#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rak n LEU 5 N 0.00 4.21 -0.01 0.00 4.77 -1.26 -4.80 117.00 119.90 1rak n LEU 5 Ca 0.00 1.12 0.03 0.00 -0.03 0.00 0.00 56.01 57.12 1rak n LEU 5 Cb 0.00 -1.58 -0.08 0.00 -2.33 0.00 0.00 43.42 39.43 1rak n LEU 5 CO 0.00 0.15 -0.67 0.00 -1.33 0.00 0.00 177.39 175.55 1rak n GLN 6 N 2.81 0.83 -3.64 3.23 6.02 0.13 -4.79 117.38 121.95 1rak n GLN 6 Ca 0.11 -0.07 -0.16 0.00 -0.01 0.00 0.00 57.00 56.88 1rak n GLN 6 Cb 0.36 -1.24 -0.07 0.00 1.02 0.00 0.00 30.24 30.30 1rak n GLN 6 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 177.06 177.04 1rak s THR 7 N -2.59 0.03 -0.20 5.09 2.01 -1.05 -0.50 115.64 118.43 1rak s THR 7 Ca -0.04 -0.23 -0.03 0.00 0.31 0.00 0.00 61.69 61.70 1rak s THR 7 Cb 0.06 -0.80 -0.01 0.00 0.01 0.00 0.00 72.50 71.75 1rak s THR 7 CO 0.41 -0.13 -0.06 -0.63 -0.69 0.00 0.00 174.62 173.53 1rak s ILE 8 N -1.21 3.39 0.31 1.82 -1.09 0.06 -0.56 121.20 123.92 1rak s ILE 8 Ca -0.12 -0.50 0.10 0.00 -2.23 0.00 0.00 60.65 57.90 1rak s ILE 8 Cb -0.03 -2.52 -0.05 0.00 -1.58 0.00 0.00 42.46 38.29 1rak s ILE 8 CO 0.07 0.45 -0.04 0.27 -1.23 0.00 0.00 174.94 174.46 1rak s ILE 9 N 1.16 2.75 -1.40 2.92 -4.36 -0.52 -0.43 121.20 121.33 1rak s ILE 9 Ca 0.02 -2.05 -0.07 0.00 -0.26 0.00 0.00 60.65 58.28 1rak s ILE 9 Cb -0.14 -2.70 0.04 0.00 1.25 0.00 0.00 42.46 40.90 1rak s ILE 9 CO -0.01 -0.28 0.93 0.59 0.24 0.00 0.00 174.94 176.41 1rak n ASN 10 N -0.87 -3.62 -4.85 4.36 5.03 -1.19 -1.20 115.26 112.91 1rak n ASN 10 Ca -0.05 -0.74 -0.37 0.00 0.87 0.00 0.00 54.58 54.29 1rak n ASN 10 Cb 0.61 -4.25 -0.06 0.00 -1.02 0.00 0.00 39.78 35.06 1rak n ASN 10 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1rak s ALA 11 N -3.43 3.81 0.05 5.41 0.00 -0.49 -0.42 121.76 126.69 1rak s ALA 11 Ca 0.37 -0.52 -0.02 0.00 0.00 0.00 0.00 51.96 51.80 1rak s ALA 11 Cb -0.18 -2.11 -0.04 0.00 0.00 0.00 0.00 23.12 20.78 1rak s ALA 11 CO 0.80 0.54 0.24 1.03 0.00 0.00 0.00 175.76 178.36 1rak s ARG 12 N -0.91 3.48 -0.02 0.00 0.52 -0.27 0.02 118.95 121.78 1rak s ARG 12 Ca 0.17 -0.32 0.05 0.00 -0.52 0.00 0.00 55.73 55.11 1rak s ARG 12 Cb -0.13 -3.02 -0.01 0.00 0.52 0.00 0.00 34.95 32.30 1rak s ARG 12 CO 0.06 0.60 -0.16 -0.51 0.02 0.00 0.00 175.30 175.32 1rak s LEU 13 N -2.34 1.99 0.33 2.53 1.43 -1.26 -1.08 118.68 120.28 1rak s LEU 13 Ca 0.34 -0.29 -0.29 0.00 -1.03 0.00 0.00 54.13 52.86 1rak s LEU 13 Cb -0.13 -0.84 -0.12 0.00 0.03 0.00 0.00 46.19 45.13 1rak s LEU 13 CO 0.24 0.18 1.35 -2.65 0.23 0.00 0.00 176.35 175.70 1rak n PRO 14 N 2.80 2.21 -0.69 1.29 -0.02 -1.26 -1.80 135.00 137.53 1rak n PRO 14 Ca -0.15 0.78 0.00 0.00 -2.02 0.00 0.00 63.50 62.10 1rak n PRO 14 Cb 0.54 -2.40 0.00 0.00 -0.02 0.00 0.00 33.50 31.62 1rak n PRO 14 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1rak n GLY 15 N 1.03 0.86 3.56 -1.23 0.00 -1.26 -4.99 105.19 103.15 1rak n GLY 15 Ca 0.06 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.79 1rak n GLY 15 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1rak s GLU 16 N -0.30 2.02 0.36 1.61 0.41 -0.75 -5.13 118.70 116.93 1rak s GLU 16 Ca 0.00 -1.15 -0.03 0.00 -0.41 0.00 0.00 54.97 53.37 1rak s GLU 16 Cb 0.00 -2.21 -0.04 0.00 -1.78 0.00 0.00 34.13 30.10 1rak s GLU 16 CO 0.00 0.47 0.62 -1.21 -0.49 0.00 0.00 175.26 174.65 1rak s GLU 17 N -2.44 3.57 2.40 1.61 0.41 -1.26 -4.62 118.70 118.37 1rak s GLU 17 Ca 0.22 -0.04 0.00 0.00 -0.41 0.00 0.00 54.97 54.74 1rak s GLU 17 Cb -0.10 -2.58 0.00 0.00 -1.78 0.00 0.00 34.13 29.67 1rak s GLU 17 CO 0.14 0.08 0.00 0.41 -0.49 0.00 0.00 175.26 175.40 1rak n GLY 18 N -1.54 -0.27 3.69 -1.39 0.00 -1.26 -4.91 105.19 99.52 1rak n GLY 18 Ca -0.02 -1.04 -0.27 0.00 0.00 0.00 0.00 46.02 44.70 1rak n GLY 18 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1rak s LEU 19 N 0.00 3.43 0.05 0.99 1.43 -1.26 -4.57 118.68 118.74 1rak s LEU 19 Ca 0.00 -0.32 0.02 0.00 -1.03 0.00 0.00 54.13 52.79 1rak s LEU 19 Cb 0.00 -2.08 -0.03 0.00 0.03 0.00 0.00 46.19 44.11 1rak s LEU 19 CO 0.00 0.09 -0.06 0.26 0.23 0.00 0.00 176.35 176.87 1rak s TRP 20 N -1.70 0.63 -0.11 0.29 0.52 0.10 -0.58 118.94 118.10 1rak s TRP 20 Ca 0.28 -0.62 0.01 0.00 0.02 0.00 0.00 56.10 55.80 1rak s TRP 20 Cb -0.10 -0.39 -0.02 0.00 -1.15 0.00 0.00 33.47 31.82 1rak s TRP 20 CO 0.20 -0.13 -0.15 -1.14 0.02 0.00 0.00 176.95 175.74 1rak s GLN 21 N -2.11 3.14 -0.29 4.98 0.74 0.53 -1.40 119.66 125.25 1rak s GLN 21 Ca -0.06 -0.72 -0.02 0.00 0.05 0.00 0.00 55.36 54.61 1rak s GLN 21 Cb -0.06 -2.52 0.04 0.00 1.10 0.00 0.00 33.01 31.57 1rak s GLN 21 CO -0.01 0.30 -0.01 0.42 -0.55 0.00 0.00 175.29 175.43 1rak s ILE 22 N 0.11 3.00 0.03 -2.34 1.01 0.43 -1.08 121.20 122.37 1rak s ILE 22 Ca -0.07 -1.30 -0.25 0.00 0.00 0.00 0.00 60.65 59.03 1rak s ILE 22 Cb -0.15 -2.68 -0.05 0.00 0.01 0.00 0.00 42.46 39.59 1rak s ILE 22 CO 0.05 -0.05 0.78 -1.00 0.00 0.00 0.00 174.94 174.72 1rak s HIS 23 N 1.27 3.71 -0.04 3.97 3.76 0.32 -0.77 115.29 127.52 1rak s HIS 23 Ca -0.04 1.47 0.04 0.00 -0.15 0.00 0.00 55.06 56.38 1rak s HIS 23 Cb -0.19 -2.85 -0.03 0.00 1.11 0.00 0.00 32.58 30.63 1rak s HIS 23 CO -0.02 0.23 -0.16 -0.51 -0.85 0.00 0.00 174.74 173.43 1rak s LEU 24 N 0.14 2.63 -0.19 0.89 1.43 0.34 -0.32 118.68 123.60 1rak s LEU 24 Ca 0.40 -0.24 -0.10 0.00 -1.03 0.00 0.00 54.13 53.15 1rak s LEU 24 Cb -0.20 -1.52 0.07 0.00 0.03 0.00 0.00 46.19 44.56 1rak s LEU 24 CO 0.23 0.34 0.46 -1.58 0.23 0.00 0.00 176.35 176.03 1rak s GLN 25 N -0.75 0.44 -1.52 1.70 2.00 -0.05 -4.68 119.66 116.81 1rak s GLN 25 Ca 0.11 0.91 -0.13 0.00 -2.00 0.00 0.00 55.36 54.25 1rak s GLN 25 Cb -0.11 0.06 0.08 0.00 0.80 0.00 0.00 33.01 33.85 1rak s GLN 25 CO 0.00 -0.17 0.98 -0.25 -0.50 0.00 0.00 175.29 175.36 1rak n ASP 26 N 4.44 -4.99 0.00 6.67 10.43 -1.26 -1.42 116.55 130.42 1rak n ASP 26 Ca -0.21 -0.73 0.00 0.00 2.57 0.00 0.00 54.79 56.42 1rak n ASP 26 Cb 0.55 -3.98 0.00 0.00 1.84 0.00 0.00 41.12 39.53 1rak n ASP 26 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 1rak n GLY 27 N -1.70 0.54 3.52 0.44 0.00 -1.26 -5.01 105.19 101.71 1rak n GLY 27 Ca 0.04 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.82 1rak n GLY 27 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1rak s LYS 28 N -0.32 1.77 -0.30 1.61 1.02 -0.51 -0.69 119.74 122.32 1rak s LYS 28 Ca 0.00 -1.98 -0.21 0.00 0.02 0.00 0.00 55.97 53.81 1rak s LYS 28 Cb 0.00 -1.22 -0.01 0.00 -0.52 0.00 0.00 37.83 36.08 1rak s LYS 28 CO 0.00 -0.10 0.65 0.42 -0.92 0.00 0.00 175.35 175.40 1rak s ILE 29 N -3.02 4.93 -0.04 2.17 1.01 0.05 -0.87 121.20 125.44 1rak s ILE 29 Ca 0.35 0.94 0.04 0.00 0.00 0.00 0.00 60.65 61.98 1rak s ILE 29 Cb 0.08 -4.00 -0.25 0.00 0.01 0.00 0.00 42.46 38.30 1rak s ILE 29 CO 0.16 -0.12 0.69 0.77 0.00 0.00 0.00 174.94 176.44 1rak h SER 30 N 8.13 0.19 -4.61 3.58 4.64 -0.97 1.00 113.55 125.49 1rak h SER 30 Ca -0.26 -0.34 0.07 0.00 -0.47 0.00 0.00 61.79 60.79 1rak h SER 30 Cb 1.12 -0.06 -0.17 0.00 -0.31 0.00 0.00 62.40 62.98 1rak h SER 30 CO 0.81 1.30 0.44 0.00 -0.87 0.00 0.00 176.83 178.51 1rak s ALA 31 N -2.60 -1.81 -0.10 5.18 0.00 -1.20 -4.70 121.76 116.52 1rak s ALA 31 Ca -0.09 1.10 -0.00 0.00 0.00 0.00 0.00 51.96 52.96 1rak s ALA 31 Cb 0.08 0.21 0.02 0.00 0.00 0.00 0.00 23.12 23.43 1rak s ALA 31 CO 0.82 -0.59 -0.08 0.42 0.00 0.00 0.00 175.76 176.33 1rak s ILE 32 N -2.61 0.99 -0.02 0.00 1.01 -1.26 -0.52 121.20 118.80 1rak s ILE 32 Ca 0.02 -0.29 0.05 0.00 0.00 0.00 0.00 60.65 60.43 1rak s ILE 32 Cb -0.01 -1.00 -0.01 0.00 0.01 0.00 0.00 42.46 41.45 1rak s ILE 32 CO -0.06 0.36 -0.15 -1.81 0.00 0.00 0.00 174.94 173.28 1rak s ASP 33 N 1.56 1.81 0.47 3.58 1.01 -0.24 -4.98 116.67 119.87 1rak s ASP 33 Ca 0.02 -0.28 -0.21 0.00 0.71 0.00 0.00 52.55 52.78 1rak s ASP 33 Cb -0.13 -0.24 -0.08 0.00 1.01 0.00 0.00 42.92 43.48 1rak s ASP 33 CO -0.06 0.18 1.08 0.00 0.21 0.00 0.00 175.17 176.57 1rak s ALA 34 N -0.30 2.91 0.15 5.23 0.00 -1.26 -0.35 121.76 128.15 1rak s ALA 34 Ca 0.05 0.72 0.06 0.00 0.00 0.00 0.00 51.96 52.79 1rak s ALA 34 Cb -0.07 -3.30 -0.04 0.00 0.00 0.00 0.00 23.12 19.72 1rak s ALA 34 CO -0.00 -0.42 0.03 -0.65 0.00 0.00 0.00 175.76 174.72 1rak s GLN 35 N -2.97 2.53 0.00 0.00 -0.21 0.25 -4.83 119.66 114.44 1rak s GLN 35 Ca 0.65 -1.00 0.18 0.00 0.02 0.00 0.00 55.36 55.21 1rak s GLN 35 Cb -0.21 -2.46 0.23 0.00 1.00 0.00 0.00 33.01 31.57 1rak s GLN 35 CO 0.25 0.48 1.16 -1.13 -2.12 0.00 0.00 175.29 173.93 1rak n SER 36 N 0.00 2.75 -1.79 5.90 3.41 -1.26 -4.35 113.62 118.29 1rak n SER 36 Ca -0.10 -1.81 -0.00 0.00 -0.26 0.00 0.00 58.87 56.69 1rak n SER 36 Cb 0.54 -0.09 0.01 0.00 -0.26 0.00 0.00 64.21 64.40 1rak n SER 36 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1rak n GLY 37 N 1.05 0.92 3.70 5.00 0.00 -1.26 -5.07 105.19 109.53 1rak n GLY 37 Ca 0.13 -0.97 -0.42 0.00 0.00 0.00 0.00 46.02 44.76 1rak n GLY 37 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1rak s VAL 38 N -2.32 4.72 0.24 1.61 1.01 -1.26 -4.93 120.40 119.45 1rak s VAL 38 Ca 0.08 1.96 -0.13 0.00 0.00 0.00 0.00 61.98 63.89 1rak s VAL 38 Cb -0.01 -4.26 -0.08 0.00 0.00 0.00 0.00 36.38 32.04 1rak s VAL 38 CO 0.01 0.11 0.61 -0.04 0.00 0.00 0.00 175.10 175.79 1rak s MET 39 N 1.28 3.92 0.45 2.72 -1.94 -1.26 -5.07 119.30 119.40 1rak s MET 39 Ca 0.52 0.46 -0.21 0.00 -1.71 0.00 0.00 55.69 54.75 1rak s MET 39 Cb -0.22 -2.67 -0.10 0.00 2.01 0.00 0.00 34.83 33.86 1rak s MET 39 CO 0.26 0.32 0.99 -1.25 -0.01 0.00 0.00 175.02 175.32 1rak s PRO 40 N -2.62 4.07 0.82 2.03 0.04 -1.26 -4.91 135.00 133.17 1rak s PRO 40 Ca 0.47 1.24 -0.12 0.00 0.04 0.00 0.00 61.00 62.63 1rak s PRO 40 Cb -0.12 -2.18 0.09 0.00 0.04 0.00 0.00 34.50 32.32 1rak s PRO 40 CO 0.20 -0.18 1.13 -1.50 0.04 0.00 0.00 177.00 176.69 1rak s ILE 41 N -2.06 2.56 -0.04 0.56 1.10 -1.26 -5.07 121.20 116.98 1rak s ILE 41 Ca 0.63 0.18 -0.31 0.00 -0.51 0.00 0.00 60.65 60.65 1rak s ILE 41 Cb -0.13 -3.02 0.12 0.00 0.15 0.00 0.00 42.46 39.58 1rak s ILE 41 CO 0.17 -0.24 1.17 0.28 -2.11 0.00 0.00 174.94 174.21 1rak s THR 42 N -3.32 0.00 0.36 4.00 -1.32 -1.26 -5.08 115.64 109.02 1rak s THR 42 Ca 0.62 -0.19 -0.28 0.00 -1.21 0.00 0.00 61.69 60.62 1rak s THR 42 Cb -0.13 -1.57 -0.11 0.00 -1.51 0.00 0.00 72.50 69.18 1rak s THR 42 CO 0.52 0.00 1.47 -0.70 -2.21 0.00 0.00 174.62 173.70 1rak s GLU 43 N -2.63 4.15 0.00 7.08 2.12 -1.26 -1.98 118.70 126.18 1rak s GLU 43 Ca 0.11 2.51 0.00 0.00 0.36 0.00 0.00 54.97 57.95 1rak s GLU 43 Cb 0.01 -2.99 0.00 0.00 0.26 0.00 0.00 34.13 31.41 1rak s GLU 43 CO -0.04 -0.49 0.00 0.09 -0.54 0.00 0.00 175.26 174.29 1rak n ASN 44 N 0.72 -1.45 -4.33 -1.70 3.02 -1.26 -4.95 115.26 105.31 1rak n ASN 44 Ca 0.02 0.00 -0.33 0.00 -0.03 0.00 0.00 54.58 54.23 1rak n ASN 44 Cb 0.39 -0.24 -0.15 0.00 -0.61 0.00 0.00 39.78 39.18 1rak n ASN 44 CO 0.00 0.00 0.00 -0.44 -2.62 0.00 0.00 177.26 174.20 1rak s SER 45 N -2.48 3.92 -0.27 6.41 0.01 -0.84 0.18 113.70 120.63 1rak s SER 45 Ca 0.00 -0.37 -0.12 0.00 1.31 0.00 0.00 55.95 56.76 1rak s SER 45 Cb 0.00 -1.60 -0.05 0.00 0.21 0.00 0.00 66.02 64.58 1rak s SER 45 CO 0.00 0.13 0.25 -0.22 0.41 0.00 0.00 173.24 173.81 1rak s LEU 46 N 0.56 4.03 -0.39 2.44 2.96 0.28 -4.63 118.68 123.93 1rak s LEU 46 Ca -0.08 0.10 -0.23 0.00 -0.22 0.00 0.00 54.13 53.70 1rak s LEU 46 Cb -0.16 -2.23 0.01 0.00 0.50 0.00 0.00 46.19 44.32 1rak s LEU 46 CO 0.03 -0.09 0.76 -0.62 -1.32 0.00 0.00 176.35 175.11 1rak s ASP 47 N 1.68 6.48 0.02 3.68 3.68 -1.26 -1.44 116.67 129.51 1rak s ASP 47 Ca 0.10 0.14 0.21 0.00 2.13 0.00 0.00 52.55 55.13 1rak s ASP 47 Cb -0.16 -2.38 0.89 0.00 -1.45 0.00 0.00 42.92 39.82 1rak s ASP 47 CO 0.10 -0.77 1.67 0.00 0.13 0.00 0.00 175.17 176.30 1rak n ALA 48 N 6.46 1.94 -4.01 3.66 0.00 -0.34 -4.91 120.51 123.31 1rak n ALA 48 Ca 0.02 -0.06 -0.31 0.00 0.00 0.00 0.00 53.44 53.09 1rak n ALA 48 Cb 0.48 -1.34 0.00 0.00 0.00 0.00 0.00 19.45 18.59 1rak n ALA 48 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1rak n GLU 49 N -1.57 -4.39 -1.65 0.00 1.02 -1.25 -0.53 120.64 112.27 1rak n GLU 49 Ca 0.05 0.50 -0.14 0.00 -0.02 0.00 0.00 57.16 57.55 1rak n GLU 49 Cb 0.25 -5.21 -0.04 0.00 -0.02 0.00 0.00 31.44 26.41 1rak n GLU 49 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 1rak n GLN 50 N -4.52 -1.01 -2.42 3.49 6.02 0.44 -5.01 117.38 114.37 1rak n GLN 50 Ca -0.02 0.90 -0.25 0.00 -0.01 0.00 0.00 57.00 57.62 1rak n GLN 50 Cb 0.55 -5.05 0.12 0.00 1.02 0.00 0.00 30.24 26.88 1rak n GLN 50 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.06 176.25 1rak s GLY 51 N -2.71 1.76 -0.12 1.08 0.00 0.31 -4.64 107.32 103.00 1rak s GLY 51 Ca 0.00 -1.58 -0.18 0.00 0.00 0.00 0.00 44.72 42.97 1rak s GLY 51 CO 0.00 -0.97 0.46 -2.27 0.00 0.00 0.00 173.10 170.31 1rak s LEU 52 N -5.31 4.27 -0.18 0.66 2.96 -0.40 -1.11 118.68 119.57 1rak s LEU 52 Ca 0.68 0.78 -0.04 0.00 -0.22 0.00 0.00 54.13 55.33 1rak s LEU 52 Cb -0.05 -2.66 -0.02 0.00 0.50 0.00 0.00 46.19 43.96 1rak s LEU 52 CO 0.46 0.01 -0.04 -0.69 -1.32 0.00 0.00 176.35 174.78 1rak s VAL 53 N 0.59 3.71 0.08 1.68 1.01 -0.24 -0.73 120.40 126.50 1rak s VAL 53 Ca 0.25 -0.40 -0.01 0.00 0.00 0.00 0.00 61.98 61.82 1rak s VAL 53 Cb -0.15 -2.65 -0.04 0.00 0.00 0.00 0.00 36.38 33.54 1rak s VAL 53 CO 0.10 0.46 -0.01 0.27 0.00 0.00 0.00 175.10 175.92 1rak s ILE 54 N 0.80 0.24 0.98 2.22 -4.36 -0.81 -4.58 121.20 115.69 1rak s ILE 54 Ca -0.01 -1.86 -0.12 0.00 -0.26 0.00 0.00 60.65 58.40 1rak s ILE 54 Cb -0.15 -1.71 0.18 0.00 1.25 0.00 0.00 42.46 42.03 1rak s ILE 54 CO 0.02 -0.81 1.08 -2.16 0.24 0.00 0.00 174.94 173.31 1rak s PRO 55 N -3.95 0.54 0.64 0.37 0.04 -1.26 -0.73 135.00 130.64 1rak s PRO 55 Ca 0.13 0.83 -0.18 0.00 0.04 0.00 0.00 61.00 61.82 1rak s PRO 55 Cb 0.08 -1.72 -0.03 0.00 0.04 0.00 0.00 34.50 32.87 1rak s PRO 55 CO -0.06 -2.74 1.10 -2.30 0.04 0.00 0.00 177.00 173.05 1rak n PRO 56 N -4.23 0.94 -1.48 0.56 -0.02 -1.26 -4.54 135.00 124.97 1rak n PRO 56 Ca 0.06 0.37 -0.33 0.00 -2.02 0.00 0.00 63.50 61.58 1rak n PRO 56 Cb 0.55 -2.33 0.08 0.00 -0.02 0.00 0.00 33.50 31.79 1rak n PRO 56 CO 0.00 0.00 0.00 -0.06 1.98 0.00 0.00 175.50 177.42 1rak s PHE 57 N -1.49 2.24 0.00 6.00 2.99 -0.54 -4.76 117.98 122.42 1rak s PHE 57 Ca 0.79 1.60 0.05 0.00 0.00 0.00 0.00 56.93 59.37 1rak s PHE 57 Cb -0.39 -3.34 -0.02 0.00 0.00 0.00 0.00 43.02 39.27 1rak s PHE 57 CO 0.44 -2.27 -0.16 0.08 -0.00 0.00 0.00 175.22 173.30 1rak s VAL 58 N -2.20 1.30 -0.47 -0.44 1.01 -0.89 -2.45 120.40 116.26 1rak s VAL 58 Ca 0.71 -0.82 -0.03 0.00 0.00 0.00 0.00 61.98 61.84 1rak s VAL 58 Cb -0.25 -1.11 0.13 0.00 0.00 0.00 0.00 36.38 35.14 1rak s VAL 58 CO 0.45 0.28 0.28 -0.70 0.00 0.00 0.00 175.10 175.41 1rak s GLU 59 N -0.63 2.18 0.04 2.72 2.56 -0.14 -4.84 118.70 120.60 1rak s GLU 59 Ca 0.06 -2.02 0.24 0.00 0.00 0.00 0.00 54.97 53.25 1rak s GLU 59 Cb -0.07 -3.64 1.01 0.00 2.00 0.00 0.00 34.13 33.43 1rak s GLU 59 CO 0.00 -1.11 1.77 -0.35 -0.56 0.00 0.00 175.26 175.02 1rak n PRO 60 N 4.29 0.04 -3.22 4.30 -0.04 -1.26 -0.79 135.00 138.32 1rak n PRO 60 Ca 0.00 0.12 -0.01 0.00 -0.04 0.00 0.00 63.50 63.57 1rak n PRO 60 Cb 0.40 -1.56 -0.03 0.00 -0.04 0.00 0.00 33.50 32.27 1rak n PRO 60 CO 0.00 0.00 0.00 -1.58 -0.04 0.00 0.00 175.50 173.88 1rak s HIS 61 N -3.03 -1.41 0.07 0.54 5.04 -1.24 -4.52 115.29 110.74 1rak s HIS 61 Ca 0.11 1.02 -0.07 0.00 -1.54 0.00 0.00 55.06 54.58 1rak s HIS 61 Cb 0.15 0.22 -0.01 0.00 0.04 0.00 0.00 32.58 32.98 1rak s HIS 61 CO 0.46 -0.94 0.14 -1.50 -2.34 0.00 0.00 174.74 170.56 1rak s ILE 62 N 2.72 0.15 -0.56 0.89 2.07 -0.85 -0.20 121.20 125.42 1rak s ILE 62 Ca 0.13 -1.22 -0.01 0.00 -1.41 0.00 0.00 60.65 58.13 1rak s ILE 62 Cb -0.13 -1.24 0.14 0.00 0.13 0.00 0.00 42.46 41.37 1rak s ILE 62 CO -0.24 -0.68 0.35 -1.00 -1.91 0.00 0.00 174.94 171.47 1rak s HIS 63 N -3.50 3.42 -0.61 3.50 3.76 -0.30 -0.69 115.29 120.87 1rak s HIS 63 Ca 0.02 -2.75 0.25 0.00 -0.15 0.00 0.00 55.06 52.44 1rak s HIS 63 Cb 0.04 -3.13 0.87 0.00 1.11 0.00 0.00 32.58 31.47 1rak s HIS 63 CO -0.09 -0.85 1.75 -0.07 -0.85 0.00 0.00 174.74 174.63 1rak h LEU 64 N 7.15 0.00 0.00 0.89 3.38 -1.90 -2.44 115.31 122.39 1rak h LEU 64 Ca -0.05 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.90 1rak h LEU 64 Cb 0.96 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.71 1rak h LEU 64 CO 0.70 0.00 -0.19 -2.24 0.09 0.00 0.00 178.44 176.80 1rak h ASP 65 N 0.00 0.00 0.00 -0.43 2.03 -1.92 -3.31 116.42 112.79 1rak h ASP 65 Ca 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 1rak h ASP 65 Cb 0.61 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.11 1rak h ASP 65 CO 0.00 0.12 -1.02 0.35 -1.03 0.00 0.00 179.24 177.65 1rak n THR 66 N -3.10 0.00 -1.74 1.15 -2.24 -1.16 -4.94 114.28 102.25 1rak n THR 66 Ca 0.03 -0.18 -0.41 0.00 -2.27 0.00 0.00 64.05 61.22 1rak n THR 66 Cb 0.58 0.78 0.01 0.00 -2.10 0.00 0.00 70.33 69.60 1rak n THR 66 CO 0.00 0.00 0.00 1.07 -0.57 0.00 0.00 175.07 175.57 1rak n THR 67 N -1.56 2.52 -1.21 4.28 5.66 -0.93 -2.65 114.28 120.38 1rak n THR 67 Ca 0.02 -0.50 -0.07 0.00 -3.05 0.00 0.00 64.05 60.44 1rak n THR 67 Cb 0.30 -1.74 -0.03 0.00 -1.55 0.00 0.00 70.33 67.31 1rak n THR 67 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1rak n GLN 68 N 0.06 -0.61 -0.10 1.09 1.13 -0.42 -4.78 117.38 113.75 1rak n GLN 68 Ca 0.05 0.72 0.05 0.00 -1.94 0.00 0.00 57.00 55.88 1rak n GLN 68 Cb 0.40 -4.54 0.10 0.00 0.11 0.00 0.00 30.24 26.31 1rak n GLN 68 CO 0.00 0.00 0.00 0.25 -1.44 0.00 0.00 177.06 175.87 1rak n THR 69 N -2.74 0.64 -1.64 5.09 -2.24 -0.28 -4.97 114.28 108.14 1rak n THR 69 Ca -0.07 -0.82 -0.47 0.00 -2.27 0.00 0.00 64.05 60.42 1rak n THR 69 Cb 0.27 0.76 -0.04 0.00 -2.10 0.00 0.00 70.33 69.21 1rak n THR 69 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1rak n ALA 70 N 0.46 0.45 -0.72 6.98 0.00 -0.73 -1.33 120.51 125.62 1rak n ALA 70 Ca 0.09 0.45 0.00 0.00 0.00 0.00 0.00 53.44 53.98 1rak n ALA 70 Cb 0.35 -2.22 0.00 0.00 0.00 0.00 0.00 19.45 17.58 1rak n ALA 70 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1rak n GLY 71 N 2.62 0.85 3.24 0.00 0.00 -1.25 -4.96 105.19 105.69 1rak n GLY 71 Ca 0.15 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.82 1rak n GLY 71 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1rak s GLN 72 N -0.28 2.82 0.00 1.61 -0.21 -0.44 -2.68 119.66 120.47 1rak s GLN 72 Ca 0.00 -1.01 0.26 0.00 0.02 0.00 0.00 55.36 54.64 1rak s GLN 72 Cb 0.00 -3.14 0.78 0.00 1.00 0.00 0.00 33.01 31.65 1rak s GLN 72 CO 0.00 -0.46 1.60 -0.35 -2.12 0.00 0.00 175.29 173.96 1rak n PRO 73 N 4.72 0.24 -4.13 2.91 -0.04 -1.26 -4.35 135.00 133.08 1rak n PRO 73 Ca -0.15 -0.11 -0.09 0.00 -0.04 0.00 0.00 63.50 63.10 1rak n PRO 73 Cb 0.46 -1.50 -0.10 0.00 -0.04 0.00 0.00 33.50 32.33 1rak n PRO 73 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 1rak s ASN 74 N -2.84 0.84 0.21 3.54 0.01 -1.09 -5.16 114.94 110.44 1rak s ASN 74 Ca 0.16 -1.01 -0.08 0.00 -0.71 0.00 0.00 52.86 51.22 1rak s ASN 74 Cb 0.18 0.14 -0.07 0.00 0.41 0.00 0.00 41.25 41.92 1rak s ASN 74 CO 0.61 -0.53 0.51 0.26 -1.51 0.00 0.00 177.10 176.43 1rak s TRP 75 N -3.76 3.44 -0.87 2.20 0.52 -1.26 -3.75 118.94 115.46 1rak s TRP 75 Ca 0.10 0.78 -0.25 0.00 0.02 0.00 0.00 56.10 56.75 1rak s TRP 75 Cb 0.07 -2.19 0.04 0.00 -1.15 0.00 0.00 33.47 30.24 1rak s TRP 75 CO -0.07 0.31 1.36 1.21 0.02 0.00 0.00 176.95 179.78 1rak s ASN 76 N -2.42 6.31 0.14 2.95 3.04 -1.26 -4.87 114.94 118.83 1rak s ASN 76 Ca 0.46 -0.91 -0.12 0.00 0.04 0.00 0.00 52.86 52.32 1rak s ASN 76 Cb -0.11 -2.56 -0.02 0.00 -1.54 0.00 0.00 41.25 37.01 1rak s ASN 76 CO 0.22 -1.69 1.52 1.56 -3.04 0.00 0.00 177.10 175.67 1rak h GLN 77 N 9.94 0.86 0.00 0.43 1.08 -1.95 -3.22 115.11 122.26 1rak h GLN 77 Ca -0.06 -0.37 0.00 0.00 -1.45 0.00 0.00 58.65 56.77 1rak h GLN 77 Cb 1.03 -0.03 0.00 0.00 -0.05 0.00 0.00 27.48 28.43 1rak h GLN 77 CO 1.35 1.01 0.00 0.66 -0.95 0.00 0.00 178.83 180.90 1rak h SER 78 N 0.68 0.00 -3.27 1.46 4.64 -1.99 -3.47 113.55 111.61 1rak h SER 78 Ca 0.10 0.00 -0.27 0.00 -0.47 0.00 0.00 61.79 61.14 1rak h SER 78 Cb 0.74 0.00 0.05 0.00 -0.31 0.00 0.00 62.40 62.88 1rak h SER 78 CO 0.06 0.00 -0.41 0.61 -0.87 0.00 0.00 176.83 176.21 1rak n GLY 79 N 0.97 -0.12 3.59 -0.77 0.00 -1.22 -5.03 105.19 102.62 1rak n GLY 79 Ca 0.04 -0.16 -0.24 0.00 0.00 0.00 0.00 46.02 45.67 1rak n GLY 79 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1rak s THR 80 N -2.99 3.01 0.17 2.61 -4.23 -1.26 -4.21 115.64 108.73 1rak s THR 80 Ca 0.22 -2.06 -0.14 0.00 -1.18 0.00 0.00 61.69 58.53 1rak s THR 80 Cb -0.10 -2.68 0.06 0.00 1.34 0.00 0.00 72.50 71.12 1rak s THR 80 CO 0.28 -0.35 1.79 0.25 -0.54 0.00 0.00 174.62 176.05 1rak h LEU 81 N 1.98 0.66 -0.30 4.79 5.85 -1.96 -1.46 115.31 124.87 1rak h LEU 81 Ca -0.43 -0.08 -0.02 0.00 0.84 0.00 0.00 57.88 58.20 1rak h LEU 81 Cb 1.25 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 42.10 1rak h LEU 81 CO 0.61 0.55 0.12 -0.26 -0.34 0.00 0.00 178.44 179.12 1rak h PHE 82 N 0.73 0.46 -0.06 1.25 -1.00 -1.97 -1.23 116.94 115.12 1rak h PHE 82 Ca 0.19 -0.04 -0.12 0.00 2.81 0.00 0.00 57.97 60.82 1rak h PHE 82 Cb 0.02 -0.14 -0.01 0.00 3.61 0.00 0.00 35.95 39.43 1rak h PHE 82 CO -0.02 0.45 -0.49 1.49 -1.61 0.00 0.00 178.31 178.13 1rak h GLU 83 N 0.34 0.16 -0.78 1.51 4.81 -1.97 -2.74 114.58 115.91 1rak h GLU 83 Ca 0.10 -0.09 0.04 0.00 -0.13 0.00 0.00 59.36 59.28 1rak h GLU 83 Cb 0.19 0.01 -0.05 0.00 0.63 0.00 0.00 28.75 29.53 1rak h GLU 83 CO -0.01 0.62 0.49 0.78 -0.73 0.00 0.00 179.01 180.16 1rak h GLY 84 N 1.39 1.13 1.42 1.92 0.00 -0.70 0.07 103.07 108.30 1rak h GLY 84 Ca 0.00 -0.36 -0.08 0.00 0.00 0.00 0.00 47.33 46.89 1rak h GLY 84 CO 0.07 0.30 -0.10 -2.22 0.00 0.00 0.00 176.54 174.58 1rak h ILE 85 N 0.94 1.25 -0.38 2.60 2.04 -1.02 0.11 117.51 123.04 1rak h ILE 85 Ca 0.32 -1.11 -0.09 0.00 1.00 0.00 0.00 64.86 64.98 1rak h ILE 85 Cb 0.05 1.06 -0.01 0.00 -0.74 0.00 0.00 36.82 37.18 1rak h ILE 85 CO -0.13 0.37 -0.11 -0.08 0.00 0.00 0.00 178.15 178.21 1rak h GLU 86 N 0.63 0.74 -0.55 2.37 4.57 -1.06 -0.65 114.58 120.63 1rak h GLU 86 Ca 0.11 -0.29 -0.09 0.00 -1.18 0.00 0.00 59.36 57.91 1rak h GLU 86 Cb 0.55 -0.04 -0.02 0.00 -0.16 0.00 0.00 28.75 29.08 1rak h GLU 86 CO 0.03 0.90 -0.02 0.00 -1.18 0.00 0.00 179.01 178.74 1rak h ARG 87 N 0.55 0.97 -0.70 1.92 2.47 -0.82 -2.65 114.38 116.12 1rak h ARG 87 Ca 0.09 -0.30 -0.07 0.00 -1.26 0.00 0.00 59.98 58.44 1rak h ARG 87 Cb 0.63 -0.09 -0.03 0.00 -1.65 0.00 0.00 29.97 28.83 1rak h ARG 87 CO 0.04 0.97 0.15 2.35 0.56 0.00 0.00 179.97 184.03 1rak h TRP 88 N 0.89 1.19 -1.01 3.04 -0.00 -0.84 -2.58 115.95 116.64 1rak h TRP 88 Ca 0.16 -0.15 0.09 0.00 -0.00 0.00 0.00 58.89 58.99 1rak h TRP 88 Cb 0.55 -0.33 -0.07 0.00 -0.00 0.00 0.00 29.16 29.30 1rak h TRP 88 CO 0.03 0.98 0.64 0.00 -0.00 0.00 0.00 178.44 180.09 1rak h ALA 89 N 1.09 1.45 -0.68 2.65 0.00 -0.78 0.52 119.26 123.51 1rak h ALA 89 Ca 0.22 -0.01 -0.07 0.00 0.00 0.00 0.00 54.91 55.05 1rak h ALA 89 Cb 0.40 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.89 1rak h ALA 89 CO 0.01 0.36 0.17 0.93 0.00 0.00 0.00 179.25 180.71 1rak h GLU 90 N 1.11 1.08 -0.03 0.00 5.08 -1.19 -2.79 114.58 117.84 1rak h GLU 90 Ca 0.46 -0.25 -0.21 0.00 -1.00 0.00 0.00 59.36 58.36 1rak h GLU 90 Cb 0.30 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 29.40 1rak h GLU 90 CO -0.21 0.95 -0.88 -0.09 -1.00 0.00 0.00 179.01 177.78 1rak h ARG 91 N 1.02 0.43 -0.28 2.33 9.65 -0.81 -3.22 114.38 123.49 1rak h ARG 91 Ca 0.22 -0.42 -0.00 0.00 -1.10 0.00 0.00 59.98 58.67 1rak h ARG 91 Cb 0.35 0.11 -0.01 0.00 -1.39 0.00 0.00 29.97 29.03 1rak h ARG 91 CO 0.00 1.08 0.17 -0.22 2.80 0.00 0.00 179.97 183.80 1rak h LYS 92 N 0.26 0.38 0.00 0.20 3.64 0.14 -0.52 116.57 120.66 1rak h LYS 92 Ca -0.07 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.29 1rak h LYS 92 Cb 1.50 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 33.24 1rak h LYS 92 CO 0.15 0.26 0.00 0.00 -2.27 0.00 0.00 179.45 177.60 1rak n ALA 93 N -2.49 1.62 0.20 5.00 0.00 -1.07 -2.57 120.51 121.20 1rak n ALA 93 Ca 0.01 0.07 0.08 0.00 0.00 0.00 0.00 53.44 53.60 1rak n ALA 93 Cb 0.08 -1.36 0.15 0.00 0.00 0.00 0.00 19.45 18.32 1rak n ALA 93 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1rak n LEU 94 N -2.12 2.86 -4.76 0.00 4.77 -0.21 -5.03 117.00 112.51 1rak n LEU 94 Ca 0.02 -1.51 -0.38 0.00 -0.03 0.00 0.00 56.01 54.11 1rak n LEU 94 Cb 0.21 -0.17 0.02 0.00 -2.33 0.00 0.00 43.42 41.15 1rak n LEU 94 CO 0.18 0.63 0.96 -0.76 -1.33 0.00 0.00 177.39 177.07 1rak s LEU 95 N -1.17 3.97 0.06 2.23 1.43 -1.06 -5.04 118.68 119.09 1rak s LEU 95 Ca 0.27 2.66 0.02 0.00 -1.03 0.00 0.00 54.13 56.04 1rak s LEU 95 Cb 0.16 -4.18 -0.03 0.00 0.03 0.00 0.00 46.19 42.17 1rak s LEU 95 CO 0.22 -1.27 -0.07 0.42 0.23 0.00 0.00 176.35 175.88 1rak s THR 96 N -1.34 0.55 0.13 5.49 -4.23 -1.26 -5.05 115.64 109.93 1rak s THR 96 Ca 0.66 -1.48 -0.27 0.00 -1.18 0.00 0.00 61.69 59.43 1rak s THR 96 Cb -0.38 -1.10 -0.03 0.00 1.34 0.00 0.00 72.50 72.33 1rak s THR 96 CO 0.46 -0.64 1.60 -0.74 -0.54 0.00 0.00 174.62 174.76 1rak h HIS 97 N 3.77 -0.99 -0.31 3.99 2.76 -1.97 -1.87 115.15 120.53 1rak h HIS 97 Ca -0.35 0.04 -0.06 0.00 -2.20 0.00 0.00 60.37 57.80 1rak h HIS 97 Cb 1.18 0.45 -0.02 0.00 1.55 0.00 0.00 27.41 30.58 1rak h HIS 97 CO 0.62 -0.43 -0.06 -0.44 -1.30 0.00 0.00 177.93 176.32 1rak h ASP 98 N -0.43 0.48 0.01 3.26 3.45 -1.97 -2.17 116.42 119.05 1rak h ASP 98 Ca 0.09 -0.10 0.01 0.00 0.43 0.00 0.00 57.03 57.46 1rak h ASP 98 Cb 0.58 -0.13 -0.02 0.00 -0.56 0.00 0.00 39.33 39.20 1rak h ASP 98 CO -0.37 0.59 -0.09 -0.78 -1.57 0.00 0.00 179.24 177.02 1rak h ASP 99 N 0.47 -0.25 -0.33 6.45 -0.00 -1.85 -0.97 116.42 119.95 1rak h ASP 99 Ca 0.10 0.04 -0.02 0.00 -0.00 0.00 0.00 57.03 57.14 1rak h ASP 99 Cb 0.40 0.10 -0.01 0.00 -0.00 0.00 0.00 39.33 39.82 1rak h ASP 99 CO 0.02 -0.13 0.13 0.58 -0.00 0.00 0.00 179.24 179.84 1rak h VAL 100 N -0.16 1.18 -0.70 2.25 2.07 -1.13 -2.41 116.25 117.35 1rak h VAL 100 Ca 0.03 -0.56 -0.03 0.00 0.82 0.00 0.00 66.70 66.97 1rak h VAL 100 Cb 0.19 0.94 -0.03 0.00 -1.52 0.00 0.00 31.29 30.87 1rak h VAL 100 CO -0.08 0.20 0.33 0.11 0.02 0.00 0.00 177.57 178.15 1rak h LYS 101 N 0.39 1.01 -0.24 1.57 1.57 -1.25 -0.98 116.57 118.63 1rak h LYS 101 Ca 0.11 -0.15 -0.02 0.00 -1.87 0.00 0.00 60.65 58.72 1rak h LYS 101 Cb 0.18 -0.18 -0.01 0.00 0.08 0.00 0.00 32.23 32.30 1rak h LYS 101 CO -0.01 0.80 0.07 1.96 -0.57 0.00 0.00 179.45 181.70 1rak h GLN 102 N 0.98 0.38 -0.42 3.15 4.20 -1.09 -1.08 115.11 121.23 1rak h GLN 102 Ca 0.24 -0.09 -0.10 0.00 0.06 0.00 0.00 58.65 58.76 1rak h GLN 102 Cb 0.13 -0.05 -0.01 0.00 0.30 0.00 0.00 27.48 27.84 1rak h GLN 102 CO -0.03 0.47 -0.13 0.00 -0.67 0.00 0.00 178.83 178.47 1rak h ARG 103 N 0.22 0.83 -0.39 1.46 3.08 -1.34 -1.83 114.38 116.42 1rak h ARG 103 Ca 0.08 -0.33 0.00 0.00 0.07 0.00 0.00 59.98 59.79 1rak h ARG 103 Cb 0.25 -0.04 -0.02 0.00 0.08 0.00 0.00 29.97 30.24 1rak h ARG 103 CO -0.00 0.96 0.24 0.00 -1.07 0.00 0.00 179.97 180.10 1rak h ALA 104 N 0.84 0.49 -0.35 0.04 0.00 -1.13 -2.41 119.26 116.74 1rak h ALA 104 Ca 0.10 -0.05 -0.04 0.00 0.00 0.00 0.00 54.91 54.93 1rak h ALA 104 Cb 0.67 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.29 1rak h ALA 104 CO 0.05 -0.03 0.05 -1.49 0.00 0.00 0.00 179.25 177.83 1rak h TRP 105 N 0.51 0.52 -0.20 0.00 4.06 -1.10 -0.10 115.95 119.63 1rak h TRP 105 Ca 0.14 -0.04 -0.00 0.00 2.06 0.00 0.00 58.89 61.05 1rak h TRP 105 Cb -0.02 -0.16 -0.01 0.00 -1.00 0.00 0.00 29.16 27.97 1rak h TRP 105 CO -0.04 0.48 0.12 0.37 -3.56 0.00 0.00 178.44 175.80 1rak h GLN 106 N 0.50 0.28 -0.26 0.49 4.15 -0.85 -1.09 115.11 118.34 1rak h GLN 106 Ca 0.11 -0.03 -0.15 0.00 0.77 0.00 0.00 58.65 59.36 1rak h GLN 106 Cb 0.24 -0.06 -0.01 0.00 0.21 0.00 0.00 27.48 27.87 1rak h GLN 106 CO 0.00 0.25 -0.44 1.15 -1.93 0.00 0.00 178.83 177.86 1rak h THR 107 N 0.24 1.30 -0.68 2.39 2.02 -1.23 -2.97 112.91 113.97 1rak h THR 107 Ca 0.07 -1.63 -0.01 0.00 0.77 0.00 0.00 66.41 65.61 1rak h THR 107 Cb 0.05 1.57 -0.03 0.00 -1.74 0.00 0.00 68.15 67.99 1rak h THR 107 CO -0.01 0.52 0.38 -0.07 0.37 0.00 0.00 175.52 176.70 1rak h LEU 108 N 0.53 0.83 -0.88 2.58 3.38 -0.79 -0.98 115.31 119.99 1rak h LEU 108 Ca 0.04 -0.06 -0.07 0.00 0.09 0.00 0.00 57.88 57.87 1rak h LEU 108 Cb 0.98 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 41.49 1rak h LEU 108 CO 0.09 0.67 0.03 0.11 0.09 0.00 0.00 178.44 179.43 1rak h LYS 109 N 0.95 0.86 -0.73 1.13 1.57 -1.07 0.35 116.57 119.64 1rak h LYS 109 Ca 0.24 -0.23 -0.05 0.00 -1.87 0.00 0.00 60.65 58.74 1rak h LYS 109 Cb 0.02 -0.10 -0.03 0.00 0.08 0.00 0.00 32.23 32.19 1rak h LYS 109 CO -0.04 0.84 0.24 -1.49 -0.57 0.00 0.00 179.45 178.43 1rak h TRP 110 N 0.81 1.15 -0.49 -1.35 4.06 -1.20 -1.60 115.95 117.32 1rak h TRP 110 Ca 0.16 -0.11 -0.05 0.00 2.06 0.00 0.00 58.89 60.95 1rak h TRP 110 Cb 0.44 -0.34 -0.02 0.00 -1.00 0.00 0.00 29.16 28.24 1rak h TRP 110 CO 0.03 0.90 0.12 1.96 -3.56 0.00 0.00 178.44 177.88 1rak h GLN 111 N 1.07 0.79 -0.59 0.49 4.20 -0.46 -1.19 115.11 119.42 1rak h GLN 111 Ca 0.24 -0.19 0.01 0.00 0.06 0.00 0.00 58.65 58.77 1rak h GLN 111 Cb 0.28 -0.10 -0.03 0.00 0.30 0.00 0.00 27.48 27.93 1rak h GLN 111 CO -0.01 0.77 0.38 0.82 -0.67 0.00 0.00 178.83 180.12 1rak h ILE 112 N 0.68 1.13 0.00 2.54 2.04 -0.70 -1.05 117.51 122.15 1rak h ILE 112 Ca 0.15 -0.26 -0.01 0.00 1.00 0.00 0.00 64.86 65.74 1rak h ILE 112 Cb 0.34 0.29 -0.00 0.00 -0.74 0.00 0.00 36.82 36.70 1rak h ILE 112 CO 0.00 0.14 -0.06 0.00 0.00 0.00 0.00 178.15 178.24 1rak h ALA 113 N 1.23 1.82 -0.44 1.87 0.00 -1.02 -2.04 119.26 120.68 1rak h ALA 113 Ca 0.22 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.08 1rak h ALA 113 Cb -0.06 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.72 1rak h ALA 113 CO -0.06 0.07 0.00 0.09 0.00 0.00 0.00 179.25 179.35 1rak n ASN 114 N -4.35 4.57 -1.14 0.00 3.02 -0.47 -4.63 115.26 112.26 1rak n ASN 114 Ca -0.03 -2.70 -0.13 0.00 -0.03 0.00 0.00 54.58 51.69 1rak n ASN 114 Cb 0.14 -0.64 -0.04 0.00 -0.61 0.00 0.00 39.78 38.63 1rak n ASN 114 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1rak n GLY 115 N 0.48 1.01 3.58 7.41 0.00 -0.77 -4.82 105.19 112.08 1rak n GLY 115 Ca 0.21 -0.39 -0.40 0.00 0.00 0.00 0.00 46.02 45.44 1rak n GLY 115 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1rak s ILE 116 N -2.53 5.12 -1.12 -0.61 1.01 -0.51 -1.47 121.20 121.09 1rak s ILE 116 Ca 0.00 0.39 0.10 0.00 0.00 0.00 0.00 60.65 61.13 1rak s ILE 116 Cb 0.00 -3.82 0.05 0.00 0.01 0.00 0.00 42.46 38.70 1rak s ILE 116 CO 0.00 -0.03 0.75 0.00 0.00 0.00 0.00 174.94 175.66 1rak n GLN 117 N 5.49 0.90 -3.87 2.79 6.02 -1.02 -4.20 117.38 123.48 1rak n GLN 117 Ca -0.07 -0.93 -0.20 0.00 -0.01 0.00 0.00 57.00 55.79 1rak n GLN 117 Cb 0.50 -1.15 -0.17 0.00 1.02 0.00 0.00 30.24 30.44 1rak n GLN 117 CO 0.00 0.00 0.00 -1.01 -1.01 0.00 0.00 177.06 175.04 1rak s HIS 118 N -0.97 0.45 -0.02 1.08 3.76 -1.25 -1.12 115.29 117.23 1rak s HIS 118 Ca 0.10 -0.05 0.00 0.00 -0.15 0.00 0.00 55.06 54.97 1rak s HIS 118 Cb 0.08 -0.58 0.01 0.00 1.11 0.00 0.00 32.58 33.21 1rak s HIS 118 CO 0.16 -0.21 -0.00 0.08 -0.85 0.00 0.00 174.74 173.91 1rak s VAL 119 N 1.47 0.13 -0.28 -0.90 1.01 -0.85 -0.97 120.40 120.01 1rak s VAL 119 Ca -0.03 0.03 -0.03 0.00 0.00 0.00 0.00 61.98 61.95 1rak s VAL 119 Cb -0.13 -0.18 0.03 0.00 0.00 0.00 0.00 36.38 36.10 1rak s VAL 119 CO -0.03 0.09 -0.01 -0.60 0.00 0.00 0.00 175.10 174.55 1rak s ARG 120 N 0.55 2.71 -0.12 2.72 3.52 0.03 -0.37 118.95 128.00 1rak s ARG 120 Ca -0.05 -1.07 -0.03 0.00 -0.13 0.00 0.00 55.73 54.45 1rak s ARG 120 Cb -0.08 -3.13 -0.03 0.00 -1.56 0.00 0.00 34.95 30.15 1rak s ARG 120 CO -0.01 -0.50 -0.01 -0.08 -0.81 0.00 0.00 175.30 173.89 1rak s THR 121 N 1.33 4.17 0.28 4.11 -1.32 -0.04 -2.00 115.64 122.16 1rak s THR 121 Ca -0.02 -0.28 -0.15 0.00 -1.21 0.00 0.00 61.69 60.03 1rak s THR 121 Cb -0.18 -2.78 -0.08 0.00 -1.51 0.00 0.00 72.50 67.94 1rak s THR 121 CO -0.02 0.55 0.69 -1.00 -2.21 0.00 0.00 174.62 172.63 1rak s HIS 122 N -0.35 3.45 -0.05 9.09 3.76 0.13 -0.46 115.29 130.85 1rak s HIS 122 Ca 0.07 1.17 -0.00 0.00 -0.15 0.00 0.00 55.06 56.15 1rak s HIS 122 Cb -0.12 -2.49 0.03 0.00 1.11 0.00 0.00 32.58 31.10 1rak s HIS 122 CO 0.02 0.19 -0.01 0.08 -0.85 0.00 0.00 174.74 174.18 1rak s VAL 123 N -1.83 0.32 -0.09 -0.90 1.01 -0.27 -4.06 120.40 114.58 1rak s VAL 123 Ca 0.50 0.07 -0.29 0.00 0.00 0.00 0.00 61.98 62.25 1rak s VAL 123 Cb -0.12 -0.43 -0.05 0.00 0.00 0.00 0.00 36.38 35.78 1rak s VAL 123 CO 0.19 0.21 1.71 -0.62 0.00 0.00 0.00 175.10 176.58 1rak s ASP 124 N 1.40 6.51 -0.17 3.32 3.68 -1.26 -0.98 116.67 129.18 1rak s ASP 124 Ca -0.04 2.12 0.16 0.00 2.13 0.00 0.00 52.55 56.92 1rak s ASP 124 Cb -0.13 -2.53 0.55 0.00 -1.45 0.00 0.00 42.92 39.36 1rak s ASP 124 CO -0.03 -1.07 1.45 1.33 0.13 0.00 0.00 175.17 176.98 1rak n VAL 125 N 5.82 2.25 -2.43 1.11 0.24 0.08 -4.68 118.33 120.72 1rak n VAL 125 Ca 0.19 -1.76 -0.42 0.00 -2.04 0.00 0.00 64.34 60.30 1rak n VAL 125 Cb 0.43 -0.20 0.01 0.00 -1.47 0.00 0.00 33.84 32.61 1rak n VAL 125 CO 0.00 0.00 0.00 -1.20 -2.14 0.00 0.00 176.83 173.49 1rak n SER 126 N -0.30 5.67 -3.21 -1.34 7.64 -1.26 -4.65 113.62 116.18 1rak n SER 126 Ca 0.21 -3.19 0.04 0.00 1.01 0.00 0.00 58.87 56.95 1rak n SER 126 Cb 0.90 -1.42 -0.02 0.00 -1.01 0.00 0.00 64.21 62.66 1rak n SER 126 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1rak s ASP 127 N 0.24 -0.96 0.56 6.43 3.68 -1.26 -4.92 116.67 120.43 1rak s ASP 127 Ca 0.39 0.71 0.26 0.00 2.13 0.00 0.00 52.55 56.04 1rak s ASP 127 Cb 0.10 1.85 1.53 0.00 -1.45 0.00 0.00 42.92 44.94 1rak s ASP 127 CO 0.01 -0.18 2.08 0.00 0.13 0.00 0.00 175.17 177.21 1rak h ALA 128 N 7.95 2.02 0.00 3.66 0.00 -1.95 -0.84 119.26 130.11 1rak h ALA 128 Ca -0.19 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.72 1rak h ALA 128 Cb 1.16 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.97 1rak h ALA 128 CO 0.10 -0.35 -0.15 1.79 0.00 0.00 0.00 179.25 180.64 1rak h THR 129 N 0.00 0.00 -6.60 0.00 1.35 -1.97 -3.47 112.91 102.22 1rak h THR 129 Ca 0.12 -0.73 -0.53 0.00 -0.55 0.00 0.00 66.41 64.72 1rak h THR 129 Cb 0.57 1.64 -0.21 0.00 -1.73 0.00 0.00 68.15 68.43 1rak h THR 129 CO -0.00 0.00 -0.79 0.18 -0.25 0.00 0.00 175.52 174.66 1rak n LEU 130 N -2.62 -1.57 0.11 3.87 4.77 -0.32 -4.87 117.00 116.38 1rak n LEU 130 Ca 0.04 -0.92 -0.13 0.00 -0.03 0.00 0.00 56.01 54.97 1rak n LEU 130 Cb 0.48 -2.02 -0.06 0.00 -2.33 0.00 0.00 43.42 39.49 1rak n LEU 130 CO 0.33 0.25 0.77 0.74 -1.33 0.00 0.00 177.39 178.15 1rak h THR 131 N -1.34 0.66 -0.59 -5.08 2.02 -1.92 -1.99 112.91 104.67 1rak h THR 131 Ca -0.56 0.00 -0.07 0.00 0.77 0.00 0.00 66.41 66.55 1rak h THR 131 Cb 1.36 0.66 -0.03 0.00 -1.74 0.00 0.00 68.15 68.41 1rak h THR 131 CO 0.75 0.00 0.10 0.00 0.37 0.00 0.00 175.52 176.74 1rak h ALA 132 N 0.51 1.06 -0.40 6.16 0.00 -1.89 -2.52 119.26 122.19 1rak h ALA 132 Ca 0.01 -0.25 -0.01 0.00 0.00 0.00 0.00 54.91 54.66 1rak h ALA 132 Cb 0.31 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 1rak h ALA 132 CO -0.05 0.61 0.22 1.25 0.00 0.00 0.00 179.25 181.27 1rak h LEU 133 N 0.90 0.50 -0.91 0.00 5.85 -1.79 0.79 115.31 120.65 1rak h LEU 133 Ca 0.18 -0.09 -0.01 0.00 0.84 0.00 0.00 57.88 58.80 1rak h LEU 133 Cb 0.39 -0.13 -0.04 0.00 0.37 0.00 0.00 40.66 41.25 1rak h LEU 133 CO 0.01 0.44 0.52 0.11 -0.34 0.00 0.00 178.44 179.18 1rak h LYS 134 N 0.51 1.26 -0.32 1.25 1.57 -1.21 -0.87 116.57 118.75 1rak h LYS 134 Ca 0.14 -0.13 -0.05 0.00 -1.87 0.00 0.00 60.65 58.74 1rak h LYS 134 Cb 0.06 -0.25 -0.01 0.00 0.08 0.00 0.00 32.23 32.10 1rak h LYS 134 CO -0.02 0.90 0.02 0.00 -0.57 0.00 0.00 179.45 179.78 1rak h ALA 135 N 1.28 0.43 -0.14 3.86 0.00 -1.16 -3.11 119.26 120.41 1rak h ALA 135 Ca 0.32 -0.23 -0.05 0.00 0.00 0.00 0.00 54.91 54.95 1rak h ALA 135 Cb -0.00 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 1rak h ALA 135 CO -0.06 0.17 -0.16 1.98 0.00 0.00 0.00 179.25 181.19 1rak h MET 136 N 0.36 0.23 -0.17 0.00 1.85 -0.41 -1.53 114.93 115.27 1rak h MET 136 Ca 0.09 -0.06 -0.06 0.00 -0.61 0.00 0.00 59.70 59.06 1rak h MET 136 Cb 0.42 -0.03 -0.01 0.00 0.43 0.00 0.00 31.60 32.40 1rak h MET 136 CO 0.01 0.40 -0.18 -0.07 -0.40 0.00 0.00 176.91 176.68 1rak h LEU 137 N 0.22 0.27 -0.07 3.39 3.38 -1.11 0.50 115.31 121.89 1rak h LEU 137 Ca 0.04 -0.07 -0.17 0.00 0.09 0.00 0.00 57.88 57.78 1rak h LEU 137 Cb 0.42 -0.07 0.01 0.00 0.09 0.00 0.00 40.66 41.10 1rak h LEU 137 CO 0.03 0.47 -0.61 -0.33 0.09 0.00 0.00 178.44 178.09 1rak h GLU 138 N 0.26 0.54 -0.89 1.13 5.08 -1.31 -3.15 114.58 116.25 1rak h GLU 138 Ca 0.05 -0.49 0.06 0.00 -1.00 0.00 0.00 59.36 57.98 1rak h GLU 138 Cb 0.47 0.12 -0.06 0.00 0.50 0.00 0.00 28.75 29.78 1rak h GLU 138 CO 0.03 1.12 0.56 0.28 -1.00 0.00 0.00 179.01 179.99 1rak h VAL 139 N 0.14 1.06 -0.68 3.13 2.07 -0.88 -0.97 116.25 120.11 1rak h VAL 139 Ca -0.06 -0.35 0.09 0.00 0.82 0.00 0.00 66.70 67.21 1rak h VAL 139 Cb 1.27 -0.05 -0.07 0.00 -1.52 0.00 0.00 31.29 30.92 1rak h VAL 139 CO 0.12 0.19 0.32 0.50 0.02 0.00 0.00 177.57 178.72 1rak h LYS 140 N 1.03 0.53 -0.32 1.57 3.64 -0.91 0.70 116.57 122.80 1rak h LYS 140 Ca 0.38 -0.03 -0.15 0.00 -1.27 0.00 0.00 60.65 59.58 1rak h LYS 140 Cb 0.15 -0.12 -0.00 0.00 -0.41 0.00 0.00 32.23 31.84 1rak h LYS 140 CO -0.17 0.35 -0.38 1.96 -2.27 0.00 0.00 179.45 178.94 1rak h GLN 141 N 0.55 0.82 -0.47 1.90 4.20 -1.33 -2.80 115.11 117.98 1rak h GLN 141 Ca 0.34 -0.46 -0.08 0.00 0.06 0.00 0.00 58.65 58.51 1rak h GLN 141 Cb 0.37 0.03 -0.02 0.00 0.30 0.00 0.00 27.48 28.16 1rak h GLN 141 CO -0.28 1.09 -0.05 0.93 -0.67 0.00 0.00 178.83 179.86 1rak h GLU 142 N 0.60 0.81 -0.00 1.46 5.08 -0.50 -3.08 114.58 118.94 1rak h GLU 142 Ca 0.04 -0.24 0.00 0.00 -1.00 0.00 0.00 59.36 58.16 1rak h GLU 142 Cb 0.97 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 30.14 1rak h GLU 142 CO 0.09 0.84 -0.28 1.55 -1.00 0.00 0.00 179.01 180.21 1rak n VAL 143 N -4.19 0.00 -0.37 3.13 3.14 0.17 -4.45 118.33 115.76 1rak n VAL 143 Ca 0.02 -0.08 0.29 0.00 -2.96 0.00 0.00 64.34 61.61 1rak n VAL 143 Cb 0.33 0.23 0.57 0.00 -1.06 0.00 0.00 33.84 33.91 1rak n VAL 143 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1rak h ALA 144 N 3.46 2.46 0.00 1.55 0.00 -1.40 0.84 119.26 126.17 1rak h ALA 144 Ca 0.00 0.08 -0.00 0.00 0.00 0.00 0.00 54.91 54.99 1rak h ALA 144 Cb 0.48 0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.37 1rak h ALA 144 CO 0.00 -0.95 -0.00 -1.35 0.00 0.00 0.00 179.25 176.95 1rak h PRO 145 N 0.26 0.00 0.00 0.00 0.11 -1.83 -3.31 132.00 127.23 1rak h PRO 145 Ca 0.68 0.00 -0.09 0.00 0.11 0.00 0.00 66.00 66.70 1rak h PRO 145 Cb 1.94 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 33.04 1rak h PRO 145 CO -0.33 0.00 -1.34 0.91 -0.21 0.00 0.00 178.00 177.03 1rak n TRP 146 N -3.09 0.00 -3.81 0.65 8.01 0.14 -5.02 117.44 114.32 1rak n TRP 146 Ca -0.01 0.00 -0.13 0.00 -1.31 0.00 0.00 57.50 56.04 1rak n TRP 146 Cb 0.18 -0.24 -0.15 0.00 -2.01 0.00 0.00 31.31 29.09 1rak n TRP 146 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.69 177.10 1rak s ILE 147 N -2.12 -0.03 -0.51 -0.99 1.01 -0.35 -4.64 121.20 113.57 1rak s ILE 147 Ca -0.04 0.10 -0.22 0.00 0.00 0.00 0.00 60.65 60.50 1rak s ILE 147 Cb 0.02 -0.08 0.04 0.00 0.01 0.00 0.00 42.46 42.45 1rak s ILE 147 CO 0.19 0.04 0.78 -0.62 0.00 0.00 0.00 174.94 175.33 1rak s ASP 148 N 0.55 6.30 -0.23 3.58 -1.08 -0.27 -3.64 116.67 121.87 1rak s ASP 148 Ca -0.04 -0.55 -0.12 0.00 -0.52 0.00 0.00 52.55 51.32 1rak s ASP 148 Cb -0.06 -2.36 -0.05 0.00 -1.46 0.00 0.00 42.92 38.99 1rak s ASP 148 CO -0.02 -1.03 0.22 -0.22 0.52 0.00 0.00 175.17 174.65 1rak s LEU 149 N 3.27 4.12 -0.10 -1.34 2.96 -1.26 -2.02 118.68 124.33 1rak s LEU 149 Ca 0.24 0.22 -0.06 0.00 -0.22 0.00 0.00 54.13 54.31 1rak s LEU 149 Cb -0.15 -2.21 -0.04 0.00 0.50 0.00 0.00 46.19 44.28 1rak s LEU 149 CO 0.17 0.03 0.12 -1.10 -1.32 0.00 0.00 176.35 174.25 1rak s GLN 150 N 1.14 3.36 -0.17 1.98 -0.21 0.50 -4.98 119.66 121.28 1rak s GLN 150 Ca 0.11 -0.20 -0.01 0.00 0.02 0.00 0.00 55.36 55.27 1rak s GLN 150 Cb -0.14 -3.11 -0.01 0.00 1.00 0.00 0.00 33.01 30.75 1rak s GLN 150 CO 0.05 0.75 -0.12 0.42 -2.12 0.00 0.00 175.29 174.28 1rak s ILE 151 N -1.05 2.95 -0.21 1.08 1.01 -1.26 -0.86 121.20 122.85 1rak s ILE 151 Ca 0.17 -0.67 -0.12 0.00 0.00 0.00 0.00 60.65 60.03 1rak s ILE 151 Cb -0.12 -2.27 -0.05 0.00 0.01 0.00 0.00 42.46 40.03 1rak s ILE 151 CO 0.06 0.49 0.22 -0.69 0.00 0.00 0.00 174.94 175.02 1rak s VAL 152 N 0.92 5.33 -0.71 2.92 1.01 0.39 -0.91 120.40 129.35 1rak s VAL 152 Ca -0.02 0.34 -0.27 0.00 0.00 0.00 0.00 61.98 62.02 1rak s VAL 152 Cb -0.15 -3.56 0.03 0.00 0.00 0.00 0.00 36.38 32.71 1rak s VAL 152 CO -0.01 0.36 1.27 0.00 0.00 0.00 0.00 175.10 176.72 1rak s ALA 153 N 0.85 2.79 -0.41 5.51 0.00 -0.05 -1.11 121.76 129.34 1rak s ALA 153 Ca 0.11 -1.25 -0.12 0.00 0.00 0.00 0.00 51.96 50.70 1rak s ALA 153 Cb -0.13 -4.22 0.04 0.00 0.00 0.00 0.00 23.12 18.82 1rak s ALA 153 CO 0.03 -3.17 0.27 0.12 0.00 0.00 0.00 175.76 173.01 1rak s PHE 154 N 5.62 3.26 -1.32 0.00 5.36 -0.15 -0.96 117.98 129.78 1rak s PHE 154 Ca 0.37 -0.99 -0.16 0.00 -0.96 0.00 0.00 56.93 55.19 1rak s PHE 154 Cb -0.08 -2.69 0.08 0.00 -0.34 0.00 0.00 43.02 39.99 1rak s PHE 154 CO 0.17 -0.70 1.82 -0.35 -1.46 0.00 0.00 175.22 174.70 1rak n PRO 155 N 5.05 3.17 -0.33 10.12 -0.04 -1.26 -0.74 135.00 150.97 1rak n PRO 155 Ca -0.11 -3.21 0.26 0.00 -0.04 0.00 0.00 63.50 60.39 1rak n PRO 155 Cb 0.45 -3.36 0.56 0.00 -0.04 0.00 0.00 33.50 31.12 1rak n PRO 155 CO 0.00 0.00 0.00 0.37 -0.04 0.00 0.00 175.50 175.83 1rak h GLN 156 N 7.04 0.29 -0.57 0.54 5.75 -1.92 0.11 115.11 126.35 1rak h GLN 156 Ca 0.46 -0.02 0.00 0.00 -0.15 0.00 0.00 58.65 58.94 1rak h GLN 156 Cb 0.80 -0.07 0.00 0.00 1.07 0.00 0.00 27.48 29.29 1rak h GLN 156 CO 1.54 0.19 0.00 0.39 -2.65 0.00 0.00 178.83 178.30 1rak n GLU 157 N -4.56 4.09 0.00 1.69 1.02 -1.26 -5.01 120.64 116.61 1rak n GLU 157 Ca 0.26 -2.97 0.00 0.00 -0.02 0.00 0.00 57.16 54.43 1rak n GLU 157 Cb 0.98 -2.02 0.00 0.00 -0.02 0.00 0.00 31.44 30.38 1rak n GLU 157 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1rak n GLY 158 N 0.74 2.08 0.10 0.62 0.00 0.03 -4.00 105.19 104.75 1rak n GLY 158 Ca 0.26 -1.85 -0.20 0.00 0.00 0.00 0.00 46.02 44.24 1rak n GLY 158 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1rak n ILE 159 N 1.88 1.52 0.44 -0.61 5.41 -1.26 -4.00 119.36 122.73 1rak n ILE 159 Ca 0.00 -0.00 0.12 0.00 1.00 0.00 0.00 62.75 63.87 1rak n ILE 159 Cb 0.00 -2.09 0.11 0.00 -0.71 0.00 0.00 39.64 36.95 1rak n ILE 159 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 176.55 176.48 1rak h LEU 160 N -1.00 0.00 -2.31 1.39 3.38 -1.91 -3.18 115.31 111.68 1rak h LEU 160 Ca -0.31 -0.17 0.00 0.00 0.09 0.00 0.00 57.88 57.49 1rak h LEU 160 Cb 1.20 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.95 1rak h LEU 160 CO -0.19 0.08 0.00 -1.20 0.09 0.00 0.00 178.44 177.23 1rak n SER 161 N -2.27 3.43 -4.18 -0.43 7.64 -1.26 -4.90 113.62 111.66 1rak n SER 161 Ca 0.02 -1.98 -0.24 0.00 1.01 0.00 0.00 58.87 57.67 1rak n SER 161 Cb 0.47 -0.28 -0.15 0.00 -1.01 0.00 0.00 64.21 63.24 1rak n SER 161 CO 0.00 0.00 0.00 -0.47 -3.01 0.00 0.00 175.04 171.56 1rak s TYR 162 N -1.44 1.58 0.04 1.43 6.14 -1.26 -4.90 117.35 118.94 1rak s TYR 162 Ca 0.40 -0.31 -0.34 0.00 0.64 0.00 0.00 57.07 57.46 1rak s TYR 162 Cb 0.23 -1.00 -0.13 0.00 0.42 0.00 0.00 41.96 41.49 1rak s TYR 162 CO 0.32 -0.00 1.75 -2.30 0.64 0.00 0.00 175.55 175.95 1rak n PRO 163 N 2.46 2.23 -2.07 4.97 -0.02 -1.26 -1.44 135.00 139.88 1rak n PRO 163 Ca -0.15 0.81 -0.19 0.00 -2.02 0.00 0.00 63.50 61.95 1rak n PRO 163 Cb 0.54 -2.63 -0.04 0.00 -0.02 0.00 0.00 33.50 31.35 1rak n PRO 163 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1rak n ASN 164 N 5.18 -5.31 -0.20 2.55 3.02 -1.26 -4.89 115.26 114.34 1rak n ASN 164 Ca 0.20 0.20 -0.01 0.00 -0.03 0.00 0.00 54.58 54.94 1rak n ASN 164 Cb 0.30 -4.55 0.10 0.00 -0.61 0.00 0.00 39.78 35.02 1rak n ASN 164 CO 0.00 0.00 0.00 1.23 -2.62 0.00 0.00 177.26 175.87 1rak h GLY 165 N 0.00 0.85 1.04 7.41 0.00 -1.33 -0.48 103.07 110.56 1rak h GLY 165 Ca -0.43 -0.16 -0.11 0.00 0.00 0.00 0.00 47.33 46.63 1rak h GLY 165 CO 0.55 0.04 -0.17 -2.09 0.00 0.00 0.00 176.54 174.88 1rak h GLU 166 N 0.48 0.88 -0.75 4.80 4.81 -1.83 -1.41 114.58 121.57 1rak h GLU 166 Ca 0.29 -0.37 -0.03 0.00 -0.13 0.00 0.00 59.36 59.12 1rak h GLU 166 Cb 0.29 -0.04 -0.03 0.00 0.63 0.00 0.00 28.75 29.61 1rak h GLU 166 CO -0.25 1.01 0.33 0.00 -0.73 0.00 0.00 179.01 179.37 1rak h ALA 167 N 0.85 0.96 -0.38 2.92 0.00 -1.83 -1.55 119.26 120.23 1rak h ALA 167 Ca 0.10 -0.17 -0.11 0.00 0.00 0.00 0.00 54.91 54.74 1rak h ALA 167 Cb 0.72 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 18.21 1rak h ALA 167 CO 0.06 0.56 -0.20 -0.07 0.00 0.00 0.00 179.25 179.59 1rak h LEU 168 N 1.06 0.73 -0.35 0.00 3.38 -0.98 0.04 115.31 119.18 1rak h LEU 168 Ca 0.25 -0.25 -0.02 0.00 0.09 0.00 0.00 57.88 57.96 1rak h LEU 168 Cb 0.16 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.70 1rak h LEU 168 CO -0.03 0.92 0.15 0.25 0.09 0.00 0.00 178.44 179.83 1rak h LEU 169 N 0.64 0.48 -0.70 1.67 5.85 -0.93 -0.91 115.31 121.40 1rak h LEU 169 Ca 0.09 -0.15 -0.10 0.00 0.84 0.00 0.00 57.88 58.56 1rak h LEU 169 Cb 0.69 -0.12 -0.02 0.00 0.37 0.00 0.00 40.66 41.58 1rak h LEU 169 CO 0.05 0.50 -0.11 -0.08 -0.34 0.00 0.00 178.44 178.46 1rak h GLU 170 N 0.42 0.89 -0.89 1.25 4.81 -1.10 -2.50 114.58 117.46 1rak h GLU 170 Ca 0.12 -0.31 0.01 0.00 -0.13 0.00 0.00 59.36 59.05 1rak h GLU 170 Cb 0.16 -0.07 -0.05 0.00 0.63 0.00 0.00 28.75 29.43 1rak h GLU 170 CO -0.01 0.95 0.59 1.49 -0.73 0.00 0.00 179.01 181.29 1rak h GLU 171 N 0.80 1.15 -0.76 1.92 4.81 -0.70 0.03 114.58 121.82 1rak h GLU 171 Ca 0.13 -0.07 -0.00 0.00 -0.13 0.00 0.00 59.36 59.29 1rak h GLU 171 Cb 0.63 -0.26 -0.04 0.00 0.63 0.00 0.00 28.75 29.71 1rak h GLU 171 CO 0.04 0.76 0.46 0.00 -0.73 0.00 0.00 179.01 179.54 1rak h ALA 172 N 1.33 1.38 -0.39 2.92 0.00 -0.84 -0.62 119.26 123.04 1rak h ALA 172 Ca 0.33 -0.08 -0.16 0.00 0.00 0.00 0.00 54.91 55.00 1rak h ALA 172 Cb -0.11 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.36 1rak h ALA 172 CO -0.08 0.54 -0.38 -0.07 0.00 0.00 0.00 179.25 179.26 1rak h LEU 173 N 1.05 1.00 -1.82 0.00 3.38 -0.89 -1.90 115.31 116.13 1rak h LEU 173 Ca 0.27 -0.45 -0.03 0.00 0.09 0.00 0.00 57.88 57.76 1rak h LEU 173 Cb -0.05 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 40.42 1rak h LEU 173 CO -0.05 1.26 -0.15 0.03 0.09 0.00 0.00 178.44 179.62 1rak h ARG 174 N 0.77 0.00 -0.00 1.13 3.08 -0.25 -1.20 114.38 117.91 1rak h ARG 174 Ca 0.06 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.11 1rak h ARG 174 Cb 0.97 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.02 1rak h ARG 174 CO 0.09 0.15 -0.12 1.28 -1.07 0.00 0.00 179.97 180.30 1rak n LEU 175 N -3.82 0.17 0.00 3.04 4.77 -0.31 -4.93 117.00 115.91 1rak n LEU 175 Ca -0.02 0.31 0.00 0.00 -0.03 0.00 0.00 56.01 56.27 1rak n LEU 175 Cb 0.25 -0.38 0.00 0.00 -2.33 0.00 0.00 43.42 40.95 1rak n LEU 175 CO 0.32 0.04 0.00 0.61 -1.33 0.00 0.00 177.39 177.03 1rak n GLY 176 N 1.45 1.15 3.74 -0.72 0.00 -0.45 -5.09 105.19 105.27 1rak n GLY 176 Ca 0.09 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.69 1rak n GLY 176 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rak n ALA 177 N -0.04 2.12 0.15 4.61 0.00 -0.74 -4.90 120.51 121.71 1rak n ALA 177 Ca 0.00 0.36 0.04 0.00 0.00 0.00 0.00 53.44 53.84 1rak n ALA 177 Cb 0.00 -2.39 0.04 0.00 0.00 0.00 0.00 19.45 17.11 1rak n ALA 177 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 1rak h ASP 178 N 3.43 0.00 -4.22 0.00 3.32 -1.38 -3.44 116.42 114.13 1rak h ASP 178 Ca -0.48 0.00 -0.31 0.00 0.02 0.00 0.00 57.03 56.26 1rak h ASP 178 Cb 1.25 0.00 -0.26 0.00 0.22 0.00 0.00 39.33 40.54 1rak h ASP 178 CO 0.68 0.40 -0.75 -0.69 -1.72 0.00 0.00 179.24 177.17 1rak s VAL 179 N -3.01 0.47 -0.19 -1.35 1.01 -0.67 -2.47 120.40 114.20 1rak s VAL 179 Ca 0.04 -0.54 -0.15 0.00 0.00 0.00 0.00 61.98 61.33 1rak s VAL 179 Cb 0.07 -0.45 -0.04 0.00 0.00 0.00 0.00 36.38 35.96 1rak s VAL 179 CO 0.74 -0.06 0.35 -0.69 0.00 0.00 0.00 175.10 175.44 1rak s VAL 180 N -0.58 5.24 0.49 2.92 1.01 0.37 -0.87 120.40 128.98 1rak s VAL 180 Ca -0.02 0.63 0.07 0.00 0.00 0.00 0.00 61.98 62.66 1rak s VAL 180 Cb -0.05 -3.69 0.02 0.00 0.00 0.00 0.00 36.38 32.66 1rak s VAL 180 CO 0.00 0.30 0.46 -0.83 0.00 0.00 0.00 175.10 175.04 1rak s GLY 181 N 0.85 2.15 0.17 4.51 0.00 -0.14 -1.32 107.32 113.54 1rak s GLY 181 Ca 0.18 -1.71 -0.24 0.00 0.00 0.00 0.00 44.72 42.94 1rak s GLY 181 CO 0.07 -1.78 0.90 0.00 0.00 0.00 0.00 173.10 172.29 1rak s ALA 182 N -2.61 -1.57 -0.46 3.20 0.00 -1.25 -4.59 121.76 114.49 1rak s ALA 182 Ca 0.46 0.09 0.07 0.00 0.00 0.00 0.00 51.96 52.58 1rak s ALA 182 Cb -0.03 0.68 0.26 0.00 0.00 0.00 0.00 23.12 24.02 1rak s ALA 182 CO 0.28 -1.01 0.81 1.51 0.00 0.00 0.00 175.76 177.34 1rak n ILE 183 N -0.45 -0.19 -0.28 0.00 3.06 -1.26 -1.11 119.36 119.13 1rak n ILE 183 Ca -0.06 -2.29 0.13 0.00 -2.50 0.00 0.00 62.75 58.03 1rak n ILE 183 Cb 0.60 0.53 0.39 0.00 0.54 0.00 0.00 39.64 41.71 1rak n ILE 183 CO 0.00 0.00 0.00 1.55 -2.50 0.00 0.00 176.55 175.60 1rak h PRO 184 N 3.84 0.64 0.00 9.51 0.13 -1.86 -1.22 132.00 143.04 1rak h PRO 184 Ca -0.08 -0.04 0.00 0.00 -0.87 0.00 0.00 66.00 65.02 1rak h PRO 184 Cb 1.00 -0.14 0.00 0.00 0.13 0.00 0.00 31.00 31.98 1rak h PRO 184 CO 0.35 0.42 0.00 -2.39 -0.23 0.00 0.00 178.00 176.15 1rak n HIS 185 N -4.58 0.25 0.94 1.56 1.44 -1.26 -2.29 115.22 111.29 1rak n HIS 185 Ca 0.18 0.10 0.11 0.00 -2.01 0.00 0.00 57.72 56.10 1rak n HIS 185 Cb 0.52 -0.66 -0.03 0.00 0.12 0.00 0.00 29.99 29.94 1rak n HIS 185 CO 0.00 0.00 0.00 0.34 -2.81 0.00 0.00 176.34 173.87 1rak n PHE 186 N -1.73 0.02 -1.49 -1.40 7.35 -0.47 -4.95 117.46 114.79 1rak n PHE 186 Ca 0.03 0.00 -0.33 0.00 -0.76 0.00 0.00 57.45 56.40 1rak n PHE 186 Cb 0.20 -0.10 0.08 0.00 0.35 0.00 0.00 39.48 40.01 1rak n PHE 186 CO 0.00 0.00 0.00 -1.21 -0.76 0.00 0.00 176.76 174.79 1rak s GLU 187 N -3.03 2.34 0.36 -4.13 0.41 -0.97 -4.86 118.70 108.83 1rak s GLU 187 Ca 0.08 1.52 0.08 0.00 -0.41 0.00 0.00 54.97 56.24 1rak s GLU 187 Cb 0.16 -1.88 0.79 0.00 -1.78 0.00 0.00 34.13 31.42 1rak s GLU 187 CO 0.83 -1.63 1.92 0.74 -0.49 0.00 0.00 175.26 176.63 1rak h PHE 188 N -0.37 0.77 -3.97 1.61 0.04 -1.92 -3.44 116.94 109.65 1rak h PHE 188 Ca -0.46 0.02 -0.19 0.00 2.80 0.00 0.00 57.97 60.13 1rak h PHE 188 Cb 1.27 -0.25 -0.15 0.00 2.20 0.00 0.00 35.95 39.02 1rak h PHE 188 CO 0.52 0.36 -0.69 0.95 -0.60 0.00 0.00 178.31 178.84 1rak s THR 189 N -5.66 0.52 0.28 -1.55 -4.23 -1.26 -5.03 115.64 98.70 1rak s THR 189 Ca -0.10 -1.90 -0.02 0.00 -1.18 0.00 0.00 61.69 58.49 1rak s THR 189 Cb 0.20 -1.67 0.27 0.00 1.34 0.00 0.00 72.50 72.64 1rak s THR 189 CO 0.78 -0.87 1.92 -0.09 -0.54 0.00 0.00 174.62 175.82 1rak h ARG 190 N 3.00 1.13 -0.59 3.99 2.43 -1.91 -0.48 114.38 121.94 1rak h ARG 190 Ca -0.35 -0.07 -0.04 0.00 -0.81 0.00 0.00 59.98 58.71 1rak h ARG 190 Cb 1.16 -0.25 -0.03 0.00 -0.42 0.00 0.00 29.97 30.43 1rak h ARG 190 CO 0.65 0.75 0.21 0.93 -1.51 0.00 0.00 179.97 180.99 1rak h GLU 191 N 1.16 0.91 -0.55 0.20 3.07 -1.97 -0.71 114.58 116.69 1rak h GLU 191 Ca 0.38 -0.19 -0.05 0.00 -0.50 0.00 0.00 59.36 59.01 1rak h GLU 191 Cb 0.05 -0.14 -0.03 0.00 -0.84 0.00 0.00 28.75 27.80 1rak h GLU 191 CO -0.12 0.80 0.15 1.88 -1.40 0.00 0.00 179.01 180.32 1rak h TYR 192 N 0.84 0.85 -0.04 4.33 -1.99 -1.76 -0.62 116.97 118.58 1rak h TYR 192 Ca 0.19 -0.07 0.00 0.00 2.00 0.00 0.00 58.73 60.85 1rak h TYR 192 Cb 0.26 -0.25 -0.00 0.00 2.00 0.00 0.00 36.73 38.73 1rak h TYR 192 CO 0.02 0.70 0.02 0.78 -0.00 0.00 0.00 178.16 179.68 1rak h GLY 193 N 0.96 0.05 0.90 3.88 0.00 -0.32 0.11 103.07 108.65 1rak h GLY 193 Ca 0.18 -0.02 -0.03 0.00 0.00 0.00 0.00 47.33 47.46 1rak h GLY 193 CO -0.00 0.02 0.08 -2.08 0.00 0.00 0.00 176.54 174.55 1rak h VAL 194 N 0.03 1.22 -0.80 4.60 2.07 -0.97 -2.86 116.25 119.53 1rak h VAL 194 Ca 0.01 -0.73 -0.00 0.00 0.82 0.00 0.00 66.70 66.80 1rak h VAL 194 Cb 0.02 1.10 -0.04 0.00 -1.52 0.00 0.00 31.29 30.85 1rak h VAL 194 CO -0.00 0.24 0.48 -0.08 0.02 0.00 0.00 177.57 178.24 1rak h GLU 195 N 0.34 1.08 -0.22 1.57 4.81 -1.00 -1.84 114.58 119.33 1rak h GLU 195 Ca 0.10 -0.09 -0.01 0.00 -0.13 0.00 0.00 59.36 59.23 1rak h GLU 195 Cb 0.29 -0.23 -0.01 0.00 0.63 0.00 0.00 28.75 29.43 1rak h GLU 195 CO 0.00 0.75 0.11 0.66 -0.73 0.00 0.00 179.01 179.80 1rak h SER 196 N 1.10 0.26 -0.09 1.04 4.64 -0.57 -1.81 113.55 118.11 1rak h SER 196 Ca 0.29 -0.01 -0.20 0.00 -0.47 0.00 0.00 61.79 61.39 1rak h SER 196 Cb -0.05 -0.06 0.00 0.00 -0.31 0.00 0.00 62.40 61.98 1rak h SER 196 CO -0.05 0.22 -0.69 -0.07 -0.87 0.00 0.00 176.83 175.37 1rak h LEU 197 N 0.30 0.83 -0.75 5.97 3.38 -1.15 -0.85 115.31 123.03 1rak h LEU 197 Ca 0.08 -0.51 0.00 0.00 0.09 0.00 0.00 57.88 57.54 1rak h LEU 197 Cb 0.03 -0.24 -0.04 0.00 0.09 0.00 0.00 40.66 40.50 1rak h LEU 197 CO -0.01 1.29 0.48 0.45 0.09 0.00 0.00 178.44 180.74 1rak h HIS 198 N 0.51 0.97 -0.55 1.13 3.86 -1.13 -0.98 115.15 118.97 1rak h HIS 198 Ca -0.03 0.01 -0.08 0.00 -1.16 0.00 0.00 60.37 59.12 1rak h HIS 198 Cb 1.29 -0.32 -0.02 0.00 1.06 0.00 0.00 27.41 29.41 1rak h HIS 198 CO 0.07 0.63 0.03 0.87 0.86 0.00 0.00 177.93 180.38 1rak h LYS 199 N 1.03 0.92 -0.18 2.45 1.57 -1.18 -1.16 116.57 120.01 1rak h LYS 199 Ca 0.27 -0.25 -0.01 0.00 -1.87 0.00 0.00 60.65 58.79 1rak h LYS 199 Cb -0.08 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.11 1rak h LYS 199 CO -0.06 0.89 0.07 1.15 -0.57 0.00 0.00 179.45 180.94 1rak h THR 200 N 0.85 1.16 -0.62 -0.16 2.02 -0.75 -1.60 112.91 113.80 1rak h THR 200 Ca 0.16 -0.47 -0.08 0.00 0.77 0.00 0.00 66.41 66.79 1rak h THR 200 Cb 0.47 1.14 -0.02 0.00 -1.74 0.00 0.00 68.15 67.99 1rak h THR 200 CO 0.02 0.15 0.08 -0.26 0.37 0.00 0.00 175.52 175.88 1rak h PHE 201 N 0.14 1.10 -0.77 3.16 0.04 -1.05 -1.25 116.94 118.30 1rak h PHE 201 Ca 0.06 -0.15 -0.02 0.00 2.80 0.00 0.00 57.97 60.66 1rak h PHE 201 Cb 0.17 -0.30 -0.04 0.00 2.20 0.00 0.00 35.95 37.98 1rak h PHE 201 CO -0.01 0.94 0.42 0.00 -0.60 0.00 0.00 178.31 179.05 1rak h ALA 202 N 1.11 0.99 -0.57 2.45 0.00 -1.05 -1.39 119.26 120.80 1rak h ALA 202 Ca 0.19 -0.12 -0.09 0.00 0.00 0.00 0.00 54.91 54.88 1rak h ALA 202 Cb 0.45 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.91 1rak h ALA 202 CO 0.02 0.51 -0.00 -0.07 0.00 0.00 0.00 179.25 179.70 1rak h LEU 203 N 1.07 0.99 -1.19 0.00 3.38 -0.99 -0.37 115.31 118.20 1rak h LEU 203 Ca 0.27 -0.31 -0.04 0.00 0.09 0.00 0.00 57.88 57.89 1rak h LEU 203 Cb 0.04 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.51 1rak h LEU 203 CO -0.04 1.05 0.12 0.00 0.09 0.00 0.00 178.44 179.66 1rak h ALA 204 N 0.97 1.35 0.05 1.53 0.00 -0.87 -1.38 119.26 120.91 1rak h ALA 204 Ca 0.16 -0.17 -0.24 0.00 0.00 0.00 0.00 54.91 54.66 1rak h ALA 204 Cb 0.55 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.15 1rak h ALA 204 CO 0.03 0.47 -1.05 1.96 0.00 0.00 0.00 179.25 180.65 1rak h GLN 205 N 0.67 0.31 -0.69 0.00 1.08 -1.06 -0.01 115.11 115.41 1rak h GLN 205 Ca 0.15 -0.40 -0.08 0.00 -1.45 0.00 0.00 58.65 56.88 1rak h GLN 205 Cb 0.24 0.13 -0.03 0.00 -0.05 0.00 0.00 27.48 27.77 1rak h GLN 205 CO -0.00 1.12 0.14 -0.22 -0.95 0.00 0.00 178.83 178.91 1rak h LYS 206 N 0.14 1.13 -0.05 1.46 3.64 -0.72 -3.22 116.57 118.95 1rak h LYS 206 Ca -0.09 -0.29 0.00 0.00 -1.27 0.00 0.00 60.65 59.00 1rak h LYS 206 Cb 1.73 -0.14 0.00 0.00 -0.41 0.00 0.00 32.23 33.41 1rak h LYS 206 CO 0.17 1.01 0.00 0.66 -2.27 0.00 0.00 179.45 179.03 1rak n TYR 207 N -4.22 0.04 -3.47 1.91 4.02 -0.55 -5.00 117.16 109.89 1rak n TYR 207 Ca 0.05 -0.02 -0.23 0.00 -0.01 0.00 0.00 57.90 57.69 1rak n TYR 207 Cb 0.28 -0.00 0.06 0.00 -0.02 0.00 0.00 39.34 39.66 1rak n TYR 207 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 176.86 172.38 1rak n ASP 208 N 1.14 -5.88 -4.52 7.72 4.64 -0.15 -5.02 116.55 114.48 1rak n ASP 208 Ca 0.12 -0.86 -0.24 0.00 -1.38 0.00 0.00 54.79 52.43 1rak n ASP 208 Cb 0.50 -4.32 -0.11 0.00 -1.04 0.00 0.00 41.12 36.16 1rak n ASP 208 CO 0.00 0.00 0.00 -0.13 -0.82 0.00 0.00 177.20 176.25 1rak s ARG 209 N -5.19 1.75 0.79 -0.67 1.81 -0.40 -5.05 118.95 111.99 1rak s ARG 209 Ca 0.46 -1.93 -0.10 0.00 -1.72 0.00 0.00 55.73 52.44 1rak s ARG 209 Cb -0.11 -1.43 0.09 0.00 -0.45 0.00 0.00 34.95 33.06 1rak s ARG 209 CO 0.80 0.03 1.13 -0.51 -0.68 0.00 0.00 175.30 176.06 1rak s LEU 210 N -3.57 2.67 -0.03 2.53 1.43 -1.03 -4.74 118.68 115.95 1rak s LEU 210 Ca 0.33 0.53 0.04 0.00 -1.03 0.00 0.00 54.13 53.99 1rak s LEU 210 Cb 0.05 -3.02 -0.00 0.00 0.03 0.00 0.00 46.19 43.25 1rak s LEU 210 CO 0.15 -1.90 -0.13 -0.63 0.23 0.00 0.00 176.35 174.07 1rak s ILE 211 N -3.47 1.07 -0.24 -0.59 1.01 -0.19 -0.48 121.20 118.30 1rak s ILE 211 Ca 0.63 -0.53 -0.03 0.00 0.00 0.00 0.00 60.65 60.72 1rak s ILE 211 Cb -0.10 -0.92 0.11 0.00 0.01 0.00 0.00 42.46 41.56 1rak s ILE 211 CO 0.48 0.31 0.25 -0.62 0.00 0.00 0.00 174.94 175.36 1rak s ASP 212 N 0.01 1.60 -0.16 3.58 3.68 -0.44 -0.80 116.67 124.15 1rak s ASP 212 Ca -0.01 -0.48 -0.12 0.00 2.13 0.00 0.00 52.55 54.06 1rak s ASP 212 Cb -0.09 0.41 -0.05 0.00 -1.45 0.00 0.00 42.92 41.74 1rak s ASP 212 CO 0.01 -0.36 0.24 -0.69 0.13 0.00 0.00 175.17 174.50 1rak s VAL 213 N 2.33 5.34 -0.62 1.11 1.01 -0.47 -3.92 120.40 125.18 1rak s VAL 213 Ca 0.08 0.43 -0.27 0.00 0.00 0.00 0.00 61.98 62.22 1rak s VAL 213 Cb -0.15 -3.57 0.02 0.00 0.00 0.00 0.00 36.38 32.68 1rak s VAL 213 CO -0.22 0.43 1.41 -1.00 0.00 0.00 0.00 175.10 175.72 1rak s HIS 214 N 0.23 2.24 -0.25 5.22 3.76 -0.27 -0.19 115.29 126.03 1rak s HIS 214 Ca 0.14 0.36 -0.03 0.00 -0.15 0.00 0.00 55.06 55.38 1rak s HIS 214 Cb -0.12 -4.44 0.02 0.00 1.11 0.00 0.00 32.58 29.15 1rak s HIS 214 CO 0.03 -2.01 -0.04 0.00 -0.85 0.00 0.00 174.74 171.86 1rak n ASP 216 N 4.71 -2.86 -4.17 0.00 10.43 -1.26 -0.89 116.55 122.51 1rak n ASP 216 Ca -0.17 -0.76 -0.43 0.00 2.57 0.00 0.00 54.79 56.00 1rak n ASP 216 Cb 0.48 -4.21 0.00 0.00 1.84 0.00 0.00 41.12 39.23 1rak n ASP 216 CO 0.00 0.00 0.00 1.21 -1.07 0.00 0.00 177.20 177.34 1rak n GLU 217 N -4.46 3.36 -3.62 -1.24 2.13 -1.26 -1.42 120.64 114.14 1rak n GLU 217 Ca -0.17 -3.48 -0.09 0.00 0.66 0.00 0.00 57.16 54.08 1rak n GLU 217 Cb 0.62 -3.10 -0.06 0.00 0.27 0.00 0.00 31.44 29.16 1rak n GLU 217 CO 0.00 0.00 0.00 -1.50 -0.41 0.00 0.00 177.13 175.22 1rak s ILE 218 N 1.77 0.00 -1.51 6.31 2.07 -1.26 -4.98 121.20 123.60 1rak s ILE 218 Ca 0.44 0.00 -0.09 0.00 -1.41 0.00 0.00 60.65 59.59 1rak s ILE 218 Cb 0.05 -1.00 -0.01 0.00 0.13 0.00 0.00 42.46 41.63 1rak s ILE 218 CO 0.00 0.00 2.71 0.47 -1.91 0.00 0.00 174.94 176.21 1rak n ASP 219 N 1.66 8.20 -3.99 4.50 10.43 -1.26 -2.86 116.55 133.23 1rak n ASP 219 Ca -0.11 -2.79 -0.31 0.00 2.57 0.00 0.00 54.79 54.15 1rak n ASP 219 Cb 0.57 -1.49 -0.16 0.00 1.84 0.00 0.00 41.12 41.88 1rak n ASP 219 CO 0.00 0.00 0.00 -0.62 -1.07 0.00 0.00 177.20 175.51 1rak s ASP 220 N 1.57 3.80 0.18 -2.24 3.68 -1.26 -4.99 116.67 117.41 1rak s ASP 220 Ca 0.63 -1.11 0.15 0.00 2.13 0.00 0.00 52.55 54.35 1rak s ASP 220 Cb 0.18 -1.29 0.74 0.00 -1.45 0.00 0.00 42.92 41.10 1rak s ASP 220 CO -0.07 -0.19 1.47 -1.84 0.13 0.00 0.00 175.17 174.67 1rak n GLU 221 N 4.62 0.09 0.00 4.34 0.00 -1.26 -1.33 120.64 127.10 1rak n GLU 221 Ca -0.14 0.50 0.13 0.00 0.00 0.00 0.00 57.16 57.65 1rak n GLU 221 Cb 0.45 -1.76 0.22 0.00 0.00 0.00 0.00 31.44 30.35 1rak n GLU 221 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.13 178.17 1rak n GLN 222 N -1.95 2.00 -2.79 3.44 6.02 -1.26 -4.79 117.38 118.05 1rak n GLN 222 Ca 0.00 -1.53 -0.43 0.00 -0.01 0.00 0.00 57.00 55.04 1rak n GLN 222 Cb 0.08 -1.47 -0.04 0.00 1.02 0.00 0.00 30.24 29.84 1rak n GLN 222 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.06 176.50 1rak s SER 223 N -2.06 6.22 -0.24 1.08 0.15 -0.44 -4.84 113.70 113.57 1rak s SER 223 Ca 0.30 -0.68 0.12 0.00 0.70 0.00 0.00 55.95 56.38 1rak s SER 223 Cb 0.20 -2.45 0.45 0.00 -1.71 0.00 0.00 66.02 62.51 1rak s SER 223 CO 0.34 -1.46 1.19 0.54 1.20 0.00 0.00 173.24 175.05 1rak n ARG 224 N 7.97 2.55 0.28 5.44 1.74 -1.26 -4.80 116.66 128.57 1rak n ARG 224 Ca -0.01 -3.69 0.15 0.00 -0.77 0.00 0.00 57.85 53.54 1rak n ARG 224 Cb 0.47 -1.84 0.79 0.00 -1.02 0.00 0.00 32.46 30.86 1rak n ARG 224 CO 0.00 0.00 0.00 0.74 -1.52 0.00 0.00 177.63 176.85 1rak h PHE 225 N 1.84 0.00 -0.69 -1.55 -1.00 -1.96 -2.66 116.94 110.92 1rak h PHE 225 Ca 0.16 0.00 0.11 0.00 2.81 0.00 0.00 57.97 61.05 1rak h PHE 225 Cb 1.38 0.00 -0.04 0.00 3.61 0.00 0.00 35.95 40.90 1rak h PHE 225 CO 0.73 0.08 0.46 -0.24 -1.61 0.00 0.00 178.31 177.73 1rak h VAL 226 N 0.00 0.88 -0.13 -0.55 3.04 -1.92 -0.94 116.25 116.63 1rak h VAL 226 Ca -0.00 -0.17 -0.08 0.00 -1.01 0.00 0.00 66.70 65.44 1rak h VAL 226 Cb 0.33 0.35 -0.01 0.00 -2.01 0.00 0.00 31.29 29.95 1rak h VAL 226 CO 0.01 0.09 -0.27 1.05 -1.01 0.00 0.00 177.57 177.44 1rak h GLU 227 N 0.48 0.24 -0.21 4.17 4.11 -1.89 -1.09 114.58 120.39 1rak h GLU 227 Ca 0.33 -0.08 -0.18 0.00 0.07 0.00 0.00 59.36 59.49 1rak h GLU 227 Cb 0.62 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.85 1rak h GLU 227 CO -0.10 0.50 -0.57 1.15 0.07 0.00 0.00 179.01 180.06 1rak h THR 228 N 0.22 1.30 -0.31 -1.06 2.02 -1.36 -0.62 112.91 113.09 1rak h THR 228 Ca 0.03 -1.78 0.02 0.00 0.77 0.00 0.00 66.41 65.46 1rak h THR 228 Cb 0.60 1.84 -0.03 0.00 -1.74 0.00 0.00 68.15 68.82 1rak h THR 228 CO 0.04 0.57 0.14 0.58 0.37 0.00 0.00 175.52 177.22 1rak h VAL 229 N 0.49 0.97 -0.45 3.16 2.07 -1.04 -0.51 116.25 120.94 1rak h VAL 229 Ca -0.01 -0.10 -0.11 0.00 0.82 0.00 0.00 66.70 67.29 1rak h VAL 229 Cb 1.19 0.64 -0.01 0.00 -1.52 0.00 0.00 31.29 31.59 1rak h VAL 229 CO 0.12 0.05 -0.15 0.00 0.02 0.00 0.00 177.57 177.62 1rak h ALA 230 N 1.17 0.63 -0.53 1.67 0.00 -1.19 -2.15 119.26 118.86 1rak h ALA 230 Ca 0.13 -0.36 -0.08 0.00 0.00 0.00 0.00 54.91 54.60 1rak h ALA 230 Cb 0.06 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 1rak h ALA 230 CO -0.10 0.56 0.01 0.00 0.00 0.00 0.00 179.25 179.72 1rak h ALA 231 N 0.86 0.71 -0.48 0.00 0.00 -0.91 -0.74 119.26 118.70 1rak h ALA 231 Ca 0.11 -0.29 -0.10 0.00 0.00 0.00 0.00 54.91 54.63 1rak h ALA 231 Cb 0.71 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.29 1rak h ALA 231 CO 0.05 0.52 -0.11 -0.07 0.00 0.00 0.00 179.25 179.64 1rak h LEU 232 N 0.80 0.86 -0.50 0.00 3.38 -1.09 -0.51 115.31 118.26 1rak h LEU 232 Ca 0.15 -0.27 -0.03 0.00 0.09 0.00 0.00 57.88 57.82 1rak h LEU 232 Cb 0.52 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 41.01 1rak h LEU 232 CO 0.03 0.99 0.18 0.00 0.09 0.00 0.00 178.44 179.72 1rak h ALA 233 N 1.09 0.65 -0.48 1.53 0.00 -1.18 -1.63 119.26 119.24 1rak h ALA 233 Ca 0.13 -0.17 -0.03 0.00 0.00 0.00 0.00 54.91 54.84 1rak h ALA 233 Cb 0.62 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.19 1rak h ALA 233 CO 0.04 0.28 0.17 1.25 0.00 0.00 0.00 179.25 180.99 1rak h HIS 234 N 0.67 0.77 -0.75 0.00 -0.00 -0.88 -0.16 115.15 114.79 1rak h HIS 234 Ca 0.16 -0.07 0.01 0.00 -0.00 0.00 0.00 60.37 60.47 1rak h HIS 234 Cb 0.23 -0.22 -0.04 0.00 -0.00 0.00 0.00 27.41 27.38 1rak h HIS 234 CO 0.01 0.66 0.50 1.25 -0.00 0.00 0.00 177.93 180.35 1rak h HIS 235 N 0.65 0.95 -0.00 5.26 6.17 -0.90 -2.27 115.15 125.00 1rak h HIS 235 Ca 0.16 0.02 0.00 0.00 0.71 0.00 0.00 60.37 61.26 1rak h HIS 235 Cb 0.25 -0.32 0.00 0.00 2.52 0.00 0.00 27.41 29.86 1rak h HIS 235 CO 0.01 0.59 -0.10 0.39 0.71 0.00 0.00 177.93 179.54 1rak n GLU 236 N -4.56 0.77 -3.58 5.26 -0.58 -0.63 -4.94 120.64 112.38 1rak n GLU 236 Ca 0.07 -0.26 -0.22 0.00 -0.42 0.00 0.00 57.16 56.33 1rak n GLU 236 Cb 0.02 -1.49 0.07 0.00 -0.57 0.00 0.00 31.44 29.47 1rak n GLU 236 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1rak n GLY 237 N 1.25 -0.45 0.88 0.62 0.00 -0.19 -4.93 105.19 102.37 1rak n GLY 237 Ca 0.15 0.18 0.05 0.00 0.00 0.00 0.00 46.02 46.41 1rak n GLY 237 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 173.32 174.47 1rak n MET 238 N -4.61 0.67 -0.30 1.61 0.00 -0.51 -4.90 117.12 109.08 1rak n MET 238 Ca -0.12 -2.34 0.12 0.00 0.00 0.00 0.00 57.70 55.36 1rak n MET 238 Cb 0.61 -0.78 0.29 0.00 0.00 0.00 0.00 33.22 33.34 1rak n MET 238 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 175.97 176.75 1rak h GLY 239 N 0.73 1.50 1.57 3.17 0.00 -1.68 -0.82 103.07 107.54 1rak h GLY 239 Ca -0.09 -0.17 0.05 0.00 0.00 0.00 0.00 47.33 47.12 1rak h GLY 239 CO 0.04 -0.24 0.17 0.00 0.00 0.00 0.00 176.54 176.50 1rak h ALA 240 N 1.69 1.83 -0.11 3.60 0.00 -1.82 -1.35 119.26 123.11 1rak h ALA 240 Ca 0.54 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.45 1rak h ALA 240 Cb 1.01 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.81 1rak h ALA 240 CO -0.51 -0.25 0.00 0.54 0.00 0.00 0.00 179.25 179.02 1rak n ARG 241 N -3.92 1.90 -5.16 0.00 1.74 -0.32 -4.66 116.66 106.25 1rak n ARG 241 Ca 0.01 -1.33 -0.32 0.00 -0.77 0.00 0.00 57.85 55.44 1rak n ARG 241 Cb 0.29 -1.45 -0.15 0.00 -1.02 0.00 0.00 32.46 30.12 1rak n ARG 241 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1rak s VAL 242 N -1.87 2.37 -0.02 1.55 1.01 -0.51 -1.02 120.40 121.92 1rak s VAL 242 Ca 0.35 -0.97 0.03 0.00 0.00 0.00 0.00 61.98 61.38 1rak s VAL 242 Cb 0.20 -1.87 -0.00 0.00 0.00 0.00 0.00 36.38 34.70 1rak s VAL 242 CO 0.30 0.58 -0.09 -0.89 0.00 0.00 0.00 175.10 175.00 1rak s THR 243 N -0.45 0.74 -0.35 3.92 2.01 0.02 -1.03 115.64 120.50 1rak s THR 243 Ca 0.05 -0.36 -0.05 0.00 0.31 0.00 0.00 61.69 61.64 1rak s THR 243 Cb -0.12 -0.64 0.06 0.00 0.01 0.00 0.00 72.50 71.80 1rak s THR 243 CO 0.01 0.22 0.11 0.00 -0.69 0.00 0.00 174.62 174.27 1rak s ALA 244 N 0.04 3.03 0.23 7.40 0.00 0.37 -1.37 121.76 131.47 1rak s ALA 244 Ca -0.01 -1.90 -0.19 0.00 0.00 0.00 0.00 51.96 49.87 1rak s ALA 244 Cb -0.07 -2.25 -0.08 0.00 0.00 0.00 0.00 23.12 20.72 1rak s ALA 244 CO 0.00 -1.42 0.72 -1.12 0.00 0.00 0.00 175.76 173.94 1rak s SER 245 N 1.51 7.01 0.00 0.00 0.01 0.74 -2.35 113.70 120.61 1rak s SER 245 Ca -0.01 1.39 0.00 0.00 1.31 0.00 0.00 55.95 58.64 1rak s SER 245 Cb -0.20 -2.41 0.00 0.00 0.21 0.00 0.00 66.02 63.62 1rak s SER 245 CO 0.01 -0.00 0.00 1.41 0.41 0.00 0.00 173.24 175.07 1rak n HIS 246 N 0.56 0.00 -4.48 2.43 8.25 0.62 -1.00 115.22 121.60 1rak n HIS 246 Ca -0.01 0.00 -0.40 0.00 -0.26 0.00 0.00 57.72 57.04 1rak n HIS 246 Cb 0.51 0.00 -0.08 0.00 1.12 0.00 0.00 29.99 31.54 1rak n HIS 246 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 1rak n THR 247 N 0.00 -0.30 0.25 1.59 -2.24 -0.06 -4.23 114.28 109.29 1rak n THR 247 Ca 0.00 -0.10 0.12 0.00 -2.27 0.00 0.00 64.05 61.80 1rak n THR 247 Cb 0.00 -0.70 0.64 0.00 -2.10 0.00 0.00 70.33 68.17 1rak n THR 247 CO 0.00 0.00 0.00 0.71 -0.57 0.00 0.00 175.07 175.21 1rak h THR 248 N -1.10 0.58 0.00 4.28 1.35 -1.63 -1.80 112.91 114.59 1rak h THR 248 Ca -0.61 -0.73 -0.00 0.00 -0.55 0.00 0.00 66.41 64.51 1rak h THR 248 Cb 1.39 1.48 -0.00 0.00 -1.73 0.00 0.00 68.15 69.29 1rak h THR 248 CO 0.85 0.16 -0.00 0.00 -0.25 0.00 0.00 175.52 176.28 1rak h ALA 249 N 1.84 1.69 0.00 6.62 0.00 -1.09 -1.33 119.26 127.00 1rak h ALA 249 Ca -0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 1rak h ALA 249 Cb 0.47 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.26 1rak h ALA 249 CO 0.02 0.00 -0.02 1.98 0.00 0.00 0.00 179.25 181.24 1rak h MET 250 N 0.00 0.00 0.00 0.00 -1.53 -1.60 0.94 114.93 112.74 1rak h MET 250 Ca -0.00 0.00 -0.01 0.00 -3.44 0.00 0.00 59.70 56.25 1rak h MET 250 Cb 0.01 0.00 -0.00 0.00 -0.55 0.00 0.00 31.60 31.05 1rak h MET 250 CO 0.00 0.02 -0.05 1.25 0.14 0.00 0.00 176.91 178.27 1rak h HIS 251 N 0.00 0.00 -0.12 1.39 2.76 -1.41 -2.92 115.15 114.85 1rak h HIS 251 Ca -0.00 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.17 1rak h HIS 251 Cb 0.05 0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.01 1rak h HIS 251 CO 0.00 0.05 0.00 0.43 -1.30 0.00 0.00 177.93 177.11 1rak n SER 252 N -3.47 2.51 -4.79 3.26 7.64 0.31 -4.97 113.62 114.12 1rak n SER 252 Ca -0.02 -1.72 -0.33 0.00 1.01 0.00 0.00 58.87 57.80 1rak n SER 252 Cb 0.18 -0.07 0.01 0.00 -1.01 0.00 0.00 64.21 63.31 1rak n SER 252 CO 0.00 0.00 0.00 -0.31 -3.01 0.00 0.00 175.04 171.72 1rak s TYR 253 N -1.23 2.91 0.67 1.43 2.02 -1.10 -4.68 117.35 117.36 1rak s TYR 253 Ca 0.21 1.53 -0.14 0.00 -0.37 0.00 0.00 57.07 58.31 1rak s TYR 253 Cb 0.14 -3.07 0.00 0.00 -0.40 0.00 0.00 41.96 38.63 1rak s TYR 253 CO 0.20 -1.19 1.08 0.54 -1.57 0.00 0.00 175.55 174.61 1rak s ASN 254 N -2.52 5.21 0.34 2.29 2.20 -1.26 -4.93 114.94 116.27 1rak s ASN 254 Ca 0.66 1.85 0.11 0.00 -0.94 0.00 0.00 52.86 54.53 1rak s ASN 254 Cb -0.17 -2.53 0.61 0.00 -2.00 0.00 0.00 41.25 37.16 1rak s ASN 254 CO 0.34 -1.56 1.78 1.23 -2.94 0.00 0.00 177.10 175.94 1rak h GLY 255 N -0.23 0.09 0.73 0.45 0.00 -1.98 -2.68 103.07 99.44 1rak h GLY 255 Ca -0.46 -0.08 -0.02 0.00 0.00 0.00 0.00 47.33 46.78 1rak h GLY 255 CO 0.55 0.07 -0.02 0.00 0.00 0.00 0.00 176.54 177.14 1rak h ALA 256 N 1.53 0.14 -0.62 3.60 0.00 -2.00 -0.95 119.26 120.97 1rak h ALA 256 Ca 0.01 -0.21 -0.02 0.00 0.00 0.00 0.00 54.91 54.68 1rak h ALA 256 Cb 0.73 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.45 1rak h ALA 256 CO 0.05 -0.14 0.29 -0.92 0.00 0.00 0.00 179.25 178.53 1rak h TYR 257 N -0.12 0.89 -0.85 0.00 3.20 -1.96 -2.18 116.97 115.95 1rak h TYR 257 Ca 0.03 -0.05 0.03 0.00 3.14 0.00 0.00 58.73 61.88 1rak h TYR 257 Cb 0.41 -0.28 -0.05 0.00 1.54 0.00 0.00 36.73 38.35 1rak h TYR 257 CO 0.05 0.68 0.55 1.15 -1.64 0.00 0.00 178.16 178.94 1rak h THR 258 N 0.85 1.14 -0.53 1.81 2.02 -1.35 0.73 112.91 117.57 1rak h THR 258 Ca 0.21 -0.36 -0.02 0.00 0.77 0.00 0.00 66.41 67.01 1rak h THR 258 Cb 0.13 -0.02 -0.02 0.00 -1.74 0.00 0.00 68.15 66.49 1rak h THR 258 CO -0.03 0.19 0.25 -1.28 0.37 0.00 0.00 175.52 175.03 1rak h SER 259 N 1.06 0.70 -0.17 4.18 0.87 -0.88 -0.09 113.55 119.22 1rak h SER 259 Ca 0.34 -0.14 -0.00 0.00 -1.23 0.00 0.00 61.79 60.76 1rak h SER 259 Cb 0.01 -0.18 -0.01 0.00 -0.44 0.00 0.00 62.40 61.78 1rak h SER 259 CO -0.12 0.64 0.09 -0.09 -0.53 0.00 0.00 176.83 176.83 1rak h ARG 260 N 0.71 0.24 -0.87 2.24 1.12 -0.79 -2.90 114.38 114.13 1rak h ARG 260 Ca 0.18 -0.03 0.05 0.00 -1.11 0.00 0.00 59.98 59.07 1rak h ARG 260 Cb 0.13 -0.05 -0.06 0.00 -0.01 0.00 0.00 29.97 29.98 1rak h ARG 260 CO -0.02 0.25 0.55 1.25 -3.11 0.00 0.00 179.97 178.89 1rak h LEU 261 N 0.18 0.89 -1.69 3.80 5.85 -0.62 -2.89 115.31 120.84 1rak h LEU 261 Ca 0.06 0.01 0.10 0.00 0.84 0.00 0.00 57.88 58.89 1rak h LEU 261 Cb 0.07 -0.19 -0.03 0.00 0.37 0.00 0.00 40.66 40.88 1rak h LEU 261 CO -0.01 0.59 0.39 -0.26 -0.34 0.00 0.00 178.44 178.81 1rak h PHE 262 N 1.04 0.37 -0.30 1.25 0.05 -0.80 -0.73 116.94 117.81 1rak h PHE 262 Ca 0.37 0.01 0.00 0.00 3.82 0.00 0.00 57.97 62.17 1rak h PHE 262 Cb 0.10 -0.12 -0.01 0.00 2.00 0.00 0.00 35.95 37.91 1rak h PHE 262 CO -0.02 0.17 0.20 -0.09 -0.18 0.00 0.00 178.31 178.38 1rak h ARG 263 N 0.34 0.40 -0.60 1.51 2.43 -1.55 -1.05 114.38 115.87 1rak h ARG 263 Ca 0.27 -0.03 -0.07 0.00 -0.81 0.00 0.00 59.98 59.34 1rak h ARG 263 Cb 0.60 -0.09 -0.02 0.00 -0.42 0.00 0.00 29.97 30.04 1rak h ARG 263 CO -0.07 0.27 0.11 1.25 -1.51 0.00 0.00 179.97 180.02 1rak h LEU 264 N 0.41 0.94 -0.47 3.80 5.85 -1.33 -1.24 115.31 123.27 1rak h LEU 264 Ca 0.11 -0.25 0.01 0.00 0.84 0.00 0.00 57.88 58.59 1rak h LEU 264 Cb -0.04 -0.25 -0.03 0.00 0.37 0.00 0.00 40.66 40.71 1rak h LEU 264 CO -0.02 0.96 0.30 -0.07 -0.34 0.00 0.00 178.44 179.26 1rak h LEU 265 N 0.89 0.50 -0.16 2.25 3.38 -0.79 0.81 115.31 122.19 1rak h LEU 265 Ca 0.18 -0.01 -0.02 0.00 0.09 0.00 0.00 57.88 58.13 1rak h LEU 265 Cb 0.41 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.04 1rak h LEU 265 CO 0.01 0.36 0.03 0.50 0.09 0.00 0.00 178.44 179.43 1rak h LYS 266 N 0.60 0.26 -0.66 1.13 1.63 -1.09 -2.97 116.57 115.48 1rak h LYS 266 Ca 0.18 -0.07 -0.01 0.00 -0.85 0.00 0.00 60.65 59.90 1rak h LYS 266 Cb -0.04 -0.03 -0.03 0.00 -0.60 0.00 0.00 32.23 31.53 1rak h LYS 266 CO -0.06 0.43 0.39 0.52 -3.45 0.00 0.00 179.45 177.28 1rak h MET 267 N 0.05 0.89 0.00 1.90 2.86 -0.94 -2.80 114.93 116.89 1rak h MET 267 Ca 0.05 -0.08 -0.08 0.00 -2.06 0.00 0.00 59.70 57.53 1rak h MET 267 Cb 0.30 -0.19 -0.01 0.00 0.06 0.00 0.00 31.60 31.76 1rak h MET 267 CO 0.00 0.63 -0.38 0.66 1.06 0.00 0.00 176.91 178.88 1rak h SER 268 N 0.90 0.00 -0.10 1.22 4.64 -0.76 -3.47 113.55 115.99 1rak h SER 268 Ca 0.24 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.51 1rak h SER 268 Cb -0.02 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.05 1rak h SER 268 CO -0.04 0.38 -0.04 0.61 -0.87 0.00 0.00 176.83 176.87 1rak n GLY 269 N -0.24 0.50 3.82 -0.77 0.00 -1.06 -3.76 105.19 103.68 1rak n GLY 269 Ca -0.01 -0.20 -0.30 0.00 0.00 0.00 0.00 46.02 45.50 1rak n GLY 269 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1rak s ILE 270 N -1.83 3.51 0.16 -0.61 -4.36 -1.25 -3.87 121.20 112.94 1rak s ILE 270 Ca 0.00 0.49 0.03 0.00 -0.26 0.00 0.00 60.65 60.91 1rak s ILE 270 Cb 0.00 -3.26 -0.03 0.00 1.25 0.00 0.00 42.46 40.42 1rak s ILE 270 CO 0.00 -0.64 0.30 0.20 0.24 0.00 0.00 174.94 175.03 1rak s ASN 271 N -3.90 6.34 -0.03 4.36 0.01 -0.20 -4.50 114.94 117.03 1rak s ASN 271 Ca 0.59 0.17 0.04 0.00 -0.71 0.00 0.00 52.86 52.96 1rak s ASN 271 Cb -0.14 -1.91 -0.00 0.00 0.41 0.00 0.00 41.25 39.60 1rak s ASN 271 CO 0.54 0.04 -0.15 -0.36 -1.51 0.00 0.00 177.10 175.66 1rak s PHE 272 N -1.77 1.43 -0.12 2.20 0.08 -0.49 -0.48 117.98 118.84 1rak s PHE 272 Ca 0.35 -0.35 0.02 0.00 0.12 0.00 0.00 56.93 57.07 1rak s PHE 272 Cb -0.11 -0.96 -0.00 0.00 -0.57 0.00 0.00 43.02 41.38 1rak s PHE 272 CO 0.29 -0.10 -0.20 0.08 -0.10 0.00 0.00 175.22 175.18 1rak s VAL 273 N -0.07 2.34 0.01 -0.44 1.01 -0.99 -1.27 120.40 121.00 1rak s VAL 273 Ca -0.00 -0.91 0.03 0.00 0.00 0.00 0.00 61.98 61.10 1rak s VAL 273 Cb -0.09 -1.93 -0.04 0.00 0.00 0.00 0.00 36.38 34.32 1rak s VAL 273 CO 0.01 0.55 -0.04 0.00 0.00 0.00 0.00 175.10 175.61 1rak s ALA 274 N 0.48 3.13 -0.62 5.51 0.00 0.06 -0.28 121.76 130.03 1rak s ALA 274 Ca -0.14 -1.01 0.05 0.00 0.00 0.00 0.00 51.96 50.86 1rak s ALA 274 Cb -0.17 -1.20 0.18 0.00 0.00 0.00 0.00 23.12 21.94 1rak s ALA 274 CO 0.05 0.63 0.49 0.09 0.00 0.00 0.00 175.76 177.03 1rak n ASN 275 N 1.38 2.23 -0.26 0.00 3.02 -1.26 -1.19 115.26 119.17 1rak n ASN 275 Ca -0.15 -3.04 0.05 0.00 -0.03 0.00 0.00 54.58 51.42 1rak n ASN 275 Cb 0.52 -0.70 0.16 0.00 -0.61 0.00 0.00 39.78 39.16 1rak n ASN 275 CO 0.00 0.00 0.00 -0.65 -2.62 0.00 0.00 177.26 173.99 1rak h PRO 276 N 5.24 0.10 -0.59 3.52 0.11 -1.88 0.17 132.00 138.68 1rak h PRO 276 Ca 0.18 -0.01 -0.06 0.00 0.11 0.00 0.00 66.00 66.22 1rak h PRO 276 Cb 0.78 -0.02 -0.02 0.00 0.11 0.00 0.00 31.00 31.84 1rak h PRO 276 CO 0.65 0.07 0.14 -0.07 -0.21 0.00 0.00 178.00 178.57 1rak h LEU 277 N 0.11 0.89 0.24 2.35 3.38 -1.86 -2.28 115.31 118.14 1rak h LEU 277 Ca 0.42 -0.24 -0.32 0.00 0.09 0.00 0.00 57.88 57.83 1rak h LEU 277 Cb 0.74 -0.24 0.04 0.00 0.09 0.00 0.00 40.66 41.29 1rak h LEU 277 CO -0.66 0.90 -1.41 0.58 0.09 0.00 0.00 178.44 177.94 1rak h VAL 278 N 0.85 1.31 -0.73 1.22 2.07 -1.70 -3.27 116.25 115.99 1rak h VAL 278 Ca 0.18 -2.68 -0.02 0.00 0.82 0.00 0.00 66.70 65.01 1rak h VAL 278 Cb 0.36 3.07 -0.03 0.00 -1.52 0.00 0.00 31.29 33.16 1rak h VAL 278 CO 0.00 0.80 0.39 0.78 0.02 0.00 0.00 177.57 179.57 1rak h ASN 279 N 0.08 0.91 0.41 0.57 2.35 -0.67 0.13 115.58 119.37 1rak h ASN 279 Ca -0.25 -0.10 -0.04 0.00 -0.55 0.00 0.00 56.30 55.36 1rak h ASN 279 Cb 2.11 -0.23 -0.01 0.00 0.05 0.00 0.00 38.32 40.24 1rak h ASN 279 CO 0.26 0.75 -0.19 -0.29 -1.65 0.00 0.00 177.43 176.31 1rak h ILE 280 N 1.00 0.78 0.05 2.81 6.09 -1.54 -0.87 117.51 125.83 1rak h ILE 280 Ca 0.26 -0.78 -0.11 0.00 -1.37 0.00 0.00 64.86 62.85 1rak h ILE 280 Cb 0.04 1.47 -0.00 0.00 0.47 0.00 0.00 36.82 38.80 1rak h ILE 280 CO -0.04 0.19 -0.57 -0.74 -3.07 0.00 0.00 178.15 173.92 1rak h HIS 281 N 0.00 0.17 0.00 2.19 2.76 -1.40 -3.39 115.15 115.49 1rak h HIS 281 Ca -0.00 -0.13 -0.12 0.00 -2.20 0.00 0.00 60.37 57.92 1rak h HIS 281 Cb 0.45 -0.01 -0.02 0.00 1.55 0.00 0.00 27.41 29.39 1rak h HIS 281 CO 0.00 1.22 -0.90 -0.07 -1.30 0.00 0.00 177.93 176.88 1rak h LEU 282 N -0.78 0.00-10.26 0.26 3.38 -0.75 -3.46 115.31 103.71 1rak h LEU 282 Ca -0.13 0.00 -0.49 0.00 0.09 0.00 0.00 57.88 57.35 1rak h LEU 282 Cb 1.29 0.00 0.03 0.00 0.09 0.00 0.00 40.66 42.06 1rak h LEU 282 CO 0.00 0.50 0.07 -1.10 0.09 0.00 0.00 178.44 178.01 1rak s GLN 283 N -2.97 3.58 0.00 1.13 -1.52 -0.34 -4.08 119.66 115.46 1rak s GLN 283 Ca 0.01 0.19 0.00 0.00 -1.95 0.00 0.00 55.36 53.61 1rak s GLN 283 Cb 0.08 -2.41 0.00 0.00 -0.22 0.00 0.00 33.01 30.46 1rak s GLN 283 CO 0.77 -0.13 0.00 0.41 -0.25 0.00 0.00 175.29 176.09 1rak n GLY 284 N -2.01 0.54 0.08 3.09 0.00 -1.26 -4.86 105.19 100.76 1rak n GLY 284 Ca 0.00 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.13 1rak n GLY 284 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1rak n ARG 285 N -2.08 0.13 0.00 1.61 5.12 -1.26 -2.59 116.66 117.60 1rak n ARG 285 Ca 0.00 0.30 0.09 0.00 -1.93 0.00 0.00 57.85 56.32 1rak n ARG 285 Cb 0.07 -1.72 0.05 0.00 -1.16 0.00 0.00 32.46 29.69 1rak n ARG 285 CO 0.00 0.00 0.00 1.19 -1.93 0.00 0.00 177.63 176.89 1rak n PHE 286 N -1.96 0.00 -2.76 -1.55 3.01 -1.26 -4.93 117.46 108.01 1rak n PHE 286 Ca 0.03 0.00 -0.28 0.00 1.01 0.00 0.00 57.45 58.21 1rak n PHE 286 Cb 0.25 0.00 -0.01 0.00 -0.01 0.00 0.00 39.48 39.71 1rak n PHE 286 CO 0.00 0.00 0.00 -0.51 1.01 0.00 0.00 176.76 177.26 1rak s ASP 287 N -1.78 6.35 0.00 4.37 1.01 -1.07 -5.06 116.67 120.49 1rak s ASP 287 Ca 0.19 0.97 0.00 0.00 0.71 0.00 0.00 52.55 54.42 1rak s ASP 287 Cb 0.15 -2.26 0.00 0.00 1.01 0.00 0.00 42.92 41.82 1rak s ASP 287 CO 0.32 -0.50 0.00 0.35 0.21 0.00 0.00 175.17 175.56 1rak n THR 288 N -1.88 0.00 -3.76 -1.27 -2.24 -1.26 -4.98 114.28 98.89 1rak n THR 288 Ca 0.01 0.00 -0.13 0.00 -2.27 0.00 0.00 64.05 61.66 1rak n THR 288 Cb 0.55 -0.33 -0.13 0.00 -2.10 0.00 0.00 70.33 68.32 1rak n THR 288 CO 0.00 0.00 0.00 -0.31 -0.57 0.00 0.00 175.07 174.19 1rak s TYR 289 N 0.26 -0.25 0.85 4.78 2.02 -1.26 -4.20 117.35 119.54 1rak s TYR 289 Ca 0.00 0.63 -0.11 0.00 -0.37 0.00 0.00 57.07 57.23 1rak s TYR 289 Cb 0.00 0.03 0.10 0.00 -0.40 0.00 0.00 41.96 41.69 1rak s TYR 289 CO 0.00 -0.17 1.10 -1.25 -1.57 0.00 0.00 175.55 173.65 1rak s PRO 290 N 0.84 1.59 -0.15 -1.71 0.04 -1.26 -5.16 135.00 129.19 1rak s PRO 290 Ca -0.06 1.13 0.01 0.00 0.04 0.00 0.00 61.00 62.13 1rak s PRO 290 Cb -0.08 -1.82 0.01 0.00 0.04 0.00 0.00 34.50 32.65 1rak s PRO 290 CO -0.05 -2.10 -0.19 0.21 0.04 0.00 0.00 177.00 174.91 1rak s LYS 291 N -4.84 3.11 0.60 4.56 2.20 -1.26 -4.90 119.74 119.21 1rak s LYS 291 Ca 0.63 -0.81 -0.16 0.00 -0.36 0.00 0.00 55.97 55.27 1rak s LYS 291 Cb -0.19 -2.52 -0.03 0.00 -1.51 0.00 0.00 37.83 33.58 1rak s LYS 291 CO 0.57 -0.01 1.08 -0.98 -0.36 0.00 0.00 175.35 175.65 1rak s ARG 292 N 0.83 3.20 -0.02 4.03 1.70 -1.26 -4.98 118.95 122.45 1rak s ARG 292 Ca -0.06 1.29 -0.24 0.00 -0.47 0.00 0.00 55.73 56.25 1rak s ARG 292 Cb -0.15 -2.01 -0.20 0.00 -0.57 0.00 0.00 34.95 32.02 1rak s ARG 292 CO -0.01 -0.92 1.20 0.00 -1.08 0.00 0.00 175.30 174.49 1rak h ARG 293 N 0.43 0.16 0.00 3.89 3.08 -1.96 -3.38 114.38 116.60 1rak h ARG 293 Ca -0.47 -0.11 0.00 0.00 0.07 0.00 0.00 59.98 59.47 1rak h ARG 293 Cb 1.23 0.02 0.00 0.00 0.08 0.00 0.00 29.97 31.30 1rak h ARG 293 CO 0.57 0.72 0.00 0.41 -1.07 0.00 0.00 179.97 180.59 1rak n GLY 294 N 0.52 0.60 3.89 0.04 0.00 -1.26 -4.45 105.19 104.53 1rak n GLY 294 Ca -0.08 -0.33 -0.32 0.00 0.00 0.00 0.00 46.02 45.28 1rak n GLY 294 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1rak s ILE 295 N -2.00 5.17 1.26 -0.61 1.01 -1.26 -4.66 121.20 120.11 1rak s ILE 295 Ca 0.00 0.10 -0.17 0.00 0.00 0.00 0.00 60.65 60.58 1rak s ILE 295 Cb 0.00 -3.62 0.31 0.00 0.01 0.00 0.00 42.46 39.16 1rak s ILE 295 CO 0.00 0.10 1.00 0.28 0.00 0.00 0.00 174.94 176.31 1rak s THR 296 N -1.59 1.70 -1.46 2.92 -1.32 -1.26 -4.34 115.64 110.29 1rak s THR 296 Ca 0.39 0.00 -0.11 0.00 -1.21 0.00 0.00 61.69 60.76 1rak s THR 296 Cb -0.12 -2.11 -0.06 0.00 -1.51 0.00 0.00 72.50 68.69 1rak s THR 296 CO 0.23 0.00 2.67 0.54 -2.21 0.00 0.00 174.62 175.85 1rak n ARG 297 N -5.15 3.23 -0.07 7.08 1.74 -1.26 -4.72 116.66 117.51 1rak n ARG 297 Ca 0.07 -2.15 -0.07 0.00 -0.77 0.00 0.00 57.85 54.92 1rak n ARG 297 Cb 0.57 -2.84 -0.01 0.00 -1.02 0.00 0.00 32.46 29.16 1rak n ARG 297 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 1rak h VAL 298 N 3.30 0.81 -0.33 1.55 2.07 -1.96 -0.64 116.25 121.05 1rak h VAL 298 Ca 0.75 -0.03 0.03 0.00 0.82 0.00 0.00 66.70 68.27 1rak h VAL 298 Cb 0.34 0.72 -0.03 0.00 -1.52 0.00 0.00 31.29 30.80 1rak h VAL 298 CO 1.76 0.01 0.14 0.50 0.02 0.00 0.00 177.57 180.01 1rak h LYS 299 N 0.08 0.30 -0.41 1.57 3.64 -1.86 -0.94 116.57 118.95 1rak h LYS 299 Ca 0.13 -0.02 -0.09 0.00 -1.27 0.00 0.00 60.65 59.40 1rak h LYS 299 Cb 0.16 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 31.90 1rak h LYS 299 CO -0.21 0.20 -0.12 0.93 -2.27 0.00 0.00 179.45 177.97 1rak h GLU 300 N 0.31 0.74 -0.39 1.90 3.07 -1.90 -1.58 114.58 116.72 1rak h GLU 300 Ca 0.14 -0.25 -0.00 0.00 -0.50 0.00 0.00 59.36 58.76 1rak h GLU 300 Cb 0.08 -0.06 -0.02 0.00 -0.84 0.00 0.00 28.75 27.91 1rak h GLU 300 CO -0.12 0.83 0.24 0.52 -1.40 0.00 0.00 179.01 179.08 1rak h MET 301 N 0.67 0.53 -0.69 2.33 2.86 -0.63 -0.96 114.93 119.04 1rak h MET 301 Ca 0.11 -0.05 -0.01 0.00 -2.06 0.00 0.00 59.70 57.70 1rak h MET 301 Cb 0.59 -0.11 -0.03 0.00 0.06 0.00 0.00 31.60 32.11 1rak h MET 301 CO 0.04 0.39 0.41 -0.07 1.06 0.00 0.00 176.91 178.73 1rak h LEU 302 N 0.52 0.84 -1.59 1.22 3.38 -0.92 -0.24 115.31 118.51 1rak h LEU 302 Ca 0.14 -0.07 -0.05 0.00 0.09 0.00 0.00 57.88 58.00 1rak h LEU 302 Cb -0.01 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.52 1rak h LEU 302 CO -0.03 0.66 -0.22 -0.33 0.09 0.00 0.00 178.44 178.62 1rak h GLU 303 N 0.94 0.00 -0.09 1.13 5.08 -0.95 -2.57 114.58 118.13 1rak h GLU 303 Ca 0.25 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.61 1rak h GLU 303 Cb -0.01 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.24 1rak h GLU 303 CO -0.04 0.22 0.00 0.43 -1.00 0.00 0.00 179.01 178.61 1rak n SER 304 N -4.13 2.03 -0.60 1.42 7.64 -0.40 -4.95 113.62 114.65 1rak n SER 304 Ca -0.02 -1.70 -0.07 0.00 1.01 0.00 0.00 58.87 58.09 1rak n SER 304 Cb 0.28 -0.05 -0.02 0.00 -1.01 0.00 0.00 64.21 63.42 1rak n SER 304 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1rak n GLY 305 N 1.23 0.62 3.72 0.23 0.00 -0.62 -5.00 105.19 105.37 1rak n GLY 305 Ca 0.17 -0.70 -0.38 0.00 0.00 0.00 0.00 46.02 45.11 1rak n GLY 305 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1rak s ILE 306 N -2.28 5.18 -0.13 -0.61 1.01 -0.20 -5.02 121.20 119.15 1rak s ILE 306 Ca 0.00 0.97 -0.29 0.00 0.00 0.00 0.00 60.65 61.33 1rak s ILE 306 Cb 0.00 -3.83 -0.04 0.00 0.01 0.00 0.00 42.46 38.60 1rak s ILE 306 CO 0.00 0.31 1.56 0.21 0.00 0.00 0.00 174.94 177.02 1rak s ASN 307 N 0.68 6.64 0.04 3.58 2.47 -1.26 -4.26 114.94 122.83 1rak s ASN 307 Ca 0.26 1.94 0.03 0.00 0.42 0.00 0.00 52.86 55.51 1rak s ASN 307 Cb -0.15 -2.53 -0.02 0.00 -1.45 0.00 0.00 41.25 37.09 1rak s ASN 307 CO 0.11 -0.99 -0.09 0.54 -3.72 0.00 0.00 177.10 172.94 1rak s VAL 308 N 4.27 0.69 0.27 -5.21 0.11 -1.26 -1.39 120.40 117.87 1rak s VAL 308 Ca 0.69 -0.91 -0.10 0.00 -2.93 0.00 0.00 61.98 58.73 1rak s VAL 308 Cb -0.28 -0.68 -0.00 0.00 -1.53 0.00 0.00 36.38 33.88 1rak s VAL 308 CO 0.26 -0.19 0.46 0.00 -3.33 0.00 0.00 175.10 172.30 1rak s PHE 310 N -3.78 2.70 0.29 0.00 0.08 -0.44 -0.76 117.98 116.07 1rak s PHE 310 Ca 0.25 -0.32 0.11 0.00 0.12 0.00 0.00 56.93 57.10 1rak s PHE 310 Cb -0.00 -1.67 -0.05 0.00 -0.57 0.00 0.00 43.02 40.72 1rak s PHE 310 CO 0.11 0.06 -0.17 0.20 -0.10 0.00 0.00 175.22 175.32 1rak s GLY 311 N -0.43 1.95 0.05 4.36 0.00 -0.34 -4.50 107.32 108.42 1rak s GLY 311 Ca 0.05 -1.92 0.08 0.00 0.00 0.00 0.00 44.72 42.93 1rak s GLY 311 CO 0.02 -1.98 1.03 0.84 0.00 0.00 0.00 173.10 173.01 1rak h HIS 312 N 2.21 0.04 0.00 1.90 2.76 -1.89 -3.37 115.15 116.80 1rak h HIS 312 Ca -0.41 -0.03 0.00 0.00 -2.20 0.00 0.00 60.37 57.74 1rak h HIS 312 Cb 1.26 -0.00 0.00 0.00 1.55 0.00 0.00 27.41 30.22 1rak h HIS 312 CO 0.80 1.03 0.00 -3.47 -1.30 0.00 0.00 177.93 174.99 1rak n ASP 313 N -3.25 0.00 -4.07 3.26 2.03 0.72 -4.54 116.55 110.70 1rak n ASP 313 Ca -0.07 0.00 -0.17 0.00 0.52 0.00 0.00 54.79 55.07 1rak n ASP 313 Cb 0.99 0.00 -0.13 0.00 -0.72 0.00 0.00 41.12 41.26 1rak n ASP 313 CO 0.00 0.00 0.00 -0.44 -1.92 0.00 0.00 177.20 174.84 1rak s SER 314 N 0.00 1.15 -0.26 1.67 0.01 -1.26 -1.15 113.70 113.85 1rak s SER 314 Ca 0.00 -0.39 -0.01 0.00 1.31 0.00 0.00 55.95 56.86 1rak s SER 314 Cb 0.00 -0.05 0.08 0.00 0.21 0.00 0.00 66.02 66.25 1rak s SER 314 CO 0.00 -0.03 0.04 -0.69 0.41 0.00 0.00 173.24 172.97 1rak s VAL 315 N -0.82 1.02 -0.97 3.43 1.01 -1.26 -4.86 120.40 117.95 1rak s VAL 315 Ca -0.02 -1.17 -0.11 0.00 0.00 0.00 0.00 61.98 60.68 1rak s VAL 315 Cb -0.07 -1.58 -0.00 0.00 0.00 0.00 0.00 36.38 34.73 1rak s VAL 315 CO 0.01 -0.40 0.72 0.33 0.00 0.00 0.00 175.10 175.76 1rak n PHE 316 N 4.83 -2.17 -4.10 5.22 -0.00 -0.70 -2.06 117.46 118.48 1rak n PHE 316 Ca -0.06 0.69 -0.07 0.00 -0.00 0.00 0.00 57.45 58.01 1rak n PHE 316 Cb 0.44 -3.40 -0.03 0.00 -0.00 0.00 0.00 39.48 36.49 1rak n PHE 316 CO 0.00 0.00 0.00 -0.40 -0.00 0.00 0.00 176.76 176.36 1rak n ASP 317 N -2.45 -0.23 -0.04 -2.13 3.85 -0.17 -1.12 116.55 114.26 1rak n ASP 317 Ca -0.13 -1.74 0.24 0.00 -0.71 0.00 0.00 54.79 52.45 1rak n ASP 317 Cb 0.60 0.56 0.72 0.00 -1.35 0.00 0.00 41.12 41.65 1rak n ASP 317 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.20 175.54 1rak h PRO 318 N 0.00 0.00 -0.02 0.11 0.11 -1.85 -1.93 132.00 128.42 1rak h PRO 318 Ca -0.08 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.03 1rak h PRO 318 Cb 0.40 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.51 1rak h PRO 318 CO 0.12 0.00 -0.22 0.91 -0.21 0.00 0.00 178.00 178.60 1rak n TRP 319 N -4.05 0.00 -3.24 0.65 8.01 -1.26 -4.64 117.44 112.90 1rak n TRP 319 Ca 0.12 0.00 0.03 0.00 -1.31 0.00 0.00 57.50 56.35 1rak n TRP 319 Cb 0.76 0.00 -0.02 0.00 -2.01 0.00 0.00 31.31 30.04 1rak n TRP 319 CO 0.00 0.00 0.00 -0.47 -1.01 0.00 0.00 177.69 176.21 1rak s TYR 320 N -2.17 -1.12 -2.00 -5.99 6.14 -0.73 -4.87 117.35 106.61 1rak s TYR 320 Ca 0.23 1.37 0.23 0.00 0.64 0.00 0.00 57.07 59.54 1rak s TYR 320 Cb 0.19 0.46 1.37 0.00 0.42 0.00 0.00 41.96 44.40 1rak s TYR 320 CO 0.42 -0.60 1.84 -0.35 0.64 0.00 0.00 175.55 177.50 1rak n PRO 321 N 5.38 0.93 -0.48 4.97 -0.04 -1.26 -1.00 135.00 143.51 1rak n PRO 321 Ca -0.05 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.41 1rak n PRO 321 Cb 0.52 -1.39 0.00 0.00 -0.04 0.00 0.00 33.50 32.59 1rak n PRO 321 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1rak n LEU 322 N -0.89 0.00 0.00 1.53 4.77 -1.26 -4.68 117.00 116.48 1rak n LEU 322 Ca 0.17 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.15 1rak n LEU 322 Cb 0.08 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.17 1rak n LEU 322 CO 0.13 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 176.80 1rak n GLY 323 N 3.61 2.47 0.29 -0.72 0.00 -1.26 -1.72 105.19 107.86 1rak n GLY 323 Ca 0.00 -1.67 0.04 0.00 0.00 0.00 0.00 46.02 44.40 1rak n GLY 323 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1rak n THR 324 N 1.38 0.83 -3.68 2.61 -2.24 -1.26 -4.82 114.28 107.10 1rak n THR 324 Ca 0.00 -0.99 -0.25 0.00 -2.27 0.00 0.00 64.05 60.54 1rak n THR 324 Cb 0.00 0.20 0.06 0.00 -2.10 0.00 0.00 70.33 68.49 1rak n THR 324 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1rak n ALA 325 N -0.62 -1.44 -2.65 6.98 0.00 -1.26 -4.76 120.51 116.75 1rak n ALA 325 Ca 0.07 0.25 -0.41 0.00 0.00 0.00 0.00 53.44 53.35 1rak n ALA 325 Cb 0.66 -4.61 -0.11 0.00 0.00 0.00 0.00 19.45 15.39 1rak n ALA 325 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 1rak s ASN 326 N -3.52 5.89 0.30 0.00 3.84 -1.26 -4.68 114.94 115.51 1rak s ASN 326 Ca 0.50 -0.71 0.06 0.00 0.21 0.00 0.00 52.86 52.92 1rak s ASN 326 Cb -0.23 -2.09 0.49 0.00 -0.55 0.00 0.00 41.25 38.87 1rak s ASN 326 CO 0.76 -0.32 1.73 0.24 -2.79 0.00 0.00 177.10 176.72 1rak h MET 327 N 8.49 0.28 0.00 0.43 2.86 -1.93 -2.21 114.93 122.85 1rak h MET 327 Ca -0.29 -0.12 -0.04 0.00 -2.06 0.00 0.00 59.70 57.19 1rak h MET 327 Cb 1.13 -0.01 -0.01 0.00 0.06 0.00 0.00 31.60 32.77 1rak h MET 327 CO 0.66 0.60 -0.21 -0.07 1.06 0.00 0.00 176.91 178.96 1rak h LEU 328 N 0.25 0.00 -0.10 1.22 3.38 -1.95 0.45 115.31 118.56 1rak h LEU 328 Ca 0.03 0.00 -0.24 0.00 0.09 0.00 0.00 57.88 57.76 1rak h LEU 328 Cb 0.73 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.50 1rak h LEU 328 CO 0.06 0.21 -0.87 -0.61 0.09 0.00 0.00 178.44 177.31 1rak h GLN 329 N 0.00 0.77 -0.23 1.13 4.15 -1.83 -0.94 115.11 118.17 1rak h GLN 329 Ca -0.00 -0.69 -0.00 0.00 0.77 0.00 0.00 58.65 58.72 1rak h GLN 329 Cb 0.41 0.16 -0.01 0.00 0.21 0.00 0.00 27.48 28.25 1rak h GLN 329 CO 0.03 1.29 0.13 0.28 -1.93 0.00 0.00 178.83 178.63 1rak h VAL 330 N 0.50 1.10 -0.41 2.39 2.07 -0.97 -2.25 116.25 118.68 1rak h VAL 330 Ca -0.08 -0.27 0.03 0.00 0.82 0.00 0.00 66.70 67.20 1rak h VAL 330 Cb 1.51 0.87 -0.03 0.00 -1.52 0.00 0.00 31.29 32.12 1rak h VAL 330 CO 0.18 0.10 0.22 0.25 0.02 0.00 0.00 177.57 178.34 1rak h LEU 331 N 0.27 0.34 -0.44 2.57 5.85 -0.88 -1.52 115.31 121.50 1rak h LEU 331 Ca 0.08 0.01 0.07 0.00 0.84 0.00 0.00 57.88 58.89 1rak h LEU 331 Cb 0.05 -0.05 -0.06 0.00 0.37 0.00 0.00 40.66 40.96 1rak h LEU 331 CO -0.01 0.24 0.07 -0.74 -0.34 0.00 0.00 178.44 177.66 1rak h HIS 332 N 0.45 0.11 -0.38 1.25 2.76 -0.97 -0.00 115.15 118.36 1rak h HIS 332 Ca 0.17 0.03 -0.02 0.00 -2.20 0.00 0.00 60.37 58.35 1rak h HIS 332 Cb 0.05 0.02 -0.02 0.00 1.55 0.00 0.00 27.41 29.02 1rak h HIS 332 CO -0.09 -0.02 0.14 1.98 -1.30 0.00 0.00 177.93 178.65 1rak h MET 333 N 0.20 0.57 -0.85 5.26 1.85 -1.01 -2.76 114.93 118.18 1rak h MET 333 Ca 0.22 -0.11 -0.01 0.00 -0.61 0.00 0.00 59.70 59.19 1rak h MET 333 Cb 0.29 -0.09 -0.04 0.00 0.43 0.00 0.00 31.60 32.19 1rak h MET 333 CO -0.30 0.55 0.51 0.78 -0.40 0.00 0.00 176.91 178.04 1rak h GLY 334 N 0.46 1.25 1.29 1.39 0.00 -0.69 -1.05 103.07 105.72 1rak h GLY 334 Ca 0.12 -0.53 -0.05 0.00 0.00 0.00 0.00 47.33 46.88 1rak h GLY 334 CO -0.01 0.51 0.17 1.41 0.00 0.00 0.00 176.54 178.62 1rak h LEU 335 N 1.18 0.83 0.12 3.11 3.38 -0.89 -0.76 115.31 122.27 1rak h LEU 335 Ca 0.31 -0.14 -0.01 0.00 0.09 0.00 0.00 57.88 58.13 1rak h LEU 335 Cb -0.03 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 40.50 1rak h LEU 335 CO -0.06 0.79 -0.06 0.45 0.09 0.00 0.00 178.44 179.65 1rak h HIS 336 N 0.86 -0.15 -0.29 1.13 3.86 -1.18 0.08 115.15 119.46 1rak h HIS 336 Ca 0.19 -0.00 -0.08 0.00 -1.16 0.00 0.00 60.37 59.32 1rak h HIS 336 Cb 0.27 0.05 -0.02 0.00 1.06 0.00 0.00 27.41 28.77 1rak h HIS 336 CO 0.02 0.30 -0.18 0.28 0.86 0.00 0.00 177.93 179.21 1rak h VAL 337 N -0.69 1.25 -0.01 2.45 2.07 -1.17 -2.37 116.25 117.79 1rak h VAL 337 Ca -0.02 -1.14 0.00 0.00 0.82 0.00 0.00 66.70 66.36 1rak h VAL 337 Cb 0.52 1.22 0.00 0.00 -1.52 0.00 0.00 31.29 31.51 1rak h VAL 337 CO 0.03 0.37 -0.05 0.00 0.02 0.00 0.00 177.57 177.94 1rak n GLN 339 N -0.37 -6.51 -2.78 0.00 6.02 -0.79 -4.77 117.38 108.18 1rak n GLN 339 Ca 0.18 0.72 -0.42 0.00 -0.01 0.00 0.00 57.00 57.47 1rak n GLN 339 Cb 0.29 -5.64 0.01 0.00 1.02 0.00 0.00 30.24 25.92 1rak n GLN 339 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 1rak n LEU 340 N -4.69 6.84 -0.79 1.08 4.77 -0.05 -4.72 117.00 119.43 1rak n LEU 340 Ca -0.05 -5.21 0.07 0.00 -0.03 0.00 0.00 56.01 50.78 1rak n LEU 340 Cb 0.58 -1.26 0.19 0.00 -2.33 0.00 0.00 43.42 40.60 1rak n LEU 340 CO 0.69 1.80 0.66 0.23 -1.33 0.00 0.00 177.39 179.44 1rak n MET 341 N 1.09 2.86 -1.95 3.23 2.81 -1.26 -3.96 117.12 119.95 1rak n MET 341 Ca 0.36 -2.20 -0.32 0.00 -1.81 0.00 0.00 57.70 53.72 1rak n MET 341 Cb 0.31 -1.35 0.02 0.00 -0.71 0.00 0.00 33.22 31.49 1rak n MET 341 CO 0.00 0.00 0.00 0.20 1.51 0.00 0.00 175.97 177.68 1rak s GLY 342 N -1.02 2.05 0.15 3.03 0.00 -1.26 -4.84 107.32 105.43 1rak s GLY 342 Ca 0.29 0.36 -0.18 0.00 0.00 0.00 0.00 44.72 45.19 1rak s GLY 342 CO 0.19 0.67 1.69 -1.82 0.00 0.00 0.00 173.10 173.84 1rak h TYR 343 N 0.23 -0.10 -0.51 1.90 3.20 -2.00 -0.71 116.97 118.99 1rak h TYR 343 Ca -0.46 0.03 -0.06 0.00 3.14 0.00 0.00 58.73 61.37 1rak h TYR 343 Cb 1.22 0.09 -0.02 0.00 1.54 0.00 0.00 36.73 39.56 1rak h TYR 343 CO 0.59 -0.10 0.06 0.78 -1.64 0.00 0.00 178.16 177.85 1rak h GLY 344 N 0.04 0.87 1.02 1.82 0.00 -1.98 -0.25 103.07 104.59 1rak h GLY 344 Ca 0.16 -0.54 -0.05 0.00 0.00 0.00 0.00 47.33 46.90 1rak h GLY 344 CO -0.30 0.50 0.17 1.46 0.00 0.00 0.00 176.54 178.37 1rak h GLN 345 N 0.76 0.98 -0.18 4.80 4.20 -1.70 0.27 115.11 124.24 1rak h GLN 345 Ca 0.16 -0.22 -0.05 0.00 0.06 0.00 0.00 58.65 58.59 1rak h GLN 345 Cb 0.37 -0.14 -0.00 0.00 0.30 0.00 0.00 27.48 28.01 1rak h GLN 345 CO 0.01 0.88 -0.09 0.82 -0.67 0.00 0.00 178.83 179.77 1rak h ILE 346 N 0.90 1.31 -0.98 2.54 2.04 -0.88 -2.26 117.51 120.19 1rak h ILE 346 Ca 0.20 -1.16 0.01 0.00 1.00 0.00 0.00 64.86 64.91 1rak h ILE 346 Cb 0.32 1.70 -0.05 0.00 -0.74 0.00 0.00 36.82 38.05 1rak h ILE 346 CO -0.00 0.35 0.65 -1.13 0.00 0.00 0.00 178.15 178.01 1rak h ASN 347 N 0.06 1.13 0.37 1.72 -1.24 -0.88 -0.81 115.58 115.93 1rak h ASN 347 Ca 0.04 -0.03 0.00 0.00 0.71 0.00 0.00 56.30 57.02 1rak h ASN 347 Cb 0.58 -0.28 0.00 0.00 0.73 0.00 0.00 38.32 39.35 1rak h ASN 347 CO 0.03 0.82 0.00 0.47 -1.29 0.00 0.00 177.43 177.46 1rak n ASP 348 N -4.40 0.00 -0.13 1.15 8.00 0.07 -3.93 116.55 117.31 1rak n ASP 348 Ca 0.11 -0.41 0.17 0.00 0.71 0.00 0.00 54.79 55.38 1rak n ASP 348 Cb 0.01 -0.19 0.56 0.00 -0.02 0.00 0.00 41.12 41.48 1rak n ASP 348 CO 0.00 0.00 0.00 1.23 -0.39 0.00 0.00 177.20 178.04 1rak h GLY 349 N 4.86 0.51 0.85 0.44 0.00 -0.51 -1.32 103.07 107.89 1rak h GLY 349 Ca 0.00 -0.13 0.15 0.00 0.00 0.00 0.00 47.33 47.36 1rak h GLY 349 CO 0.00 0.04 0.43 1.41 0.00 0.00 0.00 176.54 178.42 1rak h LEU 350 N 0.29 0.00 -1.81 3.11 3.38 -1.76 0.10 115.31 118.61 1rak h LEU 350 Ca 0.35 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.31 1rak h LEU 350 Cb 0.95 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.69 1rak h LEU 350 CO -0.09 0.00 0.01 0.78 0.09 0.00 0.00 178.44 179.24 1rak h ASN 351 N 0.00 0.11 0.68 -0.43 2.35 -1.56 -1.79 115.58 114.95 1rak h ASN 351 Ca 0.25 -0.01 0.00 0.00 -0.55 0.00 0.00 56.30 56.00 1rak h ASN 351 Cb 1.10 -0.03 0.00 0.00 0.05 0.00 0.00 38.32 39.44 1rak h ASN 351 CO -0.00 0.13 0.00 -0.07 -1.65 0.00 0.00 177.43 175.83 1rak h LEU 352 N 0.13 0.00 -2.69 1.61 3.38 -1.15 -1.05 115.31 115.53 1rak h LEU 352 Ca 0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.00 1rak h LEU 352 Cb 0.07 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.82 1rak h LEU 352 CO -0.00 0.00 -0.01 2.30 0.09 0.00 0.00 178.44 180.82 1rak n ILE 353 N -2.42 0.91 0.00 1.22 -5.35 -0.74 -1.33 119.36 111.65 1rak n ILE 353 Ca 0.01 -0.94 0.00 0.00 -0.27 0.00 0.00 62.75 61.55 1rak n ILE 353 Cb 0.22 0.51 0.00 0.00 -1.74 0.00 0.00 39.64 38.63 1rak n ILE 353 CO 0.00 0.00 0.00 0.35 -1.76 0.00 0.00 176.55 175.14 1rak n THR 354 N -0.50 0.00 -0.23 7.28 -2.24 -0.82 -2.10 114.28 115.66 1rak n THR 354 Ca 0.01 0.00 0.01 0.00 -2.27 0.00 0.00 64.05 61.81 1rak n THR 354 Cb 0.33 0.00 0.13 0.00 -2.10 0.00 0.00 70.33 68.69 1rak n THR 354 CO 0.00 0.00 0.00 0.45 -0.57 0.00 0.00 175.07 174.95 1rak h HIS 355 N 0.00 0.53 -0.33 4.78 3.86 -1.78 -0.91 115.15 121.30 1rak h HIS 355 Ca 0.00 0.03 -0.08 0.00 -1.16 0.00 0.00 60.37 59.16 1rak h HIS 355 Cb 0.00 -0.13 -0.02 0.00 1.06 0.00 0.00 27.41 28.32 1rak h HIS 355 CO 0.00 0.15 -0.15 0.45 0.86 0.00 0.00 177.93 179.24 1rak h HIS 356 N 0.51 0.63 -0.14 2.45 3.86 -1.51 -1.99 115.15 118.96 1rak h HIS 356 Ca 0.34 -0.11 -0.16 0.00 -1.16 0.00 0.00 60.37 59.28 1rak h HIS 356 Cb 0.41 -0.16 -0.01 0.00 1.06 0.00 0.00 27.41 28.71 1rak h HIS 356 CO -0.14 0.71 -0.61 0.77 0.86 0.00 0.00 177.93 179.52 1rak h SER 357 N 0.53 0.53 -0.81 2.45 0.02 -1.54 -1.97 113.55 112.75 1rak h SER 357 Ca 0.09 -0.30 -0.04 0.00 -0.84 0.00 0.00 61.79 60.70 1rak h SER 357 Cb 0.57 -0.15 -0.04 0.00 0.14 0.00 0.00 62.40 62.92 1rak h SER 357 CO 0.04 1.01 0.35 0.00 -1.14 0.00 0.00 176.83 177.09 1rak h ALA 358 N 1.00 1.05 -0.63 3.77 0.00 -0.86 -1.60 119.26 121.99 1rak h ALA 358 Ca -0.01 -0.18 -0.06 0.00 0.00 0.00 0.00 54.91 54.67 1rak h ALA 358 Cb 1.15 -0.32 -0.03 0.00 0.00 0.00 0.00 17.79 18.60 1rak h ALA 358 CO 0.11 0.65 0.17 -0.09 0.00 0.00 0.00 179.25 180.09 1rak h ARG 359 N 1.17 0.99 -0.80 0.00 2.43 -1.19 -1.62 114.38 115.36 1rak h ARG 359 Ca 0.27 -0.23 0.04 0.00 -0.81 0.00 0.00 59.98 59.26 1rak h ARG 359 Cb 0.18 -0.14 -0.05 0.00 -0.42 0.00 0.00 29.97 29.54 1rak h ARG 359 CO -0.03 0.89 0.53 1.15 -1.51 0.00 0.00 179.97 181.00 1rak h THR 360 N 0.91 1.12 -0.09 0.20 2.02 -0.87 -0.74 112.91 115.46 1rak h THR 360 Ca 0.20 -0.33 0.00 0.00 0.77 0.00 0.00 66.41 67.05 1rak h THR 360 Cb 0.33 0.06 0.00 0.00 -1.74 0.00 0.00 68.15 66.79 1rak h THR 360 CO -0.00 0.18 0.00 0.18 0.37 0.00 0.00 175.52 176.25 1rak n LEU 361 N -4.45 0.98 -3.50 2.58 4.32 -0.65 -4.88 117.00 111.40 1rak n LEU 361 Ca 0.11 -0.40 -0.25 0.00 -0.02 0.00 0.00 56.01 55.44 1rak n LEU 361 Cb 0.13 -0.05 0.04 0.00 -1.62 0.00 0.00 43.42 41.91 1rak n LEU 361 CO 0.35 0.20 0.09 -3.20 -1.22 0.00 0.00 177.39 173.61 1rak n ASN 362 N -0.15 -5.43 -4.76 -1.43 5.15 -0.29 -4.93 115.26 103.43 1rak n ASN 362 Ca 0.16 -0.52 -0.41 0.00 -0.60 0.00 0.00 54.58 53.21 1rak n ASN 362 Cb 0.23 -4.35 -0.03 0.00 -0.53 0.00 0.00 39.78 35.10 1rak n ASN 362 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 1rak s LEU 363 N -7.00 4.44 0.00 1.20 1.43 -0.67 -4.95 118.68 113.13 1rak s LEU 363 Ca 0.51 2.55 0.18 0.00 -1.03 0.00 0.00 54.13 56.34 1rak s LEU 363 Cb -0.24 -3.63 -0.15 0.00 0.03 0.00 0.00 46.19 42.20 1rak s LEU 363 CO 0.62 -0.48 0.79 0.00 0.23 0.00 0.00 176.35 177.51 1rak n GLN 364 N 1.41 1.29 -3.47 1.70 1.13 -1.26 -4.72 117.38 113.46 1rak n GLN 364 Ca 0.02 -0.21 -0.27 0.00 -1.94 0.00 0.00 57.00 54.60 1rak n GLN 364 Cb 0.42 -1.33 -0.10 0.00 0.11 0.00 0.00 30.24 29.34 1rak n GLN 364 CO 0.00 0.00 0.00 0.34 -1.44 0.00 0.00 177.06 175.96 1rak s ASP 365 N -2.53 1.96 -0.16 1.08 3.68 -1.26 -5.09 116.67 114.35 1rak s ASP 365 Ca 0.09 -3.13 -0.10 0.00 2.13 0.00 0.00 52.55 51.54 1rak s ASP 365 Cb 0.14 -0.60 0.05 0.00 -1.45 0.00 0.00 42.92 41.06 1rak s ASP 365 CO 0.66 -0.17 0.39 -0.47 0.13 0.00 0.00 175.17 175.71 1rak s TYR 366 N -0.09 -0.54 0.00 -5.34 6.14 -1.26 -4.81 117.35 111.44 1rak s TYR 366 Ca 0.31 1.19 0.00 0.00 0.64 0.00 0.00 57.07 59.21 1rak s TYR 366 Cb 0.01 0.22 0.00 0.00 0.42 0.00 0.00 41.96 42.61 1rak s TYR 366 CO -0.18 -0.31 0.00 0.41 0.64 0.00 0.00 175.55 176.11 1rak n GLY 367 N 4.00 3.45 3.52 8.97 0.00 -1.26 -4.94 105.19 118.93 1rak n GLY 367 Ca -0.22 -1.79 -0.42 0.00 0.00 0.00 0.00 46.02 43.60 1rak n GLY 367 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1rak s ILE 368 N -2.32 4.26 -0.04 -0.61 -1.09 -1.26 -4.85 121.20 115.28 1rak s ILE 368 Ca 0.00 -1.18 -0.14 0.00 -2.23 0.00 0.00 60.65 57.11 1rak s ILE 368 Cb 0.00 -4.96 0.02 0.00 -1.58 0.00 0.00 42.46 35.94 1rak s ILE 368 CO 0.00 -1.78 0.31 0.00 -1.23 0.00 0.00 174.94 172.24 1rak s ALA 369 N 4.00 -0.77 0.28 9.38 0.00 -1.26 -5.09 121.76 128.30 1rak s ALA 369 Ca 0.42 0.45 -0.30 0.00 0.00 0.00 0.00 51.96 52.53 1rak s ALA 369 Cb -0.02 -0.07 -0.12 0.00 0.00 0.00 0.00 23.12 22.91 1rak s ALA 369 CO -0.09 -0.23 1.54 0.00 0.00 0.00 0.00 175.76 176.98 1rak n ALA 370 N 1.68 2.11 0.00 0.00 0.00 -1.26 -2.10 120.51 120.94 1rak n ALA 370 Ca -0.20 0.38 0.00 0.00 0.00 0.00 0.00 53.44 53.63 1rak n ALA 370 Cb 0.56 -2.41 0.00 0.00 0.00 0.00 0.00 19.45 17.61 1rak n ALA 370 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1rak n GLY 371 N 2.14 3.28 3.86 0.00 0.00 0.35 -5.01 105.19 109.81 1rak n GLY 371 Ca 0.09 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.80 1rak n GLY 371 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1rak s ASN 372 N -0.24 6.31 0.58 1.61 -0.87 -0.89 -4.79 114.94 116.65 1rak s ASN 372 Ca 0.00 1.48 -0.20 0.00 -1.57 0.00 0.00 52.86 52.57 1rak s ASN 372 Cb 0.00 -2.48 -0.04 0.00 -0.02 0.00 0.00 41.25 38.71 1rak s ASN 372 CO 0.00 -0.81 1.28 -0.44 -2.57 0.00 0.00 177.10 174.56 1rak s SER 373 N -3.82 5.17 -1.40 -1.22 0.01 -1.26 -0.77 113.70 110.41 1rak s SER 373 Ca 0.56 2.57 -0.15 0.00 1.31 0.00 0.00 55.95 60.24 1rak s SER 373 Cb -0.11 -2.62 0.05 0.00 0.21 0.00 0.00 66.02 63.55 1rak s SER 373 CO 0.47 -1.62 2.08 0.00 0.41 0.00 0.00 173.24 174.58 1rak n ALA 374 N -1.36 4.93 -3.76 1.44 0.00 0.14 -4.56 120.51 117.34 1rak n ALA 374 Ca 0.12 -3.86 -0.34 0.00 0.00 0.00 0.00 53.44 49.36 1rak n ALA 374 Cb 0.47 -3.56 -0.14 0.00 0.00 0.00 0.00 19.45 16.22 1rak n ALA 374 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 1rak s ASN 375 N 3.53 4.38 0.12 0.00 0.01 -1.26 -1.53 114.94 120.19 1rak s ASN 375 Ca 0.49 -0.99 -0.24 0.00 -0.71 0.00 0.00 52.86 51.41 1rak s ASN 375 Cb 0.11 -1.65 0.08 0.00 0.41 0.00 0.00 41.25 40.20 1rak s ASN 375 CO -0.04 -0.15 0.68 -1.48 -1.51 0.00 0.00 177.10 174.60 1rak s LEU 376 N 1.29 -0.51 0.13 0.60 0.05 -0.15 -4.25 118.68 115.83 1rak s LEU 376 Ca -0.02 -0.01 0.05 0.00 0.05 0.00 0.00 54.13 54.21 1rak s LEU 376 Cb -0.17 2.45 -0.04 0.00 -2.05 0.00 0.00 46.19 46.38 1rak s LEU 376 CO -0.04 -0.88 -0.12 0.27 -0.55 0.00 0.00 176.35 175.03 1rak s ILE 377 N -3.59 1.21 -0.15 1.48 -4.36 0.09 -0.23 121.20 115.65 1rak s ILE 377 Ca 0.02 -1.86 0.02 0.00 -0.26 0.00 0.00 60.65 58.57 1rak s ILE 377 Cb -0.01 -1.64 0.01 0.00 1.25 0.00 0.00 42.46 42.07 1rak s ILE 377 CO -0.12 -0.58 -0.21 -0.63 0.24 0.00 0.00 174.94 173.64 1rak s ILE 378 N -2.70 2.05 -0.14 8.37 1.01 -0.04 -1.93 121.20 127.82 1rak s ILE 378 Ca 0.12 -0.96 -0.05 0.00 0.00 0.00 0.00 60.65 59.76 1rak s ILE 378 Cb -0.01 -1.82 -0.04 0.00 0.01 0.00 0.00 42.46 40.60 1rak s ILE 378 CO 0.02 0.54 0.03 -0.76 0.00 0.00 0.00 174.94 174.77 1rak s LEU 379 N 0.96 3.66 -1.51 2.97 1.43 0.09 -0.99 118.68 125.29 1rak s LEU 379 Ca -0.03 0.08 -0.13 0.00 -1.03 0.00 0.00 54.13 53.02 1rak s LEU 379 Cb -0.15 -1.89 0.00 0.00 0.03 0.00 0.00 46.19 44.19 1rak s LEU 379 CO -0.05 0.25 2.45 -0.81 0.23 0.00 0.00 176.35 178.42 1rak n PRO 380 N 2.99 3.15 -3.69 1.29 -0.04 -1.26 -1.27 135.00 136.16 1rak n PRO 380 Ca -0.18 -2.51 -0.10 0.00 -0.04 0.00 0.00 63.50 60.68 1rak n PRO 380 Cb 0.53 -3.13 -0.05 0.00 -0.04 0.00 0.00 33.50 30.81 1rak n PRO 380 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1rak s ALA 381 N 2.78 -0.76 -0.14 0.55 0.00 -1.26 -4.97 121.76 117.95 1rak s ALA 381 Ca 0.54 -0.17 0.15 0.00 0.00 0.00 0.00 51.96 52.47 1rak s ALA 381 Cb 0.15 0.63 0.04 0.00 0.00 0.00 0.00 23.12 23.94 1rak s ALA 381 CO -0.08 -0.60 1.41 0.93 0.00 0.00 0.00 175.76 177.42 1rak h GLU 382 N 2.49 0.00 0.00 0.00 5.08 -1.87 -2.14 114.58 118.13 1rak h GLU 382 Ca -0.34 0.00 0.17 0.00 -1.00 0.00 0.00 59.36 58.19 1rak h GLU 382 Cb 1.24 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 30.46 1rak h GLU 382 CO 0.49 0.51 0.58 0.27 -1.00 0.00 0.00 179.01 179.87 1rak n ASN 383 N -3.21 -1.60 -0.36 1.42 0.23 -1.26 -4.80 115.26 105.68 1rak n ASN 383 Ca 0.01 -1.80 -0.01 0.00 -0.53 0.00 0.00 54.58 52.25 1rak n ASN 383 Cb 0.75 2.59 0.12 0.00 -2.08 0.00 0.00 39.78 41.16 1rak n ASN 383 CO 0.00 0.00 0.00 1.23 -0.93 0.00 0.00 177.26 177.56 1rak h GLY 384 N 1.86 1.39 0.93 4.83 0.00 -1.92 -1.46 103.07 108.71 1rak h GLY 384 Ca -0.25 -0.49 0.00 0.00 0.00 0.00 0.00 47.33 46.59 1rak h GLY 384 CO 0.34 0.45 -0.04 -2.75 0.00 0.00 0.00 176.54 174.54 1rak h PHE 385 N 1.26 -0.10 -0.59 5.60 3.57 -1.77 -1.37 116.94 123.55 1rak h PHE 385 Ca 0.37 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.86 1rak h PHE 385 Cb -0.06 0.04 -0.03 0.00 2.79 0.00 0.00 35.95 38.69 1rak h PHE 385 CO -0.00 -0.07 0.31 0.22 -2.23 0.00 0.00 178.31 176.54 1rak h ASP 386 N -0.09 0.74 -0.66 0.41 3.58 -1.90 0.11 116.42 118.62 1rak h ASP 386 Ca 0.01 -0.10 -0.01 0.00 0.42 0.00 0.00 57.03 57.34 1rak h ASP 386 Cb 0.09 -0.19 -0.03 0.00 1.72 0.00 0.00 39.33 40.92 1rak h ASP 386 CO -0.02 0.63 0.36 0.00 -2.88 0.00 0.00 179.24 177.33 1rak h ALA 387 N 1.14 0.84 -0.09 -0.78 0.00 -1.15 -1.75 119.26 117.47 1rak h ALA 387 Ca 0.21 -0.10 -0.03 0.00 0.00 0.00 0.00 54.91 54.98 1rak h ALA 387 Cb 0.06 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 17.59 1rak h ALA 387 CO -0.03 0.35 -0.08 1.25 0.00 0.00 0.00 179.25 180.74 1rak h LEU 388 N 0.90 0.23 -0.55 0.00 7.12 -0.99 -1.09 115.31 120.92 1rak h LEU 388 Ca 0.23 -0.47 0.02 0.00 0.13 0.00 0.00 57.88 57.80 1rak h LEU 388 Cb 0.04 -0.06 -0.03 0.00 -0.53 0.00 0.00 40.66 40.07 1rak h LEU 388 CO -0.04 0.65 0.34 -0.09 -0.13 0.00 0.00 178.44 179.17 1rak h ARG 389 N -0.19 0.66 -0.01 1.25 2.43 -0.66 -2.72 114.38 115.14 1rak h ARG 389 Ca 0.02 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.15 1rak h ARG 389 Cb 0.58 -0.15 0.00 0.00 -0.42 0.00 0.00 29.97 29.98 1rak h ARG 389 CO 0.02 0.44 -0.04 0.54 -1.51 0.00 0.00 179.97 179.42 1rak n ARG 390 N -4.76 1.57 -3.92 0.20 1.74 -0.67 -4.96 116.66 105.87 1rak n ARG 390 Ca 0.04 -0.94 -0.31 0.00 -0.77 0.00 0.00 57.85 55.87 1rak n ARG 390 Cb 0.07 -1.48 -0.00 0.00 -1.02 0.00 0.00 32.46 30.03 1rak n ARG 390 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 1rak n GLN 391 N 0.11 -1.94 -2.15 5.56 1.13 -0.44 -4.89 117.38 114.75 1rak n GLN 391 Ca 0.18 0.34 -0.34 0.00 -1.94 0.00 0.00 57.00 55.23 1rak n GLN 391 Cb 0.37 -4.00 0.01 0.00 0.11 0.00 0.00 30.24 26.73 1rak n GLN 391 CO 0.00 0.00 0.00 0.14 -1.44 0.00 0.00 177.06 175.76 1rak s VAL 392 N -3.78 3.26 0.91 5.09 -7.23 -1.05 -5.05 120.40 112.55 1rak s VAL 392 Ca 0.23 0.73 -0.13 0.00 -1.81 0.00 0.00 61.98 61.00 1rak s VAL 392 Cb -0.10 -3.26 0.18 0.00 0.56 0.00 0.00 36.38 33.76 1rak s VAL 392 CO 0.90 -0.23 1.25 -2.16 -0.31 0.00 0.00 175.10 174.56 1rak s PRO 393 N -3.51 0.89 -0.36 4.82 0.04 -1.26 -5.01 135.00 130.61 1rak s PRO 393 Ca 0.71 -0.55 -0.20 0.00 0.04 0.00 0.00 61.00 60.99 1rak s PRO 393 Cb -0.22 -1.95 0.00 0.00 0.04 0.00 0.00 34.50 32.37 1rak s PRO 393 CO 0.30 -2.19 0.61 0.08 0.04 0.00 0.00 177.00 175.84 1rak s VAL 394 N -3.73 4.91 0.10 -0.36 1.01 -1.26 -4.35 120.40 116.72 1rak s VAL 394 Ca 0.72 0.48 -0.18 0.00 0.00 0.00 0.00 61.98 63.00 1rak s VAL 394 Cb -0.04 -4.06 -0.07 0.00 0.00 0.00 0.00 36.38 32.21 1rak s VAL 394 CO 0.51 -0.32 1.58 -0.09 0.00 0.00 0.00 175.10 176.78 1rak h ARG 395 N 8.50 0.44 -3.32 2.72 9.65 -1.31 -3.11 114.38 127.94 1rak h ARG 395 Ca -0.27 -0.11 -0.18 0.00 -1.10 0.00 0.00 59.98 58.32 1rak h ARG 395 Cb 1.11 -0.05 -0.26 0.00 -1.39 0.00 0.00 29.97 29.38 1rak h ARG 395 CO 0.83 0.54 -0.51 0.71 2.80 0.00 0.00 179.97 184.34 1rak s TYR 396 N -5.23 -0.18 -0.14 2.20 1.51 -1.19 -1.68 117.35 112.64 1rak s TYR 396 Ca -0.14 0.43 0.02 0.00 -1.01 0.00 0.00 57.07 56.38 1rak s TYR 396 Cb 0.08 0.06 0.01 0.00 -0.11 0.00 0.00 41.96 42.00 1rak s TYR 396 CO 0.74 -0.11 -0.22 0.45 -1.11 0.00 0.00 175.55 175.30 1rak s SER 397 N -0.01 3.11 -0.11 2.29 0.15 -0.27 -0.86 113.70 118.00 1rak s SER 397 Ca -0.01 -0.61 0.02 0.00 0.70 0.00 0.00 55.95 56.05 1rak s SER 397 Cb -0.02 -1.44 -0.01 0.00 -1.71 0.00 0.00 66.02 62.84 1rak s SER 397 CO 0.00 0.08 -0.17 -0.69 1.20 0.00 0.00 173.24 173.67 1rak s VAL 398 N 0.83 2.76 -0.04 4.45 1.01 0.68 -0.40 120.40 129.69 1rak s VAL 398 Ca -0.07 -0.78 0.00 0.00 0.00 0.00 0.00 61.98 61.14 1rak s VAL 398 Cb -0.15 -2.12 0.03 0.00 0.00 0.00 0.00 36.38 34.13 1rak s VAL 398 CO -0.02 0.54 -0.00 -0.60 0.00 0.00 0.00 175.10 175.02 1rak s ARG 399 N 0.16 0.36 -1.80 2.72 3.52 0.30 -0.98 118.95 123.24 1rak s ARG 399 Ca -0.09 0.08 0.00 0.00 -0.13 0.00 0.00 55.73 55.59 1rak s ARG 399 Cb -0.15 -0.56 0.00 0.00 -1.56 0.00 0.00 34.95 32.67 1rak s ARG 399 CO 0.06 -0.16 0.00 0.41 -0.81 0.00 0.00 175.30 174.80 1rak n GLY 400 N 4.29 0.19 2.08 8.12 0.00 -0.68 -1.69 105.19 117.50 1rak n GLY 400 Ca -0.23 -0.06 0.00 0.00 0.00 0.00 0.00 46.02 45.73 1rak n GLY 400 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1rak n GLY 401 N -0.89 0.50 3.27 -0.02 0.00 -0.58 -4.39 105.19 103.08 1rak n GLY 401 Ca -0.22 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.53 1rak n GLY 401 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1rak s LYS 402 N -0.07 1.45 -0.11 1.61 1.02 -0.68 -4.24 119.74 118.73 1rak s LYS 402 Ca 0.00 -1.00 -0.30 0.00 0.02 0.00 0.00 55.97 54.70 1rak s LYS 402 Cb 0.00 -1.60 -0.03 0.00 -0.52 0.00 0.00 37.83 35.68 1rak s LYS 402 CO 0.00 0.41 1.29 0.08 -0.92 0.00 0.00 175.35 176.21 1rak s VAL 403 N -0.83 4.15 -0.72 3.17 1.01 -1.26 -0.54 120.40 125.39 1rak s VAL 403 Ca 0.08 1.44 0.10 0.00 0.00 0.00 0.00 61.98 63.61 1rak s VAL 403 Cb -0.09 -3.93 -0.06 0.00 0.00 0.00 0.00 36.38 32.30 1rak s VAL 403 CO 0.02 -0.08 0.54 2.30 0.00 0.00 0.00 175.10 177.88 1rak n ILE 404 N 5.09 0.00 -3.53 2.22 -5.35 0.46 -4.95 119.36 113.30 1rak n ILE 404 Ca 0.13 -0.32 -0.16 0.00 -0.27 0.00 0.00 62.75 62.13 1rak n ILE 404 Cb 0.45 1.06 -0.06 0.00 -1.74 0.00 0.00 39.64 39.35 1rak n ILE 404 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1rak s ALA 405 N -1.71 -1.80 -0.08 -1.28 0.00 -1.19 -4.96 121.76 110.74 1rak s ALA 405 Ca 0.06 1.39 -0.20 0.00 0.00 0.00 0.00 51.96 53.21 1rak s ALA 405 Cb 0.08 -0.17 0.04 0.00 0.00 0.00 0.00 23.12 23.08 1rak s ALA 405 CO 0.35 -0.36 0.48 -1.54 0.00 0.00 0.00 175.76 174.69 1rak s SER 406 N -1.14 -0.43 -0.12 0.00 1.04 -1.26 -1.11 113.70 110.67 1rak s SER 406 Ca -0.09 0.57 0.00 0.00 0.48 0.00 0.00 55.95 56.91 1rak s SER 406 Cb -0.00 0.61 0.02 0.00 0.10 0.00 0.00 66.02 66.75 1rak s SER 406 CO 0.08 -0.41 -0.10 -0.89 0.98 0.00 0.00 173.24 172.91 1rak s THR 407 N -0.77 1.19 -0.35 2.02 2.01 -0.68 -4.99 115.64 114.08 1rak s THR 407 Ca -0.08 -0.40 -0.26 0.00 0.31 0.00 0.00 61.69 61.25 1rak s THR 407 Cb -0.03 -1.17 0.01 0.00 0.01 0.00 0.00 72.50 71.32 1rak s THR 407 CO 0.05 0.39 0.95 -1.58 -0.69 0.00 0.00 174.62 173.74 1rak s GLN 408 N 1.54 3.92 0.68 4.92 0.74 -1.26 -4.61 119.66 125.59 1rak s GLN 408 Ca 0.03 0.71 -0.17 0.00 0.05 0.00 0.00 55.36 55.98 1rak s GLN 408 Cb -0.13 -3.78 -0.01 0.00 1.10 0.00 0.00 33.01 30.19 1rak s GLN 408 CO -0.08 -0.91 0.97 -2.30 -0.55 0.00 0.00 175.29 172.42 1rak n PRO 409 N 6.74 0.66 -1.22 1.67 -0.02 -1.26 -4.97 135.00 136.59 1rak n PRO 409 Ca 0.08 0.28 -0.32 0.00 -2.02 0.00 0.00 63.50 61.52 1rak n PRO 409 Cb 0.48 -2.21 0.11 0.00 -0.02 0.00 0.00 33.50 31.86 1rak n PRO 409 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1rak s ALA 410 N -1.69 2.04 -0.21 3.55 0.00 -1.26 -5.02 121.76 119.17 1rak s ALA 410 Ca 0.75 0.55 0.00 0.00 0.00 0.00 0.00 51.96 53.26 1rak s ALA 410 Cb -0.37 -3.38 0.05 0.00 0.00 0.00 0.00 23.12 19.42 1rak s ALA 410 CO 0.49 -1.99 -0.06 -0.65 0.00 0.00 0.00 175.76 173.54 1rak s GLN 411 N -4.47 1.65 -0.13 0.00 -0.21 -1.26 -5.12 119.66 110.12 1rak s GLN 411 Ca 0.67 -0.82 -0.03 0.00 0.02 0.00 0.00 55.36 55.20 1rak s GLN 411 Cb -0.22 -2.39 -0.03 0.00 1.00 0.00 0.00 33.01 31.37 1rak s GLN 411 CO 0.52 -0.51 -0.03 0.99 -2.12 0.00 0.00 175.29 174.13 1rak s THR 412 N 1.47 3.96 -0.01 -0.19 2.01 -1.26 -5.07 115.64 116.54 1rak s THR 412 Ca -0.03 -0.35 0.03 0.00 0.31 0.00 0.00 61.69 61.65 1rak s THR 412 Cb -0.17 -2.71 -0.01 0.00 0.01 0.00 0.00 72.50 69.63 1rak s THR 412 CO -0.07 0.53 -0.11 -0.89 -0.69 0.00 0.00 174.62 173.39 1rak s THR 413 N -0.04 0.87 -0.06 -0.82 2.01 -1.26 -1.28 115.64 115.06 1rak s THR 413 Ca 0.02 -0.45 0.03 0.00 0.31 0.00 0.00 61.69 61.59 1rak s THR 413 Cb -0.13 -0.74 -0.02 0.00 0.01 0.00 0.00 72.50 71.62 1rak s THR 413 CO 0.02 0.25 -0.14 0.68 -0.69 0.00 0.00 174.62 174.74 1rak s VAL 414 N -0.15 3.04 -0.77 3.82 -7.23 -0.37 -4.95 120.40 113.79 1rak s VAL 414 Ca 0.02 -0.72 -0.12 0.00 -1.81 0.00 0.00 61.98 59.36 1rak s VAL 414 Cb -0.05 -2.20 0.20 0.00 0.56 0.00 0.00 36.38 34.89 1rak s VAL 414 CO -0.00 0.58 0.69 -0.31 -0.31 0.00 0.00 175.10 175.74 1rak s TYR 415 N -0.55 3.67 0.00 2.82 1.51 -1.26 -0.89 117.35 122.65 1rak s TYR 415 Ca 0.08 -2.13 0.00 0.00 -1.01 0.00 0.00 57.07 54.00 1rak s TYR 415 Cb -0.11 -3.68 0.00 0.00 -0.11 0.00 0.00 41.96 38.06 1rak s TYR 415 CO 0.01 -0.96 0.00 1.28 -1.11 0.00 0.00 175.55 174.78 1rak n LEU 416 N 3.90 0.00 0.27 -1.29 4.77 -1.26 -4.86 117.00 118.53 1rak n LEU 416 Ca 0.12 0.00 0.12 0.00 -0.03 0.00 0.00 56.01 56.21 1rak n LEU 416 Cb 0.45 0.00 0.74 0.00 -2.33 0.00 0.00 43.42 42.28 1rak n LEU 416 CO 0.34 0.00 1.02 -0.33 -1.33 0.00 0.00 177.39 177.09 1rak h GLU 417 N 0.00 0.00 -3.56 3.23 5.08 -2.05 -3.42 114.58 113.85 1rak h GLU 417 Ca 0.00 0.00 -0.10 0.00 -1.00 0.00 0.00 59.36 58.26 1rak h GLU 417 Cb 0.00 0.00 -0.16 0.00 0.50 0.00 0.00 28.75 29.09 1rak h GLU 417 CO 0.00 0.08 -0.36 -0.65 -1.00 0.00 0.00 179.01 177.09 1rak s GLN 418 N -4.48 0.75 0.41 2.33 -0.21 -1.26 -5.14 119.66 112.05 1rak s GLN 418 Ca -0.04 -0.68 -0.26 0.00 0.02 0.00 0.00 55.36 54.41 1rak s GLN 418 Cb 0.15 0.31 -0.09 0.00 1.00 0.00 0.00 33.01 34.38 1rak s GLN 418 CO 0.60 -0.23 1.31 -2.14 -2.12 0.00 0.00 175.29 172.71 1rak s PRO 419 N -2.84 3.95 -0.02 2.91 0.02 -1.26 -4.68 135.00 133.07 1rak s PRO 419 Ca -0.03 2.17 0.00 0.00 0.02 0.00 0.00 61.00 63.16 1rak s PRO 419 Cb 0.00 -2.75 0.03 0.00 0.02 0.00 0.00 34.50 31.80 1rak s PRO 419 CO -0.05 -0.52 0.01 -1.21 -0.33 0.00 0.00 177.00 174.90 1rak s GLU 420 N -2.26 0.14 0.19 5.54 2.02 -0.07 -4.94 118.70 119.32 1rak s GLU 420 Ca 0.57 0.11 -0.30 0.00 0.02 0.00 0.00 54.97 55.37 1rak s GLU 420 Cb -0.38 -0.35 -0.08 0.00 0.10 0.00 0.00 34.13 33.42 1rak s GLU 420 CO 0.49 -0.13 1.02 0.00 0.02 0.00 0.00 175.26 176.66 1rak s ALA 421 N 0.94 3.33 -0.17 5.21 0.00 -1.26 -1.24 121.76 128.57 1rak s ALA 421 Ca -0.09 0.71 0.00 0.00 0.00 0.00 0.00 51.96 52.58 1rak s ALA 421 Cb -0.12 -3.29 0.01 0.00 0.00 0.00 0.00 23.12 19.71 1rak s ALA 421 CO -0.02 -0.05 -0.17 0.42 0.00 0.00 0.00 175.76 175.95 1rak s ILE 422 N -0.51 2.42 -0.23 0.00 -1.09 -0.40 -4.95 121.20 116.44 1rak s ILE 422 Ca 0.46 -0.84 0.02 0.00 -2.23 0.00 0.00 60.65 58.06 1rak s ILE 422 Cb -0.27 -2.02 0.03 0.00 -1.58 0.00 0.00 42.46 38.62 1rak s ILE 422 CO 0.33 0.52 0.74 -0.90 -1.23 0.00 0.00 174.94 174.40 1rak n ASP 423 N 4.36 1.54 -1.46 3.58 3.85 -1.26 -4.36 116.55 122.80 1rak n ASP 423 Ca -0.20 -1.42 -0.19 0.00 -0.71 0.00 0.00 54.79 52.27 1rak n ASP 423 Cb 0.51 -0.02 -0.08 0.00 -1.35 0.00 0.00 41.12 40.19 1rak n ASP 423 CO 0.00 0.00 0.00 -1.22 -1.01 0.00 0.00 177.20 174.97 1rak n TYR 424 N -0.04 -0.04 -3.27 2.11 4.01 -1.26 -4.99 117.16 113.68 1rak n TYR 424 Ca 0.02 0.00 -0.21 0.00 -0.16 0.00 0.00 57.90 57.54 1rak n TYR 424 Cb 0.14 -3.20 0.00 0.00 -0.31 0.00 0.00 39.34 35.97 1rak n TYR 424 CO 0.00 0.00 0.00 0.15 -0.46 0.00 0.00 176.86 176.55 1rak s LYS 425 N -3.64 3.14 0.00 -0.72 1.02 -1.26 -5.00 119.74 113.28 1rak s LYS 425 Ca 0.00 -0.70 0.00 0.00 0.02 0.00 0.00 55.97 55.29 1rak s LYS 425 Cb 0.00 -2.69 0.00 0.00 -0.52 0.00 0.00 37.83 34.62 1rak s LYS 425 CO 0.00 -0.06 0.31 -2.13 -0.92 0.00 0.00 175.35 172.55