#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1def s VAL 2 N 0.00 1.10 -0.49 -3.33 1.01 -1.26 -3.04 120.40 114.38 1def s VAL 2 Ca 0.00 -2.05 -0.06 0.00 0.00 0.00 0.00 61.98 59.87 1def s VAL 2 Cb 0.00 -1.98 -0.15 0.00 0.00 0.00 0.00 36.38 34.24 1def s VAL 2 CO 0.00 -0.63 3.28 0.18 0.00 0.00 0.00 175.10 177.93 1def n LEU 3 N -0.25 6.35 0.05 3.92 4.32 -1.26 -3.57 117.00 126.56 1def n LEU 3 Ca -0.09 -3.68 0.00 0.00 -0.02 0.00 0.00 56.01 52.22 1def n LEU 3 Cb 0.62 -1.41 0.00 0.00 -1.62 0.00 0.00 43.42 41.00 1def n LEU 3 CO 0.33 1.81 -0.03 1.67 -1.22 0.00 0.00 177.39 179.95 1def n GLN 4 N 2.41 0.00 0.00 3.23 0.00 -1.26 -5.07 117.38 116.69 1def n GLN 4 Ca 0.53 0.00 0.00 0.00 -0.00 0.00 0.00 57.00 57.53 1def n GLN 4 Cb 0.68 -0.47 0.00 0.00 0.00 0.00 0.00 30.24 30.45 1def n GLN 4 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.06 177.34 1def n VAL 5 N -3.47 0.00 -4.45 1.69 0.31 -1.23 -4.93 118.33 106.25 1def n VAL 5 Ca 0.00 0.00 -0.34 0.00 -0.01 0.00 0.00 64.34 63.99 1def n VAL 5 Cb 0.03 0.00 -0.14 0.00 -0.91 0.00 0.00 33.84 32.81 1def n VAL 5 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 1def s LEU 6 N 0.00 2.73 -0.38 7.52 1.43 -1.26 -4.88 118.68 123.84 1def s LEU 6 Ca 0.00 -0.37 0.07 0.00 -1.03 0.00 0.00 54.13 52.80 1def s LEU 6 Cb 0.00 -1.64 0.68 0.00 0.03 0.00 0.00 46.19 45.26 1def s LEU 6 CO 0.00 0.09 1.83 1.41 0.23 0.00 0.00 176.35 179.91 1def n HIS 7 N 4.01 2.61 0.00 0.29 8.25 -1.13 -4.11 115.22 125.13 1def n HIS 7 Ca -0.18 -1.56 0.00 0.00 -0.26 0.00 0.00 57.72 55.72 1def n HIS 7 Cb 0.52 -0.79 0.00 0.00 1.12 0.00 0.00 29.99 30.83 1def n HIS 7 CO 0.00 0.00 0.00 0.44 0.64 0.00 0.00 176.34 177.42 1def n ILE 8 N -0.75 0.00 -2.76 1.59 -0.00 -1.26 -4.94 119.36 111.23 1def n ILE 8 Ca 0.49 0.00 0.00 0.00 -0.00 0.00 0.00 62.75 63.24 1def n ILE 8 Cb 1.49 0.09 0.00 0.00 -0.00 0.00 0.00 39.64 41.22 1def n ILE 8 CO 0.00 0.00 0.00 -0.81 -0.00 0.00 0.00 176.55 175.74 1def n PRO 9 N -0.85 1.76 0.00 6.28 -0.04 -1.26 -5.05 135.00 135.84 1def n PRO 9 Ca 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 1def n PRO 9 Cb 0.05 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.51 1def n PRO 9 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1def n ASP 10 N -1.88 -1.34 -2.91 3.54 9.92 -1.26 -4.54 116.55 118.08 1def n ASP 10 Ca 0.00 0.00 -0.25 0.00 -0.53 0.00 0.00 54.79 54.01 1def n ASP 10 Cb 0.00 0.00 -0.03 0.00 -0.64 0.00 0.00 41.12 40.45 1def n ASP 10 CO 0.00 0.00 0.00 -1.84 0.13 0.00 0.00 177.20 175.49 1def n GLU 11 N -0.03 2.90 -0.15 -1.24 0.28 0.61 -4.92 120.64 118.08 1def n GLU 11 Ca 0.00 -4.57 -0.04 0.00 -0.16 0.00 0.00 57.16 52.39 1def n GLU 11 Cb 0.00 -2.14 -0.04 0.00 1.43 0.00 0.00 31.44 30.69 1def n GLU 11 CO 0.00 0.00 0.00 2.89 -0.16 0.00 0.00 177.13 179.86 1def n ARG 12 N -0.20 -0.16 -2.36 3.44 1.85 0.21 -4.38 116.66 115.06 1def n ARG 12 Ca 0.31 0.55 -0.11 0.00 -1.00 0.00 0.00 57.85 57.59 1def n ARG 12 Cb 0.47 -0.80 -0.02 0.00 -1.05 0.00 0.00 32.46 31.06 1def n ARG 12 CO 0.00 0.00 0.00 1.28 -0.01 0.00 0.00 177.63 178.90 1def n LEU 13 N -4.42 -0.22 -0.12 2.89 4.32 -1.26 -0.12 117.00 118.07 1def n LEU 13 Ca 0.01 -0.33 0.00 0.00 -0.02 0.00 0.00 56.01 55.66 1def n LEU 13 Cb 0.09 -0.42 0.00 0.00 -1.62 0.00 0.00 43.42 41.47 1def n LEU 13 CO -0.06 0.03 0.00 -1.14 -1.22 0.00 0.00 177.39 175.01 1def n ARG 14 N -1.48 0.00 0.13 3.23 0.63 -1.26 -5.02 116.66 112.88 1def n ARG 14 Ca 0.02 0.04 0.01 0.00 -0.92 0.00 0.00 57.85 57.00 1def n ARG 14 Cb 0.12 -0.12 0.04 0.00 0.45 0.00 0.00 32.46 32.96 1def n ARG 14 CO 0.00 0.00 0.00 -0.22 -2.51 0.00 0.00 177.63 174.90 1def h LYS 15 N 0.00 0.00 -0.03 -0.14 1.63 -0.84 -3.46 116.57 113.72 1def h LYS 15 Ca 0.00 0.00 -0.00 0.00 -0.85 0.00 0.00 60.65 59.80 1def h LYS 15 Cb 0.06 0.00 -0.00 0.00 -0.60 0.00 0.00 32.23 31.69 1def h LYS 15 CO 0.00 0.60 0.01 0.28 -3.45 0.00 0.00 179.45 176.90 1def n VAL 16 N -3.31 0.00 0.00 2.00 0.31 -1.26 -3.88 118.33 112.18 1def n VAL 16 Ca 0.01 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.34 1def n VAL 16 Cb 0.75 -0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.67 1def n VAL 16 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1def n ALA 17 N 0.07 -0.95 -3.00 3.52 0.00 -1.26 -4.88 120.51 114.00 1def n ALA 17 Ca 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 53.44 53.17 1def n ALA 17 Cb 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.41 1def n ALA 17 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 1def n LYS 18 N 0.20 3.19 0.00 0.00 3.00 -1.25 -5.02 118.16 118.28 1def n LYS 18 Ca 0.00 -4.84 0.00 0.00 -0.00 0.00 0.00 58.31 53.47 1def n LYS 18 Cb 0.00 -2.25 0.00 0.00 0.00 0.00 0.00 35.03 32.78 1def n LYS 18 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.40 177.05 1def n PRO 19 N -0.09 1.13 -3.01 1.64 -0.04 -1.26 -3.94 135.00 129.43 1def n PRO 19 Ca 0.31 0.00 -0.41 0.00 -0.04 0.00 0.00 63.50 63.36 1def n PRO 19 Cb 0.39 0.00 -0.05 0.00 -0.04 0.00 0.00 33.50 33.80 1def n PRO 19 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1def s VAL 20 N 0.00 4.91 -0.02 0.52 1.01 -1.26 -4.12 120.40 121.44 1def s VAL 20 Ca 0.00 1.30 -0.03 0.00 0.00 0.00 0.00 61.98 63.24 1def s VAL 20 Cb 0.00 -4.03 -0.02 0.00 0.00 0.00 0.00 36.38 32.33 1def s VAL 20 CO 0.00 -0.04 -0.07 1.21 0.00 0.00 0.00 175.10 176.19 1def n GLU 21 N 5.88 0.12 0.00 2.72 2.13 -1.26 -4.56 120.64 125.67 1def n GLU 21 Ca 0.02 0.05 -0.00 0.00 0.66 0.00 0.00 57.16 57.89 1def n GLU 21 Cb 0.48 -0.70 -0.00 0.00 0.27 0.00 0.00 31.44 31.49 1def n GLU 21 CO 0.00 0.00 0.00 -1.91 -0.41 0.00 0.00 177.13 174.81 1def n GLU 22 N -3.44 0.00 0.00 5.31 2.13 -1.26 -4.93 120.64 118.45 1def n GLU 22 Ca -0.08 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.74 1def n GLU 22 Cb 0.39 -0.03 0.00 0.00 0.27 0.00 0.00 31.44 32.08 1def n GLU 22 CO 0.00 0.00 0.00 0.28 -0.41 0.00 0.00 177.13 177.00 1def n VAL 23 N -2.51 0.00 -3.25 6.31 0.31 -1.26 -4.49 118.33 113.43 1def n VAL 23 Ca -0.00 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 1def n VAL 23 Cb 0.00 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 32.93 1def n VAL 23 CO 0.00 0.00 0.00 -0.46 -1.32 0.00 0.00 176.83 175.05 1def n ASN 24 N 0.00 0.76 -1.83 4.52 2.04 -1.26 -5.02 115.26 114.47 1def n ASN 24 Ca 0.00 -0.25 -0.04 0.00 -0.44 0.00 0.00 54.58 53.85 1def n ASN 24 Cb 0.00 0.00 0.27 0.00 -2.53 0.00 0.00 39.78 37.52 1def n ASN 24 CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 1def n ALA 25 N -3.00 4.25 -0.20 -2.53 0.00 -1.26 -3.39 120.51 114.38 1def n ALA 25 Ca 0.00 -1.95 0.00 0.00 0.00 0.00 0.00 53.44 51.49 1def n ALA 25 Cb 0.00 -1.21 0.00 0.00 0.00 0.00 0.00 19.45 18.24 1def n ALA 25 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1def n GLU 26 N -0.01 0.65 -0.03 0.00 2.13 -1.26 -4.56 120.64 117.56 1def n GLU 26 Ca 0.34 -0.81 -0.15 0.00 0.66 0.00 0.00 57.16 57.21 1def n GLU 26 Cb 1.23 -0.90 -0.14 0.00 0.27 0.00 0.00 31.44 31.90 1def n GLU 26 CO 0.00 0.00 0.00 -0.89 -0.41 0.00 0.00 177.13 175.83 1def n ILE 27 N -0.18 1.65 -0.28 6.31 2.08 -1.22 -3.77 119.36 123.96 1def n ILE 27 Ca 0.00 -0.73 0.08 0.00 0.56 0.00 0.00 62.75 62.66 1def n ILE 27 Cb 0.16 -1.30 0.23 0.00 -0.75 0.00 0.00 39.64 37.98 1def n ILE 27 CO 0.00 0.00 0.00 0.06 0.56 0.00 0.00 176.55 177.17 1def h GLN 28 N 0.03 0.41 0.00 0.38 -0.00 -1.80 0.86 115.11 114.98 1def h GLN 28 Ca -0.39 -0.02 -0.08 0.00 -0.00 0.00 0.00 58.65 58.15 1def h GLN 28 Cb 2.03 -0.09 -0.01 0.00 -0.00 0.00 0.00 27.48 29.41 1def h GLN 28 CO 0.07 0.27 -0.40 0.07 -0.00 0.00 0.00 178.83 178.83 1def h ARG 29 N 0.42 0.00 -0.42 0.06 0.11 -1.87 0.77 114.38 113.45 1def h ARG 29 Ca 0.46 0.00 -0.09 0.00 0.10 0.00 0.00 59.98 60.46 1def h ARG 29 Cb 0.77 0.00 -0.02 0.00 1.11 0.00 0.00 29.97 31.84 1def h ARG 29 CO -0.46 0.40 -0.09 0.82 0.10 0.00 0.00 179.97 180.75 1def h ILE 30 N 0.00 1.25 0.00 0.08 2.04 0.57 0.82 117.51 122.26 1def h ILE 30 Ca -0.00 -1.11 0.00 0.00 1.00 0.00 0.00 64.86 64.75 1def h ILE 30 Cb 0.90 1.02 0.00 0.00 -0.74 0.00 0.00 36.82 38.01 1def h ILE 30 CO 0.05 0.38 0.00 0.52 0.00 0.00 0.00 178.15 179.10 1def n VAL 31 N -4.18 0.00 -0.31 1.67 0.31 -0.20 -1.43 118.33 114.19 1def n VAL 31 Ca 0.01 0.65 0.27 0.00 -0.01 0.00 0.00 64.34 65.26 1def n VAL 31 Cb 0.34 -1.51 0.59 0.00 -0.91 0.00 0.00 33.84 32.35 1def n VAL 31 CO 0.00 0.00 0.00 0.44 -1.32 0.00 0.00 176.83 175.95 1def h ASP 32 N 0.00 0.29 0.53 4.52 5.19 0.44 0.11 116.42 127.51 1def h ASP 32 Ca 0.00 0.06 0.00 0.00 -0.62 0.00 0.00 57.03 56.47 1def h ASP 32 Cb 0.00 0.01 0.00 0.00 0.18 0.00 0.00 39.33 39.52 1def h ASP 32 CO 0.00 0.05 -1.20 -0.67 -3.12 0.00 0.00 179.24 174.30 1def n ASP 33 N -4.49 0.57 0.09 6.45 2.03 0.28 -2.28 116.55 119.20 1def n ASP 33 Ca 0.25 0.00 0.13 0.00 0.52 0.00 0.00 54.79 55.69 1def n ASP 33 Cb 0.98 0.91 0.45 0.00 -0.72 0.00 0.00 41.12 42.74 1def n ASP 33 CO 0.00 0.00 0.00 0.80 -1.92 0.00 0.00 177.20 176.08 1def n MET 34 N -2.24 0.20 0.10 -0.67 1.56 0.18 0.60 117.12 116.85 1def n MET 34 Ca 0.00 0.19 -0.09 0.00 -0.27 0.00 0.00 57.70 57.53 1def n MET 34 Cb 0.50 -1.75 -0.06 0.00 2.15 0.00 0.00 33.22 34.06 1def n MET 34 CO 0.00 0.00 0.00 0.74 -0.73 0.00 0.00 175.97 175.98 1def h PHE 35 N 0.00 -0.30 -1.14 1.12 0.04 -0.83 1.06 116.94 116.87 1def h PHE 35 Ca 0.00 -0.01 0.33 0.00 2.80 0.00 0.00 57.97 61.09 1def h PHE 35 Cb 0.65 0.10 -0.10 0.00 2.20 0.00 0.00 35.95 38.80 1def h PHE 35 CO 0.00 0.02 0.74 1.49 -0.60 0.00 0.00 178.31 179.97 1def h GLU 36 N -0.97 0.25 0.00 1.51 4.81 -0.91 0.76 114.58 120.03 1def h GLU 36 Ca -0.03 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.18 1def h GLU 36 Cb 0.46 -0.06 0.00 0.00 0.63 0.00 0.00 28.75 29.79 1def h GLU 36 CO 0.05 0.17 0.00 2.41 -0.73 0.00 0.00 179.01 180.91 1def n THR 37 N -4.61 0.00 -0.14 0.32 -1.04 0.20 -0.46 114.28 108.55 1def n THR 37 Ca 0.29 0.36 0.11 0.00 -2.04 0.00 0.00 64.05 62.78 1def n THR 37 Cb 1.09 -1.12 0.21 0.00 -1.82 0.00 0.00 70.33 68.69 1def n THR 37 CO 0.00 0.00 0.00 0.80 -0.64 0.00 0.00 175.07 175.23 1def n MET 38 N -1.65 -0.03 -0.06 -2.82 0.00 0.36 0.65 117.12 113.58 1def n MET 38 Ca 0.00 0.59 -0.18 0.00 -0.00 0.00 0.00 57.70 58.11 1def n MET 38 Cb 0.00 -1.02 -0.13 0.00 0.00 0.00 0.00 33.22 32.06 1def n MET 38 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 175.97 176.63 1def n TYR 39 N -4.08 0.62 -0.55 1.12 4.01 0.24 -4.28 117.16 114.24 1def n TYR 39 Ca 0.14 0.15 -0.17 0.00 -0.16 0.00 0.00 57.90 57.86 1def n TYR 39 Cb 0.48 -1.09 0.10 0.00 -0.31 0.00 0.00 39.34 38.52 1def n TYR 39 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1def n ALA 40 N -3.04 4.69 -1.35 -0.72 0.00 0.21 -4.45 120.51 115.86 1def n ALA 40 Ca -0.36 -1.91 0.00 0.00 0.00 0.00 0.00 53.44 51.16 1def n ALA 40 Cb 1.04 -1.33 0.00 0.00 0.00 0.00 0.00 19.45 19.16 1def n ALA 40 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1def n GLU 41 N -0.43 0.00 -2.98 0.00 0.00 0.05 -4.87 120.64 112.41 1def n GLU 41 Ca 0.38 0.00 -0.19 0.00 0.00 0.00 0.00 57.16 57.35 1def n GLU 41 Cb 1.10 0.00 -0.04 0.00 0.00 0.00 0.00 31.44 32.51 1def n GLU 41 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.13 177.52 1def n GLU 42 N -0.92 -1.37 0.00 5.31 -0.58 -1.26 -4.61 120.64 117.21 1def n GLU 42 Ca 0.00 0.06 0.00 0.00 -0.42 0.00 0.00 57.16 56.80 1def n GLU 42 Cb 0.00 -3.19 0.00 0.00 -0.57 0.00 0.00 31.44 27.68 1def n GLU 42 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1def n GLY 43 N -0.69 0.47 0.05 0.62 0.00 -1.26 -5.03 105.19 99.34 1def n GLY 43 Ca 0.05 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 46.01 1def n GLY 43 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1def n ILE 44 N -0.10 0.59 0.00 -0.61 -5.35 -1.26 -5.13 119.36 107.50 1def n ILE 44 Ca 0.00 -0.25 0.00 0.00 -0.27 0.00 0.00 62.75 62.23 1def n ILE 44 Cb 0.00 -0.85 0.00 0.00 -1.74 0.00 0.00 39.64 37.05 1def n ILE 44 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1def n GLY 45 N 2.89 3.95 3.23 3.28 0.00 -1.26 -4.56 105.19 112.72 1def n GLY 45 Ca -0.17 -1.38 -0.28 0.00 0.00 0.00 0.00 46.02 44.19 1def n GLY 45 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1def s LEU 46 N 0.00 2.02 0.00 0.99 1.02 -1.26 -4.92 118.68 116.54 1def s LEU 46 Ca 0.00 -0.41 0.07 0.00 0.02 0.00 0.00 54.13 53.81 1def s LEU 46 Cb 0.00 -1.15 0.07 0.00 0.02 0.00 0.00 46.19 45.13 1def s LEU 46 CO 0.00 0.24 0.56 0.00 0.02 0.00 0.00 176.35 177.17 1def n ALA 47 N 2.73 0.96 -3.18 4.21 0.00 -1.26 -4.72 120.51 119.25 1def n ALA 47 Ca -0.16 -1.98 -0.26 0.00 0.00 0.00 0.00 53.44 51.03 1def n ALA 47 Cb 0.52 0.68 -0.06 0.00 0.00 0.00 0.00 19.45 20.60 1def n ALA 47 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1def n ALA 48 N -2.17 4.12 0.00 0.00 0.00 -1.26 -0.31 120.51 120.89 1def n ALA 48 Ca -0.14 -4.58 0.00 0.00 0.00 0.00 0.00 53.44 48.72 1def n ALA 48 Cb 0.56 -0.82 0.00 0.00 0.00 0.00 0.00 19.45 19.19 1def n ALA 48 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.50 175.13 1def n THR 49 N 0.36 0.00 0.00 0.00 5.66 -1.26 -4.44 114.28 114.59 1def n THR 49 Ca 0.30 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.30 1def n THR 49 Cb 0.42 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.20 1def n THR 49 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1def n GLN 50 N 0.00 0.00 0.05 1.09 6.02 -1.26 -4.61 117.38 118.66 1def n GLN 50 Ca 0.00 0.00 -0.00 0.00 -0.01 0.00 0.00 57.00 56.99 1def n GLN 50 Cb 0.00 0.00 -0.00 0.00 1.02 0.00 0.00 30.24 31.26 1def n GLN 50 CO 0.00 0.00 0.00 1.33 -1.01 0.00 0.00 177.06 177.38 1def n VAL 51 N 0.00 1.16 0.00 5.09 0.24 -1.26 -3.74 118.33 119.82 1def n VAL 51 Ca 0.00 0.38 0.00 0.00 -2.04 0.00 0.00 64.34 62.68 1def n VAL 51 Cb 0.00 -1.59 0.00 0.00 -1.47 0.00 0.00 33.84 30.78 1def n VAL 51 CO 0.00 0.00 0.00 -0.67 -2.14 0.00 0.00 176.83 174.02 1def n ASP 52 N -3.47 0.00 -3.97 -1.34 2.03 -1.26 0.22 116.55 108.76 1def n ASP 52 Ca -0.00 0.00 -0.09 0.00 0.52 0.00 0.00 54.79 55.22 1def n ASP 52 Cb 0.04 0.00 -0.09 0.00 -0.72 0.00 0.00 41.12 40.34 1def n ASP 52 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 1def s ILE 53 N -0.07 0.16 0.32 5.18 1.01 -1.26 -4.42 121.20 122.11 1def s ILE 53 Ca 0.00 -1.28 -0.07 0.00 0.00 0.00 0.00 60.65 59.30 1def s ILE 53 Cb 0.00 -1.04 0.00 0.00 0.01 0.00 0.00 42.46 41.43 1def s ILE 53 CO 0.00 -0.71 0.50 -1.00 0.00 0.00 0.00 174.94 173.73 1def s HIS 54 N -2.98 0.77 0.28 3.97 3.76 -1.26 -5.04 115.29 114.79 1def s HIS 54 Ca -0.02 -1.09 -0.11 0.00 -0.15 0.00 0.00 55.06 53.69 1def s HIS 54 Cb 0.01 0.07 0.00 0.00 1.11 0.00 0.00 32.58 33.78 1def s HIS 54 CO -0.06 -1.13 0.51 -0.65 -0.85 0.00 0.00 174.74 172.56 1def s GLN 55 N -3.28 1.67 -0.35 1.40 -0.21 -1.25 -4.10 119.66 113.54 1def s GLN 55 Ca 0.27 -1.35 -0.06 0.00 0.02 0.00 0.00 55.36 54.24 1def s GLN 55 Cb -0.01 0.48 0.19 0.00 1.00 0.00 0.00 33.01 34.67 1def s GLN 55 CO 0.16 -0.70 0.97 1.03 -2.12 0.00 0.00 175.29 174.62 1def s ARG 56 N -3.71 0.32 -0.20 2.91 0.52 -1.26 -4.74 118.95 112.79 1def s ARG 56 Ca 0.23 -0.13 -0.07 0.00 -0.52 0.00 0.00 55.73 55.24 1def s ARG 56 Cb -0.01 0.03 -0.04 0.00 0.52 0.00 0.00 34.95 35.45 1def s ARG 56 CO 0.11 -0.45 0.06 0.42 0.02 0.00 0.00 175.30 175.46 1def s ILE 57 N 1.83 4.58 0.00 1.52 1.01 -1.26 -2.06 121.20 126.82 1def s ILE 57 Ca 0.16 -0.10 0.00 0.00 0.00 0.00 0.00 60.65 60.71 1def s ILE 57 Cb 0.03 -3.08 0.00 0.00 0.01 0.00 0.00 42.46 39.41 1def s ILE 57 CO -0.13 0.43 0.00 -0.38 0.00 0.00 0.00 174.94 174.86 1def n ILE 58 N 3.92 0.00 -4.18 2.92 -0.00 0.58 -3.98 119.36 118.62 1def n ILE 58 Ca -0.16 0.00 -0.11 0.00 -0.00 0.00 0.00 62.75 62.47 1def n ILE 58 Cb 0.52 -1.52 -0.10 0.00 -0.00 0.00 0.00 39.64 38.54 1def n ILE 58 CO 0.00 0.00 0.00 0.68 -0.00 0.00 0.00 176.55 177.23 1def s VAL 59 N 0.36 0.34 -0.22 1.39 -7.23 -1.25 -0.13 120.40 113.65 1def s VAL 59 Ca 0.00 -1.93 -0.19 0.00 -1.81 0.00 0.00 61.98 58.05 1def s VAL 59 Cb 0.00 -2.06 0.06 0.00 0.56 0.00 0.00 36.38 34.94 1def s VAL 59 CO 0.00 -0.48 0.58 0.27 -0.31 0.00 0.00 175.10 175.16 1def s ILE 60 N -3.89 -0.00 -0.43 -0.62 -4.36 -0.50 -4.48 121.20 106.92 1def s ILE 60 Ca 0.24 0.01 0.02 0.00 -0.26 0.00 0.00 60.65 60.66 1def s ILE 60 Cb 0.07 -0.82 0.15 0.00 1.25 0.00 0.00 42.46 43.11 1def s ILE 60 CO 0.02 0.00 0.28 -1.81 0.24 0.00 0.00 174.94 173.68 1def s ASP 61 N 0.53 2.87 -1.50 4.36 1.11 -1.22 0.66 116.67 123.48 1def s ASP 61 Ca -0.02 -2.73 -0.06 0.00 0.18 0.00 0.00 52.55 49.91 1def s ASP 61 Cb -0.05 -0.71 0.01 0.00 1.07 0.00 0.00 42.92 43.25 1def s ASP 61 CO -0.02 -0.23 0.78 0.52 1.18 0.00 0.00 175.17 177.39 1def n VAL 62 N 3.34 -2.25 1.23 -1.27 0.31 -0.50 -4.71 118.33 114.49 1def n VAL 62 Ca 0.17 0.00 0.13 0.00 -0.01 0.00 0.00 64.34 64.63 1def n VAL 62 Cb 0.39 -3.55 0.33 0.00 -0.91 0.00 0.00 33.84 30.11 1def n VAL 62 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 1def n SER 63 N -2.67 1.27 0.00 4.52 3.41 -1.26 -4.76 113.62 114.14 1def n SER 63 Ca -0.07 -1.08 0.00 0.00 -0.26 0.00 0.00 58.87 57.46 1def n SER 63 Cb 0.60 0.17 0.00 0.00 -0.26 0.00 0.00 64.21 64.72 1def n SER 63 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1def n GLU 64 N -0.42 0.00 0.04 4.33 -0.58 -1.26 -5.01 120.64 117.74 1def n GLU 64 Ca 0.13 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.87 1def n GLU 64 Cb 0.37 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 31.24 1def n GLU 64 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 1def n ASN 65 N 0.00 0.03 -2.67 1.62 3.02 -1.26 -4.93 115.26 111.07 1def n ASN 65 Ca 0.00 0.14 -0.28 0.00 -0.03 0.00 0.00 54.58 54.41 1def n ASN 65 Cb 0.00 0.08 -0.01 0.00 -0.61 0.00 0.00 39.78 39.24 1def n ASN 65 CO 0.00 0.00 0.00 -2.11 -2.62 0.00 0.00 177.26 172.53 1def n ARG 66 N -2.83 3.39 -4.64 3.52 1.85 -1.26 -5.01 116.66 111.68 1def n ARG 66 Ca 0.00 -4.57 -0.29 0.00 -1.00 0.00 0.00 57.85 51.99 1def n ARG 66 Cb 0.00 -2.25 -0.10 0.00 -1.05 0.00 0.00 32.46 29.05 1def n ARG 66 CO 0.00 0.00 0.00 0.16 -0.01 0.00 0.00 177.63 177.78 1def s ASP 67 N -3.34 3.89 0.00 2.89 -4.77 -1.26 -5.10 116.67 108.98 1def s ASP 67 Ca 0.48 -1.42 0.00 0.00 -3.30 0.00 0.00 52.55 48.31 1def s ASP 67 Cb 0.36 -0.23 0.00 0.00 -1.09 0.00 0.00 42.92 41.97 1def s ASP 67 CO -0.19 -0.53 0.00 -1.84 0.70 0.00 0.00 175.17 173.32 1def n GLU 68 N -1.02 2.61 -2.75 2.11 0.28 -1.26 -3.75 120.64 116.86 1def n GLU 68 Ca -0.07 0.00 -0.43 0.00 -0.16 0.00 0.00 57.16 56.49 1def n GLU 68 Cb 0.67 0.00 0.00 0.00 1.43 0.00 0.00 31.44 33.54 1def n GLU 68 CO 0.00 0.00 0.00 2.89 -0.16 0.00 0.00 177.13 179.86 1def n ARG 69 N 0.00 3.54 -1.55 3.44 0.00 -1.24 -1.40 116.66 119.44 1def n ARG 69 Ca 0.00 -3.82 -0.06 0.00 -0.00 0.00 0.00 57.85 53.98 1def n ARG 69 Cb 0.00 -2.93 0.02 0.00 -0.00 0.00 0.00 32.46 29.55 1def n ARG 69 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.63 177.52 1def n LEU 70 N 4.52 0.00 -4.79 2.89 7.94 0.21 -4.93 117.00 122.84 1def n LEU 70 Ca 0.36 -0.71 -0.26 0.00 -1.11 0.00 0.00 56.01 54.29 1def n LEU 70 Cb 0.39 -0.12 -0.06 0.00 0.53 0.00 0.00 43.42 44.17 1def n LEU 70 CO 0.69 -0.56 -0.12 -0.69 -1.11 0.00 0.00 177.39 175.60 1def s VAL 71 N -0.04 1.94 0.36 1.96 1.01 -1.26 -1.41 120.40 122.96 1def s VAL 71 Ca 0.17 -1.69 -0.04 0.00 0.00 0.00 0.00 61.98 60.42 1def s VAL 71 Cb -0.01 -2.63 0.01 0.00 0.00 0.00 0.00 36.38 33.75 1def s VAL 71 CO 0.11 0.00 0.54 -0.22 0.00 0.00 0.00 175.10 175.53 1def s LEU 72 N -4.00 0.88 0.00 3.92 0.20 0.81 -4.35 118.68 116.15 1def s LEU 72 Ca 0.33 -1.47 0.02 0.00 0.69 0.00 0.00 54.13 53.70 1def s LEU 72 Cb 0.02 1.72 -0.01 0.00 -0.43 0.00 0.00 46.19 47.49 1def s LEU 72 CO 0.19 -1.39 0.06 2.30 -0.29 0.00 0.00 176.35 177.22 1def n ILE 73 N -0.58 0.00 -1.96 6.68 -0.00 -1.26 0.22 119.36 122.45 1def n ILE 73 Ca -0.01 -1.17 -0.03 0.00 -0.00 0.00 0.00 62.75 61.54 1def n ILE 73 Cb 0.61 0.39 0.11 0.00 -0.00 0.00 0.00 39.64 40.75 1def n ILE 73 CO 0.00 0.00 0.00 -0.46 -0.00 0.00 0.00 176.55 176.09 1def n ASN 74 N -1.69 2.52 -3.61 7.28 2.04 -0.87 -4.21 115.26 116.71 1def n ASN 74 Ca -0.04 -3.42 -0.03 0.00 -0.44 0.00 0.00 54.58 50.65 1def n ASN 74 Cb 0.30 -0.44 0.03 0.00 -2.53 0.00 0.00 39.78 37.15 1def n ASN 74 CO 0.00 0.00 0.00 -0.81 -0.44 0.00 0.00 177.26 176.01 1def n PRO 75 N -0.72 1.23 -3.85 -0.53 -0.04 -1.26 -4.90 135.00 124.93 1def n PRO 75 Ca 0.23 -0.15 -0.31 0.00 -0.04 0.00 0.00 63.50 63.23 1def n PRO 75 Cb 0.85 -0.99 -0.11 0.00 -0.04 0.00 0.00 33.50 33.21 1def n PRO 75 CO 0.00 0.00 0.00 -2.00 -0.04 0.00 0.00 175.50 173.46 1def s GLU 76 N -2.14 2.47 0.45 0.54 2.12 -0.80 -4.98 118.70 116.36 1def s GLU 76 Ca 0.07 -3.01 0.04 0.00 0.36 0.00 0.00 54.97 52.43 1def s GLU 76 Cb -0.01 -3.53 0.01 0.00 0.26 0.00 0.00 34.13 30.86 1def s GLU 76 CO 0.06 -1.21 0.63 -0.48 -0.54 0.00 0.00 175.26 173.72 1def s LEU 77 N -0.90 3.60 -0.03 2.70 2.34 -1.26 -1.28 118.68 123.85 1def s LEU 77 Ca 0.22 -0.10 -0.03 0.00 0.06 0.00 0.00 54.13 54.28 1def s LEU 77 Cb -0.14 -2.85 -0.02 0.00 -0.56 0.00 0.00 46.19 42.63 1def s LEU 77 CO -0.09 -0.80 -0.06 -0.11 -1.06 0.00 0.00 176.35 174.22 1def n LEU 78 N -2.01 0.57 -4.66 1.48 7.94 0.20 -4.91 117.00 115.61 1def n LEU 78 Ca 0.05 0.09 -0.24 0.00 -1.11 0.00 0.00 56.01 54.80 1def n LEU 78 Cb 0.59 -0.21 -0.08 0.00 0.53 0.00 0.00 43.42 44.25 1def n LEU 78 CO 0.43 -0.08 -0.27 -0.70 -1.11 0.00 0.00 177.39 175.66 1def s GLU 79 N -2.11 2.16 -0.04 1.96 2.56 -0.28 -4.94 118.70 118.01 1def s GLU 79 Ca -0.07 -1.69 -0.15 0.00 0.00 0.00 0.00 54.97 53.06 1def s GLU 79 Cb 0.02 -2.00 0.03 0.00 2.00 0.00 0.00 34.13 34.18 1def s GLU 79 CO 0.09 0.13 0.34 -1.59 -0.56 0.00 0.00 175.26 173.67 1def s LYS 80 N -3.75 0.64 0.07 4.30 -2.85 -1.26 -0.66 119.74 116.23 1def s LYS 80 Ca 0.36 -0.01 0.01 0.00 -1.00 0.00 0.00 55.97 55.32 1def s LYS 80 Cb -0.01 0.29 -0.04 0.00 -2.06 0.00 0.00 37.83 36.02 1def s LYS 80 CO 0.20 -0.16 -0.06 -1.54 0.10 0.00 0.00 175.35 173.89 1def s SER 81 N -0.99 0.92 0.00 0.03 1.04 0.17 -4.93 113.70 109.94 1def s SER 81 Ca -0.11 -0.88 0.00 0.00 0.48 0.00 0.00 55.95 55.44 1def s SER 81 Cb -0.04 0.10 0.00 0.00 0.10 0.00 0.00 66.02 66.18 1def s SER 81 CO 0.04 -0.42 0.00 0.61 0.98 0.00 0.00 173.24 174.44 1def n GLY 82 N 0.38 0.00 3.05 7.32 0.00 -1.26 -0.21 105.19 114.48 1def n GLY 82 Ca -0.15 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.52 1def n GLY 82 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1def s GLU 83 N -0.39 2.69 0.00 1.61 1.03 -1.25 0.58 118.70 122.98 1def s GLU 83 Ca 0.00 -2.88 0.00 0.00 0.03 0.00 0.00 54.97 52.12 1def s GLU 83 Cb 0.00 -3.71 0.00 0.00 -0.80 0.00 0.00 34.13 29.62 1def s GLU 83 CO 0.00 -1.21 0.00 -2.37 -1.33 0.00 0.00 175.26 170.35 1def n THR 84 N 2.89 0.00 -3.88 1.83 5.66 -0.44 -4.69 114.28 115.65 1def n THR 84 Ca 0.13 0.00 -0.10 0.00 -3.05 0.00 0.00 64.05 61.03 1def n THR 84 Cb 0.36 0.00 -0.09 0.00 -1.55 0.00 0.00 70.33 69.06 1def n THR 84 CO 0.00 0.00 0.00 -0.83 -3.05 0.00 0.00 175.07 171.19 1def s GLY 85 N 0.00 0.10 0.00 1.09 0.00 -1.26 0.74 107.32 107.99 1def s GLY 85 Ca 0.00 -0.43 0.00 0.00 0.00 0.00 0.00 44.72 44.29 1def s GLY 85 CO 0.00 -0.59 0.00 0.29 0.00 0.00 0.00 173.10 172.80 1def n ILE 86 N 0.65 0.00 -0.92 0.90 -0.00 -0.96 -4.64 119.36 114.39 1def n ILE 86 Ca -0.18 0.00 -0.11 0.00 -0.00 0.00 0.00 62.75 62.46 1def n ILE 86 Cb 0.59 -0.54 0.09 0.00 -0.00 0.00 0.00 39.64 39.78 1def n ILE 86 CO 0.00 0.00 0.00 1.21 -0.00 0.00 0.00 176.55 177.76 1def n GLU 87 N -0.14 -1.33 -0.77 6.28 4.07 -1.26 -4.29 120.64 123.20 1def n GLU 87 Ca 0.00 -0.68 -0.07 0.00 -0.06 0.00 0.00 57.16 56.35 1def n GLU 87 Cb 0.00 -0.56 -0.10 0.00 -0.06 0.00 0.00 31.44 30.71 1def n GLU 87 CO 0.00 0.00 0.00 0.39 -0.06 0.00 0.00 177.13 177.46 1def n GLU 88 N -2.48 1.54 -3.13 5.31 1.02 0.97 -4.05 120.64 119.82 1def n GLU 88 Ca 0.06 -0.61 -0.17 0.00 -0.02 0.00 0.00 57.16 56.41 1def n GLU 88 Cb 0.21 -1.65 -0.01 0.00 -0.02 0.00 0.00 31.44 29.97 1def n GLU 88 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1def n GLY 89 N 2.20 3.21 3.56 0.62 0.00 -1.26 -2.62 105.19 110.89 1def n GLY 89 Ca 0.26 -1.47 -0.37 0.00 0.00 0.00 0.00 46.02 44.44 1def n GLY 89 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1def n LEU 91 N 10.41 0.00 0.00 0.00 4.32 -1.26 -4.81 117.00 125.66 1def n LEU 91 Ca 0.30 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 56.29 1def n LEU 91 Cb 0.50 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 42.30 1def n LEU 91 CO 0.66 0.00 0.00 -1.20 -1.22 0.00 0.00 177.39 175.63 1def n SER 92 N 0.00 0.00 0.00 -1.43 7.64 -1.26 -4.18 113.62 114.39 1def n SER 92 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 1def n SER 92 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 1def n SER 92 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1def n ILE 93 N 0.00 0.00 -1.31 0.44 0.00 -1.26 -2.86 119.36 114.37 1def n ILE 93 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 62.75 62.32 1def n ILE 93 Cb 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 39.64 39.63 1def n ILE 93 CO 0.00 0.00 0.00 -2.65 0.00 0.00 0.00 176.55 173.90 1def n PRO 94 N 0.00 0.00 -2.32 9.51 -0.02 -1.26 -4.86 135.00 136.05 1def n PRO 94 Ca 0.00 0.00 -0.41 0.00 -2.02 0.00 0.00 63.50 61.07 1def n PRO 94 Cb 0.00 -0.98 0.00 0.00 -0.02 0.00 0.00 33.50 32.50 1def n PRO 94 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 1def n GLU 95 N 1.20 4.36 -4.57 -0.52 -0.58 -1.26 -4.91 120.64 114.35 1def n GLU 95 Ca 0.13 -3.77 -0.26 0.00 -0.42 0.00 0.00 57.16 52.84 1def n GLU 95 Cb 0.34 -2.70 -0.10 0.00 -0.57 0.00 0.00 31.44 28.42 1def n GLU 95 CO 0.00 0.00 0.00 -1.14 -0.48 0.00 0.00 177.13 175.51 1def s GLN 96 N -1.23 1.89 -0.02 3.49 2.00 -1.26 -5.16 119.66 119.37 1def s GLN 96 Ca 0.44 -2.11 0.01 0.00 -2.00 0.00 0.00 55.36 51.71 1def s GLN 96 Cb 0.14 -1.20 0.01 0.00 0.80 0.00 0.00 33.01 32.76 1def s GLN 96 CO -0.04 -0.22 -0.05 -0.98 -0.50 0.00 0.00 175.29 173.50 1def s ARG 97 N -3.80 0.59 0.00 1.67 1.70 -1.26 -4.63 118.95 113.21 1def s ARG 97 Ca 0.28 -0.14 0.00 0.00 -0.47 0.00 0.00 55.73 55.40 1def s ARG 97 Cb 0.07 -0.60 0.00 0.00 -0.57 0.00 0.00 34.95 33.85 1def s ARG 97 CO 0.14 0.02 0.00 0.00 -1.08 0.00 0.00 175.30 174.38 1def n ALA 98 N 3.47 0.00 -3.06 7.88 0.00 -1.08 -4.91 120.51 122.81 1def n ALA 98 Ca -0.19 0.00 -0.16 0.00 0.00 0.00 0.00 53.44 53.09 1def n ALA 98 Cb 0.54 0.00 -0.00 0.00 0.00 0.00 0.00 19.45 19.99 1def n ALA 98 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1def n LEU 99 N 0.00 0.30 -4.99 0.00 4.77 -1.26 0.32 117.00 116.15 1def n LEU 99 Ca 0.00 -4.66 -0.25 0.00 -0.03 0.00 0.00 56.01 51.08 1def n LEU 99 Cb 0.00 0.72 0.13 0.00 -2.33 0.00 0.00 43.42 41.94 1def n LEU 99 CO 0.00 2.19 0.62 -0.69 -1.33 0.00 0.00 177.39 178.17 1def s VAL 100 N -1.99 2.01 0.76 4.08 1.01 -1.26 -4.49 120.40 120.52 1def s VAL 100 Ca 0.36 -0.54 -0.09 0.00 0.00 0.00 0.00 61.98 61.70 1def s VAL 100 Cb 0.35 -2.47 0.08 0.00 0.00 0.00 0.00 36.38 34.34 1def s VAL 100 CO -0.07 0.00 1.10 -2.84 0.00 0.00 0.00 175.10 173.30 1def s PRO 101 N -5.29 1.99 -0.32 2.72 0.02 -1.26 -2.28 135.00 130.59 1def s PRO 101 Ca 0.69 -0.14 -0.01 0.00 0.02 0.00 0.00 61.00 61.56 1def s PRO 101 Cb -0.04 -2.06 0.12 0.00 0.02 0.00 0.00 34.50 32.54 1def s PRO 101 CO 0.46 -1.46 0.20 0.50 -0.33 0.00 0.00 177.00 176.37 1def s ARG 102 N -5.42 0.38 1.09 5.54 3.52 0.23 -3.72 118.95 120.57 1def s ARG 102 Ca 0.62 -0.84 -0.12 0.00 -0.13 0.00 0.00 55.73 55.26 1def s ARG 102 Cb -0.10 -1.12 0.24 0.00 -1.56 0.00 0.00 34.95 32.41 1def s ARG 102 CO 0.47 -1.11 1.07 0.00 -0.81 0.00 0.00 175.30 174.91 1def s ALA 103 N 1.66 0.13 0.02 6.12 0.00 -1.26 -1.33 121.76 127.10 1def s ALA 103 Ca 0.13 0.12 -0.02 0.00 0.00 0.00 0.00 51.96 52.20 1def s ALA 103 Cb -0.19 -3.32 -0.01 0.00 0.00 0.00 0.00 23.12 19.61 1def s ALA 103 CO -0.18 -3.52 -0.03 0.39 0.00 0.00 0.00 175.76 172.41 1def n GLU 104 N -4.72 0.05 -3.59 0.00 4.71 0.20 -4.80 120.64 112.49 1def n GLU 104 Ca 0.06 0.02 -0.21 0.00 -0.01 0.00 0.00 57.16 57.02 1def n GLU 104 Cb 0.53 -0.59 -0.16 0.00 -1.01 0.00 0.00 31.44 30.22 1def n GLU 104 CO 0.00 0.00 0.00 0.21 0.09 0.00 0.00 177.13 177.43 1def s LYS 105 N -2.07 0.08 -0.15 3.49 2.20 -1.02 -3.95 119.74 118.33 1def s LYS 105 Ca -0.03 0.19 0.01 0.00 -0.36 0.00 0.00 55.97 55.77 1def s LYS 105 Cb 0.01 -1.18 0.00 0.00 -1.51 0.00 0.00 37.83 35.15 1def s LYS 105 CO 0.04 -0.55 -0.17 0.14 -0.36 0.00 0.00 175.35 174.45 1def s VAL 106 N 2.23 2.51 -0.13 4.02 -7.23 -0.68 0.42 120.40 121.54 1def s VAL 106 Ca 0.04 -0.82 -0.05 0.00 -1.81 0.00 0.00 61.98 59.34 1def s VAL 106 Cb -0.15 -2.05 -0.04 0.00 0.56 0.00 0.00 36.38 34.70 1def s VAL 106 CO -0.09 0.52 0.06 -0.75 -0.31 0.00 0.00 175.10 174.53 1def s LYS 107 N 0.85 3.51 0.47 4.82 2.20 0.17 -0.75 119.74 131.02 1def s LYS 107 Ca -0.05 -0.32 0.08 0.00 -0.36 0.00 0.00 55.97 55.32 1def s LYS 107 Cb -0.15 -3.06 0.02 0.00 -1.51 0.00 0.00 37.83 33.13 1def s LYS 107 CO -0.01 0.54 0.55 0.96 -0.36 0.00 0.00 175.35 177.03 1def s ILE 108 N -0.39 2.50 -0.30 5.43 -4.36 0.53 -0.63 121.20 123.98 1def s ILE 108 Ca 0.09 -1.16 -0.03 0.00 -0.26 0.00 0.00 60.65 59.29 1def s ILE 108 Cb -0.12 -2.67 0.11 0.00 1.25 0.00 0.00 42.46 41.03 1def s ILE 108 CO 0.02 0.00 0.16 -0.13 0.24 0.00 0.00 174.94 175.23 1def s ARG 109 N -4.36 0.28 0.00 0.37 0.52 -0.41 -1.09 118.95 114.26 1def s ARG 109 Ca 0.52 -0.66 0.00 0.00 -0.52 0.00 0.00 55.73 55.07 1def s ARG 109 Cb -0.06 -1.14 0.00 0.00 0.52 0.00 0.00 34.95 34.27 1def s ARG 109 CO 0.31 -1.06 0.00 0.00 0.02 0.00 0.00 175.30 174.57 1def n ALA 110 N 5.01 0.00 -3.32 2.13 0.00 0.22 -1.91 120.51 122.63 1def n ALA 110 Ca -0.02 0.00 -0.14 0.00 0.00 0.00 0.00 53.44 53.28 1def n ALA 110 Cb 0.41 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.77 1def n ALA 110 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 1def s LEU 111 N 0.00 0.39 0.00 0.00 0.20 -1.26 0.19 118.68 118.19 1def s LEU 111 Ca 0.00 0.62 0.04 0.00 0.69 0.00 0.00 54.13 55.48 1def s LEU 111 Cb 0.00 1.53 0.09 0.00 -0.43 0.00 0.00 46.19 47.38 1def s LEU 111 CO 0.00 -0.29 0.65 -0.90 -0.29 0.00 0.00 176.35 175.52 1def n ASP 112 N 2.17 1.33 -3.64 3.68 5.68 -0.65 -4.78 116.55 120.33 1def n ASP 112 Ca -0.16 -2.02 -0.41 0.00 -0.50 0.00 0.00 54.79 51.70 1def n ASP 112 Cb 0.57 -0.38 0.01 0.00 -1.14 0.00 0.00 41.12 40.18 1def n ASP 112 CO 0.00 0.00 0.00 -1.14 -1.33 0.00 0.00 177.20 174.73 1def n ARG 113 N -2.11 4.96 0.00 0.11 0.00 -1.26 -3.19 116.66 115.17 1def n ARG 113 Ca 0.12 -4.20 0.00 0.00 -0.00 0.00 0.00 57.85 53.78 1def n ARG 113 Cb 0.44 -2.56 0.00 0.00 0.00 0.00 0.00 32.46 30.34 1def n ARG 113 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.63 177.38 1def n ASP 114 N 0.91 0.00 0.00 6.15 8.00 -1.26 -5.03 116.55 125.33 1def n ASP 114 Ca 0.49 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.99 1def n ASP 114 Cb 0.27 0.01 0.00 0.00 -0.02 0.00 0.00 41.12 41.38 1def n ASP 114 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1def n GLY 115 N 1.44 0.91 2.78 0.44 0.00 -1.19 -5.06 105.19 104.51 1def n GLY 115 Ca 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.75 1def n GLY 115 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1def s LYS 116 N 0.00 0.83 0.07 1.61 1.02 -1.26 -4.98 119.74 117.03 1def s LYS 116 Ca 0.00 -0.40 -0.31 0.00 0.02 0.00 0.00 55.97 55.29 1def s LYS 116 Cb 0.00 -1.96 -0.09 0.00 -0.52 0.00 0.00 37.83 35.26 1def s LYS 116 CO 0.00 -0.56 1.79 -1.25 -0.92 0.00 0.00 175.35 174.41 1def s PRO 117 N 1.81 4.16 0.50 -1.68 0.04 -1.26 -1.64 135.00 136.92 1def s PRO 117 Ca -0.00 2.48 0.06 0.00 0.04 0.00 0.00 61.00 63.57 1def s PRO 117 Cb -0.16 -3.75 0.01 0.00 0.04 0.00 0.00 34.50 30.64 1def s PRO 117 CO -0.07 -0.83 0.31 -0.59 0.04 0.00 0.00 177.00 175.86 1def s PHE 118 N 3.18 2.01 -0.33 0.56 -0.71 0.49 -4.83 117.98 118.34 1def s PHE 118 Ca 0.80 -0.75 -0.01 0.00 -1.04 0.00 0.00 56.93 55.92 1def s PHE 118 Cb -0.42 -1.93 0.12 0.00 -1.21 0.00 0.00 43.02 39.58 1def s PHE 118 CO 0.35 -0.22 0.17 -2.00 -1.34 0.00 0.00 175.22 172.19 1def s GLU 119 N -4.14 0.54 0.19 1.99 2.56 -1.26 0.69 118.70 119.28 1def s GLU 119 Ca 0.35 -1.10 -0.14 0.00 0.00 0.00 0.00 54.97 54.08 1def s GLU 119 Cb -0.01 -1.49 0.01 0.00 2.00 0.00 0.00 34.13 34.64 1def s GLU 119 CO 0.21 -1.10 0.43 -1.17 -0.56 0.00 0.00 175.26 173.06 1def s LEU 120 N 1.42 0.45 0.20 2.70 2.96 -0.25 -4.94 118.68 121.22 1def s LEU 120 Ca 0.14 -0.68 -0.12 0.00 -0.22 0.00 0.00 54.13 53.24 1def s LEU 120 Cb -0.20 1.73 -0.07 0.00 0.50 0.00 0.00 46.19 48.15 1def s LEU 120 CO -0.16 -1.00 0.55 -1.83 -1.32 0.00 0.00 176.35 172.59 1def s GLU 121 N -3.93 3.88 -0.07 1.98 4.04 -1.26 -0.35 118.70 122.99 1def s GLU 121 Ca 0.14 0.37 0.05 0.00 0.04 0.00 0.00 54.97 55.57 1def s GLU 121 Cb 0.01 -2.75 -0.01 0.00 0.02 0.00 0.00 34.13 31.39 1def s GLU 121 CO -0.00 0.38 -0.23 0.00 -1.84 0.00 0.00 175.26 173.56 1def s ALA 122 N -1.68 2.24 0.35 -0.84 0.00 0.07 -4.93 121.76 116.97 1def s ALA 122 Ca 0.44 -1.01 0.04 0.00 0.00 0.00 0.00 51.96 51.42 1def s ALA 122 Cb -0.13 -0.77 -0.01 0.00 0.00 0.00 0.00 23.12 22.21 1def s ALA 122 CO 0.20 0.38 0.38 -0.40 0.00 0.00 0.00 175.76 176.33 1def n ASP 123 N 3.08 -1.02 0.00 0.00 5.75 -1.26 -1.68 116.55 121.42 1def n ASP 123 Ca -0.18 -3.13 0.00 0.00 -0.01 0.00 0.00 54.79 51.47 1def n ASP 123 Cb 0.52 2.11 0.00 0.00 -1.03 0.00 0.00 41.12 42.72 1def n ASP 123 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1def n GLY 124 N -0.63 1.77 0.40 6.12 0.00 -1.25 -3.87 105.19 107.72 1def n GLY 124 Ca 0.05 -1.99 0.00 0.00 0.00 0.00 0.00 46.02 44.08 1def n GLY 124 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1def n LEU 125 N 0.00 0.85 0.02 0.99 7.94 -1.26 -2.28 117.00 123.25 1def n LEU 125 Ca 0.00 -0.43 -0.00 0.00 -1.11 0.00 0.00 56.01 54.47 1def n LEU 125 Cb 0.00 -0.38 -0.00 0.00 0.53 0.00 0.00 43.42 43.57 1def n LEU 125 CO 0.00 0.20 -0.34 0.18 -1.11 0.00 0.00 177.39 176.32 1def n LEU 126 N -0.10 0.39 -0.30 -1.96 4.77 -1.26 -1.33 117.00 117.20 1def n LEU 126 Ca 0.01 0.05 0.14 0.00 -0.03 0.00 0.00 56.01 56.18 1def n LEU 126 Cb 0.21 -0.12 0.30 0.00 -2.33 0.00 0.00 43.42 41.48 1def n LEU 126 CO 0.01 -0.25 0.94 0.00 -1.33 0.00 0.00 177.39 176.76 1def h ALA 127 N -0.01 1.32 0.20 -1.18 0.00 -1.67 1.44 119.26 119.36 1def h ALA 127 Ca -0.00 0.23 -0.34 0.00 0.00 0.00 0.00 54.91 54.80 1def h ALA 127 Cb 0.67 0.34 0.01 0.00 0.00 0.00 0.00 17.79 18.81 1def h ALA 127 CO -0.00 -0.50 -1.67 0.82 0.00 0.00 0.00 179.25 177.90 1def h ILE 128 N 0.19 1.01 0.27 0.00 5.03 -1.67 -1.98 117.51 120.36 1def h ILE 128 Ca 0.57 -2.54 -0.01 0.00 -0.12 0.00 0.00 64.86 62.76 1def h ILE 128 Cb 1.18 2.82 0.00 0.00 -3.03 0.00 0.00 36.82 37.79 1def h ILE 128 CO -0.68 0.84 -0.13 0.00 -0.68 0.00 0.00 178.15 177.50 1def h ILE 130 N -0.88 1.14 0.00 0.00 2.04 0.16 0.62 117.51 120.58 1def h ILE 130 Ca -0.04 -0.59 0.00 0.00 1.00 0.00 0.00 64.86 65.24 1def h ILE 130 Cb 0.51 1.15 0.00 0.00 -0.74 0.00 0.00 36.82 37.74 1def h ILE 130 CO 0.06 0.18 0.00 0.00 0.00 0.00 0.00 178.15 178.39 1def n GLN 131 N -4.34 0.03 -0.00 2.37 10.64 -0.74 -2.30 117.38 123.03 1def n GLN 131 Ca -0.01 0.19 -0.09 0.00 -1.83 0.00 0.00 57.00 55.26 1def n GLN 131 Cb 0.22 -1.55 -0.07 0.00 -0.86 0.00 0.00 30.24 27.98 1def n GLN 131 CO 0.00 0.00 0.00 1.25 -1.83 0.00 0.00 177.06 176.48 1def h HIS 132 N 0.00 -0.10 -0.85 2.61 2.76 0.31 0.55 115.15 120.42 1def h HIS 132 Ca 0.00 -0.00 0.16 0.00 -2.20 0.00 0.00 60.37 58.32 1def h HIS 132 Cb 0.36 0.03 -0.15 0.00 1.55 0.00 0.00 27.41 29.20 1def h HIS 132 CO 0.00 0.37 -0.26 0.39 -1.30 0.00 0.00 177.93 177.13 1def n GLU 133 N -4.81 -0.12 0.08 5.26 -0.58 0.31 0.39 120.64 121.17 1def n GLU 133 Ca -0.06 1.32 -0.10 0.00 -0.42 0.00 0.00 57.16 57.90 1def n GLU 133 Cb 0.25 -1.97 -0.12 0.00 -0.57 0.00 0.00 31.44 29.04 1def n GLU 133 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1def h MET 134 N 0.00 0.11 -1.25 3.49 -0.00 -1.40 -2.92 114.93 112.95 1def h MET 134 Ca 0.37 -0.17 -0.19 0.00 -0.00 0.00 0.00 59.70 59.70 1def h MET 134 Cb 0.58 0.06 -0.10 0.00 -0.00 0.00 0.00 31.60 32.14 1def h MET 134 CO -0.86 1.07 0.24 -0.25 -0.00 0.00 0.00 176.91 177.11 1def n ASP 135 N -3.44 4.32 0.02 -0.10 9.92 1.27 0.54 116.55 129.08 1def n ASP 135 Ca -0.03 -2.65 -0.01 0.00 -0.53 0.00 0.00 54.79 51.57 1def n ASP 135 Cb 0.96 -0.79 -0.00 0.00 -0.64 0.00 0.00 41.12 40.65 1def n ASP 135 CO 0.00 0.00 0.00 1.41 0.13 0.00 0.00 177.20 178.74 1def n HIS 136 N 0.24 0.00 0.73 1.24 8.25 0.69 -4.07 115.22 122.31 1def n HIS 136 Ca 0.20 0.00 0.11 0.00 -0.26 0.00 0.00 57.72 57.77 1def n HIS 136 Cb 0.76 -0.03 0.48 0.00 1.12 0.00 0.00 29.99 32.31 1def n HIS 136 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 1def n LEU 137 N -3.12 0.15 -0.28 2.41 7.99 0.23 -2.52 117.00 121.85 1def n LEU 137 Ca -0.01 0.52 -0.06 0.00 -0.01 0.00 0.00 56.01 56.45 1def n LEU 137 Cb 0.03 -0.49 0.07 0.00 -0.11 0.00 0.00 43.42 42.93 1def n LEU 137 CO 0.01 -0.15 1.03 -0.37 -1.51 0.00 0.00 177.39 176.40 1def h VAL 138 N 0.00 1.26 -0.20 4.08 -1.51 -0.14 -3.06 116.25 116.67 1def h VAL 138 Ca 0.00 -0.85 0.00 0.00 -1.23 0.00 0.00 66.70 64.62 1def h VAL 138 Cb 0.43 0.35 0.00 0.00 -2.13 0.00 0.00 31.29 29.94 1def h VAL 138 CO 0.00 0.35 0.00 0.61 -1.23 0.00 0.00 177.57 177.30 1def n GLY 139 N -0.84 1.69 3.27 5.19 0.00 -1.21 -4.91 105.19 108.38 1def n GLY 139 Ca 0.07 -0.31 -0.08 0.00 0.00 0.00 0.00 46.02 45.70 1def n GLY 139 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1def n LYS 140 N 0.44 -1.41 -2.34 1.61 4.81 -1.08 -4.95 118.16 115.24 1def n LYS 140 Ca 0.09 1.25 -0.25 0.00 -0.87 0.00 0.00 58.31 58.52 1def n LYS 140 Cb 0.35 -4.86 0.05 0.00 0.02 0.00 0.00 35.03 30.59 1def n LYS 140 CO 0.00 0.00 0.00 -0.51 1.17 0.00 0.00 177.40 178.06 1def s LEU 141 N -4.40 3.02 0.00 3.14 1.43 -1.05 -4.70 118.68 116.12 1def s LEU 141 Ca 0.04 0.47 0.00 0.00 -1.03 0.00 0.00 54.13 53.61 1def s LEU 141 Cb -0.01 -3.21 0.00 0.00 0.03 0.00 0.00 46.19 43.00 1def s LEU 141 CO 0.79 -1.35 0.00 0.49 0.23 0.00 0.00 176.35 176.51 1def n PHE 142 N -2.72 0.00 0.00 0.29 3.01 -1.26 -4.77 117.46 112.01 1def n PHE 142 Ca 0.07 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.53 1def n PHE 142 Cb 0.59 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 40.06 1def n PHE 142 CO 0.00 0.00 0.00 -1.33 1.01 0.00 0.00 176.76 176.44 1def n MET 143 N 0.00 0.00 -0.14 -1.08 2.81 -1.26 -4.17 117.12 113.27 1def n MET 143 Ca 0.00 0.00 0.11 0.00 -1.81 0.00 0.00 57.70 56.00 1def n MET 143 Cb 0.00 0.00 0.29 0.00 -0.71 0.00 0.00 33.22 32.80 1def n MET 143 CO 0.00 0.00 0.00 -0.25 1.51 0.00 0.00 175.97 177.23 1def n ASP 144 N 0.00 2.46 -3.50 7.83 9.92 -1.26 -4.85 116.55 127.14 1def n ASP 144 Ca 0.00 -1.86 -0.20 0.00 -0.53 0.00 0.00 54.79 52.20 1def n ASP 144 Cb 0.00 -0.19 0.09 0.00 -0.64 0.00 0.00 41.12 40.38 1def n ASP 144 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1def n TYR 145 N 0.84 -2.46 0.00 1.24 4.11 -1.26 -3.63 117.16 115.99 1def n TYR 145 Ca 0.17 0.97 0.00 0.00 -0.00 0.00 0.00 57.90 59.04 1def n TYR 145 Cb 0.44 -5.06 0.00 0.00 -0.00 0.00 0.00 39.34 34.72 1def n TYR 145 CO 0.00 0.00 0.00 -0.11 -0.00 0.00 0.00 176.86 176.75 1def n LEU 146 N -4.48 0.00 0.00 -3.48 7.94 -1.26 -4.82 117.00 110.90 1def n LEU 146 Ca -0.17 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.73 1def n LEU 146 Cb 0.63 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.58 1def n LEU 146 CO 0.63 0.00 0.17 -0.24 -1.11 0.00 0.00 177.39 176.84