#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1b0k s ALA 3 N 0.00 2.15 -0.53 5.13 0.00 -1.26 -5.03 121.76 122.22 1b0k s ALA 3 Ca 0.00 -0.21 0.04 0.00 0.00 0.00 0.00 51.96 51.78 1b0k s ALA 3 Cb 0.00 -3.11 0.14 0.00 0.00 0.00 0.00 23.12 20.15 1b0k s ALA 3 CO 0.00 -1.83 0.31 0.15 0.00 0.00 0.00 175.76 174.39 1b0k s LYS 4 N -5.14 1.82 -0.10 0.00 1.02 -1.26 -5.02 119.74 111.06 1b0k s LYS 4 Ca 0.61 -2.57 -0.02 0.00 0.02 0.00 0.00 55.97 54.01 1b0k s LYS 4 Cb -0.15 -2.94 -0.03 0.00 -0.52 0.00 0.00 37.83 34.19 1b0k s LYS 4 CO 0.54 -1.18 -0.00 0.08 -0.92 0.00 0.00 175.35 173.87 1b0k s VAL 5 N -0.34 4.26 0.20 3.17 1.01 -1.26 -5.07 120.40 122.36 1b0k s VAL 5 Ca 0.20 -0.26 -0.06 0.00 0.00 0.00 0.00 61.98 61.86 1b0k s VAL 5 Cb -0.19 -2.80 -0.06 0.00 0.00 0.00 0.00 36.38 33.33 1b0k s VAL 5 CO -0.05 0.59 0.46 0.00 0.00 0.00 0.00 175.10 176.10 1b0k s ALA 6 N -0.69 3.69 0.25 5.51 0.00 -1.26 -2.06 121.76 127.20 1b0k s ALA 6 Ca 0.11 -0.48 -0.04 0.00 0.00 0.00 0.00 51.96 51.55 1b0k s ALA 6 Cb -0.12 -2.25 0.30 0.00 0.00 0.00 0.00 23.12 21.05 1b0k s ALA 6 CO 0.02 0.54 1.79 0.52 0.00 0.00 0.00 175.76 178.63 1b0k h MET 7 N 2.52 0.95 0.00 0.00 2.86 -1.12 -3.45 114.93 116.69 1b0k h MET 7 Ca -0.47 -0.20 -0.21 0.00 -2.06 0.00 0.00 59.70 56.76 1b0k h MET 7 Cb 1.17 -0.14 -0.05 0.00 0.06 0.00 0.00 31.60 32.64 1b0k h MET 7 CO 0.70 0.84 -0.10 -1.13 1.06 0.00 0.00 176.91 178.28 1b0k n SER 8 N -4.26 -1.04 0.05 1.22 3.41 -1.26 -4.82 113.62 106.92 1b0k n SER 8 Ca 0.05 -2.43 0.11 0.00 -0.26 0.00 0.00 58.87 56.33 1b0k n SER 8 Cb 0.24 1.94 0.43 0.00 -0.26 0.00 0.00 64.21 66.56 1b0k n SER 8 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 1b0k n HIS 9 N -0.44 0.32 0.57 7.33 -0.00 -1.26 -3.12 115.22 118.62 1b0k n HIS 9 Ca 0.00 0.11 0.06 0.00 -0.00 0.00 0.00 57.72 57.90 1b0k n HIS 9 Cb 0.44 -0.68 -0.05 0.00 -0.00 0.00 0.00 29.99 29.70 1b0k n HIS 9 CO 0.00 0.00 0.00 1.19 -0.00 0.00 0.00 176.34 177.53 1b0k n PHE 10 N -1.78 0.00 -3.40 4.41 3.72 -1.26 -4.70 117.46 114.45 1b0k n PHE 10 Ca 0.04 0.00 -0.26 0.00 -0.05 0.00 0.00 57.45 57.18 1b0k n PHE 10 Cb 0.26 0.00 -0.08 0.00 -0.94 0.00 0.00 39.48 38.71 1b0k n PHE 10 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 176.76 177.10 1b0k n GLU 11 N -1.00 1.45 0.00 -1.08 4.71 -1.18 -4.97 120.64 118.57 1b0k n GLU 11 Ca 0.03 -3.91 0.08 0.00 -0.01 0.00 0.00 57.16 53.35 1b0k n GLU 11 Cb 0.21 -1.80 0.43 0.00 -1.01 0.00 0.00 31.44 29.27 1b0k n GLU 11 CO 0.00 0.00 0.00 -0.35 0.09 0.00 0.00 177.13 176.87 1b0k n PRO 12 N 1.47 0.32 0.00 3.49 -0.04 -1.26 -2.45 135.00 136.54 1b0k n PRO 12 Ca 0.25 0.09 0.02 0.00 -0.04 0.00 0.00 63.50 63.83 1b0k n PRO 12 Cb 0.46 -1.50 0.01 0.00 -0.04 0.00 0.00 33.50 32.43 1b0k n PRO 12 CO 0.00 0.00 0.00 -2.39 -0.04 0.00 0.00 175.50 173.07 1b0k n HIS 13 N -1.19 0.00 -3.79 0.54 1.44 -1.26 -4.77 115.22 106.19 1b0k n HIS 13 Ca 0.09 0.00 -0.37 0.00 -2.01 0.00 0.00 57.72 55.43 1b0k n HIS 13 Cb 0.10 0.00 -0.13 0.00 0.12 0.00 0.00 29.99 30.09 1b0k n HIS 13 CO 0.00 0.00 0.00 -1.21 -2.81 0.00 0.00 176.34 172.32 1b0k s GLU 14 N -0.44 2.74 0.11 -1.40 0.41 -1.03 -5.08 118.70 114.02 1b0k s GLU 14 Ca 0.05 -1.08 0.02 0.00 -0.41 0.00 0.00 54.97 53.54 1b0k s GLU 14 Cb 0.04 -3.37 -0.04 0.00 -1.78 0.00 0.00 34.13 28.98 1b0k s GLU 14 CO 0.06 -0.58 0.21 0.71 -0.49 0.00 0.00 175.26 175.18 1b0k s TYR 15 N 1.41 3.42 0.22 1.61 2.02 -1.26 -0.83 117.35 123.94 1b0k s TYR 15 Ca -0.01 0.14 -0.30 0.00 -0.37 0.00 0.00 57.07 56.53 1b0k s TYR 15 Cb -0.19 -1.67 -0.10 0.00 -0.40 0.00 0.00 41.96 39.61 1b0k s TYR 15 CO 0.02 0.54 1.40 0.42 -1.57 0.00 0.00 175.55 176.36 1b0k s ILE 16 N -1.62 2.86 -0.62 2.71 1.01 -0.88 -4.82 121.20 119.83 1b0k s ILE 16 Ca 0.34 0.71 0.06 0.00 0.00 0.00 0.00 60.65 61.75 1b0k s ILE 16 Cb -0.12 -3.45 0.27 0.00 0.01 0.00 0.00 42.46 39.18 1b0k s ILE 16 CO 0.27 0.11 0.80 0.54 0.00 0.00 0.00 174.94 176.66 1b0k n ARG 17 N 2.55 2.71 0.25 2.79 5.12 -1.26 -4.76 116.66 124.06 1b0k n ARG 17 Ca 0.07 -4.72 0.16 0.00 -1.93 0.00 0.00 57.85 51.43 1b0k n ARG 17 Cb 0.41 -2.25 0.62 0.00 -1.16 0.00 0.00 32.46 30.08 1b0k n ARG 17 CO 0.00 0.00 0.00 1.88 -1.93 0.00 0.00 177.63 177.58 1b0k h TYR 18 N 3.85 0.00 -0.25 -1.55 0.05 -1.98 -2.45 116.97 114.64 1b0k h TYR 18 Ca 0.18 0.00 -0.14 0.00 0.05 0.00 0.00 58.73 58.82 1b0k h TYR 18 Cb 0.62 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.35 1b0k h TYR 18 CO 0.75 0.00 -0.41 0.38 -1.05 0.00 0.00 178.16 177.83 1b0k h ASP 19 N 0.00 0.65 0.19 3.88 2.03 -2.00 -2.09 116.42 119.08 1b0k h ASP 19 Ca 0.00 -0.29 -0.26 0.00 -0.73 0.00 0.00 57.03 55.75 1b0k h ASP 19 Cb 0.53 -0.18 0.01 0.00 -0.83 0.00 0.00 39.33 38.86 1b0k h ASP 19 CO 0.00 0.98 -1.05 0.25 -1.03 0.00 0.00 179.24 178.40 1b0k h LEU 20 N 0.50 0.73 -0.26 0.15 7.12 -1.89 -2.48 115.31 119.17 1b0k h LEU 20 Ca 0.04 -0.61 0.06 0.00 0.13 0.00 0.00 57.88 57.50 1b0k h LEU 20 Cb 0.93 -0.23 -0.06 0.00 -0.53 0.00 0.00 40.66 40.78 1b0k h LEU 20 CO 0.08 1.42 -0.10 0.25 -0.13 0.00 0.00 178.44 179.96 1b0k h LEU 21 N 0.30 -0.34 0.14 2.25 5.85 -1.45 -2.82 115.31 119.23 1b0k h LEU 21 Ca -0.12 0.09 0.01 0.00 0.84 0.00 0.00 57.88 58.70 1b0k h LEU 21 Cb 1.70 0.20 -0.02 0.00 0.37 0.00 0.00 40.66 42.92 1b0k h LEU 21 CO 0.19 -0.13 -0.16 -0.08 -0.34 0.00 0.00 178.44 177.92 1b0k h GLU 22 N -0.05 -0.33 -0.83 1.25 4.81 -1.42 -1.59 114.58 116.43 1b0k h GLU 22 Ca 0.13 0.02 0.20 0.00 -0.13 0.00 0.00 59.36 59.58 1b0k h GLU 22 Cb 0.25 0.07 -0.12 0.00 0.63 0.00 0.00 28.75 29.59 1b0k h GLU 22 CO -0.30 -0.22 0.27 -0.22 -0.73 0.00 0.00 179.01 177.81 1b0k h LYS 23 N -0.34 0.31 0.23 1.92 3.64 -1.39 -1.68 116.57 119.25 1b0k h LYS 23 Ca 0.01 -0.02 -0.33 0.00 -1.27 0.00 0.00 60.65 59.04 1b0k h LYS 23 Cb 0.33 -0.07 0.03 0.00 -0.41 0.00 0.00 32.23 32.11 1b0k h LYS 23 CO -0.06 0.20 -1.49 -0.91 -2.27 0.00 0.00 179.45 174.93 1b0k h ASN 24 N 0.32 0.75 -0.78 4.20 2.35 -1.44 -2.52 115.58 118.46 1b0k h ASN 24 Ca 0.50 -0.93 0.15 0.00 -0.55 0.00 0.00 56.30 55.47 1b0k h ASN 24 Cb 0.91 -0.24 -0.10 0.00 0.05 0.00 0.00 38.32 38.94 1b0k h ASN 24 CO -0.54 1.70 0.31 0.40 -1.65 0.00 0.00 177.43 177.66 1b0k h ILE 25 N 0.07 0.63 0.41 2.81 2.04 -1.01 -2.21 117.51 120.26 1b0k h ILE 25 Ca -0.27 -0.15 -0.02 0.00 1.00 0.00 0.00 64.86 65.42 1b0k h ILE 25 Cb 2.10 0.15 0.00 0.00 -0.74 0.00 0.00 36.82 38.33 1b0k h ILE 25 CO 0.24 0.08 -0.20 -0.78 0.00 0.00 0.00 178.15 177.49 1b0k h ASP 26 N 0.44 -0.47 -1.07 1.72 3.58 -1.30 -0.70 116.42 118.63 1b0k h ASP 26 Ca 0.43 -0.12 0.36 0.00 0.42 0.00 0.00 57.03 58.13 1b0k h ASP 26 Cb 0.68 0.12 -0.15 0.00 1.72 0.00 0.00 39.33 41.70 1b0k h ASP 26 CO -0.42 -0.09 0.63 0.40 -2.88 0.00 0.00 179.24 176.87 1b0k h ILE 27 N -0.90 0.21 0.03 2.25 2.04 -1.35 -2.73 117.51 117.05 1b0k h ILE 27 Ca -0.06 -0.07 -0.06 0.00 1.00 0.00 0.00 64.86 65.67 1b0k h ILE 27 Cb 0.56 -0.02 0.01 0.00 -0.74 0.00 0.00 36.82 36.62 1b0k h ILE 27 CO 0.09 0.04 -0.24 0.58 0.00 0.00 0.00 178.15 178.62 1b0k h VAL 28 N 0.21 1.63 0.00 1.67 2.07 -1.13 -3.23 116.25 117.48 1b0k h VAL 28 Ca 0.77 -2.18 0.00 0.00 0.82 0.00 0.00 66.70 66.11 1b0k h VAL 28 Cb 1.97 3.07 0.00 0.00 -1.52 0.00 0.00 31.29 34.81 1b0k h VAL 28 CO -0.59 0.59 0.00 0.08 0.02 0.00 0.00 177.57 177.67 1b0k h ARG 29 N -0.67 0.00 -0.01 1.57 0.11 -0.83 -1.18 114.38 113.36 1b0k h ARG 29 Ca -0.04 0.00 -0.19 0.00 0.10 0.00 0.00 59.98 59.85 1b0k h ARG 29 Cb 1.10 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 32.17 1b0k h ARG 29 CO 0.05 0.00 -0.85 0.87 0.10 0.00 0.00 179.97 180.13 1b0k h LYS 30 N 0.00 0.22 -0.04 0.08 6.56 -1.59 -0.55 116.57 121.24 1b0k h LYS 30 Ca 0.00 -0.23 -0.20 0.00 -1.06 0.00 0.00 60.65 59.16 1b0k h LYS 30 Cb 0.19 0.06 0.01 0.00 -0.57 0.00 0.00 32.23 31.92 1b0k h LYS 30 CO 0.00 0.95 -0.75 0.00 -2.06 0.00 0.00 179.45 177.58 1b0k h ARG 31 N 0.13 0.58 0.00 3.15 3.08 -1.26 -3.37 114.38 116.69 1b0k h ARG 31 Ca -0.04 -0.57 -0.10 0.00 0.07 0.00 0.00 59.98 59.33 1b0k h ARG 31 Cb 1.47 0.15 -0.02 0.00 0.08 0.00 0.00 29.97 31.65 1b0k h ARG 31 CO 0.13 1.19 -1.09 -0.07 -1.07 0.00 0.00 179.97 179.06 1b0k h LEU 32 N 0.19 0.00 -2.06 3.04 3.38 -1.41 -3.49 115.31 114.97 1b0k h LEU 32 Ca -0.08 0.00 -0.50 0.00 0.09 0.00 0.00 57.88 57.39 1b0k h LEU 32 Cb 1.42 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 42.12 1b0k h LEU 32 CO 0.15 0.37 -0.90 0.59 0.09 0.00 0.00 178.44 178.75 1b0k n ASN 33 N -2.89 -0.72 -3.57 -0.43 3.02 -0.21 -4.97 115.26 105.48 1b0k n ASN 33 Ca -0.05 -1.02 -0.11 0.00 -0.03 0.00 0.00 54.58 53.38 1b0k n ASN 33 Cb 0.73 -3.01 -0.03 0.00 -0.61 0.00 0.00 39.78 36.86 1b0k n ASN 33 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1b0k s ARG 34 N -6.55 1.28 0.38 3.52 1.70 -1.26 -5.12 118.95 112.91 1b0k s ARG 34 Ca 0.05 -0.64 -0.28 0.00 -0.47 0.00 0.00 55.73 54.39 1b0k s ARG 34 Cb -0.02 0.55 -0.11 0.00 -0.57 0.00 0.00 34.95 34.80 1b0k s ARG 34 CO 0.89 -0.55 1.47 -2.30 -1.08 0.00 0.00 175.30 173.73 1b0k n PRO 35 N -0.34 2.60 -4.37 3.89 -0.02 -1.26 -4.96 135.00 130.54 1b0k n PRO 35 Ca -0.14 0.91 -0.34 0.00 -2.02 0.00 0.00 63.50 61.90 1b0k n PRO 35 Cb 0.64 -2.64 -0.09 0.00 -0.02 0.00 0.00 33.50 31.38 1b0k n PRO 35 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1b0k s LEU 36 N -2.03 3.55 0.94 2.45 1.43 -1.26 -4.56 118.68 119.21 1b0k s LEU 36 Ca 0.54 0.11 -0.14 0.00 -1.03 0.00 0.00 54.13 53.61 1b0k s LEU 36 Cb -0.48 -1.85 0.20 0.00 0.03 0.00 0.00 46.19 44.08 1b0k s LEU 36 CO 0.63 0.36 1.29 0.42 0.23 0.00 0.00 176.35 179.28 1b0k s THR 37 N -0.92 2.01 0.16 5.49 -4.23 -1.26 -2.09 115.64 114.80 1b0k s THR 37 Ca 0.14 -0.08 -0.16 0.00 -1.18 0.00 0.00 61.69 60.42 1b0k s THR 37 Cb -0.11 -2.94 0.02 0.00 1.34 0.00 0.00 72.50 70.81 1b0k s THR 37 CO 0.04 0.00 1.81 0.25 -0.54 0.00 0.00 174.62 176.18 1b0k h LEU 38 N -1.54 0.44 -1.26 4.79 5.85 -1.91 -2.73 115.31 118.95 1b0k h LEU 38 Ca -0.43 -0.01 -0.08 0.00 0.84 0.00 0.00 57.88 58.21 1b0k h LEU 38 Cb 1.23 -0.10 -0.01 0.00 0.37 0.00 0.00 40.66 42.15 1b0k h LEU 38 CO 0.37 0.32 -0.35 0.77 -0.34 0.00 0.00 178.44 179.20 1b0k h SER 39 N 0.53 0.03 -0.52 1.25 4.64 -1.95 -2.47 113.55 115.06 1b0k h SER 39 Ca 0.15 -0.01 -0.07 0.00 -0.47 0.00 0.00 61.79 61.40 1b0k h SER 39 Cb -0.04 -0.01 -0.02 0.00 -0.31 0.00 0.00 62.40 62.03 1b0k h SER 39 CO -0.05 0.39 0.06 -0.33 -0.87 0.00 0.00 176.83 176.03 1b0k h GLU 40 N 0.03 0.88 0.08 4.77 5.08 -1.87 -0.60 114.58 122.95 1b0k h GLU 40 Ca 0.00 -0.25 -0.00 0.00 -1.00 0.00 0.00 59.36 58.11 1b0k h GLU 40 Cb 0.64 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.80 1b0k h GLU 40 CO 0.05 0.87 -0.04 0.87 -1.00 0.00 0.00 179.01 179.76 1b0k h LYS 41 N 0.75 -0.11 -0.29 2.33 1.57 -1.24 0.87 116.57 120.45 1b0k h LYS 41 Ca 0.15 0.01 -0.12 0.00 -1.87 0.00 0.00 60.65 58.82 1b0k h LYS 41 Cb 0.44 0.02 -0.00 0.00 0.08 0.00 0.00 32.23 32.77 1b0k h LYS 41 CO 0.02 -0.04 -0.28 0.82 -0.57 0.00 0.00 179.45 179.39 1b0k h ILE 42 N -0.14 1.30 0.24 1.86 2.04 -1.46 0.26 117.51 121.60 1b0k h ILE 42 Ca -0.01 -1.44 -0.01 0.00 1.00 0.00 0.00 64.86 64.40 1b0k h ILE 42 Cb 0.11 1.57 0.00 0.00 -0.74 0.00 0.00 36.82 37.77 1b0k h ILE 42 CO 0.02 0.46 -0.11 0.58 0.00 0.00 0.00 178.15 179.10 1b0k h VAL 43 N 0.44 0.83 0.00 1.67 2.07 -1.07 -3.04 116.25 117.16 1b0k h VAL 43 Ca 0.05 -0.57 -0.06 0.00 0.82 0.00 0.00 66.70 66.93 1b0k h VAL 43 Cb 0.84 1.15 -0.01 0.00 -1.52 0.00 0.00 31.29 31.76 1b0k h VAL 43 CO 0.07 0.12 -0.29 1.88 0.02 0.00 0.00 177.57 179.37 1b0k h TYR 44 N -0.62 0.00 0.00 1.57 0.05 -0.88 -1.32 116.97 115.76 1b0k h TYR 44 Ca -0.03 0.00 -0.01 0.00 0.05 0.00 0.00 58.73 58.74 1b0k h TYR 44 Cb 0.45 0.00 -0.00 0.00 1.01 0.00 0.00 36.73 38.18 1b0k h TYR 44 CO 0.02 0.29 -0.04 0.78 -1.05 0.00 0.00 178.16 178.16 1b0k h GLY 45 N 1.77 0.00 -2.95 3.88 0.00 -0.44 -2.68 103.07 102.64 1b0k h GLY 45 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1b0k h GLY 45 CO 0.04 0.00 0.00 1.42 0.00 0.00 0.00 176.54 178.00 1b0k n HIS 46 N -3.32 1.58 -2.56 5.60 8.25 -0.50 -4.51 115.22 119.76 1b0k n HIS 46 Ca -0.02 -0.56 -0.37 0.00 -0.26 0.00 0.00 57.72 56.51 1b0k n HIS 46 Cb 0.19 -0.39 -0.04 0.00 1.12 0.00 0.00 29.99 30.87 1b0k n HIS 46 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1b0k s LEU 47 N -2.07 4.23 0.17 2.41 1.43 -1.01 -1.96 118.68 121.88 1b0k s LEU 47 Ca 0.43 2.05 -0.07 0.00 -1.03 0.00 0.00 54.13 55.51 1b0k s LEU 47 Cb 0.32 -4.07 0.06 0.00 0.03 0.00 0.00 46.19 42.53 1b0k s LEU 47 CO 0.14 -0.39 1.53 -0.78 0.23 0.00 0.00 176.35 177.08 1b0k h ASP 48 N 2.79 0.86 -2.91 2.29 3.58 -1.56 -3.38 116.42 118.09 1b0k h ASP 48 Ca -0.48 -0.38 -0.60 0.00 0.42 0.00 0.00 57.03 55.99 1b0k h ASP 48 Cb 1.21 -0.24 -0.40 0.00 1.72 0.00 0.00 39.33 41.62 1b0k h ASP 48 CO 0.63 1.14 -0.79 -0.62 -2.88 0.00 0.00 179.24 176.72 1b0k s ASP 49 N -6.84 3.07 0.39 2.28 -1.08 -1.26 -4.98 116.67 108.26 1b0k s ASP 49 Ca -0.10 -3.05 0.06 0.00 -0.52 0.00 0.00 52.55 48.94 1b0k s ASP 49 Cb 0.12 -0.91 0.79 0.00 -1.46 0.00 0.00 42.92 41.45 1b0k s ASP 49 CO 0.86 -0.19 2.02 1.55 0.52 0.00 0.00 175.17 179.93 1b0k h PRO 50 N 6.03 0.65 -0.36 4.34 0.13 -1.92 -1.75 132.00 139.12 1b0k h PRO 50 Ca 0.14 -0.04 -0.12 0.00 -0.87 0.00 0.00 66.00 65.11 1b0k h PRO 50 Cb 0.88 -0.15 -0.01 0.00 0.13 0.00 0.00 31.00 31.86 1b0k h PRO 50 CO 0.48 0.43 -0.24 0.00 -0.23 0.00 0.00 178.00 178.45 1b0k h ALA 51 N 1.67 0.51 0.00 -0.56 0.00 -1.93 -3.37 119.26 115.58 1b0k h ALA 51 Ca 0.22 -0.38 0.00 0.00 0.00 0.00 0.00 54.91 54.74 1b0k h ALA 51 Cb 0.04 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.71 1b0k h ALA 51 CO -0.06 0.50 -1.15 0.09 0.00 0.00 0.00 179.25 178.63 1b0k n ASN 52 N -4.24 0.86 -4.65 0.00 3.02 -0.93 -4.96 115.26 104.36 1b0k n ASN 52 Ca -0.02 -0.60 -0.43 0.00 -0.03 0.00 0.00 54.58 53.50 1b0k n ASN 52 Cb 0.45 1.28 -0.03 0.00 -0.61 0.00 0.00 39.78 40.86 1b0k n ASN 52 CO 0.00 0.00 0.00 1.67 -2.62 0.00 0.00 177.26 176.31 1b0k n GLN 53 N -1.65 2.59 -2.18 3.52 -0.06 -0.70 -4.95 117.38 113.95 1b0k n GLN 53 Ca 0.01 0.92 -0.42 0.00 -2.00 0.00 0.00 57.00 55.50 1b0k n GLN 53 Cb 0.33 -2.99 -0.03 0.00 -4.06 0.00 0.00 30.24 23.50 1b0k n GLN 53 CO 0.00 0.00 0.00 -1.21 -0.20 0.00 0.00 177.06 175.65 1b0k s GLU 54 N 4.77 4.24 -0.24 3.69 2.02 -1.26 -4.99 118.70 126.91 1b0k s GLU 54 Ca 0.92 1.99 -0.03 0.00 0.02 0.00 0.00 54.97 57.87 1b0k s GLU 54 Cb -0.46 -3.75 0.01 0.00 0.10 0.00 0.00 34.13 30.03 1b0k s GLU 54 CO 0.43 -0.70 -0.04 0.42 0.02 0.00 0.00 175.26 175.38 1b0k s ILE 55 N 3.17 3.10 -0.17 -1.63 1.01 -1.26 -4.70 121.20 120.72 1b0k s ILE 55 Ca 0.65 -0.84 -0.05 0.00 0.00 0.00 0.00 60.65 60.42 1b0k s ILE 55 Cb -0.30 -2.53 0.08 0.00 0.01 0.00 0.00 42.46 39.73 1b0k s ILE 55 CO 0.25 0.26 0.29 -1.61 0.00 0.00 0.00 174.94 174.13 1b0k s GLU 56 N 1.39 0.21 0.21 2.79 0.41 -1.26 -4.99 118.70 117.46 1b0k s GLU 56 Ca 0.02 0.65 -0.32 0.00 -0.41 0.00 0.00 54.97 54.91 1b0k s GLU 56 Cb -0.16 -0.28 -0.12 0.00 -1.78 0.00 0.00 34.13 31.79 1b0k s GLU 56 CO -0.04 -0.41 1.69 0.54 -0.49 0.00 0.00 175.26 176.55 1b0k n ARG 57 N 5.35 2.68 -0.68 1.61 1.74 -1.26 -1.18 116.66 124.92 1b0k n ARG 57 Ca -0.06 0.96 0.00 0.00 -0.77 0.00 0.00 57.85 57.99 1b0k n ARG 57 Cb 0.50 -2.79 0.00 0.00 -1.02 0.00 0.00 32.46 29.14 1b0k n ARG 57 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1b0k n GLY 58 N 3.67 1.09 0.70 -0.13 0.00 0.66 -4.83 105.19 106.34 1b0k n GLY 58 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.17 1b0k n GLY 58 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1b0k n LYS 59 N -2.00 0.00 -2.65 1.61 5.02 -0.33 -4.88 118.16 114.93 1b0k n LYS 59 Ca 0.00 0.00 -0.27 0.00 -2.02 0.00 0.00 58.31 56.02 1b0k n LYS 59 Cb 0.00 -0.65 0.01 0.00 -0.02 0.00 0.00 35.03 34.37 1b0k n LYS 59 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 1b0k s THR 60 N -1.99 4.62 -0.19 -0.18 -4.23 -1.01 -4.90 115.64 107.75 1b0k s THR 60 Ca 0.00 0.08 -0.05 0.00 -1.18 0.00 0.00 61.69 60.53 1b0k s THR 60 Cb 0.00 -3.76 -0.03 0.00 1.34 0.00 0.00 72.50 70.05 1b0k s THR 60 CO 0.00 -0.73 0.01 -0.31 -0.54 0.00 0.00 174.62 173.05 1b0k s TYR 61 N -2.75 3.08 -0.07 3.99 2.02 -1.26 -0.53 117.35 121.82 1b0k s TYR 61 Ca 0.48 -0.32 -0.15 0.00 -0.37 0.00 0.00 57.07 56.71 1b0k s TYR 61 Cb -0.10 -2.07 -0.05 0.00 -0.40 0.00 0.00 41.96 39.34 1b0k s TYR 61 CO 0.44 -0.14 0.38 -0.51 -1.57 0.00 0.00 175.55 174.16 1b0k s LEU 62 N 0.81 4.37 -0.39 -1.29 1.43 -0.19 -4.91 118.68 118.52 1b0k s LEU 62 Ca 0.01 0.80 -0.14 0.00 -1.03 0.00 0.00 54.13 53.77 1b0k s LEU 62 Cb -0.14 -2.54 0.01 0.00 0.03 0.00 0.00 46.19 43.55 1b0k s LEU 62 CO 0.02 0.21 0.29 -0.13 0.23 0.00 0.00 176.35 176.97 1b0k s ARG 63 N -0.35 3.15 0.33 1.70 0.52 -1.26 -1.05 118.95 121.99 1b0k s ARG 63 Ca 0.22 -0.88 0.09 0.00 -0.52 0.00 0.00 55.73 54.64 1b0k s ARG 63 Cb -0.15 -3.92 -0.05 0.00 0.52 0.00 0.00 34.95 31.35 1b0k s ARG 63 CO 0.10 -0.65 0.08 -0.51 0.02 0.00 0.00 175.30 174.34 1b0k s LEU 64 N 1.72 3.18 -0.42 2.53 1.43 -0.14 -1.49 118.68 125.50 1b0k s LEU 64 Ca 0.06 -0.80 0.03 0.00 -1.03 0.00 0.00 54.13 52.38 1b0k s LEU 64 Cb -0.18 -1.64 0.12 0.00 0.03 0.00 0.00 46.19 44.52 1b0k s LEU 64 CO 0.10 -0.23 0.17 -0.13 0.23 0.00 0.00 176.35 176.50 1b0k s ARG 65 N -3.78 1.46 0.59 1.70 1.81 -0.83 -1.25 118.95 118.65 1b0k s ARG 65 Ca 0.36 -2.01 -0.20 0.00 -1.72 0.00 0.00 55.73 52.16 1b0k s ARG 65 Cb -0.03 -2.82 -0.03 0.00 -0.45 0.00 0.00 34.95 31.63 1b0k s ARG 65 CO 0.21 -1.06 1.30 -2.14 -0.68 0.00 0.00 175.30 172.94 1b0k s PRO 66 N 0.51 2.91 0.05 3.54 0.02 -1.26 -4.93 135.00 135.84 1b0k s PRO 66 Ca 0.14 2.09 0.09 0.00 0.02 0.00 0.00 61.00 63.35 1b0k s PRO 66 Cb -0.22 -2.05 -0.22 0.00 0.02 0.00 0.00 34.50 32.02 1b0k s PRO 66 CO -0.06 -1.33 1.01 -0.44 -0.33 0.00 0.00 177.00 175.86 1b0k h ASP 67 N 1.04 0.01 -5.02 2.53 3.32 -1.37 -3.49 116.42 113.44 1b0k h ASP 67 Ca -0.51 -0.01 0.02 0.00 0.02 0.00 0.00 57.03 56.55 1b0k h ASP 67 Cb 1.31 -0.00 -0.09 0.00 0.22 0.00 0.00 39.33 40.77 1b0k h ASP 67 CO 0.55 1.01 0.19 0.00 -1.72 0.00 0.00 179.24 179.27 1b0k s ARG 68 N -2.66 1.51 -0.07 3.56 1.70 -1.25 -4.36 118.95 117.38 1b0k s ARG 68 Ca -0.02 -0.75 0.04 0.00 -0.47 0.00 0.00 55.73 54.53 1b0k s ARG 68 Cb 0.09 0.59 0.00 0.00 -0.57 0.00 0.00 34.95 35.06 1b0k s ARG 68 CO 0.82 -0.67 -0.19 0.08 -1.08 0.00 0.00 175.30 174.26 1b0k s VAL 69 N -3.84 1.60 0.02 4.99 1.01 -0.81 -2.64 120.40 120.72 1b0k s VAL 69 Ca 0.07 -0.77 0.07 0.00 0.00 0.00 0.00 61.98 61.35 1b0k s VAL 69 Cb -0.03 -1.39 -0.02 0.00 0.00 0.00 0.00 36.38 34.94 1b0k s VAL 69 CO -0.03 0.46 -0.21 0.00 0.00 0.00 0.00 175.10 175.31 1b0k s ALA 70 N 0.30 1.81 0.01 5.51 0.00 -0.98 -1.84 121.76 126.57 1b0k s ALA 70 Ca -0.12 -1.02 0.05 0.00 0.00 0.00 0.00 51.96 50.87 1b0k s ALA 70 Cb -0.15 -0.40 -0.02 0.00 0.00 0.00 0.00 23.12 22.56 1b0k s ALA 70 CO 0.05 0.42 -0.15 -1.64 0.00 0.00 0.00 175.76 174.44 1b0k s MET 71 N -0.91 1.11 0.34 0.00 -1.94 0.66 -1.56 119.30 117.00 1b0k s MET 71 Ca 0.08 -0.64 0.06 0.00 -1.71 0.00 0.00 55.69 53.48 1b0k s MET 71 Cb -0.09 -1.10 -0.01 0.00 2.01 0.00 0.00 34.83 35.65 1b0k s MET 71 CO 0.01 0.29 0.48 1.14 -0.01 0.00 0.00 175.02 176.93 1b0k s GLN 72 N -0.70 3.11 0.34 2.03 1.03 -1.26 -0.79 119.66 123.42 1b0k s GLN 72 Ca 0.04 -0.99 0.26 0.00 0.04 0.00 0.00 55.36 54.71 1b0k s GLN 72 Cb -0.07 -2.81 0.77 0.00 0.03 0.00 0.00 33.01 30.94 1b0k s GLN 72 CO 0.00 0.04 1.74 0.38 -2.54 0.00 0.00 175.29 174.92 1b0k h ASP 73 N 0.86 0.00 1.21 12.60 2.03 -1.51 -1.16 116.42 130.45 1b0k h ASP 73 Ca -0.46 0.00 -0.07 0.00 -0.73 0.00 0.00 57.03 55.78 1b0k h ASP 73 Cb 1.26 0.00 -0.01 0.00 -0.83 0.00 0.00 39.33 39.75 1b0k h ASP 73 CO 0.53 0.00 -0.32 0.00 -1.03 0.00 0.00 179.24 178.42 1b0k h ALA 74 N 2.24 0.89 -0.00 4.15 0.00 -1.95 -3.34 119.26 121.25 1b0k h ALA 74 Ca 0.00 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.62 1b0k h ALA 74 Cb 0.73 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.47 1b0k h ALA 74 CO 0.00 0.40 -0.44 0.25 0.00 0.00 0.00 179.25 179.46 1b0k n THR 75 N -3.32 0.00 0.16 0.00 -2.24 -1.07 -4.61 114.28 103.20 1b0k n THR 75 Ca 0.01 -0.28 0.02 0.00 -2.27 0.00 0.00 64.05 61.53 1b0k n THR 75 Cb 0.56 1.02 0.23 0.00 -2.10 0.00 0.00 70.33 70.04 1b0k n THR 75 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1b0k h ALA 76 N 1.46 0.96 -0.02 6.98 0.00 -1.33 -2.60 119.26 124.70 1b0k h ALA 76 Ca 0.00 -0.47 -0.00 0.00 0.00 0.00 0.00 54.91 54.44 1b0k h ALA 76 Cb 0.25 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 17.96 1b0k h ALA 76 CO 0.00 0.64 0.01 1.96 0.00 0.00 0.00 179.25 181.86 1b0k h GLN 77 N 0.00 0.03 -0.01 0.00 4.20 -1.82 -1.53 115.11 115.99 1b0k h GLN 77 Ca -0.01 -0.00 -0.17 0.00 0.06 0.00 0.00 58.65 58.53 1b0k h GLN 77 Cb 1.03 -0.01 -0.02 0.00 0.30 0.00 0.00 27.48 28.79 1b0k h GLN 77 CO 0.07 0.12 -0.79 1.98 -0.67 0.00 0.00 178.83 179.54 1b0k h MET 78 N -0.06 0.11 -0.50 1.46 4.05 -1.69 -0.18 114.93 118.13 1b0k h MET 78 Ca 0.01 -0.11 -0.03 0.00 -0.28 0.00 0.00 59.70 59.28 1b0k h MET 78 Cb 0.09 0.03 -0.02 0.00 -0.80 0.00 0.00 31.60 30.90 1b0k h MET 78 CO -0.00 0.84 0.18 0.00 0.23 0.00 0.00 176.91 178.16 1b0k h ALA 79 N 1.12 0.65 -0.53 0.39 0.00 -1.28 -2.42 119.26 117.19 1b0k h ALA 79 Ca -0.02 -0.17 -0.12 0.00 0.00 0.00 0.00 54.91 54.60 1b0k h ALA 79 Cb 1.38 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.96 1b0k h ALA 79 CO 0.11 0.28 -0.13 0.52 0.00 0.00 0.00 179.25 180.02 1b0k h MET 80 N 0.66 1.02 -0.46 0.00 2.07 -1.22 -0.99 114.93 116.01 1b0k h MET 80 Ca 0.16 -0.39 -0.01 0.00 -2.07 0.00 0.00 59.70 57.39 1b0k h MET 80 Cb 0.23 -0.06 -0.02 0.00 -1.87 0.00 0.00 31.60 29.88 1b0k h MET 80 CO -0.01 1.07 0.25 -0.07 1.07 0.00 0.00 176.91 179.22 1b0k h LEU 81 N 0.90 0.56 -0.60 1.22 3.38 -0.98 0.55 115.31 120.32 1b0k h LEU 81 Ca 0.13 -0.04 -0.15 0.00 0.09 0.00 0.00 57.88 57.92 1b0k h LEU 81 Cb 0.70 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.30 1b0k h LEU 81 CO 0.05 0.46 -0.67 1.56 0.09 0.00 0.00 178.44 179.93 1b0k h GLN 82 N 0.64 0.14 -0.46 1.13 4.20 -1.26 -2.75 115.11 116.74 1b0k h GLN 82 Ca 0.16 -0.11 -0.05 0.00 0.06 0.00 0.00 58.65 58.71 1b0k h GLN 82 Cb 0.03 0.02 -0.02 0.00 0.30 0.00 0.00 27.48 27.81 1b0k h GLN 82 CO -0.03 0.76 0.08 0.35 -0.67 0.00 0.00 178.83 179.32 1b0k h PHE 83 N 0.10 0.81 -0.73 2.96 3.57 -0.44 -2.58 116.94 120.62 1b0k h PHE 83 Ca -0.01 -0.11 0.08 0.00 3.53 0.00 0.00 57.97 61.46 1b0k h PHE 83 Cb 1.20 -0.22 -0.07 0.00 2.79 0.00 0.00 35.95 39.65 1b0k h PHE 83 CO 0.01 0.75 0.39 0.82 -2.23 0.00 0.00 178.31 178.06 1b0k h ILE 84 N 0.63 0.90 0.00 1.41 2.04 -0.90 -2.18 117.51 119.41 1b0k h ILE 84 Ca 0.14 -0.23 -0.01 0.00 1.00 0.00 0.00 64.86 65.75 1b0k h ILE 84 Cb 0.37 0.16 -0.00 0.00 -0.74 0.00 0.00 36.82 36.61 1b0k h ILE 84 CO 0.01 0.12 -0.07 0.28 0.00 0.00 0.00 178.15 178.49 1b0k h SER 85 N 0.68 0.00 -0.10 1.72 0.02 -1.16 -3.02 113.55 111.69 1b0k h SER 85 Ca 0.35 0.00 -0.09 0.00 -0.84 0.00 0.00 61.79 61.21 1b0k h SER 85 Cb 0.32 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.85 1b0k h SER 85 CO -0.24 0.07 -0.22 0.77 -1.14 0.00 0.00 176.83 176.07 1b0k h SER 86 N 0.00 0.52 0.00 3.07 4.64 -1.05 -3.47 113.55 117.25 1b0k h SER 86 Ca -0.00 -0.17 0.00 0.00 -0.47 0.00 0.00 61.79 61.15 1b0k h SER 86 Cb 0.43 -0.14 0.00 0.00 -0.31 0.00 0.00 62.40 62.38 1b0k h SER 86 CO 0.01 0.74 0.00 0.61 -0.87 0.00 0.00 176.83 177.32 1b0k n GLY 87 N -0.42 0.53 3.75 -0.77 0.00 -1.14 -4.92 105.19 102.22 1b0k n GLY 87 Ca -0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 1b0k n GLY 87 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1b0k s LEU 88 N 0.00 4.51 0.22 0.99 1.43 -1.26 -5.00 118.68 119.57 1b0k s LEU 88 Ca 0.00 2.22 0.10 0.00 -1.03 0.00 0.00 54.13 55.42 1b0k s LEU 88 Cb 0.00 -3.62 0.16 0.00 0.03 0.00 0.00 46.19 42.76 1b0k s LEU 88 CO 0.00 -0.23 1.49 1.55 0.23 0.00 0.00 176.35 179.39 1b0k h PRO 89 N 4.54 0.00 -3.28 1.29 0.13 -1.97 -3.48 132.00 129.23 1b0k h PRO 89 Ca -0.45 0.00 -0.12 0.00 -0.87 0.00 0.00 66.00 64.55 1b0k h PRO 89 Cb 1.21 0.00 -0.20 0.00 0.13 0.00 0.00 31.00 32.15 1b0k h PRO 89 CO 0.70 0.74 -0.36 0.21 -0.23 0.00 0.00 178.00 179.06 1b0k s LYS 90 N -3.25 0.62 0.24 0.86 2.47 -1.26 -4.57 119.74 114.84 1b0k s LYS 90 Ca -0.00 -0.34 -0.30 0.00 -1.56 0.00 0.00 55.97 53.77 1b0k s LYS 90 Cb 0.11 0.27 -0.09 0.00 -1.46 0.00 0.00 37.83 36.66 1b0k s LYS 90 CO 0.78 -0.17 1.15 0.14 0.16 0.00 0.00 175.35 177.41 1b0k s VAL 91 N -1.58 3.49 -1.59 4.02 -7.23 -0.33 -4.86 120.40 112.33 1b0k s VAL 91 Ca -0.12 1.38 0.27 0.00 -1.81 0.00 0.00 61.98 61.69 1b0k s VAL 91 Cb -0.05 -3.88 0.28 0.00 0.56 0.00 0.00 36.38 33.29 1b0k s VAL 91 CO 0.02 0.28 1.64 0.00 -0.31 0.00 0.00 175.10 176.73 1b0k n ALA 92 N 1.79 3.03 -2.35 1.32 0.00 0.49 -4.90 120.51 119.89 1b0k n ALA 92 Ca 0.01 -0.35 -0.13 0.00 0.00 0.00 0.00 53.44 52.98 1b0k n ALA 92 Cb 0.45 -1.20 -0.10 0.00 0.00 0.00 0.00 19.45 18.59 1b0k n ALA 92 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 1b0k s VAL 93 N -2.59 0.89 -0.21 0.00 -7.23 -1.26 -4.96 120.40 105.04 1b0k s VAL 93 Ca 0.23 -1.79 -0.37 0.00 -1.81 0.00 0.00 61.98 58.24 1b0k s VAL 93 Cb 0.19 -1.53 -0.13 0.00 0.56 0.00 0.00 36.38 35.47 1b0k s VAL 93 CO 0.53 -0.69 1.85 -2.65 -0.31 0.00 0.00 175.10 173.84 1b0k n PRO 94 N 0.25 1.60 -4.37 4.82 -0.02 -1.26 -4.85 135.00 131.17 1b0k n PRO 94 Ca -0.14 0.58 -0.22 0.00 -2.02 0.00 0.00 63.50 61.70 1b0k n PRO 94 Cb 0.59 -2.38 -0.13 0.00 -0.02 0.00 0.00 33.50 31.56 1b0k n PRO 94 CO 0.00 0.00 0.00 -1.12 1.98 0.00 0.00 175.50 176.36 1b0k s SER 95 N 4.20 2.09 0.10 2.55 0.01 -1.26 -1.91 113.70 119.47 1b0k s SER 95 Ca 0.97 -0.56 0.04 0.00 1.31 0.00 0.00 55.95 57.71 1b0k s SER 95 Cb -0.88 -0.13 -0.04 0.00 0.21 0.00 0.00 66.02 65.19 1b0k s SER 95 CO 0.58 0.05 -0.11 0.42 0.41 0.00 0.00 173.24 174.59 1b0k s THR 96 N -1.00 1.01 -0.04 1.44 -4.23 -0.77 -1.92 115.64 110.13 1b0k s THR 96 Ca 0.04 -1.60 0.07 0.00 -1.18 0.00 0.00 61.69 59.01 1b0k s THR 96 Cb -0.09 -1.33 -0.01 0.00 1.34 0.00 0.00 72.50 72.40 1b0k s THR 96 CO 0.02 -0.50 -0.25 -0.63 -0.54 0.00 0.00 174.62 172.72 1b0k s ILE 97 N -2.25 2.04 -0.12 2.99 1.01 -0.27 -0.24 121.20 124.36 1b0k s ILE 97 Ca 0.05 -1.08 0.02 0.00 0.00 0.00 0.00 60.65 59.64 1b0k s ILE 97 Cb -0.04 -1.71 0.01 0.00 0.01 0.00 0.00 42.46 40.73 1b0k s ILE 97 CO 0.01 0.57 -0.18 -1.00 0.00 0.00 0.00 174.94 174.34 1b0k s HIS 98 N -0.36 2.21 -0.85 3.97 3.76 0.03 -0.72 115.29 123.33 1b0k s HIS 98 Ca 0.02 -1.06 -0.09 0.00 -0.15 0.00 0.00 55.06 53.79 1b0k s HIS 98 Cb -0.12 -1.55 0.22 0.00 1.11 0.00 0.00 32.58 32.23 1b0k s HIS 98 CO 0.02 -0.51 0.77 0.00 -0.85 0.00 0.00 174.74 174.17 1b0k n ASP 100 N 3.38 3.93 0.04 0.00 5.75 -1.26 -4.01 116.55 124.37 1b0k n ASP 100 Ca 0.16 -0.06 0.05 0.00 -0.01 0.00 0.00 54.79 54.93 1b0k n ASP 100 Cb 0.42 0.91 -0.07 0.00 -1.03 0.00 0.00 41.12 41.34 1b0k n ASP 100 CO 0.00 0.00 0.00 1.41 -0.11 0.00 0.00 177.20 178.50 1b0k n HIS 101 N -1.30 0.77 -0.70 2.11 8.25 -1.26 -1.61 115.22 121.48 1b0k n HIS 101 Ca 0.00 0.24 0.06 0.00 -0.26 0.00 0.00 57.72 57.77 1b0k n HIS 101 Cb 0.00 -0.95 0.37 0.00 1.12 0.00 0.00 29.99 30.52 1b0k n HIS 101 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 1b0k n LEU 102 N -2.71 5.26 -4.17 2.41 4.77 -1.26 -4.72 117.00 116.57 1b0k n LEU 102 Ca -0.07 -2.67 -0.38 0.00 -0.03 0.00 0.00 56.01 52.86 1b0k n LEU 102 Cb 0.72 -0.67 -0.11 0.00 -2.33 0.00 0.00 43.42 41.04 1b0k n LEU 102 CO 0.42 0.60 -0.15 -0.63 -1.33 0.00 0.00 177.39 176.30 1b0k s ILE 103 N -2.56 3.60 0.17 -0.08 1.01 -1.26 -4.90 121.20 117.17 1b0k s ILE 103 Ca 0.49 -1.81 -0.30 0.00 0.00 0.00 0.00 60.65 59.03 1b0k s ILE 103 Cb 0.37 -3.36 -0.08 0.00 0.01 0.00 0.00 42.46 39.41 1b0k s ILE 103 CO 0.15 -0.61 1.19 -0.70 0.00 0.00 0.00 174.94 174.97 1b0k s GLU 104 N 1.25 4.49 -0.21 2.79 2.12 -1.26 -4.26 118.70 123.62 1b0k s GLU 104 Ca 0.05 1.85 -0.23 0.00 0.36 0.00 0.00 54.97 57.00 1b0k s GLU 104 Cb -0.23 -3.26 -0.01 0.00 0.26 0.00 0.00 34.13 30.89 1b0k s GLU 104 CO -0.02 -0.11 0.76 0.00 -0.54 0.00 0.00 175.26 175.36 1b0k s ALA 105 N 0.10 3.58 0.19 6.30 0.00 -0.04 -4.81 121.76 127.08 1b0k s ALA 105 Ca 0.54 -0.14 0.00 0.00 0.00 0.00 0.00 51.96 52.35 1b0k s ALA 105 Cb -0.32 -3.17 0.00 0.00 0.00 0.00 0.00 23.12 19.63 1b0k s ALA 105 CO 0.35 -0.74 0.00 0.94 0.00 0.00 0.00 175.76 176.32 1b0k n GLN 106 N 5.50 0.00 -0.02 0.00 7.27 -1.26 -1.05 117.38 127.81 1b0k n GLN 106 Ca 0.03 0.00 0.04 0.00 0.07 0.00 0.00 57.00 57.14 1b0k n GLN 106 Cb 0.49 0.00 -0.13 0.00 2.41 0.00 0.00 30.24 33.01 1b0k n GLN 106 CO 0.00 0.00 0.00 1.28 0.07 0.00 0.00 177.06 178.41 1b0k n LEU 107 N -3.00 0.00 0.00 1.69 4.32 -1.26 -5.02 117.00 113.73 1b0k n LEU 107 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.99 1b0k n LEU 107 Cb 0.00 0.09 0.00 0.00 -1.62 0.00 0.00 43.42 41.89 1b0k n LEU 107 CO 0.00 0.09 0.00 0.61 -1.22 0.00 0.00 177.39 176.87 1b0k n GLY 108 N 1.70 2.21 5.80 -0.72 0.00 -1.26 -4.90 105.19 108.01 1b0k n GLY 108 Ca -0.08 -1.86 0.00 0.00 0.00 0.00 0.00 46.02 44.08 1b0k n GLY 108 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1b0k n GLY 109 N 1.98 1.63 0.17 -0.02 0.00 0.41 -2.75 105.19 106.62 1b0k n GLY 109 Ca 0.00 0.39 0.09 0.00 0.00 0.00 0.00 46.02 46.51 1b0k n GLY 109 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 1b0k h GLU 110 N 0.00 0.00 0.31 1.61 -0.00 -1.93 -3.10 114.58 111.47 1b0k h GLU 110 Ca 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 59.36 59.35 1b0k h GLU 110 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 28.75 1b0k h GLU 110 CO 0.00 0.11 -0.16 0.87 -0.00 0.00 0.00 179.01 179.83 1b0k h LYS 111 N 0.00 -0.42 -0.74 1.06 1.57 -1.89 -2.38 116.57 113.77 1b0k h LYS 111 Ca -0.01 0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.80 1b0k h LYS 111 Cb 1.11 0.09 -0.04 0.00 0.08 0.00 0.00 32.23 33.48 1b0k h LYS 111 CO 0.02 -0.28 0.48 -0.44 -0.57 0.00 0.00 179.45 178.65 1b0k h ASP 112 N -0.43 0.86 -0.25 0.86 3.32 -1.62 -2.11 116.42 117.04 1b0k h ASP 112 Ca -0.04 -0.03 -0.01 0.00 0.02 0.00 0.00 57.03 56.98 1b0k h ASP 112 Cb 0.34 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.67 1b0k h ASP 112 CO 0.06 0.63 0.13 0.25 -1.72 0.00 0.00 179.24 178.59 1b0k h LEU 113 N 1.01 0.32 -0.40 1.55 5.85 -1.51 -0.56 115.31 121.56 1b0k h LEU 113 Ca 0.27 -0.10 0.08 0.00 0.84 0.00 0.00 57.88 58.96 1b0k h LEU 113 Cb -0.09 -0.08 -0.07 0.00 0.37 0.00 0.00 40.66 40.78 1b0k h LEU 113 CO -0.06 0.33 -0.02 0.03 -0.34 0.00 0.00 178.44 178.39 1b0k h ARG 114 N 0.29 0.08 -0.22 1.25 3.08 -1.26 -1.44 114.38 116.16 1b0k h ARG 114 Ca 0.09 -0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.12 1b0k h ARG 114 Cb 0.09 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.11 1b0k h ARG 114 CO -0.01 0.05 0.08 -0.09 -1.07 0.00 0.00 179.97 178.93 1b0k h ARG 115 N 0.08 0.33 -0.77 0.04 2.43 -1.33 -2.90 114.38 112.27 1b0k h ARG 115 Ca 0.20 -0.06 0.12 0.00 -0.81 0.00 0.00 59.98 59.42 1b0k h ARG 115 Cb 0.29 -0.05 -0.05 0.00 -0.42 0.00 0.00 29.97 29.74 1b0k h ARG 115 CO -0.35 0.40 0.50 0.00 -1.51 0.00 0.00 179.97 179.01 1b0k h ALA 116 N 0.91 1.92 0.00 2.80 0.00 -0.86 -2.05 119.26 121.98 1b0k h ALA 116 Ca 0.07 -0.00 -0.10 0.00 0.00 0.00 0.00 54.91 54.88 1b0k h ALA 116 Cb 0.20 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 1b0k h ALA 116 CO -0.00 -0.10 -0.48 0.87 0.00 0.00 0.00 179.25 179.53 1b0k h LYS 117 N 0.58 0.00 0.10 0.00 1.57 -1.14 -2.23 116.57 115.45 1b0k h LYS 117 Ca 0.37 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 59.14 1b0k h LYS 117 Cb 0.62 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.93 1b0k h LYS 117 CO -0.13 0.48 -0.05 0.22 -0.57 0.00 0.00 179.45 179.40 1b0k h ASP 118 N 0.00 -0.11 -0.99 0.86 3.58 -1.22 -3.16 116.42 115.37 1b0k h ASP 118 Ca -0.00 0.00 0.29 0.00 0.42 0.00 0.00 57.03 57.74 1b0k h ASP 118 Cb 1.02 0.03 -0.14 0.00 1.72 0.00 0.00 39.33 41.96 1b0k h ASP 118 CO 0.06 0.04 0.56 0.40 -2.88 0.00 0.00 179.24 177.42 1b0k h ILE 119 N -0.38 0.39 -0.49 2.25 2.04 -1.48 -2.80 117.51 117.05 1b0k h ILE 119 Ca -0.01 -0.14 0.00 0.00 1.00 0.00 0.00 64.86 65.70 1b0k h ILE 119 Cb 0.10 -0.06 0.00 0.00 -0.74 0.00 0.00 36.82 36.12 1b0k h ILE 119 CO 0.02 0.08 0.00 0.59 0.00 0.00 0.00 178.15 178.84 1b0k n ASN 120 N -5.00 3.32 -0.34 1.72 3.02 -0.84 -4.71 115.26 112.43 1b0k n ASN 120 Ca 0.29 -1.99 0.20 0.00 -0.03 0.00 0.00 54.58 53.04 1b0k n ASN 120 Cb 0.87 -0.33 0.42 0.00 -0.61 0.00 0.00 39.78 40.13 1b0k n ASN 120 CO 0.00 0.00 0.00 -0.61 -2.62 0.00 0.00 177.26 174.03 1b0k h GLN 121 N 2.95 0.50 -0.84 3.52 4.15 -1.46 -0.69 115.11 123.23 1b0k h GLN 121 Ca 0.00 -0.03 0.11 0.00 0.77 0.00 0.00 58.65 59.50 1b0k h GLN 121 Cb 0.83 -0.11 -0.08 0.00 0.21 0.00 0.00 27.48 28.33 1b0k h GLN 121 CO 0.00 0.33 0.48 1.49 -1.93 0.00 0.00 178.83 179.19 1b0k h GLU 122 N 0.51 0.74 0.07 1.69 4.81 -1.85 0.73 114.58 121.29 1b0k h GLU 122 Ca 0.66 -0.04 -0.17 0.00 -0.13 0.00 0.00 59.36 59.68 1b0k h GLU 122 Cb 1.36 -0.17 0.02 0.00 0.63 0.00 0.00 28.75 30.58 1b0k h GLU 122 CO -0.48 0.49 -0.69 0.28 -0.73 0.00 0.00 179.01 177.89 1b0k h VAL 123 N 0.77 1.48 -0.08 0.32 2.07 -1.51 -2.22 116.25 117.08 1b0k h VAL 123 Ca 0.42 -2.31 -0.09 0.00 0.82 0.00 0.00 66.70 65.55 1b0k h VAL 123 Cb 0.44 2.92 -0.01 0.00 -1.52 0.00 0.00 31.29 33.12 1b0k h VAL 123 CO -0.28 0.66 -0.34 1.88 0.02 0.00 0.00 177.57 179.51 1b0k h TYR 124 N -0.26 0.17 -0.59 1.57 0.05 -1.36 -1.31 116.97 115.24 1b0k h TYR 124 Ca -0.11 -0.04 -0.10 0.00 0.05 0.00 0.00 58.73 58.54 1b0k h TYR 124 Cb 1.47 -0.04 -0.02 0.00 1.01 0.00 0.00 36.73 39.14 1b0k h TYR 124 CO 0.17 0.48 -0.01 -0.97 -1.05 0.00 0.00 178.16 176.78 1b0k h ASN 125 N 0.13 1.03 0.17 3.88 -1.24 -0.86 0.40 115.58 119.09 1b0k h ASN 125 Ca 0.02 -0.31 -0.01 0.00 0.71 0.00 0.00 56.30 56.71 1b0k h ASN 125 Cb 0.67 -0.28 0.00 0.00 0.73 0.00 0.00 38.32 39.45 1b0k h ASN 125 CO 0.05 1.09 -0.08 0.15 -1.29 0.00 0.00 177.43 177.34 1b0k h PHE 126 N 0.94 -0.22 -0.02 0.67 3.57 -0.79 -2.60 116.94 118.48 1b0k h PHE 126 Ca 0.17 -0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.66 1b0k h PHE 126 Cb 0.57 0.07 -0.00 0.00 2.79 0.00 0.00 35.95 39.38 1b0k h PHE 126 CO 0.04 -0.03 0.01 -0.07 -2.23 0.00 0.00 178.31 176.04 1b0k h LEU 127 N -0.37 0.03 -0.74 0.59 3.38 -1.22 -0.68 115.31 116.29 1b0k h LEU 127 Ca -0.02 -0.13 0.14 0.00 0.09 0.00 0.00 57.88 57.96 1b0k h LEU 127 Cb 0.29 -0.01 -0.10 0.00 0.09 0.00 0.00 40.66 40.94 1b0k h LEU 127 CO 0.04 0.15 0.28 0.00 0.09 0.00 0.00 178.44 179.00 1b0k h ALA 128 N 0.88 1.03 -0.01 1.53 0.00 -0.99 0.16 119.26 121.85 1b0k h ALA 128 Ca 0.01 0.12 -0.23 0.00 0.00 0.00 0.00 54.91 54.81 1b0k h ALA 128 Cb 0.13 0.10 0.01 0.00 0.00 0.00 0.00 17.79 18.03 1b0k h ALA 128 CO -0.00 -0.23 -0.94 1.15 0.00 0.00 0.00 179.25 179.23 1b0k h THR 129 N 0.42 1.37 -0.26 0.00 2.02 -1.28 -0.26 112.91 114.92 1b0k h THR 129 Ca 0.41 -2.37 -0.13 0.00 0.77 0.00 0.00 66.41 65.09 1b0k h THR 129 Cb 0.62 2.37 -0.01 0.00 -1.74 0.00 0.00 68.15 69.39 1b0k h THR 129 CO -0.41 0.71 -0.37 0.00 0.37 0.00 0.00 175.52 175.83 1b0k h ALA 130 N 0.68 0.87 0.61 6.16 0.00 -0.96 -2.40 119.26 124.23 1b0k h ALA 130 Ca -0.09 -0.42 -0.03 0.00 0.00 0.00 0.00 54.91 54.38 1b0k h ALA 130 Cb 1.58 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 19.25 1b0k h ALA 130 CO 0.17 0.63 -0.36 0.78 0.00 0.00 0.00 179.25 180.47 1b0k h GLY 131 N 1.03 -1.07 0.55 0.00 0.00 -0.46 -2.03 103.07 101.10 1b0k h GLY 131 Ca 0.05 0.43 0.15 0.00 0.00 0.00 0.00 47.33 47.96 1b0k h GLY 131 CO 0.07 -0.37 0.56 0.00 0.00 0.00 0.00 176.54 176.81 1b0k h ALA 132 N -1.40 1.91 -0.26 3.60 0.00 -1.05 -2.14 119.26 119.91 1b0k h ALA 132 Ca -0.08 0.01 -0.18 0.00 0.00 0.00 0.00 54.91 54.66 1b0k h ALA 132 Cb 0.72 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.41 1b0k h ALA 132 CO 0.09 -0.15 -0.53 -0.22 0.00 0.00 0.00 179.25 178.45 1b0k h LYS 133 N 0.62 0.82 -0.12 0.00 3.64 -1.31 -3.35 116.57 116.86 1b0k h LYS 133 Ca 0.43 -0.53 0.00 0.00 -1.27 0.00 0.00 60.65 59.28 1b0k h LYS 133 Cb 0.77 0.07 0.00 0.00 -0.41 0.00 0.00 32.23 32.66 1b0k h LYS 133 CO -0.18 1.16 0.00 0.66 -2.27 0.00 0.00 179.45 178.82 1b0k n TYR 134 N -4.06 0.13 -1.21 1.91 4.01 -0.78 -4.84 117.16 112.33 1b0k n TYR 134 Ca -0.05 -0.08 0.00 0.00 -0.16 0.00 0.00 57.90 57.61 1b0k n TYR 134 Cb 0.62 -0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.64 1b0k n TYR 134 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1b0k n GLY 135 N 1.22 0.66 3.20 2.72 0.00 -0.94 -1.19 105.19 110.86 1b0k n GLY 135 Ca 0.14 -0.31 -0.29 0.00 0.00 0.00 0.00 46.02 45.56 1b0k n GLY 135 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1b0k s VAL 136 N -2.28 1.75 0.50 1.61 1.01 -0.85 -4.66 120.40 117.48 1b0k s VAL 136 Ca 0.00 -0.89 -0.18 0.00 0.00 0.00 0.00 61.98 60.90 1b0k s VAL 136 Cb 0.00 -1.50 -0.08 0.00 0.00 0.00 0.00 36.38 34.80 1b0k s VAL 136 CO 0.00 0.49 1.00 -0.83 0.00 0.00 0.00 175.10 175.76 1b0k s GLY 137 N -0.01 2.24 -0.08 4.51 0.00 -0.81 -4.28 107.32 108.90 1b0k s GLY 137 Ca -0.05 0.35 0.01 0.00 0.00 0.00 0.00 44.72 45.02 1b0k s GLY 137 CO 0.03 0.64 -0.08 -0.12 0.00 0.00 0.00 173.10 173.58 1b0k s PHE 138 N -2.37 1.24 -0.31 1.90 5.36 -0.89 -1.12 117.98 121.79 1b0k s PHE 138 Ca 0.62 -0.50 -0.10 0.00 -0.96 0.00 0.00 56.93 55.99 1b0k s PHE 138 Cb -0.12 -1.02 -0.01 0.00 -0.34 0.00 0.00 43.02 41.54 1b0k s PHE 138 CO 0.25 -0.35 0.16 -1.58 -1.46 0.00 0.00 175.22 172.24 1b0k s TRP 139 N 1.22 3.18 0.84 10.12 0.52 0.11 -1.29 118.94 133.64 1b0k s TRP 139 Ca -0.05 -0.49 -0.11 0.00 0.02 0.00 0.00 56.10 55.47 1b0k s TRP 139 Cb -0.14 -2.36 0.10 0.00 -1.15 0.00 0.00 33.47 29.92 1b0k s TRP 139 CO -0.02 -0.42 1.13 1.03 0.02 0.00 0.00 176.95 178.68 1b0k s ARG 140 N 1.63 1.65 -0.02 4.98 0.52 -0.55 -2.45 118.95 124.72 1b0k s ARG 140 Ca 0.05 1.39 -0.37 0.00 -0.52 0.00 0.00 55.73 56.29 1b0k s ARG 140 Cb -0.17 -1.81 -0.15 0.00 0.52 0.00 0.00 34.95 33.34 1b0k s ARG 140 CO 0.07 -2.13 1.56 -0.35 0.02 0.00 0.00 175.30 174.46 1b0k n PRO 141 N -3.81 1.46 0.00 3.54 -0.04 -1.26 -2.07 135.00 132.83 1b0k n PRO 141 Ca 0.11 0.53 0.00 0.00 -0.04 0.00 0.00 63.50 64.10 1b0k n PRO 141 Cb 0.52 -2.23 0.00 0.00 -0.04 0.00 0.00 33.50 31.75 1b0k n PRO 141 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1b0k n GLY 142 N 3.36 1.38 0.24 0.55 0.00 -1.26 -4.98 105.19 104.49 1b0k n GLY 142 Ca 0.21 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.24 1b0k n GLY 142 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1b0k h SER 143 N 1.23 -0.26 -2.66 1.61 4.64 -1.68 -3.39 113.55 113.03 1b0k h SER 143 Ca 0.00 0.16 0.00 0.00 -0.47 0.00 0.00 61.79 61.48 1b0k h SER 143 Cb 0.00 0.27 0.00 0.00 -0.31 0.00 0.00 62.40 62.36 1b0k h SER 143 CO 0.00 -0.12 0.00 0.61 -0.87 0.00 0.00 176.83 176.45 1b0k n GLY 144 N -1.37 1.27 3.72 -0.77 0.00 -1.23 -1.25 105.19 105.56 1b0k n GLY 144 Ca 0.10 -1.66 -0.42 0.00 0.00 0.00 0.00 46.02 44.04 1b0k n GLY 144 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1b0k s ILE 145 N -1.58 3.66 0.54 -0.61 1.01 -0.69 -4.49 121.20 119.04 1b0k s ILE 145 Ca 0.00 1.26 0.44 0.00 0.00 0.00 0.00 60.65 62.36 1b0k s ILE 145 Cb 0.00 -3.81 0.66 0.00 0.01 0.00 0.00 42.46 39.32 1b0k s ILE 145 CO 0.00 0.14 1.65 -0.29 0.00 0.00 0.00 174.94 176.44 1b0k h ILE 146 N 4.15 0.15 0.02 2.92 2.10 -1.92 -1.93 117.51 123.00 1b0k h ILE 146 Ca -0.43 -0.00 -0.29 0.00 1.08 0.00 0.00 64.86 65.21 1b0k h ILE 146 Cb 1.21 0.13 -0.04 0.00 -1.09 0.00 0.00 36.82 37.03 1b0k h ILE 146 CO 0.80 0.00 -1.67 0.45 -1.08 0.00 0.00 178.15 176.65 1b0k h HIS 147 N 0.01 0.09 -0.10 2.19 3.86 -1.94 -1.68 115.15 117.57 1b0k h HIS 147 Ca 0.81 -0.06 -0.03 0.00 -1.16 0.00 0.00 60.37 59.93 1b0k h HIS 147 Cb 3.19 -0.00 -0.00 0.00 1.06 0.00 0.00 27.41 31.65 1b0k h HIS 147 CO -0.00 1.12 -0.06 0.37 0.86 0.00 0.00 177.93 180.22 1b0k h GLN 148 N 0.01 0.22 -0.70 2.45 5.75 -1.63 -1.65 115.11 119.56 1b0k h GLN 148 Ca -0.28 -0.10 0.08 0.00 -0.15 0.00 0.00 58.65 58.21 1b0k h GLN 148 Cb 2.00 -0.00 -0.04 0.00 1.07 0.00 0.00 27.48 30.50 1b0k h GLN 148 CO 0.09 0.59 0.46 0.82 -2.65 0.00 0.00 178.83 178.14 1b0k h ILE 149 N -0.15 0.96 0.03 2.39 1.08 -1.58 -0.17 117.51 120.06 1b0k h ILE 149 Ca 0.02 -0.21 -0.00 0.00 -0.39 0.00 0.00 64.86 64.28 1b0k h ILE 149 Cb 0.53 0.28 0.00 0.00 -3.07 0.00 0.00 36.82 34.55 1b0k h ILE 149 CO 0.02 0.11 -0.01 0.40 -0.69 0.00 0.00 178.15 177.98 1b0k h ILE 150 N 0.62 1.41 -0.85 -0.67 2.04 -1.27 -2.28 117.51 116.52 1b0k h ILE 150 Ca 0.31 -1.49 0.01 0.00 1.00 0.00 0.00 64.86 64.69 1b0k h ILE 150 Cb 0.41 2.39 -0.04 0.00 -0.74 0.00 0.00 36.82 38.84 1b0k h ILE 150 CO -0.11 0.37 0.55 0.25 0.00 0.00 0.00 178.15 179.22 1b0k h LEU 151 N -0.70 0.98 -1.88 1.44 5.85 -1.06 0.16 115.31 120.10 1b0k h LEU 151 Ca -0.00 -0.03 -0.01 0.00 0.84 0.00 0.00 57.88 58.67 1b0k h LEU 151 Cb 0.64 -0.25 -0.00 0.00 0.37 0.00 0.00 40.66 41.42 1b0k h LEU 151 CO 0.01 0.72 -0.07 -0.33 -0.34 0.00 0.00 178.44 178.43 1b0k h GLU 152 N 1.15 0.00 0.00 1.25 5.08 -1.12 -3.41 114.58 117.53 1b0k h GLU 152 Ca 0.31 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.67 1b0k h GLU 152 Cb -0.11 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.14 1b0k h GLU 152 CO -0.06 0.07 -0.20 0.09 -1.00 0.00 0.00 179.01 177.90 1b0k n ASN 153 N -3.31 1.01 -0.00 1.42 3.02 -0.55 -4.93 115.26 111.92 1b0k n ASN 153 Ca -0.01 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.54 1b0k n ASN 153 Cb 0.25 0.11 -0.01 0.00 -0.61 0.00 0.00 39.78 39.52 1b0k n ASN 153 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 1b0k n TYR 154 N -0.77 0.00 -2.46 3.10 4.01 0.47 -4.71 117.16 116.80 1b0k n TYR 154 Ca 0.00 0.00 -0.42 0.00 -0.16 0.00 0.00 57.90 57.32 1b0k n TYR 154 Cb 0.09 -0.04 -0.03 0.00 -0.31 0.00 0.00 39.34 39.05 1b0k n TYR 154 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1b0k s ALA 155 N -2.08 3.37 0.05 -0.72 0.00 -0.90 -4.99 121.76 116.48 1b0k s ALA 155 Ca -0.01 0.80 -0.12 0.00 0.00 0.00 0.00 51.96 52.64 1b0k s ALA 155 Cb 0.01 -3.44 0.01 0.00 0.00 0.00 0.00 23.12 19.71 1b0k s ALA 155 CO 0.06 -0.42 0.27 1.52 0.00 0.00 0.00 175.76 177.19 1b0k s TYR 156 N 1.10 -0.04 -0.41 0.00 -0.85 -1.26 -4.96 117.35 110.92 1b0k s TYR 156 Ca 0.58 -0.15 -0.46 0.00 -0.52 0.00 0.00 57.07 56.52 1b0k s TYR 156 Cb -0.28 0.06 -0.20 0.00 0.38 0.00 0.00 41.96 41.91 1b0k s TYR 156 CO 0.29 -0.50 1.51 -2.30 -1.52 0.00 0.00 175.55 173.03 1b0k n PRO 157 N 0.50 0.01 -0.70 -3.49 -0.02 -0.55 -1.99 135.00 128.75 1b0k n PRO 157 Ca -0.18 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.30 1b0k n PRO 157 Cb 0.60 -1.50 0.00 0.00 -0.02 0.00 0.00 33.50 32.57 1b0k n PRO 157 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1b0k n GLY 158 N 3.56 0.90 3.79 -1.23 0.00 -0.87 -4.89 105.19 106.46 1b0k n GLY 158 Ca 0.29 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.97 1b0k n GLY 158 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1b0k s VAL 159 N -3.43 3.61 -0.27 1.61 0.11 -0.84 -4.87 120.40 116.32 1b0k s VAL 159 Ca 0.00 0.98 0.03 0.00 -2.93 0.00 0.00 61.98 60.06 1b0k s VAL 159 Cb 0.00 -3.39 0.06 0.00 -1.53 0.00 0.00 36.38 31.52 1b0k s VAL 159 CO 0.00 -0.24 -0.09 -0.22 -3.33 0.00 0.00 175.10 171.22 1b0k s LEU 160 N -3.68 3.62 -0.05 2.54 2.96 -1.26 -0.87 118.68 121.94 1b0k s LEU 160 Ca 0.68 -1.48 0.04 0.00 -0.22 0.00 0.00 54.13 53.15 1b0k s LEU 160 Cb -0.18 -1.56 0.00 0.00 0.50 0.00 0.00 46.19 44.94 1b0k s LEU 160 CO 0.24 -0.21 -0.16 -0.22 -1.32 0.00 0.00 176.35 174.67 1b0k s LEU 161 N 1.08 1.86 -0.04 -0.68 0.20 -0.01 -0.79 118.68 120.30 1b0k s LEU 161 Ca -0.07 -0.34 0.03 0.00 0.69 0.00 0.00 54.13 54.45 1b0k s LEU 161 Cb -0.20 -0.93 -0.03 0.00 -0.43 0.00 0.00 46.19 44.60 1b0k s LEU 161 CO -0.05 0.12 -0.12 0.27 -0.29 0.00 0.00 176.35 176.27 1b0k s ILE 162 N 0.21 3.23 0.04 6.68 -4.36 -1.08 -1.39 121.20 124.53 1b0k s ILE 162 Ca -0.07 -0.73 0.05 0.00 -0.26 0.00 0.00 60.65 59.64 1b0k s ILE 162 Cb -0.13 -2.30 -0.02 0.00 1.25 0.00 0.00 42.46 41.26 1b0k s ILE 162 CO 0.03 0.54 -0.15 -0.83 0.24 0.00 0.00 174.94 174.77 1b0k s GLY 163 N -0.90 0.85 -1.30 6.27 0.00 -0.85 -2.32 107.32 109.06 1b0k s GLY 163 Ca 0.13 -0.88 -0.14 0.00 0.00 0.00 0.00 44.72 43.83 1b0k s GLY 163 CO 0.02 -0.86 1.79 -1.30 0.00 0.00 0.00 173.10 172.76 1b0k n THR 164 N 1.81 4.03 -3.65 0.90 -2.24 -0.60 -1.39 114.28 113.14 1b0k n THR 164 Ca -0.18 -4.13 -0.02 0.00 -2.27 0.00 0.00 64.05 57.45 1b0k n THR 164 Cb 0.54 -2.44 -0.07 0.00 -2.10 0.00 0.00 70.33 66.27 1b0k n THR 164 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1b0k s ASP 165 N 2.75 -0.07 0.39 3.42 -1.08 -1.24 -4.29 116.67 116.55 1b0k s ASP 165 Ca 0.46 0.13 0.25 0.00 -0.52 0.00 0.00 52.55 52.86 1b0k s ASP 165 Cb 0.06 0.31 0.59 0.00 -1.46 0.00 0.00 42.92 42.42 1b0k s ASP 165 CO 0.00 -0.02 1.70 0.77 0.52 0.00 0.00 175.17 178.14 1b0k h SER 166 N 3.58 0.00 -0.16 -0.34 4.64 -1.87 -2.77 113.55 116.63 1b0k h SER 166 Ca -0.27 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.05 1b0k h SER 166 Cb 1.19 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.28 1b0k h SER 166 CO 0.19 0.00 0.00 1.41 -0.87 0.00 0.00 176.83 177.56 1b0k n HIS 167 N -2.87 0.44 0.27 4.77 8.25 -1.26 -4.40 115.22 120.42 1b0k n HIS 167 Ca 0.04 -0.16 0.11 0.00 -0.26 0.00 0.00 57.72 57.45 1b0k n HIS 167 Cb 0.47 -0.14 0.76 0.00 1.12 0.00 0.00 29.99 32.20 1b0k n HIS 167 CO 0.00 0.00 0.00 1.15 0.64 0.00 0.00 176.34 178.13 1b0k h THR 168 N 1.04 0.76 -0.25 1.59 2.02 -1.81 -2.94 112.91 113.32 1b0k h THR 168 Ca 0.00 -0.12 0.07 0.00 0.77 0.00 0.00 66.41 67.13 1b0k h THR 168 Cb 0.67 1.07 -0.01 0.00 -1.74 0.00 0.00 68.15 68.14 1b0k h THR 168 CO 0.08 0.03 0.86 -0.65 0.37 0.00 0.00 175.52 176.21 1b0k h PRO 169 N 0.00 0.00 -1.17 6.66 0.11 -1.71 -2.70 132.00 133.19 1b0k h PRO 169 Ca -0.00 0.00 0.39 0.00 0.11 0.00 0.00 66.00 66.50 1b0k h PRO 169 Cb 0.07 0.00 -0.14 0.00 0.11 0.00 0.00 31.00 31.04 1b0k h PRO 169 CO 0.00 0.00 0.72 -0.97 -0.21 0.00 0.00 178.00 177.54 1b0k h ASN 170 N 0.00 0.34 -0.02 -2.05 -1.24 -1.72 0.12 115.58 111.01 1b0k h ASN 170 Ca 0.12 0.17 0.01 0.00 0.71 0.00 0.00 56.30 57.30 1b0k h ASN 170 Cb 1.83 0.14 -0.00 0.00 0.73 0.00 0.00 38.32 41.02 1b0k h ASN 170 CO -0.00 -0.19 0.04 1.23 -1.29 0.00 0.00 177.43 177.21 1b0k h GLY 171 N 0.16 0.00 1.72 1.57 0.00 -1.78 -2.19 103.07 102.55 1b0k h GLY 171 Ca 0.79 0.00 0.01 0.00 0.00 0.00 0.00 47.33 48.13 1b0k h GLY 171 CO -0.51 0.00 0.13 -1.33 0.00 0.00 0.00 176.54 174.82 1b0k h GLY 172 N 0.00 0.00 2.00 4.60 0.00 -0.85 -1.49 103.07 107.33 1b0k h GLY 172 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.34 1b0k h GLY 172 CO -0.00 0.00 0.00 -1.33 0.00 0.00 0.00 176.54 175.21 1b0k h GLY 173 N 0.00 0.00 -1.22 4.60 0.00 -1.58 -2.42 103.07 102.45 1b0k h GLY 173 Ca 0.02 0.00 -0.05 0.00 0.00 0.00 0.00 47.33 47.30 1b0k h GLY 173 CO -0.00 0.00 -0.33 -0.10 0.00 0.00 0.00 176.54 176.11 1b0k n LEU 174 N -2.85 3.10 -0.02 3.11 7.94 -0.56 -4.63 117.00 123.09 1b0k n LEU 174 Ca -0.03 -3.78 -0.00 0.00 -1.11 0.00 0.00 56.01 51.09 1b0k n LEU 174 Cb 0.06 -0.55 -0.00 0.00 0.53 0.00 0.00 43.42 43.46 1b0k n LEU 174 CO 0.17 1.29 -0.00 0.61 -1.11 0.00 0.00 177.39 178.35 1b0k n GLY 175 N -1.13 0.42 3.80 -3.96 0.00 -0.94 -1.48 105.19 101.89 1b0k n GLY 175 Ca 0.23 -0.87 -0.22 0.00 0.00 0.00 0.00 46.02 45.16 1b0k n GLY 175 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1b0k s GLY 176 N -2.80 1.58 -0.60 -0.02 0.00 -1.25 -2.05 107.32 102.19 1b0k s GLY 176 Ca 0.00 -1.55 -0.18 0.00 0.00 0.00 0.00 44.72 42.99 1b0k s GLY 176 CO 0.00 -1.55 0.68 -0.42 0.00 0.00 0.00 173.10 171.81 1b0k s ILE 177 N -2.23 4.92 -0.28 0.90 -1.09 -0.05 -3.77 121.20 119.60 1b0k s ILE 177 Ca 0.35 -1.16 -0.05 0.00 -2.23 0.00 0.00 60.65 57.56 1b0k s ILE 177 Cb -0.07 -4.47 0.01 0.00 -1.58 0.00 0.00 42.46 36.36 1b0k s ILE 177 CO 0.25 -1.08 0.04 0.00 -1.23 0.00 0.00 174.94 172.91 1b0k s ILE 179 N 1.44 2.05 0.19 0.00 1.01 -0.48 -2.65 121.20 122.76 1b0k s ILE 179 Ca 0.02 -1.08 -0.29 0.00 0.00 0.00 0.00 60.65 59.30 1b0k s ILE 179 Cb -0.17 -1.73 -0.08 0.00 0.01 0.00 0.00 42.46 40.49 1b0k s ILE 179 CO 0.00 0.57 0.92 -0.83 0.00 0.00 0.00 174.94 175.60 1b0k s GLY 180 N -0.25 3.05 0.31 6.18 0.00 -1.26 -2.01 107.32 113.35 1b0k s GLY 180 Ca -0.01 0.56 0.06 0.00 0.00 0.00 0.00 44.72 45.33 1b0k s GLY 180 CO 0.03 1.21 0.22 3.33 0.00 0.00 0.00 173.10 177.89 1b0k n VAL 181 N 1.86 0.00 -4.13 1.40 0.24 -0.49 -4.90 118.33 112.32 1b0k n VAL 181 Ca -0.01 -2.15 -0.23 0.00 -2.04 0.00 0.00 64.34 59.90 1b0k n VAL 181 Cb 0.48 1.00 -0.05 0.00 -1.47 0.00 0.00 33.84 33.80 1b0k n VAL 181 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 1b0k s GLY 182 N -3.11 1.54 0.32 7.63 0.00 -1.26 -3.66 107.32 108.78 1b0k s GLY 182 Ca 0.31 -1.38 0.10 0.00 0.00 0.00 0.00 44.72 43.75 1b0k s GLY 182 CO 0.22 -1.41 1.63 -1.33 0.00 0.00 0.00 173.10 172.21 1b0k h GLY 183 N 1.86 1.75 2.00 0.20 0.00 -1.87 0.46 103.07 107.47 1b0k h GLY 183 Ca -0.48 -0.09 -0.04 0.00 0.00 0.00 0.00 47.33 46.71 1b0k h GLY 183 CO 0.61 -0.52 -0.21 0.00 0.00 0.00 0.00 176.54 176.42 1b0k h ALA 184 N 1.88 1.10 -0.13 3.60 0.00 -1.93 -2.22 119.26 121.55 1b0k h ALA 184 Ca 0.68 -0.19 -0.07 0.00 0.00 0.00 0.00 54.91 55.32 1b0k h ALA 184 Cb 1.53 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 19.29 1b0k h ALA 184 CO -0.70 0.27 -0.20 -0.44 0.00 0.00 0.00 179.25 178.18 1b0k h ASP 185 N 0.00 0.41 -0.73 0.00 5.19 -1.31 -3.04 116.42 116.94 1b0k h ASP 185 Ca -0.00 -0.52 0.03 0.00 -0.62 0.00 0.00 57.03 55.92 1b0k h ASP 185 Cb 0.64 -0.12 -0.05 0.00 0.18 0.00 0.00 39.33 39.99 1b0k h ASP 185 CO 0.03 0.85 0.46 0.00 -3.12 0.00 0.00 179.24 177.46 1b0k h ALA 186 N 0.57 0.96 -0.64 3.45 0.00 -1.38 -2.90 119.26 119.31 1b0k h ALA 186 Ca 0.01 -0.03 0.12 0.00 0.00 0.00 0.00 54.91 55.02 1b0k h ALA 186 Cb 0.76 -0.24 -0.09 0.00 0.00 0.00 0.00 17.79 18.22 1b0k h ALA 186 CO 0.05 0.25 0.18 0.28 0.00 0.00 0.00 179.25 180.00 1b0k h VAL 187 N 0.90 0.66 -0.48 0.00 2.07 -1.44 -0.17 116.25 117.79 1b0k h VAL 187 Ca 0.29 -0.11 0.08 0.00 0.82 0.00 0.00 66.70 67.79 1b0k h VAL 187 Cb 0.02 0.31 -0.07 0.00 -1.52 0.00 0.00 31.29 30.02 1b0k h VAL 187 CO -0.11 0.06 0.06 0.44 0.02 0.00 0.00 177.57 178.04 1b0k h ASP 188 N 0.32 -0.07 0.28 0.57 3.32 -1.39 0.12 116.42 119.57 1b0k h ASP 188 Ca 0.34 0.09 -0.22 0.00 0.02 0.00 0.00 57.03 57.27 1b0k h ASP 188 Cb 0.50 0.15 0.00 0.00 0.22 0.00 0.00 39.33 40.20 1b0k h ASP 188 CO -0.39 -0.00 -0.89 0.58 -1.72 0.00 0.00 179.24 176.81 1b0k h VAL 189 N 0.19 1.39 -0.16 -1.35 2.07 -1.52 -0.10 116.25 116.77 1b0k h VAL 189 Ca 0.24 -2.34 -0.03 0.00 0.82 0.00 0.00 66.70 65.39 1b0k h VAL 189 Cb 0.33 2.32 -0.01 0.00 -1.52 0.00 0.00 31.29 32.42 1b0k h VAL 189 CO -0.34 0.70 -0.04 0.24 0.02 0.00 0.00 177.57 178.16 1b0k h MET 190 N 0.26 0.23 0.00 1.57 2.86 -0.72 -2.66 114.93 116.47 1b0k h MET 190 Ca -0.07 -0.04 0.00 0.00 -2.06 0.00 0.00 59.70 57.54 1b0k h MET 190 Cb 1.51 -0.04 0.00 0.00 0.06 0.00 0.00 31.60 33.13 1b0k h MET 190 CO 0.16 0.28 -0.31 0.00 1.06 0.00 0.00 176.91 178.09 1b0k n ALA 191 N -2.50 3.05 -0.22 6.32 0.00 0.37 -0.38 120.51 127.16 1b0k n ALA 191 Ca -0.01 -0.25 0.00 0.00 0.00 0.00 0.00 53.44 53.19 1b0k n ALA 191 Cb 0.19 -1.26 0.00 0.00 0.00 0.00 0.00 19.45 18.39 1b0k n ALA 191 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1b0k n GLY 192 N 1.49 0.89 3.97 0.00 0.00 -0.68 -4.89 105.19 105.96 1b0k n GLY 192 Ca 0.06 -0.03 -0.21 0.00 0.00 0.00 0.00 46.02 45.84 1b0k n GLY 192 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1b0k s ILE 193 N -2.00 5.26 0.13 -0.61 -4.36 -0.13 -5.01 121.20 114.48 1b0k s ILE 193 Ca 0.00 -0.98 -0.35 0.00 -0.26 0.00 0.00 60.65 59.06 1b0k s ILE 193 Cb 0.00 -3.86 -0.15 0.00 1.25 0.00 0.00 42.46 39.71 1b0k s ILE 193 CO 0.00 -0.32 1.53 -2.65 0.24 0.00 0.00 174.94 173.73 1b0k n PRO 194 N -1.39 1.88 -3.21 0.37 -0.02 -1.26 -4.33 135.00 127.04 1b0k n PRO 194 Ca -0.09 0.68 -0.39 0.00 -2.02 0.00 0.00 63.50 61.68 1b0k n PRO 194 Cb 0.57 -2.41 -0.06 0.00 -0.02 0.00 0.00 33.50 31.58 1b0k n PRO 194 CO 0.00 0.00 0.00 -0.46 1.98 0.00 0.00 175.50 177.02 1b0k s TRP 195 N 0.94 3.63 -0.14 6.00 -0.00 -0.38 -4.81 118.94 124.18 1b0k s TRP 195 Ca 0.81 1.14 -0.07 0.00 -0.00 0.00 0.00 56.10 57.99 1b0k s TRP 195 Cb -0.76 -2.62 -0.04 0.00 -0.00 0.00 0.00 33.47 30.05 1b0k s TRP 195 CO 0.41 0.28 0.09 -1.21 -0.00 0.00 0.00 176.95 176.53 1b0k s GLU 196 N 0.10 3.58 -0.02 5.86 2.02 -1.26 -0.97 118.70 128.02 1b0k s GLU 196 Ca 0.31 -0.24 0.04 0.00 0.02 0.00 0.00 54.97 55.09 1b0k s GLU 196 Cb -0.17 -3.15 -0.01 0.00 0.10 0.00 0.00 34.13 30.90 1b0k s GLU 196 CO 0.16 0.59 -0.12 -1.17 0.02 0.00 0.00 175.26 174.73 1b0k s LEU 197 N -0.50 1.96 0.14 1.80 2.96 -0.21 -4.95 118.68 119.88 1b0k s LEU 197 Ca 0.11 -0.23 -0.31 0.00 -0.22 0.00 0.00 54.13 53.48 1b0k s LEU 197 Cb -0.12 -0.66 -0.09 0.00 0.50 0.00 0.00 46.19 45.82 1b0k s LEU 197 CO 0.02 0.13 1.51 -0.75 -1.32 0.00 0.00 176.35 175.94 1b0k s LYS 198 N -0.14 4.25 0.04 1.98 2.47 -1.26 -1.02 119.74 126.05 1b0k s LYS 198 Ca 0.02 2.25 -0.31 0.00 -1.56 0.00 0.00 55.97 56.37 1b0k s LYS 198 Cb -0.06 -3.22 -0.10 0.00 -1.46 0.00 0.00 37.83 32.98 1b0k s LYS 198 CO 0.00 -0.55 1.91 0.00 0.16 0.00 0.00 175.35 176.87 1b0k s PRO 200 N 3.87 3.16 0.88 0.00 0.04 -1.26 -0.25 135.00 141.44 1b0k s PRO 200 Ca 0.88 0.27 -0.11 0.00 0.04 0.00 0.00 61.00 62.08 1b0k s PRO 200 Cb -0.50 -2.21 0.17 0.00 0.04 0.00 0.00 34.50 32.00 1b0k s PRO 200 CO 0.43 -0.64 1.22 0.15 0.04 0.00 0.00 177.00 178.19 1b0k s LYS 201 N -5.05 1.01 -0.04 4.56 -0.14 -0.70 -4.16 119.74 115.21 1b0k s LYS 201 Ca 0.54 -0.61 -0.01 0.00 -1.36 0.00 0.00 55.97 54.52 1b0k s LYS 201 Cb -0.11 -2.00 0.03 0.00 -1.68 0.00 0.00 37.83 34.07 1b0k s LYS 201 CO 0.48 -2.09 0.03 0.08 -0.76 0.00 0.00 175.35 173.09 1b0k s VAL 202 N -3.65 0.06 -0.17 3.17 1.01 -1.26 -1.42 120.40 118.15 1b0k s VAL 202 Ca 0.71 0.24 -0.06 0.00 0.00 0.00 0.00 61.98 62.87 1b0k s VAL 202 Cb -0.04 -0.23 -0.04 0.00 0.00 0.00 0.00 36.38 36.07 1b0k s VAL 202 CO 0.50 0.16 0.05 -0.63 0.00 0.00 0.00 175.10 175.18 1b0k s ILE 203 N 1.57 4.67 -0.15 2.22 1.01 -0.74 -0.36 121.20 129.43 1b0k s ILE 203 Ca -0.02 -0.08 -0.06 0.00 0.00 0.00 0.00 60.65 60.49 1b0k s ILE 203 Cb -0.13 -3.08 -0.04 0.00 0.01 0.00 0.00 42.46 39.22 1b0k s ILE 203 CO -0.03 0.49 0.05 -0.83 0.00 0.00 0.00 174.94 174.62 1b0k s GLY 204 N 0.16 1.92 -0.20 6.18 0.00 0.02 -1.07 107.32 114.33 1b0k s GLY 204 Ca 0.04 -0.75 -0.05 0.00 0.00 0.00 0.00 44.72 43.96 1b0k s GLY 204 CO 0.01 -0.16 0.01 0.14 0.00 0.00 0.00 173.10 173.10 1b0k s VAL 205 N -0.12 4.06 -0.27 1.40 1.01 -0.75 -1.34 120.40 124.40 1b0k s VAL 205 Ca 0.06 -0.28 -0.13 0.00 0.00 0.00 0.00 61.98 61.64 1b0k s VAL 205 Cb -0.12 -2.83 -0.04 0.00 0.00 0.00 0.00 36.38 33.38 1b0k s VAL 205 CO 0.01 0.43 0.27 -0.75 0.00 0.00 0.00 175.10 175.07 1b0k s LYS 206 N 0.92 4.01 -0.09 2.72 2.20 0.35 -1.99 119.74 127.85 1b0k s LYS 206 Ca 0.01 -0.14 -0.09 0.00 -0.36 0.00 0.00 55.97 55.40 1b0k s LYS 206 Cb -0.14 -3.64 -0.04 0.00 -1.51 0.00 0.00 37.83 32.50 1b0k s LYS 206 CO 0.02 -0.18 0.22 -0.51 -0.36 0.00 0.00 175.35 174.53 1b0k s LEU 207 N 1.77 4.41 0.05 5.43 1.43 0.21 -0.48 118.68 131.49 1b0k s LEU 207 Ca 0.11 0.60 0.02 0.00 -1.03 0.00 0.00 54.13 53.82 1b0k s LEU 207 Cb -0.16 -2.22 -0.03 0.00 0.03 0.00 0.00 46.19 43.82 1b0k s LEU 207 CO 0.10 0.37 -0.06 -0.89 0.23 0.00 0.00 176.35 176.10 1b0k s THR 208 N -0.97 0.46 0.00 5.49 2.01 -0.21 -1.10 115.64 121.33 1b0k s THR 208 Ca 0.17 -1.20 0.00 0.00 0.31 0.00 0.00 61.69 60.97 1b0k s THR 208 Cb -0.13 -0.73 0.00 0.00 0.01 0.00 0.00 72.50 71.64 1b0k s THR 208 CO 0.06 -0.51 0.00 0.61 -0.69 0.00 0.00 174.62 174.10 1b0k n GLY 209 N 1.21 -1.61 3.13 4.40 0.00 -1.26 0.10 105.19 111.16 1b0k n GLY 209 Ca -0.21 -1.40 -0.12 0.00 0.00 0.00 0.00 46.02 44.29 1b0k n GLY 209 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1b0k s SER 210 N -4.00 -0.18 0.18 1.61 1.04 -1.26 -4.13 113.70 106.96 1b0k s SER 210 Ca 0.00 0.28 -0.33 0.00 0.48 0.00 0.00 55.95 56.37 1b0k s SER 210 Cb 0.00 0.40 -0.14 0.00 0.10 0.00 0.00 66.02 66.38 1b0k s SER 210 CO 0.00 -0.18 1.52 0.18 0.98 0.00 0.00 173.24 175.74 1b0k n LEU 211 N 2.44 3.03 -3.94 2.42 4.77 -1.26 -3.21 117.00 121.25 1b0k n LEU 211 Ca -0.16 1.10 -0.19 0.00 -0.03 0.00 0.00 56.01 56.73 1b0k n LEU 211 Cb 0.58 -1.42 -0.16 0.00 -2.33 0.00 0.00 43.42 40.09 1b0k n LEU 211 CO 0.20 -0.38 -0.42 -0.94 -1.33 0.00 0.00 177.39 174.52 1b0k s SER 212 N 0.71 0.97 1.25 -1.43 1.04 -1.26 -5.01 113.70 109.98 1b0k s SER 212 Ca 0.76 -0.14 0.00 0.00 0.48 0.00 0.00 55.95 57.05 1b0k s SER 212 Cb -0.68 -0.35 0.00 0.00 0.10 0.00 0.00 66.02 65.09 1b0k s SER 212 CO 0.42 0.01 0.00 0.61 0.98 0.00 0.00 173.24 175.25 1b0k n GLY 213 N 3.60 2.32 0.23 7.32 0.00 -1.26 -3.20 105.19 114.19 1b0k n GLY 213 Ca -0.21 -0.38 0.10 0.00 0.00 0.00 0.00 46.02 45.54 1b0k n GLY 213 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 173.32 174.81 1b0k h TRP 214 N 0.00 0.00 -3.92 1.61 4.06 -1.94 -3.43 115.95 112.33 1b0k h TRP 214 Ca 0.00 0.00 -0.52 0.00 2.06 0.00 0.00 58.89 60.43 1b0k h TRP 214 Cb 0.00 0.00 0.07 0.00 -1.00 0.00 0.00 29.16 28.23 1b0k h TRP 214 CO 0.00 0.21 0.62 0.99 -3.56 0.00 0.00 178.44 176.70 1b0k s THR 215 N -3.70 2.68 0.32 1.49 2.01 -1.20 -4.82 115.64 112.43 1b0k s THR 215 Ca 0.00 0.64 0.05 0.00 0.31 0.00 0.00 61.69 62.69 1b0k s THR 215 Cb 0.10 -3.39 -0.02 0.00 0.01 0.00 0.00 72.50 69.21 1b0k s THR 215 CO 0.63 0.12 0.33 -1.54 -0.69 0.00 0.00 174.62 173.47 1b0k n SER 216 N 0.43 -0.88 -0.27 3.53 3.41 -1.26 -4.43 113.62 114.15 1b0k n SER 216 Ca 0.02 -3.02 0.15 0.00 -0.26 0.00 0.00 58.87 55.76 1b0k n SER 216 Cb 0.43 1.87 0.42 0.00 -0.26 0.00 0.00 64.21 66.66 1b0k n SER 216 CO 0.00 0.00 0.00 -0.65 -0.16 0.00 0.00 175.04 174.23 1b0k h PRO 217 N 0.00 0.58 -0.47 4.33 0.11 -1.96 -3.02 132.00 131.58 1b0k h PRO 217 Ca -0.24 -0.04 -0.00 0.00 0.11 0.00 0.00 66.00 65.83 1b0k h PRO 217 Cb 1.15 -0.13 -0.02 0.00 0.11 0.00 0.00 31.00 32.10 1b0k h PRO 217 CO 0.34 0.39 0.28 -0.22 -0.21 0.00 0.00 178.00 178.57 1b0k h LYS 218 N 0.60 0.65 -0.79 1.05 1.63 -1.94 -2.76 116.57 115.00 1b0k h LYS 218 Ca 0.48 -0.06 0.22 0.00 -0.85 0.00 0.00 60.65 60.43 1b0k h LYS 218 Cb 0.91 -0.13 -0.04 0.00 -0.60 0.00 0.00 32.23 32.37 1b0k h LYS 218 CO -0.22 0.48 0.56 -0.44 -3.45 0.00 0.00 179.45 176.38 1b0k h ASP 219 N 0.63 0.08 -0.37 4.20 3.32 -1.89 -0.09 116.42 122.30 1b0k h ASP 219 Ca 0.17 0.01 -0.16 0.00 0.02 0.00 0.00 57.03 57.07 1b0k h ASP 219 Cb 0.01 -0.01 -0.01 0.00 0.22 0.00 0.00 39.33 39.54 1b0k h ASP 219 CO -0.03 0.03 -0.38 0.58 -1.72 0.00 0.00 179.24 177.73 1b0k h VAL 220 N 0.08 1.27 0.00 -1.35 2.07 -1.62 -1.59 116.25 115.11 1b0k h VAL 220 Ca 0.38 -1.55 -0.21 0.00 0.82 0.00 0.00 66.70 66.14 1b0k h VAL 220 Cb 1.40 1.41 -0.03 0.00 -1.52 0.00 0.00 31.29 32.55 1b0k h VAL 220 CO -0.04 0.52 -1.20 -0.29 0.02 0.00 0.00 177.57 176.59 1b0k h ILE 221 N 0.72 1.17 -0.86 4.57 6.09 -1.24 -1.99 117.51 125.98 1b0k h ILE 221 Ca 0.06 -2.84 -0.02 0.00 -1.37 0.00 0.00 64.86 60.69 1b0k h ILE 221 Cb 0.97 2.55 -0.04 0.00 0.47 0.00 0.00 36.82 40.77 1b0k h ILE 221 CO 0.09 0.66 0.45 -0.07 -3.07 0.00 0.00 178.15 176.22 1b0k h LEU 222 N 0.00 1.08 -0.26 2.19 3.38 -1.03 -1.00 115.31 119.68 1b0k h LEU 222 Ca -0.11 -0.11 -0.11 0.00 0.09 0.00 0.00 57.88 57.63 1b0k h LEU 222 Cb 1.76 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 42.23 1b0k h LEU 222 CO 0.09 0.89 -0.29 0.50 0.09 0.00 0.00 178.44 179.72 1b0k h LYS 223 N 1.20 0.65 -0.88 1.13 1.63 -1.29 -2.44 116.57 116.57 1b0k h LYS 223 Ca 0.30 -0.35 -0.02 0.00 -0.85 0.00 0.00 60.65 59.73 1b0k h LYS 223 Cb 0.06 0.02 -0.04 0.00 -0.60 0.00 0.00 32.23 31.66 1b0k h LYS 223 CO -0.04 0.96 0.49 0.28 -3.45 0.00 0.00 179.45 177.69 1b0k h VAL 224 N 0.37 1.25 -0.10 2.00 2.07 -1.16 -1.66 116.25 119.02 1b0k h VAL 224 Ca 0.04 -0.62 -0.00 0.00 0.82 0.00 0.00 66.70 66.94 1b0k h VAL 224 Cb 0.86 0.05 -0.00 0.00 -1.52 0.00 0.00 31.29 30.68 1b0k h VAL 224 CO 0.07 0.28 0.06 0.00 0.02 0.00 0.00 177.57 178.00 1b0k h ALA 225 N 1.27 0.13 -0.73 1.67 0.00 -1.19 -0.10 119.26 120.30 1b0k h ALA 225 Ca 0.31 -0.03 0.08 0.00 0.00 0.00 0.00 54.91 55.26 1b0k h ALA 225 Cb 0.02 -0.04 -0.06 0.00 0.00 0.00 0.00 17.79 17.70 1b0k h ALA 225 CO -0.05 -0.35 0.40 0.78 0.00 0.00 0.00 179.25 180.03 1b0k h GLY 226 N 0.10 1.09 0.58 0.00 0.00 -1.25 0.50 103.07 104.09 1b0k h GLY 226 Ca 0.04 -0.27 -0.02 0.00 0.00 0.00 0.00 47.33 47.07 1b0k h GLY 226 CO -0.01 0.14 -0.18 -2.22 0.00 0.00 0.00 176.54 174.27 1b0k h ILE 227 N 0.71 0.48 0.00 2.60 2.04 -1.07 -3.35 117.51 118.92 1b0k h ILE 227 Ca 0.34 -0.64 0.00 0.00 1.00 0.00 0.00 64.86 65.56 1b0k h ILE 227 Cb 0.27 0.72 0.00 0.00 -0.74 0.00 0.00 36.82 37.07 1b0k h ILE 227 CO -0.22 0.09 -0.52 0.25 0.00 0.00 0.00 178.15 177.75 1b0k h LEU 228 N -0.94 0.00 -0.32 1.44 5.85 -1.04 -3.51 115.31 116.80 1b0k h LEU 228 Ca -0.05 -0.08 0.24 0.00 0.84 0.00 0.00 57.88 58.84 1b0k h LEU 228 Cb 0.54 0.00 -0.11 0.00 0.37 0.00 0.00 40.66 41.46 1b0k h LEU 228 CO 0.08 0.04 -0.67 0.35 -0.34 0.00 0.00 178.44 177.90 1b0k n THR 229 N -2.50 -0.16 0.22 1.05 -2.24 0.16 -2.64 114.28 108.17 1b0k n THR 229 Ca 0.03 0.41 0.06 0.00 -2.27 0.00 0.00 64.05 62.27 1b0k n THR 229 Cb 0.49 -0.73 0.29 0.00 -2.10 0.00 0.00 70.33 68.28 1b0k n THR 229 CO 0.00 0.00 0.00 1.33 -0.57 0.00 0.00 175.07 175.83 1b0k n VAL 230 N -3.68 1.36 -0.02 2.28 0.24 -1.26 -1.56 118.33 115.69 1b0k n VAL 230 Ca -0.04 0.46 0.03 0.00 -2.04 0.00 0.00 64.34 62.75 1b0k n VAL 230 Cb 0.45 -1.39 0.08 0.00 -1.47 0.00 0.00 33.84 31.51 1b0k n VAL 230 CO 0.00 0.00 0.00 2.29 -2.14 0.00 0.00 176.83 176.98 1b0k n LYS 231 N -1.79 2.28 -0.09 7.34 2.85 -1.26 -3.77 118.16 123.72 1b0k n LYS 231 Ca 0.01 -1.63 -0.14 0.00 -1.05 0.00 0.00 58.31 55.50 1b0k n LYS 231 Cb 0.08 -1.15 -0.02 0.00 -0.65 0.00 0.00 35.03 33.28 1b0k n LYS 231 CO 0.00 0.00 0.00 0.78 -0.05 0.00 0.00 177.40 178.13 1b0k h GLY 232 N 1.23 0.96 -0.39 2.58 0.00 -1.04 -3.24 103.07 103.17 1b0k h GLY 232 Ca 0.00 -1.07 0.00 0.00 0.00 0.00 0.00 47.33 46.26 1b0k h GLY 232 CO 0.00 0.96 0.00 0.61 0.00 0.00 0.00 176.54 178.11 1b0k n GLY 233 N 0.27 -0.05 3.61 4.60 0.00 -0.07 -4.95 105.19 108.60 1b0k n GLY 233 Ca -0.03 -0.39 -0.51 0.00 0.00 0.00 0.00 46.02 45.08 1b0k n GLY 233 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1b0k n THR 234 N 0.06 0.03 -1.09 2.61 -1.04 -1.21 -2.05 114.28 111.59 1b0k n THR 234 Ca 0.18 -0.00 -0.03 0.00 -2.04 0.00 0.00 64.05 62.16 1b0k n THR 234 Cb 0.31 -0.97 -0.01 0.00 -1.82 0.00 0.00 70.33 67.84 1b0k n THR 234 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1b0k n GLY 235 N 2.78 0.58 3.17 3.41 0.00 -1.26 -4.97 105.19 108.89 1b0k n GLY 235 Ca 0.19 -0.30 -0.20 0.00 0.00 0.00 0.00 46.02 45.71 1b0k n GLY 235 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1b0k s ALA 236 N -1.91 1.25 -0.07 4.61 0.00 -0.87 -1.73 121.76 123.04 1b0k s ALA 236 Ca 0.00 -0.92 -0.15 0.00 0.00 0.00 0.00 51.96 50.89 1b0k s ALA 236 Cb 0.00 -0.17 -0.05 0.00 0.00 0.00 0.00 23.12 22.90 1b0k s ALA 236 CO 0.00 0.22 0.39 0.42 0.00 0.00 0.00 175.76 176.79 1b0k s ILE 237 N -0.99 5.15 -0.29 0.00 1.01 -0.51 -0.87 121.20 124.70 1b0k s ILE 237 Ca 0.01 0.78 -0.24 0.00 0.00 0.00 0.00 60.65 61.20 1b0k s ILE 237 Cb -0.09 -3.71 -0.00 0.00 0.01 0.00 0.00 42.46 38.67 1b0k s ILE 237 CO 0.02 0.47 0.81 -0.69 0.00 0.00 0.00 174.94 175.55 1b0k s VAL 238 N -0.31 4.79 -0.32 2.92 1.01 -0.77 -1.78 120.40 125.94 1b0k s VAL 238 Ca 0.22 1.31 -0.07 0.00 0.00 0.00 0.00 61.98 63.44 1b0k s VAL 238 Cb -0.15 -4.15 0.02 0.00 0.00 0.00 0.00 36.38 32.10 1b0k s VAL 238 CO 0.10 -0.21 0.11 -0.70 0.00 0.00 0.00 175.10 174.40 1b0k s GLU 239 N 2.96 2.91 0.30 2.72 2.12 -0.23 -2.51 118.70 126.97 1b0k s GLU 239 Ca 0.34 -0.99 -0.18 0.00 0.36 0.00 0.00 54.97 54.50 1b0k s GLU 239 Cb -0.14 -3.46 -0.09 0.00 0.26 0.00 0.00 34.13 30.70 1b0k s GLU 239 CO 0.11 -0.55 0.76 0.71 -0.54 0.00 0.00 175.26 175.75 1b0k s TYR 240 N 1.48 3.47 0.16 5.30 1.51 -0.60 -1.80 117.35 126.87 1b0k s TYR 240 Ca 0.01 1.33 -0.24 0.00 -1.01 0.00 0.00 57.07 57.17 1b0k s TYR 240 Cb -0.18 -2.61 0.08 0.00 -0.11 0.00 0.00 41.96 39.14 1b0k s TYR 240 CO 0.03 0.16 1.03 -3.38 -1.11 0.00 0.00 175.55 172.29 1b0k s HIS 241 N -1.83 -0.00 0.00 2.71 -3.43 -0.84 -4.29 115.29 107.60 1b0k s HIS 241 Ca 0.51 -0.34 0.00 0.00 -0.80 0.00 0.00 55.06 54.43 1b0k s HIS 241 Cb -0.13 0.67 0.00 0.00 -1.43 0.00 0.00 32.58 31.69 1b0k s HIS 241 CO 0.18 -0.84 0.00 0.41 -2.00 0.00 0.00 174.74 172.49 1b0k n GLY 242 N -0.61 2.94 0.32 -1.38 0.00 -1.26 -0.62 105.19 104.58 1b0k n GLY 242 Ca -0.04 -2.03 0.06 0.00 0.00 0.00 0.00 46.02 44.01 1b0k n GLY 242 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1b0k h PRO 243 N 0.00 0.53 0.00 1.61 0.13 -1.90 -2.97 132.00 129.40 1b0k h PRO 243 Ca 0.00 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 65.10 1b0k h PRO 243 Cb 0.00 -0.12 0.00 0.00 0.13 0.00 0.00 31.00 31.01 1b0k h PRO 243 CO 0.00 0.35 0.00 0.41 -0.23 0.00 0.00 178.00 178.53 1b0k n GLY 244 N -1.48 -1.19 0.16 1.56 0.00 -0.25 -3.48 105.19 100.50 1b0k n GLY 244 Ca 0.06 0.11 -0.05 0.00 0.00 0.00 0.00 46.02 46.13 1b0k n GLY 244 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1b0k h VAL 245 N 0.00 0.68 0.00 1.61 2.07 -1.72 -2.07 116.25 116.83 1b0k h VAL 245 Ca 0.00 -0.02 0.00 0.00 0.82 0.00 0.00 66.70 67.50 1b0k h VAL 245 Cb 0.29 0.61 0.00 0.00 -1.52 0.00 0.00 31.29 30.67 1b0k h VAL 245 CO 0.00 0.01 0.00 0.47 0.02 0.00 0.00 177.57 178.07 1b0k n ASP 246 N -5.22 0.04 -0.50 0.57 8.00 -1.23 -1.66 116.55 116.55 1b0k n ASP 246 Ca 0.02 0.52 0.13 0.00 0.71 0.00 0.00 54.79 56.16 1b0k n ASP 246 Cb 0.20 -0.52 0.47 0.00 -0.02 0.00 0.00 41.12 41.26 1b0k n ASP 246 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 1b0k n SER 247 N -1.55 1.54 -4.72 -2.24 3.41 -0.78 -4.91 113.62 104.37 1b0k n SER 247 Ca 0.00 -1.57 -0.35 0.00 -0.26 0.00 0.00 58.87 56.69 1b0k n SER 247 Cb 0.03 -0.04 -0.09 0.00 -0.26 0.00 0.00 64.21 63.85 1b0k n SER 247 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 1b0k s ILE 248 N -1.92 4.88 0.94 -1.33 1.01 -0.66 -4.80 121.20 119.31 1b0k s ILE 248 Ca 0.36 -0.02 -0.12 0.00 0.00 0.00 0.00 60.65 60.88 1b0k s ILE 248 Cb 0.20 -3.14 0.15 0.00 0.01 0.00 0.00 42.46 39.68 1b0k s ILE 248 CO 0.31 0.55 1.09 -0.94 0.00 0.00 0.00 174.94 175.94 1b0k s SER 249 N -0.38 3.07 0.34 3.58 1.04 -1.26 -4.82 113.70 115.27 1b0k s SER 249 Ca 0.09 1.55 0.06 0.00 0.48 0.00 0.00 55.95 58.14 1b0k s SER 249 Cb -0.12 -2.22 0.63 0.00 0.10 0.00 0.00 66.02 64.42 1b0k s SER 249 CO 0.02 -2.90 1.85 0.00 0.98 0.00 0.00 173.24 173.19 1b0k h THR 251 N 0.35 0.49 -0.43 0.00 1.35 -1.92 -2.74 112.91 110.03 1b0k h THR 251 Ca 0.07 -1.71 -0.08 0.00 -0.55 0.00 0.00 66.41 64.14 1b0k h THR 251 Cb 0.44 2.22 -0.02 0.00 -1.73 0.00 0.00 68.15 69.06 1b0k h THR 251 CO 0.03 0.28 -0.07 1.23 -0.25 0.00 0.00 175.52 176.73 1b0k h GLY 252 N 3.71 0.79 1.56 5.82 0.00 -1.80 -2.49 103.07 110.67 1b0k h GLY 252 Ca -0.01 -0.56 -0.16 0.00 0.00 0.00 0.00 47.33 46.60 1b0k h GLY 252 CO 0.04 0.52 -0.58 -0.33 0.00 0.00 0.00 176.54 176.19 1b0k h MET 253 N 0.68 0.46 -0.37 4.80 0.00 -1.40 -2.67 114.93 116.42 1b0k h MET 253 Ca 0.12 -0.30 0.00 0.00 0.00 0.00 0.00 59.70 59.52 1b0k h MET 253 Cb 0.52 0.04 -0.02 0.00 0.00 0.00 0.00 31.60 32.14 1b0k h MET 253 CO 0.03 0.91 0.24 0.00 0.00 0.00 0.00 176.91 178.08 1b0k h ALA 254 N 1.03 0.48 -0.04 6.32 0.00 -1.34 -0.63 119.26 125.08 1b0k h ALA 254 Ca 0.00 -0.04 0.04 0.00 0.00 0.00 0.00 54.91 54.90 1b0k h ALA 254 Cb 1.11 -0.15 -0.06 0.00 0.00 0.00 0.00 17.79 18.69 1b0k h ALA 254 CO 0.10 -0.04 -0.39 1.15 0.00 0.00 0.00 179.25 180.07 1b0k h THR 255 N 0.50 0.19 -0.79 0.00 2.02 -1.12 0.33 112.91 114.04 1b0k h THR 255 Ca 0.14 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.30 1b0k h THR 255 Cb -0.02 0.19 -0.04 0.00 -1.74 0.00 0.00 68.15 66.54 1b0k h THR 255 CO -0.03 0.00 0.44 0.40 0.37 0.00 0.00 175.52 176.70 1b0k h ILE 256 N -0.52 1.23 -0.01 3.11 2.04 -1.44 -2.90 117.51 119.02 1b0k h ILE 256 Ca 0.06 -0.56 -0.19 0.00 1.00 0.00 0.00 64.86 65.17 1b0k h ILE 256 Cb 0.62 0.16 -0.01 0.00 -0.74 0.00 0.00 36.82 36.85 1b0k h ILE 256 CO -0.33 0.26 -0.81 0.00 0.00 0.00 0.00 178.15 177.26 1b0k h ASN 258 N 0.12 -1.16 0.00 0.00 -0.73 -0.82 -2.45 115.58 110.54 1b0k h ASN 258 Ca -0.04 0.13 0.00 0.00 1.87 0.00 0.00 56.30 58.26 1b0k h ASN 258 Cb 1.42 0.44 0.00 0.00 0.27 0.00 0.00 38.32 40.44 1b0k h ASN 258 CO 0.12 -0.47 0.00 0.80 -0.37 0.00 0.00 177.43 177.51 1b0k n MET 259 N -5.46 0.98 0.22 6.67 1.56 -1.11 -2.67 117.12 117.32 1b0k n MET 259 Ca -0.07 0.00 0.16 0.00 -0.27 0.00 0.00 57.70 57.51 1b0k n MET 259 Cb 0.37 -1.33 0.69 0.00 2.15 0.00 0.00 33.22 35.09 1b0k n MET 259 CO 0.00 0.00 0.00 0.78 -0.73 0.00 0.00 175.97 176.02 1b0k h GLY 260 N 5.21 0.00 1.41 -5.12 0.00 -1.46 -2.44 103.07 100.67 1b0k h GLY 260 Ca 0.00 0.00 0.06 0.00 0.00 0.00 0.00 47.33 47.39 1b0k h GLY 260 CO 0.00 0.00 0.27 0.00 0.00 0.00 0.00 176.54 176.81 1b0k h ALA 261 N 2.09 1.99 0.00 3.60 0.00 -1.68 -2.71 119.26 122.55 1b0k h ALA 261 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1b0k h ALA 261 Cb 0.32 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.04 1b0k h ALA 261 CO 0.00 -0.06 0.00 0.39 0.00 0.00 0.00 179.25 179.58 1b0k n GLU 262 N -4.48 0.81 0.00 0.00 4.71 -0.92 -1.67 120.64 119.09 1b0k n GLU 262 Ca 0.05 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.20 1b0k n GLU 262 Cb 0.25 -1.28 0.00 0.00 -1.01 0.00 0.00 31.44 29.40 1b0k n GLU 262 CO 0.00 0.00 0.00 0.44 0.09 0.00 0.00 177.13 177.66 1b0k n ILE 263 N -0.78 0.47 -0.88 -3.67 -5.35 -1.04 -4.19 119.36 103.93 1b0k n ILE 263 Ca 0.11 -0.71 0.00 0.00 -0.27 0.00 0.00 62.75 61.88 1b0k n ILE 263 Cb 0.05 0.79 0.00 0.00 -1.74 0.00 0.00 39.64 38.74 1b0k n ILE 263 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1b0k n GLY 264 N -0.24 0.48 3.77 3.28 0.00 -0.67 -0.89 105.19 110.92 1b0k n GLY 264 Ca 0.00 -0.75 -0.40 0.00 0.00 0.00 0.00 46.02 44.88 1b0k n GLY 264 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1b0k s ALA 265 N -2.00 3.21 0.53 4.61 0.00 -1.12 -3.35 121.76 123.64 1b0k s ALA 265 Ca 0.00 1.38 0.24 0.00 0.00 0.00 0.00 51.96 53.58 1b0k s ALA 265 Cb 0.00 -3.56 1.38 0.00 0.00 0.00 0.00 23.12 20.94 1b0k s ALA 265 CO 0.00 -1.10 2.02 1.15 0.00 0.00 0.00 175.76 177.83 1b0k h THR 266 N 2.27 0.78 -1.22 0.00 2.02 -1.17 -3.44 112.91 112.15 1b0k h THR 266 Ca -0.50 0.00 0.06 0.00 0.77 0.00 0.00 66.41 66.74 1b0k h THR 266 Cb 1.26 0.78 -0.01 0.00 -1.74 0.00 0.00 68.15 68.44 1b0k h THR 266 CO 0.61 0.00 0.15 1.07 0.37 0.00 0.00 175.52 177.72 1b0k n THR 267 N -4.40 0.00 -3.74 3.16 5.66 -1.26 -4.46 114.28 109.24 1b0k n THR 267 Ca 0.08 -0.01 -0.14 0.00 -3.05 0.00 0.00 64.05 60.93 1b0k n THR 267 Cb 0.53 0.08 -0.08 0.00 -1.55 0.00 0.00 70.33 69.30 1b0k n THR 267 CO 0.00 0.00 0.00 -0.44 -3.05 0.00 0.00 175.07 171.58 1b0k s SER 268 N -1.45 -0.22 -0.10 1.09 0.01 -1.26 -1.85 113.70 109.91 1b0k s SER 268 Ca 0.05 0.12 -0.23 0.00 1.31 0.00 0.00 55.95 57.20 1b0k s SER 268 Cb -0.00 0.33 0.05 0.00 0.21 0.00 0.00 66.02 66.61 1b0k s SER 268 CO -0.00 -0.47 0.56 0.54 0.41 0.00 0.00 173.24 174.28 1b0k s VAL 269 N -1.37 0.01 0.12 3.43 0.11 -1.04 -4.07 120.40 117.59 1b0k s VAL 269 Ca -0.13 -0.11 0.06 0.00 -2.93 0.00 0.00 61.98 58.87 1b0k s VAL 269 Cb -0.05 -0.84 -0.04 0.00 -1.53 0.00 0.00 36.38 33.92 1b0k s VAL 269 CO 0.04 -0.06 -0.02 -0.36 -3.33 0.00 0.00 175.10 171.37 1b0k s PHE 270 N -0.67 2.89 0.42 1.54 0.40 -1.02 -1.55 117.98 119.98 1b0k s PHE 270 Ca -0.08 -0.09 -0.20 0.00 -0.60 0.00 0.00 56.93 55.96 1b0k s PHE 270 Cb -0.03 -1.46 -0.11 0.00 0.51 0.00 0.00 43.02 41.94 1b0k s PHE 270 CO 0.05 0.48 0.93 -1.25 0.70 0.00 0.00 175.22 176.13 1b0k s PRO 271 N -2.51 4.20 0.10 0.24 0.04 -1.26 -4.21 135.00 131.60 1b0k s PRO 271 Ca 0.25 1.06 -0.31 0.00 0.04 0.00 0.00 61.00 62.05 1b0k s PRO 271 Cb -0.11 -2.21 -0.10 0.00 0.04 0.00 0.00 34.50 32.12 1b0k s PRO 271 CO 0.17 -0.01 1.88 -0.47 0.04 0.00 0.00 177.00 178.61 1b0k s TYR 272 N -2.16 1.89 0.32 0.56 5.04 -0.94 -4.94 117.35 117.11 1b0k s TYR 272 Ca 0.61 -0.17 0.07 0.00 -2.44 0.00 0.00 57.07 55.14 1b0k s TYR 272 Cb -0.09 -4.21 -0.03 0.00 0.35 0.00 0.00 41.96 37.98 1b0k s TYR 272 CO 0.14 -5.13 0.26 0.27 -1.34 0.00 0.00 175.55 169.74 1b0k n ASN 273 N 6.18 -0.54 0.25 4.32 0.23 -1.26 -4.91 115.26 119.53 1b0k n ASN 273 Ca 0.18 -3.05 0.16 0.00 -0.53 0.00 0.00 54.58 51.34 1b0k n ASN 273 Cb 0.39 1.53 0.58 0.00 -2.08 0.00 0.00 39.78 40.20 1b0k n ASN 273 CO 0.00 0.00 0.00 1.12 -0.93 0.00 0.00 177.26 177.45 1b0k h HIS 274 N 1.98 0.00 -0.17 -2.53 2.07 -1.99 -2.66 115.15 111.85 1b0k h HIS 274 Ca -0.22 0.00 -0.15 0.00 -2.85 0.00 0.00 60.37 57.15 1b0k h HIS 274 Cb 1.12 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 31.10 1b0k h HIS 274 CO 0.00 0.00 -0.53 0.00 -3.07 0.00 0.00 177.93 174.33 1b0k h ARG 275 N 0.00 0.48 0.11 5.12 2.47 -1.94 -2.07 114.38 118.55 1b0k h ARG 275 Ca 0.00 -0.29 -0.01 0.00 -1.26 0.00 0.00 59.98 58.42 1b0k h ARG 275 Cb 0.57 0.03 0.00 0.00 -1.65 0.00 0.00 29.97 28.92 1b0k h ARG 275 CO 0.00 0.89 -0.05 0.52 0.56 0.00 0.00 179.97 181.89 1b0k h MET 276 N 0.37 -0.14 -0.67 0.04 2.86 -1.86 -2.42 114.93 113.11 1b0k h MET 276 Ca 0.01 0.01 0.14 0.00 -2.06 0.00 0.00 59.70 57.81 1b0k h MET 276 Cb 1.05 0.03 -0.11 0.00 0.06 0.00 0.00 31.60 32.63 1b0k h MET 276 CO 0.10 0.04 0.05 -0.22 1.06 0.00 0.00 176.91 177.93 1b0k h LYS 277 N -0.30 0.15 -0.35 1.72 3.64 -1.35 -1.01 116.57 119.06 1b0k h LYS 277 Ca -0.02 -0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.35 1b0k h LYS 277 Cb 0.25 -0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 32.02 1b0k h LYS 277 CO 0.03 0.10 0.20 -0.22 -2.27 0.00 0.00 179.45 177.28 1b0k h LYS 278 N 0.15 0.49 -0.53 1.90 3.64 -1.37 -2.30 116.57 118.54 1b0k h LYS 278 Ca 0.36 -0.05 -0.11 0.00 -1.27 0.00 0.00 60.65 59.58 1b0k h LYS 278 Cb 0.61 -0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 32.31 1b0k h LYS 278 CO -0.55 0.39 -0.12 -0.92 -2.27 0.00 0.00 179.45 175.99 1b0k h TYR 279 N 0.45 1.12 -0.78 1.91 3.20 -0.79 -2.47 116.97 119.62 1b0k h TYR 279 Ca 0.12 -0.23 0.05 0.00 3.14 0.00 0.00 58.73 61.81 1b0k h TYR 279 Cb 0.04 -0.28 -0.05 0.00 1.54 0.00 0.00 36.73 37.98 1b0k h TYR 279 CO -0.03 1.05 0.48 -0.07 -1.64 0.00 0.00 178.16 177.94 1b0k h LEU 280 N 0.89 0.76 -0.52 2.82 3.38 -1.05 -0.89 115.31 120.71 1b0k h LEU 280 Ca 0.14 0.01 -0.15 0.00 0.09 0.00 0.00 57.88 57.97 1b0k h LEU 280 Cb 0.68 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.27 1b0k h LEU 280 CO 0.05 0.51 -0.39 0.28 0.09 0.00 0.00 178.44 178.97 1b0k h SER 281 N 0.90 0.83 1.08 -0.43 0.02 -1.34 0.16 113.55 114.77 1b0k h SER 281 Ca 0.33 -0.37 0.00 0.00 -0.84 0.00 0.00 61.79 60.90 1b0k h SER 281 Cb 0.10 -0.23 0.00 0.00 0.14 0.00 0.00 62.40 62.41 1b0k h SER 281 CO -0.15 1.12 0.00 0.50 -1.14 0.00 0.00 176.83 177.16 1b0k h LYS 282 N 0.63 0.00 -0.72 3.45 1.63 -1.10 -3.04 116.57 117.42 1b0k h LYS 282 Ca 0.05 0.00 -0.44 0.00 -0.85 0.00 0.00 60.65 59.41 1b0k h LYS 282 Cb 0.95 0.00 -0.25 0.00 -0.60 0.00 0.00 32.23 32.33 1b0k h LYS 282 CO 0.09 0.00 0.20 0.25 -3.45 0.00 0.00 179.45 176.54 1b0k n THR 283 N -2.32 2.97 -2.19 1.00 -2.24 -0.37 -4.70 114.28 106.42 1b0k n THR 283 Ca 0.03 -2.84 -0.21 0.00 -2.27 0.00 0.00 64.05 58.76 1b0k n THR 283 Cb 0.32 -0.69 -0.03 0.00 -2.10 0.00 0.00 70.33 67.84 1b0k n THR 283 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1b0k n GLY 284 N -1.02 0.14 2.06 3.38 0.00 -1.15 -4.92 105.19 103.68 1b0k n GLY 284 Ca 0.48 -0.01 -0.15 0.00 0.00 0.00 0.00 46.02 46.35 1b0k n GLY 284 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1b0k n ARG 285 N -2.85 2.88 0.11 1.61 1.74 0.49 -4.85 116.66 115.79 1b0k n ARG 285 Ca -0.24 -3.87 0.04 0.00 -0.77 0.00 0.00 57.85 53.01 1b0k n ARG 285 Cb 0.69 -1.99 0.44 0.00 -1.02 0.00 0.00 32.46 30.58 1b0k n ARG 285 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1b0k h ALA 286 N 2.13 1.64 -0.93 7.54 0.00 -1.82 -1.50 119.26 126.31 1b0k h ALA 286 Ca 0.20 -0.13 0.16 0.00 0.00 0.00 0.00 54.91 55.14 1b0k h ALA 286 Cb 1.44 -0.09 -0.08 0.00 0.00 0.00 0.00 17.79 19.06 1b0k h ALA 286 CO 0.53 0.27 0.60 0.38 0.00 0.00 0.00 179.25 181.03 1b0k h ASP 287 N 0.27 0.68 -0.04 0.00 2.03 -1.94 0.21 116.42 117.62 1b0k h ASP 287 Ca 0.06 0.05 -0.02 0.00 -0.73 0.00 0.00 57.03 56.40 1b0k h ASP 287 Cb 0.20 -0.08 -0.00 0.00 -0.83 0.00 0.00 39.33 38.63 1b0k h ASP 287 CO 0.01 0.31 -0.03 0.40 -1.03 0.00 0.00 179.24 178.89 1b0k h ILE 288 N 0.70 1.36 -0.93 4.15 2.04 -1.68 -1.03 117.51 122.12 1b0k h ILE 288 Ca 0.49 -1.12 0.20 0.00 1.00 0.00 0.00 64.86 65.43 1b0k h ILE 288 Cb 0.81 2.01 -0.11 0.00 -0.74 0.00 0.00 36.82 38.78 1b0k h ILE 288 CO -0.25 0.30 0.49 0.00 0.00 0.00 0.00 178.15 178.69 1b0k h ALA 289 N 0.57 1.51 -0.15 1.87 0.00 -1.01 -0.83 119.26 121.22 1b0k h ALA 289 Ca 0.01 0.12 -0.22 0.00 0.00 0.00 0.00 54.91 54.82 1b0k h ALA 289 Cb 0.50 0.04 0.01 0.00 0.00 0.00 0.00 17.79 18.34 1b0k h ALA 289 CO 0.01 -0.21 -0.76 -0.91 0.00 0.00 0.00 179.25 177.39 1b0k h ASN 290 N 0.56 0.89 0.26 0.00 2.35 -0.62 -2.40 115.58 116.62 1b0k h ASN 290 Ca 0.56 -0.57 -0.13 0.00 -0.55 0.00 0.00 56.30 55.61 1b0k h ASN 290 Cb 0.96 -0.26 -0.01 0.00 0.05 0.00 0.00 38.32 39.06 1b0k h ASN 290 CO -0.45 1.36 -0.50 0.25 -1.65 0.00 0.00 177.43 176.45 1b0k h LEU 291 N 0.52 0.30 -0.50 1.61 5.85 -0.55 -3.02 115.31 119.52 1b0k h LEU 291 Ca -0.04 -0.15 -0.14 0.00 0.84 0.00 0.00 57.88 58.39 1b0k h LEU 291 Cb 1.38 -0.08 -0.01 0.00 0.37 0.00 0.00 40.66 42.31 1b0k h LEU 291 CO 0.15 0.75 -0.30 0.00 -0.34 0.00 0.00 178.44 178.71 1b0k h ALA 292 N 1.26 0.69 -0.70 1.25 0.00 -1.13 -2.47 119.26 118.15 1b0k h ALA 292 Ca 0.01 -0.42 0.07 0.00 0.00 0.00 0.00 54.91 54.57 1b0k h ALA 292 Cb 0.96 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 18.56 1b0k h ALA 292 CO 0.08 0.67 0.46 -0.44 0.00 0.00 0.00 179.25 180.02 1b0k h ASP 293 N 0.77 0.60 0.94 0.00 3.32 -1.33 0.34 116.42 121.06 1b0k h ASP 293 Ca 0.08 0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.14 1b0k h ASP 293 Cb 0.87 -0.12 0.00 0.00 0.22 0.00 0.00 39.33 40.30 1b0k h ASP 293 CO 0.08 0.38 0.00 -0.33 -1.72 0.00 0.00 179.24 177.65 1b0k h GLU 294 N 0.68 0.00 -0.07 3.56 5.08 -1.38 -3.28 114.58 119.18 1b0k h GLU 294 Ca 0.31 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.67 1b0k h GLU 294 Cb 0.33 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.58 1b0k h GLU 294 CO -0.10 0.00 0.00 1.19 -1.00 0.00 0.00 179.01 179.10 1b0k n PHE 295 N -2.75 0.13 -0.16 4.33 3.72 -0.35 -4.89 117.46 117.48 1b0k n PHE 295 Ca 0.01 -0.65 0.16 0.00 -0.05 0.00 0.00 57.45 56.93 1b0k n PHE 295 Cb 0.28 -0.09 0.29 0.00 -0.94 0.00 0.00 39.48 39.03 1b0k n PHE 295 CO 0.00 0.00 0.00 1.17 -0.05 0.00 0.00 176.76 177.88 1b0k n LYS 296 N -0.59 -0.03 0.19 -1.08 3.00 -0.03 -1.76 118.16 117.86 1b0k n LYS 296 Ca 0.07 0.68 0.03 0.00 -0.00 0.00 0.00 58.31 59.09 1b0k n LYS 296 Cb 0.41 -1.22 0.40 0.00 0.00 0.00 0.00 35.03 34.62 1b0k n LYS 296 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.40 176.96 1b0k h ASP 297 N 0.00 0.02 -0.05 3.14 3.32 -1.90 -1.95 116.42 119.01 1b0k h ASP 297 Ca 0.42 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.46 1b0k h ASP 297 Cb 1.12 -0.01 0.00 0.00 0.22 0.00 0.00 39.33 40.66 1b0k h ASP 297 CO -0.38 0.32 0.00 1.41 -1.72 0.00 0.00 179.24 178.87 1b0k n HIS 298 N -4.18 0.05 -0.72 4.55 8.25 -0.72 -3.86 115.22 118.58 1b0k n HIS 298 Ca -0.02 -0.02 0.07 0.00 -0.26 0.00 0.00 57.72 57.49 1b0k n HIS 298 Cb 0.34 0.00 0.16 0.00 1.12 0.00 0.00 29.99 31.61 1b0k n HIS 298 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 1b0k n LEU 299 N 0.20 2.87 -4.18 2.41 4.77 -0.74 -4.74 117.00 117.59 1b0k n LEU 299 Ca 0.18 -2.71 -0.11 0.00 -0.03 0.00 0.00 56.01 53.35 1b0k n LEU 299 Cb 0.35 -0.36 -0.10 0.00 -2.33 0.00 0.00 43.42 40.98 1b0k n LEU 299 CO 0.16 0.66 -0.37 0.68 -1.33 0.00 0.00 177.39 177.19 1b0k s VAL 300 N -2.24 0.64 0.54 4.08 -7.23 -1.18 -2.23 120.40 112.79 1b0k s VAL 300 Ca 0.28 -1.94 -0.17 0.00 -1.81 0.00 0.00 61.98 58.34 1b0k s VAL 300 Cb 0.23 -1.77 -0.06 0.00 0.56 0.00 0.00 36.38 35.33 1b0k s VAL 300 CO 0.06 -0.79 1.04 -2.16 -0.31 0.00 0.00 175.10 172.94 1b0k s PRO 301 N -3.86 3.59 0.46 4.82 0.04 -1.26 -4.56 135.00 134.22 1b0k s PRO 301 Ca 0.14 1.21 -0.24 0.00 0.04 0.00 0.00 61.00 62.16 1b0k s PRO 301 Cb 0.06 -2.07 -0.07 0.00 0.04 0.00 0.00 34.50 32.45 1b0k s PRO 301 CO -0.03 -0.59 1.27 -0.51 0.04 0.00 0.00 177.00 177.18 1b0k s ASP 302 N -2.57 6.00 0.22 6.66 1.01 -0.89 -4.91 116.67 122.19 1b0k s ASP 302 Ca 0.64 2.57 -0.31 0.00 0.71 0.00 0.00 52.55 56.16 1b0k s ASP 302 Cb -0.15 -2.63 -0.11 0.00 1.01 0.00 0.00 42.92 41.05 1b0k s ASP 302 CO 0.30 -1.06 1.57 -2.84 0.21 0.00 0.00 175.17 173.36 1b0k s PRO 303 N -2.56 4.19 -0.45 8.23 0.02 -1.26 -2.94 135.00 140.24 1b0k s PRO 303 Ca 0.63 2.44 -0.01 0.00 0.02 0.00 0.00 61.00 64.07 1b0k s PRO 303 Cb -0.36 -3.10 0.00 0.00 0.02 0.00 0.00 34.50 31.06 1b0k s PRO 303 CO 0.44 -0.60 0.18 0.41 -0.33 0.00 0.00 177.00 177.10 1b0k n GLY 304 N 3.12 0.33 3.83 0.52 0.00 -1.26 -4.83 105.19 106.91 1b0k n GLY 304 Ca 0.11 -0.52 -0.33 0.00 0.00 0.00 0.00 46.02 45.29 1b0k n GLY 304 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1b0k s HIS 306 N -2.43 3.30 0.15 0.00 2.46 -1.26 -5.02 115.29 112.48 1b0k s HIS 306 Ca 0.61 0.44 -0.14 0.00 0.47 0.00 0.00 55.06 56.45 1b0k s HIS 306 Cb -0.11 -2.51 -0.07 0.00 -0.13 0.00 0.00 32.58 29.76 1b0k s HIS 306 CO 0.26 -0.12 0.54 0.71 -2.47 0.00 0.00 174.74 173.66 1b0k s TYR 307 N 1.69 3.60 -0.64 3.88 2.02 -1.26 -4.90 117.35 121.73 1b0k s TYR 307 Ca 0.15 1.04 0.26 0.00 -0.37 0.00 0.00 57.07 58.14 1b0k s TYR 307 Cb -0.15 -2.35 0.76 0.00 -0.40 0.00 0.00 41.96 39.81 1b0k s TYR 307 CO 0.09 0.43 1.75 -0.44 -1.57 0.00 0.00 175.55 175.80 1b0k h ASP 308 N 3.52 0.00 -5.06 2.29 3.32 -1.08 -3.45 116.42 115.96 1b0k h ASP 308 Ca -0.49 0.00 -0.08 0.00 0.02 0.00 0.00 57.03 56.49 1b0k h ASP 308 Cb 1.19 0.00 -0.16 0.00 0.22 0.00 0.00 39.33 40.59 1b0k h ASP 308 CO 0.66 0.00 -0.15 -1.58 -1.72 0.00 0.00 179.24 176.45 1b0k s GLN 309 N -3.15 0.92 0.00 3.56 0.74 -1.24 -5.04 119.66 115.46 1b0k s GLN 309 Ca 0.09 -0.52 0.01 0.00 0.05 0.00 0.00 55.36 54.99 1b0k s GLN 309 Cb 0.11 0.40 -0.00 0.00 1.10 0.00 0.00 33.01 34.62 1b0k s GLN 309 CO 0.59 -0.32 -0.02 0.08 -0.55 0.00 0.00 175.29 175.07 1b0k s VAL 310 N -2.90 0.16 0.10 1.34 1.01 -1.26 -0.80 120.40 118.05 1b0k s VAL 310 Ca -0.03 -0.13 0.06 0.00 0.00 0.00 0.00 61.98 61.88 1b0k s VAL 310 Cb 0.00 -0.15 -0.03 0.00 0.00 0.00 0.00 36.38 36.20 1b0k s VAL 310 CO -0.05 0.01 -0.15 -0.63 0.00 0.00 0.00 175.10 174.28 1b0k s ILE 311 N -0.13 1.33 -0.03 2.22 1.09 -0.45 -4.94 121.20 120.30 1b0k s ILE 311 Ca -0.00 -1.54 0.03 0.00 -1.10 0.00 0.00 60.65 58.04 1b0k s ILE 311 Cb -0.01 -1.37 -0.00 0.00 -1.06 0.00 0.00 42.46 40.01 1b0k s ILE 311 CO -0.00 -0.28 -0.12 -0.70 -0.10 0.00 0.00 174.94 173.74 1b0k s GLU 312 N -2.19 1.20 -0.05 2.79 2.12 -1.26 -0.50 118.70 120.81 1b0k s GLU 312 Ca 0.05 -0.42 0.03 0.00 0.36 0.00 0.00 54.97 54.98 1b0k s GLU 312 Cb -0.08 -1.10 0.01 0.00 0.26 0.00 0.00 34.13 33.22 1b0k s GLU 312 CO 0.03 0.18 -0.11 0.42 -0.54 0.00 0.00 175.26 175.24 1b0k s ILE 313 N 0.05 1.02 -0.55 -3.70 1.01 0.37 -4.92 121.20 114.48 1b0k s ILE 313 Ca -0.02 -0.45 -0.15 0.00 0.00 0.00 0.00 60.65 60.03 1b0k s ILE 313 Cb -0.09 -0.92 0.13 0.00 0.01 0.00 0.00 42.46 41.60 1b0k s ILE 313 CO 0.01 0.32 0.50 0.21 0.00 0.00 0.00 174.94 175.98 1b0k s ASN 314 N 0.44 6.18 0.31 3.58 2.47 -1.26 -1.04 114.94 125.62 1b0k s ASN 314 Ca -0.09 -1.85 0.08 0.00 0.42 0.00 0.00 52.86 51.42 1b0k s ASN 314 Cb -0.13 -2.20 0.84 0.00 -1.45 0.00 0.00 41.25 38.32 1b0k s ASN 314 CO 0.02 -0.83 1.72 -0.07 -3.72 0.00 0.00 177.10 174.22 1b0k h LEU 315 N 8.80 0.60 -1.37 3.21 4.07 -0.66 -0.93 115.31 129.02 1b0k h LEU 315 Ca -0.27 0.14 -0.06 0.00 0.08 0.00 0.00 57.88 57.77 1b0k h LEU 315 Cb 1.09 0.05 -0.01 0.00 1.08 0.00 0.00 40.66 42.88 1b0k h LEU 315 CO 1.01 0.09 -0.28 0.28 -1.08 0.00 0.00 178.44 178.45 1b0k h SER 316 N 0.55 0.00 1.03 -0.43 0.02 -1.66 -2.97 113.55 110.09 1b0k h SER 316 Ca 0.62 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.57 1b0k h SER 316 Cb 1.18 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.72 1b0k h SER 316 CO -0.48 0.28 -0.90 -0.33 -1.14 0.00 0.00 176.83 174.26 1b0k h GLU 317 N 0.00 0.00 -6.86 3.45 3.07 -1.53 -3.47 114.58 109.24 1b0k h GLU 317 Ca -0.00 0.00 -0.53 0.00 -0.50 0.00 0.00 59.36 58.33 1b0k h GLU 317 Cb 0.62 0.00 0.08 0.00 -0.84 0.00 0.00 28.75 28.61 1b0k h GLU 317 CO 0.04 0.00 0.76 -1.17 -1.40 0.00 0.00 179.01 177.24 1b0k s LEU 318 N -5.26 4.36 0.33 1.33 2.96 -0.77 -5.03 118.68 116.61 1b0k s LEU 318 Ca 0.01 2.87 0.10 0.00 -0.22 0.00 0.00 54.13 56.88 1b0k s LEU 318 Cb 0.10 -3.65 -0.06 0.00 0.50 0.00 0.00 46.19 43.08 1b0k s LEU 318 CO 0.78 -0.77 -0.10 -0.75 -1.32 0.00 0.00 176.35 174.18 1b0k s LYS 319 N -1.38 1.79 0.26 1.98 2.47 -1.26 -4.82 119.74 118.78 1b0k s LYS 319 Ca 0.55 -1.91 -0.29 0.00 -1.56 0.00 0.00 55.97 52.76 1b0k s LYS 319 Cb -0.44 -1.68 -0.15 0.00 -1.46 0.00 0.00 37.83 34.10 1b0k s LYS 319 CO 0.54 0.15 1.02 -2.30 0.16 0.00 0.00 175.35 174.92 1b0k n PRO 320 N -0.77 1.24 -4.33 4.03 -0.02 -1.26 -4.95 135.00 128.94 1b0k n PRO 320 Ca -0.05 0.44 -0.18 0.00 -2.02 0.00 0.00 63.50 61.69 1b0k n PRO 320 Cb 0.63 -1.81 -0.10 0.00 -0.02 0.00 0.00 33.50 32.20 1b0k n PRO 320 CO 0.00 0.00 0.00 -1.01 1.98 0.00 0.00 175.50 176.47 1b0k s HIS 321 N -0.85 1.63 -0.11 6.00 3.76 -1.26 -1.75 115.29 122.72 1b0k s HIS 321 Ca 0.62 -0.60 -0.05 0.00 -0.15 0.00 0.00 55.06 54.89 1b0k s HIS 321 Cb -0.75 -0.77 0.05 0.00 1.11 0.00 0.00 32.58 32.23 1b0k s HIS 321 CO 0.58 0.31 0.23 -1.50 -0.85 0.00 0.00 174.74 173.51 1b0k s ILE 322 N -2.97 -0.24 0.08 0.60 2.07 -0.70 -4.61 121.20 115.43 1b0k s ILE 322 Ca 0.21 0.24 0.04 0.00 -1.41 0.00 0.00 60.65 59.73 1b0k s ILE 322 Cb -0.01 -0.38 -0.04 0.00 0.13 0.00 0.00 42.46 42.16 1b0k s ILE 322 CO 0.06 0.10 0.02 0.20 -1.91 0.00 0.00 174.94 173.41 1b0k s ASN 323 N 1.93 5.18 0.00 4.50 -0.87 0.05 -2.05 114.94 123.68 1b0k s ASN 323 Ca -0.03 -0.11 0.00 0.00 -1.57 0.00 0.00 52.86 51.15 1b0k s ASN 323 Cb -0.11 -1.30 0.00 0.00 -0.02 0.00 0.00 41.25 39.82 1b0k s ASN 323 CO -0.08 0.19 0.00 0.61 -2.57 0.00 0.00 177.10 175.25 1b0k n GLY 324 N 0.63 -0.43 0.05 0.66 0.00 -0.13 -0.65 105.19 105.31 1b0k n GLY 324 Ca -0.11 -2.23 0.15 0.00 0.00 0.00 0.00 46.02 43.83 1b0k n GLY 324 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1b0k n PRO 325 N -0.07 0.60 -0.20 1.61 -0.04 -1.26 -4.82 135.00 130.82 1b0k n PRO 325 Ca 0.00 -0.10 0.00 0.00 -0.04 0.00 0.00 63.50 63.36 1b0k n PRO 325 Cb 0.00 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 31.97 1b0k n PRO 325 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 1b0k n PHE 326 N -1.11 0.00 -3.86 0.54 3.01 -1.26 -3.95 117.46 110.83 1b0k n PHE 326 Ca 0.15 -0.05 -0.11 0.00 1.01 0.00 0.00 57.45 58.45 1b0k n PHE 326 Cb 0.24 -0.03 -0.11 0.00 -0.01 0.00 0.00 39.48 39.57 1b0k n PHE 326 CO 0.00 0.00 0.00 0.99 1.01 0.00 0.00 176.76 178.76 1b0k s THR 327 N -0.12 0.05 -2.26 4.37 2.01 -1.26 -4.12 115.64 114.31 1b0k s THR 327 Ca 0.01 -0.38 0.29 0.00 0.31 0.00 0.00 61.69 61.92 1b0k s THR 327 Cb 0.01 -0.29 0.69 0.00 0.01 0.00 0.00 72.50 72.92 1b0k s THR 327 CO 0.00 -0.21 1.93 -0.81 -0.69 0.00 0.00 174.62 174.85 1b0k n PRO 328 N 2.24 1.36 -0.22 4.92 -0.04 -1.26 -3.07 135.00 138.92 1b0k n PRO 328 Ca -0.18 -0.53 0.10 0.00 -0.04 0.00 0.00 63.50 62.85 1b0k n PRO 328 Cb 0.57 -1.48 0.22 0.00 -0.04 0.00 0.00 33.50 32.77 1b0k n PRO 328 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 1b0k n ASP 329 N -0.35 3.34 -4.47 3.54 5.75 -1.26 -4.69 116.55 118.40 1b0k n ASP 329 Ca 0.21 -1.95 -0.43 0.00 -0.01 0.00 0.00 54.79 52.61 1b0k n ASP 329 Cb 0.24 -0.30 -0.03 0.00 -1.03 0.00 0.00 41.12 40.01 1b0k n ASP 329 CO 0.00 0.00 0.00 -0.22 -0.11 0.00 0.00 177.20 176.87 1b0k s LEU 330 N -1.16 4.70 -0.11 -2.12 0.20 -1.25 -3.96 118.68 114.99 1b0k s LEU 330 Ca 0.35 -1.87 -0.18 0.00 0.69 0.00 0.00 54.13 53.13 1b0k s LEU 330 Cb 0.20 -2.44 -0.04 0.00 -0.43 0.00 0.00 46.19 43.48 1b0k s LEU 330 CO 0.26 -1.18 0.48 0.00 -0.29 0.00 0.00 176.35 175.63 1b0k s ALA 331 N 3.23 3.48 0.20 5.97 0.00 -1.26 -0.96 121.76 132.42 1b0k s ALA 331 Ca 0.35 -0.18 0.10 0.00 0.00 0.00 0.00 51.96 52.22 1b0k s ALA 331 Cb -0.04 -2.64 -0.04 0.00 0.00 0.00 0.00 23.12 20.39 1b0k s ALA 331 CO -0.09 0.03 -0.19 -1.01 0.00 0.00 0.00 175.76 174.50 1b0k s HIS 332 N 0.53 1.98 0.41 0.00 3.76 -0.87 -5.01 115.29 116.09 1b0k s HIS 332 Ca 0.26 -0.44 -0.21 0.00 -0.15 0.00 0.00 55.06 54.52 1b0k s HIS 332 Cb -0.15 -0.94 -0.11 0.00 1.11 0.00 0.00 32.58 32.49 1b0k s HIS 332 CO 0.11 0.45 0.93 -2.14 -0.85 0.00 0.00 174.74 173.24 1b0k s PRO 333 N -3.10 4.25 0.67 8.40 0.02 -1.26 -1.72 135.00 142.26 1b0k s PRO 333 Ca 0.21 1.10 0.43 0.00 0.02 0.00 0.00 61.00 62.76 1b0k s PRO 333 Cb -0.05 -2.27 2.32 0.00 0.02 0.00 0.00 34.50 34.52 1b0k s PRO 333 CO 0.09 0.02 2.32 0.28 -0.33 0.00 0.00 177.00 179.38 1b0k h VAL 334 N 2.00 0.02 -0.30 3.83 2.07 -1.62 -1.95 116.25 120.31 1b0k h VAL 334 Ca -0.49 0.00 -0.13 0.00 0.82 0.00 0.00 66.70 66.91 1b0k h VAL 334 Cb 1.18 0.96 -0.01 0.00 -1.52 0.00 0.00 31.29 31.90 1b0k h VAL 334 CO 0.62 0.00 -0.33 0.00 0.02 0.00 0.00 177.57 177.87 1b0k h ALA 335 N 1.92 0.86 -0.01 1.67 0.00 -1.93 -3.33 119.26 118.44 1b0k h ALA 335 Ca 0.00 -0.41 0.00 0.00 0.00 0.00 0.00 54.91 54.50 1b0k h ALA 335 Cb 0.08 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.75 1b0k h ALA 335 CO -0.00 0.63 -0.02 0.39 0.00 0.00 0.00 179.25 180.25 1b0k n GLU 336 N -4.07 0.67 -0.23 0.00 4.71 -0.80 -4.68 120.64 116.24 1b0k n GLU 336 Ca -0.01 -1.10 0.15 0.00 -0.01 0.00 0.00 57.16 56.19 1b0k n GLU 336 Cb 0.48 -1.20 0.45 0.00 -1.01 0.00 0.00 31.44 30.16 1b0k n GLU 336 CO 0.00 0.00 0.00 -0.24 0.09 0.00 0.00 177.13 176.98 1b0k h VAL 337 N 2.05 0.78 0.00 2.62 3.04 -1.50 -0.67 116.25 122.57 1b0k h VAL 337 Ca 0.00 -0.18 -0.02 0.00 -1.01 0.00 0.00 66.70 65.49 1b0k h VAL 337 Cb 0.45 0.20 -0.00 0.00 -2.01 0.00 0.00 31.29 29.92 1b0k h VAL 337 CO 0.00 0.10 -0.09 1.23 -1.01 0.00 0.00 177.57 177.79 1b0k h GLY 338 N 0.54 0.00 0.83 3.17 0.00 -1.80 -1.76 103.07 104.04 1b0k h GLY 338 Ca 0.43 0.00 -0.34 0.00 0.00 0.00 0.00 47.33 47.42 1b0k h GLY 338 CO -0.18 0.00 -1.83 1.76 0.00 0.00 0.00 176.54 176.29 1b0k h SER 339 N 0.00 0.35 0.27 0.19 0.02 -1.48 -3.28 113.55 109.63 1b0k h SER 339 Ca -0.00 -0.69 -0.15 0.00 -0.84 0.00 0.00 61.79 60.11 1b0k h SER 339 Cb 0.21 -0.12 -0.01 0.00 0.14 0.00 0.00 62.40 62.62 1b0k h SER 339 CO 0.01 1.61 -0.58 0.58 -1.14 0.00 0.00 176.83 177.32 1b0k h VAL 340 N 0.06 1.36 -0.12 2.27 2.07 -1.05 -2.33 116.25 118.51 1b0k h VAL 340 Ca -0.36 -1.90 -0.01 0.00 0.82 0.00 0.00 66.70 65.25 1b0k h VAL 340 Cb 2.04 1.93 -0.01 0.00 -1.52 0.00 0.00 31.29 33.73 1b0k h VAL 340 CO 0.11 0.57 0.03 0.00 0.02 0.00 0.00 177.57 178.30 1b0k h ALA 341 N 1.15 0.16 -0.21 1.67 0.00 -1.50 0.41 119.26 120.94 1b0k h ALA 341 Ca -0.00 -0.13 0.06 0.00 0.00 0.00 0.00 54.91 54.83 1b0k h ALA 341 Cb 1.08 -0.05 -0.07 0.00 0.00 0.00 0.00 17.79 18.76 1b0k h ALA 341 CO 0.09 -0.22 -0.32 1.49 0.00 0.00 0.00 179.25 180.30 1b0k h GLU 342 N 0.00 -0.34 0.42 0.00 4.81 -1.61 0.21 114.58 118.07 1b0k h GLU 342 Ca 0.04 0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 59.28 1b0k h GLU 342 Cb 0.24 0.08 -0.00 0.00 0.63 0.00 0.00 28.75 29.69 1b0k h GLU 342 CO -0.00 -0.23 -0.25 -0.22 -0.73 0.00 0.00 179.01 177.58 1b0k h LYS 343 N -0.35 -0.61 0.00 1.92 3.64 -1.47 -3.30 116.57 116.39 1b0k h LYS 343 Ca 0.12 0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.54 1b0k h LYS 343 Cb 0.54 0.14 0.00 0.00 -0.41 0.00 0.00 32.23 32.50 1b0k h LYS 343 CO -0.41 -0.41 0.00 -1.91 -2.27 0.00 0.00 179.45 174.46 1b0k n GLU 344 N -5.38 0.74 -1.85 1.90 4.07 0.13 -4.90 120.64 115.35 1b0k n GLU 344 Ca -0.11 0.01 -0.05 0.00 -0.06 0.00 0.00 57.16 56.95 1b0k n GLU 344 Cb 0.29 -1.50 -0.01 0.00 -0.06 0.00 0.00 31.44 30.16 1b0k n GLU 344 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1b0k n GLY 345 N 0.76 0.32 3.75 8.31 0.00 0.60 -5.02 105.19 113.92 1b0k n GLY 345 Ca 0.19 -0.70 -0.39 0.00 0.00 0.00 0.00 46.02 45.12 1b0k n GLY 345 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1b0k s TRP 346 N -2.25 3.63 0.13 1.61 0.51 -0.34 -5.04 118.94 117.20 1b0k s TRP 346 Ca 0.00 1.10 -0.35 0.00 -2.12 0.00 0.00 56.10 54.73 1b0k s TRP 346 Cb 0.00 -2.58 -0.14 0.00 -0.81 0.00 0.00 33.47 29.94 1b0k s TRP 346 CO 0.00 0.30 1.54 -2.30 -0.51 0.00 0.00 176.95 175.98 1b0k n PRO 347 N 3.00 1.92 0.08 4.98 -0.02 -1.26 -4.40 135.00 139.31 1b0k n PRO 347 Ca -0.07 0.69 0.00 0.00 -2.02 0.00 0.00 63.50 62.10 1b0k n PRO 347 Cb 0.51 -2.44 -0.04 0.00 -0.02 0.00 0.00 33.50 31.52 1b0k n PRO 347 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 1b0k h LEU 348 N 5.73 0.00 -9.51 2.45 -0.00 -1.96 -3.42 115.31 108.60 1b0k h LEU 348 Ca -0.46 0.00 -0.55 0.00 -0.00 0.00 0.00 57.88 56.87 1b0k h LEU 348 Cb 1.27 0.00 -0.05 0.00 -0.00 0.00 0.00 40.66 41.89 1b0k h LEU 348 CO 0.87 0.60 0.09 1.51 -0.00 0.00 0.00 178.44 181.50 1b0k s ASP 349 N -6.22 7.10 -0.22 -0.43 -4.77 -1.26 -1.46 116.67 109.40 1b0k s ASP 349 Ca 0.01 1.31 -0.14 0.00 -3.30 0.00 0.00 52.55 50.43 1b0k s ASP 349 Cb 0.08 -2.42 -0.04 0.00 -1.09 0.00 0.00 42.92 39.45 1b0k s ASP 349 CO 0.78 0.04 0.33 -0.63 0.70 0.00 0.00 175.17 176.39 1b0k s ILE 350 N -0.02 5.24 -0.18 2.11 1.01 -0.28 -3.81 121.20 125.26 1b0k s ILE 350 Ca 0.36 0.54 -0.14 0.00 0.00 0.00 0.00 60.65 61.40 1b0k s ILE 350 Cb -0.19 -3.66 -0.21 0.00 0.01 0.00 0.00 42.46 38.40 1b0k s ILE 350 CO 0.20 0.26 0.21 0.54 0.00 0.00 0.00 174.94 176.15 1b0k n ARG 351 N 4.59 0.65 -3.99 2.79 5.12 -0.53 -4.53 116.66 120.77 1b0k n ARG 351 Ca -0.10 0.41 -0.11 0.00 -1.93 0.00 0.00 57.85 56.12 1b0k n ARG 351 Cb 0.51 -1.70 -0.12 0.00 -1.16 0.00 0.00 32.46 29.99 1b0k n ARG 351 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 1b0k s VAL 352 N -2.46 0.20 -0.12 1.55 1.01 -1.26 -1.70 120.40 117.63 1b0k s VAL 352 Ca -0.27 -0.70 0.03 0.00 0.00 0.00 0.00 61.98 61.03 1b0k s VAL 352 Cb 0.07 -0.29 0.01 0.00 0.00 0.00 0.00 36.38 36.17 1b0k s VAL 352 CO 0.65 -0.32 -0.20 -0.83 0.00 0.00 0.00 175.10 174.40 1b0k s GLY 353 N -1.07 1.23 -0.30 4.51 0.00 0.58 -2.21 107.32 110.06 1b0k s GLY 353 Ca -0.10 -0.92 0.01 0.00 0.00 0.00 0.00 44.72 43.71 1b0k s GLY 353 CO -0.00 -0.02 0.05 1.08 0.00 0.00 0.00 173.10 174.20 1b0k s LEU 354 N 0.73 3.06 -0.07 0.66 1.02 -0.76 -1.64 118.68 121.68 1b0k s LEU 354 Ca -0.10 -1.67 -0.14 0.00 0.02 0.00 0.00 54.13 52.24 1b0k s LEU 354 Cb -0.16 -1.16 -0.05 0.00 0.02 0.00 0.00 46.19 44.84 1b0k s LEU 354 CO 0.01 -0.36 0.35 0.27 0.02 0.00 0.00 176.35 176.64 1b0k s ILE 355 N 1.36 5.18 -5.00 -0.59 -4.36 -1.01 -2.10 121.20 114.67 1b0k s ILE 355 Ca 0.06 0.70 0.00 0.00 -0.26 0.00 0.00 60.65 61.15 1b0k s ILE 355 Cb -0.18 -3.66 0.00 0.00 1.25 0.00 0.00 42.46 39.87 1b0k s ILE 355 CO -0.15 0.51 0.00 0.61 0.24 0.00 0.00 174.94 176.15 1b0k n GLY 356 N 2.36 -0.12 1.39 6.27 0.00 -1.24 -1.16 105.19 112.69 1b0k n GLY 356 Ca -0.14 -1.19 0.17 0.00 0.00 0.00 0.00 46.02 44.87 1b0k n GLY 356 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1b0k n SER 357 N 0.00 -7.90 0.21 1.61 3.41 -1.26 -3.44 113.62 106.25 1b0k n SER 357 Ca 0.00 1.23 0.13 0.00 -0.26 0.00 0.00 58.87 59.98 1b0k n SER 357 Cb 0.00 -4.66 0.71 0.00 -0.26 0.00 0.00 64.21 60.00 1b0k n SER 357 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1b0k h THR 359 N 0.00 1.26 -0.71 0.00 2.02 -1.86 -3.40 112.91 110.21 1b0k h THR 359 Ca 0.00 -2.72 -0.32 0.00 0.77 0.00 0.00 66.41 64.14 1b0k h THR 359 Cb 0.11 2.58 -0.25 0.00 -1.74 0.00 0.00 68.15 68.85 1b0k h THR 359 CO 0.00 0.70 -0.73 0.59 0.37 0.00 0.00 175.52 176.45 1b0k n ASN 360 N -3.31 -1.00 -0.57 4.18 4.13 -0.77 -4.54 115.26 113.38 1b0k n ASN 360 Ca 0.01 -3.26 0.06 0.00 1.68 0.00 0.00 54.58 53.07 1b0k n ASN 360 Cb 0.81 0.83 0.18 0.00 -1.54 0.00 0.00 39.78 40.06 1b0k n ASN 360 CO 0.00 0.00 0.00 -1.54 0.28 0.00 0.00 177.26 176.00 1b0k n SER 361 N 0.19 1.74 -4.99 6.41 3.41 -0.99 -3.59 113.62 115.79 1b0k n SER 361 Ca 0.11 -3.56 -0.19 0.00 -0.26 0.00 0.00 58.87 54.96 1b0k n SER 361 Cb 0.71 -0.49 0.01 0.00 -0.26 0.00 0.00 64.21 64.19 1b0k n SER 361 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1b0k s SER 362 N -3.03 5.67 0.28 4.04 1.04 -1.26 -1.80 113.70 118.64 1b0k s SER 362 Ca 0.36 -0.16 -0.01 0.00 0.48 0.00 0.00 55.95 56.62 1b0k s SER 362 Cb 0.35 -0.99 0.63 0.00 0.10 0.00 0.00 66.02 66.11 1b0k s SER 362 CO -0.06 -0.76 1.64 0.22 0.98 0.00 0.00 173.24 175.26 1b0k h TYR 363 N 0.53 0.19 -0.14 5.02 5.03 -1.93 -0.48 116.97 125.20 1b0k h TYR 363 Ca -0.43 0.05 -0.02 0.00 2.58 0.00 0.00 58.73 60.91 1b0k h TYR 363 Cb 1.27 0.05 -0.01 0.00 1.55 0.00 0.00 36.73 39.60 1b0k h TYR 363 CO 0.41 -0.24 0.01 1.49 -1.32 0.00 0.00 178.16 178.51 1b0k h GLU 364 N 0.16 0.24 -0.47 1.82 4.81 -1.76 -1.67 114.58 117.71 1b0k h GLU 364 Ca 0.51 -0.07 0.04 0.00 -0.13 0.00 0.00 59.36 59.71 1b0k h GLU 364 Cb 1.00 -0.02 -0.04 0.00 0.63 0.00 0.00 28.75 30.31 1b0k h GLU 364 CO -0.68 0.46 0.24 -0.44 -0.73 0.00 0.00 179.01 177.85 1b0k h ASP 365 N -0.00 0.34 -0.34 1.04 3.32 -1.71 -1.00 116.42 118.07 1b0k h ASP 365 Ca 0.04 0.03 -0.03 0.00 0.02 0.00 0.00 57.03 57.09 1b0k h ASP 365 Cb 0.34 -0.04 -0.02 0.00 0.22 0.00 0.00 39.33 39.84 1b0k h ASP 365 CO 0.01 0.24 0.13 0.24 -1.72 0.00 0.00 179.24 178.13 1b0k h MET 366 N 0.47 0.58 0.09 3.56 2.86 -1.11 -2.21 114.93 119.18 1b0k h MET 366 Ca 0.21 -0.09 -0.29 0.00 -2.06 0.00 0.00 59.70 57.48 1b0k h MET 366 Cb 0.12 -0.10 0.02 0.00 0.06 0.00 0.00 31.60 31.70 1b0k h MET 366 CO -0.15 0.51 -1.19 0.78 1.06 0.00 0.00 176.91 177.93 1b0k h GLY 367 N 0.77 0.65 0.97 8.32 0.00 -0.83 -0.46 103.07 112.49 1b0k h GLY 367 Ca 0.14 -1.32 -0.06 0.00 0.00 0.00 0.00 47.33 46.09 1b0k h GLY 367 CO -0.01 1.17 0.08 3.21 0.00 0.00 0.00 176.54 180.99 1b0k h ARG 368 N 0.27 0.77 0.12 4.80 3.08 -1.23 -1.57 114.38 120.62 1b0k h ARG 368 Ca -0.16 -0.21 0.02 0.00 0.07 0.00 0.00 59.98 59.70 1b0k h ARG 368 Cb 1.86 -0.09 -0.04 0.00 0.08 0.00 0.00 29.97 31.78 1b0k h ARG 368 CO 0.22 0.79 -0.30 0.77 -1.07 0.00 0.00 179.97 180.38 1b0k h SER 369 N 0.64 -0.86 -0.80 7.04 0.02 -1.39 -2.76 113.55 115.45 1b0k h SER 369 Ca 0.14 0.10 0.16 0.00 -0.84 0.00 0.00 61.79 61.35 1b0k h SER 369 Cb 0.39 0.33 -0.06 0.00 0.14 0.00 0.00 62.40 63.19 1b0k h SER 369 CO 0.01 -0.39 0.53 0.00 -1.14 0.00 0.00 176.83 175.84 1b0k h ALA 370 N 0.16 2.10 0.00 3.77 0.00 -0.92 -1.13 119.26 123.24 1b0k h ALA 370 Ca 0.03 0.01 -0.05 0.00 0.00 0.00 0.00 54.91 54.90 1b0k h ALA 370 Cb 0.55 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 1b0k h ALA 370 CO -0.17 -0.32 -0.22 0.00 0.00 0.00 0.00 179.25 178.54 1b0k h ALA 371 N 1.63 1.14 0.10 0.00 0.00 -0.99 -0.47 119.26 120.68 1b0k h ALA 371 Ca 0.40 -0.20 -0.15 0.00 0.00 0.00 0.00 54.91 54.96 1b0k h ALA 371 Cb 0.89 -0.03 0.02 0.00 0.00 0.00 0.00 17.79 18.67 1b0k h ALA 371 CO -0.14 0.27 -0.67 0.28 0.00 0.00 0.00 179.25 179.00 1b0k h VAL 372 N 0.00 1.54 -0.60 0.00 2.07 -1.16 -3.35 116.25 114.75 1b0k h VAL 372 Ca -0.00 -2.45 0.12 0.00 0.82 0.00 0.00 66.70 65.19 1b0k h VAL 372 Cb 0.60 3.15 -0.09 0.00 -1.52 0.00 0.00 31.29 33.43 1b0k h VAL 372 CO 0.03 0.69 0.07 0.00 0.02 0.00 0.00 177.57 178.37 1b0k h ALA 373 N 0.10 0.66 0.00 1.67 0.00 -1.18 -1.40 119.26 119.11 1b0k h ALA 373 Ca -0.11 0.16 -0.00 0.00 0.00 0.00 0.00 54.91 54.95 1b0k h ALA 373 Cb 1.50 0.25 -0.00 0.00 0.00 0.00 0.00 17.79 19.54 1b0k h ALA 373 CO 0.13 -0.35 -0.02 1.57 0.00 0.00 0.00 179.25 180.57 1b0k h LYS 374 N 0.19 0.00 -0.28 0.00 5.09 -1.24 -2.08 116.57 118.25 1b0k h LYS 374 Ca 0.32 0.00 -0.17 0.00 0.09 0.00 0.00 60.65 60.88 1b0k h LYS 374 Cb 0.50 0.00 0.00 0.00 0.10 0.00 0.00 32.23 32.83 1b0k h LYS 374 CO -0.46 0.02 -0.51 1.96 -2.09 0.00 0.00 179.45 178.38 1b0k h GLN 375 N 0.00 0.83 -0.08 0.07 4.20 -1.40 -1.18 115.11 117.56 1b0k h GLN 375 Ca -0.00 -0.53 -0.01 0.00 0.06 0.00 0.00 58.65 58.17 1b0k h GLN 375 Cb 0.46 0.06 -0.00 0.00 0.30 0.00 0.00 27.48 28.30 1b0k h GLN 375 CO 0.00 1.16 0.00 0.00 -0.67 0.00 0.00 178.83 179.32 1b0k h ALA 376 N 0.67 0.10 -0.82 3.87 0.00 -1.27 -3.08 119.26 118.74 1b0k h ALA 376 Ca 0.02 -0.17 0.13 0.00 0.00 0.00 0.00 54.91 54.88 1b0k h ALA 376 Cb 1.11 -0.03 -0.09 0.00 0.00 0.00 0.00 17.79 18.79 1b0k h ALA 376 CO 0.11 -0.22 0.42 -0.07 0.00 0.00 0.00 179.25 179.49 1b0k h LEU 377 N -0.14 0.52 -2.18 0.00 3.38 -1.30 -1.62 115.31 113.98 1b0k h LEU 377 Ca 0.02 0.08 0.06 0.00 0.09 0.00 0.00 57.88 58.13 1b0k h LEU 377 Cb 0.33 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 41.07 1b0k h LEU 377 CO 0.00 0.25 0.20 0.00 0.09 0.00 0.00 178.44 178.98 1b0k h ALA 378 N 1.52 1.92 -0.69 1.53 0.00 -1.12 0.39 119.26 122.80 1b0k h ALA 378 Ca 0.43 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.33 1b0k h ALA 378 Cb 0.56 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.36 1b0k h ALA 378 CO -0.33 -0.31 0.00 0.72 0.00 0.00 0.00 179.25 179.33 1b0k n HIS 379 N -3.96 1.05 -2.83 0.00 8.25 -0.66 -4.96 115.22 112.11 1b0k n HIS 379 Ca 0.02 -0.52 -0.08 0.00 -0.26 0.00 0.00 57.72 56.88 1b0k n HIS 379 Cb 0.34 -0.05 0.03 0.00 1.12 0.00 0.00 29.99 31.42 1b0k n HIS 379 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1b0k n GLY 380 N 1.46 0.45 3.56 -1.41 0.00 0.13 -1.06 105.19 108.32 1b0k n GLY 380 Ca 0.24 -0.37 -0.24 0.00 0.00 0.00 0.00 46.02 45.65 1b0k n GLY 380 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1b0k s LEU 381 N -3.06 2.87 0.14 0.99 1.43 -0.88 -4.47 118.68 115.70 1b0k s LEU 381 Ca 0.18 -0.90 -0.02 0.00 -1.03 0.00 0.00 54.13 52.36 1b0k s LEU 381 Cb -0.08 -1.35 -0.03 0.00 0.03 0.00 0.00 46.19 44.76 1b0k s LEU 381 CO 0.24 -0.03 0.10 -0.54 0.23 0.00 0.00 176.35 176.35 1b0k s LYS 382 N -3.60 0.99 0.14 1.70 1.02 -1.26 -3.83 119.74 114.90 1b0k s LYS 382 Ca 0.31 -1.40 -0.33 0.00 0.02 0.00 0.00 55.97 54.57 1b0k s LYS 382 Cb -0.04 0.27 -0.12 0.00 -0.52 0.00 0.00 37.83 37.41 1b0k s LYS 382 CO 0.17 -0.30 1.71 0.00 -0.92 0.00 0.00 175.35 176.02 1b0k h LYS 384 N 7.07 0.83 -7.54 0.00 3.11 -1.37 -3.46 116.57 115.22 1b0k h LYS 384 Ca -0.45 -0.60 -0.46 0.00 -2.81 0.00 0.00 60.65 56.34 1b0k h LYS 384 Cb 1.23 0.10 0.13 0.00 -1.00 0.00 0.00 32.23 32.69 1b0k h LYS 384 CO 0.93 1.22 0.30 -1.12 -2.81 0.00 0.00 179.45 177.96 1b0k s SER 385 N -7.03 3.60 0.04 4.20 0.01 -0.41 -4.92 113.70 109.20 1b0k s SER 385 Ca -0.10 -0.00 -0.19 0.00 1.31 0.00 0.00 55.95 56.97 1b0k s SER 385 Cb 0.09 -0.17 -0.06 0.00 0.21 0.00 0.00 66.02 66.10 1b0k s SER 385 CO 0.90 -2.39 0.55 -1.58 0.41 0.00 0.00 173.24 171.12 1b0k s GLN 386 N -5.59 4.18 -0.10 12.44 0.74 -0.69 -4.96 119.66 125.68 1b0k s GLN 386 Ca 0.71 0.68 0.00 0.00 0.05 0.00 0.00 55.36 56.80 1b0k s GLN 386 Cb -0.04 -3.26 0.02 0.00 1.10 0.00 0.00 33.01 30.83 1b0k s GLN 386 CO 0.50 0.59 -0.10 0.12 -0.55 0.00 0.00 175.29 175.84 1b0k s PHE 387 N -0.90 1.58 0.08 1.67 5.36 -1.26 -0.31 117.98 124.21 1b0k s PHE 387 Ca 0.28 -0.76 0.08 0.00 -0.96 0.00 0.00 56.93 55.58 1b0k s PHE 387 Cb -0.19 -1.24 -0.03 0.00 -0.34 0.00 0.00 43.02 41.22 1b0k s PHE 387 CO 0.18 -0.47 -0.21 0.95 -1.46 0.00 0.00 175.22 174.21 1b0k s THR 388 N 1.37 1.71 -0.08 0.12 -4.23 -0.65 -1.44 115.64 112.44 1b0k s THR 388 Ca -0.01 -1.43 0.00 0.00 -1.18 0.00 0.00 61.69 59.08 1b0k s THR 388 Cb -0.14 -1.53 0.02 0.00 1.34 0.00 0.00 72.50 72.20 1b0k s THR 388 CO -0.05 0.03 -0.07 -0.63 -0.54 0.00 0.00 174.62 173.36 1b0k s ILE 389 N -1.04 0.85 -0.23 2.99 1.01 0.34 -2.42 121.20 122.71 1b0k s ILE 389 Ca 0.07 -0.23 -0.03 0.00 0.00 0.00 0.00 60.65 60.46 1b0k s ILE 389 Cb -0.10 -0.87 0.01 0.00 0.01 0.00 0.00 42.46 41.51 1b0k s ILE 389 CO 0.03 0.32 -0.07 -0.89 0.00 0.00 0.00 174.94 174.34 1b0k s THR 390 N 1.37 3.05 0.40 2.92 2.01 -0.31 -1.31 115.64 123.77 1b0k s THR 390 Ca -0.02 -0.72 -0.25 0.00 0.31 0.00 0.00 61.69 61.00 1b0k s THR 390 Cb -0.14 -2.43 -0.08 0.00 0.01 0.00 0.00 72.50 69.86 1b0k s THR 390 CO -0.04 0.36 1.17 -2.84 -0.69 0.00 0.00 174.62 172.58 1b0k s PRO 391 N 1.41 4.03 0.32 4.92 0.02 -1.26 -4.34 135.00 140.10 1b0k s PRO 391 Ca 0.04 1.83 0.12 0.00 0.02 0.00 0.00 61.00 63.01 1b0k s PRO 391 Cb -0.15 -2.65 0.54 0.00 0.02 0.00 0.00 34.50 32.26 1b0k s PRO 391 CO -0.05 -0.33 1.71 0.78 -0.33 0.00 0.00 177.00 178.78 1b0k h GLY 392 N 2.59 0.00 -1.86 0.52 0.00 -1.72 -3.39 103.07 99.21 1b0k h GLY 392 Ca -0.49 0.00 0.05 0.00 0.00 0.00 0.00 47.33 46.90 1b0k h GLY 392 CO 0.62 0.00 0.23 -1.35 0.00 0.00 0.00 176.54 176.05 1b0k s SER 393 N -6.83 -0.21 0.17 0.19 1.04 -1.26 -1.70 113.70 105.10 1b0k s SER 393 Ca -0.02 -0.70 -0.14 0.00 0.48 0.00 0.00 55.95 55.57 1b0k s SER 393 Cb 0.13 0.75 0.13 0.00 0.10 0.00 0.00 66.02 67.13 1b0k s SER 393 CO 0.74 -1.40 1.73 -0.33 0.98 0.00 0.00 173.24 174.96 1b0k h GLU 394 N 2.00 0.25 -0.15 4.02 4.39 -1.37 -0.93 114.58 122.79 1b0k h GLU 394 Ca -0.21 -0.01 0.03 0.00 0.34 0.00 0.00 59.36 59.51 1b0k h GLU 394 Cb 1.25 -0.06 -0.03 0.00 -0.10 0.00 0.00 28.75 29.81 1b0k h GLU 394 CO 0.26 0.16 -0.06 0.37 -1.16 0.00 0.00 179.01 178.58 1b0k h GLN 395 N 0.25 -0.04 -0.75 2.33 4.15 -1.76 0.11 115.11 119.40 1b0k h GLN 395 Ca 0.21 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.64 1b0k h GLN 395 Cb 0.25 0.01 -0.04 0.00 0.21 0.00 0.00 27.48 27.91 1b0k h GLN 395 CO -0.26 -0.02 0.47 0.82 -1.93 0.00 0.00 178.83 177.91 1b0k h ILE 396 N -0.04 1.20 0.55 2.39 2.04 -1.77 -1.79 117.51 120.09 1b0k h ILE 396 Ca 0.08 -0.41 -0.03 0.00 1.00 0.00 0.00 64.86 65.50 1b0k h ILE 396 Cb 0.16 0.13 0.01 0.00 -0.74 0.00 0.00 36.82 36.38 1b0k h ILE 396 CO -0.18 0.21 -0.27 -0.09 0.00 0.00 0.00 178.15 177.82 1b0k h ARG 397 N 1.02 -0.72 -0.16 2.37 2.43 -0.89 -0.12 114.38 118.31 1b0k h ARG 397 Ca 0.27 0.05 0.04 0.00 -0.81 0.00 0.00 59.98 59.53 1b0k h ARG 397 Cb -0.07 0.16 -0.04 0.00 -0.42 0.00 0.00 29.97 29.60 1b0k h ARG 397 CO -0.05 -0.48 -0.10 0.00 -1.51 0.00 0.00 179.97 177.82 1b0k h ALA 398 N -0.29 0.03 -0.46 2.80 0.00 -0.85 -2.53 119.26 117.95 1b0k h ALA 398 Ca -0.08 0.06 -0.10 0.00 0.00 0.00 0.00 54.91 54.79 1b0k h ALA 398 Cb 0.57 0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.57 1b0k h ALA 398 CO 0.13 -0.54 -0.13 1.15 0.00 0.00 0.00 179.25 179.85 1b0k h THR 399 N -0.10 1.26 0.00 0.00 2.02 -1.10 -2.40 112.91 112.59 1b0k h THR 399 Ca 0.09 -1.23 -0.03 0.00 0.77 0.00 0.00 66.41 66.02 1b0k h THR 399 Cb 0.24 1.05 -0.00 0.00 -1.74 0.00 0.00 68.15 67.69 1b0k h THR 399 CO -0.22 0.42 -0.13 0.16 0.37 0.00 0.00 175.52 176.12 1b0k h ILE 400 N 0.76 0.28 0.02 3.11 3.07 -1.00 -0.88 117.51 122.88 1b0k h ILE 400 Ca 0.12 -1.02 -0.00 0.00 1.55 0.00 0.00 64.86 65.51 1b0k h ILE 400 Cb 0.64 1.82 0.00 0.00 -0.27 0.00 0.00 36.82 39.01 1b0k h ILE 400 CO 0.04 0.13 -0.01 -0.08 -1.05 0.00 0.00 178.15 177.18 1b0k h GLU 401 N 0.00 -0.03 -0.29 0.16 4.57 -1.34 0.34 114.58 117.99 1b0k h GLU 401 Ca -0.00 0.00 -0.01 0.00 -1.18 0.00 0.00 59.36 58.17 1b0k h GLU 401 Cb 0.80 0.01 -0.01 0.00 -0.16 0.00 0.00 28.75 29.39 1b0k h GLU 401 CO 0.02 0.27 0.12 -0.09 -1.18 0.00 0.00 179.01 178.15 1b0k h ARG 402 N -0.34 0.43 -0.06 1.92 1.12 -1.25 -3.11 114.38 113.07 1b0k h ARG 402 Ca -0.00 -0.07 0.00 0.00 -1.11 0.00 0.00 59.98 58.79 1b0k h ARG 402 Cb 0.32 -0.07 0.00 0.00 -0.01 0.00 0.00 29.97 30.21 1b0k h ARG 402 CO 0.01 0.44 0.00 -0.25 -3.11 0.00 0.00 179.97 177.05 1b0k n ASP 403 N -4.76 0.41 0.00 -3.80 8.00 -0.35 -4.91 116.55 111.14 1b0k n ASP 403 Ca -0.02 -1.81 0.00 0.00 0.71 0.00 0.00 54.79 53.67 1b0k n ASP 403 Cb 0.12 -0.04 0.00 0.00 -0.02 0.00 0.00 41.12 41.18 1b0k n ASP 403 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1b0k n GLY 404 N 0.72 1.20 0.21 0.44 0.00 -1.12 -4.96 105.19 101.67 1b0k n GLY 404 Ca 0.07 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.95 1b0k n GLY 404 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 1b0k h TYR 405 N 0.00 0.89 -0.76 1.61 0.05 -1.21 -3.13 116.97 114.41 1b0k h TYR 405 Ca 0.00 -0.38 0.08 0.00 0.05 0.00 0.00 58.73 58.48 1b0k h TYR 405 Cb 0.00 -0.14 -0.05 0.00 1.01 0.00 0.00 36.73 37.55 1b0k h TYR 405 CO 0.00 1.19 0.50 0.00 -1.05 0.00 0.00 178.16 178.80 1b0k h ALA 406 N 0.71 1.73 0.00 3.88 0.00 -1.65 -2.55 119.26 121.39 1b0k h ALA 406 Ca -0.04 -0.01 -0.06 0.00 0.00 0.00 0.00 54.91 54.79 1b0k h ALA 406 Cb 1.34 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.94 1b0k h ALA 406 CO 0.14 0.13 -0.30 0.37 0.00 0.00 0.00 179.25 179.59 1b0k h GLN 407 N 0.75 0.00 -0.27 0.00 5.75 -1.82 -1.19 115.11 118.33 1b0k h GLN 407 Ca 0.34 0.00 -0.11 0.00 -0.15 0.00 0.00 58.65 58.74 1b0k h GLN 407 Cb 0.36 0.00 -0.00 0.00 1.07 0.00 0.00 27.48 28.90 1b0k h GLN 407 CO -0.12 0.30 -0.25 0.28 -2.65 0.00 0.00 178.83 176.39 1b0k h VAL 408 N 0.00 1.31 -0.56 2.39 2.07 -1.51 0.15 116.25 120.10 1b0k h VAL 408 Ca -0.00 -1.41 -0.01 0.00 0.82 0.00 0.00 66.70 66.10 1b0k h VAL 408 Cb 0.99 1.62 -0.03 0.00 -1.52 0.00 0.00 31.29 32.35 1b0k h VAL 408 CO 0.04 0.45 0.31 -0.07 0.02 0.00 0.00 177.57 178.31 1b0k h LEU 409 N 0.37 0.69 -0.25 2.57 3.38 -1.49 -0.96 115.31 119.62 1b0k h LEU 409 Ca 0.04 -0.09 -0.03 0.00 0.09 0.00 0.00 57.88 57.90 1b0k h LEU 409 Cb 0.81 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.37 1b0k h LEU 409 CO 0.06 0.58 0.05 0.03 0.09 0.00 0.00 178.44 179.25 1b0k h ARG 410 N 0.75 0.40 0.00 1.13 3.08 -1.16 -2.04 114.38 116.54 1b0k h ARG 410 Ca 0.20 -0.11 -0.02 0.00 0.07 0.00 0.00 59.98 60.12 1b0k h ARG 410 Cb 0.04 -0.05 -0.00 0.00 0.08 0.00 0.00 29.97 30.04 1b0k h ARG 410 CO -0.03 0.53 -0.11 -0.44 -1.07 0.00 0.00 179.97 178.85 1b0k h ASP 411 N 0.22 0.00 0.76 7.04 3.32 -0.44 -1.15 116.42 126.17 1b0k h ASP 411 Ca 0.08 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.13 1b0k h ASP 411 Cb 0.31 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.86 1b0k h ASP 411 CO 0.00 0.11 0.00 1.33 -1.72 0.00 0.00 179.24 178.96 1b0k n VAL 412 N -3.89 0.44 0.00 -1.35 0.24 -0.39 -4.90 118.33 108.48 1b0k n VAL 412 Ca -0.02 0.11 0.00 0.00 -2.04 0.00 0.00 64.34 62.39 1b0k n VAL 412 Cb 0.20 -0.72 0.00 0.00 -1.47 0.00 0.00 33.84 31.85 1b0k n VAL 412 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1b0k n GLY 413 N 0.82 1.91 3.89 7.63 0.00 -0.44 -0.85 105.19 118.16 1b0k n GLY 413 Ca 0.06 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.79 1b0k n GLY 413 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1b0k s GLY 414 N -2.00 1.90 -0.10 -0.02 0.00 -0.77 -4.27 107.32 102.06 1b0k s GLY 414 Ca 0.00 -1.00 -0.01 0.00 0.00 0.00 0.00 44.72 43.71 1b0k s GLY 414 CO 0.00 -1.00 -0.04 -1.50 0.00 0.00 0.00 173.10 170.56 1b0k s ILE 415 N -1.63 3.89 -0.15 0.90 1.10 -0.52 -4.41 121.20 120.38 1b0k s ILE 415 Ca 0.33 -0.39 -0.18 0.00 -0.51 0.00 0.00 60.65 59.90 1b0k s ILE 415 Cb -0.12 -2.63 -0.04 0.00 0.15 0.00 0.00 42.46 39.82 1b0k s ILE 415 CO 0.27 0.57 0.50 -0.69 -2.11 0.00 0.00 174.94 173.48 1b0k s VAL 416 N -0.51 5.15 0.43 4.00 1.01 -1.26 -0.50 120.40 128.73 1b0k s VAL 416 Ca 0.08 0.96 0.08 0.00 0.00 0.00 0.00 61.98 63.10 1b0k s VAL 416 Cb -0.12 -3.83 -0.00 0.00 0.00 0.00 0.00 36.38 32.43 1b0k s VAL 416 CO 0.02 0.27 0.46 -0.76 0.00 0.00 0.00 175.10 175.09 1b0k s LEU 417 N 1.02 3.41 0.88 3.92 1.43 -0.43 -0.44 118.68 128.47 1b0k s LEU 417 Ca 0.25 -0.69 -0.13 0.00 -1.03 0.00 0.00 54.13 52.53 1b0k s LEU 417 Cb -0.15 -2.15 0.05 0.00 0.03 0.00 0.00 46.19 43.97 1b0k s LEU 417 CO 0.10 -0.75 0.71 0.00 0.23 0.00 0.00 176.35 176.63 1b0k n ALA 418 N -1.69 -1.62 -2.34 4.21 0.00 -1.26 -4.38 120.51 113.43 1b0k n ALA 418 Ca 0.05 -0.48 -0.41 0.00 0.00 0.00 0.00 53.44 52.60 1b0k n ALA 418 Cb 0.61 -1.96 -0.01 0.00 0.00 0.00 0.00 19.45 18.09 1b0k n ALA 418 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1b0k n ASN 419 N -2.01 4.49 -3.70 0.00 3.02 -1.26 -4.65 115.26 111.14 1b0k n ASN 419 Ca 0.09 -2.88 -0.10 0.00 -0.03 0.00 0.00 54.58 51.67 1b0k n ASN 419 Cb 0.52 -1.72 -0.04 0.00 -0.61 0.00 0.00 39.78 37.93 1b0k n ASN 419 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1b0k s ALA 420 N 4.84 -0.93 0.16 5.41 0.00 -1.26 -3.58 121.76 126.39 1b0k s ALA 420 Ca 0.55 -0.17 -0.23 0.00 0.00 0.00 0.00 51.96 52.10 1b0k s ALA 420 Cb 0.05 0.82 0.04 0.00 0.00 0.00 0.00 23.12 24.03 1b0k s ALA 420 CO 0.06 -0.76 1.61 0.00 0.00 0.00 0.00 175.76 176.67 1b0k n GLY 422 N -1.41 2.97 0.25 0.00 0.00 -1.26 -2.96 105.19 102.78 1b0k n GLY 422 Ca -0.00 -0.20 0.11 0.00 0.00 0.00 0.00 46.02 45.93 1b0k n GLY 422 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1b0k h PRO 423 N 0.00 0.00 -0.18 1.61 0.11 -1.90 -1.06 132.00 130.57 1b0k h PRO 423 Ca 0.00 0.00 -0.19 0.00 0.11 0.00 0.00 66.00 65.92 1b0k h PRO 423 Cb 0.00 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.11 1b0k h PRO 423 CO 0.00 0.00 -0.65 0.00 -0.21 0.00 0.00 178.00 177.14 1b0k n ILE 425 N -3.94 3.60 -2.27 0.00 -0.00 -1.04 -4.74 119.36 110.96 1b0k n ILE 425 Ca -0.05 -3.07 -0.20 0.00 -0.00 0.00 0.00 62.75 59.43 1b0k n ILE 425 Cb 0.67 -1.16 -0.02 0.00 -0.00 0.00 0.00 39.64 39.13 1b0k n ILE 425 CO 0.00 0.00 0.00 0.61 -0.00 0.00 0.00 176.55 177.16 1b0k n GLY 426 N -0.89 -0.09 2.75 7.39 0.00 -0.64 -1.78 105.19 111.94 1b0k n GLY 426 Ca 0.62 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 46.22 1b0k n GLY 426 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1b0k n GLN 427 N -2.89 4.36 -4.61 1.61 1.13 -0.43 -4.43 117.38 112.12 1b0k n GLN 427 Ca -0.23 -3.90 -0.26 0.00 -1.94 0.00 0.00 57.00 50.67 1b0k n GLN 427 Cb 0.68 -2.69 -0.17 0.00 0.11 0.00 0.00 30.24 28.18 1b0k n GLN 427 CO 0.00 0.00 0.00 -0.46 -1.44 0.00 0.00 177.06 175.16 1b0k s TRP 428 N -1.44 1.58 -0.99 1.08 -0.00 -1.26 -0.86 118.94 117.05 1b0k s TRP 428 Ca 0.42 -0.61 -0.13 0.00 -0.00 0.00 0.00 56.10 55.78 1b0k s TRP 428 Cb 0.12 -1.15 0.22 0.00 -0.00 0.00 0.00 33.47 32.67 1b0k s TRP 428 CO -0.02 -0.31 1.03 0.34 -0.00 0.00 0.00 176.95 177.99 1b0k s ASP 429 N 0.70 6.99 -0.05 5.86 2.15 -0.22 -4.91 116.67 127.18 1b0k s ASP 429 Ca -0.14 -2.97 -0.19 0.00 0.43 0.00 0.00 52.55 49.68 1b0k s ASP 429 Cb -0.16 -2.26 -0.05 0.00 -0.30 0.00 0.00 42.92 40.15 1b0k s ASP 429 CO 0.03 -0.56 0.55 -0.60 -0.17 0.00 0.00 175.17 174.42 1b0k s ARG 430 N 0.18 4.30 0.00 4.34 3.52 -1.26 -4.83 118.95 125.19 1b0k s ARG 430 Ca 0.28 0.62 0.00 0.00 -0.13 0.00 0.00 55.73 56.49 1b0k s ARG 430 Cb -0.08 -3.37 0.00 0.00 -1.56 0.00 0.00 34.95 29.93 1b0k s ARG 430 CO -0.08 0.30 0.49 1.63 -0.81 0.00 0.00 175.30 176.83 1b0k n LYS 431 N 3.07 0.51 0.00 5.12 5.02 -1.26 -4.81 118.16 125.80 1b0k n LYS 431 Ca -0.07 -0.61 0.10 0.00 -2.02 0.00 0.00 58.31 55.71 1b0k n LYS 431 Cb 0.51 -0.72 0.59 0.00 -0.02 0.00 0.00 35.03 35.39 1b0k n LYS 431 CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 1b0k n ASP 432 N -0.12 0.00 -3.97 4.39 5.75 -1.26 -4.85 116.55 116.49 1b0k n ASP 432 Ca 0.00 -0.70 -0.09 0.00 -0.01 0.00 0.00 54.79 53.99 1b0k n ASP 432 Cb 0.27 0.00 -0.11 0.00 -1.03 0.00 0.00 41.12 40.25 1b0k n ASP 432 CO 0.00 0.00 0.00 0.27 -0.11 0.00 0.00 177.20 177.36 1b0k s ILE 433 N -2.00 0.10 0.91 2.12 -4.36 -1.26 -5.16 121.20 111.55 1b0k s ILE 433 Ca 0.30 -0.80 -0.13 0.00 -0.26 0.00 0.00 60.65 59.76 1b0k s ILE 433 Cb 0.14 -0.24 0.18 0.00 1.25 0.00 0.00 42.46 43.79 1b0k s ILE 433 CO 0.23 -0.44 1.26 -1.59 0.24 0.00 0.00 174.94 174.65 1b0k s LYS 434 N -1.28 0.88 0.41 0.37 -2.85 -1.26 -5.00 119.74 111.01 1b0k s LYS 434 Ca -0.14 -0.50 -0.24 0.00 -1.00 0.00 0.00 55.97 54.10 1b0k s LYS 434 Cb -0.09 -1.93 -0.09 0.00 -2.06 0.00 0.00 37.83 33.66 1b0k s LYS 434 CO -0.01 -2.21 1.07 0.21 0.10 0.00 0.00 175.35 174.51 1b0k s LYS 435 N -5.75 4.07 0.00 1.78 2.47 -1.26 -3.42 119.74 117.63 1b0k s LYS 435 Ca 0.72 1.56 0.00 0.00 -1.56 0.00 0.00 55.97 56.69 1b0k s LYS 435 Cb -0.04 -2.50 0.00 0.00 -1.46 0.00 0.00 37.83 33.83 1b0k s LYS 435 CO 0.51 -0.23 0.00 0.41 0.16 0.00 0.00 175.35 176.20 1b0k n GLY 436 N 0.33 0.82 3.77 5.54 0.00 -1.26 -5.01 105.19 109.38 1b0k n GLY 436 Ca 0.06 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.68 1b0k n GLY 436 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1b0k s GLU 437 N -0.01 4.66 -0.20 1.61 2.12 -1.22 -4.87 118.70 120.80 1b0k s GLU 437 Ca 0.00 1.27 -0.20 0.00 0.36 0.00 0.00 54.97 56.39 1b0k s GLU 437 Cb 0.00 -3.26 -0.03 0.00 0.26 0.00 0.00 34.13 31.10 1b0k s GLU 437 CO 0.00 0.55 0.61 0.21 -0.54 0.00 0.00 175.26 176.09 1b0k s LYS 438 N -1.17 4.20 0.20 4.30 2.20 -1.26 -4.36 119.74 123.84 1b0k s LYS 438 Ca 0.38 0.57 -0.13 0.00 -0.36 0.00 0.00 55.97 56.43 1b0k s LYS 438 Cb -0.24 -3.58 0.00 0.00 -1.51 0.00 0.00 37.83 32.50 1b0k s LYS 438 CO 0.28 -0.24 0.42 0.54 -0.36 0.00 0.00 175.35 175.99 1b0k s ASN 439 N 1.22 -0.09 -0.16 1.43 4.22 -1.18 -4.99 114.94 115.40 1b0k s ASN 439 Ca 0.27 -0.77 -0.01 0.00 -2.14 0.00 0.00 52.86 50.21 1b0k s ASN 439 Cb -0.16 0.53 -0.01 0.00 1.28 0.00 0.00 41.25 42.89 1b0k s ASN 439 CO 0.10 -1.02 -0.11 -0.89 -2.04 0.00 0.00 177.10 173.14 1b0k s THR 440 N -3.95 3.11 -0.13 0.54 2.01 -1.25 -0.14 115.64 115.82 1b0k s THR 440 Ca 0.16 -0.62 0.02 0.00 0.31 0.00 0.00 61.69 61.56 1b0k s THR 440 Cb 0.01 -2.34 0.00 0.00 0.01 0.00 0.00 72.50 70.18 1b0k s THR 440 CO 0.02 0.50 -0.19 0.27 -0.69 0.00 0.00 174.62 174.52 1b0k s ILE 441 N 0.71 2.37 -0.14 1.82 -4.36 -0.64 -1.45 121.20 119.52 1b0k s ILE 441 Ca -0.05 -0.89 -0.04 0.00 -0.26 0.00 0.00 60.65 59.41 1b0k s ILE 441 Cb -0.15 -1.96 -0.03 0.00 1.25 0.00 0.00 42.46 41.56 1b0k s ILE 441 CO 0.02 0.54 0.02 0.68 0.24 0.00 0.00 174.94 176.43 1b0k s VAL 442 N 0.64 4.39 0.24 8.37 -7.23 -0.94 -2.44 120.40 123.43 1b0k s VAL 442 Ca -0.10 -0.19 0.08 0.00 -1.81 0.00 0.00 61.98 59.96 1b0k s VAL 442 Cb -0.16 -2.92 -0.05 0.00 0.56 0.00 0.00 36.38 33.81 1b0k s VAL 442 CO 0.02 0.53 -0.12 0.42 -0.31 0.00 0.00 175.10 175.64 1b0k s THR 443 N -0.13 1.77 -0.46 5.32 -4.23 0.28 -1.83 115.64 116.37 1b0k s THR 443 Ca 0.05 -2.20 0.04 0.00 -1.18 0.00 0.00 61.69 58.40 1b0k s THR 443 Cb -0.12 -2.21 0.60 0.00 1.34 0.00 0.00 72.50 72.10 1b0k s THR 443 CO 0.02 -0.47 1.85 -1.54 -0.54 0.00 0.00 174.62 173.94 1b0k n SER 444 N -0.48 4.33 -0.87 3.99 3.41 -0.89 -0.43 113.62 122.68 1b0k n SER 444 Ca -0.07 -3.68 0.00 0.00 -0.26 0.00 0.00 58.87 54.87 1b0k n SER 444 Cb 0.61 -0.82 0.00 0.00 -0.26 0.00 0.00 64.21 63.74 1b0k n SER 444 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 1b0k n TYR 445 N -1.09 0.00 0.00 7.33 4.01 -1.26 -4.27 117.16 121.88 1b0k n TYR 445 Ca 0.56 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 58.30 1b0k n TYR 445 Cb 1.37 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 40.40 1b0k n TYR 445 CO 0.00 0.00 0.00 0.27 -0.46 0.00 0.00 176.86 176.67 1b0k n ASN 446 N 0.00 1.57 -4.42 7.72 0.23 -1.26 -4.74 115.26 114.36 1b0k n ASN 446 Ca 0.00 0.00 -0.27 0.00 -0.53 0.00 0.00 54.58 53.78 1b0k n ASN 446 Cb 0.00 0.19 -0.12 0.00 -2.08 0.00 0.00 39.78 37.77 1b0k n ASN 446 CO 0.00 0.00 0.00 -0.13 -0.93 0.00 0.00 177.26 176.20 1b0k s ARG 447 N -1.19 1.50 -0.14 -3.83 0.52 -1.26 -4.74 118.95 109.81 1b0k s ARG 447 Ca 0.00 -1.52 0.18 0.00 -0.52 0.00 0.00 55.73 53.88 1b0k s ARG 447 Cb 0.00 -1.81 0.37 0.00 0.52 0.00 0.00 34.95 34.03 1b0k s ARG 447 CO 0.00 0.39 1.18 0.27 0.02 0.00 0.00 175.30 177.16 1b0k n ASN 448 N 0.27 0.42 -4.76 0.23 0.23 -1.26 -4.97 115.26 105.42 1b0k n ASN 448 Ca -0.13 -2.04 -0.37 0.00 -0.53 0.00 0.00 54.58 51.51 1b0k n ASN 448 Cb 0.56 -0.09 0.02 0.00 -2.08 0.00 0.00 39.78 38.20 1b0k n ASN 448 CO 0.00 0.00 0.00 -0.36 -0.93 0.00 0.00 177.26 175.97 1b0k s PHE 449 N -1.18 2.50 -0.35 -2.53 0.08 -1.26 -4.36 117.98 110.88 1b0k s PHE 449 Ca 0.22 1.47 -0.43 0.00 0.12 0.00 0.00 56.93 58.30 1b0k s PHE 449 Cb 0.31 -3.58 -0.17 0.00 -0.57 0.00 0.00 43.02 39.01 1b0k s PHE 449 CO -0.09 -2.27 1.67 2.41 -0.10 0.00 0.00 175.22 176.84 1b0k n THR 450 N -1.03 0.17 -1.07 0.64 -1.04 -1.26 -1.10 114.28 109.59 1b0k n THR 450 Ca 0.10 -0.03 -0.02 0.00 -2.04 0.00 0.00 64.05 62.06 1b0k n THR 450 Cb 0.47 -0.90 -0.01 0.00 -1.82 0.00 0.00 70.33 68.07 1b0k n THR 450 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1b0k n GLY 451 N 4.03 0.36 0.16 3.41 0.00 -1.25 -4.89 105.19 107.01 1b0k n GLY 451 Ca 0.28 -0.04 -0.05 0.00 0.00 0.00 0.00 46.02 46.20 1b0k n GLY 451 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1b0k h ARG 452 N 0.22 0.22 0.00 1.61 2.43 -1.44 0.15 114.38 117.57 1b0k h ARG 452 Ca -0.05 -0.16 -0.15 0.00 -0.81 0.00 0.00 59.98 58.80 1b0k h ARG 452 Cb 0.79 0.03 -0.03 0.00 -0.42 0.00 0.00 29.97 30.34 1b0k h ARG 452 CO 0.07 0.78 -1.62 0.09 -1.51 0.00 0.00 179.97 177.79 1b0k n ASN 453 N -3.85 0.58 -0.52 -3.80 4.13 -1.26 -2.18 115.26 108.36 1b0k n ASN 453 Ca -0.02 0.25 0.00 0.00 1.68 0.00 0.00 54.58 56.49 1b0k n ASN 453 Cb 0.64 0.62 0.00 0.00 -1.54 0.00 0.00 39.78 39.50 1b0k n ASN 453 CO 0.00 0.00 0.00 -0.90 0.28 0.00 0.00 177.26 176.64 1b0k n ASP 454 N -2.74 0.02 -0.84 6.41 5.68 -1.24 -4.04 116.55 119.79 1b0k n ASP 454 Ca -0.11 -1.84 -0.08 0.00 -0.50 0.00 0.00 54.79 52.26 1b0k n ASP 454 Cb 0.81 -0.17 -0.04 0.00 -1.14 0.00 0.00 41.12 40.59 1b0k n ASP 454 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1b0k n ALA 455 N 0.01 -0.13 -3.03 2.12 0.00 0.54 -4.93 120.51 115.09 1b0k n ALA 455 Ca 0.00 0.14 -0.41 0.00 0.00 0.00 0.00 53.44 53.16 1b0k n ALA 455 Cb 0.68 -1.27 -0.10 0.00 0.00 0.00 0.00 19.45 18.76 1b0k n ALA 455 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 1b0k s ASN 456 N -1.84 5.78 0.00 0.00 2.47 -1.26 -4.87 114.94 115.22 1b0k s ASN 456 Ca 0.00 -1.29 0.06 0.00 0.42 0.00 0.00 52.86 52.05 1b0k s ASN 456 Cb 0.00 -2.04 0.25 0.00 -1.45 0.00 0.00 41.25 38.01 1b0k s ASN 456 CO 0.00 -0.51 1.19 -0.81 -3.72 0.00 0.00 177.10 173.25 1b0k n PRO 457 N 5.01 0.00 -0.50 0.43 -0.04 -1.26 -1.77 135.00 136.87 1b0k n PRO 457 Ca -0.11 0.40 0.09 0.00 -0.04 0.00 0.00 63.50 63.83 1b0k n PRO 457 Cb 0.44 -1.50 0.31 0.00 -0.04 0.00 0.00 33.50 32.71 1b0k n PRO 457 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 1b0k n GLU 458 N -1.50 3.41 -2.63 0.54 -0.58 -1.26 -4.62 120.64 114.00 1b0k n GLU 458 Ca 0.01 -2.73 -0.43 0.00 -0.42 0.00 0.00 57.16 53.60 1b0k n GLU 458 Cb 0.07 -1.75 -0.02 0.00 -0.57 0.00 0.00 31.44 29.16 1b0k n GLU 458 CO 0.00 0.00 0.00 0.99 -0.48 0.00 0.00 177.13 177.64 1b0k s THR 459 N -1.72 4.64 -0.48 2.62 2.01 -0.73 -3.08 115.64 118.91 1b0k s THR 459 Ca 0.46 1.93 -0.17 0.00 0.31 0.00 0.00 61.69 64.22 1b0k s THR 459 Cb 0.29 -4.24 0.06 0.00 0.01 0.00 0.00 72.50 68.62 1b0k s THR 459 CO 0.23 -0.02 0.47 -1.00 -0.69 0.00 0.00 174.62 173.60 1b0k s HIS 460 N 2.25 3.17 -0.14 4.92 3.76 0.80 -4.81 115.29 125.24 1b0k s HIS 460 Ca 0.50 -0.73 -0.05 0.00 -0.15 0.00 0.00 55.06 54.63 1b0k s HIS 460 Cb -0.19 -3.24 -0.03 0.00 1.11 0.00 0.00 32.58 30.22 1b0k s HIS 460 CO 0.17 -0.86 0.02 0.00 -0.85 0.00 0.00 174.74 173.23 1b0k s ALA 461 N 2.02 3.30 -0.05 -1.40 0.00 -1.25 -1.61 121.76 122.76 1b0k s ALA 461 Ca 0.09 -0.77 0.06 0.00 0.00 0.00 0.00 51.96 51.33 1b0k s ALA 461 Cb -0.22 -1.69 -0.02 0.00 0.00 0.00 0.00 23.12 21.20 1b0k s ALA 461 CO 0.09 0.35 -0.23 -0.06 0.00 0.00 0.00 175.76 175.91 1b0k s PHE 462 N -0.12 2.48 -0.12 0.00 0.40 -1.02 -4.34 117.98 115.25 1b0k s PHE 462 Ca 0.05 -0.57 -0.03 0.00 -0.60 0.00 0.00 56.93 55.78 1b0k s PHE 462 Cb -0.12 -1.60 -0.03 0.00 0.51 0.00 0.00 43.02 41.77 1b0k s PHE 462 CO 0.02 -0.12 0.01 0.14 0.70 0.00 0.00 175.22 175.97 1b0k s VAL 463 N -0.31 4.36 0.00 -0.44 -7.23 0.17 -0.55 120.40 116.39 1b0k s VAL 463 Ca 0.01 -0.21 0.00 0.00 -1.81 0.00 0.00 61.98 59.97 1b0k s VAL 463 Cb -0.13 -2.88 0.00 0.00 0.56 0.00 0.00 36.38 33.94 1b0k s VAL 463 CO 0.02 0.55 0.00 1.07 -0.31 0.00 0.00 175.10 176.44 1b0k n THR 464 N 2.71 0.00 -3.44 5.32 5.66 0.42 -0.77 114.28 124.17 1b0k n THR 464 Ca -0.18 0.00 -0.30 0.00 -3.05 0.00 0.00 64.05 60.52 1b0k n THR 464 Cb 0.53 0.00 -0.04 0.00 -1.55 0.00 0.00 70.33 69.27 1b0k n THR 464 CO 0.00 0.00 0.00 -0.94 -3.05 0.00 0.00 175.07 171.08 1b0k s SER 465 N 1.49 6.52 0.30 1.09 1.04 -1.26 -4.14 113.70 118.74 1b0k s SER 465 Ca 0.00 0.75 0.06 0.00 0.48 0.00 0.00 55.95 57.25 1b0k s SER 465 Cb 0.00 -2.16 0.77 0.00 0.10 0.00 0.00 66.02 64.73 1b0k s SER 465 CO 0.00 -0.10 1.76 1.55 0.98 0.00 0.00 173.24 177.43 1b0k h PRO 466 N 2.21 0.68 0.00 4.02 0.13 -1.90 -1.78 132.00 135.36 1b0k h PRO 466 Ca -0.47 -0.04 -0.12 0.00 -0.87 0.00 0.00 66.00 64.50 1b0k h PRO 466 Cb 1.18 -0.15 -0.02 0.00 0.13 0.00 0.00 31.00 32.14 1b0k h PRO 466 CO 0.68 0.45 -0.55 1.05 -0.23 0.00 0.00 178.00 179.40 1b0k h GLU 467 N 0.70 0.00 0.22 0.86 9.09 -1.87 -2.49 114.58 121.08 1b0k h GLU 467 Ca 0.59 0.00 -0.32 0.00 0.05 0.00 0.00 59.36 59.68 1b0k h GLU 467 Cb 0.98 0.00 0.03 0.00 -1.65 0.00 0.00 28.75 28.11 1b0k h GLU 467 CO -0.41 0.55 -1.50 0.82 0.05 0.00 0.00 179.01 178.52 1b0k h ILE 468 N 0.00 1.18 -0.43 -1.06 1.08 -1.74 -2.73 117.51 113.80 1b0k h ILE 468 Ca -0.01 -2.60 0.09 0.00 -0.39 0.00 0.00 64.86 61.95 1b0k h ILE 468 Cb 1.03 2.95 -0.08 0.00 -3.07 0.00 0.00 36.82 37.66 1b0k h ILE 468 CO 0.07 0.81 -0.07 0.58 -0.69 0.00 0.00 178.15 178.85 1b0k h VAL 469 N 0.05 0.60 -0.67 1.67 2.07 -1.39 -0.38 116.25 118.20 1b0k h VAL 469 Ca -0.28 -0.01 0.00 0.00 0.82 0.00 0.00 66.70 67.23 1b0k h VAL 469 Cb 2.07 0.57 -0.03 0.00 -1.52 0.00 0.00 31.29 32.38 1b0k h VAL 469 CO 0.22 0.01 0.43 0.74 0.02 0.00 0.00 177.57 178.99 1b0k h THR 470 N 0.03 1.18 -0.48 2.57 2.02 -1.44 -0.02 112.91 116.76 1b0k h THR 470 Ca 0.21 -0.35 -0.03 0.00 0.77 0.00 0.00 66.41 67.00 1b0k h THR 470 Cb 0.32 0.21 -0.02 0.00 -1.74 0.00 0.00 68.15 66.92 1b0k h THR 470 CO -0.42 0.18 0.17 0.00 0.37 0.00 0.00 175.52 175.82 1b0k h ALA 471 N 1.23 0.63 -0.05 6.16 0.00 -1.11 -2.39 119.26 123.73 1b0k h ALA 471 Ca 0.24 -0.17 -0.13 0.00 0.00 0.00 0.00 54.91 54.86 1b0k h ALA 471 Cb -0.08 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.51 1b0k h ALA 471 CO -0.05 0.27 -0.54 -0.07 0.00 0.00 0.00 179.25 178.86 1b0k h LEU 472 N 0.64 0.17 -1.00 0.00 3.38 -0.87 -2.60 115.31 115.04 1b0k h LEU 472 Ca 0.16 -0.09 -0.10 0.00 0.09 0.00 0.00 57.88 57.94 1b0k h LEU 472 Cb 0.24 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 40.93 1b0k h LEU 472 CO -0.01 0.68 -0.35 0.00 0.09 0.00 0.00 178.44 178.85 1b0k h ALA 473 N 1.33 1.15 -0.22 1.53 0.00 -0.80 0.41 119.26 122.67 1b0k h ALA 473 Ca -0.00 -0.37 -0.12 0.00 0.00 0.00 0.00 54.91 54.42 1b0k h ALA 473 Cb 0.99 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.68 1b0k h ALA 473 CO 0.08 0.55 -0.37 0.82 0.00 0.00 0.00 179.25 180.33 1b0k h ILE 474 N 0.24 1.29 0.02 0.00 2.04 -1.22 -0.91 117.51 118.97 1b0k h ILE 474 Ca 0.03 -1.49 -0.27 0.00 1.00 0.00 0.00 64.86 64.13 1b0k h ILE 474 Cb 0.74 1.53 -0.04 0.00 -0.74 0.00 0.00 36.82 38.31 1b0k h ILE 474 CO 0.06 0.47 -1.43 0.00 0.00 0.00 0.00 178.15 177.24 1b0k h ALA 475 N 1.20 0.55 -0.38 1.87 0.00 -1.32 -3.18 119.26 118.00 1b0k h ALA 475 Ca 0.04 -1.21 -0.16 0.00 0.00 0.00 0.00 54.91 53.57 1b0k h ALA 475 Cb 0.83 0.23 -0.06 0.00 0.00 0.00 0.00 17.79 18.79 1b0k h ALA 475 CO 0.07 1.40 -0.15 0.41 0.00 0.00 0.00 179.25 180.98 1b0k n GLY 476 N 1.50 0.95 3.12 0.00 0.00 0.14 -4.88 105.19 106.02 1b0k n GLY 476 Ca -0.11 -0.35 -0.12 0.00 0.00 0.00 0.00 46.02 45.43 1b0k n GLY 476 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1b0k s THR 477 N -2.13 0.03 0.12 2.61 -1.32 -1.24 -1.12 115.64 112.59 1b0k s THR 477 Ca 0.00 -0.27 0.22 0.00 -1.21 0.00 0.00 61.69 60.43 1b0k s THR 477 Cb 0.00 -0.38 0.20 0.00 -1.51 0.00 0.00 72.50 70.81 1b0k s THR 477 CO 0.00 -0.15 1.78 -0.07 -2.21 0.00 0.00 174.62 173.97 1b0k h LEU 478 N 5.10 0.00 -6.41 9.08 3.38 -1.61 -3.32 115.31 121.53 1b0k h LEU 478 Ca -0.28 0.00 -0.72 0.00 0.09 0.00 0.00 57.88 56.98 1b0k h LEU 478 Cb 1.19 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 41.87 1b0k h LEU 478 CO 0.39 0.27 2.74 0.29 0.09 0.00 0.00 178.44 182.21 1b0k n LYS 479 N -3.41 3.06 -3.45 1.13 5.02 -1.26 -3.72 118.16 115.53 1b0k n LYS 479 Ca 0.00 -2.91 0.01 0.00 -2.02 0.00 0.00 58.31 53.39 1b0k n LYS 479 Cb 0.46 -3.24 -0.03 0.00 -0.02 0.00 0.00 35.03 32.20 1b0k n LYS 479 CO 0.00 0.00 0.00 0.12 -0.52 0.00 0.00 177.40 177.00 1b0k s PHE 480 N 2.78 -1.45 -0.37 2.13 5.36 -1.25 -5.06 117.98 120.12 1b0k s PHE 480 Ca 0.46 2.07 -0.11 0.00 -0.96 0.00 0.00 56.93 58.40 1b0k s PHE 480 Cb 0.11 0.70 0.02 0.00 -0.34 0.00 0.00 43.02 43.52 1b0k s PHE 480 CO -0.04 -0.75 0.20 1.21 -1.46 0.00 0.00 175.22 174.37 1b0k s ASN 481 N 2.88 5.72 0.43 6.13 2.47 -1.26 -4.94 114.94 126.37 1b0k s ASN 481 Ca 0.05 -0.92 0.11 0.00 0.42 0.00 0.00 52.86 52.52 1b0k s ASN 481 Cb -0.13 -2.03 0.93 0.00 -1.45 0.00 0.00 41.25 38.58 1b0k s ASN 481 CO -0.20 -0.36 2.01 -0.65 -3.72 0.00 0.00 177.10 174.19 1b0k h PRO 482 N 8.43 0.24 -0.66 0.43 0.11 -1.93 -1.91 132.00 136.70 1b0k h PRO 482 Ca -0.27 -0.03 -0.08 0.00 0.11 0.00 0.00 66.00 65.73 1b0k h PRO 482 Cb 1.11 -0.04 -0.03 0.00 0.11 0.00 0.00 31.00 32.15 1b0k h PRO 482 CO 0.66 0.27 0.11 0.93 -0.21 0.00 0.00 178.00 179.76 1b0k h GLU 483 N 0.24 1.09 0.00 1.05 5.08 -1.93 -3.38 114.58 116.73 1b0k h GLU 483 Ca 0.06 -0.29 -0.23 0.00 -1.00 0.00 0.00 59.36 57.90 1b0k h GLU 483 Cb 0.17 -0.13 -0.03 0.00 0.50 0.00 0.00 28.75 29.26 1b0k h GLU 483 CO 0.00 1.00 -1.65 0.25 -1.00 0.00 0.00 179.01 177.61 1b0k n THR 484 N -4.24 1.51 -1.27 1.13 -2.24 -0.81 -4.99 114.28 103.37 1b0k n THR 484 Ca 0.04 -0.10 -0.30 0.00 -2.27 0.00 0.00 64.05 61.43 1b0k n THR 484 Cb 0.29 -2.11 0.14 0.00 -2.10 0.00 0.00 70.33 66.54 1b0k n THR 484 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1b0k s ASP 485 N -6.70 3.48 -0.10 3.42 1.01 -0.79 -5.03 116.67 111.97 1b0k s ASP 485 Ca -0.32 1.38 0.03 0.00 0.71 0.00 0.00 52.55 54.35 1b0k s ASP 485 Cb 0.09 -2.06 -0.01 0.00 1.01 0.00 0.00 42.92 41.95 1b0k s ASP 485 CO 0.45 -2.62 -0.21 -0.36 0.21 0.00 0.00 175.17 172.65 1b0k s PHE 486 N -2.99 2.61 0.84 4.23 0.40 -1.26 -4.53 117.98 117.28 1b0k s PHE 486 Ca 0.63 -0.82 -0.09 0.00 -0.60 0.00 0.00 56.93 56.06 1b0k s PHE 486 Cb -0.17 -1.72 0.16 0.00 0.51 0.00 0.00 43.02 41.80 1b0k s PHE 486 CO 0.56 -0.29 1.16 -0.51 0.70 0.00 0.00 175.22 176.85 1b0k s LEU 487 N 0.18 2.84 -0.11 -0.37 1.02 0.15 -4.86 118.68 117.52 1b0k s LEU 487 Ca -0.12 -0.01 0.02 0.00 0.02 0.00 0.00 54.13 54.04 1b0k s LEU 487 Cb -0.16 -2.20 0.02 0.00 0.02 0.00 0.00 46.19 43.86 1b0k s LEU 487 CO 0.07 -2.28 -0.15 -0.89 0.02 0.00 0.00 176.35 173.12 1b0k s THR 488 N -3.52 1.47 0.81 5.49 2.01 -1.26 -1.69 115.64 118.95 1b0k s THR 488 Ca 0.70 -0.62 -0.08 0.00 0.31 0.00 0.00 61.69 61.99 1b0k s THR 488 Cb -0.05 -1.35 0.18 0.00 0.01 0.00 0.00 72.50 71.28 1b0k s THR 488 CO 0.49 0.44 1.10 0.61 -0.69 0.00 0.00 174.62 176.56 1b0k n GLY 489 N 4.24 -0.49 0.27 4.40 0.00 -0.29 -4.98 105.19 108.34 1b0k n GLY 489 Ca -0.19 -1.86 -0.05 0.00 0.00 0.00 0.00 46.02 43.92 1b0k n GLY 489 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1b0k h LYS 490 N 0.00 0.91 -1.83 1.61 3.64 -1.32 -3.16 116.57 116.42 1b0k h LYS 490 Ca -0.36 -0.06 0.54 0.00 -1.27 0.00 0.00 60.65 59.50 1b0k h LYS 490 Cb 1.13 -0.20 -0.09 0.00 -0.41 0.00 0.00 32.23 32.66 1b0k h LYS 490 CO 0.31 0.61 1.30 0.38 -2.27 0.00 0.00 179.45 179.78 1b0k h ASP 491 N 0.93 0.03 0.00 4.20 3.04 -1.94 -3.44 116.42 119.24 1b0k h ASP 491 Ca 0.25 0.02 0.00 0.00 -3.24 0.00 0.00 57.03 54.06 1b0k h ASP 491 Cb -0.09 0.02 0.00 0.00 -1.04 0.00 0.00 39.33 38.22 1b0k h ASP 491 CO -0.05 -0.04 0.00 0.61 -2.04 0.00 0.00 179.24 177.72 1b0k n GLY 492 N -1.85 0.30 3.91 7.15 0.00 -1.19 -5.09 105.19 108.41 1b0k n GLY 492 Ca 0.42 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 46.19 1b0k n GLY 492 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1b0k s LYS 493 N -0.91 3.30 0.25 1.61 1.02 -1.26 -4.89 119.74 118.86 1b0k s LYS 493 Ca 0.00 -0.69 -0.27 0.00 0.02 0.00 0.00 55.97 55.03 1b0k s LYS 493 Cb 0.00 -2.87 -0.09 0.00 -0.52 0.00 0.00 37.83 34.35 1b0k s LYS 493 CO 0.00 0.50 0.88 0.15 -0.92 0.00 0.00 175.35 175.96 1b0k s LYS 494 N -3.31 4.65 0.05 1.68 -0.14 -1.26 -1.13 119.74 120.28 1b0k s LYS 494 Ca 0.34 1.30 -0.02 0.00 -1.36 0.00 0.00 55.97 56.24 1b0k s LYS 494 Cb -0.10 -3.09 -0.04 0.00 -1.68 0.00 0.00 37.83 32.92 1b0k s LYS 494 CO 0.27 0.45 -0.01 -0.59 -0.76 0.00 0.00 175.35 174.71 1b0k s PHE 495 N -1.34 0.50 0.08 3.18 -0.71 -0.68 -4.93 117.98 114.08 1b0k s PHE 495 Ca 0.43 -1.04 0.09 0.00 -1.04 0.00 0.00 56.93 55.37 1b0k s PHE 495 Cb -0.22 -0.37 -0.03 0.00 -1.21 0.00 0.00 43.02 41.19 1b0k s PHE 495 CO 0.27 -0.39 -0.24 0.21 -1.34 0.00 0.00 175.22 173.72 1b0k s LYS 496 N -3.92 1.50 0.04 1.99 2.20 -1.26 -0.68 119.74 119.61 1b0k s LYS 496 Ca 0.07 -1.14 -0.31 0.00 -0.36 0.00 0.00 55.97 54.24 1b0k s LYS 496 Cb 0.08 -1.76 -0.06 0.00 -1.51 0.00 0.00 37.83 34.58 1b0k s LYS 496 CO -0.10 0.44 1.32 -0.51 -0.36 0.00 0.00 175.35 176.14 1b0k s LEU 497 N -1.54 4.34 0.63 5.43 1.02 -1.26 -5.01 118.68 122.29 1b0k s LEU 497 Ca 0.11 2.11 -0.15 0.00 0.02 0.00 0.00 54.13 56.21 1b0k s LEU 497 Cb -0.10 -3.57 -0.02 0.00 0.02 0.00 0.00 46.19 42.52 1b0k s LEU 497 CO 0.03 -0.61 1.08 -0.70 0.02 0.00 0.00 176.35 176.17 1b0k s GLU 498 N 1.64 3.06 0.36 1.70 -6.30 -1.26 -4.84 118.70 113.07 1b0k s GLU 498 Ca 0.62 1.28 -0.27 0.00 -2.50 0.00 0.00 54.97 54.10 1b0k s GLU 498 Cb -0.31 -1.99 -0.09 0.00 0.00 0.00 0.00 34.13 31.73 1b0k s GLU 498 CO 0.28 -1.02 1.15 0.00 0.02 0.00 0.00 175.26 175.68 1b0k s ALA 499 N -2.42 3.25 0.39 6.30 0.00 -1.26 -4.92 121.76 123.09 1b0k s ALA 499 Ca 0.65 0.95 -0.26 0.00 0.00 0.00 0.00 51.96 53.29 1b0k s ALA 499 Cb -0.18 -3.36 -0.09 0.00 0.00 0.00 0.00 23.12 19.49 1b0k s ALA 499 CO 0.40 -0.40 1.25 -1.25 0.00 0.00 0.00 175.76 175.76 1b0k s PRO 500 N -2.04 4.07 0.04 0.00 0.04 -1.26 -5.00 135.00 130.85 1b0k s PRO 500 Ca 0.53 2.05 0.04 0.00 0.04 0.00 0.00 61.00 63.66 1b0k s PRO 500 Cb -0.31 -2.79 -0.02 0.00 0.04 0.00 0.00 34.50 31.42 1b0k s PRO 500 CO 0.39 -0.37 -0.12 0.34 0.04 0.00 0.00 177.00 177.28 1b0k s ASP 501 N -0.83 1.39 -0.23 6.66 2.15 -1.26 -4.94 116.67 119.61 1b0k s ASP 501 Ca 0.55 -0.49 -0.35 0.00 0.43 0.00 0.00 52.55 52.69 1b0k s ASP 501 Cb -0.36 -0.05 0.15 0.00 -0.30 0.00 0.00 42.92 42.36 1b0k s ASP 501 CO 0.46 -0.05 1.28 0.00 -0.17 0.00 0.00 175.17 176.69 1b0k s ALA 502 N -1.03 -2.11 0.31 3.66 0.00 -1.26 -4.79 121.76 116.54 1b0k s ALA 502 Ca -0.02 1.75 -0.28 0.00 0.00 0.00 0.00 51.96 53.41 1b0k s ALA 502 Cb -0.08 -0.49 -0.09 0.00 0.00 0.00 0.00 23.12 22.45 1b0k s ALA 502 CO 0.01 -0.50 1.06 -0.51 0.00 0.00 0.00 175.76 175.83 1b0k s ASP 503 N -1.86 7.15 0.53 0.00 1.01 -1.26 -4.95 116.67 117.29 1b0k s ASP 503 Ca 0.09 2.16 0.34 0.00 0.71 0.00 0.00 52.55 55.85 1b0k s ASP 503 Cb -0.01 -2.61 1.47 0.00 1.01 0.00 0.00 42.92 42.78 1b0k s ASP 503 CO -0.04 -0.22 2.01 1.05 0.21 0.00 0.00 175.17 178.18 1b0k h GLU 504 N 3.44 0.00 -3.15 8.23 4.11 -1.95 -3.38 114.58 121.87 1b0k h GLU 504 Ca -0.47 0.00 -0.03 0.00 0.07 0.00 0.00 59.36 58.93 1b0k h GLU 504 Cb 1.21 0.00 -0.12 0.00 0.50 0.00 0.00 28.75 30.34 1b0k h GLU 504 CO 0.66 0.00 0.11 -0.51 0.07 0.00 0.00 179.01 179.33 1b0k s LEU 505 N -5.98 -0.21 0.36 3.06 1.43 -1.26 -4.13 118.68 111.96 1b0k s LEU 505 Ca 0.01 -0.15 -0.28 0.00 -1.03 0.00 0.00 54.13 52.68 1b0k s LEU 505 Cb 0.09 2.33 -0.10 0.00 0.03 0.00 0.00 46.19 48.54 1b0k s LEU 505 CO 0.50 -0.95 1.40 -2.16 0.23 0.00 0.00 176.35 175.37 1b0k s PRO 506 N -3.78 4.18 0.20 1.29 0.04 -1.26 -4.89 135.00 130.78 1b0k s PRO 506 Ca 0.02 2.39 -0.11 0.00 0.04 0.00 0.00 61.00 63.34 1b0k s PRO 506 Cb -0.00 -2.98 0.13 0.00 0.04 0.00 0.00 34.50 31.69 1b0k s PRO 506 CO -0.12 -0.40 1.86 -0.09 0.04 0.00 0.00 177.00 178.29 1b0k h ARG 507 N 3.09 0.93 0.00 4.56 2.43 -2.00 -3.42 114.38 119.97 1b0k h ARG 507 Ca -0.50 -0.07 -0.13 0.00 -0.81 0.00 0.00 59.98 58.47 1b0k h ARG 507 Cb 1.24 -0.20 0.05 0.00 -0.42 0.00 0.00 29.97 30.63 1b0k h ARG 507 CO 0.64 0.64 0.11 0.00 -1.51 0.00 0.00 179.97 179.85 1b0k n ALA 508 N -2.30 -0.35 -1.94 2.80 0.00 -1.26 -5.08 120.51 112.38 1b0k n ALA 508 Ca 0.06 -0.54 -0.27 0.00 0.00 0.00 0.00 53.44 52.69 1b0k n ALA 508 Cb 0.03 0.00 0.10 0.00 0.00 0.00 0.00 19.45 19.58 1b0k n ALA 508 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 1b0k s GLU 509 N -3.74 1.78 0.25 0.00 0.41 -1.26 -5.02 118.70 111.12 1b0k s GLU 509 Ca 0.22 -0.37 -0.30 0.00 -0.41 0.00 0.00 54.97 54.12 1b0k s GLU 509 Cb -0.01 -2.10 -0.09 0.00 -1.78 0.00 0.00 34.13 30.15 1b0k s GLU 509 CO 0.16 -1.55 0.97 -0.06 -0.49 0.00 0.00 175.26 174.29 1b0k s PHE 510 N -3.40 3.89 -0.23 1.61 0.08 -1.26 -4.92 117.98 113.75 1b0k s PHE 510 Ca 0.64 1.87 -0.22 0.00 0.12 0.00 0.00 56.93 59.34 1b0k s PHE 510 Cb -0.09 -3.04 -0.02 0.00 -0.57 0.00 0.00 43.02 39.31 1b0k s PHE 510 CO 0.47 0.25 0.71 0.34 -0.10 0.00 0.00 175.22 176.88 1b0k s ASP 511 N -1.14 6.71 0.00 1.36 -1.08 -1.26 -4.97 116.67 116.29 1b0k s ASP 511 Ca 0.42 0.88 0.30 0.00 -0.52 0.00 0.00 52.55 53.63 1b0k s ASP 511 Cb -0.27 -2.38 1.45 0.00 -1.46 0.00 0.00 42.92 40.26 1b0k s ASP 511 CO 0.33 -0.39 2.02 -0.81 0.52 0.00 0.00 175.17 176.84 1b0k n PRO 512 N 5.57 0.35 0.00 4.34 -0.04 -1.26 -3.98 135.00 139.98 1b0k n PRO 512 Ca 0.01 -0.01 0.00 0.00 -0.04 0.00 0.00 63.50 63.47 1b0k n PRO 512 Cb 0.49 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.45 1b0k n PRO 512 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1b0k n GLY 513 N 1.33 1.60 3.91 0.55 0.00 -1.26 -3.82 105.19 107.50 1b0k n GLY 513 Ca 0.13 -0.66 -0.22 0.00 0.00 0.00 0.00 46.02 45.27 1b0k n GLY 513 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1b0k s GLN 514 N 0.00 3.24 -0.17 1.61 1.03 -1.26 -5.04 119.66 119.07 1b0k s GLN 514 Ca 0.00 -0.87 -0.29 0.00 0.04 0.00 0.00 55.36 54.25 1b0k s GLN 514 Cb 0.00 -2.77 -0.05 0.00 0.03 0.00 0.00 33.01 30.22 1b0k s GLN 514 CO 0.00 0.42 2.02 0.16 -2.54 0.00 0.00 175.29 175.36 1b0k s ASP 515 N -3.90 5.88 -0.00 12.60 -4.77 -1.26 -4.83 116.67 120.40 1b0k s ASP 515 Ca 0.34 1.99 0.00 0.00 -3.30 0.00 0.00 52.55 51.57 1b0k s ASP 515 Cb -0.09 -2.52 -0.00 0.00 -1.09 0.00 0.00 42.92 39.22 1b0k s ASP 515 CO 0.27 -1.61 0.00 0.35 0.70 0.00 0.00 175.17 174.89 1b0k n THR 516 N 6.97 0.00 -2.83 2.11 -2.24 -1.26 -5.00 114.28 112.03 1b0k n THR 516 Ca 0.25 -0.19 -0.35 0.00 -2.27 0.00 0.00 64.05 61.49 1b0k n THR 516 Cb 0.44 0.69 -0.07 0.00 -2.10 0.00 0.00 70.33 69.30 1b0k n THR 516 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 1b0k s TYR 517 N -1.63 3.51 -0.12 4.78 5.04 -1.26 -1.48 117.35 126.19 1b0k s TYR 517 Ca -0.00 1.66 -0.02 0.00 -2.44 0.00 0.00 57.07 56.27 1b0k s TYR 517 Cb 0.00 -2.85 0.04 0.00 0.35 0.00 0.00 41.96 39.50 1b0k s TYR 517 CO 0.01 0.08 0.01 -1.14 -1.34 0.00 0.00 175.55 173.17 1b0k s GLN 518 N -2.56 0.66 0.45 4.97 0.74 -0.41 -4.96 119.66 118.54 1b0k s GLN 518 Ca 0.55 -0.10 -0.21 0.00 0.05 0.00 0.00 55.36 55.65 1b0k s GLN 518 Cb -0.14 -1.43 -0.10 0.00 1.10 0.00 0.00 33.01 32.44 1b0k s GLN 518 CO 0.19 -0.43 0.98 -1.58 -0.55 0.00 0.00 175.29 173.89 1b0k s HIS 519 N 1.92 3.22 0.28 1.67 5.65 -1.26 -2.10 115.29 124.67 1b0k s HIS 519 Ca 0.03 1.60 -0.30 0.00 0.25 0.00 0.00 55.06 56.64 1b0k s HIS 519 Cb -0.14 -2.92 -0.11 0.00 -1.18 0.00 0.00 32.58 28.23 1b0k s HIS 519 CO -0.06 -0.32 1.55 -1.25 -0.65 0.00 0.00 174.74 174.01 1b0k s PRO 520 N -3.18 4.16 0.03 2.88 0.04 -1.26 -4.95 135.00 132.72 1b0k s PRO 520 Ca 0.63 2.50 -0.30 0.00 0.04 0.00 0.00 61.00 63.87 1b0k s PRO 520 Cb -0.11 -3.05 -0.08 0.00 0.04 0.00 0.00 34.50 31.30 1b0k s PRO 520 CO 0.15 -0.58 1.82 -1.25 0.04 0.00 0.00 177.00 177.18 1b0k s PRO 521 N -0.39 4.16 -0.50 0.56 0.04 -1.26 -4.87 135.00 132.74 1b0k s PRO 521 Ca 0.63 2.45 0.04 0.00 0.04 0.00 0.00 61.00 64.15 1b0k s PRO 521 Cb -0.46 -3.96 0.41 0.00 0.04 0.00 0.00 34.50 30.53 1b0k s PRO 521 CO 0.46 -0.88 1.27 1.63 0.04 0.00 0.00 177.00 179.52 1b0k n LYS 522 N 6.92 3.32 0.00 4.56 4.76 -1.26 -4.22 118.16 132.23 1b0k n LYS 522 Ca 0.18 -4.32 0.00 0.00 -2.87 0.00 0.00 58.31 51.30 1b0k n LYS 522 Cb 0.41 -2.26 0.00 0.00 -1.84 0.00 0.00 35.03 31.35 1b0k n LYS 522 CO 0.00 0.00 0.00 -0.40 -1.37 0.00 0.00 177.40 175.63 1b0k n ASP 523 N -0.50 0.00 0.00 4.39 5.68 -1.26 -5.05 116.55 119.80 1b0k n ASP 523 Ca 0.42 0.00 0.00 0.00 -0.50 0.00 0.00 54.79 54.71 1b0k n ASP 523 Cb 0.60 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.58 1b0k n ASP 523 CO 0.00 0.00 0.00 -1.20 -1.33 0.00 0.00 177.20 174.67 1b0k n SER 524 N 0.00 0.00 0.00 -1.12 7.64 -1.26 -4.75 113.62 114.13 1b0k n SER 524 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 1b0k n SER 524 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 1b0k n SER 524 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1b0k n SER 525 N 0.00 0.00 -1.72 6.43 7.64 -1.26 -4.73 113.62 119.98 1b0k n SER 525 Ca 0.00 0.00 -0.13 0.00 1.01 0.00 0.00 58.87 59.75 1b0k n SER 525 Cb 0.00 -1.93 0.05 0.00 -1.01 0.00 0.00 64.21 61.32 1b0k n SER 525 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1b0k n GLY 526 N -1.42 3.58 3.85 0.23 0.00 -1.26 -4.66 105.19 105.51 1b0k n GLY 526 Ca 0.00 -0.77 -0.31 0.00 0.00 0.00 0.00 46.02 44.93 1b0k n GLY 526 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1b0k s GLN 527 N -1.54 3.87 0.09 1.61 1.11 -1.26 -5.10 119.66 118.44 1b0k s GLN 527 Ca 0.26 0.81 0.03 0.00 0.01 0.00 0.00 55.36 56.48 1b0k s GLN 527 Cb 0.21 -2.19 -0.04 0.00 -1.01 0.00 0.00 33.01 29.98 1b0k s GLN 527 CO 0.02 -0.24 0.08 1.03 0.01 0.00 0.00 175.29 176.18 1b0k s ARG 528 N -4.13 2.86 -0.22 2.91 0.52 -1.26 -5.01 118.95 114.62 1b0k s ARG 528 Ca 0.57 -0.72 -0.06 0.00 -0.52 0.00 0.00 55.73 54.99 1b0k s ARG 528 Cb -0.10 -2.71 -0.03 0.00 0.52 0.00 0.00 34.95 32.63 1b0k s ARG 528 CO 0.34 0.56 0.04 0.08 0.02 0.00 0.00 175.30 176.33 1b0k s VAL 529 N -1.42 4.27 -0.19 3.52 1.01 -1.26 -4.95 120.40 121.37 1b0k s VAL 529 Ca 0.29 -0.20 -0.09 0.00 0.00 0.00 0.00 61.98 61.98 1b0k s VAL 529 Cb -0.12 -2.96 -0.05 0.00 0.00 0.00 0.00 36.38 33.26 1b0k s VAL 529 CO 0.22 0.40 0.11 -0.62 0.00 0.00 0.00 175.10 175.21 1b0k s ASP 530 N 1.12 6.04 -0.26 3.32 2.15 -1.26 -5.03 116.67 122.74 1b0k s ASP 530 Ca 0.04 0.19 0.02 0.00 0.43 0.00 0.00 52.55 53.23 1b0k s ASP 530 Cb -0.14 -2.05 0.07 0.00 -0.30 0.00 0.00 42.92 40.49 1b0k s ASP 530 CO 0.03 0.18 -0.06 -0.69 -0.17 0.00 0.00 175.17 174.45 1b0k s VAL 531 N 0.35 1.89 0.17 1.11 1.01 -1.26 -4.91 120.40 118.76 1b0k s VAL 531 Ca 0.07 -1.55 -0.34 0.00 0.00 0.00 0.00 61.98 60.16 1b0k s VAL 531 Cb -0.11 -2.11 -0.14 0.00 0.00 0.00 0.00 36.38 34.01 1b0k s VAL 531 CO -0.01 -0.15 1.44 -0.24 0.00 0.00 0.00 175.10 176.14 1b0k n SER 532 N 4.52 2.53 0.00 3.32 2.88 -1.26 -4.86 113.62 120.75 1b0k n SER 532 Ca -0.11 1.11 0.09 0.00 -1.33 0.00 0.00 58.87 58.63 1b0k n SER 532 Cb 0.43 -1.36 0.42 0.00 -0.75 0.00 0.00 64.21 62.95 1b0k n SER 532 CO 0.00 0.00 0.00 -2.65 -1.23 0.00 0.00 175.04 171.16 1b0k n PRO 533 N 2.67 0.16 -0.16 -1.46 -0.02 -1.26 -2.46 135.00 132.47 1b0k n PRO 533 Ca 0.15 0.15 0.09 0.00 -2.02 0.00 0.00 63.50 61.87 1b0k n PRO 533 Cb 0.27 -1.50 0.13 0.00 -0.02 0.00 0.00 33.50 32.38 1b0k n PRO 533 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 1b0k n THR 534 N -1.36 1.69 -2.51 3.45 -2.24 -1.26 -5.06 114.28 106.99 1b0k n THR 534 Ca 0.07 -2.07 -0.39 0.00 -2.27 0.00 0.00 64.05 59.39 1b0k n THR 534 Cb 0.16 -0.15 -0.04 0.00 -2.10 0.00 0.00 70.33 68.20 1b0k n THR 534 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1b0k s SER 535 N -2.69 7.10 0.00 3.42 0.15 -1.03 -4.97 113.70 115.68 1b0k s SER 535 Ca 0.29 2.18 0.20 0.00 0.70 0.00 0.00 55.95 59.32 1b0k s SER 535 Cb 0.26 -2.61 -0.10 0.00 -1.71 0.00 0.00 66.02 61.85 1b0k s SER 535 CO 0.02 -0.26 0.93 0.00 1.20 0.00 0.00 173.24 175.14 1b0k n GLN 536 N 0.76 1.00 -0.04 5.44 1.13 -1.26 -4.45 117.38 119.96 1b0k n GLN 536 Ca 0.01 -0.52 0.01 0.00 -1.94 0.00 0.00 57.00 54.56 1b0k n GLN 536 Cb 0.46 -1.42 -0.11 0.00 0.11 0.00 0.00 30.24 29.28 1b0k n GLN 536 CO 0.00 0.00 0.00 0.54 -1.44 0.00 0.00 177.06 176.16 1b0k n ARG 537 N -0.69 1.02 -4.36 -1.09 1.74 -1.26 -4.81 116.66 107.21 1b0k n ARG 537 Ca 0.06 -0.08 -0.19 0.00 -0.77 0.00 0.00 57.85 56.87 1b0k n ARG 537 Cb 0.37 -1.36 -0.14 0.00 -1.02 0.00 0.00 32.46 30.32 1b0k n ARG 537 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1b0k s LEU 538 N -4.49 2.13 -0.23 0.55 1.43 -1.26 -2.98 118.68 113.83 1b0k s LEU 538 Ca -0.06 -0.38 -0.16 0.00 -1.03 0.00 0.00 54.13 52.50 1b0k s LEU 538 Cb 0.07 -0.55 0.07 0.00 0.03 0.00 0.00 46.19 45.81 1b0k s LEU 538 CO 0.60 0.04 0.59 -1.58 0.23 0.00 0.00 176.35 176.24 1b0k s GLN 539 N -0.88 0.63 0.57 1.70 0.74 -0.31 -4.55 119.66 117.57 1b0k s GLN 539 Ca 0.01 0.98 -0.16 0.00 0.05 0.00 0.00 55.36 56.24 1b0k s GLN 539 Cb -0.07 0.17 -0.05 0.00 1.10 0.00 0.00 33.01 34.16 1b0k s GLN 539 CO 0.01 -0.13 1.05 -0.51 -0.55 0.00 0.00 175.29 175.16 1b0k s LEU 540 N 1.12 3.56 0.14 3.68 1.43 -1.26 -4.79 118.68 122.57 1b0k s LEU 540 Ca -0.06 1.82 -0.06 0.00 -1.03 0.00 0.00 54.13 54.79 1b0k s LEU 540 Cb -0.06 -4.54 -0.06 0.00 0.03 0.00 0.00 46.19 41.57 1b0k s LEU 540 CO -0.11 -1.07 0.40 -0.76 0.23 0.00 0.00 176.35 175.04 1b0k s LEU 541 N -4.32 4.27 0.01 1.79 1.43 -1.26 -5.03 118.68 115.56 1b0k s LEU 541 Ca 0.64 0.65 0.04 0.00 -1.03 0.00 0.00 54.13 54.43 1b0k s LEU 541 Cb -0.16 -3.31 -0.03 0.00 0.03 0.00 0.00 46.19 42.72 1b0k s LEU 541 CO 0.34 0.05 -0.08 -0.70 0.23 0.00 0.00 176.35 176.20 1b0k s GLU 542 N -2.57 2.50 0.73 1.70 2.12 -1.26 -5.08 118.70 116.84 1b0k s GLU 542 Ca 0.41 -0.75 -0.15 0.00 0.36 0.00 0.00 54.97 54.83 1b0k s GLU 542 Cb -0.12 -2.47 0.04 0.00 0.26 0.00 0.00 34.13 31.84 1b0k s GLU 542 CO 0.23 0.59 1.21 -1.25 -0.54 0.00 0.00 175.26 175.51 1b0k s PRO 543 N -1.44 2.14 0.65 4.30 0.04 -1.26 -5.02 135.00 134.41 1b0k s PRO 543 Ca 0.17 1.77 -0.08 0.00 0.04 0.00 0.00 61.00 62.90 1b0k s PRO 543 Cb -0.11 -1.83 0.02 0.00 0.04 0.00 0.00 34.50 32.62 1b0k s PRO 543 CO 0.08 -1.84 0.99 -0.06 0.04 0.00 0.00 177.00 176.20 1b0k s PHE 544 N -1.96 3.20 0.65 0.56 0.08 -1.26 -5.06 117.98 114.19 1b0k s PHE 544 Ca 0.75 0.73 -0.18 0.00 0.12 0.00 0.00 56.93 58.35 1b0k s PHE 544 Cb -0.29 -2.94 -0.01 0.00 -0.57 0.00 0.00 43.02 39.21 1b0k s PHE 544 CO 0.45 -1.06 1.24 0.16 -0.10 0.00 0.00 175.22 175.91 1b0k s ASP 545 N -4.37 4.69 0.74 1.36 -4.77 -1.26 -4.90 116.67 108.16 1b0k s ASP 545 Ca 0.56 2.48 -0.11 0.00 -3.30 0.00 0.00 52.55 52.18 1b0k s ASP 545 Cb -0.11 -2.60 0.03 0.00 -1.09 0.00 0.00 42.92 39.15 1b0k s ASP 545 CO 0.47 -1.94 1.09 -0.54 0.70 0.00 0.00 175.17 174.96 1b0k s LYS 546 N -3.50 2.61 0.32 2.11 -0.14 -1.26 -4.04 119.74 115.85 1b0k s LYS 546 Ca 0.79 0.55 -0.28 0.00 -1.36 0.00 0.00 55.97 55.67 1b0k s LYS 546 Cb -0.33 -1.99 -0.10 0.00 -1.68 0.00 0.00 37.83 33.74 1b0k s LYS 546 CO 0.39 -1.23 1.18 -0.46 -0.76 0.00 0.00 175.35 174.46 1b0k s TRP 547 N -3.27 3.32 -0.31 3.18 -0.00 -0.38 -4.86 118.94 116.61 1b0k s TRP 547 Ca 0.59 1.58 0.27 0.00 -0.00 0.00 0.00 56.10 58.54 1b0k s TRP 547 Cb -0.12 -3.43 1.04 0.00 -0.00 0.00 0.00 33.47 30.96 1b0k s TRP 547 CO 0.53 -1.10 1.80 0.38 -0.00 0.00 0.00 176.95 178.56 1b0k h ASP 548 N 3.46 0.00 0.00 5.86 3.04 -1.96 -3.47 116.42 123.35 1b0k h ASP 548 Ca -0.48 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.31 1b0k h ASP 548 Cb 1.22 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 39.51 1b0k h ASP 548 CO 0.66 0.00 0.00 0.61 -2.04 0.00 0.00 179.24 178.47 1b0k n GLY 549 N 0.25 0.75 3.30 7.15 0.00 -1.26 -5.07 105.19 110.31 1b0k n GLY 549 Ca 0.02 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.88 1b0k n GLY 549 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1b0k s LYS 550 N -0.97 1.25 1.14 1.61 3.01 -1.26 -4.86 119.74 119.66 1b0k s LYS 550 Ca 0.00 -1.61 -0.17 0.00 -1.01 0.00 0.00 55.97 53.18 1b0k s LYS 550 Cb 0.00 -0.58 0.26 0.00 -1.01 0.00 0.00 37.83 36.50 1b0k s LYS 550 CO 0.00 -0.06 1.11 -0.51 0.51 0.00 0.00 175.35 176.40 1b0k s ASP 551 N -3.26 1.42 -0.94 2.83 1.01 -1.26 -4.96 116.67 111.52 1b0k s ASP 551 Ca 0.25 0.75 -0.01 0.00 0.71 0.00 0.00 52.55 54.26 1b0k s ASP 551 Cb 0.05 -1.10 0.29 0.00 1.01 0.00 0.00 42.92 43.17 1b0k s ASP 551 CO 0.06 -3.83 1.23 0.18 0.21 0.00 0.00 175.17 173.02 1b0k n LEU 552 N -4.58 5.52 -4.75 1.23 4.77 -0.94 -5.01 117.00 113.24 1b0k n LEU 552 Ca 0.11 -5.29 -0.41 0.00 -0.03 0.00 0.00 56.01 50.40 1b0k n LEU 552 Cb 0.59 -1.08 -0.03 0.00 -2.33 0.00 0.00 43.42 40.57 1b0k n LEU 552 CO 0.48 1.80 0.89 -1.83 -1.33 0.00 0.00 177.39 177.41 1b0k s GLU 553 N -2.64 4.49 -1.07 3.23 1.03 -1.26 -3.08 118.70 119.40 1b0k s GLU 553 Ca 0.34 1.97 -0.02 0.00 0.03 0.00 0.00 54.97 57.29 1b0k s GLU 553 Cb 0.07 -3.17 -0.02 0.00 -0.80 0.00 0.00 34.13 30.21 1b0k s GLU 553 CO 0.06 -0.04 0.91 -0.25 -1.33 0.00 0.00 175.26 174.61 1b0k n ASP 554 N 1.61 -3.35 -4.74 0.83 8.00 -1.21 -4.97 116.55 112.72 1b0k n ASP 554 Ca 0.02 -0.60 -0.41 0.00 0.71 0.00 0.00 54.79 54.51 1b0k n ASP 554 Cb 0.44 -4.82 -0.04 0.00 -0.02 0.00 0.00 41.12 36.67 1b0k n ASP 554 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1b0k s LEU 555 N -5.79 4.50 0.14 0.64 1.43 -0.67 -4.77 118.68 114.16 1b0k s LEU 555 Ca 0.13 2.07 -0.24 0.00 -1.03 0.00 0.00 54.13 55.06 1b0k s LEU 555 Cb -0.02 -3.60 -0.08 0.00 0.03 0.00 0.00 46.19 42.52 1b0k s LEU 555 CO 0.68 -0.20 0.73 -1.58 0.23 0.00 0.00 176.35 176.22 1b0k s GLN 556 N -0.41 4.49 -0.42 1.70 2.00 -0.33 -2.37 119.66 124.33 1b0k s GLN 556 Ca 0.49 1.07 -0.23 0.00 -2.00 0.00 0.00 55.36 54.69 1b0k s GLN 556 Cb -0.29 -3.26 0.02 0.00 0.80 0.00 0.00 33.01 30.28 1b0k s GLN 556 CO 0.35 0.57 0.76 0.42 -0.50 0.00 0.00 175.29 176.89 1b0k s ILE 557 N -1.08 4.70 0.13 -2.34 1.01 -1.26 -1.33 121.20 121.03 1b0k s ILE 557 Ca 0.34 0.55 -0.17 0.00 0.00 0.00 0.00 60.65 61.38 1b0k s ILE 557 Cb -0.22 -4.26 -0.02 0.00 0.01 0.00 0.00 42.46 37.97 1b0k s ILE 557 CO 0.25 -0.59 1.72 0.25 0.00 0.00 0.00 174.94 176.56 1b0k h LEU 558 N 9.93 0.46 -7.00 2.97 5.85 -1.19 -3.47 115.31 122.86 1b0k h LEU 558 Ca -0.25 -0.11 -0.04 0.00 0.84 0.00 0.00 57.88 58.32 1b0k h LEU 558 Cb 1.09 -0.12 -0.21 0.00 0.37 0.00 0.00 40.66 41.80 1b0k h LEU 558 CO 0.93 0.44 0.18 -0.51 -0.34 0.00 0.00 178.44 179.14 1b0k s ILE 559 N -5.76 0.00 -0.38 4.05 2.07 -1.26 -4.90 121.20 115.03 1b0k s ILE 559 Ca -0.13 0.00 -0.13 0.00 -1.41 0.00 0.00 60.65 58.98 1b0k s ILE 559 Cb 0.10 -1.00 0.02 0.00 0.13 0.00 0.00 42.46 41.70 1b0k s ILE 559 CO 0.73 0.00 0.24 -0.75 -1.91 0.00 0.00 174.94 173.25 1b0k s LYS 560 N -0.11 3.01 0.05 3.50 2.20 -1.26 -1.56 119.74 125.56 1b0k s LYS 560 Ca -0.03 -0.97 -0.26 0.00 -0.36 0.00 0.00 55.97 54.35 1b0k s LYS 560 Cb -0.03 -3.82 -0.05 0.00 -1.51 0.00 0.00 37.83 32.42 1b0k s LYS 560 CO 0.03 -0.66 0.82 0.08 -0.36 0.00 0.00 175.35 175.27 1b0k s VAL 561 N 1.63 4.70 -0.14 4.02 1.01 0.10 -2.50 120.40 129.22 1b0k s VAL 561 Ca 0.04 1.76 -0.01 0.00 0.00 0.00 0.00 61.98 63.76 1b0k s VAL 561 Cb -0.19 -4.18 -0.02 0.00 0.00 0.00 0.00 36.38 32.00 1b0k s VAL 561 CO 0.08 0.33 -0.10 -0.75 0.00 0.00 0.00 175.10 174.66 1b0k s LYS 562 N 0.07 3.46 0.77 2.72 2.36 -0.90 -3.80 119.74 124.42 1b0k s LYS 562 Ca 0.41 -0.64 0.00 0.00 -2.55 0.00 0.00 55.97 53.20 1b0k s LYS 562 Cb -0.21 -2.71 0.00 0.00 -1.05 0.00 0.00 37.83 33.86 1b0k s LYS 562 CO 0.25 0.23 0.00 0.41 1.55 0.00 0.00 175.35 177.78 1b0k n GLY 563 N 3.51 -1.42 3.69 5.54 0.00 -1.26 -4.50 105.19 110.75 1b0k n GLY 563 Ca -0.18 -1.73 -0.42 0.00 0.00 0.00 0.00 46.02 43.69 1b0k n GLY 563 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1b0k s LYS 564 N 0.00 4.19 -0.38 1.61 2.20 -1.26 -4.59 119.74 121.51 1b0k s LYS 564 Ca 0.00 2.36 0.02 0.00 -0.36 0.00 0.00 55.97 57.99 1b0k s LYS 564 Cb 0.00 -3.61 0.15 0.00 -1.51 0.00 0.00 37.83 32.86 1b0k s LYS 564 CO 0.00 -0.75 0.28 0.00 -0.36 0.00 0.00 175.35 174.52 1b0k s THR 566 N 0.70 2.35 -0.98 0.00 2.01 -1.26 -0.64 115.64 117.82 1b0k s THR 566 Ca 0.24 0.15 0.20 0.00 0.31 0.00 0.00 61.69 62.60 1b0k s THR 566 Cb -0.11 -2.60 0.17 0.00 0.01 0.00 0.00 72.50 69.97 1b0k s THR 566 CO -0.08 -0.11 1.65 0.35 -0.69 0.00 0.00 174.62 175.75 1b0k n THR 567 N -3.10 0.62 0.38 -0.82 -2.24 0.21 -1.35 114.28 107.98 1b0k n THR 567 Ca 0.13 0.15 0.14 0.00 -2.27 0.00 0.00 64.05 62.19 1b0k n THR 567 Cb 0.51 -0.81 0.52 0.00 -2.10 0.00 0.00 70.33 68.45 1b0k n THR 567 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 1b0k h ASP 568 N 0.00 0.00 0.21 3.42 3.32 -1.80 -1.02 116.42 120.54 1b0k h ASP 568 Ca 0.00 0.00 -0.34 0.00 0.02 0.00 0.00 57.03 56.71 1b0k h ASP 568 Cb 0.35 0.00 -0.05 0.00 0.22 0.00 0.00 39.33 39.85 1b0k h ASP 568 CO 0.00 0.00 -2.06 1.41 -1.72 0.00 0.00 179.24 176.87 1b0k n HIS 569 N -2.55 0.66 0.01 4.55 8.25 -0.46 -3.86 115.22 121.82 1b0k n HIS 569 Ca 0.02 0.20 -0.18 0.00 -0.26 0.00 0.00 57.72 57.50 1b0k n HIS 569 Cb 0.29 -1.11 -0.08 0.00 1.12 0.00 0.00 29.99 30.22 1b0k n HIS 569 CO 0.00 0.00 0.00 0.82 0.64 0.00 0.00 176.34 177.80 1b0k h ILE 570 N 0.02 1.29 -2.42 1.59 2.04 -1.35 -3.17 117.51 115.50 1b0k h ILE 570 Ca -0.43 -2.13 -0.45 0.00 1.00 0.00 0.00 64.86 62.85 1b0k h ILE 570 Cb 2.06 2.19 -0.36 0.00 -0.74 0.00 0.00 36.82 39.96 1b0k h ILE 570 CO 0.04 0.66 -0.74 -0.55 0.00 0.00 0.00 178.15 177.57 1b0k s SER 571 N -7.18 2.48 0.80 1.72 0.15 -0.39 -0.87 113.70 110.41 1b0k s SER 571 Ca -0.09 -1.35 -0.13 0.00 0.70 0.00 0.00 55.95 55.07 1b0k s SER 571 Cb 0.08 0.05 0.08 0.00 -1.71 0.00 0.00 66.02 64.52 1b0k s SER 571 CO 0.91 -0.37 1.19 0.00 1.20 0.00 0.00 173.24 176.16 1b0k s ALA 572 N 1.87 1.87 0.00 5.45 0.00 -1.25 -4.53 121.76 125.17 1b0k s ALA 572 Ca 0.12 0.77 0.00 0.00 0.00 0.00 0.00 51.96 52.85 1b0k s ALA 572 Cb -0.17 -3.47 0.00 0.00 0.00 0.00 0.00 23.12 19.49 1b0k s ALA 572 CO -0.23 -2.23 0.00 0.00 0.00 0.00 0.00 175.76 173.30 1b0k n ALA 573 N -3.33 0.00 -0.53 0.00 0.00 -1.26 -4.57 120.51 110.82 1b0k n ALA 573 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.57 1b0k n ALA 573 Cb 0.51 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.96 1b0k n ALA 573 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1b0k n GLY 574 N 5.00 3.15 0.30 0.00 0.00 -0.73 -1.94 105.19 110.97 1b0k n GLY 574 Ca 0.00 0.27 0.19 0.00 0.00 0.00 0.00 46.02 46.47 1b0k n GLY 574 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1b0k h PRO 575 N 0.00 0.00 0.00 1.61 0.13 -1.88 -1.57 132.00 130.29 1b0k h PRO 575 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 1b0k h PRO 575 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 1b0k h PRO 575 CO 0.00 0.03 0.00 0.91 -0.23 0.00 0.00 178.00 178.71 1b0k n TRP 576 N -3.29 0.00 0.10 1.56 7.02 -0.82 -3.46 117.44 118.55 1b0k n TRP 576 Ca -0.02 0.00 0.03 0.00 -1.02 0.00 0.00 57.50 56.49 1b0k n TRP 576 Cb 0.16 -0.36 0.41 0.00 -2.42 0.00 0.00 31.31 29.10 1b0k n TRP 576 CO 0.00 0.00 0.00 -0.07 -2.02 0.00 0.00 177.69 175.60 1b0k h LEU 577 N 0.00 0.27 -0.98 -0.99 3.38 -1.45 -1.23 115.31 114.31 1b0k h LEU 577 Ca 0.00 -0.04 0.20 0.00 0.09 0.00 0.00 57.88 58.13 1b0k h LEU 577 Cb 0.34 -0.07 -0.03 0.00 0.09 0.00 0.00 40.66 40.99 1b0k h LEU 577 CO 0.00 0.36 1.04 0.50 0.09 0.00 0.00 178.44 180.44 1b0k h LYS 578 N 0.29 0.00 -0.12 1.13 3.64 -1.79 -2.29 116.57 117.43 1b0k h LYS 578 Ca 0.06 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.44 1b0k h LYS 578 Cb 0.27 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.09 1b0k h LYS 578 CO 0.01 0.00 0.00 1.19 -2.27 0.00 0.00 179.45 178.38 1b0k n PHE 579 N -3.12 0.34 0.34 1.91 3.72 -0.46 -4.66 117.46 115.52 1b0k n PHE 579 Ca 0.15 -0.82 0.03 0.00 -0.05 0.00 0.00 57.45 56.76 1b0k n PHE 579 Cb 1.26 -0.17 0.17 0.00 -0.94 0.00 0.00 39.48 39.80 1b0k n PHE 579 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25 1b0k n ARG 580 N -0.77 0.14 -0.03 -1.08 5.12 -0.86 -1.23 116.66 117.94 1b0k n ARG 580 Ca 0.14 0.12 0.03 0.00 -1.93 0.00 0.00 57.85 56.22 1b0k n ARG 580 Cb 0.63 -1.50 0.04 0.00 -1.16 0.00 0.00 32.46 30.47 1b0k n ARG 580 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1b0k n GLY 581 N -0.69 0.20 2.98 -0.13 0.00 -1.17 -3.98 105.19 102.38 1b0k n GLY 581 Ca 0.04 -0.20 -0.31 0.00 0.00 0.00 0.00 46.02 45.55 1b0k n GLY 581 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1b0k s HIS 582 N -0.67 3.45 0.18 1.61 5.65 -0.37 -1.16 115.29 123.98 1b0k s HIS 582 Ca 0.09 -2.93 -0.14 0.00 0.25 0.00 0.00 55.06 52.33 1b0k s HIS 582 Cb 0.06 -2.79 0.17 0.00 -1.18 0.00 0.00 32.58 28.84 1b0k s HIS 582 CO 0.09 -0.90 1.68 1.25 -0.65 0.00 0.00 174.74 176.21 1b0k h LEU 583 N 7.39 -0.21 0.17 8.88 5.85 -1.87 -2.04 115.31 133.48 1b0k h LEU 583 Ca -0.05 0.11 -0.01 0.00 0.84 0.00 0.00 57.88 58.77 1b0k h LEU 583 Cb 0.99 0.20 0.00 0.00 0.37 0.00 0.00 40.66 42.23 1b0k h LEU 583 CO 0.55 -0.07 -0.08 -0.78 -0.34 0.00 0.00 178.44 177.72 1b0k h ASP 584 N 0.11 -0.19 -0.72 1.25 3.58 -1.95 -0.83 116.42 117.66 1b0k h ASP 584 Ca 0.24 -0.05 0.00 0.00 0.42 0.00 0.00 57.03 57.64 1b0k h ASP 584 Cb 0.35 0.05 -0.04 0.00 1.72 0.00 0.00 39.33 41.41 1b0k h ASP 584 CO -0.40 -0.08 0.47 0.78 -2.88 0.00 0.00 179.24 177.13 1b0k h ASN 585 N -0.29 0.84 0.15 2.28 -0.26 -1.91 -3.04 115.58 113.34 1b0k h ASN 585 Ca -0.02 -0.03 -0.15 0.00 -0.56 0.00 0.00 56.30 55.54 1b0k h ASN 585 Cb 0.23 -0.21 -0.01 0.00 -1.06 0.00 0.00 38.32 37.27 1b0k h ASN 585 CO 0.04 0.62 -0.53 -0.29 -1.06 0.00 0.00 177.43 176.21 1b0k h ILE 586 N 0.98 1.34 0.00 2.81 6.09 -1.37 -3.03 117.51 124.33 1b0k h ILE 586 Ca 0.26 -1.79 0.00 0.00 -1.37 0.00 0.00 64.86 61.96 1b0k h ILE 586 Cb -0.09 1.81 0.00 0.00 0.47 0.00 0.00 36.82 39.01 1b0k h ILE 586 CO -0.05 0.55 0.36 0.28 -3.07 0.00 0.00 178.15 176.21 1b0k h SER 587 N 0.33 0.00 0.06 2.19 0.02 -1.02 -0.83 113.55 114.30 1b0k h SER 587 Ca 0.01 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.96 1b0k h SER 587 Cb 1.04 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.58 1b0k h SER 587 CO 0.09 0.00 0.00 0.59 -1.14 0.00 0.00 176.83 176.37 1b0k n ASN 588 N -2.24 0.00 -0.92 3.07 3.02 -1.14 -2.34 115.26 114.71 1b0k n ASN 588 Ca -0.01 -0.67 0.10 0.00 -0.03 0.00 0.00 54.58 53.97 1b0k n ASN 588 Cb 0.38 -0.04 0.16 0.00 -0.61 0.00 0.00 39.78 39.67 1b0k n ASN 588 CO 0.00 0.00 0.00 -0.46 -2.62 0.00 0.00 177.26 174.18 1b0k n ASN 589 N -1.04 3.04 -4.67 6.41 2.04 -0.32 -4.83 115.26 115.89 1b0k n ASN 589 Ca 0.18 -1.89 -0.47 0.00 -0.44 0.00 0.00 54.58 51.95 1b0k n ASN 589 Cb 0.10 -0.16 -0.04 0.00 -2.53 0.00 0.00 39.78 37.14 1b0k n ASN 589 CO 0.00 0.00 0.00 -0.11 -0.44 0.00 0.00 177.26 176.71 1b0k n LEU 590 N 1.18 3.54 -1.89 -4.53 7.94 -0.99 -2.23 117.00 120.02 1b0k n LEU 590 Ca 0.15 0.90 -0.17 0.00 -1.11 0.00 0.00 56.01 55.78 1b0k n LEU 590 Cb 0.52 -1.41 -0.04 0.00 0.53 0.00 0.00 43.42 43.02 1b0k n LEU 590 CO 0.13 -0.05 -0.18 0.18 -1.11 0.00 0.00 177.39 176.35 1b0k n LEU 591 N 7.22 -1.35 0.04 -1.96 4.77 -0.05 -3.78 117.00 121.89 1b0k n LEU 591 Ca 0.23 0.27 0.08 0.00 -0.03 0.00 0.00 56.01 56.56 1b0k n LEU 591 Cb 0.32 -2.45 0.36 0.00 -2.33 0.00 0.00 43.42 39.32 1b0k n LEU 591 CO 0.72 -0.56 0.76 2.30 -1.33 0.00 0.00 177.39 179.28 1b0k n ILE 592 N -2.80 1.00 0.74 -0.08 -5.35 -0.95 -2.75 119.36 109.17 1b0k n ILE 592 Ca -0.18 0.27 0.08 0.00 -0.27 0.00 0.00 62.75 62.64 1b0k n ILE 592 Cb 0.59 -1.09 -0.07 0.00 -1.74 0.00 0.00 39.64 37.33 1b0k n ILE 592 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1b0k n GLY 593 N -0.11 -0.37 3.77 3.28 0.00 -1.20 -2.94 105.19 107.62 1b0k n GLY 593 Ca 0.03 -0.45 -0.40 0.00 0.00 0.00 0.00 46.02 45.20 1b0k n GLY 593 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1b0k s ALA 594 N -2.35 3.32 -0.26 4.61 0.00 -1.11 -4.91 121.76 121.06 1b0k s ALA 594 Ca 0.08 1.30 -0.25 0.00 0.00 0.00 0.00 51.96 53.09 1b0k s ALA 594 Cb 0.12 -3.51 -0.00 0.00 0.00 0.00 0.00 23.12 19.73 1b0k s ALA 594 CO 0.59 -0.88 0.86 0.42 0.00 0.00 0.00 175.76 176.75 1b0k s ILE 595 N -1.22 4.80 0.20 0.00 -1.09 -1.26 -4.15 121.20 118.47 1b0k s ILE 595 Ca 0.56 1.56 -0.30 0.00 -2.23 0.00 0.00 60.65 60.25 1b0k s ILE 595 Cb -0.40 -4.16 -0.08 0.00 -1.58 0.00 0.00 42.46 36.24 1b0k s ILE 595 CO 0.52 -0.13 1.18 0.21 -1.23 0.00 0.00 174.94 175.48 1b0k s ASN 596 N 1.39 7.12 0.18 3.58 2.47 -0.12 -2.11 114.94 127.44 1b0k s ASN 596 Ca 0.36 2.24 -0.07 0.00 0.42 0.00 0.00 52.86 55.81 1b0k s ASN 596 Cb -0.15 -2.61 0.08 0.00 -1.45 0.00 0.00 41.25 37.12 1b0k s ASN 596 CO 0.08 -0.33 1.54 -0.29 -3.72 0.00 0.00 177.10 174.39 1b0k h ILE 597 N 3.63 1.28 -0.77 -5.21 2.10 -1.82 0.32 117.51 117.04 1b0k h ILE 597 Ca -0.45 -1.51 0.16 0.00 1.08 0.00 0.00 64.86 64.14 1b0k h ILE 597 Cb 1.21 1.38 -0.10 0.00 -1.09 0.00 0.00 36.82 38.22 1b0k h ILE 597 CO 0.73 0.50 0.28 -0.08 -1.08 0.00 0.00 178.15 178.50 1b0k h GLU 598 N 0.67 0.38 0.00 2.19 4.81 -1.92 -3.29 114.58 117.42 1b0k h GLU 598 Ca 0.07 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.27 1b0k h GLU 598 Cb 0.90 -0.09 0.00 0.00 0.63 0.00 0.00 28.75 30.19 1b0k h GLU 598 CO 0.08 0.25 0.00 0.27 -0.73 0.00 0.00 179.01 178.88 1b0k n ASN 599 N -5.05 0.70 -1.86 1.04 0.23 -1.24 -5.01 115.26 104.07 1b0k n ASN 599 Ca 0.15 -1.00 -0.14 0.00 -0.53 0.00 0.00 54.58 53.06 1b0k n ASN 599 Cb 0.46 0.00 0.01 0.00 -2.08 0.00 0.00 39.78 38.18 1b0k n ASN 599 CO 0.00 0.00 0.00 0.54 -0.93 0.00 0.00 177.26 176.87 1b0k n ARG 600 N -0.00 -2.49 -4.20 -3.83 1.74 0.10 -5.01 116.66 102.97 1b0k n ARG 600 Ca 0.00 0.60 -0.19 0.00 -0.77 0.00 0.00 57.85 57.49 1b0k n ARG 600 Cb 0.08 -4.80 -0.12 0.00 -1.02 0.00 0.00 32.46 26.59 1b0k n ARG 600 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 1b0k s LYS 601 N -5.08 0.87 -0.12 5.56 1.02 -1.19 -4.82 119.74 115.98 1b0k s LYS 601 Ca 0.13 -0.98 -0.22 0.00 0.02 0.00 0.00 55.97 54.93 1b0k s LYS 601 Cb -0.06 -0.92 -0.03 0.00 -0.52 0.00 0.00 37.83 36.30 1b0k s LYS 601 CO 0.16 0.21 0.64 0.00 -0.92 0.00 0.00 175.35 175.45 1b0k s ALA 602 N -1.23 3.44 -1.27 5.17 0.00 -1.26 -0.95 121.76 125.66 1b0k s ALA 602 Ca -0.01 -0.06 -0.03 0.00 0.00 0.00 0.00 51.96 51.86 1b0k s ALA 602 Cb -0.10 -2.92 0.01 0.00 0.00 0.00 0.00 23.12 20.11 1b0k s ALA 602 CO 0.02 -0.26 1.02 -1.71 0.00 0.00 0.00 175.76 174.84 1b0k n ASN 603 N 4.25 -3.36 -3.30 0.00 5.15 -1.15 -5.00 115.26 111.86 1b0k n ASN 603 Ca -0.02 -0.62 -0.10 0.00 -0.60 0.00 0.00 54.58 53.24 1b0k n ASN 603 Cb 0.51 -4.94 -0.05 0.00 -0.53 0.00 0.00 39.78 34.77 1b0k n ASN 603 CO 0.00 0.00 0.00 -0.55 1.40 0.00 0.00 177.26 178.11 1b0k s SER 604 N -4.01 0.19 0.04 1.20 0.15 -1.25 -4.04 113.70 105.98 1b0k s SER 604 Ca 0.20 -0.98 0.04 0.00 0.70 0.00 0.00 55.95 55.92 1b0k s SER 604 Cb -0.09 1.11 -0.02 0.00 -1.71 0.00 0.00 66.02 65.30 1b0k s SER 604 CO 0.74 -0.27 -0.13 0.68 1.20 0.00 0.00 173.24 175.47 1b0k s VAL 605 N 1.90 1.02 -0.10 4.45 -7.23 -0.62 -4.84 120.40 114.98 1b0k s VAL 605 Ca 0.14 -0.98 -0.30 0.00 -1.81 0.00 0.00 61.98 59.03 1b0k s VAL 605 Cb -0.11 -0.94 -0.03 0.00 0.56 0.00 0.00 36.38 35.86 1b0k s VAL 605 CO -0.13 -0.04 1.25 -0.60 -0.31 0.00 0.00 175.10 175.27 1b0k s ARG 606 N -1.16 4.29 -0.22 4.82 3.52 -1.26 -0.90 118.95 128.04 1b0k s ARG 606 Ca 0.00 1.70 -0.29 0.00 -0.13 0.00 0.00 55.73 57.01 1b0k s ARG 606 Cb -0.08 -3.66 -0.01 0.00 -1.56 0.00 0.00 34.95 29.65 1b0k s ARG 606 CO 0.01 -0.58 1.29 1.21 -0.81 0.00 0.00 175.30 176.43 1b0k s ASN 607 N 1.76 6.81 0.42 -2.12 3.84 -0.62 -4.93 114.94 120.10 1b0k s ASN 607 Ca 0.56 1.50 0.19 0.00 0.21 0.00 0.00 52.86 55.32 1b0k s ASN 607 Cb -0.24 -2.54 1.11 0.00 -0.55 0.00 0.00 41.25 39.03 1b0k s ASN 607 CO 0.19 -0.91 1.83 0.00 -2.79 0.00 0.00 177.10 175.43 1b0k h ALA 608 N 8.75 2.26 0.03 1.71 0.00 -1.95 -0.31 119.26 129.74 1b0k h ALA 608 Ca -0.27 0.03 -0.08 0.00 0.00 0.00 0.00 54.91 54.59 1b0k h ALA 608 Cb 1.10 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.88 1b0k h ALA 608 CO 1.00 -0.57 -0.42 0.28 0.00 0.00 0.00 179.25 179.54 1b0k h VAL 609 N 0.38 1.56 0.00 0.00 2.07 -1.98 -3.39 116.25 114.90 1b0k h VAL 609 Ca 0.50 -2.35 0.00 0.00 0.82 0.00 0.00 66.70 65.68 1b0k h VAL 609 Cb 1.30 3.12 0.00 0.00 -1.52 0.00 0.00 31.29 34.19 1b0k h VAL 609 CO -0.20 0.58 -1.18 0.35 0.02 0.00 0.00 177.57 177.14 1b0k n THR 610 N -4.47 0.22 -2.26 2.57 -2.24 -1.22 -4.96 114.28 101.90 1b0k n THR 610 Ca -0.15 -0.33 -0.21 0.00 -2.27 0.00 0.00 64.05 61.09 1b0k n THR 610 Cb 0.59 0.10 -0.02 0.00 -2.10 0.00 0.00 70.33 68.89 1b0k n THR 610 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1b0k n GLN 611 N -2.12 -1.66 -4.07 -0.78 1.13 -0.13 -4.99 117.38 104.76 1b0k n GLN 611 Ca 0.01 1.04 -0.31 0.00 -1.94 0.00 0.00 57.00 55.80 1b0k n GLN 611 Cb 0.47 -5.66 -0.07 0.00 0.11 0.00 0.00 30.24 25.10 1b0k n GLN 611 CO 0.00 0.00 0.00 -1.21 -1.44 0.00 0.00 177.06 174.41 1b0k s GLU 612 N -4.82 2.91 0.00 -1.09 0.41 -1.26 -4.90 118.70 109.95 1b0k s GLU 612 Ca 0.00 -0.65 -0.18 0.00 -0.41 0.00 0.00 54.97 53.72 1b0k s GLU 612 Cb 0.00 -2.75 -0.06 0.00 -1.78 0.00 0.00 34.13 29.55 1b0k s GLU 612 CO 0.00 0.58 0.52 -0.06 -0.49 0.00 0.00 175.26 175.81 1b0k s PHE 613 N -1.34 3.70 0.00 1.61 0.40 -1.26 -1.59 117.98 119.50 1b0k s PHE 613 Ca 0.28 1.12 0.00 0.00 -0.60 0.00 0.00 56.93 57.73 1b0k s PHE 613 Cb -0.12 -2.49 0.00 0.00 0.51 0.00 0.00 43.02 40.92 1b0k s PHE 613 CO 0.20 0.46 0.00 0.41 0.70 0.00 0.00 175.22 176.99 1b0k n GLY 614 N 2.22 1.69 3.78 4.36 0.00 -0.08 -4.89 105.19 112.26 1b0k n GLY 614 Ca -0.10 -0.74 -0.36 0.00 0.00 0.00 0.00 46.02 44.82 1b0k n GLY 614 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1b0k s PRO 615 N 0.16 3.86 0.06 1.61 0.02 -1.26 -1.59 135.00 137.86 1b0k s PRO 615 Ca 0.00 1.65 -0.28 0.00 0.02 0.00 0.00 61.00 62.39 1b0k s PRO 615 Cb 0.00 -2.40 -0.17 0.00 0.02 0.00 0.00 34.50 31.95 1b0k s PRO 615 CO 0.00 -0.44 1.54 0.28 -0.33 0.00 0.00 177.00 178.05 1b0k h VAL 616 N 1.90 0.59 -0.18 3.83 2.07 -1.84 -1.48 116.25 121.14 1b0k h VAL 616 Ca -0.49 -0.17 0.04 0.00 0.82 0.00 0.00 66.70 66.90 1b0k h VAL 616 Cb 1.24 0.68 -0.04 0.00 -1.52 0.00 0.00 31.29 31.64 1b0k h VAL 616 CO 0.60 0.03 -0.07 1.55 0.02 0.00 0.00 177.57 179.71 1b0k h PRO 617 N -0.66 -0.03 -0.76 1.57 0.13 -1.88 -1.31 132.00 129.05 1b0k h PRO 617 Ca -0.06 0.00 0.04 0.00 -0.87 0.00 0.00 66.00 65.12 1b0k h PRO 617 Cb 0.48 0.01 -0.04 0.00 0.13 0.00 0.00 31.00 31.58 1b0k h PRO 617 CO 0.09 -0.02 0.50 -0.44 -0.23 0.00 0.00 178.00 177.90 1b0k h ASP 618 N -0.04 0.78 0.18 1.44 5.19 -1.93 0.09 116.42 122.13 1b0k h ASP 618 Ca 0.09 -0.01 -0.18 0.00 -0.62 0.00 0.00 57.03 56.32 1b0k h ASP 618 Cb 0.17 -0.18 -0.00 0.00 0.18 0.00 0.00 39.33 39.51 1b0k h ASP 618 CO -0.20 0.53 -0.69 0.74 -3.12 0.00 0.00 179.24 176.49 1b0k h THR 619 N 0.90 1.36 -0.36 0.35 2.02 -0.65 -1.60 112.91 114.92 1b0k h THR 619 Ca 0.31 -2.05 -0.12 0.00 0.77 0.00 0.00 66.41 65.32 1b0k h THR 619 Cb 0.10 2.03 -0.01 0.00 -1.74 0.00 0.00 68.15 68.53 1b0k h THR 619 CO -0.10 0.62 -0.25 0.00 0.37 0.00 0.00 175.52 176.17 1b0k h ALA 620 N 0.92 0.88 -0.29 6.16 0.00 -0.46 -0.98 119.26 125.48 1b0k h ALA 620 Ca -0.02 -0.38 -0.05 0.00 0.00 0.00 0.00 54.91 54.45 1b0k h ALA 620 Cb 1.26 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.90 1b0k h ALA 620 CO 0.12 0.63 -0.02 0.00 0.00 0.00 0.00 179.25 179.98 1b0k h ARG 621 N 0.63 0.53 -0.85 0.00 3.08 -0.83 -1.76 114.38 115.19 1b0k h ARG 621 Ca 0.08 -0.18 0.06 0.00 0.07 0.00 0.00 59.98 60.02 1b0k h ARG 621 Cb 0.76 -0.04 -0.06 0.00 0.08 0.00 0.00 29.97 30.70 1b0k h ARG 621 CO 0.06 0.70 0.53 -0.92 -1.07 0.00 0.00 179.97 179.26 1b0k h TYR 622 N 0.31 0.97 -0.54 3.04 5.03 -1.18 0.30 116.97 124.91 1b0k h TYR 622 Ca 0.08 0.03 -0.11 0.00 2.58 0.00 0.00 58.73 61.31 1b0k h TYR 622 Cb 0.47 -0.31 -0.02 0.00 1.55 0.00 0.00 36.73 38.42 1b0k h TYR 622 CO 0.04 0.49 -0.08 1.88 -1.32 0.00 0.00 178.16 179.17 1b0k h TYR 623 N 0.96 1.09 -0.52 -3.82 0.05 -1.03 -1.90 116.97 111.80 1b0k h TYR 623 Ca 0.37 -0.21 -0.07 0.00 0.05 0.00 0.00 58.73 58.87 1b0k h TYR 623 Cb 0.18 -0.28 -0.02 0.00 1.01 0.00 0.00 36.73 37.62 1b0k h TYR 623 CO -0.03 1.01 0.05 -0.22 -1.05 0.00 0.00 178.16 177.92 1b0k h LYS 624 N 0.89 0.88 -0.61 4.88 3.64 -0.64 0.24 116.57 125.85 1b0k h LYS 624 Ca 0.14 -0.25 0.03 0.00 -1.27 0.00 0.00 60.65 59.30 1b0k h LYS 624 Cb 0.63 -0.09 -0.04 0.00 -0.41 0.00 0.00 32.23 32.32 1b0k h LYS 624 CO 0.04 0.88 0.37 0.37 -2.27 0.00 0.00 179.45 178.85 1b0k h GLN 625 N 0.75 0.71 -0.20 1.90 4.15 -0.87 -2.88 115.11 118.68 1b0k h GLN 625 Ca 0.15 -0.04 0.00 0.00 0.77 0.00 0.00 58.65 59.53 1b0k h GLN 625 Cb 0.45 -0.16 0.00 0.00 0.21 0.00 0.00 27.48 27.98 1b0k h GLN 625 CO 0.02 0.47 0.00 0.72 -1.93 0.00 0.00 178.83 178.11 1b0k n HIS 626 N -4.74 0.26 -0.92 3.99 8.25 -0.72 -4.95 115.22 116.39 1b0k n HIS 626 Ca 0.06 -0.13 0.00 0.00 -0.26 0.00 0.00 57.72 57.39 1b0k n HIS 626 Cb 0.09 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.20 1b0k n HIS 626 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1b0k n GLY 627 N 1.03 0.52 3.57 -1.41 0.00 -0.85 -5.04 105.19 103.00 1b0k n GLY 627 Ca 0.14 -0.24 -0.42 0.00 0.00 0.00 0.00 46.02 45.49 1b0k n GLY 627 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1b0k s ILE 628 N -2.00 4.70 -0.04 -0.61 1.01 0.80 -5.00 121.20 120.06 1b0k s ILE 628 Ca 0.00 0.69 -0.30 0.00 0.00 0.00 0.00 60.65 61.04 1b0k s ILE 628 Cb 0.00 -4.25 -0.03 0.00 0.01 0.00 0.00 42.46 38.19 1b0k s ILE 628 CO 0.00 -0.55 1.06 -0.13 0.00 0.00 0.00 174.94 175.32 1b0k s ARG 629 N 3.17 4.46 0.34 2.79 0.52 -1.26 -4.28 118.95 124.69 1b0k s ARG 629 Ca 0.31 1.50 0.06 0.00 -0.52 0.00 0.00 55.73 57.08 1b0k s ARG 629 Cb -0.13 -3.49 -0.07 0.00 0.52 0.00 0.00 34.95 31.78 1b0k s ARG 629 CO 0.19 -0.25 -0.00 1.67 0.02 0.00 0.00 175.30 176.94 1b0k s TRP 630 N 1.60 2.18 0.10 -0.53 1.48 -1.24 -1.18 118.94 121.35 1b0k s TRP 630 Ca 0.52 -0.76 0.05 0.00 -1.06 0.00 0.00 56.10 54.86 1b0k s TRP 630 Cb -0.22 -1.41 -0.03 0.00 -1.16 0.00 0.00 33.47 30.65 1b0k s TRP 630 CO 0.23 0.27 -0.13 0.08 -4.06 0.00 0.00 176.95 173.35 1b0k s VAL 631 N -2.97 1.18 0.04 -0.66 1.01 -0.45 -0.23 120.40 118.32 1b0k s VAL 631 Ca 0.34 -1.59 0.06 0.00 0.00 0.00 0.00 61.98 60.80 1b0k s VAL 631 Cb 0.07 -1.37 -0.03 0.00 0.00 0.00 0.00 36.38 35.05 1b0k s VAL 631 CO 0.16 -0.40 -0.15 -0.69 0.00 0.00 0.00 175.10 174.02 1b0k s VAL 632 N -1.97 2.98 -0.18 2.92 1.01 -0.99 -0.56 120.40 123.62 1b0k s VAL 632 Ca 0.05 -1.11 -0.03 0.00 0.00 0.00 0.00 61.98 60.89 1b0k s VAL 632 Cb -0.06 -2.27 -0.02 0.00 0.00 0.00 0.00 36.38 34.03 1b0k s VAL 632 CO 0.02 0.34 -0.05 -0.63 0.00 0.00 0.00 175.10 174.78 1b0k s ILE 633 N -0.95 3.60 0.25 2.22 -1.09 -0.60 -0.90 121.20 123.72 1b0k s ILE 633 Ca 0.15 -0.44 0.04 0.00 -2.23 0.00 0.00 60.65 58.17 1b0k s ILE 633 Cb -0.11 -2.60 -0.05 0.00 -1.58 0.00 0.00 42.46 38.12 1b0k s ILE 633 CO 0.06 0.46 0.00 -0.83 -1.23 0.00 0.00 174.94 173.41 1b0k s GLY 634 N 0.85 1.65 0.00 6.18 0.00 0.19 0.03 107.32 116.22 1b0k s GLY 634 Ca -0.01 -1.82 0.00 0.00 0.00 0.00 0.00 44.72 42.89 1b0k s GLY 634 CO 0.01 -1.70 0.00 1.34 0.00 0.00 0.00 173.10 172.76 1b0k n ASP 635 N -0.47 0.00 -4.87 1.64 -0.08 -1.25 -3.21 116.55 108.32 1b0k n ASP 635 Ca -0.04 0.00 -0.36 0.00 -1.51 0.00 0.00 54.79 52.87 1b0k n ASP 635 Cb 0.64 0.00 -0.06 0.00 2.34 0.00 0.00 41.12 44.05 1b0k n ASP 635 CO 0.00 0.00 0.00 -1.61 0.12 0.00 0.00 177.20 175.71 1b0k s GLU 636 N 2.56 3.65 -1.23 -0.67 2.02 -1.26 -0.81 118.70 122.96 1b0k s GLU 636 Ca 0.00 0.06 -0.04 0.00 0.02 0.00 0.00 54.97 55.02 1b0k s GLU 636 Cb 0.00 -3.13 -0.01 0.00 0.10 0.00 0.00 34.13 31.08 1b0k s GLU 636 CO 0.00 0.68 0.80 -1.71 0.02 0.00 0.00 175.26 175.05 1b0k n ASN 637 N 1.49 -2.70 -4.71 -0.19 4.05 -1.16 -4.74 115.26 107.29 1b0k n ASN 637 Ca -0.14 -0.79 -0.42 0.00 0.45 0.00 0.00 54.58 53.68 1b0k n ASN 637 Cb 0.53 -4.34 -0.03 0.00 1.23 0.00 0.00 39.78 37.17 1b0k n ASN 637 CO 0.00 0.00 0.00 -0.47 -3.05 0.00 0.00 177.26 173.74 1b0k s TYR 638 N -3.55 3.59 0.00 1.20 5.04 -0.94 -2.86 117.35 119.83 1b0k s TYR 638 Ca 0.13 1.57 0.00 0.00 -2.44 0.00 0.00 57.07 56.33 1b0k s TYR 638 Cb -0.03 -3.23 0.00 0.00 0.35 0.00 0.00 41.96 39.05 1b0k s TYR 638 CO 0.79 -0.47 0.00 0.41 -1.34 0.00 0.00 175.55 174.94 1b0k n GLY 639 N 2.88 0.73 3.66 8.97 0.00 0.19 -0.99 105.19 120.63 1b0k n GLY 639 Ca 0.06 -0.43 -0.43 0.00 0.00 0.00 0.00 46.02 45.23 1b0k n GLY 639 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1b0k n GLU 640 N -2.44 1.82 0.00 1.61 2.13 -1.14 -4.26 120.64 118.36 1b0k n GLU 640 Ca 0.00 0.64 0.00 0.00 0.66 0.00 0.00 57.16 58.46 1b0k n GLU 640 Cb 0.00 -2.17 0.00 0.00 0.27 0.00 0.00 31.44 29.54 1b0k n GLU 640 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1b0k n GLY 641 N 0.94 0.25 3.62 8.31 0.00 -1.26 -0.62 105.19 116.43 1b0k n GLY 641 Ca 0.07 -1.75 -0.39 0.00 0.00 0.00 0.00 46.02 43.95 1b0k n GLY 641 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1b0k n ALA 642 N -0.53 0.29 1.18 4.61 0.00 -1.26 -4.92 120.51 119.87 1b0k n ALA 642 Ca 0.00 0.09 0.14 0.00 0.00 0.00 0.00 53.44 53.67 1b0k n ALA 642 Cb 0.00 -2.11 0.60 0.00 0.00 0.00 0.00 19.45 17.93 1b0k n ALA 642 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1b0k n SER 643 N -0.28 0.16 -3.95 0.00 3.41 -1.26 -4.76 113.62 106.94 1b0k n SER 643 Ca 0.12 0.04 -0.49 0.00 -0.26 0.00 0.00 58.87 58.28 1b0k n SER 643 Cb 0.44 -0.26 -0.12 0.00 -0.26 0.00 0.00 64.21 64.01 1b0k n SER 643 CO 0.00 0.00 0.00 -2.11 -0.16 0.00 0.00 175.04 172.77 1b0k n ARG 644 N -1.35 0.00 0.00 4.33 1.85 -1.26 -4.54 116.66 115.69 1b0k n ARG 644 Ca 0.10 0.00 0.01 0.00 -1.00 0.00 0.00 57.85 56.96 1b0k n ARG 644 Cb 0.30 -1.36 0.05 0.00 -1.05 0.00 0.00 32.46 30.40 1b0k n ARG 644 CO 0.00 0.00 0.00 -0.85 -0.01 0.00 0.00 177.63 176.77 1b0k n GLU 645 N 7.14 0.02 0.05 2.89 0.28 -1.26 -2.80 120.64 126.96 1b0k n GLU 645 Ca 0.54 0.36 0.04 0.00 -0.16 0.00 0.00 57.16 57.93 1b0k n GLU 645 Cb -0.01 -1.50 0.44 0.00 1.43 0.00 0.00 31.44 31.80 1b0k n GLU 645 CO 0.00 0.00 0.00 0.45 -0.16 0.00 0.00 177.13 177.42 1b0k h HIS 646 N 0.00 0.42 0.00 -1.84 3.86 -1.98 -0.32 115.15 115.28 1b0k h HIS 646 Ca 0.00 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 1b0k h HIS 646 Cb 0.03 -0.14 0.00 0.00 1.06 0.00 0.00 27.41 28.36 1b0k h HIS 646 CO 0.00 0.30 0.00 0.77 0.86 0.00 0.00 177.93 179.86 1b0k h SER 647 N 0.44 0.00 0.00 2.45 0.02 -1.89 0.11 113.55 114.67 1b0k h SER 647 Ca 0.12 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 61.05 1b0k h SER 647 Cb 0.01 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.55 1b0k h SER 647 CO -0.02 0.00 -1.83 0.00 -1.14 0.00 0.00 176.83 173.84 1b0k n ALA 648 N -1.96 2.59 0.13 3.77 0.00 -0.25 -4.41 120.51 120.37 1b0k n ALA 648 Ca -0.00 -0.46 -0.24 0.00 0.00 0.00 0.00 53.44 52.73 1b0k n ALA 648 Cb 0.18 -0.57 -0.16 0.00 0.00 0.00 0.00 19.45 18.90 1b0k n ALA 648 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 1b0k h LEU 649 N 0.00 0.78 -0.33 0.00 3.38 -0.50 -3.20 115.31 115.45 1b0k h LEU 649 Ca -0.03 -0.90 -0.06 0.00 0.09 0.00 0.00 57.88 56.98 1b0k h LEU 649 Cb 0.88 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 41.37 1b0k h LEU 649 CO 0.00 1.72 -0.02 -0.33 0.09 0.00 0.00 178.44 179.90 1b0k h GLU 650 N 0.14 0.59 0.00 1.13 5.08 -1.06 -0.68 114.58 119.78 1b0k h GLU 650 Ca -0.28 -0.20 -0.01 0.00 -1.00 0.00 0.00 59.36 57.87 1b0k h GLU 650 Cb 2.15 -0.05 -0.00 0.00 0.50 0.00 0.00 28.75 31.35 1b0k h GLU 650 CO 0.25 0.73 -0.06 -1.00 -1.00 0.00 0.00 179.01 177.93 1b0k h PRO 651 N 0.38 0.00 -0.16 2.33 0.13 -1.77 -2.55 132.00 130.36 1b0k h PRO 651 Ca 0.09 0.00 -0.21 0.00 -0.87 0.00 0.00 66.00 65.01 1b0k h PRO 651 Cb 0.48 0.00 0.01 0.00 0.13 0.00 0.00 31.00 31.62 1b0k h PRO 651 CO 0.02 0.06 -0.75 -0.09 -0.23 0.00 0.00 178.00 177.02 1b0k h ARG 652 N 0.00 0.75 -0.21 0.86 9.65 -1.37 0.13 114.38 124.20 1b0k h ARG 652 Ca -0.00 -0.60 -0.07 0.00 -1.10 0.00 0.00 59.98 58.22 1b0k h ARG 652 Cb 0.21 0.12 -0.00 0.00 -1.39 0.00 0.00 29.97 28.90 1b0k h ARG 652 CO 0.01 1.21 -0.13 1.25 2.80 0.00 0.00 179.97 185.11 1b0k h HIS 653 N 0.52 0.53 0.00 2.20 2.76 -0.88 -3.00 115.15 117.28 1b0k h HIS 653 Ca -0.04 -0.14 0.00 0.00 -2.20 0.00 0.00 60.37 57.99 1b0k h HIS 653 Cb 1.37 -0.12 0.00 0.00 1.55 0.00 0.00 27.41 30.21 1b0k h HIS 653 CO 0.08 0.76 0.00 1.28 -1.30 0.00 0.00 177.93 178.75 1b0k n LEU 654 N -4.51 0.74 0.00 0.26 4.77 -0.99 -4.86 117.00 112.41 1b0k n LEU 654 Ca -0.05 -0.37 0.00 0.00 -0.03 0.00 0.00 56.01 55.56 1b0k n LEU 654 Cb 0.35 -0.37 0.00 0.00 -2.33 0.00 0.00 43.42 41.07 1b0k n LEU 654 CO 0.40 0.18 0.00 0.61 -1.33 0.00 0.00 177.39 177.25 1b0k n GLY 655 N 0.13 0.61 3.68 -0.72 0.00 -1.13 -4.42 105.19 103.33 1b0k n GLY 655 Ca 0.00 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.65 1b0k n GLY 655 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1b0k n GLY 656 N -2.01 0.16 0.00 -0.02 0.00 0.46 -3.70 105.19 100.07 1b0k n GLY 656 Ca 0.00 -0.13 0.00 0.00 0.00 0.00 0.00 46.02 45.89 1b0k n GLY 656 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1b0k n ARG 657 N -1.42 2.08 -3.53 1.61 3.00 0.68 -4.61 116.66 114.46 1b0k n ARG 657 Ca 0.15 0.00 -0.17 0.00 -0.00 0.00 0.00 57.85 57.82 1b0k n ARG 657 Cb 0.47 -0.88 -0.06 0.00 0.00 0.00 0.00 32.46 31.99 1b0k n ARG 657 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1b0k s ALA 658 N -1.76 -1.71 -0.05 5.13 0.00 -1.25 -3.11 121.76 119.00 1b0k s ALA 658 Ca 0.00 1.22 0.05 0.00 0.00 0.00 0.00 51.96 53.23 1b0k s ALA 658 Cb 0.00 0.05 -0.00 0.00 0.00 0.00 0.00 23.12 23.17 1b0k s ALA 658 CO 0.00 -0.39 -0.20 0.42 0.00 0.00 0.00 175.76 175.60 1b0k s ILE 659 N -1.34 1.65 -0.09 0.00 -1.09 -0.96 -2.33 121.20 117.04 1b0k s ILE 659 Ca -0.10 -0.83 0.02 0.00 -2.23 0.00 0.00 60.65 57.50 1b0k s ILE 659 Cb -0.00 -1.42 0.01 0.00 -1.58 0.00 0.00 42.46 39.47 1b0k s ILE 659 CO 0.08 0.47 -0.13 -0.63 -1.23 0.00 0.00 174.94 173.50 1b0k s ILE 660 N 0.03 1.27 0.24 2.92 1.01 -0.08 -1.25 121.20 125.36 1b0k s ILE 660 Ca -0.05 -0.53 -0.01 0.00 0.00 0.00 0.00 60.65 60.05 1b0k s ILE 660 Cb -0.13 -1.17 -0.03 0.00 0.01 0.00 0.00 42.46 41.14 1b0k s ILE 660 CO 0.03 0.39 0.23 0.42 0.00 0.00 0.00 174.94 176.02 1b0k s THR 661 N 0.87 0.00 -0.04 2.92 -4.23 -0.61 0.54 115.64 115.09 1b0k s THR 661 Ca -0.10 -1.89 -0.25 0.00 -1.18 0.00 0.00 61.69 58.27 1b0k s THR 661 Cb -0.15 -2.47 -0.19 0.00 1.34 0.00 0.00 72.50 71.02 1b0k s THR 661 CO 0.01 0.00 1.12 0.11 -0.54 0.00 0.00 174.62 175.32 1b0k h LYS 662 N 2.44 -0.09 -4.15 3.99 1.57 -0.94 -2.11 116.57 117.27 1b0k h LYS 662 Ca -0.32 0.01 -0.14 0.00 -1.87 0.00 0.00 60.65 58.32 1b0k h LYS 662 Cb 1.25 0.02 -0.14 0.00 0.08 0.00 0.00 32.23 33.44 1b0k h LYS 662 CO 0.46 0.41 -0.49 -1.54 -0.57 0.00 0.00 179.45 177.73 1b0k s SER 663 N -5.63 0.18 0.21 0.86 1.04 -1.19 -4.58 113.70 104.60 1b0k s SER 663 Ca -0.15 -1.03 0.11 0.00 0.48 0.00 0.00 55.95 55.35 1b0k s SER 663 Cb 0.01 0.36 -0.04 0.00 0.10 0.00 0.00 66.02 66.45 1b0k s SER 663 CO 0.61 -0.80 -0.17 -0.36 0.98 0.00 0.00 173.24 173.50 1b0k s PHE 664 N -4.00 2.42 0.16 5.02 0.08 -1.26 -2.22 117.98 118.18 1b0k s PHE 664 Ca 0.20 -0.30 -0.21 0.00 0.12 0.00 0.00 56.93 56.73 1b0k s PHE 664 Cb 0.05 -1.16 -0.08 0.00 -0.57 0.00 0.00 43.02 41.27 1b0k s PHE 664 CO 0.00 0.55 0.69 0.00 -0.10 0.00 0.00 175.22 176.37 1b0k s ALA 665 N -1.87 3.48 0.20 5.36 0.00 -0.16 -4.72 121.76 124.04 1b0k s ALA 665 Ca 0.24 0.18 -0.16 0.00 0.00 0.00 0.00 51.96 52.23 1b0k s ALA 665 Cb -0.08 -2.80 0.19 0.00 0.00 0.00 0.00 23.12 20.43 1b0k s ALA 665 CO 0.13 0.34 1.62 -0.09 0.00 0.00 0.00 175.76 177.76 1b0k h ARG 666 N 4.04 -0.06 -0.12 0.00 2.43 -1.91 -2.40 114.38 116.36 1b0k h ARG 666 Ca -0.48 0.00 -0.20 0.00 -0.81 0.00 0.00 59.98 58.49 1b0k h ARG 666 Cb 1.20 0.01 0.01 0.00 -0.42 0.00 0.00 29.97 30.78 1b0k h ARG 666 CO 0.65 -0.04 -0.71 0.82 -1.51 0.00 0.00 179.97 179.18 1b0k h ILE 667 N -0.07 1.31 -0.84 1.20 2.04 -1.94 -2.23 117.51 116.98 1b0k h ILE 667 Ca 0.27 -1.95 0.03 0.00 1.00 0.00 0.00 64.86 64.21 1b0k h ILE 667 Cb 0.49 2.11 -0.05 0.00 -0.74 0.00 0.00 36.82 38.63 1b0k h ILE 667 CO -0.64 0.61 0.56 -0.74 0.00 0.00 0.00 178.15 177.94 1b0k h HIS 668 N 0.37 1.02 -0.52 1.37 2.76 -1.75 -1.48 115.15 116.93 1b0k h HIS 668 Ca -0.06 0.02 -0.11 0.00 -2.20 0.00 0.00 60.37 58.03 1b0k h HIS 668 Cb 1.35 -0.34 -0.02 0.00 1.55 0.00 0.00 27.41 29.95 1b0k h HIS 668 CO 0.10 0.61 -0.13 1.49 -1.30 0.00 0.00 177.93 178.70 1b0k h GLU 669 N 1.07 0.99 -0.10 5.26 4.81 -1.23 0.08 114.58 125.46 1b0k h GLU 669 Ca 0.33 -0.37 -0.01 0.00 -0.13 0.00 0.00 59.36 59.18 1b0k h GLU 669 Cb -0.01 -0.06 -0.00 0.00 0.63 0.00 0.00 28.75 29.30 1b0k h GLU 669 CO -0.09 1.05 0.03 1.15 -0.73 0.00 0.00 179.01 180.42 1b0k h THR 670 N 0.88 1.18 -0.87 0.32 2.02 -1.16 -2.30 112.91 112.97 1b0k h THR 670 Ca 0.13 -0.54 0.04 0.00 0.77 0.00 0.00 66.41 66.82 1b0k h THR 670 Cb 0.69 1.36 -0.05 0.00 -1.74 0.00 0.00 68.15 68.40 1b0k h THR 670 CO 0.05 0.15 0.56 0.78 0.37 0.00 0.00 175.52 177.43 1b0k h ASN 671 N -0.04 0.92 -0.43 4.18 -0.26 -1.06 -1.75 115.58 117.14 1b0k h ASN 671 Ca 0.03 -0.00 0.02 0.00 -0.56 0.00 0.00 56.30 55.79 1b0k h ASN 671 Cb 0.22 -0.20 -0.03 0.00 -1.06 0.00 0.00 38.32 37.25 1b0k h ASN 671 CO -0.00 0.62 0.26 -0.07 -1.06 0.00 0.00 177.43 177.18 1b0k h LEU 672 N 1.07 0.42 -1.23 1.61 3.38 -0.94 -2.65 115.31 116.98 1b0k h LEU 672 Ca 0.35 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 58.25 1b0k h LEU 672 Cb 0.04 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 40.69 1b0k h LEU 672 CO -0.13 0.30 -0.37 0.11 0.09 0.00 0.00 178.44 178.44 1b0k h LYS 673 N 0.52 0.00 -0.45 1.13 1.57 -1.13 -2.80 116.57 115.41 1b0k h LYS 673 Ca 0.17 0.00 -0.06 0.00 -1.87 0.00 0.00 60.65 58.89 1b0k h LYS 673 Cb 0.00 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.29 1b0k h LYS 673 CO -0.07 0.37 0.03 0.87 -0.57 0.00 0.00 179.45 180.08 1b0k h LYS 674 N 0.00 0.72 -0.51 3.15 1.79 -0.96 -2.98 116.57 117.77 1b0k h LYS 674 Ca -0.00 -0.17 0.00 0.00 -2.18 0.00 0.00 60.65 58.29 1b0k h LYS 674 Cb 0.70 -0.10 0.00 0.00 -1.58 0.00 0.00 32.23 31.25 1b0k h LYS 674 CO 0.05 0.72 0.00 1.04 -1.08 0.00 0.00 179.45 180.17 1b0k n GLN 675 N -4.25 2.27 -0.49 3.15 1.13 -1.13 -0.63 117.38 117.44 1b0k n GLN 675 Ca 0.03 -1.51 0.00 0.00 -1.94 0.00 0.00 57.00 53.57 1b0k n GLN 675 Cb 0.27 -1.49 0.00 0.00 0.11 0.00 0.00 30.24 29.13 1b0k n GLN 675 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1b0k n GLY 676 N 0.90 0.75 3.92 1.08 0.00 -1.13 -4.69 105.19 106.02 1b0k n GLY 676 Ca 0.14 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.90 1b0k n GLY 676 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1b0k s LEU 677 N 0.00 3.08 -0.42 0.99 1.43 -1.07 -4.86 118.68 117.83 1b0k s LEU 677 Ca 0.00 0.62 -0.06 0.00 -1.03 0.00 0.00 54.13 53.65 1b0k s LEU 677 Cb 0.00 -3.38 0.10 0.00 0.03 0.00 0.00 46.19 42.94 1b0k s LEU 677 CO 0.00 -1.26 0.24 -0.76 0.23 0.00 0.00 176.35 174.80 1b0k s LEU 678 N -5.08 5.22 -0.29 1.79 1.43 -1.18 -4.33 118.68 116.24 1b0k s LEU 678 Ca 0.56 -1.78 -0.29 0.00 -1.03 0.00 0.00 54.13 51.59 1b0k s LEU 678 Cb -0.11 -1.91 0.01 0.00 0.03 0.00 0.00 46.19 44.22 1b0k s LEU 678 CO 0.45 -0.56 1.10 -2.16 0.23 0.00 0.00 176.35 175.41 1b0k s PRO 679 N 1.29 4.11 0.07 1.29 0.04 -1.26 -2.27 135.00 138.26 1b0k s PRO 679 Ca 0.05 1.19 0.07 0.00 0.04 0.00 0.00 61.00 62.34 1b0k s PRO 679 Cb -0.23 -3.73 -0.03 0.00 0.04 0.00 0.00 34.50 30.55 1b0k s PRO 679 CO -0.01 -0.85 -0.18 -0.51 0.04 0.00 0.00 177.00 175.49 1b0k s LEU 680 N 3.60 2.23 0.16 -3.56 1.43 -0.38 -4.76 118.68 117.41 1b0k s LEU 680 Ca 0.47 -0.58 0.08 0.00 -1.03 0.00 0.00 54.13 53.07 1b0k s LEU 680 Cb -0.14 -0.79 -0.04 0.00 0.03 0.00 0.00 46.19 45.25 1b0k s LEU 680 CO 0.14 0.06 -0.09 0.42 0.23 0.00 0.00 176.35 177.11 1b0k s THR 681 N -1.01 3.27 0.19 5.49 -4.23 -0.60 -1.57 115.64 117.18 1b0k s THR 681 Ca 0.04 -1.55 -0.31 0.00 -1.18 0.00 0.00 61.69 58.69 1b0k s THR 681 Cb -0.09 -2.60 -0.10 0.00 1.34 0.00 0.00 72.50 71.05 1b0k s THR 681 CO 0.03 -0.06 1.52 -0.36 -0.54 0.00 0.00 174.62 175.21 1b0k s PHE 682 N -1.59 3.05 0.33 3.99 0.08 -0.79 -1.31 117.98 121.73 1b0k s PHE 682 Ca 0.24 0.76 0.11 0.00 0.12 0.00 0.00 56.93 58.16 1b0k s PHE 682 Cb -0.09 -3.89 0.56 0.00 -0.57 0.00 0.00 43.02 39.03 1b0k s PHE 682 CO 0.15 -3.15 1.74 0.00 -0.10 0.00 0.00 175.22 173.85 1b0k h ALA 683 N 6.27 1.21 -3.59 5.36 0.00 -1.37 -3.39 119.26 123.74 1b0k h ALA 683 Ca -0.44 -0.43 -0.62 0.00 0.00 0.00 0.00 54.91 53.43 1b0k h ALA 683 Cb 1.21 -0.08 -0.38 0.00 0.00 0.00 0.00 17.79 18.55 1b0k h ALA 683 CO 0.87 0.59 -0.79 0.34 0.00 0.00 0.00 179.25 180.26 1b0k s ASP 684 N -6.90 3.76 0.16 0.00 2.15 -1.26 -5.03 116.67 109.54 1b0k s ASP 684 Ca -0.02 -1.10 0.09 0.00 0.43 0.00 0.00 52.55 51.94 1b0k s ASP 684 Cb 0.14 -1.23 0.49 0.00 -0.30 0.00 0.00 42.92 42.02 1b0k s ASP 684 CO 0.74 -0.20 1.21 -0.81 -0.17 0.00 0.00 175.17 175.94 1b0k n PRO 685 N 4.65 0.06 0.14 4.34 -0.04 -1.26 -1.92 135.00 140.97 1b0k n PRO 685 Ca -0.13 0.51 0.01 0.00 -0.04 0.00 0.00 63.50 63.85 1b0k n PRO 685 Cb 0.45 -1.80 0.12 0.00 -0.04 0.00 0.00 33.50 32.23 1b0k n PRO 685 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1b0k h ALA 686 N 1.66 0.76 0.00 0.55 0.00 -1.97 -3.12 119.26 117.14 1b0k h ALA 686 Ca 0.00 -0.54 0.00 0.00 0.00 0.00 0.00 54.91 54.37 1b0k h ALA 686 Cb 0.21 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.91 1b0k h ALA 686 CO 0.00 0.74 0.51 -0.44 0.00 0.00 0.00 179.25 180.06 1b0k h ASP 687 N 0.00 0.00 -0.69 0.00 3.32 -1.83 -0.36 116.42 116.86 1b0k h ASP 687 Ca -0.01 0.00 0.03 0.00 0.02 0.00 0.00 57.03 57.07 1b0k h ASP 687 Cb 1.26 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 40.77 1b0k h ASP 687 CO 0.08 0.00 0.46 0.22 -1.72 0.00 0.00 179.24 178.27 1b0k h TYR 688 N 0.00 0.81 0.00 4.55 3.20 -1.77 -1.50 116.97 122.26 1b0k h TYR 688 Ca 0.00 0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.89 1b0k h TYR 688 Cb 1.02 -0.27 0.00 0.00 1.54 0.00 0.00 36.73 39.02 1b0k h TYR 688 CO 0.00 0.48 0.00 -0.91 -1.64 0.00 0.00 178.16 176.09 1b0k h ASN 689 N 0.84 0.00 0.27 -2.11 2.35 -1.31 -3.19 115.58 112.44 1b0k h ASN 689 Ca 0.27 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.02 1b0k h ASN 689 Cb 0.04 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.41 1b0k h ASN 689 CO -0.07 0.00 -0.14 0.29 -1.65 0.00 0.00 177.43 175.86 1b0k n LYS 690 N -2.35 0.84 -4.44 0.81 5.02 -0.56 -4.81 118.16 112.67 1b0k n LYS 690 Ca 0.02 -0.37 -0.34 0.00 -2.02 0.00 0.00 58.31 55.60 1b0k n LYS 690 Cb 0.26 -1.49 -0.14 0.00 -0.02 0.00 0.00 35.03 33.64 1b0k n LYS 690 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1b0k s ILE 691 N -2.42 3.12 0.04 -0.18 1.01 -1.21 -5.08 121.20 116.49 1b0k s ILE 691 Ca 0.29 -0.62 0.06 0.00 0.00 0.00 0.00 60.65 60.39 1b0k s ILE 691 Cb 0.20 -2.35 -0.03 0.00 0.01 0.00 0.00 42.46 40.29 1b0k s ILE 691 CO 0.47 0.49 -0.14 -1.00 0.00 0.00 0.00 174.94 174.77 1b0k s HIS 692 N 0.77 2.68 0.40 3.97 3.76 -1.26 -5.00 115.29 120.60 1b0k s HIS 692 Ca -0.04 -0.18 0.11 0.00 -0.15 0.00 0.00 55.06 54.80 1b0k s HIS 692 Cb -0.15 -1.50 0.59 0.00 1.11 0.00 0.00 32.58 32.63 1b0k s HIS 692 CO 0.01 0.32 1.24 -1.35 -0.85 0.00 0.00 174.74 174.11 1b0k h PRO 693 N 4.37 0.00 -0.01 8.40 0.11 -1.99 -2.43 132.00 140.44 1b0k h PRO 693 Ca -0.48 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.63 1b0k h PRO 693 Cb 1.16 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.27 1b0k h PRO 693 CO 0.50 0.00 -0.60 1.55 -0.21 0.00 0.00 178.00 179.24 1b0k n VAL 694 N -2.28 0.00 -1.88 3.15 3.14 -1.26 -4.66 118.33 114.54 1b0k n VAL 694 Ca -0.01 -0.20 -0.32 0.00 -2.96 0.00 0.00 64.34 60.86 1b0k n VAL 694 Cb 0.60 1.20 0.02 0.00 -1.06 0.00 0.00 33.84 34.60 1b0k n VAL 694 CO 0.00 0.00 0.00 -1.81 -6.46 0.00 0.00 176.83 168.56 1b0k s ASP 695 N -2.60 5.85 0.08 6.55 1.01 -0.92 -4.74 116.67 121.91 1b0k s ASP 695 Ca 0.16 1.61 0.06 0.00 0.71 0.00 0.00 52.55 55.09 1b0k s ASP 695 Cb 0.18 -2.50 -0.04 0.00 1.01 0.00 0.00 42.92 41.57 1b0k s ASP 695 CO 0.64 -1.12 -0.08 -0.54 0.21 0.00 0.00 175.17 174.28 1b0k s LYS 696 N -4.69 2.27 -0.05 8.23 -0.14 -0.81 -4.39 119.74 120.16 1b0k s LYS 696 Ca 0.59 -0.94 0.03 0.00 -1.36 0.00 0.00 55.97 54.29 1b0k s LYS 696 Cb -0.13 -2.37 0.01 0.00 -1.68 0.00 0.00 37.83 33.65 1b0k s LYS 696 CO 0.47 0.53 -0.14 -0.51 -0.76 0.00 0.00 175.35 174.94 1b0k s LEU 697 N -2.05 1.78 -0.23 3.17 1.43 -1.00 -0.80 118.68 120.98 1b0k s LEU 697 Ca 0.21 -0.30 -0.04 0.00 -1.03 0.00 0.00 54.13 52.97 1b0k s LEU 697 Cb -0.11 -0.84 -0.00 0.00 0.03 0.00 0.00 46.19 45.26 1b0k s LEU 697 CO 0.13 0.08 -0.03 -0.89 0.23 0.00 0.00 176.35 175.88 1b0k s THR 698 N 0.35 3.41 -0.05 5.49 2.01 -0.10 -1.67 115.64 125.09 1b0k s THR 698 Ca -0.09 -0.57 -0.19 0.00 0.31 0.00 0.00 61.69 61.16 1b0k s THR 698 Cb -0.13 -2.60 -0.05 0.00 0.01 0.00 0.00 72.50 69.73 1b0k s THR 698 CO 0.03 0.36 0.53 -0.63 -0.69 0.00 0.00 174.62 174.21 1b0k s ILE 699 N 1.47 5.04 -0.00 1.82 -1.09 -1.18 -1.48 121.20 125.77 1b0k s ILE 699 Ca 0.05 1.09 0.02 0.00 -2.23 0.00 0.00 60.65 59.57 1b0k s ILE 699 Cb -0.15 -3.86 -0.00 0.00 -1.58 0.00 0.00 42.46 36.86 1b0k s ILE 699 CO -0.03 0.40 -0.05 -1.58 -1.23 0.00 0.00 174.94 172.45 1b0k s GLN 700 N 0.04 0.42 0.00 2.79 0.74 -0.72 -2.20 119.66 120.73 1b0k s GLN 700 Ca 0.28 -0.21 0.00 0.00 0.05 0.00 0.00 55.36 55.48 1b0k s GLN 700 Cb -0.17 -0.40 0.00 0.00 1.10 0.00 0.00 33.01 33.54 1b0k s GLN 700 CO 0.14 0.11 0.00 0.41 -0.55 0.00 0.00 175.29 175.40 1b0k n GLY 701 N 2.89 1.36 0.23 2.59 0.00 -1.26 -3.14 105.19 107.85 1b0k n GLY 701 Ca -0.13 -0.10 0.14 0.00 0.00 0.00 0.00 46.02 45.92 1b0k n GLY 701 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1b0k h LEU 702 N 0.00 0.00 -0.97 0.99 4.07 -1.95 -3.25 115.31 114.21 1b0k h LEU 702 Ca 0.00 0.00 -0.11 0.00 0.08 0.00 0.00 57.88 57.85 1b0k h LEU 702 Cb 0.13 0.00 -0.02 0.00 1.08 0.00 0.00 40.66 41.86 1b0k h LEU 702 CO 0.00 0.00 -0.51 0.11 -1.08 0.00 0.00 178.44 176.96 1b0k h LYS 703 N 0.00 0.00 -1.00 1.13 6.56 -1.94 -3.05 116.57 118.27 1b0k h LYS 703 Ca 0.00 0.00 -0.50 0.00 -1.06 0.00 0.00 60.65 59.09 1b0k h LYS 703 Cb 0.81 0.00 -0.42 0.00 -0.57 0.00 0.00 32.23 32.05 1b0k h LYS 703 CO 0.00 0.51 -0.88 -0.40 -2.06 0.00 0.00 179.45 176.62 1b0k n ASP 704 N -3.89 3.93 -4.72 0.86 5.68 -1.25 -5.08 116.55 112.09 1b0k n ASP 704 Ca -0.01 -3.36 -0.42 0.00 -0.50 0.00 0.00 54.79 50.49 1b0k n ASP 704 Cb 0.53 -0.43 -0.03 0.00 -1.14 0.00 0.00 41.12 40.05 1b0k n ASP 704 CO 0.00 0.00 0.00 0.12 -1.33 0.00 0.00 177.20 175.99 1b0k s PHE 705 N -3.55 3.01 -0.03 2.11 5.36 -1.16 -5.02 117.98 118.71 1b0k s PHE 705 Ca 0.44 0.54 -0.11 0.00 -0.96 0.00 0.00 56.93 56.83 1b0k s PHE 705 Cb 0.40 -4.00 0.02 0.00 -0.34 0.00 0.00 43.02 39.10 1b0k s PHE 705 CO -0.05 -3.71 0.24 0.00 -1.46 0.00 0.00 175.22 170.24 1b0k s ALA 706 N 1.14 -0.60 0.19 11.12 0.00 -1.26 -5.09 121.76 127.25 1b0k s ALA 706 Ca 0.71 0.27 -0.32 0.00 0.00 0.00 0.00 51.96 52.63 1b0k s ALA 706 Cb -0.46 -0.04 -0.12 0.00 0.00 0.00 0.00 23.12 22.51 1b0k s ALA 706 CO 0.32 -0.21 1.75 -2.14 0.00 0.00 0.00 175.76 175.48 1b0k s PRO 707 N -0.99 4.13 0.00 0.00 0.02 -1.26 -2.46 135.00 134.43 1b0k s PRO 707 Ca -0.11 2.61 0.00 0.00 0.02 0.00 0.00 61.00 63.52 1b0k s PRO 707 Cb -0.05 -3.20 0.00 0.00 0.02 0.00 0.00 34.50 31.27 1b0k s PRO 707 CO 0.02 -0.78 0.00 0.41 -0.33 0.00 0.00 177.00 176.33 1b0k n GLY 708 N 4.05 2.78 3.63 0.52 0.00 -1.26 -5.01 105.19 109.89 1b0k n GLY 708 Ca 0.16 -0.15 -0.43 0.00 0.00 0.00 0.00 46.02 45.61 1b0k n GLY 708 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1b0k s LYS 709 N 0.00 4.01 0.94 1.61 2.20 -1.03 -5.03 119.74 122.45 1b0k s LYS 709 Ca 0.00 0.85 -0.12 0.00 -0.36 0.00 0.00 55.97 56.34 1b0k s LYS 709 Cb 0.00 -3.74 0.15 0.00 -1.51 0.00 0.00 37.83 32.74 1b0k s LYS 709 CO 0.00 -0.81 1.09 -1.25 -0.36 0.00 0.00 175.35 174.02 1b0k s PRO 710 N 3.35 0.89 0.11 4.03 0.04 -1.26 -4.49 135.00 137.68 1b0k s PRO 710 Ca 0.40 0.64 0.05 0.00 0.04 0.00 0.00 61.00 62.13 1b0k s PRO 710 Cb -0.13 -1.78 -0.04 0.00 0.04 0.00 0.00 34.50 32.59 1b0k s PRO 710 CO 0.14 -2.45 0.01 -0.51 0.04 0.00 0.00 177.00 174.23 1b0k s LEU 711 N -6.31 3.46 0.01 -3.56 1.43 -0.18 -4.90 118.68 108.64 1b0k s LEU 711 Ca 0.64 -0.21 -0.09 0.00 -1.03 0.00 0.00 54.13 53.44 1b0k s LEU 711 Cb -0.18 -2.17 -0.05 0.00 0.03 0.00 0.00 46.19 43.82 1b0k s LEU 711 CO 0.57 0.16 0.32 -0.54 0.23 0.00 0.00 176.35 177.08 1b0k s LYS 712 N -2.45 3.68 -0.14 1.70 1.02 -1.19 -0.20 119.74 122.17 1b0k s LYS 712 Ca 0.26 0.09 0.00 0.00 0.02 0.00 0.00 55.97 56.34 1b0k s LYS 712 Cb -0.11 -3.09 0.02 0.00 -0.52 0.00 0.00 37.83 34.13 1b0k s LYS 712 CO 0.19 0.65 -0.11 0.00 -0.92 0.00 0.00 175.35 175.15 1b0k s ILE 714 N 1.57 4.94 -0.35 0.00 1.09 -0.55 -0.80 121.20 127.11 1b0k s ILE 714 Ca 0.05 0.53 -0.21 0.00 -1.10 0.00 0.00 60.65 59.92 1b0k s ILE 714 Cb -0.13 -4.02 0.00 0.00 -1.06 0.00 0.00 42.46 37.25 1b0k s ILE 714 CO -0.10 -0.25 0.67 -0.63 -0.10 0.00 0.00 174.94 174.52 1b0k s ILE 715 N 2.58 4.87 -0.48 2.92 1.01 0.60 -0.92 121.20 131.78 1b0k s ILE 715 Ca 0.22 0.71 -0.17 0.00 0.00 0.00 0.00 60.65 61.42 1b0k s ILE 715 Cb -0.15 -4.09 0.07 0.00 0.01 0.00 0.00 42.46 38.30 1b0k s ILE 715 CO 0.14 -0.30 0.46 -0.54 0.00 0.00 0.00 174.94 174.70 1b0k s LYS 716 N 2.76 3.03 0.14 2.79 1.02 0.02 -1.60 119.74 127.90 1b0k s LYS 716 Ca 0.26 -1.19 -0.20 0.00 0.02 0.00 0.00 55.97 54.86 1b0k s LYS 716 Cb -0.14 -4.11 -0.07 0.00 -0.52 0.00 0.00 37.83 32.98 1b0k s LYS 716 CO 0.14 -1.07 0.66 -1.01 -0.92 0.00 0.00 175.35 173.15 1b0k s HIS 717 N 1.96 3.77 0.54 3.18 3.76 -0.24 -1.91 115.29 126.34 1b0k s HIS 717 Ca 0.08 1.37 0.40 0.00 -0.15 0.00 0.00 55.06 56.76 1b0k s HIS 717 Cb -0.22 -2.58 2.11 0.00 1.11 0.00 0.00 32.58 33.00 1b0k s HIS 717 CO 0.08 0.49 2.27 -1.35 -0.85 0.00 0.00 174.74 175.38 1b0k h PRO 718 N 4.09 0.00 0.00 8.40 0.11 -1.86 -0.01 132.00 142.72 1b0k h PRO 718 Ca -0.48 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.63 1b0k h PRO 718 Cb 1.20 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.31 1b0k h PRO 718 CO 0.65 0.01 0.00 -2.95 -0.21 0.00 0.00 178.00 175.50 1b0k h ASN 719 N 0.00 0.00 0.00 -2.05 7.08 -2.00 -3.46 115.58 115.15 1b0k h ASN 719 Ca -0.00 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 53.22 1b0k h ASN 719 Cb 0.12 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 36.36 1b0k h ASN 719 CO 0.00 0.00 0.00 0.61 -2.08 0.00 0.00 177.43 175.96 1b0k n GLY 720 N 0.49 0.85 3.63 9.14 0.00 -0.02 -5.08 105.19 114.20 1b0k n GLY 720 Ca 0.03 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.62 1b0k n GLY 720 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1b0k s THR 721 N -2.00 3.75 0.68 2.61 2.01 -1.22 -4.90 115.64 116.57 1b0k s THR 721 Ca 0.00 0.85 -0.01 0.00 0.31 0.00 0.00 61.69 62.83 1b0k s THR 721 Cb 0.00 -3.78 0.10 0.00 0.01 0.00 0.00 72.50 68.82 1b0k s THR 721 CO 0.00 -0.34 0.95 -1.10 -0.69 0.00 0.00 174.62 173.44 1b0k s GLN 722 N 4.65 1.94 -0.28 4.92 -0.21 -1.26 -1.08 119.66 128.34 1b0k s GLN 722 Ca 0.69 -0.90 -0.16 0.00 0.02 0.00 0.00 55.36 55.01 1b0k s GLN 722 Cb -0.23 -2.34 0.11 0.00 1.00 0.00 0.00 33.01 31.54 1b0k s GLN 722 CO 0.29 -1.25 0.80 -1.21 -2.12 0.00 0.00 175.29 171.79 1b0k s GLU 723 N -5.07 0.58 -0.11 2.91 2.02 -0.63 -4.91 118.70 113.49 1b0k s GLU 723 Ca 0.63 1.01 -0.14 0.00 0.02 0.00 0.00 54.97 56.49 1b0k s GLU 723 Cb -0.07 0.12 -0.05 0.00 0.10 0.00 0.00 34.13 34.23 1b0k s GLU 723 CO 0.43 -0.12 0.34 0.99 0.02 0.00 0.00 175.26 176.91 1b0k s THR 724 N 1.51 5.24 0.24 3.63 2.01 -1.26 -0.29 115.64 126.72 1b0k s THR 724 Ca -0.10 0.65 0.06 0.00 0.31 0.00 0.00 61.69 62.62 1b0k s THR 724 Cb -0.04 -3.66 -0.05 0.00 0.01 0.00 0.00 72.50 68.75 1b0k s THR 724 CO -0.18 0.44 -0.07 0.27 -0.69 0.00 0.00 174.62 174.40 1b0k s ILE 725 N -0.01 1.49 -0.09 1.82 -4.36 0.02 -4.95 121.20 115.12 1b0k s ILE 725 Ca 0.20 -2.12 -0.00 0.00 -0.26 0.00 0.00 60.65 58.46 1b0k s ILE 725 Cb -0.14 -2.28 -0.03 0.00 1.25 0.00 0.00 42.46 41.26 1b0k s ILE 725 CO 0.07 -0.41 -0.07 -0.76 0.24 0.00 0.00 174.94 174.01 1b0k s LEU 726 N -3.36 3.14 -0.16 0.37 1.43 -1.26 -0.41 118.68 118.43 1b0k s LEU 726 Ca 0.27 -0.07 0.02 0.00 -1.03 0.00 0.00 54.13 53.31 1b0k s LEU 726 Cb 0.03 -1.70 0.02 0.00 0.03 0.00 0.00 46.19 44.56 1b0k s LEU 726 CO 0.09 0.30 -0.21 -0.76 0.23 0.00 0.00 176.35 176.00 1b0k s LEU 727 N -0.45 2.12 0.31 1.79 1.43 0.73 -0.90 118.68 123.71 1b0k s LEU 727 Ca 0.07 -0.63 -0.09 0.00 -1.03 0.00 0.00 54.13 52.44 1b0k s LEU 727 Cb -0.12 -1.46 -0.07 0.00 0.03 0.00 0.00 46.19 44.57 1b0k s LEU 727 CO 0.02 0.04 0.65 0.20 0.23 0.00 0.00 176.35 177.48 1b0k s ASN 728 N 1.07 6.56 0.05 2.29 0.01 -0.43 -1.01 114.94 123.47 1b0k s ASN 728 Ca -0.01 0.98 0.03 0.00 -0.71 0.00 0.00 52.86 53.16 1b0k s ASN 728 Cb -0.14 -2.25 -0.02 0.00 0.41 0.00 0.00 41.25 39.24 1b0k s ASN 728 CO -0.08 -0.23 -0.11 -1.38 -1.51 0.00 0.00 177.10 173.80 1b0k s HIS 729 N -2.09 0.91 -0.35 2.20 -3.43 -1.26 -1.55 115.29 109.71 1b0k s HIS 729 Ca 0.49 -0.43 0.04 0.00 -0.80 0.00 0.00 55.06 54.35 1b0k s HIS 729 Cb -0.11 -0.53 0.53 0.00 -1.43 0.00 0.00 32.58 31.04 1b0k s HIS 729 CO 0.26 -0.02 1.69 0.25 -2.00 0.00 0.00 174.74 174.93 1b0k n THR 730 N 1.60 2.66 -2.39 -5.38 -2.24 -1.26 -4.70 114.28 102.56 1b0k n THR 730 Ca -0.21 -1.45 -0.41 0.00 -2.27 0.00 0.00 64.05 59.72 1b0k n THR 730 Cb 0.55 -0.57 -0.04 0.00 -2.10 0.00 0.00 70.33 68.17 1b0k n THR 730 CO 0.00 0.00 0.00 -0.36 -0.57 0.00 0.00 175.07 174.14 1b0k s PHE 731 N -2.53 3.45 0.41 4.78 0.40 -1.26 -5.06 117.98 118.17 1b0k s PHE 731 Ca 0.44 1.59 0.07 0.00 -0.60 0.00 0.00 56.93 58.42 1b0k s PHE 731 Cb 0.37 -3.39 0.07 0.00 0.51 0.00 0.00 43.02 40.58 1b0k s PHE 731 CO 0.09 -0.93 0.56 0.27 0.70 0.00 0.00 175.22 175.91 1b0k n ASN 732 N 1.44 1.53 0.16 1.36 0.23 -1.26 -4.30 115.26 114.42 1b0k n ASN 732 Ca 0.00 -2.10 0.13 0.00 -0.53 0.00 0.00 54.58 52.08 1b0k n ASN 732 Cb 0.44 -0.29 0.50 0.00 -2.08 0.00 0.00 39.78 38.35 1b0k n ASN 732 CO 0.00 0.00 0.00 -0.33 -0.93 0.00 0.00 177.26 176.00 1b0k h GLU 733 N 0.00 0.00 -0.21 -3.83 4.39 -1.99 -2.83 114.58 110.11 1b0k h GLU 733 Ca -0.19 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.49 1b0k h GLU 733 Cb 0.89 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.53 1b0k h GLU 733 CO 0.28 0.00 0.09 1.15 -1.16 0.00 0.00 179.01 179.37 1b0k h THR 734 N 0.00 1.16 -0.04 1.13 2.02 -2.01 -3.01 112.91 112.16 1b0k h THR 734 Ca 0.00 -0.46 -0.11 0.00 0.77 0.00 0.00 66.41 66.61 1b0k h THR 734 Cb 0.51 1.08 -0.01 0.00 -1.74 0.00 0.00 68.15 67.98 1b0k h THR 734 CO 0.00 0.15 -0.47 1.56 0.37 0.00 0.00 175.52 177.13 1b0k h GLN 735 N 0.19 0.10 -0.00 6.66 4.20 -1.92 -2.96 115.11 121.37 1b0k h GLN 735 Ca 0.07 -0.05 -0.15 0.00 0.06 0.00 0.00 58.65 58.58 1b0k h GLN 735 Cb 0.16 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 27.92 1b0k h GLN 735 CO -0.01 0.55 -0.73 0.82 -0.67 0.00 0.00 178.83 178.79 1b0k h ILE 736 N 0.08 1.52 0.00 2.54 2.04 -1.41 -2.10 117.51 120.19 1b0k h ILE 736 Ca 0.00 -2.50 -0.03 0.00 1.00 0.00 0.00 64.86 63.33 1b0k h ILE 736 Cb 0.87 2.35 -0.00 0.00 -0.74 0.00 0.00 36.82 39.29 1b0k h ILE 736 CO 0.07 0.72 -0.16 -0.33 0.00 0.00 0.00 178.15 178.44 1b0k h GLU 737 N 0.01 0.00 0.00 2.37 4.39 -1.39 -1.29 114.58 118.67 1b0k h GLU 737 Ca -0.01 0.00 -0.00 0.00 0.34 0.00 0.00 59.36 59.69 1b0k h GLU 737 Cb 1.30 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.95 1b0k h GLU 737 CO 0.10 0.16 -0.00 -1.49 -1.16 0.00 0.00 179.01 176.61 1b0k h TRP 738 N 0.00 -0.00 0.41 4.33 6.55 -1.35 -2.84 115.95 123.04 1b0k h TRP 738 Ca -0.00 -0.00 -0.01 0.00 0.95 0.00 0.00 58.89 59.83 1b0k h TRP 738 Cb 0.43 0.00 -0.01 0.00 -0.86 0.00 0.00 29.16 28.73 1b0k h TRP 738 CO 0.00 0.53 -0.27 0.35 -1.05 0.00 0.00 178.44 178.00 1b0k h PHE 739 N -0.54 -0.70 -0.79 0.49 3.57 -1.35 -1.00 116.94 116.62 1b0k h PHE 739 Ca -0.00 -0.01 0.13 0.00 3.53 0.00 0.00 57.97 61.62 1b0k h PHE 739 Cb 0.54 0.25 -0.06 0.00 2.79 0.00 0.00 35.95 39.47 1b0k h PHE 739 CO 0.11 -0.41 0.52 0.00 -2.23 0.00 0.00 178.31 176.30 1b0k h ARG 740 N -0.66 0.57 0.00 1.11 3.08 -1.31 -2.40 114.38 114.78 1b0k h ARG 740 Ca -0.04 -0.03 -0.09 0.00 0.07 0.00 0.00 59.98 59.89 1b0k h ARG 740 Cb 0.55 -0.13 -0.01 0.00 0.08 0.00 0.00 29.97 30.45 1b0k h ARG 740 CO 0.04 0.38 -0.41 0.00 -1.07 0.00 0.00 179.97 178.90 1b0k h ALA 741 N 1.62 0.74 0.00 0.04 0.00 -1.32 -1.01 119.26 119.34 1b0k h ALA 741 Ca 0.38 -0.38 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1b0k h ALA 741 Cb 0.66 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.39 1b0k h ALA 741 CO -0.15 0.52 0.00 0.41 0.00 0.00 0.00 179.25 180.03 1b0k n GLY 742 N 1.13 1.14 0.00 0.00 0.00 -0.48 -4.11 105.19 102.87 1b0k n GLY 742 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.04 1b0k n GLY 742 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1b0k n SER 743 N 0.00 0.00 -0.31 1.61 3.41 -0.61 -3.45 113.62 114.26 1b0k n SER 743 Ca 0.00 0.00 -0.03 0.00 -0.26 0.00 0.00 58.87 58.58 1b0k n SER 743 Cb 0.00 0.00 0.09 0.00 -0.26 0.00 0.00 64.21 64.04 1b0k n SER 743 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1b0k h ALA 744 N 0.00 1.08 -0.41 7.33 0.00 -1.06 -2.16 119.26 124.05 1b0k h ALA 744 Ca 0.00 -0.05 -0.11 0.00 0.00 0.00 0.00 54.91 54.74 1b0k h ALA 744 Cb 0.00 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.44 1b0k h ALA 744 CO 0.00 0.46 -0.20 1.25 0.00 0.00 0.00 179.25 180.76 1b0k h LEU 745 N 1.13 0.80 -0.99 0.00 5.85 -1.95 -1.55 115.31 118.61 1b0k h LEU 745 Ca 0.32 -0.28 -0.08 0.00 0.84 0.00 0.00 57.88 58.68 1b0k h LEU 745 Cb -0.11 -0.22 -0.02 0.00 0.37 0.00 0.00 40.66 40.69 1b0k h LEU 745 CO -0.08 0.99 -0.09 0.78 -0.34 0.00 0.00 178.44 179.70 1b0k h ASN 746 N 0.70 0.61 -0.36 1.25 2.35 -1.80 -2.49 115.58 115.84 1b0k h ASN 746 Ca 0.10 -0.16 -0.01 0.00 -0.55 0.00 0.00 56.30 55.69 1b0k h ASN 746 Cb 0.71 -0.16 -0.02 0.00 0.05 0.00 0.00 38.32 38.91 1b0k h ASN 746 CO 0.05 0.74 0.20 -0.09 -1.65 0.00 0.00 177.43 176.68 1b0k h ARG 747 N 0.58 0.50 -0.93 0.81 1.12 -1.18 -2.67 114.38 112.61 1b0k h ARG 747 Ca 0.11 -0.05 -0.01 0.00 -1.11 0.00 0.00 59.98 58.91 1b0k h ARG 747 Cb 0.50 -0.10 -0.04 0.00 -0.01 0.00 0.00 29.97 30.32 1b0k h ARG 747 CO 0.03 0.40 0.54 1.98 -3.11 0.00 0.00 179.97 179.81 1b0k h MET 748 N 0.46 1.28 -0.33 0.20 4.05 -1.14 -2.85 114.93 116.59 1b0k h MET 748 Ca 0.13 -0.13 -0.15 0.00 -0.28 0.00 0.00 59.70 59.27 1b0k h MET 748 Cb 0.04 -0.26 -0.01 0.00 -0.80 0.00 0.00 31.60 30.57 1b0k h MET 748 CO -0.02 0.91 -0.38 0.87 0.23 0.00 0.00 176.91 178.52 1b0k h LYS 749 N 1.29 0.78 -0.76 0.39 1.57 -1.42 -2.92 116.57 115.50 1b0k h LYS 749 Ca 0.33 -0.40 0.05 0.00 -1.87 0.00 0.00 60.65 58.77 1b0k h LYS 749 Cb -0.02 0.01 -0.05 0.00 0.08 0.00 0.00 32.23 32.24 1b0k h LYS 749 CO -0.06 1.02 0.47 0.93 -0.57 0.00 0.00 179.45 181.24 1b0k h GLU 750 N 0.64 0.84 0.00 3.15 5.08 -1.27 -2.71 114.58 120.31 1b0k h GLU 750 Ca 0.06 -0.05 -0.01 0.00 -1.00 0.00 0.00 59.36 58.36 1b0k h GLU 750 Cb 0.93 -0.19 -0.00 0.00 0.50 0.00 0.00 28.75 29.99 1b0k h GLU 750 CO 0.09 0.56 -0.03 -0.07 -1.00 0.00 0.00 179.01 178.55 1b0k h LEU 751 N 0.87 0.00 -5.52 1.33 3.38 -1.32 -3.14 115.31 110.91 1b0k h LEU 751 Ca 0.33 0.00 -0.64 0.00 0.09 0.00 0.00 57.88 57.66 1b0k h LEU 751 Cb 0.12 0.00 0.01 0.00 0.09 0.00 0.00 40.66 40.88 1b0k h LEU 751 CO -0.15 0.03 3.31 0.00 0.09 0.00 0.00 178.44 181.71 1b0k n GLN 752 N -3.78 2.99 -2.03 1.13 6.02 -1.02 -4.81 117.38 115.88 1b0k n GLN 752 Ca -0.03 -2.18 -0.02 0.00 -0.01 0.00 0.00 57.00 54.76 1b0k n GLN 752 Cb 0.12 -2.91 -0.00 0.00 1.02 0.00 0.00 30.24 28.46 1b0k n GLN 752 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1b0k n GLN 753 N 4.79 -0.99 0.00 -1.09 10.64 -1.19 -5.05 117.38 124.49 1b0k n GLN 753 Ca 0.63 0.00 0.00 0.00 -1.83 0.00 0.00 57.00 55.80 1b0k n GLN 753 Cb 0.28 -0.17 0.00 0.00 -0.86 0.00 0.00 30.24 29.49 1b0k n GLN 753 CO 0.00 0.00 0.00 0.36 -1.83 0.00 0.00 177.06 175.59