 0.06 1.23 -0.11 0.00 0.00 0.00 0.00 61.98 63.16 2j0k s VAL 299 Cb 0.14 -4.56 -0.17 0.00 0.00 0.00 0.00 36.38 31.78 2j0k s VAL 299 CO 0.73 -0.92 -0.06 0.00 0.00 0.00 0.00 175.10 174.84 2j0k n GLN 300 N 7.64 0.63 -4.25 2.72 6.02 0.25 -4.97 117.38 125.41 2j0k n GLN 300 Ca 0.11 0.32 -0.18 0.00 -0.01 0.00 0.00 57.00 57.24 2j0k n GLN 300 Cb 0.49 -1.60 -0.13 0.00 1.02 0.00 0.00 30.24 30.02 2j0k n GLN 300 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 177.06 177.00 2j0k s THR 301 N -2.48 0.96 -0.08 5.09 -4.23 -1.24 -4.98 115.64 108.68 2j0k s THR 301 Ca -0.33 -1.01 0.03 0.00 -1.18 0.00 0.00 61.69 59.20 2j0k s THR 301 Cb 0.10 -0.90 0.01 0.00 1.34 0.00 0.00 72.50 73.04 2j0k s THR 301 CO 0.59 -0.10 -0.17 -0.63 -0.54 0.00 0.00 174.62 173.77 2j0k s ILE 302 N -0.96 1.51 0.01 2.99 1.01 0.47 -1.67 121.20 124.56 2j0k s ILE 302 Ca -0.01 -0.70 -0.06 0.00 0.00 0.00 0.00 60.65 59.88 2j0k s ILE 302 Cb -0.08 -1.34 -0.00 0.00 0.01 0.00 0.00 42.46 41.04 2j0k s ILE 302 CO 0.01 0.44 0.10 0.00 0.00 0.00 0.00 174.94 175.49 2j0k s GLN 303 N 0.51 0.46 -0.01 2.79 -2.07 -0.76 -1.37 119.66 119.21 2j0k s GLN 303 Ca -0.16 -0.48 0.03 0.00 -1.82 0.00 0.00 55.36 52.93 2j0k s GLN 303 Cb -0.17 0.19 -0.01 0.00 -1.09 0.00 0.00 33.01 31.93 2j0k s GLN 303 CO 0.06 -0.11 -0.10 1.52 -1.32 0.00 0.00 175.29 175.34 2j0k s TYR 304 N -1.53 0.91 0.20 9.60 -0.85 -1.26 -0.80 117.35 123.61 2j0k s TYR 304 Ca -0.14 -0.18 -0.01 0.00 -0.52 0.00 0.00 57.07 56.22 2j0k s TYR 304 Cb -0.07 -0.59 -0.04 0.00 0.38 0.00 0.00 41.96 41.63 2j0k s TYR 304 CO 0.00 -0.02 0.13 -1.54 -1.52 0.00 0.00 175.55 172.60 2j0k s SER 305 N -0.20 0.17 0.52 -0.18 1.04 -0.58 -5.00 113.70 109.47 2j0k s SER 305 Ca 0.03 -1.39 -0.18 0.00 0.48 0.00 0.00 55.95 54.89 2j0k s SER 305 Cb -0.04 0.38 -0.07 0.00 0.10 0.00 0.00 66.02 66.38 2j0k s SER 305 CO -0.00 -0.84 1.02 0.21 0.98 0.00 0.00 173.24 174.61 2j0k s ASN 306 N -3.16 6.30 -0.00 7.02 3.04 -1.26 0.19 114.94 127.06 2j0k s ASN 306 Ca 0.39 1.80 -0.30 0.00 0.04 0.00 0.00 52.86 54.79 2j0k s ASN 306 Cb 0.07 -2.54 -0.05 0.00 -1.54 0.00 0.00 41.25 37.19 2j0k s ASN 306 CO 0.12 -0.81 1.39 -0.55 -3.04 0.00 0.00 177.10 174.21 2j0k s SER 307 N -2.44 6.86 0.19 -4.21 0.15 -1.11 -4.69 113.70 108.44 2j0k s SER 307 Ca 0.64 2.09 -0.09 0.00 0.70 0.00 0.00 55.95 59.29 2j0k s SER 307 Cb -0.14 -2.56 0.10 0.00 -1.71 0.00 0.00 66.02 61.70 2j0k s SER 307 CO 0.26 -0.71 1.69 1.05 1.20 0.00 0.00 173.24 176.73 2j0k h GLU 308 N 7.83 1.09 0.00 5.44 9.09 -1.94 -3.42 114.58 132.67 2j0k h GLU 308 Ca -0.38 -0.28 0.00 0.00 0.05 0.00 0.00 59.36 58.76 2j0k h GLU 308 Cb 1.18 -0.13 0.00 0.00 -1.65 0.00 0.00 28.75 28.14 2j0k h GLU 308 CO 0.90 0.98 0.00 -0.40 0.05 0.00 0.00 179.01 180.55 2j0k n ASP 309 N -4.25 0.00 0.00 3.06 5.75 -1.26 -4.99 116.55 114.86 2j0k n ASP 309 Ca 0.04 0.00 0.00 0.00 -0.01 0.00 0.00 54.79 54.82 2j0k n ASP 309 Cb 0.27 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.36 2j0k n ASP 309 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 2j0k n LYS 310 N 0.00 0.00 -2.01 0.11 4.76 -1.26 -5.03 118.16 114.72 2j0k n LYS 310 Ca 0.00 0.06 -0.01 0.00 -2.87 0.00 0.00 58.31 55.49 2j0k n LYS 310 Cb 0.00 -0.65 -0.00 0.00 -1.84 0.00 0.00 35.03 32.54 2j0k n LYS 310 CO 0.00 0.00 0.00 -0.25 -1.37 0.00 0.00 177.40 175.78 2j0k n ASP 311 N -0.20 -0.05 0.00 4.39 10.43 -1.26 -5.01 116.55 124.85 2j0k n ASP 311 Ca 0.00 -1.12 0.00 0.00 2.57 0.00 0.00 54.79 56.24 2j0k n ASP 311 Cb 0.00 0.11 0.00 0.00 1.84 0.00 0.00 41.12 43.07 2j0k n ASP 311 CO 0.00 0.00 0.00 0.54 -1.07 0.00 0.00 177.20 176.67 2j0k n ARG 312 N -0.04 0.00 -1.88 -1.24 1.74 -1.26 -4.69 116.66 109.29 2j0k n ARG 312 Ca 0.00 0.00 -0.40 0.00 -0.77 0.00 0.00 57.85 56.68 2j0k n ARG 312 Cb 0.03 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.48 2j0k n ARG 312 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 2j0k s LYS 313 N 0.00 3.97 -0.07 5.56 1.02 -1.16 -3.26 119.74 125.80 2j0k s LYS 313 Ca 0.00 2.41 -0.02 0.00 0.02 0.00 0.00 55.97 58.38 2j0k s LYS 313 Cb 0.00 -2.84 -0.03 0.00 -0.52 0.00 0.00 37.83 34.44 2j0k s LYS 313 CO 0.00 -0.58 0.02 0.20 -0.92 0.00 0.00 175.35 174.07 2j0k s GLY 314 N -0.41 1.90 -0.01 -3.33 0.00 0.77 -2.77 107.32 103.47 2j0k s GLY 314 Ca 0.56 -0.81 -0.02 0.00 0.00 0.00 0.00 44.72 44.44 2j0k s GLY 314 CO 0.57 -0.60 0.14 -0.29 0.00 0.00 0.00 173.10 172.93 2j0k s MET 315 N -1.07 3.31 -0.03 2.90 1.75 0.13 0.30 119.30 126.59 2j0k s MET 315 Ca 0.15 -0.37 -0.01 0.00 -1.25 0.00 0.00 55.69 54.22 2j0k s MET 315 Cb -0.11 -3.02 0.03 0.00 2.84 0.00 0.00 34.83 34.57 2j0k s MET 315 CO 0.05 0.67 0.03 -1.17 -0.65 0.00 0.00 175.02 173.95 2j0k s LEU 316 N -1.82 0.78 -0.10 4.11 2.96 0.18 -1.53 118.68 123.27 2j0k s LEU 316 Ca 0.25 0.03 0.04 0.00 -0.22 0.00 0.00 54.13 54.22 2j0k s LEU 316 Cb -0.12 -0.16 -0.01 0.00 0.50 0.00 0.00 46.19 46.40 2j0k s LEU 316 CO 0.16 -0.16 -0.22 -1.10 -1.32 0.00 0.00 176.35 173.71 2j0k s GLN 317 N 1.46 3.00 -0.13 1.98 -1.52 0.02 0.93 119.66 125.39 2j0k s GLN 317 Ca -0.04 -0.84 0.01 0.00 -1.95 0.00 0.00 55.36 52.53 2j0k s GLN 317 Cb -0.13 -2.34 0.02 0.00 -0.22 0.00 0.00 33.01 30.35 2j0k s GLN 317 CO -0.03 0.24 -0.15 -0.51 -0.25 0.00 0.00 175.29 174.59 2j0k s LEU 318 N 0.22 1.71 -0.10 2.90 1.43 0.49 -1.82 118.68 123.50 2j0k s LEU 318 Ca -0.14 -0.47 -0.28 0.00 -1.03 0.00 0.00 54.13 52.21 2j0k s LEU 318 Cb -0.17 -1.16 -0.02 0.00 0.03 0.00 0.00 46.19 44.88 2j0k s LEU 318 CO 0.07 -0.03 0.95 -0.75 0.23 0.00 0.00 176.35 176.82 2j0k s LYS 319 N 1.30 4.41 -0.08 1.70 2.20 -0.67 -0.50 119.74 128.10 2j0k s LYS 319 Ca 0.01 1.28 0.03 0.00 -0.36 0.00 0.00 55.97 56.93 2j0k s LYS 319 Cb -0.14 -3.53 0.01 0.00 -1.51 0.00 0.00 37.83 32.66 2j0k s LYS 319 CO -0.07 -0.26 -0.16 0.42 -0.36 0.00 0.00 175.35 174.91 2j0k s ILE 320 N 1.84 1.49 -0.15 5.43 1.09 -1.26 -0.58 121.20 129.05 2j0k s ILE 320 Ca 0.46 -0.68 -0.40 0.00 -1.10 0.00 0.00 60.65 58.94 2j0k s ILE 320 Cb -0.18 -1.33 -0.17 0.00 -1.06 0.00 0.00 42.46 39.72 2j0k s ILE 320 CO 0.18 0.43 1.55 0.00 -0.10 0.00 0.00 174.94 177.00 2j0k n ALA 321 N 3.80 -0.79 0.00 9.38 0.00 0.16 -2.50 120.51 130.55 2j0k n ALA 321 Ca -0.21 0.46 0.00 0.00 0.00 0.00 0.00 53.44 53.69 2j0k n ALA 321 Cb 0.52 -2.12 0.00 0.00 0.00 0.00 0.00 19.45 17.85 2j0k n ALA 321 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2j0k n GLY 322 N 3.42 2.01 3.67 0.00 0.00 -1.26 -5.01 105.19 108.02 2j0k n GLY 322 Ca 0.24 -0.63 -0.46 0.00 0.00 0.00 0.00 46.02 45.17 2j0k n GLY 322 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2j0k n ALA 323 N 0.00 1.24 0.05 4.61 0.00 -1.04 -4.90 120.51 120.47 2j0k n ALA 323 Ca 0.00 0.27 -0.06 0.00 0.00 0.00 0.00 53.44 53.65 2j0k n ALA 323 Cb 0.00 -2.57 -0.11 0.00 0.00 0.00 0.00 19.45 16.77 2j0k n ALA 323 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 2j0k h PRO 324 N 9.54 0.00 -5.97 0.00 0.13 -1.95 -3.40 132.00 130.35 2j0k h PRO 324 Ca -0.49 0.00 -0.57 0.00 -0.87 0.00 0.00 66.00 64.07 2j0k h PRO 324 Cb 1.26 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 32.32 2j0k h PRO 324 CO 0.94 0.79 0.16 -2.00 -0.23 0.00 0.00 178.00 177.66 2j0k s GLU 325 N -2.72 4.38 0.68 0.86 2.56 -1.26 -5.04 118.70 118.16 2j0k s GLU 325 Ca -0.00 0.88 -0.15 0.00 0.00 0.00 0.00 54.97 55.69 2j0k s GLU 325 Cb 0.09 -3.49 0.01 0.00 2.00 0.00 0.00 34.13 32.74 2j0k s GLU 325 CO 0.81 -0.07 1.16 -1.25 -0.56 0.00 0.00 175.26 175.36 2j0k s PRO 326 N 1.25 2.51 -0.22 4.30 0.04 -1.26 -4.83 135.00 136.80 2j0k s PRO 326 Ca 0.37 1.60 -0.28 0.00 0.04 0.00 0.00 61.00 62.72 2j0k s PRO 326 Cb -0.17 -1.90 0.00 0.00 0.04 0.00 0.00 34.50 32.48 2j0k s PRO 326 CO 0.16 -1.51 0.99 -1.17 0.04 0.00 0.00 177.00 175.51 2j0k s LEU 327 N -4.91 4.12 -0.19 -3.56 2.96 0.35 -4.84 118.68 112.60 2j0k s LEU 327 Ca 0.71 1.33 -0.05 0.00 -0.22 0.00 0.00 54.13 55.89 2j0k s LEU 327 Cb -0.25 -3.46 -0.03 0.00 0.50 0.00 0.00 46.19 42.94 2j0k s LEU 327 CO 0.42 -0.60 0.01 -0.89 -1.32 0.00 0.00 176.35 173.97 2j0k s THR 328 N 2.95 4.20 -0.14 3.68 2.01 -1.26 -0.38 115.64 126.71 2j0k s THR 328 Ca 0.43 -0.24 0.01 0.00 0.31 0.00 0.00 61.69 62.20 2j0k s THR 328 Cb -0.15 -2.89 0.02 0.00 0.01 0.00 0.00 72.50 69.48 2j0k s THR 328 CO 0.08 0.45 -0.16 -0.69 -0.69 0.00 0.00 174.62 173.60 2j0k s VAL 329 N 0.68 1.68 -0.18 3.82 1.01 0.26 -1.43 120.40 126.25 2j0k s VAL 329 Ca 0.00 -0.72 -0.15 0.00 0.00 0.00 0.00 61.98 61.11 2j0k s VAL 329 Cb -0.14 -1.54 -0.04 0.00 0.00 0.00 0.00 36.38 34.66 2j0k s VAL 329 CO 0.02 0.48 0.37 -0.89 0.00 0.00 0.00 175.10 175.08 2j0k s THR 330 N 1.21 5.24 0.10 3.92 2.01 0.08 0.50 115.64 128.70 2j0k s THR 330 Ca -0.00 0.68 0.08 0.00 0.31 0.00 0.00 61.69 62.76 2j0k s THR 330 Cb -0.14 -3.71 -0.04 0.00 0.01 0.00 0.00 72.50 68.63 2j0k s THR 330 CO -0.07 0.31 -0.16 0.00 -0.69 0.00 0.00 174.62 174.01 2j0k s ALA 331 N 0.93 2.73 0.26 7.40 0.00 0.15 -1.32 121.76 131.90 2j0k s ALA 331 Ca 0.19 -1.31 -0.12 0.00 0.00 0.00 0.00 51.96 50.73 2j0k s ALA 331 Cb -0.14 -0.72 0.36 0.00 0.00 0.00 0.00 23.12 22.63 2j0k s ALA 331 CO 0.07 0.60 1.57 -1.35 0.00 0.00 0.00 175.76 176.65 2j0k h PRO 332 N 3.81 -0.01 -4.97 0.00 0.11 -1.86 0.22 132.00 129.31 2j0k h PRO 332 Ca -0.49 0.00 -0.31 0.00 0.11 0.00 0.00 66.00 65.30 2j0k h PRO 332 Cb 1.17 0.00 -0.15 0.00 0.11 0.00 0.00 31.00 32.13 2j0k h PRO 332 CO 0.47 -0.01 -0.69 -1.54 -0.21 0.00 0.00 178.00 176.02 2j0k s SER 333 N -5.28 1.61 0.22 -2.05 1.04 -1.26 -3.00 113.70 104.99 2j0k s SER 333 Ca -0.15 -1.07 -0.08 0.00 0.48 0.00 0.00 55.95 55.14 2j0k s SER 333 Cb 0.24 0.03 0.18 0.00 0.10 0.00 0.00 66.02 66.57 2j0k s SER 333 CO 0.75 -0.42 1.83 0.25 0.98 0.00 0.00 173.24 176.63 2j0k h LEU 334 N 2.75 1.09 -0.72 2.42 5.85 -1.82 -2.16 115.31 122.72 2j0k h LEU 334 Ca -0.37 -0.12 0.13 0.00 0.84 0.00 0.00 57.88 58.36 2j0k h LEU 334 Cb 1.19 -0.28 -0.09 0.00 0.37 0.00 0.00 40.66 41.85 2j0k h LEU 334 CO 0.64 0.90 0.28 0.74 -0.34 0.00 0.00 178.44 180.66 2j0k h THR 335 N 1.19 0.68 -0.28 1.05 2.02 -1.95 0.11 112.91 115.73 2j0k h THR 335 Ca 0.29 -0.15 -0.06 0.00 0.77 0.00 0.00 66.41 67.26 2j0k h THR 335 Cb 0.08 0.21 -0.01 0.00 -1.74 0.00 0.00 68.15 66.69 2j0k h THR 335 CO -0.04 0.08 -0.07 0.40 0.37 0.00 0.00 175.52 176.26 2j0k h ILE 336 N 0.43 1.28 -0.98 3.11 2.04 -1.78 0.77 117.51 122.38 2j0k h ILE 336 Ca 0.39 -1.09 0.08 0.00 1.00 0.00 0.00 64.86 65.24 2j0k h ILE 336 Cb 0.57 1.41 -0.07 0.00 -0.74 0.00 0.00 36.82 37.99 2j0k h ILE 336 CO -0.39 0.35 0.63 0.00 0.00 0.00 0.00 178.15 178.74 2j0k h ALA 337 N 0.78 1.46 0.30 1.87 0.00 -0.73 -0.29 119.26 122.66 2j0k h ALA 337 Ca 0.07 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 2j0k h ALA 337 Cb 0.54 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 18.06 2j0k h ALA 337 CO 0.03 0.37 -0.14 0.93 0.00 0.00 0.00 179.25 180.43 2j0k h GLU 338 N 1.10 -0.39 -0.66 0.00 5.08 -0.37 -1.54 114.58 117.80 2j0k h GLU 338 Ca 0.44 0.03 0.12 0.00 -1.00 0.00 0.00 59.36 58.94 2j0k h GLU 338 Cb 0.26 0.09 -0.08 0.00 0.50 0.00 0.00 28.75 29.51 2j0k h GLU 338 CO -0.19 -0.21 0.23 -0.91 -1.00 0.00 0.00 179.01 176.93 2j0k h ASN 339 N -0.48 0.19 -0.52 1.42 2.35 0.22 0.94 115.58 119.70 2j0k h ASN 339 Ca -0.04 0.10 -0.05 0.00 -0.55 0.00 0.00 56.30 55.76 2j0k h ASN 339 Cb 0.36 0.09 -0.02 0.00 0.05 0.00 0.00 38.32 38.80 2j0k h ASN 339 CO 0.07 0.09 0.13 0.24 -1.65 0.00 0.00 177.43 176.31 2j0k h MET 340 N 0.39 0.83 0.13 0.81 2.86 -0.97 -0.83 114.93 118.15 2j0k h MET 340 Ca 0.35 -0.20 0.00 0.00 -2.06 0.00 0.00 59.70 57.79 2j0k h MET 340 Cb 0.49 -0.11 -0.01 0.00 0.06 0.00 0.00 31.60 32.03 2j0k h MET 340 CO -0.37 0.79 -0.11 0.00 1.06 0.00 0.00 176.91 178.29 2j0k h ALA 341 N 1.00 -0.23 -0.59 6.32 0.00 -0.33 0.53 119.26 125.96 2j0k h ALA 341 Ca 0.16 -0.04 0.11 0.00 0.00 0.00 0.00 54.91 55.15 2j0k h ALA 341 Cb 0.34 0.14 -0.11 0.00 0.00 0.00 0.00 17.79 18.15 2j0k h ALA 341 CO 0.00 -0.64 -0.23 0.22 0.00 0.00 0.00 179.25 178.61 2j0k h ASP 342 N -0.25 -0.80 0.24 0.00 3.58 -0.59 0.26 116.42 118.86 2j0k h ASP 342 Ca -0.00 0.20 0.00 0.00 0.42 0.00 0.00 57.03 57.65 2j0k h ASP 342 Cb 0.22 0.45 -0.02 0.00 1.72 0.00 0.00 39.33 41.71 2j0k h ASP 342 CO -0.01 -0.25 -0.22 0.25 -2.88 0.00 0.00 179.24 176.13 2j0k h LEU 343 N -0.08 -0.59 -1.07 2.28 5.85 -0.66 -0.45 115.31 120.59 2j0k h LEU 343 Ca 0.27 0.05 -0.03 0.00 0.84 0.00 0.00 57.88 59.01 2j0k h LEU 343 Cb 0.50 0.20 -0.03 0.00 0.37 0.00 0.00 40.66 41.70 2j0k h LEU 343 CO -0.64 -0.33 0.31 0.40 -0.34 0.00 0.00 178.44 177.83 2j0k h ILE 344 N -0.49 1.22 0.63 4.05 2.04 -0.20 -1.93 117.51 122.83 2j0k h ILE 344 Ca -0.01 -0.65 -0.02 0.00 1.00 0.00 0.00 64.86 65.18 2j0k h ILE 344 Cb 0.45 0.38 -0.02 0.00 -0.74 0.00 0.00 36.82 36.89 2j0k h ILE 344 CO -0.04 0.27 -0.51 -0.78 0.00 0.00 0.00 178.15 177.09 2j0k h ASP 345 N 0.96 -1.35 -0.88 1.72 3.58 -0.09 -1.50 116.42 118.86 2j0k h ASP 345 Ca 0.23 0.10 0.15 0.00 0.42 0.00 0.00 57.03 57.93 2j0k h ASP 345 Cb 0.13 0.43 -0.15 0.00 1.72 0.00 0.00 39.33 41.45 2j0k h ASP 345 CO -0.03 -0.71 -0.30 0.61 -2.88 0.00 0.00 179.24 175.93 2j0k n GLY 346 N -1.59 -1.71 0.20 -0.78 0.00 -0.22 -0.67 105.19 100.42 2j0k n GLY 346 Ca -0.13 0.98 0.04 0.00 0.00 0.00 0.00 46.02 46.90 2j0k n GLY 346 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 2j0k h TYR 347 N 0.00 0.00 0.03 1.61 -1.99 -0.55 -1.30 116.97 114.78 2j0k h TYR 347 Ca 0.35 0.00 -0.08 0.00 2.00 0.00 0.00 58.73 61.00 2j0k h TYR 347 Cb 0.57 0.00 0.01 0.00 2.00 0.00 0.00 36.73 39.30 2j0k h TYR 347 CO -0.74 0.32 -0.33 0.00 -0.00 0.00 0.00 178.16 177.41 2j0k h ARG 349 N -0.59 0.45 0.05 0.00 3.08 -0.82 -2.22 114.38 114.33 2j0k h ARG 349 Ca -0.05 -0.03 -0.08 0.00 0.07 0.00 0.00 59.98 59.90 2j0k h ARG 349 Cb 1.16 -0.10 0.01 0.00 0.08 0.00 0.00 29.97 31.12 2j0k h ARG 349 CO 0.06 0.30 -0.33 1.25 -1.07 0.00 0.00 179.97 180.18 2j0k h LEU 350 N 0.46 0.20 0.33 3.04 5.85 -1.14 0.66 115.31 124.71 2j0k h LEU 350 Ca 0.61 -0.97 -0.02 0.00 0.84 0.00 0.00 57.88 58.35 2j0k h LEU 350 Cb 1.20 -0.06 0.00 0.00 0.37 0.00 0.00 40.66 42.17 2j0k h LEU 350 CO -0.52 1.15 -0.16 1.62 -0.34 0.00 0.00 178.44 180.19 2j0k h VAL 351 N -0.72 0.68 -3.97 1.05 3.04 -0.21 -3.38 116.25 112.73 2j0k h VAL 351 Ca -0.06 -0.03 -0.46 0.00 -1.01 0.00 0.00 66.70 65.14 2j0k h VAL 351 Cb 1.24 0.70 0.15 0.00 -2.01 0.00 0.00 31.29 31.37 2j0k h VAL 351 CO 0.06 0.01 0.22 0.20 -1.01 0.00 0.00 177.57 177.05 2j0k s ASN 352 N -4.81 2.88 -0.17 3.17 0.01 -0.88 -4.93 114.94 110.21 2j0k s ASN 352 Ca -0.15 1.16 0.01 0.00 -0.71 0.00 0.00 52.86 53.16 2j0k s ASN 352 Cb 0.05 -1.80 0.20 0.00 0.41 0.00 0.00 41.25 40.10 2j0k s ASN 352 CO 0.64 -2.96 1.51 0.61 -1.51 0.00 0.00 177.10 175.38 2j0k n GLY 353 N -1.35 3.06 3.88 0.66 0.00 -1.26 -4.71 105.19 105.46 2j0k n GLY 353 Ca 0.06 -0.48 -0.30 0.00 0.00 0.00 0.00 46.02 45.30 2j0k n GLY 353 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2j0k s ALA 354 N -1.14 3.24 -0.01 4.61 0.00 0.23 -5.01 121.76 123.67 2j0k s ALA 354 Ca 0.20 -0.20 0.01 0.00 0.00 0.00 0.00 51.96 51.96 2j0k s ALA 354 Cb 0.16 -2.86 -0.01 0.00 0.00 0.00 0.00 23.12 20.41 2j0k s ALA 354 CO 0.02 -0.40 0.02 0.25 0.00 0.00 0.00 175.76 175.66 2j0k n THR 355 N -2.17 0.00 -3.53 0.00 -2.24 -1.26 -4.51 114.28 100.58 2j0k n THR 355 Ca 0.04 -0.12 -0.34 0.00 -2.27 0.00 0.00 64.05 61.35 2j0k n THR 355 Cb 0.54 0.60 -0.05 0.00 -2.10 0.00 0.00 70.33 69.32 2j0k n THR 355 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 2j0k s GLN 356 N -1.84 3.80 1.03 -0.78 1.11 -1.26 -5.08 119.66 116.64 2j0k s GLN 356 Ca -0.00 0.23 -0.11 0.00 0.01 0.00 0.00 55.36 55.49 2j0k s GLN 356 Cb 0.01 -2.96 0.20 0.00 -1.01 0.00 0.00 33.01 29.25 2j0k s GLN 356 CO 0.04 0.53 1.05 0.45 0.01 0.00 0.00 175.29 177.36 2j0k n SER 357 N 0.79 -0.61 0.00 5.90 2.88 -1.26 -4.82 113.62 116.50 2j0k n SER 357 Ca -0.07 0.18 0.00 0.00 -1.33 0.00 0.00 58.87 57.65 2j0k n SER 357 Cb 0.52 -1.38 0.00 0.00 -0.75 0.00 0.00 64.21 62.61 2j0k n SER 357 CO 0.00 0.00 0.00 0.49 -1.23 0.00 0.00 175.04 174.30 2j0k n PHE 358 N -4.54 0.00 -3.61 0.66 3.01 -1.26 -5.01 117.46 106.71 2j0k n PHE 358 Ca 0.08 -0.38 -0.37 0.00 1.01 0.00 0.00 57.45 57.79 2j0k n PHE 358 Cb 0.53 -0.04 -0.07 0.00 -0.01 0.00 0.00 39.48 39.89 2j0k n PHE 358 CO 0.00 0.00 0.00 0.42 1.01 0.00 0.00 176.76 178.19 2j0k s ILE 359 N -0.76 5.30 0.16 4.37 1.01 -1.25 -0.40 121.20 129.63 2j0k s ILE 359 Ca 0.00 0.51 0.02 0.00 0.00 0.00 0.00 60.65 61.18 2j0k s ILE 359 Cb 0.00 -3.59 -0.05 0.00 0.01 0.00 0.00 42.46 38.83 2j0k s ILE 359 CO 0.00 0.47 -0.01 0.27 0.00 0.00 0.00 174.94 175.67 2j0k s ILE 360 N -0.09 0.65 0.00 2.92 -5.25 -0.47 -4.96 121.20 113.99 2j0k s ILE 360 Ca 0.17 -1.97 0.00 0.00 -0.99 0.00 0.00 60.65 57.86 2j0k s ILE 360 Cb -0.13 -2.05 0.00 0.00 2.95 0.00 0.00 42.46 43.23 2j0k s ILE 360 CO 0.05 -0.54 0.00 -1.14 -1.79 0.00 0.00 174.94 171.53 2j0k n ARG 361 N -0.20 0.00 -1.30 0.37 3.00 -1.26 -4.61 116.66 112.65 2j0k n ARG 361 Ca -0.07 0.00 -0.38 0.00 -0.00 0.00 0.00 57.85 57.40 2j0k n ARG 361 Cb 0.63 0.00 -0.02 0.00 0.00 0.00 0.00 32.46 33.06 2j0k n ARG 361 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.63 175.33 2j0k n PRO 362 N 0.00 2.49 0.00 -0.14 -0.02 -1.26 -5.24 135.00 130.83 2j0k n PRO 362 Ca 0.00 -2.10 0.00 0.00 -2.02 0.00 0.00 63.50 59.38 2j0k n PRO 362 Cb 0.00 -2.94 0.00 0.00 -0.02 0.00 0.00 33.50 30.54 2j0k n PRO 362 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2j0k n GLY 383 N 4.06 1.07 2.10 -1.23 0.00 -1.26 -5.33 105.19 104.60 2j0k n GLY 383 Ca 0.55 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.57 2j0k n GLY 383 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2j0k n VAL 384 N 0.00 0.00 -2.12 1.61 0.31 -1.26 -5.09 118.33 111.78 2j0k n VAL 384 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 2j0k n VAL 384 Cb 0.00 -0.06 0.00 0.00 -0.91 0.00 0.00 33.84 32.87 2j0k n VAL 384 CO 0.00 0.00 0.00 -1.14 -1.32 0.00 0.00 176.83 174.37 2j0k n ARG 385 N -2.94 3.91 0.00 5.55 3.00 -1.26 -5.12 116.66 119.80 2j0k n ARG 385 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.85 2j0k n ARG 385 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32.46 32.46 2j0k n ARG 385 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.63 178.08 2j0k n SER 386 N 0.00 0.00 0.00 6.15 2.88 -1.26 -5.04 113.62 116.35 2j0k n SER 386 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 2j0k n SER 386 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 2j0k n SER 386 CO 0.00 0.00 0.00 1.41 -1.23 0.00 0.00 175.04 175.22 2j0k n HIS 387 N 0.00 0.00 -0.05 0.66 8.25 -1.26 -5.21 115.22 117.61 2j0k n HIS 387 Ca 0.00 0.00 -0.15 0.00 -0.26 0.00 0.00 57.72 57.31 2j0k n HIS 387 Cb 0.00 0.00 -0.08 0.00 1.12 0.00 0.00 29.99 31.03 2j0k n HIS 387 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2j0k h THR 388 N 0.00 1.36 -3.64 1.59 1.03 -2.08 -3.55 112.91 107.62 2j0k h THR 388 Ca 0.00 -1.63 -0.65 0.00 -0.01 0.00 0.00 66.41 64.12 2j0k h THR 388 Cb 0.00 2.05 -0.40 0.00 -1.07 0.00 0.00 68.15 68.73 2j0k h THR 388 CO 0.00 0.49 -0.73 -0.62 -0.01 0.00 0.00 175.52 174.65 2j0k s ASP 395 N -6.47 4.66 -0.75 0.00 2.15 -1.25 -5.32 116.67 109.68 2j0k s ASP 395 Ca -0.13 -2.04 -0.04 0.00 0.43 0.00 0.00 52.55 50.77 2j0k s ASP 395 Cb 0.06 -1.54 0.14 0.00 -0.30 0.00 0.00 42.92 41.28 2j0k s ASP 395 CO 0.80 -0.37 2.49 -0.90 -0.17 0.00 0.00 175.17 177.02 2j0k n ASP 396 N 4.33 7.06 -4.79 -0.34 5.68 -1.25 -4.10 116.55 123.15 2j0k n ASP 396 Ca 0.02 -3.34 -0.36 0.00 -0.50 0.00 0.00 54.79 50.61 2j0k n ASP 396 Cb 0.42 -1.23 -0.05 0.00 -1.14 0.00 0.00 41.12 39.12 2j0k n ASP 396 CO 0.00 0.00 0.00 -0.72 -1.33 0.00 0.00 177.20 175.15 2j0k s TYR 397 N -2.20 3.36 -0.04 2.11 1.13 -1.26 -4.87 117.35 115.58 2j0k s TYR 397 Ca 0.55 1.67 -0.01 0.00 -1.41 0.00 0.00 57.07 57.86 2j0k s TYR 397 Cb 0.34 -3.02 0.03 0.00 -1.10 0.00 0.00 41.96 38.21 2j0k s TYR 397 CO -0.22 -0.33 0.08 0.00 -2.51 0.00 0.00 175.55 172.56 2j0k s ALA 398 N -1.78 -0.08 -0.08 9.51 0.00 -1.26 -3.58 121.76 124.49 2j0k s ALA 398 Ca 0.57 0.42 -0.04 0.00 0.00 0.00 0.00 51.96 52.91 2j0k s ALA 398 Cb -0.18 -0.30 0.04 0.00 0.00 0.00 0.00 23.12 22.68 2j0k s ALA 398 CO 0.23 -0.11 0.19 -2.00 0.00 0.00 0.00 175.76 174.07 2j0k s GLU 399 N 0.93 0.15 0.06 0.00 2.12 -1.16 -4.98 118.70 115.83 2j0k s GLU 399 Ca -0.07 0.45 -0.26 0.00 0.36 0.00 0.00 54.97 55.44 2j0k s GLU 399 Cb -0.10 -0.15 -0.06 0.00 0.26 0.00 0.00 34.13 34.08 2j0k s GLU 399 CO -0.04 -0.16 0.80 0.96 -0.54 0.00 0.00 175.26 176.28 2j0k s ILE 400 N 1.19 4.67 0.38 -3.70 -5.25 -1.26 -1.14 121.20 116.10 2j0k s ILE 400 Ca -0.09 1.70 0.06 0.00 -0.99 0.00 0.00 60.65 61.33 2j0k s ILE 400 Cb -0.11 -4.15 -0.02 0.00 2.95 0.00 0.00 42.46 41.13 2j0k s ILE 400 CO -0.07 0.37 0.21 0.27 -1.79 0.00 0.00 174.94 173.92 2j0k s ILE 401 N -0.11 0.27 0.58 8.37 -4.36 0.42 -5.00 121.20 121.37 2j0k s ILE 401 Ca 0.40 -2.00 0.10 0.00 -0.26 0.00 0.00 60.65 58.88 2j0k s ILE 401 Cb -0.21 -2.39 0.09 0.00 1.25 0.00 0.00 42.46 41.20 2j0k s ILE 401 CO 0.24 0.00 0.79 1.51 0.24 0.00 0.00 174.94 177.72 2j0k s ASP 402 N -3.51 5.09 0.53 4.36 -4.77 -1.26 -4.22 116.67 112.89 2j0k s ASP 402 Ca 0.31 -0.86 0.09 0.00 -3.30 0.00 0.00 52.55 48.79 2j0k s ASP 402 Cb 0.02 0.31 0.06 0.00 -1.09 0.00 0.00 42.92 42.23 2j0k s ASP 402 CO 0.21 -1.34 0.73 -1.61 0.70 0.00 0.00 175.17 173.85 2j0k s GLU 403 N -4.66 2.46 -0.08 2.11 2.02 -1.26 -5.02 118.70 114.27 2j0k s GLU 403 Ca 0.61 -1.51 0.00 0.00 0.02 0.00 0.00 54.97 54.10 2j0k s GLU 403 Cb -0.06 -2.68 -0.03 0.00 0.10 0.00 0.00 34.13 31.47 2j0k s GLU 403 CO 0.39 -0.69 -0.06 -1.21 0.02 0.00 0.00 175.26 173.70 2j0k s GLU 404 N -4.58 2.85 0.11 1.61 0.41 -1.26 -5.13 118.70 112.71 2j0k s GLU 404 Ca 0.60 -0.54 0.07 0.00 -0.41 0.00 0.00 54.97 54.69 2j0k s GLU 404 Cb -0.07 -2.63 -0.03 0.00 -1.78 0.00 0.00 34.13 29.62 2j0k s GLU 404 CO 0.37 0.63 -0.18 0.34 -0.49 0.00 0.00 175.26 175.93 2j0k s ASP 405 N -0.70 2.23 0.00 -0.19 2.15 -1.26 -5.02 116.67 113.88 2j0k s ASP 405 Ca 0.11 -0.71 0.00 0.00 0.43 0.00 0.00 52.55 52.37 2j0k s ASP 405 Cb -0.11 -0.10 0.00 0.00 -0.30 0.00 0.00 42.92 42.40 2j0k s ASP 405 CO 0.02 -0.03 1.18 1.07 -0.17 0.00 0.00 175.17 177.24 2j0k n THR 406 N 0.94 1.18 -1.53 1.71 5.66 -1.26 -2.55 114.28 118.43 2j0k n THR 406 Ca -0.18 -0.09 0.00 0.00 -3.05 0.00 0.00 64.05 60.72 2j0k n THR 406 Cb 0.55 -1.09 0.00 0.00 -1.55 0.00 0.00 70.33 68.24 2j0k n THR 406 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2j0k n TYR 407 N 0.69 0.00 -2.77 1.09 9.36 -1.26 -4.93 117.16 119.33 2j0k n TYR 407 Ca 0.00 0.00 -0.03 0.00 3.32 0.00 0.00 57.90 61.19 2j0k n TYR 407 Cb 0.50 0.04 0.05 0.00 -0.63 0.00 0.00 39.34 39.29 2j0k n TYR 407 CO 0.00 0.00 0.00 2.41 0.22 0.00 0.00 176.86 179.49 2j0k n THR 408 N 0.00 1.12 -1.97 2.97 -1.04 -1.06 -4.77 114.28 109.52 2j0k n THR 408 Ca 0.00 -2.87 0.00 0.00 -2.04 0.00 0.00 64.05 59.14 2j0k n THR 408 Cb 0.31 1.09 0.00 0.00 -1.82 0.00 0.00 70.33 69.91 2j0k n THR 408 CO 0.00 0.00 0.00 1.15 -0.64 0.00 0.00 175.07 175.58 2j0k n MET 409 N -0.46 0.00 -2.36 -2.82 0.00 -1.26 -4.74 117.12 105.48 2j0k n MET 409 Ca 0.07 -0.15 -0.41 0.00 0.00 0.00 0.00 57.70 57.20 2j0k n MET 409 Cb 0.81 -0.08 -0.03 0.00 0.00 0.00 0.00 33.22 33.91 2j0k n MET 409 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 175.97 174.72 2j0k s PRO 410 N 0.00 4.51 1.39 3.17 0.04 -1.26 -4.95 135.00 137.89 2j0k s PRO 410 Ca 0.00 1.91 -0.21 0.00 0.04 0.00 0.00 61.00 62.74 2j0k s PRO 410 Cb 0.00 -3.20 0.35 0.00 0.04 0.00 0.00 34.50 31.69 2j0k s PRO 410 CO 0.00 -0.04 0.87 0.43 0.04 0.00 0.00 177.00 178.30 2j0k n SER 411 N 1.97 -3.53 0.00 6.66 7.64 -1.26 -5.07 113.62 120.04 2j0k n SER 411 Ca 0.03 -0.67 0.00 0.00 1.01 0.00 0.00 58.87 59.24 2j0k n SER 411 Cb 0.44 -1.06 0.00 0.00 -1.01 0.00 0.00 64.21 62.59 2j0k n SER 411 CO 0.00 0.00 0.00 1.07 -3.01 0.00 0.00 175.04 173.10 2j0k n THR 412 N -5.57 0.00 -0.05 0.44 5.66 -1.26 -5.06 114.28 108.44 2j0k n THR 412 Ca 0.10 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.10 2j0k n THR 412 Cb 0.58 -0.40 0.00 0.00 -1.55 0.00 0.00 70.33 68.96 2j0k n THR 412 CO 0.00 0.00 0.00 0.54 -3.05 0.00 0.00 175.07 172.56 2j0k n ARG 413 N 0.00 0.00 -1.67 1.09 1.74 -1.26 -4.27 116.66 112.29 2j0k n ARG 413 Ca 0.00 0.00 -0.42 0.00 -0.77 0.00 0.00 57.85 56.66 2j0k n ARG 413 Cb 0.00 0.00 -0.03 0.00 -1.02 0.00 0.00 32.46 31.41 2j0k n ARG 413 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 2j0k n ASP 414 N 0.03 4.15 -0.17 0.55 8.00 -1.26 -2.28 116.55 125.58 2j0k n ASP 414 Ca 0.00 0.92 0.06 0.00 0.71 0.00 0.00 54.79 56.48 2j0k n ASP 414 Cb 0.00 -1.53 0.08 0.00 -0.02 0.00 0.00 41.12 39.65 2j0k n ASP 414 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2j0k n TYR 415 N 7.15 0.00 -1.73 1.24 0.18 -1.26 -5.13 117.16 117.61 2j0k n TYR 415 Ca 0.20 -0.64 -0.41 0.00 1.88 0.00 0.00 57.90 58.93 2j0k n TYR 415 Cb 0.40 -0.11 0.01 0.00 -0.38 0.00 0.00 39.34 39.26 2j0k n TYR 415 CO 0.00 0.00 0.00 0.39 -2.08 0.00 0.00 176.86 175.17 2j0k n GLU 416 N -0.90 2.18 -4.11 -3.48 -0.58 -0.96 -1.16 120.64 111.63 2j0k n GLU 416 Ca 0.09 0.77 -0.14 0.00 -0.42 0.00 0.00 57.16 57.46 2j0k n GLU 416 Cb 0.60 -2.49 -0.13 0.00 -0.57 0.00 0.00 31.44 28.86 2j0k n GLU 416 CO 0.00 0.00 0.00 0.42 -0.48 0.00 0.00 177.13 177.07 2j0k s ILE 417 N -1.17 0.43 -0.08 -3.67 1.01 0.75 -4.82 121.20 113.65 2j0k s ILE 417 Ca 0.59 -0.54 -0.27 0.00 0.00 0.00 0.00 60.65 60.43 2j0k s ILE 417 Cb -0.50 -0.43 -0.02 0.00 0.01 0.00 0.00 42.46 41.52 2j0k s ILE 417 CO 0.60 -0.08 0.86 -1.10 0.00 0.00 0.00 174.94 175.22 2j0k s GLN 418 N -0.67 4.43 0.57 2.79 1.11 -1.26 -4.54 119.66 122.08 2j0k s GLN 418 Ca -0.03 1.15 0.31 0.00 0.01 0.00 0.00 55.36 56.80 2j0k s GLN 418 Cb -0.05 -3.50 1.44 0.00 -1.01 0.00 0.00 33.01 29.89 2j0k s GLN 418 CO 0.00 -0.14 1.82 -0.09 0.01 0.00 0.00 175.29 176.89 2j0k h ARG 419 N 6.99 0.00 0.00 2.91 2.43 -1.95 -0.65 114.38 124.11 2j0k h ARG 419 Ca -0.36 0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 58.80 2j0k h ARG 419 Cb 1.18 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 30.72 2j0k h ARG 419 CO 0.79 0.00 -0.03 0.93 -1.51 0.00 0.00 179.97 180.15 2j0k h GLU 420 N 0.00 0.00 -0.70 0.20 3.07 -2.01 -1.11 114.58 114.03 2j0k h GLU 420 Ca 0.36 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.22 2j0k h GLU 420 Cb 1.69 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 29.60 2j0k h GLU 420 CO -0.00 0.03 0.00 0.54 -1.40 0.00 0.00 179.01 178.18 2j0k n ARG 421 N -3.80 2.45 -4.03 2.33 1.74 -0.25 -4.81 116.66 110.30 2j0k n ARG 421 Ca -0.03 -1.31 -0.26 0.00 -0.77 0.00 0.00 57.85 55.49 2j0k n ARG 421 Cb 0.12 -1.69 -0.17 0.00 -1.02 0.00 0.00 32.46 29.70 2j0k n ARG 421 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 2j0k s ILE 422 N -1.71 0.99 -0.48 0.55 -1.09 -0.42 -2.53 121.20 116.50 2j0k s ILE 422 Ca 0.23 -0.29 -0.15 0.00 -2.23 0.00 0.00 60.65 58.21 2j0k s ILE 422 Cb 0.16 -0.99 0.08 0.00 -1.58 0.00 0.00 42.46 40.13 2j0k s ILE 422 CO 0.09 0.35 0.40 -1.61 -1.23 0.00 0.00 174.94 172.94 2j0k s GLU 423 N 1.51 2.97 -0.46 2.79 2.02 -0.27 -4.96 118.70 122.29 2j0k s GLU 423 Ca 0.01 -1.39 -0.28 0.00 0.02 0.00 0.00 54.97 53.34 2j0k s GLU 423 Cb -0.13 -4.13 -0.02 0.00 0.10 0.00 0.00 34.13 29.95 2j0k s GLU 423 CO -0.06 -1.05 1.79 -1.17 0.02 0.00 0.00 175.26 174.80 2j0k s LEU 424 N 1.63 3.42 0.00 1.80 2.96 -1.26 -1.89 118.68 125.34 2j0k s LEU 424 Ca 0.04 0.84 0.00 0.00 -0.22 0.00 0.00 54.13 54.79 2j0k s LEU 424 Cb -0.25 -3.08 0.00 0.00 0.50 0.00 0.00 46.19 43.36 2j0k s LEU 424 CO 0.06 -1.98 0.00 0.61 -1.32 0.00 0.00 176.35 173.72 2j0k n GLY 425 N 5.51 1.35 3.59 7.98 0.00 0.06 -5.00 105.19 118.69 2j0k n GLY 425 Ca 0.21 -1.96 -0.39 0.00 0.00 0.00 0.00 46.02 43.88 2j0k n GLY 425 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2j0k n ARG 426 N -0.05 1.04 -2.47 1.61 0.63 -1.25 -4.47 116.66 111.71 2j0k n ARG 426 Ca 0.00 0.39 -0.41 0.00 -0.92 0.00 0.00 57.85 56.91 2j0k n ARG 426 Cb 0.00 -2.04 -0.04 0.00 0.45 0.00 0.00 32.46 30.83 2j0k n ARG 426 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2j0k n ILE 428 N 2.47 0.00 -3.50 0.00 -5.35 0.20 -4.88 119.36 108.31 2j0k n ILE 428 Ca 0.03 -0.35 -0.13 0.00 -0.27 0.00 0.00 62.75 62.04 2j0k n ILE 428 Cb 0.46 0.87 -0.04 0.00 -1.74 0.00 0.00 39.64 39.19 2j0k n ILE 428 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 2j0k s GLY 429 N -1.16 -0.50 -0.19 3.28 0.00 -0.76 -4.99 107.32 102.99 2j0k s GLY 429 Ca 0.00 1.17 -0.07 0.00 0.00 0.00 0.00 44.72 45.82 2j0k s GLY 429 CO 0.00 0.62 0.05 -0.54 0.00 0.00 0.00 173.10 173.23 2j0k s GLU 430 N -2.28 3.88 0.00 2.90 8.01 -1.26 -0.90 118.70 129.05 2j0k s GLU 430 Ca -0.02 -0.39 0.00 0.00 0.01 0.00 0.00 54.97 54.56 2j0k s GLU 430 Cb -0.01 -3.19 0.00 0.00 -4.31 0.00 0.00 34.13 26.63 2j0k s GLU 430 CO -0.02 0.19 0.00 0.41 0.01 0.00 0.00 175.26 175.86 2j0k n GLY 431 N 3.76 1.82 0.88 -1.39 0.00 -1.04 -4.94 105.19 104.27 2j0k n GLY 431 Ca -0.17 -1.83 -0.03 0.00 0.00 0.00 0.00 46.02 43.99 2j0k n GLY 431 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2j0k n GLN 432 N 0.00 0.09 -0.20 1.61 1.13 -1.26 -4.67 117.38 114.08 2j0k n GLN 432 Ca 0.00 0.04 -0.03 0.00 -1.94 0.00 0.00 57.00 55.07 2j0k n GLN 432 Cb 0.00 -0.65 0.07 0.00 0.11 0.00 0.00 30.24 29.77 2j0k n GLN 432 CO 0.00 0.00 0.00 0.27 -1.44 0.00 0.00 177.06 175.89 2j0k h PHE 433 N -0.16 0.56 0.00 1.08 -5.15 -1.99 -3.48 116.94 107.80 2j0k h PHE 433 Ca -0.07 0.02 0.00 0.00 -0.20 0.00 0.00 57.97 57.73 2j0k h PHE 433 Cb 0.71 -0.17 0.00 0.00 0.22 0.00 0.00 35.95 36.71 2j0k h PHE 433 CO -0.04 0.27 0.00 0.41 -2.00 0.00 0.00 178.31 176.95 2j0k n GLY 434 N -1.27 -0.82 3.92 6.09 0.00 -1.25 -3.36 105.19 108.49 2j0k n GLY 434 Ca 0.06 -1.03 -0.26 0.00 0.00 0.00 0.00 46.02 44.80 2j0k n GLY 434 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2j0k s ASP 435 N 0.00 5.92 -0.12 1.61 1.01 -0.95 -2.50 116.67 121.63 2j0k s ASP 435 Ca 0.00 0.66 -0.01 0.00 0.71 0.00 0.00 52.55 53.92 2j0k s ASP 435 Cb 0.00 -1.86 -0.02 0.00 1.01 0.00 0.00 42.92 42.05 2j0k s ASP 435 CO 0.00 -0.77 -0.10 -0.69 0.21 0.00 0.00 175.17 173.82 2j0k s VAL 436 N -2.76 3.35 0.33 -1.27 1.01 -0.07 0.19 120.40 121.18 2j0k s VAL 436 Ca 0.49 -0.56 0.10 0.00 0.00 0.00 0.00 61.98 62.00 2j0k s VAL 436 Cb -0.10 -2.41 -0.06 0.00 0.00 0.00 0.00 36.38 33.81 2j0k s VAL 436 CO 0.43 0.53 -0.04 -1.00 0.00 0.00 0.00 175.10 175.01 2j0k s HIS 437 N 0.13 2.49 0.27 5.22 3.76 0.19 0.62 115.29 127.97 2j0k s HIS 437 Ca -0.05 -0.42 0.04 0.00 -0.15 0.00 0.00 55.06 54.48 2j0k s HIS 437 Cb -0.14 -1.38 -0.03 0.00 1.11 0.00 0.00 32.58 32.14 2j0k s HIS 437 CO 0.04 0.54 0.40 1.14 -0.85 0.00 0.00 174.74 176.01 2j0k s GLN 438 N -3.66 3.41 0.18 1.40 -2.07 -0.09 0.10 119.66 118.94 2j0k s GLN 438 Ca 0.33 -0.72 -0.08 0.00 -1.82 0.00 0.00 55.36 53.07 2j0k s GLN 438 Cb -0.00 -2.85 0.03 0.00 -1.09 0.00 0.00 33.01 29.10 2j0k s GLN 438 CO 0.18 0.35 0.44 0.41 -1.32 0.00 0.00 175.29 175.35 2j0k n GLY 439 N -1.49 1.36 3.42 2.60 0.00 0.09 -0.76 105.19 110.41 2j0k n GLY 439 Ca -0.08 -1.12 -0.31 0.00 0.00 0.00 0.00 46.02 44.52 2j0k n GLY 439 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2j0k s ILE 440 N -2.49 2.62 -0.27 -0.61 -1.09 -0.79 -1.94 121.20 116.63 2j0k s ILE 440 Ca 0.09 -1.17 -0.00 0.00 -2.23 0.00 0.00 60.65 57.34 2j0k s ILE 440 Cb -0.02 -2.06 0.08 0.00 -1.58 0.00 0.00 42.46 38.88 2j0k s ILE 440 CO 0.05 0.40 0.03 -0.47 -1.23 0.00 0.00 174.94 173.72 2j0k s TYR 441 N -0.85 2.03 -0.84 3.97 5.04 -0.04 -1.11 117.35 125.55 2j0k s TYR 441 Ca 0.13 -1.72 -0.17 0.00 -2.44 0.00 0.00 57.07 52.87 2j0k s TYR 441 Cb -0.10 -1.68 0.16 0.00 0.35 0.00 0.00 41.96 40.69 2j0k s TYR 441 CO 0.03 -0.80 0.91 -1.64 -1.34 0.00 0.00 175.55 172.71 2j0k s MET 442 N 1.51 3.52 -0.31 4.97 -1.94 -1.05 -2.58 119.30 123.42 2j0k s MET 442 Ca 0.03 -1.99 -0.21 0.00 -1.71 0.00 0.00 55.69 51.81 2j0k s MET 442 Cb -0.18 -4.61 -0.01 0.00 2.01 0.00 0.00 34.83 32.04 2j0k s MET 442 CO -0.14 -1.54 0.66 -1.54 -0.01 0.00 0.00 175.02 172.45 2j0k s SER 443 N 3.01 6.52 0.09 3.03 1.04 -1.26 -4.80 113.70 121.33 2j0k s SER 443 Ca 0.23 0.44 0.10 0.00 0.48 0.00 0.00 55.95 57.20 2j0k s SER 443 Cb -0.10 -2.34 0.47 0.00 0.10 0.00 0.00 66.02 64.15 2j0k s SER 443 CO -0.07 -0.51 1.30 -0.81 0.98 0.00 0.00 173.24 174.13 2j0k n PRO 444 N 5.95 0.05 -2.30 4.02 -0.04 -1.26 -1.16 135.00 140.25 2j0k n PRO 444 Ca -0.00 0.47 -0.36 0.00 -0.04 0.00 0.00 63.50 63.57 2j0k n PRO 444 Cb 0.49 -1.63 0.02 0.00 -0.04 0.00 0.00 33.50 32.33 2j0k n PRO 444 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 2j0k n GLU 445 N -1.73 3.51 0.00 0.54 1.02 -1.26 -4.98 120.64 117.74 2j0k n GLU 445 Ca 0.01 -4.12 0.00 0.00 -0.02 0.00 0.00 57.16 53.03 2j0k n GLU 445 Cb 0.06 -2.30 0.00 0.00 -0.02 0.00 0.00 31.44 29.18 2j0k n GLU 445 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 2j0k n ASN 446 N -0.40 0.00 -4.82 1.62 5.03 -0.31 -5.17 115.26 111.22 2j0k n ASN 446 Ca 0.47 0.00 -0.24 0.00 0.87 0.00 0.00 54.58 55.68 2j0k n ASN 446 Cb 0.35 0.00 0.08 0.00 -1.02 0.00 0.00 39.78 39.19 2j0k n ASN 446 CO 0.00 0.00 0.00 -2.16 -1.83 0.00 0.00 177.26 173.27 2j0k s PRO 447 N -2.00 2.05 0.79 3.52 0.04 -1.26 -4.69 135.00 133.46 2j0k s PRO 447 Ca 0.00 -0.65 -0.15 0.00 0.04 0.00 0.00 61.00 60.25 2j0k s PRO 447 Cb 0.00 -2.28 0.02 0.00 0.04 0.00 0.00 34.50 32.28 2j0k s PRO 447 CO 0.00 -1.22 0.77 0.00 0.04 0.00 0.00 177.00 176.59 2j0k n ALA 448 N -2.79 -1.11 -3.41 8.56 0.00 -1.26 -4.57 120.51 115.93 2j0k n ALA 448 Ca 0.10 -0.33 -0.12 0.00 0.00 0.00 0.00 53.44 53.09 2j0k n ALA 448 Cb 0.60 -2.00 -0.11 0.00 0.00 0.00 0.00 19.45 17.95 2j0k n ALA 448 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 177.50 178.91 2j0k s MET 449 N -3.42 0.38 0.13 0.00 1.75 -1.06 -4.98 119.30 112.10 2j0k s MET 449 Ca 0.67 0.57 -0.28 0.00 -1.25 0.00 0.00 55.69 55.40 2j0k s MET 449 Cb -0.30 0.11 -0.07 0.00 2.84 0.00 0.00 34.83 37.41 2j0k s MET 449 CO 0.57 -0.09 0.87 0.00 -0.65 0.00 0.00 175.02 175.72 2j0k s ALA 450 N 0.61 3.33 0.09 4.11 0.00 -1.26 -0.86 121.76 127.78 2j0k s ALA 450 Ca -0.03 0.47 -0.03 0.00 0.00 0.00 0.00 51.96 52.36 2j0k s ALA 450 Cb -0.05 -3.14 -0.03 0.00 0.00 0.00 0.00 23.12 19.91 2j0k s ALA 450 CO -0.04 0.10 0.07 0.14 0.00 0.00 0.00 175.76 176.03 2j0k s VAL 451 N -0.44 0.16 -0.08 0.00 -7.23 -0.82 -4.01 120.40 107.98 2j0k s VAL 451 Ca 0.42 -1.66 -0.01 0.00 -1.81 0.00 0.00 61.98 58.92 2j0k s VAL 451 Cb -0.23 -1.64 -0.03 0.00 0.56 0.00 0.00 36.38 35.04 2j0k s VAL 451 CO 0.28 -0.73 -0.01 0.00 -0.31 0.00 0.00 175.10 174.33 2j0k s ALA 452 N -3.94 3.21 -0.11 1.32 0.00 0.10 -0.73 121.76 121.62 2j0k s ALA 452 Ca 0.12 -0.83 0.03 0.00 0.00 0.00 0.00 51.96 51.28 2j0k s ALA 452 Cb 0.07 -1.43 0.01 0.00 0.00 0.00 0.00 23.12 21.77 2j0k s ALA 452 CO -0.06 0.57 -0.19 0.42 0.00 0.00 0.00 175.76 176.50 2j0k s ILE 453 N -0.83 1.74 -0.25 0.00 1.01 0.29 -0.94 121.20 122.21 2j0k s ILE 453 Ca 0.13 -0.80 -0.08 0.00 0.00 0.00 0.00 60.65 59.89 2j0k s ILE 453 Cb -0.11 -1.55 -0.03 0.00 0.01 0.00 0.00 42.46 40.77 2j0k s ILE 453 CO 0.02 0.49 0.10 -0.75 0.00 0.00 0.00 174.94 174.80 2j0k s LYS 454 N 0.75 3.76 -0.07 2.79 2.20 -0.23 0.54 119.74 129.47 2j0k s LYS 454 Ca -0.11 -0.43 0.00 0.00 -0.36 0.00 0.00 55.97 55.08 2j0k s LYS 454 Cb -0.16 -3.40 -0.03 0.00 -1.51 0.00 0.00 37.83 32.73 2j0k s LYS 454 CO 0.02 -0.15 -0.05 0.95 -0.36 0.00 0.00 175.35 175.76 2j0k s THR 455 N 1.55 3.88 -0.29 3.43 -4.23 0.13 -1.67 115.64 118.44 2j0k s THR 455 Ca 0.06 -0.43 -0.08 0.00 -1.18 0.00 0.00 61.69 60.06 2j0k s THR 455 Cb -0.15 -2.61 -0.00 0.00 1.34 0.00 0.00 72.50 71.08 2j0k s THR 455 CO 0.05 0.59 0.10 0.00 -0.54 0.00 0.00 174.62 174.82 2j0k n LYS 457 N 4.92 0.00 -1.95 0.00 4.81 -1.21 -3.63 118.16 121.09 2j0k n LYS 457 Ca -0.15 0.22 -0.42 0.00 -0.87 0.00 0.00 58.31 57.10 2j0k n LYS 457 Cb 0.49 -1.21 -0.00 0.00 0.02 0.00 0.00 35.03 34.33 2j0k n LYS 457 CO 0.00 0.00 0.00 0.09 1.17 0.00 0.00 177.40 178.66 2j0k n ASN 458 N -1.15 5.26 0.00 3.14 3.02 -1.26 -4.73 115.26 119.55 2j0k n ASN 458 Ca 0.00 -2.95 0.09 0.00 -0.03 0.00 0.00 54.58 51.69 2j0k n ASN 458 Cb 0.00 -1.55 0.51 0.00 -0.61 0.00 0.00 39.78 38.13 2j0k n ASN 458 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2j0k h THR 460 N 0.00 1.66 -3.21 0.00 1.35 -1.92 -3.44 112.91 107.36 2j0k h THR 460 Ca 0.00 -3.25 -0.58 0.00 -0.55 0.00 0.00 66.41 62.04 2j0k h THR 460 Cb 0.00 2.80 -0.06 0.00 -1.73 0.00 0.00 68.15 69.15 2j0k h THR 460 CO 0.00 0.93 0.60 -0.44 -0.25 0.00 0.00 175.52 176.36 2j0k s SER 461 N -6.79 7.06 0.00 5.36 0.01 -1.24 -4.93 113.70 113.16 2j0k s SER 461 Ca -0.00 1.31 0.09 0.00 1.31 0.00 0.00 55.95 58.66 2j0k s SER 461 Cb 0.10 -2.51 0.44 0.00 0.21 0.00 0.00 66.02 64.26 2j0k s SER 461 CO 0.83 -0.53 1.14 -0.90 0.41 0.00 0.00 173.24 174.19 2j0k n ASP 462 N 5.71 0.00 -0.05 2.44 5.75 -1.26 -1.72 116.55 127.42 2j0k n ASP 462 Ca 0.08 0.14 -0.16 0.00 -0.01 0.00 0.00 54.79 54.85 2j0k n ASP 462 Cb 0.48 -0.27 -0.13 0.00 -1.03 0.00 0.00 41.12 40.16 2j0k n ASP 462 CO 0.00 0.00 0.00 0.28 -0.11 0.00 0.00 177.20 177.37 2j0k h SER 463 N 0.00 0.08 -0.68 -1.12 0.02 -1.95 -2.56 113.55 107.34 2j0k h SER 463 Ca 0.00 -0.94 0.03 0.00 -0.84 0.00 0.00 61.79 60.05 2j0k h SER 463 Cb 0.08 -0.03 -0.04 0.00 0.14 0.00 0.00 62.40 62.55 2j0k h SER 463 CO 0.00 1.12 0.45 0.58 -1.14 0.00 0.00 176.83 177.84 2j0k h VAL 464 N -0.89 1.09 -0.16 2.27 2.07 -1.64 -2.35 116.25 116.64 2j0k h VAL 464 Ca -0.06 -0.28 -0.10 0.00 0.82 0.00 0.00 66.70 67.08 2j0k h VAL 464 Cb 1.15 0.21 0.00 0.00 -1.52 0.00 0.00 31.29 31.13 2j0k h VAL 464 CO 0.00 0.15 -0.29 -0.09 0.02 0.00 0.00 177.57 177.36 2j0k h ARG 465 N 0.81 0.48 -0.19 1.57 2.43 -1.58 -3.00 114.38 114.91 2j0k h ARG 465 Ca 0.27 -0.30 -0.03 0.00 -0.81 0.00 0.00 59.98 59.11 2j0k h ARG 465 Cb 0.08 0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 29.65 2j0k h ARG 465 CO -0.08 0.91 -0.01 1.49 -1.51 0.00 0.00 179.97 180.77 2j0k h GLU 466 N 0.11 0.33 0.00 0.20 4.81 -1.09 -2.67 114.58 116.28 2j0k h GLU 466 Ca 0.01 -0.11 0.00 0.00 -0.13 0.00 0.00 59.36 59.13 2j0k h GLU 466 Cb 0.88 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 30.23 2j0k h GLU 466 CO 0.07 0.55 0.00 0.87 -0.73 0.00 0.00 179.01 179.76 2j0k h LYS 467 N 0.08 0.00 -0.28 1.92 1.57 -1.57 -1.94 116.57 116.36 2j0k h LYS 467 Ca 0.05 0.00 -0.18 0.00 -1.87 0.00 0.00 60.65 58.65 2j0k h LYS 467 Cb 0.40 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.71 2j0k h LYS 467 CO 0.01 0.00 -0.54 0.35 -0.57 0.00 0.00 179.45 178.70 2j0k h PHE 468 N 0.00 1.04 -0.33 -1.35 3.57 -1.33 -3.32 116.94 115.21 2j0k h PHE 468 Ca 0.00 -0.37 0.00 0.00 3.53 0.00 0.00 57.97 61.13 2j0k h PHE 468 Cb 0.62 -0.20 0.00 0.00 2.79 0.00 0.00 35.95 39.16 2j0k h PHE 468 CO 0.00 1.18 0.00 1.47 -2.23 0.00 0.00 178.31 178.73 2j0k n LEU 469 N -4.00 2.95 0.22 0.59 -0.00 -1.04 -3.19 117.00 112.53 2j0k n LEU 469 Ca -0.04 -1.70 0.09 0.00 -0.00 0.00 0.00 56.01 54.36 2j0k n LEU 469 Cb 0.62 -0.22 0.44 0.00 -0.00 0.00 0.00 43.42 44.27 2j0k n LEU 469 CO 0.50 0.69 0.78 1.56 -0.00 0.00 0.00 177.39 180.92 2j0k h GLN 470 N 2.80 0.00 -0.29 1.47 1.08 -1.46 0.33 115.11 119.04 2j0k h GLN 470 Ca 0.00 0.00 -0.05 0.00 -1.45 0.00 0.00 58.65 57.15 2j0k h GLN 470 Cb 0.76 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 28.18 2j0k h GLN 470 CO 0.00 0.25 -0.03 1.49 -0.95 0.00 0.00 178.83 179.59 2j0k h GLU 471 N 0.00 0.53 -0.34 1.46 4.81 -1.65 -2.81 114.58 116.58 2j0k h GLU 471 Ca -0.00 -0.18 -0.05 0.00 -0.13 0.00 0.00 59.36 58.99 2j0k h GLU 471 Cb 0.76 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 30.09 2j0k h GLU 471 CO 0.03 0.70 0.01 0.00 -0.73 0.00 0.00 179.01 179.02 2j0k h ALA 472 N 0.81 0.46 -0.78 2.92 0.00 -1.55 -3.01 119.26 118.10 2j0k h ALA 472 Ca 0.08 -0.24 0.09 0.00 0.00 0.00 0.00 54.91 54.84 2j0k h ALA 472 Cb 0.48 -0.13 -0.11 0.00 0.00 0.00 0.00 17.79 18.04 2j0k h ALA 472 CO 0.02 0.21 -0.53 -0.07 0.00 0.00 0.00 179.25 178.88 2j0k h LEU 473 N 0.40 -1.90 -0.47 0.00 -0.00 -0.36 -2.52 115.31 110.46 2j0k h LEU 473 Ca 0.10 0.29 0.00 0.00 -0.00 0.00 0.00 57.88 58.27 2j0k h LEU 473 Cb 0.44 0.84 0.00 0.00 -0.00 0.00 0.00 40.66 41.94 2j0k h LEU 473 CO 0.02 -0.30 0.00 0.71 -0.00 0.00 0.00 178.44 178.87 2j0k h THR 474 N -0.14 0.00 0.00 0.22 1.35 -1.37 -2.24 112.91 110.73 2j0k h THR 474 Ca 0.16 -0.44 0.00 0.00 -0.55 0.00 0.00 66.41 65.59 2j0k h THR 474 Cb 0.50 1.33 0.00 0.00 -1.73 0.00 0.00 68.15 68.26 2j0k h THR 474 CO -0.82 0.00 0.00 0.24 -0.25 0.00 0.00 175.52 174.69 2j0k h MET 475 N 0.00 0.00 0.00 4.72 2.86 -1.32 -3.12 114.93 118.07 2j0k h MET 475 Ca 0.00 0.00 -0.12 0.00 -2.06 0.00 0.00 59.70 57.52 2j0k h MET 475 Cb 0.59 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.23 2j0k h MET 475 CO 0.00 0.00 -0.57 -0.09 1.06 0.00 0.00 176.91 177.31 2j0k h ARG 476 N 0.00 0.00 0.00 1.72 1.12 -1.38 -2.46 114.38 113.37 2j0k h ARG 476 Ca 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 59.98 58.87 2j0k h ARG 476 Cb 0.83 0.00 0.00 0.00 -0.01 0.00 0.00 29.97 30.79 2j0k h ARG 476 CO 0.00 0.57 0.00 1.04 -3.11 0.00 0.00 179.97 178.47 2j0k n GLN 477 N -3.54 0.14 -4.47 0.20 1.13 -1.18 -4.76 117.38 104.91 2j0k n GLN 477 Ca -0.00 0.51 -0.34 0.00 -1.94 0.00 0.00 57.00 55.23 2j0k n GLN 477 Cb 0.65 -1.86 -0.12 0.00 0.11 0.00 0.00 30.24 29.02 2j0k n GLN 477 CO 0.00 0.00 0.00 -0.06 -1.44 0.00 0.00 177.06 175.56 2j0k s PHE 478 N -3.37 2.99 -0.29 1.08 2.99 -0.93 -5.06 117.98 115.40 2j0k s PHE 478 Ca 0.01 -0.30 -0.03 0.00 0.00 0.00 0.00 56.93 56.61 2j0k s PHE 478 Cb 0.07 -1.92 0.11 0.00 0.00 0.00 0.00 43.02 41.28 2j0k s PHE 478 CO 0.27 -0.01 0.17 0.34 -0.00 0.00 0.00 175.22 175.99 2j0k s ASP 479 N 0.23 3.05 -0.19 1.36 -1.08 -1.26 -4.78 116.67 114.00 2j0k s ASP 479 Ca -0.03 -1.14 -0.10 0.00 -0.52 0.00 0.00 52.55 50.76 2j0k s ASP 479 Cb -0.14 -0.13 0.07 0.00 -1.46 0.00 0.00 42.92 41.25 2j0k s ASP 479 CO 0.03 -0.43 0.44 -2.28 0.52 0.00 0.00 175.17 173.46 2j0k s HIS 480 N 2.17 -0.69 -0.66 -5.34 2.46 -1.26 -5.03 115.29 106.94 2j0k s HIS 480 Ca 0.09 1.42 0.05 0.00 0.47 0.00 0.00 55.06 57.09 2j0k s HIS 480 Cb -0.15 0.31 0.27 0.00 -0.13 0.00 0.00 32.58 32.88 2j0k s HIS 480 CO -0.35 -0.39 1.09 -0.35 -2.47 0.00 0.00 174.74 172.27 2j0k n PRO 481 N 4.46 0.03 -0.35 2.88 -0.04 -1.26 -1.35 135.00 139.37 2j0k n PRO 481 Ca -0.21 0.48 0.07 0.00 -0.04 0.00 0.00 63.50 63.81 2j0k n PRO 481 Cb 0.55 -1.69 0.18 0.00 -0.04 0.00 0.00 33.50 32.50 2j0k n PRO 481 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 2j0k n HIS 482 N -1.63 0.11 -4.16 0.54 8.25 -1.26 -4.86 115.22 112.21 2j0k n HIS 482 Ca -0.00 -1.23 -0.23 0.00 -0.26 0.00 0.00 57.72 56.00 2j0k n HIS 482 Cb 0.09 -0.22 -0.17 0.00 1.12 0.00 0.00 29.99 30.81 2j0k n HIS 482 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 2j0k s ILE 483 N -3.05 0.75 -0.17 1.59 1.01 -0.45 -1.19 121.20 119.69 2j0k s ILE 483 Ca 0.36 -0.20 -0.30 0.00 0.00 0.00 0.00 60.65 60.50 2j0k s ILE 483 Cb 0.33 -0.76 -0.07 0.00 0.01 0.00 0.00 42.46 41.96 2j0k s ILE 483 CO -0.01 0.29 2.14 0.55 0.00 0.00 0.00 174.94 177.91 2j0k n VAL 484 N 4.31 0.43 -2.61 2.92 3.14 -1.08 -4.64 118.33 120.80 2j0k n VAL 484 Ca -0.20 -0.34 -0.42 0.00 -2.96 0.00 0.00 64.34 60.43 2j0k n VAL 484 Cb 0.51 -2.34 -0.04 0.00 -1.06 0.00 0.00 33.84 30.92 2j0k n VAL 484 CO 0.00 0.00 0.00 -0.75 -6.46 0.00 0.00 176.83 169.62 2j0k s LYS 485 N 5.75 4.58 0.42 1.45 2.36 -1.26 -4.89 119.74 128.15 2j0k s LYS 485 Ca 0.99 1.57 -0.23 0.00 -2.55 0.00 0.00 55.97 55.74 2j0k s LYS 485 Cb -0.46 -3.37 -0.09 0.00 -1.05 0.00 0.00 37.83 32.86 2j0k s LYS 485 CO 0.40 0.01 1.06 -1.17 1.55 0.00 0.00 175.35 177.20 2j0k s LEU 486 N 0.44 4.06 -0.08 5.43 2.96 -1.26 -1.70 118.68 128.53 2j0k s LEU 486 Ca 0.51 2.05 -0.01 0.00 -0.22 0.00 0.00 54.13 56.47 2j0k s LEU 486 Cb -0.25 -4.27 -0.05 0.00 0.50 0.00 0.00 46.19 42.11 2j0k s LEU 486 CO 0.30 -0.61 -0.08 -0.38 -1.32 0.00 0.00 176.35 174.26 2j0k n ILE 487 N -0.31 0.48 -3.37 6.68 5.41 -0.02 -4.86 119.36 123.36 2j0k n ILE 487 Ca 0.06 -0.17 0.00 0.00 1.00 0.00 0.00 62.75 63.64 2j0k n ILE 487 Cb 0.50 -0.98 0.00 0.00 -0.71 0.00 0.00 39.64 38.45 2j0k n ILE 487 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 2j0k n GLY 488 N 2.96 -1.01 3.21 7.39 0.00 -0.51 -4.80 105.19 112.43 2j0k n GLY 488 Ca -0.15 -0.90 -0.13 0.00 0.00 0.00 0.00 46.02 44.84 2j0k n GLY 488 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2j0k s VAL 489 N -3.00 0.96 -0.19 1.61 -7.23 -0.31 -0.04 120.40 112.20 2j0k s VAL 489 Ca 0.00 -1.91 0.01 0.00 -1.81 0.00 0.00 61.98 58.27 2j0k s VAL 489 Cb 0.00 -1.67 0.04 0.00 0.56 0.00 0.00 36.38 35.31 2j0k s VAL 489 CO 0.00 -0.74 -0.10 -0.63 -0.31 0.00 0.00 175.10 173.32 2j0k s ILE 490 N -3.19 1.62 -1.07 -0.62 1.01 0.12 -0.18 121.20 118.89 2j0k s ILE 490 Ca 0.12 -0.96 0.23 0.00 0.00 0.00 0.00 60.65 60.04 2j0k s ILE 490 Cb 0.02 -1.68 -0.10 0.00 0.01 0.00 0.00 42.46 40.71 2j0k s ILE 490 CO -0.01 0.19 1.15 0.35 0.00 0.00 0.00 174.94 176.62 2j0k n THR 491 N 4.70 0.00 -2.19 2.92 -2.24 -1.26 -1.52 114.28 114.69 2j0k n THR 491 Ca -0.15 -0.02 -0.43 0.00 -2.27 0.00 0.00 64.05 61.19 2j0k n THR 491 Cb 0.47 0.67 -0.02 0.00 -2.10 0.00 0.00 70.33 69.34 2j0k n THR 491 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 2j0k s GLU 492 N -2.96 4.06 0.21 -0.78 0.41 -1.26 -4.72 118.70 113.67 2j0k s GLU 492 Ca 0.10 1.81 -0.32 0.00 -0.41 0.00 0.00 54.97 56.16 2j0k s GLU 492 Cb 0.17 -3.93 -0.14 0.00 -1.78 0.00 0.00 34.13 28.45 2j0k s GLU 492 CO 0.77 -0.96 1.43 0.09 -0.49 0.00 0.00 175.26 176.11 2j0k n ASN 493 N 7.40 2.69 -4.70 -0.19 3.02 -1.26 -3.81 115.26 118.42 2j0k n ASN 493 Ca 0.17 1.13 -0.40 0.00 -0.03 0.00 0.00 54.58 55.44 2j0k n ASN 493 Cb 0.44 -1.40 -0.05 0.00 -0.61 0.00 0.00 39.78 38.17 2j0k n ASN 493 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 2j0k s PRO 494 N -0.03 4.37 0.15 3.52 0.04 -1.26 -5.12 135.00 136.68 2j0k s PRO 494 Ca 0.72 0.92 -0.34 0.00 0.04 0.00 0.00 61.00 62.34 2j0k s PRO 494 Cb -0.69 -3.50 -0.16 0.00 0.04 0.00 0.00 34.50 30.20 2j0k s PRO 494 CO 0.47 -0.09 1.28 0.28 0.04 0.00 0.00 177.00 178.97 2j0k n VAL 495 N 4.18 0.52 -4.83 -0.36 0.31 -1.25 -4.85 118.33 112.05 2j0k n VAL 495 Ca 0.01 -0.13 -0.26 0.00 -0.01 0.00 0.00 64.34 63.95 2j0k n VAL 495 Cb 0.50 -0.96 -0.16 0.00 -0.91 0.00 0.00 33.84 32.31 2j0k n VAL 495 CO 0.00 0.00 0.00 0.26 -1.32 0.00 0.00 176.83 175.77 2j0k s TRP 496 N 0.14 1.71 -0.26 3.52 0.52 -0.58 -3.09 118.94 120.90 2j0k s TRP 496 Ca 0.77 -0.50 -0.06 0.00 0.02 0.00 0.00 56.10 56.33 2j0k s TRP 496 Cb -0.85 -1.16 -0.00 0.00 -1.15 0.00 0.00 33.47 30.31 2j0k s TRP 496 CO 0.49 -0.18 0.03 0.42 0.02 0.00 0.00 176.95 177.73 2j0k s ILE 497 N 0.08 3.77 -0.27 2.03 1.01 -0.67 -0.70 121.20 126.45 2j0k s ILE 497 Ca -0.05 -0.58 -0.13 0.00 0.00 0.00 0.00 60.65 59.89 2j0k s ILE 497 Cb -0.12 -2.85 -0.04 0.00 0.01 0.00 0.00 42.46 39.46 2j0k s ILE 497 CO 0.02 0.23 0.28 -0.63 0.00 0.00 0.00 174.94 174.84 2j0k s ILE 498 N 1.50 5.25 0.29 2.92 -1.09 0.94 -1.07 121.20 129.94 2j0k s ILE 498 Ca 0.04 0.38 0.02 0.00 -2.23 0.00 0.00 60.65 58.86 2j0k s ILE 498 Cb -0.16 -3.61 -0.05 0.00 -1.58 0.00 0.00 42.46 37.06 2j0k s ILE 498 CO 0.00 0.22 0.09 0.00 -1.23 0.00 0.00 174.94 174.03 2j0k s MET 499 N 1.81 1.54 0.57 2.79 0.23 -0.12 -0.84 119.30 125.29 2j0k s MET 499 Ca 0.11 -1.85 -0.19 0.00 -1.03 0.00 0.00 55.69 52.73 2j0k s MET 499 Cb -0.16 -0.44 -0.04 0.00 -1.53 0.00 0.00 34.83 32.66 2j0k s MET 499 CO 0.10 -0.29 1.17 -1.83 -2.03 0.00 0.00 175.02 172.13 2j0k s GLU 500 N -3.95 3.13 -0.25 3.16 -1.05 -0.69 0.03 118.70 119.08 2j0k s GLU 500 Ca 0.36 1.72 -0.10 0.00 -0.15 0.00 0.00 54.97 56.80 2j0k s GLU 500 Cb 0.07 -1.96 -0.04 0.00 -0.44 0.00 0.00 34.13 31.76 2j0k s GLU 500 CO 0.15 -1.05 0.14 -1.17 0.95 0.00 0.00 175.26 174.27 2j0k s LEU 501 N -3.98 3.90 -0.87 1.83 2.96 -1.26 -4.19 118.68 117.06 2j0k s LEU 501 Ca 0.75 -0.00 -0.20 0.00 -0.22 0.00 0.00 54.13 54.46 2j0k s LEU 501 Cb -0.27 -2.05 0.11 0.00 0.50 0.00 0.00 46.19 44.48 2j0k s LEU 501 CO 0.31 0.02 1.10 0.00 -1.32 0.00 0.00 176.35 176.45 2j0k h THR 503 N 5.91 0.90 -0.04 0.00 2.02 -1.76 -1.76 112.91 118.18 2j0k h THR 503 Ca 0.06 -0.22 0.00 0.00 0.77 0.00 0.00 66.41 67.02 2j0k h THR 503 Cb 1.03 0.21 0.00 0.00 -1.74 0.00 0.00 68.15 67.65 2j0k h THR 503 CO 1.14 0.12 0.00 0.18 0.37 0.00 0.00 175.52 177.32 2j0k n LEU 504 N -4.51 0.49 0.00 2.58 4.77 -0.43 -5.01 117.00 114.90 2j0k n LEU 504 Ca 0.14 -0.19 0.00 0.00 -0.03 0.00 0.00 56.01 55.92 2j0k n LEU 504 Cb 0.39 -0.02 0.00 0.00 -2.33 0.00 0.00 43.42 41.45 2j0k n LEU 504 CO 0.32 0.10 0.00 0.61 -1.33 0.00 0.00 177.39 177.09 2j0k n GLY 505 N 0.94 -1.78 3.75 -0.72 0.00 -0.66 -4.72 105.19 101.99 2j0k n GLY 505 Ca 0.17 -1.57 -0.39 0.00 0.00 0.00 0.00 46.02 44.22 2j0k n GLY 505 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2j0k s GLU 506 N 0.00 4.42 0.25 1.61 -1.05 -1.26 -0.12 118.70 122.55 2j0k s GLU 506 Ca 0.00 0.92 -0.08 0.00 -0.15 0.00 0.00 54.97 55.66 2j0k s GLU 506 Cb 0.00 -3.36 0.42 0.00 -0.44 0.00 0.00 34.13 30.75 2j0k s GLU 506 CO 0.00 0.29 1.62 1.25 0.95 0.00 0.00 175.26 179.37 2j0k h LEU 507 N 5.78 -0.50 -0.27 1.83 5.85 -1.58 -1.26 115.31 125.15 2j0k h LEU 507 Ca -0.44 0.22 0.03 0.00 0.84 0.00 0.00 57.88 58.52 2j0k h LEU 507 Cb 1.20 0.41 -0.04 0.00 0.37 0.00 0.00 40.66 42.60 2j0k h LEU 507 CO 0.71 -0.23 -0.24 0.03 -0.34 0.00 0.00 178.44 178.37 2j0k h ARG 508 N 0.05 -0.10 -0.24 1.25 3.08 -1.86 0.42 114.38 117.00 2j0k h ARG 508 Ca 0.41 0.01 0.05 0.00 0.07 0.00 0.00 59.98 60.52 2j0k h ARG 508 Cb 0.71 0.02 -0.08 0.00 0.08 0.00 0.00 29.97 30.71 2j0k h ARG 508 CO -0.74 -0.06 -0.42 1.03 -1.07 0.00 0.00 179.97 178.71 2j0k h SER 509 N -0.10 -1.34 -0.63 7.04 0.87 -1.63 -0.48 113.55 117.28 2j0k h SER 509 Ca 0.05 0.19 0.12 0.00 -1.23 0.00 0.00 61.79 60.92 2j0k h SER 509 Cb 0.22 0.56 -0.12 0.00 -0.44 0.00 0.00 62.40 62.62 2j0k h SER 509 CO -0.31 -0.40 -0.24 0.15 -0.53 0.00 0.00 176.83 175.50 2j0k h PHE 510 N -0.42 -0.60 -0.62 2.24 3.57 -0.56 0.26 116.94 120.81 2j0k h PHE 510 Ca 0.10 0.07 -0.02 0.00 3.53 0.00 0.00 57.97 61.65 2j0k h PHE 510 Cb 0.61 0.36 -0.03 0.00 2.79 0.00 0.00 35.95 39.68 2j0k h PHE 510 CO -0.53 -0.33 0.32 -0.07 -2.23 0.00 0.00 178.31 175.46 2j0k h LEU 511 N -0.08 0.80 -0.89 0.59 3.38 0.81 -1.46 115.31 118.46 2j0k h LEU 511 Ca 0.28 -0.11 -0.10 0.00 0.09 0.00 0.00 57.88 58.04 2j0k h LEU 511 Cb 0.52 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.06 2j0k h LEU 511 CO -0.69 0.68 -0.27 1.56 0.09 0.00 0.00 178.44 179.82 2j0k h GLN 512 N 0.85 0.50 -0.12 1.13 4.20 0.48 -1.26 115.11 120.90 2j0k h GLN 512 Ca 0.22 -0.20 -0.16 0.00 0.06 0.00 0.00 58.65 58.56 2j0k h GLN 512 Cb 0.08 -0.03 -0.01 0.00 0.30 0.00 0.00 27.48 27.83 2j0k h GLN 512 CO -0.03 0.73 -0.62 0.28 -0.67 0.00 0.00 178.83 178.52 2j0k h VAL 513 N 0.44 1.35 -0.58 -0.54 2.07 -0.78 -3.19 116.25 115.03 2j0k h VAL 513 Ca 0.06 -1.94 0.00 0.00 0.82 0.00 0.00 66.70 65.64 2j0k h VAL 513 Cb 0.70 1.93 0.00 0.00 -1.52 0.00 0.00 31.29 32.40 2j0k h VAL 513 CO 0.05 0.59 0.00 0.54 0.02 0.00 0.00 177.57 178.77 2j0k n ARG 514 N -3.90 4.75 -0.50 1.57 1.74 -0.57 -4.66 116.66 115.08 2j0k n ARG 514 Ca -0.03 -3.14 0.42 0.00 -0.77 0.00 0.00 57.85 54.33 2j0k n ARG 514 Cb 0.64 -2.22 0.74 0.00 -1.02 0.00 0.00 32.46 30.59 2j0k n ARG 514 CO 0.00 0.00 0.00 -0.22 -1.52 0.00 0.00 177.63 175.89 2j0k h LYS 515 N 3.97 0.05 0.00 5.56 3.64 -1.22 0.34 116.57 128.91 2j0k h LYS 515 Ca 0.00 -0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.37 2j0k h LYS 515 Cb 1.92 -0.01 -0.01 0.00 -0.41 0.00 0.00 32.23 33.72 2j0k h LYS 515 CO 0.46 0.03 -0.18 1.19 -2.27 0.00 0.00 179.45 178.68 2j0k n PHE 516 N -4.25 0.00 -0.16 1.91 3.72 -1.26 -4.55 117.46 112.87 2j0k n PHE 516 Ca 0.36 -0.78 0.00 0.00 -0.05 0.00 0.00 57.45 56.98 2j0k n PHE 516 Cb 1.57 -0.13 0.00 0.00 -0.94 0.00 0.00 39.48 39.98 2j0k n PHE 516 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14 2j0k n SER 517 N -1.02 0.90 -4.27 4.37 7.64 0.11 -5.05 113.62 116.29 2j0k n SER 517 Ca 0.12 -1.06 -0.32 0.00 1.01 0.00 0.00 58.87 58.62 2j0k n SER 517 Cb 0.67 0.00 -0.16 0.00 -1.01 0.00 0.00 64.21 63.71 2j0k n SER 517 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 2j0k s LEU 518 N -0.06 2.12 0.58 -3.43 1.43 -0.68 -5.07 118.68 113.58 2j0k s LEU 518 Ca 0.00 -0.50 0.00 0.00 -1.03 0.00 0.00 54.13 52.60 2j0k s LEU 518 Cb 0.00 -1.39 0.04 0.00 0.03 0.00 0.00 46.19 44.87 2j0k s LEU 518 CO 0.00 0.24 0.82 1.51 0.23 0.00 0.00 176.35 179.15 2j0k s ASP 519 N -0.11 5.15 -0.01 2.29 -4.77 -1.26 -5.00 116.67 112.96 2j0k s ASP 519 Ca -0.05 0.03 -0.24 0.00 -3.30 0.00 0.00 52.55 48.98 2j0k s ASP 519 Cb -0.14 -0.85 -0.18 0.00 -1.09 0.00 0.00 42.92 40.66 2j0k s ASP 519 CO 0.04 -1.25 1.19 0.25 0.70 0.00 0.00 175.17 176.10 2j0k h LEU 520 N -0.06 -0.17 -0.76 2.11 5.85 -1.99 -2.83 115.31 117.46 2j0k h LEU 520 Ca -0.42 -0.32 0.07 0.00 0.84 0.00 0.00 57.88 58.05 2j0k h LEU 520 Cb 1.30 0.04 -0.10 0.00 0.37 0.00 0.00 40.66 42.27 2j0k h LEU 520 CO 0.53 0.26 -0.56 0.00 -0.34 0.00 0.00 178.44 178.33 2j0k h ALA 521 N 0.08 -0.62 -0.67 1.25 0.00 -1.97 0.63 119.26 117.97 2j0k h ALA 521 Ca -0.02 0.07 -0.03 0.00 0.00 0.00 0.00 54.91 54.94 2j0k h ALA 521 Cb 0.48 1.28 -0.03 0.00 0.00 0.00 0.00 17.79 19.52 2j0k h ALA 521 CO 0.03 -0.97 0.31 0.66 0.00 0.00 0.00 179.25 179.28 2j0k h SER 522 N -0.14 0.86 0.17 0.00 4.64 -1.99 0.16 113.55 117.25 2j0k h SER 522 Ca 0.12 -0.10 0.01 0.00 -0.47 0.00 0.00 61.79 61.36 2j0k h SER 522 Cb 0.46 -0.22 -0.04 0.00 -0.31 0.00 0.00 62.40 62.29 2j0k h SER 522 CO -0.79 0.74 -0.47 -0.07 -0.87 0.00 0.00 176.83 175.37 2j0k h LEU 523 N 0.95 -1.40 -1.67 5.97 3.38 -0.75 -1.76 115.31 120.03 2j0k h LEU 523 Ca 0.23 0.14 -0.02 0.00 0.09 0.00 0.00 57.88 58.32 2j0k h LEU 523 Cb 0.11 0.51 -0.01 0.00 0.09 0.00 0.00 40.66 41.36 2j0k h LEU 523 CO -0.03 -0.52 -0.02 0.16 0.09 0.00 0.00 178.44 178.12 2j0k h ILE 524 N -0.71 1.10 -0.57 1.22 3.07 -0.60 -0.61 117.51 120.40 2j0k h ILE 524 Ca -0.01 -0.39 0.11 0.00 1.55 0.00 0.00 64.86 66.12 2j0k h ILE 524 Cb 0.70 1.03 -0.11 0.00 -0.27 0.00 0.00 36.82 38.17 2j0k h ILE 524 CO -0.22 0.13 -0.16 0.25 -1.05 0.00 0.00 178.15 177.10 2j0k h LEU 525 N 0.18 -0.57 -0.73 0.16 5.85 -0.15 0.32 115.31 120.37 2j0k h LEU 525 Ca 0.04 0.18 0.05 0.00 0.84 0.00 0.00 57.88 58.99 2j0k h LEU 525 Cb 0.16 0.37 -0.05 0.00 0.37 0.00 0.00 40.66 41.51 2j0k h LEU 525 CO 0.00 -0.20 0.43 1.88 -0.34 0.00 0.00 178.44 180.22 2j0k h TYR 526 N -0.01 0.80 -0.36 1.25 0.05 -0.25 0.43 116.97 118.88 2j0k h TYR 526 Ca 0.27 0.02 0.00 0.00 0.05 0.00 0.00 58.73 59.08 2j0k h TYR 526 Cb 0.43 -0.26 -0.02 0.00 1.01 0.00 0.00 36.73 37.90 2j0k h TYR 526 CO -0.48 0.42 0.23 0.00 -1.05 0.00 0.00 178.16 177.27 2j0k h ALA 527 N 1.35 0.46 -0.40 3.88 0.00 -1.12 -0.25 119.26 123.18 2j0k h ALA 527 Ca 0.31 -0.04 0.08 0.00 0.00 0.00 0.00 54.91 55.27 2j0k h ALA 527 Cb 0.13 -0.15 -0.08 0.00 0.00 0.00 0.00 17.79 17.69 2j0k h ALA 527 CO -0.15 -0.06 -0.16 -0.92 0.00 0.00 0.00 179.25 177.95 2j0k h TYR 528 N 0.48 -0.38 -0.61 0.00 3.20 0.12 0.46 116.97 120.25 2j0k h TYR 528 Ca 0.13 0.04 -0.05 0.00 3.14 0.00 0.00 58.73 62.00 2j0k h TYR 528 Cb -0.03 0.23 -0.03 0.00 1.54 0.00 0.00 36.73 38.44 2j0k h TYR 528 CO -0.05 -0.24 0.20 1.96 -1.64 0.00 0.00 178.16 178.40 2j0k h GLN 529 N -0.08 0.95 -0.72 1.82 4.20 -0.61 -0.99 115.11 119.68 2j0k h GLN 529 Ca 0.20 -0.20 0.08 0.00 0.06 0.00 0.00 58.65 58.79 2j0k h GLN 529 Cb 0.38 -0.14 -0.05 0.00 0.30 0.00 0.00 27.48 27.97 2j0k h GLN 529 CO -0.45 0.83 0.47 1.25 -0.67 0.00 0.00 178.83 180.26 2j0k h LEU 530 N 0.87 0.59 -0.26 1.46 7.12 -0.37 -1.92 115.31 122.79 2j0k h LEU 530 Ca 0.20 0.01 -0.21 0.00 0.13 0.00 0.00 57.88 58.01 2j0k h LEU 530 Cb 0.28 -0.11 0.00 0.00 -0.53 0.00 0.00 40.66 40.30 2j0k h LEU 530 CO -0.01 0.36 -0.78 0.77 -0.13 0.00 0.00 178.44 178.66 2j0k h SER 531 N 0.66 0.73 -0.42 1.25 4.64 0.27 -2.53 113.55 118.15 2j0k h SER 531 Ca 0.32 -0.49 0.02 0.00 -0.47 0.00 0.00 61.79 61.17 2j0k h SER 531 Cb 0.40 -0.22 -0.03 0.00 -0.31 0.00 0.00 62.40 62.25 2j0k h SER 531 CO -0.11 1.26 0.25 0.71 -0.87 0.00 0.00 176.83 178.07 2j0k h THR 532 N 0.41 1.05 0.18 2.95 1.35 -0.47 -0.06 112.91 118.32 2j0k h THR 532 Ca -0.05 -0.17 0.00 0.00 -0.55 0.00 0.00 66.41 65.64 2j0k h THR 532 Cb 1.38 0.50 -0.01 0.00 -1.73 0.00 0.00 68.15 68.30 2j0k h THR 532 CO 0.15 0.09 -0.16 0.00 -0.25 0.00 0.00 175.52 175.35 2j0k h ALA 533 N 1.18 -0.33 -0.28 6.62 0.00 -1.46 -1.24 119.26 123.75 2j0k h ALA 533 Ca 0.16 -0.05 0.04 0.00 0.00 0.00 0.00 54.91 55.07 2j0k h ALA 533 Cb 0.00 0.22 -0.04 0.00 0.00 0.00 0.00 17.79 17.97 2j0k h ALA 533 CO -0.07 -0.70 0.04 -0.07 0.00 0.00 0.00 179.25 178.44 2j0k h LEU 534 N -0.35 -0.03 -0.84 0.00 3.38 -1.28 -0.70 115.31 115.49 2j0k h LEU 534 Ca -0.00 0.05 0.19 0.00 0.09 0.00 0.00 57.88 58.21 2j0k h LEU 534 Cb 0.32 0.08 -0.15 0.00 0.09 0.00 0.00 40.66 41.00 2j0k h LEU 534 CO -0.03 0.02 -0.05 0.00 0.09 0.00 0.00 178.44 178.48 2j0k h ALA 535 N 1.22 0.82 -0.12 1.53 0.00 -0.73 0.00 119.26 121.98 2j0k h ALA 535 Ca 0.13 0.29 -0.12 0.00 0.00 0.00 0.00 54.91 55.21 2j0k h ALA 535 Cb 0.15 0.52 -0.01 0.00 0.00 0.00 0.00 17.79 18.45 2j0k h ALA 535 CO -0.19 -0.45 -0.45 -0.92 0.00 0.00 0.00 179.25 177.24 2j0k h TYR 536 N 0.06 0.34 0.00 0.00 5.03 0.06 -2.44 116.97 120.01 2j0k h TYR 536 Ca 0.46 -0.10 -0.16 0.00 2.58 0.00 0.00 58.73 61.51 2j0k h TYR 536 Cb 0.82 -0.07 -0.02 0.00 1.55 0.00 0.00 36.73 39.00 2j0k h TYR 536 CO -0.50 0.69 -0.75 -0.07 -1.32 0.00 0.00 178.16 176.20 2j0k h LEU 537 N 0.23 0.00 0.11 2.82 3.38 -0.19 -2.77 115.31 118.90 2j0k h LEU 537 Ca 0.02 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.98 2j0k h LEU 537 Cb 0.89 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.64 2j0k h LEU 537 CO 0.07 0.75 -0.05 -0.08 0.09 0.00 0.00 178.44 179.22 2j0k h GLU 538 N 0.00 -0.14 0.00 1.13 4.81 -0.76 0.19 114.58 119.82 2j0k h GLU 538 Ca -0.01 0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 2j0k h GLU 538 Cb 1.46 0.03 0.00 0.00 0.63 0.00 0.00 28.75 30.87 2j0k h GLU 538 CO 0.10 -0.07 0.00 -1.13 -0.73 0.00 0.00 179.01 177.18 2j0k n SER 539 N -5.14 0.62 -1.16 1.04 3.41 -0.94 -0.50 113.62 110.94 2j0k n SER 539 Ca -0.08 0.75 0.09 0.00 -0.26 0.00 0.00 58.87 59.36 2j0k n SER 539 Cb 0.09 -0.84 0.28 0.00 -0.26 0.00 0.00 64.21 63.48 2j0k n SER 539 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2j0k n LYS 540 N -2.28 3.21 -3.72 4.33 5.02 -0.94 -4.99 118.16 118.79 2j0k n LYS 540 Ca -0.01 -2.60 -0.26 0.00 -2.02 0.00 0.00 58.31 53.42 2j0k n LYS 540 Cb 0.09 -1.65 0.03 0.00 -0.02 0.00 0.00 35.03 33.48 2j0k n LYS 540 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 2j0k n ARG 541 N 0.77 -2.85 -5.01 1.97 1.74 0.35 -4.99 116.66 108.64 2j0k n ARG 541 Ca 0.21 0.52 -0.28 0.00 -0.77 0.00 0.00 57.85 57.53 2j0k n ARG 541 Cb 0.71 -4.64 -0.16 0.00 -1.02 0.00 0.00 32.46 27.35 2j0k n ARG 541 CO 0.00 0.00 0.00 0.12 -1.52 0.00 0.00 177.63 176.23 2j0k s PHE 542 N -3.64 1.98 -0.21 -1.55 2.19 0.59 -5.02 117.98 112.33 2j0k s PHE 542 Ca 0.23 -0.55 -0.04 0.00 0.33 0.00 0.00 56.93 56.90 2j0k s PHE 542 Cb -0.07 -1.31 -0.02 0.00 -1.31 0.00 0.00 43.02 40.31 2j0k s PHE 542 CO 0.84 -0.16 -0.02 0.08 1.83 0.00 0.00 175.22 177.79 2j0k s VAL 543 N -0.12 3.61 -0.01 3.12 1.01 -1.26 -4.35 120.40 122.41 2j0k s VAL 543 Ca -0.02 -0.42 -0.19 0.00 0.00 0.00 0.00 61.98 61.35 2j0k s VAL 543 Cb -0.12 -2.64 -0.30 0.00 0.00 0.00 0.00 36.38 33.32 2j0k s VAL 543 CO 0.02 0.42 0.99 -0.74 0.00 0.00 0.00 175.10 175.79 2j0k h HIS 544 N 7.87 0.72 0.00 5.22 2.76 -1.97 -3.48 115.15 126.27 2j0k h HIS 544 Ca -0.39 -0.49 0.00 0.00 -2.20 0.00 0.00 60.37 57.30 2j0k h HIS 544 Cb 1.17 -0.04 0.00 0.00 1.55 0.00 0.00 27.41 30.09 2j0k h HIS 544 CO 0.59 1.36 0.00 0.54 -1.30 0.00 0.00 177.93 179.12 2j0k n ARG 545 N -4.01 0.00 -3.05 5.26 1.74 -1.26 -4.80 116.66 110.53 2j0k n ARG 545 Ca -0.14 0.00 -0.16 0.00 -0.77 0.00 0.00 57.85 56.79 2j0k n ARG 545 Cb 0.87 -2.09 0.00 0.00 -1.02 0.00 0.00 32.46 30.22 2j0k n ARG 545 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 2j0k n ASP 546 N 0.00 -0.16 -4.59 0.55 4.64 -1.26 -5.05 116.55 110.68 2j0k n ASP 546 Ca 0.00 -3.19 -0.42 0.00 -1.38 0.00 0.00 54.79 49.80 2j0k n ASP 546 Cb 0.00 0.13 -0.05 0.00 -1.04 0.00 0.00 41.12 40.16 2j0k n ASP 546 CO 0.00 0.00 0.00 -0.63 -0.82 0.00 0.00 177.20 175.75 2j0k s ILE 547 N -1.55 4.69 -0.02 5.18 1.01 -1.26 -4.81 121.20 124.44 2j0k s ILE 547 Ca 0.35 1.01 -0.28 0.00 0.00 0.00 0.00 60.65 61.73 2j0k s ILE 547 Cb 0.32 -4.24 0.10 0.00 0.01 0.00 0.00 42.46 38.64 2j0k s ILE 547 CO -0.08 -0.45 0.82 0.00 0.00 0.00 0.00 174.94 175.24 2j0k s ALA 548 N 3.20 -1.80 0.31 9.38 0.00 -1.26 -4.55 121.76 127.04 2j0k s ALA 548 Ca 0.34 1.11 0.07 0.00 0.00 0.00 0.00 51.96 53.47 2j0k s ALA 548 Cb -0.13 0.16 0.79 0.00 0.00 0.00 0.00 23.12 23.94 2j0k s ALA 548 CO 0.17 -0.55 1.75 0.00 0.00 0.00 0.00 175.76 177.13 2j0k h ALA 549 N 2.32 1.68 -0.30 0.00 0.00 -1.93 0.39 119.26 121.42 2j0k h ALA 549 Ca -0.24 0.10 0.09 0.00 0.00 0.00 0.00 54.91 54.86 2j0k h ALA 549 Cb 1.22 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.97 2j0k h ALA 549 CO 0.34 -0.16 0.37 0.07 0.00 0.00 0.00 179.25 179.87 2j0k h ARG 550 N 0.66 0.00 -0.35 0.00 0.11 -1.96 -0.87 114.38 111.97 2j0k h ARG 550 Ca 0.60 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.68 2j0k h ARG 550 Cb 1.03 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.11 2j0k h ARG 550 CO -0.43 0.00 0.00 0.09 0.10 0.00 0.00 179.97 179.73 2j0k n ASN 551 N -3.63 3.23 -4.89 0.08 3.02 0.14 -4.87 115.26 108.33 2j0k n ASN 551 Ca 0.05 -1.93 -0.33 0.00 -0.03 0.00 0.00 54.58 52.34 2j0k n ASN 551 Cb 0.52 -0.22 -0.05 0.00 -0.61 0.00 0.00 39.78 39.41 2j0k n ASN 551 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2j0k s VAL 552 N -1.33 5.24 0.12 2.41 1.01 -0.33 -1.82 120.40 125.70 2j0k s VAL 552 Ca 0.34 0.08 0.08 0.00 0.00 0.00 0.00 61.98 62.47 2j0k s VAL 552 Cb 0.20 -3.60 -0.04 0.00 0.00 0.00 0.00 36.38 32.94 2j0k s VAL 552 CO 0.27 0.21 -0.19 -0.76 0.00 0.00 0.00 175.10 174.64 2j0k s LEU 553 N -2.19 2.35 -0.31 3.92 1.43 0.59 -2.28 118.68 122.20 2j0k s LEU 553 Ca 0.34 -0.75 -0.07 0.00 -1.03 0.00 0.00 54.13 52.62 2j0k s LEU 553 Cb -0.13 -0.81 0.02 0.00 0.03 0.00 0.00 46.19 45.30 2j0k s LEU 553 CO 0.21 -0.00 0.08 -0.69 0.23 0.00 0.00 176.35 176.18 2j0k s VAL 554 N -1.55 3.88 -0.02 -1.59 1.01 0.83 0.06 120.40 123.02 2j0k s VAL 554 Ca 0.09 -0.84 -0.14 0.00 0.00 0.00 0.00 61.98 61.09 2j0k s VAL 554 Cb -0.08 -3.06 -0.33 0.00 0.00 0.00 0.00 36.38 32.91 2j0k s VAL 554 CO 0.05 -0.00 0.81 0.77 0.00 0.00 0.00 175.10 176.73 2j0k h SER 555 N 8.23 0.70 -5.35 3.32 4.64 -1.60 -1.12 113.55 122.37 2j0k h SER 555 Ca -0.29 -0.93 -0.12 0.00 -0.47 0.00 0.00 61.79 59.98 2j0k h SER 555 Cb 1.11 -0.23 -0.12 0.00 -0.31 0.00 0.00 62.40 62.85 2j0k h SER 555 CO 0.60 1.74 -0.32 0.00 -0.87 0.00 0.00 176.83 177.98 2j0k s ALA 556 N -2.58 0.25 0.47 5.18 0.00 -0.93 -4.36 121.76 119.80 2j0k s ALA 556 Ca -0.13 -1.13 0.35 0.00 0.00 0.00 0.00 51.96 51.05 2j0k s ALA 556 Cb 0.05 1.11 1.84 0.00 0.00 0.00 0.00 23.12 26.11 2j0k s ALA 556 CO 0.89 -0.72 2.19 1.79 0.00 0.00 0.00 175.76 179.91 2j0k h THR 557 N 2.44 0.26 -0.36 0.00 1.35 -2.03 -2.19 112.91 112.38 2j0k h THR 557 Ca -0.30 -0.27 0.00 0.00 -0.55 0.00 0.00 66.41 65.29 2j0k h THR 557 Cb 1.24 1.21 0.00 0.00 -1.73 0.00 0.00 68.15 68.87 2j0k h THR 557 CO 0.44 0.04 0.00 -0.90 -0.25 0.00 0.00 175.52 174.85 2j0k n ASP 558 N -3.37 4.24 -3.38 5.36 3.85 -1.26 -4.96 116.55 117.03 2j0k n ASP 558 Ca -0.02 -2.87 0.01 0.00 -0.71 0.00 0.00 54.79 51.20 2j0k n ASP 558 Cb 0.17 -0.55 -0.03 0.00 -1.35 0.00 0.00 41.12 39.36 2j0k n ASP 558 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 2j0k s VAL 560 N 2.85 4.00 -0.02 0.00 -7.23 -1.26 -1.66 120.40 117.07 2j0k s VAL 560 Ca 0.09 -1.27 0.01 0.00 -1.81 0.00 0.00 61.98 59.00 2j0k s VAL 560 Cb -0.14 -3.01 0.01 0.00 0.56 0.00 0.00 36.38 33.80 2j0k s VAL 560 CO -0.20 -0.09 -0.04 -0.54 -0.31 0.00 0.00 175.10 173.93 2j0k s LYS 561 N -2.93 0.52 0.76 4.82 1.02 0.11 -4.54 119.74 119.50 2j0k s LYS 561 Ca 0.28 -0.12 -0.11 0.00 0.02 0.00 0.00 55.97 56.05 2j0k s LYS 561 Cb -0.10 -0.55 0.05 0.00 -0.52 0.00 0.00 37.83 36.71 2j0k s LYS 561 CO 0.20 0.02 1.08 -1.17 -0.92 0.00 0.00 175.35 174.56 2j0k s LEU 562 N 0.37 2.94 0.00 3.17 0.20 -0.33 -0.30 118.68 124.73 2j0k s LEU 562 Ca -0.04 1.66 0.00 0.00 0.69 0.00 0.00 54.13 56.44 2j0k s LEU 562 Cb -0.08 -4.38 0.00 0.00 -0.43 0.00 0.00 46.19 41.30 2j0k s LEU 562 CO -0.00 -1.87 0.00 0.61 -0.29 0.00 0.00 176.35 174.79 2j0k n GLY 563 N -1.59 0.00 0.03 7.98 0.00 -0.76 -2.65 105.19 108.22 2j0k n GLY 563 Ca 0.08 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.10 2j0k n GLY 563 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 2j0k h ASP 564 N 0.00 0.00 0.00 1.61 1.82 -1.94 -3.46 116.42 114.46 2j0k h ASP 564 Ca 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.64 2j0k h ASP 564 Cb 0.00 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.01 2j0k h ASP 564 CO 0.00 0.34 0.00 0.49 -1.61 0.00 0.00 179.24 178.46 2j0k n PHE 565 N -3.85 0.00 -1.70 0.28 0.99 -1.26 -4.90 117.46 107.02 2j0k n PHE 565 Ca -0.00 0.00 -0.39 0.00 -0.00 0.00 0.00 57.45 57.06 2j0k n PHE 565 Cb 0.00 -1.14 0.03 0.00 -1.00 0.00 0.00 39.48 37.38 2j0k n PHE 565 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 2j0k n GLY 566 N 0.00 0.46 0.51 1.37 0.00 -1.26 -4.65 105.19 101.62 2j0k n GLY 566 Ca 0.00 0.06 0.05 0.00 0.00 0.00 0.00 46.02 46.13 2j0k n GLY 566 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2j0k n LEU 567 N -0.47 2.64 -4.53 0.99 -0.00 -1.26 -4.86 117.00 109.51 2j0k n LEU 567 Ca 0.10 -1.87 -0.29 0.00 -0.00 0.00 0.00 56.01 53.94 2j0k n LEU 567 Cb 0.43 -0.17 -0.10 0.00 -0.00 0.00 0.00 43.42 43.58 2j0k n LEU 567 CO 0.55 0.65 1.89 -1.54 -0.00 0.00 0.00 177.39 178.94 2j0k n SER 568 N 0.37 1.05 -3.09 1.96 3.41 -1.26 -5.06 113.62 110.99 2j0k n SER 568 Ca 0.09 -0.59 0.04 0.00 -0.26 0.00 0.00 58.87 58.16 2j0k n SER 568 Cb 0.38 -1.26 0.00 0.00 -0.26 0.00 0.00 64.21 63.06 2j0k n SER 568 CO 0.00 0.00 0.00 -0.60 -0.16 0.00 0.00 175.04 174.28 2j0k s ARG 569 N 8.40 0.24 -0.24 4.33 3.52 -1.26 -5.19 118.95 128.75 2j0k s ARG 569 Ca 1.12 0.15 -0.18 0.00 -0.13 0.00 0.00 55.73 56.69 2j0k s ARG 569 Cb -0.54 0.09 0.07 0.00 -1.56 0.00 0.00 34.95 33.00 2j0k s ARG 569 CO 0.33 -0.42 0.61 -0.51 -0.81 0.00 0.00 175.30 174.49 2j0k s LEU 584 N 2.74 -0.49 -1.29 -0.88 1.43 -1.26 -5.06 118.68 113.87 2j0k s LEU 584 Ca 0.23 1.27 -0.09 0.00 -1.03 0.00 0.00 54.13 54.51 2j0k s LEU 584 Cb -0.02 2.09 -0.12 0.00 0.03 0.00 0.00 46.19 48.16 2j0k s LEU 584 CO -0.21 -0.22 3.10 -0.81 0.23 0.00 0.00 176.35 178.43 2j0k n PRO 585 N 3.40 3.37 -0.32 1.29 -0.04 -1.26 -4.78 135.00 136.65 2j0k n PRO 585 Ca -0.17 -1.97 0.12 0.00 -0.04 0.00 0.00 63.50 61.44 2j0k n PRO 585 Cb 0.57 -2.63 0.25 0.00 -0.04 0.00 0.00 33.50 31.64 2j0k n PRO 585 CO 0.00 0.00 0.00 0.82 -0.04 0.00 0.00 175.50 176.28 2j0k h ILE 586 N 2.79 0.13 0.00 0.52 1.08 -1.97 0.78 117.51 120.83 2j0k h ILE 586 Ca 0.74 -0.02 0.00 0.00 -0.39 0.00 0.00 64.86 65.19 2j0k h ILE 586 Cb 0.54 0.07 0.00 0.00 -3.07 0.00 0.00 36.82 34.36 2j0k h ILE 586 CO 1.47 0.01 0.00 0.29 -0.69 0.00 0.00 178.15 179.22 2j0k n LYS 587 N -5.44 0.09 0.00 2.37 5.02 -1.26 -0.62 118.16 118.32 2j0k n LYS 587 Ca 0.20 0.23 0.04 0.00 -2.02 0.00 0.00 58.31 56.76 2j0k n LYS 587 Cb 0.66 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 34.18 2j0k n LYS 587 CO 0.00 0.00 0.00 0.91 -0.52 0.00 0.00 177.40 177.79 2j0k n TRP 588 N -1.38 0.00 -3.13 2.13 8.01 0.25 -4.89 117.44 118.43 2j0k n TRP 588 Ca 0.04 0.00 -0.39 0.00 -1.31 0.00 0.00 57.50 55.84 2j0k n TRP 588 Cb 0.11 0.00 -0.06 0.00 -2.01 0.00 0.00 31.31 29.35 2j0k n TRP 588 CO 0.00 0.00 0.00 -1.64 -1.01 0.00 0.00 177.69 175.04 2j0k s MET 589 N -1.15 4.39 0.58 -0.99 -1.94 0.21 -4.10 119.30 116.29 2j0k s MET 589 Ca 0.07 0.95 -0.20 0.00 -1.71 0.00 0.00 55.69 54.80 2j0k s MET 589 Cb 0.07 -3.26 -0.04 0.00 2.01 0.00 0.00 34.83 33.61 2j0k s MET 589 CO 0.20 0.59 1.24 0.00 -0.01 0.00 0.00 175.02 177.04 2j0k s ALA 590 N -1.06 2.61 0.14 3.03 0.00 -1.26 -4.83 121.76 120.39 2j0k s ALA 590 Ca 0.32 1.09 -0.22 0.00 0.00 0.00 0.00 51.96 53.15 2j0k s ALA 590 Cb -0.21 -3.48 0.02 0.00 0.00 0.00 0.00 23.12 19.44 2j0k s ALA 590 CO 0.22 -1.21 1.65 -1.35 0.00 0.00 0.00 175.76 175.07 2j0k h PRO 591 N 1.04 -0.20 -0.50 0.00 0.11 -1.96 -0.28 132.00 130.22 2j0k h PRO 591 Ca -0.51 0.01 0.14 0.00 0.11 0.00 0.00 66.00 65.76 2j0k h PRO 591 Cb 1.30 0.05 -0.02 0.00 0.11 0.00 0.00 31.00 32.43 2j0k h PRO 591 CO 0.56 -0.13 0.38 1.05 -0.21 0.00 0.00 178.00 179.64 2j0k h GLU 592 N -0.21 0.00 -0.08 1.05 9.09 -1.91 0.63 114.58 123.16 2j0k h GLU 592 Ca 0.12 0.00 -0.05 0.00 0.05 0.00 0.00 59.36 59.48 2j0k h GLU 592 Cb 0.39 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.49 2j0k h GLU 592 CO -0.33 0.00 -0.15 0.77 0.05 0.00 0.00 179.01 179.35 2j0k h SER 593 N 0.00 0.27 0.51 3.06 0.02 -1.18 0.30 113.55 116.53 2j0k h SER 593 Ca 0.24 -0.56 -0.02 0.00 -0.84 0.00 0.00 61.79 60.60 2j0k h SER 593 Cb 0.99 -0.08 0.00 0.00 0.14 0.00 0.00 62.40 63.46 2j0k h SER 593 CO -0.00 0.77 -0.24 0.40 -1.14 0.00 0.00 176.83 176.62 2j0k h ILE 594 N -0.23 0.43 0.86 3.27 2.04 -0.26 -1.08 117.51 122.54 2j0k h ILE 594 Ca 0.00 -0.32 -0.04 0.00 1.00 0.00 0.00 64.86 65.51 2j0k h ILE 594 Cb 0.73 0.56 0.00 0.00 -0.74 0.00 0.00 36.82 37.37 2j0k h ILE 594 CO 0.03 0.05 -0.47 0.78 0.00 0.00 0.00 178.15 178.54 2j0k h ASN 595 N -0.89 -1.16 -0.56 1.72 2.35 0.17 -3.37 115.58 113.84 2j0k h ASN 595 Ca -0.07 0.05 -0.40 0.00 -0.55 0.00 0.00 56.30 55.33 2j0k h ASN 595 Cb 0.60 0.32 -0.36 0.00 0.05 0.00 0.00 38.32 38.93 2j0k h ASN 595 CO 0.11 -0.76 -0.84 0.49 -1.65 0.00 0.00 177.43 174.78 2j0k n PHE 596 N -5.48 1.98 -3.85 1.19 3.72 0.10 -4.70 117.46 110.43 2j0k n PHE 596 Ca -0.15 -2.04 -0.30 0.00 -0.05 0.00 0.00 57.45 54.91 2j0k n PHE 596 Cb 0.50 -0.30 -0.03 0.00 -0.94 0.00 0.00 39.48 38.71 2j0k n PHE 596 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25 2j0k n ARG 597 N -0.70 -2.72 -3.76 -1.08 1.74 -0.41 -4.84 116.66 104.89 2j0k n ARG 597 Ca 0.32 0.32 -0.36 0.00 -0.77 0.00 0.00 57.85 57.36 2j0k n ARG 597 Cb 0.91 -5.00 -0.10 0.00 -1.02 0.00 0.00 32.46 27.25 2j0k n ARG 597 CO 0.00 0.00 0.00 0.50 -1.52 0.00 0.00 177.63 176.61 2j0k s ARG 598 N -6.51 4.00 -0.28 5.56 6.06 -1.14 -4.97 118.95 121.67 2j0k s ARG 598 Ca 0.58 -0.31 0.00 0.00 -2.50 0.00 0.00 55.73 53.51 2j0k s ARG 598 Cb -0.32 -3.43 0.09 0.00 0.06 0.00 0.00 34.95 31.34 2j0k s ARG 598 CO 0.72 0.09 0.04 -0.06 -2.50 0.00 0.00 175.30 173.59 2j0k s PHE 599 N 0.92 2.26 0.32 5.12 0.40 -1.26 -3.76 117.98 121.99 2j0k s PHE 599 Ca 0.06 -1.92 0.04 0.00 -0.60 0.00 0.00 56.93 54.51 2j0k s PHE 599 Cb -0.13 -1.86 -0.06 0.00 0.51 0.00 0.00 43.02 41.47 2j0k s PHE 599 CO 0.03 -0.84 0.04 0.95 0.70 0.00 0.00 175.22 176.11 2j0k s THR 600 N 1.43 1.27 0.25 0.64 -4.23 -1.26 -4.99 115.64 108.75 2j0k s THR 600 Ca 0.05 -2.01 -0.04 0.00 -1.18 0.00 0.00 61.69 58.51 2j0k s THR 600 Cb -0.18 -2.77 0.22 0.00 1.34 0.00 0.00 72.50 71.11 2j0k s THR 600 CO -0.15 -0.03 1.82 0.28 -0.54 0.00 0.00 174.62 176.00 2j0k h SER 601 N 2.12 0.74 -0.95 3.99 0.02 -1.98 0.03 113.55 117.50 2j0k h SER 601 Ca -0.41 0.04 0.13 0.00 -0.84 0.00 0.00 61.79 60.71 2j0k h SER 601 Cb 1.24 -0.11 -0.08 0.00 0.14 0.00 0.00 62.40 63.60 2j0k h SER 601 CO 0.70 0.43 0.61 0.00 -1.14 0.00 0.00 176.83 177.43 2j0k h ALA 602 N 1.45 1.65 0.00 3.77 0.00 -1.93 0.26 119.26 124.46 2j0k h ALA 602 Ca 0.40 0.02 -0.11 0.00 0.00 0.00 0.00 54.91 55.22 2j0k h ALA 602 Cb 0.33 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 2j0k h ALA 602 CO -0.23 0.10 -0.52 0.66 0.00 0.00 0.00 179.25 179.27 2j0k h SER 603 N 0.87 0.00 -0.34 0.00 4.64 -1.60 -2.48 113.55 114.64 2j0k h SER 603 Ca 0.48 0.00 -0.10 0.00 -0.47 0.00 0.00 61.79 61.69 2j0k h SER 603 Cb 0.58 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.65 2j0k h SER 603 CO -0.24 0.52 -0.14 0.44 -0.87 0.00 0.00 176.83 176.53 2j0k h ASP 604 N 0.00 0.79 -0.20 4.97 3.45 0.60 -2.25 116.42 123.78 2j0k h ASP 604 Ca -0.01 -0.25 0.03 0.00 0.43 0.00 0.00 57.03 57.23 2j0k h ASP 604 Cb 1.40 -0.21 -0.03 0.00 -0.56 0.00 0.00 39.33 39.92 2j0k h ASP 604 CO 0.07 0.94 0.01 0.58 -1.57 0.00 0.00 179.24 179.28 2j0k h VAL 605 N 0.71 0.88 -0.19 -1.35 2.07 -0.24 0.52 116.25 118.64 2j0k h VAL 605 Ca 0.11 -0.03 0.05 0.00 0.82 0.00 0.00 66.70 67.66 2j0k h VAL 605 Cb 0.64 0.79 -0.06 0.00 -1.52 0.00 0.00 31.29 31.14 2j0k h VAL 605 CO 0.04 0.02 -0.19 -0.25 0.02 0.00 0.00 177.57 177.21 2j0k h TRP 606 N 0.08 -0.51 -0.17 1.57 2.91 -1.32 0.09 115.95 118.61 2j0k h TRP 606 Ca 0.09 0.03 0.04 0.00 1.13 0.00 0.00 58.89 60.18 2j0k h TRP 606 Cb 0.11 0.25 -0.04 0.00 -0.51 0.00 0.00 29.16 28.97 2j0k h TRP 606 CO -0.16 -0.27 -0.09 0.52 -1.03 0.00 0.00 178.44 177.40 2j0k h MET 607 N -0.22 -0.08 -0.78 2.65 2.86 -1.04 -1.16 114.93 117.16 2j0k h MET 607 Ca 0.12 0.01 0.17 0.00 -2.06 0.00 0.00 59.70 57.93 2j0k h MET 607 Cb 0.40 0.02 -0.11 0.00 0.06 0.00 0.00 31.60 31.96 2j0k h MET 607 CO -0.32 -0.05 0.26 0.35 1.06 0.00 0.00 176.91 178.21 2j0k h PHE 608 N -0.08 0.43 -0.66 -0.22 3.04 0.10 0.21 116.94 119.76 2j0k h PHE 608 Ca 0.10 0.04 0.11 0.00 3.98 0.00 0.00 57.97 62.20 2j0k h PHE 608 Cb 0.22 -0.07 -0.08 0.00 2.56 0.00 0.00 35.95 38.58 2j0k h PHE 608 CO -0.24 -0.03 0.24 0.78 -2.02 0.00 0.00 178.31 177.04 2j0k h GLY 609 N 0.35 0.93 1.72 2.40 0.00 0.22 0.51 103.07 109.20 2j0k h GLY 609 Ca 0.45 -0.11 -0.08 0.00 0.00 0.00 0.00 47.33 47.58 2j0k h GLY 609 CO -0.48 -0.06 -0.23 -2.08 0.00 0.00 0.00 176.54 173.69 2j0k h VAL 610 N 0.40 1.24 -0.40 4.60 2.07 -0.18 -2.17 116.25 121.81 2j0k h VAL 610 Ca 0.34 -1.12 -0.15 0.00 0.82 0.00 0.00 66.70 66.60 2j0k h VAL 610 Cb 0.47 1.36 -0.01 0.00 -1.52 0.00 0.00 31.29 31.59 2j0k h VAL 610 CO -0.35 0.35 -0.32 0.00 0.02 0.00 0.00 177.57 177.26 2j0k h MET 612 N 0.75 -0.38 -0.79 0.00 2.86 0.03 -1.98 114.93 115.43 2j0k h MET 612 Ca 0.07 0.03 0.12 0.00 -2.06 0.00 0.00 59.70 57.86 2j0k h MET 612 Cb 0.91 0.09 -0.13 0.00 0.06 0.00 0.00 31.60 32.52 2j0k h MET 612 CO 0.08 -0.25 -0.38 2.35 1.06 0.00 0.00 176.91 179.77 2j0k h TRP 613 N -0.39 -1.08 -0.41 -0.22 7.01 -1.19 -0.46 115.95 119.22 2j0k h TRP 613 Ca 0.03 0.09 0.08 0.00 2.11 0.00 0.00 58.89 61.20 2j0k h TRP 613 Cb 0.41 0.59 -0.07 0.00 -2.10 0.00 0.00 29.16 27.99 2j0k h TRP 613 CO -0.20 -0.40 -0.06 0.93 -2.79 0.00 0.00 178.44 175.92 2j0k h GLU 614 N -0.09 0.04 0.28 2.65 5.08 -0.89 0.17 114.58 121.82 2j0k h GLU 614 Ca 0.28 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.64 2j0k h GLU 614 Cb 0.57 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.79 2j0k h GLU 614 CO -0.83 0.03 -0.31 0.82 -1.00 0.00 0.00 179.01 177.72 2j0k h ILE 615 N 0.04 0.35 0.00 3.13 2.04 -0.49 0.25 117.51 122.84 2j0k h ILE 615 Ca 0.20 0.00 0.00 0.00 1.00 0.00 0.00 64.86 66.06 2j0k h ILE 615 Cb 0.30 0.35 0.00 0.00 -0.74 0.00 0.00 36.82 36.73 2j0k h ILE 615 CO -0.39 0.00 0.00 -0.07 0.00 0.00 0.00 178.15 177.69 2j0k h LEU 616 N -0.63 0.00 -3.09 1.44 -0.00 -0.60 -0.37 115.31 112.07 2j0k h LEU 616 Ca -0.01 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.87 2j0k h LEU 616 Cb 0.58 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.24 2j0k h LEU 616 CO -0.08 0.00 0.00 0.23 -0.00 0.00 0.00 178.44 178.59 2j0k n MET 617 N -2.54 3.88 -4.02 1.13 2.81 0.56 -4.79 117.12 114.16 2j0k n MET 617 Ca -0.00 -2.81 -0.28 0.00 -1.81 0.00 0.00 57.70 52.80 2j0k n MET 617 Cb 0.14 -1.96 -0.02 0.00 -0.71 0.00 0.00 33.22 30.67 2j0k n MET 617 CO 0.00 0.00 0.00 0.72 1.51 0.00 0.00 175.97 178.20 2j0k n HIS 618 N 0.98 -1.70 -2.51 2.03 8.25 -0.15 -2.95 115.22 119.16 2j0k n HIS 618 Ca 0.25 0.77 -0.07 0.00 -0.26 0.00 0.00 57.72 58.41 2j0k n HIS 618 Cb 0.93 -3.56 0.01 0.00 1.12 0.00 0.00 29.99 28.49 2j0k n HIS 618 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2j0k n GLY 619 N -1.84 0.32 3.81 -1.41 0.00 0.81 -3.69 105.19 103.19 2j0k n GLY 619 Ca -0.20 -0.49 -0.38 0.00 0.00 0.00 0.00 46.02 44.94 2j0k n GLY 619 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2j0k s VAL 620 N -2.74 4.71 0.26 1.61 1.01 -1.15 -4.88 120.40 119.21 2j0k s VAL 620 Ca 0.10 1.22 -0.30 0.00 0.00 0.00 0.00 61.98 63.01 2j0k s VAL 620 Cb -0.04 -3.90 -0.09 0.00 0.00 0.00 0.00 36.38 32.34 2j0k s VAL 620 CO 0.12 0.50 1.09 -0.54 0.00 0.00 0.00 175.10 176.27 2j0k s LYS 621 N -1.25 4.65 0.53 2.72 1.02 -1.26 -4.61 119.74 121.53 2j0k s LYS 621 Ca 0.31 1.77 -0.21 0.00 0.02 0.00 0.00 55.97 57.86 2j0k s LYS 621 Cb -0.19 -3.21 -0.07 0.00 -0.52 0.00 0.00 37.83 33.84 2j0k s LYS 621 CO 0.20 0.21 1.01 -0.35 -0.92 0.00 0.00 175.35 175.50 2j0k n PRO 622 N 1.44 1.16 -4.16 -1.68 -0.04 -1.26 -3.52 135.00 126.95 2j0k n PRO 622 Ca -0.00 0.43 -0.36 0.00 -0.04 0.00 0.00 63.50 63.53 2j0k n PRO 622 Cb 0.45 -2.16 -0.04 0.00 -0.04 0.00 0.00 33.50 31.71 2j0k n PRO 622 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 2j0k n PHE 623 N -1.18 -1.38 -2.09 0.54 3.01 -1.26 -4.88 117.46 110.22 2j0k n PHE 623 Ca 0.11 0.42 -0.40 0.00 1.01 0.00 0.00 57.45 58.60 2j0k n PHE 623 Cb 0.44 -2.94 -0.01 0.00 -0.01 0.00 0.00 39.48 36.96 2j0k n PHE 623 CO 0.00 0.00 0.00 -0.65 1.01 0.00 0.00 176.76 177.12 2j0k s GLN 624 N -7.24 4.18 -1.55 -1.08 -0.21 -1.23 -2.26 119.66 110.27 2j0k s GLN 624 Ca 0.20 2.19 -0.04 0.00 0.02 0.00 0.00 55.36 57.72 2j0k s GLN 624 Cb -0.11 -2.92 0.01 0.00 1.00 0.00 0.00 33.01 30.99 2j0k s GLN 624 CO 0.97 -0.33 0.51 0.41 -2.12 0.00 0.00 175.29 174.74 2j0k n GLY 625 N 0.73 -0.52 3.19 3.09 0.00 -1.26 -5.00 105.19 105.41 2j0k n GLY 625 Ca 0.02 0.11 -0.32 0.00 0.00 0.00 0.00 46.02 45.83 2j0k n GLY 625 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2j0k s VAL 626 N -3.13 2.00 0.59 1.61 1.01 -0.96 -5.13 120.40 116.40 2j0k s VAL 626 Ca 0.27 -0.97 -0.19 0.00 0.00 0.00 0.00 61.98 61.09 2j0k s VAL 626 Cb -0.12 -1.75 -0.03 0.00 0.00 0.00 0.00 36.38 34.48 2j0k s VAL 626 CO 0.34 0.54 1.26 -0.54 0.00 0.00 0.00 175.10 176.70 2j0k s LYS 627 N 0.52 2.91 0.25 2.72 1.02 -1.26 -4.92 119.74 120.97 2j0k s LYS 627 Ca -0.15 1.97 -0.06 0.00 0.02 0.00 0.00 55.97 57.75 2j0k s LYS 627 Cb -0.17 -1.98 0.26 0.00 -0.52 0.00 0.00 37.83 35.42 2j0k s LYS 627 CO 0.05 -1.29 1.87 -0.91 -0.92 0.00 0.00 175.35 174.15 2j0k h ASN 628 N 0.94 1.08 1.57 2.83 2.35 -2.00 -2.54 115.58 119.81 2j0k h ASN 628 Ca -0.51 -0.09 -0.03 0.00 -0.55 0.00 0.00 56.30 55.12 2j0k h ASN 628 Cb 1.31 -0.28 -0.00 0.00 0.05 0.00 0.00 38.32 39.40 2j0k h ASN 628 CO 0.55 0.87 -0.12 0.78 -1.65 0.00 0.00 177.43 177.85 2j0k h ASN 629 N 1.21 0.00 -0.35 5.81 4.21 -2.01 -2.76 115.58 121.70 2j0k h ASN 629 Ca 0.31 0.00 -0.00 0.00 1.21 0.00 0.00 56.30 57.81 2j0k h ASN 629 Cb 0.02 0.00 -0.02 0.00 -1.12 0.00 0.00 38.32 37.21 2j0k h ASN 629 CO -0.05 0.12 0.20 0.44 -1.29 0.00 0.00 177.43 176.86 2j0k h ASP 630 N 0.00 0.43 -0.64 5.81 3.45 -1.84 -3.32 116.42 120.30 2j0k h ASP 630 Ca -0.00 -0.07 0.06 0.00 0.43 0.00 0.00 57.03 57.45 2j0k h ASP 630 Cb 0.94 -0.11 -0.10 0.00 -0.56 0.00 0.00 39.33 39.51 2j0k h ASP 630 CO 0.02 0.37 -0.55 0.58 -1.57 0.00 0.00 179.24 178.08 2j0k h VAL 631 N 0.45 0.00 -0.80 -1.35 2.07 -1.21 -1.04 116.25 114.37 2j0k h VAL 631 Ca 0.12 0.00 0.19 0.00 0.82 0.00 0.00 66.70 67.83 2j0k h VAL 631 Cb 0.03 0.00 -0.14 0.00 -1.52 0.00 0.00 31.29 29.66 2j0k h VAL 631 CO -0.02 0.00 0.03 0.16 0.02 0.00 0.00 177.57 177.76 2j0k h ILE 632 N -0.22 0.31 -0.36 4.57 3.07 -1.66 0.86 117.51 124.08 2j0k h ILE 632 Ca 0.11 -0.04 -0.07 0.00 1.55 0.00 0.00 64.86 66.41 2j0k h ILE 632 Cb 0.50 0.19 -0.02 0.00 -0.27 0.00 0.00 36.82 37.22 2j0k h ILE 632 CO -0.72 0.02 -0.06 1.23 -1.05 0.00 0.00 178.15 177.57 2j0k h GLY 633 N 0.11 0.63 1.53 0.16 0.00 -1.36 0.42 103.07 104.56 2j0k h GLY 633 Ca 0.45 -0.41 -0.15 0.00 0.00 0.00 0.00 47.33 47.21 2j0k h GLY 633 CO -0.69 0.38 -0.52 3.21 0.00 0.00 0.00 176.54 178.92 2j0k h ARG 634 N 0.55 0.50 0.04 4.80 3.08 -0.45 0.58 114.38 123.47 2j0k h ARG 634 Ca 0.11 -0.30 -0.00 0.00 0.07 0.00 0.00 59.98 59.86 2j0k h ARG 634 Cb 0.44 0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.52 2j0k h ARG 634 CO 0.02 0.90 -0.02 0.82 -1.07 0.00 0.00 179.97 180.62 2j0k h ILE 635 N 0.39 1.26 -0.84 2.04 1.08 -0.84 0.27 117.51 120.87 2j0k h ILE 635 Ca 0.01 -1.00 0.08 0.00 -0.39 0.00 0.00 64.86 63.57 2j0k h ILE 635 Cb 1.04 1.92 -0.06 0.00 -3.07 0.00 0.00 36.82 36.65 2j0k h ILE 635 CO 0.09 0.25 0.55 -0.08 -0.69 0.00 0.00 178.15 178.28 2j0k h GLU 636 N -0.50 0.85 -0.01 2.37 4.57 -0.02 -0.94 114.58 120.90 2j0k h GLU 636 Ca -0.01 -0.05 0.00 0.00 -1.18 0.00 0.00 59.36 58.12 2j0k h GLU 636 Cb 0.45 -0.19 0.00 0.00 -0.16 0.00 0.00 28.75 28.85 2j0k h GLU 636 CO 0.01 0.56 -0.08 0.09 -1.18 0.00 0.00 179.01 178.41 2j0k n ASN 637 N -4.50 0.61 0.00 1.04 5.03 0.20 -4.94 115.26 112.70 2j0k n ASN 637 Ca 0.13 -0.83 0.00 0.00 0.87 0.00 0.00 54.58 54.76 2j0k n ASN 637 Cb 0.26 -0.04 0.00 0.00 -1.02 0.00 0.00 39.78 38.99 2j0k n ASN 637 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2j0k n GLY 638 N 1.22 0.49 3.69 7.41 0.00 -0.36 -5.04 105.19 112.60 2j0k n GLY 638 Ca 0.17 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.76 2j0k n GLY 638 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2j0k n GLU 639 N -1.44 2.71 -4.41 1.61 4.71 0.93 -4.98 120.64 119.77 2j0k n GLU 639 Ca 0.00 0.98 -0.25 0.00 -0.01 0.00 0.00 57.16 57.89 2j0k n GLU 639 Cb 0.00 -2.86 -0.11 0.00 -1.01 0.00 0.00 31.44 27.46 2j0k n GLU 639 CO 0.00 0.00 0.00 1.03 0.09 0.00 0.00 177.13 178.25 2j0k s ARG 640 N 2.37 1.50 0.08 3.49 1.81 -1.26 -4.29 118.95 122.66 2j0k s ARG 640 Ca 0.81 -1.57 -0.33 0.00 -1.72 0.00 0.00 55.73 52.92 2j0k s ARG 640 Cb -0.51 -1.68 -0.12 0.00 -0.45 0.00 0.00 34.95 32.19 2j0k s ARG 640 CO 0.37 0.34 1.77 1.28 -0.68 0.00 0.00 175.30 178.39 2j0k n LEU 641 N -0.00 3.62 -4.67 2.53 4.77 -1.26 -4.90 117.00 117.08 2j0k n LEU 641 Ca -0.10 1.01 -0.38 0.00 -0.03 0.00 0.00 56.01 56.51 2j0k n LEU 641 Cb 0.58 -1.47 0.05 0.00 -2.33 0.00 0.00 43.42 40.24 2j0k n LEU 641 CO 0.32 -0.02 0.74 -0.81 -1.33 0.00 0.00 177.39 176.29 2j0k n PRO 642 N 5.23 1.22 -1.63 3.23 -0.04 -1.26 -4.88 135.00 136.88 2j0k n PRO 642 Ca 0.19 0.46 -0.47 0.00 -0.04 0.00 0.00 63.50 63.64 2j0k n PRO 642 Cb 0.33 -2.33 -0.05 0.00 -0.04 0.00 0.00 33.50 31.41 2j0k n PRO 642 CO 0.00 0.00 0.00 -0.12 -0.04 0.00 0.00 175.50 175.34 2j0k n MET 643 N -1.02 2.03 -2.04 0.54 1.56 -1.26 -4.93 117.12 112.00 2j0k n MET 643 Ca 0.13 0.69 -0.39 0.00 -0.27 0.00 0.00 57.70 57.86 2j0k n MET 643 Cb 0.46 -2.76 0.00 0.00 2.15 0.00 0.00 33.22 33.06 2j0k n MET 643 CO 0.00 0.00 0.00 -1.25 -0.73 0.00 0.00 175.97 173.99 2j0k s PRO 644 N 4.91 3.77 0.40 2.12 0.04 -1.26 -4.93 135.00 140.05 2j0k s PRO 644 Ca 0.97 2.10 -0.25 0.00 0.04 0.00 0.00 61.00 63.85 2j0k s PRO 644 Cb -0.63 -2.59 -0.11 0.00 0.04 0.00 0.00 34.50 31.21 2j0k s PRO 644 CO 0.47 -0.63 1.08 -2.30 0.04 0.00 0.00 177.00 175.66 2j0k n PRO 645 N -0.21 1.52 -1.09 0.56 -0.02 -1.26 -2.29 135.00 132.21 2j0k n PRO 645 Ca 0.06 0.54 -0.03 0.00 -2.02 0.00 0.00 63.50 62.05 2j0k n PRO 645 Cb 0.45 -2.10 -0.01 0.00 -0.02 0.00 0.00 33.50 31.81 2j0k n PRO 645 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 2j0k n ASN 646 N 0.57 -5.13 -4.72 2.55 3.02 -1.26 -4.99 115.26 105.31 2j0k n ASN 646 Ca 0.08 0.08 -0.42 0.00 -0.03 0.00 0.00 54.58 54.29 2j0k n ASN 646 Cb 0.38 -2.90 -0.03 0.00 -0.61 0.00 0.00 39.78 36.61 2j0k n ASN 646 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2j0k s PRO 648 N 0.74 4.19 0.30 0.00 0.02 -1.26 -4.92 135.00 134.07 2j0k s PRO 648 Ca 0.51 2.44 0.06 0.00 0.02 0.00 0.00 61.00 64.03 2j0k s PRO 648 Cb -0.22 -3.08 0.80 0.00 0.02 0.00 0.00 34.50 32.02 2j0k s PRO 648 CO 0.29 -0.55 1.68 -1.35 -0.33 0.00 0.00 177.00 176.73 2j0k h PRO 649 N 5.36 0.35 -0.61 5.54 0.11 -2.00 0.39 132.00 141.13 2j0k h PRO 649 Ca -0.46 -0.02 -0.03 0.00 0.11 0.00 0.00 66.00 65.60 2j0k h PRO 649 Cb 1.22 -0.08 -0.03 0.00 0.11 0.00 0.00 31.00 32.22 2j0k h PRO 649 CO 0.82 0.23 0.26 1.79 -0.21 0.00 0.00 178.00 180.89 2j0k h THR 650 N 0.36 1.21 -0.42 -1.15 1.35 -2.00 -1.62 112.91 110.65 2j0k h THR 650 Ca 0.60 -0.65 -0.12 0.00 -0.55 0.00 0.00 66.41 65.68 2j0k h THR 650 Cb 1.20 0.47 -0.01 0.00 -1.73 0.00 0.00 68.15 68.07 2j0k h THR 650 CO -0.57 0.26 -0.24 0.25 -0.25 0.00 0.00 175.52 174.98 2j0k h LEU 651 N 0.88 0.87 -0.45 3.87 5.85 -1.31 -2.29 115.31 122.74 2j0k h LEU 651 Ca 0.21 -0.33 -0.14 0.00 0.84 0.00 0.00 57.88 58.47 2j0k h LEU 651 Cb 0.15 -0.24 -0.01 0.00 0.37 0.00 0.00 40.66 40.93 2j0k h LEU 651 CO -0.02 1.07 -0.25 0.22 -0.34 0.00 0.00 178.44 179.12 2j0k h TYR 652 N 0.74 1.11 -0.90 1.25 3.20 -1.07 -1.11 116.97 120.19 2j0k h TYR 652 Ca 0.10 -0.29 0.01 0.00 3.14 0.00 0.00 58.73 61.69 2j0k h TYR 652 Cb 0.78 -0.25 -0.05 0.00 1.54 0.00 0.00 36.73 38.75 2j0k h TYR 652 CO 0.04 1.11 0.60 0.66 -1.64 0.00 0.00 178.16 178.92 2j0k h SER 653 N 0.80 1.02 0.11 -2.11 4.64 -1.28 -0.76 113.55 115.97 2j0k h SER 653 Ca 0.10 -0.02 0.01 0.00 -0.47 0.00 0.00 61.79 61.40 2j0k h SER 653 Cb 0.83 -0.25 -0.02 0.00 -0.31 0.00 0.00 62.40 62.65 2j0k h SER 653 CO 0.07 0.73 -0.17 0.25 -0.87 0.00 0.00 176.83 176.85 2j0k h LEU 654 N 1.21 -0.47 -0.77 5.97 5.85 -1.11 -1.65 115.31 124.34 2j0k h LEU 654 Ca 0.34 0.05 0.12 0.00 0.84 0.00 0.00 57.88 59.22 2j0k h LEU 654 Cb -0.12 0.18 -0.08 0.00 0.37 0.00 0.00 40.66 41.01 2j0k h LEU 654 CO -0.08 -0.25 0.38 0.24 -0.34 0.00 0.00 178.44 178.39 2j0k h MET 655 N -0.34 0.58 -0.07 1.25 2.86 -0.64 -1.89 114.93 116.69 2j0k h MET 655 Ca 0.02 -0.03 -0.12 0.00 -2.06 0.00 0.00 59.70 57.51 2j0k h MET 655 Cb 0.35 -0.13 -0.01 0.00 0.06 0.00 0.00 31.60 31.86 2j0k h MET 655 CO -0.09 0.38 -0.49 1.79 1.06 0.00 0.00 176.91 179.57 2j0k h THR 656 N 0.60 1.35 -0.97 2.22 1.35 -0.76 -1.83 112.91 114.86 2j0k h THR 656 Ca 0.40 -1.71 0.08 0.00 -0.55 0.00 0.00 66.41 64.63 2j0k h THR 656 Cb 0.49 1.84 -0.07 0.00 -1.73 0.00 0.00 68.15 68.68 2j0k h THR 656 CO -0.32 0.50 0.61 0.11 -0.25 0.00 0.00 175.52 176.18 2j0k h LYS 657 N 0.13 1.04 0.00 4.72 1.57 -0.48 0.31 116.57 123.86 2j0k h LYS 657 Ca 0.01 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 58.72 2j0k h LYS 657 Cb 0.91 -0.23 0.00 0.00 0.08 0.00 0.00 32.23 32.99 2j0k h LYS 657 CO 0.07 0.68 0.00 0.00 -0.57 0.00 0.00 179.45 179.64 2j0k n TRP 659 N -2.71 1.57 -2.00 0.00 8.01 0.11 -3.85 117.44 118.57 2j0k n TRP 659 Ca -0.01 -0.87 -0.42 0.00 -1.31 0.00 0.00 57.50 54.89 2j0k n TRP 659 Cb 0.13 -0.44 -0.03 0.00 -2.01 0.00 0.00 31.31 28.96 2j0k n TRP 659 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.69 176.68 2j0k s ALA 660 N -2.84 3.72 0.15 6.99 0.00 -1.12 -4.91 121.76 123.74 2j0k s ALA 660 Ca 0.49 1.30 -0.17 0.00 0.00 0.00 0.00 51.96 53.58 2j0k s ALA 660 Cb 0.39 -3.59 0.05 0.00 0.00 0.00 0.00 23.12 19.96 2j0k s ALA 660 CO 0.12 -0.73 1.72 -0.92 0.00 0.00 0.00 175.76 175.95 2j0k h TYR 661 N 6.61 0.06 -3.15 0.00 5.03 -1.93 -3.38 116.97 120.21 2j0k h TYR 661 Ca -0.43 0.02 -0.57 0.00 2.58 0.00 0.00 58.73 60.34 2j0k h TYR 661 Cb 1.21 0.02 -0.05 0.00 1.55 0.00 0.00 36.73 39.46 2j0k h TYR 661 CO 0.65 -0.01 1.04 0.34 -1.32 0.00 0.00 178.16 178.86 2j0k s ASP 662 N -5.28 6.47 0.31 -2.11 3.68 -1.26 -4.84 116.67 113.64 2j0k s ASP 662 Ca -0.13 1.08 0.08 0.00 2.13 0.00 0.00 52.55 55.71 2j0k s ASP 662 Cb 0.12 -2.54 0.83 0.00 -1.45 0.00 0.00 42.92 39.88 2j0k s ASP 662 CO 0.70 -1.27 1.74 1.55 0.13 0.00 0.00 175.17 178.02 2j0k h PRO 663 N 10.17 0.59 -1.01 4.34 0.13 -1.96 -0.32 132.00 143.94 2j0k h PRO 663 Ca -0.28 -0.04 0.29 0.00 -0.87 0.00 0.00 66.00 65.11 2j0k h PRO 663 Cb 1.11 -0.13 -0.04 0.00 0.13 0.00 0.00 31.00 32.07 2j0k h PRO 663 CO 1.05 0.39 0.86 1.03 -0.23 0.00 0.00 178.00 181.10 2j0k h SER 664 N 0.61 0.00 -0.29 1.44 0.87 -1.93 -0.78 113.55 113.46 2j0k h SER 664 Ca 0.62 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 61.18 2j0k h SER 664 Cb 1.13 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.09 2j0k h SER 664 CO -0.46 0.00 0.00 0.54 -0.53 0.00 0.00 176.83 176.38 2j0k n ARG 665 N -3.85 2.37 -3.19 2.24 1.74 -0.13 -4.93 116.66 110.91 2j0k n ARG 665 Ca 0.22 -2.05 -0.34 0.00 -0.77 0.00 0.00 57.85 54.90 2j0k n ARG 665 Cb 1.19 -1.49 -0.06 0.00 -1.02 0.00 0.00 32.46 31.08 2j0k n ARG 665 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 2j0k s ARG 666 N -1.63 4.05 0.89 5.56 0.52 -0.30 -4.85 118.95 123.18 2j0k s ARG 666 Ca 0.36 0.66 -0.11 0.00 -0.52 0.00 0.00 55.73 56.12 2j0k s ARG 666 Cb 0.22 -2.68 0.13 0.00 0.52 0.00 0.00 34.95 33.13 2j0k s ARG 666 CO 0.31 0.30 1.10 -1.25 0.02 0.00 0.00 175.30 175.78 2j0k s PRO 667 N -2.48 1.30 0.60 3.54 0.04 -1.26 -5.04 135.00 131.69 2j0k s PRO 667 Ca 0.47 1.16 -0.07 0.00 0.04 0.00 0.00 61.00 62.60 2j0k s PRO 667 Cb -0.13 -1.79 0.01 0.00 0.04 0.00 0.00 34.50 32.63 2j0k s PRO 667 CO 0.19 -2.31 0.92 1.03 0.04 0.00 0.00 177.00 176.87 2j0k s ARG 668 N -4.79 2.92 0.18 4.56 1.81 -1.26 -4.93 118.95 117.43 2j0k s ARG 668 Ca 0.64 0.06 -0.07 0.00 -1.72 0.00 0.00 55.73 54.63 2j0k s ARG 668 Cb -0.20 -2.24 0.07 0.00 -0.45 0.00 0.00 34.95 32.13 2j0k s ARG 668 CO 0.58 -0.73 1.55 0.74 -0.68 0.00 0.00 175.30 176.75 2j0k h PHE 669 N -0.23 0.99 -0.63 -0.53 0.04 -1.95 -2.33 116.94 112.31 2j0k h PHE 669 Ca -0.45 -0.27 0.07 0.00 2.80 0.00 0.00 57.97 60.12 2j0k h PHE 669 Cb 1.25 -0.22 -0.04 0.00 2.20 0.00 0.00 35.95 39.15 2j0k h PHE 669 CO 0.48 1.05 0.42 1.79 -0.60 0.00 0.00 178.31 181.45 2j0k h THR 670 N 0.71 0.98 0.41 -1.55 1.35 -1.91 -0.11 112.91 112.79 2j0k h THR 670 Ca 0.07 -0.20 -0.02 0.00 -0.55 0.00 0.00 66.41 65.71 2j0k h THR 670 Cb 0.88 0.34 0.00 0.00 -1.73 0.00 0.00 68.15 67.64 2j0k h THR 670 CO 0.08 0.11 -0.20 -0.08 -0.25 0.00 0.00 175.52 175.18 2j0k h GLU 671 N 0.58 -0.54 -0.94 4.72 4.57 -1.86 -2.40 114.58 118.71 2j0k h GLU 671 Ca 0.28 0.04 0.13 0.00 -1.18 0.00 0.00 59.36 58.63 2j0k h GLU 671 Cb 0.34 0.12 -0.09 0.00 -0.16 0.00 0.00 28.75 28.97 2j0k h GLU 671 CO -0.09 -0.23 0.56 -0.07 -1.18 0.00 0.00 179.01 178.01 2j0k h LEU 672 N -0.89 0.78 0.07 1.64 3.38 -0.88 0.67 115.31 120.08 2j0k h LEU 672 Ca -0.06 0.07 -0.00 0.00 0.09 0.00 0.00 57.88 57.98 2j0k h LEU 672 Cb 0.56 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.23 2j0k h LEU 672 CO 0.09 0.38 -0.03 0.50 0.09 0.00 0.00 178.44 179.47 2j0k h LYS 673 N 0.84 -0.09 -0.72 1.13 3.64 -1.04 0.76 116.57 121.10 2j0k h LYS 673 Ca 0.49 0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.86 2j0k h LYS 673 Cb 0.57 0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 32.38 2j0k h LYS 673 CO -0.30 0.01 0.42 0.00 -2.27 0.00 0.00 179.45 177.30 2j0k h ALA 674 N 0.77 0.92 0.53 5.00 0.00 -0.88 0.73 119.26 126.34 2j0k h ALA 674 Ca -0.01 -0.10 -0.03 0.00 0.00 0.00 0.00 54.91 54.78 2j0k h ALA 674 Cb 0.13 -0.29 0.01 0.00 0.00 0.00 0.00 17.79 17.64 2j0k h ALA 674 CO 0.02 0.41 -0.26 1.96 0.00 0.00 0.00 179.25 181.38 2j0k h GLN 675 N 0.99 -0.69 -0.92 0.00 1.08 -0.64 -2.83 115.11 112.09 2j0k h GLN 675 Ca 0.26 0.05 0.14 0.00 -1.45 0.00 0.00 58.65 57.65 2j0k h GLN 675 Cb 0.00 0.16 -0.09 0.00 -0.05 0.00 0.00 27.48 27.50 2j0k h GLN 675 CO -0.04 -0.40 0.53 -0.07 -0.95 0.00 0.00 178.83 177.90 2j0k h LEU 676 N -0.89 0.70 -0.16 1.46 3.38 0.62 -1.55 115.31 118.87 2j0k h LEU 676 Ca -0.07 0.08 0.04 0.00 0.09 0.00 0.00 57.88 58.01 2j0k h LEU 676 Cb 0.61 -0.05 -0.07 0.00 0.09 0.00 0.00 40.66 41.24 2j0k h LEU 676 CO 0.12 0.32 -0.48 -1.28 0.09 0.00 0.00 178.44 177.21 2j0k h SER 677 N 0.77 -1.51 0.90 -0.43 0.87 -0.75 0.18 113.55 113.58 2j0k h SER 677 Ca 0.49 0.19 0.00 0.00 -1.23 0.00 0.00 61.79 61.24 2j0k h SER 677 Cb 0.64 0.61 0.00 0.00 -0.44 0.00 0.00 62.40 63.20 2j0k h SER 677 CO -0.33 -0.45 0.00 0.71 -0.53 0.00 0.00 176.83 176.23 2j0k h THR 678 N -0.52 0.00 0.00 2.23 1.35 -1.08 -1.60 112.91 113.30 2j0k h THR 678 Ca 0.06 -0.38 -0.22 0.00 -0.55 0.00 0.00 66.41 65.33 2j0k h THR 678 Cb 0.65 1.24 -0.03 0.00 -1.73 0.00 0.00 68.15 68.28 2j0k h THR 678 CO -0.44 0.00 -1.09 0.40 -0.25 0.00 0.00 175.52 174.14 2j0k h ILE 679 N 0.00 1.59 0.39 6.82 2.04 -0.53 -3.07 117.51 124.75 2j0k h ILE 679 Ca 0.00 -3.32 -0.02 0.00 1.00 0.00 0.00 64.86 62.52 2j0k h ILE 679 Cb 0.45 2.79 0.00 0.00 -0.74 0.00 0.00 36.82 39.32 2j0k h ILE 679 CO 0.00 0.91 -0.19 0.25 0.00 0.00 0.00 178.15 179.12 2j0k h LEU 680 N 0.00 -0.44 -1.05 1.44 5.85 0.33 -3.09 115.31 118.34 2j0k h LEU 680 Ca -0.05 -0.07 0.06 0.00 0.84 0.00 0.00 57.88 58.67 2j0k h LEU 680 Cb 1.80 0.11 -0.06 0.00 0.37 0.00 0.00 40.66 42.88 2j0k h LEU 680 CO 0.12 -0.19 0.63 -0.33 -0.34 0.00 0.00 178.44 178.33 2j0k h GLU 681 N -0.68 1.11 0.00 1.25 4.39 -1.61 -1.83 114.58 117.20 2j0k h GLU 681 Ca -0.05 -0.07 0.00 0.00 0.34 0.00 0.00 59.36 59.58 2j0k h GLU 681 Cb 0.49 -0.25 0.00 0.00 -0.10 0.00 0.00 28.75 28.89 2j0k h GLU 681 CO 0.09 0.73 0.09 1.49 -1.16 0.00 0.00 179.01 180.25 2j0k h GLU 682 N 1.14 0.00 0.06 2.33 4.57 -1.45 0.45 114.58 121.68 2j0k h GLU 682 Ca 0.42 0.00 -0.33 0.00 -1.18 0.00 0.00 59.36 58.27 2j0k h GLU 682 Cb 0.17 0.00 -0.03 0.00 -0.16 0.00 0.00 28.75 28.73 2j0k h GLU 682 CO -0.16 0.00 -1.82 -1.91 -1.18 0.00 0.00 179.01 173.93 2j0k n GLU 683 N -2.81 0.67 -0.27 1.92 4.07 -0.72 -4.14 120.64 119.35 2j0k n GLU 683 Ca -0.02 0.37 0.08 0.00 -0.06 0.00 0.00 57.16 57.53 2j0k n GLU 683 Cb 0.15 -1.69 0.22 0.00 -0.06 0.00 0.00 31.44 30.06 2j0k n GLU 683 CO 0.00 0.00 0.00 0.87 -0.06 0.00 0.00 177.13 177.94 2j0k h LYS 684 N -0.42 0.27 0.00 5.31 1.57 -0.62 0.42 116.57 123.11 2j0k h LYS 684 Ca -0.44 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.33 2j0k h LYS 684 Cb 1.72 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 33.97 2j0k h LYS 684 CO -0.08 0.18 0.00 -0.07 -0.57 0.00 0.00 179.45 178.91 2j0k h LEU 685 N 0.28 0.00 0.00 2.94 3.38 -1.59 -3.52 115.31 116.81 2j0k h LEU 685 Ca 0.47 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.44 2j0k h LEU 685 Cb 0.85 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.60 2j0k h LEU 685 CO -0.55 0.00 0.00 1.67 0.09 0.00 0.00 178.44 179.65