#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1b52 s ASP 2 N 0.00 3.18 0.05 0.00 1.01 -1.26 -4.84 116.67 114.81 1b52 s ASP 2 Ca 0.00 -2.82 -0.31 0.00 0.71 0.00 0.00 52.55 50.13 1b52 s ASP 2 Cb 0.00 -0.87 -0.06 0.00 1.01 0.00 0.00 42.92 43.00 1b52 s ASP 2 CO 0.00 -0.23 1.26 -0.69 0.21 0.00 0.00 175.17 175.72 1b52 s VAL 3 N 0.16 3.89 -0.00 -1.27 1.01 -1.26 -4.96 120.40 117.96 1b52 s VAL 3 Ca 0.22 1.33 -0.30 0.00 0.00 0.00 0.00 61.98 63.23 1b52 s VAL 3 Cb -0.15 -3.86 -0.06 0.00 0.00 0.00 0.00 36.38 32.32 1b52 s VAL 3 CO -0.07 0.08 1.51 -2.84 0.00 0.00 0.00 175.10 173.78 1b52 s PRO 4 N 1.37 4.24 -0.02 2.72 0.02 -1.26 -4.93 135.00 137.14 1b52 s PRO 4 Ca 0.60 2.08 -0.37 0.00 0.02 0.00 0.00 61.00 63.33 1b52 s PRO 4 Cb -0.30 -3.67 -0.16 0.00 0.02 0.00 0.00 34.50 30.38 1b52 s PRO 4 CO 0.28 -0.68 1.49 0.00 -0.33 0.00 0.00 177.00 177.77 1b52 n ALA 5 N 5.85 -0.50 0.00 -1.55 0.00 -1.26 -2.28 120.51 120.77 1b52 n ALA 5 Ca 0.15 0.47 0.00 0.00 0.00 0.00 0.00 53.44 54.05 1b52 n ALA 5 Cb 0.43 -2.16 0.00 0.00 0.00 0.00 0.00 19.45 17.72 1b52 n ALA 5 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1b52 n GLY 6 N 3.13 1.76 3.94 0.00 0.00 -1.26 -5.13 105.19 107.63 1b52 n GLY 6 Ca 0.21 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.98 1b52 n GLY 6 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1b52 s VAL 7 N -1.75 5.11 -0.26 1.61 -7.23 -0.97 -5.07 120.40 111.84 1b52 s VAL 7 Ca 0.00 -0.39 -0.08 0.00 -1.81 0.00 0.00 61.98 59.70 1b52 s VAL 7 Cb 0.00 -3.83 -0.02 0.00 0.56 0.00 0.00 36.38 33.09 1b52 s VAL 7 CO 0.00 -0.47 0.09 -1.10 -0.31 0.00 0.00 175.10 173.31 1b52 s GLN 8 N -4.07 3.60 -0.12 4.82 -0.21 -1.26 -5.00 119.66 117.42 1b52 s GLN 8 Ca 0.40 -0.52 -0.30 0.00 0.02 0.00 0.00 55.36 54.97 1b52 s GLN 8 Cb -0.10 -3.38 -0.01 0.00 1.00 0.00 0.00 33.01 30.51 1b52 s GLN 8 CO 0.34 -0.23 1.11 -0.51 -2.12 0.00 0.00 175.29 173.87 1b52 s LEU 9 N 1.62 4.22 0.97 2.90 1.43 -1.26 0.18 118.68 128.74 1b52 s LEU 9 Ca 0.06 1.61 -0.14 0.00 -1.03 0.00 0.00 54.13 54.63 1b52 s LEU 9 Cb -0.16 -3.55 -0.01 0.00 0.03 0.00 0.00 46.19 42.50 1b52 s LEU 9 CO 0.04 -0.57 0.06 0.00 0.23 0.00 0.00 176.35 176.11 1b52 n ALA 10 N 5.51 -3.45 -0.04 4.21 0.00 -0.08 -4.61 120.51 122.05 1b52 n ALA 10 Ca 0.11 -0.68 -0.14 0.00 0.00 0.00 0.00 53.44 52.73 1b52 n ALA 10 Cb 0.47 -1.61 -0.09 0.00 0.00 0.00 0.00 19.45 18.22 1b52 n ALA 10 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 1b52 h ASP 11 N -1.45 0.26 -3.50 0.00 5.19 -1.94 -3.41 116.42 111.57 1b52 h ASP 11 Ca -0.44 -0.58 -0.61 0.00 -0.62 0.00 0.00 57.03 54.79 1b52 h ASP 11 Cb 1.29 -0.07 -0.12 0.00 0.18 0.00 0.00 39.33 40.61 1b52 h ASP 11 CO 0.31 0.79 -0.27 -0.75 -3.12 0.00 0.00 179.24 176.20 1b52 s LYS 12 N -3.91 4.15 -0.83 3.56 2.20 -1.26 -5.02 119.74 118.63 1b52 s LYS 12 Ca -0.15 0.10 -0.02 0.00 -0.36 0.00 0.00 55.97 55.53 1b52 s LYS 12 Cb 0.03 -3.54 0.21 0.00 -1.51 0.00 0.00 37.83 33.02 1b52 s LYS 12 CO 0.73 -0.01 0.70 -0.65 -0.36 0.00 0.00 175.35 175.76 1b52 s GLN 13 N 1.24 3.12 0.02 4.03 -1.52 -1.26 -4.90 119.66 120.40 1b52 s GLN 13 Ca 0.16 -3.08 0.01 0.00 -1.95 0.00 0.00 55.36 50.51 1b52 s GLN 13 Cb -0.14 -3.92 -0.02 0.00 -0.22 0.00 0.00 33.01 28.71 1b52 s GLN 13 CO 0.07 -1.24 -0.05 0.95 -0.25 0.00 0.00 175.29 174.77 1b52 s THR 14 N -1.00 0.34 -0.03 -0.19 -4.23 -1.26 -0.75 115.64 108.51 1b52 s THR 14 Ca 0.25 -0.71 -0.01 0.00 -1.18 0.00 0.00 61.69 60.04 1b52 s THR 14 Cb -0.10 -0.39 0.03 0.00 1.34 0.00 0.00 72.50 73.37 1b52 s THR 14 CO -0.10 -0.25 0.06 -0.22 -0.54 0.00 0.00 174.62 173.56 1b52 s LEU 15 N -1.02 1.16 -0.20 4.79 2.96 -1.04 -4.94 118.68 120.39 1b52 s LEU 15 Ca -0.07 0.10 -0.04 0.00 -0.22 0.00 0.00 54.13 53.90 1b52 s LEU 15 Cb -0.07 0.07 -0.01 0.00 0.50 0.00 0.00 46.19 46.67 1b52 s LEU 15 CO -0.00 -0.11 -0.04 -0.69 -1.32 0.00 0.00 176.35 174.19 1b52 s VAL 16 N 0.88 3.52 -0.02 1.68 1.01 -1.26 -0.89 120.40 125.32 1b52 s VAL 16 Ca -0.07 -0.46 0.06 0.00 0.00 0.00 0.00 61.98 61.51 1b52 s VAL 16 Cb -0.10 -2.58 -0.01 0.00 0.00 0.00 0.00 36.38 33.68 1b52 s VAL 16 CO -0.03 0.44 -0.20 -0.13 0.00 0.00 0.00 175.10 175.18 1b52 s ARG 17 N 1.16 1.64 0.09 2.72 0.52 0.57 -1.50 118.95 124.15 1b52 s ARG 17 Ca 0.02 -0.70 -0.25 0.00 -0.52 0.00 0.00 55.73 54.28 1b52 s ARG 17 Cb -0.14 -1.56 -0.06 0.00 0.52 0.00 0.00 34.95 33.70 1b52 s ARG 17 CO -0.00 0.41 0.77 1.21 0.02 0.00 0.00 175.30 177.70 1b52 s ASN 18 N -0.41 7.28 0.00 0.23 2.47 -0.50 0.24 114.94 124.26 1b52 s ASN 18 Ca 0.06 1.52 0.09 0.00 0.42 0.00 0.00 52.86 54.95 1b52 s ASN 18 Cb -0.08 -2.48 0.25 0.00 -1.45 0.00 0.00 41.25 37.49 1b52 s ASN 18 CO -0.00 0.09 1.20 -3.20 -3.72 0.00 0.00 177.10 171.46 1b52 n ASN 19 N 2.37 2.74 0.00 -4.21 5.15 0.34 -3.46 115.26 118.19 1b52 n ASN 19 Ca -0.04 -1.99 0.00 0.00 -0.60 0.00 0.00 54.58 51.96 1b52 n ASN 19 Cb 0.50 -0.19 0.00 0.00 -0.53 0.00 0.00 39.78 39.56 1b52 n ASN 19 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1b52 n GLY 20 N 0.34 1.93 0.00 8.20 0.00 -1.25 -4.60 105.19 109.82 1b52 n GLY 20 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.11 1b52 n GLY 20 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1b52 n SER 21 N 0.37 0.00 -4.70 1.61 3.41 -1.25 -3.16 113.62 109.89 1b52 n SER 21 Ca 0.00 0.00 -0.42 0.00 -0.26 0.00 0.00 58.87 58.19 1b52 n SER 21 Cb 0.00 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 63.92 1b52 n SER 21 CO 0.00 0.00 0.00 -0.70 -0.16 0.00 0.00 175.04 174.18 1b52 s GLU 22 N -2.00 4.27 0.66 4.33 2.56 -1.26 -4.56 118.70 122.71 1b52 s GLU 22 Ca 0.00 2.14 -0.18 0.00 0.00 0.00 0.00 54.97 56.93 1b52 s GLU 22 Cb 0.00 -3.38 -0.01 0.00 2.00 0.00 0.00 34.13 32.74 1b52 s GLU 22 CO 0.00 -0.55 1.25 1.33 -0.56 0.00 0.00 175.26 176.73 1b52 n VAL 23 N 4.27 4.55 -0.11 3.70 0.24 -1.26 -4.66 118.33 125.07 1b52 n VAL 23 Ca 0.13 -0.47 -0.03 0.00 -2.04 0.00 0.00 64.34 61.93 1b52 n VAL 23 Cb 0.42 -1.42 0.19 0.00 -1.47 0.00 0.00 33.84 31.55 1b52 n VAL 23 CO 0.00 0.00 0.00 1.56 -2.14 0.00 0.00 176.83 176.25 1b52 h GLN 24 N 0.37 0.78 -1.68 7.34 4.20 -1.93 -3.48 115.11 120.71 1b52 h GLN 24 Ca -0.50 -0.18 0.40 0.00 0.06 0.00 0.00 58.65 58.42 1b52 h GLN 24 Cb 1.34 -0.11 -0.10 0.00 0.30 0.00 0.00 27.48 28.91 1b52 h GLN 24 CO 0.52 0.75 0.99 0.45 -0.67 0.00 0.00 178.83 180.87 1b52 s SER 25 N -6.62 -0.00 0.00 1.46 0.15 -1.26 -5.04 113.70 102.39 1b52 s SER 25 Ca -0.09 -0.03 0.00 0.00 0.70 0.00 0.00 55.95 56.52 1b52 s SER 25 Cb 0.15 0.03 0.00 0.00 -1.71 0.00 0.00 66.02 64.49 1b52 s SER 25 CO 0.80 -0.05 0.65 0.18 1.20 0.00 0.00 173.24 176.02 1b52 n LEU 26 N -0.81 1.26 -4.68 3.45 4.77 -1.26 -4.92 117.00 114.82 1b52 n LEU 26 Ca 0.00 -1.26 -0.42 0.00 -0.03 0.00 0.00 56.01 54.30 1b52 n LEU 26 Cb 0.60 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.66 1b52 n LEU 26 CO 0.13 0.32 0.70 -0.62 -1.33 0.00 0.00 177.39 176.58 1b52 s ASP 27 N -0.35 7.13 0.57 -1.43 -1.08 -1.26 -4.92 116.67 115.32 1b52 s ASP 27 Ca 0.00 1.39 0.26 0.00 -0.52 0.00 0.00 52.55 53.67 1b52 s ASP 27 Cb 0.00 -2.51 1.58 0.00 -1.46 0.00 0.00 42.92 40.53 1b52 s ASP 27 CO 0.00 -0.40 2.13 -0.65 0.52 0.00 0.00 175.17 176.77 1b52 h PRO 28 N 7.14 0.00 -0.00 4.34 0.11 -1.93 -0.75 132.00 140.90 1b52 h PRO 28 Ca -0.31 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.80 1b52 h PRO 28 Cb 1.15 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.26 1b52 h PRO 28 CO 0.84 0.00 -0.13 0.72 -0.21 0.00 0.00 178.00 179.21 1b52 n HIS 29 N -4.05 0.00 -0.01 0.65 8.25 -1.26 -3.96 115.22 114.84 1b52 n HIS 29 Ca 0.01 0.00 0.04 0.00 -0.26 0.00 0.00 57.72 57.51 1b52 n HIS 29 Cb 0.26 -0.20 0.10 0.00 1.12 0.00 0.00 29.99 31.26 1b52 n HIS 29 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 1b52 n LYS 30 N -1.00 2.23 -4.26 -0.41 4.76 -0.29 -4.28 118.16 114.91 1b52 n LYS 30 Ca 0.13 -1.71 -0.23 0.00 -2.87 0.00 0.00 58.31 53.63 1b52 n LYS 30 Cb 0.29 -1.20 -0.07 0.00 -1.84 0.00 0.00 35.03 32.21 1b52 n LYS 30 CO 0.00 0.00 0.00 0.96 -1.37 0.00 0.00 177.40 176.99 1b52 s ILE 31 N -0.93 3.65 0.00 -0.18 -4.36 -1.23 -4.75 121.20 113.40 1b52 s ILE 31 Ca 0.16 -1.81 0.00 0.00 -0.26 0.00 0.00 60.65 58.75 1b52 s ILE 31 Cb 0.09 -2.96 0.00 0.00 1.25 0.00 0.00 42.46 40.84 1b52 s ILE 31 CO 0.12 -0.37 0.00 -1.84 0.24 0.00 0.00 174.94 173.09 1b52 n GLU 32 N -0.94 0.00 -3.37 0.37 0.28 -1.26 -4.60 120.64 111.12 1b52 n GLU 32 Ca -0.07 0.00 -0.21 0.00 -0.16 0.00 0.00 57.16 56.73 1b52 n GLU 32 Cb 0.59 -0.10 0.01 0.00 1.43 0.00 0.00 31.44 33.37 1b52 n GLU 32 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 177.13 177.17 1b52 s GLY 33 N 0.00 2.04 0.09 -1.84 0.00 -1.26 -5.01 107.32 101.34 1b52 s GLY 33 Ca 0.00 -1.79 -0.17 0.00 0.00 0.00 0.00 44.72 42.77 1b52 s GLY 33 CO 0.00 -1.70 1.46 -2.08 0.00 0.00 0.00 173.10 170.78 1b52 h VAL 34 N 0.67 1.30 -0.68 1.40 2.07 -1.98 -1.13 116.25 117.89 1b52 h VAL 34 Ca -0.37 -1.21 -0.00 0.00 0.82 0.00 0.00 66.70 65.93 1b52 h VAL 34 Cb 1.28 1.50 -0.03 0.00 -1.52 0.00 0.00 31.29 32.52 1b52 h VAL 34 CO 0.50 0.38 0.42 -0.65 0.02 0.00 0.00 177.57 178.24 1b52 h PRO 35 N 0.32 0.93 -0.49 1.57 0.11 -1.96 -0.52 132.00 131.95 1b52 h PRO 35 Ca 0.06 -0.08 -0.09 0.00 0.11 0.00 0.00 66.00 66.00 1b52 h PRO 35 Cb 0.64 -0.20 -0.02 0.00 0.11 0.00 0.00 31.00 31.54 1b52 h PRO 35 CO 0.04 0.66 -0.07 0.93 -0.21 0.00 0.00 178.00 179.35 1b52 h GLU 36 N 0.93 0.88 -0.10 1.05 3.07 -1.88 -2.78 114.58 115.74 1b52 h GLU 36 Ca 0.25 -0.29 -0.10 0.00 -0.50 0.00 0.00 59.36 58.72 1b52 h GLU 36 Cb -0.03 -0.08 -0.01 0.00 -0.84 0.00 0.00 28.75 27.79 1b52 h GLU 36 CO -0.05 0.92 -0.37 0.77 -1.40 0.00 0.00 179.01 178.88 1b52 h SER 37 N 0.80 0.21 -0.85 1.42 0.02 -0.65 -1.45 113.55 113.06 1b52 h SER 37 Ca 0.14 -0.08 0.02 0.00 -0.84 0.00 0.00 61.79 61.03 1b52 h SER 37 Cb 0.58 -0.06 -0.05 0.00 0.14 0.00 0.00 62.40 63.01 1b52 h SER 37 CO 0.04 0.58 0.56 0.78 -1.14 0.00 0.00 176.83 177.64 1b52 h ASN 38 N 0.18 0.94 0.06 3.07 2.35 -0.83 -1.22 115.58 120.14 1b52 h ASN 38 Ca 0.02 -0.02 -0.24 0.00 -0.55 0.00 0.00 56.30 55.51 1b52 h ASN 38 Cb 0.75 -0.22 0.01 0.00 0.05 0.00 0.00 38.32 38.91 1b52 h ASN 38 CO 0.06 0.67 -0.95 0.58 -1.65 0.00 0.00 177.43 176.14 1b52 h VAL 39 N 1.11 1.31 -0.63 2.81 2.07 -1.47 -3.28 116.25 118.17 1b52 h VAL 39 Ca 0.33 -2.22 -0.03 0.00 0.82 0.00 0.00 66.70 65.59 1b52 h VAL 39 Cb -0.07 2.29 -0.03 0.00 -1.52 0.00 0.00 31.29 31.96 1b52 h VAL 39 CO -0.09 0.69 0.26 -1.28 0.02 0.00 0.00 177.57 177.16 1b52 h SER 40 N 0.39 0.83 0.92 0.57 0.87 -1.01 -2.15 113.55 113.97 1b52 h SER 40 Ca -0.10 -0.11 -0.04 0.00 -1.23 0.00 0.00 61.79 60.32 1b52 h SER 40 Cb 1.59 -0.21 -0.01 0.00 -0.44 0.00 0.00 62.40 63.33 1b52 h SER 40 CO 0.18 0.74 -0.18 0.03 -0.53 0.00 0.00 176.83 177.07 1b52 h ARG 41 N 0.90 0.00 0.00 2.24 3.08 -1.28 -1.47 114.38 117.85 1b52 h ARG 41 Ca 0.21 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.25 1b52 h ARG 41 Cb 0.16 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.21 1b52 h ARG 41 CO -0.02 0.18 -0.42 -0.44 -1.07 0.00 0.00 179.97 178.20 1b52 h ASP 42 N 0.00 0.00 0.09 7.04 3.32 -1.51 -3.39 116.42 121.98 1b52 h ASP 42 Ca -0.00 0.00 -0.37 0.00 0.02 0.00 0.00 57.03 56.68 1b52 h ASP 42 Cb 0.69 0.00 -0.06 0.00 0.22 0.00 0.00 39.33 40.19 1b52 h ASP 42 CO 0.02 0.07 -2.26 0.18 -1.72 0.00 0.00 179.24 175.54 1b52 n LEU 43 N -2.97 1.94 -4.09 1.55 4.77 -1.01 -1.39 117.00 115.79 1b52 n LEU 43 Ca 0.02 0.04 -0.25 0.00 -0.03 0.00 0.00 56.01 55.79 1b52 n LEU 43 Cb 0.57 -0.49 -0.16 0.00 -2.33 0.00 0.00 43.42 41.01 1b52 n LEU 43 CO 0.37 0.75 -0.48 -0.36 -1.33 0.00 0.00 177.39 176.33 1b52 s PHE 44 N -2.53 1.52 -0.07 -1.77 0.08 -0.59 -0.76 117.98 113.87 1b52 s PHE 44 Ca -0.22 -0.44 0.06 0.00 0.12 0.00 0.00 56.93 56.44 1b52 s PHE 44 Cb 0.08 -1.04 -0.01 0.00 -0.57 0.00 0.00 43.02 41.48 1b52 s PHE 44 CO 0.72 -0.17 -0.24 -2.00 -0.10 0.00 0.00 175.22 173.43 1b52 s GLU 45 N 0.15 2.66 0.00 0.44 2.12 -1.26 -4.53 118.70 118.28 1b52 s GLU 45 Ca -0.05 -0.89 0.00 0.00 0.36 0.00 0.00 54.97 54.39 1b52 s GLU 45 Cb -0.11 -2.21 0.00 0.00 0.26 0.00 0.00 34.13 32.07 1b52 s GLU 45 CO 0.02 0.35 0.00 0.41 -0.54 0.00 0.00 175.26 175.50 1b52 n GLY 46 N 3.04 2.79 0.12 -1.50 0.00 -1.26 -4.32 105.19 104.06 1b52 n GLY 46 Ca -0.18 -1.91 -0.09 0.00 0.00 0.00 0.00 46.02 43.84 1b52 n GLY 46 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1b52 h LEU 47 N 0.00 0.25 -8.70 0.99 3.38 -1.84 -1.05 115.31 108.34 1b52 h LEU 47 Ca 0.00 -0.00 -0.57 0.00 0.09 0.00 0.00 57.88 57.40 1b52 h LEU 47 Cb 0.00 -0.06 -0.22 0.00 0.09 0.00 0.00 40.66 40.48 1b52 h LEU 47 CO 0.00 0.18 -0.83 -0.76 0.09 0.00 0.00 178.44 177.13 1b52 s LEU 48 N -10.19 2.31 0.38 1.67 1.02 -1.26 -0.80 118.68 111.80 1b52 s LEU 48 Ca -0.13 -0.70 0.06 0.00 0.02 0.00 0.00 54.13 53.38 1b52 s LEU 48 Cb 0.09 -0.91 -0.07 0.00 0.02 0.00 0.00 46.19 45.32 1b52 s LEU 48 CO 0.70 0.06 0.03 0.27 0.02 0.00 0.00 176.35 177.43 1b52 s ILE 49 N -1.19 1.64 0.13 -0.59 -4.36 0.10 -3.83 121.20 113.11 1b52 s ILE 49 Ca 0.07 -2.00 -0.07 0.00 -0.26 0.00 0.00 60.65 58.39 1b52 s ILE 49 Cb -0.10 -2.89 -0.06 0.00 1.25 0.00 0.00 42.46 40.67 1b52 s ILE 49 CO 0.04 0.00 0.41 -0.44 0.24 0.00 0.00 174.94 175.19 1b52 s SER 50 N -3.63 6.57 0.74 4.36 0.01 -1.26 0.51 113.70 121.00 1b52 s SER 50 Ca 0.35 0.72 0.00 0.00 1.31 0.00 0.00 55.95 58.32 1b52 s SER 50 Cb 0.09 -2.14 0.00 0.00 0.21 0.00 0.00 66.02 64.18 1b52 s SER 50 CO 0.17 0.08 0.00 -0.90 0.41 0.00 0.00 173.24 173.00 1b52 n ASP 51 N 0.39 0.00 0.00 2.44 5.68 0.73 -4.87 116.55 120.93 1b52 n ASP 51 Ca -0.04 -0.93 0.10 0.00 -0.50 0.00 0.00 54.79 53.42 1b52 n ASP 51 Cb 0.52 0.00 0.45 0.00 -1.14 0.00 0.00 41.12 40.95 1b52 n ASP 51 CO 0.00 0.00 0.00 1.33 -1.33 0.00 0.00 177.20 177.20 1b52 n VAL 52 N -1.67 0.56 -0.14 2.12 0.24 -1.26 -1.92 118.33 116.26 1b52 n VAL 52 Ca 0.00 0.14 0.08 0.00 -2.04 0.00 0.00 64.34 62.52 1b52 n VAL 52 Cb 0.00 -0.79 0.20 0.00 -1.47 0.00 0.00 33.84 31.78 1b52 n VAL 52 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 1b52 n GLU 53 N -1.45 2.62 -0.47 7.34 1.02 -1.26 -4.48 120.64 123.96 1b52 n GLU 53 Ca 0.06 -2.20 0.00 0.00 -0.02 0.00 0.00 57.16 55.00 1b52 n GLU 53 Cb 0.22 -1.38 0.00 0.00 -0.02 0.00 0.00 31.44 30.25 1b52 n GLU 53 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1b52 n GLY 54 N 0.98 0.75 3.81 0.62 0.00 -0.81 -4.32 105.19 106.23 1b52 n GLY 54 Ca 0.16 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.80 1b52 n GLY 54 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1b52 s HIS 55 N -2.33 3.79 0.24 1.61 3.76 -1.26 -4.71 115.29 116.39 1b52 s HIS 55 Ca 0.00 1.31 -0.31 0.00 -0.15 0.00 0.00 55.06 55.90 1b52 s HIS 55 Cb 0.00 -2.53 -0.12 0.00 1.11 0.00 0.00 32.58 31.04 1b52 s HIS 55 CO 0.00 0.54 1.62 -2.30 -0.85 0.00 0.00 174.74 173.75 1b52 n PRO 56 N 1.52 2.57 -4.10 8.40 -0.02 -1.26 -0.19 135.00 141.93 1b52 n PRO 56 Ca -0.09 0.92 -0.10 0.00 -2.02 0.00 0.00 63.50 62.22 1b52 n PRO 56 Cb 0.51 -2.71 -0.09 0.00 -0.02 0.00 0.00 33.50 31.18 1b52 n PRO 56 CO 0.00 0.00 0.00 -1.12 1.98 0.00 0.00 175.50 176.36 1b52 s SER 57 N 0.77 0.19 0.23 2.55 0.01 0.18 -4.83 113.70 112.80 1b52 s SER 57 Ca 0.70 -1.13 -0.31 0.00 1.31 0.00 0.00 55.95 56.53 1b52 s SER 57 Cb -0.54 0.36 -0.11 0.00 0.21 0.00 0.00 66.02 65.94 1b52 s SER 57 CO 0.41 -0.81 1.57 -2.84 0.41 0.00 0.00 173.24 171.98 1b52 s PRO 58 N -4.04 4.19 0.00 12.44 0.02 -1.26 -0.72 135.00 145.63 1b52 s PRO 58 Ca 0.24 2.44 0.00 0.00 0.02 0.00 0.00 61.00 63.70 1b52 s PRO 58 Cb 0.06 -3.10 0.00 0.00 0.02 0.00 0.00 34.50 31.48 1b52 s PRO 58 CO 0.03 -0.59 0.00 0.41 -0.33 0.00 0.00 177.00 176.52 1b52 n GLY 59 N 2.98 1.49 0.31 0.52 0.00 0.02 -4.31 105.19 106.20 1b52 n GLY 59 Ca 0.11 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.14 1b52 n GLY 59 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1b52 h VAL 60 N 0.00 1.17 -3.72 1.61 2.07 -0.90 -3.41 116.25 113.07 1b52 h VAL 60 Ca 0.00 -0.51 -0.50 0.00 0.82 0.00 0.00 66.70 66.52 1b52 h VAL 60 Cb 0.00 0.55 -0.01 0.00 -1.52 0.00 0.00 31.29 30.30 1b52 h VAL 60 CO 0.00 0.21 0.37 0.00 0.02 0.00 0.00 177.57 178.17 1b52 s ALA 61 N -5.39 3.34 -0.15 1.67 0.00 -0.10 -1.32 121.76 119.81 1b52 s ALA 61 Ca -0.09 0.66 0.18 0.00 0.00 0.00 0.00 51.96 52.71 1b52 s ALA 61 Cb 0.17 -3.24 -0.25 0.00 0.00 0.00 0.00 23.12 19.80 1b52 s ALA 61 CO 0.77 0.11 0.30 -0.85 0.00 0.00 0.00 175.76 176.08 1b52 n GLU 62 N 1.67 0.67 -3.50 0.00 0.28 0.16 -4.57 120.64 115.34 1b52 n GLU 62 Ca -0.01 0.04 -0.15 0.00 -0.16 0.00 0.00 57.16 56.88 1b52 n GLU 62 Cb 0.47 -1.59 -0.04 0.00 1.43 0.00 0.00 31.44 31.70 1b52 n GLU 62 CO 0.00 0.00 0.00 0.15 -0.16 0.00 0.00 177.13 177.12 1b52 s LYS 63 N -2.68 1.13 0.00 3.44 -0.14 -1.16 -4.90 119.74 115.42 1b52 s LYS 63 Ca -0.08 -0.16 -0.17 0.00 -1.36 0.00 0.00 55.97 54.20 1b52 s LYS 63 Cb 0.08 0.52 0.03 0.00 -1.68 0.00 0.00 37.83 36.78 1b52 s LYS 63 CO 0.84 -0.43 0.37 1.67 -0.76 0.00 0.00 175.35 177.04 1b52 s TRP 64 N -2.50 -0.24 0.27 3.18 -2.14 -1.26 -1.29 118.94 114.96 1b52 s TRP 64 Ca -0.05 0.30 0.02 0.00 2.66 0.00 0.00 56.10 59.04 1b52 s TRP 64 Cb -0.01 0.15 -0.05 0.00 -3.10 0.00 0.00 33.47 30.46 1b52 s TRP 64 CO -0.02 -0.47 0.06 -1.21 -2.66 0.00 0.00 176.95 172.66 1b52 s GLU 65 N -1.72 1.44 0.05 3.25 8.01 -0.15 -4.97 118.70 124.61 1b52 s GLU 65 Ca -0.10 -1.77 -0.05 0.00 0.01 0.00 0.00 54.97 53.05 1b52 s GLU 65 Cb -0.03 -0.49 -0.02 0.00 -4.31 0.00 0.00 34.13 29.29 1b52 s GLU 65 CO 0.02 -0.22 0.08 0.54 0.01 0.00 0.00 175.26 175.69 1b52 s ASN 66 N -3.35 0.23 -0.42 -0.19 2.20 -1.26 -1.70 114.94 110.45 1b52 s ASN 66 Ca 0.35 -0.64 0.00 0.00 -0.94 0.00 0.00 52.86 51.64 1b52 s ASN 66 Cb 0.08 0.23 0.11 0.00 -2.00 0.00 0.00 41.25 39.67 1b52 s ASN 66 CO 0.13 -0.55 0.18 -0.75 -2.94 0.00 0.00 177.10 173.17 1b52 s LYS 67 N -2.98 1.87 -1.23 3.55 2.47 -0.08 -4.66 119.74 118.68 1b52 s LYS 67 Ca -0.02 -2.00 0.00 0.00 -1.56 0.00 0.00 55.97 52.40 1b52 s LYS 67 Cb 0.01 -3.44 0.00 0.00 -1.46 0.00 0.00 37.83 32.94 1b52 s LYS 67 CO -0.06 -1.04 0.00 -0.25 0.16 0.00 0.00 175.35 174.16 1b52 n ASP 68 N 4.21 -4.34 -1.03 1.43 8.00 -1.26 -2.07 116.55 121.48 1b52 n ASP 68 Ca 0.02 0.25 -0.13 0.00 0.71 0.00 0.00 54.79 55.63 1b52 n ASP 68 Cb 0.40 -2.99 -0.06 0.00 -0.02 0.00 0.00 41.12 38.46 1b52 n ASP 68 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 1b52 n PHE 69 N -2.85 0.00 -0.05 1.24 3.72 -1.26 -4.60 117.46 113.66 1b52 n PHE 69 Ca -0.12 0.00 -0.05 0.00 -0.05 0.00 0.00 57.45 57.23 1b52 n PHE 69 Cb 0.42 -2.52 -0.07 0.00 -0.94 0.00 0.00 39.48 36.38 1b52 n PHE 69 CO 0.00 0.00 0.00 1.17 -0.05 0.00 0.00 176.76 177.88 1b52 n LYS 70 N -2.32 2.03 -3.92 -1.08 4.81 -0.88 -1.35 118.16 115.45 1b52 n LYS 70 Ca -0.13 0.01 -0.28 0.00 -0.87 0.00 0.00 58.31 57.04 1b52 n LYS 70 Cb 0.48 -1.23 -0.17 0.00 0.02 0.00 0.00 35.03 34.14 1b52 n LYS 70 CO 0.00 0.00 0.00 0.08 1.17 0.00 0.00 177.40 178.65 1b52 s VAL 71 N -2.22 1.16 -0.09 3.15 1.01 -1.19 -1.27 120.40 120.95 1b52 s VAL 71 Ca -0.07 -0.50 0.00 0.00 0.00 0.00 0.00 61.98 61.42 1b52 s VAL 71 Cb 0.03 -1.23 -0.03 0.00 0.00 0.00 0.00 36.38 35.15 1b52 s VAL 71 CO 0.34 0.28 -0.09 0.26 0.00 0.00 0.00 175.10 175.89 1b52 s TRP 72 N 1.63 2.88 -0.14 5.22 0.52 0.14 -0.90 118.94 128.30 1b52 s TRP 72 Ca 0.03 -0.17 0.01 0.00 0.02 0.00 0.00 56.10 55.99 1b52 s TRP 72 Cb -0.14 -1.76 0.02 0.00 -1.15 0.00 0.00 33.47 30.45 1b52 s TRP 72 CO -0.08 0.16 -0.14 0.99 0.02 0.00 0.00 176.95 177.89 1b52 s THR 73 N -0.42 1.54 -0.12 2.01 2.01 -0.69 0.14 115.64 120.10 1b52 s THR 73 Ca 0.06 -0.62 0.00 0.00 0.31 0.00 0.00 61.69 61.44 1b52 s THR 73 Cb -0.12 -1.44 -0.02 0.00 0.01 0.00 0.00 72.50 70.93 1b52 s THR 73 CO 0.02 0.45 -0.12 -0.36 -0.69 0.00 0.00 174.62 173.92 1b52 s PHE 74 N 1.40 2.82 -0.36 4.92 0.40 0.12 -0.98 117.98 126.30 1b52 s PHE 74 Ca 0.03 -0.52 -0.05 0.00 -0.60 0.00 0.00 56.93 55.78 1b52 s PHE 74 Cb -0.13 -1.82 0.06 0.00 0.51 0.00 0.00 43.02 41.64 1b52 s PHE 74 CO -0.09 -0.12 0.12 -1.01 0.70 0.00 0.00 175.22 174.83 1b52 s HIS 75 N 0.15 3.32 0.37 0.36 3.76 -0.41 0.10 115.29 122.95 1b52 s HIS 75 Ca -0.06 -1.69 -0.24 0.00 -0.15 0.00 0.00 55.06 52.92 1b52 s HIS 75 Cb -0.15 -2.51 -0.10 0.00 1.11 0.00 0.00 32.58 30.93 1b52 s HIS 75 CO 0.05 -0.80 0.95 -0.51 -0.85 0.00 0.00 174.74 173.57 1b52 s LEU 76 N 1.33 4.16 0.21 0.89 1.43 -0.51 0.36 118.68 126.55 1b52 s LEU 76 Ca -0.00 1.78 -0.30 0.00 -1.03 0.00 0.00 54.13 54.58 1b52 s LEU 76 Cb -0.21 -4.25 -0.09 0.00 0.03 0.00 0.00 46.19 41.67 1b52 s LEU 76 CO 0.01 -0.22 1.25 0.00 0.23 0.00 0.00 176.35 177.62 1b52 s ARG 77 N -2.57 4.44 0.50 1.70 1.70 -0.43 -4.73 118.95 119.56 1b52 s ARG 77 Ca 0.56 1.98 0.17 0.00 -0.47 0.00 0.00 55.73 57.97 1b52 s ARG 77 Cb -0.15 -3.20 1.23 0.00 -0.57 0.00 0.00 34.95 32.26 1b52 s ARG 77 CO 0.19 -0.15 2.07 0.93 -1.08 0.00 0.00 175.30 177.26 1b52 h GLU 78 N 5.06 0.11 -0.26 3.89 4.39 -1.95 -2.95 114.58 122.89 1b52 h GLU 78 Ca -0.45 -0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.24 1b52 h GLU 78 Cb 1.21 -0.03 0.00 0.00 -0.10 0.00 0.00 28.75 29.84 1b52 h GLU 78 CO 0.75 0.08 0.00 0.27 -1.16 0.00 0.00 179.01 178.94 1b52 n ASN 79 N -4.48 1.84 -4.66 1.42 6.94 -1.26 -4.95 115.26 110.11 1b52 n ASN 79 Ca 0.03 -1.84 -0.42 0.00 -0.02 0.00 0.00 54.58 52.33 1b52 n ASN 79 Cb 0.27 -0.17 -0.03 0.00 -2.36 0.00 0.00 39.78 37.49 1b52 n ASN 79 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1b52 s ALA 80 N -1.66 3.59 0.06 -2.53 0.00 -1.12 -4.66 121.76 115.43 1b52 s ALA 80 Ca 0.29 1.20 0.05 0.00 0.00 0.00 0.00 51.96 53.51 1b52 s ALA 80 Cb 0.16 -3.82 -0.03 0.00 0.00 0.00 0.00 23.12 19.43 1b52 s ALA 80 CO 0.22 -1.53 -0.14 0.15 0.00 0.00 0.00 175.76 174.46 1b52 s LYS 81 N 4.35 0.88 0.74 0.00 3.01 -1.26 -1.32 119.74 126.14 1b52 s LYS 81 Ca 0.84 -0.87 -0.11 0.00 -1.01 0.00 0.00 55.97 54.82 1b52 s LYS 81 Cb -0.40 -0.90 0.03 0.00 -1.01 0.00 0.00 37.83 35.55 1b52 s LYS 81 CO 0.38 0.21 1.07 -1.58 0.51 0.00 0.00 175.35 175.94 1b52 s TRP 82 N -1.07 2.99 0.43 3.18 0.52 0.78 -4.55 118.94 121.23 1b52 s TRP 82 Ca -0.00 1.32 0.16 0.00 0.02 0.00 0.00 56.10 57.61 1b52 s TRP 82 Cb -0.09 -2.97 1.05 0.00 -1.15 0.00 0.00 33.47 30.30 1b52 s TRP 82 CO 0.02 -1.45 1.99 0.66 0.02 0.00 0.00 176.95 178.18 1b52 h SER 83 N -0.87 0.00 0.00 2.95 4.64 0.18 -2.12 113.55 118.33 1b52 h SER 83 Ca -0.45 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.87 1b52 h SER 83 Cb 1.23 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.32 1b52 h SER 83 CO 0.57 0.19 0.00 -0.90 -0.87 0.00 0.00 176.83 175.83 1b52 n ASP 84 N -4.18 0.59 0.00 4.97 5.75 -1.26 -4.67 116.55 117.74 1b52 n ASP 84 Ca -0.02 -1.38 0.00 0.00 -0.01 0.00 0.00 54.79 53.38 1b52 n ASP 84 Cb 0.26 -0.29 0.00 0.00 -1.03 0.00 0.00 41.12 40.06 1b52 n ASP 84 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1b52 n GLY 85 N 0.16 0.93 3.80 6.12 0.00 -0.80 -4.96 105.19 110.45 1b52 n GLY 85 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.71 1b52 n GLY 85 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1b52 s THR 86 N -1.81 3.75 0.03 2.61 -4.23 -1.25 -4.72 115.64 110.02 1b52 s THR 86 Ca 0.00 0.60 -0.21 0.00 -1.18 0.00 0.00 61.69 60.90 1b52 s THR 86 Cb 0.00 -3.23 -0.06 0.00 1.34 0.00 0.00 72.50 70.55 1b52 s THR 86 CO 0.00 -0.72 0.61 -2.16 -0.54 0.00 0.00 174.62 171.81 1b52 s PRO 87 N -4.89 4.31 -0.28 3.99 0.04 -1.26 -0.16 135.00 136.75 1b52 s PRO 87 Ca 0.60 0.77 -0.29 0.00 0.04 0.00 0.00 61.00 62.12 1b52 s PRO 87 Cb -0.15 -3.31 0.01 0.00 0.04 0.00 0.00 34.50 31.08 1b52 s PRO 87 CO 0.53 0.45 1.16 0.08 0.04 0.00 0.00 177.00 179.27 1b52 s VAL 88 N -0.49 4.39 0.39 -0.36 1.01 -0.44 -4.84 120.40 120.06 1b52 s VAL 88 Ca 0.31 1.62 0.01 0.00 0.00 0.00 0.00 61.98 63.91 1b52 s VAL 88 Cb -0.19 -4.27 -0.00 0.00 0.00 0.00 0.00 36.38 31.92 1b52 s VAL 88 CO 0.18 -0.39 0.03 0.35 0.00 0.00 0.00 175.10 175.27 1b52 n THR 89 N 5.83 0.00 0.27 3.92 -2.24 -1.26 -4.78 114.28 116.02 1b52 n THR 89 Ca 0.13 -1.92 0.13 0.00 -2.27 0.00 0.00 64.05 60.13 1b52 n THR 89 Cb 0.46 0.45 0.77 0.00 -2.10 0.00 0.00 70.33 69.92 1b52 n THR 89 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1b52 h ALA 90 N 1.29 1.33 -0.14 6.98 0.00 -1.71 -2.55 119.26 124.46 1b52 h ALA 90 Ca -0.32 -0.09 -0.07 0.00 0.00 0.00 0.00 54.91 54.44 1b52 h ALA 90 Cb 1.01 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.77 1b52 h ALA 90 CO 0.52 0.12 -0.23 0.45 0.00 0.00 0.00 179.25 180.11 1b52 h HIS 91 N 0.00 0.26 -0.75 0.00 3.86 -1.88 0.14 115.15 116.79 1b52 h HIS 91 Ca -0.00 -0.04 -0.02 0.00 -1.16 0.00 0.00 60.37 59.15 1b52 h HIS 91 Cb 0.27 -0.07 -0.04 0.00 1.06 0.00 0.00 27.41 28.63 1b52 h HIS 91 CO 0.00 0.46 0.39 -0.44 0.86 0.00 0.00 177.93 179.20 1b52 h ASP 92 N 0.22 0.94 -0.12 2.45 3.32 -1.83 -0.22 116.42 121.18 1b52 h ASP 92 Ca 0.04 -0.08 -0.13 0.00 0.02 0.00 0.00 57.03 56.87 1b52 h ASP 92 Cb 0.53 -0.24 0.00 0.00 0.22 0.00 0.00 39.33 39.85 1b52 h ASP 92 CO 0.04 0.76 -0.44 -0.26 -1.72 0.00 0.00 179.24 177.62 1b52 h PHE 93 N 1.05 0.67 -0.19 4.55 -1.00 -1.31 -1.51 116.94 119.19 1b52 h PHE 93 Ca 0.26 -0.28 0.04 0.00 2.81 0.00 0.00 57.97 60.80 1b52 h PHE 93 Cb 0.05 -0.11 -0.03 0.00 3.61 0.00 0.00 35.95 39.47 1b52 h PHE 93 CO 0.01 1.04 -0.03 0.28 -1.61 0.00 0.00 178.31 178.00 1b52 h VAL 94 N 0.10 0.83 0.15 -0.55 2.07 -0.70 -0.83 116.25 117.33 1b52 h VAL 94 Ca -0.02 -0.01 -0.01 0.00 0.82 0.00 0.00 66.70 67.48 1b52 h VAL 94 Cb 1.07 0.80 0.00 0.00 -1.52 0.00 0.00 31.29 31.64 1b52 h VAL 94 CO 0.09 0.01 -0.07 0.22 0.02 0.00 0.00 177.57 177.83 1b52 h TYR 95 N 0.03 -0.19 -0.20 1.57 3.20 -1.05 -2.12 116.97 118.20 1b52 h TYR 95 Ca 0.09 -0.00 0.05 0.00 3.14 0.00 0.00 58.73 62.01 1b52 h TYR 95 Cb 0.13 0.06 -0.05 0.00 1.54 0.00 0.00 36.73 38.41 1b52 h TYR 95 CO -0.19 -0.12 -0.14 0.77 -1.64 0.00 0.00 178.16 176.84 1b52 h SER 96 N -0.21 -0.44 0.79 -2.11 0.02 -0.81 -0.69 113.55 110.10 1b52 h SER 96 Ca -0.02 0.09 -0.07 0.00 -0.84 0.00 0.00 61.79 60.95 1b52 h SER 96 Cb 0.16 0.23 -0.01 0.00 0.14 0.00 0.00 62.40 62.92 1b52 h SER 96 CO 0.03 -0.17 -0.35 -0.50 -1.14 0.00 0.00 176.83 174.70 1b52 h TRP 97 N -0.13 0.00 -0.27 3.45 4.06 -1.20 -1.45 115.95 120.41 1b52 h TRP 97 Ca 0.12 0.00 -0.08 0.00 2.06 0.00 0.00 58.89 60.99 1b52 h TRP 97 Cb 0.31 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.46 1b52 h TRP 97 CO -0.29 0.35 -0.13 1.96 -3.56 0.00 0.00 178.44 176.77 1b52 h GLN 98 N 0.00 0.56 -0.29 0.49 4.20 -0.85 -2.12 115.11 117.10 1b52 h GLN 98 Ca -0.00 -0.24 -0.02 0.00 0.06 0.00 0.00 58.65 58.44 1b52 h GLN 98 Cb 0.84 -0.02 -0.01 0.00 0.30 0.00 0.00 27.48 28.59 1b52 h GLN 98 CO 0.05 0.81 0.11 -0.09 -0.67 0.00 0.00 178.83 179.03 1b52 h ARG 99 N 0.30 0.44 -0.70 1.46 2.43 -0.27 -1.98 114.38 116.06 1b52 h ARG 99 Ca 0.06 -0.08 0.09 0.00 -0.81 0.00 0.00 59.98 59.24 1b52 h ARG 99 Cb 0.63 -0.07 -0.07 0.00 -0.42 0.00 0.00 29.97 30.05 1b52 h ARG 99 CO 0.04 0.47 0.35 1.25 -1.51 0.00 0.00 179.97 180.56 1b52 h LEU 100 N 0.32 0.45 -0.91 3.80 5.85 -1.28 -2.10 115.31 121.44 1b52 h LEU 100 Ca 0.10 0.06 -0.11 0.00 0.84 0.00 0.00 57.88 58.77 1b52 h LEU 100 Cb 0.20 -0.02 -0.01 0.00 0.37 0.00 0.00 40.66 41.20 1b52 h LEU 100 CO -0.01 0.26 -0.37 0.00 -0.34 0.00 0.00 178.44 177.99 1b52 h ALA 101 N 1.42 1.08 -2.54 1.25 0.00 -1.27 -3.41 119.26 115.79 1b52 h ALA 101 Ca 0.34 -0.40 -0.53 0.00 0.00 0.00 0.00 54.91 54.33 1b52 h ALA 101 Cb 0.35 -0.10 0.04 0.00 0.00 0.00 0.00 17.79 18.07 1b52 h ALA 101 CO -0.26 0.58 0.99 0.34 0.00 0.00 0.00 179.25 180.90 1b52 s ASP 102 N -6.86 6.53 0.52 0.00 -1.08 -0.75 -4.43 116.67 110.60 1b52 s ASP 102 Ca -0.05 2.63 0.24 0.00 -0.52 0.00 0.00 52.55 54.85 1b52 s ASP 102 Cb 0.13 -2.58 1.36 0.00 -1.46 0.00 0.00 42.92 40.37 1b52 s ASP 102 CO 0.78 -0.90 1.99 -0.65 0.52 0.00 0.00 175.17 176.91 1b52 h PRO 103 N 7.69 0.04 0.00 4.34 0.11 -1.86 0.91 132.00 143.23 1b52 h PRO 103 Ca -0.43 -0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.65 1b52 h PRO 103 Cb 1.21 -0.01 -0.00 0.00 0.11 0.00 0.00 31.00 32.30 1b52 h PRO 103 CO 0.93 0.03 -0.10 -0.91 -0.21 0.00 0.00 178.00 177.74 1b52 h ASN 104 N 0.04 0.00 0.76 -2.05 2.35 -1.91 -1.91 115.58 112.86 1b52 h ASN 104 Ca 0.26 0.00 -0.08 0.00 -0.55 0.00 0.00 56.30 55.93 1b52 h ASN 104 Cb 0.98 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.34 1b52 h ASN 104 CO -0.01 0.10 -0.37 0.74 -1.65 0.00 0.00 177.43 176.23 1b52 h THR 105 N 0.00 0.93 -6.20 2.81 2.02 -1.05 -3.47 112.91 107.95 1b52 h THR 105 Ca -0.00 -1.47 -0.47 0.00 0.77 0.00 0.00 66.41 65.24 1b52 h THR 105 Cb 0.72 1.88 -0.02 0.00 -1.74 0.00 0.00 68.15 68.98 1b52 h THR 105 CO 0.01 0.36 -0.74 0.00 0.37 0.00 0.00 175.52 175.53 1b52 n ALA 106 N -2.32 -1.26 -1.81 6.16 0.00 -0.72 -4.93 120.51 115.62 1b52 n ALA 106 Ca -0.01 0.21 -0.41 0.00 0.00 0.00 0.00 53.44 53.24 1b52 n ALA 106 Cb 0.49 -4.53 -0.03 0.00 0.00 0.00 0.00 19.45 15.38 1b52 n ALA 106 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1b52 s SER 107 N -3.26 6.93 0.26 0.00 0.15 -1.26 -4.90 113.70 111.62 1b52 s SER 107 Ca 0.65 2.52 0.23 0.00 0.70 0.00 0.00 55.95 60.05 1b52 s SER 107 Cb -0.32 -2.64 1.00 0.00 -1.71 0.00 0.00 66.02 62.36 1b52 s SER 107 CO 0.80 -0.43 1.68 -0.81 1.20 0.00 0.00 173.24 175.69 1b52 n PRO 108 N 1.27 0.17 -0.98 5.44 -0.04 -1.26 -2.22 135.00 137.39 1b52 n PRO 108 Ca 0.01 0.47 -0.10 0.00 -0.04 0.00 0.00 63.50 63.84 1b52 n PRO 108 Cb 0.43 -1.88 0.18 0.00 -0.04 0.00 0.00 33.50 32.19 1b52 n PRO 108 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1b52 n TYR 109 N -2.22 1.61 -0.30 0.54 4.01 -1.26 -3.81 117.16 115.73 1b52 n TYR 109 Ca 0.01 -1.76 0.02 0.00 -0.16 0.00 0.00 57.90 56.01 1b52 n TYR 109 Cb 0.18 -0.61 0.21 0.00 -0.31 0.00 0.00 39.34 38.81 1b52 n TYR 109 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1b52 h ALA 110 N 1.11 1.45 0.00 -0.72 0.00 -1.67 -1.56 119.26 117.86 1b52 h ALA 110 Ca 0.32 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.19 1b52 h ALA 110 Cb 1.83 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 19.31 1b52 h ALA 110 CO 0.59 0.47 0.00 0.77 0.00 0.00 0.00 179.25 181.08 1b52 h SER 111 N 1.10 0.00 -0.88 0.00 0.02 -1.85 -3.09 113.55 108.86 1b52 h SER 111 Ca 0.35 0.00 0.08 0.00 -0.84 0.00 0.00 61.79 61.38 1b52 h SER 111 Cb 0.02 0.00 -0.06 0.00 0.14 0.00 0.00 62.40 62.50 1b52 h SER 111 CO -0.11 0.00 0.57 0.22 -1.14 0.00 0.00 176.83 176.38 1b52 h TYR 112 N 0.00 0.98 0.00 3.45 3.20 -1.64 0.43 116.97 123.39 1b52 h TYR 112 Ca 0.00 0.03 -0.02 0.00 3.14 0.00 0.00 58.73 61.87 1b52 h TYR 112 Cb 0.13 -0.32 -0.00 0.00 1.54 0.00 0.00 36.73 38.07 1b52 h TYR 112 CO 0.00 0.48 -0.10 -0.07 -1.64 0.00 0.00 178.16 176.83 1b52 h LEU 113 N 0.93 0.00 -0.82 2.82 3.38 -1.75 -1.37 115.31 118.50 1b52 h LEU 113 Ca 0.39 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 58.24 1b52 h LEU 113 Cb 0.30 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.04 1b52 h LEU 113 CO -0.16 0.10 -0.57 1.56 0.09 0.00 0.00 178.44 179.46 1b52 h GLN 114 N 0.00 0.00 -0.71 1.13 4.20 -1.18 -2.01 115.11 116.54 1b52 h GLN 114 Ca -0.00 0.00 -0.03 0.00 0.06 0.00 0.00 58.65 58.68 1b52 h GLN 114 Cb 0.72 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 28.47 1b52 h GLN 114 CO 0.01 0.57 0.31 1.88 -0.67 0.00 0.00 178.83 180.94 1b52 h TYR 115 N 0.00 1.03 -0.00 2.96 0.05 0.02 -1.80 116.97 119.23 1b52 h TYR 115 Ca -0.01 -0.05 0.00 0.00 0.05 0.00 0.00 58.73 58.72 1b52 h TYR 115 Cb 1.04 -0.32 0.00 0.00 1.01 0.00 0.00 36.73 38.46 1b52 h TYR 115 CO 0.00 0.76 -0.18 0.41 -1.05 0.00 0.00 178.16 178.10 1b52 n GLY 116 N -1.03 -1.21 3.39 3.88 0.00 -0.73 -4.95 105.19 104.54 1b52 n GLY 116 Ca 0.07 -0.24 -0.24 0.00 0.00 0.00 0.00 46.02 45.62 1b52 n GLY 116 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1b52 n HIS 117 N -1.28 -2.55 -1.75 1.61 8.25 -0.68 -4.88 115.22 113.95 1b52 n HIS 117 Ca 0.10 0.83 -0.42 0.00 -0.26 0.00 0.00 57.72 57.97 1b52 n HIS 117 Cb 0.31 -4.84 -0.01 0.00 1.12 0.00 0.00 29.99 26.57 1b52 n HIS 117 CO 0.00 0.00 0.00 -0.89 0.64 0.00 0.00 176.34 176.09 1b52 n ILE 118 N -4.83 1.31 -1.71 1.59 -0.00 -1.03 -1.16 119.36 113.54 1b52 n ILE 118 Ca -0.04 -0.33 -0.39 0.00 -0.00 0.00 0.00 62.75 62.00 1b52 n ILE 118 Cb 0.58 -1.92 0.04 0.00 -0.00 0.00 0.00 39.64 38.35 1b52 n ILE 118 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55 1b52 n ALA 119 N 1.61 1.22 -0.79 -1.39 0.00 0.32 -2.67 120.51 118.81 1b52 n ALA 119 Ca 0.07 0.12 0.00 0.00 0.00 0.00 0.00 53.44 53.62 1b52 n ALA 119 Cb 0.37 -2.29 0.00 0.00 0.00 0.00 0.00 19.45 17.53 1b52 n ALA 119 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1b52 n ASN 120 N -0.82 -1.78 -0.21 0.00 3.02 -1.26 -1.08 115.26 113.13 1b52 n ASN 120 Ca 0.11 0.00 0.01 0.00 -0.03 0.00 0.00 54.58 54.67 1b52 n ASN 120 Cb 0.44 -1.95 0.12 0.00 -0.61 0.00 0.00 39.78 37.78 1b52 n ASN 120 CO 0.00 0.00 0.00 -0.29 -2.62 0.00 0.00 177.26 174.35 1b52 h ILE 121 N 0.00 0.71 0.45 2.41 6.09 -1.87 -1.78 117.51 123.53 1b52 h ILE 121 Ca 0.00 -0.13 -0.01 0.00 -1.37 0.00 0.00 64.86 63.35 1b52 h ILE 121 Cb 0.24 0.31 -0.02 0.00 0.47 0.00 0.00 36.82 37.82 1b52 h ILE 121 CO 0.00 0.07 -0.38 0.44 -3.07 0.00 0.00 178.15 175.21 1b52 h ASP 122 N 0.37 -1.02 -0.88 2.19 3.32 -1.92 0.03 116.42 118.51 1b52 h ASP 122 Ca 0.33 0.08 0.14 0.00 0.02 0.00 0.00 57.03 57.60 1b52 h ASP 122 Cb 0.45 0.33 -0.09 0.00 0.22 0.00 0.00 39.33 40.24 1b52 h ASP 122 CO -0.35 -0.55 0.48 0.44 -1.72 0.00 0.00 179.24 177.54 1b52 h ASP 123 N -0.83 0.61 -0.14 6.45 3.32 -1.93 0.94 116.42 124.84 1b52 h ASP 123 Ca -0.04 0.08 -0.02 0.00 0.02 0.00 0.00 57.03 57.07 1b52 h ASP 123 Cb 0.72 -0.02 -0.01 0.00 0.22 0.00 0.00 39.33 40.25 1b52 h ASP 123 CO -0.02 0.27 0.02 0.40 -1.72 0.00 0.00 179.24 178.19 1b52 h ILE 124 N 0.69 1.22 -0.93 0.35 2.04 -0.96 -0.04 117.51 119.89 1b52 h ILE 124 Ca 0.47 -0.70 0.06 0.00 1.00 0.00 0.00 64.86 65.69 1b52 h ILE 124 Cb 0.64 1.43 -0.06 0.00 -0.74 0.00 0.00 36.82 38.08 1b52 h ILE 124 CO -0.34 0.21 0.60 0.40 0.00 0.00 0.00 178.15 179.02 1b52 h ILE 125 N 0.00 1.09 0.00 -0.67 2.04 0.11 -1.98 117.51 118.10 1b52 h ILE 125 Ca 0.04 -0.37 0.00 0.00 1.00 0.00 0.00 64.86 65.53 1b52 h ILE 125 Cb 0.30 -0.09 0.00 0.00 -0.74 0.00 0.00 36.82 36.29 1b52 h ILE 125 CO 0.00 0.20 0.00 0.00 0.00 0.00 0.00 178.15 178.35 1b52 n ALA 126 N -2.39 2.11 -0.41 1.87 0.00 -0.16 -4.79 120.51 116.74 1b52 n ALA 126 Ca 0.14 -0.09 0.00 0.00 0.00 0.00 0.00 53.44 53.49 1b52 n ALA 126 Cb 0.18 -1.38 0.00 0.00 0.00 0.00 0.00 19.45 18.24 1b52 n ALA 126 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1b52 n GLY 127 N 0.91 1.28 0.27 0.00 0.00 -0.55 -4.92 105.19 102.19 1b52 n GLY 127 Ca 0.07 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.99 1b52 n GLY 127 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1b52 h LYS 128 N 3.28 0.86 -5.70 1.61 1.57 -1.30 -3.44 116.57 113.46 1b52 h LYS 128 Ca 0.00 -0.37 -0.55 0.00 -1.87 0.00 0.00 60.65 57.86 1b52 h LYS 128 Cb 0.00 -0.03 -0.14 0.00 0.08 0.00 0.00 32.23 32.14 1b52 h LYS 128 CO 0.00 1.01 -0.68 0.15 -0.57 0.00 0.00 179.45 179.36 1b52 s LYS 129 N -4.60 1.68 0.53 3.15 1.02 -1.10 -4.99 119.74 115.44 1b52 s LYS 129 Ca -0.10 -1.86 -0.16 0.00 0.02 0.00 0.00 55.97 53.87 1b52 s LYS 129 Cb 0.13 -1.40 -0.07 0.00 -0.52 0.00 0.00 37.83 35.96 1b52 s LYS 129 CO 0.85 0.08 1.00 -1.25 -0.92 0.00 0.00 175.35 175.11 1b52 s PRO 130 N -3.68 3.87 0.54 -1.68 0.04 -1.26 -4.31 135.00 128.52 1b52 s PRO 130 Ca 0.31 0.95 0.27 0.00 0.04 0.00 0.00 61.00 62.57 1b52 s PRO 130 Cb 0.03 -2.12 1.43 0.00 0.04 0.00 0.00 34.50 33.88 1b52 s PRO 130 CO 0.14 -0.34 1.97 0.00 0.04 0.00 0.00 177.00 178.80 1b52 h ALA 131 N 0.73 2.55 0.00 8.56 0.00 -1.90 0.17 119.26 129.37 1b52 h ALA 131 Ca -0.46 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.40 1b52 h ALA 131 Cb 1.19 0.05 -0.00 0.00 0.00 0.00 0.00 17.79 19.02 1b52 h ALA 131 CO 0.61 -0.77 -0.13 1.79 0.00 0.00 0.00 179.25 180.75 1b52 h THR 132 N 0.00 0.70 0.00 0.00 1.35 -1.92 -1.62 112.91 111.43 1b52 h THR 132 Ca 0.29 -0.54 0.00 0.00 -0.55 0.00 0.00 66.41 65.61 1b52 h THR 132 Cb 1.19 1.33 0.00 0.00 -1.73 0.00 0.00 68.15 68.94 1b52 h THR 132 CO -0.00 0.13 0.00 0.47 -0.25 0.00 0.00 175.52 175.87 1b52 n ASP 133 N -3.81 0.00 -4.66 5.36 9.92 0.59 -4.89 116.55 119.06 1b52 n ASP 133 Ca -0.02 -0.15 -0.44 0.00 -0.53 0.00 0.00 54.79 53.65 1b52 n ASP 133 Cb 0.24 -0.19 -0.02 0.00 -0.64 0.00 0.00 41.12 40.51 1b52 n ASP 133 CO 0.00 0.00 0.00 -0.11 0.13 0.00 0.00 177.20 177.22 1b52 n LEU 134 N -1.19 2.98 -2.48 0.64 7.94 -0.61 -4.72 117.00 119.55 1b52 n LEU 134 Ca 0.09 1.18 -0.08 0.00 -1.11 0.00 0.00 56.01 56.09 1b52 n LEU 134 Cb 0.10 -1.42 -0.06 0.00 0.53 0.00 0.00 43.42 42.58 1b52 n LEU 134 CO 0.11 -0.69 1.28 0.61 -1.11 0.00 0.00 177.39 177.59 1b52 n GLY 135 N 1.37 2.14 3.17 -3.96 0.00 -0.24 -4.79 105.19 102.88 1b52 n GLY 135 Ca 0.08 -0.58 -0.20 0.00 0.00 0.00 0.00 46.02 45.32 1b52 n GLY 135 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1b52 s VAL 136 N 2.49 1.19 -0.15 1.61 -7.23 -1.26 -0.60 120.40 116.44 1b52 s VAL 136 Ca 0.31 -1.19 -0.28 0.00 -1.81 0.00 0.00 61.98 59.01 1b52 s VAL 136 Cb 0.13 -1.10 0.08 0.00 0.56 0.00 0.00 36.38 36.05 1b52 s VAL 136 CO -0.01 -0.09 0.75 -1.59 -0.31 0.00 0.00 175.10 173.85 1b52 s LYS 137 N -1.46 0.90 -0.22 4.82 -2.85 -0.72 -5.00 119.74 115.21 1b52 s LYS 137 Ca 0.01 0.53 -0.24 0.00 -1.00 0.00 0.00 55.97 55.27 1b52 s LYS 137 Cb -0.09 0.43 -0.01 0.00 -2.06 0.00 0.00 37.83 36.10 1b52 s LYS 137 CO 0.02 -0.22 0.77 0.00 0.10 0.00 0.00 175.35 176.03 1b52 s ALA 138 N -0.54 3.60 0.06 0.59 0.00 -1.26 -1.03 121.76 123.18 1b52 s ALA 138 Ca -0.05 -0.16 -0.10 0.00 0.00 0.00 0.00 51.96 51.65 1b52 s ALA 138 Cb -0.02 -3.20 -0.29 0.00 0.00 0.00 0.00 23.12 19.61 1b52 s ALA 138 CO 0.05 -0.81 1.11 -0.07 0.00 0.00 0.00 175.76 176.04 1b52 h LEU 139 N 8.84 0.64 0.00 0.00 3.38 -1.83 -3.48 115.31 122.87 1b52 h LEU 139 Ca -0.26 -0.65 -0.15 0.00 0.09 0.00 0.00 57.88 56.91 1b52 h LEU 139 Cb 1.11 -0.21 -0.04 0.00 0.09 0.00 0.00 40.66 41.62 1b52 h LEU 139 CO 0.84 1.50 -0.07 -0.90 0.09 0.00 0.00 178.44 179.89 1b52 n ASP 140 N -3.65 -0.78 0.14 -0.43 5.68 -1.25 -5.00 116.55 111.26 1b52 n ASP 140 Ca -0.12 -2.05 0.12 0.00 -0.50 0.00 0.00 54.79 52.24 1b52 n ASP 140 Cb 1.03 1.45 0.52 0.00 -1.14 0.00 0.00 41.12 42.98 1b52 n ASP 140 CO 0.00 0.00 0.00 0.47 -1.33 0.00 0.00 177.20 176.34 1b52 n ASP 141 N -1.83 0.66 -0.02 -1.12 9.92 -1.26 -2.91 116.55 119.98 1b52 n ASP 141 Ca 0.00 0.70 0.01 0.00 -0.53 0.00 0.00 54.79 54.97 1b52 n ASP 141 Cb 0.33 -0.82 0.01 0.00 -0.64 0.00 0.00 41.12 40.00 1b52 n ASP 141 CO 0.00 0.00 0.00 1.41 0.13 0.00 0.00 177.20 178.74 1b52 n HIS 142 N -2.26 0.00 -4.26 1.24 8.25 -1.26 -2.23 115.22 114.69 1b52 n HIS 142 Ca 0.01 -0.42 -0.25 0.00 -0.26 0.00 0.00 57.72 56.79 1b52 n HIS 142 Cb 0.18 -0.05 -0.17 0.00 1.12 0.00 0.00 29.99 31.07 1b52 n HIS 142 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 1b52 s THR 143 N -0.92 1.05 -0.15 1.59 2.01 -1.15 -1.43 115.64 116.65 1b52 s THR 143 Ca 0.03 -0.37 0.02 0.00 0.31 0.00 0.00 61.69 61.67 1b52 s THR 143 Cb 0.02 -1.01 0.01 0.00 0.01 0.00 0.00 72.50 71.53 1b52 s THR 143 CO 0.00 0.35 -0.21 0.12 -0.69 0.00 0.00 174.62 174.20 1b52 s PHE 144 N 1.13 2.70 -0.14 4.92 5.36 0.29 -2.20 117.98 130.04 1b52 s PHE 144 Ca -0.06 -1.34 -0.01 0.00 -0.96 0.00 0.00 56.93 54.57 1b52 s PHE 144 Cb -0.14 -1.84 -0.01 0.00 -0.34 0.00 0.00 43.02 40.68 1b52 s PHE 144 CO -0.02 -0.62 -0.12 -2.00 -1.46 0.00 0.00 175.22 171.01 1b52 s GLU 145 N 0.87 3.39 -0.11 10.12 2.12 -0.20 0.11 118.70 135.00 1b52 s GLU 145 Ca -0.05 -0.68 0.01 0.00 0.36 0.00 0.00 54.97 54.61 1b52 s GLU 145 Cb -0.15 -2.67 -0.02 0.00 0.26 0.00 0.00 34.13 31.55 1b52 s GLU 145 CO -0.03 0.17 -0.13 0.08 -0.54 0.00 0.00 175.26 174.81 1b52 s VAL 146 N 0.47 3.10 -0.18 3.70 1.01 0.36 -1.75 120.40 127.11 1b52 s VAL 146 Ca -0.09 -0.66 -0.01 0.00 0.00 0.00 0.00 61.98 61.22 1b52 s VAL 146 Cb -0.16 -2.28 0.00 0.00 0.00 0.00 0.00 36.38 33.94 1b52 s VAL 146 CO 0.04 0.54 -0.14 -0.89 0.00 0.00 0.00 175.10 174.66 1b52 s THR 147 N 0.08 2.68 0.11 3.92 2.01 0.23 -0.68 115.64 123.99 1b52 s THR 147 Ca -0.05 -0.74 0.03 0.00 0.31 0.00 0.00 61.69 61.23 1b52 s THR 147 Cb -0.15 -2.16 -0.04 0.00 0.01 0.00 0.00 72.50 70.17 1b52 s THR 147 CO 0.04 0.50 0.15 -0.76 -0.69 0.00 0.00 174.62 173.86 1b52 s LEU 148 N 1.14 4.00 0.00 4.42 1.43 -0.40 0.12 118.68 129.39 1b52 s LEU 148 Ca 0.01 0.04 0.26 0.00 -1.03 0.00 0.00 54.13 53.41 1b52 s LEU 148 Cb -0.14 -2.63 0.68 0.00 0.03 0.00 0.00 46.19 44.13 1b52 s LEU 148 CO -0.05 0.12 1.54 -1.54 0.23 0.00 0.00 176.35 176.65 1b52 n SER 149 N 0.04 0.38 -3.82 2.29 3.41 -0.30 -4.71 113.62 110.91 1b52 n SER 149 Ca -0.08 -0.06 -0.12 0.00 -0.26 0.00 0.00 58.87 58.36 1b52 n SER 149 Cb 0.53 0.06 -0.09 0.00 -0.26 0.00 0.00 64.21 64.45 1b52 n SER 149 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 1b52 s GLU 150 N -3.00 0.57 0.28 4.33 0.41 -1.26 -5.08 118.70 114.94 1b52 s GLU 150 Ca 0.12 -0.29 -0.30 0.00 -0.41 0.00 0.00 54.97 54.09 1b52 s GLU 150 Cb 0.18 0.25 -0.10 0.00 -1.78 0.00 0.00 34.13 32.67 1b52 s GLU 150 CO 0.66 -0.15 1.40 -1.25 -0.49 0.00 0.00 175.26 175.44 1b52 s PRO 151 N -1.33 4.28 -0.30 0.39 0.04 -1.26 -4.66 135.00 132.16 1b52 s PRO 151 Ca -0.14 2.29 -0.01 0.00 0.04 0.00 0.00 61.00 63.18 1b52 s PRO 151 Cb -0.06 -3.09 0.10 0.00 0.04 0.00 0.00 34.50 31.48 1b52 s PRO 151 CO 0.03 -0.36 0.09 0.08 0.04 0.00 0.00 177.00 176.88 1b52 s VAL 152 N -0.36 0.85 0.44 -0.36 1.01 -0.46 -4.92 120.40 116.60 1b52 s VAL 152 Ca 0.56 -1.34 0.17 0.00 0.00 0.00 0.00 61.98 61.37 1b52 s VAL 152 Cb -0.41 -1.63 0.20 0.00 0.00 0.00 0.00 36.38 34.54 1b52 s VAL 152 CO 0.47 -0.64 2.00 -0.65 0.00 0.00 0.00 175.10 176.27 1b52 h PRO 153 N 8.10 0.00 -0.65 2.72 0.11 -1.93 -2.73 132.00 137.62 1b52 h PRO 153 Ca -0.14 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.97 1b52 h PRO 153 Cb 1.02 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.13 1b52 h PRO 153 CO 0.46 0.18 0.00 2.48 -0.21 0.00 0.00 178.00 180.92 1b52 n TYR 154 N -4.16 1.29 -0.28 0.65 4.11 -1.26 -4.57 117.16 112.95 1b52 n TYR 154 Ca -0.02 -0.48 0.08 0.00 -0.00 0.00 0.00 57.90 57.48 1b52 n TYR 154 Cb 0.26 -0.28 0.23 0.00 -0.00 0.00 0.00 39.34 39.55 1b52 n TYR 154 CO 0.00 0.00 0.00 0.35 -0.00 0.00 0.00 176.86 177.21 1b52 h PHE 155 N 3.03 0.55 0.00 -3.48 3.57 -1.87 -2.14 116.94 116.60 1b52 h PHE 155 Ca 0.00 0.04 -0.04 0.00 3.53 0.00 0.00 57.97 61.50 1b52 h PHE 155 Cb 1.33 -0.12 -0.01 0.00 2.79 0.00 0.00 35.95 39.95 1b52 h PHE 155 CO 0.67 0.01 -0.17 0.10 -2.23 0.00 0.00 178.31 176.69 1b52 h TYR 156 N 0.42 0.00 -0.01 0.41 -0.00 -1.87 -2.60 116.97 113.33 1b52 h TYR 156 Ca 0.47 0.00 -0.08 0.00 -0.00 0.00 0.00 58.73 59.13 1b52 h TYR 156 Cb 0.80 0.00 -0.01 0.00 -0.00 0.00 0.00 36.73 37.52 1b52 h TYR 156 CO -0.17 0.17 -0.36 0.87 -0.00 0.00 0.00 178.16 178.68 1b52 h LYS 157 N 0.00 0.02 0.00 0.10 1.57 -1.74 -3.11 116.57 113.41 1b52 h LYS 157 Ca -0.00 -0.01 -0.00 0.00 -1.87 0.00 0.00 60.65 58.77 1b52 h LYS 157 Cb 0.46 -0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.77 1b52 h LYS 157 CO 0.02 0.38 -0.02 -0.07 -0.57 0.00 0.00 179.45 179.19 1b52 h LEU 158 N 0.01 0.00 -0.03 2.94 4.07 -1.50 -3.32 115.31 117.48 1b52 h LEU 158 Ca -0.00 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.96 1b52 h LEU 158 Cb 0.65 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.39 1b52 h LEU 158 CO 0.05 0.02 -0.00 0.18 -1.08 0.00 0.00 178.44 177.60 1b52 n LEU 159 N -3.15 0.04 -0.13 1.67 4.77 -1.18 -2.96 117.00 116.08 1b52 n LEU 159 Ca -0.01 0.06 0.15 0.00 -0.03 0.00 0.00 56.01 56.18 1b52 n LEU 159 Cb 0.23 -0.08 0.79 0.00 -2.33 0.00 0.00 43.42 42.03 1b52 n LEU 159 CO 0.26 0.01 1.01 1.33 -1.33 0.00 0.00 177.39 178.66 1b52 n VAL 160 N -1.05 0.01 -2.90 4.08 0.24 -1.25 -4.23 118.33 113.23 1b52 n VAL 160 Ca 0.21 -0.07 -0.35 0.00 -2.04 0.00 0.00 64.34 62.09 1b52 n VAL 160 Cb 0.15 -0.22 -0.06 0.00 -1.47 0.00 0.00 33.84 32.24 1b52 n VAL 160 CO 0.00 0.00 0.00 -2.28 -2.14 0.00 0.00 176.83 172.41 1b52 s HIS 161 N -1.99 3.53 0.45 6.34 5.04 -1.15 -4.92 115.29 122.58 1b52 s HIS 161 Ca 0.43 1.58 0.12 0.00 -1.54 0.00 0.00 55.06 55.64 1b52 s HIS 161 Cb 0.20 -2.79 1.02 0.00 0.04 0.00 0.00 32.58 31.05 1b52 s HIS 161 CO 0.34 0.13 2.05 -1.35 -2.34 0.00 0.00 174.74 173.57 1b52 h PRO 162 N 2.73 0.36 -0.31 2.88 0.11 -1.92 -2.55 132.00 133.30 1b52 h PRO 162 Ca -0.48 -0.02 -0.04 0.00 0.11 0.00 0.00 66.00 65.57 1b52 h PRO 162 Cb 1.19 -0.08 -0.02 0.00 0.11 0.00 0.00 31.00 32.20 1b52 h PRO 162 CO 0.64 0.24 0.03 0.77 -0.21 0.00 0.00 178.00 179.47 1b52 h SER 163 N 0.37 0.42 -0.40 -2.05 0.02 -1.94 -2.07 113.55 107.90 1b52 h SER 163 Ca 0.16 -0.06 0.00 0.00 -0.84 0.00 0.00 61.79 61.05 1b52 h SER 163 Cb 0.18 -0.11 0.00 0.00 0.14 0.00 0.00 62.40 62.61 1b52 h SER 163 CO -0.04 0.47 0.00 1.33 -1.14 0.00 0.00 176.83 177.45 1b52 n VAL 164 N -4.33 1.06 -2.50 2.27 0.24 -0.96 -4.79 118.33 109.32 1b52 n VAL 164 Ca 0.01 -0.70 -0.34 0.00 -2.04 0.00 0.00 64.34 61.27 1b52 n VAL 164 Cb 0.21 0.01 -0.03 0.00 -1.47 0.00 0.00 33.84 32.55 1b52 n VAL 164 CO 0.00 0.00 0.00 -0.44 -2.14 0.00 0.00 176.83 174.25 1b52 s SER 165 N -0.77 6.29 0.48 -1.34 0.01 -0.78 -4.69 113.70 112.91 1b52 s SER 165 Ca 0.31 1.92 -0.19 0.00 1.31 0.00 0.00 55.95 59.29 1b52 s SER 165 Cb 0.20 -2.56 -0.09 0.00 0.21 0.00 0.00 66.02 63.78 1b52 s SER 165 CO 0.16 -0.82 1.00 -2.16 0.41 0.00 0.00 173.24 171.83 1b52 s PRO 166 N -3.31 3.91 0.03 12.44 0.04 -1.26 -4.92 135.00 141.92 1b52 s PRO 166 Ca 0.67 1.20 0.08 0.00 0.04 0.00 0.00 61.00 62.99 1b52 s PRO 166 Cb -0.16 -2.12 -0.02 0.00 0.04 0.00 0.00 34.50 32.23 1b52 s PRO 166 CO 0.22 -0.32 -0.22 0.14 0.04 0.00 0.00 177.00 176.85 1b52 s VAL 167 N -2.19 1.80 -0.63 -0.36 -7.23 -1.26 -4.87 120.40 105.66 1b52 s VAL 167 Ca 0.64 -1.16 -0.27 0.00 -1.81 0.00 0.00 61.98 59.37 1b52 s VAL 167 Cb -0.13 -1.54 0.00 0.00 0.56 0.00 0.00 36.38 35.27 1b52 s VAL 167 CO 0.21 0.33 1.60 -2.16 -0.31 0.00 0.00 175.10 174.78 1b52 s PRO 168 N -0.99 2.95 0.24 4.82 0.04 -1.26 -4.76 135.00 136.04 1b52 s PRO 168 Ca 0.09 0.37 -0.14 0.00 0.04 0.00 0.00 61.00 61.36 1b52 s PRO 168 Cb -0.09 -4.27 0.30 0.00 0.04 0.00 0.00 34.50 30.48 1b52 s PRO 168 CO 0.01 -2.37 1.48 1.17 0.04 0.00 0.00 177.00 177.33 1b52 n LYS 169 N 9.11 -0.18 -0.05 4.56 4.81 -1.26 -1.62 118.16 133.53 1b52 n LYS 169 Ca 0.14 1.47 -0.08 0.00 -0.87 0.00 0.00 58.31 58.97 1b52 n LYS 169 Cb 0.50 -2.19 -0.02 0.00 0.02 0.00 0.00 35.03 33.34 1b52 n LYS 169 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 1b52 h SER 170 N 0.00 -0.86 -0.21 3.14 4.64 -2.00 -1.42 113.55 116.84 1b52 h SER 170 Ca 0.37 0.15 -0.02 0.00 -0.47 0.00 0.00 61.79 61.82 1b52 h SER 170 Cb 0.61 0.40 -0.01 0.00 -0.31 0.00 0.00 62.40 63.09 1b52 h SER 170 CO -0.96 -0.30 0.05 0.00 -0.87 0.00 0.00 176.83 174.75 1b52 h ALA 171 N 0.73 0.28 -0.20 5.18 0.00 -1.66 -2.77 119.26 120.81 1b52 h ALA 171 Ca 0.14 -0.16 0.06 0.00 0.00 0.00 0.00 54.91 54.94 1b52 h ALA 171 Cb 0.49 -0.08 -0.07 0.00 0.00 0.00 0.00 17.79 18.13 1b52 h ALA 171 CO -0.41 -0.07 -0.31 0.28 0.00 0.00 0.00 179.25 178.75 1b52 h VAL 172 N 0.15 0.29 -0.21 0.00 2.07 -1.00 -0.99 116.25 116.56 1b52 h VAL 172 Ca 0.07 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.55 1b52 h VAL 172 Cb 0.28 0.29 -0.01 0.00 -1.52 0.00 0.00 31.29 30.33 1b52 h VAL 172 CO 0.00 0.00 -0.02 -0.33 0.02 0.00 0.00 177.57 177.25 1b52 h GLU 173 N -0.34 0.31 0.12 1.57 4.39 -1.30 0.70 114.58 120.03 1b52 h GLU 173 Ca 0.12 -0.05 -0.01 0.00 0.34 0.00 0.00 59.36 59.76 1b52 h GLU 173 Cb 0.53 -0.05 0.00 0.00 -0.10 0.00 0.00 28.75 29.13 1b52 h GLU 173 CO -0.40 0.36 -0.06 0.87 -1.16 0.00 0.00 179.01 178.62 1b52 h LYS 174 N 0.31 -0.16 -0.00 2.33 1.57 -1.05 -3.39 116.57 116.17 1b52 h LYS 174 Ca 0.07 0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.86 1b52 h LYS 174 Cb 0.24 0.04 0.00 0.00 0.08 0.00 0.00 32.23 32.58 1b52 h LYS 174 CO 0.01 -0.11 -0.04 1.19 -0.57 0.00 0.00 179.45 179.93 1b52 n PHE 175 N -3.50 0.00 -0.58 -1.35 3.72 -0.45 -5.03 117.46 110.27 1b52 n PHE 175 Ca -0.02 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.38 1b52 n PHE 175 Cb 0.07 -0.12 0.00 0.00 -0.94 0.00 0.00 39.48 38.49 1b52 n PHE 175 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1b52 n GLY 176 N 1.18 1.55 0.12 1.37 0.00 0.24 -0.85 105.19 108.79 1b52 n GLY 176 Ca 0.18 -0.27 0.04 0.00 0.00 0.00 0.00 46.02 45.97 1b52 n GLY 176 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1b52 n ASP 177 N -1.35 0.22 -0.85 1.61 5.68 -1.26 -0.04 116.55 120.56 1b52 n ASP 177 Ca 0.00 0.46 0.12 0.00 -0.50 0.00 0.00 54.79 54.87 1b52 n ASP 177 Cb 0.00 -0.41 0.17 0.00 -1.14 0.00 0.00 41.12 39.74 1b52 n ASP 177 CO 0.00 0.00 0.00 0.29 -1.33 0.00 0.00 177.20 176.16 1b52 n LYS 178 N -1.81 2.14 0.22 0.11 5.02 -0.03 -4.41 118.16 119.39 1b52 n LYS 178 Ca -0.01 -1.70 0.18 0.00 -2.02 0.00 0.00 58.31 54.76 1b52 n LYS 178 Cb 0.31 -1.46 0.83 0.00 -0.02 0.00 0.00 35.03 34.69 1b52 n LYS 178 CO 0.00 0.00 0.00 0.11 -0.52 0.00 0.00 177.40 176.99 1b52 h TRP 179 N 4.15 0.00 -0.14 2.13 5.08 -0.29 -1.36 115.95 125.51 1b52 h TRP 179 Ca 0.00 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.97 1b52 h TRP 179 Cb 0.90 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 27.06 1b52 h TRP 179 CO 0.00 0.00 0.00 0.25 -1.28 0.00 0.00 178.44 177.41 1b52 n THR 180 N -3.46 0.18 -1.54 0.12 -2.24 -1.26 -1.50 114.28 104.58 1b52 n THR 180 Ca 0.02 -0.32 -0.32 0.00 -2.27 0.00 0.00 64.05 61.16 1b52 n THR 180 Cb 0.42 0.36 0.06 0.00 -2.10 0.00 0.00 70.33 69.07 1b52 n THR 180 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 1b52 s GLN 181 N -1.82 2.63 0.31 -0.78 -1.52 -0.52 -4.63 119.66 113.33 1b52 s GLN 181 Ca 0.33 1.21 0.07 0.00 -1.95 0.00 0.00 55.36 55.02 1b52 s GLN 181 Cb 0.18 -1.94 0.78 0.00 -0.22 0.00 0.00 33.01 31.81 1b52 s GLN 181 CO 0.27 -1.36 1.77 -1.35 -0.25 0.00 0.00 175.29 174.37 1b52 h PRO 182 N -0.55 0.70 0.11 2.91 0.11 -1.89 0.24 132.00 133.63 1b52 h PRO 182 Ca -0.45 -0.04 0.01 0.00 0.11 0.00 0.00 66.00 65.63 1b52 h PRO 182 Cb 1.23 -0.16 -0.04 0.00 0.11 0.00 0.00 31.00 32.15 1b52 h PRO 182 CO 0.54 0.46 -0.41 0.00 -0.21 0.00 0.00 178.00 178.38 1b52 h ALA 183 N 1.66 -0.91 0.00 -0.75 0.00 -1.94 -3.32 119.26 114.00 1b52 h ALA 183 Ca 0.59 -0.09 -0.12 0.00 0.00 0.00 0.00 54.91 55.29 1b52 h ALA 183 Cb 0.98 0.79 -0.02 0.00 0.00 0.00 0.00 17.79 19.53 1b52 h ALA 183 CO -0.39 -1.01 -1.50 0.09 0.00 0.00 0.00 179.25 176.44 1b52 n ASN 184 N -4.77 0.65 -4.59 0.00 3.02 -0.97 -4.97 115.26 103.63 1b52 n ASN 184 Ca -0.07 0.27 -0.45 0.00 -0.03 0.00 0.00 54.58 54.30 1b52 n ASN 184 Cb 0.32 0.59 -0.02 0.00 -0.61 0.00 0.00 39.78 40.05 1b52 n ASN 184 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1b52 n ILE 185 N -2.73 1.71 -4.18 2.41 3.06 0.80 -4.91 119.36 115.51 1b52 n ILE 185 Ca -0.09 -0.43 -0.30 0.00 -2.50 0.00 0.00 62.75 59.44 1b52 n ILE 185 Cb 0.76 -1.01 -0.17 0.00 0.54 0.00 0.00 39.64 39.77 1b52 n ILE 185 CO 0.00 0.00 0.00 -0.69 -2.50 0.00 0.00 176.55 173.36 1b52 s VAL 186 N -0.82 1.58 0.42 9.51 1.01 -1.26 -4.98 120.40 125.86 1b52 s VAL 186 Ca 0.62 -0.65 0.07 0.00 0.00 0.00 0.00 61.98 62.01 1b52 s VAL 186 Cb -0.73 -1.46 -0.07 0.00 0.00 0.00 0.00 36.38 34.12 1b52 s VAL 186 CO 0.58 0.46 0.06 0.42 0.00 0.00 0.00 175.10 176.61 1b52 s THR 187 N 1.31 2.02 0.00 3.92 -4.23 -1.26 -4.64 115.64 112.75 1b52 s THR 187 Ca 0.01 -1.92 0.00 0.00 -1.18 0.00 0.00 61.69 58.60 1b52 s THR 187 Cb -0.14 -2.94 0.00 0.00 1.34 0.00 0.00 72.50 70.77 1b52 s THR 187 CO -0.08 0.00 0.49 -0.46 -0.54 0.00 0.00 174.62 174.03 1b52 n ASN 188 N -1.06 0.51 -1.66 3.99 6.94 -0.98 0.87 115.26 123.87 1b52 n ASN 188 Ca -0.05 -1.20 0.00 0.00 -0.02 0.00 0.00 54.58 53.31 1b52 n ASN 188 Cb 0.66 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 38.08 1b52 n ASN 188 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1b52 n GLY 189 N -0.10 0.48 0.19 4.83 0.00 0.07 -4.54 105.19 106.11 1b52 n GLY 189 Ca 0.00 -1.84 0.14 0.00 0.00 0.00 0.00 46.02 44.33 1b52 n GLY 189 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1b52 h ALA 190 N -1.38 1.00 -1.99 4.61 0.00 -1.83 -3.43 119.26 116.24 1b52 h ALA 190 Ca 0.00 0.00 -0.54 0.00 0.00 0.00 0.00 54.91 54.37 1b52 h ALA 190 Cb 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 17.79 17.65 1b52 h ALA 190 CO 0.00 0.00 -0.66 0.71 0.00 0.00 0.00 179.25 179.30 1b52 s TYR 191 N -3.46 2.14 0.05 0.00 1.51 -0.49 -1.21 117.35 115.90 1b52 s TYR 191 Ca 0.03 -0.67 0.02 0.00 -1.01 0.00 0.00 57.07 55.44 1b52 s TYR 191 Cb 0.09 -1.28 -0.03 0.00 -0.11 0.00 0.00 41.96 40.64 1b52 s TYR 191 CO 0.47 0.35 -0.07 -1.59 -1.11 0.00 0.00 175.55 173.60 1b52 s LYS 192 N -3.71 0.56 -0.19 -0.62 -2.85 -0.60 -4.52 119.74 107.81 1b52 s LYS 192 Ca 0.32 -0.87 -0.29 0.00 -1.00 0.00 0.00 55.97 54.13 1b52 s LYS 192 Cb 0.05 -0.21 -0.00 0.00 -2.06 0.00 0.00 37.83 35.61 1b52 s LYS 192 CO 0.14 0.02 1.10 -1.17 0.10 0.00 0.00 175.35 175.54 1b52 s LEU 193 N -1.90 4.14 0.00 2.77 2.96 -1.26 -1.50 118.68 123.90 1b52 s LEU 193 Ca -0.06 1.50 0.00 0.00 -0.22 0.00 0.00 54.13 55.35 1b52 s LEU 193 Cb -0.06 -3.54 0.00 0.00 0.50 0.00 0.00 46.19 43.08 1b52 s LEU 193 CO -0.01 -0.67 0.00 1.17 -1.32 0.00 0.00 176.35 175.52 1b52 n LYS 194 N 6.21 0.00 -4.18 1.98 4.81 0.41 -4.87 118.16 122.52 1b52 n LYS 194 Ca 0.12 0.22 -0.11 0.00 -0.87 0.00 0.00 58.31 57.67 1b52 n LYS 194 Cb 0.46 -0.66 -0.10 0.00 0.02 0.00 0.00 35.03 34.75 1b52 n LYS 194 CO 0.00 0.00 0.00 0.54 1.17 0.00 0.00 177.40 179.11 1b52 s ASN 195 N -2.61 1.12 -0.32 3.14 6.03 -0.88 -4.86 114.94 116.57 1b52 s ASN 195 Ca 0.00 -1.05 -0.02 0.00 -1.03 0.00 0.00 52.86 50.76 1b52 s ASN 195 Cb 0.00 0.11 0.12 0.00 -3.03 0.00 0.00 41.25 38.45 1b52 s ASN 195 CO 0.00 -0.50 0.18 0.86 -2.03 0.00 0.00 177.10 175.61 1b52 s TRP 196 N -3.65 0.46 -0.40 1.54 -0.00 -1.26 -0.01 118.94 115.62 1b52 s TRP 196 Ca 0.15 -1.19 -0.12 0.00 -0.00 0.00 0.00 56.10 54.94 1b52 s TRP 196 Cb 0.06 -0.88 0.04 0.00 -0.00 0.00 0.00 33.47 32.69 1b52 s TRP 196 CO -0.03 -0.84 0.25 0.08 -0.00 0.00 0.00 176.95 176.42 1b52 s VAL 197 N 1.63 4.68 0.22 5.86 1.01 0.44 -4.98 120.40 129.25 1b52 s VAL 197 Ca 0.13 -0.95 -0.32 0.00 0.00 0.00 0.00 61.98 60.84 1b52 s VAL 197 Cb -0.19 -3.67 -0.14 0.00 0.00 0.00 0.00 36.38 32.37 1b52 s VAL 197 CO -0.19 -0.33 1.31 0.52 0.00 0.00 0.00 175.10 176.41 1b52 n VAL 198 N 5.03 0.95 -1.17 2.92 0.31 -1.26 0.62 118.33 125.72 1b52 n VAL 198 Ca -0.11 -0.24 -0.06 0.00 -0.01 0.00 0.00 64.34 63.92 1b52 n VAL 198 Cb 0.45 -1.24 -0.03 0.00 -0.91 0.00 0.00 33.84 32.12 1b52 n VAL 198 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 1b52 n ASN 199 N 2.09 -5.31 0.10 4.52 5.03 -1.26 -4.64 115.26 115.78 1b52 n ASN 199 Ca 0.13 0.15 0.00 0.00 0.87 0.00 0.00 54.58 55.72 1b52 n ASN 199 Cb 0.29 -3.34 0.00 0.00 -1.02 0.00 0.00 39.78 35.71 1b52 n ASN 199 CO 0.00 0.00 0.00 1.21 -1.83 0.00 0.00 177.26 176.64 1b52 n GLU 200 N -0.70 0.00 -3.63 3.52 0.00 -0.27 -4.91 120.64 114.65 1b52 n GLU 200 Ca -0.06 0.00 -0.03 0.00 0.00 0.00 0.00 57.16 57.07 1b52 n GLU 200 Cb 0.46 -0.24 -0.02 0.00 0.00 0.00 0.00 31.44 31.64 1b52 n GLU 200 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.13 176.15 1b52 s ARG 201 N -2.00 0.10 -0.05 5.31 1.70 0.20 -4.53 118.95 119.69 1b52 s ARG 201 Ca 0.00 -0.03 0.04 0.00 -0.47 0.00 0.00 55.73 55.27 1b52 s ARG 201 Cb 0.00 0.05 0.00 0.00 -0.57 0.00 0.00 34.95 34.43 1b52 s ARG 201 CO 0.00 -0.04 -0.16 0.42 -1.08 0.00 0.00 175.30 174.44 1b52 s ILE 202 N -1.97 1.36 -0.07 4.99 1.01 -0.25 -0.42 121.20 125.84 1b52 s ILE 202 Ca 0.11 -0.65 0.01 0.00 0.00 0.00 0.00 60.65 60.11 1b52 s ILE 202 Cb -0.01 -1.19 0.02 0.00 0.01 0.00 0.00 42.46 41.30 1b52 s ILE 202 CO -0.04 0.40 -0.07 -0.69 0.00 0.00 0.00 174.94 174.54 1b52 s VAL 203 N 0.24 0.82 0.15 2.92 1.01 0.98 0.12 120.40 126.64 1b52 s VAL 203 Ca -0.08 -0.24 0.10 0.00 0.00 0.00 0.00 61.98 61.75 1b52 s VAL 203 Cb -0.13 -0.82 -0.04 0.00 0.00 0.00 0.00 36.38 35.39 1b52 s VAL 203 CO 0.03 0.30 -0.18 -0.76 0.00 0.00 0.00 175.10 174.49 1b52 s LEU 204 N 1.15 2.68 0.06 3.92 1.43 0.19 -0.45 118.68 127.67 1b52 s LEU 204 Ca -0.06 -0.64 0.04 0.00 -1.03 0.00 0.00 54.13 52.43 1b52 s LEU 204 Cb -0.14 -1.47 -0.03 0.00 0.03 0.00 0.00 46.19 44.58 1b52 s LEU 204 CO -0.01 0.15 -0.11 -1.83 0.23 0.00 0.00 176.35 174.77 1b52 s GLU 205 N -2.40 0.69 0.35 1.70 -1.05 -0.56 -0.81 118.70 116.60 1b52 s GLU 205 Ca 0.20 -0.87 -0.25 0.00 -0.15 0.00 0.00 54.97 53.89 1b52 s GLU 205 Cb -0.10 -0.57 -0.13 0.00 -0.44 0.00 0.00 34.13 32.89 1b52 s GLU 205 CO 0.11 0.12 0.71 -2.13 0.95 0.00 0.00 175.26 175.02 1b52 n ARG 206 N 1.33 0.78 -3.56 -4.83 0.63 0.25 -1.56 116.66 109.70 1b52 n ARG 206 Ca -0.22 0.28 -0.41 0.00 -0.92 0.00 0.00 57.85 56.58 1b52 n ARG 206 Cb 0.54 -1.57 -0.11 0.00 0.45 0.00 0.00 32.46 31.78 1b52 n ARG 206 CO 0.00 0.00 0.00 1.21 -2.51 0.00 0.00 177.63 176.33 1b52 s ASN 207 N -0.83 5.86 0.51 6.15 2.47 -0.35 -4.66 114.94 124.10 1b52 s ASN 207 Ca 0.62 -0.83 0.34 0.00 0.42 0.00 0.00 52.86 53.41 1b52 s ASN 207 Cb -0.68 -2.08 1.54 0.00 -1.45 0.00 0.00 41.25 38.59 1b52 s ASN 207 CO 0.58 -0.36 2.01 -0.65 -3.72 0.00 0.00 177.10 174.96 1b52 h PRO 208 N 8.49 0.00 0.00 0.43 0.11 -1.92 -2.06 132.00 137.05 1b52 h PRO 208 Ca -0.28 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.83 1b52 h PRO 208 Cb 1.12 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.23 1b52 h PRO 208 CO 0.67 0.00 0.00 1.04 -0.21 0.00 0.00 178.00 179.50 1b52 n GLN 209 N -2.87 0.15 -1.71 1.05 1.13 -1.26 -4.88 117.38 108.98 1b52 n GLN 209 Ca -0.00 0.12 -0.42 0.00 -1.94 0.00 0.00 57.00 54.76 1b52 n GLN 209 Cb 0.21 -1.67 -0.03 0.00 0.11 0.00 0.00 30.24 28.86 1b52 n GLN 209 CO 0.00 0.00 0.00 0.98 -1.44 0.00 0.00 177.06 176.60 1b52 n TYR 210 N -1.93 2.71 -0.08 1.08 9.36 -0.78 -4.32 117.16 123.22 1b52 n TYR 210 Ca 0.06 -0.01 0.21 0.00 3.32 0.00 0.00 57.90 61.47 1b52 n TYR 210 Cb 0.39 -2.69 0.65 0.00 -0.63 0.00 0.00 39.34 37.06 1b52 n TYR 210 CO 0.00 0.00 0.00 0.11 0.22 0.00 0.00 176.86 177.19 1b52 h TRP 211 N 7.27 0.12 -0.50 2.98 5.08 -1.87 0.34 115.95 129.38 1b52 h TRP 211 Ca -0.44 0.00 -0.08 0.00 1.08 0.00 0.00 58.89 59.45 1b52 h TRP 211 Cb 1.21 -0.04 -0.05 0.00 -3.00 0.00 0.00 29.16 27.28 1b52 h TRP 211 CO 0.68 0.04 0.08 -3.47 -1.28 0.00 0.00 178.44 174.49 1b52 n ASP 212 N -4.38 4.53 -0.30 0.11 2.03 -1.26 -4.75 116.55 112.52 1b52 n ASP 212 Ca 0.13 -3.13 0.10 0.00 0.52 0.00 0.00 54.79 52.41 1b52 n ASP 212 Cb 0.66 -0.65 0.27 0.00 -0.72 0.00 0.00 41.12 40.68 1b52 n ASP 212 CO 0.00 0.00 0.00 -1.13 -1.92 0.00 0.00 177.20 174.15 1b52 h ASN 213 N 2.55 0.45 -0.89 1.67 -1.24 -0.64 0.17 115.58 117.65 1b52 h ASN 213 Ca 0.10 0.12 0.26 0.00 0.71 0.00 0.00 56.30 57.49 1b52 h ASN 213 Cb 1.88 0.06 -0.04 0.00 0.73 0.00 0.00 38.32 40.96 1b52 h ASN 213 CO 0.47 0.12 0.69 0.00 -1.29 0.00 0.00 177.43 177.42 1b52 h ALA 214 N 1.64 2.80 0.00 1.57 0.00 -1.85 -1.06 119.26 122.35 1b52 h ALA 214 Ca 0.52 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 55.36 1b52 h ALA 214 Cb 0.87 0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.72 1b52 h ALA 214 CO -0.44 -1.15 -1.32 1.63 0.00 0.00 0.00 179.25 177.96 1b52 n LYS 215 N -4.09 0.62 -1.89 0.00 4.76 0.03 -4.92 118.16 112.67 1b52 n LYS 215 Ca 0.19 0.06 -0.41 0.00 -2.87 0.00 0.00 58.31 55.28 1b52 n LYS 215 Cb 1.01 -1.75 -0.01 0.00 -1.84 0.00 0.00 35.03 32.44 1b52 n LYS 215 CO 0.00 0.00 0.00 0.99 -1.37 0.00 0.00 177.40 177.02 1b52 s THR 216 N -3.31 2.26 0.04 -0.18 2.01 -0.40 -1.53 115.64 114.52 1b52 s THR 216 Ca -0.03 0.25 -0.01 0.00 0.31 0.00 0.00 61.69 62.21 1b52 s THR 216 Cb 0.10 -3.16 -0.00 0.00 0.01 0.00 0.00 72.50 69.45 1b52 s THR 216 CO 0.82 0.05 -0.02 0.52 -0.69 0.00 0.00 174.62 175.31 1b52 n VAL 217 N 1.07 0.69 -2.00 3.82 0.31 -1.26 -4.90 118.33 116.05 1b52 n VAL 217 Ca 0.03 0.20 -0.41 0.00 -0.01 0.00 0.00 64.34 64.14 1b52 n VAL 217 Cb 0.39 -1.57 -0.02 0.00 -0.91 0.00 0.00 33.84 31.73 1b52 n VAL 217 CO 0.00 0.00 0.00 -0.63 -1.32 0.00 0.00 176.83 174.88 1b52 s ILE 218 N -2.03 2.60 -0.22 2.52 -1.09 -1.26 -4.93 121.20 116.78 1b52 s ILE 218 Ca -0.02 0.52 -0.04 0.00 -2.23 0.00 0.00 60.65 58.88 1b52 s ILE 218 Cb 0.00 -3.33 -0.19 0.00 -1.58 0.00 0.00 42.46 37.36 1b52 s ILE 218 CO 0.02 0.09 -0.06 0.59 -1.23 0.00 0.00 174.94 174.35 1b52 n ASN 219 N 2.08 2.01 -4.21 3.58 3.02 0.07 -4.66 115.26 117.14 1b52 n ASN 219 Ca 0.06 0.05 -0.26 0.00 -0.03 0.00 0.00 54.58 54.40 1b52 n ASN 219 Cb 0.40 -0.62 -0.15 0.00 -0.61 0.00 0.00 39.78 38.80 1b52 n ASN 219 CO 0.00 0.00 0.00 -1.58 -2.62 0.00 0.00 177.26 173.06 1b52 s GLN 220 N -2.52 1.47 -0.02 3.52 0.74 -1.16 -0.58 119.66 121.11 1b52 s GLN 220 Ca -0.32 -0.79 0.01 0.00 0.05 0.00 0.00 55.36 54.31 1b52 s GLN 220 Cb 0.09 -1.48 0.01 0.00 1.10 0.00 0.00 33.01 32.73 1b52 s GLN 220 CO 0.63 0.39 -0.04 0.54 -0.55 0.00 0.00 175.29 176.27 1b52 s VAL 221 N -0.61 0.38 -0.13 1.34 0.11 0.01 -2.48 120.40 119.02 1b52 s VAL 221 Ca 0.07 -0.12 -0.02 0.00 -2.93 0.00 0.00 61.98 58.99 1b52 s VAL 221 Cb -0.08 -0.38 -0.02 0.00 -1.53 0.00 0.00 36.38 34.37 1b52 s VAL 221 CO 0.00 0.15 -0.08 -0.89 -3.33 0.00 0.00 175.10 170.96 1b52 s THR 222 N 0.43 3.54 -0.21 5.04 2.01 -0.07 0.57 115.64 126.95 1b52 s THR 222 Ca -0.05 -0.50 -0.05 0.00 0.31 0.00 0.00 61.69 61.41 1b52 s THR 222 Cb -0.08 -2.51 -0.02 0.00 0.01 0.00 0.00 72.50 69.90 1b52 s THR 222 CO -0.00 0.52 -0.00 -0.31 -0.69 0.00 0.00 174.62 174.13 1b52 s TYR 223 N 0.14 3.02 0.11 4.92 2.02 0.33 -0.32 117.35 127.56 1b52 s TYR 223 Ca -0.04 -0.60 0.01 0.00 -0.37 0.00 0.00 57.07 56.08 1b52 s TYR 223 Cb -0.14 -2.11 -0.04 0.00 -0.40 0.00 0.00 41.96 39.27 1b52 s TYR 223 CO 0.04 -0.35 0.26 -0.51 -1.57 0.00 0.00 175.55 173.41 1b52 s LEU 224 N 1.22 4.34 -0.47 -1.29 1.43 0.14 -1.10 118.68 122.95 1b52 s LEU 224 Ca 0.03 0.23 0.03 0.00 -1.03 0.00 0.00 54.13 53.40 1b52 s LEU 224 Cb -0.15 -2.95 0.47 0.00 0.03 0.00 0.00 46.19 43.59 1b52 s LEU 224 CO 0.01 0.10 1.65 -0.81 0.23 0.00 0.00 176.35 177.53 1b52 n PRO 225 N -0.16 2.93 -2.67 1.29 -0.04 -1.26 0.13 135.00 135.22 1b52 n PRO 225 Ca -0.06 -3.60 -0.43 0.00 -0.04 0.00 0.00 63.50 59.37 1b52 n PRO 225 Cb 0.53 -2.23 -0.02 0.00 -0.04 0.00 0.00 33.50 31.73 1b52 n PRO 225 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 1b52 s ILE 226 N -4.50 4.46 -2.01 0.52 1.01 -1.26 -3.87 121.20 115.55 1b52 s ILE 226 Ca 0.57 1.51 0.25 0.00 0.00 0.00 0.00 60.65 62.97 1b52 s ILE 226 Cb 0.46 -4.44 0.16 0.00 0.01 0.00 0.00 42.46 38.65 1b52 s ILE 226 CO 0.02 -0.61 1.35 -1.54 0.00 0.00 0.00 174.94 174.16 1b52 n SER 227 N 7.06 1.62 -4.68 3.58 3.41 -1.19 -3.78 113.62 119.65 1b52 n SER 227 Ca 0.11 -1.28 -0.41 0.00 -0.26 0.00 0.00 58.87 57.03 1b52 n SER 227 Cb 0.48 0.27 -0.05 0.00 -0.26 0.00 0.00 64.21 64.65 1b52 n SER 227 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1b52 s SER 228 N -2.42 6.88 0.19 4.04 0.15 -1.26 -4.27 113.70 117.01 1b52 s SER 228 Ca 0.23 1.08 -0.01 0.00 0.70 0.00 0.00 55.95 57.95 1b52 s SER 228 Cb 0.19 -2.42 0.11 0.00 -1.71 0.00 0.00 66.02 62.19 1b52 s SER 228 CO 0.52 -0.31 1.48 -0.33 1.20 0.00 0.00 173.24 175.79 1b52 h GLU 229 N 7.27 0.43 -0.24 5.44 3.07 -1.89 -2.54 114.58 126.12 1b52 h GLU 229 Ca -0.32 -0.31 -0.02 0.00 -0.50 0.00 0.00 59.36 58.21 1b52 h GLU 229 Cb 1.15 0.05 -0.01 0.00 -0.84 0.00 0.00 28.75 29.10 1b52 h GLU 229 CO 0.80 0.93 0.08 0.28 -1.40 0.00 0.00 179.01 179.71 1b52 h VAL 230 N 0.31 1.19 -0.18 3.13 2.07 -1.94 -1.92 116.25 118.90 1b52 h VAL 230 Ca -0.01 -0.58 0.02 0.00 0.82 0.00 0.00 66.70 66.94 1b52 h VAL 230 Cb 1.20 1.12 -0.02 0.00 -1.52 0.00 0.00 31.29 32.07 1b52 h VAL 230 CO 0.11 0.19 0.05 0.74 0.02 0.00 0.00 177.57 178.68 1b52 h THR 231 N 0.23 0.94 -0.23 2.57 2.02 -1.98 0.75 112.91 117.20 1b52 h THR 231 Ca 0.08 -0.04 0.06 0.00 0.77 0.00 0.00 66.41 67.27 1b52 h THR 231 Cb 0.22 0.80 -0.07 0.00 -1.74 0.00 0.00 68.15 67.35 1b52 h THR 231 CO -0.00 0.02 -0.27 -0.78 0.37 0.00 0.00 175.52 174.86 1b52 h ASP 232 N 0.13 -0.87 -0.57 4.18 3.58 -1.30 0.27 116.42 121.83 1b52 h ASP 232 Ca 0.08 0.15 -0.03 0.00 0.42 0.00 0.00 57.03 57.65 1b52 h ASP 232 Cb 0.06 0.40 -0.03 0.00 1.72 0.00 0.00 39.33 41.49 1b52 h ASP 232 CO -0.10 -0.31 0.25 0.58 -2.88 0.00 0.00 179.24 176.79 1b52 h VAL 233 N -0.29 1.22 0.63 2.25 2.07 -0.83 -1.44 116.25 119.84 1b52 h VAL 233 Ca 0.13 -0.64 -0.03 0.00 0.82 0.00 0.00 66.70 66.98 1b52 h VAL 233 Cb 0.49 0.58 0.00 0.00 -1.52 0.00 0.00 31.29 30.84 1b52 h VAL 233 CO -0.40 0.25 -0.32 0.78 0.02 0.00 0.00 177.57 177.90 1b52 h ASN 234 N 0.78 -0.78 -0.04 0.57 2.35 -0.43 0.14 115.58 118.16 1b52 h ASN 234 Ca 0.19 0.03 0.01 0.00 -0.55 0.00 0.00 56.30 55.99 1b52 h ASN 234 Cb 0.16 0.21 -0.00 0.00 0.05 0.00 0.00 38.32 38.74 1b52 h ASN 234 CO -0.02 -0.54 0.04 0.03 -1.65 0.00 0.00 177.43 175.30 1b52 h ARG 235 N -0.87 0.00 0.02 0.81 3.08 -0.43 0.62 114.38 117.60 1b52 h ARG 235 Ca -0.08 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 59.97 1b52 h ARG 235 Cb 0.68 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.73 1b52 h ARG 235 CO 0.12 0.00 -0.01 -0.92 -1.07 0.00 0.00 179.97 178.09 1b52 h TYR 236 N 0.00 -0.02 0.00 3.04 5.03 -0.67 -0.75 116.97 123.60 1b52 h TYR 236 Ca 0.02 -0.00 0.00 0.00 2.58 0.00 0.00 58.73 61.33 1b52 h TYR 236 Cb 0.10 0.01 0.00 0.00 1.55 0.00 0.00 36.73 38.39 1b52 h TYR 236 CO 0.00 0.39 0.00 0.00 -1.32 0.00 0.00 178.16 177.23 1b52 h ARG 237 N -0.43 0.00 -0.00 1.82 3.08 0.13 -1.22 114.38 117.75 1b52 h ARG 237 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1b52 h ARG 237 Cb 0.42 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.47 1b52 h ARG 237 CO 0.00 0.00 -0.30 -1.13 -1.07 0.00 0.00 179.97 177.48 1b52 n SER 238 N -2.78 0.48 0.00 7.04 3.41 -0.10 -4.96 113.62 116.72 1b52 n SER 238 Ca 0.01 -0.27 0.00 0.00 -0.26 0.00 0.00 58.87 58.35 1b52 n SER 238 Cb 0.26 0.03 0.00 0.00 -0.26 0.00 0.00 64.21 64.24 1b52 n SER 238 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1b52 n GLY 239 N 1.43 0.75 0.22 5.00 0.00 -0.46 -4.95 105.19 107.18 1b52 n GLY 239 Ca 0.08 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.23 1b52 n GLY 239 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1b52 h GLU 240 N 3.95 0.00 -4.72 1.61 5.08 -1.33 -3.45 114.58 115.72 1b52 h GLU 240 Ca 0.00 0.00 -0.46 0.00 -1.00 0.00 0.00 59.36 57.90 1b52 h GLU 240 Cb 0.00 0.00 -0.31 0.00 0.50 0.00 0.00 28.75 28.94 1b52 h GLU 240 CO 0.00 0.00 -0.80 0.42 -1.00 0.00 0.00 179.01 177.63 1b52 s ILE 241 N -3.22 0.93 0.04 3.13 1.01 -1.09 -4.89 121.20 117.11 1b52 s ILE 241 Ca 0.07 -0.43 0.01 0.00 0.00 0.00 0.00 60.65 60.29 1b52 s ILE 241 Cb 0.05 -0.83 -0.26 0.00 0.01 0.00 0.00 42.46 41.44 1b52 s ILE 241 CO 0.66 0.29 1.01 0.44 0.00 0.00 0.00 174.94 177.34 1b52 h ASP 242 N 6.42 0.27 -3.06 3.58 3.32 -1.58 -3.40 116.42 121.96 1b52 h ASP 242 Ca -0.33 -0.34 -0.25 0.00 0.02 0.00 0.00 57.03 56.13 1b52 h ASP 242 Cb 1.17 -0.09 -0.34 0.00 0.22 0.00 0.00 39.33 40.30 1b52 h ASP 242 CO 0.48 1.27 -0.58 0.00 -1.72 0.00 0.00 179.24 178.70 1b52 s MET 243 N -2.65 0.10 1.16 3.56 0.23 -0.98 -1.64 119.30 119.08 1b52 s MET 243 Ca -0.05 0.61 -0.19 0.00 -1.03 0.00 0.00 55.69 55.03 1b52 s MET 243 Cb 0.08 -0.16 0.27 0.00 -1.53 0.00 0.00 34.83 33.49 1b52 s MET 243 CO 0.85 -0.27 1.15 0.95 -2.03 0.00 0.00 175.02 175.67 1b52 s THR 244 N 2.14 1.66 0.81 3.16 -4.23 -0.85 -1.40 115.64 116.93 1b52 s THR 244 Ca 0.00 0.00 -0.11 0.00 -1.18 0.00 0.00 61.69 60.40 1b52 s THR 244 Cb -0.12 -2.58 0.08 0.00 1.34 0.00 0.00 72.50 71.22 1b52 s THR 244 CO -0.07 0.00 1.10 -0.47 -0.54 0.00 0.00 174.62 174.64 1b52 s TYR 245 N -3.16 2.75 -0.77 3.99 5.04 -1.22 -4.51 117.35 119.47 1b52 s TYR 245 Ca 0.72 1.17 -0.03 0.00 -2.44 0.00 0.00 57.07 56.49 1b52 s TYR 245 Cb -0.08 -3.12 0.22 0.00 0.35 0.00 0.00 41.96 39.32 1b52 s TYR 245 CO 0.55 -1.86 2.32 0.27 -1.34 0.00 0.00 175.55 175.50 1b52 n ASN 246 N -3.50 7.17 -4.00 4.32 6.94 -1.26 -4.72 115.26 120.21 1b52 n ASN 246 Ca 0.07 -3.51 -0.30 0.00 -0.02 0.00 0.00 54.58 50.81 1b52 n ASN 246 Cb 0.56 -1.17 -0.16 0.00 -2.36 0.00 0.00 39.78 36.65 1b52 n ASN 246 CO 0.00 0.00 0.00 0.20 -1.03 0.00 0.00 177.26 176.43 1b52 s ASN 247 N -0.43 3.07 -0.04 0.53 0.01 -1.25 -4.45 114.94 112.38 1b52 s ASN 247 Ca 0.53 -0.71 -0.06 0.00 -0.71 0.00 0.00 52.86 51.91 1b52 s ASN 247 Cb 0.36 -1.19 -0.04 0.00 0.41 0.00 0.00 41.25 40.79 1b52 s ASN 247 CO -0.28 -0.11 0.21 -0.04 -1.51 0.00 0.00 177.10 175.36 1b52 s MET 248 N 1.45 3.51 0.37 -0.60 -1.94 -1.26 -4.87 119.30 115.96 1b52 s MET 248 Ca 0.01 -0.13 -0.26 0.00 -1.71 0.00 0.00 55.69 53.61 1b52 s MET 248 Cb -0.15 -3.13 -0.09 0.00 2.01 0.00 0.00 34.83 33.47 1b52 s MET 248 CO -0.09 0.71 1.08 -1.25 -0.01 0.00 0.00 175.02 175.45 1b52 s PRO 249 N -1.49 4.27 0.21 2.03 0.04 -1.26 -4.83 135.00 133.96 1b52 s PRO 249 Ca 0.23 1.63 -0.06 0.00 0.04 0.00 0.00 61.00 62.84 1b52 s PRO 249 Cb -0.13 -2.72 0.16 0.00 0.04 0.00 0.00 34.50 31.85 1b52 s PRO 249 CO 0.12 -0.08 1.64 0.82 0.04 0.00 0.00 177.00 179.55 1b52 h ILE 250 N 2.43 1.26 -0.02 0.56 2.04 -1.93 -3.15 117.51 118.71 1b52 h ILE 250 Ca -0.48 -1.24 0.01 0.00 1.00 0.00 0.00 64.86 64.14 1b52 h ILE 250 Cb 1.22 1.04 -0.02 0.00 -0.74 0.00 0.00 36.82 38.32 1b52 h ILE 250 CO 0.63 0.43 -0.15 -0.33 0.00 0.00 0.00 178.15 178.73 1b52 h GLU 251 N 0.79 -0.17 -0.62 2.37 3.07 -1.95 -3.23 114.58 114.83 1b52 h GLU 251 Ca 0.12 0.01 0.00 0.00 -0.50 0.00 0.00 59.36 59.00 1b52 h GLU 251 Cb 0.65 0.04 0.00 0.00 -0.84 0.00 0.00 28.75 28.60 1b52 h GLU 251 CO 0.05 -0.11 0.00 1.28 -1.40 0.00 0.00 179.01 178.82 1b52 n LEU 252 N -3.36 3.64 0.23 1.33 4.77 -1.25 -4.70 117.00 117.66 1b52 n LEU 252 Ca -0.02 -1.83 -0.10 0.00 -0.03 0.00 0.00 56.01 54.04 1b52 n LEU 252 Cb 0.11 -0.47 -0.05 0.00 -2.33 0.00 0.00 43.42 40.69 1b52 n LEU 252 CO 0.03 0.74 0.27 0.15 -1.33 0.00 0.00 177.39 177.25 1b52 h PHE 253 N 3.45 -0.59 -0.09 -1.77 3.57 -1.57 -2.31 116.94 117.65 1b52 h PHE 253 Ca 0.00 -0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.48 1b52 h PHE 253 Cb 1.03 0.20 -0.01 0.00 2.79 0.00 0.00 35.95 39.96 1b52 h PHE 253 CO 0.53 -0.37 0.01 -0.56 -2.23 0.00 0.00 178.31 175.69 1b52 h GLN 254 N -1.09 0.12 0.08 1.11 -0.00 -1.84 -1.89 115.11 111.60 1b52 h GLN 254 Ca -0.07 -0.01 -0.00 0.00 -0.00 0.00 0.00 58.65 58.57 1b52 h GLN 254 Cb 0.49 -0.02 -0.01 0.00 -0.00 0.00 0.00 27.48 27.94 1b52 h GLN 254 CO 0.11 0.12 -0.11 -0.22 -0.00 0.00 0.00 178.83 178.73 1b52 h LYS 255 N 0.12 -0.18 -0.92 0.06 3.64 -1.86 -2.65 116.57 114.78 1b52 h LYS 255 Ca 0.03 0.01 0.24 0.00 -1.27 0.00 0.00 60.65 59.67 1b52 h LYS 255 Cb 0.06 0.04 -0.13 0.00 -0.41 0.00 0.00 32.23 31.79 1b52 h LYS 255 CO -0.00 -0.12 0.39 -0.07 -2.27 0.00 0.00 179.45 177.38 1b52 h LEU 256 N -0.19 0.30 -1.18 5.20 3.38 -1.07 0.53 115.31 122.28 1b52 h LEU 256 Ca -0.01 0.17 0.25 0.00 0.09 0.00 0.00 57.88 58.38 1b52 h LEU 256 Cb 0.17 0.16 -0.11 0.00 0.09 0.00 0.00 40.66 40.98 1b52 h LEU 256 CO -0.03 -0.06 0.63 0.50 0.09 0.00 0.00 178.44 179.58 1b52 h LYS 257 N 0.35 0.49 0.03 1.13 3.64 -1.03 -0.37 116.57 120.82 1b52 h LYS 257 Ca 0.59 -0.03 -0.05 0.00 -1.27 0.00 0.00 60.65 59.90 1b52 h LYS 257 Cb 1.19 -0.11 0.00 0.00 -0.41 0.00 0.00 32.23 32.90 1b52 h LYS 257 CO -0.57 0.33 -0.21 0.87 -2.27 0.00 0.00 179.45 177.60 1b52 h LYS 258 N 0.51 0.06 -0.47 1.90 1.79 0.40 -3.23 116.57 117.54 1b52 h LYS 258 Ca 0.61 -0.11 -0.13 0.00 -2.18 0.00 0.00 60.65 58.84 1b52 h LYS 258 Cb 1.33 0.04 -0.01 0.00 -1.58 0.00 0.00 32.23 32.01 1b52 h LYS 258 CO -0.38 1.05 -0.21 0.93 -1.08 0.00 0.00 179.45 179.76 1b52 h GLU 259 N -0.86 0.98 -1.16 3.15 5.08 -1.25 -3.38 114.58 117.14 1b52 h GLU 259 Ca -0.04 -0.42 -0.43 0.00 -1.00 0.00 0.00 59.36 57.47 1b52 h GLU 259 Cb 1.15 -0.03 -0.41 0.00 0.50 0.00 0.00 28.75 29.96 1b52 h GLU 259 CO 0.03 1.09 -1.05 0.44 -1.00 0.00 0.00 179.01 178.52 1b52 n ILE 260 N -4.13 1.42 -0.34 3.13 -5.35 -0.18 -4.98 119.36 108.93 1b52 n ILE 260 Ca -0.00 -3.64 0.32 0.00 -0.27 0.00 0.00 62.75 59.17 1b52 n ILE 260 Cb 0.46 0.07 0.58 0.00 -1.74 0.00 0.00 39.64 39.01 1b52 n ILE 260 CO 0.00 0.00 0.00 -0.81 -1.76 0.00 0.00 176.55 173.98 1b52 n PRO 261 N -0.19 -0.05 -0.01 6.28 -0.04 -1.22 -0.20 135.00 139.57 1b52 n PRO 261 Ca 0.18 1.28 0.14 0.00 -0.04 0.00 0.00 63.50 65.06 1b52 n PRO 261 Cb 0.77 -2.36 0.65 0.00 -0.04 0.00 0.00 33.50 32.53 1b52 n PRO 261 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1b52 n ASN 262 N -5.01 0.88 -0.00 3.54 3.02 -1.26 -2.88 115.26 113.54 1b52 n ASN 262 Ca 0.37 -1.35 0.10 0.00 -0.03 0.00 0.00 54.58 53.67 1b52 n ASN 262 Cb 1.30 -0.01 -0.12 0.00 -0.61 0.00 0.00 39.78 40.33 1b52 n ASN 262 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1b52 n GLU 263 N -0.29 0.17 -2.96 3.52 1.02 0.72 -4.80 120.64 118.02 1b52 n GLU 263 Ca 0.20 -0.01 -0.44 0.00 -0.02 0.00 0.00 57.16 56.89 1b52 n GLU 263 Cb 0.24 -1.48 -0.03 0.00 -0.02 0.00 0.00 31.44 30.15 1b52 n GLU 263 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 1b52 s VAL 264 N -3.00 4.65 -0.24 2.62 1.01 -1.14 -2.14 120.40 122.16 1b52 s VAL 264 Ca 0.07 -1.08 -0.14 0.00 0.00 0.00 0.00 61.98 60.83 1b52 s VAL 264 Cb 0.16 -4.68 -0.04 0.00 0.00 0.00 0.00 36.38 31.82 1b52 s VAL 264 CO 0.86 -1.39 0.31 -0.13 0.00 0.00 0.00 175.10 174.74 1b52 s ARG 265 N 3.05 4.09 -0.24 2.72 1.81 0.27 -4.98 118.95 125.67 1b52 s ARG 265 Ca 0.24 -0.01 0.00 0.00 -1.72 0.00 0.00 55.73 54.24 1b52 s ARG 265 Cb -0.13 -3.58 0.06 0.00 -0.45 0.00 0.00 34.95 30.85 1b52 s ARG 265 CO 0.00 -0.09 -0.03 0.08 -0.68 0.00 0.00 175.30 174.59 1b52 s VAL 266 N 1.49 1.36 0.12 3.52 1.01 -1.25 -2.11 120.40 124.53 1b52 s VAL 266 Ca 0.14 -1.18 0.02 0.00 0.00 0.00 0.00 61.98 60.96 1b52 s VAL 266 Cb -0.15 -1.71 -0.04 0.00 0.00 0.00 0.00 36.38 34.48 1b52 s VAL 266 CO 0.08 -0.18 -0.06 -1.81 0.00 0.00 0.00 175.10 173.14 1b52 s ASP 267 N 1.46 1.23 0.29 3.32 1.01 -1.00 -4.95 116.67 118.02 1b52 s ASP 267 Ca -0.03 -1.04 -0.30 0.00 0.71 0.00 0.00 52.55 51.88 1b52 s ASP 267 Cb -0.18 0.09 -0.12 0.00 1.01 0.00 0.00 42.92 43.71 1b52 s ASP 267 CO -0.08 -0.47 1.51 -2.65 0.21 0.00 0.00 175.17 173.69 1b52 n PRO 268 N -0.10 2.46 -4.35 8.23 -0.02 -1.26 0.71 135.00 140.67 1b52 n PRO 268 Ca -0.11 0.87 -0.21 0.00 -2.02 0.00 0.00 63.50 62.03 1b52 n PRO 268 Cb 0.61 -2.60 -0.16 0.00 -0.02 0.00 0.00 33.50 31.33 1b52 n PRO 268 CO 0.00 0.00 0.00 -0.47 1.98 0.00 0.00 175.50 177.01 1b52 s TYR 269 N -0.20 1.00 -1.29 6.00 5.04 -1.22 -4.48 117.35 122.19 1b52 s TYR 269 Ca 0.64 -0.30 -0.11 0.00 -2.44 0.00 0.00 57.07 54.85 1b52 s TYR 269 Cb -0.54 -0.77 0.15 0.00 0.35 0.00 0.00 41.96 41.14 1b52 s TYR 269 CO 0.51 -0.18 1.84 1.28 -1.34 0.00 0.00 175.55 177.66 1b52 n LEU 270 N 3.74 6.35 -3.87 6.97 4.77 -0.69 -4.41 117.00 129.86 1b52 n LEU 270 Ca -0.23 -4.51 -0.11 0.00 -0.03 0.00 0.00 56.01 51.13 1b52 n LEU 270 Cb 0.52 -1.54 -0.10 0.00 -2.33 0.00 0.00 43.42 39.97 1b52 n LEU 270 CO 0.24 1.17 -0.18 0.00 -1.33 0.00 0.00 177.39 177.29 1b52 s THR 272 N -1.23 1.66 -0.18 0.00 2.01 -0.66 -1.40 115.64 115.84 1b52 s THR 272 Ca -0.13 -0.87 -0.08 0.00 0.31 0.00 0.00 61.69 60.92 1b52 s THR 272 Cb -0.07 -1.41 -0.04 0.00 0.01 0.00 0.00 72.50 70.99 1b52 s THR 272 CO 0.01 0.47 0.10 -0.47 -0.69 0.00 0.00 174.62 174.05 1b52 s TYR 273 N -0.20 3.38 0.20 4.92 6.14 0.16 -2.20 117.35 129.75 1b52 s TYR 273 Ca 0.00 0.27 -0.17 0.00 0.64 0.00 0.00 57.07 57.81 1b52 s TYR 273 Cb -0.11 -2.08 0.03 0.00 0.42 0.00 0.00 41.96 40.21 1b52 s TYR 273 CO 0.02 0.33 0.53 1.52 0.64 0.00 0.00 175.55 178.59 1b52 s TYR 274 N 0.08 -0.09 -0.38 4.97 1.13 0.11 -1.02 117.35 122.15 1b52 s TYR 274 Ca 0.08 -0.26 -0.15 0.00 -1.41 0.00 0.00 57.07 55.32 1b52 s TYR 274 Cb -0.12 0.40 0.01 0.00 -1.10 0.00 0.00 41.96 41.15 1b52 s TYR 274 CO -0.00 -0.94 0.35 0.71 -2.51 0.00 0.00 175.55 173.15 1b52 s TYR 275 N -3.89 3.21 0.00 -3.49 2.02 -0.45 0.08 117.35 114.85 1b52 s TYR 275 Ca 0.10 -0.32 -0.30 0.00 -0.37 0.00 0.00 57.07 56.18 1b52 s TYR 275 Cb -0.01 -2.68 -0.04 0.00 -0.40 0.00 0.00 41.96 38.82 1b52 s TYR 275 CO -0.01 -0.55 1.18 -2.00 -1.57 0.00 0.00 175.55 172.60 1b52 s GLU 276 N 1.91 4.41 -0.04 -0.62 2.12 0.25 -0.66 118.70 126.07 1b52 s GLU 276 Ca 0.09 1.69 -0.03 0.00 0.36 0.00 0.00 54.97 57.09 1b52 s GLU 276 Cb -0.18 -3.45 -0.04 0.00 0.26 0.00 0.00 34.13 30.73 1b52 s GLU 276 CO 0.12 -0.32 0.11 0.42 -0.54 0.00 0.00 175.26 175.04 1b52 s ILE 277 N 1.56 5.01 -0.67 -3.70 1.01 -1.26 -1.10 121.20 122.05 1b52 s ILE 277 Ca 0.57 -0.20 -0.25 0.00 0.00 0.00 0.00 60.65 60.77 1b52 s ILE 277 Cb -0.27 -3.26 0.05 0.00 0.01 0.00 0.00 42.46 39.00 1b52 s ILE 277 CO 0.26 0.43 1.10 0.21 0.00 0.00 0.00 174.94 176.95 1b52 s ASN 278 N -1.52 6.21 0.21 3.58 3.84 -0.28 -4.68 114.94 122.31 1b52 s ASN 278 Ca 0.21 -0.61 0.21 0.00 0.21 0.00 0.00 52.86 52.89 1b52 s ASN 278 Cb -0.12 -2.49 0.92 0.00 -0.55 0.00 0.00 41.25 39.01 1b52 s ASN 278 CO 0.11 -1.57 1.65 0.59 -2.79 0.00 0.00 177.10 175.09 1b52 n ASN 279 N 8.39 0.54 0.04 -4.21 4.13 -0.68 -2.87 115.26 120.60 1b52 n ASN 279 Ca 0.01 0.64 0.12 0.00 1.68 0.00 0.00 54.58 57.03 1b52 n ASN 279 Cb 0.47 -0.75 0.19 0.00 -1.54 0.00 0.00 39.78 38.15 1b52 n ASN 279 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1b52 n GLN 280 N -2.10 0.21 -3.80 3.52 6.02 -1.26 -3.38 117.38 116.58 1b52 n GLN 280 Ca 0.02 0.06 -0.35 0.00 -0.01 0.00 0.00 57.00 56.71 1b52 n GLN 280 Cb 0.20 -1.63 -0.10 0.00 1.02 0.00 0.00 30.24 29.74 1b52 n GLN 280 CO 0.00 0.00 0.00 0.21 -1.01 0.00 0.00 177.06 176.26 1b52 s LYS 281 N -3.12 4.02 0.49 -1.09 2.20 -1.14 -4.79 119.74 116.32 1b52 s LYS 281 Ca 0.07 -0.30 -0.24 0.00 -0.36 0.00 0.00 55.97 55.14 1b52 s LYS 281 Cb 0.15 -3.38 -0.07 0.00 -1.51 0.00 0.00 37.83 33.02 1b52 s LYS 281 CO 0.72 0.16 1.37 0.00 -0.36 0.00 0.00 175.35 177.24 1b52 s ALA 282 N 0.73 3.05 -1.02 3.13 0.00 -1.26 0.46 121.76 126.85 1b52 s ALA 282 Ca 0.06 1.36 0.10 0.00 0.00 0.00 0.00 51.96 53.48 1b52 s ALA 282 Cb -0.13 -3.56 0.44 0.00 0.00 0.00 0.00 23.12 19.88 1b52 s ALA 282 CO 0.02 -1.21 1.25 -0.35 0.00 0.00 0.00 175.76 175.47 1b52 n PRO 283 N -0.54 2.86 0.00 0.00 -0.04 -1.26 -4.85 135.00 131.17 1b52 n PRO 283 Ca 0.07 -1.73 0.14 0.00 -0.04 0.00 0.00 63.50 61.94 1b52 n PRO 283 Cb 0.44 -1.75 0.69 0.00 -0.04 0.00 0.00 33.50 32.83 1b52 n PRO 283 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 1b52 n PHE 284 N 0.48 0.00 1.26 0.54 3.72 0.17 -1.61 117.46 122.03 1b52 n PHE 284 Ca 0.15 0.00 0.11 0.00 -0.05 0.00 0.00 57.45 57.67 1b52 n PHE 284 Cb 0.66 -0.32 0.63 0.00 -0.94 0.00 0.00 39.48 39.51 1b52 n PHE 284 CO 0.00 0.00 0.00 0.27 -0.05 0.00 0.00 176.76 176.98 1b52 n ASN 285 N -1.32 0.00 -4.63 4.37 6.94 -0.97 -4.63 115.26 115.01 1b52 n ASN 285 Ca 0.12 -0.38 -0.40 0.00 -0.02 0.00 0.00 54.58 53.90 1b52 n ASN 285 Cb 0.24 -0.14 -0.07 0.00 -2.36 0.00 0.00 39.78 37.45 1b52 n ASN 285 CO 0.00 0.00 0.00 -0.62 -1.03 0.00 0.00 177.26 175.61 1b52 s ASP 286 N -2.29 6.50 0.51 0.53 -1.08 -0.63 -4.97 116.67 115.25 1b52 s ASP 286 Ca 0.28 0.60 0.22 0.00 -0.52 0.00 0.00 52.55 53.14 1b52 s ASP 286 Cb 0.16 -2.29 1.32 0.00 -1.46 0.00 0.00 42.92 40.65 1b52 s ASP 286 CO 0.31 -0.26 2.02 1.62 0.52 0.00 0.00 175.17 179.37 1b52 h VAL 287 N 5.30 0.80 -0.20 1.11 3.04 -1.88 -1.61 116.25 122.80 1b52 h VAL 287 Ca -0.30 -0.02 -0.07 0.00 -1.01 0.00 0.00 66.70 65.30 1b52 h VAL 287 Cb 1.14 0.73 -0.00 0.00 -2.01 0.00 0.00 31.29 31.15 1b52 h VAL 287 CO 0.73 0.01 -0.14 0.03 -1.01 0.00 0.00 177.57 177.19 1b52 h ARG 288 N 0.06 0.45 -0.14 4.17 3.08 -1.93 -0.03 114.38 120.04 1b52 h ARG 288 Ca 0.22 -0.22 -0.00 0.00 0.07 0.00 0.00 59.98 60.05 1b52 h ARG 288 Cb 0.79 -0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.83 1b52 h ARG 288 CO -0.01 0.77 0.09 0.28 -1.07 0.00 0.00 179.97 180.02 1b52 h VAL 289 N 0.14 1.07 -0.44 2.04 2.07 -1.60 -0.85 116.25 118.68 1b52 h VAL 289 Ca 0.04 -0.19 0.02 0.00 0.82 0.00 0.00 66.70 67.40 1b52 h VAL 289 Cb 0.66 0.94 -0.03 0.00 -1.52 0.00 0.00 31.29 31.34 1b52 h VAL 289 CO 0.04 0.07 0.25 0.03 0.02 0.00 0.00 177.57 177.97 1b52 h ARG 290 N 0.16 0.48 -0.56 1.57 3.08 -1.11 -2.34 114.38 115.65 1b52 h ARG 290 Ca 0.05 -0.03 -0.04 0.00 0.07 0.00 0.00 59.98 60.04 1b52 h ARG 290 Cb 0.04 -0.11 -0.02 0.00 0.08 0.00 0.00 29.97 29.95 1b52 h ARG 290 CO -0.01 0.32 0.21 1.15 -1.07 0.00 0.00 179.97 180.57 1b52 h THR 291 N 0.50 1.23 -0.85 2.04 2.02 -1.01 -1.77 112.91 115.07 1b52 h THR 291 Ca 0.18 -0.72 0.02 0.00 0.77 0.00 0.00 66.41 66.65 1b52 h THR 291 Cb 0.03 0.65 -0.05 0.00 -1.74 0.00 0.00 68.15 67.05 1b52 h THR 291 CO -0.09 0.28 0.56 0.00 0.37 0.00 0.00 175.52 176.63 1b52 h ALA 292 N 1.06 1.09 -0.52 6.16 0.00 -0.92 -1.30 119.26 124.84 1b52 h ALA 292 Ca 0.19 -0.05 -0.05 0.00 0.00 0.00 0.00 54.91 55.00 1b52 h ALA 292 Cb 0.22 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 1b52 h ALA 292 CO -0.01 0.44 0.15 -0.07 0.00 0.00 0.00 179.25 179.76 1b52 h LEU 293 N 1.12 0.76 -0.21 0.00 3.38 -0.91 -2.52 115.31 116.93 1b52 h LEU 293 Ca 0.32 -0.22 0.04 0.00 0.09 0.00 0.00 57.88 58.11 1b52 h LEU 293 Cb -0.08 -0.20 -0.04 0.00 0.09 0.00 0.00 40.66 40.43 1b52 h LEU 293 CO -0.09 0.78 -0.03 0.50 0.09 0.00 0.00 178.44 179.70 1b52 h LYS 294 N 0.71 0.03 -0.23 1.13 3.64 -0.89 -3.12 116.57 117.84 1b52 h LYS 294 Ca 0.16 -0.00 -0.18 0.00 -1.27 0.00 0.00 60.65 59.37 1b52 h LYS 294 Cb 0.30 -0.01 -0.00 0.00 -0.41 0.00 0.00 32.23 32.11 1b52 h LYS 294 CO -0.00 0.02 -0.56 -0.07 -2.27 0.00 0.00 179.45 176.56 1b52 h LEU 295 N 0.03 0.79 -0.01 5.20 3.38 -1.22 -3.25 115.31 120.23 1b52 h LEU 295 Ca 0.10 -0.43 0.00 0.00 0.09 0.00 0.00 57.88 57.64 1b52 h LEU 295 Cb 0.14 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 40.66 1b52 h LEU 295 CO -0.20 1.19 -0.24 0.00 0.09 0.00 0.00 178.44 179.28 1b52 n ALA 296 N -2.55 2.93 -2.35 1.53 0.00 -0.95 -4.57 120.51 114.55 1b52 n ALA 296 Ca -0.04 -0.23 -0.42 0.00 0.00 0.00 0.00 53.44 52.76 1b52 n ALA 296 Cb 0.62 -1.30 -0.03 0.00 0.00 0.00 0.00 19.45 18.74 1b52 n ALA 296 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 1b52 s LEU 297 N -2.99 4.41 -0.48 0.00 0.20 -1.18 -4.74 118.68 113.90 1b52 s LEU 297 Ca 0.13 1.98 -0.16 0.00 0.69 0.00 0.00 54.13 56.77 1b52 s LEU 297 Cb 0.18 -3.59 0.07 0.00 -0.43 0.00 0.00 46.19 42.43 1b52 s LEU 297 CO 0.61 -0.35 0.43 -0.62 -0.29 0.00 0.00 176.35 176.13 1b52 s ASP 298 N 0.66 6.16 0.32 3.68 -1.08 -1.26 -4.93 116.67 120.22 1b52 s ASP 298 Ca 0.54 -1.29 0.11 0.00 -0.52 0.00 0.00 52.55 51.40 1b52 s ASP 298 Cb -0.28 -2.20 0.53 0.00 -1.46 0.00 0.00 42.92 39.51 1b52 s ASP 298 CO 0.31 -0.68 1.72 0.03 0.52 0.00 0.00 175.17 177.06 1b52 h ARG 299 N 8.79 0.02 -0.23 4.34 3.08 -1.93 -2.49 114.38 125.95 1b52 h ARG 299 Ca -0.28 -0.01 0.01 0.00 0.07 0.00 0.00 59.98 59.77 1b52 h ARG 299 Cb 1.11 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.14 1b52 h ARG 299 CO 0.89 0.51 0.14 0.22 -1.07 0.00 0.00 179.97 180.66 1b52 h ASP 300 N 0.01 0.22 -0.22 7.04 3.58 -1.96 0.35 116.42 125.45 1b52 h ASP 300 Ca -0.00 0.00 -0.01 0.00 0.42 0.00 0.00 57.03 57.44 1b52 h ASP 300 Cb 0.88 -0.05 -0.01 0.00 1.72 0.00 0.00 39.33 41.87 1b52 h ASP 300 CO 0.06 0.17 0.10 0.40 -2.88 0.00 0.00 179.24 177.09 1b52 h ILE 301 N 0.28 1.14 -0.06 2.25 2.04 -1.93 0.11 117.51 121.35 1b52 h ILE 301 Ca 0.09 -0.41 -0.02 0.00 1.00 0.00 0.00 64.86 65.52 1b52 h ILE 301 Cb -0.01 1.02 -0.00 0.00 -0.74 0.00 0.00 36.82 37.09 1b52 h ILE 301 CO -0.04 0.14 -0.03 0.40 0.00 0.00 0.00 178.15 178.62 1b52 h ILE 302 N 0.22 1.33 0.04 -0.67 2.04 -0.92 0.06 117.51 119.60 1b52 h ILE 302 Ca 0.07 -1.04 -0.00 0.00 1.00 0.00 0.00 64.86 64.89 1b52 h ILE 302 Cb 0.13 1.89 0.00 0.00 -0.74 0.00 0.00 36.82 38.10 1b52 h ILE 302 CO -0.01 0.28 -0.02 0.58 0.00 0.00 0.00 178.15 178.99 1b52 h VAL 303 N -0.25 1.30 0.00 1.67 2.07 -0.22 -0.94 116.25 119.87 1b52 h VAL 303 Ca 0.01 -1.65 -0.05 0.00 0.82 0.00 0.00 66.70 65.83 1b52 h VAL 303 Cb 0.47 2.31 -0.01 0.00 -1.52 0.00 0.00 31.29 32.54 1b52 h VAL 303 CO 0.01 0.39 -0.68 0.78 0.02 0.00 0.00 177.57 178.09 1b52 h ASN 304 N -0.86 0.00 0.00 0.57 2.35 -0.94 0.53 115.58 117.24 1b52 h ASN 304 Ca -0.01 0.00 -0.17 0.00 -0.55 0.00 0.00 56.30 55.57 1b52 h ASN 304 Cb 0.68 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 39.01 1b52 h ASN 304 CO 0.01 0.21 -1.64 0.29 -1.65 0.00 0.00 177.43 174.65 1b52 n LYS 305 N -2.95 1.82 -0.10 0.81 5.02 -0.76 -4.33 118.16 117.67 1b52 n LYS 305 Ca -0.00 0.02 -0.17 0.00 -2.02 0.00 0.00 58.31 56.13 1b52 n LYS 305 Cb 0.63 -1.23 -0.13 0.00 -0.02 0.00 0.00 35.03 34.28 1b52 n LYS 305 CO 0.00 0.00 0.00 1.33 -0.52 0.00 0.00 177.40 178.21 1b52 n VAL 306 N -2.50 1.53 -0.11 -0.18 0.24 -0.07 -4.69 118.33 112.56 1b52 n VAL 306 Ca -0.17 -0.62 -0.24 0.00 -2.04 0.00 0.00 64.34 61.28 1b52 n VAL 306 Cb 0.77 -1.36 -0.11 0.00 -1.47 0.00 0.00 33.84 31.67 1b52 n VAL 306 CO 0.00 0.00 0.00 1.17 -2.14 0.00 0.00 176.83 175.86 1b52 n LYS 307 N -3.24 0.58 -4.02 7.34 4.81 -0.36 -4.98 118.16 118.28 1b52 n LYS 307 Ca -0.42 0.49 -0.34 0.00 -0.87 0.00 0.00 58.31 57.17 1b52 n LYS 307 Cb 1.02 -1.69 -0.01 0.00 0.02 0.00 0.00 35.03 34.37 1b52 n LYS 307 CO 0.00 0.00 0.00 -1.71 1.17 0.00 0.00 177.40 176.86 1b52 n ASN 308 N -4.36 -2.15 -0.07 3.14 4.05 0.19 -4.85 115.26 111.21 1b52 n ASN 308 Ca -0.37 -1.16 0.07 0.00 0.45 0.00 0.00 54.58 53.57 1b52 n ASN 308 Cb 0.74 -2.38 0.10 0.00 1.23 0.00 0.00 39.78 39.47 1b52 n ASN 308 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1b52 n GLN 309 N -4.59 1.57 -0.44 1.20 6.02 -1.26 -4.96 117.38 114.91 1b52 n GLN 309 Ca -0.21 -2.28 0.00 0.00 -0.01 0.00 0.00 57.00 54.50 1b52 n GLN 309 Cb 0.63 -1.35 0.00 0.00 1.02 0.00 0.00 30.24 30.54 1b52 n GLN 309 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1b52 n GLY 310 N -1.18 0.74 3.74 1.08 0.00 -1.26 -4.93 105.19 103.38 1b52 n GLY 310 Ca 0.12 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.81 1b52 n GLY 310 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1b52 s ASP 311 N -2.65 4.37 -0.02 1.61 1.01 -1.26 -4.77 116.67 114.97 1b52 s ASP 311 Ca 0.00 2.19 -0.01 0.00 0.71 0.00 0.00 52.55 55.44 1b52 s ASP 311 Cb 0.00 -2.57 -0.04 0.00 1.01 0.00 0.00 42.92 41.32 1b52 s ASP 311 CO 0.00 -2.14 0.09 -0.76 0.21 0.00 0.00 175.17 172.58 1b52 s LEU 312 N -5.27 3.97 0.22 1.23 1.43 -0.58 -4.91 118.68 114.78 1b52 s LEU 312 Ca 0.70 0.19 -0.31 0.00 -1.03 0.00 0.00 54.13 53.69 1b52 s LEU 312 Cb -0.25 -2.27 -0.10 0.00 0.03 0.00 0.00 46.19 43.60 1b52 s LEU 312 CO 0.46 0.29 1.50 -2.84 0.23 0.00 0.00 176.35 175.99 1b52 s PRO 313 N -1.66 4.23 0.02 1.29 0.02 -1.26 0.26 135.00 137.90 1b52 s PRO 313 Ca 0.22 2.36 0.03 0.00 0.02 0.00 0.00 61.00 63.63 1b52 s PRO 313 Cb -0.12 -3.12 -0.04 0.00 0.02 0.00 0.00 34.50 31.25 1b52 s PRO 313 CO 0.13 -0.51 -0.03 0.00 -0.33 0.00 0.00 177.00 176.26 1b52 s ALA 314 N 0.41 3.16 0.00 -1.55 0.00 -0.52 -4.73 121.76 118.54 1b52 s ALA 314 Ca 0.64 -1.02 0.00 0.00 0.00 0.00 0.00 51.96 51.57 1b52 s ALA 314 Cb -0.43 -1.21 0.00 0.00 0.00 0.00 0.00 23.12 21.48 1b52 s ALA 314 CO 0.39 0.64 0.67 2.48 0.00 0.00 0.00 175.76 179.95 1b52 n TYR 315 N 1.27 0.00 -4.03 0.00 0.18 -1.26 -4.46 117.16 108.86 1b52 n TYR 315 Ca -0.14 -0.23 -0.11 0.00 1.88 0.00 0.00 57.90 59.31 1b52 n TYR 315 Cb 0.52 -0.02 -0.05 0.00 -0.38 0.00 0.00 39.34 39.41 1b52 n TYR 315 CO 0.00 0.00 0.00 -1.54 -2.08 0.00 0.00 176.86 173.24 1b52 s SER 316 N -0.45 0.14 -0.13 9.48 1.04 -1.26 -4.82 113.70 117.70 1b52 s SER 316 Ca 0.00 -1.10 -0.10 0.00 0.48 0.00 0.00 55.95 55.23 1b52 s SER 316 Cb 0.00 0.59 -0.07 0.00 0.10 0.00 0.00 66.02 66.64 1b52 s SER 316 CO 0.00 -1.16 0.09 0.22 0.98 0.00 0.00 173.24 173.37 1b52 h TYR 317 N 2.25 0.00 -2.90 5.02 3.20 -1.98 -3.45 116.97 119.11 1b52 h TYR 317 Ca -0.28 0.00 -0.53 0.00 3.14 0.00 0.00 58.73 61.06 1b52 h TYR 317 Cb 1.25 0.00 0.02 0.00 1.54 0.00 0.00 36.73 39.54 1b52 h TYR 317 CO 0.65 0.34 0.82 0.99 -1.64 0.00 0.00 178.16 179.32 1b52 s THR 318 N -1.97 3.30 0.22 1.81 2.01 -1.26 -4.71 115.64 115.05 1b52 s THR 318 Ca -0.11 0.85 -0.31 0.00 0.31 0.00 0.00 61.69 62.44 1b52 s THR 318 Cb 0.01 -3.55 -0.10 0.00 0.01 0.00 0.00 72.50 68.87 1b52 s THR 318 CO 0.25 0.04 1.50 -2.84 -0.69 0.00 0.00 174.62 172.87 1b52 s PRO 319 N 1.73 4.23 0.62 4.92 0.02 -1.26 -4.88 135.00 140.38 1b52 s PRO 319 Ca 0.66 2.35 0.41 0.00 0.02 0.00 0.00 61.00 64.44 1b52 s PRO 319 Cb -0.36 -3.12 2.08 0.00 0.02 0.00 0.00 34.50 33.12 1b52 s PRO 319 CO 0.30 -0.51 2.23 -1.00 -0.33 0.00 0.00 177.00 177.69 1b52 h PRO 320 N 5.64 0.00 -0.65 5.54 0.13 -1.95 -1.86 132.00 138.84 1b52 h PRO 320 Ca -0.45 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.68 1b52 h PRO 320 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 1b52 h PRO 320 CO 0.83 0.00 0.00 2.48 -0.23 0.00 0.00 178.00 181.08 1b52 n TYR 321 N -3.03 1.13 -2.08 1.56 4.11 -1.26 -4.70 117.16 112.89 1b52 n TYR 321 Ca -0.02 -0.42 -0.39 0.00 -0.00 0.00 0.00 57.90 57.07 1b52 n TYR 321 Cb 0.13 -0.25 -0.00 0.00 -0.00 0.00 0.00 39.34 39.22 1b52 n TYR 321 CO 0.00 0.00 0.00 0.99 -0.00 0.00 0.00 176.86 177.85 1b52 s THR 322 N -1.90 2.69 0.08 -3.48 2.01 -0.70 -4.94 115.64 109.40 1b52 s THR 322 Ca 0.34 0.59 -0.31 0.00 0.31 0.00 0.00 61.69 62.63 1b52 s THR 322 Cb 0.24 -3.34 -0.09 0.00 0.01 0.00 0.00 72.50 69.32 1b52 s THR 322 CO 0.14 0.07 1.74 -0.62 -0.69 0.00 0.00 174.62 175.26 1b52 s ASP 323 N -0.86 6.52 0.00 3.53 2.15 -1.26 -1.04 116.67 125.71 1b52 s ASP 323 Ca 0.59 2.59 0.00 0.00 0.43 0.00 0.00 52.55 56.16 1b52 s ASP 323 Cb -0.36 -2.56 0.00 0.00 -0.30 0.00 0.00 42.92 39.70 1b52 s ASP 323 CO 0.46 -0.95 0.00 0.61 -0.17 0.00 0.00 175.17 175.12 1b52 n GLY 324 N 4.13 0.93 3.82 2.66 0.00 -1.26 -4.04 105.19 111.43 1b52 n GLY 324 Ca 0.17 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.84 1b52 n GLY 324 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1b52 s ALA 325 N -2.65 3.37 -0.43 4.61 0.00 -0.21 -4.70 121.76 121.75 1b52 s ALA 325 Ca 0.00 0.17 0.06 0.00 0.00 0.00 0.00 51.96 52.19 1b52 s ALA 325 Cb 0.00 -2.84 0.20 0.00 0.00 0.00 0.00 23.12 20.48 1b52 s ALA 325 CO 0.00 0.31 0.50 1.63 0.00 0.00 0.00 175.76 178.21 1b52 n LYS 326 N 0.47 0.44 -3.26 0.00 5.02 -1.26 -4.88 118.16 114.69 1b52 n LYS 326 Ca -0.01 -2.87 -0.36 0.00 -2.02 0.00 0.00 58.31 53.05 1b52 n LYS 326 Cb 0.51 -1.49 -0.06 0.00 -0.02 0.00 0.00 35.03 33.97 1b52 n LYS 326 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1b52 s LEU 327 N -0.23 4.34 -0.15 -0.35 1.43 -1.26 -4.63 118.68 117.83 1b52 s LEU 327 Ca 0.33 1.21 -0.16 0.00 -1.03 0.00 0.00 54.13 54.48 1b52 s LEU 327 Cb 0.09 -3.40 -0.04 0.00 0.03 0.00 0.00 46.19 42.87 1b52 s LEU 327 CO -0.16 0.07 0.40 -0.69 0.23 0.00 0.00 176.35 176.20 1b52 s VAL 328 N -1.49 5.23 0.10 -1.59 1.01 -1.26 -5.06 120.40 117.33 1b52 s VAL 328 Ca 0.40 0.77 -0.30 0.00 0.00 0.00 0.00 61.98 62.84 1b52 s VAL 328 Cb -0.16 -3.74 -0.06 0.00 0.00 0.00 0.00 36.38 32.42 1b52 s VAL 328 CO 0.20 0.33 1.21 -1.61 0.00 0.00 0.00 175.10 175.23 1b52 s GLU 329 N 0.73 4.44 0.73 2.72 2.02 -1.26 -4.99 118.70 123.10 1b52 s GLU 329 Ca 0.21 1.81 -0.11 0.00 0.02 0.00 0.00 54.97 56.90 1b52 s GLU 329 Cb -0.14 -3.31 0.03 0.00 0.10 0.00 0.00 34.13 30.80 1b52 s GLU 329 CO 0.07 -0.22 1.08 -1.25 0.02 0.00 0.00 175.26 174.97 1b52 s PRO 330 N 0.73 2.62 0.23 0.39 0.04 -1.26 -4.96 135.00 132.79 1b52 s PRO 330 Ca 0.58 0.65 -0.07 0.00 0.04 0.00 0.00 61.00 62.19 1b52 s PRO 330 Cb -0.31 -1.98 0.38 0.00 0.04 0.00 0.00 34.50 32.64 1b52 s PRO 330 CO 0.31 -1.25 1.70 0.93 0.04 0.00 0.00 177.00 178.73 1b52 h GLU 331 N -0.81 0.26 -0.74 4.56 4.39 -2.01 -2.85 114.58 117.39 1b52 h GLU 331 Ca -0.45 -0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.23 1b52 h GLU 331 Cb 1.25 -0.06 -0.04 0.00 -0.10 0.00 0.00 28.75 29.80 1b52 h GLU 331 CO 0.61 0.17 0.47 0.11 -1.16 0.00 0.00 179.01 179.20 1b52 h TRP 332 N 0.27 0.94 0.00 4.33 5.08 -1.97 0.52 115.95 125.13 1b52 h TRP 332 Ca 0.37 0.01 -0.01 0.00 1.08 0.00 0.00 58.89 60.34 1b52 h TRP 332 Cb 0.59 -0.32 -0.00 0.00 -3.00 0.00 0.00 29.16 26.43 1b52 h TRP 332 CO -0.26 0.61 -0.06 0.35 -1.28 0.00 0.00 178.44 177.80 1b52 h PHE 333 N 1.01 0.00 0.00 0.12 3.57 -1.89 -3.08 116.94 116.66 1b52 h PHE 333 Ca 0.27 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.77 1b52 h PHE 333 Cb -0.08 0.00 0.00 0.00 2.79 0.00 0.00 35.95 38.66 1b52 h PHE 333 CO 0.00 0.06 -0.34 0.87 -2.23 0.00 0.00 178.31 176.67 1b52 h LYS 334 N 0.00 0.00 -7.28 1.11 1.57 0.03 -3.46 116.57 108.54 1b52 h LYS 334 Ca -0.00 0.00 -0.40 0.00 -1.87 0.00 0.00 60.65 58.38 1b52 h LYS 334 Cb 0.47 0.00 0.20 0.00 0.08 0.00 0.00 32.23 32.99 1b52 h LYS 334 CO 0.01 0.00 0.04 -1.58 -0.57 0.00 0.00 179.45 177.35 1b52 s TRP 335 N -3.22 -0.16 0.60 -1.35 0.51 -1.13 -5.04 118.94 109.16 1b52 s TRP 335 Ca 0.06 0.44 -0.04 0.00 -2.12 0.00 0.00 56.10 54.45 1b52 s TRP 335 Cb 0.09 -3.29 0.03 0.00 -0.81 0.00 0.00 33.47 29.49 1b52 s TRP 335 CO 0.69 -4.40 0.88 -1.54 -0.51 0.00 0.00 176.95 172.07 1b52 s SER 336 N -3.73 5.26 0.14 2.95 1.04 -1.26 -4.93 113.70 113.18 1b52 s SER 336 Ca 0.71 0.39 -0.17 0.00 0.48 0.00 0.00 55.95 57.35 1b52 s SER 336 Cb -0.09 -1.26 -0.01 0.00 0.10 0.00 0.00 66.02 64.76 1b52 s SER 336 CO 0.56 -1.23 1.77 -0.61 0.98 0.00 0.00 173.24 174.71 1b52 h GLN 337 N -0.20 0.47 -0.98 4.02 5.75 -1.96 -1.98 115.11 120.24 1b52 h GLN 337 Ca -0.44 -0.04 0.09 0.00 -0.15 0.00 0.00 58.65 58.11 1b52 h GLN 337 Cb 1.29 -0.10 -0.08 0.00 1.07 0.00 0.00 27.48 29.66 1b52 h GLN 337 CO 0.58 0.35 0.61 -0.56 -2.65 0.00 0.00 178.83 177.17 1b52 h GLN 338 N 0.46 1.01 -0.02 1.69 -0.00 -1.98 0.28 115.11 116.55 1b52 h GLN 338 Ca 0.13 -0.06 -0.00 0.00 -0.00 0.00 0.00 58.65 58.71 1b52 h GLN 338 Cb -0.00 -0.23 -0.00 0.00 -0.00 0.00 0.00 27.48 27.25 1b52 h GLN 338 CO -0.02 0.67 -0.00 -0.22 -0.00 0.00 0.00 178.83 179.25 1b52 h LYS 339 N 1.04 0.03 -0.66 0.06 1.63 -1.92 -1.45 116.57 115.30 1b52 h LYS 339 Ca 0.45 -0.01 0.11 0.00 -0.85 0.00 0.00 60.65 60.35 1b52 h LYS 339 Cb 0.33 -0.00 -0.08 0.00 -0.60 0.00 0.00 32.23 31.88 1b52 h LYS 339 CO -0.22 0.34 0.26 0.00 -3.45 0.00 0.00 179.45 176.37 1b52 h ARG 340 N -0.27 0.42 -0.44 1.90 3.08 -0.62 -1.10 114.38 117.35 1b52 h ARG 340 Ca 0.01 -0.03 -0.01 0.00 0.07 0.00 0.00 59.98 60.03 1b52 h ARG 340 Cb 0.32 -0.09 -0.02 0.00 0.08 0.00 0.00 29.97 30.26 1b52 h ARG 340 CO 0.00 0.28 0.25 -0.91 -1.07 0.00 0.00 179.97 178.52 1b52 h ASN 341 N 0.43 0.53 -0.37 7.04 2.35 -0.21 -0.42 115.58 124.93 1b52 h ASN 341 Ca 0.34 -0.07 0.04 0.00 -0.55 0.00 0.00 56.30 56.06 1b52 h ASN 341 Cb 0.45 -0.13 -0.04 0.00 0.05 0.00 0.00 38.32 38.65 1b52 h ASN 341 CO -0.34 0.45 0.14 -0.33 -1.65 0.00 0.00 177.43 175.70 1b52 h GLU 342 N 0.57 0.30 0.00 0.81 5.08 -1.00 -0.62 114.58 119.72 1b52 h GLU 342 Ca 0.15 -0.02 -0.08 0.00 -1.00 0.00 0.00 59.36 58.42 1b52 h GLU 342 Cb 0.02 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.19 1b52 h GLU 342 CO -0.03 0.20 -0.38 1.49 -1.00 0.00 0.00 179.01 179.29 1b52 h GLU 343 N 0.31 0.00 -0.11 2.33 4.57 -0.80 -2.19 114.58 118.69 1b52 h GLU 343 Ca 0.17 0.00 -0.23 0.00 -1.18 0.00 0.00 59.36 58.12 1b52 h GLU 343 Cb 0.13 0.00 0.01 0.00 -0.16 0.00 0.00 28.75 28.73 1b52 h GLU 343 CO -0.16 0.38 -0.81 0.00 -1.18 0.00 0.00 179.01 177.24 1b52 h ALA 344 N 1.62 0.25 -0.58 2.92 0.00 -0.28 -1.85 119.26 121.34 1b52 h ALA 344 Ca -0.00 -0.61 -0.07 0.00 0.00 0.00 0.00 54.91 54.23 1b52 h ALA 344 Cb 0.68 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.45 1b52 h ALA 344 CO 0.05 0.65 0.09 0.87 0.00 0.00 0.00 179.25 180.90 1b52 h LYS 345 N 0.46 0.93 -0.22 0.00 1.57 -1.07 -2.54 116.57 115.70 1b52 h LYS 345 Ca -0.07 -0.23 -0.13 0.00 -1.87 0.00 0.00 60.65 58.35 1b52 h LYS 345 Cb 1.45 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 33.63 1b52 h LYS 345 CO 0.17 0.87 -0.40 -0.22 -0.57 0.00 0.00 179.45 179.29 1b52 h LYS 346 N 0.88 0.50 -0.10 3.15 3.64 -1.34 -1.69 116.57 121.61 1b52 h LYS 346 Ca 0.18 -0.25 -0.13 0.00 -1.27 0.00 0.00 60.65 59.18 1b52 h LYS 346 Cb 0.40 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.21 1b52 h LYS 346 CO 0.01 0.82 -0.50 -0.07 -2.27 0.00 0.00 179.45 177.44 1b52 h LEU 347 N 0.41 0.27 0.14 5.20 3.38 -1.02 -2.12 115.31 121.58 1b52 h LEU 347 Ca 0.04 -0.13 -0.01 0.00 0.09 0.00 0.00 57.88 57.87 1b52 h LEU 347 Cb 0.88 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.56 1b52 h LEU 347 CO 0.07 0.73 -0.07 -0.07 0.09 0.00 0.00 178.44 179.20 1b52 h LEU 348 N 0.20 -0.15 -0.83 1.67 3.38 -1.35 -2.37 115.31 115.87 1b52 h LEU 348 Ca 0.01 -0.24 0.08 0.00 0.09 0.00 0.00 57.88 57.82 1b52 h LEU 348 Cb 0.95 0.04 -0.07 0.00 0.09 0.00 0.00 40.66 41.67 1b52 h LEU 348 CO 0.08 0.16 0.48 0.00 0.09 0.00 0.00 178.44 179.26 1b52 h ALA 349 N 0.32 1.16 0.00 1.53 0.00 -1.29 0.19 119.26 121.18 1b52 h ALA 349 Ca -0.02 0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.90 1b52 h ALA 349 Cb 0.39 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 18.02 1b52 h ALA 349 CO 0.03 0.14 -0.07 1.49 0.00 0.00 0.00 179.25 180.84 1b52 h GLU 350 N 0.83 0.00 -0.20 0.00 4.81 -1.20 -1.49 114.58 117.33 1b52 h GLU 350 Ca 0.39 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.62 1b52 h GLU 350 Cb 0.31 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.69 1b52 h GLU 350 CO -0.23 0.07 0.00 0.00 -0.73 0.00 0.00 179.01 178.13 1b52 n ALA 351 N -2.46 2.51 -0.17 2.92 0.00 0.56 -4.91 120.51 118.96 1b52 n ALA 351 Ca -0.03 -0.56 0.00 0.00 0.00 0.00 0.00 53.44 52.85 1b52 n ALA 351 Cb 0.15 -1.06 0.00 0.00 0.00 0.00 0.00 19.45 18.54 1b52 n ALA 351 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1b52 n GLY 352 N 1.15 0.91 3.42 0.00 0.00 -0.56 -5.07 105.19 105.04 1b52 n GLY 352 Ca 0.16 -0.05 -0.33 0.00 0.00 0.00 0.00 46.02 45.80 1b52 n GLY 352 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1b52 s PHE 353 N -2.00 2.78 0.00 1.61 0.08 -0.52 -4.92 117.98 115.00 1b52 s PHE 353 Ca 0.00 -0.44 0.00 0.00 0.12 0.00 0.00 56.93 56.61 1b52 s PHE 353 Cb 0.00 -1.76 0.00 0.00 -0.57 0.00 0.00 43.02 40.69 1b52 s PHE 353 CO 0.00 -0.04 0.00 0.25 -0.10 0.00 0.00 175.22 175.33 1b52 n THR 354 N 3.03 0.00 -3.45 0.64 -2.24 -1.26 -3.50 114.28 107.50 1b52 n THR 354 Ca -0.18 0.00 -0.29 0.00 -2.27 0.00 0.00 64.05 61.31 1b52 n THR 354 Cb 0.52 0.00 -0.08 0.00 -2.10 0.00 0.00 70.33 68.68 1b52 n THR 354 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1b52 n ALA 355 N -3.00 4.10 0.00 6.98 0.00 -1.26 -4.65 120.51 122.68 1b52 n ALA 355 Ca 0.00 -4.75 0.00 0.00 0.00 0.00 0.00 53.44 48.69 1b52 n ALA 355 Cb 0.00 -1.08 0.00 0.00 0.00 0.00 0.00 19.45 18.37 1b52 n ALA 355 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1b52 n PRO 358 N 1.07 0.00 -2.25 0.00 -0.04 -1.26 -5.23 135.00 127.29 1b52 n PRO 358 Ca 0.28 0.00 -0.42 0.00 -0.04 0.00 0.00 63.50 63.32 1b52 n PRO 358 Cb 0.39 0.00 -0.03 0.00 -0.04 0.00 0.00 33.50 33.82 1b52 n PRO 358 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 1b52 s LEU 359 N 0.00 4.36 -0.02 1.53 2.96 -1.26 -4.94 118.68 121.30 1b52 s LEU 359 Ca 0.00 2.20 0.04 0.00 -0.22 0.00 0.00 54.13 56.16 1b52 s LEU 359 Cb 0.00 -3.58 -0.01 0.00 0.50 0.00 0.00 46.19 43.10 1b52 s LEU 359 CO 0.00 -0.61 -0.14 -0.89 -1.32 0.00 0.00 176.35 173.39 1b52 s THR 360 N 1.27 1.18 0.04 3.68 2.01 -1.25 -1.22 115.64 121.35 1b52 s THR 360 Ca 0.63 -0.61 -0.28 0.00 0.31 0.00 0.00 61.69 61.74 1b52 s THR 360 Cb -0.34 -1.00 0.09 0.00 0.01 0.00 0.00 72.50 71.26 1b52 s THR 360 CO 0.29 0.34 0.99 0.72 -0.69 0.00 0.00 174.62 176.28 1b52 s PHE 361 N -0.13 -0.20 0.03 4.92 -0.12 -0.87 -5.01 117.98 116.60 1b52 s PHE 361 Ca 0.01 0.01 -0.10 0.00 -0.05 0.00 0.00 56.93 56.80 1b52 s PHE 361 Cb -0.08 0.58 -0.05 0.00 -0.63 0.00 0.00 43.02 42.84 1b52 s PHE 361 CO 0.00 -0.60 0.35 -0.51 -0.05 0.00 0.00 175.22 174.41 1b52 s ASP 362 N -2.71 6.62 -0.24 1.98 1.01 -1.26 -0.15 116.67 121.93 1b52 s ASP 362 Ca 0.09 0.74 0.02 0.00 0.71 0.00 0.00 52.55 54.12 1b52 s ASP 362 Cb -0.00 -2.16 0.05 0.00 1.01 0.00 0.00 42.92 41.81 1b52 s ASP 362 CO -0.03 0.24 -0.13 -0.22 0.21 0.00 0.00 175.17 175.24 1b52 s LEU 363 N -1.65 3.10 -0.13 1.23 2.96 0.32 -2.77 118.68 121.74 1b52 s LEU 363 Ca 0.28 -1.21 -0.10 0.00 -0.22 0.00 0.00 54.13 52.88 1b52 s LEU 363 Cb -0.14 -1.51 -0.05 0.00 0.50 0.00 0.00 46.19 44.99 1b52 s LEU 363 CO 0.16 -0.15 0.20 -0.22 -1.32 0.00 0.00 176.35 175.02 1b52 s LEU 364 N 1.16 4.33 0.11 -0.68 2.96 -0.31 -1.61 118.68 124.65 1b52 s LEU 364 Ca -0.06 0.49 0.02 0.00 -0.22 0.00 0.00 54.13 54.37 1b52 s LEU 364 Cb -0.18 -2.21 -0.04 0.00 0.50 0.00 0.00 46.19 44.26 1b52 s LEU 364 CO -0.07 0.29 -0.06 -0.72 -1.32 0.00 0.00 176.35 174.47 1b52 s TYR 365 N -0.44 0.98 -0.04 5.38 1.13 -0.89 -0.49 117.35 122.97 1b52 s TYR 365 Ca 0.15 -0.91 -0.19 0.00 -1.41 0.00 0.00 57.07 54.71 1b52 s TYR 365 Cb -0.13 -0.55 -0.05 0.00 -1.10 0.00 0.00 41.96 40.13 1b52 s TYR 365 CO 0.04 -0.13 0.52 0.54 -2.51 0.00 0.00 175.55 174.01 1b52 s ASN 366 N -3.08 6.85 -0.40 -0.18 4.22 -1.26 -1.56 114.94 119.53 1b52 s ASN 366 Ca 0.14 1.01 -0.38 0.00 -2.14 0.00 0.00 52.86 51.50 1b52 s ASN 366 Cb 0.05 -2.32 -0.16 0.00 1.28 0.00 0.00 41.25 40.10 1b52 s ASN 366 CO -0.03 0.12 1.33 0.41 -2.04 0.00 0.00 177.10 176.89 1b52 n THR 367 N 2.83 0.00 -3.65 0.54 -1.04 0.09 -4.81 114.28 108.25 1b52 n THR 367 Ca -0.08 0.00 -0.02 0.00 -2.04 0.00 0.00 64.05 61.90 1b52 n THR 367 Cb 0.51 -0.40 -0.05 0.00 -1.82 0.00 0.00 70.33 68.57 1b52 n THR 367 CO 0.00 0.00 0.00 -0.55 -0.64 0.00 0.00 175.07 173.88 1b52 s SER 368 N 2.65 -0.04 0.16 8.00 0.15 -1.26 -4.81 113.70 118.55 1b52 s SER 368 Ca 0.86 0.06 -0.04 0.00 0.70 0.00 0.00 55.95 57.52 1b52 s SER 368 Cb -1.21 0.05 0.01 0.00 -1.71 0.00 0.00 66.02 63.17 1b52 s SER 368 CO 0.65 -0.02 1.41 0.44 1.20 0.00 0.00 173.24 176.92 1b52 h ASP 369 N 2.54 0.61 -0.25 5.45 3.32 -1.92 -2.76 116.42 123.41 1b52 h ASP 369 Ca -0.17 -0.39 -0.02 0.00 0.02 0.00 0.00 57.03 56.47 1b52 h ASP 369 Cb 1.19 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 40.55 1b52 h ASP 369 CO 0.20 1.14 0.09 0.25 -1.72 0.00 0.00 179.24 179.20 1b52 h LEU 370 N 0.36 0.36 -0.40 1.55 5.85 -1.91 -2.80 115.31 118.30 1b52 h LEU 370 Ca -0.03 -0.19 -0.18 0.00 0.84 0.00 0.00 57.88 58.32 1b52 h LEU 370 Cb 1.30 -0.09 -0.00 0.00 0.37 0.00 0.00 40.66 42.24 1b52 h LEU 370 CO 0.13 0.45 -0.60 0.45 -0.34 0.00 0.00 178.44 178.53 1b52 h HIS 371 N 0.24 0.83 -0.61 1.25 3.86 -1.87 -1.79 115.15 117.06 1b52 h HIS 371 Ca 0.08 -0.31 0.00 0.00 -1.16 0.00 0.00 60.37 58.98 1b52 h HIS 371 Cb 0.22 -0.15 -0.03 0.00 1.06 0.00 0.00 27.41 28.51 1b52 h HIS 371 CO -0.00 1.08 0.39 -0.22 0.86 0.00 0.00 177.93 180.04 1b52 h LYS 372 N 0.48 0.81 0.25 2.45 3.64 -1.55 1.27 116.57 123.91 1b52 h LYS 372 Ca -0.00 -0.06 -0.01 0.00 -1.27 0.00 0.00 60.65 59.31 1b52 h LYS 372 Cb 1.17 -0.18 0.00 0.00 -0.41 0.00 0.00 32.23 32.82 1b52 h LYS 372 CO 0.12 0.55 -0.12 0.87 -2.27 0.00 0.00 179.45 178.60 1b52 h LYS 373 N 0.82 -0.32 -0.02 1.90 1.79 -1.27 -1.13 116.57 118.34 1b52 h LYS 373 Ca 0.22 0.02 -0.09 0.00 -2.18 0.00 0.00 60.65 58.62 1b52 h LYS 373 Cb -0.06 0.07 -0.01 0.00 -1.58 0.00 0.00 32.23 30.65 1b52 h LYS 373 CO -0.05 -0.18 -0.40 -0.07 -1.08 0.00 0.00 179.45 177.68 1b52 h LEU 374 N -0.38 0.05 -0.63 2.94 3.38 -1.03 -2.18 115.31 117.46 1b52 h LEU 374 Ca -0.03 -0.02 -0.04 0.00 0.09 0.00 0.00 57.88 57.88 1b52 h LEU 374 Cb 0.29 -0.01 -0.03 0.00 0.09 0.00 0.00 40.66 41.00 1b52 h LEU 374 CO 0.06 0.44 0.25 0.00 0.09 0.00 0.00 178.44 179.28 1b52 h ALA 375 N 1.56 0.82 -0.21 1.53 0.00 0.23 0.12 119.26 123.31 1b52 h ALA 375 Ca 0.00 -0.18 -0.02 0.00 0.00 0.00 0.00 54.91 54.71 1b52 h ALA 375 Cb 0.72 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 1b52 h ALA 375 CO 0.05 0.45 0.05 0.82 0.00 0.00 0.00 179.25 180.62 1b52 h ILE 376 N 0.89 1.21 -0.65 0.00 2.04 -1.20 0.11 117.51 119.91 1b52 h ILE 376 Ca 0.21 -0.69 0.09 0.00 1.00 0.00 0.00 64.86 65.47 1b52 h ILE 376 Cb 0.21 1.26 -0.07 0.00 -0.74 0.00 0.00 36.82 37.49 1b52 h ILE 376 CO -0.02 0.22 0.30 0.00 0.00 0.00 0.00 178.15 178.65 1b52 h ALA 377 N 0.86 0.88 -0.27 1.87 0.00 -1.11 -0.36 119.26 121.13 1b52 h ALA 377 Ca 0.07 0.06 -0.18 0.00 0.00 0.00 0.00 54.91 54.86 1b52 h ALA 377 Cb 0.29 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.06 1b52 h ALA 377 CO 0.00 -0.10 -0.53 0.28 0.00 0.00 0.00 179.25 178.90 1b52 h VAL 378 N 0.52 1.29 -0.82 0.00 2.07 -0.61 -0.44 116.25 118.26 1b52 h VAL 378 Ca 0.32 -1.72 0.01 0.00 0.82 0.00 0.00 66.70 66.13 1b52 h VAL 378 Cb 0.35 1.63 -0.04 0.00 -1.52 0.00 0.00 31.29 31.71 1b52 h VAL 378 CO -0.27 0.56 0.54 0.00 0.02 0.00 0.00 177.57 178.42 1b52 h ALA 379 N 0.78 1.05 -0.51 1.67 0.00 -0.29 0.11 119.26 122.07 1b52 h ALA 379 Ca 0.02 -0.05 -0.12 0.00 0.00 0.00 0.00 54.91 54.75 1b52 h ALA 379 Cb 1.11 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 18.56 1b52 h ALA 379 CO 0.11 0.44 -0.16 0.66 0.00 0.00 0.00 179.25 180.30 1b52 h SER 380 N 1.10 1.03 -0.14 0.00 4.64 -0.88 -0.34 113.55 118.96 1b52 h SER 380 Ca 0.31 -0.37 -0.02 0.00 -0.47 0.00 0.00 61.79 61.23 1b52 h SER 380 Cb -0.11 -0.28 -0.01 0.00 -0.31 0.00 0.00 62.40 61.70 1b52 h SER 380 CO -0.07 1.17 0.01 0.40 -0.87 0.00 0.00 176.83 177.46 1b52 h ILE 381 N 0.88 1.24 -0.33 0.95 2.04 -0.39 -0.69 117.51 121.22 1b52 h ILE 381 Ca 0.13 -0.78 -0.02 0.00 1.00 0.00 0.00 64.86 65.18 1b52 h ILE 381 Cb 0.74 1.48 -0.02 0.00 -0.74 0.00 0.00 36.82 38.28 1b52 h ILE 381 CO 0.06 0.23 0.10 -0.50 0.00 0.00 0.00 178.15 178.03 1b52 h TRP 382 N -0.01 0.46 0.84 1.37 6.55 -0.69 0.26 115.95 124.74 1b52 h TRP 382 Ca 0.04 -0.02 -0.04 0.00 0.95 0.00 0.00 58.89 59.82 1b52 h TRP 382 Cb 0.34 -0.15 0.01 0.00 -0.86 0.00 0.00 29.16 28.50 1b52 h TRP 382 CO 0.03 0.40 -0.40 -0.22 -1.05 0.00 0.00 178.44 177.19 1b52 h LYS 383 N 0.46 -1.09 -0.19 0.49 3.11 -0.85 -1.25 116.57 117.24 1b52 h LYS 383 Ca 0.11 0.07 0.04 0.00 -2.81 0.00 0.00 60.65 58.07 1b52 h LYS 383 Cb 0.16 0.25 -0.04 0.00 -1.00 0.00 0.00 32.23 31.59 1b52 h LYS 383 CO -0.01 -0.72 -0.07 -0.22 -2.81 0.00 0.00 179.45 175.62 1b52 h LYS 384 N -1.26 -0.04 0.00 1.90 3.64 -1.02 0.14 116.57 119.93 1b52 h LYS 384 Ca -0.12 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.26 1b52 h LYS 384 Cb 0.87 0.01 -0.00 0.00 -0.41 0.00 0.00 32.23 32.70 1b52 h LYS 384 CO 0.19 -0.03 -0.05 -0.91 -2.27 0.00 0.00 179.45 176.39 1b52 h ASN 385 N -0.04 0.00 0.00 4.20 4.21 -0.53 -3.39 115.58 120.03 1b52 h ASN 385 Ca 0.10 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.61 1b52 h ASN 385 Cb 0.19 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.39 1b52 h ASN 385 CO -0.22 0.05 0.00 -0.11 -1.29 0.00 0.00 177.43 175.86 1b52 n LEU 386 N -3.11 0.05 -0.01 1.61 7.94 -0.49 -4.80 117.00 118.19 1b52 n LEU 386 Ca 0.04 -0.12 -0.00 0.00 -1.11 0.00 0.00 56.01 54.82 1b52 n LEU 386 Cb 0.54 0.00 -0.00 0.00 0.53 0.00 0.00 43.42 44.49 1b52 n LEU 386 CO 0.34 0.01 -0.00 0.61 -1.11 0.00 0.00 177.39 177.24 1b52 n GLY 387 N 0.15 0.46 3.78 -3.96 0.00 0.48 -4.98 105.19 101.12 1b52 n GLY 387 Ca 0.00 -0.04 -0.39 0.00 0.00 0.00 0.00 46.02 45.59 1b52 n GLY 387 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1b52 s VAL 388 N -1.91 4.40 -0.25 1.61 -7.23 -1.18 -4.61 120.40 111.23 1b52 s VAL 388 Ca 0.00 1.65 -0.09 0.00 -1.81 0.00 0.00 61.98 61.73 1b52 s VAL 388 Cb 0.00 -4.10 -0.04 0.00 0.56 0.00 0.00 36.38 32.80 1b52 s VAL 388 CO 0.00 0.49 0.13 0.20 -0.31 0.00 0.00 175.10 175.61 1b52 s ASN 389 N -1.20 5.65 -0.14 4.85 0.01 -0.36 -3.65 114.94 120.11 1b52 s ASN 389 Ca 0.36 -0.06 -0.04 0.00 -0.71 0.00 0.00 52.86 52.41 1b52 s ASN 389 Cb -0.22 -2.03 -0.03 0.00 0.41 0.00 0.00 41.25 39.38 1b52 s ASN 389 CO 0.25 -0.01 0.01 -0.69 -1.51 0.00 0.00 177.10 175.16 1b52 s VAL 390 N 1.48 4.35 -0.20 1.60 1.01 -1.26 -2.06 120.40 125.32 1b52 s VAL 390 Ca 0.06 -0.21 -0.07 0.00 0.00 0.00 0.00 61.98 61.76 1b52 s VAL 390 Cb -0.15 -2.89 -0.04 0.00 0.00 0.00 0.00 36.38 33.30 1b52 s VAL 390 CO 0.06 0.53 0.07 0.20 0.00 0.00 0.00 175.10 175.96 1b52 s ASN 391 N -0.12 5.49 0.18 3.32 0.02 0.79 -4.92 114.94 119.71 1b52 s ASN 391 Ca 0.05 0.00 -0.29 0.00 -1.02 0.00 0.00 52.86 51.59 1b52 s ASN 391 Cb -0.13 -1.95 -0.08 0.00 0.02 0.00 0.00 41.25 39.11 1b52 s ASN 391 CO 0.02 0.12 0.92 -0.76 0.02 0.00 0.00 177.10 177.42 1b52 s LEU 392 N 0.72 4.59 0.03 0.60 1.02 -1.26 -0.52 118.68 123.86 1b52 s LEU 392 Ca 0.03 1.85 0.02 0.00 0.02 0.00 0.00 54.13 56.05 1b52 s LEU 392 Cb -0.13 -3.55 -0.02 0.00 0.02 0.00 0.00 46.19 42.51 1b52 s LEU 392 CO 0.02 0.09 -0.07 -1.61 0.02 0.00 0.00 176.35 174.80 1b52 s GLU 393 N -0.77 0.49 0.01 1.70 2.02 -0.63 -4.90 118.70 116.62 1b52 s GLU 393 Ca 0.42 -0.62 0.01 0.00 0.02 0.00 0.00 54.97 54.81 1b52 s GLU 393 Cb -0.25 -0.30 -0.01 0.00 0.10 0.00 0.00 34.13 33.67 1b52 s GLU 393 CO 0.30 0.06 -0.05 0.54 0.02 0.00 0.00 175.26 176.14 1b52 s ASN 394 N -1.23 0.55 0.06 -0.19 4.22 -1.26 -2.10 114.94 114.99 1b52 s ASN 394 Ca -0.07 -0.20 -0.01 0.00 -2.14 0.00 0.00 52.86 50.43 1b52 s ASN 394 Cb -0.08 -0.02 -0.04 0.00 1.28 0.00 0.00 41.25 42.38 1b52 s ASN 394 CO 0.00 -0.03 -0.02 -1.10 -2.04 0.00 0.00 177.10 173.92 1b52 s GLN 395 N -0.50 0.66 0.49 3.55 -0.21 -0.60 -4.92 119.66 118.13 1b52 s GLN 395 Ca -0.02 -1.25 -0.20 0.00 0.02 0.00 0.00 55.36 53.91 1b52 s GLN 395 Cb -0.04 0.21 -0.08 0.00 1.00 0.00 0.00 33.01 34.09 1b52 s GLN 395 CO -0.00 -0.13 1.02 -2.00 -2.12 0.00 0.00 175.29 172.06 1b52 s GLU 396 N -3.94 3.85 0.08 2.91 2.12 -1.26 -0.73 118.70 121.73 1b52 s GLU 396 Ca 0.10 1.27 -0.16 0.00 0.36 0.00 0.00 54.97 56.54 1b52 s GLU 396 Cb 0.08 -2.11 -0.04 0.00 0.26 0.00 0.00 34.13 32.32 1b52 s GLU 396 CO -0.08 -0.37 1.06 1.87 -0.54 0.00 0.00 175.26 177.20 1b52 n TRP 397 N -1.04 -0.22 -0.26 5.30 -0.00 -1.26 -0.38 117.44 119.57 1b52 n TRP 397 Ca 0.09 0.63 0.04 0.00 -0.00 0.00 0.00 57.50 58.25 1b52 n TRP 397 Cb 0.53 -0.50 0.18 0.00 -0.00 0.00 0.00 31.31 31.51 1b52 n TRP 397 CO 0.00 0.00 0.00 -0.22 -0.00 0.00 0.00 177.69 177.47 1b52 h LYS 398 N 0.00 0.54 -0.02 5.87 3.11 -1.93 -1.56 116.57 122.57 1b52 h LYS 398 Ca 0.08 -0.03 -0.16 0.00 -2.81 0.00 0.00 60.65 57.73 1b52 h LYS 398 Cb 0.21 -0.12 0.01 0.00 -1.00 0.00 0.00 32.23 31.33 1b52 h LYS 398 CO -0.47 0.36 -0.60 1.15 -2.81 0.00 0.00 179.45 177.07 1b52 h THR 399 N 0.55 1.41 -0.57 1.00 2.02 -1.09 -2.42 112.91 113.81 1b52 h THR 399 Ca 0.40 -2.04 0.12 0.00 0.77 0.00 0.00 66.41 65.66 1b52 h THR 399 Cb 0.52 2.51 -0.10 0.00 -1.74 0.00 0.00 68.15 69.34 1b52 h THR 399 CO -0.34 0.60 -0.08 0.15 0.37 0.00 0.00 175.52 176.22 1b52 h PHE 400 N -0.04 -0.19 -0.75 3.16 3.57 -0.76 0.40 116.94 122.33 1b52 h PHE 400 Ca -0.07 0.05 -0.05 0.00 3.53 0.00 0.00 57.97 61.43 1b52 h PHE 400 Cb 1.30 0.17 -0.03 0.00 2.79 0.00 0.00 35.95 40.18 1b52 h PHE 400 CO 0.14 -0.21 0.27 -0.07 -2.23 0.00 0.00 178.31 176.21 1b52 h LEU 401 N 0.05 1.05 -0.30 0.59 3.38 -1.22 -1.91 115.31 116.95 1b52 h LEU 401 Ca 0.29 -0.18 -0.11 0.00 0.09 0.00 0.00 57.88 57.97 1b52 h LEU 401 Cb 0.45 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.92 1b52 h LEU 401 CO -0.55 0.95 -0.23 -0.78 0.09 0.00 0.00 178.44 177.92 1b52 h ASP 402 N 1.10 0.73 -0.38 -0.43 3.58 -0.74 -2.30 116.42 117.98 1b52 h ASP 402 Ca 0.25 -0.45 0.05 0.00 0.42 0.00 0.00 57.03 57.30 1b52 h ASP 402 Cb 0.25 -0.20 -0.05 0.00 1.72 0.00 0.00 39.33 41.05 1b52 h ASP 402 CO -0.02 1.02 0.10 0.74 -2.88 0.00 0.00 179.24 178.21 1b52 h THR 403 N 0.44 0.84 -0.06 2.25 2.02 0.03 -1.31 112.91 117.13 1b52 h THR 403 Ca 0.06 -0.08 -0.00 0.00 0.77 0.00 0.00 66.41 67.15 1b52 h THR 403 Cb 0.79 0.58 -0.00 0.00 -1.74 0.00 0.00 68.15 67.77 1b52 h THR 403 CO 0.06 0.04 0.03 0.03 0.37 0.00 0.00 175.52 176.06 1b52 h ARG 404 N 0.24 0.08 -0.97 6.66 3.08 -1.20 0.11 114.38 122.38 1b52 h ARG 404 Ca 0.18 -0.01 0.15 0.00 0.07 0.00 0.00 59.98 60.37 1b52 h ARG 404 Cb 0.19 -0.02 -0.09 0.00 0.08 0.00 0.00 29.97 30.13 1b52 h ARG 404 CO -0.21 0.15 0.58 0.45 -1.07 0.00 0.00 179.97 179.87 1b52 h HIS 405 N -0.01 1.04 0.00 3.04 3.86 -1.28 -2.40 115.15 119.41 1b52 h HIS 405 Ca 0.02 0.03 -0.07 0.00 -1.16 0.00 0.00 60.37 59.20 1b52 h HIS 405 Cb 0.09 -0.32 -0.01 0.00 1.06 0.00 0.00 27.41 28.24 1b52 h HIS 405 CO -0.04 0.32 -0.32 1.96 0.86 0.00 0.00 177.93 180.71 1b52 h GLN 406 N 0.83 0.00 0.00 2.45 4.20 -0.88 -3.48 115.11 118.24 1b52 h GLN 406 Ca 0.52 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.23 1b52 h GLN 406 Cb 0.67 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.45 1b52 h GLN 406 CO -0.33 0.32 0.00 0.41 -0.67 0.00 0.00 178.83 178.56 1b52 n GLY 407 N 0.64 0.87 2.73 3.46 0.00 0.34 -4.97 105.19 108.25 1b52 n GLY 407 Ca 0.01 -0.03 -0.40 0.00 0.00 0.00 0.00 46.02 45.59 1b52 n GLY 407 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1b52 n THR 408 N -2.26 5.30 -3.69 2.61 -2.24 -1.11 -4.84 114.28 108.05 1b52 n THR 408 Ca 0.00 -5.46 -0.10 0.00 -2.27 0.00 0.00 64.05 56.22 1b52 n THR 408 Cb 0.00 -1.45 -0.04 0.00 -2.10 0.00 0.00 70.33 66.74 1b52 n THR 408 CO 0.00 0.00 0.00 0.72 -0.57 0.00 0.00 175.07 175.22 1b52 s PHE 409 N -4.25 -0.15 -0.05 4.78 -0.71 -1.26 -4.93 117.98 111.41 1b52 s PHE 409 Ca 0.43 -0.18 -0.05 0.00 -1.04 0.00 0.00 56.93 56.09 1b52 s PHE 409 Cb 0.27 0.34 -0.02 0.00 -1.21 0.00 0.00 43.02 42.40 1b52 s PHE 409 CO -0.22 -0.83 -0.10 -0.25 -1.34 0.00 0.00 175.22 172.48 1b52 n ASP 410 N -0.30 0.59 -3.97 1.98 8.00 -1.26 -4.74 116.55 116.84 1b52 n ASP 410 Ca -0.12 0.13 -0.19 0.00 0.71 0.00 0.00 54.79 55.32 1b52 n ASP 410 Cb 0.63 -0.58 -0.15 0.00 -0.02 0.00 0.00 41.12 41.00 1b52 n ASP 410 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1b52 s VAL 411 N -1.56 0.63 0.02 2.53 1.01 -1.12 -1.13 120.40 120.80 1b52 s VAL 411 Ca -0.08 -0.28 0.03 0.00 0.00 0.00 0.00 61.98 61.65 1b52 s VAL 411 Cb 0.01 -0.58 -0.02 0.00 0.00 0.00 0.00 36.38 35.80 1b52 s VAL 411 CO 0.12 0.21 -0.10 0.00 0.00 0.00 0.00 175.10 175.33 1b52 s ALA 412 N 0.25 0.78 0.32 5.51 0.00 -0.26 -1.16 121.76 127.20 1b52 s ALA 412 Ca -0.03 -0.60 -0.29 0.00 0.00 0.00 0.00 51.96 51.04 1b52 s ALA 412 Cb -0.08 -0.11 -0.10 0.00 0.00 0.00 0.00 23.12 22.83 1b52 s ALA 412 CO 0.00 0.13 1.24 0.50 0.00 0.00 0.00 175.76 177.63 1b52 s ARG 413 N -0.86 4.43 0.13 0.00 3.00 0.35 0.88 118.95 126.89 1b52 s ARG 413 Ca -0.01 2.08 -0.11 0.00 -1.00 0.00 0.00 55.73 56.68 1b52 s ARG 413 Cb -0.06 -3.09 0.01 0.00 0.00 0.00 0.00 34.95 31.80 1b52 s ARG 413 CO 0.00 -0.07 0.30 0.00 0.00 0.00 0.00 175.30 175.54 1b52 s ALA 414 N -1.16 -0.38 -0.12 6.12 0.00 0.11 -4.79 121.76 121.55 1b52 s ALA 414 Ca 0.48 -0.54 -0.08 0.00 0.00 0.00 0.00 51.96 51.81 1b52 s ALA 414 Cb -0.37 0.69 0.04 0.00 0.00 0.00 0.00 23.12 23.48 1b52 s ALA 414 CO 0.49 -0.61 0.29 0.20 0.00 0.00 0.00 175.76 176.13 1b52 s GLY 415 N -2.89 -0.21 -0.07 0.00 0.00 -1.26 -0.71 107.32 102.18 1b52 s GLY 415 Ca 0.09 1.01 0.03 0.00 0.00 0.00 0.00 44.72 45.84 1b52 s GLY 415 CO -0.07 1.07 -0.15 0.86 0.00 0.00 0.00 173.10 174.82 1b52 s TRP 416 N 0.77 1.72 -0.08 1.90 -0.11 -0.93 -4.98 118.94 117.22 1b52 s TRP 416 Ca -0.05 -0.66 -0.01 0.00 1.22 0.00 0.00 56.10 56.61 1b52 s TRP 416 Cb -0.06 -1.22 -0.03 0.00 -1.50 0.00 0.00 33.47 30.66 1b52 s TRP 416 CO -0.05 -0.31 -0.04 0.00 -4.62 0.00 0.00 176.95 171.93 1b52 n ALA 418 N 2.35 0.41 0.00 0.00 0.00 -0.44 -4.92 120.51 117.91 1b52 n ALA 418 Ca -0.18 0.23 0.08 0.00 0.00 0.00 0.00 53.44 53.56 1b52 n ALA 418 Cb 0.53 -2.12 -0.13 0.00 0.00 0.00 0.00 19.45 17.73 1b52 n ALA 418 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1b52 n ASP 419 N 0.38 0.21 -3.72 0.00 8.00 -1.26 -4.95 116.55 115.20 1b52 n ASP 419 Ca 0.09 0.08 -0.14 0.00 0.71 0.00 0.00 54.79 55.53 1b52 n ASP 419 Cb 0.40 1.48 -0.09 0.00 -0.02 0.00 0.00 41.12 42.89 1b52 n ASP 419 CO 0.00 0.00 0.00 -0.72 -0.39 0.00 0.00 177.20 176.09 1b52 s TYR 420 N -3.32 -0.32 -1.21 1.24 1.13 -1.26 -4.72 117.35 108.89 1b52 s TYR 420 Ca -0.07 0.62 -0.19 0.00 -1.41 0.00 0.00 57.07 56.03 1b52 s TYR 420 Cb 0.12 0.15 0.08 0.00 -1.10 0.00 0.00 41.96 41.21 1b52 s TYR 420 CO 0.87 -0.37 1.61 1.21 -2.51 0.00 0.00 175.55 176.36 1b52 s ASN 421 N -0.87 6.77 -0.28 -0.18 3.84 -1.26 -4.64 114.94 118.32 1b52 s ASN 421 Ca -0.09 -2.25 -0.24 0.00 0.21 0.00 0.00 52.86 50.49 1b52 s ASN 421 Cb -0.04 -2.55 0.13 0.00 -0.55 0.00 0.00 41.25 38.24 1b52 s ASN 421 CO 0.04 -1.20 1.05 -0.70 -2.79 0.00 0.00 177.10 173.49 1b52 s GLU 422 N 4.06 0.47 0.62 0.43 -6.30 -1.26 -4.45 118.70 112.27 1b52 s GLU 422 Ca 0.50 0.58 0.32 0.00 -2.50 0.00 0.00 54.97 53.87 1b52 s GLU 422 Cb 0.02 0.22 1.79 0.00 0.00 0.00 0.00 34.13 36.16 1b52 s GLU 422 CO 0.02 -0.06 2.10 -1.35 0.02 0.00 0.00 175.26 175.99 1b52 h PRO 423 N 4.30 0.00 0.00 4.30 0.11 -1.88 -1.21 132.00 137.63 1b52 h PRO 423 Ca -0.28 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.83 1b52 h PRO 423 Cb 1.18 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.29 1b52 h PRO 423 CO 0.12 0.00 0.00 1.79 -0.21 0.00 0.00 178.00 179.70 1b52 h THR 424 N 0.00 0.00 -0.43 -1.15 1.35 -1.96 -1.51 112.91 109.21 1b52 h THR 424 Ca 0.06 -0.31 -0.02 0.00 -0.55 0.00 0.00 66.41 65.59 1b52 h THR 424 Cb 0.47 1.12 -0.02 0.00 -1.73 0.00 0.00 68.15 67.99 1b52 h THR 424 CO -0.00 0.00 0.19 -1.28 -0.25 0.00 0.00 175.52 174.18 1b52 h SER 425 N 0.00 0.53 0.00 5.36 0.87 -1.48 0.91 113.55 119.75 1b52 h SER 425 Ca 0.00 -0.05 -0.02 0.00 -1.23 0.00 0.00 61.79 60.49 1b52 h SER 425 Cb 0.46 -0.14 -0.00 0.00 -0.44 0.00 0.00 62.40 62.28 1b52 h SER 425 CO 0.00 0.47 -0.26 -0.26 -0.53 0.00 0.00 176.83 176.25 1b52 h PHE 426 N 0.60 0.00 -0.43 2.24 -1.00 -1.54 -3.42 116.94 113.39 1b52 h PHE 426 Ca 0.15 0.00 0.05 0.00 2.81 0.00 0.00 57.97 60.98 1b52 h PHE 426 Cb 0.09 0.00 -0.02 0.00 3.61 0.00 0.00 35.95 39.63 1b52 h PHE 426 CO 0.00 0.29 0.29 -0.07 -1.61 0.00 0.00 178.31 177.22 1b52 h LEU 427 N -1.00 0.31 -2.28 1.54 3.38 -1.20 -2.08 115.31 113.98 1b52 h LEU 427 Ca -0.03 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.94 1b52 h LEU 427 Cb 0.42 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.10 1b52 h LEU 427 CO -0.02 0.21 0.00 0.78 0.09 0.00 0.00 178.44 179.50 1b52 h ASN 428 N 0.36 0.00 0.71 -0.43 2.35 -1.05 -2.01 115.58 115.51 1b52 h ASN 428 Ca 0.19 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.94 1b52 h ASN 428 Cb 0.28 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.65 1b52 h ASN 428 CO -0.04 0.00 -0.00 0.35 -1.65 0.00 0.00 177.43 176.09 1b52 n THR 429 N -3.01 0.00 0.46 2.81 -2.24 -0.78 -2.62 114.28 108.90 1b52 n THR 429 Ca -0.01 -0.00 0.10 0.00 -2.27 0.00 0.00 64.05 61.86 1b52 n THR 429 Cb 0.16 -0.50 0.14 0.00 -2.10 0.00 0.00 70.33 68.03 1b52 n THR 429 CO 0.00 0.00 0.00 0.23 -0.57 0.00 0.00 175.07 174.73 1b52 n MET 430 N -1.36 2.00 -2.08 -0.78 2.81 -0.75 -3.17 117.12 113.79 1b52 n MET 430 Ca 0.12 -1.89 -0.39 0.00 -1.81 0.00 0.00 57.70 53.73 1b52 n MET 430 Cb 0.27 -1.40 -0.00 0.00 -0.71 0.00 0.00 33.22 31.39 1b52 n MET 430 CO 0.00 0.00 0.00 -0.51 1.51 0.00 0.00 175.97 176.97 1b52 s LEU 431 N -1.41 4.12 0.26 4.03 1.43 -1.08 -4.79 118.68 121.24 1b52 s LEU 431 Ca 0.28 2.56 -0.02 0.00 -1.03 0.00 0.00 54.13 55.92 1b52 s LEU 431 Cb 0.17 -4.04 0.56 0.00 0.03 0.00 0.00 46.19 42.91 1b52 s LEU 431 CO 0.25 -0.95 1.69 0.28 0.23 0.00 0.00 176.35 177.85 1b52 h SER 432 N 2.37 0.13 -0.62 2.29 0.02 -1.89 -0.84 113.55 115.01 1b52 h SER 432 Ca -0.50 0.15 0.00 0.00 -0.84 0.00 0.00 61.79 60.60 1b52 h SER 432 Cb 1.25 0.17 0.00 0.00 0.14 0.00 0.00 62.40 63.97 1b52 h SER 432 CO 0.61 -0.02 0.00 -0.90 -1.14 0.00 0.00 176.83 175.38 1b52 n ASP 433 N -5.11 4.28 -4.77 3.07 5.75 -1.26 -4.91 116.55 113.60 1b52 n ASP 433 Ca 0.17 -2.33 -0.41 0.00 -0.01 0.00 0.00 54.79 52.22 1b52 n ASP 433 Cb 0.53 -0.54 -0.02 0.00 -1.03 0.00 0.00 41.12 40.06 1b52 n ASP 433 CO 0.00 0.00 0.00 -0.55 -0.11 0.00 0.00 177.20 176.54 1b52 s SER 434 N -0.89 6.73 0.47 -1.12 0.15 -0.32 -4.90 113.70 113.81 1b52 s SER 434 Ca 0.47 2.73 0.32 0.00 0.70 0.00 0.00 55.95 60.16 1b52 s SER 434 Cb 0.29 -2.65 1.44 0.00 -1.71 0.00 0.00 66.02 63.39 1b52 s SER 434 CO 0.24 -0.57 1.94 0.77 1.20 0.00 0.00 173.24 176.83 1b52 h SER 435 N 3.35 0.00 -0.62 5.45 4.64 -1.91 -2.87 113.55 121.59 1b52 h SER 435 Ca -0.49 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.83 1b52 h SER 435 Cb 1.23 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.32 1b52 h SER 435 CO 0.65 0.00 0.00 0.59 -0.87 0.00 0.00 176.83 177.20 1b52 n ASN 436 N -2.76 3.37 -4.16 4.97 4.13 -1.25 -4.78 115.26 114.77 1b52 n ASN 436 Ca 0.00 -2.02 -0.43 0.00 1.68 0.00 0.00 54.58 53.82 1b52 n ASN 436 Cb 0.21 -0.42 0.00 0.00 -1.54 0.00 0.00 39.78 38.03 1b52 n ASN 436 CO 0.00 0.00 0.00 -3.20 0.28 0.00 0.00 177.26 174.34 1b52 n ASN 437 N 1.31 4.44 0.03 6.41 2.85 -1.09 -4.64 115.26 124.57 1b52 n ASN 437 Ca 0.21 -2.88 0.13 0.00 -0.11 0.00 0.00 54.58 51.92 1b52 n ASN 437 Cb 0.54 -1.70 0.41 0.00 1.24 0.00 0.00 39.78 40.27 1b52 n ASN 437 CO 0.00 0.00 0.00 0.35 -2.11 0.00 0.00 177.26 175.50 1b52 n THR 438 N 5.72 0.14 0.39 -0.44 -2.24 -1.26 -2.62 114.28 113.97 1b52 n THR 438 Ca 0.50 -0.08 0.14 0.00 -2.27 0.00 0.00 64.05 62.33 1b52 n THR 438 Cb 0.43 -0.24 0.47 0.00 -2.10 0.00 0.00 70.33 68.89 1b52 n THR 438 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1b52 h ALA 439 N 2.85 1.00 -3.38 6.98 0.00 -1.83 -3.45 119.26 121.43 1b52 h ALA 439 Ca 0.00 0.00 -0.37 0.00 0.00 0.00 0.00 54.91 54.54 1b52 h ALA 439 Cb 0.57 0.00 0.02 0.00 0.00 0.00 0.00 17.79 18.38 1b52 h ALA 439 CO 0.00 0.00 -0.51 0.72 0.00 0.00 0.00 179.25 179.46 1b52 n HIS 440 N -2.63 -1.35 -3.02 0.00 8.25 -1.08 -1.68 115.22 113.71 1b52 n HIS 440 Ca 0.03 0.25 -0.40 0.00 -0.26 0.00 0.00 57.72 57.34 1b52 n HIS 440 Cb 0.35 -3.91 -0.05 0.00 1.12 0.00 0.00 29.99 27.50 1b52 n HIS 440 CO 0.00 0.00 0.00 -0.47 0.64 0.00 0.00 176.34 176.51 1b52 s TYR 441 N -3.03 3.79 -0.19 4.41 5.04 -1.26 -4.18 117.35 121.93 1b52 s TYR 441 Ca 0.15 1.48 -0.02 0.00 -2.44 0.00 0.00 57.07 56.23 1b52 s TYR 441 Cb -0.06 -2.76 0.06 0.00 0.35 0.00 0.00 41.96 39.54 1b52 s TYR 441 CO 0.18 0.37 0.03 0.15 -1.34 0.00 0.00 175.55 174.94 1b52 s LYS 442 N -0.45 0.74 -0.13 4.97 1.02 -1.26 -4.24 119.74 120.39 1b52 s LYS 442 Ca 0.36 -0.45 -0.04 0.00 0.02 0.00 0.00 55.97 55.86 1b52 s LYS 442 Cb -0.21 -2.12 0.05 0.00 -0.52 0.00 0.00 37.83 35.03 1b52 s LYS 442 CO 0.23 -0.62 0.07 0.45 -0.92 0.00 0.00 175.35 174.56 1b52 s SER 443 N 1.82 2.07 0.44 2.83 0.15 -1.26 -5.00 113.70 114.74 1b52 s SER 443 Ca -0.01 -0.43 0.13 0.00 0.70 0.00 0.00 55.95 56.34 1b52 s SER 443 Cb -0.17 -0.28 1.02 0.00 -1.71 0.00 0.00 66.02 64.88 1b52 s SER 443 CO -0.08 -0.31 2.00 -0.65 1.20 0.00 0.00 173.24 175.41 1b52 h PRO 444 N 8.40 0.40 -0.46 5.44 0.11 -1.99 -1.85 132.00 142.03 1b52 h PRO 444 Ca -0.15 -0.02 -0.11 0.00 0.11 0.00 0.00 66.00 65.83 1b52 h PRO 444 Cb 1.14 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 32.14 1b52 h PRO 444 CO 0.26 0.26 -0.13 0.00 -0.21 0.00 0.00 178.00 178.19 1b52 h ALA 445 N 1.72 0.64 -0.17 -0.75 0.00 -2.00 -2.43 119.26 116.28 1b52 h ALA 445 Ca 0.24 -0.35 -0.00 0.00 0.00 0.00 0.00 54.91 54.80 1b52 h ALA 445 Cb 0.42 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 1b52 h ALA 445 CO -0.06 0.56 0.09 0.35 0.00 0.00 0.00 179.25 180.18 1b52 h PHE 446 N 0.75 0.23 -0.92 0.00 3.57 -1.77 -2.50 116.94 116.30 1b52 h PHE 446 Ca 0.12 -0.00 0.05 0.00 3.53 0.00 0.00 57.97 61.66 1b52 h PHE 446 Cb 0.68 -0.07 -0.06 0.00 2.79 0.00 0.00 35.95 39.29 1b52 h PHE 446 CO 0.05 0.21 0.59 -0.44 -2.23 0.00 0.00 178.31 176.49 1b52 h ASP 447 N 0.17 0.96 0.14 0.41 3.32 -1.22 -2.41 116.42 117.79 1b52 h ASP 447 Ca 0.06 0.00 -0.16 0.00 0.02 0.00 0.00 57.03 56.95 1b52 h ASP 447 Cb 0.06 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 39.40 1b52 h ASP 447 CO -0.01 0.64 -0.60 0.50 -1.72 0.00 0.00 179.24 178.05 1b52 h LYS 448 N 1.12 0.46 -0.44 3.56 1.63 -1.39 0.12 116.57 121.64 1b52 h LYS 448 Ca 0.38 -0.32 -0.06 0.00 -0.85 0.00 0.00 60.65 59.80 1b52 h LYS 448 Cb 0.07 0.05 -0.02 0.00 -0.60 0.00 0.00 32.23 31.72 1b52 h LYS 448 CO -0.14 0.93 0.03 -0.07 -3.45 0.00 0.00 179.45 176.75 1b52 h LEU 449 N 0.35 0.66 0.00 5.20 3.38 -0.97 -1.40 115.31 122.52 1b52 h LEU 449 Ca -0.00 -0.14 -0.15 0.00 0.09 0.00 0.00 57.88 57.68 1b52 h LEU 449 Cb 1.15 -0.17 0.01 0.00 0.09 0.00 0.00 40.66 41.74 1b52 h LEU 449 CO 0.11 0.71 -0.60 0.40 0.09 0.00 0.00 178.44 179.14 1b52 h ILE 450 N 0.66 1.43 -0.13 1.22 1.08 -1.05 -3.18 117.51 117.55 1b52 h ILE 450 Ca 0.14 -2.10 -0.01 0.00 -0.39 0.00 0.00 64.86 62.50 1b52 h ILE 450 Cb 0.37 2.63 -0.01 0.00 -3.07 0.00 0.00 36.82 36.74 1b52 h ILE 450 CO 0.01 0.61 0.01 0.00 -0.69 0.00 0.00 178.15 178.09 1b52 h ALA 451 N 0.31 1.79 0.00 1.87 0.00 -0.52 -1.28 119.26 121.42 1b52 h ALA 451 Ca -0.08 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.76 1b52 h ALA 451 Cb 1.32 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.05 1b52 h ALA 451 CO 0.12 0.17 0.00 -0.44 0.00 0.00 0.00 179.25 179.10 1b52 h ASP 452 N 0.18 0.00 1.29 0.00 3.32 -1.28 -2.90 116.42 117.03 1b52 h ASP 452 Ca 0.05 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.08 1b52 h ASP 452 Cb 0.11 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.65 1b52 h ASP 452 CO -0.00 0.00 -0.09 0.71 -1.72 0.00 0.00 179.24 178.14 1b52 h THR 453 N 0.00 0.20 -0.07 0.35 1.35 -1.21 -2.66 112.91 110.88 1b52 h THR 453 Ca 0.00 -0.92 0.00 0.00 -0.55 0.00 0.00 66.41 64.94 1b52 h THR 453 Cb 0.35 1.77 0.00 0.00 -1.73 0.00 0.00 68.15 68.54 1b52 h THR 453 CO 0.00 0.09 0.00 0.18 -0.25 0.00 0.00 175.52 175.54 1b52 n LEU 454 N -3.18 1.31 -0.16 3.87 4.32 -1.09 -3.88 117.00 118.18 1b52 n LEU 454 Ca 0.01 -0.49 0.03 0.00 -0.02 0.00 0.00 56.01 55.55 1b52 n LEU 454 Cb 0.43 -0.04 -0.00 0.00 -1.62 0.00 0.00 43.42 42.18 1b52 n LEU 454 CO 0.32 0.25 0.19 0.29 -1.22 0.00 0.00 177.39 177.21 1b52 n LYS 455 N 0.05 2.23 -1.59 3.23 5.02 -1.01 -4.57 118.16 121.51 1b52 n LYS 455 Ca 0.18 -0.51 -0.29 0.00 -2.02 0.00 0.00 58.31 55.67 1b52 n LYS 455 Cb 0.30 -0.99 0.11 0.00 -0.02 0.00 0.00 35.03 34.43 1b52 n LYS 455 CO 0.00 0.00 0.00 0.14 -0.52 0.00 0.00 177.40 177.02 1b52 s VAL 456 N -1.07 2.39 -0.09 -0.18 -7.23 -1.16 -4.97 120.40 108.08 1b52 s VAL 456 Ca 0.06 0.13 0.15 0.00 -1.81 0.00 0.00 61.98 60.50 1b52 s VAL 456 Cb 0.06 -2.91 -0.23 0.00 0.56 0.00 0.00 36.38 33.86 1b52 s VAL 456 CO 0.17 -0.16 0.52 0.00 -0.31 0.00 0.00 175.10 175.32 1b52 n ALA 457 N -3.59 1.57 -2.63 1.32 0.00 -1.26 -5.00 120.51 110.92 1b52 n ALA 457 Ca 0.07 -0.89 -0.21 0.00 0.00 0.00 0.00 53.44 52.41 1b52 n ALA 457 Cb 0.58 -0.68 -0.12 0.00 0.00 0.00 0.00 19.45 19.23 1b52 n ALA 457 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1b52 s ASP 458 N -5.87 2.02 0.44 0.00 2.15 -1.26 -5.06 116.67 109.10 1b52 s ASP 458 Ca -0.06 -0.62 0.13 0.00 0.43 0.00 0.00 52.55 52.42 1b52 s ASP 458 Cb 0.08 -0.09 0.99 0.00 -0.30 0.00 0.00 42.92 43.59 1b52 s ASP 458 CO 0.83 -0.01 2.01 0.44 -0.17 0.00 0.00 175.17 178.27 1b52 h ASP 459 N 4.29 0.11 -0.38 -0.34 3.32 -1.98 -2.03 116.42 119.41 1b52 h ASP 459 Ca -0.43 -0.01 -0.13 0.00 0.02 0.00 0.00 57.03 56.48 1b52 h ASP 459 Cb 1.19 -0.03 -0.01 0.00 0.22 0.00 0.00 39.33 40.69 1b52 h ASP 459 CO 0.40 0.21 -0.26 0.00 -1.72 0.00 0.00 179.24 177.88 1b52 h THR 460 N 0.12 1.27 -0.56 0.35 1.03 -1.99 -1.31 112.91 111.83 1b52 h THR 460 Ca 0.03 -1.41 -0.06 0.00 -0.01 0.00 0.00 66.41 64.95 1b52 h THR 460 Cb 0.22 1.22 -0.02 0.00 -1.07 0.00 0.00 68.15 68.50 1b52 h THR 460 CO 0.01 0.48 0.11 -0.61 -0.01 0.00 0.00 175.52 175.50 1b52 h GLN 461 N 0.76 0.91 -0.40 0.00 4.15 -1.96 -2.43 115.11 116.14 1b52 h GLN 461 Ca 0.09 -0.23 -0.00 0.00 0.77 0.00 0.00 58.65 59.28 1b52 h GLN 461 Cb 0.82 -0.11 -0.02 0.00 0.21 0.00 0.00 27.48 28.38 1b52 h GLN 461 CO 0.07 0.86 0.25 -0.09 -1.93 0.00 0.00 178.83 177.99 1b52 h ARG 462 N 0.80 0.54 -0.13 1.69 2.43 -0.93 -2.09 114.38 116.68 1b52 h ARG 462 Ca 0.17 -0.04 -0.09 0.00 -0.81 0.00 0.00 59.98 59.20 1b52 h ARG 462 Cb 0.38 -0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 29.81 1b52 h ARG 462 CO 0.01 0.39 -0.33 0.77 -1.51 0.00 0.00 179.97 179.30 1b52 h SER 463 N 0.53 0.26 -0.36 -3.80 0.02 -1.22 -1.78 113.55 107.19 1b52 h SER 463 Ca 0.14 -0.09 -0.15 0.00 -0.84 0.00 0.00 61.79 60.85 1b52 h SER 463 Cb -0.01 -0.07 -0.01 0.00 0.14 0.00 0.00 62.40 62.45 1b52 h SER 463 CO -0.03 0.58 -0.35 -0.33 -1.14 0.00 0.00 176.83 175.57 1b52 h GLU 464 N 0.23 0.91 -0.31 3.45 5.08 -1.20 -1.80 114.58 120.93 1b52 h GLU 464 Ca 0.03 -0.46 -0.07 0.00 -1.00 0.00 0.00 59.36 57.86 1b52 h GLU 464 Cb 0.70 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.94 1b52 h GLU 464 CO 0.05 1.11 -0.11 -0.07 -1.00 0.00 0.00 179.01 178.99 1b52 h LEU 465 N 0.75 0.51 -0.78 1.33 3.38 -0.83 -1.13 115.31 118.55 1b52 h LEU 465 Ca 0.07 -0.13 -0.01 0.00 0.09 0.00 0.00 57.88 57.90 1b52 h LEU 465 Cb 0.93 -0.14 -0.04 0.00 0.09 0.00 0.00 40.66 41.51 1b52 h LEU 465 CO 0.09 0.66 0.46 1.88 0.09 0.00 0.00 178.44 181.61 1b52 h TYR 466 N 0.49 1.05 -0.46 1.13 0.05 -1.11 0.44 116.97 118.56 1b52 h TYR 466 Ca 0.09 -0.01 -0.11 0.00 0.05 0.00 0.00 58.73 58.75 1b52 h TYR 466 Cb 0.49 -0.34 -0.02 0.00 1.01 0.00 0.00 36.73 37.88 1b52 h TYR 466 CO 0.02 0.72 -0.15 0.00 -1.05 0.00 0.00 178.16 177.69 1b52 h ALA 467 N 1.24 0.87 -0.10 3.88 0.00 -0.64 -2.27 119.26 122.24 1b52 h ALA 467 Ca 0.28 -0.35 -0.15 0.00 0.00 0.00 0.00 54.91 54.69 1b52 h ALA 467 Cb -0.01 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 1b52 h ALA 467 CO -0.05 0.64 -0.60 0.87 0.00 0.00 0.00 179.25 180.11 1b52 h LYS 468 N 0.77 0.34 -0.78 0.00 1.57 -0.29 -1.75 116.57 116.44 1b52 h LYS 468 Ca 0.12 -0.23 -0.03 0.00 -1.87 0.00 0.00 60.65 58.63 1b52 h LYS 468 Cb 0.67 0.03 -0.04 0.00 0.08 0.00 0.00 32.23 32.98 1b52 h LYS 468 CO 0.05 0.84 0.37 0.00 -0.57 0.00 0.00 179.45 180.14 1b52 h ALA 469 N 1.11 1.01 -0.56 3.86 0.00 -0.66 0.64 119.26 124.66 1b52 h ALA 469 Ca -0.00 -0.16 -0.07 0.00 0.00 0.00 0.00 54.91 54.68 1b52 h ALA 469 Cb 1.12 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 18.58 1b52 h ALA 469 CO 0.10 0.58 0.07 0.93 0.00 0.00 0.00 179.25 180.93 1b52 h GLU 470 N 1.11 0.91 -0.14 0.00 4.39 -1.28 -1.86 114.58 117.71 1b52 h GLU 470 Ca 0.27 -0.23 -0.13 0.00 0.34 0.00 0.00 59.36 59.61 1b52 h GLU 470 Cb 0.13 -0.12 -0.01 0.00 -0.10 0.00 0.00 28.75 28.65 1b52 h GLU 470 CO -0.03 0.86 -0.47 1.96 -1.16 0.00 0.00 179.01 180.17 1b52 h GLN 471 N 0.86 0.35 -0.39 2.33 4.20 -0.72 -0.46 115.11 121.28 1b52 h GLN 471 Ca 0.17 -0.19 -0.07 0.00 0.06 0.00 0.00 58.65 58.62 1b52 h GLN 471 Cb 0.40 0.01 -0.02 0.00 0.30 0.00 0.00 27.48 28.17 1b52 h GLN 471 CO 0.01 0.75 -0.05 0.37 -0.67 0.00 0.00 178.83 179.24 1b52 h GLN 472 N 0.28 0.65 -0.22 1.46 5.75 -0.22 0.29 115.11 123.11 1b52 h GLN 472 Ca 0.02 -0.17 -0.12 0.00 -0.15 0.00 0.00 58.65 58.23 1b52 h GLN 472 Cb 0.93 -0.08 -0.00 0.00 1.07 0.00 0.00 27.48 29.40 1b52 h GLN 472 CO 0.08 0.70 -0.32 1.25 -2.65 0.00 0.00 178.83 177.89 1b52 h LEU 473 N 0.60 0.65 -0.59 -2.39 5.85 -1.20 -0.85 115.31 117.39 1b52 h LEU 473 Ca 0.12 -0.52 -0.11 0.00 0.84 0.00 0.00 57.88 58.21 1b52 h LEU 473 Cb 0.45 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 41.27 1b52 h LEU 473 CO 0.02 1.05 -0.04 -0.78 -0.34 0.00 0.00 178.44 178.35 1b52 h ASP 474 N 0.28 1.06 0.70 1.25 3.58 -0.92 -0.73 116.42 121.64 1b52 h ASP 474 Ca 0.02 -0.32 -0.09 0.00 0.42 0.00 0.00 57.03 57.06 1b52 h ASP 474 Cb 0.90 -0.29 -0.01 0.00 1.72 0.00 0.00 39.33 41.65 1b52 h ASP 474 CO 0.07 1.13 -0.42 0.07 -2.88 0.00 0.00 179.24 177.22 1b52 h LYS 475 N 0.97 0.00 0.00 0.28 2.10 -0.05 -2.12 116.57 117.75 1b52 h LYS 475 Ca 0.16 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.81 1b52 h LYS 475 Cb 0.61 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.94 1b52 h LYS 475 CO 0.04 0.42 0.00 -0.25 -2.00 0.00 0.00 179.45 177.66 1b52 n ASP 476 N -3.68 0.04 -4.18 7.07 8.00 -0.35 -4.93 116.55 118.51 1b52 n ASP 476 Ca -0.01 0.51 -0.40 0.00 0.71 0.00 0.00 54.79 55.60 1b52 n ASP 476 Cb 0.50 -0.51 -0.03 0.00 -0.02 0.00 0.00 41.12 41.06 1b52 n ASP 476 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 1b52 n SER 477 N -1.54 -1.90 -0.27 -2.24 7.64 -0.31 -4.84 113.62 110.16 1b52 n SER 477 Ca 0.05 -1.29 -0.05 0.00 1.01 0.00 0.00 58.87 58.59 1b52 n SER 477 Cb 0.26 -1.56 0.06 0.00 -1.01 0.00 0.00 64.21 61.96 1b52 n SER 477 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1b52 h ALA 478 N 1.33 0.96 -1.60 -0.43 0.00 -1.81 -3.43 119.26 114.28 1b52 h ALA 478 Ca -0.69 -0.12 -0.56 0.00 0.00 0.00 0.00 54.91 53.55 1b52 h ALA 478 Cb 1.39 -0.30 -0.13 0.00 0.00 0.00 0.00 17.79 18.75 1b52 h ALA 478 CO 0.59 0.47 -0.52 0.96 0.00 0.00 0.00 179.25 180.76 1b52 s ILE 479 N -5.85 0.63 -0.46 0.00 -4.36 -1.26 -4.06 121.20 105.83 1b52 s ILE 479 Ca -0.13 -2.00 -0.00 0.00 -0.26 0.00 0.00 60.65 58.26 1b52 s ILE 479 Cb 0.15 -2.35 0.12 0.00 1.25 0.00 0.00 42.46 41.63 1b52 s ILE 479 CO 0.80 0.00 0.23 -0.69 0.24 0.00 0.00 174.94 175.52 1b52 s VAL 480 N -3.20 3.05 0.16 8.37 1.01 0.16 -4.87 120.40 125.08 1b52 s VAL 480 Ca 0.23 -2.52 -0.32 0.00 0.00 0.00 0.00 61.98 59.37 1b52 s VAL 480 Cb 0.03 -3.10 -0.10 0.00 0.00 0.00 0.00 36.38 33.21 1b52 s VAL 480 CO 0.14 -0.73 1.61 -2.84 0.00 0.00 0.00 175.10 173.28 1b52 s PRO 481 N 0.59 4.20 -0.02 2.72 0.02 -1.26 -1.33 135.00 139.92 1b52 s PRO 481 Ca 0.12 2.40 -0.08 0.00 0.02 0.00 0.00 61.00 63.46 1b52 s PRO 481 Cb -0.22 -3.20 -0.03 0.00 0.02 0.00 0.00 34.50 31.07 1b52 s PRO 481 CO -0.04 -0.65 -0.15 0.28 -0.33 0.00 0.00 177.00 176.11 1b52 n VAL 482 N 4.07 1.34 -3.63 3.83 0.31 -0.19 -4.72 118.33 119.35 1b52 n VAL 482 Ca 0.14 0.29 -0.13 0.00 -0.01 0.00 0.00 64.34 64.64 1b52 n VAL 482 Cb 0.38 -1.91 -0.06 0.00 -0.91 0.00 0.00 33.84 31.34 1b52 n VAL 482 CO 0.00 0.00 0.00 -0.72 -1.32 0.00 0.00 176.83 174.79 1b52 s TYR 483 N -2.38 -0.32 -0.21 3.52 -0.85 -0.96 -1.44 117.35 114.71 1b52 s TYR 483 Ca -0.12 0.30 -0.19 0.00 -0.52 0.00 0.00 57.07 56.54 1b52 s TYR 483 Cb 0.02 0.26 -0.03 0.00 0.38 0.00 0.00 41.96 42.59 1b52 s TYR 483 CO 0.18 -0.60 0.54 0.71 -1.52 0.00 0.00 175.55 174.86 1b52 s TYR 484 N -2.51 3.35 0.81 -3.49 2.02 0.14 0.35 117.35 118.03 1b52 s TYR 484 Ca -0.05 0.78 -0.11 0.00 -0.37 0.00 0.00 57.07 57.32 1b52 s TYR 484 Cb -0.01 -2.71 0.09 0.00 -0.40 0.00 0.00 41.96 38.93 1b52 s TYR 484 CO -0.02 -0.16 1.13 0.71 -1.57 0.00 0.00 175.55 175.64 1b52 s TYR 485 N 1.84 2.15 0.10 2.71 1.51 -0.50 -1.52 117.35 123.65 1b52 s TYR 485 Ca 0.24 1.65 0.05 0.00 -1.01 0.00 0.00 57.07 58.01 1b52 s TYR 485 Cb -0.16 -3.21 -0.04 0.00 -0.11 0.00 0.00 41.96 38.44 1b52 s TYR 485 CO 0.10 -2.26 -0.00 0.14 -1.11 0.00 0.00 175.55 172.41 1b52 s VAL 486 N -2.67 3.94 -0.74 0.71 -7.23 -1.26 -3.44 120.40 109.70 1b52 s VAL 486 Ca 0.65 -1.07 -0.19 0.00 -1.81 0.00 0.00 61.98 59.56 1b52 s VAL 486 Cb -0.21 -2.89 0.11 0.00 0.56 0.00 0.00 36.38 33.95 1b52 s VAL 486 CO 0.55 0.08 0.92 0.21 -0.31 0.00 0.00 175.10 176.55 1b52 s ASN 487 N -2.40 6.38 -0.25 4.85 2.47 0.22 -4.82 114.94 121.38 1b52 s ASN 487 Ca 0.26 -1.62 -0.07 0.00 0.42 0.00 0.00 52.86 51.84 1b52 s ASN 487 Cb -0.11 -2.36 -0.03 0.00 -1.45 0.00 0.00 41.25 37.30 1b52 s ASN 487 CO 0.18 -1.14 0.07 0.00 -3.72 0.00 0.00 177.10 172.49 1b52 s ALA 488 N 2.85 3.16 0.27 1.71 0.00 -1.26 -2.39 121.76 126.11 1b52 s ALA 488 Ca 0.22 -1.13 -0.07 0.00 0.00 0.00 0.00 51.96 50.98 1b52 s ALA 488 Cb -0.15 -2.08 -0.01 0.00 0.00 0.00 0.00 23.12 20.89 1b52 s ALA 488 CO 0.01 -0.49 0.40 -0.98 0.00 0.00 0.00 175.76 174.70 1b52 s ARG 489 N 1.61 1.61 -0.18 0.00 1.70 -0.90 -3.93 118.95 118.86 1b52 s ARG 489 Ca 0.06 -1.51 -0.03 0.00 -0.47 0.00 0.00 55.73 53.79 1b52 s ARG 489 Cb -0.15 0.42 -0.01 0.00 -0.57 0.00 0.00 34.95 34.64 1b52 s ARG 489 CO 0.04 -0.64 -0.07 -0.51 -1.08 0.00 0.00 175.30 173.03 1b52 s LEU 490 N -3.13 2.87 -0.10 -1.89 1.43 -1.25 -0.56 118.68 116.04 1b52 s LEU 490 Ca 0.29 -0.34 0.03 0.00 -1.03 0.00 0.00 54.13 53.08 1b52 s LEU 490 Cb 0.01 -1.70 0.01 0.00 0.03 0.00 0.00 46.19 44.54 1b52 s LEU 490 CO 0.14 0.07 -0.19 -0.69 0.23 0.00 0.00 176.35 175.90 1b52 s VAL 491 N 0.96 1.74 0.76 -1.59 1.01 -0.91 -2.00 120.40 120.37 1b52 s VAL 491 Ca -0.01 -0.81 -0.14 0.00 0.00 0.00 0.00 61.98 61.01 1b52 s VAL 491 Cb -0.15 -1.54 0.06 0.00 0.00 0.00 0.00 36.38 34.75 1b52 s VAL 491 CO 0.00 0.49 1.21 -0.54 0.00 0.00 0.00 175.10 176.26 1b52 s LYS 492 N 0.64 1.91 0.49 2.72 -0.14 -0.65 -4.57 119.74 120.14 1b52 s LYS 492 Ca -0.13 1.79 0.15 0.00 -1.36 0.00 0.00 55.97 56.42 1b52 s LYS 492 Cb -0.16 -1.80 1.14 0.00 -1.68 0.00 0.00 37.83 35.33 1b52 s LYS 492 CO 0.04 -2.01 2.08 -1.35 -0.76 0.00 0.00 175.35 173.34 1b52 h PRO 493 N -0.54 0.00 -0.14 -1.68 0.11 -1.92 -2.57 132.00 125.26 1b52 h PRO 493 Ca -0.47 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 1b52 h PRO 493 Cb 1.30 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.41 1b52 h PRO 493 CO 0.48 0.09 0.00 -2.67 -0.21 0.00 0.00 178.00 175.69 1b52 n TRP 494 N -4.44 0.19 -3.06 0.65 2.14 -1.26 -4.75 117.44 106.90 1b52 n TRP 494 Ca -0.03 -0.09 -0.41 0.00 2.07 0.00 0.00 57.50 59.04 1b52 n TRP 494 Cb 0.16 0.00 -0.06 0.00 -0.81 0.00 0.00 31.31 30.60 1b52 n TRP 494 CO 0.00 0.00 0.00 0.08 2.07 0.00 0.00 177.69 179.84 1b52 s VAL 495 N -1.81 4.89 0.34 -1.67 1.01 -0.97 -0.53 120.40 121.65 1b52 s VAL 495 Ca 0.23 0.96 0.07 0.00 0.00 0.00 0.00 61.98 63.24 1b52 s VAL 495 Cb 0.12 -4.05 -0.02 0.00 0.00 0.00 0.00 36.38 32.43 1b52 s VAL 495 CO 0.18 -0.17 0.36 -0.83 0.00 0.00 0.00 175.10 174.63 1b52 s GLY 496 N 1.63 1.71 0.00 4.51 0.00 0.11 -4.68 107.32 110.60 1b52 s GLY 496 Ca 0.27 -1.58 0.00 0.00 0.00 0.00 0.00 44.72 43.41 1b52 s GLY 496 CO 0.12 -1.50 0.00 0.61 0.00 0.00 0.00 173.10 172.33 1b52 n GLY 497 N -1.47 2.90 3.56 0.20 0.00 -1.26 -1.92 105.19 107.19 1b52 n GLY 497 Ca -0.01 -0.02 -0.40 0.00 0.00 0.00 0.00 46.02 45.59 1b52 n GLY 497 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1b52 s TYR 498 N -2.38 2.50 0.15 1.61 5.04 -1.26 -4.84 117.35 118.16 1b52 s TYR 498 Ca 0.00 -0.79 -0.07 0.00 -2.44 0.00 0.00 57.07 53.77 1b52 s TYR 498 Cb 0.00 -4.67 -0.02 0.00 0.35 0.00 0.00 41.96 37.62 1b52 s TYR 498 CO 0.00 -1.93 1.40 1.79 -1.34 0.00 0.00 175.55 175.48 1b52 h THR 499 N 6.79 1.32 0.00 4.34 1.35 -1.95 -3.47 112.91 121.28 1b52 h THR 499 Ca 0.20 -1.95 0.00 0.00 -0.55 0.00 0.00 66.41 64.11 1b52 h THR 499 Cb 1.01 1.92 0.00 0.00 -1.73 0.00 0.00 68.15 69.35 1b52 h THR 499 CO 1.42 0.61 0.00 0.61 -0.25 0.00 0.00 175.52 177.91 1b52 n GLY 500 N 0.51 0.54 0.16 5.82 0.00 -1.26 -4.94 105.19 106.03 1b52 n GLY 500 Ca -0.05 -0.04 0.12 0.00 0.00 0.00 0.00 46.02 46.06 1b52 n GLY 500 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1b52 n LYS 501 N -2.90 0.55 -2.61 1.61 4.76 -1.26 -4.79 118.16 113.51 1b52 n LYS 501 Ca 0.00 -0.33 -0.43 0.00 -2.87 0.00 0.00 58.31 54.68 1b52 n LYS 501 Cb 0.00 -1.49 -0.02 0.00 -1.84 0.00 0.00 35.03 31.68 1b52 n LYS 501 CO 0.00 0.00 0.00 0.34 -1.37 0.00 0.00 177.40 176.37 1b52 s ASP 502 N -2.68 6.94 0.15 4.39 2.15 -1.26 -4.82 116.67 121.53 1b52 s ASP 502 Ca 0.19 1.14 0.19 0.00 0.43 0.00 0.00 52.55 54.51 1b52 s ASP 502 Cb 0.19 -2.54 0.82 0.00 -0.30 0.00 0.00 42.92 41.08 1b52 s ASP 502 CO 0.59 -0.86 1.60 -0.81 -0.17 0.00 0.00 175.17 175.52 1b52 n PRO 503 N 6.81 0.11 0.00 4.34 -0.04 -1.26 -1.53 135.00 143.43 1b52 n PRO 503 Ca 0.12 0.35 0.11 0.00 -0.04 0.00 0.00 63.50 64.05 1b52 n PRO 503 Cb 0.47 -1.71 0.02 0.00 -0.04 0.00 0.00 33.50 32.24 1b52 n PRO 503 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1b52 n LEU 504 N -1.92 0.74 -3.22 1.53 4.77 -1.26 -1.70 117.00 115.94 1b52 n LEU 504 Ca 0.03 -0.24 -0.23 0.00 -0.03 0.00 0.00 56.01 55.53 1b52 n LEU 504 Cb 0.20 -0.10 0.05 0.00 -2.33 0.00 0.00 43.42 41.24 1b52 n LEU 504 CO 0.17 0.17 0.08 -0.67 -1.33 0.00 0.00 177.39 175.80 1b52 n ASP 505 N -1.60 -6.17 -3.71 -1.43 2.03 -0.58 -4.89 116.55 100.20 1b52 n ASP 505 Ca 0.04 -0.38 -0.42 0.00 0.52 0.00 0.00 54.79 54.55 1b52 n ASP 505 Cb 0.36 -4.94 -0.00 0.00 -0.72 0.00 0.00 41.12 35.81 1b52 n ASP 505 CO 0.00 0.00 0.00 0.59 -1.92 0.00 0.00 177.20 175.87 1b52 n ASN 506 N -2.68 3.91 -4.74 1.67 3.02 -1.26 -4.97 115.26 110.21 1b52 n ASN 506 Ca -0.07 -2.82 -0.41 0.00 -0.03 0.00 0.00 54.58 51.24 1b52 n ASN 506 Cb 0.60 -1.63 -0.03 0.00 -0.61 0.00 0.00 39.78 38.11 1b52 n ASN 506 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1b52 s ILE 507 N 3.28 3.61 -0.16 2.41 -1.09 -1.26 -4.91 121.20 123.09 1b52 s ILE 507 Ca 0.48 1.34 -0.02 0.00 -2.23 0.00 0.00 60.65 60.22 1b52 s ILE 507 Cb 0.14 -3.86 -0.02 0.00 -1.58 0.00 0.00 42.46 37.14 1b52 s ILE 507 CO -0.08 0.21 -0.07 -0.31 -1.23 0.00 0.00 174.94 173.46 1b52 s TYR 508 N 0.02 2.94 0.33 3.97 1.51 -1.26 -4.82 117.35 120.04 1b52 s TYR 508 Ca 0.53 -0.50 0.16 0.00 -1.01 0.00 0.00 57.07 56.25 1b52 s TYR 508 Cb -0.32 -1.94 0.82 0.00 -0.11 0.00 0.00 41.96 40.40 1b52 s TYR 508 CO 0.36 -0.17 1.84 0.28 -1.11 0.00 0.00 175.55 176.75 1b52 h VAL 509 N 5.31 1.08 0.00 0.71 2.07 -1.93 -2.33 116.25 121.17 1b52 h VAL 509 Ca -0.31 -1.24 0.00 0.00 0.82 0.00 0.00 66.70 65.97 1b52 h VAL 509 Cb 1.19 1.70 0.00 0.00 -1.52 0.00 0.00 31.29 32.67 1b52 h VAL 509 CO 0.60 0.34 0.19 0.07 0.02 0.00 0.00 177.57 178.79 1b52 h LYS 510 N 0.00 0.00 -0.02 1.57 2.10 -1.95 0.16 116.57 118.44 1b52 h LYS 510 Ca -0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 1b52 h LYS 510 Cb 0.67 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.00 1b52 h LYS 510 CO 0.04 0.00 -0.36 0.09 -2.00 0.00 0.00 179.45 177.23 1b52 n ASN 511 N -2.27 2.12 -4.97 7.07 3.02 -0.87 -0.72 115.26 118.64 1b52 n ASN 511 Ca -0.01 -1.56 -0.21 0.00 -0.03 0.00 0.00 54.58 52.77 1b52 n ASN 511 Cb 0.22 0.38 0.02 0.00 -0.61 0.00 0.00 39.78 39.79 1b52 n ASN 511 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1b52 s LEU 512 N -2.27 3.19 -0.28 3.41 1.43 0.56 -4.36 118.68 120.36 1b52 s LEU 512 Ca 0.19 -0.83 -0.22 0.00 -1.03 0.00 0.00 54.13 52.25 1b52 s LEU 512 Cb 0.17 -1.83 0.13 0.00 0.03 0.00 0.00 46.19 44.69 1b52 s LEU 512 CO 0.48 -1.03 1.00 -0.72 0.23 0.00 0.00 176.35 176.32 1b52 s TYR 513 N -2.58 -0.53 -0.21 0.29 -0.85 -0.81 -4.30 117.35 108.35 1b52 s TYR 513 Ca 0.52 1.19 -0.24 0.00 -0.52 0.00 0.00 57.07 58.01 1b52 s TYR 513 Cb -0.05 0.37 -0.01 0.00 0.38 0.00 0.00 41.96 42.65 1b52 s TYR 513 CO 0.32 -0.26 0.81 0.42 -1.52 0.00 0.00 175.55 175.32 1b52 s ILE 514 N 0.67 4.87 0.37 -3.49 -1.09 -1.26 0.05 121.20 121.31 1b52 s ILE 514 Ca -0.01 1.56 -0.24 0.00 -2.23 0.00 0.00 60.65 59.72 1b52 s ILE 514 Cb -0.05 -4.11 -0.10 0.00 -1.58 0.00 0.00 42.46 36.62 1b52 s ILE 514 CO -0.10 -0.02 0.96 -0.63 -1.23 0.00 0.00 174.94 173.92 1b52 s ILE 515 N 2.53 4.20 0.03 2.92 1.01 0.31 -0.90 121.20 131.29 1b52 s ILE 515 Ca 0.35 1.64 -0.36 0.00 0.00 0.00 0.00 60.65 62.29 1b52 s ILE 515 Cb -0.16 -3.83 -0.15 0.00 0.01 0.00 0.00 42.46 38.34 1b52 s ILE 515 CO 0.09 -0.03 1.56 1.17 0.00 0.00 0.00 174.94 177.73 1b52 n LYS 516 N 0.06 1.63 0.00 2.79 3.00 0.48 -4.27 118.16 121.85 1b52 n LYS 516 Ca 0.04 0.59 0.00 0.00 -0.00 0.00 0.00 58.31 58.94 1b52 n LYS 516 Cb 0.51 -2.31 0.00 0.00 0.00 0.00 0.00 35.03 33.23 1b52 n LYS 516 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 177.40 175.01