#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2puq s VAL 7 N 0.00 2.54 0.23 1.08 1.01 -1.26 -5.09 120.40 118.91 2puq s VAL 7 Ca 0.00 -0.90 -0.30 0.00 0.00 0.00 0.00 61.98 60.78 2puq s VAL 7 Cb 0.00 -1.97 -0.09 0.00 0.00 0.00 0.00 36.38 34.33 2puq s VAL 7 CO 0.00 0.57 1.00 0.00 0.00 0.00 0.00 175.10 176.67 2puq s ALA 8 N -0.37 3.35 0.57 5.51 0.00 -1.26 -4.80 121.76 124.76 2puq s ALA 8 Ca 0.03 0.71 -0.18 0.00 0.00 0.00 0.00 51.96 52.52 2puq s ALA 8 Cb -0.12 -3.26 -0.10 0.00 0.00 0.00 0.00 23.12 19.64 2puq s ALA 8 CO 0.02 0.04 0.40 0.00 0.00 0.00 0.00 175.76 176.22 2puq n ALA 9 N 1.67 -1.55 -4.09 0.00 0.00 -1.26 -4.68 120.51 110.60 2puq n ALA 9 Ca -0.01 -0.05 -0.20 0.00 0.00 0.00 0.00 53.44 53.19 2puq n ALA 9 Cb 0.47 -1.75 -0.07 0.00 0.00 0.00 0.00 19.45 18.10 2puq n ALA 9 CO 0.00 0.00 0.00 2.48 0.00 0.00 0.00 177.50 179.98 2puq n TYR 10 N -1.71 -0.74 -4.15 0.00 0.18 0.13 -4.78 117.16 106.09 2puq n TYR 10 Ca 0.11 -2.43 -0.40 0.00 1.88 0.00 0.00 57.90 57.06 2puq n TYR 10 Cb 0.48 0.27 -0.02 0.00 -0.38 0.00 0.00 39.34 39.68 2puq n TYR 10 CO 0.00 0.00 0.00 0.09 -2.08 0.00 0.00 176.86 174.87 2puq n ASN 11 N -1.84 -2.18 -4.71 9.48 3.02 -1.26 -0.82 115.26 116.95 2puq n ASN 11 Ca 0.06 -1.28 -0.42 0.00 -0.03 0.00 0.00 54.58 52.92 2puq n ASN 11 Cb 0.53 -1.73 -0.03 0.00 -0.61 0.00 0.00 39.78 37.93 2puq n ASN 11 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 2puq s LEU 12 N -7.40 4.35 0.03 3.41 1.02 -1.26 -4.25 118.68 114.57 2puq s LEU 12 Ca 0.30 1.95 0.00 0.00 0.02 0.00 0.00 54.13 56.40 2puq s LEU 12 Cb -0.16 -3.57 -0.02 0.00 0.02 0.00 0.00 46.19 42.45 2puq s LEU 12 CO 0.98 -0.49 -0.04 -0.89 0.02 0.00 0.00 176.35 175.93 2puq s THR 13 N 1.35 0.24 -0.27 5.49 2.01 0.28 -4.47 115.64 120.28 2puq s THR 13 Ca 0.58 -1.10 -0.10 0.00 0.31 0.00 0.00 61.69 61.37 2puq s THR 13 Cb -0.28 -0.55 -0.05 0.00 0.01 0.00 0.00 72.50 71.64 2puq s THR 13 CO 0.27 -0.55 0.16 0.26 -0.69 0.00 0.00 174.62 174.07 2puq s TRP 14 N -1.84 3.21 -0.28 4.92 0.52 -1.26 -1.56 118.94 122.64 2puq s TRP 14 Ca -0.11 0.03 -0.06 0.00 0.02 0.00 0.00 56.10 55.98 2puq s TRP 14 Cb -0.07 -2.33 0.01 0.00 -1.15 0.00 0.00 33.47 29.93 2puq s TRP 14 CO -0.02 -0.16 0.06 0.15 0.02 0.00 0.00 176.95 177.00 2puq s LYS 15 N 1.60 3.14 -0.05 4.98 -0.14 0.50 -4.99 119.74 124.78 2puq s LYS 15 Ca 0.07 -0.81 -0.02 0.00 -1.36 0.00 0.00 55.97 53.85 2puq s LYS 15 Cb -0.15 -3.32 0.04 0.00 -1.68 0.00 0.00 37.83 32.72 2puq s LYS 15 CO 0.08 -0.40 0.10 0.45 -0.76 0.00 0.00 175.35 174.82 2puq s SER 16 N 1.50 0.24 -0.03 2.83 0.15 -1.26 -1.09 113.70 116.04 2puq s SER 16 Ca 0.03 0.18 0.00 0.00 0.70 0.00 0.00 55.95 56.87 2puq s SER 16 Cb -0.17 0.07 0.02 0.00 -1.71 0.00 0.00 66.02 64.23 2puq s SER 16 CO 0.02 -0.17 -0.00 -0.89 1.20 0.00 0.00 173.24 173.39 2puq s THR 17 N 1.44 0.18 -1.75 6.45 2.01 -0.48 -0.66 115.64 122.82 2puq s THR 17 Ca -0.05 0.07 -0.00 0.00 0.31 0.00 0.00 61.69 62.01 2puq s THR 17 Cb -0.12 -0.26 0.00 0.00 0.01 0.00 0.00 72.50 72.13 2puq s THR 17 CO -0.04 0.14 0.01 0.59 -0.69 0.00 0.00 174.62 174.62 2puq n ASN 18 N 4.02 -5.84 0.00 3.53 4.13 0.59 -1.46 115.26 120.24 2puq n ASN 18 Ca -0.26 -0.01 0.00 0.00 1.68 0.00 0.00 54.58 55.99 2puq n ASN 18 Cb 0.51 -4.86 0.00 0.00 -1.54 0.00 0.00 39.78 33.89 2puq n ASN 18 CO 0.00 0.00 0.00 0.49 0.28 0.00 0.00 177.26 178.03 2puq n PHE 19 N -3.99 0.00 -1.80 3.10 3.72 -1.26 -1.98 117.46 115.25 2puq n PHE 19 Ca -0.24 0.00 -0.42 0.00 -0.05 0.00 0.00 57.45 56.74 2puq n PHE 19 Cb 0.68 -0.03 -0.03 0.00 -0.94 0.00 0.00 39.48 39.17 2puq n PHE 19 CO 0.00 0.00 0.00 0.21 -0.05 0.00 0.00 176.76 176.92 2puq s LYS 20 N 0.00 4.16 -0.07 -1.08 2.47 -0.53 -4.82 119.74 119.87 2puq s LYS 20 Ca 0.00 2.46 0.01 0.00 -1.56 0.00 0.00 55.97 56.89 2puq s LYS 20 Cb 0.00 -3.98 0.02 0.00 -1.46 0.00 0.00 37.83 32.41 2puq s LYS 20 CO 0.00 -0.89 -0.08 0.99 0.16 0.00 0.00 175.35 175.54 2puq s THR 21 N 3.94 0.84 -0.02 3.43 2.01 -1.26 -1.39 115.64 123.19 2puq s THR 21 Ca 0.82 -0.27 0.01 0.00 0.31 0.00 0.00 61.69 62.56 2puq s THR 21 Cb -0.40 -0.83 0.01 0.00 0.01 0.00 0.00 72.50 71.29 2puq s THR 21 CO 0.37 0.30 -0.04 -0.63 -0.69 0.00 0.00 174.62 173.93 2puq s ILE 22 N 1.01 0.39 -0.14 1.82 1.01 -0.25 -1.55 121.20 123.50 2puq s ILE 22 Ca -0.09 -0.14 -0.05 0.00 0.00 0.00 0.00 60.65 60.37 2puq s ILE 22 Cb -0.14 -0.37 -0.04 0.00 0.01 0.00 0.00 42.46 41.91 2puq s ILE 22 CO -0.00 0.14 0.06 -0.22 0.00 0.00 0.00 174.94 174.92 2puq s LEU 23 N 0.31 3.85 0.18 2.97 2.96 -0.36 -0.37 118.68 128.23 2puq s LEU 23 Ca -0.03 0.18 0.09 0.00 -0.22 0.00 0.00 54.13 54.15 2puq s LEU 23 Cb -0.07 -1.94 -0.04 0.00 0.50 0.00 0.00 46.19 44.64 2puq s LEU 23 CO -0.00 0.29 -0.18 -1.61 -1.32 0.00 0.00 176.35 173.53 2puq s GLU 24 N -0.36 1.31 0.16 1.98 2.02 -0.60 -0.24 118.70 122.98 2puq s GLU 24 Ca 0.09 -1.45 -0.05 0.00 0.02 0.00 0.00 54.97 53.58 2puq s GLU 24 Cb -0.12 -1.36 0.02 0.00 0.10 0.00 0.00 34.13 32.77 2puq s GLU 24 CO 0.02 0.27 0.31 -2.67 0.02 0.00 0.00 175.26 173.21 2puq n TRP 25 N 0.19 -1.45 -4.25 1.61 2.14 -0.94 -0.55 117.44 114.18 2puq n TRP 25 Ca -0.12 -0.82 -0.14 0.00 2.07 0.00 0.00 57.50 58.49 2puq n TRP 25 Cb 0.57 0.36 -0.10 0.00 -0.81 0.00 0.00 31.31 31.33 2puq n TRP 25 CO 0.00 0.00 0.00 -1.21 2.07 0.00 0.00 177.69 178.55 2puq s GLU 26 N -2.09 1.27 0.74 -2.67 2.02 -0.00 -4.83 118.70 113.14 2puq s GLU 26 Ca 0.08 -1.68 -0.02 0.00 0.02 0.00 0.00 54.97 53.37 2puq s GLU 26 Cb -0.02 0.03 0.13 0.00 0.10 0.00 0.00 34.13 34.37 2puq s GLU 26 CO 0.06 -0.34 1.02 -1.25 0.02 0.00 0.00 175.26 174.77 2puq s PRO 27 N -4.09 1.62 0.18 0.39 0.04 -1.26 0.19 135.00 132.06 2puq s PRO 27 Ca 0.37 -1.04 -0.30 0.00 0.04 0.00 0.00 61.00 60.07 2puq s PRO 27 Cb 0.07 -2.29 -0.08 0.00 0.04 0.00 0.00 34.50 32.24 2puq s PRO 27 CO 0.12 -1.51 1.32 0.15 0.04 0.00 0.00 177.00 177.12 2puq s LYS 28 N -5.20 4.38 -0.12 4.56 -0.14 -1.26 -4.89 119.74 117.07 2puq s LYS 28 Ca 0.67 2.04 -0.29 0.00 -1.36 0.00 0.00 55.97 57.02 2puq s LYS 28 Cb -0.05 -3.21 -0.03 0.00 -1.68 0.00 0.00 37.83 32.86 2puq s LYS 28 CO 0.45 -0.28 1.30 -1.25 -0.76 0.00 0.00 175.35 174.81 2puq s PRO 29 N 0.16 4.25 -0.49 -1.68 0.04 -1.26 -4.98 135.00 131.05 2puq s PRO 29 Ca 0.58 1.74 -0.14 0.00 0.04 0.00 0.00 61.00 63.23 2puq s PRO 29 Cb -0.36 -3.73 0.10 0.00 0.04 0.00 0.00 34.50 30.55 2puq s PRO 29 CO 0.36 -0.66 0.41 0.08 0.04 0.00 0.00 177.00 177.23 2puq s VAL 30 N 3.22 4.92 -1.54 -0.36 1.01 -1.26 -4.57 120.40 121.83 2puq s VAL 30 Ca 0.58 -1.38 -0.11 0.00 0.00 0.00 0.00 61.98 61.06 2puq s VAL 30 Cb -0.24 -4.07 0.08 0.00 0.00 0.00 0.00 36.38 32.15 2puq s VAL 30 CO 0.18 -0.70 0.81 0.59 0.00 0.00 0.00 175.10 175.98 2puq n ASN 31 N 5.13 -3.29 -3.67 3.32 3.02 -1.26 -4.99 115.26 113.52 2puq n ASN 31 Ca -0.12 -0.88 -0.13 0.00 -0.03 0.00 0.00 54.58 53.42 2puq n ASN 31 Cb 0.42 -3.47 -0.06 0.00 -0.61 0.00 0.00 39.78 36.05 2puq n ASN 31 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2puq s GLN 32 N -6.62 0.91 0.38 3.52 -2.07 -1.26 -2.47 119.66 112.06 2puq s GLN 32 Ca 0.51 -0.36 0.05 0.00 -1.82 0.00 0.00 55.36 53.74 2puq s GLN 32 Cb -0.26 0.41 -0.06 0.00 -1.09 0.00 0.00 33.01 32.00 2puq s GLN 32 CO 0.86 -0.31 0.04 0.14 -1.32 0.00 0.00 175.29 174.70 2puq s VAL 33 N -2.44 1.48 0.14 3.63 -7.23 -0.42 -4.75 120.40 110.80 2puq s VAL 33 Ca -0.06 -2.00 0.06 0.00 -1.81 0.00 0.00 61.98 58.17 2puq s VAL 33 Cb -0.01 -2.79 -0.04 0.00 0.56 0.00 0.00 36.38 34.11 2puq s VAL 33 CO -0.02 0.00 -0.13 -0.31 -0.31 0.00 0.00 175.10 174.33 2puq s TYR 34 N -3.01 1.40 -0.00 2.82 2.02 -0.35 -1.39 117.35 118.83 2puq s TYR 34 Ca 0.32 -0.60 0.02 0.00 -0.37 0.00 0.00 57.07 56.44 2puq s TYR 34 Cb 0.08 -0.72 -0.00 0.00 -0.40 0.00 0.00 41.96 40.92 2puq s TYR 34 CO 0.15 0.16 -0.05 0.99 -1.57 0.00 0.00 175.55 175.22 2puq s THR 35 N -2.49 0.43 -0.02 -0.71 2.01 -0.35 -0.95 115.64 113.55 2puq s THR 35 Ca 0.12 -0.23 -0.15 0.00 0.31 0.00 0.00 61.69 61.74 2puq s THR 35 Cb -0.03 -0.36 -0.05 0.00 0.01 0.00 0.00 72.50 72.06 2puq s THR 35 CO 0.03 0.12 0.40 -0.69 -0.69 0.00 0.00 174.62 173.79 2puq s VAL 36 N -0.11 5.07 -0.12 3.82 1.01 -0.94 0.86 120.40 129.99 2puq s VAL 36 Ca 0.02 0.82 0.00 0.00 0.00 0.00 0.00 61.98 62.82 2puq s VAL 36 Cb -0.02 -3.71 -0.02 0.00 0.00 0.00 0.00 36.38 32.63 2puq s VAL 36 CO -0.00 0.55 -0.13 -1.10 0.00 0.00 0.00 175.10 174.41 2puq s GLN 37 N -0.83 3.27 0.23 2.72 -0.21 0.11 -1.43 119.66 123.51 2puq s GLN 37 Ca 0.23 -0.69 0.10 0.00 0.02 0.00 0.00 55.36 55.03 2puq s GLN 37 Cb -0.16 -2.59 -0.05 0.00 1.00 0.00 0.00 33.01 31.21 2puq s GLN 37 CO 0.12 0.26 -0.19 -1.50 -2.12 0.00 0.00 175.29 171.87 2puq s ILE 38 N 0.21 2.18 -0.22 1.08 2.07 -0.76 0.51 121.20 126.28 2puq s ILE 38 Ca -0.08 -2.22 -0.29 0.00 -1.41 0.00 0.00 60.65 56.65 2puq s ILE 38 Cb -0.15 -2.14 0.15 0.00 0.13 0.00 0.00 42.46 40.45 2puq s ILE 38 CO 0.05 -0.38 1.14 -0.94 -1.91 0.00 0.00 174.94 172.90 2puq s SER 39 N -3.18 -0.25 0.72 4.50 1.04 -0.39 -1.39 113.70 114.74 2puq s SER 39 Ca 0.24 0.31 -0.11 0.00 0.48 0.00 0.00 55.95 56.88 2puq s SER 39 Cb -0.05 0.26 0.02 0.00 0.10 0.00 0.00 66.02 66.35 2puq s SER 39 CO 0.11 -0.21 1.07 0.42 0.98 0.00 0.00 173.24 175.61 2puq s THR 40 N -0.89 3.84 0.66 2.02 -4.23 -1.26 -0.41 115.64 115.38 2puq s THR 40 Ca 0.03 0.60 0.31 0.00 -1.18 0.00 0.00 61.69 61.45 2puq s THR 40 Cb -0.01 -3.32 0.32 0.00 1.34 0.00 0.00 72.50 70.83 2puq s THR 40 CO -0.03 -0.78 1.98 0.07 -0.54 0.00 0.00 174.62 175.31 2puq h LYS 41 N -0.80 0.00 0.00 3.99 -0.00 -1.94 -1.46 116.57 116.35 2puq h LYS 41 Ca -0.44 0.00 0.00 0.00 -0.00 0.00 0.00 60.65 60.21 2puq h LYS 41 Cb 1.22 0.00 0.00 0.00 -0.00 0.00 0.00 32.23 33.45 2puq h LYS 41 CO 0.57 0.00 0.00 -1.13 -0.00 0.00 0.00 179.45 178.89 2puq n SER 42 N -3.00 0.31 -4.60 7.07 3.41 -1.26 -5.09 113.62 110.46 2puq n SER 42 Ca -0.01 -1.07 -0.29 0.00 -0.26 0.00 0.00 58.87 57.24 2puq n SER 42 Cb 0.36 0.00 0.20 0.00 -0.26 0.00 0.00 64.21 64.51 2puq n SER 42 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2puq s GLY 43 N -0.07 1.57 0.76 5.00 0.00 -0.55 -5.04 107.32 108.99 2puq s GLY 43 Ca 0.00 -0.16 -0.12 0.00 0.00 0.00 0.00 44.72 44.45 2puq s GLY 43 CO 0.00 0.47 1.11 0.99 0.00 0.00 0.00 173.10 175.67 2puq s ASP 44 N -3.01 4.41 0.32 1.64 1.01 -1.26 -4.67 116.67 115.10 2puq s ASP 44 Ca 0.66 1.95 -0.21 0.00 0.71 0.00 0.00 52.55 55.66 2puq s ASP 44 Cb -0.21 -2.54 -0.09 0.00 1.01 0.00 0.00 42.92 41.08 2puq s ASP 44 CO 0.60 -2.10 0.84 0.26 0.21 0.00 0.00 175.17 174.98 2puq s TRP 45 N -2.68 3.53 -0.07 4.23 0.52 -1.26 -4.59 118.94 118.61 2puq s TRP 45 Ca 0.64 1.52 0.01 0.00 0.02 0.00 0.00 56.10 58.28 2puq s TRP 45 Cb -0.19 -2.74 0.02 0.00 -1.15 0.00 0.00 33.47 29.41 2puq s TRP 45 CO 0.52 0.16 -0.06 0.21 0.02 0.00 0.00 176.95 177.80 2puq s LYS 46 N -2.45 1.18 0.35 4.98 2.20 -0.49 -4.96 119.74 120.55 2puq s LYS 46 Ca 0.51 -0.18 -0.26 0.00 -0.36 0.00 0.00 55.97 55.69 2puq s LYS 46 Cb -0.14 -1.19 -0.09 0.00 -1.51 0.00 0.00 37.83 34.89 2puq s LYS 46 CO 0.19 -0.14 1.02 -1.12 -0.36 0.00 0.00 175.35 174.94 2puq s SER 47 N 1.25 7.05 0.06 1.43 0.01 -1.26 -1.82 113.70 120.42 2puq s SER 47 Ca -0.05 2.02 -0.05 0.00 1.31 0.00 0.00 55.95 59.18 2puq s SER 47 Cb -0.14 -2.59 -0.02 0.00 0.21 0.00 0.00 66.02 63.48 2puq s SER 47 CO -0.02 -0.28 0.08 -0.54 0.41 0.00 0.00 173.24 172.88 2puq s LYS 48 N -2.13 0.66 -1.14 12.44 -0.14 -0.52 -4.99 119.74 123.92 2puq s LYS 48 Ca 0.53 -0.97 -0.06 0.00 -1.36 0.00 0.00 55.97 54.11 2puq s LYS 48 Cb -0.23 0.25 -0.03 0.00 -1.68 0.00 0.00 37.83 36.14 2puq s LYS 48 CO 0.29 -0.17 0.89 0.00 -0.76 0.00 0.00 175.35 175.60 2puq s PHE 50 N -3.44 2.25 -1.54 0.00 0.08 -1.26 -3.39 117.98 110.68 2puq s PHE 50 Ca 0.27 0.35 -0.10 0.00 0.12 0.00 0.00 56.93 57.56 2puq s PHE 50 Cb -0.05 -3.87 0.08 0.00 -0.57 0.00 0.00 43.02 38.60 2puq s PHE 50 CO 0.77 -3.57 0.73 0.66 -0.10 0.00 0.00 175.22 173.71 2puq n TYR 51 N 6.47 -1.89 -2.75 0.36 4.01 -0.13 -4.95 117.16 118.28 2puq n TYR 51 Ca 0.16 0.82 -0.32 0.00 -0.16 0.00 0.00 57.90 58.40 2puq n TYR 51 Cb 0.42 -3.60 -0.05 0.00 -0.31 0.00 0.00 39.34 35.81 2puq n TYR 51 CO 0.00 0.00 0.00 -0.08 -0.46 0.00 0.00 176.86 176.32 2puq s THR 52 N -3.52 4.60 -1.59 -0.72 -1.32 -0.67 -4.68 115.64 107.75 2puq s THR 52 Ca 0.44 1.05 0.22 0.00 -1.21 0.00 0.00 61.69 62.19 2puq s THR 52 Cb -0.23 -3.68 -0.10 0.00 -1.51 0.00 0.00 72.50 66.97 2puq s THR 52 CO 0.88 -0.47 1.00 0.35 -2.21 0.00 0.00 174.62 174.17 2puq n THR 53 N -1.08 0.00 -1.07 5.08 -2.24 -1.26 -1.21 114.28 112.49 2puq n THR 53 Ca 0.05 -0.15 -0.34 0.00 -2.27 0.00 0.00 64.05 61.34 2puq n THR 53 Cb 0.54 1.15 0.11 0.00 -2.10 0.00 0.00 70.33 70.03 2puq n THR 53 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 2puq n ASP 54 N -0.64 -0.32 -1.53 3.42 9.92 -1.26 -4.47 116.55 121.68 2puq n ASP 54 Ca 0.07 0.53 -0.14 0.00 -0.53 0.00 0.00 54.79 54.72 2puq n ASP 54 Cb 0.41 -1.36 0.12 0.00 -0.64 0.00 0.00 41.12 39.65 2puq n ASP 54 CO 0.00 0.00 0.00 0.35 0.13 0.00 0.00 177.20 177.68 2puq n THR 55 N -3.13 2.60 -4.01 -3.53 -2.24 -1.26 -4.85 114.28 97.85 2puq n THR 55 Ca 0.11 -3.47 -0.09 0.00 -2.27 0.00 0.00 64.05 58.32 2puq n THR 55 Cb 0.51 -0.73 -0.08 0.00 -2.10 0.00 0.00 70.33 67.93 2puq n THR 55 CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 2puq s GLU 56 N -3.46 1.04 -0.15 -0.78 -1.05 -1.26 -2.21 118.70 110.84 2puq s GLU 56 Ca 0.48 -1.24 -0.05 0.00 -0.15 0.00 0.00 54.97 54.01 2puq s GLU 56 Cb 0.41 0.33 0.07 0.00 -0.44 0.00 0.00 34.13 34.50 2puq s GLU 56 CO -0.00 -0.35 0.30 0.00 0.95 0.00 0.00 175.26 176.16 2puq s ASP 58 N 2.44 6.23 -0.29 0.00 2.15 -1.26 -1.22 116.67 124.72 2puq s ASP 58 Ca 0.00 1.31 0.10 0.00 0.43 0.00 0.00 52.55 54.40 2puq s ASP 58 Cb -0.12 -2.53 0.61 0.00 -0.30 0.00 0.00 42.92 40.58 2puq s ASP 58 CO -0.10 -1.43 1.62 0.18 -0.17 0.00 0.00 175.17 175.28 2puq n LEU 59 N 9.06 5.03 -0.07 -1.34 4.77 -0.60 -4.73 117.00 129.12 2puq n LEU 59 Ca 0.19 -3.40 -0.13 0.00 -0.03 0.00 0.00 56.01 52.65 2puq n LEU 59 Cb 0.46 -0.68 -0.06 0.00 -2.33 0.00 0.00 43.42 40.82 2puq n LEU 59 CO 0.67 0.95 0.61 0.74 -1.33 0.00 0.00 177.39 179.03 2puq h THR 60 N 1.72 1.32 -0.81 -5.08 2.02 -1.86 -2.51 112.91 107.71 2puq h THR 60 Ca 0.24 -1.31 0.09 0.00 0.77 0.00 0.00 66.41 66.20 2puq h THR 60 Cb 1.98 1.73 -0.06 0.00 -1.74 0.00 0.00 68.15 70.07 2puq h THR 60 CO 0.55 0.40 0.53 0.44 0.37 0.00 0.00 175.52 177.81 2puq h ASP 61 N 0.14 0.70 0.01 4.18 5.19 -1.91 -0.82 116.42 123.92 2puq h ASP 61 Ca 0.04 0.02 -0.23 0.00 -0.62 0.00 0.00 57.03 56.24 2puq h ASP 61 Cb 0.70 -0.13 0.02 0.00 0.18 0.00 0.00 39.33 40.10 2puq h ASP 61 CO 0.04 0.42 -0.89 -0.33 -3.12 0.00 0.00 179.24 175.36 2puq h GLU 62 N 0.78 0.58 0.00 3.56 4.39 -1.88 -3.34 114.58 118.66 2puq h GLU 62 Ca 0.37 -0.64 -0.09 0.00 0.34 0.00 0.00 59.36 59.33 2puq h GLU 62 Cb 0.41 0.19 -0.01 0.00 -0.10 0.00 0.00 28.75 29.23 2puq h GLU 62 CO -0.14 1.25 -0.47 -0.84 -1.16 0.00 0.00 179.01 177.65 2puq h ILE 63 N 0.18 0.76 0.00 3.13 -0.00 -1.19 -3.11 117.51 117.28 2puq h ILE 63 Ca -0.12 -2.08 0.00 0.00 -0.00 0.00 0.00 64.86 62.67 2puq h ILE 63 Cb 1.57 2.37 0.00 0.00 -0.00 0.00 0.00 36.82 40.76 2puq h ILE 63 CO 0.17 0.43 0.00 1.33 -0.00 0.00 0.00 178.15 180.09 2puq n VAL 64 N -3.20 0.10 0.17 0.16 0.24 -0.34 -3.22 118.33 112.25 2puq n VAL 64 Ca 0.02 0.03 0.01 0.00 -2.04 0.00 0.00 64.34 62.36 2puq n VAL 64 Cb 0.71 -0.57 0.29 0.00 -1.47 0.00 0.00 33.84 32.81 2puq n VAL 64 CO 0.00 0.00 0.00 0.11 -2.14 0.00 0.00 176.83 174.80 2puq h LYS 65 N 0.00 0.00 -1.90 7.34 1.57 -1.68 -3.40 116.57 118.51 2puq h LYS 65 Ca 0.00 0.00 -0.18 0.00 -1.87 0.00 0.00 60.65 58.60 2puq h LYS 65 Cb 0.29 0.00 -0.30 0.00 0.08 0.00 0.00 32.23 32.30 2puq h LYS 65 CO 0.00 0.46 -0.51 0.34 -0.57 0.00 0.00 179.45 179.17 2puq s ASP 66 N -6.90 0.41 0.00 0.86 -1.08 -1.20 -5.04 116.67 103.72 2puq s ASP 66 Ca -0.02 0.03 0.28 0.00 -0.52 0.00 0.00 52.55 52.31 2puq s ASP 66 Cb 0.14 1.04 1.37 0.00 -1.46 0.00 0.00 42.92 44.01 2puq s ASP 66 CO 0.74 -0.32 1.95 1.33 0.52 0.00 0.00 175.17 179.39 2puq n VAL 67 N 5.36 0.10 0.98 1.11 0.24 -1.24 -3.23 118.33 121.65 2puq n VAL 67 Ca -0.03 0.02 0.10 0.00 -2.04 0.00 0.00 64.34 62.40 2puq n VAL 67 Cb 0.50 -0.56 -0.10 0.00 -1.47 0.00 0.00 33.84 32.21 2puq n VAL 67 CO 0.00 0.00 0.00 0.29 -2.14 0.00 0.00 176.83 174.98 2puq n LYS 68 N -1.32 0.33 -1.68 7.34 4.76 -1.26 0.03 118.16 126.36 2puq n LYS 68 Ca 0.12 -0.19 -0.30 0.00 -2.87 0.00 0.00 58.31 55.07 2puq n LYS 68 Cb 0.24 -1.48 0.06 0.00 -1.84 0.00 0.00 35.03 32.01 2puq n LYS 68 CO 0.00 0.00 0.00 -0.65 -1.37 0.00 0.00 177.40 175.38 2puq s GLN 69 N -2.87 2.70 -0.14 1.97 -1.52 -1.20 -4.92 119.66 113.68 2puq s GLN 69 Ca 0.10 0.69 -0.04 0.00 -1.95 0.00 0.00 55.36 54.16 2puq s GLN 69 Cb 0.16 -1.98 -0.03 0.00 -0.22 0.00 0.00 33.01 30.94 2puq s GLN 69 CO 0.80 -1.20 0.00 0.99 -0.25 0.00 0.00 175.29 175.63 2puq s THR 70 N -3.18 4.25 -0.01 -0.19 2.01 -1.26 -4.03 115.64 113.23 2puq s THR 70 Ca 0.59 -0.24 0.03 0.00 0.31 0.00 0.00 61.69 62.38 2puq s THR 70 Cb -0.13 -2.86 -0.03 0.00 0.01 0.00 0.00 72.50 69.49 2puq s THR 70 CO 0.54 0.51 -0.07 -0.31 -0.69 0.00 0.00 174.62 174.60 2puq s TYR 71 N 0.03 2.88 0.02 4.92 1.51 -0.04 -3.27 117.35 123.39 2puq s TYR 71 Ca 0.02 -0.04 0.08 0.00 -1.01 0.00 0.00 57.07 56.13 2puq s TYR 71 Cb -0.13 -1.62 -0.03 0.00 -0.11 0.00 0.00 41.96 40.07 2puq s TYR 71 CO 0.02 0.36 -0.25 -1.17 -1.11 0.00 0.00 175.55 173.40 2puq s LEU 72 N -1.30 2.21 0.24 -1.29 1.98 0.46 -1.03 118.68 119.94 2puq s LEU 72 Ca 0.16 -0.51 0.12 0.00 -2.89 0.00 0.00 54.13 51.01 2puq s LEU 72 Cb -0.11 -1.35 -0.05 0.00 0.66 0.00 0.00 46.19 45.35 2puq s LEU 72 CO 0.06 0.29 -0.21 0.00 -1.89 0.00 0.00 176.35 174.60 2puq s ALA 73 N -0.74 2.62 0.05 5.97 0.00 -1.25 -1.26 121.76 127.14 2puq s ALA 73 Ca 0.11 -1.77 -0.11 0.00 0.00 0.00 0.00 51.96 50.20 2puq s ALA 73 Cb -0.10 -0.28 0.01 0.00 0.00 0.00 0.00 23.12 22.75 2puq s ALA 73 CO 0.01 0.33 0.24 -0.98 0.00 0.00 0.00 175.76 175.36 2puq s ARG 74 N -3.16 0.76 -0.10 0.00 1.70 0.18 -0.05 118.95 118.28 2puq s ARG 74 Ca 0.26 -0.63 0.02 0.00 -0.47 0.00 0.00 55.73 54.91 2puq s ARG 74 Cb -0.06 0.32 0.01 0.00 -0.57 0.00 0.00 34.95 34.65 2puq s ARG 74 CO 0.12 -0.23 -0.16 0.08 -1.08 0.00 0.00 175.30 174.03 2puq s VAL 75 N -2.76 1.53 0.07 4.99 1.01 0.39 0.04 120.40 125.68 2puq s VAL 75 Ca -0.04 -0.68 0.02 0.00 0.00 0.00 0.00 61.98 61.29 2puq s VAL 75 Cb -0.00 -1.38 -0.04 0.00 0.00 0.00 0.00 36.38 34.96 2puq s VAL 75 CO -0.05 0.45 0.10 -0.36 0.00 0.00 0.00 175.10 175.24 2puq s PHE 76 N 0.80 3.25 -0.08 5.22 0.08 0.25 -1.90 117.98 125.60 2puq s PHE 76 Ca -0.10 0.11 0.03 0.00 0.12 0.00 0.00 56.93 57.09 2puq s PHE 76 Cb -0.16 -1.65 -0.02 0.00 -0.57 0.00 0.00 43.02 40.63 2puq s PHE 76 CO 0.01 0.53 -0.17 -1.12 -0.10 0.00 0.00 175.22 174.38 2puq s SER 77 N -2.38 3.77 0.05 1.36 0.01 -0.87 -1.22 113.70 114.42 2puq s SER 77 Ca 0.30 -0.32 0.03 0.00 1.31 0.00 0.00 55.95 57.27 2puq s SER 77 Cb -0.12 -1.09 -0.03 0.00 0.21 0.00 0.00 66.02 64.99 2puq s SER 77 CO 0.23 0.26 -0.09 -0.31 0.41 0.00 0.00 173.24 173.74 2puq s TYR 78 N -0.23 0.80 0.94 2.43 2.02 -0.49 -4.18 117.35 118.64 2puq s TYR 78 Ca 0.00 -0.53 -0.11 0.00 -0.37 0.00 0.00 57.07 56.07 2puq s TYR 78 Cb -0.13 -0.47 0.16 0.00 -0.40 0.00 0.00 41.96 41.12 2puq s TYR 78 CO 0.03 -0.06 1.11 -2.14 -1.57 0.00 0.00 175.55 172.93 2puq s PRO 79 N -1.81 0.84 2.42 -1.71 0.02 -1.26 -1.31 135.00 132.19 2puq s PRO 79 Ca -0.06 1.33 0.00 0.00 0.02 0.00 0.00 61.00 62.28 2puq s PRO 79 Cb -0.09 -1.72 0.00 0.00 0.02 0.00 0.00 34.50 32.71 2puq s PRO 79 CO 0.00 -2.68 0.00 0.00 -0.33 0.00 0.00 177.00 173.99 2puq n ALA 80 N -4.25 0.00 0.00 -1.55 0.00 -1.03 -1.81 120.51 111.87 2puq n ALA 80 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.54 2puq n ALA 80 Cb 0.53 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.98 2puq n ALA 80 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2puq n GLY 81 N 0.00 2.08 0.00 0.00 0.00 -1.26 -4.89 105.19 101.12 2puq n GLY 81 Ca 0.00 -0.62 0.00 0.00 0.00 0.00 0.00 46.02 45.40 2puq n GLY 81 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2puq n ASN 82 N 0.00 0.00 0.00 1.61 5.03 -0.75 -5.09 115.26 116.06 2puq n ASN 82 Ca 0.00 0.00 0.00 0.00 0.87 0.00 0.00 54.58 55.45 2puq n ASN 82 Cb 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 39.78 38.76 2puq n ASN 82 CO 0.00 0.00 0.00 1.33 -1.83 0.00 0.00 177.26 176.76 2puq n VAL 83 N 0.00 0.00 0.00 2.41 0.24 -1.26 -4.83 118.33 114.88 2puq n VAL 83 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.30 2puq n VAL 83 Cb 0.00 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 32.37 2puq n VAL 83 CO 0.00 0.00 0.00 1.21 -2.14 0.00 0.00 176.83 175.90 2puq n GLU 84 N 0.00 0.00 -3.70 7.34 2.13 -1.26 -5.13 120.64 120.03 2puq n GLU 84 Ca 0.00 0.00 -0.04 0.00 0.66 0.00 0.00 57.16 57.78 2puq n GLU 84 Cb 0.00 0.00 -0.01 0.00 0.27 0.00 0.00 31.44 31.70 2puq n GLU 84 CO 0.00 0.00 0.00 0.45 -0.41 0.00 0.00 177.13 177.17 2puq s SER 85 N 0.00 -0.19 0.44 4.31 0.15 -1.26 -4.71 113.70 112.44 2puq s SER 85 Ca 0.00 -0.30 -0.04 0.00 0.70 0.00 0.00 55.95 56.30 2puq s SER 85 Cb 0.00 0.42 -0.04 0.00 -1.71 0.00 0.00 66.02 64.70 2puq s SER 85 CO 0.00 -0.77 0.73 -0.89 1.20 0.00 0.00 173.24 173.51 2puq s THR 86 N -3.14 4.94 -0.41 6.45 2.01 1.48 -4.72 115.64 122.26 2puq s THR 86 Ca 0.11 0.09 0.08 0.00 0.31 0.00 0.00 61.69 62.29 2puq s THR 86 Cb -0.01 -3.85 0.38 0.00 0.01 0.00 0.00 72.50 69.03 2puq s THR 86 CO -0.00 -0.75 1.31 0.61 -0.69 0.00 0.00 174.62 175.10 2puq n GLY 87 N -2.06 1.18 7.00 4.40 0.00 -1.26 -0.77 105.19 113.68 2puq n GLY 87 Ca -0.00 -0.09 0.00 0.00 0.00 0.00 0.00 46.02 45.92 2puq n GLY 87 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2puq n SER 88 N -0.41 -3.92 0.00 1.61 7.64 -1.26 -4.99 113.62 112.29 2puq n SER 88 Ca -0.01 0.00 0.03 0.00 1.01 0.00 0.00 58.87 59.90 2puq n SER 88 Cb 0.82 0.00 0.18 0.00 -1.01 0.00 0.00 64.21 64.20 2puq n SER 88 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2puq n ALA 89 N 1.28 1.73 -1.58 -0.43 0.00 -1.24 -4.76 120.51 115.50 2puq n ALA 89 Ca 0.00 -0.04 -0.17 0.00 0.00 0.00 0.00 53.44 53.23 2puq n ALA 89 Cb 0.00 -1.10 -0.07 0.00 0.00 0.00 0.00 19.45 18.29 2puq n ALA 89 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2puq n GLY 90 N -0.59 1.52 3.52 0.00 0.00 0.05 -4.89 105.19 104.80 2puq n GLY 90 Ca 0.04 -0.19 -0.25 0.00 0.00 0.00 0.00 46.02 45.63 2puq n GLY 90 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2puq s GLU 91 N -3.60 1.76 0.37 1.61 2.02 -1.25 -4.55 118.70 115.05 2puq s GLU 91 Ca 0.00 -1.91 -0.28 0.00 0.02 0.00 0.00 54.97 52.80 2puq s GLU 91 Cb 0.00 -1.57 -0.10 0.00 0.10 0.00 0.00 34.13 32.56 2puq s GLU 91 CO 0.00 0.11 1.38 -1.25 0.02 0.00 0.00 175.26 175.52 2puq s PRO 92 N -3.64 4.17 0.23 0.39 0.04 -1.26 0.43 135.00 135.36 2puq s PRO 92 Ca 0.32 2.35 -0.30 0.00 0.04 0.00 0.00 61.00 63.42 2puq s PRO 92 Cb 0.03 -2.97 -0.09 0.00 0.04 0.00 0.00 34.50 31.51 2puq s PRO 92 CO 0.15 -0.39 1.29 -1.17 0.04 0.00 0.00 177.00 176.92 2puq s LEU 93 N -2.05 4.43 0.34 -3.56 2.96 -1.26 -4.79 118.68 114.75 2puq s LEU 93 Ca 0.52 2.43 0.02 0.00 -0.22 0.00 0.00 54.13 56.88 2puq s LEU 93 Cb -0.42 -3.62 -0.01 0.00 0.50 0.00 0.00 46.19 42.64 2puq s LEU 93 CO 0.56 -0.49 0.39 -0.72 -1.32 0.00 0.00 176.35 174.77 2puq s TYR 94 N -0.19 1.37 0.08 5.38 1.13 -1.26 -2.04 117.35 121.82 2puq s TYR 94 Ca 0.54 -1.46 -0.14 0.00 -1.41 0.00 0.00 57.07 54.60 2puq s TYR 94 Cb -0.36 -0.36 0.02 0.00 -1.10 0.00 0.00 41.96 40.16 2puq s TYR 94 CO 0.41 -1.02 0.33 -2.00 -2.51 0.00 0.00 175.55 170.76 2puq s GLU 95 N -3.23 0.94 -0.05 -3.49 2.56 -0.80 -4.85 118.70 109.78 2puq s GLU 95 Ca 0.35 -0.66 -0.07 0.00 0.00 0.00 0.00 54.97 54.60 2puq s GLU 95 Cb 0.01 0.40 -0.04 0.00 2.00 0.00 0.00 34.13 36.50 2puq s GLU 95 CO 0.23 -0.33 0.21 -0.80 -0.56 0.00 0.00 175.26 174.02 2puq s ASN 96 N -2.51 6.46 0.73 -1.70 0.01 -1.26 -0.46 114.94 116.21 2puq s ASN 96 Ca 0.00 0.53 -0.07 0.00 -0.71 0.00 0.00 52.86 52.60 2puq s ASN 96 Cb 0.01 -2.08 0.07 0.00 0.41 0.00 0.00 41.25 39.66 2puq s ASN 96 CO -0.08 0.33 1.05 -0.94 -1.51 0.00 0.00 177.10 175.94 2puq s SER 97 N -1.39 4.68 0.91 -1.22 1.04 0.93 -4.83 113.70 113.82 2puq s SER 97 Ca 0.22 0.46 -0.11 0.00 0.48 0.00 0.00 55.95 57.00 2puq s SER 97 Cb -0.13 -1.05 0.14 0.00 0.10 0.00 0.00 66.02 65.08 2puq s SER 97 CO 0.11 -1.70 1.11 -2.16 0.98 0.00 0.00 173.24 171.58 2puq s PRO 98 N -5.31 1.07 0.70 4.02 0.04 -1.26 -4.72 135.00 129.53 2puq s PRO 98 Ca 0.61 1.21 -0.14 0.00 0.04 0.00 0.00 61.00 62.73 2puq s PRO 98 Cb -0.10 -1.76 0.02 0.00 0.04 0.00 0.00 34.50 32.70 2puq s PRO 98 CO 0.46 -2.48 1.11 -1.21 0.04 0.00 0.00 177.00 174.91 2puq s GLU 99 N -4.74 2.59 -0.12 4.56 2.02 -1.26 -4.59 118.70 117.16 2puq s GLU 99 Ca 0.65 1.35 -0.05 0.00 0.02 0.00 0.00 54.97 56.94 2puq s GLU 99 Cb -0.21 -1.93 0.05 0.00 0.10 0.00 0.00 34.13 32.15 2puq s GLU 99 CO 0.58 -1.41 0.26 0.12 0.02 0.00 0.00 175.26 174.83 2puq s PHE 100 N -2.47 -0.38 -0.41 1.61 5.36 -0.20 -4.92 117.98 116.57 2puq s PHE 100 Ca 0.66 0.88 0.04 0.00 -0.96 0.00 0.00 56.93 57.55 2puq s PHE 100 Cb -0.20 0.02 0.11 0.00 -0.34 0.00 0.00 43.02 42.61 2puq s PHE 100 CO 0.46 -0.29 0.14 0.99 -1.46 0.00 0.00 175.22 175.06 2puq s THR 101 N 1.74 2.39 0.20 0.12 2.01 -1.26 -0.86 115.64 119.98 2puq s THR 101 Ca -0.05 -2.73 -0.14 0.00 0.31 0.00 0.00 61.69 59.08 2puq s THR 101 Cb -0.11 -2.72 0.20 0.00 0.01 0.00 0.00 72.50 69.88 2puq s THR 101 CO -0.09 -0.68 1.64 -0.65 -0.69 0.00 0.00 174.62 174.15 2puq h PRO 102 N 7.16 0.01 -0.64 4.92 0.11 -1.69 -0.52 132.00 141.35 2puq h PRO 102 Ca -0.06 -0.00 0.19 0.00 0.11 0.00 0.00 66.00 66.24 2puq h PRO 102 Cb 0.97 -0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.05 2puq h PRO 102 CO 0.59 0.00 0.54 -0.92 -0.21 0.00 0.00 178.00 178.00 2puq h TYR 103 N 0.01 0.00 -0.00 0.65 3.20 -0.72 -2.28 116.97 117.82 2puq h TYR 103 Ca 0.28 0.00 0.00 0.00 3.14 0.00 0.00 58.73 62.15 2puq h TYR 103 Cb 0.43 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.70 2puq h TYR 103 CO -0.47 0.00 -0.47 1.28 -1.64 0.00 0.00 178.16 176.86 2puq n LEU 104 N -4.01 1.03 0.00 2.82 4.77 -0.23 -4.73 117.00 116.64 2puq n LEU 104 Ca 0.13 -0.63 0.00 0.00 -0.03 0.00 0.00 56.01 55.48 2puq n LEU 104 Cb 0.78 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.87 2puq n LEU 104 CO 0.33 0.22 -0.05 -0.62 -1.33 0.00 0.00 177.39 175.94 2puq n GLU 105 N -0.77 3.09 -2.17 3.23 1.02 -0.90 -4.60 120.64 119.53 2puq n GLU 105 Ca 0.04 0.00 -0.41 0.00 -0.02 0.00 0.00 57.16 56.77 2puq n GLU 105 Cb 0.25 -0.34 -0.03 0.00 -0.02 0.00 0.00 31.44 31.30 2puq n GLU 105 CO 0.00 0.00 0.00 -0.08 1.18 0.00 0.00 177.13 178.23 2puq s THR 106 N -0.53 2.94 0.05 2.62 -1.32 -0.96 -4.88 115.64 113.56 2puq s THR 106 Ca 0.00 0.87 -0.31 0.00 -1.21 0.00 0.00 61.69 61.05 2puq s THR 106 Cb 0.00 -3.56 -0.07 0.00 -1.51 0.00 0.00 72.50 67.37 2puq s THR 106 CO 0.00 0.18 1.42 0.20 -2.21 0.00 0.00 174.62 174.21 2puq s ASN 107 N -0.19 6.82 0.24 8.08 0.01 0.16 -4.81 114.94 125.25 2puq s ASN 107 Ca 0.52 2.22 -0.30 0.00 -0.71 0.00 0.00 52.86 54.59 2puq s ASN 107 Cb -0.38 -2.57 -0.10 0.00 0.41 0.00 0.00 41.25 38.61 2puq s ASN 107 CO 0.46 -0.71 1.39 -0.76 -1.51 0.00 0.00 177.10 175.97 2puq s LEU 108 N 1.98 4.40 0.38 0.60 1.43 -1.26 -0.30 118.68 125.91 2puq s LEU 108 Ca 0.65 2.59 -0.25 0.00 -1.03 0.00 0.00 54.13 56.09 2puq s LEU 108 Cb -0.34 -3.62 -0.09 0.00 0.03 0.00 0.00 46.19 42.17 2puq s LEU 108 CO 0.28 -0.64 1.07 -0.83 0.23 0.00 0.00 176.35 176.47 2puq s GLY 109 N 0.29 2.81 -0.45 -3.19 0.00 -1.26 -4.47 107.32 101.04 2puq s GLY 109 Ca 0.58 0.77 -0.43 0.00 0.00 0.00 0.00 44.72 45.63 2puq s GLY 109 CO 0.42 1.24 1.91 -0.18 0.00 0.00 0.00 173.10 176.49 2puq n GLN 110 N 0.16 0.30 -1.74 2.90 7.27 -1.26 -4.75 117.38 120.26 2puq n GLN 110 Ca 0.04 0.10 -0.29 0.00 0.07 0.00 0.00 57.00 56.91 2puq n GLN 110 Cb 0.48 -1.70 0.16 0.00 2.41 0.00 0.00 30.24 31.60 2puq n GLN 110 CO 0.00 0.00 0.00 -1.25 0.07 0.00 0.00 177.06 175.88 2puq s PRO 111 N 4.67 0.75 -0.07 3.69 0.04 -1.26 -4.92 135.00 137.91 2puq s PRO 111 Ca 1.11 -0.13 -0.01 0.00 0.04 0.00 0.00 61.00 62.01 2puq s PRO 111 Cb -1.36 -1.83 0.03 0.00 0.04 0.00 0.00 34.50 31.37 2puq s PRO 111 CO 0.69 -2.38 0.00 0.95 0.04 0.00 0.00 177.00 176.30 2puq s THR 112 N -3.59 0.37 -0.03 1.26 -4.23 -1.26 -4.14 115.64 104.02 2puq s THR 112 Ca 0.69 0.12 -0.35 0.00 -1.18 0.00 0.00 61.69 60.98 2puq s THR 112 Cb -0.08 -0.53 -0.13 0.00 1.34 0.00 0.00 72.50 73.10 2puq s THR 112 CO 0.53 0.26 1.74 -0.38 -0.54 0.00 0.00 174.62 176.23 2puq n ILE 113 N 5.14 0.34 -3.64 2.99 5.41 -1.26 -2.64 119.36 125.70 2puq n ILE 113 Ca -0.07 -0.06 -0.29 0.00 1.00 0.00 0.00 62.75 63.32 2puq n ILE 113 Cb 0.50 -1.63 -0.14 0.00 -0.71 0.00 0.00 39.64 37.66 2puq n ILE 113 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2puq s GLN 114 N 2.85 0.77 0.00 0.38 1.03 -0.17 -4.90 119.66 119.61 2puq s GLN 114 Ca 0.89 -1.32 0.00 0.00 0.04 0.00 0.00 55.36 54.96 2puq s GLN 114 Cb -0.75 -1.83 0.00 0.00 0.03 0.00 0.00 33.01 30.47 2puq s GLN 114 CO 0.49 -1.09 0.00 0.45 -2.54 0.00 0.00 175.29 172.60 2puq n SER 115 N 4.35 0.00 0.00 12.60 2.88 -1.26 -4.60 113.62 127.59 2puq n SER 115 Ca 0.04 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.58 2puq n SER 115 Cb 0.39 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.85 2puq n SER 115 CO 0.00 0.00 0.00 0.33 -1.23 0.00 0.00 175.04 174.14 2puq n PHE 116 N -0.00 0.00 -0.49 0.66 -0.00 -1.26 -2.62 117.46 113.75 2puq n PHE 116 Ca 0.00 0.00 -0.19 0.00 -0.00 0.00 0.00 57.45 57.26 2puq n PHE 116 Cb 0.00 0.03 -0.03 0.00 -0.00 0.00 0.00 39.48 39.48 2puq n PHE 116 CO 0.00 0.00 0.00 -1.91 -0.00 0.00 0.00 176.76 174.85 2puq n GLU 117 N 0.00 0.00 -3.63 -4.13 2.13 -1.24 -4.33 120.64 109.43 2puq n GLU 117 Ca 0.00 0.00 -0.37 0.00 0.66 0.00 0.00 57.16 57.45 2puq n GLU 117 Cb 0.48 -0.44 -0.07 0.00 0.27 0.00 0.00 31.44 31.68 2puq n GLU 117 CO 0.00 0.00 0.00 -0.65 -0.41 0.00 0.00 177.13 176.07 2puq s GLN 118 N 0.58 3.12 0.00 5.31 -0.21 -1.26 -1.54 119.66 125.66 2puq s GLN 118 Ca 0.29 -3.01 0.00 0.00 0.02 0.00 0.00 55.36 52.66 2puq s GLN 118 Cb -0.42 -3.94 0.00 0.00 1.00 0.00 0.00 33.01 29.66 2puq s GLN 118 CO 0.22 -1.24 0.54 0.28 -2.12 0.00 0.00 175.29 172.97 2puq n VAL 119 N 2.77 0.00 0.00 1.09 0.31 -0.55 -4.91 118.33 117.04 2puq n VAL 119 Ca 0.17 0.97 0.00 0.00 -0.01 0.00 0.00 64.34 65.47 2puq n VAL 119 Cb 0.38 -1.84 0.00 0.00 -0.91 0.00 0.00 33.84 31.47 2puq n VAL 119 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2puq n GLY 120 N 0.17 1.35 0.00 2.92 0.00 -1.26 -4.88 105.19 103.48 2puq n GLY 120 Ca 0.00 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.13 2puq n GLY 120 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 2puq n THR 121 N 0.00 0.11 -5.15 2.61 5.66 -1.26 -4.81 114.28 111.43 2puq n THR 121 Ca 0.00 0.03 -0.30 0.00 -3.05 0.00 0.00 64.05 60.73 2puq n THR 121 Cb 0.00 -0.68 -0.16 0.00 -1.55 0.00 0.00 70.33 67.94 2puq n THR 121 CO 0.00 0.00 0.00 -0.54 -3.05 0.00 0.00 175.07 171.48 2puq s LYS 122 N -2.17 1.96 -0.23 1.09 -0.14 -1.26 -2.61 119.74 116.38 2puq s LYS 122 Ca 0.29 -0.96 -0.09 0.00 -1.36 0.00 0.00 55.97 53.85 2puq s LYS 122 Cb 0.15 -1.96 -0.04 0.00 -1.68 0.00 0.00 37.83 34.29 2puq s LYS 122 CO 0.27 0.53 0.11 0.08 -0.76 0.00 0.00 175.35 175.59 2puq s VAL 123 N -0.66 4.98 -0.79 3.17 1.01 -1.21 -1.48 120.40 125.41 2puq s VAL 123 Ca 0.10 0.04 -0.14 0.00 0.00 0.00 0.00 61.98 61.99 2puq s VAL 123 Cb -0.10 -3.30 0.21 0.00 0.00 0.00 0.00 36.38 33.19 2puq s VAL 123 CO -0.00 0.37 0.73 0.21 0.00 0.00 0.00 175.10 176.41 2puq s ASN 124 N 0.99 6.65 -0.23 3.32 2.47 -0.59 -2.10 114.94 125.45 2puq s ASN 124 Ca 0.06 -2.59 -0.23 0.00 0.42 0.00 0.00 52.86 50.51 2puq s ASN 124 Cb -0.14 -2.20 -0.01 0.00 -1.45 0.00 0.00 41.25 37.45 2puq s ASN 124 CO 0.03 -0.60 0.75 0.54 -3.72 0.00 0.00 177.10 174.11 2puq s VAL 125 N 0.32 4.90 -0.10 -5.21 0.11 -1.25 -3.73 120.40 115.44 2puq s VAL 125 Ca 0.16 1.42 -0.02 0.00 -2.93 0.00 0.00 61.98 60.62 2puq s VAL 125 Cb -0.13 -4.05 -0.03 0.00 -1.53 0.00 0.00 36.38 30.64 2puq s VAL 125 CO -0.07 -0.01 -0.03 -0.89 -3.33 0.00 0.00 175.10 170.77 2puq s THR 126 N 2.51 4.05 0.06 5.04 2.01 -1.08 -1.44 115.64 126.80 2puq s THR 126 Ca 0.32 -0.33 -0.01 0.00 0.31 0.00 0.00 61.69 61.98 2puq s THR 126 Cb -0.16 -2.71 -0.04 0.00 0.01 0.00 0.00 72.50 69.60 2puq s THR 126 CO 0.09 0.58 0.22 -0.69 -0.69 0.00 0.00 174.62 174.12 2puq s VAL 127 N -0.56 5.38 -0.07 3.82 1.01 -0.12 -1.00 120.40 128.86 2puq s VAL 127 Ca 0.09 -0.35 -0.21 0.00 0.00 0.00 0.00 61.98 61.51 2puq s VAL 127 Cb -0.12 -3.62 -0.04 0.00 0.00 0.00 0.00 36.38 32.60 2puq s VAL 127 CO 0.02 0.15 0.60 -0.70 0.00 0.00 0.00 175.10 175.17 2puq s GLU 128 N -2.47 4.38 -1.06 2.72 2.12 -1.08 -4.79 118.70 118.52 2puq s GLU 128 Ca 0.35 0.71 -0.23 0.00 0.36 0.00 0.00 54.97 56.16 2puq s GLU 128 Cb -0.13 -3.42 -0.01 0.00 0.26 0.00 0.00 34.13 30.84 2puq s GLU 128 CO 0.27 0.17 1.76 -0.51 -0.54 0.00 0.00 175.26 176.41 2puq s ASP 129 N 0.48 5.81 0.13 -1.70 1.01 -1.26 -4.76 116.67 116.38 2puq s ASP 129 Ca 0.32 -1.38 -0.30 0.00 0.71 0.00 0.00 52.55 51.90 2puq s ASP 129 Cb -0.17 -2.57 -0.07 0.00 1.01 0.00 0.00 42.92 41.12 2puq s ASP 129 CO 0.15 -2.18 1.11 -1.61 0.21 0.00 0.00 175.17 172.86 2puq s GLU 130 N 5.84 4.55 0.52 8.23 8.01 -1.26 -4.70 118.70 139.89 2puq s GLU 130 Ca 0.60 1.70 -0.22 0.00 0.01 0.00 0.00 54.97 57.06 2puq s GLU 130 Cb -0.02 -3.31 -0.06 0.00 -4.31 0.00 0.00 34.13 26.43 2puq s GLU 130 CO 0.00 -0.02 1.26 -0.98 0.01 0.00 0.00 175.26 175.54 2puq s ARG 131 N 0.13 3.35 0.56 1.61 1.70 -1.26 -0.75 118.95 124.30 2puq s ARG 131 Ca 0.52 2.00 0.05 0.00 -0.47 0.00 0.00 55.73 57.83 2puq s ARG 131 Cb -0.28 -2.27 0.05 0.00 -0.57 0.00 0.00 34.95 31.88 2puq s ARG 131 CO 0.33 -0.95 0.42 0.95 -1.08 0.00 0.00 175.30 174.97 2puq s THR 132 N -1.44 1.54 -2.10 4.99 -4.23 0.38 -4.78 115.64 110.00 2puq s THR 132 Ca 0.69 -1.49 0.30 0.00 -1.18 0.00 0.00 61.69 60.02 2puq s THR 132 Cb -0.34 -2.03 0.82 0.00 1.34 0.00 0.00 72.50 72.29 2puq s THR 132 CO 0.41 0.00 2.11 0.18 -0.54 0.00 0.00 174.62 176.77 2puq n LEU 133 N -1.82 0.30 -4.69 4.79 7.99 -0.84 -4.45 117.00 118.28 2puq n LEU 133 Ca -0.02 -0.10 -0.42 0.00 -0.01 0.00 0.00 56.01 55.46 2puq n LEU 133 Cb 0.64 -0.00 -0.03 0.00 -0.11 0.00 0.00 43.42 43.93 2puq n LEU 133 CO 0.38 0.05 0.80 -0.69 -1.51 0.00 0.00 177.39 176.42 2puq s VAL 134 N -2.00 4.71 0.06 4.08 1.01 -1.26 -4.95 120.40 122.05 2puq s VAL 134 Ca 0.45 1.98 0.03 0.00 0.00 0.00 0.00 61.98 64.44 2puq s VAL 134 Cb 0.21 -4.27 -0.04 0.00 0.00 0.00 0.00 36.38 32.28 2puq s VAL 134 CO 0.35 0.02 0.03 -0.13 0.00 0.00 0.00 175.10 175.38 2puq s ARG 135 N 1.90 2.73 -0.24 2.72 0.52 -1.26 0.57 118.95 125.89 2puq s ARG 135 Ca 0.50 -0.72 -0.01 0.00 -0.52 0.00 0.00 55.73 54.98 2puq s ARG 135 Cb -0.20 -2.64 0.07 0.00 0.52 0.00 0.00 34.95 32.70 2puq s ARG 135 CO 0.20 0.58 0.03 1.03 0.02 0.00 0.00 175.30 177.16 2puq s ARG 136 N -2.11 0.91 -0.47 3.54 3.00 0.41 -4.86 118.95 119.37 2puq s ARG 136 Ca 0.25 -0.78 -0.01 0.00 0.00 0.00 0.00 55.73 55.18 2puq s ARG 136 Cb -0.12 -2.20 -0.01 0.00 0.00 0.00 0.00 34.95 32.62 2puq s ARG 136 CO 0.17 -0.75 0.40 0.09 0.00 0.00 0.00 175.30 175.21 2puq n ASN 137 N 4.88 -2.85 0.00 0.23 3.02 -1.26 -3.16 115.26 116.13 2puq n ASN 137 Ca -0.07 -0.27 0.00 0.00 -0.03 0.00 0.00 54.58 54.20 2puq n ASN 137 Cb 0.45 -2.44 0.00 0.00 -0.61 0.00 0.00 39.78 37.18 2puq n ASN 137 CO 0.00 0.00 0.00 -0.46 -2.62 0.00 0.00 177.26 174.18 2puq n ASN 138 N -2.03 0.00 -4.82 6.41 6.94 -1.26 -4.94 115.26 115.56 2puq n ASN 138 Ca -0.08 0.00 -0.27 0.00 -0.02 0.00 0.00 54.58 54.21 2puq n ASN 138 Cb 0.56 -0.70 -0.05 0.00 -2.36 0.00 0.00 39.78 37.23 2puq n ASN 138 CO 0.00 0.00 0.00 0.42 -1.03 0.00 0.00 177.26 176.65 2puq s THR 139 N -1.10 4.67 -0.23 5.53 -4.23 -1.19 -5.03 115.64 114.08 2puq s THR 139 Ca 0.00 -0.92 -0.16 0.00 -1.18 0.00 0.00 61.69 59.44 2puq s THR 139 Cb 0.00 -3.36 -0.04 0.00 1.34 0.00 0.00 72.50 70.45 2puq s THR 139 CO 0.00 -0.04 0.40 -0.36 -0.54 0.00 0.00 174.62 174.07 2puq s PHE 140 N -1.66 3.33 0.72 3.99 0.08 -1.26 -0.45 117.98 122.73 2puq s PHE 140 Ca 0.31 0.55 -0.13 0.00 0.12 0.00 0.00 56.93 57.78 2puq s PHE 140 Cb -0.11 -2.55 0.03 0.00 -0.57 0.00 0.00 43.02 39.82 2puq s PHE 140 CO 0.24 -0.09 1.11 -0.51 -0.10 0.00 0.00 175.22 175.87 2puq s LEU 141 N 1.61 3.22 0.38 -0.37 1.43 0.19 -4.72 118.68 120.42 2puq s LEU 141 Ca 0.18 1.95 0.06 0.00 -1.03 0.00 0.00 54.13 55.29 2puq s LEU 141 Cb -0.15 -4.54 -0.00 0.00 0.03 0.00 0.00 46.19 41.53 2puq s LEU 141 CO 0.08 -1.88 0.53 -0.94 0.23 0.00 0.00 176.35 174.37 2puq s SER 142 N -2.90 5.83 0.25 2.29 1.04 -1.26 -0.47 113.70 118.47 2puq s SER 142 Ca 0.65 -0.21 -0.05 0.00 0.48 0.00 0.00 55.95 56.82 2puq s SER 142 Cb -0.20 -1.06 0.49 0.00 0.10 0.00 0.00 66.02 65.36 2puq s SER 142 CO 0.48 -0.59 1.65 -0.07 0.98 0.00 0.00 173.24 175.70 2puq h LEU 143 N 0.73 -0.16 -1.31 2.42 3.38 -1.22 -0.58 115.31 118.57 2puq h LEU 143 Ca -0.44 0.18 -0.02 0.00 0.09 0.00 0.00 57.88 57.68 2puq h LEU 143 Cb 1.27 0.28 -0.02 0.00 0.09 0.00 0.00 40.66 42.27 2puq h LEU 143 CO 0.51 -0.13 0.18 0.03 0.09 0.00 0.00 178.44 179.12 2puq h ARG 144 N 0.18 0.65 -0.20 1.13 2.47 -1.92 -1.47 114.38 115.22 2puq h ARG 144 Ca 0.44 -0.09 -0.06 0.00 -1.26 0.00 0.00 59.98 59.01 2puq h ARG 144 Cb 0.79 -0.12 -0.01 0.00 -1.65 0.00 0.00 29.97 28.97 2puq h ARG 144 CO -0.61 0.54 -0.12 -0.44 0.56 0.00 0.00 179.97 179.90 2puq h ASP 145 N 0.65 0.30 0.13 7.04 3.32 -1.48 -1.88 116.42 124.49 2puq h ASP 145 Ca 0.16 -0.07 -0.37 0.00 0.02 0.00 0.00 57.03 56.78 2puq h ASP 145 Cb 0.14 -0.08 -0.02 0.00 0.22 0.00 0.00 39.33 39.59 2puq h ASP 145 CO -0.02 0.46 -2.03 0.52 -1.72 0.00 0.00 179.24 176.45 2puq n VAL 146 N -4.25 1.76 0.00 -1.35 0.31 -1.01 -4.57 118.33 109.22 2puq n VAL 146 Ca -0.00 -0.66 0.11 0.00 -0.01 0.00 0.00 64.34 63.78 2puq n VAL 146 Cb 0.28 -1.68 -0.17 0.00 -0.91 0.00 0.00 33.84 31.36 2puq n VAL 146 CO 0.00 0.00 0.00 0.49 -1.32 0.00 0.00 176.83 176.00 2puq n PHE 147 N -3.45 0.01 -0.58 3.52 3.72 -0.57 -5.05 117.46 115.06 2puq n PHE 147 Ca -0.33 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.08 2puq n PHE 147 Cb 1.04 -0.50 0.00 0.00 -0.94 0.00 0.00 39.48 39.08 2puq n PHE 147 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2puq n GLY 148 N 1.26 1.91 0.00 1.37 0.00 -0.71 -0.59 105.19 108.43 2puq n GLY 148 Ca -0.04 -0.21 0.00 0.00 0.00 0.00 0.00 46.02 45.78 2puq n GLY 148 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2puq n LYS 149 N 14.00 0.12 0.01 1.61 3.00 -1.26 -2.36 118.16 133.28 2puq n LYS 149 Ca 0.00 0.00 -0.05 0.00 -0.00 0.00 0.00 58.31 58.26 2puq n LYS 149 Cb 0.00 -1.01 -0.11 0.00 0.00 0.00 0.00 35.03 33.91 2puq n LYS 149 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.40 176.96 2puq h ASP 150 N 0.00 0.00 -3.88 3.14 5.19 -1.25 -3.46 116.42 116.17 2puq h ASP 150 Ca 0.00 0.00 -0.64 0.00 -0.62 0.00 0.00 57.03 55.77 2puq h ASP 150 Cb 0.00 0.00 -0.17 0.00 0.18 0.00 0.00 39.33 39.34 2puq h ASP 150 CO 0.00 0.82 -0.52 -0.22 -3.12 0.00 0.00 179.24 176.20 2puq s LEU 151 N -6.03 4.01 0.41 1.55 2.96 -1.00 -3.90 118.68 116.68 2puq s LEU 151 Ca -0.03 -0.01 0.07 0.00 -0.22 0.00 0.00 54.13 53.94 2puq s LEU 151 Cb 0.08 -2.12 -0.05 0.00 0.50 0.00 0.00 46.19 44.61 2puq s LEU 151 CO 0.82 -0.04 0.18 0.27 -1.32 0.00 0.00 176.35 176.25 2puq s ILE 152 N 1.72 2.33 0.42 6.68 -4.36 0.16 -4.78 121.20 123.37 2puq s ILE 152 Ca 0.07 -1.69 0.07 0.00 -0.26 0.00 0.00 60.65 58.84 2puq s ILE 152 Cb -0.16 -3.00 -0.06 0.00 1.25 0.00 0.00 42.46 40.50 2puq s ILE 152 CO 0.11 -0.01 0.12 -0.31 0.24 0.00 0.00 174.94 175.09 2puq s TYR 153 N -2.59 2.51 -0.12 1.37 2.02 -0.20 -0.26 117.35 120.07 2puq s TYR 153 Ca 0.41 -0.64 -0.04 0.00 -0.37 0.00 0.00 57.07 56.43 2puq s TYR 153 Cb 0.04 -1.88 0.06 0.00 -0.40 0.00 0.00 41.96 39.77 2puq s TYR 153 CO 0.23 0.25 0.21 0.99 -1.57 0.00 0.00 175.55 175.66 2puq s THR 154 N -2.66 -0.33 -0.19 -0.71 2.01 -0.47 -2.87 115.64 110.42 2puq s THR 154 Ca 0.37 0.26 -0.08 0.00 0.31 0.00 0.00 61.69 62.55 2puq s THR 154 Cb 0.06 -0.41 -0.04 0.00 0.01 0.00 0.00 72.50 72.11 2puq s THR 154 CO 0.20 0.09 0.08 -0.22 -0.69 0.00 0.00 174.62 174.08 2puq s LEU 155 N 2.35 3.90 0.05 4.42 2.96 -1.23 -2.67 118.68 128.47 2puq s LEU 155 Ca 0.03 0.11 -0.02 0.00 -0.22 0.00 0.00 54.13 54.03 2puq s LEU 155 Cb -0.13 -1.99 -0.04 0.00 0.50 0.00 0.00 46.19 44.53 2puq s LEU 155 CO -0.08 0.17 0.23 -0.31 -1.32 0.00 0.00 176.35 175.05 2puq s TYR 156 N 0.39 3.52 0.00 5.38 2.02 -0.45 -0.32 117.35 127.89 2puq s TYR 156 Ca 0.04 0.34 0.00 0.00 -0.37 0.00 0.00 57.07 57.08 2puq s TYR 156 Cb -0.12 -1.83 0.00 0.00 -0.40 0.00 0.00 41.96 39.61 2puq s TYR 156 CO -0.00 0.58 0.00 2.48 -1.57 0.00 0.00 175.55 177.04 2puq n TYR 157 N 0.45 0.00 -0.64 2.71 4.11 -1.26 -1.98 117.16 120.55 2puq n TYR 157 Ca -0.06 0.00 0.01 0.00 -0.00 0.00 0.00 57.90 57.85 2puq n TYR 157 Cb 0.52 0.00 -0.01 0.00 -0.00 0.00 0.00 39.34 39.85 2puq n TYR 157 CO 0.00 0.00 0.00 1.17 -0.00 0.00 0.00 176.86 178.03 2puq n LYS 166 N -0.20 -0.29 -4.49 -3.48 0.00 -1.26 -4.05 118.16 104.38 2puq n LYS 166 Ca 0.00 0.24 -0.22 0.00 0.00 0.00 0.00 58.31 58.33 2puq n LYS 166 Cb 0.00 -0.79 -0.14 0.00 0.00 0.00 0.00 35.03 34.10 2puq n LYS 166 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.40 178.35 2puq s THR 167 N -4.85 1.30 0.00 3.15 -4.23 -1.26 -5.05 115.64 104.70 2puq s THR 167 Ca 0.00 -1.01 0.00 0.00 -1.18 0.00 0.00 61.69 59.50 2puq s THR 167 Cb 0.00 -1.15 0.00 0.00 1.34 0.00 0.00 72.50 72.69 2puq s THR 167 CO 0.00 0.11 0.00 0.00 -0.54 0.00 0.00 174.62 174.19 2puq n ALA 168 N 1.99 0.00 0.00 3.99 0.00 0.57 -5.00 120.51 122.06 2puq n ALA 168 Ca -0.17 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.27 2puq n ALA 168 Cb 0.54 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.99 2puq n ALA 168 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 2puq n LYS 169 N 0.00 0.00 -3.84 0.00 4.81 -1.26 -3.47 118.16 114.40 2puq n LYS 169 Ca 0.00 0.00 -0.09 0.00 -0.87 0.00 0.00 58.31 57.35 2puq n LYS 169 Cb 0.00 0.00 -0.04 0.00 0.02 0.00 0.00 35.03 35.01 2puq n LYS 169 CO 0.00 0.00 0.00 -0.08 1.17 0.00 0.00 177.40 178.49 2puq s THR 170 N -1.41 0.02 0.00 3.15 -1.32 -1.14 -4.98 115.64 109.97 2puq s THR 170 Ca 0.00 -1.04 0.00 0.00 -1.21 0.00 0.00 61.69 59.44 2puq s THR 170 Cb 0.00 -1.80 0.00 0.00 -1.51 0.00 0.00 72.50 69.19 2puq s THR 170 CO 0.00 -0.11 0.66 -0.46 -2.21 0.00 0.00 174.62 172.50 2puq n ASN 171 N -0.34 1.18 -3.21 8.08 0.23 -1.26 -1.04 115.26 118.89 2puq n ASN 171 Ca -0.07 -1.44 -0.11 0.00 -0.53 0.00 0.00 54.58 52.43 2puq n ASN 171 Cb 0.62 0.00 0.06 0.00 -2.08 0.00 0.00 39.78 38.38 2puq n ASN 171 CO 0.00 0.00 0.00 1.07 -0.93 0.00 0.00 177.26 177.40 2puq n THR 172 N -0.22 0.00 0.12 5.53 5.66 -1.26 -4.77 114.28 119.34 2puq n THR 172 Ca 0.00 -0.75 0.06 0.00 -3.05 0.00 0.00 64.05 60.31 2puq n THR 172 Cb 0.21 -1.16 0.23 0.00 -1.55 0.00 0.00 70.33 68.06 2puq n THR 172 CO 0.00 0.00 0.00 0.59 -3.05 0.00 0.00 175.07 172.61 2puq n ASN 173 N -2.97 3.33 -3.95 1.09 3.02 -1.26 -4.62 115.26 109.90 2puq n ASN 173 Ca 0.08 -2.34 -0.16 0.00 -0.03 0.00 0.00 54.58 52.13 2puq n ASN 173 Cb 0.28 -0.49 -0.14 0.00 -0.61 0.00 0.00 39.78 38.82 2puq n ASN 173 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 2puq s GLU 174 N -1.80 0.41 0.42 3.52 0.41 -1.26 -0.95 118.70 119.46 2puq s GLU 174 Ca 0.33 -0.17 0.06 0.00 -0.41 0.00 0.00 54.97 54.77 2puq s GLU 174 Cb 0.22 -0.41 0.06 0.00 -1.78 0.00 0.00 34.13 32.22 2puq s GLU 174 CO 0.15 0.09 0.47 1.19 -0.49 0.00 0.00 175.26 176.67 2puq n PHE 175 N 3.02 -1.70 -3.18 1.61 3.72 -0.52 -4.83 117.46 115.59 2puq n PHE 175 Ca -0.14 -1.66 0.05 0.00 -0.05 0.00 0.00 57.45 55.65 2puq n PHE 175 Cb 0.58 -0.38 -0.02 0.00 -0.94 0.00 0.00 39.48 38.72 2puq n PHE 175 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 176.76 176.20 2puq s LEU 176 N 0.00 -0.68 0.00 4.37 1.43 -1.26 -3.93 118.68 118.61 2puq s LEU 176 Ca 0.35 0.48 0.00 0.00 -1.03 0.00 0.00 54.13 53.93 2puq s LEU 176 Cb -0.03 1.59 0.00 0.00 0.03 0.00 0.00 46.19 47.78 2puq s LEU 176 CO 0.22 -0.13 0.00 -0.38 0.23 0.00 0.00 176.35 176.30 2puq n ILE 177 N 5.41 0.00 -3.47 -0.59 5.41 -0.89 -4.98 119.36 120.24 2puq n ILE 177 Ca -0.06 0.00 -0.10 0.00 1.00 0.00 0.00 62.75 63.59 2puq n ILE 177 Cb 0.53 0.00 -0.02 0.00 -0.71 0.00 0.00 39.64 39.44 2puq n ILE 177 CO 0.00 0.00 0.00 1.51 0.00 0.00 0.00 176.55 178.06 2puq s ASP 178 N 1.00 -0.45 -0.41 4.38 -4.77 -1.26 -3.35 116.67 111.81 2puq s ASP 178 Ca 0.00 -0.01 -0.28 0.00 -3.30 0.00 0.00 52.55 48.96 2puq s ASP 178 Cb 0.00 0.48 -0.00 0.00 -1.09 0.00 0.00 42.92 42.31 2puq s ASP 178 CO 0.00 -0.78 1.56 -0.69 0.70 0.00 0.00 175.17 175.97 2puq s VAL 179 N -3.39 3.72 0.00 2.11 1.01 -1.07 -4.95 120.40 117.82 2puq s VAL 179 Ca 0.03 0.71 0.00 0.00 0.00 0.00 0.00 61.98 62.72 2puq s VAL 179 Cb -0.01 -4.03 0.00 0.00 0.00 0.00 0.00 36.38 32.34 2puq s VAL 179 CO -0.10 -0.69 0.00 0.00 0.00 0.00 0.00 175.10 174.30 2puq s PHE 187 N -0.13 1.25 -0.01 0.00 0.08 -1.16 -4.02 117.98 114.00 2puq s PHE 187 Ca 0.00 1.05 0.03 0.00 0.12 0.00 0.00 56.93 58.14 2puq s PHE 187 Cb 0.00 -3.81 -0.01 0.00 -0.57 0.00 0.00 43.02 38.63 2puq s PHE 187 CO 0.00 -3.03 -0.11 -1.54 -0.10 0.00 0.00 175.22 170.44 2puq s SER 188 N 9.83 1.29 0.00 1.36 1.04 -0.84 -0.38 113.70 126.00 2puq s SER 188 Ca 0.93 -0.20 0.00 0.00 0.48 0.00 0.00 55.95 57.16 2puq s SER 188 Cb -0.22 -0.15 0.00 0.00 0.10 0.00 0.00 66.02 65.75 2puq s SER 188 CO 0.29 0.13 0.00 1.33 0.98 0.00 0.00 173.24 175.97 2puq n VAL 189 N 2.82 0.00 -3.19 5.02 0.24 -1.26 -1.34 118.33 120.62 2puq n VAL 189 Ca -0.14 0.00 0.05 0.00 -2.04 0.00 0.00 64.34 62.21 2puq n VAL 189 Cb 0.56 -0.75 -0.02 0.00 -1.47 0.00 0.00 33.84 32.16 2puq n VAL 189 CO 0.00 0.00 0.00 -1.58 -2.14 0.00 0.00 176.83 173.11 2puq s GLN 190 N -1.94 0.18 0.34 7.34 2.00 -1.09 -1.49 119.66 125.00 2puq s GLN 190 Ca 0.00 0.35 -0.26 0.00 -2.00 0.00 0.00 55.36 53.45 2puq s GLN 190 Cb 0.00 0.20 -0.09 0.00 0.80 0.00 0.00 33.01 33.92 2puq s GLN 190 CO 0.00 -0.16 1.03 0.00 -0.50 0.00 0.00 175.29 175.65 2puq s ALA 191 N 2.79 3.21 -0.01 1.58 0.00 -1.26 -1.37 121.76 126.70 2puq s ALA 191 Ca -0.02 0.70 0.00 0.00 0.00 0.00 0.00 51.96 52.65 2puq s ALA 191 Cb -0.09 -3.26 0.01 0.00 0.00 0.00 0.00 23.12 19.79 2puq s ALA 191 CO -0.12 -0.08 0.00 0.08 0.00 0.00 0.00 175.76 175.64 2puq s VAL 192 N -1.50 0.07 -0.37 0.00 1.01 0.64 -0.79 120.40 119.46 2puq s VAL 192 Ca 0.52 0.04 -0.01 0.00 0.00 0.00 0.00 61.98 62.53 2puq s VAL 192 Cb -0.24 -0.11 0.09 0.00 0.00 0.00 0.00 36.38 36.13 2puq s VAL 192 CO 0.30 0.06 0.12 -0.63 0.00 0.00 0.00 175.10 174.95 2puq s ILE 193 N 0.41 2.95 0.35 2.22 -1.09 -0.63 -0.67 121.20 124.75 2puq s ILE 193 Ca -0.04 -1.99 0.03 0.00 -2.23 0.00 0.00 60.65 56.42 2puq s ILE 193 Cb -0.06 -2.99 0.27 0.00 -1.58 0.00 0.00 42.46 38.11 2puq s ILE 193 CO -0.01 -0.54 2.00 -0.65 -1.23 0.00 0.00 174.94 174.51 2puq h PRO 194 N 7.92 0.81 0.00 2.79 0.11 -1.83 -2.91 132.00 138.89 2puq h PRO 194 Ca -0.12 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.94 2puq h PRO 194 Cb 1.04 -0.18 0.00 0.00 0.11 0.00 0.00 31.00 31.97 2puq h PRO 194 CO 0.62 0.54 0.00 -1.13 -0.21 0.00 0.00 178.00 177.81 2puq n SER 195 N -4.45 0.00 -4.74 -2.05 3.41 -1.26 -4.78 113.62 99.75 2puq n SER 195 Ca 0.07 -0.92 -0.40 0.00 -0.26 0.00 0.00 58.87 57.36 2puq n SER 195 Cb 0.08 0.00 -0.05 0.00 -0.26 0.00 0.00 64.21 63.99 2puq n SER 195 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 2puq s ARG 196 N -2.00 4.48 0.15 4.33 0.52 -1.10 -4.95 118.95 120.39 2puq s ARG 196 Ca 0.22 1.04 -0.03 0.00 -0.52 0.00 0.00 55.73 56.43 2puq s ARG 196 Cb 0.10 -3.39 -0.01 0.00 0.52 0.00 0.00 34.95 32.17 2puq s ARG 196 CO 0.17 0.20 1.38 0.00 0.02 0.00 0.00 175.30 177.07 2puq h THR 197 N 4.34 1.38 -3.80 0.02 1.03 -1.87 -3.44 112.91 110.56 2puq h THR 197 Ca -0.43 -2.21 -0.33 0.00 -0.01 0.00 0.00 66.41 63.42 2puq h THR 197 Cb 1.20 2.19 -0.14 0.00 -1.07 0.00 0.00 68.15 70.33 2puq h THR 197 CO 0.72 0.67 -0.62 0.68 -0.01 0.00 0.00 175.52 176.96 2puq s VAL 198 N -3.53 0.56 -0.98 0.00 -7.23 -1.26 -4.86 120.40 103.10 2puq s VAL 198 Ca -0.06 -2.00 -0.03 0.00 -1.81 0.00 0.00 61.98 58.08 2puq s VAL 198 Cb 0.10 -2.54 0.03 0.00 0.56 0.00 0.00 36.38 34.52 2puq s VAL 198 CO 0.85 -0.08 0.08 0.59 -0.31 0.00 0.00 175.10 176.23 2puq n ASN 199 N -0.42 0.22 -0.21 4.85 5.03 -1.26 -4.83 115.26 118.64 2puq n ASN 199 Ca -0.01 -0.77 -0.08 0.00 0.87 0.00 0.00 54.58 54.60 2puq n ASN 199 Cb 0.66 -0.96 0.03 0.00 -1.02 0.00 0.00 39.78 38.49 2puq n ASN 199 CO 0.00 0.00 0.00 0.03 -1.83 0.00 0.00 177.26 175.46 2puq h ARG 200 N -0.65 0.89 -5.17 3.52 2.47 -1.85 -3.43 114.38 110.16 2puq h ARG 200 Ca -0.39 -0.17 -0.64 0.00 -1.26 0.00 0.00 59.98 57.52 2puq h ARG 200 Cb 0.84 -0.14 -0.22 0.00 -1.65 0.00 0.00 29.97 28.80 2puq h ARG 200 CO 0.45 0.77 -0.65 0.15 0.56 0.00 0.00 179.97 181.25 2puq s LYS 201 N -5.53 3.67 0.00 0.04 3.01 -1.26 -1.60 119.74 118.06 2puq s LYS 201 Ca -0.13 -0.50 0.00 0.00 -1.01 0.00 0.00 55.97 54.33 2puq s LYS 201 Cb 0.13 -3.07 0.00 0.00 -1.01 0.00 0.00 37.83 33.88 2puq s LYS 201 CO 0.80 0.08 0.00 0.45 0.51 0.00 0.00 175.35 177.18 2puq n SER 202 N 4.06 -0.36 -4.54 2.83 2.88 0.03 -4.91 113.62 113.61 2puq n SER 202 Ca -0.17 0.00 -0.29 0.00 -1.33 0.00 0.00 58.87 57.08 2puq n SER 202 Cb 0.52 0.00 -0.10 0.00 -0.75 0.00 0.00 64.21 63.88 2puq n SER 202 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 2puq s THR 203 N -0.18 3.10 0.11 2.46 -1.32 -1.26 -4.88 115.64 113.67 2puq s THR 203 Ca 0.00 -1.48 -0.33 0.00 -1.21 0.00 0.00 61.69 58.67 2puq s THR 203 Cb 0.00 -2.47 -0.12 0.00 -1.51 0.00 0.00 72.50 68.40 2puq s THR 203 CO 0.00 0.04 1.75 0.47 -2.21 0.00 0.00 174.62 174.67 2puq n ASP 204 N 0.55 3.62 -4.42 8.08 9.92 -1.25 -4.18 116.55 128.87 2puq n ASP 204 Ca -0.13 1.03 -0.33 0.00 -0.53 0.00 0.00 54.79 54.82 2puq n ASP 204 Cb 0.53 -1.48 0.12 0.00 -0.64 0.00 0.00 41.12 39.65 2puq n ASP 204 CO 0.00 0.00 0.00 -1.54 0.13 0.00 0.00 177.20 175.79 2puq n SER 205 N 4.88 -2.04 -4.69 -2.24 3.41 -0.55 -4.80 113.62 107.58 2puq n SER 205 Ca 0.18 0.34 -0.42 0.00 -0.26 0.00 0.00 58.87 58.71 2puq n SER 205 Cb 0.33 -1.21 -0.03 0.00 -0.26 0.00 0.00 64.21 63.04 2puq n SER 205 CO 0.00 0.00 0.00 -2.16 -0.16 0.00 0.00 175.04 172.72 2puq s PRO 206 N -3.61 4.28 0.26 4.33 0.04 -1.26 -4.50 135.00 134.55 2puq s PRO 206 Ca 0.57 2.01 -0.31 0.00 0.04 0.00 0.00 61.00 63.31 2puq s PRO 206 Cb -0.22 -3.52 -0.12 0.00 0.04 0.00 0.00 34.50 30.68 2puq s PRO 206 CO 0.67 -0.56 1.59 1.55 0.04 0.00 0.00 177.00 180.29 2puq n VAL 207 N 4.55 0.76 -3.98 -0.36 3.14 -1.26 -4.77 118.33 116.41 2puq n VAL 207 Ca 0.13 -0.19 -0.09 0.00 -2.96 0.00 0.00 64.34 61.23 2puq n VAL 207 Cb 0.43 -1.87 -0.11 0.00 -1.06 0.00 0.00 33.84 31.23 2puq n VAL 207 CO 0.00 0.00 0.00 -1.61 -6.46 0.00 0.00 176.83 168.76 2puq s GLU 208 N -0.09 0.33 0.00 1.45 0.41 0.49 -4.99 118.70 116.29 2puq s GLU 208 Ca 0.68 -0.63 0.00 0.00 -0.41 0.00 0.00 54.97 54.61 2puq s GLU 208 Cb -0.53 0.12 0.00 0.00 -1.78 0.00 0.00 34.13 31.94 2puq s GLU 208 CO 0.45 -0.05 0.00 0.00 -0.49 0.00 0.00 175.26 175.16