#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2x40 h LYS 3 N 0.00 0.93 0.34 3.49 1.57 -2.03 -0.70 116.57 120.18 2x40 h LYS 3 Ca 0.00 -0.35 -0.01 0.00 -1.87 0.00 0.00 60.65 58.42 2x40 h LYS 3 Cb 0.00 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.24 2x40 h LYS 3 CO 0.00 1.01 -0.24 0.28 -0.57 0.00 0.00 179.45 179.93 2x40 h VAL 4 N 0.79 0.50 0.00 0.50 2.07 -1.99 -1.50 116.25 116.62 2x40 h VAL 4 Ca 0.13 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.65 2x40 h VAL 4 Cb 0.65 0.50 0.00 0.00 -1.52 0.00 0.00 31.29 30.92 2x40 h VAL 4 CO 0.04 0.00 0.00 0.78 0.02 0.00 0.00 177.57 178.41 2x40 h ASN 5 N -0.57 0.00 0.52 0.57 4.21 -1.99 -1.22 115.58 117.11 2x40 h ASN 5 Ca -0.03 0.00 -0.03 0.00 1.21 0.00 0.00 56.30 57.45 2x40 h ASN 5 Cb 0.48 0.00 0.01 0.00 -1.12 0.00 0.00 38.32 37.69 2x40 h ASN 5 CO 0.02 0.00 -0.25 -0.08 -1.29 0.00 0.00 177.43 175.83 2x40 h GLU 6 N 0.00 -0.67 -0.56 0.81 4.57 -0.57 -3.04 114.58 115.12 2x40 h GLU 6 Ca 0.00 0.05 0.06 0.00 -1.18 0.00 0.00 59.36 58.29 2x40 h GLU 6 Cb 0.33 0.15 -0.06 0.00 -0.16 0.00 0.00 28.75 29.02 2x40 h GLU 6 CO 0.00 -0.39 0.26 0.82 -1.18 0.00 0.00 179.01 178.52 2x40 h ILE 7 N -1.10 0.89 -0.67 2.32 2.04 -0.96 -2.73 117.51 117.31 2x40 h ILE 7 Ca -0.07 -0.17 0.11 0.00 1.00 0.00 0.00 64.86 65.73 2x40 h ILE 7 Cb 0.60 0.36 -0.08 0.00 -0.74 0.00 0.00 36.82 36.96 2x40 h ILE 7 CO 0.12 0.09 0.27 0.25 0.00 0.00 0.00 178.15 178.87 2x40 h LEU 8 N 0.48 0.27 -1.03 1.44 5.85 -1.32 0.16 115.31 121.17 2x40 h LEU 8 Ca 0.26 0.09 0.00 0.00 0.84 0.00 0.00 57.88 59.07 2x40 h LEU 8 Cb 0.23 0.06 0.00 0.00 0.37 0.00 0.00 40.66 41.31 2x40 h LEU 8 CO -0.21 0.14 0.00 0.77 -0.34 0.00 0.00 178.44 178.80 2x40 h SER 9 N 0.45 0.00 0.31 1.25 4.64 -1.36 -2.90 113.55 115.94 2x40 h SER 9 Ca 0.35 0.00 -0.33 0.00 -0.47 0.00 0.00 61.79 61.34 2x40 h SER 9 Cb 0.46 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.52 2x40 h SER 9 CO -0.33 0.00 -1.79 1.56 -0.87 0.00 0.00 176.83 175.40 2x40 h GLN 10 N 0.00 0.20 -6.81 4.77 1.08 -0.66 -3.48 115.11 110.21 2x40 h GLN 10 Ca 0.00 -0.34 -0.53 0.00 -1.45 0.00 0.00 58.65 56.33 2x40 h GLN 10 Cb 0.29 0.13 0.09 0.00 -0.05 0.00 0.00 27.48 27.93 2x40 h GLN 10 CO 0.00 1.00 0.87 1.28 -0.95 0.00 0.00 178.83 181.03 2x40 n LEU 11 N -3.36 4.43 -4.86 1.46 4.77 -0.78 -5.01 117.00 113.64 2x40 n LEU 11 Ca -0.23 1.16 -0.30 0.00 -0.03 0.00 0.00 56.01 56.61 2x40 n LEU 11 Cb 1.05 -1.60 0.07 0.00 -2.33 0.00 0.00 43.42 40.62 2x40 n LEU 11 CO 0.46 0.16 0.75 0.42 -1.33 0.00 0.00 177.39 177.84 2x40 s THR 12 N -0.16 2.91 0.20 -5.08 -4.23 -1.26 -4.88 115.64 103.14 2x40 s THR 12 Ca 0.62 0.30 -0.11 0.00 -1.18 0.00 0.00 61.69 61.32 2x40 s THR 12 Cb -0.49 -3.21 0.12 0.00 1.34 0.00 0.00 72.50 70.25 2x40 s THR 12 CO 0.51 -0.39 1.79 0.25 -0.54 0.00 0.00 174.62 176.24 2x40 h LEU 13 N -0.92 0.42 -0.84 4.79 5.85 -2.00 -1.98 115.31 120.63 2x40 h LEU 13 Ca -0.46 0.04 -0.12 0.00 0.84 0.00 0.00 57.88 58.17 2x40 h LEU 13 Cb 1.28 -0.04 -0.02 0.00 0.37 0.00 0.00 40.66 42.26 2x40 h LEU 13 CO 0.63 0.28 -0.56 -0.08 -0.34 0.00 0.00 178.44 178.37 2x40 h GLU 14 N 0.56 0.07 -0.47 1.25 4.81 -1.99 -2.38 114.58 116.43 2x40 h GLU 14 Ca 0.27 -0.04 -0.10 0.00 -0.13 0.00 0.00 59.36 59.36 2x40 h GLU 14 Cb 0.21 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.57 2x40 h GLU 14 CO -0.20 0.61 -0.11 0.93 -0.73 0.00 0.00 179.01 179.51 2x40 h GLU 15 N 0.05 0.87 -0.79 1.92 5.08 -1.82 -0.46 114.58 119.44 2x40 h GLU 15 Ca -0.00 -0.30 -0.02 0.00 -1.00 0.00 0.00 59.36 58.03 2x40 h GLU 15 Cb 1.00 -0.07 -0.04 0.00 0.50 0.00 0.00 28.75 30.15 2x40 h GLU 15 CO 0.08 0.94 0.41 0.87 -1.00 0.00 0.00 179.01 180.30 2x40 h LYS 16 N 0.78 1.10 -0.13 2.33 1.57 -1.06 -1.80 116.57 119.37 2x40 h LYS 16 Ca 0.13 -0.14 -0.04 0.00 -1.87 0.00 0.00 60.65 58.73 2x40 h LYS 16 Cb 0.63 -0.21 -0.00 0.00 0.08 0.00 0.00 32.23 32.72 2x40 h LYS 16 CO 0.04 0.83 -0.09 0.28 -0.57 0.00 0.00 179.45 179.94 2x40 h VAL 17 N 1.10 1.33 -0.79 0.50 2.07 -1.07 -3.06 116.25 116.33 2x40 h VAL 17 Ca 0.27 -1.17 0.13 0.00 0.82 0.00 0.00 66.70 66.76 2x40 h VAL 17 Cb 0.06 1.82 -0.09 0.00 -1.52 0.00 0.00 31.29 31.56 2x40 h VAL 17 CO -0.04 0.34 0.39 0.11 0.02 0.00 0.00 177.57 178.39 2x40 h LYS 18 N -0.07 0.57 0.00 1.57 1.57 -0.94 -2.38 116.57 116.89 2x40 h LYS 18 Ca 0.03 -0.03 -0.02 0.00 -1.87 0.00 0.00 60.65 58.75 2x40 h LYS 18 Cb 0.57 -0.13 -0.00 0.00 0.08 0.00 0.00 32.23 32.75 2x40 h LYS 18 CO 0.02 0.38 -0.09 -0.07 -0.57 0.00 0.00 179.45 179.12 2x40 h LEU 19 N 0.59 0.00 -1.40 2.94 3.38 -1.23 -2.29 115.31 117.30 2x40 h LEU 19 Ca 0.42 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.39 2x40 h LEU 19 Cb 0.56 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.31 2x40 h LEU 19 CO -0.34 0.09 0.00 1.33 0.09 0.00 0.00 178.44 179.61 2x40 n VAL 20 N -4.28 0.24 -4.94 1.22 0.24 -0.90 -4.78 118.33 105.14 2x40 n VAL 20 Ca -0.03 -0.43 -0.27 0.00 -2.04 0.00 0.00 64.34 61.57 2x40 n VAL 20 Cb 0.17 0.58 -0.16 0.00 -1.47 0.00 0.00 33.84 32.96 2x40 n VAL 20 CO 0.00 0.00 0.00 -0.69 -2.14 0.00 0.00 176.83 174.00 2x40 s VAL 21 N -1.76 1.54 1.14 3.34 1.01 -0.86 -0.45 120.40 124.37 2x40 s VAL 21 Ca 0.34 -0.81 -0.13 0.00 0.00 0.00 0.00 61.98 61.38 2x40 s VAL 21 Cb 0.19 -1.30 0.27 0.00 0.00 0.00 0.00 36.38 35.54 2x40 s VAL 21 CO 0.28 0.44 1.04 -0.83 0.00 0.00 0.00 175.10 176.03 2x40 s GLY 22 N -0.25 1.55 -0.06 4.51 0.00 0.78 -4.24 107.32 109.62 2x40 s GLY 22 Ca 0.02 -0.10 0.16 0.00 0.00 0.00 0.00 44.72 44.80 2x40 s GLY 22 CO 0.01 0.59 1.46 3.33 0.00 0.00 0.00 173.10 178.49 2x40 n VAL 23 N -4.84 1.23 0.00 1.40 0.24 -0.92 -4.31 118.33 111.12 2x40 n VAL 23 Ca 0.04 -0.89 0.00 0.00 -2.04 0.00 0.00 64.34 61.44 2x40 n VAL 23 Cb 0.54 0.18 0.00 0.00 -1.47 0.00 0.00 33.84 33.09 2x40 n VAL 23 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2x40 n GLY 24 N 1.16 1.53 3.62 7.63 0.00 0.14 -4.86 105.19 114.41 2x40 n GLY 24 Ca 0.21 -1.89 -0.43 0.00 0.00 0.00 0.00 46.02 43.90 2x40 n GLY 24 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2x40 s LEU 25 N -0.39 3.75 0.38 0.99 2.96 -1.26 -4.63 118.68 120.47 2x40 s LEU 25 Ca 0.00 1.35 -0.27 0.00 -0.22 0.00 0.00 54.13 54.99 2x40 s LEU 25 Cb 0.00 -3.53 -0.10 0.00 0.50 0.00 0.00 46.19 43.06 2x40 s LEU 25 CO 0.00 -1.36 1.38 -2.84 -1.32 0.00 0.00 176.35 172.21 2x40 s PRO 26 N 4.85 4.09 0.00 0.98 0.02 -1.26 -2.81 135.00 140.87 2x40 s PRO 26 Ca 0.69 2.34 0.00 0.00 0.02 0.00 0.00 61.00 64.05 2x40 s PRO 26 Cb -0.21 -2.91 0.00 0.00 0.02 0.00 0.00 34.50 31.40 2x40 s PRO 26 CO 0.30 -0.45 0.00 0.41 -0.33 0.00 0.00 177.00 176.92 2x40 n GLY 27 N 0.63 2.07 3.59 0.52 0.00 -0.92 -4.83 105.19 106.26 2x40 n GLY 27 Ca 0.02 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.79 2x40 n GLY 27 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2x40 s LEU 28 N 0.00 3.03 0.00 0.99 1.43 -1.12 -4.85 118.68 118.15 2x40 s LEU 28 Ca 0.00 -0.68 0.00 0.00 -1.03 0.00 0.00 54.13 52.42 2x40 s LEU 28 Cb 0.00 -1.60 0.00 0.00 0.03 0.00 0.00 46.19 44.62 2x40 s LEU 28 CO 0.00 0.04 0.00 0.49 0.23 0.00 0.00 176.35 177.11 2x40 n PHE 29 N -0.53 0.00 1.09 0.29 3.72 -1.26 -0.80 117.46 119.97 2x40 n PHE 29 Ca -0.08 0.00 0.09 0.00 -0.05 0.00 0.00 57.45 57.42 2x40 n PHE 29 Cb 0.58 0.05 0.53 0.00 -0.94 0.00 0.00 39.48 39.70 2x40 n PHE 29 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2x40 n GLY 30 N 0.00 -0.65 3.74 1.37 0.00 -1.26 -4.89 105.19 103.50 2x40 n GLY 30 Ca 0.00 -0.11 -0.40 0.00 0.00 0.00 0.00 46.02 45.51 2x40 n GLY 30 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2x40 s ASN 31 N -2.13 7.56 0.45 1.61 0.01 0.02 -5.02 114.94 117.44 2x40 s ASN 31 Ca 0.25 1.90 -0.23 0.00 -0.71 0.00 0.00 52.86 54.08 2x40 s ASN 31 Cb 0.13 -2.60 -0.08 0.00 0.41 0.00 0.00 41.25 39.11 2x40 s ASN 31 CO 0.23 0.04 1.12 -2.84 -1.51 0.00 0.00 177.10 174.14 2x40 s PRO 32 N -0.67 3.85 0.45 -0.60 0.02 -1.26 -2.47 135.00 134.32 2x40 s PRO 32 Ca 0.44 1.66 -0.25 0.00 0.02 0.00 0.00 61.00 62.87 2x40 s PRO 32 Cb -0.25 -2.40 -0.09 0.00 0.02 0.00 0.00 34.50 31.78 2x40 s PRO 32 CO 0.31 -0.44 1.38 0.72 -0.33 0.00 0.00 177.00 178.64 2x40 n HIS 33 N -0.45 2.49 -1.45 6.54 8.25 -1.26 -2.17 115.22 127.17 2x40 n HIS 33 Ca 0.07 0.46 -0.33 0.00 -0.26 0.00 0.00 57.72 57.66 2x40 n HIS 33 Cb 0.49 -2.43 0.08 0.00 1.12 0.00 0.00 29.99 29.25 2x40 n HIS 33 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 2x40 s SER 34 N -0.52 4.51 0.63 0.41 1.04 -1.26 -4.83 113.70 113.69 2x40 s SER 34 Ca 0.62 2.07 0.29 0.00 0.48 0.00 0.00 55.95 59.41 2x40 s SER 34 Cb -0.47 -2.56 1.58 0.00 0.10 0.00 0.00 66.02 64.68 2x40 s SER 34 CO 0.57 -2.04 1.93 0.08 0.98 0.00 0.00 173.24 174.76 2x40 h ARG 35 N -0.51 0.00 -3.10 4.02 0.11 -2.00 -2.07 114.38 110.84 2x40 h ARG 35 Ca -0.46 0.00 -0.72 0.00 0.10 0.00 0.00 59.98 58.90 2x40 h ARG 35 Cb 1.26 0.00 -0.34 0.00 1.11 0.00 0.00 29.97 31.99 2x40 h ARG 35 CO 0.51 0.00 0.05 0.28 0.10 0.00 0.00 179.97 180.90 2x40 n VAL 36 N -3.24 3.49 -1.60 0.08 0.31 -1.26 -5.07 118.33 111.05 2x40 n VAL 36 Ca 0.02 -5.31 -0.59 0.00 -0.01 0.00 0.00 64.34 58.45 2x40 n VAL 36 Cb 0.47 -2.30 -0.08 0.00 -0.91 0.00 0.00 33.84 31.02 2x40 n VAL 36 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2x40 n ALA 37 N 1.94 -2.08 0.00 3.52 0.00 -0.78 -1.44 120.51 121.67 2x40 n ALA 37 Ca 0.24 0.53 0.00 0.00 0.00 0.00 0.00 53.44 54.21 2x40 n ALA 37 Cb 0.37 -1.93 0.00 0.00 0.00 0.00 0.00 19.45 17.89 2x40 n ALA 37 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2x40 n GLY 38 N 2.57 2.07 3.57 0.00 0.00 -1.26 -1.72 105.19 110.42 2x40 n GLY 38 Ca 0.22 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.85 2x40 n GLY 38 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2x40 n ALA 39 N -1.55 -0.22 0.08 4.61 0.00 -0.52 -4.70 120.51 118.22 2x40 n ALA 39 Ca 0.00 0.07 -0.06 0.00 0.00 0.00 0.00 53.44 53.46 2x40 n ALA 39 Cb 0.00 -2.02 0.10 0.00 0.00 0.00 0.00 19.45 17.54 2x40 n ALA 39 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2x40 h ALA 40 N 0.75 0.80 -1.64 0.00 0.00 -1.33 -3.42 119.26 114.43 2x40 h ALA 40 Ca -0.46 -0.57 0.30 0.00 0.00 0.00 0.00 54.91 54.18 2x40 h ALA 40 Cb 1.37 -0.08 -0.11 0.00 0.00 0.00 0.00 17.79 18.96 2x40 h ALA 40 CO 0.52 0.76 0.77 0.20 0.00 0.00 0.00 179.25 181.49 2x40 s GLY 41 N -4.36 -0.37 0.06 0.00 0.00 -0.88 -4.48 107.32 97.29 2x40 s GLY 41 Ca -0.04 0.55 0.00 0.00 0.00 0.00 0.00 44.72 45.24 2x40 s GLY 41 CO 0.80 0.30 -0.04 -0.54 0.00 0.00 0.00 173.10 173.62 2x40 s GLU 42 N -2.57 0.61 0.45 2.90 2.02 -1.26 -0.75 118.70 120.10 2x40 s GLU 42 Ca 0.14 -1.09 -0.00 0.00 0.02 0.00 0.00 54.97 54.04 2x40 s GLU 42 Cb 0.03 0.03 -0.01 0.00 0.10 0.00 0.00 34.13 34.29 2x40 s GLU 42 CO -0.03 -0.06 0.68 0.95 0.02 0.00 0.00 175.26 176.83 2x40 s THR 43 N -3.13 4.18 0.01 3.63 -4.23 -0.65 -2.17 115.64 113.28 2x40 s THR 43 Ca 0.02 -0.41 -0.30 0.00 -1.18 0.00 0.00 61.69 59.82 2x40 s THR 43 Cb 0.02 -3.55 -0.05 0.00 1.34 0.00 0.00 72.50 70.26 2x40 s THR 43 CO -0.06 -0.41 1.30 -1.00 -0.54 0.00 0.00 174.62 173.91 2x40 s HIS 44 N -2.57 3.12 0.62 3.99 0.09 -1.26 -4.20 115.29 115.08 2x40 s HIS 44 Ca 0.48 1.05 -0.16 0.00 -0.00 0.00 0.00 55.06 56.43 2x40 s HIS 44 Cb -0.10 -3.54 -0.02 0.00 -0.00 0.00 0.00 32.58 28.92 2x40 s HIS 44 CO 0.39 -1.86 1.09 -2.14 -0.00 0.00 0.00 174.74 172.21 2x40 s PRO 45 N 1.90 3.09 -0.46 8.40 0.02 -1.26 -4.70 135.00 141.99 2x40 s PRO 45 Ca 0.61 1.31 0.07 0.00 0.02 0.00 0.00 61.00 63.01 2x40 s PRO 45 Cb -0.30 -1.99 0.24 0.00 0.02 0.00 0.00 34.50 32.47 2x40 s PRO 45 CO 0.26 -1.01 0.55 0.28 -0.33 0.00 0.00 177.00 176.75 2x40 n VAL 46 N -2.15 0.01 -0.34 3.83 0.31 0.20 -4.96 118.33 115.23 2x40 n VAL 46 Ca 0.10 -4.24 0.31 0.00 -0.01 0.00 0.00 64.34 60.50 2x40 n VAL 46 Cb 0.52 -1.96 0.58 0.00 -0.91 0.00 0.00 33.84 32.07 2x40 n VAL 46 CO 0.00 0.00 0.00 -0.65 -1.32 0.00 0.00 176.83 174.86 2x40 h PRO 47 N 4.30 0.08 0.00 5.55 0.11 -1.93 -2.22 132.00 137.89 2x40 h PRO 47 Ca 0.13 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.23 2x40 h PRO 47 Cb 0.83 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 31.92 2x40 h PRO 47 CO 0.54 0.05 0.00 0.54 -0.21 0.00 0.00 178.00 178.92 2x40 n ARG 48 N -5.13 0.00 -0.03 1.05 1.74 -1.26 -0.72 116.66 112.31 2x40 n ARG 48 Ca 0.37 0.42 0.00 0.00 -0.77 0.00 0.00 57.85 57.87 2x40 n ARG 48 Cb 1.25 -0.80 0.01 0.00 -1.02 0.00 0.00 32.46 31.91 2x40 n ARG 48 CO 0.00 0.00 0.00 1.33 -1.52 0.00 0.00 177.63 177.44 2x40 n VAL 49 N -1.12 0.09 -2.98 1.55 0.24 -0.95 -4.82 118.33 110.34 2x40 n VAL 49 Ca 0.00 -0.05 -0.12 0.00 -2.04 0.00 0.00 64.34 62.13 2x40 n VAL 49 Cb 0.00 -0.39 0.05 0.00 -1.47 0.00 0.00 33.84 32.03 2x40 n VAL 49 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2x40 n GLY 50 N 0.13 0.07 3.56 7.63 0.00 0.11 -5.03 105.19 111.66 2x40 n GLY 50 Ca 0.01 -0.16 -0.36 0.00 0.00 0.00 0.00 46.02 45.51 2x40 n GLY 50 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2x40 s LEU 51 N -4.47 3.75 0.47 0.99 1.43 -0.88 -4.97 118.68 114.99 2x40 s LEU 51 Ca 0.19 -0.03 -0.03 0.00 -1.03 0.00 0.00 54.13 53.23 2x40 s LEU 51 Cb -0.08 -1.99 -0.02 0.00 0.03 0.00 0.00 46.19 44.13 2x40 s LEU 51 CO 0.40 0.06 0.73 -2.16 0.23 0.00 0.00 176.35 175.61 2x40 s PRO 52 N 1.08 3.30 -0.08 1.29 0.04 -1.26 -0.63 135.00 138.75 2x40 s PRO 52 Ca 0.05 -0.11 -0.30 0.00 0.04 0.00 0.00 61.00 60.68 2x40 s PRO 52 Cb -0.14 -2.46 -0.04 0.00 0.04 0.00 0.00 34.50 31.90 2x40 s PRO 52 CO 0.04 -0.24 1.38 0.00 0.04 0.00 0.00 177.00 178.22 2x40 s ALA 53 N -2.66 3.61 0.16 8.56 0.00 -1.26 -4.51 121.76 125.66 2x40 s ALA 53 Ca 0.47 0.70 -0.18 0.00 0.00 0.00 0.00 51.96 52.96 2x40 s ALA 53 Cb -0.10 -3.63 -0.07 0.00 0.00 0.00 0.00 23.12 19.31 2x40 s ALA 53 CO 0.41 -1.10 0.63 -0.06 0.00 0.00 0.00 175.76 175.64 2x40 s PHE 54 N 3.17 3.67 -0.14 0.00 0.40 -1.26 -4.83 117.98 118.98 2x40 s PHE 54 Ca 0.62 1.24 -0.02 0.00 -0.60 0.00 0.00 56.93 58.17 2x40 s PHE 54 Cb -0.27 -2.50 -0.02 0.00 0.51 0.00 0.00 43.02 40.73 2x40 s PHE 54 CO 0.22 0.42 -0.07 0.08 0.70 0.00 0.00 175.22 176.58 2x40 s VAL 55 N -1.42 3.65 -0.06 -0.44 1.01 -1.26 -1.63 120.40 120.24 2x40 s VAL 55 Ca 0.38 -0.45 0.03 0.00 0.00 0.00 0.00 61.98 61.94 2x40 s VAL 55 Cb -0.17 -2.57 -0.02 0.00 0.00 0.00 0.00 36.38 33.62 2x40 s VAL 55 CO 0.20 0.51 -0.15 -0.76 0.00 0.00 0.00 175.10 174.91 2x40 s LEU 56 N 0.22 2.69 -0.04 3.92 2.01 0.08 -1.11 118.68 126.45 2x40 s LEU 56 Ca -0.04 -0.24 -0.13 0.00 0.01 0.00 0.00 54.13 53.73 2x40 s LEU 56 Cb -0.14 -1.55 0.02 0.00 0.01 0.00 0.00 46.19 44.53 2x40 s LEU 56 CO 0.04 0.31 0.30 0.00 1.01 0.00 0.00 176.35 178.00 2x40 s ALA 57 N -0.49 -0.74 0.98 4.21 0.00 -0.79 -0.89 121.76 124.04 2x40 s ALA 57 Ca 0.06 0.41 -0.12 0.00 0.00 0.00 0.00 51.96 52.31 2x40 s ALA 57 Cb -0.12 -0.06 0.18 0.00 0.00 0.00 0.00 23.12 23.12 2x40 s ALA 57 CO 0.02 -0.23 1.09 -0.51 0.00 0.00 0.00 175.76 176.13 2x40 s ASP 58 N -1.00 2.79 0.13 0.00 -0.00 -1.26 -0.43 116.67 116.90 2x40 s ASP 58 Ca -0.11 1.27 -0.11 0.00 -0.00 0.00 0.00 52.55 53.60 2x40 s ASP 58 Cb -0.05 -1.94 0.04 0.00 -0.00 0.00 0.00 42.92 40.98 2x40 s ASP 58 CO 0.03 -3.04 0.56 0.61 -0.00 0.00 0.00 175.17 173.33 2x40 n GLY 59 N -1.06 1.02 0.41 0.21 0.00 -0.75 0.00 105.19 105.01 2x40 n GLY 59 Ca 0.06 -1.08 0.23 0.00 0.00 0.00 0.00 46.02 45.23 2x40 n GLY 59 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 2x40 h PRO 60 N 0.00 0.00 -0.26 1.61 0.11 -1.84 -1.58 132.00 130.04 2x40 h PRO 60 Ca -0.16 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.95 2x40 h PRO 60 Cb 0.69 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.80 2x40 h PRO 60 CO 0.22 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 178.01 2x40 n ALA 61 N -2.61 2.46 0.00 -0.75 0.00 -1.26 -4.80 120.51 113.56 2x40 n ALA 61 Ca 0.12 -0.78 0.00 0.00 0.00 0.00 0.00 53.44 52.78 2x40 n ALA 61 Cb 0.72 -0.96 0.00 0.00 0.00 0.00 0.00 19.45 19.22 2x40 n ALA 61 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2x40 n GLY 62 N 1.35 4.27 3.67 0.00 0.00 -0.59 -0.30 105.19 113.59 2x40 n GLY 62 Ca 0.18 -1.51 -0.50 0.00 0.00 0.00 0.00 46.02 44.18 2x40 n GLY 62 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2x40 n LEU 63 N 0.00 2.96 -4.26 0.99 7.94 -1.26 -1.82 117.00 121.55 2x40 n LEU 63 Ca 0.00 1.03 -0.42 0.00 -1.11 0.00 0.00 56.01 55.51 2x40 n LEU 63 Cb 0.00 -1.32 -0.08 0.00 0.53 0.00 0.00 43.42 42.55 2x40 n LEU 63 CO 0.00 -0.29 0.01 -0.60 -1.11 0.00 0.00 177.39 175.40 2x40 s ARG 64 N 2.86 2.66 0.18 1.96 3.52 0.10 -4.74 118.95 125.49 2x40 s ARG 64 Ca 0.90 -1.67 0.00 0.00 -0.13 0.00 0.00 55.73 54.83 2x40 s ARG 64 Cb -0.79 -4.01 -0.04 0.00 -1.56 0.00 0.00 34.95 28.54 2x40 s ARG 64 CO 0.51 -1.17 0.06 0.96 -0.81 0.00 0.00 175.30 174.84 2x40 s ILE 65 N 1.45 0.38 0.06 4.11 -4.36 -1.26 -4.43 121.20 117.15 2x40 s ILE 65 Ca 0.04 -1.96 -0.31 0.00 -0.26 0.00 0.00 60.65 58.16 2x40 s ILE 65 Cb -0.26 -2.25 -0.07 0.00 1.25 0.00 0.00 42.46 41.12 2x40 s ILE 65 CO 0.01 -0.31 1.51 0.20 0.24 0.00 0.00 174.94 176.59 2x40 s ASN 66 N -3.16 6.72 0.09 4.36 0.01 -0.70 -4.78 114.94 117.48 2x40 s ASN 66 Ca 0.29 2.34 -0.20 0.00 -0.71 0.00 0.00 52.86 54.58 2x40 s ASN 66 Cb 0.07 -2.57 -0.09 0.00 0.41 0.00 0.00 41.25 39.07 2x40 s ASN 66 CO 0.06 -0.78 1.61 -0.65 -1.51 0.00 0.00 177.10 175.83 2x40 h PRO 67 N 7.75 0.31 -6.17 -0.60 0.11 -1.88 -3.43 132.00 128.09 2x40 h PRO 67 Ca -0.41 -0.06 -0.53 0.00 0.11 0.00 0.00 66.00 65.11 2x40 h PRO 67 Cb 1.19 -0.05 -0.05 0.00 0.11 0.00 0.00 31.00 32.21 2x40 h PRO 67 CO 0.91 0.40 -0.52 0.95 -0.21 0.00 0.00 178.00 179.53 2x40 s THR 68 N -5.45 4.71 -0.02 -1.15 -4.23 -1.26 -0.77 115.64 107.48 2x40 s THR 68 Ca -0.14 -1.12 0.03 0.00 -1.18 0.00 0.00 61.69 59.29 2x40 s THR 68 Cb 0.07 -3.48 -0.00 0.00 1.34 0.00 0.00 72.50 70.43 2x40 s THR 68 CO 0.71 -0.22 -0.12 -0.13 -0.54 0.00 0.00 174.62 174.32 2x40 s ARG 69 N -3.51 1.06 0.33 3.99 0.52 -1.26 -5.02 118.95 115.06 2x40 s ARG 69 Ca 0.33 -0.41 -0.29 0.00 -0.52 0.00 0.00 55.73 54.83 2x40 s ARG 69 Cb -0.09 -1.00 -0.12 0.00 0.52 0.00 0.00 34.95 34.26 2x40 s ARG 69 CO 0.25 0.21 1.45 0.39 0.02 0.00 0.00 175.30 177.63 2x40 n GLU 70 N 2.98 2.45 -3.64 3.54 1.02 -1.26 -2.02 120.64 123.70 2x40 n GLU 70 Ca -0.16 0.87 -0.23 0.00 -0.02 0.00 0.00 57.16 57.62 2x40 n GLU 70 Cb 0.55 -2.56 0.06 0.00 -0.02 0.00 0.00 31.44 29.47 2x40 n GLU 70 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 2x40 n ASN 71 N 1.17 -4.04 -3.75 1.62 5.03 -1.26 -5.00 115.26 109.03 2x40 n ASN 71 Ca 0.05 -0.66 -0.14 0.00 0.87 0.00 0.00 54.58 54.70 2x40 n ASN 71 Cb 0.37 -4.64 -0.15 0.00 -1.02 0.00 0.00 39.78 34.34 2x40 n ASN 71 CO 0.00 0.00 0.00 -0.62 -1.83 0.00 0.00 177.26 174.81 2x40 s ASP 72 N -3.76 -0.01 0.19 6.41 -1.08 -0.86 -5.01 116.67 112.55 2x40 s ASP 72 Ca 0.36 0.25 0.25 0.00 -0.52 0.00 0.00 52.55 52.89 2x40 s ASP 72 Cb -0.17 0.14 0.57 0.00 -1.46 0.00 0.00 42.92 42.01 2x40 s ASP 72 CO 0.77 -0.15 1.56 -0.08 0.52 0.00 0.00 175.17 177.79 2x40 h GLU 73 N 7.34 0.00 -7.26 4.34 4.57 -1.95 -3.43 114.58 118.19 2x40 h GLU 73 Ca -0.41 0.00 -0.47 0.00 -1.18 0.00 0.00 59.36 57.30 2x40 h GLU 73 Cb 1.13 0.00 0.07 0.00 -0.16 0.00 0.00 28.75 29.79 2x40 h GLU 73 CO 0.41 0.00 0.24 -0.80 -1.18 0.00 0.00 179.01 177.68 2x40 s ASN 74 N -4.52 5.21 0.15 1.04 0.01 -1.26 -5.10 114.94 110.46 2x40 s ASN 74 Ca 0.08 0.66 0.11 0.00 -0.71 0.00 0.00 52.86 53.00 2x40 s ASN 74 Cb 0.12 -1.47 -0.04 0.00 0.41 0.00 0.00 41.25 40.27 2x40 s ASN 74 CO 0.66 -1.35 -0.25 -0.89 -1.51 0.00 0.00 177.10 173.76 2x40 s THR 75 N -3.17 2.17 -0.32 1.60 2.01 -1.26 -4.57 115.64 112.11 2x40 s THR 75 Ca 0.57 -1.81 0.18 0.00 0.31 0.00 0.00 61.69 60.94 2x40 s THR 75 Cb -0.11 -1.96 0.46 0.00 0.01 0.00 0.00 72.50 70.91 2x40 s THR 75 CO 0.46 -0.02 1.00 -1.22 -0.69 0.00 0.00 174.62 174.15 2x40 n TYR 76 N 0.72 0.96 -1.98 4.92 4.01 0.05 -4.95 117.16 120.89 2x40 n TYR 76 Ca -0.16 -2.65 -0.32 0.00 -0.16 0.00 0.00 57.90 54.60 2x40 n TYR 76 Cb 0.54 -0.24 0.01 0.00 -0.31 0.00 0.00 39.34 39.34 2x40 n TYR 76 CO 0.00 0.00 0.00 0.71 -0.46 0.00 0.00 176.86 177.11 2x40 s TYR 77 N -3.02 3.06 0.16 -0.72 1.51 -1.26 -4.25 117.35 112.82 2x40 s TYR 77 Ca 0.27 1.49 0.07 0.00 -1.01 0.00 0.00 57.07 57.89 2x40 s TYR 77 Cb 0.44 -2.96 -0.04 0.00 -0.11 0.00 0.00 41.96 39.29 2x40 s TYR 77 CO 0.02 -1.07 -0.16 0.99 -1.11 0.00 0.00 175.55 174.22 2x40 s THR 78 N -2.59 1.61 -0.13 -0.71 2.01 -1.26 -5.00 115.64 109.58 2x40 s THR 78 Ca 0.62 -1.90 -0.29 0.00 0.31 0.00 0.00 61.69 60.42 2x40 s THR 78 Cb -0.15 -1.77 -0.02 0.00 0.01 0.00 0.00 72.50 70.58 2x40 s THR 78 CO 0.40 -0.41 1.17 -0.89 -0.69 0.00 0.00 174.62 174.20 2x40 s THR 79 N -2.27 4.40 -0.54 -0.82 2.01 -1.26 -4.24 115.64 112.92 2x40 s THR 79 Ca 0.14 1.70 -0.19 0.00 0.31 0.00 0.00 61.69 63.66 2x40 s THR 79 Cb -0.04 -4.10 0.08 0.00 0.01 0.00 0.00 72.50 68.45 2x40 s THR 79 CO 0.05 -0.07 0.64 0.00 -0.69 0.00 0.00 174.62 174.55 2x40 s ALA 80 N 2.78 3.41 0.67 7.40 0.00 -1.26 -4.44 121.76 130.32 2x40 s ALA 80 Ca 0.53 -1.97 -0.11 0.00 0.00 0.00 0.00 51.96 50.41 2x40 s ALA 80 Cb -0.21 -3.41 -0.00 0.00 0.00 0.00 0.00 23.12 19.50 2x40 s ALA 80 CO 0.16 -2.13 1.06 -0.06 0.00 0.00 0.00 175.76 174.80 2x40 s PHE 81 N 2.59 3.42 0.79 0.00 0.08 0.59 -1.39 117.98 124.04 2x40 s PHE 81 Ca 0.13 1.10 -0.15 0.00 0.12 0.00 0.00 56.93 58.13 2x40 s PHE 81 Cb -0.22 -2.94 -0.01 0.00 -0.57 0.00 0.00 43.02 39.28 2x40 s PHE 81 CO 0.09 -1.01 0.57 -2.30 -0.10 0.00 0.00 175.22 172.48 2x40 n PRO 82 N -2.90 0.16 -1.66 0.24 -0.02 -1.23 -4.07 135.00 125.52 2x40 n PRO 82 Ca 0.06 0.10 -0.33 0.00 -2.02 0.00 0.00 63.50 61.32 2x40 n PRO 82 Cb 0.56 -1.90 0.05 0.00 -0.02 0.00 0.00 33.50 32.19 2x40 n PRO 82 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 2x40 s VAL 83 N -2.04 3.30 0.32 -1.45 -7.23 -0.79 -4.75 120.40 107.75 2x40 s VAL 83 Ca 0.64 0.56 0.04 0.00 -1.81 0.00 0.00 61.98 61.42 2x40 s VAL 83 Cb -0.31 -3.08 0.30 0.00 0.56 0.00 0.00 36.38 33.85 2x40 s VAL 83 CO 0.59 -0.41 1.86 -0.33 -0.31 0.00 0.00 175.10 176.50 2x40 h GLU 84 N -0.20 0.85 0.00 4.82 5.08 -1.74 0.17 114.58 123.56 2x40 h GLU 84 Ca -0.46 -0.05 -0.02 0.00 -1.00 0.00 0.00 59.36 57.82 2x40 h GLU 84 Cb 1.24 -0.19 -0.00 0.00 0.50 0.00 0.00 28.75 30.30 2x40 h GLU 84 CO 0.54 0.56 -0.12 0.97 -1.00 0.00 0.00 179.01 179.96 2x40 h ILE 85 N 0.88 0.89 0.22 3.13 2.10 -0.68 0.34 117.51 124.38 2x40 h ILE 85 Ca 0.46 -0.42 -0.30 0.00 1.08 0.00 0.00 64.86 65.68 2x40 h ILE 85 Cb 0.54 1.24 0.03 0.00 -1.09 0.00 0.00 36.82 37.54 2x40 h ILE 85 CO -0.23 0.11 -1.35 -0.03 -1.08 0.00 0.00 178.15 175.58 2x40 h MET 86 N 0.00 0.46 -0.63 2.19 4.05 -0.98 -2.47 114.93 117.55 2x40 h MET 86 Ca -0.00 -0.78 0.08 0.00 -0.28 0.00 0.00 59.70 58.72 2x40 h MET 86 Cb 0.23 0.29 -0.07 0.00 -0.80 0.00 0.00 31.60 31.26 2x40 h MET 86 CO 0.01 1.38 0.28 -0.07 0.23 0.00 0.00 176.91 178.74 2x40 h LEU 87 N -0.00 0.34 -1.25 3.39 3.38 -0.60 -1.40 115.31 119.17 2x40 h LEU 87 Ca -0.24 0.06 -0.03 0.00 0.09 0.00 0.00 57.88 57.76 2x40 h LEU 87 Cb 2.02 0.01 -0.03 0.00 0.09 0.00 0.00 40.66 42.76 2x40 h LEU 87 CO 0.23 0.21 0.21 0.00 0.09 0.00 0.00 178.44 179.18 2x40 h ALA 88 N 1.39 1.41 0.00 1.53 0.00 -0.37 -1.50 119.26 121.73 2x40 h ALA 88 Ca 0.31 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 55.09 2x40 h ALA 88 Cb 0.33 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 17.90 2x40 h ALA 88 CO -0.26 0.45 0.00 0.77 0.00 0.00 0.00 179.25 180.21 2x40 h SER 89 N 0.73 0.00 0.56 0.00 0.02 -0.76 -0.54 113.55 113.56 2x40 h SER 89 Ca 0.18 0.00 -0.11 0.00 -0.84 0.00 0.00 61.79 61.02 2x40 h SER 89 Cb 0.13 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 62.66 2x40 h SER 89 CO -0.02 0.00 -0.54 0.71 -1.14 0.00 0.00 176.83 175.85 2x40 h THR 90 N 0.00 1.36 -4.46 -2.27 1.35 -1.12 -0.16 112.91 107.62 2x40 h THR 90 Ca 0.00 -1.85 -0.31 0.00 -0.55 0.00 0.00 66.41 63.70 2x40 h THR 90 Cb 0.10 2.00 -0.03 0.00 -1.73 0.00 0.00 68.15 68.49 2x40 h THR 90 CO 0.00 0.52 -0.43 0.79 -0.25 0.00 0.00 175.52 176.15 2x40 n TRP 91 N -3.87 -1.60 -3.98 4.73 7.02 -0.21 -4.82 117.44 114.70 2x40 n TRP 91 Ca -0.01 0.22 -0.31 0.00 -1.02 0.00 0.00 57.50 56.38 2x40 n TRP 91 Cb 0.55 -3.02 -0.15 0.00 -2.42 0.00 0.00 31.31 26.27 2x40 n TRP 91 CO 0.00 0.00 0.00 1.21 -2.02 0.00 0.00 177.69 176.88 2x40 s ASN 92 N -2.34 4.65 0.12 -0.99 3.84 -1.26 -4.40 114.94 114.56 2x40 s ASN 92 Ca 0.17 -2.06 -0.20 0.00 0.21 0.00 0.00 52.86 50.98 2x40 s ASN 92 Cb -0.09 -1.52 -0.05 0.00 -0.55 0.00 0.00 41.25 39.04 2x40 s ASN 92 CO 0.21 -0.38 1.72 0.03 -2.79 0.00 0.00 177.10 175.89 2x40 h ARG 93 N 7.68 0.04 -0.37 0.43 3.08 -1.93 -1.26 114.38 122.04 2x40 h ARG 93 Ca -0.06 -0.00 0.07 0.00 0.07 0.00 0.00 59.98 60.06 2x40 h ARG 93 Cb 1.02 -0.01 -0.06 0.00 0.08 0.00 0.00 29.97 31.00 2x40 h ARG 93 CO 0.51 0.02 0.02 1.49 -1.07 0.00 0.00 179.97 180.94 2x40 h GLU 94 N 0.04 0.12 -0.75 0.04 4.81 -1.96 0.11 114.58 116.99 2x40 h GLU 94 Ca 0.08 -0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.29 2x40 h GLU 94 Cb 0.10 -0.03 -0.04 0.00 0.63 0.00 0.00 28.75 29.42 2x40 h GLU 94 CO -0.14 0.08 0.43 1.25 -0.73 0.00 0.00 179.01 179.90 2x40 h LEU 95 N 0.12 0.92 -0.97 1.64 5.85 -1.93 -0.95 115.31 119.99 2x40 h LEU 95 Ca 0.18 -0.08 -0.02 0.00 0.84 0.00 0.00 57.88 58.80 2x40 h LEU 95 Cb 0.25 -0.23 -0.04 0.00 0.37 0.00 0.00 40.66 41.00 2x40 h LEU 95 CO -0.29 0.74 0.48 -0.07 -0.34 0.00 0.00 178.44 178.95 2x40 h LEU 96 N 1.03 1.07 -0.57 2.25 -0.00 -0.11 0.95 115.31 119.93 2x40 h LEU 96 Ca 0.27 -0.09 -0.02 0.00 -0.00 0.00 0.00 57.88 58.04 2x40 h LEU 96 Cb 0.01 -0.27 -0.03 0.00 -0.00 0.00 0.00 40.66 40.37 2x40 h LEU 96 CO -0.05 0.86 0.28 -0.08 -0.00 0.00 0.00 178.44 179.45 2x40 h GLU 97 N 1.21 0.81 -0.57 1.13 4.81 -0.19 -0.88 114.58 120.90 2x40 h GLU 97 Ca 0.30 -0.12 0.03 0.00 -0.13 0.00 0.00 59.36 59.45 2x40 h GLU 97 Cb 0.02 -0.15 -0.04 0.00 0.63 0.00 0.00 28.75 29.21 2x40 h GLU 97 CO -0.05 0.66 0.34 0.93 -0.73 0.00 0.00 179.01 180.16 2x40 h GLU 98 N 0.77 0.64 -0.80 1.92 4.39 -0.39 -1.36 114.58 119.74 2x40 h GLU 98 Ca 0.20 -0.04 0.01 0.00 0.34 0.00 0.00 59.36 59.86 2x40 h GLU 98 Cb 0.11 -0.14 -0.04 0.00 -0.10 0.00 0.00 28.75 28.58 2x40 h GLU 98 CO -0.03 0.42 0.52 0.28 -1.16 0.00 0.00 179.01 179.05 2x40 h VAL 99 N 0.66 1.21 -0.56 3.13 2.07 -0.39 -2.05 116.25 120.32 2x40 h VAL 99 Ca 0.24 -0.39 -0.08 0.00 0.82 0.00 0.00 66.70 67.29 2x40 h VAL 99 Cb 0.06 0.04 -0.02 0.00 -1.52 0.00 0.00 31.29 29.84 2x40 h VAL 99 CO -0.12 0.20 0.04 1.23 0.02 0.00 0.00 177.57 178.94 2x40 h GLY 100 N 1.09 1.02 0.90 2.17 0.00 -0.48 -1.79 103.07 105.97 2x40 h GLY 100 Ca 0.29 -0.69 -0.07 0.00 0.00 0.00 0.00 47.33 46.86 2x40 h GLY 100 CO -0.06 0.64 -0.08 0.50 0.00 0.00 0.00 176.54 177.53 2x40 h LYS 101 N 0.88 0.60 0.03 4.80 1.57 -0.73 0.18 116.57 123.90 2x40 h LYS 101 Ca 0.17 -0.23 -0.00 0.00 -1.87 0.00 0.00 60.65 58.72 2x40 h LYS 101 Cb 0.47 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.74 2x40 h LYS 101 CO 0.02 0.79 -0.02 0.00 -0.57 0.00 0.00 179.45 179.67 2x40 h ALA 102 N 0.79 -0.05 -0.79 3.86 0.00 -1.29 0.12 119.26 121.90 2x40 h ALA 102 Ca 0.08 -0.05 0.01 0.00 0.00 0.00 0.00 54.91 54.94 2x40 h ALA 102 Cb 0.57 0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.34 2x40 h ALA 102 CO 0.03 -0.48 0.51 0.52 0.00 0.00 0.00 179.25 179.83 2x40 h MET 103 N -0.14 1.05 -0.51 0.00 2.86 -1.33 -2.70 114.93 114.16 2x40 h MET 103 Ca -0.00 -0.07 0.05 0.00 -2.06 0.00 0.00 59.70 57.62 2x40 h MET 103 Cb 0.12 -0.23 -0.05 0.00 0.06 0.00 0.00 31.60 31.50 2x40 h MET 103 CO 0.01 0.70 0.24 0.78 1.06 0.00 0.00 176.91 179.70 2x40 h GLY 104 N 1.07 0.71 0.99 8.32 0.00 -0.23 -0.22 103.07 113.72 2x40 h GLY 104 Ca 0.29 -0.16 0.00 0.00 0.00 0.00 0.00 47.33 47.46 2x40 h GLY 104 CO -0.06 0.09 0.18 -2.09 0.00 0.00 0.00 176.54 174.66 2x40 h GLU 105 N 0.47 0.38 -0.34 4.80 4.81 -0.52 -0.80 114.58 123.38 2x40 h GLU 105 Ca 0.23 -0.03 0.03 0.00 -0.13 0.00 0.00 59.36 59.47 2x40 h GLU 105 Cb 0.17 -0.08 -0.03 0.00 0.63 0.00 0.00 28.75 29.43 2x40 h GLU 105 CO -0.18 0.27 0.13 0.93 -0.73 0.00 0.00 179.01 179.43 2x40 h GLU 106 N 0.38 0.28 -0.44 1.92 5.08 -1.15 -0.25 114.58 120.40 2x40 h GLU 106 Ca 0.10 -0.02 0.06 0.00 -1.00 0.00 0.00 59.36 58.50 2x40 h GLU 106 Cb -0.02 -0.06 -0.05 0.00 0.50 0.00 0.00 28.75 29.11 2x40 h GLU 106 CO -0.02 0.19 0.15 0.28 -1.00 0.00 0.00 179.01 178.60 2x40 h VAL 107 N 0.29 0.86 0.13 3.13 2.07 -0.72 -1.68 116.25 120.33 2x40 h VAL 107 Ca 0.15 -0.11 -0.01 0.00 0.82 0.00 0.00 66.70 67.56 2x40 h VAL 107 Cb 0.10 0.51 0.00 0.00 -1.52 0.00 0.00 31.29 30.39 2x40 h VAL 107 CO -0.14 0.06 -0.06 -0.09 0.02 0.00 0.00 177.57 177.36 2x40 h ARG 108 N 0.32 -0.16 0.00 1.57 2.43 -0.68 -1.56 114.38 116.29 2x40 h ARG 108 Ca 0.20 0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.39 2x40 h ARG 108 Cb 0.20 0.04 0.00 0.00 -0.42 0.00 0.00 29.97 29.79 2x40 h ARG 108 CO -0.21 -0.02 0.00 0.93 -1.51 0.00 0.00 179.97 179.15 2x40 h GLU 109 N -0.27 0.00 -0.53 0.20 4.39 -0.76 -2.05 114.58 115.56 2x40 h GLU 109 Ca -0.02 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.68 2x40 h GLU 109 Cb 0.22 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.87 2x40 h GLU 109 CO 0.03 0.00 0.00 0.66 -1.16 0.00 0.00 179.01 178.54 2x40 n TYR 110 N -2.35 0.70 -0.93 4.33 4.01 -0.66 -0.65 117.16 121.62 2x40 n TYR 110 Ca 0.02 -0.35 0.00 0.00 -0.16 0.00 0.00 57.90 57.41 2x40 n TYR 110 Cb 0.27 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.30 2x40 n TYR 110 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2x40 n GLY 111 N 1.46 0.47 3.85 2.72 0.00 -0.77 -4.85 105.19 108.07 2x40 n GLY 111 Ca 0.20 -0.95 -0.37 0.00 0.00 0.00 0.00 46.02 44.90 2x40 n GLY 111 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2x40 s VAL 112 N -2.00 5.13 -0.22 1.61 1.01 -0.59 -4.73 120.40 120.61 2x40 s VAL 112 Ca 0.00 0.67 0.05 0.00 0.00 0.00 0.00 61.98 62.70 2x40 s VAL 112 Cb 0.00 -3.64 -0.20 0.00 0.00 0.00 0.00 36.38 32.53 2x40 s VAL 112 CO 0.00 0.56 -0.05 0.47 0.00 0.00 0.00 175.10 176.08 2x40 n ASP 113 N 1.75 1.51 -3.81 3.32 10.43 -0.26 -4.23 116.55 125.26 2x40 n ASP 113 Ca -0.15 -0.04 -0.23 0.00 2.57 0.00 0.00 54.79 56.95 2x40 n ASP 113 Cb 0.53 -0.14 -0.17 0.00 1.84 0.00 0.00 41.12 43.17 2x40 n ASP 113 CO 0.00 0.00 0.00 -0.69 -1.07 0.00 0.00 177.20 175.44 2x40 s VAL 114 N -2.52 0.49 -0.06 2.53 1.01 -0.62 -1.05 120.40 120.19 2x40 s VAL 114 Ca -0.26 0.03 -0.23 0.00 0.00 0.00 0.00 61.98 61.51 2x40 s VAL 114 Cb 0.08 -0.61 -0.04 0.00 0.00 0.00 0.00 36.38 35.81 2x40 s VAL 114 CO 0.68 0.27 0.70 -0.22 0.00 0.00 0.00 175.10 176.53 2x40 s LEU 115 N 1.77 4.33 -1.28 3.92 2.96 0.67 -1.88 118.68 129.17 2x40 s LEU 115 Ca 0.03 1.20 -0.14 0.00 -0.22 0.00 0.00 54.13 54.99 2x40 s LEU 115 Cb -0.13 -3.09 0.12 0.00 0.50 0.00 0.00 46.19 43.60 2x40 s LEU 115 CO -0.05 -0.10 1.70 0.18 -1.32 0.00 0.00 176.35 176.76 2x40 n LEU 116 N 3.68 5.57 -3.58 -0.68 4.77 0.43 -1.57 117.00 125.62 2x40 n LEU 116 Ca -0.02 -4.28 -0.07 0.00 -0.03 0.00 0.00 56.01 51.62 2x40 n LEU 116 Cb 0.51 -1.64 -0.03 0.00 -2.33 0.00 0.00 43.42 39.93 2x40 n LEU 116 CO 0.47 0.70 0.89 0.00 -1.33 0.00 0.00 177.39 178.12 2x40 s ALA 117 N 2.41 -1.98 0.41 -1.18 0.00 -0.98 -3.67 121.76 116.76 2x40 s ALA 117 Ca 0.46 1.51 -0.05 0.00 0.00 0.00 0.00 51.96 53.87 2x40 s ALA 117 Cb 0.03 -0.37 -0.04 0.00 0.00 0.00 0.00 23.12 22.74 2x40 s ALA 117 CO 0.02 -0.48 0.71 -1.25 0.00 0.00 0.00 175.76 174.75 2x40 s PRO 118 N -2.00 3.60 0.11 0.00 0.04 -1.24 -1.52 135.00 134.00 2x40 s PRO 118 Ca 0.05 0.14 -0.23 0.00 0.04 0.00 0.00 61.00 61.00 2x40 s PRO 118 Cb -0.01 -2.47 -0.07 0.00 0.04 0.00 0.00 34.50 31.99 2x40 s PRO 118 CO -0.04 -0.04 0.71 0.00 0.04 0.00 0.00 177.00 177.66 2x40 s ALA 119 N -2.49 3.48 -0.01 8.56 0.00 -1.26 -2.21 121.76 127.84 2x40 s ALA 119 Ca 0.46 0.24 0.18 0.00 0.00 0.00 0.00 51.96 52.84 2x40 s ALA 119 Cb -0.10 -2.86 0.30 0.00 0.00 0.00 0.00 23.12 20.46 2x40 s ALA 119 CO 0.38 0.29 1.12 0.00 0.00 0.00 0.00 175.76 177.54 2x40 n MET 120 N 1.86 0.03 -1.95 0.00 0.00 0.16 -4.36 117.12 112.86 2x40 n MET 120 Ca -0.07 -1.71 -0.36 0.00 0.00 0.00 0.00 57.70 55.57 2x40 n MET 120 Cb 0.50 0.14 0.04 0.00 0.00 0.00 0.00 33.22 33.89 2x40 n MET 120 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 175.97 175.17 2x40 s ASN 121 N -1.71 5.06 0.40 3.17 -0.87 -1.25 -4.85 114.94 114.89 2x40 s ASN 121 Ca 0.23 2.42 -0.25 0.00 -1.57 0.00 0.00 52.86 53.69 2x40 s ASN 121 Cb 0.27 -2.60 -0.08 0.00 -0.02 0.00 0.00 41.25 38.81 2x40 s ASN 121 CO -0.12 -1.68 1.13 -0.63 -2.57 0.00 0.00 177.10 173.23 2x40 s ILE 122 N -1.59 3.33 -1.21 0.60 -1.09 -1.26 -4.43 121.20 115.54 2x40 s ILE 122 Ca 0.78 1.08 -0.20 0.00 -2.23 0.00 0.00 60.65 60.08 2x40 s ILE 122 Cb -0.31 -3.58 0.04 0.00 -1.58 0.00 0.00 42.46 37.02 2x40 s ILE 122 CO 0.35 0.06 1.72 -1.00 -1.23 0.00 0.00 174.94 174.84 2x40 s HIS 123 N -1.50 2.56 0.09 3.97 3.76 -0.40 -4.75 115.29 119.04 2x40 s HIS 123 Ca 0.58 -1.06 -0.15 0.00 -0.15 0.00 0.00 55.06 54.28 2x40 s HIS 123 Cb -0.28 -4.60 -0.10 0.00 1.11 0.00 0.00 32.58 28.71 2x40 s HIS 123 CO 0.35 -1.74 1.39 -0.09 -0.85 0.00 0.00 174.74 173.80 2x40 h ARG 124 N 8.49 0.69 -3.35 1.40 2.43 -1.89 -3.41 114.38 118.73 2x40 h ARG 124 Ca 0.35 -0.40 -0.22 0.00 -0.81 0.00 0.00 59.98 58.90 2x40 h ARG 124 Cb 0.91 0.03 -0.29 0.00 -0.42 0.00 0.00 29.97 30.20 2x40 h ARG 124 CO 1.41 1.02 -0.59 1.21 -1.51 0.00 0.00 179.97 181.50 2x40 s ASN 125 N -6.60 -0.11 0.56 -3.80 3.84 -1.26 -4.61 114.94 102.95 2x40 s ASN 125 Ca -0.12 0.27 0.25 0.00 0.21 0.00 0.00 52.86 53.46 2x40 s ASN 125 Cb 0.08 0.21 1.52 0.00 -0.55 0.00 0.00 41.25 42.51 2x40 s ASN 125 CO 0.84 -0.10 2.11 -0.65 -2.79 0.00 0.00 177.10 176.51 2x40 h PRO 126 N 6.62 0.00 0.00 0.43 0.11 -1.95 -2.54 132.00 134.67 2x40 h PRO 126 Ca -0.34 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.77 2x40 h PRO 126 Cb 1.17 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.28 2x40 h PRO 126 CO 0.43 0.00 0.00 1.28 -0.21 0.00 0.00 178.00 179.50 2x40 n LEU 127 N -4.13 0.32 -4.69 2.35 4.77 -1.26 -4.72 117.00 109.64 2x40 n LEU 127 Ca 0.02 0.56 -0.42 0.00 -0.03 0.00 0.00 56.01 56.14 2x40 n LEU 127 Cb 0.29 -0.50 -0.03 0.00 -2.33 0.00 0.00 43.42 40.85 2x40 n LEU 127 CO 0.31 -0.29 1.48 0.00 -1.33 0.00 0.00 177.39 177.55 2x40 h GLY 129 N 8.47 0.00 -1.30 0.00 0.00 -1.84 -2.28 103.07 106.12 2x40 h GLY 129 Ca -0.46 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.87 2x40 h GLY 129 CO 0.95 0.00 0.00 0.54 0.00 0.00 0.00 176.54 178.03 2x40 n ARG 130 N -3.40 2.87 -0.32 4.80 1.74 -1.26 -2.90 116.66 118.19 2x40 n ARG 130 Ca -0.01 -2.07 0.19 0.00 -0.77 0.00 0.00 57.85 55.18 2x40 n ARG 130 Cb 0.21 -1.28 0.44 0.00 -1.02 0.00 0.00 32.46 30.81 2x40 n ARG 130 CO 0.00 0.00 0.00 -0.91 -1.52 0.00 0.00 177.63 175.20 2x40 h ASN 131 N 2.05 0.57 -0.66 0.55 2.35 -1.74 -0.88 115.58 117.83 2x40 h ASN 131 Ca 0.00 0.09 0.11 0.00 -0.55 0.00 0.00 56.30 55.95 2x40 h ASN 131 Cb 0.74 -0.01 -0.04 0.00 0.05 0.00 0.00 38.32 39.06 2x40 h ASN 131 CO 0.00 0.16 0.44 2.19 -1.65 0.00 0.00 177.43 178.57 2x40 h PHE 132 N 0.53 0.47 -0.58 1.19 -0.00 -1.80 -0.76 116.94 116.00 2x40 h PHE 132 Ca 0.58 0.01 0.00 0.00 -0.00 0.00 0.00 57.97 58.56 2x40 h PHE 132 Cb 1.23 -0.15 0.00 0.00 -0.00 0.00 0.00 35.95 37.03 2x40 h PHE 132 CO -0.00 0.21 0.00 -0.85 -0.00 0.00 0.00 178.31 177.67 2x40 n GLU 133 N -4.47 4.58 -4.31 6.09 0.28 -0.34 -1.13 120.64 121.33 2x40 n GLU 133 Ca 0.11 -3.01 -0.23 0.00 -0.16 0.00 0.00 57.16 53.87 2x40 n GLU 133 Cb 0.41 -2.18 -0.08 0.00 1.43 0.00 0.00 31.44 31.03 2x40 n GLU 133 CO 0.00 0.00 0.00 0.71 -0.16 0.00 0.00 177.13 177.68 2x40 s TYR 134 N -2.54 2.60 -0.08 -1.84 2.02 -0.29 -4.33 117.35 112.90 2x40 s TYR 134 Ca 0.52 -0.29 -0.00 0.00 -0.37 0.00 0.00 57.07 56.93 2x40 s TYR 134 Cb 0.39 -1.25 -0.00 0.00 -0.40 0.00 0.00 41.96 40.70 2x40 s TYR 134 CO 0.17 0.59 -0.01 1.88 -1.57 0.00 0.00 175.55 176.62 2x40 h TYR 135 N 1.91 0.00 -3.61 2.71 0.05 -1.77 -2.55 116.97 113.70 2x40 h TYR 135 Ca -0.43 0.00 -0.06 0.00 0.05 0.00 0.00 58.73 58.29 2x40 h TYR 135 Cb 1.25 0.00 -0.10 0.00 1.01 0.00 0.00 36.73 38.89 2x40 h TYR 135 CO 0.70 0.00 -0.13 0.45 -1.05 0.00 0.00 178.16 178.13 2x40 s SER 136 N -4.96 -0.10 0.00 3.88 0.15 -1.26 -4.61 113.70 106.80 2x40 s SER 136 Ca -0.00 -0.78 0.28 0.00 0.70 0.00 0.00 55.95 56.14 2x40 s SER 136 Cb 0.00 0.54 1.00 0.00 -1.71 0.00 0.00 66.02 65.85 2x40 s SER 136 CO 0.01 -1.05 1.72 -1.84 1.20 0.00 0.00 173.24 173.28 2x40 n GLU 137 N -0.32 0.76 -4.68 5.44 0.28 -1.00 -1.27 120.64 119.86 2x40 n GLU 137 Ca -0.06 -0.36 -0.33 0.00 -0.16 0.00 0.00 57.16 56.24 2x40 n GLU 137 Cb 0.62 -1.49 -0.12 0.00 1.43 0.00 0.00 31.44 31.88 2x40 n GLU 137 CO 0.00 0.00 0.00 0.34 -0.16 0.00 0.00 177.13 177.31 2x40 s ASP 138 N -2.49 4.40 0.22 -1.84 2.15 -1.26 -4.70 116.67 113.15 2x40 s ASP 138 Ca 0.27 -0.15 0.05 0.00 0.43 0.00 0.00 52.55 53.15 2x40 s ASP 138 Cb 0.20 -1.31 0.19 0.00 -0.30 0.00 0.00 42.92 41.70 2x40 s ASP 138 CO 0.50 0.28 1.52 -0.65 -0.17 0.00 0.00 175.17 176.64 2x40 h PRO 139 N 5.85 0.17 0.02 4.34 0.11 -1.89 -1.41 132.00 139.19 2x40 h PRO 139 Ca -0.40 -0.14 -0.00 0.00 0.11 0.00 0.00 66.00 65.57 2x40 h PRO 139 Cb 1.18 0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.32 2x40 h PRO 139 CO 0.55 0.79 -0.01 0.28 -0.21 0.00 0.00 178.00 179.40 2x40 h VAL 140 N 0.12 1.32 -0.37 3.15 2.07 -1.91 0.19 116.25 120.82 2x40 h VAL 140 Ca -0.02 -1.04 0.02 0.00 0.82 0.00 0.00 66.70 66.49 2x40 h VAL 140 Cb 1.23 2.02 -0.03 0.00 -1.52 0.00 0.00 31.29 32.98 2x40 h VAL 140 CO 0.10 0.27 0.20 0.25 0.02 0.00 0.00 177.57 178.41 2x40 h LEU 141 N -0.47 0.31 -0.29 2.57 5.85 -1.92 0.76 115.31 122.12 2x40 h LEU 141 Ca -0.00 0.01 -0.03 0.00 0.84 0.00 0.00 57.88 58.70 2x40 h LEU 141 Cb 0.45 -0.05 -0.01 0.00 0.37 0.00 0.00 40.66 41.42 2x40 h LEU 141 CO 0.00 0.22 0.06 -1.28 -0.34 0.00 0.00 178.44 177.11 2x40 h SER 142 N 0.41 0.44 -0.50 1.25 0.87 -1.27 -1.45 113.55 113.30 2x40 h SER 142 Ca 0.15 -0.24 -0.10 0.00 -1.23 0.00 0.00 61.79 60.36 2x40 h SER 142 Cb 0.04 -0.12 -0.02 0.00 -0.44 0.00 0.00 62.40 61.86 2x40 h SER 142 CO -0.09 0.57 -0.10 1.23 -0.53 0.00 0.00 176.83 177.92 2x40 h GLY 143 N 0.29 1.02 0.86 5.77 0.00 -0.46 -0.81 103.07 109.75 2x40 h GLY 143 Ca 0.09 -0.83 -0.02 0.00 0.00 0.00 0.00 47.33 46.57 2x40 h GLY 143 CO 0.00 0.76 0.06 0.83 0.00 0.00 0.00 176.54 178.19 2x40 h GLU 144 N 0.80 0.36 -0.44 4.80 4.39 -0.83 -1.09 114.58 122.58 2x40 h GLU 144 Ca 0.13 -0.09 0.02 0.00 0.34 0.00 0.00 59.36 59.76 2x40 h GLU 144 Cb 0.65 -0.05 -0.03 0.00 -0.10 0.00 0.00 28.75 29.22 2x40 h GLU 144 CO 0.04 0.47 0.26 0.52 -1.16 0.00 0.00 179.01 179.14 2x40 h MET 145 N 0.19 0.50 -0.51 2.33 2.86 -1.18 -1.87 114.93 117.24 2x40 h MET 145 Ca 0.07 -0.03 -0.02 0.00 -2.06 0.00 0.00 59.70 57.66 2x40 h MET 145 Cb 0.27 -0.11 -0.02 0.00 0.06 0.00 0.00 31.60 31.80 2x40 h MET 145 CO 0.00 0.33 0.24 0.00 1.06 0.00 0.00 176.91 178.54 2x40 h ALA 146 N 1.20 0.65 -0.29 6.32 0.00 -1.03 -1.19 119.26 124.92 2x40 h ALA 146 Ca 0.18 -0.13 0.05 0.00 0.00 0.00 0.00 54.91 55.01 2x40 h ALA 146 Cb 0.02 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 17.57 2x40 h ALA 146 CO -0.08 0.22 0.02 0.77 0.00 0.00 0.00 179.25 180.18 2x40 h SER 147 N 0.67 -0.08 -0.69 0.00 0.02 -0.99 0.14 113.55 112.63 2x40 h SER 147 Ca 0.17 0.06 -0.01 0.00 -0.84 0.00 0.00 61.79 61.17 2x40 h SER 147 Cb 0.13 0.10 -0.03 0.00 0.14 0.00 0.00 62.40 62.74 2x40 h SER 147 CO -0.02 -0.01 0.40 0.28 -1.14 0.00 0.00 176.83 176.34 2x40 h SER 148 N 0.11 0.84 -0.29 3.07 0.02 -1.14 -0.86 113.55 115.30 2x40 h SER 148 Ca 0.14 -0.08 -0.01 0.00 -0.84 0.00 0.00 61.79 60.99 2x40 h SER 148 Cb 0.17 -0.21 -0.01 0.00 0.14 0.00 0.00 62.40 62.48 2x40 h SER 148 CO -0.22 0.67 0.12 0.15 -1.14 0.00 0.00 176.83 176.42 2x40 h PHE 149 N 0.94 0.44 -0.66 3.45 3.57 -0.74 -2.59 116.94 121.35 2x40 h PHE 149 Ca 0.24 -0.03 -0.03 0.00 3.53 0.00 0.00 57.97 61.68 2x40 h PHE 149 Cb 0.00 -0.13 -0.03 0.00 2.79 0.00 0.00 35.95 38.58 2x40 h PHE 149 CO -0.01 0.42 0.29 0.28 -2.23 0.00 0.00 178.31 177.06 2x40 h VAL 150 N 0.33 1.23 -0.75 1.41 2.07 -0.46 -1.05 116.25 119.03 2x40 h VAL 150 Ca 0.10 -0.68 0.05 0.00 0.82 0.00 0.00 66.70 66.98 2x40 h VAL 150 Cb 0.16 0.46 -0.05 0.00 -1.52 0.00 0.00 31.29 30.34 2x40 h VAL 150 CO -0.01 0.28 0.46 0.11 0.02 0.00 0.00 177.57 178.42 2x40 h LYS 151 N 0.92 0.83 0.59 1.57 1.57 -1.13 -1.19 116.57 119.71 2x40 h LYS 151 Ca 0.22 -0.05 -0.03 0.00 -1.87 0.00 0.00 60.65 58.92 2x40 h LYS 151 Cb 0.16 -0.19 0.01 0.00 0.08 0.00 0.00 32.23 32.29 2x40 h LYS 151 CO -0.02 0.55 -0.28 0.78 -0.57 0.00 0.00 179.45 179.90 2x40 h GLY 152 N 0.85 -0.82 0.47 3.86 0.00 -1.01 -2.04 103.07 104.38 2x40 h GLY 152 Ca 0.32 0.31 0.09 0.00 0.00 0.00 0.00 47.33 48.04 2x40 h GLY 152 CO -0.15 -0.30 0.27 -2.08 0.00 0.00 0.00 176.54 174.28 2x40 h VAL 153 N -0.79 0.82 -0.04 4.60 2.07 -0.96 -2.72 116.25 119.23 2x40 h VAL 153 Ca -0.08 -0.17 0.00 0.00 0.82 0.00 0.00 66.70 67.27 2x40 h VAL 153 Cb 0.61 0.29 0.00 0.00 -1.52 0.00 0.00 31.29 30.67 2x40 h VAL 153 CO 0.13 0.09 0.00 0.00 0.02 0.00 0.00 177.57 177.81 2x40 n GLN 154 N -4.93 1.43 0.00 1.57 6.02 -0.47 -2.37 117.38 118.63 2x40 n GLN 154 Ca 0.09 -0.64 0.14 0.00 -0.01 0.00 0.00 57.00 56.58 2x40 n GLN 154 Cb 0.25 -1.45 0.68 0.00 1.02 0.00 0.00 30.24 30.74 2x40 n GLN 154 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 177.06 174.92 2x40 n SER 155 N -0.21 0.00 -1.01 1.08 3.41 -0.77 -3.58 113.62 112.54 2x40 n SER 155 Ca 0.19 -0.03 0.08 0.00 -0.26 0.00 0.00 58.87 58.85 2x40 n SER 155 Cb 0.26 -0.31 0.24 0.00 -0.26 0.00 0.00 64.21 64.14 2x40 n SER 155 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2x40 n GLN 156 N -1.31 3.06 -1.03 4.33 1.13 -1.00 -4.95 117.38 117.62 2x40 n GLN 156 Ca 0.12 -2.47 -0.01 0.00 -1.94 0.00 0.00 57.00 52.70 2x40 n GLN 156 Cb 0.23 -1.56 -0.00 0.00 0.11 0.00 0.00 30.24 29.02 2x40 n GLN 156 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2x40 n GLY 157 N 0.64 0.46 3.59 1.08 0.00 -1.24 -4.84 105.19 104.89 2x40 n GLY 157 Ca 0.18 -0.17 -0.27 0.00 0.00 0.00 0.00 46.02 45.76 2x40 n GLY 157 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2x40 s VAL 158 N -1.86 1.90 -0.05 1.61 -7.23 -1.26 -4.07 120.40 109.44 2x40 s VAL 158 Ca 0.00 -2.02 -0.05 0.00 -1.81 0.00 0.00 61.98 58.10 2x40 s VAL 158 Cb 0.00 -2.94 -0.04 0.00 0.56 0.00 0.00 36.38 33.96 2x40 s VAL 158 CO 0.00 -0.02 0.19 -0.83 -0.31 0.00 0.00 175.10 174.13 2x40 s GLY 159 N -3.67 2.19 0.12 2.32 0.00 -0.21 -4.09 107.32 103.98 2x40 s GLY 159 Ca 0.35 -0.67 0.01 0.00 0.00 0.00 0.00 44.72 44.41 2x40 s GLY 159 CO 0.17 -0.49 0.26 0.00 0.00 0.00 0.00 173.10 173.05 2x40 s ALA 160 N -1.21 3.97 -0.24 3.20 0.00 -1.26 -0.24 121.76 125.98 2x40 s ALA 160 Ca 0.23 -0.93 -0.01 0.00 0.00 0.00 0.00 51.96 51.25 2x40 s ALA 160 Cb -0.13 -1.82 0.07 0.00 0.00 0.00 0.00 23.12 21.25 2x40 s ALA 160 CO 0.13 0.65 0.03 0.00 0.00 0.00 0.00 175.76 176.57 2x40 s ILE 162 N 1.63 3.89 0.15 0.00 -4.36 -0.96 -2.31 121.20 119.23 2x40 s ILE 162 Ca 0.01 1.86 -0.18 0.00 -0.26 0.00 0.00 60.65 62.09 2x40 s ILE 162 Cb -0.18 -4.17 0.04 0.00 1.25 0.00 0.00 42.46 39.40 2x40 s ILE 162 CO -0.12 0.41 0.46 -1.59 0.24 0.00 0.00 174.94 174.34 2x40 s LYS 163 N -1.37 1.18 -0.16 0.37 -2.85 -0.94 -1.12 119.74 114.84 2x40 s LYS 163 Ca 0.43 -0.71 -0.03 0.00 -1.00 0.00 0.00 55.97 54.66 2x40 s LYS 163 Cb -0.27 0.50 -0.02 0.00 -2.06 0.00 0.00 37.83 35.98 2x40 s LYS 163 CO 0.34 -0.48 -0.04 -1.01 0.10 0.00 0.00 175.35 174.25 2x40 s HIS 164 N -3.81 2.99 -0.49 1.78 0.09 -1.26 0.40 115.29 114.98 2x40 s HIS 164 Ca 0.04 -0.42 -0.20 0.00 -0.00 0.00 0.00 55.06 54.48 2x40 s HIS 164 Cb 0.01 -1.97 0.04 0.00 -0.00 0.00 0.00 32.58 30.66 2x40 s HIS 164 CO -0.10 -0.13 0.67 0.12 -0.00 0.00 0.00 174.74 175.30 2x40 s PHE 165 N 0.54 3.02 0.22 1.40 5.36 0.37 -3.95 117.98 124.95 2x40 s PHE 165 Ca -0.03 -0.32 -0.08 0.00 -0.96 0.00 0.00 56.93 55.53 2x40 s PHE 165 Cb -0.14 -3.54 -0.02 0.00 -0.34 0.00 0.00 43.02 38.98 2x40 s PHE 165 CO 0.03 -1.02 0.33 0.54 -1.46 0.00 0.00 175.22 173.64 2x40 s VAL 166 N 2.86 0.01 -1.39 3.12 0.11 -1.26 0.28 120.40 124.12 2x40 s VAL 166 Ca 0.19 -1.63 -0.10 0.00 -2.93 0.00 0.00 61.98 57.51 2x40 s VAL 166 Cb -0.17 -2.29 0.02 0.00 -1.53 0.00 0.00 36.38 32.42 2x40 s VAL 166 CO 0.15 -0.03 1.15 0.00 -3.33 0.00 0.00 175.10 173.04 2x40 n ALA 167 N -0.33 -1.32 -2.33 1.54 0.00 -1.25 -4.80 120.51 112.02 2x40 n ALA 167 Ca -0.01 0.36 -0.43 0.00 0.00 0.00 0.00 53.44 53.37 2x40 n ALA 167 Cb 0.64 -5.29 0.00 0.00 0.00 0.00 0.00 19.45 14.80 2x40 n ALA 167 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 2x40 n ASN 168 N -2.99 4.88 -1.15 0.00 4.05 -1.26 -4.75 115.26 114.04 2x40 n ASN 168 Ca 0.01 -3.03 0.09 0.00 0.45 0.00 0.00 54.58 52.10 2x40 n ASN 168 Cb 0.56 -1.54 0.27 0.00 1.23 0.00 0.00 39.78 40.30 2x40 n ASN 168 CO 0.00 0.00 0.00 0.59 -3.05 0.00 0.00 177.26 174.80 2x40 n ASN 169 N 4.79 3.86 -3.65 1.20 4.13 -1.26 -4.91 115.26 119.42 2x40 n ASN 169 Ca 0.42 -2.22 -0.14 0.00 1.68 0.00 0.00 54.58 54.32 2x40 n ASN 169 Cb 0.38 -0.44 -0.06 0.00 -1.54 0.00 0.00 39.78 38.12 2x40 n ASN 169 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2x40 s GLN 170 N -1.41 0.91 -0.02 3.52 -2.07 -1.26 -4.72 119.66 114.60 2x40 s GLN 170 Ca 0.41 -0.25 0.11 0.00 -1.82 0.00 0.00 55.36 53.81 2x40 s GLN 170 Cb 0.24 0.41 -0.23 0.00 -1.09 0.00 0.00 33.01 32.34 2x40 s GLN 170 CO 0.23 -0.30 0.75 0.93 -1.32 0.00 0.00 175.29 175.57 2x40 h GLU 171 N 3.11 0.01 -6.20 9.60 4.39 -1.91 -3.42 114.58 120.16 2x40 h GLU 171 Ca -0.30 -0.02 -0.63 0.00 0.34 0.00 0.00 59.36 58.75 2x40 h GLU 171 Cb 1.19 0.01 0.01 0.00 -0.10 0.00 0.00 28.75 29.86 2x40 h GLU 171 CO 0.42 0.59 1.17 2.41 -1.16 0.00 0.00 179.01 182.44 2x40 n THR 172 N -3.10 0.50 -3.02 1.13 -1.04 -1.26 -1.88 114.28 105.60 2x40 n THR 172 Ca -0.15 -0.16 -0.20 0.00 -2.04 0.00 0.00 64.05 61.51 2x40 n THR 172 Cb 1.04 -1.89 0.00 0.00 -1.82 0.00 0.00 70.33 67.66 2x40 n THR 172 CO 0.00 0.00 0.00 0.59 -0.64 0.00 0.00 175.07 175.02 2x40 n ASN 173 N 7.52 -4.16 0.19 8.00 4.13 -1.26 -4.82 115.26 124.86 2x40 n ASN 173 Ca 0.26 -0.19 0.15 0.00 1.68 0.00 0.00 54.58 56.47 2x40 n ASN 173 Cb 0.29 -3.45 0.75 0.00 -1.54 0.00 0.00 39.78 35.83 2x40 n ASN 173 CO 0.00 0.00 0.00 0.08 0.28 0.00 0.00 177.26 177.62 2x40 h ARG 174 N -0.74 0.00 -0.00 3.52 0.11 -1.62 0.19 114.38 115.83 2x40 h ARG 174 Ca -0.40 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.68 2x40 h ARG 174 Cb 1.28 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.36 2x40 h ARG 174 CO 0.48 0.00 -0.02 -1.33 0.10 0.00 0.00 179.97 179.20 2x40 n MET 175 N -4.16 0.02 0.00 0.08 2.81 -1.26 -1.69 117.12 112.91 2x40 n MET 175 Ca 0.01 -0.00 0.00 0.00 -1.81 0.00 0.00 57.70 55.90 2x40 n MET 175 Cb 0.28 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.29 2x40 n MET 175 CO 0.00 0.00 0.00 1.33 1.51 0.00 0.00 175.97 178.81 2x40 n VAL 176 N -1.49 0.00 -1.68 2.03 0.24 -0.57 -4.78 118.33 112.08 2x40 n VAL 176 Ca 0.07 0.00 -0.43 0.00 -2.04 0.00 0.00 64.34 61.94 2x40 n VAL 176 Cb 0.34 -0.57 -0.01 0.00 -1.47 0.00 0.00 33.84 32.13 2x40 n VAL 176 CO 0.00 0.00 0.00 0.55 -2.14 0.00 0.00 176.83 175.24 2x40 n VAL 177 N -1.64 1.85 -3.44 3.34 3.14 0.55 -4.54 118.33 117.60 2x40 n VAL 177 Ca 0.00 -0.46 -0.39 0.00 -2.96 0.00 0.00 64.34 60.53 2x40 n VAL 177 Cb 0.32 -1.46 -0.10 0.00 -1.06 0.00 0.00 33.84 31.55 2x40 n VAL 177 CO 0.00 0.00 0.00 -0.62 -6.46 0.00 0.00 176.83 169.75 2x40 s ASP 178 N -0.27 6.19 -0.33 6.55 2.15 -0.52 -1.53 116.67 128.90 2x40 s ASP 178 Ca 0.58 0.11 -0.14 0.00 0.43 0.00 0.00 52.55 53.52 2x40 s ASP 178 Cb -0.60 -2.19 -0.02 0.00 -0.30 0.00 0.00 42.92 39.81 2x40 s ASP 178 CO 0.60 -0.19 0.32 -0.89 -0.17 0.00 0.00 175.17 174.84 2x40 s THR 179 N 1.99 5.21 -0.37 1.71 2.01 -0.48 -1.42 115.64 124.29 2x40 s THR 179 Ca 0.13 0.01 -0.13 0.00 0.31 0.00 0.00 61.69 62.00 2x40 s THR 179 Cb -0.16 -3.77 0.00 0.00 0.01 0.00 0.00 72.50 68.58 2x40 s THR 179 CO 0.11 -0.04 0.26 -0.63 -0.69 0.00 0.00 174.62 173.62 2x40 s ILE 180 N 1.93 5.19 -0.02 1.82 -1.09 -0.50 -0.96 121.20 127.57 2x40 s ILE 180 Ca 0.10 -0.44 0.00 0.00 -2.23 0.00 0.00 60.65 58.08 2x40 s ILE 180 Cb -0.17 -3.76 0.02 0.00 -1.58 0.00 0.00 42.46 36.97 2x40 s ILE 180 CO 0.11 -0.13 0.02 -0.69 -1.23 0.00 0.00 174.94 173.01 2x40 s VAL 181 N 1.69 0.00 0.65 2.92 1.01 -1.26 -1.03 120.40 124.37 2x40 s VAL 181 Ca 0.05 0.13 -0.17 0.00 0.00 0.00 0.00 61.98 61.99 2x40 s VAL 181 Cb -0.18 -0.09 -0.01 0.00 0.00 0.00 0.00 36.38 36.10 2x40 s VAL 181 CO 0.10 0.07 1.20 -0.94 0.00 0.00 0.00 175.10 175.54 2x40 s SER 182 N 0.73 4.81 0.43 3.32 1.04 -1.26 -4.86 113.70 117.90 2x40 s SER 182 Ca -0.06 2.36 0.09 0.00 0.48 0.00 0.00 55.95 58.81 2x40 s SER 182 Cb -0.09 -2.59 0.92 0.00 0.10 0.00 0.00 66.02 64.36 2x40 s SER 182 CO -0.02 -1.85 2.07 -0.08 0.98 0.00 0.00 173.24 174.34 2x40 h GLU 183 N 0.39 0.46 -0.25 4.02 4.81 -1.99 -2.01 114.58 120.00 2x40 h GLU 183 Ca -0.49 -0.03 -0.01 0.00 -0.13 0.00 0.00 59.36 58.70 2x40 h GLU 183 Cb 1.30 -0.10 -0.01 0.00 0.63 0.00 0.00 28.75 30.56 2x40 h GLU 183 CO 0.53 0.30 0.11 -0.09 -0.73 0.00 0.00 179.01 179.14 2x40 h ARG 184 N 0.47 0.37 -0.60 1.92 2.43 -1.90 -0.95 114.38 116.12 2x40 h ARG 184 Ca 0.14 -0.06 -0.06 0.00 -0.81 0.00 0.00 59.98 59.19 2x40 h ARG 184 Cb -0.02 -0.06 -0.03 0.00 -0.42 0.00 0.00 29.97 29.44 2x40 h ARG 184 CO -0.03 0.38 0.13 0.00 -1.51 0.00 0.00 179.97 178.95 2x40 h ALA 185 N 0.97 1.11 0.49 2.80 0.00 -1.86 -0.87 119.26 121.90 2x40 h ALA 185 Ca 0.09 -0.23 -0.01 0.00 0.00 0.00 0.00 54.91 54.76 2x40 h ALA 185 Cb 0.14 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 2x40 h ALA 185 CO -0.01 0.59 -0.40 -0.07 0.00 0.00 0.00 179.25 179.36 2x40 h LEU 186 N 0.90 -1.07 -1.06 0.00 3.38 -1.09 0.42 115.31 116.78 2x40 h LEU 186 Ca 0.19 0.08 -0.10 0.00 0.09 0.00 0.00 57.88 58.14 2x40 h LEU 186 Cb 0.34 0.34 -0.01 0.00 0.09 0.00 0.00 40.66 41.42 2x40 h LEU 186 CO 0.00 -0.58 -0.46 0.03 0.09 0.00 0.00 178.44 177.52 2x40 h ARG 187 N -0.89 0.02 0.00 1.13 3.08 -1.02 0.48 114.38 117.18 2x40 h ARG 187 Ca -0.05 -0.01 -0.27 0.00 0.07 0.00 0.00 59.98 59.72 2x40 h ARG 187 Cb 0.76 0.00 -0.05 0.00 0.08 0.00 0.00 29.97 30.77 2x40 h ARG 187 CO -0.01 0.48 -1.57 0.93 -1.07 0.00 0.00 179.97 178.72 2x40 h GLU 188 N 0.01 0.00 0.00 0.04 5.08 -1.10 -3.33 114.58 115.29 2x40 h GLU 188 Ca -0.00 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.35 2x40 h GLU 188 Cb 0.83 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.07 2x40 h GLU 188 CO 0.06 0.53 -0.60 -0.89 -1.00 0.00 0.00 179.01 177.12 2x40 n ILE 189 N -3.07 0.52 -0.01 3.13 2.08 0.12 -4.66 119.36 117.47 2x40 n ILE 189 Ca -0.14 0.17 -0.22 0.00 0.56 0.00 0.00 62.75 63.12 2x40 n ILE 189 Cb 1.01 -1.54 -0.13 0.00 -0.75 0.00 0.00 39.64 38.22 2x40 n ILE 189 CO 0.00 0.00 0.00 1.88 0.56 0.00 0.00 176.55 178.99 2x40 h TYR 190 N -0.01 0.39 0.00 1.39 0.05 -1.18 -3.34 116.97 114.27 2x40 h TYR 190 Ca -0.00 -0.29 -0.15 0.00 0.05 0.00 0.00 58.73 58.34 2x40 h TYR 190 Cb 0.59 -0.02 -0.02 0.00 1.01 0.00 0.00 36.73 38.30 2x40 h TYR 190 CO -0.00 1.62 -0.73 -0.07 -1.05 0.00 0.00 178.16 177.93 2x40 h LEU 191 N -0.29 0.00 -0.74 3.88 3.38 -0.31 -3.38 115.31 117.85 2x40 h LEU 191 Ca -0.35 0.00 0.08 0.00 0.09 0.00 0.00 57.88 57.70 2x40 h LEU 191 Cb 1.78 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 42.47 2x40 h LEU 191 CO 0.03 0.73 0.40 -0.09 0.09 0.00 0.00 178.44 179.59 2x40 h ARG 192 N 0.00 0.68 -0.27 1.13 9.65 -1.67 0.14 114.38 124.03 2x40 h ARG 192 Ca -0.01 -0.04 -0.01 0.00 -1.10 0.00 0.00 59.98 58.82 2x40 h ARG 192 Cb 1.45 -0.15 -0.01 0.00 -1.39 0.00 0.00 29.97 29.86 2x40 h ARG 192 CO 0.09 0.45 0.12 0.78 2.80 0.00 0.00 179.97 184.22 2x40 h GLY 193 N 0.70 0.43 1.24 2.80 0.00 -1.73 -2.03 103.07 104.48 2x40 h GLY 193 Ca 0.35 -0.22 -0.03 0.00 0.00 0.00 0.00 47.33 47.43 2x40 h GLY 193 CO -0.23 0.21 0.32 0.74 0.00 0.00 0.00 176.54 177.58 2x40 h PHE 194 N 0.30 0.98 -0.39 5.60 0.04 -1.38 -1.47 116.94 120.63 2x40 h PHE 194 Ca 0.09 -0.04 0.01 0.00 2.80 0.00 0.00 57.97 60.83 2x40 h PHE 194 Cb 0.15 -0.31 -0.02 0.00 2.20 0.00 0.00 35.95 37.97 2x40 h PHE 194 CO -0.01 0.72 0.25 1.49 -0.60 0.00 0.00 178.31 180.16 2x40 h GLU 195 N 0.98 0.50 -0.38 1.51 4.81 -0.52 0.64 114.58 122.11 2x40 h GLU 195 Ca 0.24 -0.03 -0.01 0.00 -0.13 0.00 0.00 59.36 59.43 2x40 h GLU 195 Cb 0.11 -0.11 -0.02 0.00 0.63 0.00 0.00 28.75 29.36 2x40 h GLU 195 CO -0.03 0.33 0.20 0.82 -0.73 0.00 0.00 179.01 179.60 2x40 h ILE 196 N 0.51 1.16 -0.51 2.32 2.04 -0.78 -1.93 117.51 120.32 2x40 h ILE 196 Ca 0.14 -0.42 -0.06 0.00 1.00 0.00 0.00 64.86 65.52 2x40 h ILE 196 Cb -0.05 0.73 -0.02 0.00 -0.74 0.00 0.00 36.82 36.75 2x40 h ILE 196 CO -0.04 0.16 0.07 0.00 0.00 0.00 0.00 178.15 178.35 2x40 h ALA 197 N 1.06 0.68 -0.86 1.87 0.00 -0.98 -0.52 119.26 120.51 2x40 h ALA 197 Ca 0.13 -0.25 -0.03 0.00 0.00 0.00 0.00 54.91 54.77 2x40 h ALA 197 Cb 0.08 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 17.64 2x40 h ALA 197 CO -0.02 0.43 0.42 0.28 0.00 0.00 0.00 179.25 180.36 2x40 h VAL 198 N 0.73 1.26 0.02 0.00 2.07 -0.73 -1.18 116.25 118.43 2x40 h VAL 198 Ca 0.15 -0.72 -0.26 0.00 0.82 0.00 0.00 66.70 66.70 2x40 h VAL 198 Cb 0.42 0.15 -0.03 0.00 -1.52 0.00 0.00 31.29 30.31 2x40 h VAL 198 CO 0.01 0.31 -1.36 0.11 0.02 0.00 0.00 177.57 176.66 2x40 h LYS 199 N 1.22 0.05 0.00 1.57 1.57 -1.18 -2.90 116.57 116.90 2x40 h LYS 199 Ca 0.30 -0.08 -0.17 0.00 -1.87 0.00 0.00 60.65 58.82 2x40 h LYS 199 Cb 0.10 0.03 -0.03 0.00 0.08 0.00 0.00 32.23 32.42 2x40 h LYS 199 CO -0.04 0.84 -1.49 1.63 -0.57 0.00 0.00 179.45 179.82 2x40 n LYS 200 N -3.26 0.63 0.00 3.15 5.02 -0.22 -4.64 118.16 118.84 2x40 n LYS 200 Ca -0.09 0.19 0.00 0.00 -2.02 0.00 0.00 58.31 56.39 2x40 n LYS 200 Cb 1.00 -1.78 0.00 0.00 -0.02 0.00 0.00 35.03 34.23 2x40 n LYS 200 CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75 2x40 n SER 201 N -2.86 1.70 -3.47 4.39 3.41 -0.45 -5.03 113.62 111.31 2x40 n SER 201 Ca -0.11 -0.18 -0.19 0.00 -0.26 0.00 0.00 58.87 58.14 2x40 n SER 201 Cb 0.85 0.70 0.02 0.00 -0.26 0.00 0.00 64.21 65.52 2x40 n SER 201 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2x40 n LYS 202 N -0.87 -1.42 -1.84 4.33 5.02 -1.10 -4.71 118.16 117.58 2x40 n LYS 202 Ca 0.00 0.88 -0.39 0.00 -2.02 0.00 0.00 58.31 56.78 2x40 n LYS 202 Cb 0.00 -4.42 0.03 0.00 -0.02 0.00 0.00 35.03 30.62 2x40 n LYS 202 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 2x40 s PRO 203 N -4.69 3.34 0.44 1.97 0.04 -1.26 -4.88 135.00 129.97 2x40 s PRO 203 Ca 0.23 2.23 0.16 0.00 0.04 0.00 0.00 61.00 63.67 2x40 s PRO 203 Cb -0.07 -2.38 1.09 0.00 0.04 0.00 0.00 34.50 33.18 2x40 s PRO 203 CO 0.82 -1.03 1.96 -1.49 0.04 0.00 0.00 177.00 177.30 2x40 h TRP 204 N 1.75 0.39 -3.42 0.56 4.06 -1.89 -3.41 115.95 113.99 2x40 h TRP 204 Ca -0.51 0.01 -0.05 0.00 2.06 0.00 0.00 58.89 60.40 2x40 h TRP 204 Cb 1.29 -0.13 -0.13 0.00 -1.00 0.00 0.00 29.16 29.19 2x40 h TRP 204 CO 0.48 0.17 -0.08 -1.54 -3.56 0.00 0.00 178.44 173.90 2x40 s SER 205 N -6.11 -0.21 0.00 -3.49 1.04 -1.10 -2.37 113.70 101.45 2x40 s SER 205 Ca -0.07 -0.37 0.04 0.00 0.48 0.00 0.00 55.95 56.03 2x40 s SER 205 Cb 0.20 0.48 -0.01 0.00 0.10 0.00 0.00 66.02 66.79 2x40 s SER 205 CO 0.75 -0.87 -0.14 -0.69 0.98 0.00 0.00 173.24 173.28 2x40 s VAL 206 N -3.82 1.07 -0.28 5.02 1.01 -0.73 -2.27 120.40 120.41 2x40 s VAL 206 Ca 0.04 -0.67 -0.07 0.00 0.00 0.00 0.00 61.98 61.28 2x40 s VAL 206 Cb 0.02 -0.91 -0.00 0.00 0.00 0.00 0.00 36.38 35.48 2x40 s VAL 206 CO -0.11 0.23 0.07 -0.32 0.00 0.00 0.00 175.10 174.97 2x40 s MET 207 N -0.51 3.26 0.28 2.72 1.75 -0.28 -0.63 119.30 125.90 2x40 s MET 207 Ca 0.04 -0.74 -0.29 0.00 -1.25 0.00 0.00 55.69 53.45 2x40 s MET 207 Cb -0.06 -3.32 -0.10 0.00 2.84 0.00 0.00 34.83 34.19 2x40 s MET 207 CO -0.00 -0.35 1.29 -1.54 -0.65 0.00 0.00 175.02 173.77 2x40 s SER 208 N 1.53 6.87 0.87 1.11 1.04 -0.40 -0.48 113.70 124.23 2x40 s SER 208 Ca 0.04 2.55 -0.11 0.00 0.48 0.00 0.00 55.95 58.91 2x40 s SER 208 Cb -0.16 -2.63 0.11 0.00 0.10 0.00 0.00 66.02 63.44 2x40 s SER 208 CO 0.02 -0.49 1.10 0.00 0.98 0.00 0.00 173.24 174.85 2x40 s ALA 209 N -0.69 1.67 0.10 5.32 0.00 0.14 -2.38 121.76 125.92 2x40 s ALA 209 Ca 0.51 0.25 -0.14 0.00 0.00 0.00 0.00 51.96 52.58 2x40 s ALA 209 Cb -0.38 -3.30 -0.10 0.00 0.00 0.00 0.00 23.12 19.34 2x40 s ALA 209 CO 0.46 -2.33 1.39 1.88 0.00 0.00 0.00 175.76 177.16 2x40 h TYR 210 N -1.54 0.90 -4.19 0.00 0.05 -1.90 -3.35 116.97 106.94 2x40 h TYR 210 Ca -0.46 -0.30 -0.50 0.00 0.05 0.00 0.00 58.73 57.52 2x40 h TYR 210 Cb 1.26 -0.18 0.15 0.00 1.01 0.00 0.00 36.73 38.97 2x40 h TYR 210 CO 0.50 1.08 0.27 0.54 -1.05 0.00 0.00 178.16 179.50 2x40 s ASN 211 N -6.68 3.85 0.37 3.88 4.22 -0.68 -4.55 114.94 115.35 2x40 s ASN 211 Ca -0.12 1.73 -0.19 0.00 -2.14 0.00 0.00 52.86 52.14 2x40 s ASN 211 Cb 0.09 -2.39 -0.10 0.00 1.28 0.00 0.00 41.25 40.12 2x40 s ASN 211 CO 0.85 -2.44 0.86 -0.54 -2.04 0.00 0.00 177.10 173.78 2x40 s LYS 212 N -4.87 4.16 -0.23 3.55 1.02 -0.58 -2.05 119.74 120.73 2x40 s LYS 212 Ca 0.63 0.95 0.02 0.00 0.02 0.00 0.00 55.97 57.59 2x40 s LYS 212 Cb -0.18 -2.34 0.05 0.00 -0.52 0.00 0.00 37.83 34.83 2x40 s LYS 212 CO 0.57 0.08 -0.13 -1.17 -0.92 0.00 0.00 175.35 173.78 2x40 s LEU 213 N -2.99 2.98 -1.46 3.17 2.96 0.11 -1.38 118.68 122.07 2x40 s LEU 213 Ca 0.57 -1.17 -0.11 0.00 -0.22 0.00 0.00 54.13 53.21 2x40 s LEU 213 Cb -0.10 -1.48 0.07 0.00 0.50 0.00 0.00 46.19 45.18 2x40 s LEU 213 CO 0.16 -0.15 0.77 0.59 -1.32 0.00 0.00 176.35 176.40 2x40 n ASN 214 N 4.51 -4.76 0.00 3.68 3.02 -0.13 -2.48 115.26 119.09 2x40 n ASN 214 Ca -0.15 -0.56 0.00 0.00 -0.03 0.00 0.00 54.58 53.83 2x40 n ASN 214 Cb 0.44 -3.84 0.00 0.00 -0.61 0.00 0.00 39.78 35.77 2x40 n ASN 214 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2x40 n GLY 215 N -1.51 1.15 3.01 7.41 0.00 -1.26 -5.07 105.19 108.92 2x40 n GLY 215 Ca -0.00 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.76 2x40 n GLY 215 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2x40 s LYS 216 N -0.60 1.84 0.16 1.61 1.02 -1.04 -5.05 119.74 117.68 2x40 s LYS 216 Ca 0.00 -0.43 -0.32 0.00 0.02 0.00 0.00 55.97 55.24 2x40 s LYS 216 Cb 0.00 -1.59 -0.17 0.00 -0.52 0.00 0.00 37.83 35.55 2x40 s LYS 216 CO 0.00 -0.05 0.92 0.66 -0.92 0.00 0.00 175.35 175.96 2x40 n TYR 217 N 4.14 0.59 0.09 3.18 4.01 -1.26 0.09 117.16 128.00 2x40 n TYR 217 Ca -0.20 0.85 0.04 0.00 -0.16 0.00 0.00 57.90 58.43 2x40 n TYR 217 Cb 0.51 -2.14 0.45 0.00 -0.31 0.00 0.00 39.34 37.85 2x40 n TYR 217 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2x40 n SER 219 N -4.41 0.00 -0.13 0.00 3.41 -1.26 -2.69 113.62 108.55 2x40 n SER 219 Ca 0.00 -0.04 0.03 0.00 -0.26 0.00 0.00 58.87 58.61 2x40 n SER 219 Cb 0.15 -0.28 0.05 0.00 -0.26 0.00 0.00 64.21 63.87 2x40 n SER 219 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2x40 n GLN 220 N -1.28 1.25 -3.24 4.33 6.02 0.14 -4.28 117.38 120.33 2x40 n GLN 220 Ca 0.10 -1.56 -0.46 0.00 -0.01 0.00 0.00 57.00 55.07 2x40 n GLN 220 Cb 0.17 -0.97 -0.05 0.00 1.02 0.00 0.00 30.24 30.42 2x40 n GLN 220 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 177.06 177.26 2x40 s ASN 221 N -1.43 6.21 0.24 1.08 3.84 -0.18 -4.77 114.94 119.94 2x40 s ASN 221 Ca 0.10 -1.71 -0.05 0.00 0.21 0.00 0.00 52.86 51.41 2x40 s ASN 221 Cb 0.09 -2.24 0.26 0.00 -0.55 0.00 0.00 41.25 38.81 2x40 s ASN 221 CO 0.01 -0.94 1.84 -0.08 -2.79 0.00 0.00 177.10 175.14 2x40 h GLU 222 N 8.95 1.14 -0.98 0.43 4.81 -1.90 0.02 114.58 127.06 2x40 h GLU 222 Ca -0.28 -0.17 0.09 0.00 -0.13 0.00 0.00 59.36 58.87 2x40 h GLU 222 Cb 1.09 -0.21 -0.07 0.00 0.63 0.00 0.00 28.75 30.19 2x40 h GLU 222 CO 1.05 0.88 0.62 2.35 -0.73 0.00 0.00 179.01 183.18 2x40 h TRP 223 N 1.13 1.14 0.00 0.92 7.01 -1.92 -0.30 115.95 123.94 2x40 h TRP 223 Ca 0.27 0.03 -0.00 0.00 2.11 0.00 0.00 58.89 61.31 2x40 h TRP 223 Cb 0.12 -0.37 0.00 0.00 -2.10 0.00 0.00 29.16 26.81 2x40 h TRP 223 CO 0.01 0.53 -0.00 1.25 -2.79 0.00 0.00 178.44 177.44 2x40 h LEU 224 N 1.07 -0.00 0.00 0.65 5.85 -1.71 0.67 115.31 121.84 2x40 h LEU 224 Ca 0.45 -0.83 -0.20 0.00 0.84 0.00 0.00 57.88 58.14 2x40 h LEU 224 Cb 0.29 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 41.29 2x40 h LEU 224 CO -0.21 0.90 -1.00 -0.07 -0.34 0.00 0.00 178.44 177.72 2x40 h LEU 225 N -0.98 0.00 0.00 2.25 3.38 -1.00 -1.66 115.31 117.30 2x40 h LEU 225 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2x40 h LEU 225 Cb 0.84 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.59 2x40 h LEU 225 CO 0.00 0.91 -0.48 0.29 0.09 0.00 0.00 178.44 179.25 2x40 n LYS 226 N -3.29 0.25 0.08 1.13 5.02 -0.17 -3.86 118.16 117.32 2x40 n LYS 226 Ca -0.02 0.10 -0.12 0.00 -2.02 0.00 0.00 58.31 56.26 2x40 n LYS 226 Cb 0.91 -0.90 -0.06 0.00 -0.02 0.00 0.00 35.03 34.97 2x40 n LYS 226 CO 0.00 0.00 0.00 0.87 -0.52 0.00 0.00 177.40 177.75 2x40 h LYS 227 N -0.48 -0.23 0.10 1.97 1.57 -1.37 0.29 116.57 118.43 2x40 h LYS 227 Ca 0.00 0.02 -0.01 0.00 -1.87 0.00 0.00 60.65 58.79 2x40 h LYS 227 Cb 0.48 0.05 0.00 0.00 0.08 0.00 0.00 32.23 32.84 2x40 h LYS 227 CO 0.00 -0.15 -0.05 0.28 -0.57 0.00 0.00 179.45 178.96 2x40 h VAL 228 N -0.24 0.00 0.21 0.50 2.07 -0.95 -1.27 116.25 116.57 2x40 h VAL 228 Ca 0.02 -0.76 0.01 0.00 0.82 0.00 0.00 66.70 66.79 2x40 h VAL 228 Cb 0.26 0.00 -0.04 0.00 -1.52 0.00 0.00 31.29 29.99 2x40 h VAL 228 CO -0.07 0.00 -0.38 0.25 0.02 0.00 0.00 177.57 177.39 2x40 h LEU 229 N -0.90 -1.07 0.00 2.57 5.85 -1.39 -1.94 115.31 118.42 2x40 h LEU 229 Ca -0.01 0.11 0.00 0.00 0.84 0.00 0.00 57.88 58.82 2x40 h LEU 229 Cb 0.11 0.39 0.00 0.00 0.37 0.00 0.00 40.66 41.53 2x40 h LEU 229 CO 0.02 -0.48 -0.29 0.03 -0.34 0.00 0.00 178.44 177.38 2x40 h ARG 230 N -0.67 0.00 -0.25 1.25 -0.00 -1.29 -2.64 114.38 110.78 2x40 h ARG 230 Ca 0.01 0.00 -0.05 0.00 -0.50 0.00 0.00 59.98 59.44 2x40 h ARG 230 Cb 0.66 0.00 -0.01 0.00 0.00 0.00 0.00 29.97 30.61 2x40 h ARG 230 CO -0.16 0.00 -0.06 0.93 0.00 0.00 0.00 179.97 180.68 2x40 h GLU 231 N -0.65 0.40 0.00 0.04 5.08 -0.96 0.16 114.58 118.65 2x40 h GLU 231 Ca 0.00 -0.09 -0.16 0.00 -1.00 0.00 0.00 59.36 58.11 2x40 h GLU 231 Cb 0.29 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.46 2x40 h GLU 231 CO 0.00 0.47 -1.04 0.39 -1.00 0.00 0.00 179.01 177.83 2x40 n GLU 232 N -4.28 0.53 0.11 2.33 1.02 -0.49 -4.62 120.64 115.25 2x40 n GLU 232 Ca 0.00 0.56 0.04 0.00 -0.02 0.00 0.00 57.16 57.74 2x40 n GLU 232 Cb 0.25 -1.73 0.01 0.00 -0.02 0.00 0.00 31.44 29.95 2x40 n GLU 232 CO 0.00 0.00 0.00 -1.49 1.18 0.00 0.00 177.13 176.82 2x40 h TRP 233 N -1.00 0.00 -0.71 -0.32 6.55 -1.34 -3.48 115.95 115.64 2x40 h TRP 233 Ca -0.25 0.00 -0.01 0.00 0.95 0.00 0.00 58.89 59.58 2x40 h TRP 233 Cb 1.06 0.00 0.00 0.00 -0.86 0.00 0.00 29.16 29.36 2x40 h TRP 233 CO -0.00 0.40 -0.02 0.41 -1.05 0.00 0.00 178.44 178.18 2x40 n GLY 234 N 1.26 0.66 3.74 1.49 0.00 0.56 -4.86 105.19 108.04 2x40 n GLY 234 Ca -0.02 -0.74 -0.41 0.00 0.00 0.00 0.00 46.02 44.85 2x40 n GLY 234 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2x40 s PHE 235 N -2.59 3.00 -0.04 1.61 5.36 -1.01 -4.93 117.98 119.38 2x40 s PHE 235 Ca 0.01 0.99 0.06 0.00 -0.96 0.00 0.00 56.93 57.04 2x40 s PHE 235 Cb -0.01 -3.84 0.10 0.00 -0.34 0.00 0.00 43.02 38.93 2x40 s PHE 235 CO 0.01 -2.76 0.98 0.39 -1.46 0.00 0.00 175.22 172.39 2x40 n GLU 236 N 2.40 1.72 -0.13 10.12 1.02 -1.26 -4.75 120.64 129.76 2x40 n GLU 236 Ca 0.07 -1.67 0.00 0.00 -0.02 0.00 0.00 57.16 55.54 2x40 n GLU 236 Cb 0.40 -1.04 0.00 0.00 -0.02 0.00 0.00 31.44 30.77 2x40 n GLU 236 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2x40 n GLY 237 N -0.69 1.49 3.65 0.62 0.00 -1.26 -4.82 105.19 104.18 2x40 n GLY 237 Ca 0.05 -1.99 -0.24 0.00 0.00 0.00 0.00 46.02 43.84 2x40 n GLY 237 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2x40 s PHE 238 N 1.54 2.58 -0.10 1.61 -0.12 -1.00 -4.85 117.98 117.64 2x40 s PHE 238 Ca 0.00 -0.41 -0.01 0.00 -0.05 0.00 0.00 56.93 56.46 2x40 s PHE 238 Cb 0.00 -1.50 -0.03 0.00 -0.63 0.00 0.00 43.02 40.87 2x40 s PHE 238 CO 0.00 0.46 -0.07 0.08 -0.05 0.00 0.00 175.22 175.64 2x40 s VAL 239 N -2.49 3.67 0.21 -2.49 1.01 -1.26 -1.77 120.40 117.28 2x40 s VAL 239 Ca 0.35 -0.47 0.10 0.00 0.00 0.00 0.00 61.98 61.96 2x40 s VAL 239 Cb -0.01 -2.54 -0.04 0.00 0.00 0.00 0.00 36.38 33.79 2x40 s VAL 239 CO 0.20 0.56 -0.12 0.00 0.00 0.00 0.00 175.10 175.73 2x40 s MET 240 N -0.32 1.94 0.40 2.72 0.23 0.20 -1.02 119.30 123.46 2x40 s MET 240 Ca 0.05 -1.41 -0.16 0.00 -1.03 0.00 0.00 55.69 53.14 2x40 s MET 240 Cb -0.13 -2.05 -0.09 0.00 -1.53 0.00 0.00 34.83 31.04 2x40 s MET 240 CO 0.02 0.40 0.84 -1.54 -2.03 0.00 0.00 175.02 172.72 2x40 s SER 241 N -3.01 6.72 1.05 -1.18 1.04 -0.51 -1.28 113.70 116.53 2x40 s SER 241 Ca 0.26 1.39 -0.12 0.00 0.48 0.00 0.00 55.95 57.96 2x40 s SER 241 Cb -0.08 -2.43 0.22 0.00 0.10 0.00 0.00 66.02 63.84 2x40 s SER 241 CO 0.15 -0.36 1.07 -0.62 0.98 0.00 0.00 173.24 174.46 2x40 s ASP 242 N -2.63 1.93 -0.34 7.02 -1.08 -1.00 -4.31 116.67 116.27 2x40 s ASP 242 Ca 0.56 1.68 -0.28 0.00 -0.52 0.00 0.00 52.55 53.99 2x40 s ASP 242 Cb -0.10 -2.33 -0.03 0.00 -1.46 0.00 0.00 42.92 39.00 2x40 s ASP 242 CO 0.23 -3.63 1.98 0.26 0.52 0.00 0.00 175.17 174.52 2x40 s TRP 243 N -2.61 1.54 -0.11 -5.34 0.23 -1.26 -2.18 118.94 109.22 2x40 s TRP 243 Ca 0.67 0.70 0.00 0.00 -2.03 0.00 0.00 56.10 55.44 2x40 s TRP 243 Cb -0.23 -4.02 0.00 0.00 0.03 0.00 0.00 33.47 29.25 2x40 s TRP 243 CO 0.61 -3.17 0.00 0.66 0.96 0.00 0.00 176.95 176.01 2x40 n TYR 244 N 11.45 0.00 -1.07 -1.98 4.02 -0.26 -4.88 117.16 124.45 2x40 n TYR 244 Ca 0.26 0.00 -0.30 0.00 -0.01 0.00 0.00 57.90 57.85 2x40 n TYR 244 Cb 0.48 -0.56 0.15 0.00 -0.02 0.00 0.00 39.34 39.38 2x40 n TYR 244 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2x40 s ALA 245 N -1.90 1.45 0.01 -0.72 0.00 -0.93 -4.88 121.76 114.80 2x40 s ALA 245 Ca 0.00 0.09 0.00 0.00 0.00 0.00 0.00 51.96 52.05 2x40 s ALA 245 Cb 0.00 -3.25 0.00 0.00 0.00 0.00 0.00 23.12 19.87 2x40 s ALA 245 CO 0.00 -2.46 0.00 0.41 0.00 0.00 0.00 175.76 173.71 2x40 n GLY 246 N -0.75 -1.79 0.00 0.00 0.00 -1.26 -4.84 105.19 96.55 2x40 n GLY 246 Ca 0.08 -1.31 0.00 0.00 0.00 0.00 0.00 46.02 44.78 2x40 n GLY 246 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2x40 n ASP 247 N -0.25 0.00 -3.26 1.61 5.68 -1.26 -5.07 116.55 114.00 2x40 n ASP 247 Ca 0.00 -1.00 -0.04 0.00 -0.50 0.00 0.00 54.79 53.25 2x40 n ASP 247 Cb 0.01 0.00 -0.05 0.00 -1.14 0.00 0.00 41.12 39.94 2x40 n ASP 247 CO 0.00 0.00 0.00 0.21 -1.33 0.00 0.00 177.20 176.08 2x40 s ASN 248 N 0.00 -0.42 0.23 -1.12 3.84 -1.26 -5.05 114.94 111.16 2x40 s ASN 248 Ca 0.00 0.32 -0.08 0.00 0.21 0.00 0.00 52.86 53.31 2x40 s ASN 248 Cb 0.00 1.53 0.22 0.00 -0.55 0.00 0.00 41.25 42.45 2x40 s ASN 248 CO 0.00 -0.30 1.90 -0.65 -2.79 0.00 0.00 177.10 175.26 2x40 h PRO 249 N 8.11 1.13 -0.07 0.43 0.11 -1.96 -1.45 132.00 138.29 2x40 h PRO 249 Ca -0.17 -0.07 -0.20 0.00 0.11 0.00 0.00 66.00 65.67 2x40 h PRO 249 Cb 1.15 -0.25 -0.00 0.00 0.11 0.00 0.00 31.00 32.01 2x40 h PRO 249 CO 0.26 0.75 -0.78 -0.24 -0.21 0.00 0.00 178.00 177.77 2x40 h VAL 250 N 1.16 1.37 -0.13 3.15 3.04 -1.93 -2.26 116.25 120.63 2x40 h VAL 250 Ca 0.33 -2.17 -0.04 0.00 -1.01 0.00 0.00 66.70 63.81 2x40 h VAL 250 Cb -0.10 2.15 -0.01 0.00 -2.01 0.00 0.00 31.29 31.32 2x40 h VAL 250 CO -0.08 0.66 -0.10 -0.33 -1.01 0.00 0.00 177.57 176.71 2x40 h GLU 251 N 0.31 0.20 -0.23 4.17 4.39 -1.89 -0.55 114.58 120.97 2x40 h GLU 251 Ca -0.04 -0.04 -0.03 0.00 0.34 0.00 0.00 59.36 59.59 2x40 h GLU 251 Cb 1.37 -0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 29.98 2x40 h GLU 251 CO 0.14 0.31 0.04 1.96 -1.16 0.00 0.00 179.01 180.31 2x40 h GLN 252 N 0.19 0.38 -0.21 2.33 4.20 -0.87 -2.37 115.11 118.78 2x40 h GLN 252 Ca 0.04 -0.10 -0.10 0.00 0.06 0.00 0.00 58.65 58.56 2x40 h GLN 252 Cb 0.30 -0.05 -0.01 0.00 0.30 0.00 0.00 27.48 28.02 2x40 h GLN 252 CO 0.02 0.51 -0.29 -0.07 -0.67 0.00 0.00 178.83 178.33 2x40 h LEU 253 N 0.20 0.40 -1.17 1.46 3.38 -1.02 -0.60 115.31 117.96 2x40 h LEU 253 Ca 0.07 -0.14 -0.08 0.00 0.09 0.00 0.00 57.88 57.83 2x40 h LEU 253 Cb 0.31 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.94 2x40 h LEU 253 CO 0.00 0.68 -0.37 0.11 0.09 0.00 0.00 178.44 178.96 2x40 h LYS 254 N 0.35 0.00 0.00 1.13 1.57 -1.05 -3.08 116.57 115.49 2x40 h LYS 254 Ca 0.05 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.83 2x40 h LYS 254 Cb 0.69 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.00 2x40 h LYS 254 CO 0.05 0.37 -0.38 0.00 -0.57 0.00 0.00 179.45 178.92 2x40 h ALA 255 N 1.63 0.76 0.00 3.86 0.00 -1.09 -3.47 119.26 120.96 2x40 h ALA 255 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2x40 h ALA 255 Cb 0.76 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.55 2x40 h ALA 255 CO 0.05 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.71 2x40 n GLY 256 N 1.29 1.22 3.50 0.00 0.00 -1.11 -3.42 105.19 106.67 2x40 n GLY 256 Ca 0.04 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.64 2x40 n GLY 256 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2x40 s ASN 257 N -2.00 6.21 -0.01 1.61 2.47 -0.26 -4.43 114.94 118.53 2x40 s ASN 257 Ca 0.00 -0.65 -0.21 0.00 0.42 0.00 0.00 52.86 52.42 2x40 s ASN 257 Cb 0.00 -2.47 -0.23 0.00 -1.45 0.00 0.00 41.25 37.10 2x40 s ASN 257 CO 0.00 -1.54 1.09 0.44 -3.72 0.00 0.00 177.10 173.38 2x40 h ASP 258 N 9.67 0.46 -3.48 -4.21 3.32 -1.34 -3.27 116.42 117.57 2x40 h ASP 258 Ca -0.28 -0.75 -0.67 0.00 0.02 0.00 0.00 57.03 55.35 2x40 h ASP 258 Cb 1.06 -0.14 -0.30 0.00 0.22 0.00 0.00 39.33 40.18 2x40 h ASP 258 CO 1.20 1.15 -0.72 -0.22 -1.72 0.00 0.00 179.24 178.92 2x40 s LEU 259 N -8.41 3.19 -0.18 1.55 2.96 -0.36 -4.69 118.68 112.73 2x40 s LEU 259 Ca -0.14 -0.71 -0.22 0.00 -0.22 0.00 0.00 54.13 52.84 2x40 s LEU 259 Cb 0.03 -1.71 -0.02 0.00 0.50 0.00 0.00 46.19 44.98 2x40 s LEU 259 CO 0.80 -0.11 0.69 -0.63 -1.32 0.00 0.00 176.35 175.78 2x40 s ILE 260 N 1.39 4.98 0.05 6.68 1.01 0.40 -1.42 121.20 134.31 2x40 s ILE 260 Ca 0.02 1.32 0.05 0.00 0.00 0.00 0.00 60.65 62.05 2x40 s ILE 260 Cb -0.16 -4.00 -0.03 0.00 0.01 0.00 0.00 42.46 38.28 2x40 s ILE 260 CO -0.03 0.09 -0.15 -0.04 0.00 0.00 0.00 174.94 174.81 2x40 s MET 261 N 1.93 0.93 0.00 2.79 -1.94 -1.26 -0.16 119.30 121.59 2x40 s MET 261 Ca 0.32 -0.86 0.23 0.00 -1.71 0.00 0.00 55.69 53.67 2x40 s MET 261 Cb -0.16 -0.96 0.67 0.00 2.01 0.00 0.00 34.83 36.39 2x40 s MET 261 CO 0.11 0.23 1.52 -0.35 -0.01 0.00 0.00 175.02 176.52 2x40 n PRO 262 N 1.63 1.97 0.00 2.03 -0.04 -1.26 -1.10 135.00 138.23 2x40 n PRO 262 Ca -0.19 -1.44 0.00 0.00 -0.04 0.00 0.00 63.50 61.83 2x40 n PRO 262 Cb 0.54 -1.45 0.00 0.00 -0.04 0.00 0.00 33.50 32.55 2x40 n PRO 262 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2x40 n GLY 263 N 1.25 1.11 3.90 0.55 0.00 -1.25 0.28 105.19 111.03 2x40 n GLY 263 Ca 0.17 -1.84 -0.26 0.00 0.00 0.00 0.00 46.02 44.09 2x40 n GLY 263 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2x40 n LYS 264 N 1.19 -4.05 0.33 1.61 5.02 -1.26 -3.96 118.16 117.03 2x40 n LYS 264 Ca 0.00 0.49 0.21 0.00 -2.02 0.00 0.00 58.31 56.99 2x40 n LYS 264 Cb 0.00 -4.90 1.12 0.00 -0.02 0.00 0.00 35.03 31.23 2x40 n LYS 264 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2x40 h ALA 265 N 0.87 1.05 0.00 7.82 0.00 -1.94 -1.27 119.26 125.78 2x40 h ALA 265 Ca -0.61 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.30 2x40 h ALA 265 Cb 1.37 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.16 2x40 h ALA 265 CO 0.63 -0.05 0.00 2.48 0.00 0.00 0.00 179.25 182.31 2x40 n TYR 266 N -2.99 0.00 0.65 0.00 4.11 -1.26 -2.44 117.16 115.23 2x40 n TYR 266 Ca -0.03 0.00 0.13 0.00 -0.00 0.00 0.00 57.90 58.00 2x40 n TYR 266 Cb 0.11 -0.44 0.36 0.00 -0.00 0.00 0.00 39.34 39.37 2x40 n TYR 266 CO 0.00 0.00 0.00 1.04 -0.00 0.00 0.00 176.86 177.90 2x40 n GLN 267 N -1.44 0.25 0.00 -3.48 6.02 -0.48 -3.91 117.38 114.34 2x40 n GLN 267 Ca 0.02 0.16 0.00 0.00 -0.01 0.00 0.00 57.00 57.18 2x40 n GLN 267 Cb 0.09 -1.75 0.00 0.00 1.02 0.00 0.00 30.24 29.60 2x40 n GLN 267 CO 0.00 0.00 0.00 1.33 -1.01 0.00 0.00 177.06 177.38 2x40 n VAL 268 N -2.16 0.00 -3.70 5.09 0.24 -1.02 -4.97 118.33 111.81 2x40 n VAL 268 Ca 0.05 -0.30 -0.28 0.00 -2.04 0.00 0.00 64.34 61.77 2x40 n VAL 268 Cb 0.42 0.88 -0.16 0.00 -1.47 0.00 0.00 33.84 33.51 2x40 n VAL 268 CO 0.00 0.00 0.00 0.21 -2.14 0.00 0.00 176.83 174.90 2x40 s ASN 269 N -0.89 3.33 0.66 -1.34 3.84 -1.04 -4.99 114.94 114.50 2x40 s ASN 269 Ca 0.00 -1.13 0.29 0.00 0.21 0.00 0.00 52.86 52.23 2x40 s ASN 269 Cb 0.00 -0.63 1.57 0.00 -0.55 0.00 0.00 41.25 41.64 2x40 s ASN 269 CO 0.00 -0.36 1.89 0.74 -2.79 0.00 0.00 177.10 176.58 2x40 h THR 270 N 6.49 0.04 0.01 -5.21 2.02 -1.87 -1.71 112.91 112.67 2x40 h THR 270 Ca -0.16 0.00 -0.25 0.00 0.77 0.00 0.00 66.41 66.77 2x40 h THR 270 Cb 1.07 0.64 -0.04 0.00 -1.74 0.00 0.00 68.15 68.09 2x40 h THR 270 CO 0.39 0.00 -1.35 -0.33 0.37 0.00 0.00 175.52 174.60 2x40 h GLU 271 N 0.00 0.02 -7.02 6.66 3.07 -1.94 -3.47 114.58 111.90 2x40 h GLU 271 Ca 0.02 -0.03 -0.49 0.00 -0.50 0.00 0.00 59.36 58.36 2x40 h GLU 271 Cb 0.76 0.01 0.05 0.00 -0.84 0.00 0.00 28.75 28.72 2x40 h GLU 271 CO -0.00 0.78 0.44 1.03 -1.40 0.00 0.00 179.01 179.86 2x40 s ARG 272 N -2.65 3.79 0.41 2.33 1.81 -0.64 -5.05 118.95 118.94 2x40 s ARG 272 Ca -0.02 1.61 -0.01 0.00 -1.72 0.00 0.00 55.73 55.58 2x40 s ARG 272 Cb 0.09 -2.30 -0.03 0.00 -0.45 0.00 0.00 34.95 32.26 2x40 s ARG 272 CO 0.82 -0.49 0.65 1.03 -0.68 0.00 0.00 175.30 176.63 2x40 s ARG 273 N -2.86 3.42 0.07 3.54 0.52 -1.26 -4.41 118.95 117.98 2x40 s ARG 273 Ca 0.65 -0.19 -0.32 0.00 -0.52 0.00 0.00 55.73 55.35 2x40 s ARG 273 Cb -0.24 -2.55 -0.11 0.00 0.52 0.00 0.00 34.95 32.57 2x40 s ARG 273 CO 0.29 -0.05 1.85 -3.47 0.02 0.00 0.00 175.30 173.94 2x40 n ASP 274 N -2.00 3.87 0.09 0.23 2.03 -1.26 -4.47 116.55 115.04 2x40 n ASP 274 Ca -0.02 0.98 0.03 0.00 0.52 0.00 0.00 54.79 56.30 2x40 n ASP 274 Cb 0.56 -1.50 0.43 0.00 -0.72 0.00 0.00 41.12 39.89 2x40 n ASP 274 CO 0.00 0.00 0.00 1.05 -1.92 0.00 0.00 177.20 176.33 2x40 h GLU 275 N 8.79 0.33 -0.21 -0.67 9.09 -1.97 -2.09 114.58 127.84 2x40 h GLU 275 Ca -0.47 -0.05 -0.04 0.00 0.05 0.00 0.00 59.36 58.85 2x40 h GLU 275 Cb 1.24 -0.06 -0.01 0.00 -1.65 0.00 0.00 28.75 28.27 2x40 h GLU 275 CO 0.94 0.33 -0.01 0.82 0.05 0.00 0.00 179.01 181.14 2x40 h ILE 276 N 0.32 1.26 -0.35 -1.06 2.04 -1.93 -1.57 117.51 116.22 2x40 h ILE 276 Ca 0.08 -0.93 0.07 0.00 1.00 0.00 0.00 64.86 65.08 2x40 h ILE 276 Cb 0.17 1.45 -0.06 0.00 -0.74 0.00 0.00 36.82 37.64 2x40 h ILE 276 CO 0.00 0.28 -0.03 -0.33 0.00 0.00 0.00 178.15 178.08 2x40 h GLU 277 N 0.14 0.06 -0.57 2.37 5.08 -1.85 -0.66 114.58 119.14 2x40 h GLU 277 Ca 0.06 -0.00 -0.07 0.00 -1.00 0.00 0.00 59.36 58.35 2x40 h GLU 277 Cb 0.43 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.64 2x40 h GLU 277 CO 0.01 0.04 0.10 1.49 -1.00 0.00 0.00 179.01 179.65 2x40 h GLU 278 N 0.06 0.95 -0.20 2.33 4.81 -1.31 -1.79 114.58 119.44 2x40 h GLU 278 Ca 0.17 -0.25 -0.03 0.00 -0.13 0.00 0.00 59.36 59.11 2x40 h GLU 278 Cb 0.25 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 29.51 2x40 h GLU 278 CO -0.31 0.90 -0.01 0.82 -0.73 0.00 0.00 179.01 179.68 2x40 h ILE 279 N 0.85 1.26 -0.95 2.32 2.04 -1.10 -1.92 117.51 120.02 2x40 h ILE 279 Ca 0.17 -0.91 0.14 0.00 1.00 0.00 0.00 64.86 65.26 2x40 h ILE 279 Cb 0.41 1.47 -0.09 0.00 -0.74 0.00 0.00 36.82 37.88 2x40 h ILE 279 CO 0.01 0.28 0.57 0.24 0.00 0.00 0.00 178.15 179.25 2x40 h MET 280 N 0.10 0.82 -0.52 2.37 2.86 -1.02 -1.35 114.93 118.19 2x40 h MET 280 Ca 0.05 -0.05 -0.05 0.00 -2.06 0.00 0.00 59.70 57.59 2x40 h MET 280 Cb 0.42 -0.19 -0.02 0.00 0.06 0.00 0.00 31.60 31.87 2x40 h MET 280 CO 0.01 0.54 0.12 1.49 1.06 0.00 0.00 176.91 180.14 2x40 h GLU 281 N 0.85 0.84 -0.22 1.72 4.81 -1.10 -1.53 114.58 119.94 2x40 h GLU 281 Ca 0.49 -0.21 -0.11 0.00 -0.13 0.00 0.00 59.36 59.41 2x40 h GLU 281 Cb 0.59 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 29.85 2x40 h GLU 281 CO -0.31 0.80 -0.34 0.00 -0.73 0.00 0.00 179.01 178.44 2x40 h ALA 282 N 1.00 1.00 -0.44 2.92 0.00 -0.47 -0.30 119.26 122.96 2x40 h ALA 282 Ca 0.16 -0.39 -0.12 0.00 0.00 0.00 0.00 54.91 54.56 2x40 h ALA 282 Cb 0.34 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 2x40 h ALA 282 CO 0.00 0.60 -0.20 -0.07 0.00 0.00 0.00 179.25 179.58 2x40 h LEU 283 N 0.41 0.93 -1.80 0.00 3.38 -1.22 0.47 115.31 117.48 2x40 h LEU 283 Ca 0.05 -0.40 0.00 0.00 0.09 0.00 0.00 57.88 57.62 2x40 h LEU 283 Cb 0.79 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.27 2x40 h LEU 283 CO 0.06 1.12 0.13 0.50 0.09 0.00 0.00 178.44 180.35 2x40 h LYS 284 N 0.74 0.26 -0.02 1.13 1.63 -0.73 -2.82 116.57 116.76 2x40 h LYS 284 Ca 0.10 -0.02 0.00 0.00 -0.85 0.00 0.00 60.65 59.88 2x40 h LYS 284 Cb 0.77 -0.06 0.00 0.00 -0.60 0.00 0.00 32.23 32.34 2x40 h LYS 284 CO 0.06 0.18 -0.15 0.39 -3.45 0.00 0.00 179.45 176.47 2x40 n GLU 285 N -4.51 1.56 -1.25 1.90 1.02 -0.17 -4.96 120.64 114.24 2x40 n GLU 285 Ca -0.00 -1.27 -0.04 0.00 -0.02 0.00 0.00 57.16 55.83 2x40 n GLU 285 Cb 0.08 -1.33 -0.01 0.00 -0.02 0.00 0.00 31.44 30.15 2x40 n GLU 285 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2x40 n GLY 286 N 1.10 0.60 0.09 0.62 0.00 -0.15 -4.89 105.19 102.56 2x40 n GLY 286 Ca 0.09 -0.88 -0.04 0.00 0.00 0.00 0.00 46.02 45.19 2x40 n GLY 286 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2x40 h LYS 287 N 0.00 0.00 -4.40 1.61 1.57 -0.43 -3.44 116.57 111.49 2x40 h LYS 287 Ca -0.08 0.00 -0.47 0.00 -1.87 0.00 0.00 60.65 58.23 2x40 h LYS 287 Cb 0.36 0.00 -0.33 0.00 0.08 0.00 0.00 32.23 32.34 2x40 h LYS 287 CO 0.11 0.84 -0.80 -1.17 -0.57 0.00 0.00 179.45 177.86 2x40 s LEU 288 N -6.79 1.57 0.29 2.94 2.96 -0.53 -4.96 118.68 114.15 2x40 s LEU 288 Ca 0.01 -0.23 -0.13 0.00 -0.22 0.00 0.00 54.13 53.56 2x40 s LEU 288 Cb 0.10 -0.67 -0.08 0.00 0.50 0.00 0.00 46.19 46.03 2x40 s LEU 288 CO 0.79 0.01 0.68 -0.94 -1.32 0.00 0.00 176.35 175.57 2x40 s SER 289 N 0.67 6.73 0.52 3.68 1.04 -1.26 -3.84 113.70 121.24 2x40 s SER 289 Ca -0.12 1.17 0.25 0.00 0.48 0.00 0.00 55.95 57.73 2x40 s SER 289 Cb -0.15 -2.33 1.43 0.00 0.10 0.00 0.00 66.02 65.08 2x40 s SER 289 CO 0.02 -0.17 2.09 -0.08 0.98 0.00 0.00 173.24 176.08 2x40 h GLU 290 N 2.34 0.00 -0.31 4.02 4.81 -1.99 -2.59 114.58 120.86 2x40 h GLU 290 Ca -0.48 0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 58.74 2x40 h GLU 290 Cb 1.17 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.54 2x40 h GLU 290 CO 0.67 0.11 0.12 1.05 -0.73 0.00 0.00 179.01 180.23 2x40 h GLU 291 N 0.00 0.46 -0.71 1.92 9.09 -1.99 0.15 114.58 123.50 2x40 h GLU 291 Ca -0.00 -0.08 -0.05 0.00 0.05 0.00 0.00 59.36 59.27 2x40 h GLU 291 Cb 0.28 -0.07 -0.03 0.00 -1.65 0.00 0.00 28.75 27.27 2x40 h GLU 291 CO 0.01 0.47 0.25 0.28 0.05 0.00 0.00 179.01 180.07 2x40 h VAL 292 N 0.35 1.25 -0.51 -1.06 2.07 -1.88 -1.83 116.25 114.64 2x40 h VAL 292 Ca 0.10 -0.85 0.01 0.00 0.82 0.00 0.00 66.70 66.78 2x40 h VAL 292 Cb 0.19 0.47 -0.03 0.00 -1.52 0.00 0.00 31.29 30.40 2x40 h VAL 292 CO -0.01 0.34 0.34 0.25 0.02 0.00 0.00 177.57 178.50 2x40 h LEU 293 N 1.04 0.58 -0.61 2.57 5.85 -1.25 -2.59 115.31 120.90 2x40 h LEU 293 Ca 0.23 -0.01 0.07 0.00 0.84 0.00 0.00 57.88 59.00 2x40 h LEU 293 Cb 0.27 -0.15 -0.06 0.00 0.37 0.00 0.00 40.66 41.10 2x40 h LEU 293 CO -0.01 0.42 0.30 0.44 -0.34 0.00 0.00 178.44 179.25 2x40 h ASP 294 N 0.69 0.40 -0.13 1.25 3.32 -0.28 -1.69 116.42 119.98 2x40 h ASP 294 Ca 0.19 0.04 -0.05 0.00 0.02 0.00 0.00 57.03 57.23 2x40 h ASP 294 Cb -0.08 -0.03 -0.02 0.00 0.22 0.00 0.00 39.33 39.43 2x40 h ASP 294 CO -0.04 0.26 -0.06 -0.08 -1.72 0.00 0.00 179.24 177.60 2x40 h GLU 295 N 0.55 0.42 0.29 3.56 4.81 -1.07 0.47 114.58 123.60 2x40 h GLU 295 Ca 0.28 -0.09 -0.01 0.00 -0.13 0.00 0.00 59.36 59.40 2x40 h GLU 295 Cb 0.24 -0.06 0.00 0.00 0.63 0.00 0.00 28.75 29.56 2x40 h GLU 295 CO -0.21 0.50 -0.14 0.00 -0.73 0.00 0.00 179.01 178.42 2x40 h VAL 297 N -0.68 1.17 -0.24 0.00 2.07 -1.10 -1.70 116.25 115.77 2x40 h VAL 297 Ca -0.04 -0.42 0.00 0.00 0.82 0.00 0.00 66.70 67.06 2x40 h VAL 297 Cb 0.47 -0.17 -0.01 0.00 -1.52 0.00 0.00 31.29 30.06 2x40 h VAL 297 CO 0.06 0.23 0.15 -0.09 0.02 0.00 0.00 177.57 177.94 2x40 h ARG 298 N 1.23 0.32 -0.51 1.57 2.43 -0.92 0.01 114.38 118.51 2x40 h ARG 298 Ca 0.39 -0.02 0.06 0.00 -0.81 0.00 0.00 59.98 59.60 2x40 h ARG 298 Cb 0.00 -0.07 -0.05 0.00 -0.42 0.00 0.00 29.97 29.43 2x40 h ARG 298 CO -0.12 0.23 0.22 -0.91 -1.51 0.00 0.00 179.97 177.87 2x40 h ASN 299 N 0.32 0.27 0.33 -3.80 2.35 -0.52 0.37 115.58 114.89 2x40 h ASN 299 Ca 0.09 0.05 -0.02 0.00 -0.55 0.00 0.00 56.30 55.87 2x40 h ASN 299 Cb -0.02 0.01 0.00 0.00 0.05 0.00 0.00 38.32 38.36 2x40 h ASN 299 CO -0.02 0.18 -0.16 0.40 -1.65 0.00 0.00 177.43 176.19 2x40 h ILE 300 N 0.42 0.69 -0.56 2.81 2.04 -1.19 -3.21 117.51 118.51 2x40 h ILE 300 Ca 0.24 -0.05 -0.05 0.00 1.00 0.00 0.00 64.86 66.00 2x40 h ILE 300 Cb 0.22 0.72 -0.02 0.00 -0.74 0.00 0.00 36.82 36.99 2x40 h ILE 300 CO -0.21 0.01 0.16 -0.07 0.00 0.00 0.00 178.15 178.03 2x40 h LEU 301 N -0.47 0.83 -1.74 1.44 4.07 -0.54 -0.53 115.31 118.37 2x40 h LEU 301 Ca -0.04 -0.22 0.23 0.00 0.08 0.00 0.00 57.88 57.93 2x40 h LEU 301 Cb 0.35 -0.22 -0.05 0.00 1.08 0.00 0.00 40.66 41.83 2x40 h LEU 301 CO 0.07 0.83 0.61 0.11 -1.08 0.00 0.00 178.44 178.98 2x40 h LYS 302 N 0.78 0.20 0.00 1.13 1.79 -0.33 -2.11 116.57 118.03 2x40 h LYS 302 Ca 0.18 -0.01 -0.03 0.00 -2.18 0.00 0.00 60.65 58.60 2x40 h LYS 302 Cb 0.31 -0.05 -0.01 0.00 -1.58 0.00 0.00 32.23 30.91 2x40 h LYS 302 CO -0.00 0.13 -0.41 0.28 -1.08 0.00 0.00 179.45 178.37 2x40 h VAL 303 N 0.21 0.31 0.00 0.50 2.07 -1.42 -3.41 116.25 114.51 2x40 h VAL 303 Ca 0.45 -1.30 0.00 0.00 0.82 0.00 0.00 66.70 66.67 2x40 h VAL 303 Cb 1.42 0.65 0.00 0.00 -1.52 0.00 0.00 31.29 31.84 2x40 h VAL 303 CO -0.10 0.10 0.00 0.18 0.02 0.00 0.00 177.57 177.77 2x40 n LEU 304 N -4.64 0.00 0.06 2.57 4.77 -0.26 -1.43 117.00 118.07 2x40 n LEU 304 Ca -0.09 0.49 0.09 0.00 -0.03 0.00 0.00 56.01 56.48 2x40 n LEU 304 Cb 0.26 -0.49 0.40 0.00 -2.33 0.00 0.00 43.42 41.26 2x40 n LEU 304 CO 0.11 -0.16 0.79 1.33 -1.33 0.00 0.00 177.39 178.13 2x40 n VAL 305 N -1.49 0.89 1.20 4.08 0.24 -0.82 -1.46 118.33 120.97 2x40 n VAL 305 Ca 0.05 0.22 0.13 0.00 -2.04 0.00 0.00 64.34 62.70 2x40 n VAL 305 Cb 0.23 -1.05 0.27 0.00 -1.47 0.00 0.00 33.84 31.81 2x40 n VAL 305 CO 0.00 0.00 0.00 0.59 -2.14 0.00 0.00 176.83 175.28 2x40 n ASN 306 N -1.85 1.87 -4.81 -1.34 3.02 -0.52 -4.78 115.26 106.86 2x40 n ASN 306 Ca 0.03 -1.47 -0.33 0.00 -0.03 0.00 0.00 54.58 52.77 2x40 n ASN 306 Cb 0.21 0.14 -0.05 0.00 -0.61 0.00 0.00 39.78 39.46 2x40 n ASN 306 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2x40 s ALA 307 N -2.23 2.97 0.34 5.41 0.00 -0.54 -4.88 121.76 122.83 2x40 s ALA 307 Ca 0.28 0.48 0.05 0.00 0.00 0.00 0.00 51.96 52.77 2x40 s ALA 307 Cb 0.20 -3.19 0.71 0.00 0.00 0.00 0.00 23.12 20.83 2x40 s ALA 307 CO 0.42 -0.08 1.92 -1.35 0.00 0.00 0.00 175.76 176.67 2x40 h PRO 308 N 1.70 0.78 -0.98 0.00 0.11 -1.88 -2.12 132.00 129.61 2x40 h PRO 308 Ca -0.49 -0.05 0.02 0.00 0.11 0.00 0.00 66.00 65.59 2x40 h PRO 308 Cb 1.20 -0.18 -0.05 0.00 0.11 0.00 0.00 31.00 32.08 2x40 h PRO 308 CO 0.60 0.52 0.65 0.77 -0.21 0.00 0.00 178.00 180.33 2x40 h SER 309 N 0.81 1.11 -0.72 -2.05 0.02 -1.90 -1.65 113.55 109.16 2x40 h SER 309 Ca 0.38 -0.02 0.01 0.00 -0.84 0.00 0.00 61.79 61.31 2x40 h SER 309 Cb 0.39 -0.27 -0.04 0.00 0.14 0.00 0.00 62.40 62.63 2x40 h SER 309 CO -0.15 0.78 0.48 0.15 -1.14 0.00 0.00 176.83 176.95 2x40 h PHE 310 N 1.30 0.91 -0.91 3.45 3.04 -1.61 -1.49 116.94 121.63 2x40 h PHE 310 Ca 0.37 0.02 -0.51 0.00 3.98 0.00 0.00 57.97 61.83 2x40 h PHE 310 Cb -0.09 -0.31 -0.28 0.00 2.56 0.00 0.00 35.95 37.84 2x40 h PHE 310 CO -0.00 0.57 0.65 1.63 -2.02 0.00 0.00 178.31 179.14 2x40 n LYS 311 N -4.43 2.24 -2.10 1.11 5.02 -0.86 -4.90 118.16 114.25 2x40 n LYS 311 Ca 0.08 -2.80 -0.07 0.00 -2.02 0.00 0.00 58.31 53.50 2x40 n LYS 311 Cb 0.03 -2.10 -0.01 0.00 -0.02 0.00 0.00 35.03 32.94 2x40 n LYS 311 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 2x40 n ASN 312 N -0.91 -2.43 -4.67 4.39 3.02 -0.56 -4.79 115.26 109.31 2x40 n ASN 312 Ca 0.55 0.28 -0.51 0.00 -0.03 0.00 0.00 54.58 54.87 2x40 n ASN 312 Cb 1.31 -2.23 -0.05 0.00 -0.61 0.00 0.00 39.78 38.20 2x40 n ASN 312 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2x40 n TYR 313 N -2.56 2.13 -2.61 3.10 4.19 -0.68 -4.90 117.16 115.83 2x40 n TYR 313 Ca -0.08 0.28 -0.43 0.00 3.31 0.00 0.00 57.90 60.99 2x40 n TYR 313 Cb 0.47 -2.54 -0.02 0.00 0.49 0.00 0.00 39.34 37.74 2x40 n TYR 313 CO 0.00 0.00 0.00 0.50 0.91 0.00 0.00 176.86 178.27 2x40 s ARG 314 N 2.76 3.62 0.23 2.98 3.52 -1.26 -4.88 118.95 125.92 2x40 s ARG 314 Ca 0.90 0.39 -0.09 0.00 -0.13 0.00 0.00 55.73 56.80 2x40 s ARG 314 Cb -0.83 -3.96 -0.07 0.00 -1.56 0.00 0.00 34.95 28.53 2x40 s ARG 314 CO 0.52 -1.51 0.55 1.52 -0.81 0.00 0.00 175.30 175.57 2x40 s TYR 315 N 4.63 3.43 -0.42 5.12 -0.85 -1.26 -5.00 117.35 123.00 2x40 s TYR 315 Ca 0.45 0.87 0.23 0.00 -0.52 0.00 0.00 57.07 58.10 2x40 s TYR 315 Cb -0.07 -2.26 0.24 0.00 0.38 0.00 0.00 41.96 40.25 2x40 s TYR 315 CO 0.29 0.26 1.35 0.66 -1.52 0.00 0.00 175.55 176.58 2x40 h SER 316 N 2.50 0.00 -2.42 -0.18 4.64 -1.88 -3.48 113.55 112.73 2x40 h SER 316 Ca -0.47 -0.04 -0.39 0.00 -0.47 0.00 0.00 61.79 60.43 2x40 h SER 316 Cb 1.17 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 63.19 2x40 h SER 316 CO 0.69 0.02 -0.45 0.59 -0.87 0.00 0.00 176.83 176.81 2x40 n ASN 317 N -2.69 -5.39 -2.93 4.97 3.02 0.18 -4.90 115.26 107.52 2x40 n ASN 317 Ca 0.02 0.19 -0.14 0.00 -0.03 0.00 0.00 54.58 54.62 2x40 n ASN 317 Cb 0.51 -4.60 0.00 0.00 -0.61 0.00 0.00 39.78 35.09 2x40 n ASN 317 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 2x40 n LYS 318 N -2.73 0.73 -1.14 3.52 5.02 -1.26 -4.90 118.16 117.40 2x40 n LYS 318 Ca -0.22 -2.32 -0.29 0.00 -2.02 0.00 0.00 58.31 53.47 2x40 n LYS 318 Cb 0.66 -1.38 0.19 0.00 -0.02 0.00 0.00 35.03 34.48 2x40 n LYS 318 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 2x40 s PRO 319 N 0.02 0.10 -1.22 1.97 0.04 -1.26 -4.92 135.00 129.72 2x40 s PRO 319 Ca 0.33 0.42 -0.16 0.00 0.04 0.00 0.00 61.00 61.62 2x40 s PRO 319 Cb 0.19 -1.71 0.12 0.00 0.04 0.00 0.00 34.50 33.14 2x40 s PRO 319 CO -0.19 -2.93 1.54 0.34 0.04 0.00 0.00 177.00 175.80 2x40 s ASP 320 N -3.50 6.91 0.17 6.66 3.68 -1.26 -4.83 116.67 124.50 2x40 s ASP 320 Ca 0.66 -2.61 -0.15 0.00 2.13 0.00 0.00 52.55 52.59 2x40 s ASP 320 Cb -0.18 -2.49 0.09 0.00 -1.45 0.00 0.00 42.92 38.90 2x40 s ASP 320 CO 0.58 -0.99 1.77 -0.07 0.13 0.00 0.00 175.17 176.59 2x40 h LEU 321 N 11.16 0.27 -0.54 -1.34 -0.00 -1.96 -2.40 115.31 120.50 2x40 h LEU 321 Ca 0.36 0.03 0.03 0.00 -0.00 0.00 0.00 57.88 58.29 2x40 h LEU 321 Cb 0.89 -0.02 -0.04 0.00 -0.00 0.00 0.00 40.66 41.49 2x40 h LEU 321 CO 1.34 0.20 0.31 -0.33 -0.00 0.00 0.00 178.44 179.96 2x40 h GLU 322 N 0.40 0.60 -0.63 1.13 3.07 -2.00 0.12 114.58 117.27 2x40 h GLU 322 Ca 0.19 -0.04 -0.00 0.00 -0.50 0.00 0.00 59.36 59.01 2x40 h GLU 322 Cb 0.12 -0.13 -0.03 0.00 -0.84 0.00 0.00 28.75 27.86 2x40 h GLU 322 CO -0.15 0.39 0.37 -0.22 -1.40 0.00 0.00 179.01 178.01 2x40 h LYS 323 N 0.61 0.85 0.00 2.33 3.64 -1.92 -2.92 116.57 119.16 2x40 h LYS 323 Ca 0.22 -0.07 -0.21 0.00 -1.27 0.00 0.00 60.65 59.32 2x40 h LYS 323 Cb 0.05 -0.18 -0.00 0.00 -0.41 0.00 0.00 32.23 31.69 2x40 h LYS 323 CO -0.11 0.60 -0.91 0.45 -2.27 0.00 0.00 179.45 177.21 2x40 h HIS 324 N 0.87 0.45 -0.30 1.91 3.86 -0.74 -3.01 115.15 118.19 2x40 h HIS 324 Ca 0.23 -0.25 0.02 0.00 -1.16 0.00 0.00 60.37 59.21 2x40 h HIS 324 Cb -0.02 -0.05 -0.02 0.00 1.06 0.00 0.00 27.41 28.38 2x40 h HIS 324 CO 0.00 1.06 0.20 0.00 0.86 0.00 0.00 177.93 180.06 2x40 h ALA 325 N 0.86 1.87 -0.26 2.45 0.00 -0.63 0.38 119.26 123.93 2x40 h ALA 325 Ca -0.06 -0.02 -0.12 0.00 0.00 0.00 0.00 54.91 54.71 2x40 h ALA 325 Cb 1.54 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 19.22 2x40 h ALA 325 CO 0.15 0.10 -0.34 0.87 0.00 0.00 0.00 179.25 180.03 2x40 h LYS 326 N 0.34 0.57 -0.53 0.00 1.57 -1.42 -0.70 116.57 116.39 2x40 h LYS 326 Ca 0.12 -0.26 -0.11 0.00 -1.87 0.00 0.00 60.65 58.53 2x40 h LYS 326 Cb 0.07 -0.01 -0.02 0.00 0.08 0.00 0.00 32.23 32.35 2x40 h LYS 326 CO -0.03 0.83 -0.11 0.28 -0.57 0.00 0.00 179.45 179.86 2x40 h VAL 327 N 0.48 1.27 -0.46 0.50 2.07 -0.98 -1.29 116.25 117.85 2x40 h VAL 327 Ca 0.05 -1.26 -0.09 0.00 0.82 0.00 0.00 66.70 66.23 2x40 h VAL 327 Cb 0.82 0.96 -0.02 0.00 -1.52 0.00 0.00 31.29 31.54 2x40 h VAL 327 CO 0.07 0.44 -0.06 0.00 0.02 0.00 0.00 177.57 178.04 2x40 h ALA 328 N 0.97 1.03 -0.18 1.67 0.00 -0.67 0.34 119.26 122.42 2x40 h ALA 328 Ca 0.14 -0.30 -0.03 0.00 0.00 0.00 0.00 54.91 54.73 2x40 h ALA 328 Cb 0.67 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 2x40 h ALA 328 CO 0.05 0.59 0.00 -0.92 0.00 0.00 0.00 179.25 178.97 2x40 h TYR 329 N 0.73 0.35 -0.18 0.00 3.20 -1.03 -2.05 116.97 117.99 2x40 h TYR 329 Ca 0.13 -0.06 0.03 0.00 3.14 0.00 0.00 58.73 61.97 2x40 h TYR 329 Cb 0.53 -0.09 -0.03 0.00 1.54 0.00 0.00 36.73 38.68 2x40 h TYR 329 CO 0.03 0.53 -0.02 0.93 -1.64 0.00 0.00 178.16 177.98 2x40 h GLU 330 N 0.08 0.03 -0.35 1.82 4.39 -0.98 0.12 114.58 119.68 2x40 h GLU 330 Ca 0.05 -0.00 0.08 0.00 0.34 0.00 0.00 59.36 59.83 2x40 h GLU 330 Cb 0.38 -0.01 -0.08 0.00 -0.10 0.00 0.00 28.75 28.95 2x40 h GLU 330 CO 0.01 0.02 -0.15 0.00 -1.16 0.00 0.00 179.01 177.73 2x40 h ALA 331 N 1.17 0.14 -0.74 3.43 0.00 -0.87 -1.49 119.26 120.91 2x40 h ALA 331 Ca 0.09 0.13 -0.05 0.00 0.00 0.00 0.00 54.91 55.08 2x40 h ALA 331 Cb 0.12 0.37 -0.03 0.00 0.00 0.00 0.00 17.79 18.25 2x40 h ALA 331 CO -0.17 -0.52 0.26 0.78 0.00 0.00 0.00 179.25 179.60 2x40 h GLY 332 N -0.08 1.21 0.65 0.00 0.00 -1.12 -2.76 103.07 100.97 2x40 h GLY 332 Ca 0.18 -0.69 0.08 0.00 0.00 0.00 0.00 47.33 46.89 2x40 h GLY 332 CO -0.41 0.65 0.60 0.00 0.00 0.00 0.00 176.54 177.38 2x40 h ALA 333 N 1.13 1.35 -0.01 3.60 0.00 0.25 -1.13 119.26 124.45 2x40 h ALA 333 Ca 0.24 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.15 2x40 h ALA 333 Cb 0.26 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.81 2x40 h ALA 333 CO -0.01 0.32 -0.16 0.39 0.00 0.00 0.00 179.25 179.78 2x40 n GLU 334 N -4.58 0.87 0.00 0.00 1.02 -0.84 -4.00 120.64 113.10 2x40 n GLU 334 Ca 0.15 -0.43 0.07 0.00 -0.02 0.00 0.00 57.16 56.94 2x40 n GLU 334 Cb 0.23 -1.49 -0.02 0.00 -0.02 0.00 0.00 31.44 30.14 2x40 n GLU 334 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2x40 n GLY 335 N 1.29 -0.12 3.74 0.62 0.00 -0.46 -2.95 105.19 107.31 2x40 n GLY 335 Ca 0.14 -0.41 -0.41 0.00 0.00 0.00 0.00 46.02 45.34 2x40 n GLY 335 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2x40 s VAL 336 N -1.87 3.51 -0.24 1.61 1.01 -1.00 -4.70 120.40 118.73 2x40 s VAL 336 Ca 0.11 1.30 -0.05 0.00 0.00 0.00 0.00 61.98 63.34 2x40 s VAL 336 Cb 0.11 -3.83 -0.00 0.00 0.00 0.00 0.00 36.38 32.66 2x40 s VAL 336 CO 0.41 0.22 -0.01 -0.69 0.00 0.00 0.00 175.10 175.03 2x40 s VAL 337 N -0.21 3.54 -0.38 2.92 1.01 0.44 -2.64 120.40 125.08 2x40 s VAL 337 Ca 0.52 -0.56 -0.29 0.00 0.00 0.00 0.00 61.98 61.65 2x40 s VAL 337 Cb -0.33 -2.69 0.02 0.00 0.00 0.00 0.00 36.38 33.39 2x40 s VAL 337 CO 0.38 0.31 1.09 -0.22 0.00 0.00 0.00 175.10 176.66 2x40 s LEU 338 N 1.48 3.82 -0.15 3.92 2.96 -1.26 0.98 118.68 130.42 2x40 s LEU 338 Ca 0.04 0.79 0.11 0.00 -0.22 0.00 0.00 54.13 54.85 2x40 s LEU 338 Cb -0.15 -3.53 -0.23 0.00 0.50 0.00 0.00 46.19 42.78 2x40 s LEU 338 CO -0.01 -1.03 0.23 0.18 -1.32 0.00 0.00 176.35 174.40 2x40 n LEU 339 N 7.24 1.08 -3.73 -0.68 4.77 0.43 -0.61 117.00 125.52 2x40 n LEU 339 Ca 0.12 0.12 -0.13 0.00 -0.03 0.00 0.00 56.01 56.09 2x40 n LEU 339 Cb 0.48 -0.03 -0.10 0.00 -2.33 0.00 0.00 43.42 41.43 2x40 n LEU 339 CO 0.64 0.59 0.07 -0.60 -1.33 0.00 0.00 177.39 176.75 2x40 s ARG 340 N -2.54 0.45 -0.45 3.23 3.52 -1.09 -4.87 118.95 117.21 2x40 s ARG 340 Ca -0.14 0.61 0.06 0.00 -0.13 0.00 0.00 55.73 56.12 2x40 s ARG 340 Cb 0.07 0.17 0.18 0.00 -1.56 0.00 0.00 34.95 33.81 2x40 s ARG 340 CO 0.78 -0.08 0.55 1.21 -0.81 0.00 0.00 175.30 176.95 2x40 s ASN 341 N 0.47 -0.25 -1.28 -2.12 2.47 -1.22 -0.43 114.94 112.58 2x40 s ASN 341 Ca -0.02 -1.90 -0.14 0.00 0.42 0.00 0.00 52.86 51.22 2x40 s ASN 341 Cb -0.04 1.08 0.13 0.00 -1.45 0.00 0.00 41.25 40.97 2x40 s ASN 341 CO -0.02 -0.14 1.72 -0.62 -3.72 0.00 0.00 177.10 174.32 2x40 n GLU 342 N 3.38 3.33 -3.96 0.43 -0.58 0.22 -4.52 120.64 118.92 2x40 n GLU 342 Ca 0.19 -3.48 -0.27 0.00 -0.42 0.00 0.00 57.16 53.17 2x40 n GLU 342 Cb 0.52 -3.15 -0.01 0.00 -0.57 0.00 0.00 31.44 28.23 2x40 n GLU 342 CO 0.00 0.00 0.00 0.39 -0.48 0.00 0.00 177.13 177.04 2x40 n GLU 343 N 5.89 -3.78 -0.01 3.49 1.02 -1.26 -4.88 120.64 121.11 2x40 n GLU 343 Ca 0.42 0.45 -0.00 0.00 -0.02 0.00 0.00 57.16 58.02 2x40 n GLU 343 Cb 0.41 -4.84 -0.02 0.00 -0.02 0.00 0.00 31.44 26.97 2x40 n GLU 343 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2x40 n ALA 344 N -4.41 2.01 -2.59 0.62 0.00 -1.26 -5.06 120.51 109.81 2x40 n ALA 344 Ca -0.20 -0.10 -0.18 0.00 0.00 0.00 0.00 53.44 52.96 2x40 n ALA 344 Cb 0.63 0.07 -0.12 0.00 0.00 0.00 0.00 19.45 20.04 2x40 n ALA 344 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2x40 s LEU 345 N -3.71 2.34 0.78 0.00 1.43 -1.26 -4.14 118.68 114.12 2x40 s LEU 345 Ca -0.01 -0.71 -0.12 0.00 -1.03 0.00 0.00 54.13 52.26 2x40 s LEU 345 Cb 0.01 -0.54 0.06 0.00 0.03 0.00 0.00 46.19 45.75 2x40 s LEU 345 CO 0.09 -0.11 1.10 -2.16 0.23 0.00 0.00 176.35 175.51 2x40 s PRO 346 N -2.19 2.24 0.37 1.29 0.04 -1.26 -5.00 135.00 130.48 2x40 s PRO 346 Ca 0.03 0.57 -0.27 0.00 0.04 0.00 0.00 61.00 61.37 2x40 s PRO 346 Cb -0.07 -1.94 -0.09 0.00 0.04 0.00 0.00 34.50 32.43 2x40 s PRO 346 CO 0.03 -1.50 1.25 -0.51 0.04 0.00 0.00 177.00 176.31 2x40 s LEU 347 N -5.68 4.30 0.79 -3.56 1.43 0.14 -4.95 118.68 111.15 2x40 s LEU 347 Ca 0.60 2.55 -0.14 0.00 -1.03 0.00 0.00 54.13 56.11 2x40 s LEU 347 Cb -0.13 -3.83 0.08 0.00 0.03 0.00 0.00 46.19 42.33 2x40 s LEU 347 CO 0.53 -0.65 1.22 -0.44 0.23 0.00 0.00 176.35 177.25 2x40 s SER 348 N -0.78 3.64 0.15 2.29 0.01 -1.26 -4.69 113.70 113.06 2x40 s SER 348 Ca 0.53 2.41 -0.21 0.00 1.31 0.00 0.00 55.95 59.99 2x40 s SER 348 Cb -0.36 -2.59 0.02 0.00 0.21 0.00 0.00 66.02 63.30 2x40 s SER 348 CO 0.47 -2.63 1.65 -0.08 0.41 0.00 0.00 173.24 173.05 2x40 h GLU 349 N -0.78 -0.18 -0.51 12.44 4.57 -1.94 -2.74 114.58 125.44 2x40 h GLU 349 Ca -0.47 0.01 -0.03 0.00 -1.18 0.00 0.00 59.36 57.70 2x40 h GLU 349 Cb 1.30 0.04 -0.02 0.00 -0.16 0.00 0.00 28.75 29.91 2x40 h GLU 349 CO 0.47 -0.12 0.21 -2.95 -1.18 0.00 0.00 179.01 175.43 2x40 h ASN 350 N -0.19 0.70 -0.08 1.04 -1.07 -2.02 -3.46 115.58 110.50 2x40 h ASN 350 Ca 0.13 -0.16 -0.06 0.00 0.07 0.00 0.00 56.30 56.27 2x40 h ASN 350 Cb 0.39 -0.18 0.00 0.00 -2.07 0.00 0.00 38.32 36.46 2x40 h ASN 350 CO -0.34 0.67 0.03 -1.20 0.07 0.00 0.00 177.43 176.66 2x40 n SER 351 N -4.55 0.05 -4.53 6.14 7.64 -1.03 -4.71 113.62 112.62 2x40 n SER 351 Ca 0.02 0.09 -0.41 0.00 1.01 0.00 0.00 58.87 59.58 2x40 n SER 351 Cb 0.15 -0.07 -0.09 0.00 -1.01 0.00 0.00 64.21 63.19 2x40 n SER 351 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 2x40 s LYS 352 N 0.13 3.50 -0.17 1.43 1.02 -1.26 -4.18 119.74 120.22 2x40 s LYS 352 Ca 0.08 -0.47 -0.16 0.00 0.02 0.00 0.00 55.97 55.43 2x40 s LYS 352 Cb -0.11 -3.83 -0.04 0.00 -0.52 0.00 0.00 37.83 33.33 2x40 s LYS 352 CO 0.05 -0.56 0.41 0.42 -0.92 0.00 0.00 175.35 174.75 2x40 s ILE 353 N 2.01 5.21 -0.38 2.17 1.01 0.20 -0.52 121.20 130.91 2x40 s ILE 353 Ca 0.11 0.77 -0.17 0.00 0.00 0.00 0.00 60.65 61.36 2x40 s ILE 353 Cb -0.17 -3.74 0.01 0.00 0.01 0.00 0.00 42.46 38.57 2x40 s ILE 353 CO 0.12 0.30 0.46 0.00 0.00 0.00 0.00 174.94 175.82 2x40 s ALA 354 N 0.95 3.45 -0.34 9.38 0.00 -0.06 -0.39 121.76 134.76 2x40 s ALA 354 Ca 0.21 -1.25 -0.14 0.00 0.00 0.00 0.00 51.96 50.78 2x40 s ALA 354 Cb -0.14 -3.00 -0.02 0.00 0.00 0.00 0.00 23.12 19.95 2x40 s ALA 354 CO 0.08 -1.36 0.32 -1.17 0.00 0.00 0.00 175.76 173.63 2x40 s LEU 355 N 2.25 4.44 0.38 0.00 2.96 -1.26 -0.59 118.68 126.85 2x40 s LEU 355 Ca 0.15 -0.27 0.08 0.00 -0.22 0.00 0.00 54.13 53.87 2x40 s LEU 355 Cb -0.16 -2.27 -0.04 0.00 0.50 0.00 0.00 46.19 44.22 2x40 s LEU 355 CO 0.14 -0.29 0.20 -0.36 -1.32 0.00 0.00 176.35 174.72 2x40 s PHE 356 N 1.91 2.69 0.00 5.38 0.40 0.93 -4.85 117.98 124.43 2x40 s PHE 356 Ca 0.10 -0.46 0.00 0.00 -0.60 0.00 0.00 56.93 55.97 2x40 s PHE 356 Cb -0.17 -1.84 0.00 0.00 0.51 0.00 0.00 43.02 41.53 2x40 s PHE 356 CO 0.11 0.21 0.00 0.41 0.70 0.00 0.00 175.22 176.65 2x40 n GLY 357 N -1.25 -0.19 0.27 4.36 0.00 -1.26 -1.19 105.19 105.93 2x40 n GLY 357 Ca -0.01 -1.22 0.18 0.00 0.00 0.00 0.00 46.02 44.96 2x40 n GLY 357 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2x40 h THR 358 N 0.00 0.00 0.00 2.61 1.03 -1.93 -2.57 112.91 112.04 2x40 h THR 358 Ca 0.00 -0.31 0.00 0.00 -0.01 0.00 0.00 66.41 66.09 2x40 h THR 358 Cb 0.00 1.25 0.00 0.00 -1.07 0.00 0.00 68.15 68.33 2x40 h THR 358 CO 0.00 0.00 0.00 0.61 -0.01 0.00 0.00 175.52 176.12 2x40 n GLY 359 N -0.35 -0.98 0.25 2.99 0.00 -1.26 -2.29 105.19 103.56 2x40 n GLY 359 Ca -0.00 -0.17 0.13 0.00 0.00 0.00 0.00 46.02 45.97 2x40 n GLY 359 CO 0.00 0.00 0.00 0.06 0.00 0.00 0.00 173.32 173.38 2x40 h GLN 360 N 0.00 0.00 0.00 1.61 3.07 -1.72 -2.87 115.11 115.20 2x40 h GLN 360 Ca 0.00 0.00 -0.18 0.00 0.09 0.00 0.00 58.65 58.56 2x40 h GLN 360 Cb 0.06 0.00 -0.03 0.00 0.08 0.00 0.00 27.48 27.59 2x40 h GLN 360 CO 0.00 0.14 -1.66 -0.89 0.09 0.00 0.00 178.83 176.51 2x40 n ILE 361 N -3.43 0.65 -1.95 1.86 5.41 -1.14 -0.44 119.36 120.33 2x40 n ILE 361 Ca -0.01 -0.23 -0.40 0.00 1.00 0.00 0.00 62.75 63.11 2x40 n ILE 361 Cb 0.31 -1.11 -0.01 0.00 -0.71 0.00 0.00 39.64 38.13 2x40 n ILE 361 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 176.55 175.93 2x40 n GLU 362 N -3.02 4.44 -2.30 0.38 1.02 -0.97 -4.84 120.64 115.35 2x40 n GLU 362 Ca -0.21 -3.34 -0.42 0.00 -0.02 0.00 0.00 57.16 53.17 2x40 n GLU 362 Cb 0.70 -2.67 -0.03 0.00 -0.02 0.00 0.00 31.44 29.42 2x40 n GLU 362 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 2x40 s THR 363 N -0.71 3.72 -0.37 2.62 2.01 -1.08 -4.57 115.64 117.25 2x40 s THR 363 Ca 0.55 1.21 -0.25 0.00 0.31 0.00 0.00 61.69 63.51 2x40 s THR 363 Cb 0.18 -3.78 0.01 0.00 0.01 0.00 0.00 72.50 68.92 2x40 s THR 363 CO -0.09 0.07 0.89 -0.63 -0.69 0.00 0.00 174.62 174.18 2x40 s ILE 364 N 1.35 4.62 -0.47 1.82 -1.09 -1.26 -4.91 121.20 121.26 2x40 s ILE 364 Ca 0.62 1.10 0.23 0.00 -2.23 0.00 0.00 60.65 60.37 2x40 s ILE 364 Cb -0.32 -4.31 0.07 0.00 -1.58 0.00 0.00 42.46 36.32 2x40 s ILE 364 CO 0.29 -0.52 1.26 0.07 -1.23 0.00 0.00 174.94 174.81 2x40 h LYS 365 N 8.50 0.00 0.00 2.79 2.10 -1.91 -3.39 116.57 124.66 2x40 h LYS 365 Ca -0.24 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.41 2x40 h LYS 365 Cb 1.08 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.41 2x40 h LYS 365 CO 0.97 0.00 0.00 0.41 -2.00 0.00 0.00 179.45 178.83 2x40 n GLY 366 N 1.25 2.12 3.76 0.07 0.00 -1.26 -1.57 105.19 109.56 2x40 n GLY 366 Ca 0.02 -0.93 -0.29 0.00 0.00 0.00 0.00 46.02 44.81 2x40 n GLY 366 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2x40 s GLY 367 N 0.00 1.63 0.62 -0.02 0.00 -1.26 -4.93 107.32 103.36 2x40 s GLY 367 Ca 0.00 -0.83 0.02 0.00 0.00 0.00 0.00 44.72 43.90 2x40 s GLY 367 CO 0.00 -0.11 0.87 -0.51 0.00 0.00 0.00 173.10 173.34 2x40 s THR 368 N -3.34 2.37 0.00 0.90 -4.23 -0.57 -4.18 115.64 106.60 2x40 s THR 368 Ca 0.69 -0.69 0.00 0.00 -1.18 0.00 0.00 61.69 60.50 2x40 s THR 368 Cb -0.10 -2.68 0.00 0.00 1.34 0.00 0.00 72.50 71.06 2x40 s THR 368 CO 0.54 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 175.23 2x40 n GLY 369 N -2.53 -0.97 0.01 3.99 0.00 -1.26 -2.26 105.19 102.17 2x40 n GLY 369 Ca 0.12 -2.11 0.07 0.00 0.00 0.00 0.00 46.02 44.11 2x40 n GLY 369 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2x40 n SER 370 N 0.00 0.04 -0.64 1.61 3.41 -1.26 -1.38 113.62 115.40 2x40 n SER 370 Ca 0.00 0.51 0.11 0.00 -0.26 0.00 0.00 58.87 59.23 2x40 n SER 370 Cb 0.00 -0.52 0.35 0.00 -0.26 0.00 0.00 64.21 63.78 2x40 n SER 370 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2x40 n GLY 371 N -0.02 0.48 3.84 5.00 0.00 -1.26 -4.48 105.19 108.75 2x40 n GLY 371 Ca 0.03 -0.47 -0.29 0.00 0.00 0.00 0.00 46.02 45.29 2x40 n GLY 371 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2x40 s ASP 372 N -1.58 4.30 0.08 1.61 2.15 -0.48 -4.17 116.67 118.58 2x40 s ASP 372 Ca 0.33 1.00 -0.09 0.00 0.43 0.00 0.00 52.55 54.23 2x40 s ASP 372 Cb 0.18 -1.62 -0.00 0.00 -0.30 0.00 0.00 42.92 41.18 2x40 s ASP 372 CO 0.27 -2.06 0.18 0.42 -0.17 0.00 0.00 175.17 173.82 2x40 s THR 373 N -3.36 0.14 -0.59 1.71 -4.23 -1.26 -4.66 115.64 103.39 2x40 s THR 373 Ca 0.62 -1.17 0.04 0.00 -1.18 0.00 0.00 61.69 60.00 2x40 s THR 373 Cb -0.13 -1.30 0.16 0.00 1.34 0.00 0.00 72.50 72.57 2x40 s THR 373 CO 0.52 -0.65 0.40 -1.00 -0.54 0.00 0.00 174.62 173.36 2x40 s HIS 374 N -3.74 2.77 0.58 3.99 0.09 -1.26 -5.07 115.29 112.64 2x40 s HIS 374 Ca 0.04 -2.98 -0.09 0.00 -0.00 0.00 0.00 55.06 52.03 2x40 s HIS 374 Cb 0.04 -2.21 -0.04 0.00 -0.00 0.00 0.00 32.58 30.38 2x40 s HIS 374 CO -0.10 -0.66 0.96 -1.25 -0.00 0.00 0.00 174.74 173.69 2x40 s PRO 375 N -0.77 3.59 0.56 8.40 0.04 -1.26 -4.07 135.00 141.49 2x40 s PRO 375 Ca 0.25 0.59 0.31 0.00 0.04 0.00 0.00 61.00 62.19 2x40 s PRO 375 Cb -0.07 -2.17 1.69 0.00 0.04 0.00 0.00 34.50 33.99 2x40 s PRO 375 CO -0.14 -0.46 2.16 -0.09 0.04 0.00 0.00 177.00 178.52 2x40 h ARG 376 N -0.14 0.00 -2.90 4.56 2.43 -1.95 -3.45 114.38 112.94 2x40 h ARG 376 Ca -0.45 0.00 0.05 0.00 -0.81 0.00 0.00 59.98 58.77 2x40 h ARG 376 Cb 1.19 0.00 -0.08 0.00 -0.42 0.00 0.00 29.97 30.66 2x40 h ARG 376 CO 0.62 0.06 0.26 1.52 -1.51 0.00 0.00 179.97 180.92 2x40 s TYR 377 N -4.28 -0.31 -0.27 2.20 1.13 -1.26 -5.14 117.35 109.40 2x40 s TYR 377 Ca -0.04 -0.03 -0.00 0.00 -1.41 0.00 0.00 57.07 55.60 2x40 s TYR 377 Cb 0.13 0.64 0.14 0.00 -1.10 0.00 0.00 41.96 41.78 2x40 s TYR 377 CO 0.55 -1.03 0.35 0.00 -2.51 0.00 0.00 175.55 172.91 2x40 s ALA 378 N -3.76 -0.86 -0.22 9.51 0.00 -1.26 -4.68 121.76 120.49 2x40 s ALA 378 Ca 0.07 0.19 -0.29 0.00 0.00 0.00 0.00 51.96 51.93 2x40 s ALA 378 Cb -0.04 -1.84 -0.03 0.00 0.00 0.00 0.00 23.12 21.21 2x40 s ALA 378 CO -0.01 -1.59 1.71 0.42 0.00 0.00 0.00 175.76 176.29 2x40 s ILE 379 N 2.47 3.56 1.02 0.00 -1.09 0.38 -4.99 121.20 122.54 2x40 s ILE 379 Ca 0.10 0.63 -0.12 0.00 -2.23 0.00 0.00 60.65 59.02 2x40 s ILE 379 Cb -0.14 -3.60 0.20 0.00 -1.58 0.00 0.00 42.46 37.34 2x40 s ILE 379 CO -0.27 -0.27 1.08 -0.94 -1.23 0.00 0.00 174.94 173.31 2x40 s SER 380 N 4.84 2.38 0.19 3.58 1.04 -1.26 -0.65 113.70 123.82 2x40 s SER 380 Ca 0.76 1.29 -0.11 0.00 0.48 0.00 0.00 55.95 58.37 2x40 s SER 380 Cb -0.26 -1.97 0.11 0.00 0.10 0.00 0.00 66.02 63.99 2x40 s SER 380 CO 0.31 -3.30 1.76 0.40 0.98 0.00 0.00 173.24 173.40 2x40 h ILE 381 N -2.00 1.23 0.13 -1.02 2.04 -1.80 -0.72 117.51 115.37 2x40 h ILE 381 Ca -0.55 -0.68 -0.01 0.00 1.00 0.00 0.00 64.86 64.62 2x40 h ILE 381 Cb 1.33 0.44 0.00 0.00 -0.74 0.00 0.00 36.82 37.85 2x40 h ILE 381 CO 0.56 0.28 -0.06 0.25 0.00 0.00 0.00 178.15 179.17 2x40 h LEU 382 N 0.93 -0.15 -1.47 1.44 5.85 -1.10 -2.37 115.31 118.43 2x40 h LEU 382 Ca 0.23 -0.20 0.05 0.00 0.84 0.00 0.00 57.88 58.80 2x40 h LEU 382 Cb 0.15 0.04 -0.04 0.00 0.37 0.00 0.00 40.66 41.19 2x40 h LEU 382 CO -0.02 0.12 0.42 -0.33 -0.34 0.00 0.00 178.44 178.28 2x40 h GLU 383 N -0.42 0.64 -0.62 1.25 5.08 -1.79 -0.41 114.58 118.31 2x40 h GLU 383 Ca -0.02 -0.04 -0.02 0.00 -1.00 0.00 0.00 59.36 58.29 2x40 h GLU 383 Cb 0.34 -0.14 -0.03 0.00 0.50 0.00 0.00 28.75 29.42 2x40 h GLU 383 CO 0.03 0.42 0.32 0.78 -1.00 0.00 0.00 179.01 179.56 2x40 h GLY 384 N 0.66 0.94 1.37 -3.84 0.00 -0.96 0.06 103.07 101.31 2x40 h GLY 384 Ca 0.27 -0.45 -0.11 0.00 0.00 0.00 0.00 47.33 47.04 2x40 h GLY 384 CO -0.08 0.43 -0.24 -2.22 0.00 0.00 0.00 176.54 174.43 2x40 h ILE 385 N 0.84 1.27 0.41 2.60 2.04 -0.70 -2.10 117.51 121.87 2x40 h ILE 385 Ca 0.21 -1.34 -0.02 0.00 1.00 0.00 0.00 64.86 64.71 2x40 h ILE 385 Cb 0.08 1.25 0.00 0.00 -0.74 0.00 0.00 36.82 37.42 2x40 h ILE 385 CO -0.03 0.44 -0.20 0.11 0.00 0.00 0.00 178.15 178.48 2x40 h LYS 386 N 0.63 -0.53 -0.98 2.37 1.57 -0.79 -1.99 116.57 116.85 2x40 h LYS 386 Ca 0.09 0.04 0.16 0.00 -1.87 0.00 0.00 60.65 59.07 2x40 h LYS 386 Cb 0.74 0.12 -0.10 0.00 0.08 0.00 0.00 32.23 33.07 2x40 h LYS 386 CO 0.06 -0.30 0.59 1.49 -0.57 0.00 0.00 179.45 180.72 2x40 h GLU 387 N -0.64 0.78 -0.00 3.15 4.81 -0.89 0.53 114.58 122.34 2x40 h GLU 387 Ca -0.06 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.13 2x40 h GLU 387 Cb 0.47 -0.18 0.00 0.00 0.63 0.00 0.00 28.75 29.67 2x40 h GLU 387 CO 0.09 0.52 -0.03 0.54 -0.73 0.00 0.00 179.01 179.40 2x40 n ARG 388 N -4.74 0.13 -3.29 1.92 3.00 -0.80 -4.93 116.66 107.95 2x40 n ARG 388 Ca 0.21 -0.01 -0.17 0.00 -0.01 0.00 0.00 57.85 57.87 2x40 n ARG 388 Cb 0.49 -1.50 0.06 0.00 0.00 0.00 0.00 32.46 31.51 2x40 n ARG 388 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2x40 n GLY 389 N 1.44 -0.14 3.84 -0.13 0.00 0.19 -5.01 105.19 105.38 2x40 n GLY 389 Ca 0.09 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.80 2x40 n GLY 389 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2x40 s LEU 390 N -5.59 3.09 -1.35 0.99 1.43 -0.81 -4.96 118.68 111.49 2x40 s LEU 390 Ca 0.42 1.47 -0.14 0.00 -1.03 0.00 0.00 54.13 54.84 2x40 s LEU 390 Cb -0.18 -4.37 0.09 0.00 0.03 0.00 0.00 46.19 41.75 2x40 s LEU 390 CO 0.53 -1.28 1.92 0.59 0.23 0.00 0.00 176.35 178.33 2x40 n ASN 391 N -3.01 4.59 -4.94 2.29 3.02 -1.26 -4.88 115.26 111.06 2x40 n ASN 391 Ca 0.07 -2.93 -0.25 0.00 -0.03 0.00 0.00 54.58 51.43 2x40 n ASN 391 Cb 0.54 -1.64 -0.03 0.00 -0.61 0.00 0.00 39.78 38.05 2x40 n ASN 391 CO 0.00 0.00 0.00 0.72 -2.62 0.00 0.00 177.26 175.36 2x40 s PHE 392 N 2.75 3.48 -0.51 3.10 -0.12 -1.26 0.62 117.98 126.05 2x40 s PHE 392 Ca 0.47 0.23 -0.28 0.00 -0.05 0.00 0.00 56.93 57.31 2x40 s PHE 392 Cb 0.08 -1.77 -0.01 0.00 -0.63 0.00 0.00 43.02 40.69 2x40 s PHE 392 CO -0.01 0.37 1.67 0.34 -0.05 0.00 0.00 175.22 177.53 2x40 s ASP 393 N -3.51 5.79 0.28 1.98 3.68 0.47 -4.83 116.67 120.54 2x40 s ASP 393 Ca 0.37 0.60 0.05 0.00 2.13 0.00 0.00 52.55 55.71 2x40 s ASP 393 Cb -0.10 -2.53 0.40 0.00 -1.45 0.00 0.00 42.92 39.23 2x40 s ASP 393 CO 0.30 -1.92 1.67 -0.33 0.13 0.00 0.00 175.17 175.02 2x40 h GLU 394 N 12.84 0.28 -0.49 4.34 3.07 -1.95 -2.29 114.58 130.38 2x40 h GLU 394 Ca -0.28 -0.14 -0.11 0.00 -0.50 0.00 0.00 59.36 58.33 2x40 h GLU 394 Cb 1.14 0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 29.03 2x40 h GLU 394 CO 1.15 0.67 -0.13 1.49 -1.40 0.00 0.00 179.01 180.78 2x40 h GLU 395 N 0.23 0.92 -0.30 2.33 4.81 -2.00 -2.10 114.58 118.48 2x40 h GLU 395 Ca 0.02 -0.34 -0.09 0.00 -0.13 0.00 0.00 59.36 58.83 2x40 h GLU 395 Cb 0.86 -0.06 -0.01 0.00 0.63 0.00 0.00 28.75 30.17 2x40 h GLU 395 CO 0.07 0.99 -0.15 1.25 -0.73 0.00 0.00 179.01 180.44 2x40 h LEU 396 N 0.82 0.64 -1.08 1.64 5.85 -1.92 -2.10 115.31 119.16 2x40 h LEU 396 Ca 0.13 -0.41 0.01 0.00 0.84 0.00 0.00 57.88 58.45 2x40 h LEU 396 Cb 0.67 -0.18 -0.05 0.00 0.37 0.00 0.00 40.66 41.47 2x40 h LEU 396 CO 0.05 0.91 0.63 0.00 -0.34 0.00 0.00 178.44 179.69 2x40 h ALA 397 N 0.75 1.33 -0.64 1.25 0.00 -1.22 -0.60 119.26 120.13 2x40 h ALA 397 Ca 0.07 -0.06 -0.09 0.00 0.00 0.00 0.00 54.91 54.83 2x40 h ALA 397 Cb 0.67 -0.38 -0.02 0.00 0.00 0.00 0.00 17.79 18.06 2x40 h ALA 397 CO 0.04 0.62 0.07 0.87 0.00 0.00 0.00 179.25 180.85 2x40 h LYS 398 N 1.28 1.09 -0.63 0.00 1.57 -1.34 -1.03 116.57 117.50 2x40 h LYS 398 Ca 0.35 -0.31 0.04 0.00 -1.87 0.00 0.00 60.65 58.85 2x40 h LYS 398 Cb -0.14 -0.12 -0.04 0.00 0.08 0.00 0.00 32.23 32.01 2x40 h LYS 398 CO -0.08 1.02 0.38 1.15 -0.57 0.00 0.00 179.45 181.35 2x40 h THR 399 N 1.01 1.04 -0.15 -0.16 2.02 -0.45 -2.20 112.91 114.02 2x40 h THR 399 Ca 0.19 -0.25 -0.04 0.00 0.77 0.00 0.00 66.41 67.08 2x40 h THR 399 Cb 0.48 0.25 -0.00 0.00 -1.74 0.00 0.00 68.15 67.14 2x40 h THR 399 CO 0.02 0.13 -0.06 1.88 0.37 0.00 0.00 175.52 177.86 2x40 h TYR 400 N 0.73 0.36 -0.51 3.16 -1.99 -0.95 -2.36 116.97 115.40 2x40 h TYR 400 Ca 0.26 -0.09 0.10 0.00 2.00 0.00 0.00 58.73 61.00 2x40 h TYR 400 Cb 0.07 -0.08 -0.08 0.00 2.00 0.00 0.00 36.73 38.63 2x40 h TYR 400 CO -0.06 0.62 0.03 0.93 -0.00 0.00 0.00 178.16 179.69 2x40 h GLU 401 N -0.02 0.15 -0.25 4.88 5.08 -0.98 0.19 114.58 123.62 2x40 h GLU 401 Ca 0.03 -0.01 -0.13 0.00 -1.00 0.00 0.00 59.36 58.25 2x40 h GLU 401 Cb 0.53 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.73 2x40 h GLU 401 CO 0.02 0.10 -0.39 -0.44 -1.00 0.00 0.00 179.01 177.29 2x40 h ASP 402 N 0.15 0.63 -0.18 1.42 3.32 -1.44 -2.60 116.42 117.72 2x40 h ASP 402 Ca 0.26 -0.28 -0.01 0.00 0.02 0.00 0.00 57.03 57.02 2x40 h ASP 402 Cb 0.38 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.75 2x40 h ASP 402 CO -0.40 0.95 0.08 0.22 -1.72 0.00 0.00 179.24 178.37 2x40 h TYR 403 N 0.49 0.27 0.52 4.55 3.20 -0.67 -1.11 116.97 124.22 2x40 h TYR 403 Ca 0.04 -0.02 -0.03 0.00 3.14 0.00 0.00 58.73 61.87 2x40 h TYR 403 Cb 0.90 -0.08 0.01 0.00 1.54 0.00 0.00 36.73 39.09 2x40 h TYR 403 CO 0.04 0.32 -0.25 0.82 -1.64 0.00 0.00 178.16 177.44 2x40 h ILE 404 N 0.15 0.49 -0.98 1.81 2.04 -0.99 -2.57 117.51 117.46 2x40 h ILE 404 Ca 0.06 -0.02 0.08 0.00 1.00 0.00 0.00 64.86 65.99 2x40 h ILE 404 Cb 0.15 0.50 -0.07 0.00 -0.74 0.00 0.00 36.82 36.66 2x40 h ILE 404 CO -0.01 0.00 0.62 0.50 0.00 0.00 0.00 178.15 179.27 2x40 h LYS 405 N -0.71 1.05 -0.04 2.37 3.64 -1.47 0.55 116.57 121.96 2x40 h LYS 405 Ca -0.07 -0.06 0.03 0.00 -1.27 0.00 0.00 60.65 59.27 2x40 h LYS 405 Cb 0.54 -0.24 -0.03 0.00 -0.41 0.00 0.00 32.23 32.09 2x40 h LYS 405 CO 0.12 0.70 -0.13 -0.22 -2.27 0.00 0.00 179.45 177.64 2x40 h LYS 406 N 1.09 -0.19 0.00 1.90 3.64 -1.03 -2.90 116.57 119.07 2x40 h LYS 406 Ca 0.44 0.01 -0.02 0.00 -1.27 0.00 0.00 60.65 59.82 2x40 h LYS 406 Cb 0.26 0.04 -0.00 0.00 -0.41 0.00 0.00 32.23 32.12 2x40 h LYS 406 CO -0.20 -0.13 -0.51 0.52 -2.27 0.00 0.00 179.45 176.86 2x40 h MET 407 N -0.20 0.00 0.00 1.90 2.86 -1.03 -3.02 114.93 115.45 2x40 h MET 407 Ca 0.06 0.00 -0.00 0.00 -2.06 0.00 0.00 59.70 57.70 2x40 h MET 407 Cb 0.28 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 31.94 2x40 h MET 407 CO -0.16 0.05 -0.02 0.00 1.06 0.00 0.00 176.91 177.83 2x40 h ARG 408 N 0.00 0.00 0.00 1.72 2.47 -0.82 -1.77 114.38 115.98 2x40 h ARG 408 Ca -0.01 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.71 2x40 h ARG 408 Cb 1.05 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.37 2x40 h ARG 408 CO 0.01 0.02 -0.71 -1.91 0.56 0.00 0.00 179.97 177.94 2x40 n GLU 409 N -3.13 0.04 -2.80 0.04 0.00 -1.10 -4.04 120.64 109.65 2x40 n GLU 409 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 57.16 56.81 2x40 n GLU 409 Cb 0.30 -1.51 -0.07 0.00 0.00 0.00 0.00 31.44 30.16 2x40 n GLU 409 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.13 177.05 2x40 s THR 410 N -3.03 4.28 0.28 6.31 -1.32 -0.67 -4.94 115.64 116.55 2x40 s THR 410 Ca 0.09 1.70 0.01 0.00 -1.21 0.00 0.00 61.69 62.28 2x40 s THR 410 Cb 0.17 -3.86 0.27 0.00 -1.51 0.00 0.00 72.50 67.57 2x40 s THR 410 CO 0.76 -0.03 1.81 -0.33 -2.21 0.00 0.00 174.62 174.63 2x40 h GLU 411 N 2.71 0.86 0.00 7.08 4.39 -1.91 -1.40 114.58 126.31 2x40 h GLU 411 Ca -0.48 -0.05 0.00 0.00 0.34 0.00 0.00 59.36 59.17 2x40 h GLU 411 Cb 1.19 -0.19 0.00 0.00 -0.10 0.00 0.00 28.75 29.64 2x40 h GLU 411 CO 0.63 0.57 0.00 1.49 -1.16 0.00 0.00 179.01 180.54 2x40 h GLU 412 N 0.89 0.00 -0.12 2.33 4.81 -1.93 -3.33 114.58 117.23 2x40 h GLU 412 Ca 0.49 0.00 -0.15 0.00 -0.13 0.00 0.00 59.36 59.57 2x40 h GLU 412 Cb 0.54 0.00 -0.23 0.00 0.63 0.00 0.00 28.75 29.68 2x40 h GLU 412 CO -0.29 0.00 -0.80 0.66 -0.73 0.00 0.00 179.01 177.85 2x40 n TYR 413 N -2.52 0.39 -4.12 0.92 4.01 -0.55 -4.82 117.16 110.47 2x40 n TYR 413 Ca 0.04 -1.24 -0.31 0.00 -0.16 0.00 0.00 57.90 56.23 2x40 n TYR 413 Cb 0.37 -0.22 -0.08 0.00 -0.31 0.00 0.00 39.34 39.11 2x40 n TYR 413 CO 0.00 0.00 0.00 -1.59 -0.46 0.00 0.00 176.86 174.81 2x40 s LYS 414 N -2.06 2.69 0.68 -0.72 -2.85 -1.08 -4.21 119.74 112.19 2x40 s LYS 414 Ca 0.37 -0.76 -0.17 0.00 -1.00 0.00 0.00 55.97 54.41 2x40 s LYS 414 Cb 0.38 -2.62 -0.00 0.00 -2.06 0.00 0.00 37.83 33.53 2x40 s LYS 414 CO -0.10 0.56 1.09 -2.30 0.10 0.00 0.00 175.35 174.70 2x40 n PRO 415 N 0.64 0.73 0.00 1.78 -0.02 -1.26 -4.65 135.00 132.22 2x40 n PRO 415 Ca -0.11 0.31 0.00 0.00 -2.02 0.00 0.00 63.50 61.68 2x40 n PRO 415 Cb 0.52 -2.33 0.00 0.00 -0.02 0.00 0.00 33.50 31.67 2x40 n PRO 415 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 2x40 n ARG 416 N -1.84 2.15 -1.51 -0.52 1.74 -1.26 -5.00 116.66 110.42 2x40 n ARG 416 Ca 0.14 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.22 2x40 n ARG 416 Cb 0.49 -0.42 0.00 0.00 -1.02 0.00 0.00 32.46 31.51 2x40 n ARG 416 CO 0.00 0.00 0.00 0.44 -1.52 0.00 0.00 177.63 176.55 2x40 n ILE 424 N -0.29 -2.85 -4.18 0.55 -6.64 -1.26 -5.23 119.36 99.45 2x40 n ILE 424 Ca 0.00 1.38 -0.34 0.00 -1.77 0.00 0.00 62.75 62.02 2x40 n ILE 424 Cb 0.00 -2.16 -0.14 0.00 -1.44 0.00 0.00 39.64 35.90 2x40 n ILE 424 CO 0.00 0.00 0.00 -0.54 -1.77 0.00 0.00 176.55 174.24 2x40 s LYS 425 N -4.74 3.38 0.48 6.28 1.02 -1.26 -4.96 119.74 119.94 2x40 s LYS 425 Ca 0.00 -0.64 -0.24 0.00 0.02 0.00 0.00 55.97 55.11 2x40 s LYS 425 Cb 0.00 -2.88 -0.07 0.00 -0.52 0.00 0.00 37.83 34.36 2x40 s LYS 425 CO 0.00 -0.06 1.38 -2.14 -0.92 0.00 0.00 175.35 173.61 2x40 s PRO 426 N 1.08 3.55 0.06 -1.68 0.02 -1.26 -4.92 135.00 131.85 2x40 s PRO 426 Ca 0.01 2.30 -0.31 0.00 0.02 0.00 0.00 61.00 63.02 2x40 s PRO 426 Cb -0.15 -2.53 -0.07 0.00 0.02 0.00 0.00 34.50 31.77 2x40 s PRO 426 CO -0.01 -0.88 1.44 0.21 -0.33 0.00 0.00 177.00 177.42 2x40 s LYS 427 N -2.58 4.28 0.33 5.54 2.20 -1.26 -4.96 119.74 123.29 2x40 s LYS 427 Ca 0.64 2.07 -0.14 0.00 -0.36 0.00 0.00 55.97 58.18 2x40 s LYS 427 Cb -0.41 -3.43 -0.09 0.00 -1.51 0.00 0.00 37.83 32.39 2x40 s LYS 427 CO 0.52 -0.54 0.73 -0.51 -0.36 0.00 0.00 175.35 175.19 2x40 s LEU 428 N 1.85 4.03 0.33 5.43 1.43 -1.26 -5.05 118.68 125.44 2x40 s LEU 428 Ca 0.66 1.25 -0.29 0.00 -1.03 0.00 0.00 54.13 54.72 2x40 s LEU 428 Cb -0.35 -4.06 -0.10 0.00 0.03 0.00 0.00 46.19 41.70 2x40 s LEU 428 CO 0.29 -0.23 1.34 -2.84 0.23 0.00 0.00 176.35 175.14 2x40 s PRO 429 N -3.09 4.32 -0.00 1.29 0.02 -1.26 -4.95 135.00 131.32 2x40 s PRO 429 Ca 0.54 2.27 0.12 0.00 0.02 0.00 0.00 61.00 63.94 2x40 s PRO 429 Cb -0.10 -3.06 -0.13 0.00 0.02 0.00 0.00 34.50 31.22 2x40 s PRO 429 CO 0.19 -0.25 0.51 0.39 -0.33 0.00 0.00 177.00 177.51 2x40 n GLU 430 N 0.91 2.96 -1.28 5.54 -0.58 -1.26 -4.60 120.64 122.33 2x40 n GLU 430 Ca 0.01 -0.00 -0.27 0.00 -0.42 0.00 0.00 57.16 56.48 2x40 n GLU 430 Cb 0.41 -1.08 0.13 0.00 -0.57 0.00 0.00 31.44 30.34 2x40 n GLU 430 CO 0.00 0.00 0.00 0.27 -0.48 0.00 0.00 177.13 176.92 2x40 n ASN 431 N -1.30 5.41 0.00 1.62 6.94 -1.26 -4.63 115.26 122.04 2x40 n ASN 431 Ca 0.02 -3.72 0.12 0.00 -0.02 0.00 0.00 54.58 50.99 2x40 n ASN 431 Cb 0.19 -0.84 0.63 0.00 -2.36 0.00 0.00 39.78 37.39 2x40 n ASN 431 CO 0.00 0.00 0.00 2.22 -1.03 0.00 0.00 177.26 178.45 2x40 n PHE 432 N -1.02 0.00 -3.38 -2.53 1.16 -1.26 -4.76 117.46 105.67 2x40 n PHE 432 Ca 0.57 0.00 -0.38 0.00 -1.87 0.00 0.00 57.45 55.78 2x40 n PHE 432 Cb 1.12 -0.27 -0.06 0.00 -1.61 0.00 0.00 39.48 38.66 2x40 n PHE 432 CO 0.00 0.00 0.00 -0.51 -1.87 0.00 0.00 176.76 174.38 2x40 s LEU 433 N -2.55 4.33 0.52 5.98 1.43 -1.26 -5.05 118.68 122.09 2x40 s LEU 433 Ca 0.24 0.84 -0.22 0.00 -1.03 0.00 0.00 54.13 53.96 2x40 s LEU 433 Cb 0.17 -2.65 -0.06 0.00 0.03 0.00 0.00 46.19 43.68 2x40 s LEU 433 CO 0.37 0.10 1.27 -0.24 0.23 0.00 0.00 176.35 178.09 2x40 n SER 434 N 3.12 2.33 0.14 2.29 2.88 -1.26 -4.87 113.62 118.24 2x40 n SER 434 Ca -0.09 0.98 0.15 0.00 -1.33 0.00 0.00 58.87 58.57 2x40 n SER 434 Cb 0.52 -1.53 0.69 0.00 -0.75 0.00 0.00 64.21 63.14 2x40 n SER 434 CO 0.00 0.00 0.00 -0.33 -1.23 0.00 0.00 175.04 173.48 2x40 h GLU 435 N 1.43 0.00 -0.00 -1.46 5.08 -1.96 -1.80 114.58 115.86 2x40 h GLU 435 Ca -0.50 0.00 -0.23 0.00 -1.00 0.00 0.00 59.36 57.64 2x40 h GLU 435 Cb 1.31 0.00 0.02 0.00 0.50 0.00 0.00 28.75 30.58 2x40 h GLU 435 CO 0.57 0.00 -0.88 0.87 -1.00 0.00 0.00 179.01 178.56 2x40 h LYS 436 N 0.00 0.60 -0.32 2.33 1.57 -2.00 -2.85 116.57 115.90 2x40 h LYS 436 Ca 0.12 -0.64 0.01 0.00 -1.87 0.00 0.00 60.65 58.27 2x40 h LYS 436 Cb 0.51 0.18 -0.02 0.00 0.08 0.00 0.00 32.23 32.99 2x40 h LYS 436 CO -0.00 1.25 0.22 0.93 -0.57 0.00 0.00 179.45 181.27 2x40 h GLU 437 N 0.22 0.39 0.05 3.15 5.08 -1.70 -1.93 114.58 119.84 2x40 h GLU 437 Ca -0.11 -0.02 -0.23 0.00 -1.00 0.00 0.00 59.36 58.00 2x40 h GLU 437 Cb 1.56 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 30.71 2x40 h GLU 437 CO 0.17 0.26 -1.03 0.82 -1.00 0.00 0.00 179.01 178.24 2x40 h ILE 438 N 0.40 1.52 -0.60 3.13 2.04 -1.46 -2.57 117.51 119.97 2x40 h ILE 438 Ca 0.12 -2.88 0.07 0.00 1.00 0.00 0.00 64.86 63.17 2x40 h ILE 438 Cb 0.00 2.69 -0.06 0.00 -0.74 0.00 0.00 36.82 38.71 2x40 h ILE 438 CO -0.03 0.84 0.28 -0.74 0.00 0.00 0.00 178.15 178.51 2x40 h HIS 439 N 0.09 0.51 -0.25 1.37 2.76 -1.12 -0.37 115.15 118.14 2x40 h HIS 439 Ca -0.07 0.03 -0.04 0.00 -2.20 0.00 0.00 60.37 58.08 2x40 h HIS 439 Cb 1.72 -0.14 -0.01 0.00 1.55 0.00 0.00 27.41 30.53 2x40 h HIS 439 CO 0.04 0.20 -0.02 0.87 -1.30 0.00 0.00 177.93 177.73 2x40 h LYS 440 N 0.52 0.46 -0.61 5.26 1.79 -1.36 -2.25 116.57 120.37 2x40 h LYS 440 Ca 0.29 -0.15 0.06 0.00 -2.18 0.00 0.00 60.65 58.66 2x40 h LYS 440 Cb 0.26 -0.04 -0.04 0.00 -1.58 0.00 0.00 32.23 30.84 2x40 h LYS 440 CO -0.23 0.64 0.41 -0.07 -1.08 0.00 0.00 179.45 179.12 2x40 h LEU 441 N 0.23 0.54 -0.72 2.94 3.38 -1.21 -0.05 115.31 120.41 2x40 h LEU 441 Ca 0.07 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.91 2x40 h LEU 441 Cb 0.45 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.07 2x40 h LEU 441 CO 0.02 0.35 -0.45 0.00 0.09 0.00 0.00 178.44 178.45 2x40 h ALA 442 N 1.66 0.90 -0.19 1.53 0.00 -0.75 -0.82 119.26 121.60 2x40 h ALA 442 Ca 0.26 -0.45 -0.19 0.00 0.00 0.00 0.00 54.91 54.53 2x40 h ALA 442 Cb 0.26 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 17.95 2x40 h ALA 442 CO -0.08 0.65 -0.63 -0.22 0.00 0.00 0.00 179.25 178.97 2x40 h LYS 443 N 0.36 0.67 -0.06 0.00 3.64 -0.69 -3.33 116.57 117.16 2x40 h LYS 443 Ca 0.02 -0.47 -0.24 0.00 -1.27 0.00 0.00 60.65 58.70 2x40 h LYS 443 Cb 0.93 0.07 0.01 0.00 -0.41 0.00 0.00 32.23 32.84 2x40 h LYS 443 CO 0.08 1.09 -0.91 -0.22 -2.27 0.00 0.00 179.45 177.22 2x40 h LYS 444 N 0.49 0.67 -6.41 1.90 3.64 -0.93 -3.47 116.57 112.46 2x40 h LYS 444 Ca -0.01 -0.63 -0.45 0.00 -1.27 0.00 0.00 60.65 58.29 2x40 h LYS 444 Cb 1.22 0.16 0.01 0.00 -0.41 0.00 0.00 32.23 33.21 2x40 h LYS 444 CO 0.13 1.24 -0.26 -0.80 -2.27 0.00 0.00 179.45 177.48 2x40 s ASN 445 N -7.17 5.44 -0.24 4.20 0.01 -0.32 -5.03 114.94 111.83 2x40 s ASN 445 Ca -0.09 -0.57 -0.05 0.00 -0.71 0.00 0.00 52.86 51.44 2x40 s ASN 445 Cb 0.08 -0.47 -0.18 0.00 0.41 0.00 0.00 41.25 41.09 2x40 s ASN 445 CO 0.90 -0.84 -0.13 0.47 -1.51 0.00 0.00 177.10 176.00 2x40 n ASP 446 N -1.85 1.99 -4.11 -1.22 8.00 0.32 -4.88 116.55 114.81 2x40 n ASP 446 Ca 0.08 0.07 -0.11 0.00 0.71 0.00 0.00 54.79 55.55 2x40 n ASP 446 Cb 0.60 -0.63 -0.11 0.00 -0.02 0.00 0.00 41.12 40.97 2x40 n ASP 446 CO 0.00 0.00 0.00 0.68 -0.39 0.00 0.00 177.20 177.49 2x40 s VAL 447 N -2.51 0.54 -0.09 2.53 -7.23 -0.98 -4.12 120.40 108.55 2x40 s VAL 447 Ca -0.33 -1.54 -0.01 0.00 -1.81 0.00 0.00 61.98 58.28 2x40 s VAL 447 Cb 0.10 -1.18 -0.03 0.00 0.56 0.00 0.00 36.38 35.83 2x40 s VAL 447 CO 0.60 -0.68 -0.02 0.00 -0.31 0.00 0.00 175.10 174.69 2x40 s ALA 448 N -2.70 3.18 -0.17 1.32 0.00 -0.80 -0.88 121.76 121.71 2x40 s ALA 448 Ca 0.01 -0.83 -0.00 0.00 0.00 0.00 0.00 51.96 51.14 2x40 s ALA 448 Cb -0.01 -1.41 0.04 0.00 0.00 0.00 0.00 23.12 21.74 2x40 s ALA 448 CO -0.03 0.56 -0.05 0.08 0.00 0.00 0.00 175.76 176.32 2x40 s VAL 449 N -0.78 1.12 -0.25 0.00 1.01 0.24 -0.35 120.40 121.39 2x40 s VAL 449 Ca 0.12 -0.68 -0.06 0.00 0.00 0.00 0.00 61.98 61.36 2x40 s VAL 449 Cb -0.11 -1.32 -0.02 0.00 0.00 0.00 0.00 36.38 34.93 2x40 s VAL 449 CO 0.02 0.09 0.04 -0.63 0.00 0.00 0.00 175.10 174.62 2x40 s ILE 450 N 1.62 4.00 -0.23 2.22 1.01 0.27 -0.05 121.20 130.05 2x40 s ILE 450 Ca 0.00 -0.32 -0.14 0.00 0.00 0.00 0.00 60.65 60.19 2x40 s ILE 450 Cb -0.16 -2.88 -0.04 0.00 0.01 0.00 0.00 42.46 39.39 2x40 s ILE 450 CO -0.08 0.33 0.30 -0.69 0.00 0.00 0.00 174.94 174.81 2x40 s VAL 451 N 1.56 5.26 -0.06 2.92 1.01 -0.33 0.62 120.40 131.37 2x40 s VAL 451 Ca 0.06 0.48 0.06 0.00 0.00 0.00 0.00 61.98 62.58 2x40 s VAL 451 Cb -0.15 -3.64 -0.01 0.00 0.00 0.00 0.00 36.38 32.58 2x40 s VAL 451 CO 0.01 0.27 -0.24 0.27 0.00 0.00 0.00 175.10 175.41 2x40 s ILE 452 N 1.34 2.10 0.08 2.22 -5.25 -0.65 -4.23 121.20 116.82 2x40 s ILE 452 Ca 0.14 -1.05 0.07 0.00 -0.99 0.00 0.00 60.65 58.82 2x40 s ILE 452 Cb -0.14 -1.76 -0.03 0.00 2.95 0.00 0.00 42.46 43.47 2x40 s ILE 452 CO 0.07 0.57 -0.20 -0.44 -1.79 0.00 0.00 174.94 173.15 2x40 s SER 453 N -0.13 2.38 0.01 4.36 0.01 -1.26 -1.20 113.70 117.87 2x40 s SER 453 Ca -0.04 -0.61 -0.00 0.00 1.31 0.00 0.00 55.95 56.60 2x40 s SER 453 Cb -0.14 -0.15 -0.01 0.00 0.21 0.00 0.00 66.02 65.93 2x40 s SER 453 CO 0.04 0.08 -0.01 -0.13 0.41 0.00 0.00 173.24 173.63 2x40 s ARG 454 N -1.59 0.21 0.02 12.44 1.81 -0.86 -4.97 118.95 126.02 2x40 s ARG 454 Ca 0.06 -0.38 0.02 0.00 -1.72 0.00 0.00 55.73 53.71 2x40 s ARG 454 Cb -0.09 0.07 -0.02 0.00 -0.45 0.00 0.00 34.95 34.47 2x40 s ARG 454 CO 0.03 -0.03 -0.07 -1.50 -0.68 0.00 0.00 175.30 173.04 2x40 s ILE 455 N -0.93 0.54 0.06 1.52 2.07 -1.26 -4.24 121.20 118.96 2x40 s ILE 455 Ca -0.10 -0.72 0.01 0.00 -1.41 0.00 0.00 60.65 58.43 2x40 s ILE 455 Cb -0.06 -0.54 -0.00 0.00 0.13 0.00 0.00 42.46 41.98 2x40 s ILE 455 CO -0.01 -0.14 0.04 -1.54 -1.91 0.00 0.00 174.94 171.38 2x40 n SER 456 N 2.12 0.31 -3.62 4.50 3.41 -1.26 -5.05 113.62 114.03 2x40 n SER 456 Ca -0.18 -1.35 -0.01 0.00 -0.26 0.00 0.00 58.87 57.08 2x40 n SER 456 Cb 0.56 0.23 -0.01 0.00 -0.26 0.00 0.00 64.21 64.72 2x40 n SER 456 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2x40 s GLY 457 N -1.38 -0.28 0.20 5.00 0.00 -1.14 -1.51 107.32 108.21 2x40 s GLY 457 Ca 0.05 1.66 -0.32 0.00 0.00 0.00 0.00 44.72 46.12 2x40 s GLY 457 CO 0.04 0.52 1.17 -2.21 0.00 0.00 0.00 173.10 172.62 2x40 n GLU 458 N -0.14 1.33 0.00 2.90 2.13 -0.96 -2.66 120.64 123.24 2x40 n GLU 458 Ca 0.01 0.47 0.00 0.00 0.66 0.00 0.00 57.16 58.31 2x40 n GLU 458 Cb 0.58 -1.97 0.00 0.00 0.27 0.00 0.00 31.44 30.32 2x40 n GLU 458 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2x40 n GLY 459 N 1.91 1.00 2.89 8.31 0.00 -1.26 -4.79 105.19 113.26 2x40 n GLY 459 Ca 0.14 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.92 2x40 n GLY 459 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2x40 s TYR 460 N -2.26 1.08 0.31 1.61 2.02 -1.09 -4.79 117.35 114.24 2x40 s TYR 460 Ca 0.00 -0.41 -0.11 0.00 -0.37 0.00 0.00 57.07 56.18 2x40 s TYR 460 Cb 0.00 -0.93 -0.07 0.00 -0.40 0.00 0.00 41.96 40.55 2x40 s TYR 460 CO 0.00 -0.33 0.67 -0.51 -1.57 0.00 0.00 175.55 173.81 2x40 s ASP 461 N 1.33 6.62 0.61 2.29 -0.00 -1.26 -3.42 116.67 122.83 2x40 s ASP 461 Ca -0.04 1.07 -0.11 0.00 -0.00 0.00 0.00 52.55 53.47 2x40 s ASP 461 Cb -0.14 -2.29 -0.04 0.00 -0.00 0.00 0.00 42.92 40.45 2x40 s ASP 461 CO -0.03 -0.22 1.02 -0.13 -0.00 0.00 0.00 175.17 175.82 2x40 s ARG 462 N -3.24 3.63 0.12 8.23 0.52 0.80 -4.87 118.95 124.14 2x40 s ARG 462 Ca 0.50 0.76 0.08 0.00 -0.52 0.00 0.00 55.73 56.55 2x40 s ARG 462 Cb -0.11 -2.09 -0.04 0.00 0.52 0.00 0.00 34.95 33.24 2x40 s ARG 462 CO 0.24 -0.54 -0.12 0.15 0.02 0.00 0.00 175.30 175.04 2x40 s LYS 463 N -5.09 2.02 -1.49 3.54 1.02 -1.26 -4.81 119.74 113.67 2x40 s LYS 463 Ca 0.55 -1.10 -0.11 0.00 0.02 0.00 0.00 55.97 55.33 2x40 s LYS 463 Cb -0.11 -2.23 -0.05 0.00 -0.52 0.00 0.00 37.83 34.91 2x40 s LYS 463 CO 0.52 0.49 2.65 -0.35 -0.92 0.00 0.00 175.35 177.75 2x40 n PRO 464 N 0.64 3.25 -4.28 -1.68 -0.04 -1.26 -3.25 135.00 128.37 2x40 n PRO 464 Ca -0.14 -2.23 -0.15 0.00 -0.04 0.00 0.00 63.50 60.94 2x40 n PRO 464 Cb 0.53 -2.91 -0.10 0.00 -0.04 0.00 0.00 33.50 30.98 2x40 n PRO 464 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 2x40 s VAL 465 N 2.66 0.97 0.51 0.52 -7.23 -1.26 -4.90 120.40 111.67 2x40 s VAL 465 Ca 0.61 -2.03 -0.23 0.00 -1.81 0.00 0.00 61.98 58.52 2x40 s VAL 465 Cb 0.16 -2.14 -0.06 0.00 0.56 0.00 0.00 36.38 34.89 2x40 s VAL 465 CO -0.06 -0.48 1.39 -0.54 -0.31 0.00 0.00 175.10 175.10 2x40 s LYS 466 N -3.85 3.37 0.00 4.82 1.02 -1.26 -1.70 119.74 122.14 2x40 s LYS 466 Ca 0.24 2.32 0.00 0.00 0.02 0.00 0.00 55.97 58.55 2x40 s LYS 466 Cb 0.05 -2.43 0.00 0.00 -0.52 0.00 0.00 37.83 34.93 2x40 s LYS 466 CO 0.05 -1.03 0.00 0.41 -0.92 0.00 0.00 175.35 173.86 2x40 n GLY 467 N 0.66 1.79 0.00 -3.33 0.00 0.14 -4.75 105.19 99.70 2x40 n GLY 467 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.10 2x40 n GLY 467 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2x40 n ASP 468 N 0.00 0.00 0.04 1.61 -0.08 -0.69 -4.86 116.55 112.57 2x40 n ASP 468 Ca 0.00 0.00 -0.02 0.00 -1.51 0.00 0.00 54.79 53.26 2x40 n ASP 468 Cb 0.00 0.00 0.25 0.00 2.34 0.00 0.00 41.12 43.71 2x40 n ASP 468 CO 0.00 0.00 0.00 0.15 0.12 0.00 0.00 177.20 177.47 2x40 h PHE 469 N 0.00 0.47 -2.95 -0.67 3.57 -1.49 -3.44 116.94 112.43 2x40 h PHE 469 Ca 0.00 -0.08 -0.61 0.00 3.53 0.00 0.00 57.97 60.81 2x40 h PHE 469 Cb 0.00 -0.12 -0.07 0.00 2.79 0.00 0.00 35.95 38.55 2x40 h PHE 469 CO 0.00 0.61 -0.57 0.71 -2.23 0.00 0.00 178.31 176.83 2x40 s TYR 470 N -4.59 3.24 0.36 0.41 1.51 -1.07 0.20 117.35 117.41 2x40 s TYR 470 Ca -0.07 0.07 -0.28 0.00 -1.01 0.00 0.00 57.07 55.78 2x40 s TYR 470 Cb 0.14 -1.61 -0.11 0.00 -0.11 0.00 0.00 41.96 40.28 2x40 s TYR 470 CO 0.77 0.53 1.47 -0.51 -1.11 0.00 0.00 175.55 176.70 2x40 s LEU 471 N -2.69 4.34 0.71 -1.29 1.02 -1.26 0.29 118.68 119.79 2x40 s LEU 471 Ca 0.31 2.99 -0.13 0.00 0.02 0.00 0.00 54.13 57.32 2x40 s LEU 471 Cb -0.12 -3.66 0.02 0.00 0.02 0.00 0.00 46.19 42.46 2x40 s LEU 471 CO 0.24 -0.83 1.09 -0.94 0.02 0.00 0.00 176.35 175.93 2x40 s SER 472 N -0.12 4.90 0.32 2.29 1.04 -1.26 -3.90 113.70 116.97 2x40 s SER 472 Ca 0.53 1.88 0.07 0.00 0.48 0.00 0.00 55.95 58.91 2x40 s SER 472 Cb -0.46 -2.53 0.75 0.00 0.10 0.00 0.00 66.02 63.88 2x40 s SER 472 CO 0.60 -1.77 1.82 0.44 0.98 0.00 0.00 173.24 175.31 2x40 h ASP 473 N -0.52 0.76 0.27 7.02 3.32 -1.95 -1.08 116.42 124.24 2x40 h ASP 473 Ca -0.45 0.07 -0.10 0.00 0.02 0.00 0.00 57.03 56.57 2x40 h ASP 473 Cb 1.23 -0.08 -0.01 0.00 0.22 0.00 0.00 39.33 40.70 2x40 h ASP 473 CO 0.53 0.33 -0.40 -2.24 -1.72 0.00 0.00 179.24 175.75 2x40 h ASP 474 N 0.77 0.18 -0.10 6.45 -0.00 -1.98 -0.23 116.42 121.51 2x40 h ASP 474 Ca 0.52 -0.07 -0.04 0.00 -0.00 0.00 0.00 57.03 57.44 2x40 h ASP 474 Cb 0.80 -0.05 -0.00 0.00 -0.00 0.00 0.00 39.33 40.08 2x40 h ASP 474 CO -0.30 0.56 -0.11 -0.33 -0.00 0.00 0.00 179.24 179.06 2x40 h GLU 475 N 0.15 0.25 -0.07 4.15 5.08 -1.58 -1.24 114.58 121.31 2x40 h GLU 475 Ca 0.01 -0.14 -0.07 0.00 -1.00 0.00 0.00 59.36 58.16 2x40 h GLU 475 Cb 0.77 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 30.02 2x40 h GLU 475 CO 0.06 0.68 -0.29 0.00 -1.00 0.00 0.00 179.01 178.46 2x40 h THR 476 N -0.17 1.24 -0.10 1.13 1.03 -1.32 -1.17 112.91 113.54 2x40 h THR 476 Ca 0.01 -1.13 -0.00 0.00 -0.01 0.00 0.00 66.41 65.28 2x40 h THR 476 Cb 0.64 1.51 -0.00 0.00 -1.07 0.00 0.00 68.15 69.23 2x40 h THR 476 CO 0.03 0.33 0.05 0.44 -0.01 0.00 0.00 175.52 176.36 2x40 h ASP 477 N 0.12 0.13 -0.06 0.00 3.32 -0.99 -0.96 116.42 117.99 2x40 h ASP 477 Ca 0.02 -0.11 0.01 0.00 0.02 0.00 0.00 57.03 56.97 2x40 h ASP 477 Cb 0.58 -0.03 -0.01 0.00 0.22 0.00 0.00 39.33 40.08 2x40 h ASP 477 CO 0.04 0.21 -0.02 0.25 -1.72 0.00 0.00 179.24 178.00 2x40 h LEU 478 N 0.05 -0.08 -0.74 1.55 5.85 -0.79 -0.91 115.31 120.24 2x40 h LEU 478 Ca 0.04 0.02 -0.03 0.00 0.84 0.00 0.00 57.88 58.74 2x40 h LEU 478 Cb 0.11 0.05 -0.03 0.00 0.37 0.00 0.00 40.66 41.15 2x40 h LEU 478 CO -0.00 -0.03 0.33 0.40 -0.34 0.00 0.00 178.44 178.79 2x40 h ILE 479 N -0.02 1.25 -0.75 4.05 2.04 -1.20 0.60 117.51 123.47 2x40 h ILE 479 Ca 0.03 -0.73 -0.05 0.00 1.00 0.00 0.00 64.86 65.11 2x40 h ILE 479 Cb 0.07 0.35 -0.03 0.00 -0.74 0.00 0.00 36.82 36.46 2x40 h ILE 479 CO -0.07 0.30 0.25 0.11 0.00 0.00 0.00 178.15 178.75 2x40 h LYS 480 N 1.05 1.14 -0.01 2.37 1.57 -0.95 -0.62 116.57 121.13 2x40 h LYS 480 Ca 0.25 -0.23 -0.04 0.00 -1.87 0.00 0.00 60.65 58.76 2x40 h LYS 480 Cb 0.16 -0.17 0.00 0.00 0.08 0.00 0.00 32.23 32.30 2x40 h LYS 480 CO -0.03 0.96 -0.16 1.15 -0.57 0.00 0.00 179.45 180.80 2x40 h THR 481 N 1.10 1.55 -0.58 -0.16 2.02 -0.83 -2.04 112.91 113.98 2x40 h THR 481 Ca 0.24 -1.83 0.01 0.00 0.77 0.00 0.00 66.41 65.60 2x40 h THR 481 Cb 0.28 2.72 -0.03 0.00 -1.74 0.00 0.00 68.15 69.37 2x40 h THR 481 CO -0.01 0.49 0.39 0.58 0.37 0.00 0.00 175.52 177.34 2x40 h VAL 482 N -0.56 1.15 -0.39 3.16 2.07 -0.91 -1.90 116.25 118.87 2x40 h VAL 482 Ca -0.02 -0.27 0.05 0.00 0.82 0.00 0.00 66.70 67.28 2x40 h VAL 482 Cb 0.89 0.29 -0.05 0.00 -1.52 0.00 0.00 31.29 30.91 2x40 h VAL 482 CO 0.03 0.14 0.13 -1.28 0.02 0.00 0.00 177.57 176.61 2x40 h SER 483 N 0.79 0.12 -0.16 0.57 0.87 -1.16 -0.83 113.55 113.75 2x40 h SER 483 Ca 0.21 0.05 -0.01 0.00 -1.23 0.00 0.00 61.79 60.81 2x40 h SER 483 Cb -0.09 0.04 -0.01 0.00 -0.44 0.00 0.00 62.40 61.90 2x40 h SER 483 CO -0.05 0.11 0.04 -0.09 -0.53 0.00 0.00 176.83 176.31 2x40 h ARG 484 N 0.28 0.26 -0.01 2.24 2.43 -0.99 -0.86 114.38 117.73 2x40 h ARG 484 Ca 0.18 -0.06 -0.23 0.00 -0.81 0.00 0.00 59.98 59.07 2x40 h ARG 484 Cb 0.18 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 29.69 2x40 h ARG 484 CO -0.20 0.39 -0.94 0.93 -1.51 0.00 0.00 179.97 178.65 2x40 h GLU 485 N 0.07 0.43 -0.01 0.20 4.39 -1.28 0.17 114.58 118.56 2x40 h GLU 485 Ca 0.05 -0.46 -0.12 0.00 0.34 0.00 0.00 59.36 59.18 2x40 h GLU 485 Cb 0.25 0.13 -0.02 0.00 -0.10 0.00 0.00 28.75 29.01 2x40 h GLU 485 CO -0.00 1.11 -0.54 0.74 -1.16 0.00 0.00 179.01 179.16 2x40 h PHE 486 N 0.25 0.05 0.00 4.33 0.04 -1.18 -2.27 116.94 118.15 2x40 h PHE 486 Ca -0.08 -0.02 -0.01 0.00 2.80 0.00 0.00 57.97 60.67 2x40 h PHE 486 Cb 1.57 -0.01 -0.00 0.00 2.20 0.00 0.00 35.95 39.71 2x40 h PHE 486 CO 0.06 0.57 -0.04 0.45 -0.60 0.00 0.00 178.31 178.76 2x40 h HIS 487 N 0.03 0.00 0.67 -0.55 3.86 -1.06 -1.12 115.15 116.98 2x40 h HIS 487 Ca -0.00 0.00 -0.03 0.00 -1.16 0.00 0.00 60.37 59.17 2x40 h HIS 487 Cb 0.96 0.00 0.01 0.00 1.06 0.00 0.00 27.41 29.44 2x40 h HIS 487 CO 0.00 0.04 -0.32 1.49 0.86 0.00 0.00 177.93 180.00 2x40 h GLU 488 N 0.00 -0.87 -7.30 2.45 4.57 -0.36 -3.40 114.58 109.68 2x40 h GLU 488 Ca -0.00 0.06 -0.50 0.00 -1.18 0.00 0.00 59.36 57.74 2x40 h GLU 488 Cb 0.91 0.20 0.16 0.00 -0.16 0.00 0.00 28.75 29.86 2x40 h GLU 488 CO 0.00 -0.56 0.24 -0.65 -1.18 0.00 0.00 179.01 176.87 2x40 s GLN 489 N -5.76 1.32 -0.03 1.92 -1.52 -1.11 -4.88 119.66 109.60 2x40 s GLN 489 Ca -0.17 1.09 -0.04 0.00 -1.95 0.00 0.00 55.36 54.29 2x40 s GLN 489 Cb 0.03 -1.79 -0.18 0.00 -0.22 0.00 0.00 33.01 30.84 2x40 s GLN 489 CO 0.59 -2.28 3.17 0.41 -0.25 0.00 0.00 175.29 176.93 2x40 n GLY 490 N -0.68 2.96 3.64 3.09 0.00 -1.26 -4.79 105.19 108.15 2x40 n GLY 490 Ca 0.08 -0.95 -0.25 0.00 0.00 0.00 0.00 46.02 44.91 2x40 n GLY 490 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2x40 s LYS 491 N 0.58 2.29 0.19 1.61 1.02 -0.43 -5.03 119.74 119.97 2x40 s LYS 491 Ca 0.50 -1.28 0.00 0.00 0.02 0.00 0.00 55.97 55.21 2x40 s LYS 491 Cb 0.24 -2.23 -0.04 0.00 -0.52 0.00 0.00 37.83 35.28 2x40 s LYS 491 CO -0.01 0.41 0.36 0.15 -0.92 0.00 0.00 175.35 175.34 2x40 s LYS 492 N -3.26 3.50 0.02 1.68 -0.14 -1.26 -3.84 119.74 116.44 2x40 s LYS 492 Ca 0.29 -0.41 0.07 0.00 -1.36 0.00 0.00 55.97 54.56 2x40 s LYS 492 Cb -0.08 -2.87 -0.02 0.00 -1.68 0.00 0.00 37.83 33.18 2x40 s LYS 492 CO 0.19 0.43 -0.21 0.54 -0.76 0.00 0.00 175.35 175.54 2x40 s VAL 493 N -1.84 1.64 -0.02 3.17 0.11 -1.26 -1.91 120.40 120.30 2x40 s VAL 493 Ca 0.37 -1.05 0.03 0.00 -2.93 0.00 0.00 61.98 58.41 2x40 s VAL 493 Cb -0.11 -1.40 -0.00 0.00 -1.53 0.00 0.00 36.38 33.34 2x40 s VAL 493 CO 0.29 0.32 -0.11 -0.63 -3.33 0.00 0.00 175.10 171.64 2x40 s ILE 494 N -0.65 0.92 -0.09 7.04 1.01 0.52 -1.39 121.20 128.56 2x40 s ILE 494 Ca 0.08 -0.46 0.01 0.00 0.00 0.00 0.00 60.65 60.28 2x40 s ILE 494 Cb -0.08 -0.79 -0.02 0.00 0.01 0.00 0.00 42.46 41.58 2x40 s ILE 494 CO 0.01 0.27 -0.13 -0.69 0.00 0.00 0.00 174.94 174.40 2x40 s VAL 495 N -0.05 3.12 -0.21 2.92 1.01 -0.77 0.96 120.40 127.38 2x40 s VAL 495 Ca 0.00 -0.67 -0.05 0.00 0.00 0.00 0.00 61.98 61.26 2x40 s VAL 495 Cb -0.07 -2.27 -0.02 0.00 0.00 0.00 0.00 36.38 34.02 2x40 s VAL 495 CO 0.00 0.56 -0.00 -0.76 0.00 0.00 0.00 175.10 174.90 2x40 s LEU 496 N -0.20 3.19 -0.62 3.92 1.43 0.20 -1.69 118.68 124.91 2x40 s LEU 496 Ca 0.01 -0.25 -0.19 0.00 -1.03 0.00 0.00 54.13 52.67 2x40 s LEU 496 Cb -0.13 -1.81 0.11 0.00 0.03 0.00 0.00 46.19 44.38 2x40 s LEU 496 CO 0.03 0.04 0.73 -0.76 0.23 0.00 0.00 176.35 176.62 2x40 s LEU 497 N 1.15 5.42 -1.19 1.79 1.43 0.01 -1.63 118.68 125.66 2x40 s LEU 497 Ca 0.03 -1.51 -0.04 0.00 -1.03 0.00 0.00 54.13 51.57 2x40 s LEU 497 Cb -0.14 -2.30 0.22 0.00 0.03 0.00 0.00 46.19 43.99 2x40 s LEU 497 CO 0.01 -1.10 2.03 -3.20 0.23 0.00 0.00 176.35 174.32 2x40 n ASN 498 N 6.26 7.26 -4.50 2.29 4.05 -0.34 -1.30 115.26 128.98 2x40 n ASN 498 Ca -0.07 -3.36 -0.25 0.00 0.45 0.00 0.00 54.58 51.36 2x40 n ASN 498 Cb 0.43 -1.30 -0.10 0.00 1.23 0.00 0.00 39.78 40.04 2x40 n ASN 498 CO 0.00 0.00 0.00 0.27 -3.05 0.00 0.00 177.26 174.48 2x40 s ILE 499 N -2.24 2.16 -2.04 -1.44 -4.36 -1.14 -2.02 121.20 110.13 2x40 s ILE 499 Ca 0.44 -2.23 0.17 0.00 -0.26 0.00 0.00 60.65 58.77 2x40 s ILE 499 Cb 0.16 -2.53 0.15 0.00 1.25 0.00 0.00 42.46 41.49 2x40 s ILE 499 CO -0.07 -0.27 1.05 0.61 0.24 0.00 0.00 174.94 176.51 2x40 n GLY 500 N -0.71 0.39 3.54 6.27 0.00 -1.26 -3.51 105.19 109.91 2x40 n GLY 500 Ca -0.05 -0.49 -0.07 0.00 0.00 0.00 0.00 46.02 45.41 2x40 n GLY 500 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2x40 s SER 501 N -1.37 -0.30 0.37 1.61 0.15 -1.26 -3.46 113.70 109.45 2x40 s SER 501 Ca 0.20 -0.04 -0.27 0.00 0.70 0.00 0.00 55.95 56.54 2x40 s SER 501 Cb 0.14 0.35 -0.11 0.00 -1.71 0.00 0.00 66.02 64.69 2x40 s SER 501 CO 0.21 -0.58 1.21 -2.65 1.20 0.00 0.00 173.24 172.63 2x40 n PRO 502 N -0.25 1.86 -4.48 5.44 -0.02 -1.26 -5.02 135.00 131.27 2x40 n PRO 502 Ca -0.07 0.66 -0.23 0.00 -2.02 0.00 0.00 63.50 61.84 2x40 n PRO 502 Cb 0.61 -2.25 -0.10 0.00 -0.02 0.00 0.00 33.50 31.74 2x40 n PRO 502 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 2x40 s VAL 503 N -1.15 1.77 0.36 -1.45 -7.23 -1.26 -4.87 120.40 106.57 2x40 s VAL 503 Ca 0.59 -2.11 -0.28 0.00 -1.81 0.00 0.00 61.98 58.36 2x40 s VAL 503 Cb -0.56 -2.61 -0.11 0.00 0.56 0.00 0.00 36.38 33.67 2x40 s VAL 503 CO 0.60 -0.20 1.44 -0.70 -0.31 0.00 0.00 175.10 175.92 2x40 s GLU 504 N -3.72 4.18 0.00 4.82 -6.30 0.13 -4.89 118.70 112.92 2x40 s GLU 504 Ca 0.32 2.47 0.00 0.00 -2.50 0.00 0.00 54.97 55.26 2x40 s GLU 504 Cb 0.05 -3.00 0.00 0.00 0.00 0.00 0.00 34.13 31.18 2x40 s GLU 504 CO 0.14 -0.44 0.00 0.28 0.02 0.00 0.00 175.26 175.26 2x40 n VAL 505 N 0.57 0.00 -0.22 3.70 0.31 -1.26 -4.77 118.33 116.66 2x40 n VAL 505 Ca 0.01 0.00 -0.05 0.00 -0.01 0.00 0.00 64.34 64.28 2x40 n VAL 505 Cb 0.40 -0.18 0.10 0.00 -0.91 0.00 0.00 33.84 33.25 2x40 n VAL 505 CO 0.00 0.00 0.00 0.58 -1.32 0.00 0.00 176.83 176.09 2x40 h VAL 506 N 0.00 1.25 0.00 2.52 2.07 -1.90 -1.83 116.25 118.36 2x40 h VAL 506 Ca 0.00 -0.89 -0.00 0.00 0.82 0.00 0.00 66.70 66.63 2x40 h VAL 506 Cb 0.21 0.53 -0.00 0.00 -1.52 0.00 0.00 31.29 30.51 2x40 h VAL 506 CO 0.00 0.34 -0.01 0.77 0.02 0.00 0.00 177.57 178.70 2x40 h SER 507 N 1.00 0.00 0.00 0.57 4.64 -1.91 -3.31 113.55 114.54 2x40 h SER 507 Ca 0.22 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.54 2x40 h SER 507 Cb 0.32 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.41 2x40 h SER 507 CO -0.00 0.01 -0.09 -2.67 -0.87 0.00 0.00 176.83 173.20 2x40 n TRP 508 N -3.10 0.00 0.24 4.77 4.27 -1.19 -4.82 117.44 117.62 2x40 n TRP 508 Ca -0.01 0.00 0.09 0.00 -3.89 0.00 0.00 57.50 53.70 2x40 n TRP 508 Cb 0.24 0.00 0.62 0.00 -1.36 0.00 0.00 31.31 30.81 2x40 n TRP 508 CO 0.00 0.00 0.00 0.07 -2.29 0.00 0.00 177.69 175.47 2x40 h ARG 509 N 0.00 0.00 0.00 -2.67 0.11 -1.42 -1.25 114.38 109.15 2x40 h ARG 509 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 2x40 h ARG 509 Cb 0.00 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.08 2x40 h ARG 509 CO 0.00 0.16 0.00 -0.25 0.10 0.00 0.00 179.97 179.98 2x40 n ASP 510 N -3.88 0.00 0.15 0.08 8.00 -1.26 -2.81 116.55 116.82 2x40 n ASP 510 Ca -0.02 0.46 0.08 0.00 0.71 0.00 0.00 54.79 56.02 2x40 n ASP 510 Cb 0.26 -0.48 0.06 0.00 -0.02 0.00 0.00 41.12 40.93 2x40 n ASP 510 CO 0.00 0.00 0.00 -0.07 -0.39 0.00 0.00 177.20 176.74 2x40 h LEU 511 N 0.00 0.00 -9.71 0.64 3.38 -1.57 -3.47 115.31 104.58 2x40 h LEU 511 Ca 0.00 0.00 -0.56 0.00 0.09 0.00 0.00 57.88 57.41 2x40 h LEU 511 Cb 0.37 0.00 -0.09 0.00 0.09 0.00 0.00 40.66 41.04 2x40 h LEU 511 CO 0.00 0.18 -0.58 -0.69 0.09 0.00 0.00 178.44 177.44 2x40 s VAL 512 N -3.16 3.00 -0.19 1.22 1.01 -1.12 -4.84 120.40 116.31 2x40 s VAL 512 Ca 0.03 -1.80 0.15 0.00 0.00 0.00 0.00 61.98 60.36 2x40 s VAL 512 Cb 0.07 -2.91 -0.22 0.00 0.00 0.00 0.00 36.38 33.32 2x40 s VAL 512 CO 0.74 -0.22 0.03 0.47 0.00 0.00 0.00 175.10 176.12 2x40 n ASP 513 N -1.05 0.57 -4.13 3.32 8.00 -0.48 -4.92 116.55 117.84 2x40 n ASP 513 Ca -0.04 -0.01 -0.15 0.00 0.71 0.00 0.00 54.79 55.29 2x40 n ASP 513 Cb 0.61 0.82 -0.11 0.00 -0.02 0.00 0.00 41.12 42.42 2x40 n ASP 513 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 2x40 s GLY 514 N -5.41 0.73 -0.18 0.44 0.00 -0.91 0.69 107.32 102.67 2x40 s GLY 514 Ca -0.12 -0.98 -0.04 0.00 0.00 0.00 0.00 44.72 43.58 2x40 s GLY 514 CO 0.74 -1.03 0.25 -0.42 0.00 0.00 0.00 173.10 172.65 2x40 s ILE 515 N -1.69 -0.39 -0.24 0.90 1.01 0.43 -1.85 121.20 119.37 2x40 s ILE 515 Ca -0.02 0.02 -0.08 0.00 0.00 0.00 0.00 60.65 60.56 2x40 s ILE 515 Cb -0.08 -0.62 -0.04 0.00 0.01 0.00 0.00 42.46 41.74 2x40 s ILE 515 CO 0.01 -0.09 0.10 -0.76 0.00 0.00 0.00 174.94 174.20 2x40 s LEU 516 N 2.38 3.72 -0.63 2.97 1.43 -0.68 -0.43 118.68 127.45 2x40 s LEU 516 Ca 0.06 -0.07 -0.24 0.00 -1.03 0.00 0.00 54.13 52.85 2x40 s LEU 516 Cb -0.15 -2.00 0.05 0.00 0.03 0.00 0.00 46.19 44.13 2x40 s LEU 516 CO -0.11 0.02 1.03 -0.22 0.23 0.00 0.00 176.35 177.30 2x40 s LEU 517 N 1.31 3.99 0.00 1.79 0.20 0.27 -0.81 118.68 125.43 2x40 s LEU 517 Ca 0.06 -0.59 0.23 0.00 0.69 0.00 0.00 54.13 54.52 2x40 s LEU 517 Cb -0.15 -2.64 0.14 0.00 -0.43 0.00 0.00 46.19 43.12 2x40 s LEU 517 CO 0.05 -1.45 1.18 0.52 -0.29 0.00 0.00 176.35 176.37 2x40 n VAL 518 N 6.15 0.00 -0.53 1.68 0.31 -0.42 -0.42 118.33 125.10 2x40 n VAL 518 Ca 0.00 -0.25 0.00 0.00 -0.01 0.00 0.00 64.34 64.09 2x40 n VAL 518 Cb 0.47 1.11 0.00 0.00 -0.91 0.00 0.00 33.84 34.51 2x40 n VAL 518 CO 0.00 0.00 0.00 0.79 -1.32 0.00 0.00 176.83 176.30 2x40 n TRP 519 N -0.07 0.00 -3.68 3.52 7.02 -0.74 -4.10 117.44 119.39 2x40 n TRP 519 Ca 0.10 0.00 -0.29 0.00 -1.02 0.00 0.00 57.50 56.29 2x40 n TRP 519 Cb 0.45 0.01 -0.15 0.00 -2.42 0.00 0.00 31.31 29.20 2x40 n TRP 519 CO 0.00 0.00 0.00 -0.65 -2.02 0.00 0.00 177.69 175.02 2x40 s GLN 520 N 0.00 0.54 -0.16 -0.99 -0.21 -1.23 -2.87 119.66 114.74 2x40 s GLN 520 Ca 0.00 -0.81 0.15 0.00 0.02 0.00 0.00 55.36 54.72 2x40 s GLN 520 Cb 0.00 -1.76 0.72 0.00 1.00 0.00 0.00 33.01 32.96 2x40 s GLN 520 CO 0.00 -0.94 1.61 0.00 -2.12 0.00 0.00 175.29 173.84 2x40 n ALA 521 N 5.00 3.44 -0.35 6.09 0.00 -1.25 -1.89 120.51 131.55 2x40 n ALA 521 Ca -0.04 -1.61 0.00 0.00 0.00 0.00 0.00 53.44 51.78 2x40 n ALA 521 Cb 0.43 -1.08 0.00 0.00 0.00 0.00 0.00 19.45 18.80 2x40 n ALA 521 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2x40 n GLY 522 N 0.82 -0.45 0.28 0.00 0.00 -0.61 -3.52 105.19 101.72 2x40 n GLY 522 Ca 0.25 -1.09 0.13 0.00 0.00 0.00 0.00 46.02 45.31 2x40 n GLY 522 CO 0.00 0.00 0.00 0.06 0.00 0.00 0.00 173.32 173.38 2x40 h GLN 523 N 0.00 0.00 -0.41 1.61 3.07 -1.50 -2.27 115.11 115.61 2x40 h GLN 523 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.74 2x40 h GLN 523 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.56 2x40 h GLN 523 CO 0.00 0.01 0.00 0.39 0.09 0.00 0.00 178.83 179.32 2x40 n GLU 524 N -4.00 2.32 -0.31 0.06 -0.58 -1.26 -0.47 120.64 116.40 2x40 n GLU 524 Ca -0.03 -2.01 -0.08 0.00 -0.42 0.00 0.00 57.16 54.62 2x40 n GLU 524 Cb 0.10 -1.48 -0.07 0.00 -0.57 0.00 0.00 31.44 29.42 2x40 n GLU 524 CO 0.00 0.00 0.00 2.41 -0.48 0.00 0.00 177.13 179.06 2x40 n THR 525 N 1.19 -0.50 -0.30 2.62 -1.04 -0.85 -1.44 114.28 113.95 2x40 n THR 525 Ca 0.19 2.18 0.06 0.00 -2.04 0.00 0.00 64.05 64.44 2x40 n THR 525 Cb 0.52 -2.73 0.21 0.00 -1.82 0.00 0.00 70.33 66.51 2x40 n THR 525 CO 0.00 0.00 0.00 1.23 -0.64 0.00 0.00 175.07 175.66 2x40 h GLY 526 N 0.00 1.39 0.93 3.41 0.00 -0.97 -0.06 103.07 107.78 2x40 h GLY 526 Ca 0.12 -0.30 -0.00 0.00 0.00 0.00 0.00 47.33 47.15 2x40 h GLY 526 CO -0.70 0.04 0.10 3.21 0.00 0.00 0.00 176.54 179.19 2x40 h ARG 527 N 0.73 0.26 -0.45 4.80 3.08 -1.49 -0.92 114.38 120.38 2x40 h ARG 527 Ca 0.45 -0.03 0.03 0.00 0.07 0.00 0.00 59.98 60.49 2x40 h ARG 527 Cb 0.55 -0.05 -0.03 0.00 0.08 0.00 0.00 29.97 30.51 2x40 h ARG 527 CO -0.31 0.27 0.25 0.82 -1.07 0.00 0.00 179.97 179.92 2x40 h ILE 528 N 0.19 1.01 -0.15 2.04 2.04 -0.55 -2.27 117.51 119.83 2x40 h ILE 528 Ca 0.07 -0.17 -0.01 0.00 1.00 0.00 0.00 64.86 65.74 2x40 h ILE 528 Cb 0.08 0.47 -0.01 0.00 -0.74 0.00 0.00 36.82 36.62 2x40 h ILE 528 CO -0.01 0.09 0.05 0.58 0.00 0.00 0.00 178.15 178.87 2x40 h VAL 529 N 0.50 1.16 -0.57 1.67 2.07 -0.79 -1.36 116.25 118.93 2x40 h VAL 529 Ca 0.19 -0.49 0.06 0.00 0.82 0.00 0.00 66.70 67.28 2x40 h VAL 529 Cb 0.05 1.22 -0.05 0.00 -1.52 0.00 0.00 31.29 30.99 2x40 h VAL 529 CO -0.11 0.15 0.28 0.00 0.02 0.00 0.00 177.57 177.91 2x40 h ALA 530 N 0.89 0.74 0.00 1.67 0.00 -1.10 -1.42 119.26 120.03 2x40 h ALA 530 Ca 0.05 0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.95 2x40 h ALA 530 Cb 0.19 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 2x40 h ALA 530 CO -0.00 -0.08 -0.20 -0.44 0.00 0.00 0.00 179.25 178.53 2x40 h ASP 531 N 0.52 0.00 -0.03 0.00 3.45 -1.11 -2.32 116.42 116.93 2x40 h ASP 531 Ca 0.26 0.00 -0.22 0.00 0.43 0.00 0.00 57.03 57.50 2x40 h ASP 531 Cb 0.21 0.00 0.02 0.00 -0.56 0.00 0.00 39.33 38.99 2x40 h ASP 531 CO -0.20 0.20 -0.84 0.58 -1.57 0.00 0.00 179.24 177.41 2x40 h VAL 532 N 0.00 1.32 -0.56 -1.35 2.07 -0.41 0.31 116.25 117.63 2x40 h VAL 532 Ca -0.00 -2.12 0.05 0.00 0.82 0.00 0.00 66.70 65.44 2x40 h VAL 532 Cb 0.53 2.36 -0.05 0.00 -1.52 0.00 0.00 31.29 32.61 2x40 h VAL 532 CO 0.03 0.65 0.30 -0.07 0.02 0.00 0.00 177.57 178.50 2x40 h LEU 533 N 0.27 0.45 0.00 2.57 -0.00 -0.93 -2.79 115.31 114.88 2x40 h LEU 533 Ca -0.10 0.03 0.00 0.00 -0.00 0.00 0.00 57.88 57.81 2x40 h LEU 533 Cb 1.51 -0.06 0.00 0.00 -0.00 0.00 0.00 40.66 42.11 2x40 h LEU 533 CO 0.17 0.30 -0.03 0.35 -0.00 0.00 0.00 178.44 179.23 2x40 n THR 534 N -4.84 0.11 -0.48 0.22 -2.24 -0.91 0.24 114.28 106.38 2x40 n THR 534 Ca 0.06 -0.06 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 2x40 n THR 534 Cb 0.14 -0.48 0.00 0.00 -2.10 0.00 0.00 70.33 67.89 2x40 n THR 534 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2x40 n GLY 535 N 1.46 0.87 0.37 3.38 0.00 -1.05 -4.69 105.19 105.53 2x40 n GLY 535 Ca 0.07 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.15 2x40 n GLY 535 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 2x40 h ARG 536 N 3.79 0.96 -5.25 1.61 2.43 -1.53 -3.36 114.38 113.04 2x40 h ARG 536 Ca 0.00 -0.06 -0.61 0.00 -0.81 0.00 0.00 59.98 58.50 2x40 h ARG 536 Cb 0.00 -0.22 -0.14 0.00 -0.42 0.00 0.00 29.97 29.19 2x40 h ARG 536 CO 0.00 0.64 -0.53 0.42 -1.51 0.00 0.00 179.97 178.99 2x40 s ILE 537 N -5.92 5.08 -0.48 1.20 1.01 -0.01 -5.00 121.20 117.09 2x40 s ILE 537 Ca -0.12 0.07 -0.17 0.00 0.00 0.00 0.00 60.65 60.43 2x40 s ILE 537 Cb 0.21 -3.31 0.06 0.00 0.01 0.00 0.00 42.46 39.43 2x40 s ILE 537 CO 0.80 0.44 0.50 0.21 0.00 0.00 0.00 174.94 176.89 2x40 s ASN 538 N 0.46 6.19 0.09 3.58 3.84 -1.26 -4.55 114.94 123.29 2x40 s ASN 538 Ca 0.05 -1.04 -0.36 0.00 0.21 0.00 0.00 52.86 51.72 2x40 s ASN 538 Cb -0.12 -2.24 -0.17 0.00 -0.55 0.00 0.00 41.25 38.17 2x40 s ASN 538 CO -0.00 -0.74 1.24 -2.65 -2.79 0.00 0.00 177.10 172.16 2x40 n PRO 539 N 5.68 0.94 0.00 0.43 -0.02 -1.26 -4.72 135.00 136.05 2x40 n PRO 539 Ca -0.09 0.34 0.00 0.00 -2.02 0.00 0.00 63.50 61.73 2x40 n PRO 539 Cb 0.45 -1.92 0.00 0.00 -0.02 0.00 0.00 33.50 32.01 2x40 n PRO 539 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 2x40 n SER 540 N 2.24 0.40 -4.80 2.55 3.41 -1.26 -4.46 113.62 111.71 2x40 n SER 540 Ca 0.18 -1.13 -0.32 0.00 -0.26 0.00 0.00 58.87 57.33 2x40 n SER 540 Cb 0.18 0.00 0.03 0.00 -0.26 0.00 0.00 64.21 64.16 2x40 n SER 540 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2x40 s GLY 541 N -0.13 2.05 0.01 5.00 0.00 -1.08 -4.58 107.32 108.58 2x40 s GLY 541 Ca 0.00 0.38 -0.03 0.00 0.00 0.00 0.00 44.72 45.07 2x40 s GLY 541 CO 0.00 0.71 0.05 0.54 0.00 0.00 0.00 173.10 174.39 2x40 s LYS 542 N -4.24 0.36 0.19 2.90 1.02 -0.07 -4.42 119.74 115.48 2x40 s LYS 542 Ca 0.63 -0.47 -0.33 0.00 0.02 0.00 0.00 55.97 55.83 2x40 s LYS 542 Cb -0.17 0.14 -0.13 0.00 -0.52 0.00 0.00 37.83 37.16 2x40 s LYS 542 CO 0.41 -0.07 1.68 1.28 -0.92 0.00 0.00 175.35 177.73 2x40 n LEU 543 N 1.65 3.72 -0.59 3.17 4.77 -0.17 -4.36 117.00 125.19 2x40 n LEU 543 Ca -0.23 1.07 0.13 0.00 -0.03 0.00 0.00 56.01 56.96 2x40 n LEU 543 Cb 0.56 -1.53 0.42 0.00 -2.33 0.00 0.00 43.42 40.53 2x40 n LEU 543 CO 0.21 0.04 0.80 -0.81 -1.33 0.00 0.00 177.39 176.30 2x40 n PRO 544 N 3.79 1.80 -3.79 3.23 -0.04 -1.26 0.21 135.00 138.95 2x40 n PRO 544 Ca 0.16 -1.18 -0.12 0.00 -0.04 0.00 0.00 63.50 62.31 2x40 n PRO 544 Cb 0.33 -1.48 -0.09 0.00 -0.04 0.00 0.00 33.50 32.23 2x40 n PRO 544 CO 0.00 0.00 0.00 0.99 -0.04 0.00 0.00 175.50 176.45 2x40 s THR 545 N -2.01 0.07 0.10 0.52 2.01 -1.26 -2.36 115.64 112.71 2x40 s THR 545 Ca 0.35 -0.59 -0.30 0.00 0.31 0.00 0.00 61.69 61.47 2x40 s THR 545 Cb 0.21 -0.65 -0.06 0.00 0.01 0.00 0.00 72.50 72.01 2x40 s THR 545 CO 0.33 -0.32 0.98 -0.89 -0.69 0.00 0.00 174.62 174.03 2x40 s THR 546 N -1.63 4.46 -0.44 -0.82 2.01 -1.26 -4.40 115.64 113.56 2x40 s THR 546 Ca -0.12 2.01 -0.19 0.00 0.31 0.00 0.00 61.69 63.70 2x40 s THR 546 Cb -0.05 -4.29 0.03 0.00 0.01 0.00 0.00 72.50 68.21 2x40 s THR 546 CO 0.02 0.29 0.55 -0.36 -0.69 0.00 0.00 174.62 174.43 2x40 s PHE 547 N 0.11 3.11 0.46 4.92 0.40 -0.13 -4.92 117.98 121.92 2x40 s PHE 547 Ca 0.48 -0.29 -0.22 0.00 -0.60 0.00 0.00 56.93 56.31 2x40 s PHE 547 Cb -0.24 -3.18 -0.08 0.00 0.51 0.00 0.00 43.02 40.03 2x40 s PHE 547 CO 0.30 -0.82 1.07 -1.25 0.70 0.00 0.00 175.22 175.22 2x40 s PRO 548 N 2.47 3.87 0.23 0.24 0.05 -1.26 0.63 135.00 141.23 2x40 s PRO 548 Ca 0.17 1.49 -0.08 0.00 0.05 0.00 0.00 61.00 62.62 2x40 s PRO 548 Cb -0.16 -2.28 0.20 0.00 0.05 0.00 0.00 34.50 32.31 2x40 s PRO 548 CO 0.15 -0.39 1.87 0.00 0.05 0.00 0.00 177.00 178.68 2x40 h ARG 549 N 1.90 1.18 -3.74 4.56 3.08 -1.84 -3.39 114.38 116.12 2x40 h ARG 549 Ca -0.49 -0.11 -0.11 0.00 0.07 0.00 0.00 59.98 59.34 2x40 h ARG 549 Cb 1.23 -0.24 -0.17 0.00 0.08 0.00 0.00 29.97 30.87 2x40 h ARG 549 CO 0.60 0.83 -0.46 0.34 -1.07 0.00 0.00 179.97 180.22 2x40 s ASP 550 N -6.11 0.13 0.50 7.04 -1.08 -1.26 -4.59 116.67 111.31 2x40 s ASP 550 Ca -0.13 -0.53 0.18 0.00 -0.52 0.00 0.00 52.55 51.56 2x40 s ASP 550 Cb 0.16 0.27 1.25 0.00 -1.46 0.00 0.00 42.92 43.14 2x40 s ASP 550 CO 0.81 -0.58 2.09 0.22 0.52 0.00 0.00 175.17 178.24 2x40 h TYR 551 N 3.37 0.00 0.00 -5.34 3.20 -1.99 -1.48 116.97 114.74 2x40 h TYR 551 Ca -0.33 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.54 2x40 h TYR 551 Cb 1.19 0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.46 2x40 h TYR 551 CO 0.50 0.08 0.00 -1.13 -1.64 0.00 0.00 178.16 175.98 2x40 n SER 552 N -4.28 0.05 0.18 -2.11 3.41 -1.26 -2.20 113.62 107.41 2x40 n SER 552 Ca -0.03 0.51 0.12 0.00 -0.26 0.00 0.00 58.87 59.21 2x40 n SER 552 Cb 0.16 -0.52 0.12 0.00 -0.26 0.00 0.00 64.21 63.71 2x40 n SER 552 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 2x40 h ASP 553 N 0.00 0.00 -3.54 4.04 5.19 -1.69 -3.46 116.42 116.97 2x40 h ASP 553 Ca 0.00 0.00 -0.52 0.00 -0.62 0.00 0.00 57.03 55.89 2x40 h ASP 553 Cb 0.22 0.00 0.03 0.00 0.18 0.00 0.00 39.33 39.76 2x40 h ASP 553 CO 0.00 0.01 0.61 0.68 -3.12 0.00 0.00 179.24 177.43 2x40 s VAL 554 N -3.25 3.21 0.26 -1.35 -7.23 -0.94 -4.93 120.40 106.19 2x40 s VAL 554 Ca 0.05 1.06 0.17 0.00 -1.81 0.00 0.00 61.98 61.45 2x40 s VAL 554 Cb 0.06 -3.68 0.12 0.00 0.56 0.00 0.00 36.38 33.44 2x40 s VAL 554 CO 0.71 0.19 1.78 1.55 -0.31 0.00 0.00 175.10 179.01 2x40 h PRO 555 N 4.82 0.00 -2.53 4.82 0.13 -1.90 -3.32 132.00 134.02 2x40 h PRO 555 Ca -0.46 0.00 -0.53 0.00 -0.87 0.00 0.00 66.00 64.14 2x40 h PRO 555 Cb 1.22 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.29 2x40 h PRO 555 CO 0.73 0.38 1.99 -1.13 -0.23 0.00 0.00 178.00 179.74 2x40 n SER 556 N -3.72 7.39 0.32 1.44 3.41 -1.26 -4.52 113.62 116.67 2x40 n SER 556 Ca -0.01 -2.74 0.21 0.00 -0.26 0.00 0.00 58.87 56.07 2x40 n SER 556 Cb 0.47 -1.44 1.05 0.00 -0.26 0.00 0.00 64.21 64.03 2x40 n SER 556 CO 0.00 0.00 0.00 4.11 -0.16 0.00 0.00 175.04 178.99 2x40 h TRP 557 N 4.12 0.00 0.00 7.33 5.08 -1.97 -2.73 115.95 127.78 2x40 h TRP 557 Ca 0.60 0.00 0.00 0.00 1.08 0.00 0.00 58.89 60.57 2x40 h TRP 557 Cb 0.68 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.84 2x40 h TRP 557 CO 1.75 0.01 0.00 1.79 -1.28 0.00 0.00 178.44 180.71 2x40 h THR 558 N 0.00 0.00 -1.63 0.12 1.35 -1.87 -3.45 112.91 107.44 2x40 h THR 558 Ca -0.00 -0.61 -0.69 0.00 -0.55 0.00 0.00 66.41 64.56 2x40 h THR 558 Cb 0.16 1.57 0.06 0.00 -1.73 0.00 0.00 68.15 68.21 2x40 h THR 558 CO 0.00 0.00 0.40 0.33 -0.25 0.00 0.00 175.52 176.00 2x40 n PHE 559 N -2.64 1.41 -1.11 4.73 7.35 -1.03 0.63 117.46 126.80 2x40 n PHE 559 Ca 0.04 0.68 -0.02 0.00 -0.76 0.00 0.00 57.45 57.39 2x40 n PHE 559 Cb 0.42 -2.30 0.28 0.00 0.35 0.00 0.00 39.48 38.22 2x40 n PHE 559 CO 0.00 0.00 0.00 -0.35 -0.76 0.00 0.00 176.76 175.65 2x40 n PRO 560 N 2.37 3.18 0.00 -7.13 -0.04 -1.26 -5.09 135.00 127.03 2x40 n PRO 560 Ca 0.18 -3.05 0.00 0.00 -0.04 0.00 0.00 63.50 60.59 2x40 n PRO 560 Cb 0.18 -2.05 0.00 0.00 -0.04 0.00 0.00 33.50 31.59 2x40 n PRO 560 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2x40 n GLY 561 N -0.43 0.31 3.20 0.55 0.00 0.20 -4.74 105.19 104.29 2x40 n GLY 561 Ca 0.35 -2.30 -0.31 0.00 0.00 0.00 0.00 46.02 43.75 2x40 n GLY 561 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2x40 s GLU 562 N -0.62 2.81 0.51 1.61 2.12 0.58 -2.69 118.70 123.02 2x40 s GLU 562 Ca 0.00 -0.83 -0.18 0.00 0.36 0.00 0.00 54.97 54.32 2x40 s GLU 562 Cb 0.00 -2.17 -0.08 0.00 0.26 0.00 0.00 34.13 32.14 2x40 s GLU 562 CO 0.00 0.19 1.00 -2.14 -0.54 0.00 0.00 175.26 173.77 2x40 s PRO 563 N 0.29 3.88 0.33 4.30 0.02 -1.26 -1.25 135.00 141.32 2x40 s PRO 563 Ca -0.16 1.07 0.06 0.00 0.02 0.00 0.00 61.00 61.99 2x40 s PRO 563 Cb -0.17 -2.12 0.74 0.00 0.02 0.00 0.00 34.50 32.96 2x40 s PRO 563 CO 0.08 -0.33 1.86 -0.22 -0.33 0.00 0.00 177.00 178.05 2x40 h LYS 564 N 1.09 0.76 0.00 5.54 3.64 -1.90 -0.26 116.57 125.45 2x40 h LYS 564 Ca -0.47 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 58.86 2x40 h LYS 564 Cb 1.19 -0.17 0.00 0.00 -0.41 0.00 0.00 32.23 32.84 2x40 h LYS 564 CO 0.60 0.51 -0.31 0.22 -2.27 0.00 0.00 179.45 178.20 2x40 h ASP 565 N 0.79 0.00 -0.64 4.20 3.58 -1.98 -3.39 116.42 118.98 2x40 h ASP 565 Ca 0.47 -0.06 -0.32 0.00 0.42 0.00 0.00 57.03 57.54 2x40 h ASP 565 Cb 0.65 0.00 -0.23 0.00 1.72 0.00 0.00 39.33 41.47 2x40 h ASP 565 CO -0.23 0.03 -0.68 -3.20 -2.88 0.00 0.00 179.24 172.28 2x40 n ASN 566 N -2.48 -1.52 -4.70 2.28 5.15 -0.67 -5.11 115.26 108.21 2x40 n ASN 566 Ca 0.04 -3.37 -0.42 0.00 -0.60 0.00 0.00 54.58 50.23 2x40 n ASN 566 Cb 0.47 1.10 -0.03 0.00 -0.53 0.00 0.00 39.78 40.79 2x40 n ASN 566 CO 0.00 0.00 0.00 -2.84 1.40 0.00 0.00 177.26 175.82 2x40 s PRO 567 N -0.38 4.15 -0.02 1.20 0.02 -0.20 -4.15 135.00 135.62 2x40 s PRO 567 Ca 0.29 2.53 0.19 0.00 0.02 0.00 0.00 61.00 64.04 2x40 s PRO 567 Cb 0.28 -3.40 -0.28 0.00 0.02 0.00 0.00 34.50 31.11 2x40 s PRO 567 CO -0.11 -0.77 0.44 1.04 -0.33 0.00 0.00 177.00 177.27 2x40 n GLN 568 N 5.00 0.60 -3.74 5.54 1.13 -0.38 -4.54 117.38 120.99 2x40 n GLN 568 Ca 0.16 -0.16 -0.10 0.00 -1.94 0.00 0.00 57.00 54.97 2x40 n GLN 568 Cb 0.38 -1.44 -0.06 0.00 0.11 0.00 0.00 30.24 29.23 2x40 n GLN 568 CO 0.00 0.00 0.00 -1.59 -1.44 0.00 0.00 177.06 174.03 2x40 s LYS 569 N -3.26 0.95 -0.16 -1.09 -2.85 -1.11 -1.44 119.74 110.78 2x40 s LYS 569 Ca -0.06 -0.82 -0.05 0.00 -1.00 0.00 0.00 55.97 54.04 2x40 s LYS 569 Cb 0.12 0.41 0.08 0.00 -2.06 0.00 0.00 37.83 36.38 2x40 s LYS 569 CO 0.78 -0.34 0.32 0.54 0.10 0.00 0.00 175.35 176.75 2x40 s VAL 570 N -3.79 -0.51 -0.12 1.79 0.11 -0.51 -0.31 120.40 117.06 2x40 s VAL 570 Ca 0.04 0.21 -0.04 0.00 -2.93 0.00 0.00 61.98 59.25 2x40 s VAL 570 Cb 0.03 -0.55 -0.04 0.00 -1.53 0.00 0.00 36.38 34.29 2x40 s VAL 570 CO -0.11 0.07 0.04 0.68 -3.33 0.00 0.00 175.10 172.46 2x40 s VAL 571 N 2.50 4.66 -1.35 2.04 -7.23 -1.26 -1.41 120.40 118.35 2x40 s VAL 571 Ca 0.01 -0.10 -0.16 0.00 -1.81 0.00 0.00 61.98 59.92 2x40 s VAL 571 Cb -0.12 -3.01 0.07 0.00 0.56 0.00 0.00 36.38 33.87 2x40 s VAL 571 CO -0.11 0.57 1.89 -1.22 -0.31 0.00 0.00 175.10 175.92 2x40 n TYR 572 N 2.51 4.25 -0.18 2.82 4.02 -0.20 -4.76 117.16 125.61 2x40 n TYR 572 Ca -0.18 -2.92 0.03 0.00 -0.01 0.00 0.00 57.90 54.82 2x40 n TYR 572 Cb 0.54 -2.56 0.31 0.00 -0.02 0.00 0.00 39.34 37.61 2x40 n TYR 572 CO 0.00 0.00 0.00 0.93 -1.01 0.00 0.00 176.86 176.78 2x40 h GLU 573 N 6.95 0.83 0.00 -0.72 4.39 -1.92 -1.34 114.58 122.77 2x40 h GLU 573 Ca 0.48 -0.05 0.00 0.00 0.34 0.00 0.00 59.36 60.13 2x40 h GLU 573 Cb 0.78 -0.19 0.00 0.00 -0.10 0.00 0.00 28.75 29.25 2x40 h GLU 573 CO 1.60 0.55 0.00 1.05 -1.16 0.00 0.00 179.01 181.05 2x40 h GLU 574 N 0.86 0.00 0.00 2.33 9.09 -1.86 -3.47 114.58 121.53 2x40 h GLU 574 Ca 0.28 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.69 2x40 h GLU 574 Cb 0.04 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.14 2x40 h GLU 574 CO -0.08 0.00 0.00 -3.47 0.05 0.00 0.00 179.01 175.51 2x40 n ASP 575 N -2.89 0.00 0.13 3.06 -0.08 -0.51 -1.33 116.55 114.94 2x40 n ASP 575 Ca 0.02 0.00 0.12 0.00 -1.51 0.00 0.00 54.79 53.42 2x40 n ASP 575 Cb 0.38 0.00 0.49 0.00 2.34 0.00 0.00 41.12 44.33 2x40 n ASP 575 CO 0.00 0.00 0.00 2.30 0.12 0.00 0.00 177.20 179.62 2x40 n ILE 576 N 0.00 0.82 -2.17 5.18 -5.35 -1.26 -4.05 119.36 112.53 2x40 n ILE 576 Ca 0.00 0.22 -0.42 0.00 -0.27 0.00 0.00 62.75 62.29 2x40 n ILE 576 Cb 0.00 -1.16 0.00 0.00 -1.74 0.00 0.00 39.64 36.74 2x40 n ILE 576 CO 0.00 0.00 0.00 -1.22 -1.76 0.00 0.00 176.55 173.57 2x40 n TYR 577 N -2.25 2.86 -4.82 4.28 4.02 -0.44 -4.81 117.16 115.99 2x40 n TYR 577 Ca 0.02 -2.82 -0.28 0.00 -0.01 0.00 0.00 57.90 54.81 2x40 n TYR 577 Cb 0.23 -1.98 -0.15 0.00 -0.02 0.00 0.00 39.34 37.43 2x40 n TYR 577 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 176.86 176.39 2x40 s VAL 578 N 0.27 1.96 0.00 -0.72 0.11 -1.26 -3.98 120.40 116.78 2x40 s VAL 578 Ca 0.45 -1.31 0.00 0.00 -2.93 0.00 0.00 61.98 58.19 2x40 s VAL 578 Cb 0.12 -1.68 0.00 0.00 -1.53 0.00 0.00 36.38 33.29 2x40 s VAL 578 CO -0.03 0.31 0.00 0.61 -3.33 0.00 0.00 175.10 172.67 2x40 n GLY 579 N 1.83 1.64 0.27 6.54 0.00 -1.26 -3.15 105.19 111.05 2x40 n GLY 579 Ca -0.17 -0.62 0.12 0.00 0.00 0.00 0.00 46.02 45.35 2x40 n GLY 579 CO 0.00 0.00 0.00 0.10 0.00 0.00 0.00 173.32 173.42 2x40 h TYR 580 N 0.00 0.00 -0.96 1.61 -0.00 -1.95 -1.10 116.97 114.57 2x40 h TYR 580 Ca 0.00 0.00 0.17 0.00 -0.00 0.00 0.00 58.73 58.90 2x40 h TYR 580 Cb 0.00 0.00 -0.09 0.00 -0.00 0.00 0.00 36.73 36.64 2x40 h TYR 580 CO 0.00 0.06 0.61 0.00 -0.00 0.00 0.00 178.16 178.82 2x40 h ARG 581 N 0.00 0.72 0.03 0.10 3.08 -1.86 -0.76 114.38 115.69 2x40 h ARG 581 Ca -0.00 -0.04 -0.00 0.00 0.07 0.00 0.00 59.98 60.00 2x40 h ARG 581 Cb 0.12 -0.16 0.00 0.00 0.08 0.00 0.00 29.97 30.01 2x40 h ARG 581 CO 0.01 0.48 -0.01 -0.92 -1.07 0.00 0.00 179.97 178.45 2x40 h TYR 582 N 0.74 -0.04 -0.75 3.04 3.20 -1.33 -2.98 116.97 118.86 2x40 h TYR 582 Ca 0.51 -0.00 -0.05 0.00 3.14 0.00 0.00 58.73 62.33 2x40 h TYR 582 Cb 0.81 0.01 -0.03 0.00 1.54 0.00 0.00 36.73 39.06 2x40 h TYR 582 CO -0.00 0.55 0.28 1.88 -1.64 0.00 0.00 178.16 179.23 2x40 h TYR 583 N -0.67 1.16 -0.06 -3.82 0.05 -1.40 -1.29 116.97 110.93 2x40 h TYR 583 Ca -0.00 -0.09 -0.03 0.00 0.05 0.00 0.00 58.73 58.65 2x40 h TYR 583 Cb 0.61 -0.34 -0.00 0.00 1.01 0.00 0.00 36.73 38.01 2x40 h TYR 583 CO 0.13 0.89 -0.09 -0.44 -1.05 0.00 0.00 178.16 177.61 2x40 h ASP 584 N 1.10 0.19 -0.41 3.88 3.32 -1.29 -1.55 116.42 121.65 2x40 h ASP 584 Ca 0.25 -0.52 -0.05 0.00 0.02 0.00 0.00 57.03 56.73 2x40 h ASP 584 Cb 0.24 -0.05 -0.02 0.00 0.22 0.00 0.00 39.33 39.72 2x40 h ASP 584 CO -0.02 0.67 0.05 0.74 -1.72 0.00 0.00 179.24 178.96 2x40 h THR 585 N -0.29 1.25 -0.59 0.35 2.02 -1.35 -3.21 112.91 111.08 2x40 h THR 585 Ca 0.01 -0.90 0.00 0.00 0.77 0.00 0.00 66.41 66.28 2x40 h THR 585 Cb 0.62 1.04 0.00 0.00 -1.74 0.00 0.00 68.15 68.07 2x40 h THR 585 CO 0.02 0.31 0.00 0.49 0.37 0.00 0.00 175.52 176.71 2x40 n PHE 586 N -4.50 0.95 -2.48 3.16 3.01 -0.50 -4.92 117.46 112.18 2x40 n PHE 586 Ca -0.00 -0.54 -0.14 0.00 1.01 0.00 0.00 57.45 57.77 2x40 n PHE 586 Cb 0.25 -0.07 0.01 0.00 -0.01 0.00 0.00 39.48 39.65 2x40 n PHE 586 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2x40 n GLY 587 N 1.13 -0.15 3.66 1.37 0.00 -0.66 -4.99 105.19 105.54 2x40 n GLY 587 Ca 0.21 -0.26 -0.39 0.00 0.00 0.00 0.00 46.02 45.59 2x40 n GLY 587 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2x40 s VAL 588 N -2.80 5.17 -0.16 1.61 1.01 -0.73 -5.04 120.40 119.45 2x40 s VAL 588 Ca 0.09 0.77 -0.26 0.00 0.00 0.00 0.00 61.98 62.58 2x40 s VAL 588 Cb -0.04 -3.76 -0.01 0.00 0.00 0.00 0.00 36.38 32.56 2x40 s VAL 588 CO 0.11 0.22 0.85 -0.70 0.00 0.00 0.00 175.10 175.58 2x40 s GLU 589 N 1.50 4.31 0.80 2.72 2.12 -1.26 -4.59 118.70 124.31 2x40 s GLU 589 Ca 0.20 1.07 -0.11 0.00 0.36 0.00 0.00 54.97 56.48 2x40 s GLU 589 Cb -0.15 -3.57 0.07 0.00 0.26 0.00 0.00 34.13 30.74 2x40 s GLU 589 CO 0.09 -0.33 1.09 -2.14 -0.54 0.00 0.00 175.26 173.43 2x40 s PRO 590 N 2.13 2.04 -0.01 4.30 0.02 -1.26 -4.44 135.00 137.78 2x40 s PRO 590 Ca 0.40 0.68 -0.25 0.00 0.02 0.00 0.00 61.00 61.84 2x40 s PRO 590 Cb -0.17 -1.91 -0.19 0.00 0.02 0.00 0.00 34.50 32.25 2x40 s PRO 590 CO 0.13 -1.67 1.30 0.00 -0.33 0.00 0.00 177.00 176.43 2x40 h ALA 591 N -1.12 -0.04 -3.52 -1.55 0.00 -0.01 -3.44 119.26 109.58 2x40 h ALA 591 Ca -0.47 -0.21 -0.33 0.00 0.00 0.00 0.00 54.91 53.90 2x40 h ALA 591 Cb 1.27 0.02 -0.34 0.00 0.00 0.00 0.00 17.79 18.74 2x40 h ALA 591 CO 0.58 -0.31 -0.74 0.71 0.00 0.00 0.00 179.25 179.49 2x40 s TYR 592 N -4.45 0.23 0.47 0.00 2.02 -0.77 -4.99 117.35 109.85 2x40 s TYR 592 Ca -0.15 0.03 -0.11 0.00 -0.37 0.00 0.00 57.07 56.47 2x40 s TYR 592 Cb 0.02 -0.35 -0.06 0.00 -0.40 0.00 0.00 41.96 41.18 2x40 s TYR 592 CO 0.65 -0.11 0.85 -1.83 -1.57 0.00 0.00 175.55 173.55 2x40 s GLU 593 N 0.97 3.75 0.14 -0.62 1.03 -1.26 -0.95 118.70 121.75 2x40 s GLU 593 Ca -0.09 0.57 -0.35 0.00 0.03 0.00 0.00 54.97 55.13 2x40 s GLU 593 Cb -0.13 -2.29 -0.16 0.00 -0.80 0.00 0.00 34.13 30.75 2x40 s GLU 593 CO -0.02 -0.19 1.30 0.34 -1.33 0.00 0.00 175.26 175.36 2x40 n PHE 594 N -1.71 1.54 -1.05 4.83 7.35 -1.26 -1.94 117.46 125.22 2x40 n PHE 594 Ca 0.03 0.61 -0.02 0.00 -0.76 0.00 0.00 57.45 57.32 2x40 n PHE 594 Cb 0.54 -2.34 -0.01 0.00 0.35 0.00 0.00 39.48 38.03 2x40 n PHE 594 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 2x40 n GLY 595 N 2.38 0.53 3.83 7.13 0.00 0.13 -2.07 105.19 117.13 2x40 n GLY 595 Ca 0.17 -0.63 -0.37 0.00 0.00 0.00 0.00 46.02 45.19 2x40 n GLY 595 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2x40 s TYR 596 N -2.02 3.71 0.00 1.61 5.04 -0.82 -3.78 117.35 121.09 2x40 s TYR 596 Ca 0.00 1.10 0.00 0.00 -2.44 0.00 0.00 57.07 55.73 2x40 s TYR 596 Cb 0.00 -2.38 0.00 0.00 0.35 0.00 0.00 41.96 39.93 2x40 s TYR 596 CO 0.00 0.54 0.00 0.41 -1.34 0.00 0.00 175.55 175.16 2x40 n GLY 597 N 1.37 1.27 4.01 8.97 0.00 -1.26 -1.00 105.19 118.55 2x40 n GLY 597 Ca -0.09 0.09 -0.20 0.00 0.00 0.00 0.00 46.02 45.82 2x40 n GLY 597 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2x40 s LEU 598 N 0.00 3.20 0.07 0.99 1.43 0.22 -4.96 118.68 119.63 2x40 s LEU 598 Ca 0.00 -0.52 0.00 0.00 -1.03 0.00 0.00 54.13 52.58 2x40 s LEU 598 Cb 0.00 -2.09 -0.04 0.00 0.03 0.00 0.00 46.19 44.09 2x40 s LEU 598 CO 0.00 -1.34 -0.05 -0.55 0.23 0.00 0.00 176.35 174.64 2x40 s SER 599 N -4.59 0.74 0.00 2.29 0.15 -1.26 -4.42 113.70 106.60 2x40 s SER 599 Ca 0.61 -0.94 0.26 0.00 0.70 0.00 0.00 55.95 56.59 2x40 s SER 599 Cb -0.07 0.14 1.38 0.00 -1.71 0.00 0.00 66.02 65.77 2x40 s SER 599 CO 0.39 -0.50 1.89 -1.22 1.20 0.00 0.00 173.24 175.00 2x40 n TYR 600 N 0.25 0.00 -4.44 3.44 4.01 -1.26 -4.81 117.16 114.35 2x40 n TYR 600 Ca -0.15 0.00 -0.23 0.00 -0.16 0.00 0.00 57.90 57.36 2x40 n TYR 600 Cb 0.60 -0.21 -0.08 0.00 -0.31 0.00 0.00 39.34 39.34 2x40 n TYR 600 CO 0.00 0.00 0.00 -0.08 -0.46 0.00 0.00 176.86 176.32 2x40 s THR 601 N -2.41 0.41 0.19 -0.72 -1.32 -1.26 -4.72 115.64 105.80 2x40 s THR 601 Ca 0.29 -2.00 0.10 0.00 -1.21 0.00 0.00 61.69 58.86 2x40 s THR 601 Cb 0.18 -2.39 -0.04 0.00 -1.51 0.00 0.00 72.50 68.73 2x40 s THR 601 CO 0.37 0.00 -0.13 0.42 -2.21 0.00 0.00 174.62 173.07 2x40 s THR 602 N -3.31 2.98 0.07 5.08 -4.23 -1.26 -4.95 115.64 110.01 2x40 s THR 602 Ca 0.29 -1.80 0.05 0.00 -1.18 0.00 0.00 61.69 59.04 2x40 s THR 602 Cb 0.03 -2.48 -0.03 0.00 1.34 0.00 0.00 72.50 71.36 2x40 s THR 602 CO 0.18 -0.15 -0.14 -0.36 -0.54 0.00 0.00 174.62 173.62 2x40 s PHE 603 N -1.79 1.16 -0.09 3.99 0.40 -1.26 -0.64 117.98 119.76 2x40 s PHE 603 Ca 0.25 -0.45 0.03 0.00 -0.60 0.00 0.00 56.93 56.15 2x40 s PHE 603 Cb -0.08 -0.66 0.01 0.00 0.51 0.00 0.00 43.02 42.79 2x40 s PHE 603 CO 0.14 0.04 -0.19 -2.00 0.70 0.00 0.00 175.22 173.92 2x40 s GLU 604 N -1.68 2.43 0.13 0.44 2.56 -0.37 -4.86 118.70 117.35 2x40 s GLU 604 Ca -0.02 -0.66 -0.10 0.00 0.00 0.00 0.00 54.97 54.18 2x40 s GLU 604 Cb -0.10 -1.90 -0.06 0.00 2.00 0.00 0.00 34.13 34.07 2x40 s GLU 604 CO 0.02 0.10 0.47 0.71 -0.56 0.00 0.00 175.26 176.00 2x40 s TYR 605 N 0.51 3.55 0.24 5.30 4.12 -1.26 -1.68 117.35 128.13 2x40 s TYR 605 Ca -0.17 0.85 -0.21 0.00 0.02 0.00 0.00 57.07 57.56 2x40 s TYR 605 Cb -0.17 -2.22 0.06 0.00 -1.52 0.00 0.00 41.96 38.11 2x40 s TYR 605 CO 0.06 0.44 0.89 -1.54 0.02 0.00 0.00 175.55 175.42 2x40 s SER 606 N -1.93 -0.11 -1.30 2.29 1.04 0.37 -4.97 113.70 109.10 2x40 s SER 606 Ca 0.38 -0.69 -0.05 0.00 0.48 0.00 0.00 55.95 56.07 2x40 s SER 606 Cb -0.13 0.62 0.01 0.00 0.10 0.00 0.00 66.02 66.62 2x40 s SER 606 CO 0.20 -1.20 1.09 0.47 0.98 0.00 0.00 173.24 174.78 2x40 n ASP 607 N -0.87 -4.43 -4.71 7.02 8.00 -1.26 0.94 116.55 121.23 2x40 n ASP 607 Ca -0.05 -0.59 -0.42 0.00 0.71 0.00 0.00 54.79 54.44 2x40 n ASP 607 Cb 0.60 -5.03 -0.03 0.00 -0.02 0.00 0.00 41.12 36.64 2x40 n ASP 607 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 2x40 s LEU 608 N -6.91 4.37 -0.14 0.64 2.96 -1.26 -4.02 118.68 114.33 2x40 s LEU 608 Ca 0.33 2.45 -0.04 0.00 -0.22 0.00 0.00 54.13 56.66 2x40 s LEU 608 Cb -0.15 -3.59 0.05 0.00 0.50 0.00 0.00 46.19 43.01 2x40 s LEU 608 CO 0.73 -0.74 0.07 0.21 -1.32 0.00 0.00 176.35 175.29 2x40 s ASN 609 N 1.23 2.14 -0.12 3.68 3.84 0.63 -4.99 114.94 121.36 2x40 s ASN 609 Ca 0.68 -0.46 -0.02 0.00 0.21 0.00 0.00 52.86 53.26 2x40 s ASN 609 Cb -0.40 -0.31 -0.03 0.00 -0.55 0.00 0.00 41.25 39.96 2x40 s ASN 609 CO 0.31 -0.31 -0.04 0.68 -2.79 0.00 0.00 177.10 174.95 2x40 s VAL 610 N 2.08 3.93 -0.00 -5.21 -7.23 -1.26 -1.29 120.40 111.41 2x40 s VAL 610 Ca 0.02 -0.37 0.01 0.00 -1.81 0.00 0.00 61.98 59.83 2x40 s VAL 610 Cb -0.15 -2.67 -0.00 0.00 0.56 0.00 0.00 36.38 34.11 2x40 s VAL 610 CO -0.07 0.55 -0.02 -0.94 -0.31 0.00 0.00 175.10 174.30 2x40 s SER 611 N -0.22 0.22 -0.11 4.85 1.04 -0.52 -4.98 113.70 113.98 2x40 s SER 611 Ca 0.04 -0.03 -0.00 0.00 0.48 0.00 0.00 55.95 56.43 2x40 s SER 611 Cb -0.13 -0.03 0.02 0.00 0.10 0.00 0.00 66.02 65.99 2x40 s SER 611 CO 0.02 0.02 -0.09 0.12 0.98 0.00 0.00 173.24 174.30 2x40 s PHE 612 N -0.04 1.58 -2.20 5.02 5.36 -1.26 -0.52 117.98 125.92 2x40 s PHE 612 Ca 0.01 -0.79 0.23 0.00 -0.96 0.00 0.00 56.93 55.41 2x40 s PHE 612 Cb -0.01 -1.27 0.56 0.00 -0.34 0.00 0.00 43.02 41.96 2x40 s PHE 612 CO -0.00 -0.52 1.49 -0.40 -1.46 0.00 0.00 175.22 174.33 2x40 n ASP 613 N 4.83 3.79 0.00 6.13 5.68 -1.06 -4.92 116.55 131.00 2x40 n ASP 613 Ca -0.14 -2.00 0.00 0.00 -0.50 0.00 0.00 54.79 52.15 2x40 n ASP 613 Cb 0.50 -0.40 0.00 0.00 -1.14 0.00 0.00 41.12 40.08 2x40 n ASP 613 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2x40 n GLY 614 N 1.62 0.96 0.00 6.12 0.00 -1.26 -4.79 105.19 107.85 2x40 n GLY 614 Ca 0.23 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.25 2x40 n GLY 614 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2x40 n GLU 615 N -1.92 2.90 -3.93 1.61 4.07 -1.26 -4.90 120.64 117.22 2x40 n GLU 615 Ca 0.00 0.00 -0.16 0.00 -0.06 0.00 0.00 57.16 56.94 2x40 n GLU 615 Cb 0.00 -0.66 -0.16 0.00 -0.06 0.00 0.00 31.44 30.57 2x40 n GLU 615 CO 0.00 0.00 0.00 0.99 -0.06 0.00 0.00 177.13 178.06 2x40 s THR 616 N -0.92 0.15 -0.11 6.31 2.01 -1.26 -1.64 115.64 120.17 2x40 s THR 616 Ca 0.00 0.06 -0.13 0.00 0.31 0.00 0.00 61.69 61.93 2x40 s THR 616 Cb 0.00 -0.22 -0.05 0.00 0.01 0.00 0.00 72.50 72.24 2x40 s THR 616 CO 0.00 0.11 0.30 -0.22 -0.69 0.00 0.00 174.62 174.12 2x40 s LEU 617 N 0.75 4.33 -0.16 4.42 2.96 0.49 -2.57 118.68 128.89 2x40 s LEU 617 Ca -0.07 0.61 0.01 0.00 -0.22 0.00 0.00 54.13 54.46 2x40 s LEU 617 Cb -0.10 -2.37 0.02 0.00 0.50 0.00 0.00 46.19 44.24 2x40 s LEU 617 CO -0.01 0.21 -0.16 -0.60 -1.32 0.00 0.00 176.35 174.46 2x40 s ARG 618 N -0.17 2.55 -0.18 1.98 3.52 0.32 -0.42 118.95 126.55 2x40 s ARG 618 Ca 0.18 -0.67 -0.01 0.00 -0.13 0.00 0.00 55.73 55.09 2x40 s ARG 618 Cb -0.14 -2.30 -0.00 0.00 -1.56 0.00 0.00 34.95 30.95 2x40 s ARG 618 CO 0.06 -0.24 -0.11 0.14 -0.81 0.00 0.00 175.30 174.35 2x40 s VAL 619 N 1.41 2.98 -0.03 7.11 -7.23 -0.01 -1.44 120.40 123.18 2x40 s VAL 619 Ca 0.05 -0.65 0.07 0.00 -1.81 0.00 0.00 61.98 59.63 2x40 s VAL 619 Cb -0.13 -2.30 -0.01 0.00 0.56 0.00 0.00 36.38 34.50 2x40 s VAL 619 CO -0.11 0.48 -0.22 -1.58 -0.31 0.00 0.00 175.10 173.36 2x40 s GLN 620 N 1.04 1.93 0.05 4.82 0.74 -0.41 -0.99 119.66 126.84 2x40 s GLN 620 Ca -0.01 -0.80 -0.27 0.00 0.05 0.00 0.00 55.36 54.34 2x40 s GLN 620 Cb -0.15 -1.80 0.09 0.00 1.10 0.00 0.00 33.01 32.25 2x40 s GLN 620 CO -0.02 0.44 0.75 1.52 -0.55 0.00 0.00 175.29 177.43 2x40 s TYR 621 N -0.41 -0.46 -0.09 1.67 1.13 -0.56 -0.27 117.35 118.36 2x40 s TYR 621 Ca 0.05 0.38 -0.02 0.00 -1.41 0.00 0.00 57.07 56.08 2x40 s TYR 621 Cb -0.10 0.53 -0.03 0.00 -1.10 0.00 0.00 41.96 41.26 2x40 s TYR 621 CO 0.00 -0.67 -0.02 0.50 -2.51 0.00 0.00 175.55 172.85 2x40 s ARG 622 N -3.08 3.02 -0.18 -3.49 3.52 0.27 -0.55 118.95 118.45 2x40 s ARG 622 Ca 0.01 -0.45 0.01 0.00 -0.13 0.00 0.00 55.73 55.17 2x40 s ARG 622 Cb -0.01 -2.77 0.03 0.00 -1.56 0.00 0.00 34.95 30.64 2x40 s ARG 622 CO -0.08 0.64 -0.17 0.42 -0.81 0.00 0.00 175.30 175.29 2x40 s ILE 623 N -0.72 1.95 -0.08 4.11 1.01 -0.54 -0.47 121.20 126.45 2x40 s ILE 623 Ca 0.11 -0.94 0.03 0.00 0.00 0.00 0.00 60.65 59.84 2x40 s ILE 623 Cb -0.12 -1.81 -0.02 0.00 0.01 0.00 0.00 42.46 40.52 2x40 s ILE 623 CO 0.02 0.45 -0.15 -0.70 0.00 0.00 0.00 174.94 174.56 2x40 s GLU 624 N 1.32 2.84 -0.36 2.79 2.12 -0.68 -0.50 118.70 126.23 2x40 s GLU 624 Ca 0.03 -0.72 -0.29 0.00 0.36 0.00 0.00 54.97 54.36 2x40 s GLU 624 Cb -0.14 -2.45 -0.01 0.00 0.26 0.00 0.00 34.13 31.80 2x40 s GLU 624 CO -0.12 0.44 1.62 1.21 -0.54 0.00 0.00 175.26 177.88 2x40 s ASN 625 N -0.26 6.10 0.00 -1.70 3.84 0.55 -1.23 114.94 122.24 2x40 s ASN 625 Ca 0.01 1.11 0.20 0.00 0.21 0.00 0.00 52.86 54.39 2x40 s ASN 625 Cb -0.13 -2.53 0.40 0.00 -0.55 0.00 0.00 41.25 38.44 2x40 s ASN 625 CO 0.03 -1.57 1.34 1.07 -2.79 0.00 0.00 177.10 175.17 2x40 n THR 626 N 7.25 0.61 -2.33 -5.21 5.66 0.19 -0.72 114.28 119.74 2x40 n THR 626 Ca 0.20 -0.81 0.00 0.00 -3.05 0.00 0.00 64.05 60.39 2x40 n THR 626 Cb 0.47 0.85 0.00 0.00 -1.55 0.00 0.00 70.33 70.11 2x40 n THR 626 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2x40 n GLY 627 N 1.26 4.28 0.63 1.09 0.00 -1.14 -4.79 105.19 106.52 2x40 n GLY 627 Ca 0.17 -2.02 0.06 0.00 0.00 0.00 0.00 46.02 44.23 2x40 n GLY 627 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2x40 n GLY 628 N 5.00 2.54 2.91 -0.02 0.00 -1.26 -4.55 105.19 109.81 2x40 n GLY 628 Ca 0.00 -0.38 -0.11 0.00 0.00 0.00 0.00 46.02 45.53 2x40 n GLY 628 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2x40 s ARG 629 N -1.00 0.11 0.42 1.61 0.52 -1.26 -4.90 118.95 114.46 2x40 s ARG 629 Ca 0.23 -0.21 -0.26 0.00 -0.52 0.00 0.00 55.73 54.97 2x40 s ARG 629 Cb 0.12 0.04 -0.09 0.00 0.52 0.00 0.00 34.95 35.54 2x40 s ARG 629 CO 0.16 -0.02 1.39 0.00 0.02 0.00 0.00 175.30 176.85 2x40 s ALA 630 N -0.51 3.30 0.23 2.13 0.00 -1.26 -4.54 121.76 121.11 2x40 s ALA 630 Ca -0.06 1.40 -0.22 0.00 0.00 0.00 0.00 51.96 53.07 2x40 s ALA 630 Cb -0.03 -3.55 0.04 0.00 0.00 0.00 0.00 23.12 19.57 2x40 s ALA 630 CO -0.00 -1.03 0.84 0.20 0.00 0.00 0.00 175.76 175.77 2x40 s GLY 631 N -0.53 -0.12 0.05 0.00 0.00 -0.22 -4.76 107.32 101.74 2x40 s GLY 631 Ca 0.58 -0.15 0.04 0.00 0.00 0.00 0.00 44.72 45.19 2x40 s GLY 631 CO 0.55 0.03 -0.04 0.54 0.00 0.00 0.00 173.10 174.18 2x40 s LYS 632 N -3.48 2.53 -0.14 2.90 1.02 -1.26 -0.45 119.74 120.86 2x40 s LYS 632 Ca 0.12 -0.78 0.02 0.00 0.02 0.00 0.00 55.97 55.35 2x40 s LYS 632 Cb -0.04 -2.52 0.01 0.00 -0.52 0.00 0.00 37.83 34.77 2x40 s LYS 632 CO 0.05 0.57 -0.19 -2.00 -0.92 0.00 0.00 175.35 172.86 2x40 s GLU 633 N -1.85 2.76 -0.16 1.68 2.56 -1.26 -4.77 118.70 117.67 2x40 s GLU 633 Ca 0.21 -0.75 -0.25 0.00 0.00 0.00 0.00 54.97 54.18 2x40 s GLU 633 Cb -0.11 -2.32 -0.02 0.00 2.00 0.00 0.00 34.13 33.68 2x40 s GLU 633 CO 0.12 -0.10 0.81 0.08 -0.56 0.00 0.00 175.26 175.61 2x40 s VAL 634 N 1.05 4.91 0.12 3.70 1.01 -1.26 -1.58 120.40 128.35 2x40 s VAL 634 Ca -0.02 1.59 0.08 0.00 0.00 0.00 0.00 61.98 63.63 2x40 s VAL 634 Cb -0.14 -4.12 -0.04 0.00 0.00 0.00 0.00 36.38 32.08 2x40 s VAL 634 CO -0.06 0.06 -0.14 -0.94 0.00 0.00 0.00 175.10 174.02 2x40 s SER 635 N 1.12 4.14 -0.05 3.32 1.04 0.32 -4.75 113.70 118.84 2x40 s SER 635 Ca 0.38 -0.50 0.02 0.00 0.48 0.00 0.00 55.95 56.33 2x40 s SER 635 Cb -0.17 -0.68 0.01 0.00 0.10 0.00 0.00 66.02 65.28 2x40 s SER 635 CO 0.13 0.17 -0.10 -1.10 0.98 0.00 0.00 173.24 173.32 2x40 s GLN 636 N -2.28 1.35 -0.32 4.02 -0.21 0.03 -1.95 119.66 120.30 2x40 s GLN 636 Ca 0.20 -0.32 -0.05 0.00 0.02 0.00 0.00 55.36 55.21 2x40 s GLN 636 Cb -0.10 -1.17 0.04 0.00 1.00 0.00 0.00 33.01 32.77 2x40 s GLN 636 CO 0.12 0.02 0.07 0.54 -2.12 0.00 0.00 175.29 173.92 2x40 s VAL 637 N 0.64 3.61 -0.10 1.09 0.11 0.16 0.10 120.40 126.01 2x40 s VAL 637 Ca -0.12 -1.13 -0.05 0.00 -2.93 0.00 0.00 61.98 57.75 2x40 s VAL 637 Cb -0.14 -3.02 -0.04 0.00 -1.53 0.00 0.00 36.38 31.65 2x40 s VAL 637 CO 0.02 -0.12 0.12 -0.31 -3.33 0.00 0.00 175.10 171.48 2x40 s TYR 638 N 1.38 3.50 -0.17 1.54 1.51 0.79 -1.68 117.35 124.22 2x40 s TYR 638 Ca -0.02 0.43 -0.05 0.00 -1.01 0.00 0.00 57.07 56.43 2x40 s TYR 638 Cb -0.19 -1.89 -0.03 0.00 -0.11 0.00 0.00 41.96 39.74 2x40 s TYR 638 CO 0.02 0.67 -0.00 0.42 -1.11 0.00 0.00 175.55 175.54 2x40 s ILE 639 N -1.04 4.14 -0.44 2.71 -1.09 0.31 -0.18 121.20 125.61 2x40 s ILE 639 Ca 0.16 -0.26 -0.14 0.00 -2.23 0.00 0.00 60.65 58.18 2x40 s ILE 639 Cb -0.12 -2.84 0.06 0.00 -1.58 0.00 0.00 42.46 37.98 2x40 s ILE 639 CO 0.06 0.47 0.33 -0.75 -1.23 0.00 0.00 174.94 173.82 2x40 s LYS 640 N 0.48 2.89 0.51 2.79 2.20 -0.32 -1.13 119.74 127.15 2x40 s LYS 640 Ca -0.01 -1.28 -0.17 0.00 -0.36 0.00 0.00 55.97 54.14 2x40 s LYS 640 Cb -0.14 -3.99 -0.08 0.00 -1.51 0.00 0.00 37.83 32.11 2x40 s LYS 640 CO 0.02 -0.93 0.99 0.00 -0.36 0.00 0.00 175.35 175.07 2x40 s ALA 641 N 1.60 3.02 0.78 3.13 0.00 -1.26 -1.38 121.76 127.64 2x40 s ALA 641 Ca 0.04 0.24 -0.13 0.00 0.00 0.00 0.00 51.96 52.11 2x40 s ALA 641 Cb -0.23 -3.14 0.06 0.00 0.00 0.00 0.00 23.12 19.82 2x40 s ALA 641 CO 0.06 -0.26 1.14 -1.25 0.00 0.00 0.00 175.76 175.46 2x40 s PRO 642 N -3.95 2.00 0.12 0.00 0.04 -1.24 -4.95 135.00 127.01 2x40 s PRO 642 Ca 0.60 1.49 -0.17 0.00 0.04 0.00 0.00 61.00 62.95 2x40 s PRO 642 Cb -0.11 -1.84 -0.04 0.00 0.04 0.00 0.00 34.50 32.55 2x40 s PRO 642 CO 0.30 -1.89 1.67 0.87 0.04 0.00 0.00 177.00 177.98 2x40 h LYS 643 N -0.86 0.48 0.00 4.56 1.79 -1.92 -3.45 116.57 117.17 2x40 h LYS 643 Ca -0.45 -0.08 0.00 0.00 -2.18 0.00 0.00 60.65 57.93 2x40 h LYS 643 Cb 1.26 -0.08 0.00 0.00 -1.58 0.00 0.00 32.23 31.83 2x40 h LYS 643 CO 0.49 0.47 0.00 0.41 -1.08 0.00 0.00 179.45 179.74 2x40 n GLY 644 N -0.76 2.94 0.11 3.86 0.00 -1.26 -3.50 105.19 106.58 2x40 n GLY 644 Ca -0.02 0.23 -0.22 0.00 0.00 0.00 0.00 46.02 46.01 2x40 n GLY 644 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2x40 n LYS 645 N 14.00 0.60 -4.43 1.61 4.76 -1.26 -4.99 118.16 128.45 2x40 n LYS 645 Ca 0.00 0.52 -0.26 0.00 -2.87 0.00 0.00 58.31 55.70 2x40 n LYS 645 Cb 0.00 -1.74 -0.11 0.00 -1.84 0.00 0.00 35.03 31.34 2x40 n LYS 645 CO 0.00 0.00 0.00 -1.50 -1.37 0.00 0.00 177.40 174.53 2x40 s ILE 646 N -2.40 2.36 0.36 -0.18 2.07 -1.23 -5.11 121.20 117.09 2x40 s ILE 646 Ca -0.28 -2.12 -0.28 0.00 -1.41 0.00 0.00 60.65 56.56 2x40 s ILE 646 Cb 0.06 -2.16 -0.10 0.00 0.13 0.00 0.00 42.46 40.39 2x40 s ILE 646 CO 0.62 -0.19 1.41 1.51 -1.91 0.00 0.00 174.94 176.37 2x40 s ASP 647 N -2.87 6.48 0.03 4.50 -4.77 -1.26 -4.89 116.67 113.89 2x40 s ASP 647 Ca 0.23 2.89 -0.02 0.00 -3.30 0.00 0.00 52.55 52.35 2x40 s ASP 647 Cb -0.07 -2.66 -0.02 0.00 -1.09 0.00 0.00 42.92 39.08 2x40 s ASP 647 CO 0.11 -0.76 0.01 -0.54 0.70 0.00 0.00 175.17 174.69 2x40 s LYS 648 N -2.01 0.47 0.92 2.11 1.02 -1.26 -5.09 119.74 115.90 2x40 s LYS 648 Ca 0.52 -0.79 -0.11 0.00 0.02 0.00 0.00 55.97 55.61 2x40 s LYS 648 Cb -0.43 0.17 0.11 0.00 -0.52 0.00 0.00 37.83 37.15 2x40 s LYS 648 CO 0.58 -0.09 0.91 -2.30 -0.92 0.00 0.00 175.35 173.53 2x40 n PRO 649 N 1.00 -0.35 -0.17 -1.68 -0.02 -1.26 -4.89 135.00 127.64 2x40 n PRO 649 Ca -0.20 -0.04 -0.02 0.00 -2.02 0.00 0.00 63.50 61.22 2x40 n PRO 649 Cb 0.57 -2.21 0.05 0.00 -0.02 0.00 0.00 33.50 31.90 2x40 n PRO 649 CO 0.00 0.00 0.00 0.35 1.98 0.00 0.00 175.50 177.83 2x40 h PHE 650 N -1.69 -0.17 -3.51 6.00 3.57 -1.88 -3.45 116.94 115.80 2x40 h PHE 650 Ca -0.43 0.04 -0.04 0.00 3.53 0.00 0.00 57.97 61.07 2x40 h PHE 650 Cb 1.28 0.15 -0.10 0.00 2.79 0.00 0.00 35.95 40.07 2x40 h PHE 650 CO 0.46 -0.18 -0.07 1.14 -2.23 0.00 0.00 178.31 177.42 2x40 s GLN 651 N -6.20 1.42 -0.03 1.11 -2.07 -1.26 -4.55 119.66 108.08 2x40 s GLN 651 Ca -0.14 -1.07 -0.01 0.00 -1.82 0.00 0.00 55.36 52.33 2x40 s GLN 651 Cb 0.17 0.48 0.02 0.00 -1.09 0.00 0.00 33.01 32.59 2x40 s GLN 651 CO 0.72 -0.59 0.05 -1.21 -1.32 0.00 0.00 175.29 172.95 2x40 s GLU 652 N -3.94 0.01 0.05 9.60 2.02 -0.29 -4.82 118.70 121.33 2x40 s GLU 652 Ca 0.15 0.18 -0.30 0.00 0.02 0.00 0.00 54.97 55.02 2x40 s GLU 652 Cb -0.00 -0.15 -0.08 0.00 0.10 0.00 0.00 34.13 34.00 2x40 s GLU 652 CO 0.02 -0.12 1.63 -1.17 0.02 0.00 0.00 175.26 175.65 2x40 s LEU 653 N 0.77 4.36 -0.00 1.80 2.96 -1.26 -0.53 118.68 126.77 2x40 s LEU 653 Ca -0.06 2.42 0.00 0.00 -0.22 0.00 0.00 54.13 56.27 2x40 s LEU 653 Cb -0.09 -3.56 -0.00 0.00 0.50 0.00 0.00 46.19 43.04 2x40 s LEU 653 CO -0.03 -0.88 0.00 0.29 -1.32 0.00 0.00 176.35 174.42 2x40 n LYS 654 N 5.81 1.59 -3.66 1.98 4.76 -0.67 -4.77 118.16 123.20 2x40 n LYS 654 Ca 0.16 -0.00 -0.10 0.00 -2.87 0.00 0.00 58.31 55.50 2x40 n LYS 654 Cb 0.41 -1.00 -0.04 0.00 -1.84 0.00 0.00 35.03 32.56 2x40 n LYS 654 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2x40 s ALA 655 N -2.01 -1.07 0.29 7.82 0.00 -1.12 -5.00 121.76 120.67 2x40 s ALA 655 Ca -0.00 -0.05 -0.19 0.00 0.00 0.00 0.00 51.96 51.72 2x40 s ALA 655 Cb 0.00 0.82 0.02 0.00 0.00 0.00 0.00 23.12 23.96 2x40 s ALA 655 CO 0.01 -0.77 0.69 -0.59 0.00 0.00 0.00 175.76 175.10 2x40 s PHE 656 N -3.83 -0.08 -0.18 0.00 -0.71 -1.26 -0.67 117.98 111.25 2x40 s PHE 656 Ca 0.06 -0.39 -0.28 0.00 -1.04 0.00 0.00 56.93 55.28 2x40 s PHE 656 Cb -0.00 0.64 0.10 0.00 -1.21 0.00 0.00 43.02 42.54 2x40 s PHE 656 CO -0.07 -1.23 0.86 -1.58 -1.34 0.00 0.00 175.22 171.86 2x40 s HIS 657 N -3.79 -0.57 -0.12 3.49 2.46 -0.82 -5.01 115.29 110.93 2x40 s HIS 657 Ca 0.13 1.17 0.01 0.00 0.47 0.00 0.00 55.06 56.84 2x40 s HIS 657 Cb -0.05 0.38 0.02 0.00 -0.13 0.00 0.00 32.58 32.80 2x40 s HIS 657 CO 0.08 -0.40 -0.12 0.21 -2.47 0.00 0.00 174.74 172.03 2x40 s LYS 658 N -0.51 2.03 0.87 2.88 2.20 -1.26 -0.52 119.74 125.43 2x40 s LYS 658 Ca -0.03 -0.46 -0.11 0.00 -0.36 0.00 0.00 55.97 55.01 2x40 s LYS 658 Cb -0.02 -1.87 0.12 0.00 -1.51 0.00 0.00 37.83 34.54 2x40 s LYS 658 CO 0.02 -0.19 1.10 -0.08 -0.36 0.00 0.00 175.35 175.84 2x40 s THR 659 N 1.39 2.71 1.26 3.43 -1.32 -0.61 -4.95 115.64 117.54 2x40 s THR 659 Ca 0.01 0.23 -0.20 0.00 -1.21 0.00 0.00 61.69 60.52 2x40 s THR 659 Cb -0.13 -2.54 0.31 0.00 -1.51 0.00 0.00 72.50 68.62 2x40 s THR 659 CO -0.07 -0.30 1.06 0.00 -2.21 0.00 0.00 174.62 173.10 2x40 s ARG 660 N -4.80 -1.69 -0.53 7.08 1.70 -1.26 -4.47 118.95 114.98 2x40 s ARG 660 Ca 0.64 -0.00 -0.27 0.00 -0.47 0.00 0.00 55.73 55.62 2x40 s ARG 660 Cb -0.20 -1.54 -0.01 0.00 -0.57 0.00 0.00 34.95 32.64 2x40 s ARG 660 CO 0.57 -4.04 1.65 -1.17 -1.08 0.00 0.00 175.30 171.24 2x40 s LEU 661 N -7.19 3.39 -0.19 -1.89 2.96 -1.26 -4.43 118.68 110.06 2x40 s LEU 661 Ca 0.70 0.53 -0.15 0.00 -0.22 0.00 0.00 54.13 54.99 2x40 s LEU 661 Cb -0.11 -2.98 -0.04 0.00 0.50 0.00 0.00 46.19 43.56 2x40 s LEU 661 CO 0.57 -1.94 0.37 -0.76 -1.32 0.00 0.00 176.35 173.27 2x40 s LEU 662 N 7.27 4.17 0.69 -0.68 1.43 0.40 -4.83 118.68 127.13 2x40 s LEU 662 Ca 0.63 0.50 -0.11 0.00 -1.03 0.00 0.00 54.13 54.13 2x40 s LEU 662 Cb -0.14 -2.47 0.00 0.00 0.03 0.00 0.00 46.19 43.61 2x40 s LEU 662 CO 0.25 -0.04 1.06 0.20 0.23 0.00 0.00 176.35 178.05 2x40 s ASN 663 N 0.94 5.49 0.15 2.29 0.01 -1.26 -1.05 114.94 121.50 2x40 s ASN 663 Ca 0.18 1.59 -0.34 0.00 -0.71 0.00 0.00 52.86 53.59 2x40 s ASN 663 Cb -0.14 -2.49 -0.16 0.00 0.41 0.00 0.00 41.25 38.86 2x40 s ASN 663 CO 0.07 -1.37 1.15 -2.65 -1.51 0.00 0.00 177.10 172.79 2x40 n PRO 664 N -3.08 1.01 0.00 -0.60 -0.02 -1.26 -0.80 135.00 130.25 2x40 n PRO 664 Ca 0.07 0.36 0.00 0.00 -2.02 0.00 0.00 63.50 61.91 2x40 n PRO 664 Cb 0.54 -1.85 0.00 0.00 -0.02 0.00 0.00 33.50 32.16 2x40 n PRO 664 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2x40 n GLY 665 N 2.04 3.14 3.77 -1.23 0.00 0.10 -5.01 105.19 107.99 2x40 n GLY 665 Ca 0.16 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.84 2x40 n GLY 665 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2x40 s GLU 666 N -0.27 2.88 0.11 1.61 2.02 0.02 -4.76 118.70 120.30 2x40 s GLU 666 Ca 0.00 1.50 -0.01 0.00 0.02 0.00 0.00 54.97 56.48 2x40 s GLU 666 Cb 0.00 -1.95 -0.04 0.00 0.10 0.00 0.00 34.13 32.24 2x40 s GLU 666 CO 0.00 -1.20 0.04 -1.54 0.02 0.00 0.00 175.26 172.57 2x40 s SER 667 N -2.28 0.35 0.04 -0.19 1.04 -1.26 -0.33 113.70 111.06 2x40 s SER 667 Ca 0.70 -1.15 0.02 0.00 0.48 0.00 0.00 55.95 56.00 2x40 s SER 667 Cb -0.23 0.27 -0.02 0.00 0.10 0.00 0.00 66.02 66.14 2x40 s SER 667 CO 0.38 -0.70 -0.08 -0.70 0.98 0.00 0.00 173.24 173.12 2x40 s GLU 668 N -4.01 0.53 -0.20 4.02 2.12 0.35 -4.96 118.70 116.54 2x40 s GLU 668 Ca 0.20 -0.76 -0.16 0.00 0.36 0.00 0.00 54.97 54.60 2x40 s GLU 668 Cb 0.08 -0.30 -0.04 0.00 0.26 0.00 0.00 34.13 34.13 2x40 s GLU 668 CO -0.01 0.05 0.42 -2.00 -0.54 0.00 0.00 175.26 173.18 2x40 s GLU 669 N -1.59 4.18 -0.22 4.30 2.56 -1.26 -1.47 118.70 125.20 2x40 s GLU 669 Ca -0.10 0.24 -0.05 0.00 0.00 0.00 0.00 54.97 55.07 2x40 s GLU 669 Cb -0.10 -3.54 -0.01 0.00 2.00 0.00 0.00 34.13 32.48 2x40 s GLU 669 CO 0.00 -0.05 -0.02 0.08 -0.56 0.00 0.00 175.26 174.72 2x40 s VAL 670 N 1.33 3.61 -0.19 3.70 1.01 0.28 -4.99 120.40 125.15 2x40 s VAL 670 Ca 0.20 -0.42 0.01 0.00 0.00 0.00 0.00 61.98 61.77 2x40 s VAL 670 Cb -0.15 -2.65 0.04 0.00 0.00 0.00 0.00 36.38 33.62 2x40 s VAL 670 CO 0.08 0.41 -0.10 -0.69 0.00 0.00 0.00 175.10 174.80 2x40 s VAL 671 N 1.41 1.59 -0.04 2.92 1.01 -1.26 -1.49 120.40 124.54 2x40 s VAL 671 Ca 0.05 -0.93 0.05 0.00 0.00 0.00 0.00 61.98 61.15 2x40 s VAL 671 Cb -0.14 -1.65 -0.01 0.00 0.00 0.00 0.00 36.38 34.57 2x40 s VAL 671 CO -0.01 0.21 -0.20 -0.76 0.00 0.00 0.00 175.10 174.34 2x40 s LEU 672 N 1.43 1.98 -0.06 3.92 1.43 -0.16 -4.99 118.68 122.23 2x40 s LEU 672 Ca -0.00 -0.40 0.04 0.00 -1.03 0.00 0.00 54.13 52.74 2x40 s LEU 672 Cb -0.16 -1.09 -0.02 0.00 0.03 0.00 0.00 46.19 44.95 2x40 s LEU 672 CO -0.08 0.20 -0.17 -1.61 0.23 0.00 0.00 176.35 174.91 2x40 s GLU 673 N -0.14 2.59 -0.12 1.70 2.02 -1.26 -0.83 118.70 122.65 2x40 s GLU 673 Ca -0.01 -0.75 0.01 0.00 0.02 0.00 0.00 54.97 54.23 2x40 s GLU 673 Cb -0.11 -2.34 0.02 0.00 0.10 0.00 0.00 34.13 31.80 2x40 s GLU 673 CO 0.02 0.52 -0.12 0.42 0.02 0.00 0.00 175.26 176.12 2x40 s ILE 674 N -0.48 1.29 0.39 -1.63 1.01 0.44 -4.97 121.20 117.25 2x40 s ILE 674 Ca 0.06 -0.48 -0.26 0.00 0.00 0.00 0.00 60.65 59.97 2x40 s ILE 674 Cb -0.12 -1.23 -0.09 0.00 0.01 0.00 0.00 42.46 41.03 2x40 s ILE 674 CO 0.01 0.41 1.20 -2.84 0.00 0.00 0.00 174.94 173.72 2x40 s PRO 675 N 1.38 4.09 0.54 2.79 0.02 -1.26 -0.38 135.00 142.18 2x40 s PRO 675 Ca 0.00 1.92 0.24 0.00 0.02 0.00 0.00 61.00 63.18 2x40 s PRO 675 Cb -0.13 -2.74 1.41 0.00 0.02 0.00 0.00 34.50 33.05 2x40 s PRO 675 CO -0.06 -0.31 2.05 -0.24 -0.33 0.00 0.00 177.00 178.10 2x40 h VAL 676 N 2.44 0.74 0.00 3.83 3.04 -1.66 0.03 116.25 124.67 2x40 h VAL 676 Ca -0.49 0.00 -0.01 0.00 -1.01 0.00 0.00 66.70 65.19 2x40 h VAL 676 Cb 1.23 0.81 -0.00 0.00 -2.01 0.00 0.00 31.29 31.33 2x40 h VAL 676 CO 0.63 0.00 -0.04 -0.09 -1.01 0.00 0.00 177.57 177.06 2x40 h ARG 677 N 0.00 0.00 0.00 4.17 2.43 -1.90 -1.77 114.38 117.30 2x40 h ARG 677 Ca 0.16 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.33 2x40 h ARG 677 Cb 0.68 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.23 2x40 h ARG 677 CO -0.00 0.04 -0.02 -0.25 -1.51 0.00 0.00 179.97 178.23 2x40 n ASP 678 N -3.45 0.08 -0.24 -3.80 10.43 -0.00 -3.05 116.55 116.51 2x40 n ASP 678 Ca -0.02 0.47 0.14 0.00 2.57 0.00 0.00 54.79 57.96 2x40 n ASP 678 Cb 0.16 -0.49 0.71 0.00 1.84 0.00 0.00 41.12 43.35 2x40 n ASP 678 CO 0.00 0.00 0.00 0.18 -1.07 0.00 0.00 177.20 176.31 2x40 n LEU 679 N -1.55 0.76 -4.86 0.64 4.77 -0.67 -4.96 117.00 111.14 2x40 n LEU 679 Ca 0.07 -0.26 -0.31 0.00 -0.03 0.00 0.00 56.01 55.47 2x40 n LEU 679 Cb 0.35 -0.01 -0.00 0.00 -2.33 0.00 0.00 43.42 41.43 2x40 n LEU 679 CO 0.28 0.13 0.71 0.00 -1.33 0.00 0.00 177.39 177.17 2x40 s ALA 680 N -1.99 3.05 0.11 -1.18 0.00 -1.17 -4.77 121.76 115.81 2x40 s ALA 680 Ca 0.42 0.02 0.10 0.00 0.00 0.00 0.00 51.96 52.50 2x40 s ALA 680 Cb 0.21 -3.10 -0.04 0.00 0.00 0.00 0.00 23.12 20.19 2x40 s ALA 680 CO 0.34 -0.58 -0.26 -1.12 0.00 0.00 0.00 175.76 174.14 2x40 s SER 681 N -3.75 3.15 -0.20 0.00 0.01 -0.26 -4.88 113.70 107.76 2x40 s SER 681 Ca 0.57 -0.72 -0.17 0.00 1.31 0.00 0.00 55.95 56.94 2x40 s SER 681 Cb -0.11 -0.21 -0.04 0.00 0.21 0.00 0.00 66.02 65.87 2x40 s SER 681 CO 0.46 0.17 0.44 0.12 0.41 0.00 0.00 173.24 174.83 2x40 s PHE 682 N -1.05 3.37 -1.38 2.43 2.19 -1.26 -0.50 117.98 121.78 2x40 s PHE 682 Ca 0.12 0.66 0.19 0.00 0.33 0.00 0.00 56.93 58.23 2x40 s PHE 682 Cb -0.10 -2.58 0.70 0.00 -1.31 0.00 0.00 43.02 39.73 2x40 s PHE 682 CO 0.05 -0.05 1.60 0.27 1.83 0.00 0.00 175.22 178.92 2x40 n ASN 683 N 4.61 4.52 0.00 6.13 6.94 -0.71 -4.86 115.26 131.88 2x40 n ASN 683 Ca -0.07 -2.33 0.00 0.00 -0.02 0.00 0.00 54.58 52.16 2x40 n ASN 683 Cb 0.51 -0.56 0.00 0.00 -2.36 0.00 0.00 39.78 37.37 2x40 n ASN 683 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 2x40 n GLY 684 N 1.28 2.54 0.58 4.83 0.00 -1.26 -4.78 105.19 108.37 2x40 n GLY 684 Ca 0.25 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.27 2x40 n GLY 684 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2x40 n GLU 685 N -0.60 0.00 -4.19 1.61 4.71 -1.26 -4.95 120.64 115.97 2x40 n GLU 685 Ca 0.00 0.00 -0.16 0.00 -0.01 0.00 0.00 57.16 56.99 2x40 n GLU 685 Cb 0.00 -0.61 -0.11 0.00 -1.01 0.00 0.00 31.44 29.71 2x40 n GLU 685 CO 0.00 0.00 0.00 -1.21 0.09 0.00 0.00 177.13 176.01 2x40 s GLU 686 N -1.80 0.88 0.06 3.49 2.02 -1.26 -4.63 118.70 117.45 2x40 s GLU 686 Ca 0.00 -1.14 -0.30 0.00 0.02 0.00 0.00 54.97 53.55 2x40 s GLU 686 Cb 0.00 -0.66 -0.05 0.00 0.10 0.00 0.00 34.13 33.52 2x40 s GLU 686 CO 0.00 0.12 1.05 -1.58 0.02 0.00 0.00 175.26 174.87 2x40 s TRP 687 N -2.17 3.61 -0.08 1.61 0.52 -0.32 -1.74 118.94 120.37 2x40 s TRP 687 Ca 0.05 1.59 0.02 0.00 0.02 0.00 0.00 56.10 57.79 2x40 s TRP 687 Cb -0.05 -3.21 0.01 0.00 -1.15 0.00 0.00 33.47 29.07 2x40 s TRP 687 CO 0.01 -0.40 -0.14 0.08 0.02 0.00 0.00 176.95 176.52 2x40 s VAL 688 N 0.71 1.33 -0.54 4.03 1.01 0.34 -0.67 120.40 126.60 2x40 s VAL 688 Ca 0.53 -0.58 -0.13 0.00 0.00 0.00 0.00 61.98 61.79 2x40 s VAL 688 Cb -0.25 -1.21 0.13 0.00 0.00 0.00 0.00 36.38 35.06 2x40 s VAL 688 CO 0.29 0.40 0.47 -0.69 0.00 0.00 0.00 175.10 175.57 2x40 s VAL 689 N 0.70 4.87 0.44 2.92 1.01 0.54 -1.10 120.40 129.78 2x40 s VAL 689 Ca -0.13 -1.71 -0.24 0.00 0.00 0.00 0.00 61.98 59.89 2x40 s VAL 689 Cb -0.16 -4.14 -0.08 0.00 0.00 0.00 0.00 36.38 32.01 2x40 s VAL 689 CO 0.03 -0.85 1.20 -1.61 0.00 0.00 0.00 175.10 173.87 2x40 s GLU 690 N 1.36 3.83 0.74 2.72 2.02 -1.26 -1.25 118.70 126.86 2x40 s GLU 690 Ca 0.05 1.88 -0.11 0.00 0.02 0.00 0.00 54.97 56.81 2x40 s GLU 690 Cb -0.27 -2.52 0.03 0.00 0.10 0.00 0.00 34.13 31.47 2x40 s GLU 690 CO 0.01 -0.52 1.08 0.00 0.02 0.00 0.00 175.26 175.84 2x40 s ALA 691 N -1.45 2.45 0.00 5.21 0.00 -1.26 -4.82 121.76 121.89 2x40 s ALA 691 Ca 0.61 0.15 0.00 0.00 0.00 0.00 0.00 51.96 52.72 2x40 s ALA 691 Cb -0.31 -3.22 0.00 0.00 0.00 0.00 0.00 23.12 19.59 2x40 s ALA 691 CO 0.39 -1.51 0.00 0.41 0.00 0.00 0.00 175.76 175.05 2x40 n GLY 692 N -1.64 0.60 3.72 0.00 0.00 -0.36 -4.93 105.19 102.57 2x40 n GLY 692 Ca 0.08 -2.16 -0.39 0.00 0.00 0.00 0.00 46.02 43.56 2x40 n GLY 692 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2x40 s GLU 693 N -0.83 4.38 0.02 1.61 2.12 -1.26 -1.24 118.70 123.49 2x40 s GLU 693 Ca 0.00 0.64 0.05 0.00 0.36 0.00 0.00 54.97 56.02 2x40 s GLU 693 Cb 0.00 -3.44 -0.03 0.00 0.26 0.00 0.00 34.13 30.92 2x40 s GLU 693 CO 0.00 0.13 -0.11 0.71 -0.54 0.00 0.00 175.26 175.45 2x40 s TYR 694 N 0.65 2.75 -0.15 5.30 1.51 0.31 -3.63 117.35 124.09 2x40 s TYR 694 Ca 0.31 -0.13 -0.06 0.00 -1.01 0.00 0.00 57.07 56.18 2x40 s TYR 694 Cb -0.16 -1.55 -0.04 0.00 -0.11 0.00 0.00 41.96 40.10 2x40 s TYR 694 CO 0.14 0.32 0.06 -2.00 -1.11 0.00 0.00 175.55 172.96 2x40 s GLU 695 N -1.41 3.69 -0.22 -0.62 2.12 -0.48 -1.58 118.70 120.20 2x40 s GLU 695 Ca 0.16 -0.32 -0.14 0.00 0.36 0.00 0.00 54.97 55.02 2x40 s GLU 695 Cb -0.11 -3.12 -0.04 0.00 0.26 0.00 0.00 34.13 31.12 2x40 s GLU 695 CO 0.06 0.44 0.33 0.08 -0.54 0.00 0.00 175.26 175.64 2x40 s VAL 696 N -0.12 5.24 -0.32 3.70 1.01 0.26 -1.17 120.40 129.00 2x40 s VAL 696 Ca 0.07 0.55 0.03 0.00 0.00 0.00 0.00 61.98 62.62 2x40 s VAL 696 Cb -0.12 -3.66 0.09 0.00 0.00 0.00 0.00 36.38 32.69 2x40 s VAL 696 CO 0.01 0.26 0.04 -0.13 0.00 0.00 0.00 175.10 175.28 2x40 s ARG 697 N 1.36 1.40 -0.35 2.72 0.52 0.75 -1.76 118.95 123.59 2x40 s ARG 697 Ca 0.15 -1.65 -0.20 0.00 -0.52 0.00 0.00 55.73 53.52 2x40 s ARG 697 Cb -0.15 -2.93 -0.00 0.00 0.52 0.00 0.00 34.95 32.39 2x40 s ARG 697 CO 0.07 -0.90 0.61 0.08 0.02 0.00 0.00 175.30 175.18 2x40 s VAL 698 N 1.07 4.93 0.22 3.52 1.01 -0.04 -0.15 120.40 130.96 2x40 s VAL 698 Ca 0.08 0.58 0.12 0.00 0.00 0.00 0.00 61.98 62.76 2x40 s VAL 698 Cb -0.19 -4.04 -0.05 0.00 0.00 0.00 0.00 36.38 32.11 2x40 s VAL 698 CO -0.11 -0.26 -0.23 -0.83 0.00 0.00 0.00 175.10 173.67 2x40 s GLY 699 N 1.76 1.77 0.12 4.51 0.00 0.28 -0.60 107.32 115.15 2x40 s GLY 699 Ca 0.23 -1.71 0.26 0.00 0.00 0.00 0.00 44.72 43.49 2x40 s GLY 699 CO 0.14 -1.76 1.56 0.00 0.00 0.00 0.00 173.10 173.04 2x40 n ALA 700 N -0.01 2.72 -3.76 3.20 0.00 0.25 -0.79 120.51 122.12 2x40 n ALA 700 Ca -0.10 -0.17 -0.09 0.00 0.00 0.00 0.00 53.44 53.08 2x40 n ALA 700 Cb 0.57 -1.30 0.02 0.00 0.00 0.00 0.00 19.45 18.74 2x40 n ALA 700 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2x40 s SER 701 N -3.99 0.05 0.44 0.00 1.04 -1.22 -4.60 113.70 105.42 2x40 s SER 701 Ca 0.09 -1.15 0.30 0.00 0.48 0.00 0.00 55.95 55.68 2x40 s SER 701 Cb 0.14 0.84 1.44 0.00 0.10 0.00 0.00 66.02 68.55 2x40 s SER 701 CO 0.65 -1.66 1.91 0.77 0.98 0.00 0.00 173.24 175.89 2x40 h SER 702 N 2.01 0.00 -0.00 7.02 4.64 -1.63 -2.94 113.55 122.65 2x40 h SER 702 Ca -0.32 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.00 2x40 h SER 702 Cb 1.25 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.34 2x40 h SER 702 CO 0.40 0.00 -0.11 0.54 -0.87 0.00 0.00 176.83 176.79 2x40 n ARG 703 N -2.64 4.95 -3.40 4.77 1.74 -1.26 -4.80 116.66 116.01 2x40 n ARG 703 Ca -0.00 -0.12 -0.39 0.00 -0.77 0.00 0.00 57.85 56.57 2x40 n ARG 703 Cb 0.17 -0.71 -0.03 0.00 -1.02 0.00 0.00 32.46 30.87 2x40 n ARG 703 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 2x40 n ASN 704 N -0.86 4.99 -4.63 0.55 2.85 -1.11 -5.03 115.26 112.02 2x40 n ASN 704 Ca 0.01 -3.21 -0.42 0.00 -0.11 0.00 0.00 54.58 50.85 2x40 n ASN 704 Cb 0.05 -1.14 -0.04 0.00 1.24 0.00 0.00 39.78 39.89 2x40 n ASN 704 CO 0.00 0.00 0.00 -0.63 -2.11 0.00 0.00 177.26 174.52 2x40 s ILE 705 N -1.82 4.79 -0.12 -1.44 -1.09 -1.26 -0.59 121.20 119.68 2x40 s ILE 705 Ca 0.31 1.46 0.20 0.00 -2.23 0.00 0.00 60.65 60.39 2x40 s ILE 705 Cb -0.02 -4.16 -0.24 0.00 -1.58 0.00 0.00 42.46 36.45 2x40 s ILE 705 CO -0.05 -0.18 0.49 0.29 -1.23 0.00 0.00 174.94 174.26 2x40 n LYS 706 N 6.16 0.66 -3.84 2.79 4.76 0.23 -4.94 118.16 123.99 2x40 n LYS 706 Ca 0.06 -0.03 -0.12 0.00 -2.87 0.00 0.00 58.31 55.34 2x40 n LYS 706 Cb 0.48 -1.61 -0.13 0.00 -1.84 0.00 0.00 35.03 31.93 2x40 n LYS 706 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 2x40 s LEU 707 N -5.13 1.64 -0.02 -0.35 1.43 -0.89 -4.95 118.68 110.40 2x40 s LEU 707 Ca -0.07 0.19 0.02 0.00 -1.03 0.00 0.00 54.13 53.24 2x40 s LEU 707 Cb 0.10 0.31 0.01 0.00 0.03 0.00 0.00 46.19 46.64 2x40 s LEU 707 CO 0.86 -0.03 -0.07 -0.54 0.23 0.00 0.00 176.35 176.79 2x40 s LYS 708 N 0.06 0.80 0.13 1.70 1.02 -1.26 -0.86 119.74 121.33 2x40 s LYS 708 Ca -0.00 -0.23 -0.05 0.00 0.02 0.00 0.00 55.97 55.72 2x40 s LYS 708 Cb -0.01 -0.77 -0.02 0.00 -0.52 0.00 0.00 37.83 36.51 2x40 s LYS 708 CO 0.00 0.07 0.14 0.20 -0.92 0.00 0.00 175.35 174.83 2x40 s GLY 709 N 0.30 0.63 0.26 -3.33 0.00 -0.72 -4.98 107.32 99.47 2x40 s GLY 709 Ca -0.04 -1.13 0.11 0.00 0.00 0.00 0.00 44.72 43.66 2x40 s GLY 709 CO 0.00 -1.11 -0.15 -0.51 0.00 0.00 0.00 173.10 171.33 2x40 s THR 710 N -3.98 2.74 0.20 0.90 -4.23 -1.26 0.92 115.64 110.93 2x40 s THR 710 Ca 0.17 -2.20 -0.07 0.00 -1.18 0.00 0.00 61.69 58.41 2x40 s THR 710 Cb 0.06 -2.42 -0.02 0.00 1.34 0.00 0.00 72.50 71.45 2x40 s THR 710 CO -0.02 -0.34 0.27 0.72 -0.54 0.00 0.00 174.62 174.71 2x40 s PHE 711 N -2.31 0.69 -0.02 3.99 -0.71 -0.61 -4.92 117.98 114.08 2x40 s PHE 711 Ca 0.29 -1.01 0.05 0.00 -1.04 0.00 0.00 56.93 55.22 2x40 s PHE 711 Cb -0.06 -0.19 -0.01 0.00 -1.21 0.00 0.00 43.02 41.55 2x40 s PHE 711 CO 0.16 -0.76 -0.17 0.45 -1.34 0.00 0.00 175.22 173.55 2x40 s SER 712 N -3.06 2.09 -0.28 1.98 0.15 -1.26 -0.53 113.70 112.80 2x40 s SER 712 Ca 0.27 -0.33 -0.11 0.00 0.70 0.00 0.00 55.95 56.48 2x40 s SER 712 Cb 0.04 -0.35 -0.05 0.00 -1.71 0.00 0.00 66.02 63.95 2x40 s SER 712 CO 0.07 0.19 0.20 -0.69 1.20 0.00 0.00 173.24 174.21 2x40 s VAL 713 N -0.26 5.31 -0.08 4.45 1.01 -0.37 -4.96 120.40 125.49 2x40 s VAL 713 Ca 0.03 0.20 -0.25 0.00 0.00 0.00 0.00 61.98 61.95 2x40 s VAL 713 Cb -0.08 -3.54 -0.26 0.00 0.00 0.00 0.00 36.38 32.50 2x40 s VAL 713 CO 0.00 0.25 0.91 1.23 0.00 0.00 0.00 175.10 177.50 2x40 h GLY 714 N 8.30 0.17 -5.31 4.51 0.00 -1.94 -0.96 103.07 107.83 2x40 h GLY 714 Ca -0.35 -0.36 -0.68 0.00 0.00 0.00 0.00 47.33 45.94 2x40 h GLY 714 CO 0.57 0.32 -0.83 -0.54 0.00 0.00 0.00 176.54 176.05 2x40 s GLU 715 N -2.65 3.01 0.66 4.80 2.02 -1.26 -4.81 118.70 120.47 2x40 s GLU 715 Ca -0.16 -0.80 -0.17 0.00 0.02 0.00 0.00 54.97 53.85 2x40 s GLU 715 Cb -0.00 -2.39 -0.02 0.00 0.10 0.00 0.00 34.13 31.82 2x40 s GLU 715 CO 0.75 0.27 0.96 -1.91 0.02 0.00 0.00 175.26 175.35 2x40 n GLU 716 N 3.30 0.70 -4.49 1.61 2.13 -1.26 -4.72 120.64 117.91 2x40 n GLU 716 Ca -0.18 0.29 -0.20 0.00 0.66 0.00 0.00 57.16 57.72 2x40 n GLU 716 Cb 0.53 -2.19 -0.15 0.00 0.27 0.00 0.00 31.44 29.89 2x40 n GLU 716 CO 0.00 0.00 0.00 1.03 -0.41 0.00 0.00 177.13 177.75 2x40 s ARG 717 N -3.05 0.92 0.03 5.31 1.81 -0.38 -4.97 118.95 118.62 2x40 s ARG 717 Ca 0.75 -0.42 0.05 0.00 -1.72 0.00 0.00 55.73 54.39 2x40 s ARG 717 Cb -0.38 -0.89 -0.02 0.00 -0.45 0.00 0.00 34.95 33.21 2x40 s ARG 717 CO 0.48 0.24 -0.14 1.03 -0.68 0.00 0.00 175.30 176.24 2x40 s ARG 718 N -0.31 0.93 -0.19 3.54 0.52 -1.26 -0.34 118.95 121.85 2x40 s ARG 718 Ca 0.04 -0.71 -0.05 0.00 -0.52 0.00 0.00 55.73 54.49 2x40 s ARG 718 Cb -0.05 -0.93 0.07 0.00 0.52 0.00 0.00 34.95 34.56 2x40 s ARG 718 CO -0.00 0.23 0.10 -0.06 0.02 0.00 0.00 175.30 175.59 2x40 s PHE 719 N -0.78 0.17 -0.30 -0.53 0.08 0.15 -4.98 117.98 111.79 2x40 s PHE 719 Ca 0.02 -0.34 -0.16 0.00 0.12 0.00 0.00 56.93 56.57 2x40 s PHE 719 Cb -0.07 -0.69 -0.02 0.00 -0.57 0.00 0.00 43.02 41.66 2x40 s PHE 719 CO 0.01 -0.55 0.43 0.21 -0.10 0.00 0.00 175.22 175.22 2x40 s LYS 720 N 2.15 3.88 0.00 0.44 2.20 -1.26 -1.18 119.74 125.97 2x40 s LYS 720 Ca 0.03 -0.01 0.10 0.00 -0.36 0.00 0.00 55.97 55.73 2x40 s LYS 720 Cb -0.16 -3.71 0.60 0.00 -1.51 0.00 0.00 37.83 33.05 2x40 s LYS 720 CO -0.12 -0.41 1.04 -2.30 -0.36 0.00 0.00 175.35 173.20