#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ttj s LYS 3 N 0.00 4.32 0.98 4.33 1.02 -1.26 -5.05 119.74 124.08 1ttj s LYS 3 Ca 0.00 1.26 -0.13 0.00 0.02 0.00 0.00 55.97 57.12 1ttj s LYS 3 Cb 0.00 -2.44 0.18 0.00 -0.52 0.00 0.00 37.83 35.04 1ttj s LYS 3 CO 0.00 0.04 1.13 -1.25 -0.92 0.00 0.00 175.35 174.35 1ttj s PRO 4 N -2.69 0.58 0.17 -1.68 0.04 -1.26 -4.90 135.00 125.27 1ttj s PRO 4 Ca 0.58 0.27 -0.33 0.00 0.04 0.00 0.00 61.00 61.55 1ttj s PRO 4 Cb -0.15 -1.78 -0.14 0.00 0.04 0.00 0.00 34.50 32.47 1ttj s PRO 4 CO 0.19 -2.57 1.46 0.94 0.04 0.00 0.00 177.00 177.06 1ttj n GLN 5 N -4.02 1.89 -2.81 4.56 7.27 -1.26 -4.94 117.38 118.06 1ttj n GLN 5 Ca 0.07 0.68 -0.32 0.00 0.07 0.00 0.00 57.00 57.50 1ttj n GLN 5 Cb 0.59 -2.37 -0.04 0.00 2.41 0.00 0.00 30.24 30.82 1ttj n GLN 5 CO 0.00 0.00 0.00 -1.25 0.07 0.00 0.00 177.06 175.88 1ttj s PRO 6 N 0.34 3.93 0.03 3.69 0.04 -1.26 -4.91 135.00 136.86 1ttj s PRO 6 Ca 0.76 0.71 0.09 0.00 0.04 0.00 0.00 61.00 62.60 1ttj s PRO 6 Cb -0.72 -2.31 -0.03 0.00 0.04 0.00 0.00 34.50 31.48 1ttj s PRO 6 CO 0.44 -0.04 -0.26 0.42 0.04 0.00 0.00 177.00 177.60 1ttj s ILE 7 N -2.31 2.06 -0.33 0.56 1.01 -0.66 -0.66 121.20 120.87 1ttj s ILE 7 Ca 0.55 -1.31 0.02 0.00 0.00 0.00 0.00 60.65 59.90 1ttj s ILE 7 Cb -0.10 -1.76 0.10 0.00 0.01 0.00 0.00 42.46 40.71 1ttj s ILE 7 CO 0.26 0.39 0.08 0.00 0.00 0.00 0.00 174.94 175.66 1ttj s ALA 8 N -0.76 2.21 -0.13 9.38 0.00 -0.28 -1.72 121.76 130.45 1ttj s ALA 8 Ca 0.11 -2.12 -0.03 0.00 0.00 0.00 0.00 51.96 49.92 1ttj s ALA 8 Cb -0.10 -1.80 -0.03 0.00 0.00 0.00 0.00 23.12 21.19 1ttj s ALA 8 CO 0.01 -1.69 -0.01 0.00 0.00 0.00 0.00 175.76 174.07 1ttj s ALA 9 N 1.23 3.15 -0.24 0.00 0.00 0.19 -1.46 121.76 124.63 1ttj s ALA 9 Ca 0.11 -0.81 -0.08 0.00 0.00 0.00 0.00 51.96 51.18 1ttj s ALA 9 Cb -0.18 -1.56 -0.04 0.00 0.00 0.00 0.00 23.12 21.34 1ttj s ALA 9 CO -0.16 0.35 0.10 0.00 0.00 0.00 0.00 175.76 176.04 1ttj s ALA 10 N -0.11 3.30 -0.64 0.00 0.00 0.11 -0.64 121.76 123.78 1ttj s ALA 10 Ca 0.03 -1.04 -0.13 0.00 0.00 0.00 0.00 51.96 50.82 1ttj s ALA 10 Cb -0.13 -2.13 0.16 0.00 0.00 0.00 0.00 23.12 21.02 1ttj s ALA 10 CO 0.02 -0.35 0.57 1.21 0.00 0.00 0.00 175.76 177.21 1ttj s ASN 11 N 1.37 6.26 0.75 0.00 3.84 -0.22 0.25 114.94 127.19 1ttj s ASN 11 Ca 0.06 -2.21 -0.03 0.00 0.21 0.00 0.00 52.86 50.89 1ttj s ASN 11 Cb -0.15 -2.16 0.08 0.00 -0.55 0.00 0.00 41.25 38.48 1ttj s ASN 11 CO 0.05 -0.70 0.52 0.79 -2.79 0.00 0.00 177.10 174.96 1ttj n TRP 12 N 4.62 -3.56 0.00 0.43 8.01 -0.21 -4.59 117.44 122.14 1ttj n TRP 12 Ca -0.02 -0.67 0.00 0.00 -1.31 0.00 0.00 57.50 55.51 1ttj n TRP 12 Cb 0.42 -0.39 0.00 0.00 -2.01 0.00 0.00 31.31 29.34 1ttj n TRP 12 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.69 177.13 1ttj n SER 20 N -3.16 0.00 -0.23 -0.99 2.88 -1.26 -4.31 113.62 106.55 1ttj n SER 20 Ca 0.07 0.00 0.03 0.00 -1.33 0.00 0.00 58.87 57.64 1ttj n SER 20 Cb 0.26 0.00 0.15 0.00 -0.75 0.00 0.00 64.21 63.87 1ttj n SER 20 CO 0.00 0.00 0.00 -0.07 -1.23 0.00 0.00 175.04 173.74 1ttj h LEU 21 N 0.00 0.25 -0.89 2.46 4.07 -1.99 0.43 115.31 119.65 1ttj h LEU 21 Ca 0.00 0.09 -0.09 0.00 0.08 0.00 0.00 57.88 57.96 1ttj h LEU 21 Cb 0.00 0.07 -0.02 0.00 1.08 0.00 0.00 40.66 41.80 1ttj h LEU 21 CO 0.00 0.12 -0.16 0.77 -1.08 0.00 0.00 178.44 178.09 1ttj h SER 22 N 0.43 0.63 -0.65 -0.43 4.64 -2.02 -0.69 113.55 115.47 1ttj h SER 22 Ca 0.36 -0.19 -0.02 0.00 -0.47 0.00 0.00 61.79 61.46 1ttj h SER 22 Cb 0.50 -0.17 -0.03 0.00 -0.31 0.00 0.00 62.40 62.38 1ttj h SER 22 CO -0.36 0.81 0.32 -0.33 -0.87 0.00 0.00 176.83 176.40 1ttj h GLU 23 N 0.58 0.95 -0.14 4.77 5.08 -1.40 0.32 114.58 124.74 1ttj h GLU 23 Ca 0.10 -0.13 -0.20 0.00 -1.00 0.00 0.00 59.36 58.13 1ttj h GLU 23 Cb 0.60 -0.18 0.01 0.00 0.50 0.00 0.00 28.75 29.68 1ttj h GLU 23 CO 0.04 0.74 -0.68 -0.07 -1.00 0.00 0.00 179.01 178.04 1ttj h LEU 24 N 0.95 0.83 -0.32 1.33 3.38 0.25 -2.08 115.31 119.66 1ttj h LEU 24 Ca 0.23 -0.63 0.01 0.00 0.09 0.00 0.00 57.88 57.58 1ttj h LEU 24 Cb 0.10 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.58 1ttj h LEU 24 CO -0.03 1.33 0.19 0.40 0.09 0.00 0.00 178.44 180.42 1ttj h ILE 25 N 0.39 1.04 -0.72 1.22 2.04 -0.70 0.19 117.51 120.97 1ttj h ILE 25 Ca -0.05 -0.13 0.09 0.00 1.00 0.00 0.00 64.86 65.77 1ttj h ILE 25 Cb 1.31 0.62 -0.07 0.00 -0.74 0.00 0.00 36.82 37.94 1ttj h ILE 25 CO 0.14 0.07 0.36 0.44 0.00 0.00 0.00 178.15 179.16 1ttj h ASP 26 N 0.39 0.48 -0.63 1.72 3.32 -0.36 0.35 116.42 121.68 1ttj h ASP 26 Ca 0.13 0.06 -0.07 0.00 0.02 0.00 0.00 57.03 57.17 1ttj h ASP 26 Cb -0.00 -0.02 -0.03 0.00 0.22 0.00 0.00 39.33 39.50 1ttj h ASP 26 CO -0.06 0.27 0.15 0.25 -1.72 0.00 0.00 179.24 178.13 1ttj h LEU 27 N 0.62 0.98 -0.19 1.55 7.12 -0.62 -1.82 115.31 122.95 1ttj h LEU 27 Ca 0.35 -0.21 -0.05 0.00 0.13 0.00 0.00 57.88 58.11 1ttj h LEU 27 Cb 0.36 -0.26 -0.01 0.00 -0.53 0.00 0.00 40.66 40.23 1ttj h LEU 27 CO -0.27 0.96 -0.07 -0.26 -0.13 0.00 0.00 178.44 178.67 1ttj h PHE 28 N 0.99 0.44 -0.54 1.25 0.04 0.14 -2.81 116.94 116.44 1ttj h PHE 28 Ca 0.21 -0.10 0.06 0.00 2.80 0.00 0.00 57.97 60.93 1ttj h PHE 28 Cb 0.37 -0.10 -0.03 0.00 2.20 0.00 0.00 35.95 38.38 1ttj h PHE 28 CO 0.03 0.67 0.36 -0.91 -0.60 0.00 0.00 178.31 177.85 1ttj h ASN 29 N 0.09 0.43 1.01 2.17 2.35 -0.59 -1.84 115.58 119.20 1ttj h ASN 29 Ca 0.05 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.80 1ttj h ASN 29 Cb 0.54 -0.09 0.00 0.00 0.05 0.00 0.00 38.32 38.82 1ttj h ASN 29 CO 0.02 0.28 -0.26 -1.20 -1.65 0.00 0.00 177.43 174.63 1ttj n SER 30 N -4.47 0.51 -4.69 5.81 7.64 -0.72 -4.85 113.62 112.86 1ttj n SER 30 Ca 0.08 0.28 -0.42 0.00 1.01 0.00 0.00 58.87 59.82 1ttj n SER 30 Cb 0.25 -0.27 -0.03 0.00 -1.01 0.00 0.00 64.21 63.14 1ttj n SER 30 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 1ttj s THR 31 N -3.07 4.82 -0.19 0.44 2.01 -0.69 -5.04 115.64 113.92 1ttj s THR 31 Ca 0.10 1.95 -0.20 0.00 0.31 0.00 0.00 61.69 63.85 1ttj s THR 31 Cb 0.15 -4.27 -0.03 0.00 0.01 0.00 0.00 72.50 68.36 1ttj s THR 31 CO 0.63 0.03 0.59 -0.55 -0.69 0.00 0.00 174.62 174.63 1ttj s SER 32 N 1.09 6.66 -0.18 3.53 0.15 -1.26 -5.00 113.70 118.68 1ttj s SER 32 Ca 0.46 0.80 -0.01 0.00 0.70 0.00 0.00 55.95 57.91 1ttj s SER 32 Cb -0.18 -2.33 0.00 0.00 -1.71 0.00 0.00 66.02 61.80 1ttj s SER 32 CO 0.18 -0.22 -0.13 -0.63 1.20 0.00 0.00 173.24 173.64 1ttj s ILE 33 N 1.69 2.74 -1.41 6.45 1.09 -1.26 -4.99 121.20 125.50 1ttj s ILE 33 Ca 0.28 -0.72 0.17 0.00 -1.10 0.00 0.00 60.65 59.27 1ttj s ILE 33 Cb -0.16 -2.19 -0.04 0.00 -1.06 0.00 0.00 42.46 39.02 1ttj s ILE 33 CO 0.11 0.49 0.85 0.59 -0.10 0.00 0.00 174.94 176.88 1ttj n ASN 34 N 4.46 1.52 -4.91 3.58 3.02 -1.26 -4.98 115.26 116.69 1ttj n ASN 34 Ca -0.19 -1.26 -0.21 0.00 -0.03 0.00 0.00 54.58 52.88 1ttj n ASN 34 Cb 0.51 0.57 -0.01 0.00 -0.61 0.00 0.00 39.78 40.23 1ttj n ASN 34 CO 0.00 0.00 0.00 -1.38 -2.62 0.00 0.00 177.26 173.26 1ttj s HIS 35 N -2.09 2.38 -0.85 3.10 -3.43 -1.26 -5.02 115.29 108.13 1ttj s HIS 35 Ca 0.13 -0.57 -0.25 0.00 -0.80 0.00 0.00 55.06 53.56 1ttj s HIS 35 Cb 0.13 -2.14 0.00 0.00 -1.43 0.00 0.00 32.58 29.14 1ttj s HIS 35 CO 0.47 -0.31 1.66 0.34 -2.00 0.00 0.00 174.74 174.90 1ttj s ASP 36 N -4.23 5.76 -0.01 7.38 2.15 -1.26 -4.93 116.67 121.53 1ttj s ASP 36 Ca 0.47 -0.66 -0.02 0.00 0.43 0.00 0.00 52.55 52.77 1ttj s ASP 36 Cb -0.04 -2.56 -0.00 0.00 -0.30 0.00 0.00 42.92 40.03 1ttj s ASP 36 CO 0.28 -2.14 0.05 0.54 -0.17 0.00 0.00 175.17 173.73 1ttj s VAL 37 N 7.56 0.03 -0.30 1.11 0.11 -1.26 -4.17 120.40 123.48 1ttj s VAL 37 Ca 0.56 -0.29 -0.11 0.00 -2.93 0.00 0.00 61.98 59.21 1ttj s VAL 37 Cb -0.06 -0.17 -0.03 0.00 -1.53 0.00 0.00 36.38 34.59 1ttj s VAL 37 CO 0.04 -0.16 0.19 -1.58 -3.33 0.00 0.00 175.10 170.26 1ttj s GLN 38 N -0.48 3.64 -0.02 1.54 2.00 0.16 -4.93 119.66 121.58 1ttj s GLN 38 Ca -0.05 -0.53 -0.06 0.00 -2.00 0.00 0.00 55.36 52.72 1ttj s GLN 38 Cb -0.03 -3.66 -0.04 0.00 0.80 0.00 0.00 33.01 30.07 1ttj s GLN 38 CO 0.00 -0.32 0.22 0.00 -0.50 0.00 0.00 175.29 174.69 1ttj s VAL 40 N -1.25 0.42 -0.27 0.00 1.01 -0.54 -1.56 120.40 118.22 1ttj s VAL 40 Ca 0.25 -0.43 0.02 0.00 0.00 0.00 0.00 61.98 61.82 1ttj s VAL 40 Cb -0.13 -0.40 0.07 0.00 0.00 0.00 0.00 36.38 35.93 1ttj s VAL 40 CO 0.14 -0.02 -0.05 -0.69 0.00 0.00 0.00 175.10 174.48 1ttj s VAL 41 N -0.45 1.90 -0.15 2.92 1.01 0.01 0.06 120.40 125.70 1ttj s VAL 41 Ca -0.01 -1.61 -0.18 0.00 0.00 0.00 0.00 61.98 60.18 1ttj s VAL 41 Cb -0.04 -2.15 -0.04 0.00 0.00 0.00 0.00 36.38 34.15 1ttj s VAL 41 CO -0.00 -0.19 0.49 0.00 0.00 0.00 0.00 175.10 175.40 1ttj s ALA 42 N 1.19 3.51 0.24 5.51 0.00 0.14 -0.47 121.76 131.88 1ttj s ALA 42 Ca -0.03 -0.29 0.03 0.00 0.00 0.00 0.00 51.96 51.66 1ttj s ALA 42 Cb -0.19 -2.71 -0.05 0.00 0.00 0.00 0.00 23.12 20.16 1ttj s ALA 42 CO -0.07 -0.19 0.03 -1.12 0.00 0.00 0.00 175.76 174.41 1ttj s SER 43 N 0.86 1.64 0.50 0.00 0.01 -0.12 -1.04 113.70 115.56 1ttj s SER 43 Ca 0.25 -1.28 -0.18 0.00 1.31 0.00 0.00 55.95 56.05 1ttj s SER 43 Cb -0.15 0.05 -0.08 0.00 0.21 0.00 0.00 66.02 66.05 1ttj s SER 43 CO 0.10 -0.59 1.00 0.42 0.41 0.00 0.00 173.24 174.57 1ttj s THR 44 N -3.53 4.27 0.47 1.44 -4.23 -1.26 -3.28 115.64 109.51 1ttj s THR 44 Ca 0.31 1.21 0.19 0.00 -1.18 0.00 0.00 61.69 62.22 1ttj s THR 44 Cb 0.07 -3.59 0.37 0.00 1.34 0.00 0.00 72.50 70.68 1ttj s THR 44 CO 0.10 -0.50 1.96 0.77 -0.54 0.00 0.00 174.62 176.40 1ttj h SER 45 N 1.16 0.23 -0.54 3.99 4.64 -1.98 -0.27 113.55 120.78 1ttj h SER 45 Ca -0.48 0.01 0.11 0.00 -0.47 0.00 0.00 61.79 60.96 1ttj h SER 45 Cb 1.19 -0.03 -0.11 0.00 -0.31 0.00 0.00 62.40 63.14 1ttj h SER 45 CO 0.60 0.12 -0.17 -1.28 -0.87 0.00 0.00 176.83 175.23 1ttj h SER 46 N 0.25 -0.63 -0.42 4.97 0.87 -2.04 -2.00 113.55 114.55 1ttj h SER 46 Ca 0.31 0.17 0.00 0.00 -1.23 0.00 0.00 61.79 61.05 1ttj h SER 46 Cb 0.89 0.38 0.00 0.00 -0.44 0.00 0.00 62.40 63.23 1ttj h SER 46 CO -0.07 -0.21 0.00 1.41 -0.53 0.00 0.00 176.83 177.43 1ttj n HIS 47 N -5.40 0.55 0.21 2.24 -0.00 -0.50 -4.62 115.22 107.70 1ttj n HIS 47 Ca 0.05 -0.32 -0.17 0.00 -0.00 0.00 0.00 57.72 57.28 1ttj n HIS 47 Cb 0.31 -0.00 -0.09 0.00 -0.00 0.00 0.00 29.99 30.20 1ttj n HIS 47 CO 0.00 0.00 0.00 -0.07 -0.00 0.00 0.00 176.34 176.27 1ttj h LEU 48 N 3.87 -1.37 -0.34 2.41 3.38 -0.30 -1.91 115.31 121.04 1ttj h LEU 48 Ca 0.00 0.13 0.07 0.00 0.09 0.00 0.00 57.88 58.17 1ttj h LEU 48 Cb 0.91 0.48 -0.08 0.00 0.09 0.00 0.00 40.66 42.06 1ttj h LEU 48 CO 0.00 -0.60 -0.16 0.00 0.09 0.00 0.00 178.44 177.77 1ttj h ALA 49 N -0.60 0.11 0.28 1.53 0.00 -1.82 0.16 119.26 118.90 1ttj h ALA 49 Ca -0.03 0.13 0.00 0.00 0.00 0.00 0.00 54.91 55.01 1ttj h ALA 49 Cb 0.80 0.39 -0.04 0.00 0.00 0.00 0.00 17.79 18.94 1ttj h ALA 49 CO -0.15 -0.54 -0.48 1.98 0.00 0.00 0.00 179.25 180.06 1ttj h MET 50 N -0.10 -0.79 -0.83 0.00 1.85 -1.84 -0.14 114.93 113.07 1ttj h MET 50 Ca 0.17 0.05 0.10 0.00 -0.61 0.00 0.00 59.70 59.42 1ttj h MET 50 Cb 0.37 0.18 -0.08 0.00 0.43 0.00 0.00 31.60 32.50 1ttj h MET 50 CO -0.41 -0.53 0.47 1.15 -0.40 0.00 0.00 176.91 177.20 1ttj h THR 51 N -0.82 0.89 -0.88 -0.77 2.02 -1.16 0.33 112.91 112.51 1ttj h THR 51 Ca -0.02 -0.27 0.14 0.00 0.77 0.00 0.00 66.41 67.04 1ttj h THR 51 Cb 0.78 0.04 -0.09 0.00 -1.74 0.00 0.00 68.15 67.14 1ttj h THR 51 CO -0.18 0.14 0.49 0.50 0.37 0.00 0.00 175.52 176.84 1ttj h LYS 52 N 0.78 0.68 0.00 6.66 1.63 0.22 -1.35 116.57 125.18 1ttj h LYS 52 Ca 0.41 -0.04 0.00 0.00 -0.85 0.00 0.00 60.65 60.17 1ttj h LYS 52 Cb 0.41 -0.15 0.00 0.00 -0.60 0.00 0.00 32.23 31.88 1ttj h LYS 52 CO -0.26 0.45 -1.11 -0.85 -3.45 0.00 0.00 179.45 174.23 1ttj n GLU 53 N -4.81 0.85 0.03 1.90 -0.00 -0.15 -4.51 120.64 113.95 1ttj n GLU 53 Ca 0.18 -0.04 -0.22 0.00 -0.00 0.00 0.00 57.16 57.07 1ttj n GLU 53 Cb 0.43 -1.39 -0.14 0.00 -0.00 0.00 0.00 31.44 30.34 1ttj n GLU 53 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1ttj h ARG 54 N 0.00 0.32 -6.25 3.44 2.47 -0.16 -3.45 114.38 110.75 1ttj h ARG 54 Ca 0.00 -0.54 -0.56 0.00 -1.26 0.00 0.00 59.98 57.62 1ttj h ARG 54 Cb 0.54 0.20 -0.02 0.00 -1.65 0.00 0.00 29.97 29.04 1ttj h ARG 54 CO 0.00 1.26 1.08 -1.17 0.56 0.00 0.00 179.97 181.70 1ttj s LEU 55 N -7.24 4.17 0.00 3.04 2.96 -0.53 -4.88 118.68 116.20 1ttj s LEU 55 Ca -0.19 2.00 0.00 0.00 -0.22 0.00 0.00 54.13 55.71 1ttj s LEU 55 Cb 0.06 -3.53 0.00 0.00 0.50 0.00 0.00 46.19 43.21 1ttj s LEU 55 CO 0.80 -1.01 0.37 -1.54 -1.32 0.00 0.00 176.35 173.65 1ttj n SER 56 N 7.50 0.67 -4.74 3.68 3.41 -1.26 -4.90 113.62 117.98 1ttj n SER 56 Ca 0.17 -1.09 -0.42 0.00 -0.26 0.00 0.00 58.87 57.28 1ttj n SER 56 Cb 0.44 0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 64.36 1ttj n SER 56 CO 0.00 0.00 0.00 -2.28 -0.16 0.00 0.00 175.04 172.60 1ttj s HIS 57 N -0.09 2.96 0.34 7.33 5.04 -1.26 -4.90 115.29 124.71 1ttj s HIS 57 Ca 0.00 0.79 0.02 0.00 -1.54 0.00 0.00 55.06 54.33 1ttj s HIS 57 Cb 0.00 -3.94 0.60 0.00 0.04 0.00 0.00 32.58 29.28 1ttj s HIS 57 CO 0.00 -3.24 1.98 -1.00 -2.34 0.00 0.00 174.74 170.13 1ttj h PRO 58 N 5.67 0.82 -0.03 2.88 0.13 -1.97 -2.16 132.00 137.34 1ttj h PRO 58 Ca -0.45 -0.07 0.00 0.00 -0.87 0.00 0.00 66.00 64.61 1ttj h PRO 58 Cb 1.21 -0.17 0.00 0.00 0.13 0.00 0.00 31.00 32.17 1ttj h PRO 58 CO 0.84 0.58 0.00 1.63 -0.23 0.00 0.00 178.00 180.82 1ttj n LYS 59 N -4.41 1.29 -4.06 0.86 5.02 -1.26 -4.85 118.16 110.74 1ttj n LYS 59 Ca 0.06 -0.42 -0.31 0.00 -2.02 0.00 0.00 58.31 55.62 1ttj n LYS 59 Cb 0.08 -1.42 -0.07 0.00 -0.02 0.00 0.00 35.03 33.60 1ttj n LYS 59 CO 0.00 0.00 0.00 -0.06 -0.52 0.00 0.00 177.40 176.82 1ttj s PHE 60 N -1.96 3.19 0.05 2.13 0.40 -0.81 -1.24 117.98 119.74 1ttj s PHE 60 Ca 0.37 0.09 0.02 0.00 -0.60 0.00 0.00 56.93 56.82 1ttj s PHE 60 Cb 0.18 -1.63 -0.03 0.00 0.51 0.00 0.00 43.02 42.05 1ttj s PHE 60 CO 0.30 0.52 -0.08 0.54 0.70 0.00 0.00 175.22 177.20 1ttj s VAL 61 N -1.36 0.59 0.07 -0.44 0.11 -0.60 -4.86 120.40 113.92 1ttj s VAL 61 Ca 0.28 -1.19 0.03 0.00 -2.93 0.00 0.00 61.98 58.18 1ttj s VAL 61 Cb -0.12 -0.75 -0.04 0.00 -1.53 0.00 0.00 36.38 33.94 1ttj s VAL 61 CO 0.21 -0.43 0.06 0.27 -3.33 0.00 0.00 175.10 171.88 1ttj s ILE 62 N -1.62 4.44 0.06 7.04 -0.00 -1.26 -0.81 121.20 129.05 1ttj s ILE 62 Ca -0.07 -0.77 0.04 0.00 -0.00 0.00 0.00 60.65 59.85 1ttj s ILE 62 Cb -0.08 -3.12 -0.03 0.00 -0.00 0.00 0.00 42.46 39.23 1ttj s ILE 62 CO -0.00 0.15 -0.13 0.00 -0.00 0.00 0.00 174.94 174.97 1ttj s ALA 63 N -1.35 1.02 0.40 2.27 0.00 0.38 -4.00 121.76 120.48 1ttj s ALA 63 Ca 0.28 -0.90 -0.00 0.00 0.00 0.00 0.00 51.96 51.33 1ttj s ALA 63 Cb -0.12 -0.08 -0.02 0.00 0.00 0.00 0.00 23.12 22.90 1ttj s ALA 63 CO 0.20 0.13 0.62 0.00 0.00 0.00 0.00 175.76 176.71 1ttj s ALA 64 N -1.21 3.69 -0.15 0.00 0.00 -0.40 -0.94 121.76 122.76 1ttj s ALA 64 Ca -0.03 -0.92 0.16 0.00 0.00 0.00 0.00 51.96 51.16 1ttj s ALA 64 Cb -0.09 -2.17 -0.24 0.00 0.00 0.00 0.00 23.12 20.61 1ttj s ALA 64 CO 0.02 -0.19 0.27 1.04 0.00 0.00 0.00 175.76 176.90 1ttj n GLN 65 N -1.95 0.67 -3.55 0.00 6.02 -1.21 -1.03 117.38 116.34 1ttj n GLN 65 Ca -0.02 0.10 -0.15 0.00 -0.01 0.00 0.00 57.00 56.92 1ttj n GLN 65 Cb 0.57 -1.61 -0.06 0.00 1.02 0.00 0.00 30.24 30.15 1ttj n GLN 65 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 177.06 177.26 1ttj s ASN 66 N -5.71 -0.54 -0.16 1.08 2.47 -1.26 -4.46 114.94 106.36 1ttj s ASN 66 Ca -0.09 0.62 -0.01 0.00 0.42 0.00 0.00 52.86 53.80 1ttj s ASN 66 Cb 0.07 0.48 0.04 0.00 -1.45 0.00 0.00 41.25 40.39 1ttj s ASN 66 CO 0.83 -0.47 -0.03 0.00 -3.72 0.00 0.00 177.10 173.70 1ttj s ALA 67 N -1.06 1.28 0.10 1.71 0.00 -1.26 -5.04 121.76 117.48 1ttj s ALA 67 Ca -0.06 -0.70 -0.29 0.00 0.00 0.00 0.00 51.96 50.91 1ttj s ALA 67 Cb -0.00 -1.08 -0.12 0.00 0.00 0.00 0.00 23.12 21.92 1ttj s ALA 67 CO 0.06 -0.81 1.64 0.78 0.00 0.00 0.00 175.76 177.43 1ttj h GLY 68 N 8.17 -0.63 0.00 0.00 0.00 -2.00 -3.48 103.07 105.14 1ttj h GLY 68 Ca -0.22 0.32 0.00 0.00 0.00 0.00 0.00 47.33 47.43 1ttj h GLY 68 CO 0.37 -0.25 0.00 1.16 0.00 0.00 0.00 176.54 177.82 1ttj n ASN 69 N -5.40 0.00 -0.22 0.19 0.23 -1.26 -5.00 115.26 103.80 1ttj n ASN 69 Ca -0.09 -0.92 0.03 0.00 -0.53 0.00 0.00 54.58 53.06 1ttj n ASN 69 Cb 0.30 0.00 0.14 0.00 -2.08 0.00 0.00 39.78 38.15 1ttj n ASN 69 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1ttj h ALA 70 N 1.60 0.87 -0.70 -2.53 0.00 -1.99 0.38 119.26 116.89 1ttj h ALA 70 Ca 0.00 0.12 -0.05 0.00 0.00 0.00 0.00 54.91 54.98 1ttj h ALA 70 Cb 0.00 0.13 -0.03 0.00 0.00 0.00 0.00 17.79 17.89 1ttj h ALA 70 CO 0.00 -0.25 0.25 -0.44 0.00 0.00 0.00 179.25 178.80 1ttj h ASP 71 N 0.35 0.98 -0.48 0.00 5.19 -2.00 -1.43 116.42 119.04 1ttj h ASP 71 Ca 0.36 -0.16 -0.11 0.00 -0.62 0.00 0.00 57.03 56.50 1ttj h ASP 71 Cb 0.53 -0.26 -0.02 0.00 0.18 0.00 0.00 39.33 39.77 1ttj h ASP 71 CO -0.40 0.90 -0.09 0.00 -3.12 0.00 0.00 179.24 176.53 1ttj h ALA 72 N 1.24 0.86 -0.46 3.45 0.00 -0.81 -2.00 119.26 121.54 1ttj h ALA 72 Ca 0.23 -0.34 -0.07 0.00 0.00 0.00 0.00 54.91 54.73 1ttj h ALA 72 Cb 0.25 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 1ttj h ALA 72 CO -0.01 0.65 -0.01 -0.07 0.00 0.00 0.00 179.25 179.81 1ttj h LEU 80 N 0.85 0.73 -0.27 0.00 3.38 -0.23 -2.64 115.31 117.13 1ttj h LEU 80 Ca 0.14 -0.17 -0.05 0.00 0.09 0.00 0.00 57.88 57.88 1ttj h LEU 80 Cb 0.63 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.18 1ttj h LEU 80 CO 0.04 0.80 -0.04 0.00 0.09 0.00 0.00 178.44 179.33 1ttj h ALA 81 N 1.28 0.37 -0.10 1.53 0.00 -0.87 -2.94 119.26 118.53 1ttj h ALA 81 Ca 0.14 -0.26 -0.04 0.00 0.00 0.00 0.00 54.91 54.75 1ttj h ALA 81 Cb 0.45 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 1ttj h ALA 81 CO 0.02 0.15 -0.11 0.66 0.00 0.00 0.00 179.25 179.97 1ttj h SER 82 N 0.27 0.14 -0.10 0.00 4.64 -1.30 -0.86 113.55 116.34 1ttj h SER 82 Ca 0.07 -0.02 -0.00 0.00 -0.47 0.00 0.00 61.79 61.36 1ttj h SER 82 Cb 0.50 -0.04 -0.00 0.00 -0.31 0.00 0.00 62.40 62.55 1ttj h SER 82 CO 0.02 0.27 0.05 -0.07 -0.87 0.00 0.00 176.83 176.23 1ttj h LEU 83 N 0.14 0.14 -0.36 5.97 3.38 -1.32 -1.87 115.31 121.39 1ttj h LEU 83 Ca 0.03 -0.14 0.03 0.00 0.09 0.00 0.00 57.88 57.89 1ttj h LEU 83 Cb 0.29 -0.04 -0.03 0.00 0.09 0.00 0.00 40.66 40.98 1ttj h LEU 83 CO 0.02 0.24 0.18 0.11 0.09 0.00 0.00 178.44 179.07 1ttj h LYS 84 N 0.03 0.36 -0.18 1.13 1.57 -1.29 0.55 116.57 118.73 1ttj h LYS 84 Ca 0.03 -0.02 0.05 0.00 -1.87 0.00 0.00 60.65 58.84 1ttj h LYS 84 Cb 0.14 -0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.36 1ttj h LYS 84 CO -0.00 0.24 0.17 -0.44 -0.57 0.00 0.00 179.45 178.85 1ttj h ASP 85 N 0.37 0.00 0.22 0.86 3.32 -0.94 0.87 116.42 121.12 1ttj h ASP 85 Ca 0.15 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.20 1ttj h ASP 85 Cb 0.06 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.61 1ttj h ASP 85 CO -0.11 0.00 -0.26 0.33 -1.72 0.00 0.00 179.24 177.49 1ttj n PHE 86 N -3.95 0.00 -0.41 4.55 7.35 0.10 -4.95 117.46 120.15 1ttj n PHE 86 Ca 0.01 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.70 1ttj n PHE 86 Cb 0.30 -0.11 0.00 0.00 0.35 0.00 0.00 39.48 40.02 1ttj n PHE 86 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1ttj n GLY 87 N 1.34 0.75 3.61 7.13 0.00 0.30 -5.04 105.19 113.28 1ttj n GLY 87 Ca 0.12 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.73 1ttj n GLY 87 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ttj s VAL 88 N -2.42 4.94 -1.23 1.61 1.01 -0.69 -4.89 120.40 118.72 1ttj s VAL 88 Ca 0.00 1.04 0.10 0.00 0.00 0.00 0.00 61.98 63.12 1ttj s VAL 88 Cb 0.00 -3.99 0.12 0.00 0.00 0.00 0.00 36.38 32.51 1ttj s VAL 88 CO 0.00 -0.08 0.92 -3.20 0.00 0.00 0.00 175.10 172.73 1ttj n ASN 89 N 5.85 2.08 -4.35 3.32 2.85 -1.26 -3.93 115.26 119.82 1ttj n ASN 89 Ca -0.00 -1.55 -0.25 0.00 -0.11 0.00 0.00 54.58 52.67 1ttj n ASN 89 Cb 0.49 -0.04 -0.12 0.00 1.24 0.00 0.00 39.78 41.34 1ttj n ASN 89 CO 0.00 0.00 0.00 0.26 -2.11 0.00 0.00 177.26 175.41 1ttj s TRP 90 N -0.90 2.00 -0.11 1.20 0.52 -1.26 -0.95 118.94 119.44 1ttj s TRP 90 Ca 0.14 -0.41 -0.12 0.00 0.02 0.00 0.00 56.10 55.73 1ttj s TRP 90 Cb 0.09 -1.03 0.03 0.00 -1.15 0.00 0.00 33.47 31.41 1ttj s TRP 90 CO 0.14 0.34 0.32 -1.50 0.02 0.00 0.00 176.95 176.27 1ttj s ILE 91 N -1.56 0.01 -0.28 2.03 2.07 -0.31 -1.27 121.20 121.88 1ttj s ILE 91 Ca 0.14 -0.05 -0.12 0.00 -1.41 0.00 0.00 60.65 59.21 1ttj s ILE 91 Cb -0.08 -0.47 -0.04 0.00 0.13 0.00 0.00 42.46 41.99 1ttj s ILE 91 CO 0.07 -0.03 0.25 -0.69 -1.91 0.00 0.00 174.94 172.63 1ttj s VAL 92 N 0.03 5.27 0.03 4.00 1.01 -0.20 -1.07 120.40 129.47 1ttj s VAL 92 Ca -0.01 0.26 0.06 0.00 0.00 0.00 0.00 61.98 62.28 1ttj s VAL 92 Cb -0.03 -3.59 -0.02 0.00 0.00 0.00 0.00 36.38 32.74 1ttj s VAL 92 CO 0.01 0.20 -0.17 -0.76 0.00 0.00 0.00 175.10 174.39 1ttj s LEU 93 N 1.85 2.15 0.00 3.92 1.43 0.48 -4.44 118.68 124.07 1ttj s LEU 93 Ca 0.09 -0.46 0.00 0.00 -1.03 0.00 0.00 54.13 52.74 1ttj s LEU 93 Cb -0.16 -0.76 0.00 0.00 0.03 0.00 0.00 46.19 45.30 1ttj s LEU 93 CO 0.11 0.10 0.00 0.61 0.23 0.00 0.00 176.35 177.39 1ttj n GLY 94 N 1.98 0.44 3.77 -3.19 0.00 -1.26 -0.40 105.19 106.53 1ttj n GLY 94 Ca -0.17 -0.96 -0.39 0.00 0.00 0.00 0.00 46.02 44.49 1ttj n GLY 94 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1ttj s HIS 95 N -2.00 2.76 0.31 1.61 2.46 -1.26 -4.36 115.29 114.81 1ttj s HIS 95 Ca 0.00 1.39 0.05 0.00 0.47 0.00 0.00 55.06 56.97 1ttj s HIS 95 Cb 0.00 -3.70 0.82 0.00 -0.13 0.00 0.00 32.58 29.57 1ttj s HIS 95 CO 0.00 -2.21 1.51 -1.13 -2.47 0.00 0.00 174.74 170.44 1ttj n SER 96 N 0.06 -0.04 0.27 9.88 3.41 -1.26 0.88 113.62 126.82 1ttj n SER 96 Ca 0.04 1.63 0.15 0.00 -0.26 0.00 0.00 58.87 60.43 1ttj n SER 96 Cb 0.43 -0.62 0.70 0.00 -0.26 0.00 0.00 64.21 64.46 1ttj n SER 96 CO 0.00 0.00 0.00 1.05 -0.16 0.00 0.00 175.04 175.93 1ttj h GLU 97 N 0.00 0.00 -0.20 4.33 9.09 -1.98 -1.44 114.58 124.38 1ttj h GLU 97 Ca 0.62 0.00 -0.10 0.00 0.05 0.00 0.00 59.36 59.93 1ttj h GLU 97 Cb 1.35 0.00 -0.00 0.00 -1.65 0.00 0.00 28.75 28.45 1ttj h GLU 97 CO -0.88 0.08 -0.27 0.00 0.05 0.00 0.00 179.01 177.99 1ttj h ARG 98 N 0.00 0.53 -0.20 1.06 2.47 0.16 0.25 114.38 118.64 1ttj h ARG 98 Ca -0.00 -0.31 -0.09 0.00 -1.26 0.00 0.00 59.98 58.33 1ttj h ARG 98 Cb 0.48 0.02 -0.01 0.00 -1.65 0.00 0.00 29.97 28.81 1ttj h ARG 98 CO 0.01 0.90 -0.25 0.00 0.56 0.00 0.00 179.97 181.19 1ttj h ARG 99 N 0.20 0.38 0.00 0.04 3.08 -1.24 0.33 114.38 117.17 1ttj h ARG 99 Ca 0.02 -0.13 -0.02 0.00 0.07 0.00 0.00 59.98 59.92 1ttj h ARG 99 Cb 0.84 -0.03 -0.00 0.00 0.08 0.00 0.00 29.97 30.86 1ttj h ARG 99 CO 0.06 0.61 -0.12 0.00 -1.07 0.00 0.00 179.97 179.45 1ttj h ALA 100 N 1.40 0.02 -0.22 0.04 0.00 -1.22 -3.39 119.26 115.89 1ttj h ALA 100 Ca 0.05 -0.41 0.00 0.00 0.00 0.00 0.00 54.91 54.55 1ttj h ALA 100 Cb 0.62 0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.49 1ttj h ALA 100 CO 0.04 0.07 0.00 0.66 0.00 0.00 0.00 179.25 180.03 1ttj n TYR 101 N -4.64 0.35 -0.93 0.00 4.01 0.07 -4.62 117.16 111.40 1ttj n TYR 101 Ca -0.09 -0.55 0.06 0.00 -0.16 0.00 0.00 57.90 57.16 1ttj n TYR 101 Cb 0.35 -0.06 0.08 0.00 -0.31 0.00 0.00 39.34 39.40 1ttj n TYR 101 CO 0.00 0.00 0.00 0.66 -0.46 0.00 0.00 176.86 177.06 1ttj n TYR 102 N 0.05 0.00 -1.25 -0.72 4.02 0.09 -4.97 117.16 114.39 1ttj n TYR 102 Ca 0.09 -0.71 -0.09 0.00 -0.01 0.00 0.00 57.90 57.18 1ttj n TYR 102 Cb 0.42 -0.11 -0.04 0.00 -0.02 0.00 0.00 39.34 39.60 1ttj n TYR 102 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1ttj n GLY 103 N -0.98 1.01 3.45 2.72 0.00 -1.23 -4.96 105.19 105.21 1ttj n GLY 103 Ca 0.10 -0.38 -0.43 0.00 0.00 0.00 0.00 46.02 45.31 1ttj n GLY 103 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1ttj s GLU 104 N -2.52 3.14 0.93 1.61 2.02 -1.14 -4.98 118.70 117.77 1ttj s GLU 104 Ca 0.00 -0.91 -0.15 0.00 0.02 0.00 0.00 54.97 53.94 1ttj s GLU 104 Cb 0.00 -4.28 0.16 0.00 0.10 0.00 0.00 34.13 30.12 1ttj s GLU 104 CO 0.00 -1.81 1.24 0.95 0.02 0.00 0.00 175.26 175.66 1ttj s THR 105 N 3.94 1.96 0.19 3.63 -4.23 -1.26 -4.18 115.64 115.70 1ttj s THR 105 Ca 0.22 0.00 -0.11 0.00 -1.18 0.00 0.00 61.69 60.62 1ttj s THR 105 Cb -0.16 -2.92 0.12 0.00 1.34 0.00 0.00 72.50 70.87 1ttj s THR 105 CO 0.09 0.00 1.74 0.78 -0.54 0.00 0.00 174.62 176.69 1ttj h ASN 106 N -1.53 0.16 -0.54 3.99 2.35 -1.97 -0.69 115.58 117.36 1ttj h ASN 106 Ca -0.46 0.07 -0.09 0.00 -0.55 0.00 0.00 56.30 55.28 1ttj h ASN 106 Cb 1.28 0.07 -0.02 0.00 0.05 0.00 0.00 38.32 39.70 1ttj h ASN 106 CO 0.49 0.11 -0.01 -0.33 -1.65 0.00 0.00 177.43 176.04 1ttj h GLU 107 N 0.35 0.95 -0.69 0.81 3.07 -1.92 -1.92 114.58 115.24 1ttj h GLU 107 Ca 0.27 -0.31 -0.03 0.00 -0.50 0.00 0.00 59.36 58.79 1ttj h GLU 107 Cb 0.32 -0.08 -0.03 0.00 -0.84 0.00 0.00 28.75 28.12 1ttj h GLU 107 CO -0.29 0.97 0.31 0.82 -1.40 0.00 0.00 179.01 179.43 1ttj h ILE 108 N 0.83 1.24 -0.59 3.13 2.04 -1.81 -1.37 117.51 120.98 1ttj h ILE 108 Ca 0.15 -0.70 -0.09 0.00 1.00 0.00 0.00 64.86 65.23 1ttj h ILE 108 Cb 0.55 0.41 -0.02 0.00 -0.74 0.00 0.00 36.82 37.02 1ttj h ILE 108 CO 0.03 0.28 0.02 1.62 0.00 0.00 0.00 178.15 180.11 1ttj h VAL 109 N 0.97 1.26 -0.50 1.67 3.04 -0.93 -1.65 116.25 120.11 1ttj h VAL 109 Ca 0.24 -1.11 0.05 0.00 -1.01 0.00 0.00 66.70 64.87 1ttj h VAL 109 Cb 0.15 0.81 -0.04 0.00 -2.01 0.00 0.00 31.29 30.20 1ttj h VAL 109 CO -0.03 0.40 0.24 0.00 -1.01 0.00 0.00 177.57 177.18 1ttj h ALA 110 N 0.99 0.63 -0.85 3.17 0.00 -0.92 0.13 119.26 122.41 1ttj h ALA 110 Ca 0.17 0.03 -0.02 0.00 0.00 0.00 0.00 54.91 55.09 1ttj h ALA 110 Cb 0.52 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.21 1ttj h ALA 110 CO 0.03 -0.11 0.47 -0.44 0.00 0.00 0.00 179.25 179.19 1ttj h ASP 111 N 0.48 1.06 -0.46 0.00 3.32 -1.12 -1.56 116.42 118.14 1ttj h ASP 111 Ca 0.22 -0.10 -0.10 0.00 0.02 0.00 0.00 57.03 57.07 1ttj h ASP 111 Cb 0.14 -0.27 -0.01 0.00 0.22 0.00 0.00 39.33 39.41 1ttj h ASP 111 CO -0.16 0.85 -0.12 0.11 -1.72 0.00 0.00 179.24 178.20 1ttj h LYS 112 N 1.18 0.89 -0.37 3.56 1.57 -0.62 -1.36 116.57 121.42 1ttj h LYS 112 Ca 0.30 -0.34 0.00 0.00 -1.87 0.00 0.00 60.65 58.74 1ttj h LYS 112 Cb 0.03 -0.05 -0.02 0.00 0.08 0.00 0.00 32.23 32.27 1ttj h LYS 112 CO -0.05 0.99 0.24 0.28 -0.57 0.00 0.00 179.45 180.35 1ttj h VAL 113 N 0.73 1.10 -0.67 0.50 2.07 -0.54 -1.32 116.25 118.12 1ttj h VAL 113 Ca 0.12 -0.17 -0.07 0.00 0.82 0.00 0.00 66.70 67.40 1ttj h VAL 113 Cb 0.66 0.55 -0.03 0.00 -1.52 0.00 0.00 31.29 30.96 1ttj h VAL 113 CO 0.05 0.09 0.16 0.00 0.02 0.00 0.00 177.57 177.89 1ttj h ALA 114 N 1.13 0.88 -0.08 1.67 0.00 -1.19 -1.20 119.26 120.48 1ttj h ALA 114 Ca 0.14 -0.24 -0.08 0.00 0.00 0.00 0.00 54.91 54.72 1ttj h ALA 114 Cb -0.06 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.47 1ttj h ALA 114 CO -0.03 0.60 -0.31 0.00 0.00 0.00 0.00 179.25 179.51 1ttj h ALA 115 N 1.07 1.34 -0.16 0.00 0.00 -0.96 -0.09 119.26 120.45 1ttj h ALA 115 Ca 0.21 -0.32 -0.12 0.00 0.00 0.00 0.00 54.91 54.68 1ttj h ALA 115 Cb 0.37 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.09 1ttj h ALA 115 CO 0.00 0.47 -0.37 0.00 0.00 0.00 0.00 179.25 179.35 1ttj h ALA 116 N 1.56 0.27 -0.65 0.00 0.00 -0.90 -2.95 119.26 116.59 1ttj h ALA 116 Ca 0.02 -0.44 0.02 0.00 0.00 0.00 0.00 54.91 54.51 1ttj h ALA 116 Cb 0.62 -0.04 -0.04 0.00 0.00 0.00 0.00 17.79 18.33 1ttj h ALA 116 CO 0.05 0.34 0.40 0.28 0.00 0.00 0.00 179.25 180.32 1ttj h VAL 117 N 0.18 1.10 0.00 0.00 2.07 -0.90 -1.42 116.25 117.27 1ttj h VAL 117 Ca 0.00 -0.27 -0.00 0.00 0.82 0.00 0.00 66.70 67.25 1ttj h VAL 117 Cb 0.97 0.23 -0.00 0.00 -1.52 0.00 0.00 31.29 30.96 1ttj h VAL 117 CO 0.08 0.15 -0.00 0.00 0.02 0.00 0.00 177.57 177.81 1ttj h ALA 118 N 1.27 1.41 -0.48 1.67 0.00 -0.97 0.24 119.26 122.40 1ttj h ALA 118 Ca 0.26 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.16 1ttj h ALA 118 Cb 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1ttj h ALA 118 CO -0.10 0.01 0.00 0.43 0.00 0.00 0.00 179.25 179.59 1ttj n SER 119 N -3.68 4.57 -1.14 0.00 7.64 -0.59 -4.93 113.62 115.49 1ttj n SER 119 Ca -0.03 -2.64 -0.09 0.00 1.01 0.00 0.00 58.87 57.12 1ttj n SER 119 Cb 0.08 -0.61 0.00 0.00 -1.01 0.00 0.00 64.21 62.67 1ttj n SER 119 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1ttj n GLY 120 N 0.64 0.03 3.91 0.23 0.00 0.07 -5.03 105.19 105.04 1ttj n GLY 120 Ca 0.22 -0.48 -0.28 0.00 0.00 0.00 0.00 46.02 45.48 1ttj n GLY 120 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1ttj s PHE 121 N -2.54 3.48 -0.23 1.61 0.08 -0.89 -5.00 117.98 114.49 1ttj s PHE 121 Ca 0.03 0.58 -0.10 0.00 0.12 0.00 0.00 56.93 57.57 1ttj s PHE 121 Cb -0.01 -2.06 -0.05 0.00 -0.57 0.00 0.00 43.02 40.33 1ttj s PHE 121 CO 0.04 0.19 0.14 -1.64 -0.10 0.00 0.00 175.22 173.85 1ttj s MET 122 N -3.59 4.05 -0.04 0.44 -1.94 -0.12 -4.53 119.30 113.57 1ttj s MET 122 Ca 0.43 -0.28 0.04 0.00 -1.71 0.00 0.00 55.69 54.17 1ttj s MET 122 Cb -0.11 -3.47 -0.02 0.00 2.01 0.00 0.00 34.83 33.24 1ttj s MET 122 CO 0.30 0.10 -0.16 0.08 -0.01 0.00 0.00 175.02 175.33 1ttj s VAL 123 N 0.92 2.87 -0.42 -6.03 1.01 0.17 -1.16 120.40 117.76 1ttj s VAL 123 Ca 0.07 -0.81 -0.02 0.00 0.00 0.00 0.00 61.98 61.22 1ttj s VAL 123 Cb -0.13 -2.11 0.11 0.00 0.00 0.00 0.00 36.38 34.25 1ttj s VAL 123 CO 0.03 0.58 0.21 -0.63 0.00 0.00 0.00 175.10 175.29 1ttj s ILE 124 N -0.72 3.23 -0.22 2.22 1.01 -0.24 0.32 121.20 126.81 1ttj s ILE 124 Ca 0.11 -2.16 -0.17 0.00 0.00 0.00 0.00 60.65 58.43 1ttj s ILE 124 Cb -0.10 -3.22 -0.03 0.00 0.01 0.00 0.00 42.46 39.11 1ttj s ILE 124 CO 0.00 -0.70 0.46 0.00 0.00 0.00 0.00 174.94 174.70 1ttj s ALA 125 N 1.01 3.56 -0.02 9.38 0.00 -0.08 -0.39 121.76 135.23 1ttj s ALA 125 Ca 0.09 -0.54 -0.13 0.00 0.00 0.00 0.00 51.96 51.38 1ttj s ALA 125 Cb -0.22 -2.76 -0.05 0.00 0.00 0.00 0.00 23.12 20.08 1ttj s ALA 125 CO -0.04 -0.49 0.37 0.00 0.00 0.00 0.00 175.76 175.59 1ttj s ILE 127 N -1.08 0.33 0.00 0.00 -4.36 -0.21 -4.71 121.20 111.17 1ttj s ILE 127 Ca 0.23 -1.99 0.00 0.00 -0.26 0.00 0.00 60.65 58.63 1ttj s ILE 127 Cb -0.16 -2.44 0.00 0.00 1.25 0.00 0.00 42.46 41.11 1ttj s ILE 127 CO 0.12 -0.13 0.00 0.61 0.24 0.00 0.00 174.94 175.78 1ttj n GLY 128 N -0.32 4.31 3.90 6.27 0.00 -1.26 0.00 105.19 118.09 1ttj n GLY 128 Ca -0.01 -0.77 -0.28 0.00 0.00 0.00 0.00 46.02 44.95 1ttj n GLY 128 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1ttj s GLU 129 N -3.07 3.26 0.54 1.61 1.03 -1.26 -4.64 118.70 116.17 1ttj s GLU 129 Ca 0.00 0.30 -0.01 0.00 0.03 0.00 0.00 54.97 55.29 1ttj s GLU 129 Cb 0.00 -2.22 0.02 0.00 -0.80 0.00 0.00 34.13 31.13 1ttj s GLU 129 CO 0.00 -0.57 0.78 0.95 -1.33 0.00 0.00 175.26 175.10 1ttj s THR 130 N -3.01 3.28 0.21 1.83 -4.23 -1.26 -0.41 115.64 112.05 1ttj s THR 130 Ca 0.53 -0.45 -0.09 0.00 -1.18 0.00 0.00 61.69 60.50 1ttj s THR 130 Cb -0.11 -3.25 0.15 0.00 1.34 0.00 0.00 72.50 70.64 1ttj s THR 130 CO 0.48 -0.20 1.84 0.25 -0.54 0.00 0.00 174.62 176.45 1ttj h LEU 131 N 0.08 0.70 -0.32 4.79 5.85 -1.97 0.19 115.31 124.62 1ttj h LEU 131 Ca -0.44 0.01 0.02 0.00 0.84 0.00 0.00 57.88 58.30 1ttj h LEU 131 Cb 1.28 -0.14 -0.02 0.00 0.37 0.00 0.00 40.66 42.15 1ttj h LEU 131 CO 0.56 0.47 0.18 1.56 -0.34 0.00 0.00 178.44 180.87 1ttj h GLN 132 N 0.83 0.36 -0.40 1.25 4.20 -1.99 0.57 115.11 119.93 1ttj h GLN 132 Ca 0.30 -0.02 -0.05 0.00 0.06 0.00 0.00 58.65 58.94 1ttj h GLN 132 Cb 0.08 -0.08 -0.02 0.00 0.30 0.00 0.00 27.48 27.76 1ttj h GLN 132 CO -0.14 0.24 0.03 0.93 -0.67 0.00 0.00 178.83 179.22 1ttj h GLU 133 N 0.37 0.63 -0.50 1.46 5.08 -1.69 -0.97 114.58 118.96 1ttj h GLU 133 Ca 0.13 -0.13 -0.12 0.00 -1.00 0.00 0.00 59.36 58.23 1ttj h GLU 133 Cb 0.01 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.16 1ttj h GLU 133 CO -0.07 0.62 -0.17 -0.09 -1.00 0.00 0.00 179.01 178.30 1ttj h ARG 134 N 0.60 1.00 -0.38 2.33 9.65 0.61 -0.46 114.38 127.73 1ttj h ARG 134 Ca 0.13 -0.41 -0.11 0.00 -1.10 0.00 0.00 59.98 58.49 1ttj h ARG 134 Cb 0.33 -0.04 -0.01 0.00 -1.39 0.00 0.00 29.97 28.86 1ttj h ARG 134 CO 0.01 1.09 -0.20 0.93 2.80 0.00 0.00 179.97 184.59 1ttj h GLU 135 N 0.86 0.81 0.00 0.20 5.08 0.41 -2.87 114.58 119.07 1ttj h GLU 135 Ca 0.12 -0.36 0.00 0.00 -1.00 0.00 0.00 59.36 58.12 1ttj h GLU 135 Cb 0.75 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.98 1ttj h GLU 135 CO 0.06 0.99 0.00 0.43 -1.00 0.00 0.00 179.01 179.49 1ttj n SER 136 N -4.25 0.00 -2.87 1.42 7.64 -0.40 -4.83 113.62 110.34 1ttj n SER 136 Ca -0.02 -0.40 -0.22 0.00 1.01 0.00 0.00 58.87 59.25 1ttj n SER 136 Cb 0.43 0.00 0.02 0.00 -1.01 0.00 0.00 64.21 63.65 1ttj n SER 136 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1ttj n GLY 137 N -0.30 -0.52 0.81 0.23 0.00 -1.08 -4.91 105.19 99.42 1ttj n GLY 137 Ca 0.06 0.10 0.07 0.00 0.00 0.00 0.00 46.02 46.25 1ttj n GLY 137 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ttj n ARG 138 N -3.76 2.61 -0.05 1.61 1.74 -0.19 -4.80 116.66 113.82 1ttj n ARG 138 Ca -0.15 -2.12 -0.13 0.00 -0.77 0.00 0.00 57.85 54.68 1ttj n ARG 138 Cb 0.64 -1.35 -0.08 0.00 -1.02 0.00 0.00 32.46 30.65 1ttj n ARG 138 CO 0.00 0.00 0.00 1.15 -1.52 0.00 0.00 177.63 177.26 1ttj h THR 139 N 2.71 0.06 -0.37 0.55 2.02 -1.86 -1.50 112.91 114.52 1ttj h THR 139 Ca 0.00 0.00 0.05 0.00 0.77 0.00 0.00 66.41 67.23 1ttj h THR 139 Cb 0.78 0.06 -0.05 0.00 -1.74 0.00 0.00 68.15 67.20 1ttj h THR 139 CO 0.00 0.00 0.07 0.00 0.37 0.00 0.00 175.52 175.96 1ttj h ALA 140 N 0.00 0.39 -0.57 6.16 0.00 -1.94 -0.68 119.26 122.63 1ttj h ALA 140 Ca 0.07 0.07 -0.03 0.00 0.00 0.00 0.00 54.91 55.03 1ttj h ALA 140 Cb 0.64 0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.49 1ttj h ALA 140 CO -0.48 -0.33 0.25 -0.24 0.00 0.00 0.00 179.25 178.45 1ttj h VAL 141 N 0.20 1.22 -0.31 0.00 3.04 -1.85 0.17 116.25 118.71 1ttj h VAL 141 Ca 0.17 -0.64 0.03 0.00 -1.01 0.00 0.00 66.70 65.25 1ttj h VAL 141 Cb 0.20 0.58 -0.03 0.00 -2.01 0.00 0.00 31.29 30.03 1ttj h VAL 141 CO -0.23 0.25 0.13 0.58 -1.01 0.00 0.00 177.57 177.29 1ttj h VAL 142 N 0.77 0.94 -0.58 1.51 2.07 -0.81 0.11 116.25 120.27 1ttj h VAL 142 Ca 0.19 -0.09 -0.09 0.00 0.82 0.00 0.00 66.70 67.53 1ttj h VAL 142 Cb 0.16 0.65 -0.02 0.00 -1.52 0.00 0.00 31.29 30.56 1ttj h VAL 142 CO -0.02 0.05 0.02 0.58 0.02 0.00 0.00 177.57 178.22 1ttj h VAL 143 N 0.28 1.26 -0.10 2.57 2.07 -0.76 -0.68 116.25 120.89 1ttj h VAL 143 Ca 0.14 -1.10 -0.14 0.00 0.82 0.00 0.00 66.70 66.42 1ttj h VAL 143 Cb 0.08 0.83 -0.01 0.00 -1.52 0.00 0.00 31.29 30.67 1ttj h VAL 143 CO -0.12 0.40 -0.55 -0.07 0.02 0.00 0.00 177.57 177.25 1ttj h LEU 144 N 0.90 0.31 -0.51 2.57 3.38 -0.28 -1.93 115.31 119.75 1ttj h LEU 144 Ca 0.17 -0.17 -0.05 0.00 0.09 0.00 0.00 57.88 57.92 1ttj h LEU 144 Cb 0.52 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 41.16 1ttj h LEU 144 CO 0.03 0.80 0.13 0.74 0.09 0.00 0.00 178.44 180.22 1ttj h THR 145 N 0.22 1.24 -0.38 0.22 2.02 -0.32 0.14 112.91 116.05 1ttj h THR 145 Ca 0.00 -0.85 -0.07 0.00 0.77 0.00 0.00 66.41 66.26 1ttj h THR 145 Cb 1.03 0.82 -0.01 0.00 -1.74 0.00 0.00 68.15 68.24 1ttj h THR 145 CO 0.09 0.31 -0.04 1.56 0.37 0.00 0.00 175.52 177.80 1ttj h GLN 146 N 0.71 0.71 -0.28 6.66 4.20 -0.94 -2.54 115.11 123.62 1ttj h GLN 146 Ca 0.16 -0.25 -0.13 0.00 0.06 0.00 0.00 58.65 58.49 1ttj h GLN 146 Cb 0.33 -0.05 -0.00 0.00 0.30 0.00 0.00 27.48 28.05 1ttj h GLN 146 CO 0.00 0.83 -0.34 0.97 -0.67 0.00 0.00 178.83 179.62 1ttj h ILE 147 N 0.52 1.30 -1.01 2.54 6.09 -1.27 -3.06 117.51 122.63 1ttj h ILE 147 Ca 0.10 -1.52 0.08 0.00 -1.37 0.00 0.00 64.86 62.15 1ttj h ILE 147 Cb 0.53 1.63 -0.07 0.00 0.47 0.00 0.00 36.82 39.38 1ttj h ILE 147 CO 0.03 0.49 0.65 0.00 -3.07 0.00 0.00 178.15 176.24 1ttj h ALA 148 N 0.69 1.43 0.00 0.18 0.00 -0.67 0.15 119.26 121.03 1ttj h ALA 148 Ca 0.04 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.89 1ttj h ALA 148 Cb 0.92 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 18.41 1ttj h ALA 148 CO 0.08 0.40 -0.19 0.00 0.00 0.00 0.00 179.25 179.54 1ttj h ALA 149 N 1.47 1.43 0.22 0.00 0.00 -1.41 -1.42 119.26 119.55 1ttj h ALA 149 Ca 0.45 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 55.17 1ttj h ALA 149 Cb 0.24 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.00 1ttj h ALA 149 CO -0.19 0.24 -0.10 0.82 0.00 0.00 0.00 179.25 180.01 1ttj h ILE 150 N 0.00 0.62 -0.36 0.00 2.04 -0.88 -3.27 117.51 115.65 1ttj h ILE 150 Ca -0.00 -1.00 0.11 0.00 1.00 0.00 0.00 64.86 64.97 1ttj h ILE 150 Cb 0.41 1.04 -0.01 0.00 -0.74 0.00 0.00 36.82 37.51 1ttj h ILE 150 CO 0.03 0.16 0.42 0.00 0.00 0.00 0.00 178.15 178.76 1ttj h ALA 151 N -0.52 2.04 0.00 1.87 0.00 -0.42 -1.98 119.26 120.26 1ttj h ALA 151 Ca -0.03 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.83 1ttj h ALA 151 Cb 0.49 0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.30 1ttj h ALA 151 CO 0.05 -0.61 -0.16 0.87 0.00 0.00 0.00 179.25 179.40 1ttj h LYS 152 N 0.00 0.00 -0.19 0.00 1.57 -1.32 -3.08 116.57 113.55 1ttj h LYS 152 Ca 0.17 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.95 1ttj h LYS 152 Cb 1.01 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.32 1ttj h LYS 152 CO -0.00 0.16 0.00 1.63 -0.57 0.00 0.00 179.45 180.67 1ttj n LYS 153 N -4.16 1.89 -4.18 3.15 5.02 -0.74 -4.98 118.16 114.16 1ttj n LYS 153 Ca -0.02 -1.82 -0.25 0.00 -2.02 0.00 0.00 58.31 54.20 1ttj n LYS 153 Cb 0.24 -1.37 -0.07 0.00 -0.02 0.00 0.00 35.03 33.82 1ttj n LYS 153 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1ttj s LEU 154 N -1.32 3.49 0.20 -0.35 1.43 -1.16 -4.87 118.68 116.09 1ttj s LEU 154 Ca 0.26 -0.36 0.09 0.00 -1.03 0.00 0.00 54.13 53.09 1ttj s LEU 154 Cb 0.16 -2.08 -0.04 0.00 0.03 0.00 0.00 46.19 44.26 1ttj s LEU 154 CO 0.23 0.05 -0.07 -0.54 0.23 0.00 0.00 176.35 176.24 1ttj s LYS 155 N -3.28 2.12 0.31 1.70 -0.14 -1.26 -4.96 119.74 114.23 1ttj s LYS 155 Ca 0.30 -1.30 0.06 0.00 -1.36 0.00 0.00 55.97 53.67 1ttj s LYS 155 Cb -0.09 -2.16 0.87 0.00 -1.68 0.00 0.00 37.83 34.77 1ttj s LYS 155 CO 0.21 0.42 1.50 1.17 -0.76 0.00 0.00 175.35 177.88 1ttj n LYS 156 N -0.18 -0.07 0.21 1.68 4.81 -1.26 0.24 118.16 123.59 1ttj n LYS 156 Ca -0.10 1.40 0.06 0.00 -0.87 0.00 0.00 58.31 58.80 1ttj n LYS 156 Cb 0.56 -2.29 0.47 0.00 0.02 0.00 0.00 35.03 33.79 1ttj n LYS 156 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1ttj h ALA 157 N 1.91 1.42 0.00 3.14 0.00 -2.02 -2.90 119.26 120.80 1ttj h ALA 157 Ca 0.64 -0.24 -0.03 0.00 0.00 0.00 0.00 54.91 55.27 1ttj h ALA 157 Cb 1.43 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 19.18 1ttj h ALA 157 CO -0.86 0.33 -0.16 -0.44 0.00 0.00 0.00 179.25 178.13 1ttj h ASP 158 N 0.00 0.00 0.00 0.00 3.32 -0.60 -2.86 116.42 116.27 1ttj h ASP 158 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1ttj h ASP 158 Cb 0.51 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.06 1ttj h ASP 158 CO 0.03 0.16 0.02 -0.50 -1.72 0.00 0.00 179.24 177.23 1ttj h TRP 159 N 0.00 0.00 0.00 4.55 4.06 -1.56 0.15 115.95 123.14 1ttj h TRP 159 Ca -0.00 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.95 1ttj h TRP 159 Cb 0.38 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.54 1ttj h TRP 159 CO 0.00 0.00 0.00 0.00 -3.56 0.00 0.00 178.44 174.88 1ttj n ALA 160 N -1.84 1.79 0.84 1.49 0.00 -1.08 -2.66 120.51 119.05 1ttj n ALA 160 Ca -0.02 0.06 0.10 0.00 0.00 0.00 0.00 53.44 53.58 1ttj n ALA 160 Cb 0.06 -1.40 0.07 0.00 0.00 0.00 0.00 19.45 18.18 1ttj n ALA 160 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1ttj n LYS 161 N -2.22 1.75 -4.08 0.00 5.02 0.51 -4.98 118.16 114.16 1ttj n LYS 161 Ca 0.03 -1.57 -0.33 0.00 -2.02 0.00 0.00 58.31 54.41 1ttj n LYS 161 Cb 0.27 -1.38 -0.07 0.00 -0.02 0.00 0.00 35.03 33.83 1ttj n LYS 161 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1ttj s VAL 162 N -1.76 4.82 -0.06 -0.18 1.01 -1.09 -0.66 120.40 122.49 1ttj s VAL 162 Ca 0.22 -0.37 0.01 0.00 0.00 0.00 0.00 61.98 61.85 1ttj s VAL 162 Cb 0.17 -3.21 0.02 0.00 0.00 0.00 0.00 36.38 33.36 1ttj s VAL 162 CO 0.29 0.35 -0.08 -0.69 0.00 0.00 0.00 175.10 174.98 1ttj s VAL 163 N -1.20 0.82 -0.22 2.92 1.01 0.15 -4.69 120.40 119.18 1ttj s VAL 163 Ca 0.23 -0.27 -0.13 0.00 0.00 0.00 0.00 61.98 61.81 1ttj s VAL 163 Cb -0.12 -0.81 -0.04 0.00 0.00 0.00 0.00 36.38 35.41 1ttj s VAL 163 CO 0.14 0.30 0.27 -0.63 0.00 0.00 0.00 175.10 175.18 1ttj s ILE 164 N 0.97 5.28 -0.35 2.22 -1.09 -0.85 -0.91 121.20 126.48 1ttj s ILE 164 Ca -0.10 0.43 -0.08 0.00 -2.23 0.00 0.00 60.65 58.68 1ttj s ILE 164 Cb -0.15 -3.61 0.04 0.00 -1.58 0.00 0.00 42.46 37.17 1ttj s ILE 164 CO 0.00 0.30 0.14 0.00 -1.23 0.00 0.00 174.94 174.15 1ttj s ALA 165 N 1.17 3.11 -0.30 9.38 0.00 -0.47 0.03 121.76 134.69 1ttj s ALA 165 Ca 0.13 -1.78 -0.19 0.00 0.00 0.00 0.00 51.96 50.12 1ttj s ALA 165 Cb -0.14 -2.37 -0.01 0.00 0.00 0.00 0.00 23.12 20.60 1ttj s ALA 165 CO 0.06 -1.38 0.59 -0.47 0.00 0.00 0.00 175.76 174.56 1ttj s TYR 166 N 1.43 3.22 -0.26 0.00 5.04 0.92 -1.05 117.35 126.67 1ttj s TYR 166 Ca -0.00 0.55 -0.02 0.00 -2.44 0.00 0.00 57.07 55.16 1ttj s TYR 166 Cb -0.20 -2.91 0.08 0.00 0.35 0.00 0.00 41.96 39.29 1ttj s TYR 166 CO 0.03 -0.43 0.08 -1.21 -1.34 0.00 0.00 175.55 172.69 1ttj s GLU 167 N 2.50 0.57 0.11 4.97 2.02 0.10 -1.75 118.70 127.23 1ttj s GLU 167 Ca 0.23 -0.70 -0.31 0.00 0.02 0.00 0.00 54.97 54.22 1ttj s GLU 167 Cb -0.15 -1.87 -0.10 0.00 0.10 0.00 0.00 34.13 32.11 1ttj s GLU 167 CO 0.11 -0.85 1.79 -2.14 0.02 0.00 0.00 175.26 174.18 1ttj s PRO 168 N 1.82 4.15 0.38 0.39 0.02 -1.26 -4.27 135.00 136.23 1ttj s PRO 168 Ca 0.05 2.53 0.10 0.00 0.02 0.00 0.00 61.00 63.70 1ttj s PRO 168 Cb -0.17 -3.59 0.86 0.00 0.02 0.00 0.00 34.50 31.62 1ttj s PRO 168 CO -0.21 -0.82 1.93 0.28 -0.33 0.00 0.00 177.00 177.85 1ttj h VAL 169 N 4.71 0.90 0.00 3.83 2.07 -1.00 0.11 116.25 126.87 1ttj h VAL 169 Ca -0.45 -0.22 0.00 0.00 0.82 0.00 0.00 66.70 66.85 1ttj h VAL 169 Cb 1.21 0.22 0.00 0.00 -1.52 0.00 0.00 31.29 31.20 1ttj h VAL 169 CO 0.94 0.11 0.00 -2.67 0.02 0.00 0.00 177.57 175.98 1ttj n TRP 170 N -4.50 0.00 0.79 1.57 4.27 -1.26 -2.30 117.44 116.00 1ttj n TRP 170 Ca 0.13 0.00 0.08 0.00 -3.89 0.00 0.00 57.50 53.83 1ttj n TRP 170 Cb 0.38 -0.45 -0.10 0.00 -1.36 0.00 0.00 31.31 29.78 1ttj n TRP 170 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 1ttj n ALA 171 N -1.45 4.22 -2.41 -1.67 0.00 0.37 -4.66 120.51 114.91 1ttj n ALA 171 Ca 0.04 -0.50 -0.41 0.00 0.00 0.00 0.00 53.44 52.57 1ttj n ALA 171 Cb 0.15 -0.64 -0.03 0.00 0.00 0.00 0.00 19.45 18.93 1ttj n ALA 171 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1ttj s ILE 172 N -2.71 3.78 0.00 0.00 1.01 -0.97 -2.27 121.20 120.04 1ttj s ILE 172 Ca 0.06 0.64 0.00 0.00 0.00 0.00 0.00 60.65 61.35 1ttj s ILE 172 Cb 0.13 -4.50 0.00 0.00 0.01 0.00 0.00 42.46 38.10 1ttj s ILE 172 CO 0.73 -1.26 0.00 0.61 0.00 0.00 0.00 174.94 175.02 1ttj n GLY 173 N 5.27 0.90 0.10 6.18 0.00 -1.26 -4.90 105.19 111.48 1ttj n GLY 173 Ca 0.11 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.11 1ttj n GLY 173 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1ttj h THR 174 N 0.00 0.85 0.00 2.61 1.35 -1.83 -3.48 112.91 112.41 1ttj h THR 174 Ca 0.00 -2.41 0.00 0.00 -0.55 0.00 0.00 66.41 63.45 1ttj h THR 174 Cb 0.00 2.33 0.00 0.00 -1.73 0.00 0.00 68.15 68.76 1ttj h THR 174 CO 0.00 0.48 0.00 0.61 -0.25 0.00 0.00 175.52 176.36 1ttj n GLY 175 N 1.37 0.76 3.21 5.82 0.00 -1.26 -4.99 105.19 110.11 1ttj n GLY 175 Ca -0.06 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.55 1ttj n GLY 175 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1ttj s LYS 176 N -0.67 3.35 0.46 1.61 2.20 -1.26 -5.07 119.74 120.37 1ttj s LYS 176 Ca 0.00 -2.86 -0.20 0.00 -0.36 0.00 0.00 55.97 52.55 1ttj s LYS 176 Cb 0.00 -4.14 -0.10 0.00 -1.51 0.00 0.00 37.83 32.09 1ttj s LYS 176 CO 0.00 -1.24 0.97 0.54 -0.36 0.00 0.00 175.35 175.26 1ttj s VAL 177 N -0.60 4.33 0.34 4.02 0.11 -1.26 -4.19 120.40 123.14 1ttj s VAL 177 Ca 0.23 1.36 -0.27 0.00 -2.93 0.00 0.00 61.98 60.36 1ttj s VAL 177 Cb -0.12 -3.60 -0.09 0.00 -1.53 0.00 0.00 36.38 31.03 1ttj s VAL 177 CO -0.08 -0.40 1.15 0.00 -3.33 0.00 0.00 175.10 172.43 1ttj s ALA 178 N -2.27 3.31 0.89 1.54 0.00 -1.26 -4.98 121.76 118.99 1ttj s ALA 178 Ca 0.62 0.96 -0.11 0.00 0.00 0.00 0.00 51.96 53.42 1ttj s ALA 178 Cb -0.10 -3.36 0.13 0.00 0.00 0.00 0.00 23.12 19.78 1ttj s ALA 178 CO 0.19 -0.35 1.09 0.95 0.00 0.00 0.00 175.76 177.64 1ttj s THR 179 N -1.29 2.68 0.45 0.00 -4.23 -1.26 -4.76 115.64 107.24 1ttj s THR 179 Ca 0.50 0.22 0.14 0.00 -1.18 0.00 0.00 61.69 61.37 1ttj s THR 179 Cb -0.32 -2.67 0.20 0.00 1.34 0.00 0.00 72.50 71.05 1ttj s THR 179 CO 0.41 -0.29 2.01 -0.65 -0.54 0.00 0.00 174.62 175.56 1ttj h PRO 180 N -1.55 0.06 -0.16 3.99 0.11 -1.93 -1.19 132.00 131.31 1ttj h PRO 180 Ca -0.49 -0.01 -0.13 0.00 0.11 0.00 0.00 66.00 65.48 1ttj h PRO 180 Cb 1.28 -0.01 -0.01 0.00 0.11 0.00 0.00 31.00 32.37 1ttj h PRO 180 CO 0.54 0.18 -0.46 1.96 -0.21 0.00 0.00 178.00 180.00 1ttj h GLN 181 N 0.06 0.41 0.31 1.05 7.50 -1.98 -1.96 115.11 120.49 1ttj h GLN 181 Ca 0.01 -0.22 -0.01 0.00 0.50 0.00 0.00 58.65 58.92 1ttj h GLN 181 Cb 0.25 0.01 0.00 0.00 0.05 0.00 0.00 27.48 27.80 1ttj h GLN 181 CO 0.02 0.79 -0.15 1.96 -1.50 0.00 0.00 178.83 179.95 1ttj h GLN 182 N 0.33 -0.40 -0.11 1.46 4.20 -1.59 -2.29 115.11 116.72 1ttj h GLN 182 Ca 0.02 0.03 0.04 0.00 0.06 0.00 0.00 58.65 58.80 1ttj h GLN 182 Cb 0.94 0.09 -0.06 0.00 0.30 0.00 0.00 27.48 28.75 1ttj h GLN 182 CO 0.08 -0.10 -0.43 0.00 -0.67 0.00 0.00 178.83 177.72 1ttj h ALA 183 N -0.13 -0.63 -0.87 3.87 0.00 -1.29 -0.98 119.26 119.24 1ttj h ALA 183 Ca -0.04 -0.02 0.10 0.00 0.00 0.00 0.00 54.91 54.95 1ttj h ALA 183 Cb 0.48 0.79 -0.06 0.00 0.00 0.00 0.00 17.79 19.00 1ttj h ALA 183 CO 0.07 -0.94 0.56 0.37 0.00 0.00 0.00 179.25 179.31 1ttj h GLN 184 N -0.51 0.81 -0.58 0.00 5.75 -1.40 0.30 115.11 119.47 1ttj h GLN 184 Ca 0.07 -0.05 -0.10 0.00 -0.15 0.00 0.00 58.65 58.41 1ttj h GLN 184 Cb 0.64 -0.18 -0.02 0.00 1.07 0.00 0.00 27.48 28.98 1ttj h GLN 184 CO -0.38 0.54 -0.04 1.49 -2.65 0.00 0.00 178.83 177.78 1ttj h GLU 185 N 0.84 1.06 0.12 1.69 4.81 -0.76 0.03 114.58 122.37 1ttj h GLU 185 Ca 0.40 -0.36 -0.01 0.00 -0.13 0.00 0.00 59.36 59.26 1ttj h GLU 185 Cb 0.43 -0.08 0.00 0.00 0.63 0.00 0.00 28.75 29.73 1ttj h GLU 185 CO -0.17 1.06 -0.06 0.00 -0.73 0.00 0.00 179.01 179.12 1ttj h ALA 186 N 0.96 -0.17 -0.76 2.92 0.00 0.21 -2.58 119.26 119.85 1ttj h ALA 186 Ca 0.16 -0.16 0.03 0.00 0.00 0.00 0.00 54.91 54.94 1ttj h ALA 186 Cb 0.61 0.06 -0.05 0.00 0.00 0.00 0.00 17.79 18.42 1ttj h ALA 186 CO 0.04 -0.44 0.48 0.45 0.00 0.00 0.00 179.25 179.78 1ttj h HIS 187 N -0.47 0.90 -0.58 0.00 3.86 -0.39 -2.38 115.15 116.08 1ttj h HIS 187 Ca -0.02 0.02 -0.04 0.00 -1.16 0.00 0.00 60.37 59.18 1ttj h HIS 187 Cb 0.38 -0.30 -0.03 0.00 1.06 0.00 0.00 27.41 28.52 1ttj h HIS 187 CO 0.02 0.52 0.20 0.00 0.86 0.00 0.00 177.93 179.54 1ttj h ALA 188 N 1.32 1.26 0.07 2.45 0.00 -1.01 -0.85 119.26 122.50 1ttj h ALA 188 Ca 0.30 -0.17 -0.00 0.00 0.00 0.00 0.00 54.91 55.04 1ttj h ALA 188 Cb 0.01 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.57 1ttj h ALA 188 CO -0.11 0.53 -0.03 1.25 0.00 0.00 0.00 179.25 180.89 1ttj h LEU 189 N 0.85 -0.08 -0.31 0.00 5.85 -1.04 -1.27 115.31 119.31 1ttj h LEU 189 Ca 0.20 -0.11 0.04 0.00 0.84 0.00 0.00 57.88 58.84 1ttj h LEU 189 Cb 0.22 0.02 -0.04 0.00 0.37 0.00 0.00 40.66 41.23 1ttj h LEU 189 CO -0.01 0.07 0.08 0.40 -0.34 0.00 0.00 178.44 178.63 1ttj h ILE 190 N -0.22 0.88 -0.56 4.05 2.04 -1.19 -1.52 117.51 120.99 1ttj h ILE 190 Ca -0.01 -0.07 -0.03 0.00 1.00 0.00 0.00 64.86 65.75 1ttj h ILE 190 Cb 0.19 0.66 -0.02 0.00 -0.74 0.00 0.00 36.82 36.90 1ttj h ILE 190 CO 0.02 0.04 0.23 -0.09 0.00 0.00 0.00 178.15 178.34 1ttj h ARG 191 N 0.20 0.83 -0.77 2.37 2.43 -1.08 0.17 114.38 118.54 1ttj h ARG 191 Ca 0.14 -0.15 -0.05 0.00 -0.81 0.00 0.00 59.98 59.12 1ttj h ARG 191 Cb 0.14 -0.14 -0.03 0.00 -0.42 0.00 0.00 29.97 29.52 1ttj h ARG 191 CO -0.17 0.72 0.30 0.66 -1.51 0.00 0.00 179.97 179.96 1ttj h SER 192 N 0.76 1.07 -0.59 -3.80 4.64 -0.96 0.37 113.55 115.04 1ttj h SER 192 Ca 0.19 -0.17 -0.06 0.00 -0.47 0.00 0.00 61.79 61.27 1ttj h SER 192 Cb 0.19 -0.28 -0.02 0.00 -0.31 0.00 0.00 62.40 61.98 1ttj h SER 192 CO -0.02 0.95 0.13 -0.25 -0.87 0.00 0.00 176.83 176.78 1ttj h TRP 193 N 1.12 1.01 0.26 4.77 7.01 -0.96 0.13 115.95 129.29 1ttj h TRP 193 Ca 0.26 -0.13 -0.01 0.00 2.11 0.00 0.00 58.89 61.12 1ttj h TRP 193 Cb 0.23 -0.28 0.00 0.00 -2.10 0.00 0.00 29.16 27.01 1ttj h TRP 193 CO 0.02 0.86 -0.12 0.28 -2.79 0.00 0.00 178.44 176.69 1ttj h VAL 194 N 0.87 0.76 -0.76 2.65 2.07 -0.28 0.20 116.25 121.75 1ttj h VAL 194 Ca 0.18 -0.05 0.12 0.00 0.82 0.00 0.00 66.70 67.78 1ttj h VAL 194 Cb 0.37 0.79 -0.05 0.00 -1.52 0.00 0.00 31.29 30.88 1ttj h VAL 194 CO 0.00 0.01 0.50 -1.28 0.02 0.00 0.00 177.57 176.83 1ttj h SER 195 N -0.37 0.50 0.51 0.57 0.87 -0.01 0.54 113.55 116.16 1ttj h SER 195 Ca -0.04 0.02 -0.29 0.00 -1.23 0.00 0.00 61.79 60.25 1ttj h SER 195 Cb 0.28 -0.08 -0.02 0.00 -0.44 0.00 0.00 62.40 62.14 1ttj h SER 195 CO 0.06 0.28 -1.56 0.77 -0.53 0.00 0.00 176.83 175.85 1ttj h SER 196 N 0.54 0.21 0.47 6.23 4.64 -0.18 -2.94 113.55 122.53 1ttj h SER 196 Ca 0.36 -0.34 -0.30 0.00 -0.47 0.00 0.00 61.79 61.05 1ttj h SER 196 Cb 0.66 -0.07 -0.04 0.00 -0.31 0.00 0.00 62.40 62.64 1ttj h SER 196 CO -0.13 1.29 -1.68 0.11 -0.87 0.00 0.00 176.83 175.54 1ttj h LYS 197 N 0.04 0.06 0.00 4.77 1.79 -0.37 -3.43 116.57 119.44 1ttj h LYS 197 Ca -0.24 -0.11 -0.28 0.00 -2.18 0.00 0.00 60.65 57.84 1ttj h LYS 197 Cb 1.98 0.04 -0.04 0.00 -1.58 0.00 0.00 32.23 32.63 1ttj h LYS 197 CO 0.12 0.70 -1.92 -0.89 -1.08 0.00 0.00 179.45 176.38 1ttj n ILE 198 N -3.17 0.92 0.00 1.86 2.08 0.19 -5.07 119.36 116.16 1ttj n ILE 198 Ca -0.18 -0.23 0.00 0.00 0.56 0.00 0.00 62.75 62.90 1ttj n ILE 198 Cb 1.04 -1.73 0.00 0.00 -0.75 0.00 0.00 39.64 38.20 1ttj n ILE 198 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 1ttj n GLY 199 N 1.96 4.38 0.36 7.39 0.00 -0.89 -4.94 105.19 113.44 1ttj n GLY 199 Ca -0.33 -0.70 0.06 0.00 0.00 0.00 0.00 46.02 45.05 1ttj n GLY 199 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ttj h ALA 200 N 0.00 1.62 -0.55 4.61 0.00 -1.85 -0.94 119.26 122.15 1ttj h ALA 200 Ca 0.00 -0.02 -0.05 0.00 0.00 0.00 0.00 54.91 54.85 1ttj h ALA 200 Cb 0.00 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.54 1ttj h ALA 200 CO 0.00 0.25 0.16 0.38 0.00 0.00 0.00 179.25 180.04 1ttj h ASP 201 N 0.89 0.80 0.20 0.00 2.03 -1.94 0.11 116.42 118.51 1ttj h ASP 201 Ca 0.36 -0.21 -0.01 0.00 -0.73 0.00 0.00 57.03 56.44 1ttj h ASP 201 Cb 0.27 -0.21 0.00 0.00 -0.83 0.00 0.00 39.33 38.56 1ttj h ASP 201 CO -0.13 0.80 -0.10 0.58 -1.03 0.00 0.00 179.24 179.36 1ttj h VAL 202 N 0.76 0.89 -0.54 4.15 2.07 -1.79 -2.49 116.25 119.30 1ttj h VAL 202 Ca 0.17 -0.51 0.11 0.00 0.82 0.00 0.00 66.70 67.30 1ttj h VAL 202 Cb 0.29 1.19 -0.10 0.00 -1.52 0.00 0.00 31.29 31.15 1ttj h VAL 202 CO -0.00 0.11 -0.15 0.00 0.02 0.00 0.00 177.57 177.55 1ttj h ALA 203 N 0.22 0.33 0.00 1.67 0.00 -1.10 0.12 119.26 120.50 1ttj h ALA 203 Ca -0.03 0.21 -0.00 0.00 0.00 0.00 0.00 54.91 55.09 1ttj h ALA 203 Cb 0.39 0.44 -0.00 0.00 0.00 0.00 0.00 17.79 18.62 1ttj h ALA 203 CO 0.04 -0.45 -0.00 0.78 0.00 0.00 0.00 179.25 179.62 1ttj h GLY 204 N -0.02 0.00 0.38 0.00 0.00 -0.65 -2.28 103.07 100.50 1ttj h GLY 204 Ca 0.26 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.59 1ttj h GLY 204 CO -0.57 0.00 -1.26 1.18 0.00 0.00 0.00 176.54 175.89 1ttj n GLU 205 N -4.18 0.35 -2.17 4.80 1.02 0.24 -4.64 120.64 116.06 1ttj n GLU 205 Ca -0.03 -0.04 -0.42 0.00 -0.02 0.00 0.00 57.16 56.65 1ttj n GLU 205 Cb 0.09 -1.58 -0.03 0.00 -0.02 0.00 0.00 31.44 29.90 1ttj n GLU 205 CO 0.00 0.00 0.00 -1.17 1.18 0.00 0.00 177.13 177.14 1ttj s LEU 206 N -4.02 4.39 -0.33 -4.62 2.96 -0.11 -4.83 118.68 112.12 1ttj s LEU 206 Ca 0.01 2.39 -0.20 0.00 -0.22 0.00 0.00 54.13 56.11 1ttj s LEU 206 Cb 0.14 -3.60 -0.00 0.00 0.50 0.00 0.00 46.19 43.23 1ttj s LEU 206 CO 0.84 -0.61 0.62 -0.13 -1.32 0.00 0.00 176.35 175.76 1ttj s ARG 207 N 0.47 3.77 -0.36 1.98 3.00 -1.26 -4.90 118.95 121.65 1ttj s ARG 207 Ca 0.61 0.15 -0.05 0.00 0.00 0.00 0.00 55.73 56.44 1ttj s ARG 207 Cb -0.37 -3.77 0.07 0.00 0.00 0.00 0.00 34.95 30.87 1ttj s ARG 207 CO 0.35 -0.66 0.13 0.42 0.00 0.00 0.00 175.30 175.54 1ttj s ILE 208 N 2.65 3.53 0.36 1.52 1.01 -1.26 -2.00 121.20 127.01 1ttj s ILE 208 Ca 0.24 -1.47 -0.12 0.00 0.00 0.00 0.00 60.65 59.31 1ttj s ILE 208 Cb -0.15 -3.13 -0.07 0.00 0.01 0.00 0.00 42.46 39.12 1ttj s ILE 208 CO 0.13 -0.34 0.74 -0.76 0.00 0.00 0.00 174.94 174.71 1ttj s LEU 209 N 1.30 3.94 -0.09 2.97 1.43 0.10 -1.53 118.68 126.81 1ttj s LEU 209 Ca 0.01 1.16 -0.02 0.00 -1.03 0.00 0.00 54.13 54.24 1ttj s LEU 209 Cb -0.21 -4.00 -0.03 0.00 0.03 0.00 0.00 46.19 41.98 1ttj s LEU 209 CO -0.00 -0.31 0.00 -0.47 0.23 0.00 0.00 176.35 175.81 1ttj s TYR 210 N -2.20 3.16 -0.01 0.29 5.04 -0.16 -0.05 117.35 123.42 1ttj s TYR 210 Ca 0.52 0.19 -0.05 0.00 -2.44 0.00 0.00 57.07 55.29 1ttj s TYR 210 Cb -0.10 -1.79 0.00 0.00 0.35 0.00 0.00 41.96 40.42 1ttj s TYR 210 CO 0.26 0.47 0.10 0.20 -1.34 0.00 0.00 175.55 175.23 1ttj s GLY 211 N -0.87 0.02 0.00 8.97 0.00 -0.72 -1.36 107.32 113.37 1ttj s GLY 211 Ca 0.13 -0.02 0.00 0.00 0.00 0.00 0.00 44.72 44.83 1ttj s GLY 211 CO 0.02 -0.10 0.00 0.61 0.00 0.00 0.00 173.10 173.63 1ttj n GLY 212 N 2.16 1.90 2.47 0.20 0.00 -1.25 -4.03 105.19 106.64 1ttj n GLY 212 Ca -0.18 -0.49 -0.20 0.00 0.00 0.00 0.00 46.02 45.14 1ttj n GLY 212 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1ttj n SER 213 N 0.00 -5.77 -4.77 1.61 7.64 -0.96 -4.42 113.62 106.95 1ttj n SER 213 Ca 0.00 -0.06 -0.38 0.00 1.01 0.00 0.00 58.87 59.44 1ttj n SER 213 Cb 0.00 -4.76 -0.02 0.00 -1.01 0.00 0.00 64.21 58.42 1ttj n SER 213 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 1ttj s VAL 214 N -3.02 3.07 0.33 0.44 1.01 -1.26 -4.71 120.40 116.25 1ttj s VAL 214 Ca 0.04 0.90 0.08 0.00 0.00 0.00 0.00 61.98 63.00 1ttj s VAL 214 Cb -0.02 -3.51 -0.03 0.00 0.00 0.00 0.00 36.38 32.82 1ttj s VAL 214 CO 0.05 0.09 0.28 -0.46 0.00 0.00 0.00 175.10 175.06 1ttj n ASN 215 N 0.09 -0.64 0.24 3.32 0.23 -1.26 -4.47 115.26 112.76 1ttj n ASN 215 Ca 0.04 -3.17 0.07 0.00 -0.53 0.00 0.00 54.58 51.00 1ttj n ASN 215 Cb 0.46 1.64 0.59 0.00 -2.08 0.00 0.00 39.78 40.38 1ttj n ASN 215 CO 0.00 0.00 0.00 1.23 -0.93 0.00 0.00 177.26 177.56 1ttj h GLY 216 N 2.01 0.00 0.85 4.83 0.00 -1.94 -1.68 103.07 107.15 1ttj h GLY 216 Ca -0.23 0.00 -0.33 0.00 0.00 0.00 0.00 47.33 46.76 1ttj h GLY 216 CO 0.34 0.00 -1.65 0.07 0.00 0.00 0.00 176.54 175.31 1ttj h LYS 217 N 0.00 0.37 0.00 4.80 -0.00 -1.96 -3.37 116.57 116.41 1ttj h LYS 217 Ca -0.00 -0.64 -0.01 0.00 -0.00 0.00 0.00 60.65 60.00 1ttj h LYS 217 Cb 0.23 0.24 -0.00 0.00 -0.00 0.00 0.00 32.23 32.69 1ttj h LYS 217 CO 0.02 1.31 -0.20 -2.95 -0.00 0.00 0.00 179.45 177.62 1ttj h ASN 218 N 0.01 0.00 -0.15 7.07 7.08 -1.93 -3.39 115.58 124.27 1ttj h ASN 218 Ca -0.33 0.00 0.05 0.00 -3.08 0.00 0.00 56.30 52.94 1ttj h ASN 218 Cb 2.02 0.00 -0.07 0.00 -2.08 0.00 0.00 38.32 38.20 1ttj h ASN 218 CO 0.16 0.04 -0.38 0.00 -2.08 0.00 0.00 177.43 175.17 1ttj h ALA 219 N 1.96 -0.49 -0.93 4.14 0.00 -1.47 -3.05 119.26 119.42 1ttj h ALA 219 Ca -0.00 0.01 0.22 0.00 0.00 0.00 0.00 54.91 55.13 1ttj h ALA 219 Cb 1.03 0.72 -0.12 0.00 0.00 0.00 0.00 17.79 19.42 1ttj h ALA 219 CO 0.00 -0.87 0.48 -0.09 0.00 0.00 0.00 179.25 178.78 1ttj h ARG 220 N -0.44 0.51 -0.22 0.00 9.65 -1.81 -0.50 114.38 121.55 1ttj h ARG 220 Ca 0.09 -0.03 -0.17 0.00 -1.10 0.00 0.00 59.98 58.77 1ttj h ARG 220 Cb 0.59 -0.11 -0.00 0.00 -1.39 0.00 0.00 29.97 29.06 1ttj h ARG 220 CO -0.39 0.33 -0.56 1.15 2.80 0.00 0.00 179.97 183.30 1ttj h THR 221 N 0.52 1.30 0.09 0.20 2.02 -1.83 -2.58 112.91 112.63 1ttj h THR 221 Ca 0.58 -1.79 -0.00 0.00 0.77 0.00 0.00 66.41 65.96 1ttj h THR 221 Cb 1.05 1.73 0.00 0.00 -1.74 0.00 0.00 68.15 69.19 1ttj h THR 221 CO -0.48 0.57 -0.04 -0.07 0.37 0.00 0.00 175.52 175.87 1ttj h LEU 222 N 0.52 -0.11 -2.11 2.58 3.38 -1.15 -2.89 115.31 115.53 1ttj h LEU 222 Ca 0.01 -0.18 0.07 0.00 0.09 0.00 0.00 57.88 57.87 1ttj h LEU 222 Cb 1.14 0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.90 1ttj h LEU 222 CO 0.11 0.12 0.22 0.22 0.09 0.00 0.00 178.44 179.20 1ttj h TYR 223 N -0.34 0.00 0.00 1.13 3.20 -1.15 -1.11 116.97 118.70 1ttj h TYR 223 Ca -0.01 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.86 1ttj h TYR 223 Cb 0.28 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.55 1ttj h TYR 223 CO -0.00 0.00 0.00 1.96 -1.64 0.00 0.00 178.16 178.48 1ttj h GLN 224 N 0.00 0.00 -6.93 1.82 4.20 -1.23 -3.44 115.11 109.53 1ttj h GLN 224 Ca 0.12 0.00 -0.53 0.00 0.06 0.00 0.00 58.65 58.30 1ttj h GLN 224 Cb 0.55 0.00 0.09 0.00 0.30 0.00 0.00 27.48 28.43 1ttj h GLN 224 CO -0.00 0.00 0.72 -0.65 -0.67 0.00 0.00 178.83 178.23 1ttj s GLN 225 N -3.43 4.16 0.39 1.46 -1.52 -0.42 -4.89 119.66 115.40 1ttj s GLN 225 Ca 0.04 2.42 0.13 0.00 -1.95 0.00 0.00 55.36 56.00 1ttj s GLN 225 Cb 0.09 -2.97 0.96 0.00 -0.22 0.00 0.00 33.01 30.87 1ttj s GLN 225 CO 0.47 -0.43 1.86 -0.09 -0.25 0.00 0.00 175.29 176.85 1ttj h ARG 226 N 3.07 0.52 -0.50 2.91 2.43 -1.88 -2.68 114.38 118.25 1ttj h ARG 226 Ca -0.50 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 58.64 1ttj h ARG 226 Cb 1.24 -0.12 0.00 0.00 -0.42 0.00 0.00 29.97 30.67 1ttj h ARG 226 CO 0.64 0.34 0.00 -0.25 -1.51 0.00 0.00 179.97 179.20 1ttj n ASP 227 N -4.55 3.92 -4.64 -3.80 8.00 -1.26 -4.93 116.55 109.29 1ttj n ASP 227 Ca 0.18 -2.33 -0.37 0.00 0.71 0.00 0.00 54.79 52.99 1ttj n ASP 227 Cb 0.59 -0.45 -0.10 0.00 -0.02 0.00 0.00 41.12 41.14 1ttj n ASP 227 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1ttj s VAL 228 N -1.61 5.35 -0.23 2.53 1.01 -1.01 -4.60 120.40 121.84 1ttj s VAL 228 Ca 0.41 0.19 0.16 0.00 0.00 0.00 0.00 61.98 62.73 1ttj s VAL 228 Cb 0.25 -3.51 0.55 0.00 0.00 0.00 0.00 36.38 33.67 1ttj s VAL 228 CO 0.21 0.32 1.44 0.59 0.00 0.00 0.00 175.10 177.66 1ttj n ASN 229 N 4.47 4.00 0.00 3.32 4.13 -0.58 -4.85 115.26 125.74 1ttj n ASN 229 Ca -0.15 -2.96 0.00 0.00 1.68 0.00 0.00 54.58 53.15 1ttj n ASN 229 Cb 0.52 -0.54 0.00 0.00 -1.54 0.00 0.00 39.78 38.22 1ttj n ASN 229 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1ttj n GLY 230 N -0.36 0.87 3.15 7.41 0.00 -1.26 -1.65 105.19 113.35 1ttj n GLY 230 Ca 0.21 -1.97 -0.08 0.00 0.00 0.00 0.00 46.02 44.18 1ttj n GLY 230 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1ttj s PHE 231 N -2.02 0.33 -0.28 1.61 0.08 -0.70 -0.99 117.98 116.02 1ttj s PHE 231 Ca 0.00 -0.82 -0.01 0.00 0.12 0.00 0.00 56.93 56.22 1ttj s PHE 231 Cb 0.00 -0.22 0.05 0.00 -0.57 0.00 0.00 43.02 42.27 1ttj s PHE 231 CO 0.00 -0.46 -0.03 -1.17 -0.10 0.00 0.00 175.22 173.45 1ttj s LEU 232 N -2.88 3.64 -0.16 -0.37 2.96 -0.46 -0.64 118.68 120.77 1ttj s LEU 232 Ca 0.06 -1.19 0.01 0.00 -0.22 0.00 0.00 54.13 52.79 1ttj s LEU 232 Cb 0.06 -1.67 0.00 0.00 0.50 0.00 0.00 46.19 45.08 1ttj s LEU 232 CO -0.10 -0.21 -0.17 -0.69 -1.32 0.00 0.00 176.35 173.85 1ttj s VAL 233 N 1.25 2.47 0.00 1.68 1.01 0.19 -3.78 120.40 123.22 1ttj s VAL 233 Ca -0.04 -0.83 0.00 0.00 0.00 0.00 0.00 61.98 61.10 1ttj s VAL 233 Cb -0.19 -2.03 0.00 0.00 0.00 0.00 0.00 36.38 34.16 1ttj s VAL 233 CO -0.03 0.52 0.00 0.61 0.00 0.00 0.00 175.10 176.21 1ttj n GLY 234 N 4.15 0.45 0.24 4.51 0.00 -1.26 -1.06 105.19 112.22 1ttj n GLY 234 Ca -0.19 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.71 1ttj n GLY 234 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1ttj h GLY 235 N 0.00 -0.33 2.00 -0.02 0.00 -1.91 -1.81 103.07 101.01 1ttj h GLY 235 Ca 0.00 0.24 0.00 0.00 0.00 0.00 0.00 47.33 47.57 1ttj h GLY 235 CO 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 176.54 176.36 1ttj h ALA 236 N 0.49 1.00 0.00 3.60 0.00 -1.88 -1.70 119.26 120.77 1ttj h ALA 236 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1ttj h ALA 236 Cb 0.40 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.19 1ttj h ALA 236 CO -0.14 0.00 -0.01 -1.13 0.00 0.00 0.00 179.25 177.96 1ttj n SER 237 N -2.55 0.23 -0.96 0.00 3.41 -0.68 -2.52 113.62 110.54 1ttj n SER 237 Ca -0.01 0.50 0.09 0.00 -0.26 0.00 0.00 58.87 59.19 1ttj n SER 237 Cb 0.09 -0.56 0.24 0.00 -0.26 0.00 0.00 64.21 63.72 1ttj n SER 237 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1ttj n LEU 238 N -1.70 2.80 -4.43 1.04 7.99 -0.64 -4.89 117.00 117.17 1ttj n LEU 238 Ca 0.07 -1.38 -0.21 0.00 -0.01 0.00 0.00 56.01 54.47 1ttj n LEU 238 Cb 0.36 -0.34 -0.11 0.00 -0.11 0.00 0.00 43.42 43.23 1ttj n LEU 238 CO 0.28 0.69 -0.30 -0.54 -1.51 0.00 0.00 177.39 176.02 1ttj s LYS 239 N -1.33 1.60 0.36 3.23 1.02 -1.05 -5.02 119.74 118.56 1ttj s LYS 239 Ca 0.35 -1.87 0.27 0.00 0.02 0.00 0.00 55.97 54.75 1ttj s LYS 239 Cb 0.19 -0.90 1.15 0.00 -0.52 0.00 0.00 37.83 37.74 1ttj s LYS 239 CO 0.25 -0.13 1.81 -1.35 -0.92 0.00 0.00 175.35 175.01 1ttj h PRO 240 N 2.18 0.00 0.00 -1.68 0.11 -1.90 -2.51 132.00 128.20 1ttj h PRO 240 Ca -0.40 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.71 1ttj h PRO 240 Cb 1.24 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.35 1ttj h PRO 240 CO 0.69 0.00 0.00 1.05 -0.21 0.00 0.00 178.00 179.53 1ttj h GLU 241 N 0.00 0.00 -0.92 1.05 4.11 -1.96 -1.90 114.58 114.96 1ttj h GLU 241 Ca 0.00 0.00 0.16 0.00 0.07 0.00 0.00 59.36 59.59 1ttj h GLU 241 Cb 0.38 0.00 -0.08 0.00 0.50 0.00 0.00 28.75 29.55 1ttj h GLU 241 CO 0.00 0.00 0.59 0.35 0.07 0.00 0.00 179.01 180.02 1ttj h PHE 242 N 0.00 0.85 -0.67 2.06 3.57 -1.42 0.37 116.94 121.70 1ttj h PHE 242 Ca 0.00 0.03 0.05 0.00 3.53 0.00 0.00 57.97 61.57 1ttj h PHE 242 Cb 0.10 -0.27 -0.04 0.00 2.79 0.00 0.00 35.95 38.53 1ttj h PHE 242 CO 0.00 0.29 0.44 0.28 -2.23 0.00 0.00 178.31 177.09 1ttj h VAL 243 N 0.70 1.05 -0.09 1.41 2.07 -1.59 0.41 116.25 120.21 1ttj h VAL 243 Ca 0.47 -0.25 -0.16 0.00 0.82 0.00 0.00 66.70 67.58 1ttj h VAL 243 Cb 0.78 0.25 -0.01 0.00 -1.52 0.00 0.00 31.29 30.79 1ttj h VAL 243 CO -0.23 0.13 -0.63 0.44 0.02 0.00 0.00 177.57 177.30 1ttj h ASP 244 N 0.74 0.39 -0.07 0.57 3.32 -0.46 -1.45 116.42 119.45 1ttj h ASP 244 Ca 0.28 -0.23 -0.00 0.00 0.02 0.00 0.00 57.03 57.10 1ttj h ASP 244 Cb 0.17 -0.11 -0.00 0.00 0.22 0.00 0.00 39.33 39.60 1ttj h ASP 244 CO -0.08 0.92 0.03 0.40 -1.72 0.00 0.00 179.24 178.78 1ttj h ILE 245 N 0.25 1.11 -0.50 0.35 2.04 0.67 -1.57 117.51 119.86 1ttj h ILE 245 Ca -0.01 -0.32 0.09 0.00 1.00 0.00 0.00 64.86 65.62 1ttj h ILE 245 Cb 1.16 1.20 -0.07 0.00 -0.74 0.00 0.00 36.82 38.36 1ttj h ILE 245 CO 0.10 0.09 0.07 0.40 0.00 0.00 0.00 178.15 178.81 1ttj h ILE 246 N -0.01 0.68 0.00 -0.67 2.04 -0.13 -1.42 117.51 118.00 1ttj h ILE 246 Ca 0.02 -0.07 -0.02 0.00 1.00 0.00 0.00 64.86 65.80 1ttj h ILE 246 Cb 0.12 0.47 -0.00 0.00 -0.74 0.00 0.00 36.82 36.67 1ttj h ILE 246 CO -0.00 0.04 -0.08 0.11 0.00 0.00 0.00 178.15 178.21 1ttj h LYS 247 N 0.19 0.00 0.00 2.37 1.57 -0.86 -2.17 116.57 117.67 1ttj h LYS 247 Ca 0.25 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.03 1ttj h LYS 247 Cb 0.35 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.66 1ttj h LYS 247 CO -0.36 0.08 0.00 0.00 -0.57 0.00 0.00 179.45 178.60 1ttj n ALA 248 N -2.31 1.56 0.30 3.86 0.00 -0.54 -1.79 120.51 121.59 1ttj n ALA 248 Ca -0.02 -0.04 0.11 0.00 0.00 0.00 0.00 53.44 53.49 1ttj n ALA 248 Cb 0.18 -1.16 0.26 0.00 0.00 0.00 0.00 19.45 18.73 1ttj n ALA 248 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1ttj n THR 249 N -1.37 0.60 0.26 0.00 -2.24 -0.81 -4.70 114.28 106.02 1ttj n THR 249 Ca 0.04 -0.73 0.02 0.00 -2.27 0.00 0.00 64.05 61.10 1ttj n THR 249 Cb 0.09 0.68 0.12 0.00 -2.10 0.00 0.00 70.33 69.12 1ttj n THR 249 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50