#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1k9z n LEU 3 N 0.00 -0.70 0.05 0.00 4.77 -1.26 -4.95 117.00 114.91 1k9z n LEU 3 Ca 0.00 0.00 -0.13 0.00 -0.03 0.00 0.00 56.01 55.85 1k9z n LEU 3 Cb 0.00 -0.34 -0.08 0.00 -2.33 0.00 0.00 43.42 40.67 1k9z n LEU 3 CO 0.00 0.00 0.75 -0.33 -1.33 0.00 0.00 177.39 176.48 1k9z h GLU 4 N 0.00 -0.08 -0.64 3.23 3.07 -2.05 -0.67 114.58 117.45 1k9z h GLU 4 Ca 0.00 0.01 -0.07 0.00 -0.50 0.00 0.00 59.36 58.80 1k9z h GLU 4 Cb 0.68 0.02 -0.03 0.00 -0.84 0.00 0.00 28.75 28.58 1k9z h GLU 4 CO 0.00 0.12 0.13 -0.09 -1.40 0.00 0.00 179.01 177.78 1k9z h ARG 5 N -0.27 1.02 -0.55 2.33 9.65 -2.00 -1.77 114.38 122.79 1k9z h ARG 5 Ca -0.01 -0.24 -0.05 0.00 -1.10 0.00 0.00 59.98 58.58 1k9z h ARG 5 Cb 0.24 -0.13 -0.03 0.00 -1.39 0.00 0.00 29.97 28.66 1k9z h ARG 5 CO 0.01 0.91 0.13 0.93 2.80 0.00 0.00 179.97 184.76 1k9z h GLU 6 N 0.96 0.86 -0.30 0.20 3.07 -1.92 -0.58 114.58 116.86 1k9z h GLU 6 Ca 0.20 -0.18 -0.16 0.00 -0.50 0.00 0.00 59.36 58.72 1k9z h GLU 6 Cb 0.37 -0.13 -0.00 0.00 -0.84 0.00 0.00 28.75 28.15 1k9z h GLU 6 CO 0.00 0.77 -0.44 1.25 -1.40 0.00 0.00 179.01 179.19 1k9z h LEU 7 N 0.82 0.91 -0.06 1.33 5.85 -0.62 0.23 115.31 123.77 1k9z h LEU 7 Ca 0.18 -0.51 0.01 0.00 0.84 0.00 0.00 57.88 58.40 1k9z h LEU 7 Cb 0.31 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 41.07 1k9z h LEU 7 CO -0.00 1.24 -0.01 0.25 -0.34 0.00 0.00 178.44 179.58 1k9z h LEU 8 N 0.61 -0.04 -0.12 2.25 5.85 -1.03 -0.43 115.31 122.39 1k9z h LEU 8 Ca 0.03 0.02 0.02 0.00 0.84 0.00 0.00 57.88 58.79 1k9z h LEU 8 Cb 1.04 0.03 -0.02 0.00 0.37 0.00 0.00 40.66 42.08 1k9z h LEU 8 CO 0.10 -0.01 -0.01 0.58 -0.34 0.00 0.00 178.44 178.76 1k9z h VAL 9 N 0.01 0.90 -0.35 1.05 2.07 -1.00 -1.23 116.25 117.70 1k9z h VAL 9 Ca 0.03 -0.01 0.06 0.00 0.82 0.00 0.00 66.70 67.60 1k9z h VAL 9 Cb 0.04 0.87 -0.05 0.00 -1.52 0.00 0.00 31.29 30.63 1k9z h VAL 9 CO -0.06 0.01 0.02 0.00 0.02 0.00 0.00 177.57 177.55 1k9z h ALA 10 N 1.11 0.33 0.03 1.67 0.00 -0.84 -0.62 119.26 120.94 1k9z h ALA 10 Ca 0.06 0.09 -0.00 0.00 0.00 0.00 0.00 54.91 55.06 1k9z h ALA 10 Cb 0.08 0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.02 1k9z h ALA 10 CO -0.11 -0.39 -0.01 1.15 0.00 0.00 0.00 179.25 179.89 1k9z h THR 11 N 0.12 1.13 -0.35 0.00 2.02 -0.75 -0.94 112.91 114.14 1k9z h THR 11 Ca 0.17 -0.48 -0.07 0.00 0.77 0.00 0.00 66.41 66.81 1k9z h THR 11 Cb 0.23 1.45 -0.02 0.00 -1.74 0.00 0.00 68.15 68.07 1k9z h THR 11 CO -0.27 0.12 -0.07 1.56 0.37 0.00 0.00 175.52 177.23 1k9z h GLN 12 N -0.24 0.57 -0.08 6.66 1.08 -1.14 0.37 115.11 122.34 1k9z h GLN 12 Ca -0.00 -0.15 -0.02 0.00 -1.45 0.00 0.00 58.65 57.03 1k9z h GLN 12 Cb 0.23 -0.07 -0.00 0.00 -0.05 0.00 0.00 27.48 27.59 1k9z h GLN 12 CO 0.01 0.65 -0.02 0.00 -0.95 0.00 0.00 178.83 178.51 1k9z h ALA 13 N 1.39 0.10 -0.87 3.87 0.00 -0.98 -1.27 119.26 121.51 1k9z h ALA 13 Ca 0.10 -0.21 0.06 0.00 0.00 0.00 0.00 54.91 54.87 1k9z h ALA 13 Cb 0.45 -0.03 -0.06 0.00 0.00 0.00 0.00 17.79 18.15 1k9z h ALA 13 CO 0.02 -0.17 0.54 0.28 0.00 0.00 0.00 179.25 179.92 1k9z h VAL 14 N -0.19 1.04 0.13 0.00 2.07 -1.08 -2.09 116.25 116.12 1k9z h VAL 14 Ca 0.02 -0.34 -0.01 0.00 0.82 0.00 0.00 66.70 67.20 1k9z h VAL 14 Cb 0.42 -0.03 0.00 0.00 -1.52 0.00 0.00 31.29 30.17 1k9z h VAL 14 CO 0.01 0.18 -0.06 -0.09 0.02 0.00 0.00 177.57 177.63 1k9z h ARG 15 N 0.98 -0.16 -0.66 1.57 2.43 -0.62 0.13 114.38 118.05 1k9z h ARG 15 Ca 0.38 0.01 -0.08 0.00 -0.81 0.00 0.00 59.98 59.48 1k9z h ARG 15 Cb 0.19 0.04 -0.03 0.00 -0.42 0.00 0.00 29.97 29.75 1k9z h ARG 15 CO -0.18 -0.10 0.10 -0.22 -1.51 0.00 0.00 179.97 178.06 1k9z h LYS 16 N -0.18 1.09 -0.16 0.20 3.64 -1.11 -2.00 116.57 118.04 1k9z h LYS 16 Ca -0.02 -0.29 -0.08 0.00 -1.27 0.00 0.00 60.65 58.99 1k9z h LYS 16 Cb 0.14 -0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 31.82 1k9z h LYS 16 CO 0.03 1.00 -0.26 0.00 -2.27 0.00 0.00 179.45 177.95 1k9z h ALA 17 N 1.08 1.28 -0.62 5.00 0.00 -1.21 -2.26 119.26 122.53 1k9z h ALA 17 Ca 0.20 -0.31 -0.08 0.00 0.00 0.00 0.00 54.91 54.72 1k9z h ALA 17 Cb 0.45 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.12 1k9z h ALA 17 CO 0.01 0.48 0.07 0.77 0.00 0.00 0.00 179.25 180.58 1k9z h SER 18 N 0.26 1.01 -0.59 0.00 0.02 -0.29 -1.11 113.55 112.85 1k9z h SER 18 Ca 0.04 -0.28 -0.03 0.00 -0.84 0.00 0.00 61.79 60.69 1k9z h SER 18 Cb 0.60 -0.27 -0.03 0.00 0.14 0.00 0.00 62.40 62.84 1k9z h SER 18 CO 0.04 1.03 0.26 0.25 -1.14 0.00 0.00 176.83 177.27 1k9z h LEU 19 N 0.95 0.79 -0.25 5.07 5.85 -1.04 -1.76 115.31 124.92 1k9z h LEU 19 Ca 0.18 -0.15 -0.02 0.00 0.84 0.00 0.00 57.88 58.73 1k9z h LEU 19 Cb 0.48 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 41.29 1k9z h LEU 19 CO 0.02 0.72 0.07 0.25 -0.34 0.00 0.00 178.44 179.16 1k9z h LEU 20 N 0.80 0.37 -0.61 2.25 6.46 -1.13 -0.81 115.31 122.65 1k9z h LEU 20 Ca 0.20 -0.21 -0.13 0.00 -0.12 0.00 0.00 57.88 57.61 1k9z h LEU 20 Cb 0.16 -0.10 -0.01 0.00 -0.73 0.00 0.00 40.66 39.98 1k9z h LEU 20 CO -0.02 0.48 -0.31 0.71 -0.62 0.00 0.00 178.44 178.69 1k9z h THR 21 N 0.23 1.28 -0.47 1.05 1.35 -1.20 -1.34 112.91 113.80 1k9z h THR 21 Ca 0.08 -1.45 0.02 0.00 -0.55 0.00 0.00 66.41 64.51 1k9z h THR 21 Cb 0.25 1.33 -0.03 0.00 -1.73 0.00 0.00 68.15 67.97 1k9z h THR 21 CO -0.00 0.48 0.27 0.50 -0.25 0.00 0.00 175.52 176.52 1k9z h LYS 22 N 0.65 0.53 -0.08 4.72 1.63 -1.15 -2.68 116.57 120.19 1k9z h LYS 22 Ca 0.07 -0.03 -0.14 0.00 -0.85 0.00 0.00 60.65 59.70 1k9z h LYS 22 Cb 0.84 -0.12 -0.01 0.00 -0.60 0.00 0.00 32.23 32.34 1k9z h LYS 22 CO 0.07 0.35 -0.56 0.00 -3.45 0.00 0.00 179.45 175.86 1k9z h ARG 23 N 0.55 0.24 -0.01 1.90 3.08 -0.70 -3.22 114.38 116.21 1k9z h ARG 23 Ca 0.19 -0.15 0.00 0.00 0.07 0.00 0.00 59.98 60.09 1k9z h ARG 23 Cb 0.03 0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.10 1k9z h ARG 23 CO -0.10 0.74 -0.48 1.51 -1.07 0.00 0.00 179.97 180.57 1k9z n ILE 24 N -3.91 0.00 -0.11 2.04 3.06 -0.55 -4.50 119.36 115.39 1k9z n ILE 24 Ca -0.02 -0.13 -0.05 0.00 -2.50 0.00 0.00 62.75 60.05 1k9z n ILE 24 Cb 0.59 0.75 0.02 0.00 0.54 0.00 0.00 39.64 41.54 1k9z n ILE 24 CO 0.00 0.00 0.00 -0.61 -2.50 0.00 0.00 176.55 173.44 1k9z h GLN 25 N 1.23 0.10 -0.47 9.51 4.15 -1.49 0.19 115.11 128.33 1k9z h GLN 25 Ca 0.00 -0.01 -0.11 0.00 0.77 0.00 0.00 58.65 59.30 1k9z h GLN 25 Cb 0.59 -0.02 -0.02 0.00 0.21 0.00 0.00 27.48 28.24 1k9z h GLN 25 CO 0.00 0.07 -0.14 0.66 -1.93 0.00 0.00 178.83 177.49 1k9z h SER 26 N 0.11 0.90 -0.69 -0.69 4.64 -1.83 -1.93 113.55 114.07 1k9z h SER 26 Ca 0.19 -0.30 -0.08 0.00 -0.47 0.00 0.00 61.79 61.13 1k9z h SER 26 Cb 0.26 -0.24 -0.03 0.00 -0.31 0.00 0.00 62.40 62.08 1k9z h SER 26 CO -0.31 1.04 0.12 -0.33 -0.87 0.00 0.00 176.83 176.48 1k9z h GLU 27 N 0.80 1.13 -0.55 4.77 3.07 -1.72 -1.08 114.58 121.00 1k9z h GLU 27 Ca 0.12 -0.30 -0.01 0.00 -0.50 0.00 0.00 59.36 58.68 1k9z h GLU 27 Cb 0.67 -0.14 -0.03 0.00 -0.84 0.00 0.00 28.75 28.42 1k9z h GLU 27 CO 0.05 1.02 0.30 0.28 -1.40 0.00 0.00 179.01 179.25 1k9z h VAL 28 N 1.06 1.19 -0.48 3.13 2.07 -0.61 -0.97 116.25 121.64 1k9z h VAL 28 Ca 0.21 -0.48 -0.01 0.00 0.82 0.00 0.00 66.70 67.24 1k9z h VAL 28 Cb 0.43 0.50 -0.02 0.00 -1.52 0.00 0.00 31.29 30.68 1k9z h VAL 28 CO 0.01 0.20 0.28 0.40 0.02 0.00 0.00 177.57 178.48 1k9z h ILE 29 N 0.74 1.16 -0.69 4.57 2.04 -1.09 -2.71 117.51 121.53 1k9z h ILE 29 Ca 0.19 -0.38 -0.06 0.00 1.00 0.00 0.00 64.86 65.61 1k9z h ILE 29 Cb 0.06 0.54 -0.03 0.00 -0.74 0.00 0.00 36.82 36.65 1k9z h ILE 29 CO -0.03 0.16 0.18 0.77 0.00 0.00 0.00 178.15 179.23 1k9z h SER 30 N 0.64 1.03 -1.56 1.72 4.64 -0.96 -3.19 113.55 115.88 1k9z h SER 30 Ca 0.17 -0.23 -0.66 0.00 -0.47 0.00 0.00 61.79 60.60 1k9z h SER 30 Cb 0.02 -0.27 -0.35 0.00 -0.31 0.00 0.00 62.40 61.49 1k9z h SER 30 CO -0.03 0.99 0.13 1.41 -0.87 0.00 0.00 176.83 178.46 1k9z n HIS 31 N -4.27 3.15 0.21 4.77 8.25 -0.39 -4.82 115.22 122.12 1k9z n HIS 31 Ca 0.05 -2.70 0.04 0.00 -0.26 0.00 0.00 57.72 54.85 1k9z n HIS 31 Cb 0.25 -0.69 0.44 0.00 1.12 0.00 0.00 29.99 31.11 1k9z n HIS 31 CO 0.00 0.00 0.00 1.57 0.64 0.00 0.00 176.34 178.55 1k9z h LYS 32 N 2.63 0.00 -0.14 -0.41 5.09 -1.47 -0.70 116.57 121.57 1k9z h LYS 32 Ca 0.45 0.00 -0.08 0.00 0.09 0.00 0.00 60.65 61.11 1k9z h LYS 32 Cb 0.64 0.00 -0.01 0.00 0.10 0.00 0.00 32.23 32.95 1k9z h LYS 32 CO 1.15 0.29 -0.26 -0.44 -2.09 0.00 0.00 179.45 178.10 1k9z h ASP 33 N 0.00 0.24 0.00 7.07 3.45 -1.87 -2.30 116.42 123.01 1k9z h ASP 33 Ca -0.00 -0.07 0.00 0.00 0.43 0.00 0.00 57.03 57.38 1k9z h ASP 33 Cb 0.53 -0.07 0.00 0.00 -0.56 0.00 0.00 39.33 39.23 1k9z h ASP 33 CO 0.04 0.51 -1.95 -1.54 -1.57 0.00 0.00 179.24 174.72 1k9z n SER 34 N -4.15 0.16 -0.00 6.45 3.41 -0.79 -4.55 113.62 114.14 1k9z n SER 34 Ca -0.01 -0.02 0.08 0.00 -0.26 0.00 0.00 58.87 58.66 1k9z n SER 34 Cb 0.37 1.96 -0.10 0.00 -0.26 0.00 0.00 64.21 66.17 1k9z n SER 34 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 1k9z n THR 35 N -2.23 0.00 -5.26 6.66 -2.24 -0.34 -4.97 114.28 105.91 1k9z n THR 35 Ca -0.04 -0.22 -0.32 0.00 -2.27 0.00 0.00 64.05 61.21 1k9z n THR 35 Cb 0.55 0.68 -0.17 0.00 -2.10 0.00 0.00 70.33 69.29 1k9z n THR 35 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1k9z s THR 36 N -2.69 2.06 -0.03 4.28 2.01 -0.87 -1.67 115.64 118.72 1k9z s THR 36 Ca 0.02 -1.06 0.06 0.00 0.31 0.00 0.00 61.69 61.02 1k9z s THR 36 Cb 0.11 -1.75 -0.01 0.00 0.01 0.00 0.00 72.50 70.86 1k9z s THR 36 CO 0.64 0.57 -0.22 -0.63 -0.69 0.00 0.00 174.62 174.29 1k9z s ILE 37 N -0.07 1.81 -0.26 1.82 1.01 0.07 -4.82 121.20 120.76 1k9z s ILE 37 Ca -0.07 -0.95 -0.20 0.00 0.00 0.00 0.00 60.65 59.43 1k9z s ILE 37 Cb -0.15 -1.52 -0.02 0.00 0.01 0.00 0.00 42.46 40.79 1k9z s ILE 37 CO 0.05 0.51 0.60 -0.89 0.00 0.00 0.00 174.94 175.20 1k9z s THR 38 N -0.31 5.00 0.83 2.92 2.01 -1.26 -1.41 115.64 123.42 1k9z s THR 38 Ca 0.02 1.05 -0.13 0.00 0.31 0.00 0.00 61.69 62.94 1k9z s THR 38 Cb -0.11 -3.91 0.19 0.00 0.01 0.00 0.00 72.50 68.68 1k9z s THR 38 CO 0.01 0.03 1.12 0.29 -0.69 0.00 0.00 174.62 175.39 1k9z n LYS 39 N 5.67 -1.01 0.03 4.92 5.02 -0.22 -4.87 118.16 127.71 1k9z n LYS 39 Ca -0.02 -1.85 0.11 0.00 -2.02 0.00 0.00 58.31 54.53 1k9z n LYS 39 Cb 0.49 -1.12 0.45 0.00 -0.02 0.00 0.00 35.03 34.83 1k9z n LYS 39 CO 0.00 0.00 0.00 0.27 -0.52 0.00 0.00 177.40 177.15 1k9z n ASN 40 N -3.65 0.16 -1.39 4.39 6.94 -1.26 -0.76 115.26 119.69 1k9z n ASN 40 Ca 0.14 0.53 0.10 0.00 -0.02 0.00 0.00 54.58 55.34 1k9z n ASN 40 Cb 0.50 -0.57 0.32 0.00 -2.36 0.00 0.00 39.78 37.68 1k9z n ASN 40 CO 0.00 0.00 0.00 -0.90 -1.03 0.00 0.00 177.26 175.33 1k9z n ASP 41 N -1.67 4.21 0.00 0.53 5.75 -1.26 -4.93 116.55 119.18 1k9z n ASP 41 Ca 0.05 -2.20 0.00 0.00 -0.01 0.00 0.00 54.79 52.63 1k9z n ASP 41 Cb 0.26 -0.51 0.00 0.00 -1.03 0.00 0.00 41.12 39.84 1k9z n ASP 41 CO 0.00 0.00 0.00 0.59 -0.11 0.00 0.00 177.20 177.68 1k9z n ASN 42 N 1.31 -2.87 -4.86 -1.12 3.02 0.06 -5.01 115.26 105.80 1k9z n ASN 42 Ca 0.24 0.00 -0.31 0.00 -0.03 0.00 0.00 54.58 54.48 1k9z n ASN 42 Cb 0.72 -1.86 -0.04 0.00 -0.61 0.00 0.00 39.78 38.00 1k9z n ASN 42 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 1k9z s SER 43 N -2.17 6.59 0.44 6.41 1.04 -1.26 -4.69 113.70 120.06 1k9z s SER 43 Ca 0.00 1.36 -0.14 0.00 0.48 0.00 0.00 55.95 57.64 1k9z s SER 43 Cb 0.00 -2.42 -0.08 0.00 0.10 0.00 0.00 66.02 63.63 1k9z s SER 43 CO 0.00 -0.48 0.86 -2.16 0.98 0.00 0.00 173.24 172.44 1k9z s PRO 44 N -3.89 3.90 -0.03 4.02 0.04 -1.26 -1.05 135.00 136.73 1k9z s PRO 44 Ca 0.55 0.72 -0.04 0.00 0.04 0.00 0.00 61.00 62.28 1k9z s PRO 44 Cb -0.10 -2.28 0.01 0.00 0.04 0.00 0.00 34.50 32.16 1k9z s PRO 44 CO 0.30 -0.10 0.10 0.54 0.04 0.00 0.00 177.00 177.88 1k9z s VAL 45 N -2.40 0.02 0.33 -0.36 0.11 -0.50 -4.91 120.40 112.69 1k9z s VAL 45 Ca 0.55 -0.16 0.04 0.00 -2.93 0.00 0.00 61.98 59.48 1k9z s VAL 45 Cb -0.10 -0.20 -0.06 0.00 -1.53 0.00 0.00 36.38 34.49 1k9z s VAL 45 CO 0.28 -0.09 0.06 0.42 -3.33 0.00 0.00 175.10 172.45 1k9z s THR 46 N -0.25 1.14 0.34 5.04 -4.23 -1.26 -0.75 115.64 115.68 1k9z s THR 46 Ca -0.03 -2.00 0.11 0.00 -1.18 0.00 0.00 61.69 58.59 1k9z s THR 46 Cb -0.02 -2.76 0.33 0.00 1.34 0.00 0.00 72.50 71.38 1k9z s THR 46 CO 0.00 0.00 1.74 0.74 -0.54 0.00 0.00 174.62 176.57 1k9z h THR 47 N 2.10 0.55 -0.68 3.99 2.02 -1.71 -0.81 112.91 118.36 1k9z h THR 47 Ca -0.40 -0.19 -0.08 0.00 0.77 0.00 0.00 66.41 66.51 1k9z h THR 47 Cb 1.25 -0.05 -0.03 0.00 -1.74 0.00 0.00 68.15 67.58 1k9z h THR 47 CO 0.69 0.10 0.12 1.23 0.37 0.00 0.00 175.52 178.03 1k9z h GLY 48 N 0.55 1.21 0.91 2.16 0.00 -1.95 -0.25 103.07 105.69 1k9z h GLY 48 Ca 0.63 -0.80 -0.01 0.00 0.00 0.00 0.00 47.33 47.15 1k9z h GLY 48 CO -0.42 0.74 0.11 -0.55 0.00 0.00 0.00 176.54 176.41 1k9z h ASP 49 N 1.05 0.35 -0.55 0.19 5.19 -1.52 -0.94 116.42 120.19 1k9z h ASP 49 Ca 0.21 -0.16 -0.10 0.00 -0.62 0.00 0.00 57.03 56.35 1k9z h ASP 49 Cb 0.44 -0.09 -0.02 0.00 0.18 0.00 0.00 39.33 39.84 1k9z h ASP 49 CO 0.01 0.42 -0.06 1.88 -3.12 0.00 0.00 179.24 178.37 1k9z h TYR 50 N 0.27 1.12 -0.50 4.55 0.05 -1.31 -1.40 116.97 119.75 1k9z h TYR 50 Ca 0.09 -0.22 -0.02 0.00 0.05 0.00 0.00 58.73 58.63 1k9z h TYR 50 Cb 0.17 -0.28 -0.02 0.00 1.01 0.00 0.00 36.73 37.60 1k9z h TYR 50 CO -0.01 1.03 0.24 0.00 -1.05 0.00 0.00 178.16 178.37 1k9z h ALA 51 N 0.94 0.64 -0.48 3.88 0.00 -0.90 0.12 119.26 123.47 1k9z h ALA 51 Ca 0.15 -0.12 -0.03 0.00 0.00 0.00 0.00 54.91 54.91 1k9z h ALA 51 Cb 0.62 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.19 1k9z h ALA 51 CO 0.04 0.20 0.19 0.00 0.00 0.00 0.00 179.25 179.69 1k9z h ALA 52 N 1.08 0.62 -0.76 0.00 0.00 -1.08 -0.93 119.26 118.19 1k9z h ALA 52 Ca 0.17 -0.15 -0.03 0.00 0.00 0.00 0.00 54.91 54.90 1k9z h ALA 52 Cb 0.11 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.68 1k9z h ALA 52 CO -0.02 0.23 0.36 0.37 0.00 0.00 0.00 179.25 180.18 1k9z h GLN 53 N 0.63 1.10 0.13 0.00 4.15 -0.91 -1.47 115.11 118.75 1k9z h GLN 53 Ca 0.16 -0.17 -0.00 0.00 0.77 0.00 0.00 58.65 59.41 1k9z h GLN 53 Cb 0.19 -0.20 -0.00 0.00 0.21 0.00 0.00 27.48 27.68 1k9z h GLN 53 CO -0.01 0.86 -0.08 1.15 -1.93 0.00 0.00 178.83 178.82 1k9z h THR 54 N 1.08 0.84 -0.37 2.39 2.02 -0.68 -0.76 112.91 117.44 1k9z h THR 54 Ca 0.26 0.00 0.02 0.00 0.77 0.00 0.00 66.41 67.46 1k9z h THR 54 Cb 0.13 0.84 -0.03 0.00 -1.74 0.00 0.00 68.15 67.35 1k9z h THR 54 CO -0.03 0.00 0.20 0.40 0.37 0.00 0.00 175.52 176.45 1k9z h ILE 55 N -0.20 1.01 -0.02 3.11 2.04 -1.03 -0.37 117.51 122.04 1k9z h ILE 55 Ca -0.01 -0.14 -0.01 0.00 1.00 0.00 0.00 64.86 65.70 1k9z h ILE 55 Cb 0.16 0.57 -0.00 0.00 -0.74 0.00 0.00 36.82 36.81 1k9z h ILE 55 CO 0.02 0.07 -0.02 0.40 0.00 0.00 0.00 178.15 178.62 1k9z h ILE 56 N 0.40 1.39 -0.54 -0.67 2.04 -1.13 -1.40 117.51 117.61 1k9z h ILE 56 Ca 0.15 -1.20 -0.07 0.00 1.00 0.00 0.00 64.86 64.74 1k9z h ILE 56 Cb 0.04 2.16 -0.02 0.00 -0.74 0.00 0.00 36.82 38.26 1k9z h ILE 56 CO -0.09 0.32 0.05 0.40 0.00 0.00 0.00 178.15 178.83 1k9z h ILE 57 N -0.44 1.24 -0.50 -0.67 2.04 -1.15 -0.66 117.51 117.38 1k9z h ILE 57 Ca 0.00 -0.98 -0.04 0.00 1.00 0.00 0.00 64.86 64.85 1k9z h ILE 57 Cb 0.53 0.78 -0.02 0.00 -0.74 0.00 0.00 36.82 37.36 1k9z h ILE 57 CO 0.01 0.35 0.15 -1.13 0.00 0.00 0.00 178.15 177.53 1k9z h ASN 58 N 0.83 0.67 -0.34 1.72 -1.24 -0.97 0.13 115.58 116.38 1k9z h ASN 58 Ca 0.17 -0.10 -0.09 0.00 0.71 0.00 0.00 56.30 56.99 1k9z h ASN 58 Cb 0.42 -0.17 -0.01 0.00 0.73 0.00 0.00 38.32 39.29 1k9z h ASN 58 CO 0.01 0.65 -0.13 0.00 -1.29 0.00 0.00 177.43 176.67 1k9z h ALA 59 N 1.45 0.47 -0.10 1.57 0.00 -0.74 -0.52 119.26 121.39 1k9z h ALA 59 Ca 0.17 -0.32 0.02 0.00 0.00 0.00 0.00 54.91 54.77 1k9z h ALA 59 Cb 0.22 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 1k9z h ALA 59 CO -0.01 0.36 -0.02 0.82 0.00 0.00 0.00 179.25 180.40 1k9z h ILE 60 N 0.46 0.90 -0.10 0.00 2.04 -0.68 -2.75 117.51 117.39 1k9z h ILE 60 Ca 0.08 -0.00 -0.09 0.00 1.00 0.00 0.00 64.86 65.85 1k9z h ILE 60 Cb 0.65 0.90 -0.01 0.00 -0.74 0.00 0.00 36.82 37.62 1k9z h ILE 60 CO 0.04 0.00 -0.36 0.11 0.00 0.00 0.00 178.15 177.94 1k9z h LYS 61 N 0.00 0.20 -0.04 2.37 1.79 -0.86 0.40 116.57 120.42 1k9z h LYS 61 Ca 0.05 -0.08 -0.08 0.00 -2.18 0.00 0.00 60.65 58.36 1k9z h LYS 61 Cb 0.07 -0.01 -0.01 0.00 -1.58 0.00 0.00 32.23 30.70 1k9z h LYS 61 CO -0.10 0.53 -0.34 0.77 -1.08 0.00 0.00 179.45 179.24 1k9z h SER 62 N 0.17 0.08 0.14 0.86 0.02 -0.94 -2.66 113.55 111.21 1k9z h SER 62 Ca 0.02 -0.03 -0.17 0.00 -0.84 0.00 0.00 61.79 60.78 1k9z h SER 62 Cb 0.72 -0.02 -0.03 0.00 0.14 0.00 0.00 62.40 63.21 1k9z h SER 62 CO 0.05 0.41 -2.02 0.59 -1.14 0.00 0.00 176.83 174.72 1k9z n ASN 63 N -4.12 0.16 -3.20 3.07 3.02 -0.92 -4.73 115.26 108.54 1k9z n ASN 63 Ca -0.02 0.07 -0.21 0.00 -0.03 0.00 0.00 54.58 54.39 1k9z n ASN 63 Cb 0.39 1.28 -0.07 0.00 -0.61 0.00 0.00 39.78 40.78 1k9z n ASN 63 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 1k9z n PHE 64 N -2.56 -1.49 0.13 3.10 3.72 0.14 -5.04 117.46 115.47 1k9z n PHE 64 Ca -0.16 -2.92 0.17 0.00 -0.05 0.00 0.00 57.45 54.49 1k9z n PHE 64 Cb 0.84 0.44 0.73 0.00 -0.94 0.00 0.00 39.48 40.54 1k9z n PHE 64 CO 0.00 0.00 0.00 -1.35 -0.05 0.00 0.00 176.76 175.36 1k9z h PRO 65 N 5.09 0.00 -0.01 -1.08 0.11 -1.68 -1.41 132.00 133.01 1k9z h PRO 65 Ca 0.17 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.28 1k9z h PRO 65 Cb 0.95 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.06 1k9z h PRO 65 CO 0.32 0.00 -0.31 -0.25 -0.21 0.00 0.00 178.00 177.56 1k9z n ASP 66 N -4.19 1.49 -4.77 -2.05 8.00 -1.26 -4.95 116.55 108.82 1k9z n ASP 66 Ca 0.04 -1.20 -0.37 0.00 0.71 0.00 0.00 54.79 53.97 1k9z n ASP 66 Cb 0.40 0.24 -0.01 0.00 -0.02 0.00 0.00 41.12 41.73 1k9z n ASP 66 CO 0.00 0.00 0.00 -1.81 -0.39 0.00 0.00 177.20 175.00 1k9z s ASP 67 N -2.44 6.31 0.16 -2.24 1.11 -0.53 -5.01 116.67 114.03 1k9z s ASP 67 Ca 0.23 2.29 -0.15 0.00 0.18 0.00 0.00 52.55 55.11 1k9z s ASP 67 Cb 0.19 -2.60 -0.07 0.00 1.07 0.00 0.00 42.92 41.50 1k9z s ASP 67 CO 0.52 -0.82 0.58 -0.54 1.18 0.00 0.00 175.17 176.09 1k9z s LYS 68 N -2.58 4.02 -0.05 8.23 1.02 -1.26 -4.98 119.74 124.14 1k9z s LYS 68 Ca 0.61 0.55 0.01 0.00 0.02 0.00 0.00 55.97 57.16 1k9z s LYS 68 Cb -0.28 -2.92 0.02 0.00 -0.52 0.00 0.00 37.83 34.13 1k9z s LYS 68 CO 0.35 0.46 -0.04 0.08 -0.92 0.00 0.00 175.35 175.28 1k9z s VAL 69 N -1.47 0.55 -0.50 3.17 1.01 -1.25 -0.95 120.40 120.95 1k9z s VAL 69 Ca 0.39 -0.11 -0.18 0.00 0.00 0.00 0.00 61.98 62.08 1k9z s VAL 69 Cb -0.15 -0.59 0.07 0.00 0.00 0.00 0.00 36.38 35.71 1k9z s VAL 69 CO 0.19 0.24 0.55 -0.69 0.00 0.00 0.00 175.10 175.39 1k9z s VAL 70 N 1.05 5.01 0.03 2.92 1.01 0.64 -1.94 120.40 129.13 1k9z s VAL 70 Ca -0.09 -0.76 0.07 0.00 0.00 0.00 0.00 61.98 61.21 1k9z s VAL 70 Cb -0.14 -4.25 -0.03 0.00 0.00 0.00 0.00 36.38 31.96 1k9z s VAL 70 CO -0.01 -0.75 -0.20 -0.83 0.00 0.00 0.00 175.10 173.31 1k9z s GLY 71 N 2.75 1.51 0.22 4.51 0.00 0.26 -0.64 107.32 115.93 1k9z s GLY 71 Ca 0.11 -1.20 -0.09 0.00 0.00 0.00 0.00 44.72 43.54 1k9z s GLY 71 CO 0.09 -1.08 1.87 -2.09 0.00 0.00 0.00 173.10 171.90 1k9z h GLU 72 N 4.70 1.10 -6.33 2.90 4.81 -1.68 -3.43 114.58 116.66 1k9z h GLU 72 Ca -0.47 -0.09 -0.46 0.00 -0.13 0.00 0.00 59.36 58.21 1k9z h GLU 72 Cb 1.15 -0.24 0.00 0.00 0.63 0.00 0.00 28.75 30.29 1k9z h GLU 72 CO 0.47 0.77 -0.34 -1.21 -0.73 0.00 0.00 179.01 177.97 1k9z s GLU 73 N -6.01 3.35 0.02 1.92 0.41 -1.26 -5.11 118.70 112.02 1k9z s GLU 73 Ca -0.13 -0.70 0.01 0.00 -0.41 0.00 0.00 54.97 53.74 1k9z s GLU 73 Cb 0.16 -2.80 -0.02 0.00 -1.78 0.00 0.00 34.13 29.69 1k9z s GLU 73 CO 0.80 0.24 -0.04 0.45 -0.49 0.00 0.00 175.26 176.21 1k9z s SER 74 N -4.05 0.46 0.00 -0.19 0.15 -1.26 -4.76 113.70 104.05 1k9z s SER 74 Ca 0.39 -0.40 0.28 0.00 0.70 0.00 0.00 55.95 56.91 1k9z s SER 74 Cb -0.09 0.05 0.99 0.00 -1.71 0.00 0.00 66.02 65.25 1k9z s SER 74 CO 0.32 -0.19 1.71 -1.54 1.20 0.00 0.00 173.24 174.74 1k9z n SER 75 N 1.91 0.94 -4.70 5.45 3.41 -1.26 -4.92 113.62 114.44 1k9z n SER 75 Ca -0.21 -0.94 -0.44 0.00 -0.26 0.00 0.00 58.87 57.02 1k9z n SER 75 Cb 0.56 0.04 -0.03 0.00 -0.26 0.00 0.00 64.21 64.53 1k9z n SER 75 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1k9z n SER 76 N -0.56 3.38 0.00 4.04 7.64 -1.26 -1.67 113.62 125.19 1k9z n SER 76 Ca 0.15 1.11 0.00 0.00 1.01 0.00 0.00 58.87 61.14 1k9z n SER 76 Cb 0.32 -1.50 0.00 0.00 -1.01 0.00 0.00 64.21 62.02 1k9z n SER 76 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1k9z n GLY 77 N 2.82 2.97 3.76 0.23 0.00 -1.26 -5.01 105.19 108.69 1k9z n GLY 77 Ca 0.13 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.74 1k9z n GLY 77 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1k9z s LEU 78 N 0.00 4.40 0.69 0.99 1.43 -0.67 -4.99 118.68 120.53 1k9z s LEU 78 Ca 0.00 2.69 -0.11 0.00 -1.03 0.00 0.00 54.13 55.68 1k9z s LEU 78 Cb 0.00 -3.64 0.00 0.00 0.03 0.00 0.00 46.19 42.59 1k9z s LEU 78 CO 0.00 -0.64 1.06 -0.94 0.23 0.00 0.00 176.35 176.07 1k9z s SER 79 N -0.03 5.54 0.30 2.29 1.04 -1.26 -4.87 113.70 116.71 1k9z s SER 79 Ca 0.54 1.41 -0.01 0.00 0.48 0.00 0.00 55.95 58.37 1k9z s SER 79 Cb -0.41 -2.31 0.47 0.00 0.10 0.00 0.00 66.02 63.87 1k9z s SER 79 CO 0.49 -1.32 1.96 0.44 0.98 0.00 0.00 173.24 175.79 1k9z h ASP 80 N -0.63 0.93 -0.71 7.02 5.19 -1.98 -0.38 116.42 125.85 1k9z h ASP 80 Ca -0.45 -0.02 -0.04 0.00 -0.62 0.00 0.00 57.03 55.91 1k9z h ASP 80 Cb 1.22 -0.23 -0.03 0.00 0.18 0.00 0.00 39.33 40.47 1k9z h ASP 80 CO 0.60 0.66 0.29 0.00 -3.12 0.00 0.00 179.24 177.67 1k9z h ALA 81 N 1.49 0.93 -0.37 3.45 0.00 -1.99 0.16 119.26 122.93 1k9z h ALA 81 Ca 0.32 -0.18 -0.09 0.00 0.00 0.00 0.00 54.91 54.95 1k9z h ALA 81 Cb -0.06 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.44 1k9z h ALA 81 CO -0.08 0.55 -0.13 0.35 0.00 0.00 0.00 179.25 179.94 1k9z h PHE 82 N 1.02 0.84 -0.73 0.00 3.57 -1.70 -2.47 116.94 117.47 1k9z h PHE 82 Ca 0.24 -0.19 -0.04 0.00 3.53 0.00 0.00 57.97 61.51 1k9z h PHE 82 Cb 0.21 -0.20 -0.03 0.00 2.79 0.00 0.00 35.95 38.71 1k9z h PHE 82 CO 0.02 0.91 0.30 0.28 -2.23 0.00 0.00 178.31 177.58 1k9z h VAL 83 N 0.54 1.24 -0.21 1.41 2.07 -0.90 -1.54 116.25 118.86 1k9z h VAL 83 Ca 0.09 -0.76 -0.03 0.00 0.82 0.00 0.00 66.70 66.83 1k9z h VAL 83 Cb 0.66 0.36 -0.01 0.00 -1.52 0.00 0.00 31.29 30.78 1k9z h VAL 83 CO 0.04 0.31 0.01 0.77 0.02 0.00 0.00 177.57 178.73 1k9z h SER 84 N 1.05 0.27 -0.39 0.57 4.64 -0.50 -0.97 113.55 118.22 1k9z h SER 84 Ca 0.25 -0.03 -0.11 0.00 -0.47 0.00 0.00 61.79 61.43 1k9z h SER 84 Cb 0.19 -0.07 -0.01 0.00 -0.31 0.00 0.00 62.40 62.20 1k9z h SER 84 CO -0.02 0.32 -0.18 1.23 -0.87 0.00 0.00 176.83 177.31 1k9z h GLY 85 N 0.56 0.88 0.54 -0.77 0.00 -0.92 0.73 103.07 104.09 1k9z h GLY 85 Ca 0.07 -0.79 0.03 0.00 0.00 0.00 0.00 47.33 46.64 1k9z h GLY 85 CO 0.00 0.71 -0.20 -2.22 0.00 0.00 0.00 176.54 174.84 1k9z h ILE 86 N 0.61 0.53 -0.67 2.60 2.04 -0.65 -1.05 117.51 120.93 1k9z h ILE 86 Ca 0.09 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.94 1k9z h ILE 86 Cb 0.73 0.53 -0.03 0.00 -0.74 0.00 0.00 36.82 37.31 1k9z h ILE 86 CO 0.06 0.00 0.37 0.25 0.00 0.00 0.00 178.15 178.82 1k9z h LEU 87 N -0.32 0.83 -0.72 1.44 5.85 -1.05 -1.74 115.31 119.59 1k9z h LEU 87 Ca 0.05 -0.09 -0.02 0.00 0.84 0.00 0.00 57.88 58.66 1k9z h LEU 87 Cb 0.39 -0.21 -0.03 0.00 0.37 0.00 0.00 40.66 41.18 1k9z h LEU 87 CO -0.18 0.68 0.37 -1.13 -0.34 0.00 0.00 178.44 177.84 1k9z h ASN 88 N 0.91 0.92 -0.45 1.25 -1.24 -0.60 -0.32 115.58 116.05 1k9z h ASN 88 Ca 0.23 -0.12 -0.05 0.00 0.71 0.00 0.00 56.30 57.08 1k9z h ASN 88 Cb 0.04 -0.24 -0.02 0.00 0.73 0.00 0.00 38.32 38.83 1k9z h ASN 88 CO -0.04 0.78 0.13 -0.33 -1.29 0.00 0.00 177.43 176.68 1k9z h GLU 89 N 1.00 0.77 -0.46 6.67 4.39 -0.80 -0.32 114.58 125.84 1k9z h GLU 89 Ca 0.25 -0.15 -0.02 0.00 0.34 0.00 0.00 59.36 59.78 1k9z h GLU 89 Cb 0.08 -0.12 -0.02 0.00 -0.10 0.00 0.00 28.75 28.59 1k9z h GLU 89 CO -0.04 0.69 0.20 0.82 -1.16 0.00 0.00 179.01 179.52 1k9z h ILE 90 N 0.75 1.20 -0.07 3.13 2.04 -0.43 -1.14 117.51 122.99 1k9z h ILE 90 Ca 0.17 -0.60 -0.17 0.00 1.00 0.00 0.00 64.86 65.26 1k9z h ILE 90 Cb 0.26 0.74 -0.01 0.00 -0.74 0.00 0.00 36.82 37.08 1k9z h ILE 90 CO -0.00 0.22 -0.68 0.11 0.00 0.00 0.00 178.15 177.80 1k9z h LYS 91 N 0.60 0.32 -0.60 2.37 1.79 -0.75 -0.72 116.57 119.57 1k9z h LYS 91 Ca 0.15 -0.25 -0.03 0.00 -2.18 0.00 0.00 60.65 58.35 1k9z h LYS 91 Cb 0.17 0.05 -0.03 0.00 -1.58 0.00 0.00 32.23 30.84 1k9z h LYS 91 CO -0.01 0.88 0.28 0.00 -1.08 0.00 0.00 179.45 179.51 1k9z h ALA 92 N 1.05 0.78 -0.79 3.86 0.00 -0.94 -2.41 119.26 120.82 1k9z h ALA 92 Ca -0.02 -0.14 -0.04 0.00 0.00 0.00 0.00 54.91 54.71 1k9z h ALA 92 Cb 1.23 -0.24 -0.04 0.00 0.00 0.00 0.00 17.79 18.74 1k9z h ALA 92 CO 0.11 0.35 0.35 -0.97 0.00 0.00 0.00 179.25 179.10 1k9z h ASN 93 N 0.82 1.05 -0.75 0.00 -1.24 -0.91 -2.70 115.58 111.86 1k9z h ASN 93 Ca 0.20 -0.15 0.07 0.00 0.71 0.00 0.00 56.30 57.13 1k9z h ASN 93 Cb 0.14 -0.27 -0.05 0.00 0.73 0.00 0.00 38.32 38.87 1k9z h ASN 93 CO -0.02 0.91 0.49 0.44 -1.29 0.00 0.00 177.43 177.96 1k9z h ASP 94 N 1.12 0.68 0.03 1.15 3.32 -0.80 0.18 116.42 122.09 1k9z h ASP 94 Ca 0.27 0.01 -0.13 0.00 0.02 0.00 0.00 57.03 57.19 1k9z h ASP 94 Cb 0.16 -0.14 -0.01 0.00 0.22 0.00 0.00 39.33 39.56 1k9z h ASP 94 CO -0.03 0.43 -0.44 -0.08 -1.72 0.00 0.00 179.24 177.41 1k9z h GLU 95 N 0.77 0.50 -0.01 3.56 4.22 -1.11 -0.26 114.58 122.24 1k9z h GLU 95 Ca 0.33 -0.27 -0.11 0.00 0.08 0.00 0.00 59.36 59.39 1k9z h GLU 95 Cb 0.29 0.01 0.01 0.00 0.50 0.00 0.00 28.75 29.56 1k9z h GLU 95 CO -0.11 0.84 -0.44 0.28 -2.18 0.00 0.00 179.01 177.40 1k9z h VAL 96 N 0.41 1.47 -0.27 0.32 2.07 -1.26 -3.25 116.25 115.74 1k9z h VAL 96 Ca 0.03 -1.99 -0.02 0.00 0.82 0.00 0.00 66.70 65.55 1k9z h VAL 96 Cb 0.93 2.62 -0.01 0.00 -1.52 0.00 0.00 31.29 33.31 1k9z h VAL 96 CO 0.08 0.57 0.11 0.22 0.02 0.00 0.00 177.57 178.56 1k9z h TYR 97 N -0.25 0.41 -0.00 1.57 5.03 -0.53 -2.79 116.97 120.40 1k9z h TYR 97 Ca -0.05 -0.03 -0.09 0.00 2.58 0.00 0.00 58.73 61.14 1k9z h TYR 97 Cb 1.16 -0.12 -0.01 0.00 1.55 0.00 0.00 36.73 39.31 1k9z h TYR 97 CO 0.16 0.41 -0.43 -0.91 -1.32 0.00 0.00 178.16 176.07 1k9z h ASN 98 N 0.28 0.00 -0.59 -2.11 4.21 -1.19 0.28 115.58 116.47 1k9z h ASN 98 Ca 0.09 -0.00 -0.07 0.00 1.21 0.00 0.00 56.30 57.52 1k9z h ASN 98 Cb 0.18 -0.00 -0.02 0.00 -1.12 0.00 0.00 38.32 37.36 1k9z h ASN 98 CO -0.01 0.43 0.08 0.11 -1.29 0.00 0.00 177.43 176.75 1k9z h LYS 99 N 0.00 0.99 0.00 0.81 1.57 -1.55 -3.37 116.57 115.02 1k9z h LYS 99 Ca -0.00 -0.28 -0.21 0.00 -1.87 0.00 0.00 60.65 58.29 1k9z h LYS 99 Cb 0.76 -0.11 -0.04 0.00 0.08 0.00 0.00 32.23 32.92 1k9z h LYS 99 CO 0.06 0.95 -1.80 0.09 -0.57 0.00 0.00 179.45 178.18 1k9z n ASN 100 N -4.29 2.49 -0.01 0.86 3.02 -1.00 -4.82 115.26 111.51 1k9z n ASN 100 Ca 0.03 -0.03 0.00 0.00 -0.03 0.00 0.00 54.58 54.55 1k9z n ASN 100 Cb 0.29 0.36 0.00 0.00 -0.61 0.00 0.00 39.78 39.82 1k9z n ASN 100 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 1k9z n TYR 101 N -2.63 0.00 -1.65 3.10 4.01 0.96 -5.09 117.16 115.86 1k9z n TYR 101 Ca -0.21 -0.26 -0.47 0.00 -0.16 0.00 0.00 57.90 56.79 1k9z n TYR 101 Cb 0.83 -0.03 -0.05 0.00 -0.31 0.00 0.00 39.34 39.78 1k9z n TYR 101 CO 0.00 0.00 0.00 1.17 -0.46 0.00 0.00 176.86 177.57 1k9z n LYS 102 N -0.27 1.94 -3.35 -0.72 4.81 -1.12 -4.96 118.16 114.49 1k9z n LYS 102 Ca 0.00 0.70 -0.39 0.00 -0.87 0.00 0.00 58.31 57.75 1k9z n LYS 102 Cb 0.39 -2.45 -0.08 0.00 0.02 0.00 0.00 35.03 32.91 1k9z n LYS 102 CO 0.00 0.00 0.00 0.21 1.17 0.00 0.00 177.40 178.78 1k9z s LYS 103 N 1.06 4.05 0.46 1.64 2.47 -1.26 -5.06 119.74 123.11 1k9z s LYS 103 Ca 0.81 0.13 -0.24 0.00 -1.56 0.00 0.00 55.97 55.11 1k9z s LYS 103 Cb -0.74 -3.64 -0.07 0.00 -1.46 0.00 0.00 37.83 31.92 1k9z s LYS 103 CO 0.41 -0.26 1.37 0.34 0.16 0.00 0.00 175.35 177.37 1k9z s ASP 104 N 1.53 5.83 -1.40 1.43 2.15 -1.26 -3.30 116.67 121.65 1k9z s ASP 104 Ca 0.17 2.80 -0.08 0.00 0.43 0.00 0.00 52.55 55.87 1k9z s ASP 104 Cb -0.16 -2.64 0.04 0.00 -0.30 0.00 0.00 42.92 39.86 1k9z s ASP 104 CO 0.09 -1.19 1.00 -0.67 -0.17 0.00 0.00 175.17 174.23 1k9z n ASP 105 N -0.34 -4.36 -3.80 -0.34 2.03 -1.26 -5.00 116.55 103.48 1k9z n ASP 105 Ca 0.06 -0.69 -0.15 0.00 0.52 0.00 0.00 54.79 54.52 1k9z n ASP 105 Cb 0.43 -4.41 -0.16 0.00 -0.72 0.00 0.00 41.12 36.26 1k9z n ASP 105 CO 0.00 0.00 0.00 0.12 -1.92 0.00 0.00 177.20 175.40 1k9z s PHE 106 N -3.38 0.13 -0.16 -0.67 5.36 -1.21 -5.15 117.98 112.90 1k9z s PHE 106 Ca 0.45 0.07 -0.03 0.00 -0.96 0.00 0.00 56.93 56.46 1k9z s PHE 106 Cb -0.21 -0.27 -0.02 0.00 -0.34 0.00 0.00 43.02 42.17 1k9z s PHE 106 CO 0.78 -0.09 -0.05 -0.51 -1.46 0.00 0.00 175.22 173.89 1k9z s LEU 107 N 0.89 3.13 0.11 6.12 1.43 -1.26 -4.92 118.68 124.19 1k9z s LEU 107 Ca -0.08 -0.19 0.22 0.00 -1.03 0.00 0.00 54.13 53.06 1k9z s LEU 107 Cb -0.11 -1.75 -0.12 0.00 0.03 0.00 0.00 46.19 44.23 1k9z s LEU 107 CO -0.02 0.15 0.83 0.49 0.23 0.00 0.00 176.35 178.03 1k9z n PHE 108 N 3.65 0.59 -3.84 0.29 3.72 -1.26 -4.79 117.46 115.83 1k9z n PHE 108 Ca -0.18 0.17 -0.09 0.00 -0.05 0.00 0.00 57.45 57.30 1k9z n PHE 108 Cb 0.52 -0.77 -0.07 0.00 -0.94 0.00 0.00 39.48 38.22 1k9z n PHE 108 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 176.76 177.66 1k9z s THR 109 N -3.42 0.11 0.05 4.37 -4.23 -1.26 -3.49 115.64 107.77 1k9z s THR 109 Ca -0.03 -1.10 -0.01 0.00 -1.18 0.00 0.00 61.69 59.36 1k9z s THR 109 Cb 0.11 -1.44 0.00 0.00 1.34 0.00 0.00 72.50 72.51 1k9z s THR 109 CO 0.83 -0.48 0.09 -0.46 -0.54 0.00 0.00 174.62 174.06 1k9z n ASN 110 N -0.14 -0.25 -0.19 3.99 0.23 -0.86 -4.99 115.26 113.06 1k9z n ASN 110 Ca -0.13 -1.24 -0.00 0.00 -0.53 0.00 0.00 54.58 52.67 1k9z n ASN 110 Cb 0.63 0.43 0.09 0.00 -2.08 0.00 0.00 39.78 38.86 1k9z n ASN 110 CO 0.00 0.00 0.00 0.44 -0.93 0.00 0.00 177.26 176.77 1k9z h ASP 111 N 0.28 -0.11 0.03 0.53 3.32 -1.98 -1.67 116.42 116.82 1k9z h ASP 111 Ca -0.04 0.12 -0.18 0.00 0.02 0.00 0.00 57.03 56.95 1k9z h ASP 111 Cb 0.17 0.19 -0.00 0.00 0.22 0.00 0.00 39.33 39.90 1k9z h ASP 111 CO 0.05 -0.04 -0.62 -0.61 -1.72 0.00 0.00 179.24 176.31 1k9z h GLN 112 N 0.19 0.58 -2.44 3.56 4.15 -1.99 -3.37 115.11 115.79 1k9z h GLN 112 Ca 0.30 -0.40 -0.60 0.00 0.77 0.00 0.00 58.65 58.72 1k9z h GLN 112 Cb 0.45 0.06 -0.41 0.00 0.21 0.00 0.00 27.48 27.80 1k9z h GLN 112 CO -0.43 1.02 -0.76 1.19 -1.93 0.00 0.00 178.83 177.92 1k9z n PHE 113 N -3.93 1.87 0.78 3.99 3.72 -1.04 -4.96 117.46 117.88 1k9z n PHE 113 Ca -0.04 -3.92 0.13 0.00 -0.05 0.00 0.00 57.45 53.57 1k9z n PHE 113 Cb 0.65 -0.38 0.42 0.00 -0.94 0.00 0.00 39.48 39.23 1k9z n PHE 113 CO 0.00 0.00 0.00 -0.35 -0.05 0.00 0.00 176.76 176.36 1k9z n PRO 114 N 1.64 0.15 -3.56 -1.08 -0.04 -0.66 -2.02 135.00 129.44 1k9z n PRO 114 Ca 0.25 0.10 -0.27 0.00 -0.04 0.00 0.00 63.50 63.54 1k9z n PRO 114 Cb 0.43 -1.65 0.05 0.00 -0.04 0.00 0.00 33.50 32.29 1k9z n PRO 114 CO 0.00 0.00 0.00 -0.11 -0.04 0.00 0.00 175.50 175.35 1k9z n LEU 115 N -1.90 -3.63 -0.01 1.53 7.94 -1.26 -4.82 117.00 114.84 1k9z n LEU 115 Ca 0.06 -0.93 -0.01 0.00 -1.11 0.00 0.00 56.01 54.02 1k9z n LEU 115 Cb 0.39 -2.63 -0.01 0.00 0.53 0.00 0.00 43.42 41.70 1k9z n LEU 115 CO 0.31 0.37 -0.56 0.29 -1.11 0.00 0.00 177.39 176.68 1k9z n LYS 116 N -3.92 3.31 -4.39 1.96 5.02 -1.26 -5.04 118.16 113.84 1k9z n LYS 116 Ca -0.09 0.00 -0.25 0.00 -2.02 0.00 0.00 58.31 55.95 1k9z n LYS 116 Cb 0.60 -1.05 -0.09 0.00 -0.02 0.00 0.00 35.03 34.47 1k9z n LYS 116 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 1k9z s SER 117 N -3.34 4.08 0.30 4.39 1.04 -1.26 -5.02 113.70 113.89 1k9z s SER 117 Ca -0.01 -1.08 -0.02 0.00 0.48 0.00 0.00 55.95 55.32 1k9z s SER 117 Cb 0.01 -0.48 0.45 0.00 0.10 0.00 0.00 66.02 66.10 1k9z s SER 117 CO 0.08 -0.29 1.97 -0.07 0.98 0.00 0.00 173.24 175.91 1k9z h LEU 118 N 1.81 0.94 -0.84 2.42 3.38 -1.98 -2.15 115.31 118.88 1k9z h LEU 118 Ca -0.43 -0.02 -0.09 0.00 0.09 0.00 0.00 57.88 57.43 1k9z h LEU 118 Cb 1.25 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 41.75 1k9z h LEU 118 CO 0.69 0.68 -0.13 -0.33 0.09 0.00 0.00 178.44 179.44 1k9z h GLU 119 N 1.11 0.72 -0.40 1.13 4.39 -1.99 -2.05 114.58 117.48 1k9z h GLU 119 Ca 0.31 -0.24 0.02 0.00 0.34 0.00 0.00 59.36 59.79 1k9z h GLU 119 Cb -0.11 -0.06 -0.03 0.00 -0.10 0.00 0.00 28.75 28.45 1k9z h GLU 119 CO -0.07 0.82 0.22 -0.44 -1.16 0.00 0.00 179.01 178.39 1k9z h ASP 120 N 0.65 0.35 -0.27 1.42 3.32 -1.81 -0.96 116.42 119.13 1k9z h ASP 120 Ca 0.11 0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.17 1k9z h ASP 120 Cb 0.60 -0.06 -0.01 0.00 0.22 0.00 0.00 39.33 40.07 1k9z h ASP 120 CO 0.04 0.25 0.17 0.58 -1.72 0.00 0.00 179.24 178.56 1k9z h VAL 121 N 0.45 1.09 -0.28 -1.35 2.07 -1.00 0.96 116.25 118.19 1k9z h VAL 121 Ca 0.16 -0.19 0.00 0.00 0.82 0.00 0.00 66.70 67.50 1k9z h VAL 121 Cb 0.03 0.74 -0.01 0.00 -1.52 0.00 0.00 31.29 30.53 1k9z h VAL 121 CO -0.09 0.08 0.19 0.03 0.02 0.00 0.00 177.57 177.80 1k9z h ARG 122 N 0.34 0.37 -0.27 1.57 3.08 -1.23 -1.08 114.38 117.16 1k9z h ARG 122 Ca 0.10 -0.02 0.01 0.00 0.07 0.00 0.00 59.98 60.13 1k9z h ARG 122 Cb -0.01 -0.08 -0.02 0.00 0.08 0.00 0.00 29.97 29.94 1k9z h ARG 122 CO -0.02 0.25 0.16 0.37 -1.07 0.00 0.00 179.97 179.66 1k9z h GLN 123 N 0.38 0.33 -0.33 0.04 4.15 -0.76 -2.07 115.11 116.85 1k9z h GLN 123 Ca 0.10 -0.02 -0.03 0.00 0.77 0.00 0.00 58.65 59.48 1k9z h GLN 123 Cb -0.04 -0.07 -0.01 0.00 0.21 0.00 0.00 27.48 27.56 1k9z h GLN 123 CO -0.02 0.22 0.09 0.82 -1.93 0.00 0.00 178.83 178.00 1k9z h ILE 124 N 0.34 1.21 -0.79 2.39 1.08 -0.51 -2.36 117.51 118.87 1k9z h ILE 124 Ca 0.11 -0.69 0.10 0.00 -0.39 0.00 0.00 64.86 63.99 1k9z h ILE 124 Cb -0.01 1.05 -0.08 0.00 -3.07 0.00 0.00 36.82 34.71 1k9z h ILE 124 CO -0.04 0.23 0.42 0.40 -0.69 0.00 0.00 178.15 178.47 1k9z h ILE 125 N 0.37 0.85 0.00 -0.67 2.04 -1.08 -2.41 117.51 116.60 1k9z h ILE 125 Ca 0.10 -0.24 0.00 0.00 1.00 0.00 0.00 64.86 65.73 1k9z h ILE 125 Cb 0.27 0.10 0.00 0.00 -0.74 0.00 0.00 36.82 36.45 1k9z h ILE 125 CO -0.00 0.13 0.00 0.47 0.00 0.00 0.00 178.15 178.74 1k9z n ASP 126 N -4.81 0.00 0.00 1.72 8.00 -0.79 -1.71 116.55 118.95 1k9z n ASP 126 Ca 0.13 0.47 0.05 0.00 0.71 0.00 0.00 54.79 56.15 1k9z n ASP 126 Cb 0.31 -0.49 0.23 0.00 -0.02 0.00 0.00 41.12 41.15 1k9z n ASP 126 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 1k9z n PHE 127 N -1.49 0.00 1.11 1.24 3.72 -0.91 -2.63 117.46 118.51 1k9z n PHE 127 Ca 0.06 0.00 0.01 0.00 -0.05 0.00 0.00 57.45 57.47 1k9z n PHE 127 Cb 0.27 -0.44 0.06 0.00 -0.94 0.00 0.00 39.48 38.43 1k9z n PHE 127 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1k9z n GLY 128 N -0.43 0.79 1.19 1.37 0.00 -0.70 -3.87 105.19 103.54 1k9z n GLY 128 Ca 0.03 -0.13 0.05 0.00 0.00 0.00 0.00 46.02 45.97 1k9z n GLY 128 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1k9z n ASN 129 N -0.02 3.41 -4.77 1.61 6.94 -1.08 -0.58 115.26 120.77 1k9z n ASN 129 Ca 0.04 -2.42 -0.35 0.00 -0.02 0.00 0.00 54.58 51.83 1k9z n ASN 129 Cb 0.27 -0.54 0.01 0.00 -2.36 0.00 0.00 39.78 37.16 1k9z n ASN 129 CO 0.00 0.00 0.00 -0.47 -1.03 0.00 0.00 177.26 175.76 1k9z s TYR 130 N -1.89 2.67 -2.47 -2.53 5.04 -0.82 -4.94 117.35 112.41 1k9z s TYR 130 Ca 0.31 1.54 0.27 0.00 -2.44 0.00 0.00 57.07 56.75 1k9z s TYR 130 Cb 0.22 -3.28 0.80 0.00 0.35 0.00 0.00 41.96 40.06 1k9z s TYR 130 CO 0.11 -1.58 1.60 -0.85 -1.34 0.00 0.00 175.55 173.49 1k9z n GLU 131 N -1.42 1.66 0.00 4.97 0.00 -1.26 -4.56 120.64 120.03 1k9z n GLU 131 Ca 0.11 -1.08 0.00 0.00 0.00 0.00 0.00 57.16 56.19 1k9z n GLU 131 Cb 0.51 -1.48 0.00 0.00 0.00 0.00 0.00 31.44 30.47 1k9z n GLU 131 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1k9z n GLY 132 N 1.24 0.44 0.00 -1.84 0.00 -1.26 -2.82 105.19 100.95 1k9z n GLY 132 Ca 0.17 -0.82 0.00 0.00 0.00 0.00 0.00 46.02 45.36 1k9z n GLY 132 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1k9z n GLY 133 N 0.00 0.30 0.09 -0.02 0.00 -1.26 -4.77 105.19 99.53 1k9z n GLY 133 Ca 0.00 -2.26 -0.12 0.00 0.00 0.00 0.00 46.02 43.63 1k9z n GLY 133 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1k9z h ARG 134 N 8.75 0.17 -6.61 1.61 9.65 -1.82 -3.37 114.38 122.76 1k9z h ARG 134 Ca 0.00 -0.28 -0.68 0.00 -1.10 0.00 0.00 59.98 57.92 1k9z h ARG 134 Cb 0.00 0.10 -0.19 0.00 -1.39 0.00 0.00 29.97 28.49 1k9z h ARG 134 CO 0.00 1.12 -0.78 0.15 2.80 0.00 0.00 179.97 183.26 1k9z s LYS 135 N -2.73 1.99 0.19 0.20 3.01 -1.26 -3.07 119.74 118.08 1k9z s LYS 135 Ca -0.02 -1.06 0.00 0.00 -1.01 0.00 0.00 55.97 53.88 1k9z s LYS 135 Cb 0.08 -2.20 0.00 0.00 -1.01 0.00 0.00 37.83 34.70 1k9z s LYS 135 CO 0.86 0.51 0.00 0.41 0.51 0.00 0.00 175.35 177.64 1k9z n GLY 136 N 1.06 -2.70 3.74 -3.33 0.00 -1.26 -4.69 105.19 98.01 1k9z n GLY 136 Ca -0.15 -1.71 -0.35 0.00 0.00 0.00 0.00 46.02 43.80 1k9z n GLY 136 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1k9z s ARG 137 N -0.71 3.64 0.04 1.61 3.52 -1.26 -0.98 118.95 124.80 1k9z s ARG 137 Ca 0.00 -0.26 -0.24 0.00 -0.13 0.00 0.00 55.73 55.10 1k9z s ARG 137 Cb 0.00 -3.16 0.06 0.00 -1.56 0.00 0.00 34.95 30.29 1k9z s ARG 137 CO 0.00 0.53 0.55 -0.59 -0.81 0.00 0.00 175.30 174.99 1k9z s PHE 138 N -0.36 -0.47 0.37 5.12 -0.71 -0.19 -4.51 117.98 117.23 1k9z s PHE 138 Ca 0.10 0.58 -0.07 0.00 -1.04 0.00 0.00 56.93 56.50 1k9z s PHE 138 Cb -0.12 0.37 -0.05 0.00 -1.21 0.00 0.00 43.02 42.01 1k9z s PHE 138 CO 0.02 -0.65 0.68 -1.58 -1.34 0.00 0.00 175.22 172.35 1k9z s TRP 139 N -2.28 3.49 -0.05 3.49 0.52 -0.12 -0.60 118.94 123.39 1k9z s TRP 139 Ca -0.06 0.82 -0.01 0.00 0.02 0.00 0.00 56.10 56.87 1k9z s TRP 139 Cb -0.01 -2.27 0.03 0.00 -1.15 0.00 0.00 33.47 30.08 1k9z s TRP 139 CO -0.00 -0.02 0.02 0.00 0.02 0.00 0.00 176.95 176.97 1k9z s LEU 141 N 1.83 1.05 -0.34 0.00 2.96 0.19 -0.76 118.68 123.60 1k9z s LEU 141 Ca 0.02 -0.10 -0.01 0.00 -0.22 0.00 0.00 54.13 53.82 1k9z s LEU 141 Cb -0.12 -0.41 0.08 0.00 0.50 0.00 0.00 46.19 46.23 1k9z s LEU 141 CO -0.04 -0.11 0.07 -0.62 -1.32 0.00 0.00 176.35 174.34 1k9z s ASP 142 N 1.30 4.99 0.19 3.68 -1.08 -0.27 -2.00 116.67 123.48 1k9z s ASP 142 Ca -0.05 -1.65 -0.07 0.00 -0.52 0.00 0.00 52.55 50.25 1k9z s ASP 142 Cb -0.13 -1.74 0.11 0.00 -1.46 0.00 0.00 42.92 39.70 1k9z s ASP 142 CO -0.02 -0.37 1.63 1.55 0.52 0.00 0.00 175.17 178.48 1k9z h PRO 143 N 7.96 0.97 -3.94 4.34 0.13 -1.86 -0.96 132.00 138.64 1k9z h PRO 143 Ca -0.16 -0.34 -0.59 0.00 -0.87 0.00 0.00 66.00 64.04 1k9z h PRO 143 Cb 1.05 -0.07 -0.39 0.00 0.13 0.00 0.00 31.00 31.72 1k9z h PRO 143 CO 0.59 1.01 -0.76 0.42 -0.23 0.00 0.00 178.00 179.02 1k9z s ILE 144 N -4.85 1.16 -0.17 -3.56 1.01 -1.26 -4.39 121.20 109.15 1k9z s ILE 144 Ca -0.11 -1.26 -0.24 0.00 0.00 0.00 0.00 60.65 59.04 1k9z s ILE 144 Cb 0.13 -1.68 -0.02 0.00 0.01 0.00 0.00 42.46 40.90 1k9z s ILE 144 CO 0.85 -0.38 0.77 -0.62 0.00 0.00 0.00 174.94 175.57 1k9z s ASP 145 N 1.52 6.89 0.00 3.58 2.15 0.16 -4.00 116.67 126.98 1k9z s ASP 145 Ca 0.02 1.09 0.00 0.00 0.43 0.00 0.00 52.55 54.09 1k9z s ASP 145 Cb -0.18 -2.42 0.00 0.00 -0.30 0.00 0.00 42.92 40.02 1k9z s ASP 145 CO -0.13 -0.34 0.00 0.61 -0.17 0.00 0.00 175.17 175.14 1k9z n GLY 146 N 3.51 0.85 0.35 2.66 0.00 -1.26 -1.10 105.19 110.20 1k9z n GLY 146 Ca 0.02 -0.23 0.10 0.00 0.00 0.00 0.00 46.02 45.91 1k9z n GLY 146 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1k9z h THR 147 N 0.00 0.94 -0.41 2.61 2.02 -1.92 0.11 112.91 116.26 1k9z h THR 147 Ca 0.00 -0.19 -0.06 0.00 0.77 0.00 0.00 66.41 66.93 1k9z h THR 147 Cb 0.37 0.34 -0.02 0.00 -1.74 0.00 0.00 68.15 67.11 1k9z h THR 147 CO 0.00 0.10 0.03 0.11 0.37 0.00 0.00 175.52 176.13 1k9z h LYS 148 N 0.55 0.71 -0.52 6.66 1.57 -1.94 -0.49 116.57 123.10 1k9z h LYS 148 Ca 0.30 -0.21 0.03 0.00 -1.87 0.00 0.00 60.65 58.90 1k9z h LYS 148 Cb 0.44 -0.07 -0.04 0.00 0.08 0.00 0.00 32.23 32.64 1k9z h LYS 148 CO -0.09 0.77 0.30 0.78 -0.57 0.00 0.00 179.45 180.63 1k9z h GLY 149 N 0.55 0.73 0.08 3.86 0.00 -1.52 -1.17 103.07 105.60 1k9z h GLY 149 Ca 0.12 -0.22 0.11 0.00 0.00 0.00 0.00 47.33 47.35 1k9z h GLY 149 CO 0.01 0.17 0.02 -2.75 0.00 0.00 0.00 176.54 174.00 1k9z h PHE 150 N 0.59 -0.00 0.00 5.60 3.57 -0.77 0.14 116.94 126.07 1k9z h PHE 150 Ca 0.21 0.04 0.00 0.00 3.53 0.00 0.00 57.97 61.75 1k9z h PHE 150 Cb 0.05 0.09 0.00 0.00 2.79 0.00 0.00 35.95 38.88 1k9z h PHE 150 CO -0.07 -0.12 0.00 -0.07 -2.23 0.00 0.00 178.31 175.81 1k9z h LEU 151 N 0.14 0.00 -0.87 0.59 3.38 -0.67 -1.98 115.31 115.89 1k9z h LEU 151 Ca 0.29 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.26 1k9z h LEU 151 Cb 0.45 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.20 1k9z h LEU 151 CO -0.46 0.00 0.00 0.54 0.09 0.00 0.00 178.44 178.61 1k9z n ARG 152 N -2.36 1.60 -1.67 1.13 1.74 -0.48 -4.88 116.66 111.74 1k9z n ARG 152 Ca 0.04 -0.87 -0.08 0.00 -0.77 0.00 0.00 57.85 56.16 1k9z n ARG 152 Cb 0.34 -1.48 -0.02 0.00 -1.02 0.00 0.00 32.46 30.28 1k9z n ARG 152 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1k9z n GLY 153 N 1.16 0.54 0.00 -0.13 0.00 -0.74 -5.03 105.19 100.98 1k9z n GLY 153 Ca 0.19 -0.62 0.00 0.00 0.00 0.00 0.00 46.02 45.59 1k9z n GLY 153 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1k9z n GLU 154 N -2.29 3.83 -2.43 1.61 1.02 -0.05 -5.02 120.64 117.32 1k9z n GLU 154 Ca -0.09 0.00 -0.37 0.00 -0.02 0.00 0.00 57.16 56.69 1k9z n GLU 154 Cb 0.41 0.00 -0.03 0.00 -0.02 0.00 0.00 31.44 31.80 1k9z n GLU 154 CO 0.00 0.00 0.00 -0.65 1.18 0.00 0.00 177.13 177.66 1k9z s GLN 155 N 2.41 4.01 0.27 3.49 -1.52 -1.26 -4.49 119.66 122.58 1k9z s GLN 155 Ca 0.00 1.62 -0.15 0.00 -1.95 0.00 0.00 55.36 54.88 1k9z s GLN 155 Cb 0.00 -2.50 0.01 0.00 -0.22 0.00 0.00 33.01 30.30 1k9z s GLN 155 CO 0.00 -0.30 0.58 -0.59 -0.25 0.00 0.00 175.29 174.73 1k9z s PHE 156 N -1.61 0.18 0.02 0.91 -0.71 -1.26 -3.93 117.98 111.58 1k9z s PHE 156 Ca 0.60 -0.59 -0.04 0.00 -1.04 0.00 0.00 56.93 55.86 1k9z s PHE 156 Cb -0.25 0.40 -0.01 0.00 -1.21 0.00 0.00 43.02 41.95 1k9z s PHE 156 CO 0.31 -1.12 0.05 0.00 -1.34 0.00 0.00 175.22 173.12 1k9z s ALA 157 N -3.85 -0.03 -0.27 1.99 0.00 -0.26 -4.22 121.76 115.11 1k9z s ALA 157 Ca 0.18 -0.49 -0.08 0.00 0.00 0.00 0.00 51.96 51.57 1k9z s ALA 157 Cb -0.03 0.17 -0.02 0.00 0.00 0.00 0.00 23.12 23.24 1k9z s ALA 157 CO 0.09 -0.23 0.10 0.08 0.00 0.00 0.00 175.76 175.80 1k9z s VAL 158 N -1.89 4.43 -0.12 0.00 1.01 0.38 0.38 120.40 124.59 1k9z s VAL 158 Ca -0.11 -0.27 0.00 0.00 0.00 0.00 0.00 61.98 61.60 1k9z s VAL 158 Cb -0.06 -3.15 0.02 0.00 0.00 0.00 0.00 36.38 33.19 1k9z s VAL 158 CO -0.02 0.23 -0.11 0.00 0.00 0.00 0.00 175.10 175.20 1k9z s LEU 160 N 1.52 1.89 0.05 0.00 2.96 -0.33 -1.11 118.68 123.67 1k9z s LEU 160 Ca 0.03 -0.20 -0.01 0.00 -0.22 0.00 0.00 54.13 53.73 1k9z s LEU 160 Cb -0.13 -0.56 -0.04 0.00 0.50 0.00 0.00 46.19 45.96 1k9z s LEU 160 CO -0.08 0.10 -0.02 0.00 -1.32 0.00 0.00 176.35 175.03 1k9z s ALA 161 N 0.00 0.47 -0.13 5.97 0.00 0.06 -0.62 121.76 127.51 1k9z s ALA 161 Ca -0.00 -1.18 0.02 0.00 0.00 0.00 0.00 51.96 50.80 1k9z s ALA 161 Cb -0.07 0.28 0.01 0.00 0.00 0.00 0.00 23.12 23.35 1k9z s ALA 161 CO 0.00 -0.38 -0.21 -1.17 0.00 0.00 0.00 175.76 174.01 1k9z s LEU 162 N -2.92 2.03 -0.09 0.00 2.96 -0.21 -0.49 118.68 119.96 1k9z s LEU 162 Ca 0.07 -0.57 -0.00 0.00 -0.22 0.00 0.00 54.13 53.41 1k9z s LEU 162 Cb 0.08 -1.37 -0.03 0.00 0.50 0.00 0.00 46.19 45.37 1k9z s LEU 162 CO -0.10 0.07 -0.06 -0.63 -1.32 0.00 0.00 176.35 174.31 1k9z s ILE 163 N 0.81 3.73 -0.08 6.68 1.01 0.24 -0.57 121.20 133.02 1k9z s ILE 163 Ca -0.08 -0.45 -0.01 0.00 0.00 0.00 0.00 60.65 60.11 1k9z s ILE 163 Cb -0.16 -2.55 0.03 0.00 0.01 0.00 0.00 42.46 39.79 1k9z s ILE 163 CO -0.01 0.57 -0.03 -0.69 0.00 0.00 0.00 174.94 174.78 1k9z s VAL 164 N -0.49 0.60 -1.48 2.92 1.01 -0.16 -1.02 120.40 121.78 1k9z s VAL 164 Ca 0.07 -0.04 -0.09 0.00 0.00 0.00 0.00 61.98 61.92 1k9z s VAL 164 Cb -0.12 -0.69 0.06 0.00 0.00 0.00 0.00 36.38 35.63 1k9z s VAL 164 CO 0.02 0.29 0.81 0.47 0.00 0.00 0.00 175.10 176.69 1k9z n ASP 165 N 4.88 -3.06 0.00 3.32 8.00 -0.15 -1.85 116.55 127.68 1k9z n ASP 165 Ca -0.12 -0.85 0.00 0.00 0.71 0.00 0.00 54.79 54.53 1k9z n ASP 165 Cb 0.50 -3.68 0.00 0.00 -0.02 0.00 0.00 41.12 37.92 1k9z n ASP 165 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1k9z n GLY 166 N -1.67 0.86 3.26 0.44 0.00 -1.17 -4.84 105.19 102.06 1k9z n GLY 166 Ca -0.09 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.61 1k9z n GLY 166 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1k9z s VAL 167 N -3.42 2.10 -0.26 1.61 1.01 -0.77 -3.05 120.40 117.63 1k9z s VAL 167 Ca 0.00 -1.04 -0.29 0.00 0.00 0.00 0.00 61.98 60.65 1k9z s VAL 167 Cb 0.00 -1.77 -0.01 0.00 0.00 0.00 0.00 36.38 34.60 1k9z s VAL 167 CO 0.00 0.57 1.38 -0.69 0.00 0.00 0.00 175.10 176.36 1k9z s VAL 168 N -0.01 4.04 -0.09 2.92 1.01 -1.26 -0.99 120.40 126.02 1k9z s VAL 168 Ca -0.08 1.18 0.22 0.00 0.00 0.00 0.00 61.98 63.30 1k9z s VAL 168 Cb -0.15 -4.01 -0.25 0.00 0.00 0.00 0.00 36.38 31.98 1k9z s VAL 168 CO 0.05 -0.37 0.61 0.00 0.00 0.00 0.00 175.10 175.39 1k9z n GLN 169 N 7.30 0.65 -3.70 2.72 1.13 0.26 -4.77 117.38 120.97 1k9z n GLN 169 Ca 0.16 -0.10 -0.12 0.00 -1.94 0.00 0.00 57.00 54.99 1k9z n GLN 169 Cb 0.46 -1.61 -0.09 0.00 0.11 0.00 0.00 30.24 29.11 1k9z n GLN 169 CO 0.00 0.00 0.00 -1.17 -1.44 0.00 0.00 177.06 174.45 1k9z s LEU 170 N -4.80 -0.00 0.01 1.08 0.20 -1.12 -1.04 118.68 113.00 1k9z s LEU 170 Ca -0.06 1.02 -0.01 0.00 0.69 0.00 0.00 54.13 55.76 1k9z s LEU 170 Cb 0.12 1.68 -0.01 0.00 -0.43 0.00 0.00 46.19 47.56 1k9z s LEU 170 CO 0.87 -0.18 0.01 -0.83 -0.29 0.00 0.00 176.35 175.93 1k9z s GLY 171 N 0.56 0.11 -0.16 7.98 0.00 -0.33 -1.05 107.32 114.43 1k9z s GLY 171 Ca -0.02 -0.26 -0.06 0.00 0.00 0.00 0.00 44.72 44.38 1k9z s GLY 171 CO -0.03 -0.31 0.34 0.00 0.00 0.00 0.00 173.10 173.10 1k9z s ILE 173 N 2.40 1.48 -0.16 0.00 1.01 0.24 -1.18 121.20 124.98 1k9z s ILE 173 Ca -0.01 -0.64 -0.17 0.00 0.00 0.00 0.00 60.65 59.83 1k9z s ILE 173 Cb -0.12 -1.44 -0.04 0.00 0.01 0.00 0.00 42.46 40.87 1k9z s ILE 173 CO -0.11 0.38 0.44 -0.83 0.00 0.00 0.00 174.94 174.83 1k9z s GLY 174 N 1.51 2.22 -0.66 6.18 0.00 0.01 -0.71 107.32 115.88 1k9z s GLY 174 Ca 0.04 -0.35 0.04 0.00 0.00 0.00 0.00 44.72 44.44 1k9z s GLY 174 CO -0.10 0.81 0.45 0.00 0.00 0.00 0.00 173.10 174.26 1k9z h PRO 176 N 5.80 0.00 -0.32 0.00 0.11 -1.73 -2.27 132.00 133.59 1k9z h PRO 176 Ca 0.08 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.19 1k9z h PRO 176 Cb 0.80 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.91 1k9z h PRO 176 CO 0.72 0.00 0.00 0.09 -0.21 0.00 0.00 178.00 178.60 1k9z n ASN 177 N -3.09 2.86 -4.64 -2.05 3.02 -1.26 -2.58 115.26 107.52 1k9z n ASN 177 Ca 0.00 -1.91 -0.43 0.00 -0.03 0.00 0.00 54.58 52.21 1k9z n ASN 177 Cb 0.30 -0.21 -0.02 0.00 -0.61 0.00 0.00 39.78 39.23 1k9z n ASN 177 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 1k9z s LEU 178 N -1.01 3.91 -0.28 3.41 2.96 -1.10 -4.94 118.68 121.63 1k9z s LEU 178 Ca 0.24 1.06 -0.05 0.00 -0.22 0.00 0.00 54.13 55.17 1k9z s LEU 178 Cb 0.13 -3.54 0.02 0.00 0.50 0.00 0.00 46.19 43.30 1k9z s LEU 178 CO 0.17 -0.94 0.03 -0.69 -1.32 0.00 0.00 176.35 173.60 1k9z s VAL 179 N 3.84 3.51 0.19 1.68 1.01 -1.26 -4.62 120.40 124.75 1k9z s VAL 179 Ca 0.48 -0.89 0.27 0.00 0.00 0.00 0.00 61.98 61.84 1k9z s VAL 179 Cb -0.13 -2.83 0.28 0.00 0.00 0.00 0.00 36.38 33.71 1k9z s VAL 179 CO 0.18 0.09 1.91 -0.07 0.00 0.00 0.00 175.10 177.21 1k9z h LEU 180 N 8.14 0.00 -1.84 3.92 3.38 -1.88 -2.32 115.31 124.71 1k9z h LEU 180 Ca -0.30 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.67 1k9z h LEU 180 Cb 1.11 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.86 1k9z h LEU 180 CO 0.59 0.15 0.00 0.77 0.09 0.00 0.00 178.44 180.04 1k9z h SER 181 N 0.00 0.00 0.97 -0.43 4.64 -1.81 0.72 113.55 117.64 1k9z h SER 181 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1k9z h SER 181 Cb 0.61 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.70 1k9z h SER 181 CO 0.02 0.00 0.00 0.28 -0.87 0.00 0.00 176.83 176.26 1k9z h SER 182 N 0.00 0.00 0.00 4.97 0.02 -1.69 -3.25 113.55 113.61 1k9z h SER 182 Ca 0.00 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 60.93 1k9z h SER 182 Cb 0.27 0.00 -0.04 0.00 0.14 0.00 0.00 62.40 62.77 1k9z h SER 182 CO 0.00 0.00 -0.45 -1.22 -1.14 0.00 0.00 176.83 174.02 1k9z n TYR 183 N -2.51 0.00 0.00 3.45 4.01 0.18 -4.95 117.16 117.35 1k9z n TYR 183 Ca 0.02 -1.25 0.00 0.00 -0.16 0.00 0.00 57.90 56.51 1k9z n TYR 183 Cb 0.29 -0.21 0.00 0.00 -0.31 0.00 0.00 39.34 39.11 1k9z n TYR 183 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1k9z n GLY 184 N -0.99 2.92 3.99 2.72 0.00 -1.18 -4.97 105.19 107.67 1k9z n GLY 184 Ca 0.17 -0.22 -0.23 0.00 0.00 0.00 0.00 46.02 45.73 1k9z n GLY 184 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1k9z s ALA 185 N -2.13 3.75 -0.00 4.61 0.00 -0.84 -4.90 121.76 122.26 1k9z s ALA 185 Ca 0.00 -1.60 -0.13 0.00 0.00 0.00 0.00 51.96 50.23 1k9z s ALA 185 Cb 0.00 -2.04 -0.05 0.00 0.00 0.00 0.00 23.12 21.03 1k9z s ALA 185 CO 0.00 -1.26 0.36 -0.65 0.00 0.00 0.00 175.76 174.22 1k9z s GLN 186 N -5.04 3.81 0.49 0.00 -0.21 -1.26 -2.67 119.66 114.78 1k9z s GLN 186 Ca 0.64 0.28 -0.08 0.00 0.02 0.00 0.00 55.36 56.21 1k9z s GLN 186 Cb -0.07 -3.17 -0.05 0.00 1.00 0.00 0.00 33.01 30.72 1k9z s GLN 186 CO 0.43 0.68 0.84 -0.51 -2.12 0.00 0.00 175.29 174.60 1k9z s ASP 187 N -1.20 6.34 0.04 5.90 1.01 -1.26 -4.78 116.67 122.72 1k9z s ASP 187 Ca 0.24 1.10 -0.05 0.00 0.71 0.00 0.00 52.55 54.56 1k9z s ASP 187 Cb -0.15 -2.32 -0.05 0.00 1.01 0.00 0.00 42.92 41.41 1k9z s ASP 187 CO 0.13 -0.58 0.26 -0.76 0.21 0.00 0.00 175.17 174.43 1k9z s LEU 188 N -4.55 4.35 -0.11 1.23 1.43 -1.26 -5.05 118.68 114.72 1k9z s LEU 188 Ca 0.50 0.49 -0.38 0.00 -1.03 0.00 0.00 54.13 53.71 1k9z s LEU 188 Cb -0.10 -2.82 -0.15 0.00 0.03 0.00 0.00 46.19 43.15 1k9z s LEU 188 CO 0.42 0.21 1.63 2.29 0.23 0.00 0.00 176.35 181.13 1k9z n LYS 189 N 0.79 1.36 0.00 1.70 2.85 -1.26 -1.51 118.16 122.09 1k9z n LYS 189 Ca -0.09 0.50 0.00 0.00 -1.05 0.00 0.00 58.31 57.67 1k9z n LYS 189 Cb 0.52 -2.20 0.00 0.00 -0.65 0.00 0.00 35.03 32.71 1k9z n LYS 189 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1k9z n GLY 190 N 3.65 0.32 0.29 2.58 0.00 -1.26 -4.80 105.19 105.98 1k9z n GLY 190 Ca 0.23 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.38 1k9z n GLY 190 CO 0.00 0.00 0.00 1.12 0.00 0.00 0.00 173.32 174.44 1k9z h HIS 191 N 0.00 0.00 0.00 1.61 2.07 -1.52 -3.21 115.15 114.10 1k9z h HIS 191 Ca 0.00 0.00 -0.09 0.00 -2.85 0.00 0.00 60.37 57.43 1k9z h HIS 191 Cb 0.00 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 29.97 1k9z h HIS 191 CO 0.00 0.00 -0.41 0.93 -3.07 0.00 0.00 177.93 175.38 1k9z h GLU 192 N 0.00 0.00 -0.00 5.12 3.07 -1.87 -0.62 114.58 120.28 1k9z h GLU 192 Ca 0.02 0.00 -0.00 0.00 -0.50 0.00 0.00 59.36 58.88 1k9z h GLU 192 Cb 0.10 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.01 1k9z h GLU 192 CO -0.00 0.41 -0.01 0.66 -1.40 0.00 0.00 179.01 178.67 1k9z h SER 193 N 0.00 0.01 -0.17 1.42 4.64 -1.94 -3.41 113.55 114.10 1k9z h SER 193 Ca -0.00 -0.58 -0.21 0.00 -0.47 0.00 0.00 61.79 60.53 1k9z h SER 193 Cb 0.78 -0.00 -0.23 0.00 -0.31 0.00 0.00 62.40 62.64 1k9z h SER 193 CO 0.05 0.59 -0.55 2.22 -0.87 0.00 0.00 176.83 178.28 1k9z n PHE 194 N -4.80 -1.15 -4.12 4.77 -1.74 -1.24 -4.99 117.46 104.18 1k9z n PHE 194 Ca -0.09 -1.93 0.00 0.00 -0.56 0.00 0.00 57.45 54.87 1k9z n PHE 194 Cb 0.30 1.02 0.00 0.00 1.52 0.00 0.00 39.48 42.32 1k9z n PHE 194 CO 0.00 0.00 0.00 0.41 -0.56 0.00 0.00 176.76 176.61 1k9z n GLY 195 N -1.05 0.39 3.25 4.97 0.00 -0.24 -4.20 105.19 108.30 1k9z n GLY 195 Ca -0.08 -0.93 -0.19 0.00 0.00 0.00 0.00 46.02 44.83 1k9z n GLY 195 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1k9z s TYR 196 N 0.00 1.46 -0.10 1.61 2.02 -0.87 -0.47 117.35 121.00 1k9z s TYR 196 Ca 0.00 -0.53 0.02 0.00 -0.37 0.00 0.00 57.07 56.20 1k9z s TYR 196 Cb 0.00 -0.77 -0.01 0.00 -0.40 0.00 0.00 41.96 40.78 1k9z s TYR 196 CO 0.00 0.16 -0.17 0.42 -1.57 0.00 0.00 175.55 174.39 1k9z s ILE 197 N -2.00 2.71 -0.05 2.71 1.01 0.13 -0.38 121.20 125.33 1k9z s ILE 197 Ca 0.09 -0.81 0.02 0.00 0.00 0.00 0.00 60.65 59.95 1k9z s ILE 197 Cb -0.06 -2.08 -0.03 0.00 0.01 0.00 0.00 42.46 40.30 1k9z s ILE 197 CO 0.03 0.55 -0.07 -0.36 0.00 0.00 0.00 174.94 175.09 1k9z s PHE 198 N 0.05 2.91 0.10 3.97 0.40 0.11 -1.34 117.98 124.18 1k9z s PHE 198 Ca -0.07 -0.01 -0.17 0.00 -0.60 0.00 0.00 56.93 56.09 1k9z s PHE 198 Cb -0.15 -1.68 0.04 0.00 0.51 0.00 0.00 43.02 41.74 1k9z s PHE 198 CO 0.05 0.33 0.41 -0.98 0.70 0.00 0.00 175.22 175.73 1k9z s ARG 199 N -0.98 1.03 -0.09 0.44 1.70 -0.16 -0.60 118.95 120.29 1k9z s ARG 199 Ca 0.14 -0.60 -0.30 0.00 -0.47 0.00 0.00 55.73 54.49 1k9z s ARG 199 Cb -0.11 0.45 0.07 0.00 -0.57 0.00 0.00 34.95 34.80 1k9z s ARG 199 CO 0.03 -0.39 0.70 0.00 -1.08 0.00 0.00 175.30 174.56 1k9z s ALA 200 N -3.41 -1.78 -0.06 7.88 0.00 -0.31 -0.85 121.76 123.23 1k9z s ALA 200 Ca 0.01 1.46 0.05 0.00 0.00 0.00 0.00 51.96 53.47 1k9z s ALA 200 Cb 0.01 -0.24 -0.01 0.00 0.00 0.00 0.00 23.12 22.89 1k9z s ALA 200 CO -0.09 -0.36 -0.21 0.08 0.00 0.00 0.00 175.76 175.17 1k9z s VAL 201 N -0.90 1.76 0.12 0.00 1.01 -1.21 -1.19 120.40 119.99 1k9z s VAL 201 Ca -0.09 -0.90 -0.35 0.00 0.00 0.00 0.00 61.98 60.65 1k9z s VAL 201 Cb -0.01 -1.51 -0.14 0.00 0.00 0.00 0.00 36.38 34.72 1k9z s VAL 201 CO 0.08 0.50 1.55 -1.14 0.00 0.00 0.00 175.10 176.09 1k9z n ARG 202 N 3.12 1.93 -0.97 2.72 0.63 -0.21 -0.80 116.66 123.08 1k9z n ARG 202 Ca -0.18 0.70 0.00 0.00 -0.92 0.00 0.00 57.85 57.45 1k9z n ARG 202 Cb 0.52 -2.44 0.00 0.00 0.45 0.00 0.00 32.46 30.99 1k9z n ARG 202 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1k9z n GLY 203 N 3.31 0.98 0.10 5.14 0.00 -1.26 -4.88 105.19 108.58 1k9z n GLY 203 Ca 0.18 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.21 1k9z n GLY 203 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1k9z n LEU 204 N 0.00 1.17 0.00 0.99 4.77 0.02 -5.12 117.00 118.83 1k9z n LEU 204 Ca 0.00 -0.98 0.00 0.00 -0.03 0.00 0.00 56.01 55.00 1k9z n LEU 204 Cb 0.00 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.09 1k9z n LEU 204 CO 0.00 0.27 0.00 0.61 -1.33 0.00 0.00 177.39 176.94 1k9z n GLY 205 N 0.18 1.18 3.59 -0.72 0.00 -1.23 -4.88 105.19 103.32 1k9z n GLY 205 Ca 0.01 -1.86 -0.33 0.00 0.00 0.00 0.00 46.02 43.85 1k9z n GLY 205 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1k9z s ALA 206 N -2.62 3.00 0.11 4.61 0.00 -1.25 -3.36 121.76 122.25 1k9z s ALA 206 Ca 0.00 -0.97 -0.05 0.00 0.00 0.00 0.00 51.96 50.94 1k9z s ALA 206 Cb 0.00 -1.17 -0.02 0.00 0.00 0.00 0.00 23.12 21.93 1k9z s ALA 206 CO 0.00 0.60 0.13 -0.06 0.00 0.00 0.00 175.76 176.42 1k9z s PHE 207 N -0.92 0.50 0.13 0.00 0.40 -0.03 -1.19 117.98 116.86 1k9z s PHE 207 Ca 0.15 -0.92 -0.04 0.00 -0.60 0.00 0.00 56.93 55.52 1k9z s PHE 207 Cb -0.11 -0.25 -0.03 0.00 0.51 0.00 0.00 43.02 43.14 1k9z s PHE 207 CO 0.05 -0.54 0.13 1.52 0.70 0.00 0.00 175.22 177.08 1k9z s TYR 208 N -3.95 0.60 -0.09 0.36 1.13 -0.17 -0.99 117.35 114.24 1k9z s TYR 208 Ca 0.14 -1.00 -0.28 0.00 -1.41 0.00 0.00 57.07 54.51 1k9z s TYR 208 Cb 0.06 -0.30 0.06 0.00 -1.10 0.00 0.00 41.96 40.69 1k9z s TYR 208 CO -0.04 -0.56 0.64 0.45 -2.51 0.00 0.00 175.55 173.53 1k9z s SER 209 N -2.99 -0.62 0.28 -0.18 0.15 -0.45 -1.02 113.70 108.87 1k9z s SER 209 Ca 0.18 0.78 -0.29 0.00 0.70 0.00 0.00 55.95 57.32 1k9z s SER 209 Cb 0.06 0.68 -0.13 0.00 -1.71 0.00 0.00 66.02 64.91 1k9z s SER 209 CO -0.02 -0.52 1.23 -2.65 1.20 0.00 0.00 173.24 172.48 1k9z n PRO 210 N 1.29 1.80 -0.23 5.44 -0.02 -1.26 -0.69 135.00 141.32 1k9z n PRO 210 Ca -0.18 0.63 0.08 0.00 -2.02 0.00 0.00 63.50 62.01 1k9z n PRO 210 Cb 0.57 -2.17 0.34 0.00 -0.02 0.00 0.00 33.50 32.22 1k9z n PRO 210 CO 0.00 0.00 0.00 0.77 1.98 0.00 0.00 175.50 178.25 1k9z h SER 211 N 2.90 0.71 0.55 2.55 0.02 -1.00 -0.08 113.55 119.20 1k9z h SER 211 Ca -0.44 0.01 -0.01 0.00 -0.84 0.00 0.00 61.79 60.51 1k9z h SER 211 Cb 1.30 -0.13 -0.00 0.00 0.14 0.00 0.00 62.40 63.71 1k9z h SER 211 CO 0.66 0.43 -0.07 0.77 -1.14 0.00 0.00 176.83 177.48 1k9z h SER 212 N 0.79 0.00 0.00 3.07 4.64 -1.79 -3.33 113.55 116.93 1k9z h SER 212 Ca 0.37 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.69 1k9z h SER 212 Cb 0.39 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.48 1k9z h SER 212 CO -0.14 0.07 0.00 -0.67 -0.87 0.00 0.00 176.83 175.22 1k9z n ASP 213 N -3.33 0.00 -2.04 4.97 -0.08 -0.16 -4.97 116.55 110.93 1k9z n ASP 213 Ca -0.01 0.00 -0.19 0.00 -1.51 0.00 0.00 54.79 53.08 1k9z n ASP 213 Cb 0.25 0.00 -0.04 0.00 2.34 0.00 0.00 41.12 43.66 1k9z n ASP 213 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1k9z n ALA 214 N -1.59 -0.50 0.00 -1.67 0.00 -0.48 -4.79 120.51 111.49 1k9z n ALA 214 Ca 0.00 0.22 0.00 0.00 0.00 0.00 0.00 53.44 53.66 1k9z n ALA 214 Cb 0.00 -2.00 0.00 0.00 0.00 0.00 0.00 19.45 17.45 1k9z n ALA 214 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1k9z n GLU 215 N -2.68 0.00 -2.96 0.00 -0.58 -1.26 -4.98 120.64 108.19 1k9z n GLU 215 Ca -0.21 0.00 -0.42 0.00 -0.42 0.00 0.00 57.16 56.11 1k9z n GLU 215 Cb 0.66 -0.46 -0.05 0.00 -0.57 0.00 0.00 31.44 31.02 1k9z n GLU 215 CO 0.00 0.00 0.00 0.45 -0.48 0.00 0.00 177.13 177.10 1k9z s SER 216 N -4.82 6.65 -0.14 1.62 0.15 -1.26 -5.05 113.70 110.85 1k9z s SER 216 Ca 0.00 0.65 -0.02 0.00 0.70 0.00 0.00 55.95 57.28 1k9z s SER 216 Cb 0.00 -2.40 -0.02 0.00 -1.71 0.00 0.00 66.02 61.89 1k9z s SER 216 CO 0.00 -0.60 -0.08 0.26 1.20 0.00 0.00 173.24 174.02 1k9z s TRP 217 N 2.92 2.92 -0.18 3.44 0.52 -1.26 -4.58 118.94 122.72 1k9z s TRP 217 Ca 0.32 -0.44 -0.05 0.00 0.02 0.00 0.00 56.10 55.94 1k9z s TRP 217 Cb -0.14 -1.89 -0.03 0.00 -1.15 0.00 0.00 33.47 30.26 1k9z s TRP 217 CO 0.12 -0.10 0.01 0.99 0.02 0.00 0.00 176.95 177.99 1k9z s THR 218 N 0.29 4.16 0.41 2.01 2.01 -0.19 -4.90 115.64 119.44 1k9z s THR 218 Ca -0.07 -0.25 -0.24 0.00 0.31 0.00 0.00 61.69 61.44 1k9z s THR 218 Cb -0.15 -2.86 -0.08 0.00 0.01 0.00 0.00 72.50 69.41 1k9z s THR 218 CO 0.04 0.45 1.10 -0.75 -0.69 0.00 0.00 174.62 174.77 1k9z s LYS 219 N 0.64 4.05 0.16 4.92 2.20 -1.26 -1.00 119.74 129.44 1k9z s LYS 219 Ca -0.00 1.63 0.08 0.00 -0.36 0.00 0.00 55.97 57.31 1k9z s LYS 219 Cb -0.14 -2.53 -0.04 0.00 -1.51 0.00 0.00 37.83 33.61 1k9z s LYS 219 CO 0.02 -0.27 -0.17 0.96 -0.36 0.00 0.00 175.35 175.53 1k9z s ILE 220 N -1.59 1.71 -0.05 5.43 -4.36 -0.33 -4.90 121.20 117.11 1k9z s ILE 220 Ca 0.59 -1.89 -0.20 0.00 -0.26 0.00 0.00 60.65 58.89 1k9z s ILE 220 Cb -0.25 -1.79 0.04 0.00 1.25 0.00 0.00 42.46 41.71 1k9z s ILE 220 CO 0.31 -0.35 0.45 -2.28 0.24 0.00 0.00 174.94 173.31 1k9z s HIS 221 N -2.11 -0.38 0.88 1.37 2.46 -1.09 -4.55 115.29 111.87 1k9z s HIS 221 Ca 0.15 0.68 -0.11 0.00 0.47 0.00 0.00 55.06 56.25 1k9z s HIS 221 Cb -0.05 0.21 0.12 0.00 -0.13 0.00 0.00 32.58 32.73 1k9z s HIS 221 CO 0.06 -0.44 1.17 0.14 -2.47 0.00 0.00 174.74 173.20 1k9z s VAL 222 N -1.06 2.04 0.33 0.89 -7.23 0.20 -3.67 120.40 111.90 1k9z s VAL 222 Ca -0.11 0.01 0.01 0.00 -1.81 0.00 0.00 61.98 60.08 1k9z s VAL 222 Cb -0.03 -2.17 -0.03 0.00 0.56 0.00 0.00 36.38 34.71 1k9z s VAL 222 CO 0.06 -0.02 0.52 0.00 -0.31 0.00 0.00 175.10 175.35 1k9z s ARG 223 N -4.47 3.49 -0.43 4.82 1.70 -1.26 -4.84 118.95 117.96 1k9z s ARG 223 Ca 0.69 -0.37 0.02 0.00 -0.47 0.00 0.00 55.73 55.61 1k9z s ARG 223 Cb -0.25 -2.70 0.12 0.00 -0.57 0.00 0.00 34.95 31.56 1k9z s ARG 223 CO 0.55 0.19 0.20 -1.01 -1.08 0.00 0.00 175.30 174.15 1k9z s HIS 224 N -2.25 2.50 0.38 5.89 3.76 -1.26 -4.80 115.29 119.51 1k9z s HIS 224 Ca 0.39 -2.60 -0.12 0.00 -0.15 0.00 0.00 55.06 52.58 1k9z s HIS 224 Cb -0.10 -2.25 -0.07 0.00 1.11 0.00 0.00 32.58 31.27 1k9z s HIS 224 CO 0.35 -0.81 0.77 -0.51 -0.85 0.00 0.00 174.74 173.68 1k9z s LEU 225 N 0.45 3.89 -0.09 0.89 1.43 -1.26 -5.00 118.68 119.00 1k9z s LEU 225 Ca 0.15 1.20 0.05 0.00 -1.03 0.00 0.00 54.13 54.50 1k9z s LEU 225 Cb -0.23 -4.05 -0.09 0.00 0.03 0.00 0.00 46.19 41.85 1k9z s LEU 225 CO -0.05 -0.35 -0.02 0.29 0.23 0.00 0.00 176.35 176.46 1k9z n LYS 226 N -1.02 1.77 -2.64 1.70 5.02 -1.26 -4.80 118.16 116.94 1k9z n LYS 226 Ca 0.03 0.02 -0.42 0.00 -2.02 0.00 0.00 58.31 55.92 1k9z n LYS 226 Cb 0.54 -1.21 -0.02 0.00 -0.02 0.00 0.00 35.03 34.31 1k9z n LYS 226 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 1k9z s ASP 227 N -4.38 6.61 0.55 4.39 3.68 -1.26 -4.84 116.67 121.41 1k9z s ASP 227 Ca -0.08 -1.79 0.37 0.00 2.13 0.00 0.00 52.55 53.18 1k9z s ASP 227 Cb 0.03 -2.54 1.55 0.00 -1.45 0.00 0.00 42.92 40.51 1k9z s ASP 227 CO 0.30 -1.34 1.79 0.71 0.13 0.00 0.00 175.17 176.76 1k9z h THR 228 N 6.33 0.39 0.00 1.71 1.35 -1.93 1.10 112.91 121.86 1k9z h THR 228 Ca 0.24 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 66.10 1k9z h THR 228 Cb 0.98 0.40 0.00 0.00 -1.73 0.00 0.00 68.15 67.80 1k9z h THR 228 CO 1.37 0.00 0.00 0.07 -0.25 0.00 0.00 175.52 176.71 1k9z h LYS 229 N 0.00 0.00 -0.02 4.72 2.10 -1.84 -0.39 116.57 121.14 1k9z h LYS 229 Ca 0.56 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.21 1k9z h LYS 229 Cb 2.28 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 33.61 1k9z h LYS 229 CO -0.01 0.00 -0.01 -0.25 -2.00 0.00 0.00 179.45 177.18 1k9z n ASP 230 N -2.30 2.37 -4.85 7.07 8.00 0.38 -4.58 116.55 122.65 1k9z n ASP 230 Ca -0.00 -1.78 -0.31 0.00 0.71 0.00 0.00 54.79 53.40 1k9z n ASP 230 Cb 0.11 0.01 0.01 0.00 -0.02 0.00 0.00 41.12 41.23 1k9z n ASP 230 CO 0.00 0.00 0.00 -0.04 -0.39 0.00 0.00 177.20 176.77 1k9z s MET 231 N -2.02 3.52 -0.09 -1.24 -1.94 -0.16 -5.00 119.30 112.37 1k9z s MET 231 Ca 0.32 0.83 0.04 0.00 -1.71 0.00 0.00 55.69 55.17 1k9z s MET 231 Cb 0.20 -2.07 -0.00 0.00 2.01 0.00 0.00 34.83 34.97 1k9z s MET 231 CO 0.32 -0.64 -0.24 0.42 -0.01 0.00 0.00 175.02 174.88 1k9z s ILE 232 N -3.05 2.02 0.35 2.53 1.01 -1.26 -3.98 121.20 118.83 1k9z s ILE 232 Ca 0.56 -1.01 -0.06 0.00 0.00 0.00 0.00 60.65 60.14 1k9z s ILE 232 Cb -0.12 -1.74 -0.05 0.00 0.01 0.00 0.00 42.46 40.56 1k9z s ILE 232 CO 0.50 0.55 0.64 0.42 0.00 0.00 0.00 174.94 177.06 1k9z s THR 233 N 0.22 4.95 -0.09 2.92 -4.23 -0.72 -0.89 115.64 117.81 1k9z s THR 233 Ca -0.15 0.18 0.03 0.00 -1.18 0.00 0.00 61.69 60.57 1k9z s THR 233 Cb -0.17 -3.77 -0.01 0.00 1.34 0.00 0.00 72.50 69.90 1k9z s THR 233 CO 0.07 -0.48 -0.20 -0.76 -0.54 0.00 0.00 174.62 172.72 1k9z s LEU 234 N -3.88 2.35 0.05 4.79 1.43 0.69 -1.06 118.68 123.04 1k9z s LEU 234 Ca 0.46 -0.44 -0.07 0.00 -1.03 0.00 0.00 54.13 53.06 1k9z s LEU 234 Cb -0.10 -1.48 -0.01 0.00 0.03 0.00 0.00 46.19 44.63 1k9z s LEU 234 CO 0.33 0.20 0.13 -1.61 0.23 0.00 0.00 176.35 175.64 1k9z s GLU 235 N 0.09 0.66 0.96 1.70 2.02 -0.63 -1.86 118.70 121.64 1k9z s GLU 235 Ca -0.09 -0.77 -0.11 0.00 0.02 0.00 0.00 54.97 54.02 1k9z s GLU 235 Cb -0.15 0.26 0.17 0.00 0.10 0.00 0.00 34.13 34.51 1k9z s GLU 235 CO 0.06 -0.18 1.11 0.20 0.02 0.00 0.00 175.26 176.47 1k9z s GLY 236 N -2.26 1.65 -0.14 -1.39 0.00 -1.26 -1.57 107.32 102.36 1k9z s GLY 236 Ca -0.03 0.34 -0.07 0.00 0.00 0.00 0.00 44.72 44.97 1k9z s GLY 236 CO -0.06 0.84 0.31 -0.62 0.00 0.00 0.00 173.10 173.57 1k9z n VAL 237 N -4.33 1.75 -2.15 1.40 0.31 -1.26 -4.57 118.33 109.48 1k9z n VAL 237 Ca 0.09 -0.61 -0.42 0.00 -0.01 0.00 0.00 64.34 63.38 1k9z n VAL 237 Cb 0.53 -1.73 -0.03 0.00 -0.91 0.00 0.00 33.84 31.70 1k9z n VAL 237 CO 0.00 0.00 0.00 -1.61 -1.32 0.00 0.00 176.83 173.90 1k9z s GLU 238 N -2.54 4.22 0.53 5.55 0.41 -1.26 -4.89 118.70 120.72 1k9z s GLU 238 Ca -0.24 2.02 0.22 0.00 -0.41 0.00 0.00 54.97 56.57 1k9z s GLU 238 Cb 0.07 -3.80 1.46 0.00 -1.78 0.00 0.00 34.13 30.07 1k9z s GLU 238 CO 0.75 -0.74 2.15 0.87 -0.49 0.00 0.00 175.26 177.80 1k9z h LYS 239 N 8.71 0.00 -0.27 1.61 1.57 -1.91 -2.46 116.57 123.82 1k9z h LYS 239 Ca -0.36 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.42 1k9z h LYS 239 Cb 1.16 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.47 1k9z h LYS 239 CO 0.94 0.05 0.00 0.41 -0.57 0.00 0.00 179.45 180.28 1k9z n GLY 240 N -1.25 1.01 0.07 3.86 0.00 -1.26 -4.01 105.19 103.61 1k9z n GLY 240 Ca -0.03 -0.58 0.01 0.00 0.00 0.00 0.00 46.02 45.42 1k9z n GLY 240 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1k9z n HIS 241 N 0.93 0.41 -3.73 1.61 8.25 -0.93 -4.96 115.22 116.80 1k9z n HIS 241 Ca 0.18 0.14 -0.13 0.00 -0.26 0.00 0.00 57.72 57.64 1k9z n HIS 241 Cb 0.47 -0.88 -0.08 0.00 1.12 0.00 0.00 29.99 30.62 1k9z n HIS 241 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 1k9z s SER 242 N -5.30 -0.21 -1.03 0.41 1.04 -1.25 -4.82 113.70 102.54 1k9z s SER 242 Ca -0.06 0.01 -0.23 0.00 0.48 0.00 0.00 55.95 56.15 1k9z s SER 242 Cb 0.10 0.36 0.01 0.00 0.10 0.00 0.00 66.02 66.58 1k9z s SER 242 CO 0.84 -0.55 1.68 -0.55 0.98 0.00 0.00 173.24 175.65 1k9z s SER 243 N -1.69 5.99 0.39 7.02 0.15 -0.14 -4.79 113.70 120.64 1k9z s SER 243 Ca -0.09 -1.36 0.11 0.00 0.70 0.00 0.00 55.95 55.31 1k9z s SER 243 Cb -0.03 -2.57 0.80 0.00 -1.71 0.00 0.00 66.02 62.51 1k9z s SER 243 CO 0.01 -1.99 1.91 -0.74 1.20 0.00 0.00 173.24 173.63 1k9z h HIS 244 N 9.97 0.16 -0.13 3.44 6.17 -1.90 -1.02 115.15 131.85 1k9z h HIS 244 Ca 0.20 -0.02 -0.16 0.00 0.71 0.00 0.00 60.37 61.10 1k9z h HIS 244 Cb 0.98 -0.04 -0.01 0.00 2.52 0.00 0.00 27.41 30.86 1k9z h HIS 244 CO 1.27 0.34 -0.60 -0.44 0.71 0.00 0.00 177.93 179.22 1k9z h ASP 245 N 0.14 0.48 0.54 3.26 3.45 -1.96 -0.42 116.42 121.91 1k9z h ASP 245 Ca 0.03 -0.27 -0.16 0.00 0.43 0.00 0.00 57.03 57.05 1k9z h ASP 245 Cb 0.43 -0.14 -0.01 0.00 -0.56 0.00 0.00 39.33 39.05 1k9z h ASP 245 CO 0.03 0.97 -0.73 -0.33 -1.57 0.00 0.00 179.24 177.61 1k9z h GLU 246 N 0.32 0.16 -0.72 3.56 5.08 -1.86 -2.18 114.58 118.94 1k9z h GLU 246 Ca -0.00 -0.14 -0.05 0.00 -1.00 0.00 0.00 59.36 58.17 1k9z h GLU 246 Cb 1.13 0.03 -0.03 0.00 0.50 0.00 0.00 28.75 30.38 1k9z h GLU 246 CO 0.10 0.82 0.24 1.96 -1.00 0.00 0.00 179.01 181.13 1k9z h GLN 247 N 0.10 1.10 -0.56 2.33 4.20 -0.89 -1.46 115.11 119.93 1k9z h GLN 247 Ca -0.02 -0.22 -0.09 0.00 0.06 0.00 0.00 58.65 58.38 1k9z h GLN 247 Cb 1.29 -0.17 -0.02 0.00 0.30 0.00 0.00 27.48 28.88 1k9z h GLN 247 CO 0.11 0.92 -0.02 1.15 -0.67 0.00 0.00 178.83 180.32 1k9z h THR 248 N 1.06 1.26 -0.45 -0.54 2.02 -0.99 -1.59 112.91 113.67 1k9z h THR 248 Ca 0.23 -1.14 0.06 0.00 0.77 0.00 0.00 66.41 66.34 1k9z h THR 248 Cb 0.27 0.85 -0.06 0.00 -1.74 0.00 0.00 68.15 67.48 1k9z h THR 248 CO -0.01 0.41 0.14 0.00 0.37 0.00 0.00 175.52 176.43 1k9z h ALA 249 N 1.06 0.53 -0.33 6.16 0.00 -1.03 0.42 119.26 126.07 1k9z h ALA 249 Ca 0.16 0.07 0.04 0.00 0.00 0.00 0.00 54.91 55.18 1k9z h ALA 249 Cb 0.55 0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.37 1k9z h ALA 249 CO 0.03 -0.26 0.10 0.82 0.00 0.00 0.00 179.25 179.94 1k9z h ILE 250 N 0.29 0.89 -0.52 0.00 2.04 -0.88 -1.36 117.51 117.97 1k9z h ILE 250 Ca 0.22 -0.08 0.02 0.00 1.00 0.00 0.00 64.86 66.01 1k9z h ILE 250 Cb 0.24 0.63 -0.03 0.00 -0.74 0.00 0.00 36.82 36.92 1k9z h ILE 250 CO -0.24 0.04 0.32 0.11 0.00 0.00 0.00 178.15 178.38 1k9z h LYS 251 N 0.23 0.63 -0.12 2.37 1.57 -0.39 -1.33 116.57 119.54 1k9z h LYS 251 Ca 0.15 -0.04 0.03 0.00 -1.87 0.00 0.00 60.65 58.92 1k9z h LYS 251 Cb 0.14 -0.14 -0.03 0.00 0.08 0.00 0.00 32.23 32.28 1k9z h LYS 251 CO -0.17 0.42 -0.05 -0.91 -0.57 0.00 0.00 179.45 178.16 1k9z h ASN 252 N 0.65 -0.18 -0.39 0.86 -0.26 0.07 0.10 115.58 116.42 1k9z h ASN 252 Ca 0.20 0.05 -0.02 0.00 -0.56 0.00 0.00 56.30 55.97 1k9z h ASN 252 Cb -0.02 0.10 -0.02 0.00 -1.06 0.00 0.00 38.32 37.32 1k9z h ASN 252 CO -0.07 -0.07 0.18 0.11 -1.06 0.00 0.00 177.43 176.52 1k9z h LYS 253 N -0.04 0.61 -0.02 0.81 1.57 -0.89 -2.19 116.57 116.42 1k9z h LYS 253 Ca 0.06 -0.08 0.00 0.00 -1.87 0.00 0.00 60.65 58.77 1k9z h LYS 253 Cb 0.14 -0.12 0.00 0.00 0.08 0.00 0.00 32.23 32.33 1k9z h LYS 253 CO -0.14 0.50 -0.00 1.28 -0.57 0.00 0.00 179.45 180.51 1k9z n LEU 254 N -4.38 2.48 -2.44 2.94 4.32 -0.53 -4.96 117.00 114.42 1k9z n LEU 254 Ca 0.03 -0.83 -0.19 0.00 -0.02 0.00 0.00 56.01 55.00 1k9z n LEU 254 Cb 0.14 -0.00 0.01 0.00 -1.62 0.00 0.00 43.42 41.95 1k9z n LEU 254 CO 0.37 0.41 -0.10 0.59 -1.22 0.00 0.00 177.39 177.44 1k9z n ASN 255 N 0.93 -5.52 -4.27 -1.43 5.03 -0.08 -4.68 115.26 105.25 1k9z n ASN 255 Ca 0.16 -0.15 -0.43 0.00 0.87 0.00 0.00 54.58 55.02 1k9z n ASN 255 Cb 0.52 -4.45 -0.03 0.00 -1.02 0.00 0.00 39.78 34.80 1k9z n ASN 255 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 1k9z s ILE 256 N -3.03 5.29 0.03 2.41 1.01 -0.62 -4.19 121.20 122.11 1k9z s ILE 256 Ca 0.15 -3.01 -0.18 0.00 0.00 0.00 0.00 60.65 57.62 1k9z s ILE 256 Cb -0.07 -4.26 -0.22 0.00 0.01 0.00 0.00 42.46 37.92 1k9z s ILE 256 CO 0.19 -1.06 1.15 0.77 0.00 0.00 0.00 174.94 175.99 1k9z h SER 257 N 7.11 0.68 -3.83 3.58 4.64 -1.81 -3.44 113.55 120.47 1k9z h SER 257 Ca 0.12 -0.73 -0.52 0.00 -0.47 0.00 0.00 61.79 60.18 1k9z h SER 257 Cb 0.95 -0.21 0.06 0.00 -0.31 0.00 0.00 62.40 62.89 1k9z h SER 257 CO 0.83 1.32 0.62 -0.54 -0.87 0.00 0.00 176.83 178.20 1k9z s LYS 258 N -3.32 4.39 -0.02 4.77 1.02 -1.26 -4.95 119.74 120.38 1k9z s LYS 258 Ca -0.12 2.16 -0.01 0.00 0.02 0.00 0.00 55.97 58.03 1k9z s LYS 258 Cb 0.05 -3.09 0.02 0.00 -0.52 0.00 0.00 37.83 34.29 1k9z s LYS 258 CO 0.86 -0.15 0.04 -1.12 -0.92 0.00 0.00 175.35 174.06 1k9z s SER 259 N -0.47 0.01 -0.07 2.83 0.01 -1.26 -1.75 113.70 113.01 1k9z s SER 259 Ca 0.49 0.07 0.05 0.00 1.31 0.00 0.00 55.95 57.87 1k9z s SER 259 Cb -0.39 0.01 -0.00 0.00 0.21 0.00 0.00 66.02 65.85 1k9z s SER 259 CO 0.51 -0.08 -0.22 -0.76 0.41 0.00 0.00 173.24 173.09 1k9z s LEU 260 N 0.67 2.02 -0.10 2.44 1.43 -0.23 -4.94 118.68 119.98 1k9z s LEU 260 Ca -0.05 -0.48 0.03 0.00 -1.03 0.00 0.00 54.13 52.60 1k9z s LEU 260 Cb -0.08 -1.27 0.00 0.00 0.03 0.00 0.00 46.19 44.88 1k9z s LEU 260 CO -0.02 0.19 -0.21 -1.00 0.23 0.00 0.00 176.35 175.54 1k9z s HIS 261 N 0.05 2.36 0.06 0.29 3.76 -1.26 -1.61 115.29 118.94 1k9z s HIS 261 Ca -0.08 -1.00 -0.26 0.00 -0.15 0.00 0.00 55.06 53.56 1k9z s HIS 261 Cb -0.14 -1.60 0.08 0.00 1.11 0.00 0.00 32.58 32.02 1k9z s HIS 261 CO 0.05 -0.43 0.72 -0.48 -0.85 0.00 0.00 174.74 173.74 1k9z s LEU 262 N 0.51 -0.52 0.48 0.89 2.34 -0.61 -4.85 118.68 116.93 1k9z s LEU 262 Ca -0.16 0.16 -0.13 0.00 0.06 0.00 0.00 54.13 54.07 1k9z s LEU 262 Cb -0.17 2.39 -0.07 0.00 -0.56 0.00 0.00 46.19 47.78 1k9z s LEU 262 CO 0.06 -0.77 0.90 -1.81 -1.06 0.00 0.00 176.35 173.67 1k9z s ASP 263 N -2.27 6.52 0.00 1.48 1.11 -1.26 -4.01 116.67 118.24 1k9z s ASP 263 Ca -0.00 1.36 0.00 0.00 0.18 0.00 0.00 52.55 54.08 1k9z s ASP 263 Cb -0.01 -2.42 0.00 0.00 1.07 0.00 0.00 42.92 41.56 1k9z s ASP 263 CO -0.07 -0.55 0.00 -1.54 1.18 0.00 0.00 175.17 174.20 1k9z n SER 264 N -1.64 0.00 0.00 0.27 3.41 -1.26 -4.40 113.62 110.00 1k9z n SER 264 Ca 0.05 0.00 0.07 0.00 -0.26 0.00 0.00 58.87 58.72 1k9z n SER 264 Cb 0.54 0.00 0.40 0.00 -0.26 0.00 0.00 64.21 64.89 1k9z n SER 264 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1k9z n GLN 265 N -0.72 0.46 -0.16 4.33 6.02 -1.26 -1.95 117.38 124.10 1k9z n GLN 265 Ca 0.00 0.00 0.27 0.00 -0.01 0.00 0.00 57.00 57.26 1k9z n GLN 265 Cb 0.00 -1.45 0.70 0.00 1.02 0.00 0.00 30.24 30.51 1k9z n GLN 265 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1k9z h ALA 266 N 2.83 2.75 -0.58 -1.58 0.00 -1.88 -0.86 119.26 119.95 1k9z h ALA 266 Ca 0.00 -0.03 0.02 0.00 0.00 0.00 0.00 54.91 54.91 1k9z h ALA 266 Cb 0.00 0.06 -0.04 0.00 0.00 0.00 0.00 17.79 17.81 1k9z h ALA 266 CO 0.00 -1.00 0.36 0.87 0.00 0.00 0.00 179.25 179.48 1k9z h LYS 267 N 0.03 0.68 -0.62 0.00 1.57 -1.65 -1.05 116.57 115.53 1k9z h LYS 267 Ca 0.41 -0.04 -0.02 0.00 -1.87 0.00 0.00 60.65 59.13 1k9z h LYS 267 Cb 1.58 -0.15 -0.03 0.00 0.08 0.00 0.00 32.23 33.70 1k9z h LYS 267 CO -0.02 0.45 0.32 1.88 -0.57 0.00 0.00 179.45 181.52 1k9z h TYR 268 N 0.70 0.85 -0.50 -1.35 0.05 -1.41 -1.61 116.97 113.70 1k9z h TYR 268 Ca 0.23 -0.02 -0.02 0.00 0.05 0.00 0.00 58.73 58.98 1k9z h TYR 268 Cb 0.01 -0.27 -0.02 0.00 1.01 0.00 0.00 36.73 37.46 1k9z h TYR 268 CO -0.06 0.61 0.25 0.00 -1.05 0.00 0.00 178.16 177.91 1k9z h LEU 270 N 0.66 0.88 -0.06 0.00 3.38 -0.88 -0.56 115.31 118.72 1k9z h LEU 270 Ca 0.17 -0.24 -0.00 0.00 0.09 0.00 0.00 57.88 57.90 1k9z h LEU 270 Cb 0.10 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 40.61 1k9z h LEU 270 CO -0.02 0.95 0.04 0.25 0.09 0.00 0.00 178.44 179.75 1k9z h LEU 271 N 0.83 0.08 -1.66 1.67 5.85 -1.13 -0.96 115.31 119.99 1k9z h LEU 271 Ca 0.15 -0.05 -0.03 0.00 0.84 0.00 0.00 57.88 58.79 1k9z h LEU 271 Cb 0.52 -0.02 -0.01 0.00 0.37 0.00 0.00 40.66 41.53 1k9z h LEU 271 CO 0.03 0.10 -0.13 0.00 -0.34 0.00 0.00 178.44 178.09 1k9z h ALA 272 N 0.98 1.72 0.00 1.25 0.00 -0.82 -1.68 119.26 120.71 1k9z h ALA 272 Ca 0.02 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.79 1k9z h ALA 272 Cb 0.04 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1k9z h ALA 272 CO -0.00 0.21 0.00 1.25 0.00 0.00 0.00 179.25 180.71 1k9z h LEU 273 N 0.05 0.00 -0.02 0.00 6.46 -0.95 -2.85 115.31 117.99 1k9z h LEU 273 Ca 0.01 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.77 1k9z h LEU 273 Cb 0.27 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 40.20 1k9z h LEU 273 CO 0.02 0.00 0.00 0.61 -0.62 0.00 0.00 178.44 178.45 1k9z n GLY 274 N 1.10 1.05 0.31 3.75 0.00 -0.63 -4.63 105.19 106.14 1k9z n GLY 274 Ca 0.04 -0.51 0.10 0.00 0.00 0.00 0.00 46.02 45.64 1k9z n GLY 274 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1k9z n LEU 275 N -0.01 1.58 -3.95 0.99 4.77 -0.40 -4.52 117.00 115.46 1k9z n LEU 275 Ca 0.00 -0.68 -0.10 0.00 -0.03 0.00 0.00 56.01 55.19 1k9z n LEU 275 Cb 0.29 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.36 1k9z n LEU 275 CO 0.00 0.31 0.31 0.00 -1.33 0.00 0.00 177.39 176.68 1k9z s ALA 276 N -2.42 -0.21 0.00 -1.18 0.00 -1.24 -4.94 121.76 111.77 1k9z s ALA 276 Ca 0.14 -0.96 0.00 0.00 0.00 0.00 0.00 51.96 51.13 1k9z s ALA 276 Cb 0.16 0.95 0.00 0.00 0.00 0.00 0.00 23.12 24.22 1k9z s ALA 276 CO 0.59 -0.90 0.00 -0.25 0.00 0.00 0.00 175.76 175.20 1k9z n ASP 277 N -1.01 4.10 -3.70 0.00 8.00 -0.06 -4.57 116.55 119.30 1k9z n ASP 277 Ca -0.03 0.00 -0.14 0.00 0.71 0.00 0.00 54.79 55.33 1k9z n ASP 277 Cb 0.61 0.36 -0.14 0.00 -0.02 0.00 0.00 41.12 41.93 1k9z n ASP 277 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1k9z s VAL 278 N -1.84 -0.19 -0.19 2.53 1.01 -1.06 -1.41 120.40 119.25 1k9z s VAL 278 Ca 0.00 0.23 -0.06 0.00 0.00 0.00 0.00 61.98 62.15 1k9z s VAL 278 Cb 0.00 -0.36 -0.03 0.00 0.00 0.00 0.00 36.38 35.99 1k9z s VAL 278 CO 0.00 0.10 0.04 -0.47 0.00 0.00 0.00 175.10 174.76 1k9z s TYR 279 N 1.76 3.16 -0.14 5.22 5.04 0.74 -0.22 117.35 132.90 1k9z s TYR 279 Ca -0.04 -0.13 0.02 0.00 -2.44 0.00 0.00 57.07 54.49 1k9z s TYR 279 Cb -0.11 -2.08 0.01 0.00 0.35 0.00 0.00 41.96 40.13 1k9z s TYR 279 CO -0.08 -0.00 -0.22 -0.51 -1.34 0.00 0.00 175.55 173.40 1k9z s LEU 280 N 0.62 2.11 -0.37 6.97 1.43 -0.78 -1.79 118.68 126.88 1k9z s LEU 280 Ca 0.02 -0.60 0.01 0.00 -1.03 0.00 0.00 54.13 52.52 1k9z s LEU 280 Cb -0.13 -1.45 0.14 0.00 0.03 0.00 0.00 46.19 44.78 1k9z s LEU 280 CO 0.02 0.08 0.22 -0.60 0.23 0.00 0.00 176.35 176.30 1k9z s ARG 281 N 0.81 0.68 0.13 1.70 3.52 -0.21 -4.58 118.95 121.00 1k9z s ARG 281 Ca -0.07 -1.47 -0.20 0.00 -0.13 0.00 0.00 55.73 53.86 1k9z s ARG 281 Cb -0.16 -1.46 -0.07 0.00 -1.56 0.00 0.00 34.95 31.70 1k9z s ARG 281 CO -0.02 -1.21 0.64 -0.51 -0.81 0.00 0.00 175.30 173.38 1k9z s LEU 282 N 0.91 4.48 0.29 -0.88 1.02 -1.26 -0.77 118.68 122.47 1k9z s LEU 282 Ca 0.19 1.35 -0.29 0.00 0.02 0.00 0.00 54.13 55.39 1k9z s LEU 282 Cb -0.22 -3.15 -0.10 0.00 0.02 0.00 0.00 46.19 42.75 1k9z s LEU 282 CO -0.00 0.20 1.20 -2.16 0.02 0.00 0.00 176.35 175.60 1k9z s PRO 283 N -1.38 4.51 -0.09 1.29 0.04 -1.26 -0.96 135.00 137.14 1k9z s PRO 283 Ca 0.34 1.98 -0.20 0.00 0.04 0.00 0.00 61.00 63.16 1k9z s PRO 283 Cb -0.19 -3.15 -0.16 0.00 0.04 0.00 0.00 34.50 31.04 1k9z s PRO 283 CO 0.21 0.01 0.67 0.82 0.04 0.00 0.00 177.00 178.75 1k9z h ILE 284 N 3.16 1.05 -3.29 0.56 2.04 -1.88 -3.41 117.51 115.74 1k9z h ILE 284 Ca -0.47 -1.56 -0.63 0.00 1.00 0.00 0.00 64.86 63.20 1k9z h ILE 284 Cb 1.22 1.90 -0.18 0.00 -0.74 0.00 0.00 36.82 39.02 1k9z h ILE 284 CO 0.67 0.32 -0.61 -0.54 0.00 0.00 0.00 178.15 178.00 1k9z s LYS 285 N -2.61 3.81 0.00 2.37 1.02 -1.26 -4.98 119.74 118.09 1k9z s LYS 285 Ca -0.12 -0.42 0.21 0.00 0.02 0.00 0.00 55.97 55.65 1k9z s LYS 285 Cb -0.01 -3.07 0.91 0.00 -0.52 0.00 0.00 37.83 35.14 1k9z s LYS 285 CO 0.46 0.28 1.66 1.28 -0.92 0.00 0.00 175.35 178.12 1k9z n LEU 286 N 3.47 0.00 0.14 3.17 4.77 -1.26 -1.65 117.00 125.64 1k9z n LEU 286 Ca -0.17 0.47 0.13 0.00 -0.03 0.00 0.00 56.01 56.40 1k9z n LEU 286 Cb 0.52 -0.47 0.30 0.00 -2.33 0.00 0.00 43.42 41.45 1k9z n LEU 286 CO 0.34 -0.14 0.82 0.77 -1.33 0.00 0.00 177.39 177.85 1k9z h SER 287 N 0.00 0.00 -3.02 -1.43 4.64 -2.00 -3.47 113.55 108.28 1k9z h SER 287 Ca 0.00 -0.01 -0.53 0.00 -0.47 0.00 0.00 61.79 60.78 1k9z h SER 287 Cb 0.33 0.00 0.03 0.00 -0.31 0.00 0.00 62.40 62.45 1k9z h SER 287 CO 0.00 0.00 0.73 -0.47 -0.87 0.00 0.00 176.83 176.22 1k9z s TYR 288 N -3.15 3.23 -0.24 4.77 5.04 -0.66 -5.01 117.35 121.34 1k9z s TYR 288 Ca 0.09 0.95 -0.05 0.00 -2.44 0.00 0.00 57.07 55.62 1k9z s TYR 288 Cb 0.10 -3.69 -0.01 0.00 0.35 0.00 0.00 41.96 38.71 1k9z s TYR 288 CO 0.63 -2.41 0.01 -0.65 -1.34 0.00 0.00 175.55 171.79 1k9z s GLN 289 N 1.03 3.37 0.43 4.97 -0.21 -1.26 -4.83 119.66 123.16 1k9z s GLN 289 Ca 0.64 -0.65 -0.26 0.00 0.02 0.00 0.00 55.36 55.12 1k9z s GLN 289 Cb -0.37 -3.15 -0.09 0.00 1.00 0.00 0.00 33.01 30.39 1k9z s GLN 289 CO 0.31 -0.25 1.43 0.39 -2.12 0.00 0.00 175.29 175.04 1k9z n GLU 290 N 4.83 2.31 -2.83 2.91 -0.58 -1.25 -4.72 120.64 121.31 1k9z n GLU 290 Ca -0.17 0.82 -0.38 0.00 -0.42 0.00 0.00 57.16 57.01 1k9z n GLU 290 Cb 0.50 -2.61 -0.06 0.00 -0.57 0.00 0.00 31.44 28.70 1k9z n GLU 290 CO 0.00 0.00 0.00 0.15 -0.48 0.00 0.00 177.13 176.80 1k9z s LYS 291 N -2.33 4.66 0.44 3.49 -0.14 -1.26 -0.03 119.74 124.56 1k9z s LYS 291 Ca 0.59 1.32 0.13 0.00 -1.36 0.00 0.00 55.97 56.65 1k9z s LYS 291 Cb -0.46 -3.06 0.97 0.00 -1.68 0.00 0.00 37.83 33.60 1k9z s LYS 291 CO 0.59 0.42 2.00 -0.84 -0.76 0.00 0.00 175.35 176.77 1k9z h ILE 292 N 2.93 1.12 0.00 2.17 3.07 -1.36 -1.78 117.51 123.66 1k9z h ILE 292 Ca -0.46 -0.53 0.00 0.00 1.55 0.00 0.00 64.86 65.42 1k9z h ILE 292 Cb 1.20 1.17 0.00 0.00 -0.27 0.00 0.00 36.82 38.92 1k9z h ILE 292 CO 0.66 0.16 0.00 -2.67 -1.05 0.00 0.00 178.15 175.25 1k9z n TRP 293 N -4.36 0.58 1.21 0.16 2.14 -1.26 -0.95 117.44 114.96 1k9z n TRP 293 Ca -0.02 0.21 0.14 0.00 2.07 0.00 0.00 57.50 59.90 1k9z n TRP 293 Cb 0.21 -0.83 0.67 0.00 -0.81 0.00 0.00 31.31 30.55 1k9z n TRP 293 CO 0.00 0.00 0.00 -0.25 2.07 0.00 0.00 177.69 179.51 1k9z n ASP 294 N -2.01 0.03 0.00 -0.67 8.00 -0.67 -4.39 116.55 116.85 1k9z n ASP 294 Ca 0.04 0.15 0.00 0.00 0.71 0.00 0.00 54.79 55.69 1k9z n ASP 294 Cb 0.28 -0.37 0.00 0.00 -0.02 0.00 0.00 41.12 41.01 1k9z n ASP 294 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 1k9z n HIS 295 N -1.38 0.00 0.08 1.24 8.25 -0.66 -4.79 115.22 117.96 1k9z n HIS 295 Ca 0.11 0.00 -0.13 0.00 -0.26 0.00 0.00 57.72 57.43 1k9z n HIS 295 Cb 0.29 0.00 -0.08 0.00 1.12 0.00 0.00 29.99 31.32 1k9z n HIS 295 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1k9z h ALA 296 N 0.00 -0.16 -0.85 -1.41 0.00 -1.25 -1.31 119.26 114.28 1k9z h ALA 296 Ca 0.00 -0.12 0.01 0.00 0.00 0.00 0.00 54.91 54.80 1k9z h ALA 296 Cb 0.00 0.06 -0.04 0.00 0.00 0.00 0.00 17.79 17.81 1k9z h ALA 296 CO 0.00 -0.49 0.56 0.00 0.00 0.00 0.00 179.25 179.32 1k9z h ALA 297 N 0.50 1.08 -0.42 0.00 0.00 -1.85 -2.15 119.26 116.42 1k9z h ALA 297 Ca -0.02 -0.07 -0.04 0.00 0.00 0.00 0.00 54.91 54.78 1k9z h ALA 297 Cb 0.29 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 1k9z h ALA 297 CO 0.03 0.50 0.08 0.78 0.00 0.00 0.00 179.25 180.63 1k9z h GLY 298 N 1.16 0.68 0.49 0.00 0.00 -1.88 -2.76 103.07 100.76 1k9z h GLY 298 Ca 0.31 -0.38 0.03 0.00 0.00 0.00 0.00 47.33 47.29 1k9z h GLY 298 CO -0.07 0.36 -0.18 -0.57 0.00 0.00 0.00 176.54 176.08 1k9z h ASN 299 N 0.62 -0.54 0.41 0.19 -0.73 -0.54 0.71 115.58 115.69 1k9z h ASN 299 Ca 0.14 0.09 -0.18 0.00 1.87 0.00 0.00 56.30 58.21 1k9z h ASN 299 Cb 0.27 0.24 -0.01 0.00 0.27 0.00 0.00 38.32 39.10 1k9z h ASN 299 CO 0.00 -0.24 -0.78 1.62 -0.37 0.00 0.00 177.43 177.67 1k9z h VAL 300 N -0.26 1.43 -0.16 2.57 3.04 -1.54 -1.86 116.25 119.47 1k9z h VAL 300 Ca 0.08 -2.31 -0.01 0.00 -1.01 0.00 0.00 66.70 63.44 1k9z h VAL 300 Cb 0.37 2.25 -0.01 0.00 -2.01 0.00 0.00 31.29 31.89 1k9z h VAL 300 CO -0.22 0.68 0.05 0.40 -1.01 0.00 0.00 177.57 177.48 1k9z h ILE 301 N 0.19 1.18 -0.46 3.17 2.04 -1.24 -0.40 117.51 121.99 1k9z h ILE 301 Ca -0.03 -0.57 0.00 0.00 1.00 0.00 0.00 64.86 65.26 1k9z h ILE 301 Cb 1.36 1.26 -0.02 0.00 -0.74 0.00 0.00 36.82 38.68 1k9z h ILE 301 CO 0.12 0.18 0.30 0.58 0.00 0.00 0.00 178.15 179.33 1k9z h VAL 302 N 0.08 1.12 -0.19 1.67 2.07 -0.87 -0.98 116.25 119.14 1k9z h VAL 302 Ca 0.05 -0.21 0.03 0.00 0.82 0.00 0.00 66.70 67.39 1k9z h VAL 302 Cb 0.23 0.44 -0.03 0.00 -1.52 0.00 0.00 31.29 30.41 1k9z h VAL 302 CO -0.00 0.11 0.00 -0.74 0.02 0.00 0.00 177.57 176.96 1k9z h HIS 303 N 0.62 -0.00 0.00 1.57 -0.00 -1.13 -0.52 115.15 115.68 1k9z h HIS 303 Ca 0.17 0.01 -0.04 0.00 -0.00 0.00 0.00 60.37 60.51 1k9z h HIS 303 Cb -0.07 0.03 -0.01 0.00 -0.00 0.00 0.00 27.41 27.36 1k9z h HIS 303 CO -0.04 -0.02 -0.19 0.93 -0.00 0.00 0.00 177.93 178.61 1k9z h GLU 304 N 0.07 0.00 -0.05 5.26 4.39 -0.87 -1.24 114.58 122.14 1k9z h GLU 304 Ca 0.09 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.79 1k9z h GLU 304 Cb 0.11 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.76 1k9z h GLU 304 CO -0.15 0.19 0.00 0.00 -1.16 0.00 0.00 179.01 177.89 1k9z n ALA 305 N -2.22 2.60 -0.55 3.43 0.00 -0.39 -3.85 120.51 119.52 1k9z n ALA 305 Ca -0.00 -0.31 0.00 0.00 0.00 0.00 0.00 53.44 53.13 1k9z n ALA 305 Cb 0.38 -1.27 0.00 0.00 0.00 0.00 0.00 19.45 18.56 1k9z n ALA 305 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1k9z n GLY 306 N 1.01 0.70 1.71 0.00 0.00 -0.47 -0.63 105.19 107.51 1k9z n GLY 306 Ca 0.18 -0.22 -0.10 0.00 0.00 0.00 0.00 46.02 45.88 1k9z n GLY 306 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1k9z n GLY 307 N -2.55 1.11 3.18 -0.02 0.00 -0.24 -4.74 105.19 101.92 1k9z n GLY 307 Ca 0.00 -2.05 -0.25 0.00 0.00 0.00 0.00 46.02 43.72 1k9z n GLY 307 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1k9z s ILE 308 N -1.02 1.44 -0.10 -0.61 1.01 -0.30 -4.42 121.20 117.20 1k9z s ILE 308 Ca 0.28 -0.80 -0.03 0.00 0.00 0.00 0.00 60.65 60.10 1k9z s ILE 308 Cb -0.02 -1.20 0.04 0.00 0.01 0.00 0.00 42.46 41.30 1k9z s ILE 308 CO 0.19 0.39 0.07 -2.28 0.00 0.00 0.00 174.94 173.30 1k9z s HIS 309 N -0.45 0.18 0.29 3.97 2.46 -1.26 -1.07 115.29 119.40 1k9z s HIS 309 Ca 0.07 -0.05 0.06 0.00 0.47 0.00 0.00 55.06 55.61 1k9z s HIS 309 Cb -0.07 -0.61 -0.02 0.00 -0.13 0.00 0.00 32.58 31.75 1k9z s HIS 309 CO -0.01 -0.35 0.22 0.25 -2.47 0.00 0.00 174.74 172.39 1k9z n THR 310 N 5.27 0.00 -0.84 0.89 -2.24 -0.23 -4.00 114.28 113.13 1k9z n THR 310 Ca -0.05 -2.05 -0.12 0.00 -2.27 0.00 0.00 64.05 59.56 1k9z n THR 310 Cb 0.49 0.99 0.10 0.00 -2.10 0.00 0.00 70.33 69.81 1k9z n THR 310 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1k9z n ASP 311 N -1.86 -1.18 -0.89 3.42 5.75 -0.92 -1.00 116.55 119.87 1k9z n ASP 311 Ca 0.05 -0.85 0.10 0.00 -0.01 0.00 0.00 54.79 54.08 1k9z n ASP 311 Cb 0.51 -0.41 0.14 0.00 -1.03 0.00 0.00 41.12 40.33 1k9z n ASP 311 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1k9z n ALA 312 N -3.69 2.42 0.01 2.12 0.00 -0.48 -3.43 120.51 117.45 1k9z n ALA 312 Ca -0.09 -0.85 0.00 0.00 0.00 0.00 0.00 53.44 52.51 1k9z n ALA 312 Cb 0.24 -0.70 0.00 0.00 0.00 0.00 0.00 19.45 18.99 1k9z n ALA 312 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 1k9z n MET 313 N 1.16 0.00 0.09 0.00 2.81 -1.25 -3.71 117.12 116.22 1k9z n MET 313 Ca 0.14 0.00 0.12 0.00 -1.81 0.00 0.00 57.70 56.15 1k9z n MET 313 Cb 0.51 -0.26 0.11 0.00 -0.71 0.00 0.00 33.22 32.87 1k9z n MET 313 CO 0.00 0.00 0.00 0.93 1.51 0.00 0.00 175.97 178.41 1k9z h GLU 314 N 0.00 0.00 -4.14 0.03 5.08 -1.89 -3.42 114.58 110.24 1k9z h GLU 314 Ca 0.00 0.00 -0.25 0.00 -1.00 0.00 0.00 59.36 58.11 1k9z h GLU 314 Cb 0.47 0.00 0.09 0.00 0.50 0.00 0.00 28.75 29.81 1k9z h GLU 314 CO 0.00 0.00 -0.44 -3.47 -1.00 0.00 0.00 179.01 174.10 1k9z n ASP 315 N -2.40 -4.40 -4.62 1.42 2.03 -1.26 -5.04 116.55 102.27 1k9z n ASP 315 Ca 0.02 -0.35 -0.28 0.00 0.52 0.00 0.00 54.79 54.70 1k9z n ASP 315 Cb 0.49 -3.42 -0.09 0.00 -0.72 0.00 0.00 41.12 37.38 1k9z n ASP 315 CO 0.00 0.00 0.00 0.68 -1.92 0.00 0.00 177.20 175.96 1k9z s VAL 316 N -3.21 3.56 0.59 5.18 -7.23 -1.26 -4.95 120.40 113.08 1k9z s VAL 316 Ca 0.32 -1.34 -0.19 0.00 -1.81 0.00 0.00 61.98 58.96 1k9z s VAL 316 Cb -0.14 -2.73 -0.03 0.00 0.56 0.00 0.00 36.38 34.04 1k9z s VAL 316 CO 0.47 0.01 1.24 -2.84 -0.31 0.00 0.00 175.10 173.67 1k9z s PRO 317 N -2.56 2.93 0.31 4.82 0.02 -1.26 -2.16 135.00 137.09 1k9z s PRO 317 Ca 0.25 1.93 -0.29 0.00 0.02 0.00 0.00 61.00 62.91 1k9z s PRO 317 Cb -0.10 -1.97 -0.10 0.00 0.02 0.00 0.00 34.50 32.35 1k9z s PRO 317 CO 0.16 -1.26 1.15 -0.51 -0.33 0.00 0.00 177.00 176.21 1k9z s LEU 318 N -4.03 4.47 -0.41 -5.54 1.43 -1.26 -4.77 118.68 108.57 1k9z s LEU 318 Ca 0.77 2.36 -0.07 0.00 -1.03 0.00 0.00 54.13 56.16 1k9z s LEU 318 Cb -0.33 -3.70 0.09 0.00 0.03 0.00 0.00 46.19 42.27 1k9z s LEU 318 CO 0.36 -0.30 0.23 -0.62 0.23 0.00 0.00 176.35 176.25 1k9z s ASP 319 N -0.86 5.49 -0.08 2.29 2.15 -1.26 -4.96 116.67 119.44 1k9z s ASP 319 Ca 0.47 -1.64 0.05 0.00 0.43 0.00 0.00 52.55 51.87 1k9z s ASP 319 Cb -0.33 -1.93 0.30 0.00 -0.30 0.00 0.00 42.92 40.66 1k9z s ASP 319 CO 0.43 -0.53 0.96 0.49 -0.17 0.00 0.00 175.17 176.34 1k9z n PHE 320 N 4.82 0.75 -0.99 -5.34 3.72 -1.17 -3.90 117.46 115.35 1k9z n PHE 320 Ca -0.08 -0.26 0.09 0.00 -0.05 0.00 0.00 57.45 57.15 1k9z n PHE 320 Cb 0.42 -0.24 0.20 0.00 -0.94 0.00 0.00 39.48 38.92 1k9z n PHE 320 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1k9z n GLY 321 N 0.24 4.35 0.88 1.37 0.00 -1.19 -4.62 105.19 106.21 1k9z n GLY 321 Ca 0.10 -1.05 0.11 0.00 0.00 0.00 0.00 46.02 45.18 1k9z n GLY 321 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1k9z n ASN 322 N -0.88 2.63 0.00 1.61 2.85 -1.25 -2.31 115.26 117.91 1k9z n ASN 322 Ca 0.19 -1.87 0.00 0.00 -0.11 0.00 0.00 54.58 52.79 1k9z n ASN 322 Cb 0.77 -0.16 0.00 0.00 1.24 0.00 0.00 39.78 41.62 1k9z n ASN 322 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1k9z n GLY 323 N 1.33 0.20 0.03 8.20 0.00 -1.26 -4.59 105.19 109.09 1k9z n GLY 323 Ca 0.18 -1.93 0.12 0.00 0.00 0.00 0.00 46.02 44.39 1k9z n GLY 323 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1k9z n ARG 324 N 0.00 0.06 -4.37 1.61 1.74 -1.13 -4.40 116.66 110.17 1k9z n ARG 324 Ca 0.00 0.13 -0.19 0.00 -0.77 0.00 0.00 57.85 57.02 1k9z n ARG 324 Cb 0.00 -1.58 -0.10 0.00 -1.02 0.00 0.00 32.46 29.75 1k9z n ARG 324 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 1k9z s THR 325 N -3.04 1.74 -0.08 0.55 -4.23 -1.26 -0.97 115.64 108.35 1k9z s THR 325 Ca 0.11 -2.20 -0.15 0.00 -1.18 0.00 0.00 61.69 58.27 1k9z s THR 325 Cb 0.15 -2.16 -0.05 0.00 1.34 0.00 0.00 72.50 71.78 1k9z s THR 325 CO 0.47 -0.51 0.39 -0.76 -0.54 0.00 0.00 174.62 173.66 1k9z s LEU 326 N -3.36 4.36 0.41 4.79 1.43 0.95 -4.52 118.68 122.75 1k9z s LEU 326 Ca 0.25 0.79 0.23 0.00 -1.03 0.00 0.00 54.13 54.36 1k9z s LEU 326 Cb 0.00 -2.54 0.33 0.00 0.03 0.00 0.00 46.19 44.01 1k9z s LEU 326 CO 0.08 0.19 1.57 0.00 0.23 0.00 0.00 176.35 178.42 1k9z h ALA 327 N 5.75 0.96 -3.69 4.21 0.00 -1.88 -3.33 119.26 121.27 1k9z h ALA 327 Ca -0.46 0.00 -0.40 0.00 0.00 0.00 0.00 54.91 54.04 1k9z h ALA 327 Cb 1.20 0.00 0.17 0.00 0.00 0.00 0.00 17.79 19.16 1k9z h ALA 327 CO 0.69 0.00 0.31 0.25 0.00 0.00 0.00 179.25 180.50 1k9z n THR 328 N -3.03 0.00 -3.95 0.00 -2.24 -1.26 -5.05 114.28 98.75 1k9z n THR 328 Ca 0.04 -0.79 -0.35 0.00 -2.27 0.00 0.00 64.05 60.68 1k9z n THR 328 Cb 0.53 -1.44 -0.14 0.00 -2.10 0.00 0.00 70.33 67.18 1k9z n THR 328 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1k9z s LYS 329 N -5.66 3.16 0.15 -0.78 -0.14 -1.26 -4.70 119.74 110.51 1k9z s LYS 329 Ca 0.71 -0.76 0.00 0.00 -1.36 0.00 0.00 55.97 54.56 1k9z s LYS 329 Cb -0.03 -2.96 0.00 0.00 -1.68 0.00 0.00 37.83 33.16 1k9z s LYS 329 CO 0.51 -0.27 0.00 0.41 -0.76 0.00 0.00 175.35 175.24 1k9z n GLY 330 N 4.74 -1.64 3.03 -3.33 0.00 -1.26 -1.38 105.19 105.35 1k9z n GLY 330 Ca -0.18 -1.37 -0.13 0.00 0.00 0.00 0.00 46.02 44.34 1k9z n GLY 330 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1k9z s VAL 331 N -1.67 -0.02 -0.04 1.61 1.01 0.05 -3.04 120.40 118.30 1k9z s VAL 331 Ca 0.00 0.08 0.02 0.00 0.00 0.00 0.00 61.98 62.08 1k9z s VAL 331 Cb 0.00 -0.28 0.01 0.00 0.00 0.00 0.00 36.38 36.11 1k9z s VAL 331 CO 0.00 0.03 -0.09 -0.63 0.00 0.00 0.00 175.10 174.41 1k9z s ILE 332 N 0.62 0.84 0.12 2.22 1.01 -0.17 -1.05 121.20 124.79 1k9z s ILE 332 Ca -0.04 -0.35 0.08 0.00 0.00 0.00 0.00 60.65 60.34 1k9z s ILE 332 Cb -0.06 -0.78 -0.04 0.00 0.01 0.00 0.00 42.46 41.59 1k9z s ILE 332 CO -0.03 0.28 -0.20 0.00 0.00 0.00 0.00 174.94 174.98 1k9z s ALA 333 N 0.52 1.84 0.31 9.38 0.00 -0.74 -1.07 121.76 132.00 1k9z s ALA 333 Ca -0.09 -1.30 -0.09 0.00 0.00 0.00 0.00 51.96 50.48 1k9z s ALA 333 Cb -0.12 -0.23 0.01 0.00 0.00 0.00 0.00 23.12 22.78 1k9z s ALA 333 CO 0.01 0.33 0.53 -1.54 0.00 0.00 0.00 175.76 175.10 1k9z s SER 334 N -2.08 0.34 0.00 0.00 1.04 -0.24 -0.19 113.70 112.58 1k9z s SER 334 Ca 0.08 -1.19 0.28 0.00 0.48 0.00 0.00 55.95 55.60 1k9z s SER 334 Cb -0.09 0.67 1.43 0.00 0.10 0.00 0.00 66.02 68.13 1k9z s SER 334 CO 0.05 -1.30 1.97 -1.54 0.98 0.00 0.00 173.24 173.40 1k9z n SER 335 N -0.98 0.00 -0.32 7.02 3.41 -0.50 -1.15 113.62 121.09 1k9z n SER 335 Ca -0.02 -0.15 0.00 0.00 -0.26 0.00 0.00 58.87 58.45 1k9z n SER 335 Cb 0.61 -0.27 0.00 0.00 -0.26 0.00 0.00 64.21 64.29 1k9z n SER 335 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1k9z n GLY 336 N 1.09 -1.66 3.12 5.00 0.00 -1.26 -4.68 105.19 106.79 1k9z n GLY 336 Ca 0.14 -1.27 -0.26 0.00 0.00 0.00 0.00 46.02 44.62 1k9z n GLY 336 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1k9z n PRO 337 N -0.65 -2.42 -0.28 1.61 -0.04 -1.26 -4.78 135.00 127.18 1k9z n PRO 337 Ca 0.00 -1.58 0.10 0.00 -0.04 0.00 0.00 63.50 61.98 1k9z n PRO 337 Cb 0.00 -1.36 0.26 0.00 -0.04 0.00 0.00 33.50 32.35 1k9z n PRO 337 CO 0.00 0.00 0.00 -0.09 -0.04 0.00 0.00 175.50 175.37 1k9z h ARG 338 N 0.00 0.27 -0.35 0.54 2.43 -1.99 -1.13 114.38 114.15 1k9z h ARG 338 Ca -0.36 -0.02 -0.09 0.00 -0.81 0.00 0.00 59.98 58.70 1k9z h ARG 338 Cb 1.07 -0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 30.55 1k9z h ARG 338 CO 0.24 0.18 -0.16 0.93 -1.51 0.00 0.00 179.97 179.65 1k9z h GLU 339 N 0.28 0.62 -0.15 0.20 3.07 -1.99 0.11 114.58 116.72 1k9z h GLU 339 Ca 0.51 -0.21 -0.11 0.00 -0.50 0.00 0.00 59.36 59.05 1k9z h GLU 339 Cb 0.96 -0.05 0.00 0.00 -0.84 0.00 0.00 28.75 28.82 1k9z h GLU 339 CO -0.58 0.76 -0.34 1.25 -1.40 0.00 0.00 179.01 178.69 1k9z h LEU 340 N 0.56 0.56 -0.33 1.33 7.12 -1.57 -1.94 115.31 121.05 1k9z h LEU 340 Ca 0.09 -0.57 0.03 0.00 0.13 0.00 0.00 57.88 57.56 1k9z h LEU 340 Cb 0.59 -0.16 -0.03 0.00 -0.53 0.00 0.00 40.66 40.53 1k9z h LEU 340 CO 0.04 1.03 0.15 -0.74 -0.13 0.00 0.00 178.44 178.79 1k9z h HIS 341 N 0.12 0.28 -0.77 1.25 2.76 -0.93 -1.01 115.15 116.84 1k9z h HIS 341 Ca -0.00 0.01 -0.01 0.00 -2.20 0.00 0.00 60.37 58.17 1k9z h HIS 341 Cb 0.95 -0.08 -0.04 0.00 1.55 0.00 0.00 27.41 29.79 1k9z h HIS 341 CO 0.10 0.14 0.43 -0.44 -1.30 0.00 0.00 177.93 176.86 1k9z h ASP 342 N 0.32 0.96 -0.30 3.26 3.32 -0.78 -0.97 116.42 122.22 1k9z h ASP 342 Ca 0.14 -0.08 0.00 0.00 0.02 0.00 0.00 57.03 57.12 1k9z h ASP 342 Cb 0.07 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.36 1k9z h ASP 342 CO -0.11 0.77 0.20 0.25 -1.72 0.00 0.00 179.24 178.62 1k9z h LEU 343 N 1.08 0.34 -0.27 1.55 5.85 -0.76 -0.17 115.31 122.94 1k9z h LEU 343 Ca 0.27 -0.01 -0.00 0.00 0.84 0.00 0.00 57.88 58.98 1k9z h LEU 343 Cb 0.02 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 40.95 1k9z h LEU 343 CO -0.04 0.25 0.16 0.58 -0.34 0.00 0.00 178.44 179.05 1k9z h VAL 344 N 0.40 1.10 -0.47 1.05 2.07 -0.59 -0.77 116.25 119.04 1k9z h VAL 344 Ca 0.11 -0.23 -0.12 0.00 0.82 0.00 0.00 66.70 67.28 1k9z h VAL 344 Cb -0.05 0.77 -0.02 0.00 -1.52 0.00 0.00 31.29 30.48 1k9z h VAL 344 CO -0.02 0.10 -0.17 0.58 0.02 0.00 0.00 177.57 178.07 1k9z h VAL 345 N 0.34 1.27 -0.05 2.57 2.07 -1.10 -1.53 116.25 119.81 1k9z h VAL 345 Ca 0.10 -1.32 -0.10 0.00 0.82 0.00 0.00 66.70 66.20 1k9z h VAL 345 Cb 0.02 1.09 -0.01 0.00 -1.52 0.00 0.00 31.29 30.86 1k9z h VAL 345 CO -0.02 0.45 -0.45 0.77 0.02 0.00 0.00 177.57 178.35 1k9z h SER 346 N 0.81 0.12 -0.50 0.57 4.64 -0.80 -0.19 113.55 118.20 1k9z h SER 346 Ca 0.12 -0.05 -0.06 0.00 -0.47 0.00 0.00 61.79 61.32 1k9z h SER 346 Cb 0.72 -0.03 -0.02 0.00 -0.31 0.00 0.00 62.40 62.76 1k9z h SER 346 CO 0.06 0.55 0.07 0.74 -0.87 0.00 0.00 176.83 177.38 1k9z h THR 347 N 0.09 1.25 0.01 2.95 2.02 -0.92 -0.69 112.91 117.62 1k9z h THR 347 Ca 0.00 -0.95 0.00 0.00 0.77 0.00 0.00 66.41 66.24 1k9z h THR 347 Cb 0.84 0.89 -0.00 0.00 -1.74 0.00 0.00 68.15 68.13 1k9z h THR 347 CO 0.06 0.34 -0.01 -1.28 0.37 0.00 0.00 175.52 175.00 1k9z h SER 348 N 0.72 -0.03 -0.44 4.18 0.87 -0.89 -0.11 113.55 117.84 1k9z h SER 348 Ca 0.15 0.00 0.09 0.00 -1.23 0.00 0.00 61.79 60.81 1k9z h SER 348 Cb 0.41 0.01 -0.09 0.00 -0.44 0.00 0.00 62.40 62.30 1k9z h SER 348 CO 0.01 -0.02 -0.12 0.00 -0.53 0.00 0.00 176.83 176.17 1k9z h ASP 350 N -0.02 0.83 -0.14 0.00 3.58 -0.82 0.11 116.42 119.97 1k9z h ASP 350 Ca 0.21 -0.25 0.01 0.00 0.42 0.00 0.00 57.03 57.42 1k9z h ASP 350 Cb 0.34 -0.22 -0.01 0.00 1.72 0.00 0.00 39.33 41.16 1k9z h ASP 350 CO -0.47 0.86 0.08 0.58 -2.88 0.00 0.00 179.24 177.41 1k9z h VAL 351 N 0.76 1.01 -0.70 2.25 2.07 -0.63 -1.45 116.25 119.56 1k9z h VAL 351 Ca 0.16 -0.06 -0.04 0.00 0.82 0.00 0.00 66.70 67.59 1k9z h VAL 351 Cb 0.38 0.84 -0.03 0.00 -1.52 0.00 0.00 31.29 30.95 1k9z h VAL 351 CO 0.01 0.03 0.27 0.40 0.02 0.00 0.00 177.57 178.30 1k9z h ILE 352 N 0.16 1.25 0.00 4.57 2.04 -0.80 -2.49 117.51 122.24 1k9z h ILE 352 Ca 0.05 -0.80 -0.04 0.00 1.00 0.00 0.00 64.86 65.08 1k9z h ILE 352 Cb -0.00 0.45 -0.01 0.00 -0.74 0.00 0.00 36.82 36.52 1k9z h ILE 352 CO -0.03 0.32 -0.18 1.56 0.00 0.00 0.00 178.15 179.82 1k9z h GLN 353 N 1.01 0.00 -0.02 2.37 1.08 -0.60 -2.76 115.11 116.19 1k9z h GLN 353 Ca 0.23 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.43 1k9z h GLN 353 Cb 0.23 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.66 1k9z h GLN 353 CO -0.02 0.18 0.00 -1.13 -0.95 0.00 0.00 178.83 176.91 1k9z n SER 354 N -4.17 0.30 0.00 1.46 3.41 -0.56 -5.09 113.62 108.97 1k9z n SER 354 Ca -0.02 -1.30 0.00 0.00 -0.26 0.00 0.00 58.87 57.29 1k9z n SER 354 Cb 0.25 -0.01 0.00 0.00 -0.26 0.00 0.00 64.21 64.19 1k9z n SER 354 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42