#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1f90 s VAL 2 N 0.00 4.28 0.24 2.53 1.01 -1.26 -5.04 120.40 122.15 1f90 s VAL 2 Ca 0.00 1.52 -0.15 0.00 0.00 0.00 0.00 61.98 63.35 1f90 s VAL 2 Cb 0.00 -4.06 -0.08 0.00 0.00 0.00 0.00 36.38 32.24 1f90 s VAL 2 CO 0.00 -0.22 0.65 0.00 0.00 0.00 0.00 175.10 175.53 1f90 s GLN 3 N 3.65 4.02 -0.13 2.72 -2.07 -1.26 -4.78 119.66 121.82 1f90 s GLN 3 Ca 0.54 0.60 0.03 0.00 -1.82 0.00 0.00 55.36 54.71 1f90 s GLN 3 Cb -0.20 -2.70 0.01 0.00 -1.09 0.00 0.00 33.01 29.03 1f90 s GLN 3 CO 0.16 0.32 -0.21 -1.64 -1.32 0.00 0.00 175.29 172.60 1f90 s MET 4 N -2.46 2.89 -0.13 9.60 -1.94 -1.26 -1.10 119.30 124.91 1f90 s MET 4 Ca 0.46 -0.81 0.00 0.00 -1.71 0.00 0.00 55.69 53.64 1f90 s MET 4 Cb -0.13 -2.31 -0.01 0.00 2.01 0.00 0.00 34.83 34.38 1f90 s MET 4 CO 0.19 0.01 -0.14 0.99 -0.01 0.00 0.00 175.02 176.07 1f90 s THR 5 N 0.75 2.96 0.08 2.05 2.01 0.35 -4.16 115.64 119.69 1f90 s THR 5 Ca -0.09 -0.69 0.08 0.00 0.31 0.00 0.00 61.69 61.30 1f90 s THR 5 Cb -0.16 -2.24 -0.04 0.00 0.01 0.00 0.00 72.50 70.08 1f90 s THR 5 CO 0.00 0.53 -0.20 -1.10 -0.69 0.00 0.00 174.62 173.16 1f90 s GLN 6 N 0.33 1.85 -0.11 4.92 -0.21 -1.26 0.55 119.66 125.73 1f90 s GLN 6 Ca -0.11 -1.12 -0.13 0.00 0.02 0.00 0.00 55.36 54.01 1f90 s GLN 6 Cb -0.16 -2.11 0.03 0.00 1.00 0.00 0.00 33.01 31.78 1f90 s GLN 6 CO 0.06 0.50 0.36 0.95 -2.12 0.00 0.00 175.29 175.04 1f90 s THR 7 N -1.03 0.01 1.04 -0.19 -4.23 -0.70 -4.54 115.64 106.00 1f90 s THR 7 Ca 0.16 -0.08 -0.17 0.00 -1.18 0.00 0.00 61.69 60.41 1f90 s THR 7 Cb -0.10 -0.53 0.23 0.00 1.34 0.00 0.00 72.50 73.43 1f90 s THR 7 CO 0.07 -0.05 1.25 -2.16 -0.54 0.00 0.00 174.62 173.20 1f90 s PRO 8 N -0.09 0.05 0.10 3.99 0.04 -1.26 -1.31 135.00 136.51 1f90 s PRO 8 Ca -0.02 -0.29 -0.09 0.00 0.04 0.00 0.00 61.00 60.63 1f90 s PRO 8 Cb -0.03 -1.77 -0.18 0.00 0.04 0.00 0.00 34.50 32.56 1f90 s PRO 8 CO 0.01 -2.83 1.22 -0.07 0.04 0.00 0.00 177.00 175.38 1f90 h LEU 9 N -1.94 0.71 -8.48 -3.56 -0.00 -1.87 -3.43 115.31 96.74 1f90 h LEU 9 Ca -0.45 -0.59 -0.34 0.00 -0.00 0.00 0.00 57.88 56.51 1f90 h LEU 9 Cb 1.25 -0.22 -0.18 0.00 -0.00 0.00 0.00 40.66 41.52 1f90 h LEU 9 CO 0.37 1.40 -0.74 0.42 -0.00 0.00 0.00 178.44 179.89 1f90 s THR 10 N -3.20 1.01 -0.08 0.22 -4.23 -1.26 -2.34 115.64 105.76 1f90 s THR 10 Ca -0.08 -1.65 -0.03 0.00 -1.18 0.00 0.00 61.69 58.75 1f90 s THR 10 Cb 0.08 -1.39 0.05 0.00 1.34 0.00 0.00 72.50 72.57 1f90 s THR 10 CO 0.90 -0.53 0.16 -0.22 -0.54 0.00 0.00 174.62 174.39 1f90 s LEU 11 N -2.45 0.18 -0.32 4.79 2.96 0.35 -4.91 118.68 119.28 1f90 s LEU 11 Ca 0.06 0.34 -0.04 0.00 -0.22 0.00 0.00 54.13 54.27 1f90 s LEU 11 Cb -0.03 0.33 0.05 0.00 0.50 0.00 0.00 46.19 47.04 1f90 s LEU 11 CO 0.01 -0.21 0.06 -0.55 -1.32 0.00 0.00 176.35 174.33 1f90 s SER 12 N 1.91 5.10 0.10 3.68 0.15 -1.26 -0.78 113.70 122.61 1f90 s SER 12 Ca -0.01 -1.27 0.09 0.00 0.70 0.00 0.00 55.95 55.46 1f90 s SER 12 Cb -0.12 -1.79 -0.04 0.00 -1.71 0.00 0.00 66.02 62.37 1f90 s SER 12 CO -0.06 -0.31 -0.21 -0.69 1.20 0.00 0.00 173.24 173.18 1f90 s VAL 13 N 1.31 2.66 0.20 4.45 1.01 -0.55 -4.84 120.40 124.64 1f90 s VAL 13 Ca -0.03 -1.50 -0.15 0.00 0.00 0.00 0.00 61.98 60.30 1f90 s VAL 13 Cb -0.20 -2.18 -0.08 0.00 0.00 0.00 0.00 36.38 33.92 1f90 s VAL 13 CO 0.00 0.15 0.62 -0.89 0.00 0.00 0.00 175.10 174.99 1f90 s THR 14 N -1.07 4.76 0.31 3.92 2.01 -1.26 0.16 115.64 124.47 1f90 s THR 14 Ca 0.16 0.94 -0.29 0.00 0.31 0.00 0.00 61.69 62.80 1f90 s THR 14 Cb -0.10 -3.74 -0.11 0.00 0.01 0.00 0.00 72.50 68.55 1f90 s THR 14 CO 0.08 0.15 1.56 -0.63 -0.69 0.00 0.00 174.62 175.09 1f90 s ILE 15 N -1.57 2.08 0.00 1.82 1.01 -1.26 -1.88 121.20 121.40 1f90 s ILE 15 Ca 0.42 0.07 0.00 0.00 0.00 0.00 0.00 60.65 61.14 1f90 s ILE 15 Cb -0.15 -3.04 0.00 0.00 0.01 0.00 0.00 42.46 39.28 1f90 s ILE 15 CO 0.20 0.01 0.00 0.61 0.00 0.00 0.00 174.94 175.76 1f90 n GLY 16 N 1.69 3.05 3.82 6.18 0.00 -0.48 -4.95 105.19 114.51 1f90 n GLY 16 Ca 0.06 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.77 1f90 n GLY 16 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1f90 s GLN 17 N -0.20 3.01 0.37 1.61 -1.52 -0.79 -4.33 119.66 117.82 1f90 s GLN 17 Ca 0.00 0.94 -0.07 0.00 -1.95 0.00 0.00 55.36 54.28 1f90 s GLN 17 Cb 0.00 -2.00 -0.05 0.00 -0.22 0.00 0.00 33.01 30.74 1f90 s GLN 17 CO 0.00 -1.04 0.68 -1.25 -0.25 0.00 0.00 175.29 173.43 1f90 s PRO 18 N -5.03 3.69 0.03 2.91 0.04 -1.22 -0.66 135.00 134.75 1f90 s PRO 18 Ca 0.58 0.24 -0.02 0.00 0.04 0.00 0.00 61.00 61.83 1f90 s PRO 18 Cb -0.14 -2.49 -0.02 0.00 0.04 0.00 0.00 34.50 31.89 1f90 s PRO 18 CO 0.54 0.04 0.02 0.00 0.04 0.00 0.00 177.00 177.64 1f90 s ALA 19 N -2.31 0.12 -0.06 8.56 0.00 -0.29 -4.93 121.76 122.85 1f90 s ALA 19 Ca 0.48 -0.68 -0.07 0.00 0.00 0.00 0.00 51.96 51.70 1f90 s ALA 19 Cb -0.10 0.20 0.02 0.00 0.00 0.00 0.00 23.12 23.23 1f90 s ALA 19 CO 0.33 -0.25 0.18 -1.54 0.00 0.00 0.00 175.76 174.47 1f90 s SER 20 N -1.95 -0.17 0.05 0.00 1.04 -1.26 0.40 113.70 111.80 1f90 s SER 20 Ca -0.08 0.32 0.09 0.00 0.48 0.00 0.00 55.95 56.76 1f90 s SER 20 Cb -0.04 0.36 -0.03 0.00 0.10 0.00 0.00 66.02 66.42 1f90 s SER 20 CO -0.04 -0.09 -0.24 -0.63 0.98 0.00 0.00 173.24 173.22 1f90 s ILE 21 N -0.04 1.97 0.04 -1.02 1.01 0.26 -4.79 121.20 118.64 1f90 s ILE 21 Ca -0.01 -1.35 0.06 0.00 0.00 0.00 0.00 60.65 59.35 1f90 s ILE 21 Cb -0.02 -1.70 -0.03 0.00 0.01 0.00 0.00 42.46 40.72 1f90 s ILE 21 CO 0.00 0.28 -0.15 -0.44 0.00 0.00 0.00 174.94 174.64 1f90 s SER 22 N -1.28 4.02 -0.04 3.58 0.01 -0.43 -0.19 113.70 119.38 1f90 s SER 22 Ca 0.10 -0.38 0.00 0.00 1.31 0.00 0.00 55.95 56.99 1f90 s SER 22 Cb -0.10 -0.72 0.03 0.00 0.21 0.00 0.00 66.02 65.44 1f90 s SER 22 CO 0.02 0.25 -0.02 0.00 0.41 0.00 0.00 173.24 173.90 1f90 s GLU 24 N 1.15 2.65 0.10 0.00 8.01 0.19 -0.58 118.70 130.22 1f90 s GLU 24 Ca -0.08 -0.86 0.05 0.00 0.01 0.00 0.00 54.97 54.09 1f90 s GLU 24 Cb -0.14 -2.24 -0.04 0.00 -4.31 0.00 0.00 34.13 27.41 1f90 s GLU 24 CO -0.02 0.38 -0.01 -1.54 0.01 0.00 0.00 175.26 174.09 1f90 s SER 25 N -0.15 4.93 0.52 -0.19 1.04 -0.64 0.13 113.70 119.34 1f90 s SER 25 Ca -0.03 -0.22 0.30 0.00 0.48 0.00 0.00 55.95 56.47 1f90 s SER 25 Cb -0.14 -1.14 1.33 0.00 0.10 0.00 0.00 66.02 66.18 1f90 s SER 25 CO 0.04 0.16 1.99 0.77 0.98 0.00 0.00 173.24 177.18 1f90 h SER 26 N 3.36 0.00 -5.05 7.02 4.64 -1.46 -3.44 113.55 118.62 1f90 h SER 26 Ca -0.48 0.00 -0.16 0.00 -0.47 0.00 0.00 61.79 60.68 1f90 h SER 26 Cb 1.17 0.00 -0.17 0.00 -0.31 0.00 0.00 62.40 63.08 1f90 h SER 26 CO 0.59 0.11 -0.69 -1.10 -0.87 0.00 0.00 176.83 174.87 1f90 s GLN 27 N -3.86 0.53 0.00 4.77 -0.21 -1.26 -5.02 119.66 114.61 1f90 s GLN 27 Ca -0.01 -0.99 0.00 0.00 0.02 0.00 0.00 55.36 54.38 1f90 s GLN 27 Cb 0.11 0.10 0.00 0.00 1.00 0.00 0.00 33.01 34.21 1f90 s GLN 27 CO 0.58 -0.07 0.00 0.45 -2.12 0.00 0.00 175.29 174.13 1f90 n SER 27 N 0.69 -0.47 -0.71 5.90 2.88 -1.26 -4.72 113.62 115.92 1f90 n SER 27 Ca -0.18 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.36 1f90 n SER 27 Cb 0.58 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.04 1f90 n SER 27 CO 0.00 0.00 0.00 -0.11 -1.23 0.00 0.00 175.04 173.70 1f90 n LEU 27 N 0.00 -3.66 -4.91 2.46 7.94 -1.26 -4.99 117.00 112.58 1f90 n LEU 27 Ca 0.00 1.22 -0.32 0.00 -1.11 0.00 0.00 56.01 55.80 1f90 n LEU 27 Cb 0.00 -0.60 -0.04 0.00 0.53 0.00 0.00 43.42 43.31 1f90 n LEU 27 CO 0.00 -0.26 -0.13 -0.47 -1.11 0.00 0.00 177.39 175.42 1f90 s TYR 27 N -1.33 3.52 0.54 1.96 5.04 0.15 -4.96 117.35 122.27 1f90 s TYR 27 Ca 0.00 0.31 0.39 0.00 -2.44 0.00 0.00 57.07 55.32 1f90 s TYR 27 Cb 0.00 -1.80 1.58 0.00 0.35 0.00 0.00 41.96 42.08 1f90 s TYR 27 CO 0.00 0.59 1.77 0.66 -1.34 0.00 0.00 175.55 177.23 1f90 h SER 27 N 3.23 0.01 -0.06 4.32 4.64 -2.00 0.90 113.55 124.58 1f90 h SER 27 Ca -0.46 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.86 1f90 h SER 27 Cb 1.17 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.26 1f90 h SER 27 CO 0.74 0.00 0.00 -0.46 -0.87 0.00 0.00 176.83 176.24 1f90 n ASN 28 N -4.15 0.82 0.00 4.97 6.94 -1.26 -4.89 115.26 117.70 1f90 n ASN 28 Ca 0.28 -2.04 0.00 0.00 -0.02 0.00 0.00 54.58 52.81 1f90 n ASN 28 Cb 1.36 -0.25 0.00 0.00 -2.36 0.00 0.00 39.78 38.53 1f90 n ASN 28 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1f90 n GLY 29 N 0.36 2.66 3.88 4.83 0.00 0.31 -5.01 105.19 112.22 1f90 n GLY 29 Ca 0.02 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.74 1f90 n GLY 29 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1f90 s LYS 30 N -0.00 3.22 -0.16 1.61 1.02 -1.25 -4.66 119.74 119.52 1f90 s LYS 30 Ca 0.00 0.51 -0.02 0.00 0.02 0.00 0.00 55.97 56.48 1f90 s LYS 30 Cb 0.00 -2.10 0.05 0.00 -0.52 0.00 0.00 37.83 35.26 1f90 s LYS 30 CO 0.00 -0.75 0.02 0.95 -0.92 0.00 0.00 175.35 174.65 1f90 s THR 31 N -3.20 0.51 -1.04 2.17 -4.23 -1.26 0.32 115.64 108.90 1f90 s THR 31 Ca 0.56 -0.36 -0.21 0.00 -1.18 0.00 0.00 61.69 60.50 1f90 s THR 31 Cb -0.11 -0.90 0.07 0.00 1.34 0.00 0.00 72.50 72.91 1f90 s THR 31 CO 0.51 -0.05 1.43 -0.31 -0.54 0.00 0.00 174.62 175.66 1f90 s TYR 32 N 1.88 2.69 -0.05 3.99 2.02 -1.26 -3.94 117.35 122.68 1f90 s TYR 32 Ca 0.01 -1.07 0.02 0.00 -0.37 0.00 0.00 57.07 55.67 1f90 s TYR 32 Cb -0.15 -4.62 0.01 0.00 -0.40 0.00 0.00 41.96 36.79 1f90 s TYR 32 CO -0.07 -1.83 -0.11 -1.17 -1.57 0.00 0.00 175.55 170.80 1f90 s LEU 33 N 4.39 1.68 0.16 -1.29 2.96 -1.26 -0.06 118.68 125.26 1f90 s LEU 33 Ca 0.45 -0.25 0.06 0.00 -0.22 0.00 0.00 54.13 54.17 1f90 s LEU 33 Cb -0.00 -0.71 -0.04 0.00 0.50 0.00 0.00 46.19 45.93 1f90 s LEU 33 CO -0.07 0.05 -0.13 0.20 -1.32 0.00 0.00 176.35 175.07 1f90 s ASN 34 N 0.48 2.13 -0.07 3.68 0.01 0.71 -1.56 114.94 120.31 1f90 s ASN 34 Ca -0.09 -0.96 0.05 0.00 -0.71 0.00 0.00 52.86 51.14 1f90 s ASN 34 Cb -0.13 -0.07 -0.01 0.00 0.41 0.00 0.00 41.25 41.45 1f90 s ASN 34 CO 0.02 -0.22 -0.21 0.26 -1.51 0.00 0.00 177.10 175.44 1f90 s TRP 35 N -2.85 2.55 0.09 2.20 0.52 0.19 -0.88 118.94 120.76 1f90 s TRP 35 Ca 0.16 -0.64 0.08 0.00 0.02 0.00 0.00 56.10 55.72 1f90 s TRP 35 Cb -0.01 -1.65 -0.03 0.00 -1.15 0.00 0.00 33.47 30.63 1f90 s TRP 35 CO 0.03 -0.17 -0.21 -0.51 0.02 0.00 0.00 176.95 176.11 1f90 s LEU 36 N -0.13 2.26 -0.07 2.99 1.43 -0.02 0.22 118.68 125.36 1f90 s LEU 36 Ca -0.04 -0.64 0.04 0.00 -1.03 0.00 0.00 54.13 52.46 1f90 s LEU 36 Cb -0.14 -0.93 -0.00 0.00 0.03 0.00 0.00 46.19 45.15 1f90 s LEU 36 CO 0.04 0.10 -0.21 -0.22 0.23 0.00 0.00 176.35 176.28 1f90 s LEU 37 N -1.71 1.99 -0.27 1.79 2.96 0.11 -0.43 118.68 123.12 1f90 s LEU 37 Ca 0.07 -0.48 0.03 0.00 -0.22 0.00 0.00 54.13 53.54 1f90 s LEU 37 Cb -0.10 -1.24 0.07 0.00 0.50 0.00 0.00 46.19 45.41 1f90 s LEU 37 CO 0.04 0.16 -0.09 -1.58 -1.32 0.00 0.00 176.35 173.56 1f90 s GLN 38 N 0.21 2.10 0.23 1.98 0.74 0.89 0.13 119.66 125.94 1f90 s GLN 38 Ca -0.12 -1.40 -0.18 0.00 0.05 0.00 0.00 55.36 53.71 1f90 s GLN 38 Cb -0.16 -2.91 -0.08 0.00 1.10 0.00 0.00 33.01 30.96 1f90 s GLN 38 CO 0.06 -0.62 0.70 1.03 -0.55 0.00 0.00 175.29 175.91 1f90 s ARG 39 N 1.09 4.18 -0.23 1.67 0.52 -1.26 -0.60 118.95 124.32 1f90 s ARG 39 Ca -0.06 0.79 -0.41 0.00 -0.52 0.00 0.00 55.73 55.53 1f90 s ARG 39 Cb -0.20 -2.82 -0.17 0.00 0.52 0.00 0.00 34.95 32.28 1f90 s ARG 39 CO -0.06 0.37 1.61 -2.30 0.02 0.00 0.00 175.30 174.94 1f90 n PRO 40 N 0.57 0.90 -0.79 3.54 -0.02 -1.26 -0.88 135.00 137.06 1f90 n PRO 40 Ca -0.02 0.33 0.00 0.00 -2.02 0.00 0.00 63.50 61.79 1f90 n PRO 40 Cb 0.51 -1.97 0.00 0.00 -0.02 0.00 0.00 33.50 32.03 1f90 n PRO 40 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1f90 n GLY 41 N 3.69 0.76 3.54 -1.23 0.00 -1.26 -5.03 105.19 105.66 1f90 n GLY 41 Ca 0.25 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 46.02 1f90 n GLY 41 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1f90 s GLN 42 N -0.21 1.84 0.25 1.61 -0.21 -0.06 -5.15 119.66 117.73 1f90 s GLN 42 Ca 0.00 -2.07 -0.01 0.00 0.02 0.00 0.00 55.36 53.30 1f90 s GLN 42 Cb 0.00 -1.09 -0.04 0.00 1.00 0.00 0.00 33.01 32.87 1f90 s GLN 42 CO 0.00 -0.23 0.46 -1.54 -2.12 0.00 0.00 175.29 171.86 1f90 s SER 43 N -3.61 6.38 0.44 5.90 1.04 -1.26 -4.59 113.70 118.00 1f90 s SER 43 Ca 0.30 0.47 -0.22 0.00 0.48 0.00 0.00 55.95 56.98 1f90 s SER 43 Cb 0.07 -2.04 -0.12 0.00 0.10 0.00 0.00 66.02 64.03 1f90 s SER 43 CO 0.14 -0.13 0.62 -2.65 0.98 0.00 0.00 173.24 172.21 1f90 n PRO 44 N -0.96 0.68 -4.49 4.02 -0.02 -1.26 -4.65 135.00 128.33 1f90 n PRO 44 Ca -0.04 0.25 -0.23 0.00 -2.02 0.00 0.00 63.50 61.46 1f90 n PRO 44 Cb 0.54 -1.61 -0.16 0.00 -0.02 0.00 0.00 33.50 32.25 1f90 n PRO 44 CO 0.00 0.00 0.00 0.21 1.98 0.00 0.00 175.50 177.69 1f90 s LYS 45 N -1.71 1.46 0.17 -0.52 2.20 0.12 -4.93 119.74 116.52 1f90 s LYS 45 Ca 0.64 -0.34 -0.30 0.00 -0.36 0.00 0.00 55.97 55.61 1f90 s LYS 45 Cb -0.58 -1.24 -0.07 0.00 -1.51 0.00 0.00 37.83 34.42 1f90 s LYS 45 CO 0.57 0.01 1.03 0.50 -0.36 0.00 0.00 175.35 177.10 1f90 s ARG 46 N 0.67 4.67 -0.11 4.03 3.52 -1.26 0.05 118.95 130.53 1f90 s ARG 46 Ca -0.13 1.59 0.01 0.00 -0.13 0.00 0.00 55.73 57.07 1f90 s ARG 46 Cb -0.15 -3.31 -0.07 0.00 -1.56 0.00 0.00 34.95 29.86 1f90 s ARG 46 CO 0.03 0.19 -0.09 1.28 -0.81 0.00 0.00 175.30 175.90 1f90 n LEU 47 N 2.35 2.98 -4.00 -0.88 4.77 0.13 -4.77 117.00 117.58 1f90 n LEU 47 Ca 0.02 -0.06 -0.16 0.00 -0.03 0.00 0.00 56.01 55.78 1f90 n LEU 47 Cb 0.47 -0.37 -0.14 0.00 -2.33 0.00 0.00 43.42 41.05 1f90 n LEU 47 CO 0.52 0.68 -0.41 -0.63 -1.33 0.00 0.00 177.39 176.22 1f90 s ILE 48 N -2.21 0.55 0.15 -0.08 1.01 -1.13 -0.08 121.20 119.40 1f90 s ILE 48 Ca -0.14 -0.47 0.03 0.00 0.00 0.00 0.00 60.65 60.06 1f90 s ILE 48 Cb 0.04 -0.50 -0.05 0.00 0.01 0.00 0.00 42.46 41.97 1f90 s ILE 48 CO 0.25 0.03 -0.04 -0.72 0.00 0.00 0.00 174.94 174.46 1f90 s TYR 49 N -0.43 1.18 -1.30 3.97 1.13 0.11 -0.64 117.35 121.38 1f90 s TYR 49 Ca 0.00 -0.92 -0.06 0.00 -1.41 0.00 0.00 57.07 54.68 1f90 s TYR 49 Cb -0.04 -0.66 -0.00 0.00 -1.10 0.00 0.00 41.96 40.16 1f90 s TYR 49 CO -0.00 -0.11 0.61 1.28 -2.51 0.00 0.00 175.55 174.82 1f90 n LEU 50 N -0.20 -2.70 0.00 -3.49 4.77 -1.06 -0.17 117.00 114.15 1f90 n LEU 50 Ca -0.09 -0.95 0.00 0.00 -0.03 0.00 0.00 56.01 54.94 1f90 n LEU 50 Cb 0.62 -2.41 0.00 0.00 -2.33 0.00 0.00 43.42 39.30 1f90 n LEU 50 CO 0.33 0.43 0.00 0.52 -1.33 0.00 0.00 177.39 177.34 1f90 n VAL 51 N -4.28 0.00 -0.72 4.08 0.31 -0.60 -3.74 118.33 113.37 1f90 n VAL 51 Ca -0.24 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.09 1f90 n VAL 51 Cb 0.66 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.59 1f90 n VAL 51 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 1f90 n SER 52 N 0.17 0.30 -4.66 4.52 3.41 -1.13 -3.77 113.62 112.46 1f90 n SER 52 Ca 0.00 -1.01 -0.42 0.00 -0.26 0.00 0.00 58.87 57.17 1f90 n SER 52 Cb 0.00 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 63.92 1f90 n SER 52 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 1f90 s LYS 53 N -0.01 4.28 0.14 4.33 1.02 0.77 -4.60 119.74 125.66 1f90 s LYS 53 Ca 0.00 1.16 -0.30 0.00 0.02 0.00 0.00 55.97 56.85 1f90 s LYS 53 Cb 0.00 -3.61 -0.07 0.00 -0.52 0.00 0.00 37.83 33.64 1f90 s LYS 53 CO 0.00 -0.46 1.11 -0.51 -0.92 0.00 0.00 175.35 174.57 1f90 s LEU 54 N 2.60 4.46 0.81 3.17 1.02 -1.26 0.07 118.68 129.55 1f90 s LEU 54 Ca 0.41 2.05 -0.11 0.00 0.02 0.00 0.00 54.13 56.50 1f90 s LEU 54 Cb -0.16 -3.60 0.08 0.00 0.02 0.00 0.00 46.19 42.53 1f90 s LEU 54 CO 0.10 -0.28 1.09 -1.81 0.02 0.00 0.00 176.35 175.48 1f90 s ASP 55 N 0.19 4.35 0.58 2.29 1.01 0.88 -4.92 116.67 121.06 1f90 s ASP 55 Ca 0.51 1.36 -0.19 0.00 0.71 0.00 0.00 52.55 54.95 1f90 s ASP 55 Cb -0.29 -2.09 -0.04 0.00 1.01 0.00 0.00 42.92 41.51 1f90 s ASP 55 CO 0.33 -2.07 1.21 -0.44 0.21 0.00 0.00 175.17 174.42 1f90 s SER 56 N -3.80 5.25 0.00 0.27 0.01 -1.26 -2.73 113.70 111.44 1f90 s SER 56 Ca 0.61 2.40 0.00 0.00 1.31 0.00 0.00 55.95 60.27 1f90 s SER 56 Cb -0.15 -2.60 0.00 0.00 0.21 0.00 0.00 66.02 63.48 1f90 s SER 56 CO 0.55 -1.55 0.00 0.61 0.41 0.00 0.00 173.24 173.26 1f90 n GLY 57 N 0.51 0.99 3.74 3.44 0.00 -1.26 -5.01 105.19 107.61 1f90 n GLY 57 Ca 0.13 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.79 1f90 n GLY 57 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1f90 s VAL 58 N -3.78 5.33 0.60 1.61 1.01 -1.11 -5.08 120.40 118.98 1f90 s VAL 58 Ca 0.00 0.47 -0.19 0.00 0.00 0.00 0.00 61.98 62.26 1f90 s VAL 58 Cb 0.00 -3.59 -0.03 0.00 0.00 0.00 0.00 36.38 32.76 1f90 s VAL 58 CO 0.00 0.42 1.21 -2.84 0.00 0.00 0.00 175.10 173.89 1f90 s PRO 59 N 0.27 2.93 0.48 2.72 0.02 -1.26 -4.92 135.00 135.24 1f90 s PRO 59 Ca 0.15 1.83 0.24 0.00 0.02 0.00 0.00 61.00 63.25 1f90 s PRO 59 Cb -0.13 -1.92 1.28 0.00 0.02 0.00 0.00 34.50 33.75 1f90 s PRO 59 CO 0.03 -1.24 1.88 -0.44 -0.33 0.00 0.00 177.00 176.89 1f90 h ASP 60 N 0.83 0.20 -1.08 2.53 3.32 -2.01 -2.31 116.42 117.90 1f90 h ASP 60 Ca -0.50 0.02 0.31 0.00 0.02 0.00 0.00 57.03 56.88 1f90 h ASP 60 Cb 1.30 -0.01 -0.05 0.00 0.22 0.00 0.00 39.33 40.78 1f90 h ASP 60 CO 0.55 0.08 0.76 0.03 -1.72 0.00 0.00 179.24 178.94 1f90 h ARG 61 N 0.20 0.08 -5.58 3.56 3.08 -1.94 -3.40 114.38 110.37 1f90 h ARG 61 Ca 0.44 -0.00 -0.59 0.00 0.07 0.00 0.00 59.98 59.90 1f90 h ARG 61 Cb 1.42 -0.02 -0.10 0.00 0.08 0.00 0.00 29.97 31.35 1f90 h ARG 61 CO -0.10 0.05 -0.08 -0.06 -1.07 0.00 0.00 179.97 178.71 1f90 s PHE 62 N -5.06 3.41 -0.01 3.04 0.40 -0.87 -1.50 117.98 117.40 1f90 s PHE 62 Ca -0.06 0.79 0.04 0.00 -0.60 0.00 0.00 56.93 57.10 1f90 s PHE 62 Cb 0.23 -2.62 -0.01 0.00 0.51 0.00 0.00 43.02 41.13 1f90 s PHE 62 CO 0.80 -0.01 -0.12 0.99 0.70 0.00 0.00 175.22 177.58 1f90 s THR 63 N 1.30 0.91 0.08 0.64 2.01 -0.23 -4.98 115.64 115.37 1f90 s THR 63 Ca 0.24 -0.52 0.09 0.00 0.31 0.00 0.00 61.69 61.81 1f90 s THR 63 Cb -0.15 -0.76 -0.03 0.00 0.01 0.00 0.00 72.50 71.56 1f90 s THR 63 CO 0.10 0.24 -0.24 -0.83 -0.69 0.00 0.00 174.62 173.20 1f90 s GLY 64 N -0.32 1.34 0.35 4.40 0.00 -1.26 -0.42 107.32 111.41 1f90 s GLY 64 Ca 0.04 -1.26 -0.17 0.00 0.00 0.00 0.00 44.72 43.33 1f90 s GLY 64 CO -0.00 -1.22 0.76 -1.35 0.00 0.00 0.00 173.10 171.29 1f90 s SER 65 N -1.61 -0.04 0.00 1.64 1.04 -0.45 -4.43 113.70 109.85 1f90 s SER 65 Ca 0.10 -1.01 0.00 0.00 0.48 0.00 0.00 55.95 55.52 1f90 s SER 65 Cb -0.10 0.81 0.00 0.00 0.10 0.00 0.00 66.02 66.83 1f90 s SER 65 CO 0.04 -1.58 0.00 0.61 0.98 0.00 0.00 173.24 173.28 1f90 n GLY 66 N -0.51 0.37 3.65 7.32 0.00 -1.26 -0.48 105.19 114.27 1f90 n GLY 66 Ca -0.07 -2.28 -0.02 0.00 0.00 0.00 0.00 46.02 43.66 1f90 n GLY 66 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1f90 s SER 67 N -3.45 -0.02 0.04 1.61 1.04 -0.46 -4.97 113.70 107.49 1f90 s SER 67 Ca 0.00 0.01 0.00 0.00 0.48 0.00 0.00 55.95 56.44 1f90 s SER 67 Cb 0.00 0.02 0.00 0.00 0.10 0.00 0.00 66.02 66.14 1f90 s SER 67 CO 0.00 -0.02 0.00 0.61 0.98 0.00 0.00 173.24 174.81 1f90 n GLY 68 N 0.23 1.17 0.00 7.32 0.00 -1.26 -2.71 105.19 109.94 1f90 n GLY 68 Ca 0.03 0.35 0.00 0.00 0.00 0.00 0.00 46.02 46.40 1f90 n GLY 68 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1f90 n THR 69 N 0.00 0.00 -4.52 2.61 -1.04 -1.26 -4.12 114.28 105.95 1f90 n THR 69 Ca 0.00 -0.01 -0.33 0.00 -2.04 0.00 0.00 64.05 61.66 1f90 n THR 69 Cb 0.00 0.32 -0.13 0.00 -1.82 0.00 0.00 70.33 68.70 1f90 n THR 69 CO 0.00 0.00 0.00 -1.81 -0.64 0.00 0.00 175.07 172.62 1f90 s ASP 70 N -2.18 4.39 0.11 8.00 1.01 -1.10 -1.62 116.67 125.27 1f90 s ASP 70 Ca -0.00 -0.25 0.06 0.00 0.71 0.00 0.00 52.55 53.07 1f90 s ASP 70 Cb 0.00 -1.70 -0.04 0.00 1.01 0.00 0.00 42.92 42.20 1f90 s ASP 70 CO 0.02 0.15 -0.14 -0.36 0.21 0.00 0.00 175.17 175.05 1f90 s PHE 71 N 0.48 1.36 -0.04 4.23 0.08 0.26 -1.35 117.98 123.00 1f90 s PHE 71 Ca -0.06 -0.53 0.00 0.00 0.12 0.00 0.00 56.93 56.46 1f90 s PHE 71 Cb -0.15 -0.73 0.03 0.00 -0.57 0.00 0.00 43.02 41.60 1f90 s PHE 71 CO 0.04 0.12 -0.00 0.99 -0.10 0.00 0.00 175.22 176.26 1f90 s THR 72 N -1.87 0.23 -0.14 0.64 2.01 0.37 -1.01 115.64 115.86 1f90 s THR 72 Ca 0.06 0.09 -0.06 0.00 0.31 0.00 0.00 61.69 62.09 1f90 s THR 72 Cb -0.06 -0.33 -0.04 0.00 0.01 0.00 0.00 72.50 72.07 1f90 s THR 72 CO 0.03 0.17 0.06 -0.22 -0.69 0.00 0.00 174.62 173.97 1f90 s LEU 73 N 1.20 3.88 0.00 4.42 2.96 0.74 -1.34 118.68 130.55 1f90 s LEU 73 Ca -0.07 0.19 0.02 0.00 -0.22 0.00 0.00 54.13 54.06 1f90 s LEU 73 Cb -0.13 -1.95 -0.01 0.00 0.50 0.00 0.00 46.19 44.60 1f90 s LEU 73 CO -0.02 0.29 -0.07 -0.60 -1.32 0.00 0.00 176.35 174.63 1f90 s ARG 74 N -0.35 0.56 -0.15 1.98 3.00 0.44 0.92 118.95 125.35 1f90 s ARG 74 Ca 0.09 -0.33 0.02 0.00 -1.00 0.00 0.00 55.73 54.51 1f90 s ARG 74 Cb -0.12 -0.52 0.01 0.00 0.00 0.00 0.00 34.95 34.32 1f90 s ARG 74 CO 0.02 0.14 -0.21 0.42 0.00 0.00 0.00 175.30 175.66 1f90 s ILE 75 N -0.34 2.12 0.02 4.11 1.01 0.16 -1.07 121.20 127.21 1f90 s ILE 75 Ca 0.01 -0.95 -0.24 0.00 0.00 0.00 0.00 60.65 59.47 1f90 s ILE 75 Cb -0.04 -1.86 -0.17 0.00 0.01 0.00 0.00 42.46 40.41 1f90 s ILE 75 CO -0.00 0.54 1.38 0.77 0.00 0.00 0.00 174.94 177.63 1f90 h SER 76 N 7.43 0.13 -3.21 3.58 4.64 -1.52 -0.74 113.55 123.85 1f90 h SER 76 Ca -0.35 -0.40 -0.48 0.00 -0.47 0.00 0.00 61.79 60.09 1f90 h SER 76 Cb 1.18 -0.04 -0.40 0.00 -0.31 0.00 0.00 62.40 62.84 1f90 h SER 76 CO 0.57 0.50 -0.76 -0.60 -0.87 0.00 0.00 176.83 175.67 1f90 s ARG 77 N -4.62 0.44 0.38 4.77 3.52 -1.26 -3.44 118.95 118.74 1f90 s ARG 77 Ca -0.15 -0.20 -0.27 0.00 -0.13 0.00 0.00 55.73 54.99 1f90 s ARG 77 Cb 0.04 -1.76 -0.09 0.00 -1.56 0.00 0.00 34.95 31.57 1f90 s ARG 77 CO 0.70 -0.58 1.27 0.08 -0.81 0.00 0.00 175.30 175.96 1f90 s VAL 78 N 1.97 2.79 0.26 7.11 1.01 0.16 -4.80 120.40 128.90 1f90 s VAL 78 Ca 0.01 0.73 0.10 0.00 0.00 0.00 0.00 61.98 62.82 1f90 s VAL 78 Cb -0.16 -3.44 -0.05 0.00 0.00 0.00 0.00 36.38 32.73 1f90 s VAL 78 CO -0.08 0.12 -0.16 -1.61 0.00 0.00 0.00 175.10 173.37 1f90 s GLU 79 N -2.08 1.55 0.23 2.72 0.41 -1.26 -1.38 118.70 118.89 1f90 s GLU 79 Ca 0.54 -1.71 -0.07 0.00 -0.41 0.00 0.00 54.97 53.32 1f90 s GLU 79 Cb -0.37 -1.49 0.29 0.00 -1.78 0.00 0.00 34.13 30.79 1f90 s GLU 79 CO 0.48 0.25 1.84 0.00 -0.49 0.00 0.00 175.26 177.34 1f90 h ALA 80 N 2.36 1.08 0.00 5.21 0.00 -1.96 -0.71 119.26 125.25 1f90 h ALA 80 Ca -0.39 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.51 1f90 h ALA 80 Cb 1.24 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.82 1f90 h ALA 80 CO 0.62 0.24 0.00 -0.85 0.00 0.00 0.00 179.25 179.25 1f90 n GLU 81 N -4.65 0.20 -0.06 0.00 0.28 -1.26 -2.57 120.64 112.57 1f90 n GLU 81 Ca 0.11 0.14 0.11 0.00 -0.16 0.00 0.00 57.16 57.36 1f90 n GLU 81 Cb 0.16 -1.50 0.41 0.00 1.43 0.00 0.00 31.44 31.93 1f90 n GLU 81 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 177.13 176.72 1f90 n ASP 82 N -1.22 1.66 -4.79 -1.84 8.00 -0.27 -4.91 116.55 113.19 1f90 n ASP 82 Ca 0.06 -1.66 -0.33 0.00 0.71 0.00 0.00 54.79 53.56 1f90 n ASP 82 Cb 0.07 -0.08 0.01 0.00 -0.02 0.00 0.00 41.12 41.10 1f90 n ASP 82 CO 0.00 0.00 0.00 -1.48 -0.39 0.00 0.00 177.20 175.33 1f90 s LEU 83 N -1.67 3.55 0.00 0.64 2.34 -1.06 -4.88 118.68 117.59 1f90 s LEU 83 Ca 0.34 1.92 0.00 0.00 0.06 0.00 0.00 54.13 56.45 1f90 s LEU 83 Cb 0.18 -4.55 0.00 0.00 -0.56 0.00 0.00 46.19 41.27 1f90 s LEU 83 CO 0.28 -1.24 0.00 0.61 -1.06 0.00 0.00 176.35 174.94 1f90 n GLY 84 N -0.63 0.94 3.53 -3.48 0.00 -1.16 -4.69 105.19 99.71 1f90 n GLY 84 Ca 0.10 -1.94 -0.34 0.00 0.00 0.00 0.00 46.02 43.84 1f90 n GLY 84 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1f90 s VAL 85 N -1.96 3.81 -0.21 1.61 1.01 0.23 -1.35 120.40 123.54 1f90 s VAL 85 Ca 0.00 -0.41 -0.10 0.00 0.00 0.00 0.00 61.98 61.48 1f90 s VAL 85 Cb 0.00 -2.63 -0.05 0.00 0.00 0.00 0.00 36.38 33.71 1f90 s VAL 85 CO 0.00 0.54 0.13 -0.31 0.00 0.00 0.00 175.10 175.46 1f90 s TYR 86 N -0.12 3.35 0.12 5.22 1.51 0.31 -0.07 117.35 127.66 1f90 s TYR 86 Ca 0.02 0.24 0.08 0.00 -1.01 0.00 0.00 57.07 56.40 1f90 s TYR 86 Cb -0.13 -2.19 -0.04 0.00 -0.11 0.00 0.00 41.96 39.49 1f90 s TYR 86 CO 0.03 0.18 -0.10 0.71 -1.11 0.00 0.00 175.55 175.25 1f90 s TYR 87 N 0.63 2.71 -0.10 2.71 1.51 0.43 -0.78 117.35 124.45 1f90 s TYR 87 Ca 0.07 -0.17 0.02 0.00 -1.01 0.00 0.00 57.07 55.98 1f90 s TYR 87 Cb -0.12 -1.40 -0.01 0.00 -0.11 0.00 0.00 41.96 40.32 1f90 s TYR 87 CO 0.01 0.44 -0.16 0.00 -1.11 0.00 0.00 175.55 174.73 1f90 s VAL 89 N 0.10 -0.02 0.05 0.00 0.11 -0.06 0.73 120.40 121.32 1f90 s VAL 89 Ca -0.07 0.07 0.02 0.00 -2.93 0.00 0.00 61.98 59.07 1f90 s VAL 89 Cb -0.15 -0.07 -0.04 0.00 -1.53 0.00 0.00 36.38 34.59 1f90 s VAL 89 CO 0.05 0.03 0.05 0.00 -3.33 0.00 0.00 175.10 171.90 1f90 s GLN 90 N 0.37 2.85 -0.03 1.54 1.03 -0.23 -0.21 119.66 124.98 1f90 s GLN 90 Ca -0.03 -0.66 0.21 0.00 0.04 0.00 0.00 55.36 54.92 1f90 s GLN 90 Cb -0.04 -2.71 0.37 0.00 0.03 0.00 0.00 33.01 30.66 1f90 s GLN 90 CO -0.01 0.59 1.16 0.41 -2.54 0.00 0.00 175.29 174.89 1f90 n GLY 91 N 0.78 1.53 0.05 2.60 0.00 0.92 -2.80 105.19 108.27 1f90 n GLY 91 Ca -0.11 -0.81 -0.00 0.00 0.00 0.00 0.00 46.02 45.10 1f90 n GLY 91 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1f90 n THR 92 N 0.20 0.65 -4.51 2.61 -2.24 -1.26 -4.83 114.28 104.91 1f90 n THR 92 Ca 0.07 -0.61 -0.32 0.00 -2.27 0.00 0.00 64.05 60.93 1f90 n THR 92 Cb 1.03 -0.25 -0.11 0.00 -2.10 0.00 0.00 70.33 68.90 1f90 n THR 92 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 1f90 s HIS 93 N -2.85 2.81 -0.18 4.78 3.76 -1.26 -5.05 115.29 117.29 1f90 s HIS 93 Ca -0.08 -0.09 -0.09 0.00 -0.15 0.00 0.00 55.06 54.65 1f90 s HIS 93 Cb 0.08 -1.57 -0.05 0.00 1.11 0.00 0.00 32.58 32.16 1f90 s HIS 93 CO 0.76 0.34 0.11 0.12 -0.85 0.00 0.00 174.74 175.22 1f90 s PHE 94 N -0.98 3.38 0.73 1.40 2.19 -1.26 -3.24 117.98 120.20 1f90 s PHE 94 Ca 0.17 0.27 -0.12 0.00 0.33 0.00 0.00 56.93 57.58 1f90 s PHE 94 Cb -0.11 -2.11 0.03 0.00 -1.31 0.00 0.00 43.02 39.52 1f90 s PHE 94 CO 0.07 0.30 1.11 -1.25 1.83 0.00 0.00 175.22 177.28 1f90 s PRO 95 N 0.20 2.65 0.37 10.12 0.04 -1.26 -4.90 135.00 142.22 1f90 s PRO 95 Ca 0.07 0.42 -0.27 0.00 0.04 0.00 0.00 61.00 61.27 1f90 s PRO 95 Cb -0.11 -2.00 -0.09 0.00 0.04 0.00 0.00 34.50 32.33 1f90 s PRO 95 CO -0.01 -1.18 1.18 -0.98 0.04 0.00 0.00 177.00 176.06 1f90 s ARG 96 N -5.38 4.20 0.13 4.56 1.70 -1.20 -4.83 118.95 118.14 1f90 s ARG 96 Ca 0.59 1.90 0.07 0.00 -0.47 0.00 0.00 55.73 57.82 1f90 s ARG 96 Cb -0.11 -2.83 -0.04 0.00 -0.57 0.00 0.00 34.95 31.40 1f90 s ARG 96 CO 0.52 -0.21 -0.16 0.95 -1.08 0.00 0.00 175.30 175.31 1f90 s THR 97 N -1.32 1.50 0.29 4.99 -4.23 -1.12 -4.98 115.64 110.76 1f90 s THR 97 Ca 0.54 -1.72 0.08 0.00 -1.18 0.00 0.00 61.69 59.40 1f90 s THR 97 Cb -0.33 -1.59 -0.04 0.00 1.34 0.00 0.00 72.50 71.89 1f90 s THR 97 CO 0.42 -0.33 0.15 -0.36 -0.54 0.00 0.00 174.62 173.96 1f90 s PHE 98 N -1.92 2.89 0.56 3.99 0.40 -1.26 -1.07 117.98 121.56 1f90 s PHE 98 Ca 0.10 -0.22 -0.04 0.00 -0.60 0.00 0.00 56.93 56.16 1f90 s PHE 98 Cb -0.06 -1.46 0.01 0.00 0.51 0.00 0.00 43.02 42.02 1f90 s PHE 98 CO 0.04 0.46 0.84 0.20 0.70 0.00 0.00 175.22 177.46 1f90 s GLY 99 N -3.82 1.62 0.00 4.36 0.00 0.22 -4.40 107.32 105.30 1f90 s GLY 99 Ca 0.35 -0.86 0.19 0.00 0.00 0.00 0.00 44.72 44.39 1f90 s GLY 99 CO 0.23 -0.60 1.56 0.61 0.00 0.00 0.00 173.10 174.90 1f90 n GLY 100 N -2.47 -0.79 0.00 0.20 0.00 -1.26 -4.68 105.19 96.19 1f90 n GLY 100 Ca 0.04 -0.10 0.00 0.00 0.00 0.00 0.00 46.02 45.96 1f90 n GLY 100 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1f90 n GLY 101 N 0.26 -1.05 2.66 -0.02 0.00 -1.26 -5.01 105.19 100.78 1f90 n GLY 101 Ca 0.11 -1.59 -0.22 0.00 0.00 0.00 0.00 46.02 44.32 1f90 n GLY 101 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1f90 s THR 102 N -3.02 -0.06 -0.05 2.61 2.01 0.04 -4.79 115.64 112.38 1f90 s THR 102 Ca 0.00 0.26 -0.25 0.00 0.31 0.00 0.00 61.69 62.01 1f90 s THR 102 Cb 0.00 -0.29 -0.04 0.00 0.01 0.00 0.00 72.50 72.19 1f90 s THR 102 CO 0.00 0.08 0.76 -0.75 -0.69 0.00 0.00 174.62 174.01 1f90 s LYS 103 N 2.14 4.46 -0.23 4.92 2.20 -0.99 -0.53 119.74 131.71 1f90 s LYS 103 Ca 0.04 1.00 -0.04 0.00 -0.36 0.00 0.00 55.97 56.61 1f90 s LYS 103 Cb -0.13 -3.45 0.00 0.00 -1.51 0.00 0.00 37.83 32.74 1f90 s LYS 103 CO -0.05 0.05 -0.03 -1.17 -0.36 0.00 0.00 175.35 173.79 1f90 s LEU 104 N 0.81 3.06 -0.10 5.43 2.96 -0.46 -0.50 118.68 129.90 1f90 s LEU 104 Ca 0.40 -0.54 0.01 0.00 -0.22 0.00 0.00 54.13 53.79 1f90 s LEU 104 Cb -0.18 -1.74 -0.02 0.00 0.50 0.00 0.00 46.19 44.75 1f90 s LEU 104 CO 0.20 -0.06 -0.11 -1.61 -1.32 0.00 0.00 176.35 173.45 1f90 s GLU 105 N 1.45 3.02 -0.06 1.98 8.01 0.04 -2.99 118.70 130.14 1f90 s GLU 105 Ca 0.04 -0.64 -0.30 0.00 0.01 0.00 0.00 54.97 54.08 1f90 s GLU 105 Cb -0.15 -2.58 -0.03 0.00 -4.31 0.00 0.00 34.13 27.06 1f90 s GLU 105 CO -0.03 0.43 1.18 0.42 0.01 0.00 0.00 175.26 177.27 1f90 s ILE 106 N -0.21 4.31 0.11 -1.63 -1.09 -1.26 -1.48 121.20 119.95 1f90 s ILE 106 Ca 0.01 1.63 -0.22 0.00 -2.23 0.00 0.00 60.65 59.85 1f90 s ILE 106 Cb -0.13 -4.05 -0.07 0.00 -1.58 0.00 0.00 42.46 36.63 1f90 s ILE 106 CO 0.03 -0.00 0.66 -0.75 -1.23 0.00 0.00 174.94 173.64 1f90 s LYS 107 N 2.22 4.36 0.32 2.79 2.20 0.41 -4.88 119.74 127.15 1f90 s LYS 107 Ca 0.55 0.91 -0.05 0.00 -0.36 0.00 0.00 55.97 57.02 1f90 s LYS 107 Cb -0.24 -3.25 0.00 0.00 -1.51 0.00 0.00 37.83 32.83 1f90 s LYS 107 CO 0.21 0.60 0.46 -0.98 -0.36 0.00 0.00 175.35 175.29 1f90 s ARG 108 N -1.09 1.80 0.60 4.03 1.04 -1.26 -4.22 118.95 119.85 1f90 s ARG 108 Ca 0.32 -1.64 -0.19 0.00 -1.04 0.00 0.00 55.73 53.18 1f90 s ARG 108 Cb -0.21 0.44 -0.04 0.00 -2.04 0.00 0.00 34.95 33.10 1f90 s ARG 108 CO 0.22 -0.74 1.09 0.00 -0.04 0.00 0.00 175.30 175.83 1f90 n ALA 109 N -0.51 0.56 -1.75 7.88 0.00 -1.26 -4.92 120.51 120.51 1f90 n ALA 109 Ca 0.00 0.02 -0.37 0.00 0.00 0.00 0.00 53.44 53.09 1f90 n ALA 109 Cb 0.62 -2.19 0.04 0.00 0.00 0.00 0.00 19.45 17.92 1f90 n ALA 109 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1f90 s ASP 110 N -1.24 5.28 0.00 0.00 1.11 -1.26 -4.81 116.67 115.75 1f90 s ASP 110 Ca 0.77 2.58 0.00 0.00 0.18 0.00 0.00 52.55 56.09 1f90 s ASP 110 Cb -0.41 -2.62 -0.00 0.00 1.07 0.00 0.00 42.92 40.96 1f90 s ASP 110 CO 0.46 -1.55 -0.02 0.00 1.18 0.00 0.00 175.17 175.24 1f90 s ALA 111 N -1.42 0.12 0.14 5.23 0.00 0.36 -4.90 121.76 121.29 1f90 s ALA 111 Ca 0.74 -0.17 -0.18 0.00 0.00 0.00 0.00 51.96 52.34 1f90 s ALA 111 Cb -0.36 0.01 -0.07 0.00 0.00 0.00 0.00 23.12 22.69 1f90 s ALA 111 CO 0.41 -0.01 0.62 0.00 0.00 0.00 0.00 175.76 176.79 1f90 s ALA 112 N -0.31 3.53 0.57 0.00 0.00 -1.26 -2.05 121.76 122.24 1f90 s ALA 112 Ca -0.03 0.05 -0.15 0.00 0.00 0.00 0.00 51.96 51.83 1f90 s ALA 112 Cb -0.02 -2.68 -0.05 0.00 0.00 0.00 0.00 23.12 20.37 1f90 s ALA 112 CO -0.00 0.39 1.02 -1.25 0.00 0.00 0.00 175.76 175.92 1f90 s PRO 113 N -1.59 3.60 -0.39 0.00 0.04 -1.26 -4.55 135.00 130.85 1f90 s PRO 113 Ca 0.36 1.01 -0.12 0.00 0.04 0.00 0.00 61.00 62.29 1f90 s PRO 113 Cb -0.18 -2.08 0.03 0.00 0.04 0.00 0.00 34.50 32.31 1f90 s PRO 113 CO 0.20 -0.57 0.24 0.99 0.04 0.00 0.00 177.00 177.90 1f90 s THR 114 N -2.68 4.80 0.00 1.26 2.01 -0.54 -4.89 115.64 115.60 1f90 s THR 114 Ca 0.60 -0.81 -0.20 0.00 0.31 0.00 0.00 61.69 61.59 1f90 s THR 114 Cb -0.12 -3.68 -0.06 0.00 0.01 0.00 0.00 72.50 68.65 1f90 s THR 114 CO 0.38 -0.27 0.57 -0.69 -0.69 0.00 0.00 174.62 173.92 1f90 s VAL 115 N 1.59 4.91 -0.03 3.82 1.01 -1.26 -1.57 120.40 128.86 1f90 s VAL 115 Ca 0.03 1.19 -0.01 0.00 0.00 0.00 0.00 61.98 63.19 1f90 s VAL 115 Cb -0.19 -3.90 0.03 0.00 0.00 0.00 0.00 36.38 32.32 1f90 s VAL 115 CO 0.08 0.45 0.03 -0.44 0.00 0.00 0.00 175.10 175.22 1f90 s SER 116 N -0.38 0.63 0.02 3.32 0.01 0.48 -4.96 113.70 112.82 1f90 s SER 116 Ca 0.30 0.03 0.04 0.00 1.31 0.00 0.00 55.95 57.63 1f90 s SER 116 Cb -0.18 -0.15 -0.03 0.00 0.21 0.00 0.00 66.02 65.87 1f90 s SER 116 CO 0.17 -0.17 -0.06 -0.51 0.41 0.00 0.00 173.24 173.07 1f90 s ILE 117 N 1.53 3.66 -0.08 1.44 2.07 -1.26 0.86 121.20 129.43 1f90 s ILE 117 Ca -0.03 -0.83 -0.01 0.00 -1.41 0.00 0.00 60.65 58.36 1f90 s ILE 117 Cb -0.13 -2.62 0.03 0.00 0.13 0.00 0.00 42.46 39.88 1f90 s ILE 117 CO -0.03 0.34 0.01 -0.36 -1.91 0.00 0.00 174.94 172.99 1f90 s PHE 118 N -1.04 0.66 0.91 3.50 0.40 0.19 -4.98 117.98 117.62 1f90 s PHE 118 Ca 0.18 -0.19 -0.12 0.00 -0.60 0.00 0.00 56.93 56.20 1f90 s PHE 118 Cb -0.11 -0.80 0.14 0.00 0.51 0.00 0.00 43.02 42.75 1f90 s PHE 118 CO 0.09 -0.34 1.10 -2.14 0.70 0.00 0.00 175.22 174.63 1f90 s PRO 119 N 1.97 1.17 0.99 0.24 0.02 -1.26 -1.31 135.00 136.82 1f90 s PRO 119 Ca 0.05 0.60 -0.11 0.00 0.02 0.00 0.00 61.00 61.56 1f90 s PRO 119 Cb -0.13 -1.82 0.17 0.00 0.02 0.00 0.00 34.50 32.75 1f90 s PRO 119 CO -0.05 -2.25 1.00 -2.30 -0.33 0.00 0.00 177.00 173.08 1f90 n PRO 120 N -3.85 -0.92 -3.93 5.54 -0.02 -1.21 -4.82 135.00 125.78 1f90 n PRO 120 Ca 0.06 -0.21 -0.34 0.00 -2.02 0.00 0.00 63.50 60.99 1f90 n PRO 120 Cb 0.57 -2.26 -0.05 0.00 -0.02 0.00 0.00 33.50 31.74 1f90 n PRO 120 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 1f90 s SER 121 N -2.50 6.28 0.29 2.55 1.04 -1.26 -4.98 113.70 115.13 1f90 s SER 121 Ca 0.66 0.34 0.04 0.00 0.48 0.00 0.00 55.95 57.48 1f90 s SER 121 Cb -0.23 -1.96 0.72 0.00 0.10 0.00 0.00 66.02 64.64 1f90 s SER 121 CO 0.61 0.29 1.74 0.77 0.98 0.00 0.00 173.24 177.63 1f90 h SER 122 N 4.09 0.58 -0.72 7.02 4.64 -1.95 0.90 113.55 128.11 1f90 h SER 122 Ca -0.50 0.12 0.14 0.00 -0.47 0.00 0.00 61.79 61.08 1f90 h SER 122 Cb 1.19 0.03 -0.10 0.00 -0.31 0.00 0.00 62.40 63.22 1f90 h SER 122 CO 0.66 0.15 0.22 -0.33 -0.87 0.00 0.00 176.83 176.67 1f90 h GLU 123 N 0.60 0.33 -0.00 4.77 5.08 -1.99 -1.25 114.58 122.11 1f90 h GLU 123 Ca 0.56 -0.02 -0.25 0.00 -1.00 0.00 0.00 59.36 58.65 1f90 h GLU 123 Cb 0.95 -0.08 0.02 0.00 0.50 0.00 0.00 28.75 30.15 1f90 h GLU 123 CO -0.44 0.22 -0.98 0.37 -1.00 0.00 0.00 179.01 177.19 1f90 h GLN 124 N 0.34 0.67 -0.62 2.33 4.15 -1.21 -3.30 115.11 117.47 1f90 h GLN 124 Ca 0.40 -0.72 0.13 0.00 0.77 0.00 0.00 58.65 59.23 1f90 h GLN 124 Cb 0.63 0.20 -0.10 0.00 0.21 0.00 0.00 27.48 28.43 1f90 h GLN 124 CO -0.44 1.30 0.08 -0.07 -1.93 0.00 0.00 178.83 177.77 1f90 h LEU 125 N 0.33 -0.11 -1.39 -2.39 3.38 -0.02 0.19 115.31 115.31 1f90 h LEU 125 Ca -0.12 0.13 0.04 0.00 0.09 0.00 0.00 57.88 58.02 1f90 h LEU 125 Cb 1.64 0.21 -0.04 0.00 0.09 0.00 0.00 40.66 42.56 1f90 h LEU 125 CO 0.19 -0.05 0.45 0.71 0.09 0.00 0.00 178.44 179.83 1f90 h THR 126 N 0.20 1.08 0.00 0.22 1.35 -1.38 0.38 112.91 114.76 1f90 h THR 126 Ca 0.33 -0.27 0.00 0.00 -0.55 0.00 0.00 66.41 65.92 1f90 h THR 126 Cb 0.52 0.22 0.00 0.00 -1.73 0.00 0.00 68.15 67.17 1f90 h THR 126 CO -0.47 0.14 0.00 -1.54 -0.25 0.00 0.00 175.52 173.41 1f90 n SER 127 N -4.46 0.00 0.00 5.36 3.41 0.66 -4.77 113.62 113.81 1f90 n SER 127 Ca 0.09 -0.06 0.00 0.00 -0.26 0.00 0.00 58.87 58.63 1f90 n SER 127 Cb 0.15 -0.09 0.00 0.00 -0.26 0.00 0.00 64.21 64.01 1f90 n SER 127 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1f90 n GLY 128 N -0.69 0.62 3.36 5.00 0.00 0.13 -5.04 105.19 108.58 1f90 n GLY 128 Ca 0.04 -0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.87 1f90 n GLY 128 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1f90 s GLY 129 N -2.00 1.87 -0.20 -0.02 0.00 -1.21 -2.24 107.32 103.50 1f90 s GLY 129 Ca 0.00 -1.92 -0.12 0.00 0.00 0.00 0.00 44.72 42.68 1f90 s GLY 129 CO 0.00 -1.67 0.50 0.00 0.00 0.00 0.00 173.10 171.93 1f90 s ALA 130 N -3.60 -1.31 -0.06 3.20 0.00 -0.38 -3.07 121.76 116.54 1f90 s ALA 130 Ca 0.37 1.80 0.04 0.00 0.00 0.00 0.00 51.96 54.17 1f90 s ALA 130 Cb 0.08 -1.08 0.00 0.00 0.00 0.00 0.00 23.12 22.13 1f90 s ALA 130 CO 0.14 -0.30 -0.18 -1.12 0.00 0.00 0.00 175.76 174.31 1f90 s SER 131 N 1.41 2.32 -0.23 0.00 0.01 -1.26 -0.80 113.70 115.14 1f90 s SER 131 Ca -0.09 -0.39 -0.10 0.00 1.31 0.00 0.00 55.95 56.67 1f90 s SER 131 Cb -0.07 -0.85 -0.05 0.00 0.21 0.00 0.00 66.02 65.26 1f90 s SER 131 CO -0.14 0.13 0.15 -0.69 0.41 0.00 0.00 173.24 173.10 1f90 s VAL 132 N 0.26 5.32 -0.13 3.43 1.01 0.27 -3.33 120.40 127.22 1f90 s VAL 132 Ca -0.10 0.16 0.00 0.00 0.00 0.00 0.00 61.98 62.04 1f90 s VAL 132 Cb -0.14 -3.47 -0.02 0.00 0.00 0.00 0.00 36.38 32.75 1f90 s VAL 132 CO 0.04 0.36 -0.13 -0.69 0.00 0.00 0.00 175.10 174.68 1f90 s VAL 133 N 0.95 3.07 -0.15 2.92 1.01 -0.43 -0.52 120.40 127.26 1f90 s VAL 133 Ca 0.07 -0.66 0.02 0.00 0.00 0.00 0.00 61.98 61.41 1f90 s VAL 133 Cb -0.13 -2.28 0.02 0.00 0.00 0.00 0.00 36.38 33.98 1f90 s VAL 133 CO 0.03 0.53 -0.19 0.00 0.00 0.00 0.00 175.10 175.47 1f90 s PHE 135 N 1.11 3.33 -0.38 0.00 0.08 0.25 -1.07 117.98 121.30 1f90 s PHE 135 Ca -0.01 0.21 0.04 0.00 0.12 0.00 0.00 56.93 57.28 1f90 s PHE 135 Cb -0.14 -2.09 0.11 0.00 -0.57 0.00 0.00 43.02 40.33 1f90 s PHE 135 CO -0.07 0.26 0.11 -0.51 -0.10 0.00 0.00 175.22 174.90 1f90 s LEU 136 N 0.22 4.43 0.05 -0.37 1.02 -0.01 -0.39 118.68 123.64 1f90 s LEU 136 Ca 0.06 -2.33 0.01 0.00 0.02 0.00 0.00 54.13 51.89 1f90 s LEU 136 Cb -0.12 -1.56 -0.04 0.00 0.02 0.00 0.00 46.19 44.49 1f90 s LEU 136 CO -0.00 -0.35 0.15 0.20 0.02 0.00 0.00 176.35 176.37 1f90 s ASN 137 N 0.66 6.00 -1.12 2.29 0.01 -0.61 -0.74 114.94 121.43 1f90 s ASN 137 Ca 0.12 0.17 -0.23 0.00 -0.71 0.00 0.00 52.86 52.22 1f90 s ASN 137 Cb -0.21 -1.76 0.01 0.00 0.41 0.00 0.00 41.25 39.70 1f90 s ASN 137 CO -0.07 0.19 0.75 0.59 -1.51 0.00 0.00 177.10 177.05 1f90 n ASN 138 N 0.52 -5.07 -4.53 -1.22 4.13 -0.55 -1.47 115.26 107.05 1f90 n ASN 138 Ca -0.08 -1.06 -0.24 0.00 1.68 0.00 0.00 54.58 54.88 1f90 n ASN 138 Cb 0.52 -2.83 -0.10 0.00 -1.54 0.00 0.00 39.78 35.83 1f90 n ASN 138 CO 0.00 0.00 0.00 0.72 0.28 0.00 0.00 177.26 178.26 1f90 s PHE 139 N -3.42 2.41 -0.26 3.10 -0.12 -0.39 -4.57 117.98 114.72 1f90 s PHE 139 Ca 0.43 -0.37 -0.21 0.00 -0.05 0.00 0.00 56.93 56.73 1f90 s PHE 139 Cb -0.18 -1.18 0.07 0.00 -0.63 0.00 0.00 43.02 41.10 1f90 s PHE 139 CO 0.89 0.64 0.68 -0.47 -0.05 0.00 0.00 175.22 176.92 1f90 s TYR 140 N -2.51 -0.86 1.25 3.49 6.14 -0.87 -0.95 117.35 123.05 1f90 s TYR 140 Ca 0.31 1.93 -0.21 0.00 0.64 0.00 0.00 57.07 59.75 1f90 s TYR 140 Cb -0.03 0.38 0.31 0.00 0.42 0.00 0.00 41.96 43.04 1f90 s TYR 140 CO 0.17 -0.42 1.10 -1.25 0.64 0.00 0.00 175.55 175.79 1f90 s PRO 141 N 0.82 -1.61 0.46 4.97 0.04 -1.26 0.13 135.00 138.55 1f90 s PRO 141 Ca -0.04 -0.14 0.22 0.00 0.04 0.00 0.00 61.00 61.09 1f90 s PRO 141 Cb -0.05 -1.56 1.13 0.00 0.04 0.00 0.00 34.50 34.06 1f90 s PRO 141 CO -0.06 -3.95 1.95 -0.22 0.04 0.00 0.00 177.00 174.75 1f90 h LYS 142 N -2.75 0.00 -6.41 4.56 3.64 -1.99 -3.44 116.57 110.18 1f90 h LYS 142 Ca -0.43 0.00 -0.53 0.00 -1.27 0.00 0.00 60.65 58.42 1f90 h LYS 142 Cb 1.29 0.00 0.03 0.00 -0.41 0.00 0.00 32.23 33.14 1f90 h LYS 142 CO 0.30 0.21 1.20 -0.25 -2.27 0.00 0.00 179.45 178.64 1f90 n ASP 143 N -3.73 4.15 -3.61 4.20 8.00 -1.26 -4.95 116.55 119.36 1f90 n ASP 143 Ca -0.01 0.93 -0.13 0.00 0.71 0.00 0.00 54.79 56.28 1f90 n ASP 143 Cb 0.32 -1.54 -0.07 0.00 -0.02 0.00 0.00 41.12 39.82 1f90 n ASP 143 CO 0.00 0.00 0.00 -0.51 -0.39 0.00 0.00 177.20 176.30 1f90 s ILE 144 N 3.93 0.00 -0.06 0.53 2.07 -1.26 -4.61 121.20 121.79 1f90 s ILE 144 Ca 0.87 0.00 0.05 0.00 -1.41 0.00 0.00 60.65 60.16 1f90 s ILE 144 Cb -0.45 -1.00 -0.01 0.00 0.13 0.00 0.00 42.46 41.14 1f90 s ILE 144 CO 0.40 0.00 -0.23 0.21 -1.91 0.00 0.00 174.94 173.42 1f90 s ASN 145 N -0.02 2.82 -0.01 4.50 2.47 -0.67 -4.99 114.94 119.05 1f90 s ASN 145 Ca -0.01 -0.48 0.08 0.00 0.42 0.00 0.00 52.86 52.87 1f90 s ASN 145 Cb -0.04 -0.92 -0.02 0.00 -1.45 0.00 0.00 41.25 38.82 1f90 s ASN 145 CO 0.00 0.20 -0.25 -0.69 -3.72 0.00 0.00 177.10 172.64 1f90 s VAL 146 N 0.03 2.15 0.01 -5.21 1.01 -1.26 -0.26 120.40 116.87 1f90 s VAL 146 Ca -0.08 -1.13 0.04 0.00 0.00 0.00 0.00 61.98 60.81 1f90 s VAL 146 Cb -0.14 -1.76 -0.01 0.00 0.00 0.00 0.00 36.38 34.46 1f90 s VAL 146 CO 0.05 0.54 -0.13 -0.54 0.00 0.00 0.00 175.10 175.02 1f90 s LYS 147 N -0.73 0.99 -0.05 2.72 1.02 0.56 -4.99 119.74 119.25 1f90 s LYS 147 Ca 0.10 -0.56 0.01 0.00 0.02 0.00 0.00 55.97 55.54 1f90 s LYS 147 Cb -0.10 -0.96 -0.03 0.00 -0.52 0.00 0.00 37.83 36.21 1f90 s LYS 147 CO -0.00 0.25 -0.04 -1.58 -0.92 0.00 0.00 175.35 173.06 1f90 s TRP 148 N -0.50 3.01 -0.08 3.18 0.52 -1.26 -0.84 118.94 122.95 1f90 s TRP 148 Ca 0.04 0.06 -0.02 0.00 0.02 0.00 0.00 56.10 56.20 1f90 s TRP 148 Cb -0.06 -1.70 0.03 0.00 -1.15 0.00 0.00 33.47 30.59 1f90 s TRP 148 CO 0.00 0.39 0.01 0.15 0.02 0.00 0.00 176.95 177.52 1f90 s LYS 149 N -1.06 0.59 -0.19 4.98 1.02 -0.28 -2.32 119.74 122.48 1f90 s LYS 149 Ca 0.15 0.06 -0.07 0.00 0.02 0.00 0.00 55.97 56.12 1f90 s LYS 149 Cb -0.11 -1.09 -0.04 0.00 -0.52 0.00 0.00 37.83 36.07 1f90 s LYS 149 CO 0.04 -0.34 0.06 0.42 -0.92 0.00 0.00 175.35 174.61 1f90 s ILE 150 N 1.97 4.71 -0.71 2.17 1.09 0.15 -1.21 121.20 129.37 1f90 s ILE 150 Ca 0.04 -0.06 -0.09 0.00 -1.10 0.00 0.00 60.65 59.44 1f90 s ILE 150 Cb -0.13 -3.13 0.01 0.00 -1.06 0.00 0.00 42.46 38.16 1f90 s ILE 150 CO -0.06 0.45 0.63 0.47 -0.10 0.00 0.00 174.94 176.33 1f90 n ASP 151 N 3.69 -5.63 0.00 3.58 8.00 0.18 -3.87 116.55 122.49 1f90 n ASP 151 Ca -0.16 -0.57 0.00 0.00 0.71 0.00 0.00 54.79 54.76 1f90 n ASP 151 Cb 0.52 -2.46 0.00 0.00 -0.02 0.00 0.00 41.12 39.16 1f90 n ASP 151 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1f90 n GLY 152 N -1.29 -0.73 0.00 0.44 0.00 -1.26 -4.12 105.19 98.23 1f90 n GLY 152 Ca -0.20 -1.73 0.00 0.00 0.00 0.00 0.00 46.02 44.10 1f90 n GLY 152 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1f90 n SER 153 N -0.70 0.00 -4.55 1.61 2.88 -1.26 -4.45 113.62 107.15 1f90 n SER 153 Ca 0.00 0.04 -0.25 0.00 -1.33 0.00 0.00 58.87 57.33 1f90 n SER 153 Cb 0.00 -0.04 -0.05 0.00 -0.75 0.00 0.00 64.21 63.37 1f90 n SER 153 CO 0.00 0.00 0.00 -0.70 -1.23 0.00 0.00 175.04 173.11 1f90 s GLU 154 N -1.64 1.89 0.81 -1.46 2.12 -1.25 -4.85 118.70 114.32 1f90 s GLU 154 Ca 0.00 0.92 -0.11 0.00 0.36 0.00 0.00 54.97 56.13 1f90 s GLU 154 Cb 0.00 -4.68 0.08 0.00 0.26 0.00 0.00 34.13 29.78 1f90 s GLU 154 CO 0.00 -3.82 1.10 1.03 -0.54 0.00 0.00 175.26 173.03 1f90 s ARG 155 N 8.50 1.95 0.22 4.30 0.52 -1.25 0.34 118.95 133.53 1f90 s ARG 155 Ca 0.94 0.67 0.04 0.00 -0.52 0.00 0.00 55.73 56.86 1f90 s ARG 155 Cb -0.15 -1.90 -0.05 0.00 0.52 0.00 0.00 34.95 33.37 1f90 s ARG 155 CO 0.17 -1.72 -0.02 -1.14 0.02 0.00 0.00 175.30 172.61 1f90 s GLN 156 N -5.12 1.31 -0.20 3.54 2.00 -0.98 -4.79 119.66 115.42 1f90 s GLN 156 Ca 0.61 -1.65 -0.04 0.00 -2.00 0.00 0.00 55.36 52.28 1f90 s GLN 156 Cb -0.15 -0.64 0.08 0.00 0.80 0.00 0.00 33.01 33.10 1f90 s GLN 156 CO 0.55 -0.07 0.14 -0.80 -0.50 0.00 0.00 175.29 174.61 1f90 s ASN 157 N -3.29 2.18 0.00 6.67 0.01 -1.26 -4.69 114.94 114.55 1f90 s ASN 157 Ca 0.27 -0.58 0.00 0.00 -0.71 0.00 0.00 52.86 51.84 1f90 s ASN 157 Cb 0.05 -0.05 0.00 0.00 0.41 0.00 0.00 41.25 41.66 1f90 s ASN 157 CO 0.08 -0.35 0.00 0.61 -1.51 0.00 0.00 177.10 175.92 1f90 n GLY 158 N 5.29 0.00 3.48 0.66 0.00 -1.26 -5.12 105.19 108.24 1f90 n GLY 158 Ca -0.06 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.63 1f90 n GLY 158 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1f90 s VAL 159 N 0.00 3.24 -0.27 1.61 -7.23 -1.26 -3.17 120.40 113.33 1f90 s VAL 159 Ca 0.00 -0.64 -0.13 0.00 -1.81 0.00 0.00 61.98 59.40 1f90 s VAL 159 Cb 0.00 -2.31 -0.04 0.00 0.56 0.00 0.00 36.38 34.59 1f90 s VAL 159 CO 0.00 0.57 0.28 -0.76 -0.31 0.00 0.00 175.10 174.88 1f90 s LEU 160 N -0.47 4.04 0.09 1.32 1.43 0.95 -4.90 118.68 121.14 1f90 s LEU 160 Ca 0.06 0.16 0.05 0.00 -1.03 0.00 0.00 54.13 53.37 1f90 s LEU 160 Cb -0.12 -2.27 -0.04 0.00 0.03 0.00 0.00 46.19 43.79 1f90 s LEU 160 CO 0.02 -0.10 -0.00 0.20 0.23 0.00 0.00 176.35 176.70 1f90 s ASN 161 N 1.60 5.01 -0.18 2.29 0.01 -1.26 -0.32 114.94 122.09 1f90 s ASN 161 Ca 0.11 -0.18 -0.09 0.00 -0.71 0.00 0.00 52.86 51.99 1f90 s ASN 161 Cb -0.16 -1.19 0.07 0.00 0.41 0.00 0.00 41.25 40.39 1f90 s ASN 161 CO 0.10 0.17 0.42 -0.55 -1.51 0.00 0.00 177.10 175.73 1f90 s SER 162 N -2.31 -0.43 0.15 -1.22 0.15 -0.15 -4.98 113.70 104.90 1f90 s SER 162 Ca 0.26 0.93 0.04 0.00 0.70 0.00 0.00 55.95 57.88 1f90 s SER 162 Cb -0.12 0.97 -0.04 0.00 -1.71 0.00 0.00 66.02 65.12 1f90 s SER 162 CO 0.18 -0.21 0.17 0.26 1.20 0.00 0.00 173.24 174.84 1f90 s TRP 163 N 1.81 3.24 0.21 3.44 0.51 -1.26 -0.63 118.94 126.24 1f90 s TRP 163 Ca -0.07 0.03 0.07 0.00 -2.12 0.00 0.00 56.10 54.00 1f90 s TRP 163 Cb -0.10 -1.56 -0.04 0.00 -0.81 0.00 0.00 33.47 30.97 1f90 s TRP 163 CO -0.13 0.52 0.12 0.95 -0.51 0.00 0.00 176.95 177.90 1f90 s THR 164 N -1.71 4.25 0.99 2.01 -4.23 -0.03 -4.99 115.64 111.93 1f90 s THR 164 Ca 0.32 -1.33 -0.12 0.00 -1.18 0.00 0.00 61.69 59.38 1f90 s THR 164 Cb -0.11 -3.22 0.18 0.00 1.34 0.00 0.00 72.50 70.70 1f90 s THR 164 CO 0.25 -0.22 1.08 -1.81 -0.54 0.00 0.00 174.62 173.38 1f90 s ASP 165 N -3.39 2.55 0.15 3.99 1.01 -1.26 -4.44 116.67 115.28 1f90 s ASP 165 Ca 0.31 1.59 -0.31 0.00 0.71 0.00 0.00 52.55 54.84 1f90 s ASP 165 Cb -0.09 -2.25 -0.09 0.00 1.01 0.00 0.00 42.92 41.50 1f90 s ASP 165 CO 0.23 -3.23 1.54 -1.58 0.21 0.00 0.00 175.17 172.33 1f90 s GLN 166 N -4.75 4.23 0.29 8.23 0.74 -1.26 -4.72 119.66 122.42 1f90 s GLN 166 Ca 0.66 2.30 -0.29 0.00 0.05 0.00 0.00 55.36 58.07 1f90 s GLN 166 Cb -0.21 -3.20 -0.10 0.00 1.10 0.00 0.00 33.01 30.60 1f90 s GLN 166 CO 0.59 -0.58 1.26 0.34 -0.55 0.00 0.00 175.29 176.35 1f90 s ASP 167 N 1.22 6.91 0.01 6.67 3.68 -0.41 -4.89 116.67 129.87 1f90 s ASP 167 Ca 0.69 2.53 0.28 0.00 2.13 0.00 0.00 52.55 58.18 1f90 s ASP 167 Cb -0.42 -2.63 1.08 0.00 -1.45 0.00 0.00 42.92 39.49 1f90 s ASP 167 CO 0.31 -0.45 1.82 -1.54 0.13 0.00 0.00 175.17 175.45 1f90 n SER 168 N 1.36 0.15 -0.01 -0.34 3.41 -1.26 -1.12 113.62 115.79 1f90 n SER 168 Ca 0.01 0.37 -0.04 0.00 -0.26 0.00 0.00 58.87 58.95 1f90 n SER 168 Cb 0.43 -0.38 -0.03 0.00 -0.26 0.00 0.00 64.21 63.96 1f90 n SER 168 CO 0.00 0.00 0.00 0.50 -0.16 0.00 0.00 175.04 175.38 1f90 h LYS 169 N 0.00 -0.09 0.00 4.33 1.63 -1.94 -3.42 116.57 117.08 1f90 h LYS 169 Ca 0.00 0.01 0.00 0.00 -0.85 0.00 0.00 60.65 59.81 1f90 h LYS 169 Cb 0.52 0.02 0.00 0.00 -0.60 0.00 0.00 32.23 32.17 1f90 h LYS 169 CO 0.00 0.14 -0.01 -0.40 -3.45 0.00 0.00 179.45 175.73 1f90 n ASP 170 N -4.81 1.59 -2.31 4.20 5.75 -1.25 -5.02 116.55 114.70 1f90 n ASP 170 Ca -0.03 -1.92 -0.18 0.00 -0.01 0.00 0.00 54.79 52.65 1f90 n ASP 170 Cb 0.13 -0.05 -0.02 0.00 -1.03 0.00 0.00 41.12 40.16 1f90 n ASP 170 CO 0.00 0.00 0.00 -1.20 -0.11 0.00 0.00 177.20 175.89 1f90 n SER 171 N -0.48 -5.17 -4.81 -1.12 7.64 -0.28 -4.98 113.62 104.42 1f90 n SER 171 Ca 0.02 0.10 -0.22 0.00 1.01 0.00 0.00 58.87 59.77 1f90 n SER 171 Cb 0.35 -4.36 -0.05 0.00 -1.01 0.00 0.00 64.21 59.14 1f90 n SER 171 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 1f90 s THR 172 N -2.85 2.63 0.43 0.44 -4.23 -1.26 -4.77 115.64 106.03 1f90 s THR 172 Ca 0.00 -1.51 0.07 0.00 -1.18 0.00 0.00 61.69 59.07 1f90 s THR 172 Cb 0.00 -3.01 -0.04 0.00 1.34 0.00 0.00 72.50 70.79 1f90 s THR 172 CO 0.00 -0.03 0.18 -0.31 -0.54 0.00 0.00 174.62 173.92 1f90 s TYR 173 N -2.50 2.49 -0.04 3.99 1.51 -0.12 -1.29 117.35 121.38 1f90 s TYR 173 Ca 0.44 -0.63 -0.11 0.00 -1.01 0.00 0.00 57.07 55.76 1f90 s TYR 173 Cb -0.01 -1.93 0.02 0.00 -0.11 0.00 0.00 41.96 39.93 1f90 s TYR 173 CO 0.25 0.15 0.25 -1.12 -1.11 0.00 0.00 175.55 173.97 1f90 s SER 174 N -3.93 -0.16 0.03 2.29 0.01 -1.26 -1.26 113.70 109.42 1f90 s SER 174 Ca 0.38 0.17 0.02 0.00 1.31 0.00 0.00 55.95 57.83 1f90 s SER 174 Cb 0.03 0.37 -0.02 0.00 0.21 0.00 0.00 66.02 66.61 1f90 s SER 174 CO 0.21 -0.30 -0.07 -0.32 0.41 0.00 0.00 173.24 173.17 1f90 s MET 175 N -0.83 0.51 -0.08 12.44 0.00 0.08 -0.85 119.30 130.57 1f90 s MET 175 Ca -0.09 -0.61 0.05 0.00 0.00 0.00 0.00 55.69 55.04 1f90 s MET 175 Cb -0.05 -0.33 -0.00 0.00 0.00 0.00 0.00 34.83 34.45 1f90 s MET 175 CO 0.02 0.07 -0.24 0.45 0.00 0.00 0.00 175.02 175.33 1f90 s SER 176 N -1.18 2.98 -0.11 1.11 0.15 0.19 -0.83 113.70 116.01 1f90 s SER 176 Ca -0.07 -0.52 0.01 0.00 0.70 0.00 0.00 55.95 56.07 1f90 s SER 176 Cb -0.08 -1.15 0.02 0.00 -1.71 0.00 0.00 66.02 63.10 1f90 s SER 176 CO 0.00 0.18 -0.13 -0.55 1.20 0.00 0.00 173.24 173.95 1f90 s SER 177 N 0.16 2.37 -0.12 5.45 0.15 -0.23 -0.98 113.70 120.50 1f90 s SER 177 Ca -0.13 -0.40 0.03 0.00 0.70 0.00 0.00 55.95 56.15 1f90 s SER 177 Cb -0.16 -1.03 0.01 0.00 -1.71 0.00 0.00 66.02 63.13 1f90 s SER 177 CO 0.07 -0.03 -0.22 -0.89 1.20 0.00 0.00 173.24 173.36 1f90 s THR 178 N 1.22 2.01 -0.25 6.45 2.01 0.56 -0.61 115.64 127.04 1f90 s THR 178 Ca -0.02 -0.97 -0.09 0.00 0.31 0.00 0.00 61.69 60.92 1f90 s THR 178 Cb -0.14 -1.76 -0.04 0.00 0.01 0.00 0.00 72.50 70.57 1f90 s THR 178 CO -0.05 0.54 0.12 -0.22 -0.69 0.00 0.00 174.62 174.33 1f90 s LEU 179 N 0.61 3.74 -0.22 4.42 2.96 0.32 -0.04 118.68 130.48 1f90 s LEU 179 Ca -0.12 -0.07 -0.06 0.00 -0.22 0.00 0.00 54.13 53.66 1f90 s LEU 179 Cb -0.17 -2.01 -0.02 0.00 0.50 0.00 0.00 46.19 44.49 1f90 s LEU 179 CO 0.03 -0.00 0.01 -0.89 -1.32 0.00 0.00 176.35 174.18 1f90 s THR 180 N 1.44 3.93 0.09 3.68 2.01 -1.19 -0.57 115.64 125.04 1f90 s THR 180 Ca 0.06 -0.31 0.04 0.00 0.31 0.00 0.00 61.69 61.79 1f90 s THR 180 Cb -0.15 -2.80 -0.03 0.00 0.01 0.00 0.00 72.50 69.52 1f90 s THR 180 CO 0.06 0.39 -0.11 -0.76 -0.69 0.00 0.00 174.62 173.51 1f90 s LEU 181 N 1.35 2.38 0.69 4.42 1.43 0.02 -4.93 118.68 124.04 1f90 s LEU 181 Ca 0.04 -0.77 -0.12 0.00 -1.03 0.00 0.00 54.13 52.26 1f90 s LEU 181 Cb -0.15 -0.37 0.01 0.00 0.03 0.00 0.00 46.19 45.71 1f90 s LEU 181 CO 0.01 -0.21 1.06 0.28 0.23 0.00 0.00 176.35 177.73 1f90 s THR 182 N -2.15 3.89 0.26 5.49 -1.32 -1.26 -1.25 115.64 119.30 1f90 s THR 182 Ca 0.04 0.66 -0.04 0.00 -1.21 0.00 0.00 61.69 61.13 1f90 s THR 182 Cb -0.05 -3.32 0.22 0.00 -1.51 0.00 0.00 72.50 67.83 1f90 s THR 182 CO 0.01 -0.76 1.89 0.50 -2.21 0.00 0.00 174.62 174.05 1f90 h LYS 183 N -0.59 1.14 -0.47 7.08 3.64 -1.70 -0.53 116.57 125.13 1f90 h LYS 183 Ca -0.44 -0.13 -0.05 0.00 -1.27 0.00 0.00 60.65 58.76 1f90 h LYS 183 Cb 1.21 -0.22 -0.02 0.00 -0.41 0.00 0.00 32.23 32.79 1f90 h LYS 183 CO 0.56 0.83 0.09 -0.44 -2.27 0.00 0.00 179.45 178.23 1f90 h ASP 184 N 1.14 0.73 -0.55 4.20 3.32 -1.93 -1.36 116.42 121.99 1f90 h ASP 184 Ca 0.29 -0.25 -0.00 0.00 0.02 0.00 0.00 57.03 57.09 1f90 h ASP 184 Cb 0.03 -0.19 -0.03 0.00 0.22 0.00 0.00 39.33 39.36 1f90 h ASP 184 CO -0.05 0.79 0.33 -0.08 -1.72 0.00 0.00 179.24 178.52 1f90 h GLU 185 N 0.64 0.74 -0.42 3.56 4.22 -1.85 -2.76 114.58 118.71 1f90 h GLU 185 Ca 0.15 -0.07 -0.05 0.00 0.08 0.00 0.00 59.36 59.47 1f90 h GLU 185 Cb 0.36 -0.16 -0.02 0.00 0.50 0.00 0.00 28.75 29.43 1f90 h GLU 185 CO 0.01 0.53 0.04 -0.92 -2.18 0.00 0.00 179.01 176.49 1f90 h TYR 186 N 0.74 0.68 -0.15 0.92 3.20 -0.90 -2.86 116.97 118.59 1f90 h TYR 186 Ca 0.20 -0.07 0.00 0.00 3.14 0.00 0.00 58.73 62.00 1f90 h TYR 186 Cb -0.02 -0.20 0.00 0.00 1.54 0.00 0.00 36.73 38.05 1f90 h TYR 186 CO -0.03 0.62 0.00 0.39 -1.64 0.00 0.00 178.16 177.51 1f90 n GLU 187 N -4.27 1.46 -0.11 1.82 1.02 -0.53 -3.82 120.64 116.21 1f90 n GLU 187 Ca 0.02 -0.70 -0.22 0.00 -0.02 0.00 0.00 57.16 56.24 1f90 n GLU 187 Cb 0.24 -1.27 -0.10 0.00 -0.02 0.00 0.00 31.44 30.30 1f90 n GLU 187 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 1f90 n ARG 188 N -0.01 0.56 -1.72 3.49 1.74 -1.08 -4.98 116.66 114.65 1f90 n ARG 188 Ca 0.11 0.47 -0.30 0.00 -0.77 0.00 0.00 57.85 57.36 1f90 n ARG 188 Cb 0.20 -1.66 0.08 0.00 -1.02 0.00 0.00 32.46 30.07 1f90 n ARG 188 CO 0.00 0.00 0.00 -1.01 -1.52 0.00 0.00 177.63 175.10 1f90 s HIS 189 N -2.42 2.99 -0.03 -1.55 3.76 -1.24 -5.06 115.29 111.74 1f90 s HIS 189 Ca -0.30 1.02 -0.01 0.00 -0.15 0.00 0.00 55.06 55.62 1f90 s HIS 189 Cb 0.08 -3.19 -0.02 0.00 1.11 0.00 0.00 32.58 30.56 1f90 s HIS 189 CO 0.52 -1.62 -0.03 -1.71 -0.85 0.00 0.00 174.74 171.04 1f90 n ASN 190 N -3.30 2.27 -4.56 1.40 4.05 -1.26 -4.88 115.26 108.98 1f90 n ASN 190 Ca 0.07 0.01 -0.36 0.00 0.45 0.00 0.00 54.58 54.75 1f90 n ASN 190 Cb 0.58 -0.07 -0.11 0.00 1.23 0.00 0.00 39.78 41.41 1f90 n ASN 190 CO 0.00 0.00 0.00 -0.55 -3.05 0.00 0.00 177.26 173.66 1f90 s SER 191 N -4.72 5.51 -0.30 1.20 0.15 -1.26 -1.78 113.70 112.49 1f90 s SER 191 Ca -0.04 -0.04 -0.02 0.00 0.70 0.00 0.00 55.95 56.54 1f90 s SER 191 Cb 0.01 -1.98 0.05 0.00 -1.71 0.00 0.00 66.02 62.39 1f90 s SER 191 CO 0.07 0.06 0.00 -0.31 1.20 0.00 0.00 173.24 174.26 1f90 s TYR 192 N 1.08 3.24 -0.14 3.44 1.51 -0.60 -0.65 117.35 125.24 1f90 s TYR 192 Ca 0.05 -1.78 -0.02 0.00 -1.01 0.00 0.00 57.07 54.31 1f90 s TYR 192 Cb -0.14 -2.12 -0.02 0.00 -0.11 0.00 0.00 41.96 39.57 1f90 s TYR 192 CO 0.04 -0.79 -0.09 0.99 -1.11 0.00 0.00 175.55 174.59 1f90 s THR 193 N 1.28 3.37 -0.28 -0.71 2.01 -0.35 -2.22 115.64 118.74 1f90 s THR 193 Ca -0.04 -0.55 -0.07 0.00 0.31 0.00 0.00 61.69 61.34 1f90 s THR 193 Cb -0.19 -2.44 -0.00 0.00 0.01 0.00 0.00 72.50 69.87 1f90 s THR 193 CO -0.01 0.51 0.09 0.00 -0.69 0.00 0.00 174.62 174.52 1f90 s GLU 195 N 1.55 2.94 -0.14 0.00 2.02 -0.02 -0.83 118.70 124.22 1f90 s GLU 195 Ca 0.04 -0.88 -0.01 0.00 0.02 0.00 0.00 54.97 54.14 1f90 s GLU 195 Cb -0.16 -2.74 -0.02 0.00 0.10 0.00 0.00 34.13 31.31 1f90 s GLU 195 CO 0.03 -0.28 -0.11 0.00 0.02 0.00 0.00 175.26 174.93 1f90 s ALA 196 N 1.30 2.72 -0.12 5.21 0.00 -0.12 -0.32 121.76 130.43 1f90 s ALA 196 Ca 0.03 -0.88 -0.02 0.00 0.00 0.00 0.00 51.96 51.09 1f90 s ALA 196 Cb -0.15 -1.31 -0.03 0.00 0.00 0.00 0.00 23.12 21.64 1f90 s ALA 196 CO -0.09 0.23 -0.03 0.99 0.00 0.00 0.00 175.76 176.86 1f90 s THR 197 N 0.37 4.03 0.05 0.00 2.01 0.64 -0.49 115.64 122.26 1f90 s THR 197 Ca -0.09 -0.33 -0.04 0.00 0.31 0.00 0.00 61.69 61.54 1f90 s THR 197 Cb -0.15 -2.72 -0.02 0.00 0.01 0.00 0.00 72.50 69.61 1f90 s THR 197 CO 0.05 0.55 0.06 -2.28 -0.69 0.00 0.00 174.62 172.30 1f90 s HIS 198 N -0.27 0.31 -0.97 4.92 2.46 -1.26 -1.67 115.29 118.81 1f90 s HIS 198 Ca 0.05 -0.73 0.17 0.00 0.47 0.00 0.00 55.06 55.02 1f90 s HIS 198 Cb -0.13 -0.22 0.71 0.00 -0.13 0.00 0.00 32.58 32.82 1f90 s HIS 198 CO 0.02 -0.39 1.54 0.36 -2.47 0.00 0.00 174.74 173.80 1f90 n LYS 199 N 0.43 0.01 0.00 2.88 2.85 -1.26 -2.62 118.16 120.45 1f90 n LYS 199 Ca -0.17 0.23 0.06 0.00 -1.05 0.00 0.00 58.31 57.38 1f90 n LYS 199 Cb 0.60 -1.52 0.37 0.00 -0.65 0.00 0.00 35.03 33.82 1f90 n LYS 199 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 177.40 177.60 1f90 n THR 200 N -1.54 0.00 -3.56 0.58 -2.24 -1.26 -4.80 114.28 101.45 1f90 n THR 200 Ca 0.04 0.00 -0.07 0.00 -2.27 0.00 0.00 64.05 61.75 1f90 n THR 200 Cb 0.20 -0.46 -0.03 0.00 -2.10 0.00 0.00 70.33 67.94 1f90 n THR 200 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1f90 s SER 201 N -1.72 -0.26 -0.12 3.42 0.15 -1.08 -5.00 113.70 109.10 1f90 s SER 201 Ca 0.19 0.08 -0.19 0.00 0.70 0.00 0.00 55.95 56.73 1f90 s SER 201 Cb 0.08 0.25 -0.26 0.00 -1.71 0.00 0.00 66.02 64.39 1f90 s SER 201 CO 0.14 -0.38 0.55 0.71 1.20 0.00 0.00 173.24 175.46 1f90 h THR 202 N 2.11 1.14 -3.41 6.45 1.35 -1.87 -3.41 112.91 115.27 1f90 h THR 202 Ca -0.15 -2.37 -0.55 0.00 -0.55 0.00 0.00 66.41 62.79 1f90 h THR 202 Cb 1.19 2.75 -0.04 0.00 -1.73 0.00 0.00 68.15 70.33 1f90 h THR 202 CO 0.27 0.63 0.17 -0.94 -0.25 0.00 0.00 175.52 175.40 1f90 s SER 203 N -6.90 7.17 0.59 5.36 1.04 -1.26 -5.00 113.70 114.70 1f90 s SER 203 Ca -0.21 1.41 -0.18 0.00 0.48 0.00 0.00 55.95 57.45 1f90 s SER 203 Cb 0.03 -2.47 -0.04 0.00 0.10 0.00 0.00 66.02 63.65 1f90 s SER 203 CO 0.73 -0.05 1.14 -2.16 0.98 0.00 0.00 173.24 173.89 1f90 s PRO 204 N 0.28 3.10 -0.21 4.02 0.04 -1.26 -4.92 135.00 136.05 1f90 s PRO 204 Ca 0.40 1.59 -0.27 0.00 0.04 0.00 0.00 61.00 62.76 1f90 s PRO 204 Cb -0.20 -1.97 -0.00 0.00 0.04 0.00 0.00 34.50 32.37 1f90 s PRO 204 CO 0.22 -1.05 0.93 0.42 0.04 0.00 0.00 177.00 177.57 1f90 s ILE 205 N -1.90 4.78 -0.05 0.56 1.01 0.36 -4.87 121.20 121.09 1f90 s ILE 205 Ca 0.72 1.81 0.03 0.00 0.00 0.00 0.00 60.65 63.21 1f90 s ILE 205 Cb -0.24 -4.22 -0.03 0.00 0.01 0.00 0.00 42.46 37.99 1f90 s ILE 205 CO 0.32 -0.09 -0.13 -0.69 0.00 0.00 0.00 174.94 174.35 1f90 s VAL 206 N 2.79 3.20 -0.08 2.92 1.01 -1.26 -0.94 120.40 128.04 1f90 s VAL 206 Ca 0.40 -0.70 -0.03 0.00 0.00 0.00 0.00 61.98 61.65 1f90 s VAL 206 Cb -0.16 -2.27 0.04 0.00 0.00 0.00 0.00 36.38 33.99 1f90 s VAL 206 CO 0.09 0.57 0.15 -0.54 0.00 0.00 0.00 175.10 175.37 1f90 s LYS 207 N -0.81 0.03 0.36 2.72 -0.14 -0.01 -5.00 119.74 116.90 1f90 s LYS 207 Ca 0.12 0.53 -0.02 0.00 -1.36 0.00 0.00 55.97 55.23 1f90 s LYS 207 Cb -0.11 -0.28 0.01 0.00 -1.68 0.00 0.00 37.83 35.77 1f90 s LYS 207 CO 0.01 -0.29 0.51 -1.54 -0.76 0.00 0.00 175.35 173.28 1f90 s SER 208 N 2.15 1.00 0.08 2.83 1.04 -1.26 -0.02 113.70 119.53 1f90 s SER 208 Ca 0.02 -1.53 -0.23 0.00 0.48 0.00 0.00 55.95 54.69 1f90 s SER 208 Cb -0.12 0.70 0.06 0.00 0.10 0.00 0.00 66.02 66.75 1f90 s SER 208 CO -0.06 -1.36 0.56 0.72 0.98 0.00 0.00 173.24 174.08 1f90 s PHE 209 N -2.86 -0.47 0.12 5.02 -0.12 -0.94 -5.00 117.98 113.72 1f90 s PHE 209 Ca 0.30 0.45 0.07 0.00 -0.05 0.00 0.00 56.93 57.70 1f90 s PHE 209 Cb -0.01 0.42 -0.04 0.00 -0.63 0.00 0.00 43.02 42.76 1f90 s PHE 209 CO 0.21 -0.72 -0.06 -0.80 -0.05 0.00 0.00 175.22 173.81 1f90 s ASN 210 N -2.22 4.58 -0.99 1.98 -0.87 -1.26 -1.55 114.94 114.60 1f90 s ASN 210 Ca -0.03 -0.37 -0.23 0.00 -1.57 0.00 0.00 52.86 50.66 1f90 s ASN 210 Cb -0.00 -0.93 -0.00 0.00 -0.02 0.00 0.00 41.25 40.29 1f90 s ASN 210 CO -0.05 0.15 1.72 -0.13 -2.57 0.00 0.00 177.10 176.23 1f90 s ARG 211 N -2.44 3.07 -0.31 -0.60 0.52 -0.74 -4.47 118.95 114.00 1f90 s ARG 211 Ca 0.24 -0.79 -0.04 0.00 -0.52 0.00 0.00 55.73 54.62 1f90 s ARG 211 Cb -0.11 -5.23 0.28 0.00 0.52 0.00 0.00 34.95 30.41 1f90 s ARG 211 CO 0.16 -2.86 1.28 0.27 0.02 0.00 0.00 175.30 174.17 1f90 n ASN 212 N 11.54 -1.07 0.00 0.23 0.23 -1.26 -5.08 115.26 119.85 1f90 n ASN 212 Ca 0.38 -1.53 0.00 0.00 -0.53 0.00 0.00 54.58 52.90 1f90 n ASN 212 Cb 0.49 0.55 0.00 0.00 -2.08 0.00 0.00 39.78 38.74 1f90 n ASN 212 CO 0.00 0.00 0.00 -1.84 -0.93 0.00 0.00 177.26 174.49 1f90 n GLU 213 N 1.54 0.00 0.00 -3.83 0.28 -1.26 -5.23 120.64 112.14 1f90 n GLU 213 Ca 0.01 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.01 1f90 n GLU 213 Cb 0.71 0.00 0.00 0.00 1.43 0.00 0.00 31.44 33.58 1f90 n GLU 213 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97