#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1up8 s ILE 2 N 0.00 5.03 0.34 -0.61 1.01 -1.26 -5.02 121.20 120.70 1up8 s ILE 2 Ca 0.00 1.16 -0.28 0.00 0.00 0.00 0.00 60.65 61.53 1up8 s ILE 2 Cb 0.00 -3.93 -0.12 0.00 0.01 0.00 0.00 42.46 38.41 1up8 s ILE 2 CO 0.00 0.13 1.20 -2.65 0.00 0.00 0.00 174.94 173.62 1up8 n PRO 3 N 4.96 1.87 -4.11 2.79 -0.02 -1.26 -5.01 135.00 134.24 1up8 n PRO 3 Ca -0.02 0.66 -0.09 0.00 -2.02 0.00 0.00 63.50 62.02 1up8 n PRO 3 Cb 0.50 -2.20 -0.09 0.00 -0.02 0.00 0.00 33.50 31.69 1up8 n PRO 3 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1up8 s ALA 4 N -1.11 0.66 0.74 3.55 0.00 -1.26 -5.16 121.76 119.18 1up8 s ALA 4 Ca 0.57 -1.33 -0.07 0.00 0.00 0.00 0.00 51.96 51.13 1up8 s ALA 4 Cb -0.59 0.82 0.09 0.00 0.00 0.00 0.00 23.12 23.44 1up8 s ALA 4 CO 0.61 -0.51 1.04 -0.51 0.00 0.00 0.00 175.76 176.39 1up8 s ASP 5 N -3.02 4.51 0.07 0.00 1.11 -1.26 -5.15 116.67 112.92 1up8 s ASP 5 Ca 0.21 0.26 0.02 0.00 0.18 0.00 0.00 52.55 53.23 1up8 s ASP 5 Cb 0.07 -0.79 -0.03 0.00 1.07 0.00 0.00 42.92 43.24 1up8 s ASP 5 CO 0.01 -1.79 -0.08 0.54 1.18 0.00 0.00 175.17 175.03 1up8 s ASN 6 N -4.60 1.06 0.41 0.27 4.22 -1.26 -5.16 114.94 109.88 1up8 s ASN 6 Ca 0.63 -0.71 -0.08 0.00 -2.14 0.00 0.00 52.86 50.56 1up8 s ASN 6 Cb -0.09 0.04 -0.05 0.00 1.28 0.00 0.00 41.25 42.43 1up8 s ASN 6 CO 0.45 -0.27 0.75 -0.76 -2.04 0.00 0.00 177.10 175.23 1up8 s LEU 7 N -2.10 3.80 0.00 3.54 1.43 -1.26 -5.12 118.68 118.97 1up8 s LEU 7 Ca -0.02 1.02 0.06 0.00 -1.03 0.00 0.00 54.13 54.16 1up8 s LEU 7 Cb -0.05 -3.92 -0.02 0.00 0.03 0.00 0.00 46.19 42.23 1up8 s LEU 7 CO -0.01 -0.42 0.21 0.00 0.23 0.00 0.00 176.35 176.36 1up8 n GLN 8 N -1.53 0.50 -1.92 1.70 10.64 -1.26 -5.15 117.38 120.36 1up8 n GLN 8 Ca 0.01 -3.49 -0.36 0.00 -1.83 0.00 0.00 57.00 51.33 1up8 n GLN 8 Cb 0.54 2.33 0.04 0.00 -0.86 0.00 0.00 30.24 32.30 1up8 n GLN 8 CO 0.00 0.00 0.00 -1.54 -1.83 0.00 0.00 177.06 173.69 1up8 s SER 9 N -3.49 5.01 0.20 2.61 1.04 -1.26 -4.82 113.70 112.99 1up8 s SER 9 Ca 0.30 2.48 -0.12 0.00 0.48 0.00 0.00 55.95 59.10 1up8 s SER 9 Cb 0.01 -2.61 0.25 0.00 0.10 0.00 0.00 66.02 63.78 1up8 s SER 9 CO 0.21 -1.72 1.69 -0.09 0.98 0.00 0.00 173.24 174.31 1up8 h ARG 10 N 0.81 0.18 -0.62 4.02 9.65 -2.01 -1.18 114.38 125.22 1up8 h ARG 10 Ca -0.51 -0.01 0.10 0.00 -1.10 0.00 0.00 59.98 58.47 1up8 h ARG 10 Cb 1.31 -0.04 -0.08 0.00 -1.39 0.00 0.00 29.97 29.77 1up8 h ARG 10 CO 0.55 0.12 0.21 0.00 2.80 0.00 0.00 179.97 183.64 1up8 h ALA 11 N 1.47 0.80 -0.19 2.80 0.00 -2.00 -0.02 119.26 122.12 1up8 h ALA 11 Ca 0.29 0.10 -0.14 0.00 0.00 0.00 0.00 54.91 55.16 1up8 h ALA 11 Cb 0.44 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 1up8 h ALA 11 CO -0.42 -0.22 -0.46 0.87 0.00 0.00 0.00 179.25 179.01 1up8 h LYS 12 N 0.37 0.49 -0.63 0.00 1.79 -1.72 -1.80 116.57 115.08 1up8 h LYS 12 Ca 0.32 -0.27 -0.08 0.00 -2.18 0.00 0.00 60.65 58.44 1up8 h LYS 12 Cb 0.43 0.02 -0.03 0.00 -1.58 0.00 0.00 32.23 31.07 1up8 h LYS 12 CO -0.34 0.85 0.09 0.00 -1.08 0.00 0.00 179.45 178.97 1up8 h ALA 13 N 1.10 0.98 0.19 3.86 0.00 -0.62 -0.41 119.26 124.36 1up8 h ALA 13 Ca 0.02 -0.26 -0.01 0.00 0.00 0.00 0.00 54.91 54.66 1up8 h ALA 13 Cb 0.96 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.51 1up8 h ALA 13 CO 0.08 0.64 -0.09 1.03 0.00 0.00 0.00 179.25 180.91 1up8 h SER 14 N 0.96 -0.22 -0.45 0.00 0.87 -0.78 -1.62 113.55 112.32 1up8 h SER 14 Ca 0.19 -0.14 0.09 0.00 -1.23 0.00 0.00 61.79 60.70 1up8 h SER 14 Cb 0.43 0.06 -0.10 0.00 -0.44 0.00 0.00 62.40 62.35 1up8 h SER 14 CO 0.01 0.01 -0.27 0.15 -0.53 0.00 0.00 176.83 176.20 1up8 h PHE 15 N -0.44 -0.73 -0.39 2.24 3.57 -1.29 -2.01 116.94 117.88 1up8 h PHE 15 Ca -0.03 0.06 -0.03 0.00 3.53 0.00 0.00 57.97 61.50 1up8 h PHE 15 Cb 0.34 0.39 -0.02 0.00 2.79 0.00 0.00 35.95 39.45 1up8 h PHE 15 CO -0.01 -0.34 0.13 -0.44 -2.23 0.00 0.00 178.31 175.42 1up8 h ASP 16 N -0.18 0.51 -0.19 0.41 3.32 -1.04 -1.39 116.42 117.86 1up8 h ASP 16 Ca 0.20 -0.06 -0.01 0.00 0.02 0.00 0.00 57.03 57.18 1up8 h ASP 16 Cb 0.51 -0.13 -0.01 0.00 0.22 0.00 0.00 39.33 39.92 1up8 h ASP 16 CO -0.56 0.49 0.08 0.74 -1.72 0.00 0.00 179.24 178.27 1up8 h THR 17 N 0.56 1.16 -0.88 0.35 2.02 -0.91 -0.61 112.91 114.60 1up8 h THR 17 Ca 0.14 -0.49 -0.02 0.00 0.77 0.00 0.00 66.41 66.80 1up8 h THR 17 Cb 0.16 1.13 -0.04 0.00 -1.74 0.00 0.00 68.15 67.66 1up8 h THR 17 CO -0.01 0.16 0.47 0.03 0.37 0.00 0.00 175.52 176.54 1up8 h ARG 18 N 0.16 1.24 -0.47 6.66 3.08 -1.04 -2.25 114.38 121.76 1up8 h ARG 18 Ca 0.06 -0.16 -0.09 0.00 0.07 0.00 0.00 59.98 59.87 1up8 h ARG 18 Cb 0.18 -0.24 -0.02 0.00 0.08 0.00 0.00 29.97 29.97 1up8 h ARG 18 CO -0.01 0.92 -0.06 0.28 -1.07 0.00 0.00 179.97 180.03 1up8 h VAL 19 N 1.24 1.27 -0.63 2.04 2.07 -1.18 -2.32 116.25 118.74 1up8 h VAL 19 Ca 0.31 -1.16 -0.01 0.00 0.82 0.00 0.00 66.70 66.66 1up8 h VAL 19 Cb 0.05 1.07 -0.03 0.00 -1.52 0.00 0.00 31.29 30.86 1up8 h VAL 19 CO -0.05 0.40 0.37 0.00 0.02 0.00 0.00 177.57 178.31 1up8 h ALA 20 N 0.90 1.46 -0.27 1.67 0.00 -0.92 -0.37 119.26 121.72 1up8 h ALA 20 Ca 0.13 -0.08 -0.09 0.00 0.00 0.00 0.00 54.91 54.86 1up8 h ALA 20 Cb 0.59 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 1up8 h ALA 20 CO 0.04 0.46 -0.19 0.00 0.00 0.00 0.00 179.25 179.55 1up8 h ALA 21 N 1.53 0.39 -0.94 0.00 0.00 -1.28 -0.17 119.26 118.79 1up8 h ALA 21 Ca 0.23 -0.35 0.11 0.00 0.00 0.00 0.00 54.91 54.89 1up8 h ALA 21 Cb -0.01 -0.09 -0.08 0.00 0.00 0.00 0.00 17.79 17.61 1up8 h ALA 21 CO -0.04 0.33 0.58 0.00 0.00 0.00 0.00 179.25 180.12 1up8 h ALA 22 N 0.72 1.39 -0.23 0.00 0.00 -1.08 -1.04 119.26 119.02 1up8 h ALA 22 Ca 0.05 0.02 -0.19 0.00 0.00 0.00 0.00 54.91 54.80 1up8 h ALA 22 Cb 0.73 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.34 1up8 h ALA 22 CO 0.05 0.20 -0.59 1.49 0.00 0.00 0.00 179.25 180.41 1up8 h GLU 23 N 0.94 0.80 -0.43 0.00 4.57 -0.84 -0.13 114.58 119.50 1up8 h GLU 23 Ca 0.46 -0.56 0.05 0.00 -1.18 0.00 0.00 59.36 58.13 1up8 h GLU 23 Cb 0.42 0.09 -0.05 0.00 -0.16 0.00 0.00 28.75 29.05 1up8 h GLU 23 CO -0.25 1.18 0.16 1.25 -1.18 0.00 0.00 179.01 180.17 1up8 h LEU 24 N 0.55 0.18 -0.54 1.64 6.46 -0.79 -0.04 115.31 122.77 1up8 h LEU 24 Ca -0.01 0.04 -0.02 0.00 -0.12 0.00 0.00 57.88 57.77 1up8 h LEU 24 Cb 1.21 0.02 -0.02 0.00 -0.73 0.00 0.00 40.66 41.13 1up8 h LEU 24 CO 0.13 0.14 0.25 0.00 -0.62 0.00 0.00 178.44 178.34 1up8 h ALA 25 N 1.27 0.70 -0.48 1.25 0.00 -0.97 -2.89 119.26 118.15 1up8 h ALA 25 Ca 0.20 -0.13 0.05 0.00 0.00 0.00 0.00 54.91 55.02 1up8 h ALA 25 Cb 0.17 -0.22 -0.05 0.00 0.00 0.00 0.00 17.79 17.70 1up8 h ALA 25 CO -0.19 0.28 0.21 1.25 0.00 0.00 0.00 179.25 180.80 1up8 h LEU 26 N 0.73 0.28 0.00 0.00 5.85 -0.84 -3.07 115.31 118.28 1up8 h LEU 26 Ca 0.19 0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.94 1up8 h LEU 26 Cb 0.13 -0.01 0.00 0.00 0.37 0.00 0.00 40.66 41.15 1up8 h LEU 26 CO -0.02 0.20 0.00 0.59 -0.34 0.00 0.00 178.44 178.87 1up8 n ASN 27 N -4.93 0.00 0.27 1.25 3.02 -0.04 -1.76 115.26 113.05 1up8 n ASN 27 Ca 0.04 0.30 0.15 0.00 -0.03 0.00 0.00 54.58 55.04 1up8 n ASN 27 Cb 0.15 -0.40 0.69 0.00 -0.61 0.00 0.00 39.78 39.61 1up8 n ASN 27 CO 0.00 0.00 0.00 0.03 -2.62 0.00 0.00 177.26 174.67 1up8 h ARG 28 N 0.00 0.00 0.00 3.52 3.08 -1.44 -3.49 114.38 116.05 1up8 h ARG 28 Ca 0.00 0.00 0.06 0.00 0.07 0.00 0.00 59.98 60.11 1up8 h ARG 28 Cb 0.20 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.23 1up8 h ARG 28 CO 0.00 0.09 -0.08 0.41 -1.07 0.00 0.00 179.97 179.31 1up8 n GLY 29 N -0.21 -1.88 3.18 0.04 0.00 -0.72 -5.00 105.19 100.60 1up8 n GLY 29 Ca -0.00 -1.33 -0.12 0.00 0.00 0.00 0.00 46.02 44.57 1up8 n GLY 29 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1up8 s VAL 30 N -0.62 0.79 0.13 1.61 -7.23 -1.26 -4.99 120.40 108.83 1up8 s VAL 30 Ca 0.00 -1.90 0.08 0.00 -1.81 0.00 0.00 61.98 58.35 1up8 s VAL 30 Cb 0.00 -1.64 -0.04 0.00 0.56 0.00 0.00 36.38 35.26 1up8 s VAL 30 CO 0.00 -0.80 -0.18 0.68 -0.31 0.00 0.00 175.10 174.48 1up8 s VAL 31 N -3.38 1.68 0.55 1.32 -7.23 -0.90 -5.06 120.40 107.38 1up8 s VAL 31 Ca 0.11 -1.74 -0.10 0.00 -1.81 0.00 0.00 61.98 58.44 1up8 s VAL 31 Cb 0.03 -1.67 -0.05 0.00 0.56 0.00 0.00 36.38 35.26 1up8 s VAL 31 CO -0.03 -0.24 0.93 -2.16 -0.31 0.00 0.00 175.10 173.29 1up8 s PRO 32 N -2.44 3.64 -0.09 4.82 0.04 -1.26 -4.51 135.00 135.20 1up8 s PRO 32 Ca 0.11 0.60 -0.01 0.00 0.04 0.00 0.00 61.00 61.74 1up8 s PRO 32 Cb -0.07 -2.20 -0.03 0.00 0.04 0.00 0.00 34.50 32.24 1up8 s PRO 32 CO 0.05 -0.39 -0.03 -1.12 0.04 0.00 0.00 177.00 175.55 1up8 s SER 33 N -3.94 4.94 -0.16 6.66 0.01 -1.26 -4.79 113.70 115.16 1up8 s SER 33 Ca 0.53 0.04 -0.01 0.00 1.31 0.00 0.00 55.95 57.82 1up8 s SER 33 Cb -0.11 -1.38 -0.01 0.00 0.21 0.00 0.00 66.02 64.74 1up8 s SER 33 CO 0.47 0.35 -0.12 -0.36 0.41 0.00 0.00 173.24 173.99 1up8 s PHE 34 N -0.71 2.84 0.70 2.43 0.40 -1.26 -5.09 117.98 117.29 1up8 s PHE 34 Ca 0.11 -0.87 -0.05 0.00 -0.60 0.00 0.00 56.93 55.52 1up8 s PHE 34 Cb -0.11 -1.93 0.08 0.00 0.51 0.00 0.00 43.02 41.56 1up8 s PHE 34 CO 0.02 -0.40 0.99 0.00 0.70 0.00 0.00 175.22 176.53 1up8 s ALA 35 N 0.81 3.33 -2.44 5.36 0.00 -1.26 -2.92 121.76 124.64 1up8 s ALA 35 Ca -0.04 -1.16 0.25 0.00 0.00 0.00 0.00 51.96 51.01 1up8 s ALA 35 Cb -0.15 -2.41 0.90 0.00 0.00 0.00 0.00 23.12 21.46 1up8 s ALA 35 CO 0.01 -1.30 1.65 0.27 0.00 0.00 0.00 175.76 176.38 1up8 n ASN 36 N -2.86 1.66 0.00 0.00 0.23 -1.26 -4.85 115.26 108.19 1up8 n ASN 36 Ca 0.10 -1.60 0.00 0.00 -0.53 0.00 0.00 54.58 52.54 1up8 n ASN 36 Cb 0.60 -0.04 0.00 0.00 -2.08 0.00 0.00 39.78 38.26 1up8 n ASN 36 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1up8 n GLY 37 N 1.17 1.11 0.18 4.83 0.00 -1.26 -4.93 105.19 106.29 1up8 n GLY 37 Ca 0.18 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.23 1up8 n GLY 37 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1up8 h GLU 38 N 3.51 0.00 -0.99 1.61 5.08 -1.97 -2.80 114.58 119.02 1up8 h GLU 38 Ca 0.00 0.00 0.02 0.00 -1.00 0.00 0.00 59.36 58.38 1up8 h GLU 38 Cb 0.00 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.20 1up8 h GLU 38 CO 0.00 0.41 0.65 1.49 -1.00 0.00 0.00 179.01 180.56 1up8 h GLU 39 N 0.00 1.28 0.00 2.33 4.81 -1.93 -2.55 114.58 118.52 1up8 h GLU 39 Ca -0.00 -0.08 0.00 0.00 -0.13 0.00 0.00 59.36 59.15 1up8 h GLU 39 Cb 0.79 -0.29 0.00 0.00 0.63 0.00 0.00 28.75 29.88 1up8 h GLU 39 CO 0.05 0.85 -0.87 1.28 -0.73 0.00 0.00 179.01 179.59 1up8 n LEU 40 N -4.40 0.58 0.27 1.64 4.77 -1.24 -4.45 117.00 114.18 1up8 n LEU 40 Ca 0.12 -0.42 -0.16 0.00 -0.03 0.00 0.00 56.01 55.52 1up8 n LEU 40 Cb 0.03 0.00 -0.08 0.00 -2.33 0.00 0.00 43.42 41.04 1up8 n LEU 40 CO 0.36 0.15 0.71 0.25 -1.33 0.00 0.00 177.39 177.53 1up8 h LEU 41 N 0.00 -0.54 -9.54 2.23 5.85 -1.17 -3.44 115.31 108.70 1up8 h LEU 41 Ca 0.00 0.02 -0.54 0.00 0.84 0.00 0.00 57.88 58.20 1up8 h LEU 41 Cb 0.41 0.14 -0.03 0.00 0.37 0.00 0.00 40.66 41.55 1up8 h LEU 41 CO 0.00 -0.39 0.22 -0.31 -0.34 0.00 0.00 178.44 177.62 1up8 s TYR 42 N -6.08 3.75 0.21 1.25 4.12 -1.18 -5.03 117.35 114.40 1up8 s TYR 42 Ca -0.16 1.57 0.10 0.00 0.02 0.00 0.00 57.07 58.60 1up8 s TYR 42 Cb 0.04 -2.89 -0.04 0.00 -1.52 0.00 0.00 41.96 37.54 1up8 s TYR 42 CO 0.63 0.24 -0.17 1.03 0.02 0.00 0.00 175.55 177.31 1up8 s ARG 43 N 0.00 1.79 0.14 -0.62 1.81 -1.26 -1.70 118.95 119.10 1up8 s ARG 43 Ca 0.41 -1.47 -0.35 0.00 -1.72 0.00 0.00 55.73 52.61 1up8 s ARG 43 Cb -0.21 -1.97 -0.15 0.00 -0.45 0.00 0.00 34.95 32.17 1up8 s ARG 43 CO 0.25 0.40 1.44 -1.71 -0.68 0.00 0.00 175.30 175.00 1up8 n ASN 44 N -0.05 2.38 0.00 0.23 2.85 -0.07 -4.41 115.26 116.19 1up8 n ASN 44 Ca -0.10 1.11 0.13 0.00 -0.11 0.00 0.00 54.58 55.61 1up8 n ASN 44 Cb 0.57 -1.32 0.60 0.00 1.24 0.00 0.00 39.78 40.87 1up8 n ASN 44 CO 0.00 0.00 0.00 -0.81 -2.11 0.00 0.00 177.26 174.34 1up8 n PRO 45 N 2.85 0.03 -1.78 1.20 -0.04 -1.26 -4.85 135.00 131.14 1up8 n PRO 45 Ca 0.17 0.03 -0.42 0.00 -0.04 0.00 0.00 63.50 63.24 1up8 n PRO 45 Cb 0.25 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 32.18 1up8 n PRO 45 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1up8 s ASP 46 N -2.97 6.42 0.60 3.54 1.11 -1.26 -4.99 116.67 119.13 1up8 s ASP 46 Ca 0.14 2.83 -0.19 0.00 0.18 0.00 0.00 52.55 55.52 1up8 s ASP 46 Cb 0.18 -2.61 -0.03 0.00 1.07 0.00 0.00 42.92 41.54 1up8 s ASP 46 CO 0.50 -0.93 1.25 -2.84 1.18 0.00 0.00 175.17 174.33 1up8 s PRO 47 N 0.85 2.86 -1.02 8.23 0.02 -1.26 -3.54 135.00 141.14 1up8 s PRO 47 Ca 0.72 1.96 -0.05 0.00 0.02 0.00 0.00 61.00 63.64 1up8 s PRO 47 Cb -0.48 -1.95 0.01 0.00 0.02 0.00 0.00 34.50 32.10 1up8 s PRO 47 CO 0.35 -1.33 0.65 -3.47 -0.33 0.00 0.00 177.00 172.87 1up8 n ASP 48 N -1.61 -4.96 -3.81 2.53 -0.08 -1.26 -5.04 116.55 102.33 1up8 n ASP 48 Ca 0.14 -0.30 -0.13 0.00 -1.51 0.00 0.00 54.79 52.99 1up8 n ASP 48 Cb 0.48 -3.67 -0.14 0.00 2.34 0.00 0.00 41.12 40.13 1up8 n ASP 48 CO 0.00 0.00 0.00 0.21 0.12 0.00 0.00 177.20 177.53 1up8 s ASN 49 N -3.03 -0.05 -0.36 1.67 3.84 -1.23 -5.07 114.94 110.70 1up8 s ASN 49 Ca 0.32 0.15 0.06 0.00 0.21 0.00 0.00 52.86 53.60 1up8 s ASN 49 Cb -0.14 0.10 0.44 0.00 -0.55 0.00 0.00 41.25 41.10 1up8 s ASN 49 CO 0.40 -0.07 1.15 0.35 -2.79 0.00 0.00 177.10 176.14 1up8 n THR 50 N 3.56 2.44 -4.83 -5.21 -2.24 -1.26 -4.95 114.28 101.79 1up8 n THR 50 Ca -0.19 -4.56 -0.32 0.00 -2.27 0.00 0.00 64.05 56.72 1up8 n THR 50 Cb 0.56 -1.19 -0.13 0.00 -2.10 0.00 0.00 70.33 67.47 1up8 n THR 50 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1up8 s ASP 51 N -3.57 3.80 0.66 3.42 1.01 -1.26 -5.07 116.67 115.67 1up8 s ASP 51 Ca 0.49 -0.34 -0.17 0.00 0.71 0.00 0.00 52.55 53.24 1up8 s ASP 51 Cb 0.41 -0.67 0.00 0.00 1.01 0.00 0.00 42.92 43.66 1up8 s ASP 51 CO -0.07 0.30 1.24 -2.84 0.21 0.00 0.00 175.17 174.01 1up8 s PRO 52 N -1.06 2.50 0.15 8.23 0.02 -1.26 -0.89 135.00 142.69 1up8 s PRO 52 Ca 0.13 1.91 0.21 0.00 0.02 0.00 0.00 61.00 63.27 1up8 s PRO 52 Cb -0.10 -1.86 -0.06 0.00 0.02 0.00 0.00 34.50 32.49 1up8 s PRO 52 CO 0.03 -1.59 0.93 -1.13 -0.33 0.00 0.00 177.00 174.91 1up8 n SER 53 N -2.11 0.77 -1.52 2.53 3.41 -0.69 -4.35 113.62 111.66 1up8 n SER 53 Ca 0.15 0.30 -0.16 0.00 -0.26 0.00 0.00 58.87 58.90 1up8 n SER 53 Cb 0.49 0.54 -0.06 0.00 -0.26 0.00 0.00 64.21 64.91 1up8 n SER 53 CO 0.00 0.00 0.00 0.49 -0.16 0.00 0.00 175.04 175.37 1up8 n PHE 54 N -2.68 -0.32 0.30 7.33 3.01 -1.26 -4.51 117.46 119.33 1up8 n PHE 54 Ca -0.03 0.00 0.16 0.00 1.01 0.00 0.00 57.45 58.59 1up8 n PHE 54 Cb 0.62 -2.90 0.92 0.00 -0.01 0.00 0.00 39.48 38.11 1up8 n PHE 54 CO 0.00 0.00 0.00 -0.84 1.01 0.00 0.00 176.76 176.93 1up8 h ILE 55 N 0.00 0.47 -0.60 4.37 3.07 -1.92 -2.20 117.51 120.69 1up8 h ILE 55 Ca -0.33 -0.11 0.00 0.00 1.55 0.00 0.00 64.86 65.97 1up8 h ILE 55 Cb 1.04 1.07 0.00 0.00 -0.27 0.00 0.00 36.82 38.67 1up8 h ILE 55 CO 0.47 0.02 0.00 0.00 -1.05 0.00 0.00 178.15 177.59 1up8 n ALA 56 N -2.28 2.40 -2.88 0.16 0.00 -1.26 -4.93 120.51 111.72 1up8 n ALA 56 Ca -0.03 -1.15 -0.29 0.00 0.00 0.00 0.00 53.44 51.97 1up8 n ALA 56 Cb 0.11 -0.92 -0.05 0.00 0.00 0.00 0.00 19.45 18.59 1up8 n ALA 56 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1up8 s SER 57 N -1.17 6.07 -0.11 0.00 0.01 -0.83 -2.90 113.70 114.77 1up8 s SER 57 Ca 0.45 0.14 -0.29 0.00 1.31 0.00 0.00 55.95 57.56 1up8 s SER 57 Cb 0.24 -1.78 -0.06 0.00 0.21 0.00 0.00 66.02 64.63 1up8 s SER 57 CO 0.32 0.14 1.89 0.12 0.41 0.00 0.00 173.24 176.12 1up8 s PHE 58 N -1.55 1.56 -0.01 2.43 5.36 0.10 -4.46 117.98 121.41 1up8 s PHE 58 Ca 0.33 0.14 0.02 0.00 -0.96 0.00 0.00 56.93 56.46 1up8 s PHE 58 Cb -0.12 -4.06 0.02 0.00 -0.34 0.00 0.00 43.02 38.53 1up8 s PHE 58 CO 0.26 -4.27 0.85 0.25 -1.46 0.00 0.00 175.22 170.84 1up8 n THR 59 N 6.32 0.69 -1.62 0.12 -2.24 -1.26 -4.98 114.28 111.30 1up8 n THR 59 Ca 0.22 -0.72 -0.54 0.00 -2.27 0.00 0.00 64.05 60.74 1up8 n THR 59 Cb 0.43 0.60 -0.06 0.00 -2.10 0.00 0.00 70.33 69.20 1up8 n THR 59 CO 0.00 0.00 0.00 1.17 -0.57 0.00 0.00 175.07 175.67 1up8 n LYS 60 N -0.39 1.15 0.00 -0.78 4.81 -1.26 -1.14 118.16 120.55 1up8 n LYS 60 Ca 0.01 0.42 0.00 0.00 -0.87 0.00 0.00 58.31 57.87 1up8 n LYS 60 Cb 0.39 -2.07 0.00 0.00 0.02 0.00 0.00 35.03 33.37 1up8 n LYS 60 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1up8 n GLY 61 N 2.99 2.41 3.78 3.14 0.00 0.60 -4.95 105.19 113.16 1up8 n GLY 61 Ca 0.21 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.85 1up8 n GLY 61 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1up8 s LEU 62 N 0.00 4.44 0.08 0.99 1.43 -0.29 -0.48 118.68 124.84 1up8 s LEU 62 Ca 0.00 1.73 -0.31 0.00 -1.03 0.00 0.00 54.13 54.53 1up8 s LEU 62 Cb 0.00 -3.73 -0.08 0.00 0.03 0.00 0.00 46.19 42.40 1up8 s LEU 62 CO 0.00 0.04 1.62 -2.16 0.23 0.00 0.00 176.35 176.08 1up8 s PRO 63 N -1.73 4.21 0.19 1.29 0.04 -1.26 -4.61 135.00 133.13 1up8 s PRO 63 Ca 0.45 2.30 0.06 0.00 0.04 0.00 0.00 61.00 63.85 1up8 s PRO 63 Cb -0.20 -3.53 -0.04 0.00 0.04 0.00 0.00 34.50 30.77 1up8 s PRO 63 CO 0.25 -0.70 0.13 -1.01 0.04 0.00 0.00 177.00 175.71 1up8 s HIS 64 N 2.40 3.08 0.00 0.56 3.76 -1.26 -2.30 115.29 121.52 1up8 s HIS 64 Ca 0.72 -0.06 0.00 0.00 -0.15 0.00 0.00 55.06 55.57 1up8 s HIS 64 Cb -0.40 -1.45 0.00 0.00 1.11 0.00 0.00 32.58 31.84 1up8 s HIS 64 CO 0.32 0.52 0.00 -0.40 -0.85 0.00 0.00 174.74 174.33 1up8 n ASP 65 N -0.54 0.00 0.12 1.40 5.68 0.76 -4.81 116.55 119.15 1up8 n ASP 65 Ca -0.08 -0.75 0.12 0.00 -0.50 0.00 0.00 54.79 53.58 1up8 n ASP 65 Cb 0.56 0.00 0.47 0.00 -1.14 0.00 0.00 41.12 41.00 1up8 n ASP 65 CO 0.00 0.00 0.00 0.47 -1.33 0.00 0.00 177.20 176.34 1up8 n ASP 66 N -2.24 0.66 -0.99 -1.12 8.00 -1.26 -1.80 116.55 117.79 1up8 n ASP 66 Ca 0.00 0.64 0.10 0.00 0.71 0.00 0.00 54.79 56.24 1up8 n ASP 66 Cb 0.00 -0.79 0.17 0.00 -0.02 0.00 0.00 41.12 40.49 1up8 n ASP 66 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1up8 n ASN 67 N -2.20 3.17 -0.01 -2.24 5.03 -1.26 -4.98 115.26 112.78 1up8 n ASN 67 Ca 0.03 -1.92 -0.00 0.00 0.87 0.00 0.00 54.58 53.55 1up8 n ASN 67 Cb 0.27 -0.19 -0.00 0.00 -1.02 0.00 0.00 39.78 38.84 1up8 n ASN 67 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1up8 n GLY 68 N 1.26 0.47 3.87 7.41 0.00 -0.75 -4.86 105.19 112.60 1up8 n GLY 68 Ca 0.16 -0.31 -0.33 0.00 0.00 0.00 0.00 46.02 45.55 1up8 n GLY 68 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1up8 s ALA 69 N -1.99 3.65 0.40 4.61 0.00 -1.26 -4.82 121.76 122.35 1up8 s ALA 69 Ca 0.00 -0.34 -0.25 0.00 0.00 0.00 0.00 51.96 51.36 1up8 s ALA 69 Cb 0.00 -2.34 -0.08 0.00 0.00 0.00 0.00 23.12 20.69 1up8 s ALA 69 CO 0.00 0.55 1.16 0.96 0.00 0.00 0.00 175.76 178.44 1up8 s ILE 70 N -1.65 3.18 -0.00 0.00 -4.36 -1.26 -0.17 121.20 116.93 1up8 s ILE 70 Ca 0.42 0.99 -0.23 0.00 -0.26 0.00 0.00 60.65 61.57 1up8 s ILE 70 Cb -0.12 -3.55 -0.19 0.00 1.25 0.00 0.00 42.46 39.85 1up8 s ILE 70 CO 0.21 0.09 1.22 0.40 0.24 0.00 0.00 174.94 177.10 1up8 h ILE 71 N 2.33 1.42 -3.76 8.37 2.04 -1.77 -3.44 117.51 122.70 1up8 h ILE 71 Ca -0.49 -1.47 -0.65 0.00 1.00 0.00 0.00 64.86 63.26 1up8 h ILE 71 Cb 1.23 2.23 -0.38 0.00 -0.74 0.00 0.00 36.82 39.17 1up8 h ILE 71 CO 0.62 0.41 -0.79 -0.62 0.00 0.00 0.00 178.15 177.78 1up8 s ASP 72 N -6.08 4.24 0.58 1.72 -1.08 -1.26 -5.01 116.67 109.79 1up8 s ASP 72 Ca -0.15 -1.38 0.28 0.00 -0.52 0.00 0.00 52.55 50.78 1up8 s ASP 72 Cb 0.03 -1.40 1.69 0.00 -1.46 0.00 0.00 42.92 41.77 1up8 s ASP 72 CO 0.73 -0.23 2.16 1.55 0.52 0.00 0.00 175.17 179.90 1up8 h PRO 73 N 7.83 0.00 0.00 4.34 0.13 -1.91 -0.96 132.00 141.43 1up8 h PRO 73 Ca -0.17 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.93 1up8 h PRO 73 Cb 1.05 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.18 1up8 h PRO 73 CO 0.45 0.00 -0.10 -0.44 -0.23 0.00 0.00 178.00 177.67 1up8 h ASP 74 N 0.00 0.00 -0.46 1.44 3.32 -1.98 -2.16 116.42 116.58 1up8 h ASP 74 Ca 0.05 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.10 1up8 h ASP 74 Cb 0.30 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.83 1up8 h ASP 74 CO -0.00 0.10 0.27 0.44 -1.72 0.00 0.00 179.24 178.33 1up8 h ASP 75 N 0.00 0.56 -0.20 6.45 3.32 -1.60 0.10 116.42 125.05 1up8 h ASP 75 Ca -0.00 -0.07 -0.08 0.00 0.02 0.00 0.00 57.03 56.90 1up8 h ASP 75 Cb 0.20 -0.14 -0.00 0.00 0.22 0.00 0.00 39.33 39.60 1up8 h ASP 75 CO 0.01 0.46 -0.18 0.15 -1.72 0.00 0.00 179.24 177.96 1up8 h PHE 76 N 0.61 0.56 -0.77 4.55 3.57 -1.59 -2.61 116.94 121.26 1up8 h PHE 76 Ca 0.16 -0.17 0.02 0.00 3.53 0.00 0.00 57.97 61.52 1up8 h PHE 76 Cb 0.01 -0.12 -0.04 0.00 2.79 0.00 0.00 35.95 38.59 1up8 h PHE 76 CO -0.03 0.82 0.51 -0.07 -2.23 0.00 0.00 178.31 177.31 1up8 h LEU 77 N 0.14 0.85 -0.67 0.59 3.38 -1.32 -0.40 115.31 117.88 1up8 h LEU 77 Ca 0.03 -0.02 -0.10 0.00 0.09 0.00 0.00 57.88 57.88 1up8 h LEU 77 Cb 0.72 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.25 1up8 h LEU 77 CO 0.05 0.60 -0.10 0.00 0.09 0.00 0.00 178.44 179.08 1up8 h ALA 78 N 1.54 0.87 -0.49 1.53 0.00 -1.02 -2.25 119.26 119.44 1up8 h ALA 78 Ca 0.30 -0.33 -0.00 0.00 0.00 0.00 0.00 54.91 54.87 1up8 h ALA 78 Cb -0.03 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.55 1up8 h ALA 78 CO -0.08 0.65 0.30 0.35 0.00 0.00 0.00 179.25 180.47 1up8 h PHE 79 N 0.84 0.64 -0.50 0.00 3.57 -0.86 -0.94 116.94 119.70 1up8 h PHE 79 Ca 0.14 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.64 1up8 h PHE 79 Cb 0.63 -0.21 -0.02 0.00 2.79 0.00 0.00 35.95 39.13 1up8 h PHE 79 CO 0.04 0.44 0.32 0.28 -2.23 0.00 0.00 178.31 177.16 1up8 h VAL 80 N 0.65 1.13 -0.60 1.41 2.07 -1.05 -0.79 116.25 119.08 1up8 h VAL 80 Ca 0.18 -0.25 0.03 0.00 0.82 0.00 0.00 66.70 67.47 1up8 h VAL 80 Cb -0.02 0.41 -0.04 0.00 -1.52 0.00 0.00 31.29 30.12 1up8 h VAL 80 CO -0.03 0.13 0.37 0.03 0.02 0.00 0.00 177.57 178.08 1up8 h ARG 81 N 0.67 0.70 -0.72 1.57 3.08 -1.04 -2.50 114.38 116.15 1up8 h ARG 81 Ca 0.18 -0.04 -0.05 0.00 0.07 0.00 0.00 59.98 60.14 1up8 h ARG 81 Cb -0.07 -0.16 -0.03 0.00 0.08 0.00 0.00 29.97 29.79 1up8 h ARG 81 CO -0.04 0.46 0.26 0.00 -1.07 0.00 0.00 179.97 179.59 1up8 h ALA 82 N 1.26 0.94 -0.45 0.04 0.00 -0.80 -2.26 119.26 117.98 1up8 h ALA 82 Ca 0.24 -0.20 0.06 0.00 0.00 0.00 0.00 54.91 55.00 1up8 h ALA 82 Cb 0.01 -0.28 -0.05 0.00 0.00 0.00 0.00 17.79 17.48 1up8 h ALA 82 CO -0.10 0.58 0.16 0.82 0.00 0.00 0.00 179.25 180.72 1up8 h ILE 83 N 1.04 0.87 0.00 0.00 2.04 -0.93 -0.07 117.51 120.46 1up8 h ILE 83 Ca 0.24 -0.12 0.00 0.00 1.00 0.00 0.00 64.86 65.98 1up8 h ILE 83 Cb 0.25 0.50 0.00 0.00 -0.74 0.00 0.00 36.82 36.83 1up8 h ILE 83 CO -0.01 0.06 0.00 0.59 0.00 0.00 0.00 178.15 178.79 1up8 n ASN 84 N -5.00 0.80 -0.13 1.72 3.02 -0.96 -4.00 115.26 110.71 1up8 n ASN 84 Ca 0.04 0.60 -0.22 0.00 -0.03 0.00 0.00 54.58 54.96 1up8 n ASN 84 Cb 0.17 -0.80 -0.11 0.00 -0.61 0.00 0.00 39.78 38.42 1up8 n ASN 84 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 1up8 n SER 85 N -2.27 1.97 0.00 6.41 3.41 -0.87 -5.00 113.62 117.27 1up8 n SER 85 Ca 0.05 0.01 0.00 0.00 -0.26 0.00 0.00 58.87 58.67 1up8 n SER 85 Cb 0.39 -0.54 0.00 0.00 -0.26 0.00 0.00 64.21 63.80 1up8 n SER 85 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1up8 n GLY 86 N 1.94 2.98 3.66 5.00 0.00 -0.06 -5.00 105.19 113.70 1up8 n GLY 86 Ca -0.49 0.00 -0.52 0.00 0.00 0.00 0.00 46.02 45.01 1up8 n GLY 86 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1up8 n ASP 87 N 0.00 2.41 -0.18 1.61 2.03 -1.26 -4.91 116.55 116.24 1up8 n ASP 87 Ca 0.00 1.07 -0.06 0.00 0.52 0.00 0.00 54.79 56.32 1up8 n ASP 87 Cb 0.00 -1.24 0.03 0.00 -0.72 0.00 0.00 41.12 39.19 1up8 n ASP 87 CO 0.00 0.00 0.00 -0.33 -1.92 0.00 0.00 177.20 174.95 1up8 h GLU 88 N 6.43 0.68 -0.27 -0.67 3.07 -1.98 -2.21 114.58 119.64 1up8 h GLU 88 Ca -0.47 -0.04 -0.00 0.00 -0.50 0.00 0.00 59.36 58.35 1up8 h GLU 88 Cb 1.31 -0.15 -0.01 0.00 -0.84 0.00 0.00 28.75 29.05 1up8 h GLU 88 CO 0.88 0.45 0.15 -0.22 -1.40 0.00 0.00 179.01 178.88 1up8 h LYS 89 N 0.70 0.37 -0.99 2.33 1.63 -1.99 -0.93 116.57 117.69 1up8 h LYS 89 Ca 0.20 -0.04 0.13 0.00 -0.85 0.00 0.00 60.65 60.10 1up8 h LYS 89 Cb -0.05 -0.07 -0.09 0.00 -0.60 0.00 0.00 32.23 31.42 1up8 h LYS 89 CO -0.06 0.31 0.62 1.49 -3.45 0.00 0.00 179.45 178.36 1up8 h GLU 90 N 0.33 0.91 -0.36 1.90 4.81 -1.90 -0.30 114.58 119.97 1up8 h GLU 90 Ca 0.10 -0.05 -0.05 0.00 -0.13 0.00 0.00 59.36 59.22 1up8 h GLU 90 Cb 0.05 -0.20 -0.01 0.00 0.63 0.00 0.00 28.75 29.21 1up8 h GLU 90 CO -0.02 0.60 0.03 0.82 -0.73 0.00 0.00 179.01 179.71 1up8 h ILE 91 N 0.94 1.25 0.00 2.32 2.04 -1.05 -2.90 117.51 120.11 1up8 h ILE 91 Ca 0.51 -0.91 -0.01 0.00 1.00 0.00 0.00 64.86 65.45 1up8 h ILE 91 Cb 0.57 1.15 -0.00 0.00 -0.74 0.00 0.00 36.82 37.79 1up8 h ILE 91 CO -0.29 0.31 -0.02 0.00 0.00 0.00 0.00 178.15 178.14 1up8 h ALA 92 N 0.88 1.44 0.00 1.87 0.00 -0.03 -2.63 119.26 120.80 1up8 h ALA 92 Ca 0.10 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.99 1up8 h ALA 92 Cb 0.41 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.20 1up8 h ALA 92 CO 0.01 0.03 -0.07 -0.25 0.00 0.00 0.00 179.25 178.97 1up8 n ASP 93 N -3.75 0.15 -4.70 0.00 8.00 -0.24 -4.89 116.55 111.13 1up8 n ASP 93 Ca -0.03 0.41 -0.30 0.00 0.71 0.00 0.00 54.79 55.58 1up8 n ASP 93 Cb 0.11 -0.42 0.14 0.00 -0.02 0.00 0.00 41.12 40.93 1up8 n ASP 93 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1up8 s LEU 94 N -3.17 2.46 -0.29 0.64 1.02 -0.99 -5.01 118.68 113.34 1up8 s LEU 94 Ca 0.13 1.73 -0.18 0.00 0.02 0.00 0.00 54.13 55.83 1up8 s LEU 94 Cb 0.18 -4.17 -0.02 0.00 0.02 0.00 0.00 46.19 42.20 1up8 s LEU 94 CO 0.56 -2.71 0.50 -0.89 0.02 0.00 0.00 176.35 173.83 1up8 s THR 95 N -2.82 5.06 -0.15 5.49 2.01 -1.26 -5.06 115.64 118.91 1up8 s THR 95 Ca 0.64 0.71 0.01 0.00 0.31 0.00 0.00 61.69 63.36 1up8 s THR 95 Cb -0.19 -3.85 0.02 0.00 0.01 0.00 0.00 72.50 68.48 1up8 s THR 95 CO 0.58 0.01 -0.18 -0.22 -0.69 0.00 0.00 174.62 174.12 1up8 s LEU 96 N 2.31 1.91 0.00 4.42 2.96 -1.26 -4.59 118.68 124.44 1up8 s LEU 96 Ca 0.20 -0.55 0.00 0.00 -0.22 0.00 0.00 54.13 53.56 1up8 s LEU 96 Cb -0.16 -1.31 0.00 0.00 0.50 0.00 0.00 46.19 45.23 1up8 s LEU 96 CO 0.10 0.00 0.00 0.61 -1.32 0.00 0.00 176.35 175.75 1up8 n GLY 97 N 4.47 -2.34 2.04 7.98 0.00 0.37 -5.01 105.19 112.70 1up8 n GLY 97 Ca -0.19 -1.55 -0.14 0.00 0.00 0.00 0.00 46.02 44.13 1up8 n GLY 97 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1up8 n PRO 98 N -0.84 -0.35 -1.76 1.61 -0.04 -1.26 -4.41 135.00 127.95 1up8 n PRO 98 Ca 0.00 -1.21 -0.38 0.00 -0.04 0.00 0.00 63.50 61.87 1up8 n PRO 98 Cb 0.00 -0.59 0.05 0.00 -0.04 0.00 0.00 33.50 32.92 1up8 n PRO 98 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1up8 s ALA 99 N -3.62 2.77 0.12 0.55 0.00 -1.26 -4.78 121.76 115.54 1up8 s ALA 99 Ca 0.38 1.34 0.06 0.00 0.00 0.00 0.00 51.96 53.74 1up8 s ALA 99 Cb -0.01 -3.58 -0.04 0.00 0.00 0.00 0.00 23.12 19.49 1up8 s ALA 99 CO 0.26 -1.43 -0.04 1.03 0.00 0.00 0.00 175.76 175.59 1up8 s ARG 100 N -2.96 2.35 -0.14 0.00 0.52 -1.26 -1.46 118.95 116.00 1up8 s ARG 100 Ca 0.73 -0.98 -0.29 0.00 -0.52 0.00 0.00 55.73 54.66 1up8 s ARG 100 Cb -0.41 -2.40 -0.02 0.00 0.52 0.00 0.00 34.95 32.64 1up8 s ARG 100 CO 0.48 0.50 1.34 0.34 0.02 0.00 0.00 175.30 177.98 1up8 s ASP 101 N -2.46 6.89 0.46 0.23 -1.08 0.46 -4.91 116.67 116.26 1up8 s ASP 101 Ca 0.25 1.80 0.22 0.00 -0.52 0.00 0.00 52.55 54.30 1up8 s ASP 101 Cb -0.11 -2.54 1.23 0.00 -1.46 0.00 0.00 42.92 40.04 1up8 s ASP 101 CO 0.17 -0.79 1.88 -0.65 0.52 0.00 0.00 175.17 176.29 1up8 h PRO 102 N 8.45 0.24 0.00 4.34 0.11 -1.96 0.34 132.00 143.53 1up8 h PRO 102 Ca -0.29 -0.01 -0.19 0.00 0.11 0.00 0.00 66.00 65.62 1up8 h PRO 102 Cb 1.12 -0.06 -0.03 0.00 0.11 0.00 0.00 31.00 32.15 1up8 h PRO 102 CO 0.97 0.16 -1.03 0.93 -0.21 0.00 0.00 178.00 178.82 1up8 h GLU 103 N 0.25 0.00 0.00 1.05 4.39 -1.98 -3.39 114.58 114.90 1up8 h GLU 103 Ca 0.44 0.00 -0.13 0.00 0.34 0.00 0.00 59.36 60.01 1up8 h GLU 103 Cb 1.32 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 29.95 1up8 h GLU 103 CO -0.11 0.95 -0.75 1.79 -1.16 0.00 0.00 179.01 179.72 1up8 h THR 104 N -1.00 0.89 0.00 1.13 1.35 -1.98 -3.47 112.91 109.83 1up8 h THR 104 Ca -0.28 -2.31 0.00 0.00 -0.55 0.00 0.00 66.41 63.27 1up8 h THR 104 Cb 1.21 2.39 0.00 0.00 -1.73 0.00 0.00 68.15 70.03 1up8 h THR 104 CO -0.17 0.51 0.00 0.61 -0.25 0.00 0.00 175.52 176.22 1up8 n GLY 105 N 1.28 0.80 3.82 5.82 0.00 0.10 -5.04 105.19 111.97 1up8 n GLY 105 Ca -0.01 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.66 1up8 n GLY 105 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1up8 s LEU 106 N 0.00 4.32 0.36 0.99 1.43 -1.25 -4.66 118.68 119.86 1up8 s LEU 106 Ca 0.00 1.35 -0.28 0.00 -1.03 0.00 0.00 54.13 54.16 1up8 s LEU 106 Cb 0.00 -3.57 -0.11 0.00 0.03 0.00 0.00 46.19 42.54 1up8 s LEU 106 CO 0.00 0.03 1.51 -2.84 0.23 0.00 0.00 176.35 175.27 1up8 s PRO 107 N -2.05 4.12 -0.45 1.29 0.02 -1.26 -0.41 135.00 136.26 1up8 s PRO 107 Ca 0.43 2.56 -0.18 0.00 0.02 0.00 0.00 61.00 63.83 1up8 s PRO 107 Cb -0.16 -2.98 0.03 0.00 0.02 0.00 0.00 34.50 31.41 1up8 s PRO 107 CO 0.20 -0.55 0.53 0.42 -0.33 0.00 0.00 177.00 177.28 1up8 s ILE 108 N -0.88 4.98 0.55 2.83 1.01 -0.54 -4.85 121.20 124.30 1up8 s ILE 108 Ca 0.55 -0.32 -0.06 0.00 0.00 0.00 0.00 60.65 60.81 1up8 s ILE 108 Cb -0.47 -4.15 -0.01 0.00 0.01 0.00 0.00 42.46 37.84 1up8 s ILE 108 CO 0.60 -0.58 0.87 0.26 0.00 0.00 0.00 174.94 176.09 1up8 s TRP 109 N 2.40 3.39 0.09 3.97 0.52 -1.26 -4.72 118.94 123.33 1up8 s TRP 109 Ca 0.15 0.75 -0.11 0.00 0.02 0.00 0.00 56.10 56.91 1up8 s TRP 109 Cb -0.17 -2.58 -0.19 0.00 -1.15 0.00 0.00 33.47 29.37 1up8 s TRP 109 CO 0.14 -0.62 1.22 0.00 0.02 0.00 0.00 176.95 177.71 1up8 h ARG 110 N -0.04 0.60 -6.60 4.98 3.08 -1.97 -3.47 114.38 110.96 1up8 h ARG 110 Ca -0.46 -0.66 -0.51 0.00 0.07 0.00 0.00 59.98 58.42 1up8 h ARG 110 Cb 1.23 0.19 -0.02 0.00 0.08 0.00 0.00 29.97 31.45 1up8 h ARG 110 CO 0.61 1.26 -0.01 -1.54 -1.07 0.00 0.00 179.97 179.22 1up8 s SER 111 N -7.23 6.66 0.20 7.04 1.04 -1.26 -4.98 113.70 115.17 1up8 s SER 111 Ca -0.08 1.07 -0.08 0.00 0.48 0.00 0.00 55.95 57.34 1up8 s SER 111 Cb 0.07 -2.29 0.12 0.00 0.10 0.00 0.00 66.02 64.03 1up8 s SER 111 CO 0.90 -0.17 1.70 0.44 0.98 0.00 0.00 173.24 177.10 1up8 h ASP 112 N 2.23 1.06 0.08 7.02 3.32 -1.96 -2.91 116.42 125.27 1up8 h ASP 112 Ca -0.47 -0.25 0.00 0.00 0.02 0.00 0.00 57.03 56.33 1up8 h ASP 112 Cb 1.17 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 40.44 1up8 h ASP 112 CO 0.67 1.04 -0.07 0.25 -1.72 0.00 0.00 179.24 179.41 1up8 h LEU 113 N 1.04 -0.19 -0.82 1.55 5.85 -1.99 -0.04 115.31 120.71 1up8 h LEU 113 Ca 0.21 0.02 -0.08 0.00 0.84 0.00 0.00 57.88 58.87 1up8 h LEU 113 Cb 0.43 0.07 -0.02 0.00 0.37 0.00 0.00 40.66 41.50 1up8 h LEU 113 CO 0.01 -0.12 0.03 0.00 -0.34 0.00 0.00 178.44 178.03 1up8 h ALA 114 N 0.74 1.02 -0.53 1.25 0.00 -1.97 -1.82 119.26 117.95 1up8 h ALA 114 Ca 0.00 -0.27 -0.11 0.00 0.00 0.00 0.00 54.91 54.53 1up8 h ALA 114 Cb 0.16 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 1up8 h ALA 114 CO -0.02 0.61 -0.09 -0.91 0.00 0.00 0.00 179.25 178.85 1up8 h ASN 115 N 0.86 0.99 0.17 0.00 2.35 -1.43 -2.51 115.58 116.01 1up8 h ASN 115 Ca 0.17 -0.34 -0.06 0.00 -0.55 0.00 0.00 56.30 55.51 1up8 h ASN 115 Cb 0.46 -0.27 -0.01 0.00 0.05 0.00 0.00 38.32 38.55 1up8 h ASN 115 CO 0.02 1.11 -0.22 0.77 -1.65 0.00 0.00 177.43 177.46 1up8 h SER 116 N 0.87 0.10 0.80 5.81 4.64 -0.72 -2.40 113.55 122.65 1up8 h SER 116 Ca 0.14 -0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.44 1up8 h SER 116 Cb 0.65 -0.03 0.00 0.00 -0.31 0.00 0.00 62.40 62.71 1up8 h SER 116 CO 0.04 0.33 -0.20 0.18 -0.87 0.00 0.00 176.83 176.32 1up8 n LEU 117 N -4.24 0.20 -3.73 5.97 4.77 -0.71 -4.95 117.00 114.31 1up8 n LEU 117 Ca -0.02 0.30 -0.26 0.00 -0.03 0.00 0.00 56.01 56.01 1up8 n LEU 117 Cb 0.30 -0.40 0.05 0.00 -2.33 0.00 0.00 43.42 41.05 1up8 n LEU 117 CO 0.38 0.05 0.15 -0.62 -1.33 0.00 0.00 177.39 176.02 1up8 n GLU 118 N -1.50 -6.59 -1.86 3.23 1.02 -0.90 -4.92 120.64 109.11 1up8 n GLU 118 Ca 0.06 0.72 -0.41 0.00 -0.02 0.00 0.00 57.16 57.51 1up8 n GLU 118 Cb 0.34 -5.66 -0.00 0.00 -0.02 0.00 0.00 31.44 26.10 1up8 n GLU 118 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1up8 s LEU 119 N -7.18 4.30 0.61 -4.62 1.43 -1.11 -5.01 118.68 107.10 1up8 s LEU 119 Ca 0.52 2.96 0.04 0.00 -1.03 0.00 0.00 54.13 56.63 1up8 s LEU 119 Cb -0.25 -3.71 0.08 0.00 0.03 0.00 0.00 46.19 42.34 1up8 s LEU 119 CO 0.78 -0.87 0.84 -1.61 0.23 0.00 0.00 176.35 175.72 1up8 s GLU 120 N -2.11 2.17 0.33 1.70 0.41 -1.26 -4.55 118.70 115.39 1up8 s GLU 120 Ca 0.54 -1.25 -0.19 0.00 -0.41 0.00 0.00 54.97 53.65 1up8 s GLU 120 Cb -0.45 -2.52 -0.09 0.00 -1.78 0.00 0.00 34.13 29.29 1up8 s GLU 120 CO 0.60 -0.98 0.82 0.14 -0.49 0.00 0.00 175.26 175.35 1up8 s VAL 121 N -2.82 4.50 0.16 2.63 -7.23 -1.26 -1.99 120.40 114.39 1up8 s VAL 121 Ca 0.62 1.31 0.05 0.00 -1.81 0.00 0.00 61.98 62.16 1up8 s VAL 121 Cb -0.07 -3.73 -0.04 0.00 0.56 0.00 0.00 36.38 33.10 1up8 s VAL 121 CO 0.40 -0.07 0.11 0.00 -0.31 0.00 0.00 175.10 175.23 1up8 s ARG 122 N -2.64 2.82 0.32 4.82 1.70 -0.74 -4.86 118.95 120.37 1up8 s ARG 122 Ca 0.53 -0.91 0.07 0.00 -0.47 0.00 0.00 55.73 54.95 1up8 s ARG 122 Cb -0.13 -2.60 -0.02 0.00 -0.57 0.00 0.00 34.95 31.63 1up8 s ARG 122 CO 0.18 0.48 0.34 0.20 -1.08 0.00 0.00 175.30 175.42 1up8 s GLY 123 N -3.07 1.63 0.36 3.88 0.00 -1.26 -4.89 107.32 103.96 1up8 s GLY 123 Ca 0.30 -1.53 -0.28 0.00 0.00 0.00 0.00 44.72 43.21 1up8 s GLY 123 CO 0.23 -1.47 1.45 0.79 0.00 0.00 0.00 173.10 174.09 1up8 n TRP 124 N -1.43 2.79 -3.33 1.90 8.01 -1.26 -4.82 117.44 119.31 1up8 n TRP 124 Ca -0.03 0.45 -0.46 0.00 -1.31 0.00 0.00 57.50 56.15 1up8 n TRP 124 Cb 0.59 -2.51 -0.05 0.00 -2.01 0.00 0.00 31.31 27.33 1up8 n TRP 124 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 177.69 175.47 1up8 s GLU 125 N -1.82 2.98 -0.97 -0.99 2.02 -1.07 -4.61 118.70 114.24 1up8 s GLU 125 Ca 0.55 -1.74 -0.11 0.00 0.02 0.00 0.00 54.97 53.70 1up8 s GLU 125 Cb -0.50 -4.28 -0.01 0.00 0.10 0.00 0.00 34.13 29.44 1up8 s GLU 125 CO 0.61 -1.32 0.73 0.09 0.02 0.00 0.00 175.26 175.39 1up8 n ASN 126 N 5.19 -5.83 0.28 -0.19 4.13 -1.26 -4.91 115.26 112.67 1up8 n ASN 126 Ca -0.13 -0.78 0.17 0.00 1.68 0.00 0.00 54.58 55.52 1up8 n ASN 126 Cb 0.40 -3.46 0.70 0.00 -1.54 0.00 0.00 39.78 35.87 1up8 n ASN 126 CO 0.00 0.00 0.00 0.77 0.28 0.00 0.00 177.26 178.31 1up8 h SER 127 N -0.97 0.00 -0.23 6.41 4.64 -1.95 -2.84 113.55 118.61 1up8 h SER 127 Ca -0.50 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 60.80 1up8 h SER 127 Cb 1.29 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.37 1up8 h SER 127 CO 0.41 0.02 -0.00 -1.20 -0.87 0.00 0.00 176.83 175.19 1up8 n SER 128 N -3.13 3.55 0.34 4.97 7.64 -1.26 -4.68 113.62 121.04 1up8 n SER 128 Ca 0.00 -3.09 0.23 0.00 1.01 0.00 0.00 58.87 57.02 1up8 n SER 128 Cb 0.30 -0.54 1.19 0.00 -1.01 0.00 0.00 64.21 64.16 1up8 n SER 128 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1up8 h ALA 129 N 1.47 1.00 0.00 -0.43 0.00 -1.86 -1.31 119.26 118.13 1up8 h ALA 129 Ca 0.02 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1up8 h ALA 129 Cb 1.40 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.19 1up8 h ALA 129 CO 0.20 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.86 1up8 n GLY 130 N -1.01 -0.67 0.02 0.00 0.00 -1.26 -2.83 105.19 99.44 1up8 n GLY 130 Ca -0.03 -0.08 0.11 0.00 0.00 0.00 0.00 46.02 46.02 1up8 n GLY 130 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1up8 n LEU 131 N -1.17 0.56 -4.75 0.99 4.77 -0.49 -4.73 117.00 112.18 1up8 n LEU 131 Ca 0.09 -0.16 -0.41 0.00 -0.03 0.00 0.00 56.01 55.50 1up8 n LEU 131 Cb 0.09 -0.04 -0.03 0.00 -2.33 0.00 0.00 43.42 41.11 1up8 n LEU 131 CO 0.10 0.09 0.91 -0.89 -1.33 0.00 0.00 177.39 176.27 1up8 s THR 132 N -3.23 3.26 0.88 -5.08 2.01 -1.13 -5.05 115.64 107.30 1up8 s THR 132 Ca 0.02 1.15 -0.11 0.00 0.31 0.00 0.00 61.69 63.06 1up8 s THR 132 Cb 0.15 -3.73 0.18 0.00 0.01 0.00 0.00 72.50 69.10 1up8 s THR 132 CO 0.85 0.23 1.21 -0.36 -0.69 0.00 0.00 174.62 175.86 1up8 s PHE 133 N -0.56 1.57 -0.01 4.92 0.40 -1.26 -4.64 117.98 118.41 1up8 s PHE 133 Ca 0.51 0.10 -0.11 0.00 -0.60 0.00 0.00 56.93 56.82 1up8 s PHE 133 Cb -0.35 -3.72 0.01 0.00 0.51 0.00 0.00 43.02 39.48 1up8 s PHE 133 CO 0.42 -2.32 0.23 0.34 0.70 0.00 0.00 175.22 174.59 1up8 s ASP 134 N -4.84 -0.10 0.41 1.36 -1.08 -1.26 -5.03 116.67 106.13 1up8 s ASP 134 Ca 0.71 -0.03 0.28 0.00 -0.52 0.00 0.00 52.55 53.00 1up8 s ASP 134 Cb -0.04 0.27 1.07 0.00 -1.46 0.00 0.00 42.92 42.76 1up8 s ASP 134 CO 0.50 -0.40 1.83 -0.07 0.52 0.00 0.00 175.17 177.55 1up8 h LEU 135 N 4.09 0.00 -7.80 -1.34 3.38 -2.00 -3.45 115.31 108.19 1up8 h LEU 135 Ca -0.30 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.54 1up8 h LEU 135 Cb 1.18 0.00 -0.18 0.00 0.09 0.00 0.00 40.66 41.75 1up8 h LEU 135 CO 0.40 0.00 -0.47 -1.83 0.09 0.00 0.00 178.44 176.63 1up8 s GLU 136 N -3.45 0.59 0.00 1.13 -1.05 -1.26 -5.00 118.70 109.67 1up8 s GLU 136 Ca 0.04 -0.60 0.00 0.00 -0.15 0.00 0.00 54.97 54.25 1up8 s GLU 136 Cb 0.09 0.24 0.00 0.00 -0.44 0.00 0.00 34.13 34.02 1up8 s GLU 136 CO 0.51 -0.16 0.00 0.41 0.95 0.00 0.00 175.26 176.98 1up8 n GLY 137 N 0.94 -0.85 3.75 -3.83 0.00 -1.26 -4.90 105.19 99.04 1up8 n GLY 137 Ca -0.20 -1.69 -0.41 0.00 0.00 0.00 0.00 46.02 43.72 1up8 n GLY 137 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1up8 s PRO 138 N -1.29 4.17 0.52 1.61 0.02 -1.26 -4.94 135.00 133.83 1up8 s PRO 138 Ca 0.00 2.49 -0.22 0.00 0.02 0.00 0.00 61.00 63.30 1up8 s PRO 138 Cb 0.00 -3.05 -0.07 0.00 0.02 0.00 0.00 34.50 31.40 1up8 s PRO 138 CO 0.00 -0.57 1.14 -3.47 -0.33 0.00 0.00 177.00 173.76 1up8 n ASP 139 N 2.31 1.70 -0.06 2.53 2.03 -1.26 -4.88 116.55 118.90 1up8 n ASP 139 Ca 0.08 0.95 0.25 0.00 0.52 0.00 0.00 54.79 56.59 1up8 n ASP 139 Cb 0.38 -1.45 0.72 0.00 -0.72 0.00 0.00 41.12 40.04 1up8 n ASP 139 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1up8 h ALA 140 N 1.20 2.55 -0.02 -1.67 0.00 -1.90 -2.53 119.26 116.89 1up8 h ALA 140 Ca -0.48 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.40 1up8 h ALA 140 Cb 1.33 0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.17 1up8 h ALA 140 CO 0.55 -0.94 -0.12 1.04 0.00 0.00 0.00 179.25 179.78 1up8 n GLN 141 N -3.98 1.45 0.14 0.00 6.02 -1.26 -4.47 117.38 115.28 1up8 n GLN 141 Ca 0.14 -1.23 0.13 0.00 -0.01 0.00 0.00 57.00 56.03 1up8 n GLN 141 Cb 0.84 -1.30 0.35 0.00 1.02 0.00 0.00 30.24 31.16 1up8 n GLN 141 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.06 176.71 1up8 h SER 142 N 2.68 0.00 -2.16 1.08 4.64 -1.76 -3.45 113.55 114.59 1up8 h SER 142 Ca 0.00 0.00 -0.58 0.00 -0.47 0.00 0.00 61.79 60.74 1up8 h SER 142 Cb 0.63 0.00 -0.13 0.00 -0.31 0.00 0.00 62.40 62.59 1up8 h SER 142 CO 0.00 0.00 -0.61 0.27 -0.87 0.00 0.00 176.83 175.62 1up8 s ILE 143 N -3.15 1.78 0.03 0.95 -4.36 -1.26 -2.12 121.20 113.07 1up8 s ILE 143 Ca 0.09 -2.02 0.01 0.00 -0.26 0.00 0.00 60.65 58.47 1up8 s ILE 143 Cb 0.10 -2.90 -0.02 0.00 1.25 0.00 0.00 42.46 40.89 1up8 s ILE 143 CO 0.61 -0.03 -0.04 0.00 0.24 0.00 0.00 174.94 175.72 1up8 s ALA 144 N -2.88 0.32 -0.03 2.27 0.00 -1.26 -4.83 121.76 115.35 1up8 s ALA 144 Ca 0.35 -0.73 0.03 0.00 0.00 0.00 0.00 51.96 51.60 1up8 s ALA 144 Cb 0.09 0.13 -0.03 0.00 0.00 0.00 0.00 23.12 23.31 1up8 s ALA 144 CO 0.17 -0.15 -0.09 -1.64 0.00 0.00 0.00 175.76 174.05 1up8 s MET 145 N -1.85 2.57 0.93 0.00 -1.94 -1.26 -4.94 119.30 112.80 1up8 s MET 145 Ca -0.11 -0.68 -0.12 0.00 -1.71 0.00 0.00 55.69 53.07 1up8 s MET 145 Cb -0.07 -2.48 0.15 0.00 2.01 0.00 0.00 34.83 34.43 1up8 s MET 145 CO -0.02 0.62 1.12 -1.25 -0.01 0.00 0.00 175.02 175.49 1up8 s PRO 146 N -1.06 1.02 0.22 2.03 0.04 -1.26 -4.43 135.00 131.56 1up8 s PRO 146 Ca 0.14 0.40 -0.31 0.00 0.04 0.00 0.00 61.00 61.26 1up8 s PRO 146 Cb -0.11 -1.82 -0.14 0.00 0.04 0.00 0.00 34.50 32.47 1up8 s PRO 146 CO 0.04 -2.30 1.30 -2.30 0.04 0.00 0.00 177.00 173.77 1up8 n PRO 147 N -3.86 1.70 -1.90 0.56 -0.02 -1.15 -4.95 135.00 125.37 1up8 n PRO 147 Ca 0.06 0.60 -0.35 0.00 -2.02 0.00 0.00 63.50 61.80 1up8 n PRO 147 Cb 0.58 -2.19 0.04 0.00 -0.02 0.00 0.00 33.50 31.92 1up8 n PRO 147 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1up8 s ALA 148 N -0.19 2.48 0.52 3.55 0.00 -1.26 -4.95 121.76 121.90 1up8 s ALA 148 Ca 0.69 0.84 -0.21 0.00 0.00 0.00 0.00 51.96 53.28 1up8 s ALA 148 Cb -0.72 -3.41 -0.07 0.00 0.00 0.00 0.00 23.12 18.92 1up8 s ALA 148 CO 0.51 -1.23 1.04 -2.30 0.00 0.00 0.00 175.76 173.78 1up8 n PRO 149 N -1.92 1.23 -3.25 0.00 -0.02 -1.26 -4.73 135.00 125.06 1up8 n PRO 149 Ca 0.12 0.46 -0.28 0.00 -2.02 0.00 0.00 63.50 61.78 1up8 n PRO 149 Cb 0.51 -2.18 -0.03 0.00 -0.02 0.00 0.00 33.50 31.78 1up8 n PRO 149 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 1up8 s VAL 150 N -1.39 5.01 0.53 -1.45 -7.23 -1.26 -4.98 120.40 109.64 1up8 s VAL 150 Ca 0.69 0.02 0.27 0.00 -1.81 0.00 0.00 61.98 61.15 1up8 s VAL 150 Cb -0.47 -3.77 0.43 0.00 0.56 0.00 0.00 36.38 33.13 1up8 s VAL 150 CO 0.52 -0.43 1.96 -0.07 -0.31 0.00 0.00 175.10 176.77 1up8 h LEU 151 N 1.35 0.00 -0.64 1.32 3.38 -1.95 -1.80 115.31 116.97 1up8 h LEU 151 Ca -0.48 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.49 1up8 h LEU 151 Cb 1.20 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.95 1up8 h LEU 151 CO 0.65 0.00 -0.09 0.35 0.09 0.00 0.00 178.44 179.43 1up8 n THR 152 N -4.33 0.00 -2.91 0.22 -2.24 -1.25 -4.73 114.28 99.03 1up8 n THR 152 Ca 0.13 -0.16 -0.33 0.00 -2.27 0.00 0.00 64.05 61.41 1up8 n THR 152 Cb 0.72 0.30 -0.07 0.00 -2.10 0.00 0.00 70.33 69.19 1up8 n THR 152 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1up8 s SER 153 N -2.22 6.90 0.34 3.42 1.04 -0.68 -4.97 113.70 117.53 1up8 s SER 153 Ca 0.33 1.57 0.08 0.00 0.48 0.00 0.00 55.95 58.42 1up8 s SER 153 Cb 0.20 -2.49 0.79 0.00 0.10 0.00 0.00 66.02 64.62 1up8 s SER 153 CO 0.41 -0.30 1.83 -0.65 0.98 0.00 0.00 173.24 175.51 1up8 h PRO 154 N 2.06 0.70 -0.41 4.02 0.11 -1.93 -2.54 132.00 134.01 1up8 h PRO 154 Ca -0.49 -0.04 0.06 0.00 0.11 0.00 0.00 66.00 65.64 1up8 h PRO 154 Cb 1.18 -0.16 -0.05 0.00 0.11 0.00 0.00 31.00 32.08 1up8 h PRO 154 CO 0.62 0.46 0.11 1.49 -0.21 0.00 0.00 178.00 180.48 1up8 h GLU 155 N 0.72 0.25 -0.24 1.05 4.81 -1.93 -2.00 114.58 117.24 1up8 h GLU 155 Ca 0.51 -0.01 -0.18 0.00 -0.13 0.00 0.00 59.36 59.55 1up8 h GLU 155 Cb 0.83 -0.06 -0.00 0.00 0.63 0.00 0.00 28.75 30.15 1up8 h GLU 155 CO -0.27 0.16 -0.56 1.25 -0.73 0.00 0.00 179.01 178.86 1up8 h LEU 156 N 0.25 0.81 -0.52 1.64 7.12 -1.71 -0.99 115.31 121.91 1up8 h LEU 156 Ca 0.20 -0.44 0.07 0.00 0.13 0.00 0.00 57.88 57.84 1up8 h LEU 156 Cb 0.22 -0.23 -0.06 0.00 -0.53 0.00 0.00 40.66 40.06 1up8 h LEU 156 CO -0.23 1.20 0.20 0.58 -0.13 0.00 0.00 178.44 180.05 1up8 h VAL 157 N 0.55 0.83 -0.58 1.05 2.07 -1.21 -0.85 116.25 118.10 1up8 h VAL 157 Ca 0.01 -0.13 -0.07 0.00 0.82 0.00 0.00 66.70 67.33 1up8 h VAL 157 Cb 1.14 0.42 -0.03 0.00 -1.52 0.00 0.00 31.29 31.30 1up8 h VAL 157 CO 0.12 0.07 0.10 0.00 0.02 0.00 0.00 177.57 177.87 1up8 h ALA 158 N 1.35 1.08 -0.08 1.67 0.00 -1.07 -1.63 119.26 120.58 1up8 h ALA 158 Ca 0.25 -0.24 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 1up8 h ALA 158 Cb 0.27 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 17.83 1up8 h ALA 158 CO -0.25 0.60 -0.00 0.93 0.00 0.00 0.00 179.25 180.53 1up8 h GLU 159 N 0.89 0.14 -0.13 0.00 5.08 -0.69 -1.69 114.58 118.18 1up8 h GLU 159 Ca 0.18 -0.04 -0.15 0.00 -1.00 0.00 0.00 59.36 58.35 1up8 h GLU 159 Cb 0.38 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.61 1up8 h GLU 159 CO 0.01 0.41 -0.55 0.97 -1.00 0.00 0.00 179.01 178.85 1up8 h ILE 160 N -0.16 1.35 -0.24 3.13 6.09 -1.16 -2.26 117.51 124.27 1up8 h ILE 160 Ca 0.02 -1.83 0.05 0.00 -1.37 0.00 0.00 64.86 61.72 1up8 h ILE 160 Cb 0.36 1.85 -0.04 0.00 0.47 0.00 0.00 36.82 39.45 1up8 h ILE 160 CO 0.00 0.55 -0.04 0.00 -3.07 0.00 0.00 178.15 175.60 1up8 h ALA 161 N 1.12 0.18 -0.71 0.18 0.00 -1.29 -1.86 119.26 116.89 1up8 h ALA 161 Ca 0.00 0.08 0.06 0.00 0.00 0.00 0.00 54.91 55.06 1up8 h ALA 161 Cb 1.06 0.16 -0.06 0.00 0.00 0.00 0.00 17.79 18.95 1up8 h ALA 161 CO 0.09 -0.45 0.41 1.49 0.00 0.00 0.00 179.25 180.80 1up8 h GLU 162 N 0.03 0.74 -0.32 0.00 4.81 -1.06 -2.22 114.58 116.56 1up8 h GLU 162 Ca 0.12 -0.04 -0.10 0.00 -0.13 0.00 0.00 59.36 59.20 1up8 h GLU 162 Cb 0.17 -0.17 -0.01 0.00 0.63 0.00 0.00 28.75 29.37 1up8 h GLU 162 CO -0.23 0.49 -0.23 -0.07 -0.73 0.00 0.00 179.01 178.24 1up8 h LEU 163 N 0.76 0.63 -0.75 1.64 3.38 -0.92 -0.93 115.31 119.12 1up8 h LEU 163 Ca 0.32 -0.22 -0.07 0.00 0.09 0.00 0.00 57.88 57.99 1up8 h LEU 163 Cb 0.17 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 40.72 1up8 h LEU 163 CO -0.17 0.85 0.14 1.88 0.09 0.00 0.00 178.44 181.22 1up8 h TYR 164 N 0.55 1.14 -0.15 1.13 -1.99 -1.10 -1.57 116.97 114.98 1up8 h TYR 164 Ca 0.08 -0.14 -0.09 0.00 2.00 0.00 0.00 58.73 60.58 1up8 h TYR 164 Cb 0.70 -0.32 -0.01 0.00 2.00 0.00 0.00 36.73 39.10 1up8 h TYR 164 CO 0.03 0.94 -0.30 -0.07 -0.00 0.00 0.00 178.16 178.77 1up8 h LEU 165 N 1.02 0.29 -0.17 3.88 3.38 -0.98 -1.60 115.31 121.14 1up8 h LEU 165 Ca 0.21 -0.10 -0.07 0.00 0.09 0.00 0.00 57.88 58.01 1up8 h LEU 165 Cb 0.40 -0.08 -0.00 0.00 0.09 0.00 0.00 40.66 41.07 1up8 h LEU 165 CO 0.01 0.58 -0.16 0.24 0.09 0.00 0.00 178.44 179.20 1up8 h MET 166 N 0.25 0.41 -0.97 1.13 2.86 -0.98 -2.24 114.93 115.39 1up8 h MET 166 Ca 0.04 -0.21 0.02 0.00 -2.06 0.00 0.00 59.70 57.49 1up8 h MET 166 Cb 0.66 0.01 -0.05 0.00 0.06 0.00 0.00 31.60 32.27 1up8 h MET 166 CO 0.05 0.77 0.64 0.00 1.06 0.00 0.00 176.91 179.43 1up8 h ALA 167 N 0.63 1.33 0.00 6.32 0.00 -1.08 -1.75 119.26 124.71 1up8 h ALA 167 Ca 0.03 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1up8 h ALA 167 Cb 0.69 -0.37 0.00 0.00 0.00 0.00 0.00 17.79 18.10 1up8 h ALA 167 CO 0.04 0.60 -0.07 1.28 0.00 0.00 0.00 179.25 181.09 1up8 n LEU 168 N -4.41 0.53 -1.56 0.00 4.77 -0.62 -3.41 117.00 112.31 1up8 n LEU 168 Ca 0.12 0.50 0.08 0.00 -0.03 0.00 0.00 56.01 56.68 1up8 n LEU 168 Cb 0.05 -0.36 0.36 0.00 -2.33 0.00 0.00 43.42 41.13 1up8 n LEU 168 CO 0.36 -0.10 0.82 0.61 -1.33 0.00 0.00 177.39 177.75 1up8 n GLY 169 N 1.38 3.12 0.29 -0.72 0.00 -0.69 -4.72 105.19 103.85 1up8 n GLY 169 Ca 0.06 -0.91 0.15 0.00 0.00 0.00 0.00 46.02 45.32 1up8 n GLY 169 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1up8 h ARG 170 N 3.53 0.00 -0.15 1.61 3.08 -1.50 -2.01 114.38 118.94 1up8 h ARG 170 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1up8 h ARG 170 Cb 1.68 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.73 1up8 h ARG 170 CO 0.34 0.04 0.00 0.39 -1.07 0.00 0.00 179.97 179.67 1up8 n GLU 171 N -3.76 2.19 -2.21 0.04 4.71 -1.26 -1.09 120.64 119.26 1up8 n GLU 171 Ca -0.03 -1.75 -0.42 0.00 -0.01 0.00 0.00 57.16 54.96 1up8 n GLU 171 Cb 0.13 -1.47 -0.03 0.00 -1.01 0.00 0.00 31.44 29.06 1up8 n GLU 171 CO 0.00 0.00 0.00 0.42 0.09 0.00 0.00 177.13 177.64 1up8 s ILE 172 N -1.83 3.24 0.03 -3.67 1.01 -0.76 -4.90 121.20 114.32 1up8 s ILE 172 Ca 0.33 0.99 -0.28 0.00 0.00 0.00 0.00 60.65 61.70 1up8 s ILE 172 Cb 0.21 -3.63 -0.04 0.00 0.01 0.00 0.00 42.46 39.00 1up8 s ILE 172 CO 0.31 0.13 0.87 -1.61 0.00 0.00 0.00 174.94 174.64 1up8 s GLU 173 N 0.18 4.56 0.21 2.79 2.02 -1.26 -2.07 118.70 125.13 1up8 s GLU 173 Ca 0.58 1.25 -0.09 0.00 0.02 0.00 0.00 54.97 56.73 1up8 s GLU 173 Cb -0.36 -3.41 0.27 0.00 0.10 0.00 0.00 34.13 30.72 1up8 s GLU 173 CO 0.36 0.12 1.78 0.74 0.02 0.00 0.00 175.26 178.28 1up8 h PHE 174 N 6.20 0.55 0.00 1.61 -1.00 -1.74 0.56 116.94 123.12 1up8 h PHE 174 Ca -0.42 0.03 0.00 0.00 2.81 0.00 0.00 57.97 60.39 1up8 h PHE 174 Cb 1.21 -0.15 0.00 0.00 3.61 0.00 0.00 35.95 40.62 1up8 h PHE 174 CO 0.66 0.21 0.00 -1.13 -1.61 0.00 0.00 178.31 176.44 1up8 n SER 175 N -4.89 0.00 -0.04 2.17 3.41 -1.26 -2.79 113.62 110.21 1up8 n SER 175 Ca 0.09 -0.60 0.05 0.00 -0.26 0.00 0.00 58.87 58.15 1up8 n SER 175 Cb 0.23 0.00 0.07 0.00 -0.26 0.00 0.00 64.21 64.25 1up8 n SER 175 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1up8 n GLU 176 N -0.98 2.03 -0.22 4.33 1.02 0.18 -4.75 120.64 122.26 1up8 n GLU 176 Ca 0.13 -2.02 0.17 0.00 -0.02 0.00 0.00 57.16 55.43 1up8 n GLU 176 Cb 0.06 -1.24 0.50 0.00 -0.02 0.00 0.00 31.44 30.75 1up8 n GLU 176 CO 0.00 0.00 0.00 0.74 1.18 0.00 0.00 177.13 179.05 1up8 h PHE 177 N 0.00 0.53 -0.45 -0.32 -1.00 -1.46 -2.05 116.94 112.20 1up8 h PHE 177 Ca 0.00 0.02 0.00 0.00 2.81 0.00 0.00 57.97 60.80 1up8 h PHE 177 Cb 0.78 -0.16 0.00 0.00 3.61 0.00 0.00 35.95 40.17 1up8 h PHE 177 CO 0.00 0.17 0.00 -0.25 -1.61 0.00 0.00 178.31 176.62 1up8 n ASP 178 N -4.50 3.24 -4.79 2.17 8.00 -1.26 -4.83 116.55 114.58 1up8 n ASP 178 Ca 0.17 -1.96 -0.37 0.00 0.71 0.00 0.00 54.79 53.35 1up8 n ASP 178 Cb 0.62 -0.29 -0.06 0.00 -0.02 0.00 0.00 41.12 41.37 1up8 n ASP 178 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 1up8 s SER 179 N -1.33 7.26 0.31 -2.24 1.04 -0.77 -4.95 113.70 113.01 1up8 s SER 179 Ca 0.40 1.75 0.06 0.00 0.48 0.00 0.00 55.95 58.63 1up8 s SER 179 Cb 0.22 -2.55 0.71 0.00 0.10 0.00 0.00 66.02 64.50 1up8 s SER 179 CO 0.30 -0.07 1.83 -0.65 0.98 0.00 0.00 173.24 175.63 1up8 h PRO 180 N 3.13 0.79 -0.96 4.02 0.11 -1.94 -1.02 132.00 136.13 1up8 h PRO 180 Ca -0.47 -0.05 0.20 0.00 0.11 0.00 0.00 66.00 65.79 1up8 h PRO 180 Cb 1.19 -0.18 -0.09 0.00 0.11 0.00 0.00 31.00 32.04 1up8 h PRO 180 CO 0.65 0.53 0.61 -0.22 -0.21 0.00 0.00 178.00 179.36 1up8 h LYS 181 N 0.82 0.57 -0.02 1.05 3.64 -1.94 -2.15 116.57 118.54 1up8 h LYS 181 Ca 0.51 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.86 1up8 h LYS 181 Cb 0.72 -0.13 0.00 0.00 -0.41 0.00 0.00 32.23 32.41 1up8 h LYS 181 CO -0.28 0.38 -0.34 0.09 -2.27 0.00 0.00 179.45 177.02 1up8 n ASN 182 N -4.63 2.12 -0.29 4.20 3.02 -0.44 -4.58 115.26 114.65 1up8 n ASN 182 Ca 0.22 -1.56 0.10 0.00 -0.03 0.00 0.00 54.58 53.31 1up8 n ASN 182 Cb 0.65 0.33 0.26 0.00 -0.61 0.00 0.00 39.78 40.41 1up8 n ASN 182 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1up8 h ALA 183 N 4.05 1.29 0.05 5.41 0.00 -0.79 -1.51 119.26 127.76 1up8 h ALA 183 Ca 0.00 0.15 -0.00 0.00 0.00 0.00 0.00 54.91 55.06 1up8 h ALA 183 Cb 0.78 0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.70 1up8 h ALA 183 CO 0.00 -0.30 -0.02 1.49 0.00 0.00 0.00 179.25 180.42 1up8 h GLU 184 N 0.41 -0.06 -0.36 0.00 4.81 -1.81 -2.32 114.58 115.24 1up8 h GLU 184 Ca 0.51 0.00 -0.05 0.00 -0.13 0.00 0.00 59.36 59.69 1up8 h GLU 184 Cb 0.90 0.01 -0.01 0.00 0.63 0.00 0.00 28.75 30.28 1up8 h GLU 184 CO -0.49 0.24 0.03 -0.92 -0.73 0.00 0.00 179.01 177.14 1up8 h TYR 185 N -0.37 0.67 -0.72 0.92 3.20 -1.81 -2.59 116.97 116.27 1up8 h TYR 185 Ca -0.01 -0.11 -0.04 0.00 3.14 0.00 0.00 58.73 61.72 1up8 h TYR 185 Cb 0.34 -0.18 -0.03 0.00 1.54 0.00 0.00 36.73 38.40 1up8 h TYR 185 CO 0.03 0.70 0.30 0.82 -1.64 0.00 0.00 178.16 178.36 1up8 h ILE 186 N 0.45 1.25 -0.01 1.81 1.08 -1.33 -1.11 117.51 119.65 1up8 h ILE 186 Ca 0.11 -0.77 -0.14 0.00 -0.39 0.00 0.00 64.86 63.67 1up8 h ILE 186 Cb 0.41 0.40 -0.02 0.00 -3.07 0.00 0.00 36.82 34.55 1up8 h ILE 186 CO 0.01 0.31 -0.66 -0.61 -0.69 0.00 0.00 178.15 176.51 1up8 h GLN 187 N 1.03 0.04 -0.08 2.37 5.75 -1.46 -1.91 115.11 120.85 1up8 h GLN 187 Ca 0.24 -0.03 -0.00 0.00 -0.15 0.00 0.00 58.65 58.70 1up8 h GLN 187 Cb 0.20 0.01 -0.00 0.00 1.07 0.00 0.00 27.48 28.75 1up8 h GLN 187 CO -0.02 0.69 0.03 0.35 -2.65 0.00 0.00 178.83 177.23 1up8 h PHE 188 N 0.03 0.12 -0.10 3.99 3.57 -1.02 0.08 116.94 123.60 1up8 h PHE 188 Ca -0.01 -0.01 0.04 0.00 3.53 0.00 0.00 57.97 61.52 1up8 h PHE 188 Cb 1.17 -0.04 -0.04 0.00 2.79 0.00 0.00 35.95 39.84 1up8 h PHE 188 CO 0.00 0.23 -0.14 0.00 -2.23 0.00 0.00 178.31 176.17 1up8 h ALA 189 N 0.88 -0.08 -0.08 2.41 0.00 -0.97 0.05 119.26 121.46 1up8 h ALA 189 Ca 0.03 0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.98 1up8 h ALA 189 Cb 0.16 0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 1up8 h ALA 189 CO -0.00 -0.60 0.04 0.82 0.00 0.00 0.00 179.25 179.51 1up8 h ILE 190 N -0.19 1.00 -0.62 0.00 2.04 -1.31 -2.19 117.51 116.25 1up8 h ILE 190 Ca 0.08 -0.03 0.00 0.00 1.00 0.00 0.00 64.86 65.91 1up8 h ILE 190 Cb 0.31 0.91 -0.03 0.00 -0.74 0.00 0.00 36.82 37.26 1up8 h ILE 190 CO -0.21 0.02 0.39 0.44 0.00 0.00 0.00 178.15 178.78 1up8 h ASP 191 N 0.09 0.73 -0.18 1.72 3.32 -0.87 -1.57 116.42 119.67 1up8 h ASP 191 Ca 0.03 -0.04 0.01 0.00 0.02 0.00 0.00 57.03 57.05 1up8 h ASP 191 Cb 0.00 -0.18 -0.02 0.00 0.22 0.00 0.00 39.33 39.35 1up8 h ASP 191 CO -0.02 0.56 0.07 1.56 -1.72 0.00 0.00 179.24 179.69 1up8 h GLN 192 N 0.84 0.16 -0.32 3.56 1.08 -0.86 -1.93 115.11 117.65 1up8 h GLN 192 Ca 0.22 -0.01 -0.06 0.00 -1.45 0.00 0.00 58.65 57.35 1up8 h GLN 192 Cb -0.05 -0.04 -0.01 0.00 -0.05 0.00 0.00 27.48 27.33 1up8 h GLN 192 CO -0.04 0.11 -0.05 -0.07 -0.95 0.00 0.00 178.83 177.83 1up8 h LEU 193 N 0.17 0.59 -2.18 1.46 3.38 -1.35 -2.81 115.31 114.57 1up8 h LEU 193 Ca 0.07 -0.34 0.00 0.00 0.09 0.00 0.00 57.88 57.70 1up8 h LEU 193 Cb 0.03 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 40.62 1up8 h LEU 193 CO -0.06 0.79 0.00 0.78 0.09 0.00 0.00 178.44 180.04 1up8 h ASN 194 N 0.37 0.00 0.34 -0.43 2.35 -1.27 -0.58 115.58 116.37 1up8 h ASN 194 Ca 0.08 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.83 1up8 h ASN 194 Cb 0.52 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.89 1up8 h ASN 194 CO 0.03 0.00 0.00 0.61 -1.65 0.00 0.00 177.43 176.42 1up8 n GLY 195 N -0.79 -1.00 3.86 2.83 0.00 -0.73 -4.50 105.19 104.86 1up8 n GLY 195 Ca -0.01 -0.12 -0.37 0.00 0.00 0.00 0.00 46.02 45.52 1up8 n GLY 195 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1up8 s LEU 196 N -2.44 4.36 0.29 0.99 1.43 -0.23 -5.01 118.68 118.06 1up8 s LEU 196 Ca 0.26 0.43 0.03 0.00 -1.03 0.00 0.00 54.13 53.82 1up8 s LEU 196 Cb 0.16 -2.07 0.64 0.00 0.03 0.00 0.00 46.19 44.95 1up8 s LEU 196 CO 0.34 0.37 1.79 -0.08 0.23 0.00 0.00 176.35 179.01 1up8 h GLU 197 N 5.24 0.77 -0.64 1.70 4.81 -1.89 -1.07 114.58 123.50 1up8 h GLU 197 Ca -0.53 -0.05 0.10 0.00 -0.13 0.00 0.00 59.36 58.76 1up8 h GLU 197 Cb 1.22 -0.17 -0.07 0.00 0.63 0.00 0.00 28.75 30.35 1up8 h GLU 197 CO 0.61 0.51 0.25 2.35 -0.73 0.00 0.00 179.01 182.00 1up8 h TRP 198 N 0.79 0.44 0.01 0.92 2.91 -1.84 -1.47 115.95 117.71 1up8 h TRP 198 Ca 0.53 0.03 -0.26 0.00 1.13 0.00 0.00 58.89 60.32 1up8 h TRP 198 Cb 0.73 -0.10 -0.04 0.00 -0.51 0.00 0.00 29.16 29.24 1up8 h TRP 198 CO -0.02 0.11 -1.43 0.74 -1.03 0.00 0.00 178.44 176.81 1up8 h PHE 199 N 0.44 0.04 -0.01 2.65 -1.00 -1.60 -3.38 116.94 114.07 1up8 h PHE 199 Ca 0.33 -0.03 0.00 0.00 2.81 0.00 0.00 57.97 61.08 1up8 h PHE 199 Cb 0.41 -0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.97 1up8 h PHE 199 CO -0.16 1.03 -0.49 0.27 -1.61 0.00 0.00 178.31 177.35 1up8 n ASN 200 N -3.19 1.42 -4.08 2.17 0.23 -0.46 -3.76 115.26 107.59 1up8 n ASN 200 Ca -0.11 -1.13 -0.21 0.00 -0.53 0.00 0.00 54.58 52.61 1up8 n ASN 200 Cb 1.01 0.43 -0.15 0.00 -2.08 0.00 0.00 39.78 38.99 1up8 n ASN 200 CO 0.00 0.00 0.00 -0.89 -0.93 0.00 0.00 177.26 175.44 1up8 s THR 201 N -2.61 0.95 0.83 5.53 2.01 -0.58 -5.03 115.64 116.74 1up8 s THR 201 Ca 0.18 -0.57 -0.12 0.00 0.31 0.00 0.00 61.69 61.48 1up8 s THR 201 Cb 0.18 -0.81 0.09 0.00 0.01 0.00 0.00 72.50 71.98 1up8 s THR 201 CO 0.61 0.23 1.19 -2.16 -0.69 0.00 0.00 174.62 173.80 1up8 s PRO 202 N -0.40 1.79 0.91 4.92 0.04 -1.26 -4.71 135.00 136.29 1up8 s PRO 202 Ca 0.04 0.08 -0.10 0.00 0.04 0.00 0.00 61.00 61.06 1up8 s PRO 202 Cb -0.05 -1.93 0.14 0.00 0.04 0.00 0.00 34.50 32.70 1up8 s PRO 202 CO -0.00 -1.71 1.14 0.00 0.04 0.00 0.00 177.00 176.46 1up8 s ALA 203 N -3.58 1.45 0.10 8.56 0.00 -1.26 -5.05 121.76 121.97 1up8 s ALA 203 Ca 0.63 0.53 0.05 0.00 0.00 0.00 0.00 51.96 53.17 1up8 s ALA 203 Cb -0.11 -3.43 -0.04 0.00 0.00 0.00 0.00 23.12 19.55 1up8 s ALA 203 CO 0.50 -2.73 -0.01 0.15 0.00 0.00 0.00 175.76 173.67 1up8 s LYS 204 N -4.67 2.50 0.08 0.00 1.02 -1.26 -5.06 119.74 112.34 1up8 s LYS 204 Ca 0.66 -0.87 -0.35 0.00 0.02 0.00 0.00 55.97 55.44 1up8 s LYS 204 Cb -0.22 -2.51 -0.14 0.00 -0.52 0.00 0.00 37.83 34.44 1up8 s LYS 204 CO 0.58 0.53 1.62 -0.11 -0.92 0.00 0.00 175.35 177.06 1up8 n LEU 205 N 0.54 2.97 0.00 3.17 7.94 -1.26 -1.59 117.00 128.77 1up8 n LEU 205 Ca -0.11 1.06 0.00 0.00 -1.11 0.00 0.00 56.01 55.85 1up8 n LEU 205 Cb 0.52 -1.37 0.00 0.00 0.53 0.00 0.00 43.42 43.10 1up8 n LEU 205 CO 0.39 -0.34 0.00 0.61 -1.11 0.00 0.00 177.39 176.94 1up8 n GLY 206 N 3.56 2.26 3.67 -3.96 0.00 -1.26 -5.08 105.19 104.38 1up8 n GLY 206 Ca 0.19 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.85 1up8 n GLY 206 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1up8 n ASP 207 N 0.00 1.17 -4.71 1.61 8.00 -0.62 -4.93 116.55 117.06 1up8 n ASP 207 Ca 0.00 0.71 -0.43 0.00 0.71 0.00 0.00 54.79 55.78 1up8 n ASP 207 Cb 0.00 -1.48 -0.03 0.00 -0.02 0.00 0.00 41.12 39.59 1up8 n ASP 207 CO 0.00 0.00 0.00 -2.65 -0.39 0.00 0.00 177.20 174.16 1up8 n PRO 208 N -2.14 2.56 -0.34 -0.24 -0.02 -1.26 -4.84 135.00 128.72 1up8 n PRO 208 Ca 0.14 0.92 0.18 0.00 -2.02 0.00 0.00 63.50 62.72 1up8 n PRO 208 Cb 0.49 -2.71 0.41 0.00 -0.02 0.00 0.00 33.50 31.67 1up8 n PRO 208 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 1up8 h PRO 209 N 5.83 0.54 -0.90 0.52 0.11 -2.00 0.23 132.00 136.34 1up8 h PRO 209 Ca -0.45 -0.03 0.04 0.00 0.11 0.00 0.00 66.00 65.67 1up8 h PRO 209 Cb 1.23 -0.12 -0.05 0.00 0.11 0.00 0.00 31.00 32.16 1up8 h PRO 209 CO 0.88 0.36 0.58 0.00 -0.21 0.00 0.00 178.00 179.61 1up8 h ALA 210 N 1.68 1.19 -0.31 -0.75 0.00 -2.00 -1.85 119.26 117.22 1up8 h ALA 210 Ca 0.62 -0.04 -0.08 0.00 0.00 0.00 0.00 54.91 55.41 1up8 h ALA 210 Cb 1.24 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 18.71 1up8 h ALA 210 CO -0.40 0.44 -0.13 0.93 0.00 0.00 0.00 179.25 180.09 1up8 h GLU 211 N 1.13 0.64 -0.99 0.00 5.08 -1.34 -2.75 114.58 116.35 1up8 h GLU 211 Ca 0.36 -0.27 0.11 0.00 -1.00 0.00 0.00 59.36 58.57 1up8 h GLU 211 Cb 0.01 -0.02 -0.08 0.00 0.50 0.00 0.00 28.75 29.16 1up8 h GLU 211 CO -0.12 0.85 0.62 0.82 -1.00 0.00 0.00 179.01 180.17 1up8 h ILE 212 N 0.41 0.93 -0.02 3.13 2.04 -1.06 -1.56 117.51 121.38 1up8 h ILE 212 Ca 0.07 -0.34 -0.15 0.00 1.00 0.00 0.00 64.86 65.45 1up8 h ILE 212 Cb 0.64 -0.15 -0.02 0.00 -0.74 0.00 0.00 36.82 36.56 1up8 h ILE 212 CO 0.04 0.18 -0.66 -0.09 0.00 0.00 0.00 178.15 177.62 1up8 h ARG 213 N 0.99 0.09 -0.01 2.37 2.43 -1.14 -3.25 114.38 115.86 1up8 h ARG 213 Ca 0.48 -0.07 0.00 0.00 -0.81 0.00 0.00 59.98 59.58 1up8 h ARG 213 Cb 0.46 0.01 0.00 0.00 -0.42 0.00 0.00 29.97 30.02 1up8 h ARG 213 CO -0.26 0.72 -0.53 2.89 -1.51 0.00 0.00 179.97 181.28 1up8 n ARG 214 N -3.78 1.18 -2.05 0.20 1.85 -1.02 -4.97 116.66 108.06 1up8 n ARG 214 Ca -0.02 -0.78 -0.41 0.00 -1.00 0.00 0.00 57.85 55.64 1up8 n ARG 214 Cb 0.66 -1.43 -0.02 0.00 -1.05 0.00 0.00 32.46 30.62 1up8 n ARG 214 CO 0.00 0.00 0.00 0.50 -0.01 0.00 0.00 177.63 178.12 1up8 s ARG 215 N -2.43 4.31 0.10 2.89 3.52 -0.62 -5.02 118.95 121.70 1up8 s ARG 215 Ca 0.15 2.28 0.05 0.00 -0.13 0.00 0.00 55.73 58.09 1up8 s ARG 215 Cb 0.16 -3.06 -0.04 0.00 -1.56 0.00 0.00 34.95 30.45 1up8 s ARG 215 CO 0.58 -0.27 -0.01 1.03 -0.81 0.00 0.00 175.30 175.82 1up8 s ARG 216 N -1.64 2.48 0.00 5.12 0.52 -1.26 -5.06 118.95 119.12 1up8 s ARG 216 Ca 0.51 -0.88 0.00 0.00 -0.52 0.00 0.00 55.73 54.84 1up8 s ARG 216 Cb -0.41 -2.50 0.00 0.00 0.52 0.00 0.00 34.95 32.56 1up8 s ARG 216 CO 0.53 0.53 0.00 0.41 0.02 0.00 0.00 175.30 176.79 1up8 n GLY 217 N 0.52 2.54 3.63 -3.53 0.00 -1.26 -4.26 105.19 102.82 1up8 n GLY 217 Ca -0.11 -1.86 -0.55 0.00 0.00 0.00 0.00 46.02 43.50 1up8 n GLY 217 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1up8 n GLU 218 N 0.00 1.05 -2.89 1.61 -0.58 -1.25 -4.85 120.64 113.74 1up8 n GLU 218 Ca 0.00 0.38 -0.41 0.00 -0.42 0.00 0.00 57.16 56.71 1up8 n GLU 218 Cb 0.00 -2.02 -0.04 0.00 -0.57 0.00 0.00 31.44 28.81 1up8 n GLU 218 CO 0.00 0.00 0.00 0.08 -0.48 0.00 0.00 177.13 176.73 1up8 s VAL 219 N 1.46 4.96 0.36 2.62 1.01 -1.26 -5.00 120.40 124.55 1up8 s VAL 219 Ca 0.90 1.73 0.04 0.00 0.00 0.00 0.00 61.98 64.65 1up8 s VAL 219 Cb -1.02 -4.17 -0.06 0.00 0.00 0.00 0.00 36.38 31.13 1up8 s VAL 219 CO 0.54 0.21 0.06 0.42 0.00 0.00 0.00 175.10 176.33 1up8 s THR 220 N 0.88 1.20 0.37 3.92 -4.23 -1.26 -4.96 115.64 111.56 1up8 s THR 220 Ca 0.44 -2.00 0.06 0.00 -1.18 0.00 0.00 61.69 59.02 1up8 s THR 220 Cb -0.19 -2.72 0.19 0.00 1.34 0.00 0.00 72.50 71.12 1up8 s THR 220 CO 0.23 0.00 1.94 1.62 -0.54 0.00 0.00 174.62 177.86 1up8 h VAL 221 N 1.97 1.16 0.00 2.29 3.04 -1.96 -0.46 116.25 122.29 1up8 h VAL 221 Ca -0.41 -0.61 0.00 0.00 -1.01 0.00 0.00 66.70 64.67 1up8 h VAL 221 Cb 1.25 0.89 0.00 0.00 -2.01 0.00 0.00 31.29 31.42 1up8 h VAL 221 CO 0.69 0.21 0.00 1.23 -1.01 0.00 0.00 177.57 178.70 1up8 h GLY 222 N 0.72 0.00 -0.10 3.17 0.00 -1.97 -3.26 103.07 101.63 1up8 h GLY 222 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.43 1up8 h GLY 222 CO 0.00 0.00 -0.10 1.16 0.00 0.00 0.00 176.54 177.60 1up8 n ASN 223 N -2.94 0.55 -4.65 0.19 0.23 -1.03 -4.91 115.26 102.71 1up8 n ASN 223 Ca 0.01 -0.78 -0.50 0.00 -0.53 0.00 0.00 54.58 52.78 1up8 n ASN 223 Cb 0.31 0.65 -0.05 0.00 -2.08 0.00 0.00 39.78 38.61 1up8 n ASN 223 CO 0.00 0.00 0.00 -0.11 -0.93 0.00 0.00 177.26 176.22 1up8 n LEU 224 N -0.63 2.59 -1.06 -4.53 7.94 -0.21 -1.59 117.00 119.50 1up8 n LEU 224 Ca 0.01 1.07 -0.14 0.00 -1.11 0.00 0.00 56.01 55.85 1up8 n LEU 224 Cb 0.07 -1.30 -0.06 0.00 0.53 0.00 0.00 43.42 42.66 1up8 n LEU 224 CO 0.05 -0.51 -0.13 0.49 -1.11 0.00 0.00 177.39 176.18 1up8 n PHE 225 N 3.97 0.00 -2.92 1.96 0.99 -1.26 -4.99 117.46 115.20 1up8 n PHE 225 Ca 0.20 0.00 -0.21 0.00 -0.00 0.00 0.00 57.45 57.44 1up8 n PHE 225 Cb 0.23 -2.90 0.02 0.00 -1.00 0.00 0.00 39.48 35.84 1up8 n PHE 225 CO 0.00 0.00 0.00 1.03 -0.00 0.00 0.00 176.76 177.79 1up8 s ARG 226 N -3.14 2.82 0.00 -1.08 0.52 -0.62 -5.01 118.95 112.44 1up8 s ARG 226 Ca 0.00 -0.82 0.00 0.00 -0.52 0.00 0.00 55.73 54.39 1up8 s ARG 226 Cb 0.00 -2.61 0.00 0.00 0.52 0.00 0.00 34.95 32.86 1up8 s ARG 226 CO 0.00 -0.40 0.00 0.41 0.02 0.00 0.00 175.30 175.33 1up8 n GLY 227 N -2.08 0.49 0.02 -3.53 0.00 -1.26 -5.06 105.19 93.77 1up8 n GLY 227 Ca 0.05 -1.90 0.01 0.00 0.00 0.00 0.00 46.02 44.18 1up8 n GLY 227 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1up8 n ILE 228 N -1.25 0.70 -2.28 -0.61 -5.35 -1.26 -4.68 119.36 104.62 1up8 n ILE 228 Ca 0.00 -0.73 -0.39 0.00 -0.27 0.00 0.00 62.75 61.36 1up8 n ILE 228 Cb 0.00 0.61 -0.02 0.00 -1.74 0.00 0.00 39.64 38.49 1up8 n ILE 228 CO 0.00 0.00 0.00 -0.76 -1.76 0.00 0.00 176.55 174.03 1up8 s LEU 229 N -0.77 4.25 0.11 7.28 1.43 -1.26 -4.91 118.68 124.80 1up8 s LEU 229 Ca 0.02 2.38 -0.32 0.00 -1.03 0.00 0.00 54.13 55.19 1up8 s LEU 229 Cb 0.02 -3.95 -0.11 0.00 0.03 0.00 0.00 46.19 42.18 1up8 s LEU 229 CO 0.00 -0.62 1.81 -0.81 0.23 0.00 0.00 176.35 176.96 1up8 n PRO 230 N 0.24 2.67 0.00 1.29 -0.04 -1.26 -1.68 135.00 136.22 1up8 n PRO 230 Ca 0.03 0.97 0.00 0.00 -0.04 0.00 0.00 63.50 64.46 1up8 n PRO 230 Cb 0.46 -2.85 0.00 0.00 -0.04 0.00 0.00 33.50 31.07 1up8 n PRO 230 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1up8 n GLY 231 N 4.15 2.15 0.12 0.55 0.00 -1.26 -4.65 105.19 106.25 1up8 n GLY 231 Ca 0.18 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.19 1up8 n GLY 231 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1up8 h SER 232 N 0.53 0.00 -0.20 1.61 0.02 -1.54 -3.05 113.55 110.93 1up8 h SER 232 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1up8 h SER 232 Cb 0.00 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.54 1up8 h SER 232 CO 0.00 0.68 0.00 -0.62 -1.14 0.00 0.00 176.83 175.75 1up8 n GLU 233 N -3.61 1.86 -4.52 3.45 1.02 -1.26 -4.84 120.64 112.74 1up8 n GLU 233 Ca -0.01 -1.30 -0.33 0.00 -0.02 0.00 0.00 57.16 55.50 1up8 n GLU 233 Cb 0.69 -1.41 -0.13 0.00 -0.02 0.00 0.00 31.44 30.57 1up8 n GLU 233 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 1up8 s VAL 234 N -1.75 3.64 0.00 2.62 1.01 -1.15 -4.92 120.40 119.85 1up8 s VAL 234 Ca 0.33 -0.45 0.00 0.00 0.00 0.00 0.00 61.98 61.86 1up8 s VAL 234 Cb 0.18 -2.58 0.00 0.00 0.00 0.00 0.00 36.38 33.99 1up8 s VAL 234 CO 0.27 0.50 0.00 0.61 0.00 0.00 0.00 175.10 176.48 1up8 n GLY 235 N 3.52 -1.69 3.71 4.51 0.00 -1.26 -4.93 105.19 109.03 1up8 n GLY 235 Ca -0.18 -1.34 -0.30 0.00 0.00 0.00 0.00 46.02 44.20 1up8 n GLY 235 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1up8 s PRO 236 N 0.00 1.39 0.10 1.61 0.04 -1.26 -4.96 135.00 131.91 1up8 s PRO 236 Ca 0.00 1.14 -0.18 0.00 0.04 0.00 0.00 61.00 61.99 1up8 s PRO 236 Cb 0.00 -1.80 -0.06 0.00 0.04 0.00 0.00 34.50 32.68 1up8 s PRO 236 CO 0.00 -2.24 1.59 -0.92 0.04 0.00 0.00 177.00 175.47 1up8 h TYR 237 N -1.57 0.47 -3.23 0.56 3.20 -1.91 -3.43 116.97 111.06 1up8 h TYR 237 Ca -0.47 -0.06 -0.58 0.00 3.14 0.00 0.00 58.73 60.76 1up8 h TYR 237 Cb 1.26 -0.13 -0.06 0.00 1.54 0.00 0.00 36.73 39.34 1up8 h TYR 237 CO 0.49 0.53 -0.11 -0.51 -1.64 0.00 0.00 178.16 176.92 1up8 s LEU 238 N -9.65 4.39 0.50 2.82 1.43 -1.26 -4.93 118.68 111.98 1up8 s LEU 238 Ca -0.13 0.99 -0.23 0.00 -1.03 0.00 0.00 54.13 53.73 1up8 s LEU 238 Cb 0.08 -2.75 -0.07 0.00 0.03 0.00 0.00 46.19 43.48 1up8 s LEU 238 CO 0.74 0.14 1.36 -0.24 0.23 0.00 0.00 176.35 178.57 1up8 n SER 239 N 2.74 2.80 -0.20 2.29 2.88 -1.26 -4.88 113.62 117.99 1up8 n SER 239 Ca -0.09 1.03 0.24 0.00 -1.33 0.00 0.00 58.87 58.73 1up8 n SER 239 Cb 0.52 -1.57 0.63 0.00 -0.75 0.00 0.00 64.21 63.04 1up8 n SER 239 CO 0.00 0.00 0.00 1.56 -1.23 0.00 0.00 175.04 175.37 1up8 h GLN 240 N 1.75 0.17 0.00 -1.46 1.08 -1.91 -2.55 115.11 112.18 1up8 h GLN 240 Ca -0.50 -0.01 0.00 0.00 -1.45 0.00 0.00 58.65 56.69 1up8 h GLN 240 Cb 1.29 -0.04 0.00 0.00 -0.05 0.00 0.00 27.48 28.69 1up8 h GLN 240 CO 0.58 0.11 0.00 0.66 -0.95 0.00 0.00 178.83 179.24 1up8 n TYR 241 N -4.38 0.00 0.54 2.96 0.53 -1.26 -1.83 117.16 113.72 1up8 n TYR 241 Ca 0.19 0.00 0.06 0.00 -1.02 0.00 0.00 57.90 57.13 1up8 n TYR 241 Cb 0.84 -0.18 0.04 0.00 -1.03 0.00 0.00 39.34 39.02 1up8 n TYR 241 CO 0.00 0.00 0.00 1.51 -1.02 0.00 0.00 176.86 177.35 1up8 n ILE 242 N -1.18 0.00 0.00 -0.72 3.06 -0.96 -4.50 119.36 115.06 1up8 n ILE 242 Ca 0.16 -0.48 0.00 0.00 -2.50 0.00 0.00 62.75 59.93 1up8 n ILE 242 Cb 0.18 1.25 0.00 0.00 0.54 0.00 0.00 39.64 41.60 1up8 n ILE 242 CO 0.00 0.00 0.00 2.30 -2.50 0.00 0.00 176.55 176.35 1up8 n ILE 243 N 0.57 0.00 -3.14 9.51 -5.35 -1.05 -4.79 119.36 115.10 1up8 n ILE 243 Ca 0.07 0.00 -0.34 0.00 -0.27 0.00 0.00 62.75 62.21 1up8 n ILE 243 Cb 0.31 -0.66 -0.06 0.00 -1.74 0.00 0.00 39.64 37.49 1up8 n ILE 243 CO 0.00 0.00 0.00 0.68 -1.76 0.00 0.00 176.55 175.47 1up8 s VAL 244 N -1.75 4.66 0.00 7.28 -7.23 -0.76 -4.37 120.40 118.23 1up8 s VAL 244 Ca 0.00 1.04 0.00 0.00 -1.81 0.00 0.00 61.98 61.21 1up8 s VAL 244 Cb 0.00 -3.70 0.00 0.00 0.56 0.00 0.00 36.38 33.24 1up8 s VAL 244 CO 0.00 -0.03 0.00 0.61 -0.31 0.00 0.00 175.10 175.37 1up8 n GLY 245 N 0.06 0.02 3.36 2.32 0.00 -0.25 -4.76 105.19 105.94 1up8 n GLY 245 Ca 0.01 -1.67 -0.19 0.00 0.00 0.00 0.00 46.02 44.18 1up8 n GLY 245 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1up8 s SER 246 N -1.00 1.59 0.44 1.61 1.04 -0.77 -4.84 113.70 111.77 1up8 s SER 246 Ca 0.00 -1.44 -0.23 0.00 0.48 0.00 0.00 55.95 54.76 1up8 s SER 246 Cb 0.00 0.20 -0.10 0.00 0.10 0.00 0.00 66.02 66.21 1up8 s SER 246 CO 0.00 -0.76 0.89 1.17 0.98 0.00 0.00 173.24 175.52 1up8 n LYS 247 N -0.56 1.10 -4.28 4.02 4.81 -1.26 -3.88 118.16 118.10 1up8 n LYS 247 Ca -0.01 0.40 -0.24 0.00 -0.87 0.00 0.00 58.31 57.59 1up8 n LYS 247 Cb 0.66 -1.91 -0.08 0.00 0.02 0.00 0.00 35.03 33.72 1up8 n LYS 247 CO 0.00 0.00 0.00 -0.65 1.17 0.00 0.00 177.40 177.92 1up8 s GLN 248 N -1.97 2.27 0.26 1.64 -1.52 -1.26 -4.44 119.66 114.64 1up8 s GLN 248 Ca 0.64 -1.35 -0.31 0.00 -1.95 0.00 0.00 55.36 52.39 1up8 s GLN 248 Cb -0.56 -2.18 -0.13 0.00 -0.22 0.00 0.00 33.01 29.92 1up8 s GLN 248 CO 0.56 0.39 1.38 -0.89 -0.25 0.00 0.00 175.29 176.48 1up8 n ILE 249 N -0.65 1.13 0.00 1.08 2.08 -1.26 -2.11 119.36 119.63 1up8 n ILE 249 Ca -0.08 -0.28 0.00 0.00 0.56 0.00 0.00 62.75 62.95 1up8 n ILE 249 Cb 0.58 -1.48 0.00 0.00 -0.75 0.00 0.00 39.64 37.99 1up8 n ILE 249 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 1up8 n GLY 250 N 1.93 1.91 3.62 7.39 0.00 -1.26 -4.66 105.19 114.11 1up8 n GLY 250 Ca 0.10 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.71 1up8 n GLY 250 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1up8 s SER 251 N -1.47 6.58 0.01 1.61 0.01 -0.90 -2.55 113.70 117.00 1up8 s SER 251 Ca 0.00 0.63 -0.28 0.00 1.31 0.00 0.00 55.95 57.62 1up8 s SER 251 Cb 0.00 -2.35 0.09 0.00 0.21 0.00 0.00 66.02 63.97 1up8 s SER 251 CO 0.00 -0.45 0.76 0.00 0.41 0.00 0.00 173.24 173.97 1up8 s ALA 252 N 2.62 -1.76 -0.22 1.44 0.00 -0.81 -4.88 121.76 118.15 1up8 s ALA 252 Ca 0.27 1.00 -0.04 0.00 0.00 0.00 0.00 51.96 53.20 1up8 s ALA 252 Cb -0.15 0.30 -0.01 0.00 0.00 0.00 0.00 23.12 23.26 1up8 s ALA 252 CO 0.10 -0.58 -0.04 0.99 0.00 0.00 0.00 175.76 176.22 1up8 s THR 253 N -2.58 3.37 -0.31 0.00 2.01 -1.26 -0.87 115.64 116.00 1up8 s THR 253 Ca -0.01 -0.50 0.03 0.00 0.31 0.00 0.00 61.69 61.53 1up8 s THR 253 Cb -0.01 -2.54 0.09 0.00 0.01 0.00 0.00 72.50 70.05 1up8 s THR 253 CO -0.04 0.42 -0.01 -0.69 -0.69 0.00 0.00 174.62 173.61 1up8 s VAL 254 N 1.48 2.26 0.00 3.82 1.01 0.03 -4.98 120.40 124.01 1up8 s VAL 254 Ca 0.06 -2.08 0.00 0.00 0.00 0.00 0.00 61.98 59.96 1up8 s VAL 254 Cb -0.14 -2.55 0.00 0.00 0.00 0.00 0.00 36.38 33.69 1up8 s VAL 254 CO -0.03 -0.39 0.00 0.61 0.00 0.00 0.00 175.10 175.29 1up8 n GLY 255 N 4.32 3.84 0.62 4.51 0.00 -1.26 -1.07 105.19 116.15 1up8 n GLY 255 Ca -0.03 0.20 0.11 0.00 0.00 0.00 0.00 46.02 46.31 1up8 n GLY 255 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1up8 n ASN 256 N 7.23 1.89 -4.63 1.61 0.23 -1.26 -4.92 115.26 115.41 1up8 n ASN 256 Ca 0.00 -1.71 -0.35 0.00 -0.53 0.00 0.00 54.58 52.00 1up8 n ASN 256 Cb 0.00 -0.09 -0.10 0.00 -2.08 0.00 0.00 39.78 37.51 1up8 n ASN 256 CO 0.00 0.00 0.00 -0.75 -0.93 0.00 0.00 177.26 175.58 1up8 s LYS 257 N -1.82 3.58 -0.26 -3.83 2.20 -0.23 -5.10 119.74 114.27 1up8 s LYS 257 Ca 0.34 -0.39 -0.09 0.00 -0.36 0.00 0.00 55.97 55.47 1up8 s LYS 257 Cb 0.19 -3.02 -0.04 0.00 -1.51 0.00 0.00 37.83 33.45 1up8 s LYS 257 CO 0.29 0.43 0.12 0.99 -0.36 0.00 0.00 175.35 176.82 1up8 s THR 258 N -0.10 4.74 -0.03 3.43 2.01 -1.26 -0.79 115.64 123.63 1up8 s THR 258 Ca 0.05 -0.03 -0.02 0.00 0.31 0.00 0.00 61.69 62.00 1up8 s THR 258 Cb -0.12 -3.24 -0.04 0.00 0.01 0.00 0.00 72.50 69.11 1up8 s THR 258 CO 0.02 0.30 0.12 -0.76 -0.69 0.00 0.00 174.62 173.60 1up8 s LEU 259 N 1.68 4.11 -0.13 4.42 1.02 -0.05 -5.01 118.68 124.72 1up8 s LEU 259 Ca 0.07 0.26 0.00 0.00 0.02 0.00 0.00 54.13 54.48 1up8 s LEU 259 Cb -0.15 -2.32 -0.01 0.00 0.02 0.00 0.00 46.19 43.73 1up8 s LEU 259 CO 0.07 0.30 -0.14 -0.69 0.02 0.00 0.00 176.35 175.91 1up8 s VAL 260 N -1.19 2.98 0.34 -1.59 1.01 -1.23 -1.93 120.40 118.80 1up8 s VAL 260 Ca 0.22 -0.68 -0.28 0.00 0.00 0.00 0.00 61.98 61.24 1up8 s VAL 260 Cb -0.12 -2.25 -0.10 0.00 0.00 0.00 0.00 36.38 33.91 1up8 s VAL 260 CO 0.13 0.52 1.28 -0.55 0.00 0.00 0.00 175.10 176.48 1up8 s SER 261 N 0.41 6.73 0.22 3.32 0.15 -1.06 -4.61 113.70 118.86 1up8 s SER 261 Ca -0.11 2.62 0.20 0.00 0.70 0.00 0.00 55.95 59.36 1up8 s SER 261 Cb -0.16 -2.64 0.91 0.00 -1.71 0.00 0.00 66.02 62.41 1up8 s SER 261 CO 0.05 -0.56 1.60 -2.65 1.20 0.00 0.00 173.24 172.89 1up8 n PRO 262 N 0.68 0.14 -0.47 5.44 -0.02 -1.26 -1.84 135.00 137.67 1up8 n PRO 262 Ca 0.01 0.48 0.08 0.00 -2.02 0.00 0.00 63.50 62.05 1up8 n PRO 262 Cb 0.43 -1.82 0.27 0.00 -0.02 0.00 0.00 33.50 32.35 1up8 n PRO 262 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1up8 n ASN 263 N -2.09 3.99 -0.25 2.55 3.02 -1.26 -4.76 115.26 116.46 1up8 n ASN 263 Ca 0.01 -2.91 0.14 0.00 -0.03 0.00 0.00 54.58 51.79 1up8 n ASN 263 Cb 0.14 -0.53 0.43 0.00 -0.61 0.00 0.00 39.78 39.21 1up8 n ASN 263 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1up8 h ALA 264 N 2.07 1.97 0.00 5.41 0.00 -1.74 -0.11 119.26 126.85 1up8 h ALA 264 Ca 0.00 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 1up8 h ALA 264 Cb 1.43 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 19.13 1up8 h ALA 264 CO 0.23 -0.22 -0.05 0.00 0.00 0.00 0.00 179.25 179.21 1up8 h ALA 265 N 1.61 1.21 -0.75 0.00 0.00 -1.86 -2.64 119.26 116.84 1up8 h ALA 265 Ca 0.45 -0.04 0.16 0.00 0.00 0.00 0.00 54.91 55.47 1up8 h ALA 265 Cb 0.86 -0.01 -0.05 0.00 0.00 0.00 0.00 17.79 18.60 1up8 h ALA 265 CO -0.19 0.06 0.50 -0.44 0.00 0.00 0.00 179.25 179.18 1up8 h ASP 266 N 0.00 0.33 -0.78 0.00 3.32 -1.38 -2.04 116.42 115.87 1up8 h ASP 266 Ca -0.00 0.02 0.18 0.00 0.02 0.00 0.00 57.03 57.25 1up8 h ASP 266 Cb 0.20 -0.04 -0.13 0.00 0.22 0.00 0.00 39.33 39.57 1up8 h ASP 266 CO 0.01 0.17 0.07 -0.08 -1.72 0.00 0.00 179.24 177.68 1up8 h GLU 267 N 0.35 0.14 -0.62 3.56 4.81 -1.58 -1.71 114.58 119.53 1up8 h GLU 267 Ca 0.37 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.59 1up8 h GLU 267 Cb 0.93 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 30.28 1up8 h GLU 267 CO -0.11 0.09 0.00 1.19 -0.73 0.00 0.00 179.01 179.45 1up8 n PHE 268 N -5.30 1.11 -1.41 0.92 3.01 -0.77 -1.09 117.46 113.92 1up8 n PHE 268 Ca 0.15 -0.46 0.07 0.00 1.01 0.00 0.00 57.45 58.23 1up8 n PHE 268 Cb 0.52 -0.16 0.11 0.00 -0.01 0.00 0.00 39.48 39.93 1up8 n PHE 268 CO 0.00 0.00 0.00 -3.47 1.01 0.00 0.00 176.76 174.30 1up8 n ASP 269 N 0.93 1.65 0.00 4.37 2.03 -0.67 -4.33 116.55 120.52 1up8 n ASP 269 Ca 0.20 -2.85 0.00 0.00 0.52 0.00 0.00 54.79 52.66 1up8 n ASP 269 Cb 0.68 -0.38 0.00 0.00 -0.72 0.00 0.00 41.12 40.71 1up8 n ASP 269 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1up8 n GLY 270 N -0.97 0.50 3.36 0.27 0.00 -1.18 -4.90 105.19 102.28 1up8 n GLY 270 Ca 0.12 -0.90 -0.39 0.00 0.00 0.00 0.00 46.02 44.85 1up8 n GLY 270 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1up8 s GLU 271 N -2.02 2.88 -0.18 1.61 0.41 -1.02 -0.79 118.70 119.59 1up8 s GLU 271 Ca 0.00 -1.03 -0.28 0.00 -0.41 0.00 0.00 54.97 53.25 1up8 s GLU 271 Cb 0.00 -3.63 -0.00 0.00 -1.78 0.00 0.00 34.13 28.72 1up8 s GLU 271 CO 0.00 -0.63 0.96 0.42 -0.49 0.00 0.00 175.26 175.52 1up8 s ILE 272 N 1.53 4.77 0.06 -1.63 1.01 -0.22 -1.85 121.20 124.87 1up8 s ILE 272 Ca 0.02 1.89 -0.32 0.00 0.00 0.00 0.00 60.65 62.24 1up8 s ILE 272 Cb -0.19 -4.25 -0.11 0.00 0.01 0.00 0.00 42.46 37.93 1up8 s ILE 272 CO 0.05 -0.07 1.87 0.00 0.00 0.00 0.00 174.94 176.80 1up8 n ALA 273 N 5.68 1.68 -3.76 9.38 0.00 -1.26 -1.16 120.51 131.07 1up8 n ALA 273 Ca 0.09 0.28 -0.29 0.00 0.00 0.00 0.00 53.44 53.52 1up8 n ALA 273 Cb 0.48 -2.59 -0.13 0.00 0.00 0.00 0.00 19.45 17.21 1up8 n ALA 273 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.50 177.03 1up8 s TYR 274 N 3.43 2.44 0.00 0.00 6.04 0.54 -4.86 117.35 124.94 1up8 s TYR 274 Ca 0.86 -2.75 0.00 0.00 0.04 0.00 0.00 57.07 55.22 1up8 s TYR 274 Cb -0.52 -2.12 0.00 0.00 -1.04 0.00 0.00 41.96 38.27 1up8 s TYR 274 CO 0.42 -0.73 0.00 0.41 -1.54 0.00 0.00 175.55 174.11 1up8 n GLY 275 N 3.05 4.00 0.90 8.97 0.00 -1.26 -1.96 105.19 118.90 1up8 n GLY 275 Ca 0.13 0.19 0.10 0.00 0.00 0.00 0.00 46.02 46.44 1up8 n GLY 275 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1up8 n SER 276 N 8.46 3.01 -0.68 1.61 7.64 -1.26 -4.92 113.62 127.48 1up8 n SER 276 Ca 0.00 -1.88 0.00 0.00 1.01 0.00 0.00 58.87 58.00 1up8 n SER 276 Cb 0.00 -0.17 0.00 0.00 -1.01 0.00 0.00 64.21 63.03 1up8 n SER 276 CO 0.00 0.00 0.00 2.30 -3.01 0.00 0.00 175.04 174.33 1up8 n ILE 277 N 1.14 0.00 -4.20 0.44 -5.35 -0.83 -5.10 119.36 105.46 1up8 n ILE 277 Ca 0.15 0.00 -0.12 0.00 -0.27 0.00 0.00 62.75 62.51 1up8 n ILE 277 Cb 0.51 -0.41 -0.10 0.00 -1.74 0.00 0.00 39.64 37.89 1up8 n ILE 277 CO 0.00 0.00 0.00 0.42 -1.76 0.00 0.00 176.55 175.21 1up8 s THR 278 N 0.87 0.64 -0.08 7.28 -4.23 -1.26 -0.34 115.64 118.52 1up8 s THR 278 Ca 0.00 -1.95 0.03 0.00 -1.18 0.00 0.00 61.69 58.59 1up8 s THR 278 Cb 0.00 -1.88 -0.02 0.00 1.34 0.00 0.00 72.50 71.94 1up8 s THR 278 CO 0.00 -0.69 -0.18 -0.63 -0.54 0.00 0.00 174.62 172.59 1up8 s ILE 279 N -3.67 2.70 -0.13 2.99 1.01 -0.31 -4.83 121.20 118.96 1up8 s ILE 279 Ca 0.17 -0.83 -0.13 0.00 0.00 0.00 0.00 60.65 59.86 1up8 s ILE 279 Cb 0.06 -2.06 -0.05 0.00 0.01 0.00 0.00 42.46 40.42 1up8 s ILE 279 CO -0.01 0.56 0.31 -0.55 0.00 0.00 0.00 174.94 175.25 1up8 s SER 280 N -0.17 6.51 0.00 3.58 0.15 -1.26 -1.05 113.70 121.45 1up8 s SER 280 Ca -0.01 0.60 0.28 0.00 0.70 0.00 0.00 55.95 57.51 1up8 s SER 280 Cb -0.14 -2.19 1.63 0.00 -1.71 0.00 0.00 66.02 63.62 1up8 s SER 280 CO 0.03 0.16 1.99 0.00 1.20 0.00 0.00 173.24 176.63 1up8 n GLN 281 N 3.11 0.83 -2.76 5.44 1.13 0.03 -4.85 117.38 120.32 1up8 n GLN 281 Ca -0.13 0.00 -0.42 0.00 -1.94 0.00 0.00 57.00 54.51 1up8 n GLN 281 Cb 0.52 -1.50 -0.03 0.00 0.11 0.00 0.00 30.24 29.34 1up8 n GLN 281 CO 0.00 0.00 0.00 1.03 -1.44 0.00 0.00 177.06 176.65 1up8 s ARG 282 N -2.04 4.34 0.24 -1.09 0.52 -1.26 -4.54 118.95 115.12 1up8 s ARG 282 Ca 0.40 1.25 -0.10 0.00 -0.52 0.00 0.00 55.73 56.76 1up8 s ARG 282 Cb 0.19 -3.58 -0.07 0.00 0.52 0.00 0.00 34.95 32.01 1up8 s ARG 282 CO 0.33 -0.39 0.57 0.54 0.02 0.00 0.00 175.30 176.36 1up8 s VAL 283 N 2.34 4.91 0.78 3.52 0.11 -0.08 -4.53 120.40 127.45 1up8 s VAL 283 Ca 0.44 0.50 -0.14 0.00 -2.93 0.00 0.00 61.98 59.85 1up8 s VAL 283 Cb -0.17 -3.62 0.07 0.00 -1.53 0.00 0.00 36.38 31.13 1up8 s VAL 283 CO 0.13 -0.10 1.21 -0.13 -3.33 0.00 0.00 175.10 172.88 1up8 s ARG 284 N -2.88 1.78 -0.34 1.54 1.81 -1.26 -1.96 118.95 117.64 1up8 s ARG 284 Ca 0.48 1.76 -0.04 0.00 -1.72 0.00 0.00 55.73 56.21 1up8 s ARG 284 Cb -0.11 -1.79 0.06 0.00 -0.45 0.00 0.00 34.95 32.66 1up8 s ARG 284 CO 0.21 -2.11 0.09 0.42 -0.68 0.00 0.00 175.30 173.23 1up8 s ILE 285 N -2.09 3.39 0.31 1.52 1.01 -1.26 -4.90 121.20 119.18 1up8 s ILE 285 Ca 0.74 -1.41 -0.28 0.00 0.00 0.00 0.00 60.65 59.69 1up8 s ILE 285 Cb -0.29 -3.01 -0.09 0.00 0.01 0.00 0.00 42.46 39.08 1up8 s ILE 285 CO 0.49 -0.25 1.10 0.00 0.00 0.00 0.00 174.94 176.28 1up8 s ALA 286 N 1.30 3.33 -0.41 9.38 0.00 -1.26 -1.26 121.76 132.84 1up8 s ALA 286 Ca -0.01 0.88 -0.41 0.00 0.00 0.00 0.00 51.96 52.41 1up8 s ALA 286 Cb -0.20 -3.32 -0.16 0.00 0.00 0.00 0.00 23.12 19.43 1up8 s ALA 286 CO -0.00 -0.21 1.96 2.41 0.00 0.00 0.00 175.76 179.93 1up8 n THR 287 N 0.88 0.12 -1.72 0.00 -1.04 -0.68 -4.76 114.28 107.08 1up8 n THR 287 Ca 0.00 -0.08 -0.42 0.00 -2.04 0.00 0.00 64.05 61.52 1up8 n THR 287 Cb 0.46 -0.95 -0.01 0.00 -1.82 0.00 0.00 70.33 68.01 1up8 n THR 287 CO 0.00 0.00 0.00 -2.65 -0.64 0.00 0.00 175.07 171.78 1up8 n PRO 288 N 6.55 2.30 0.00 -2.82 -0.02 -1.26 -2.76 135.00 136.99 1up8 n PRO 288 Ca 0.41 0.81 0.00 0.00 -2.02 0.00 0.00 63.50 62.69 1up8 n PRO 288 Cb 0.06 -2.44 0.00 0.00 -0.02 0.00 0.00 33.50 31.10 1up8 n PRO 288 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1up8 n GLY 289 N 0.77 2.70 3.55 -1.23 0.00 -1.26 -4.99 105.19 104.72 1up8 n GLY 289 Ca 0.04 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.64 1up8 n GLY 289 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1up8 s ARG 290 N -0.13 3.53 0.41 1.61 3.52 -1.11 -5.04 118.95 121.74 1up8 s ARG 290 Ca 0.00 -0.22 0.07 0.00 -0.13 0.00 0.00 55.73 55.46 1up8 s ARG 290 Cb 0.00 -3.85 -0.06 0.00 -1.56 0.00 0.00 34.95 29.49 1up8 s ARG 290 CO 0.00 -0.74 0.14 -0.51 -0.81 0.00 0.00 175.30 173.38 1up8 s ASP 291 N 1.81 4.29 0.22 -2.12 1.01 -1.26 -4.94 116.67 115.68 1up8 s ASP 291 Ca 0.20 -1.14 0.05 0.00 0.71 0.00 0.00 52.55 52.36 1up8 s ASP 291 Cb -0.15 -0.46 -0.05 0.00 1.01 0.00 0.00 42.92 43.26 1up8 s ASP 291 CO 0.14 -0.51 -0.06 -0.36 0.21 0.00 0.00 175.17 174.59 1up8 s PHE 292 N -2.62 1.63 -1.29 4.23 0.40 0.22 -4.85 117.98 115.69 1up8 s PHE 292 Ca 0.40 -0.77 -0.08 0.00 -0.60 0.00 0.00 56.93 55.87 1up8 s PHE 292 Cb 0.05 -0.89 0.01 0.00 0.51 0.00 0.00 43.02 42.71 1up8 s PHE 292 CO 0.21 0.14 1.09 -1.33 0.70 0.00 0.00 175.22 176.03 1up8 n MET 293 N -0.41 -7.36 0.00 0.44 2.81 -1.26 -1.57 117.12 109.78 1up8 n MET 293 Ca -0.07 0.79 0.11 0.00 -1.81 0.00 0.00 57.70 56.72 1up8 n MET 293 Cb 0.62 -5.69 0.04 0.00 -0.71 0.00 0.00 33.22 27.49 1up8 n MET 293 CO 0.00 0.00 0.00 0.25 1.51 0.00 0.00 175.97 177.73 1up8 n THR 294 N -4.85 0.00 -4.34 2.03 -2.24 -1.26 -4.72 114.28 98.90 1up8 n THR 294 Ca 0.00 -0.39 -0.34 0.00 -2.27 0.00 0.00 64.05 61.06 1up8 n THR 294 Cb 0.56 1.35 -0.13 0.00 -2.10 0.00 0.00 70.33 70.01 1up8 n THR 294 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1up8 s ASP 295 N -2.09 4.49 0.23 3.42 -1.08 -1.26 -4.82 116.67 115.57 1up8 s ASP 295 Ca 0.21 -0.25 -0.06 0.00 -0.52 0.00 0.00 52.55 51.93 1up8 s ASP 295 Cb 0.18 -1.74 0.40 0.00 -1.46 0.00 0.00 42.92 40.30 1up8 s ASP 295 CO 0.41 0.11 1.71 0.25 0.52 0.00 0.00 175.17 178.17 1up8 h LEU 296 N 7.13 0.11 -0.52 -1.34 5.85 -1.96 0.64 115.31 125.22 1up8 h LEU 296 Ca -0.33 0.12 -0.00 0.00 0.84 0.00 0.00 57.88 58.51 1up8 h LEU 296 Cb 1.19 0.14 -0.03 0.00 0.37 0.00 0.00 40.66 42.33 1up8 h LEU 296 CO 0.60 0.03 0.31 0.11 -0.34 0.00 0.00 178.44 179.16 1up8 h LYS 297 N 0.33 0.71 -0.41 1.25 1.57 -1.96 0.23 116.57 118.30 1up8 h LYS 297 Ca 0.38 -0.07 -0.03 0.00 -1.87 0.00 0.00 60.65 59.06 1up8 h LYS 297 Cb 0.60 -0.15 -0.02 0.00 0.08 0.00 0.00 32.23 32.74 1up8 h LYS 297 CO -0.43 0.52 0.14 0.28 -0.57 0.00 0.00 179.45 179.39 1up8 h VAL 298 N 0.70 1.21 -0.34 0.50 2.07 -1.84 -1.99 116.25 116.57 1up8 h VAL 298 Ca 0.19 -0.70 0.04 0.00 0.82 0.00 0.00 66.70 67.05 1up8 h VAL 298 Cb -0.00 0.89 -0.03 0.00 -1.52 0.00 0.00 31.29 30.63 1up8 h VAL 298 CO -0.03 0.25 0.13 0.15 0.02 0.00 0.00 177.57 178.09 1up8 h PHE 299 N 0.53 0.24 -0.39 1.57 3.57 -0.50 -1.71 116.94 120.26 1up8 h PHE 299 Ca 0.13 0.02 -0.09 0.00 3.53 0.00 0.00 57.97 61.56 1up8 h PHE 299 Cb 0.25 -0.06 -0.02 0.00 2.79 0.00 0.00 35.95 38.91 1up8 h PHE 299 CO 0.01 0.11 -0.11 -0.07 -2.23 0.00 0.00 178.31 176.01 1up8 h LEU 300 N 0.29 0.67 -0.97 0.59 3.38 -0.50 -1.88 115.31 116.89 1up8 h LEU 300 Ca 0.15 -0.19 -0.06 0.00 0.09 0.00 0.00 57.88 57.87 1up8 h LEU 300 Cb 0.11 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.66 1up8 h LEU 300 CO -0.14 0.81 0.06 0.44 0.09 0.00 0.00 178.44 179.70 1up8 h ASP 301 N 0.62 0.77 -0.76 -0.43 3.32 -0.98 -0.81 116.42 118.15 1up8 h ASP 301 Ca 0.11 -0.16 -0.02 0.00 0.02 0.00 0.00 57.03 56.97 1up8 h ASP 301 Cb 0.56 -0.20 -0.04 0.00 0.22 0.00 0.00 39.33 39.87 1up8 h ASP 301 CO 0.03 0.80 0.38 0.58 -1.72 0.00 0.00 179.24 179.31 1up8 h VAL 302 N 0.77 1.24 0.00 -1.35 2.07 -0.93 -0.10 116.25 117.95 1up8 h VAL 302 Ca 0.16 -0.66 -0.02 0.00 0.82 0.00 0.00 66.70 67.00 1up8 h VAL 302 Cb 0.38 0.27 -0.00 0.00 -1.52 0.00 0.00 31.29 30.41 1up8 h VAL 302 CO 0.01 0.28 -0.11 1.56 0.02 0.00 0.00 177.57 179.33 1up8 h GLN 303 N 1.07 0.00 -0.67 1.57 1.08 -0.78 -1.03 115.11 116.35 1up8 h GLN 303 Ca 0.26 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.46 1up8 h GLN 303 Cb 0.10 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.53 1up8 h GLN 303 CO -0.04 0.11 0.00 -0.25 -0.95 0.00 0.00 178.83 177.71 1up8 n ASP 304 N -3.34 4.62 0.00 1.46 8.00 -0.36 -0.29 116.55 126.64 1up8 n ASP 304 Ca -0.00 -2.70 0.00 0.00 0.71 0.00 0.00 54.79 52.80 1up8 n ASP 304 Cb 0.32 -0.64 0.00 0.00 -0.02 0.00 0.00 41.12 40.78 1up8 n ASP 304 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1up8 n ALA 305 N 0.51 0.00 -2.16 2.24 0.00 -0.39 -3.93 120.51 116.78 1up8 n ALA 305 Ca 0.21 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 53.23 1up8 n ALA 305 Cb 0.97 -0.31 -0.03 0.00 0.00 0.00 0.00 19.45 20.08 1up8 n ALA 305 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1up8 s ALA 306 N -2.00 3.61 -1.03 0.00 0.00 -0.11 -1.79 121.76 120.45 1up8 s ALA 306 Ca 0.00 0.88 -0.19 0.00 0.00 0.00 0.00 51.96 52.65 1up8 s ALA 306 Cb 0.00 -3.65 0.11 0.00 0.00 0.00 0.00 23.12 19.58 1up8 s ALA 306 CO 0.00 -1.08 1.31 0.34 0.00 0.00 0.00 175.76 176.33 1up8 s ASP 307 N 2.30 6.67 0.00 0.00 -1.08 -0.84 -4.65 116.67 119.07 1up8 s ASP 307 Ca 0.66 -2.04 0.15 0.00 -0.52 0.00 0.00 52.55 50.80 1up8 s ASP 307 Cb -0.32 -2.46 0.66 0.00 -1.46 0.00 0.00 42.92 39.34 1up8 s ASP 307 CO 0.26 -1.16 1.46 0.49 0.52 0.00 0.00 175.17 176.75 1up8 n PHE 308 N 7.25 0.17 -1.66 -5.34 3.01 -1.26 -4.85 117.46 114.77 1up8 n PHE 308 Ca 0.30 -0.08 -0.48 0.00 1.01 0.00 0.00 57.45 58.20 1up8 n PHE 308 Cb 0.48 0.00 -0.05 0.00 -0.01 0.00 0.00 39.48 39.91 1up8 n PHE 308 CO 0.00 0.00 0.00 0.54 1.01 0.00 0.00 176.76 178.31 1up8 n ARG 309 N -0.08 1.95 -0.44 -1.08 1.74 -1.26 -2.60 116.66 114.88 1up8 n ARG 309 Ca 0.12 0.71 0.00 0.00 -0.77 0.00 0.00 57.85 57.91 1up8 n ARG 309 Cb 0.20 -2.46 0.00 0.00 -1.02 0.00 0.00 32.46 29.18 1up8 n ARG 309 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1up8 n GLY 310 N 3.42 0.77 0.01 -0.13 0.00 -1.26 -4.97 105.19 103.03 1up8 n GLY 310 Ca 0.18 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.33 1up8 n GLY 310 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1up8 n PHE 311 N -2.35 0.00 -1.63 1.61 7.35 -1.07 -4.93 117.46 116.43 1up8 n PHE 311 Ca 0.00 0.00 -0.35 0.00 -0.76 0.00 0.00 57.45 56.34 1up8 n PHE 311 Cb 0.00 -0.35 0.07 0.00 0.35 0.00 0.00 39.48 39.55 1up8 n PHE 311 CO 0.00 0.00 0.00 -1.21 -0.76 0.00 0.00 176.76 174.79 1up8 s GLU 312 N -2.94 2.46 0.30 -4.13 8.01 -1.26 -5.04 118.70 116.10 1up8 s GLU 312 Ca 0.14 1.73 0.08 0.00 0.01 0.00 0.00 54.97 56.93 1up8 s GLU 312 Cb 0.18 -1.87 -0.04 0.00 -4.31 0.00 0.00 34.13 28.09 1up8 s GLU 312 CO 0.60 -1.58 0.15 -1.54 0.01 0.00 0.00 175.26 172.90 1up8 s SER 313 N -1.99 4.96 -0.01 -0.19 1.04 -1.26 -5.09 113.70 111.16 1up8 s SER 313 Ca 0.74 -0.56 -0.03 0.00 0.48 0.00 0.00 55.95 56.58 1up8 s SER 313 Cb -0.28 -0.97 0.00 0.00 0.10 0.00 0.00 66.02 64.87 1up8 s SER 313 CO 0.41 -0.17 0.07 -0.31 0.98 0.00 0.00 173.24 174.22 1up8 s TYR 314 N -2.31 0.02 0.73 5.02 1.51 -1.26 -1.68 117.35 119.37 1up8 s TYR 314 Ca 0.35 -0.03 -0.12 0.00 -1.01 0.00 0.00 57.07 56.26 1up8 s TYR 314 Cb -0.05 -0.04 0.03 0.00 -0.11 0.00 0.00 41.96 41.79 1up8 s TYR 314 CO 0.23 -0.13 1.10 -1.21 -1.11 0.00 0.00 175.55 174.43 1up8 s GLU 315 N -0.60 2.46 0.57 -0.62 0.41 -0.39 -4.84 118.70 115.69 1up8 s GLU 315 Ca -0.07 1.27 -0.18 0.00 -0.41 0.00 0.00 54.97 55.58 1up8 s GLU 315 Cb -0.04 -1.92 -0.05 0.00 -1.78 0.00 0.00 34.13 30.35 1up8 s GLU 315 CO 0.00 -1.50 1.10 -2.14 -0.49 0.00 0.00 175.26 172.24 1up8 s PRO 316 N -4.56 3.28 0.63 0.39 0.02 -1.26 -4.52 135.00 128.98 1up8 s PRO 316 Ca 0.64 1.47 0.00 0.00 0.02 0.00 0.00 61.00 63.13 1up8 s PRO 316 Cb -0.19 -2.01 0.00 0.00 0.02 0.00 0.00 34.50 32.33 1up8 s PRO 316 CO 0.50 -0.88 0.00 0.41 -0.33 0.00 0.00 177.00 176.69 1up8 n GLY 317 N -0.20 -1.02 3.45 0.52 0.00 -1.26 -4.94 105.19 101.74 1up8 n GLY 317 Ca 0.11 -1.74 -0.12 0.00 0.00 0.00 0.00 46.02 44.26 1up8 n GLY 317 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1up8 s ALA 318 N -1.74 -1.67 -0.04 4.61 0.00 -1.26 -4.41 121.76 117.26 1up8 s ALA 318 Ca 0.00 0.72 -0.28 0.00 0.00 0.00 0.00 51.96 52.40 1up8 s ALA 318 Cb 0.00 0.64 0.06 0.00 0.00 0.00 0.00 23.12 23.82 1up8 s ALA 318 CO 0.00 -0.68 0.61 -0.98 0.00 0.00 0.00 175.76 174.70 1up8 s ARG 319 N -3.19 0.99 0.50 0.00 1.70 -0.83 -4.87 118.95 113.26 1up8 s ARG 319 Ca -0.00 0.15 -0.22 0.00 -0.47 0.00 0.00 55.73 55.19 1up8 s ARG 319 Cb -0.01 0.46 -0.08 0.00 -0.57 0.00 0.00 34.95 34.75 1up8 s ARG 319 CO -0.08 -0.31 0.97 1.28 -1.08 0.00 0.00 175.30 176.08 1up8 n LEU 320 N 0.93 2.95 -4.68 -1.89 4.77 -1.26 -0.91 117.00 116.91 1up8 n LEU 320 Ca -0.19 0.93 -0.50 0.00 -0.03 0.00 0.00 56.01 56.22 1up8 n LEU 320 Cb 0.57 -1.36 -0.05 0.00 -2.33 0.00 0.00 43.42 40.25 1up8 n LEU 320 CO 0.23 -1.68 1.41 -0.38 -1.33 0.00 0.00 177.39 175.64 1up8 n ILE 321 N -1.01 0.45 -0.03 -0.08 5.41 -1.26 -4.84 119.36 118.01 1up8 n ILE 321 Ca 0.11 -0.08 -0.06 0.00 1.00 0.00 0.00 62.75 63.72 1up8 n ILE 321 Cb 0.43 -1.70 -0.02 0.00 -0.71 0.00 0.00 39.64 37.64 1up8 n ILE 321 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 176.55 175.41 1up8 n ARG 322 N 5.92 0.12 -4.09 0.38 0.63 -1.26 -4.91 116.66 113.45 1up8 n ARG 322 Ca 0.22 0.05 -0.23 0.00 -0.92 0.00 0.00 57.85 56.97 1up8 n ARG 322 Cb 0.27 -0.71 -0.06 0.00 0.45 0.00 0.00 32.46 32.40 1up8 n ARG 322 CO 0.00 0.00 0.00 0.95 -2.51 0.00 0.00 177.63 176.07 1up8 s THR 323 N -2.10 2.83 0.24 5.15 -4.23 -1.26 -1.96 115.64 114.30 1up8 s THR 323 Ca -0.08 -1.69 -0.07 0.00 -1.18 0.00 0.00 61.69 58.67 1up8 s THR 323 Cb 0.03 -2.97 0.23 0.00 1.34 0.00 0.00 72.50 71.13 1up8 s THR 323 CO 0.10 -0.14 1.67 0.40 -0.54 0.00 0.00 174.62 176.12 1up8 h ILE 324 N 1.51 0.49 -0.72 2.99 2.04 -1.44 -0.60 117.51 121.77 1up8 h ILE 324 Ca -0.43 -0.07 0.11 0.00 1.00 0.00 0.00 64.86 65.46 1up8 h ILE 324 Cb 1.25 0.26 -0.05 0.00 -0.74 0.00 0.00 36.82 37.54 1up8 h ILE 324 CO 0.64 0.04 0.48 -0.09 0.00 0.00 0.00 178.15 179.22 1up8 h ARG 325 N 0.21 0.55 -0.08 2.37 2.43 -1.41 -2.24 114.38 116.21 1up8 h ARG 325 Ca 0.39 -0.03 -0.06 0.00 -0.81 0.00 0.00 59.98 59.47 1up8 h ARG 325 Cb 0.67 -0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 30.08 1up8 h ARG 325 CO -0.53 0.37 -0.22 -0.44 -1.51 0.00 0.00 179.97 177.63 1up8 h ASP 326 N 0.57 0.14 -0.21 -3.80 3.32 -1.39 -1.25 116.42 113.80 1up8 h ASP 326 Ca 0.34 -0.03 -0.17 0.00 0.02 0.00 0.00 57.03 57.18 1up8 h ASP 326 Cb 0.55 -0.04 0.00 0.00 0.22 0.00 0.00 39.33 40.07 1up8 h ASP 326 CO -0.12 0.37 -0.55 0.25 -1.72 0.00 0.00 179.24 177.47 1up8 h LEU 327 N 0.13 0.84 -0.80 1.55 5.85 -1.30 -1.41 115.31 120.18 1up8 h LEU 327 Ca 0.02 -0.58 0.09 0.00 0.84 0.00 0.00 57.88 58.26 1up8 h LEU 327 Cb 0.47 -0.25 -0.07 0.00 0.37 0.00 0.00 40.66 41.19 1up8 h LEU 327 CO 0.03 1.27 0.45 0.00 -0.34 0.00 0.00 178.44 179.86 1up8 h ALA 328 N 0.60 1.13 -0.66 1.25 0.00 -1.22 -2.29 119.26 118.06 1up8 h ALA 328 Ca -0.01 0.03 -0.07 0.00 0.00 0.00 0.00 54.91 54.86 1up8 h ALA 328 Cb 1.17 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.80 1up8 h ALA 328 CO 0.12 0.09 0.14 1.15 0.00 0.00 0.00 179.25 180.76 1up8 h THR 329 N 0.78 1.26 -0.50 0.00 2.02 -1.12 -2.40 112.91 112.95 1up8 h THR 329 Ca 0.38 -0.98 0.09 0.00 0.77 0.00 0.00 66.41 66.67 1up8 h THR 329 Cb 0.33 0.62 -0.08 0.00 -1.74 0.00 0.00 68.15 67.28 1up8 h THR 329 CO -0.24 0.37 0.05 -0.25 0.37 0.00 0.00 175.52 175.83 1up8 h TRP 330 N 0.99 0.07 -0.15 3.16 7.01 -0.71 -2.30 115.95 124.03 1up8 h TRP 330 Ca 0.20 0.03 0.00 0.00 2.11 0.00 0.00 58.89 61.24 1up8 h TRP 330 Cb 0.39 0.05 0.00 0.00 -2.10 0.00 0.00 29.16 27.50 1up8 h TRP 330 CO 0.03 -0.06 0.00 1.33 -2.79 0.00 0.00 178.44 176.95 1up8 n VAL 331 N -5.17 0.19 0.08 2.65 0.24 -0.99 -3.28 118.33 112.04 1up8 n VAL 331 Ca 0.06 -0.29 -0.09 0.00 -2.04 0.00 0.00 64.34 61.97 1up8 n VAL 331 Cb 0.26 0.26 0.00 0.00 -1.47 0.00 0.00 33.84 32.89 1up8 n VAL 331 CO 0.00 0.00 0.00 -0.74 -2.14 0.00 0.00 176.83 173.95 1up8 h HIS 332 N 1.84 0.38 0.00 6.34 6.17 -0.90 -3.40 115.15 125.57 1up8 h HIS 332 Ca 0.00 -0.19 0.00 0.00 0.71 0.00 0.00 60.37 60.89 1up8 h HIS 332 Cb 0.40 -0.05 0.00 0.00 2.52 0.00 0.00 27.41 30.29 1up8 h HIS 332 CO 0.09 0.99 0.00 1.19 0.71 0.00 0.00 177.93 180.91 1up8 n PHE 333 N -3.72 0.00 -1.69 5.26 3.01 -1.24 -5.09 117.46 113.99 1up8 n PHE 333 Ca -0.04 -0.01 -0.40 0.00 1.01 0.00 0.00 57.45 58.01 1up8 n PHE 333 Cb 0.78 -0.00 0.02 0.00 -0.01 0.00 0.00 39.48 40.27 1up8 n PHE 333 CO 0.00 0.00 0.00 -0.40 1.01 0.00 0.00 176.76 177.37 1up8 n ASP 334 N -0.01 2.29 -4.33 4.37 5.75 -1.21 -4.87 116.55 118.54 1up8 n ASP 334 Ca 0.00 1.06 -0.44 0.00 -0.01 0.00 0.00 54.79 55.40 1up8 n ASP 334 Cb 0.14 -1.49 0.00 0.00 -1.03 0.00 0.00 41.12 38.74 1up8 n ASP 334 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1up8 n ALA 335 N -0.49 4.23 -0.61 2.12 0.00 -1.26 -4.93 120.51 119.57 1up8 n ALA 335 Ca 0.08 -4.28 0.00 0.00 0.00 0.00 0.00 53.44 49.24 1up8 n ALA 335 Cb 0.41 -3.01 0.00 0.00 0.00 0.00 0.00 19.45 16.85 1up8 n ALA 335 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 1up8 n LEU 336 N 5.12 0.00 -0.87 0.00 7.94 -1.26 -1.68 117.00 126.25 1up8 n LEU 336 Ca 0.37 0.00 0.07 0.00 -1.11 0.00 0.00 56.01 55.34 1up8 n LEU 336 Cb 0.41 0.00 0.20 0.00 0.53 0.00 0.00 43.42 44.56 1up8 n LEU 336 CO 0.66 0.00 0.66 0.00 -1.11 0.00 0.00 177.39 177.60 1up8 n TYR 337 N 0.00 0.66 -0.36 1.96 0.18 -1.26 -4.68 117.16 113.66 1up8 n TYR 337 Ca 0.00 -0.31 -0.05 0.00 1.88 0.00 0.00 57.90 59.42 1up8 n TYR 337 Cb 0.00 -0.04 -0.01 0.00 -0.38 0.00 0.00 39.34 38.91 1up8 n TYR 337 CO 0.00 0.00 0.00 1.49 -2.08 0.00 0.00 176.86 176.27 1up8 h GLU 338 N 2.55 -0.05 -0.88 -3.48 4.81 -1.69 -1.05 114.58 114.79 1up8 h GLU 338 Ca 0.00 0.00 0.09 0.00 -0.13 0.00 0.00 59.36 59.32 1up8 h GLU 338 Cb 0.67 0.01 -0.07 0.00 0.63 0.00 0.00 28.75 29.99 1up8 h GLU 338 CO 0.03 -0.03 0.53 0.00 -0.73 0.00 0.00 179.01 178.81 1up8 h ALA 339 N 0.97 1.26 0.18 2.92 0.00 -1.88 -1.20 119.26 121.51 1up8 h ALA 339 Ca 0.26 0.02 -0.31 0.00 0.00 0.00 0.00 54.91 54.88 1up8 h ALA 339 Cb 0.54 -0.18 0.01 0.00 0.00 0.00 0.00 17.79 18.16 1up8 h ALA 339 CO -0.91 0.18 -1.42 1.88 0.00 0.00 0.00 179.25 178.98 1up8 h TYR 340 N 0.90 0.68 -0.85 0.00 -1.99 -1.69 -1.57 116.97 112.44 1up8 h TYR 340 Ca 0.42 -0.49 0.05 0.00 2.00 0.00 0.00 58.73 60.70 1up8 h TYR 340 Cb 0.34 -0.03 -0.06 0.00 2.00 0.00 0.00 36.73 38.99 1up8 h TYR 340 CO -0.04 1.43 0.54 1.25 -0.00 0.00 0.00 178.16 181.34 1up8 h LEU 341 N 0.10 0.86 -0.07 3.88 5.85 -1.03 0.24 115.31 125.14 1up8 h LEU 341 Ca -0.21 0.01 -0.02 0.00 0.84 0.00 0.00 57.88 58.49 1up8 h LEU 341 Cb 2.06 -0.18 -0.00 0.00 0.37 0.00 0.00 40.66 42.91 1up8 h LEU 341 CO 0.22 0.57 -0.05 0.78 -0.34 0.00 0.00 178.44 179.62 1up8 h ASN 342 N 1.01 0.17 -0.62 1.25 -0.26 -1.13 -0.00 115.58 116.00 1up8 h ASN 342 Ca 0.36 -0.45 0.11 0.00 -0.56 0.00 0.00 56.30 55.76 1up8 h ASN 342 Cb 0.10 -0.05 -0.08 0.00 -1.06 0.00 0.00 38.32 37.23 1up8 h ASN 342 CO -0.15 0.58 0.18 0.00 -1.06 0.00 0.00 177.43 176.99 1up8 h ALA 343 N 0.59 0.78 -0.61 -0.83 0.00 -1.17 -1.11 119.26 116.90 1up8 h ALA 343 Ca 0.01 0.11 0.06 0.00 0.00 0.00 0.00 54.91 55.09 1up8 h ALA 343 Cb 0.53 0.13 -0.05 0.00 0.00 0.00 0.00 17.79 18.39 1up8 h ALA 343 CO 0.01 -0.26 0.33 0.00 0.00 0.00 0.00 179.25 179.33 1up8 h LEU 345 N 0.61 1.08 -0.25 0.00 3.38 -0.14 -0.75 115.31 119.24 1up8 h LEU 345 Ca 0.28 -0.23 -0.00 0.00 0.09 0.00 0.00 57.88 58.02 1up8 h LEU 345 Cb 0.18 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.63 1up8 h LEU 345 CO -0.18 1.03 0.14 0.40 0.09 0.00 0.00 178.44 179.92 1up8 h ILE 346 N 1.08 1.10 -0.74 1.22 2.04 -0.89 -1.95 117.51 119.37 1up8 h ILE 346 Ca 0.23 -0.26 0.03 0.00 1.00 0.00 0.00 64.86 65.86 1up8 h ILE 346 Cb 0.36 0.83 -0.05 0.00 -0.74 0.00 0.00 36.82 37.23 1up8 h ILE 346 CO 0.00 0.10 0.47 -0.07 0.00 0.00 0.00 178.15 178.65 1up8 h LEU 347 N 0.30 0.77 -0.23 1.44 3.38 -0.69 -1.40 115.31 118.87 1up8 h LEU 347 Ca 0.09 -0.00 -0.04 0.00 0.09 0.00 0.00 57.88 58.02 1up8 h LEU 347 Cb 0.04 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.61 1up8 h LEU 347 CO -0.02 0.53 -0.01 -0.07 0.09 0.00 0.00 178.44 178.96 1up8 h LEU 348 N 0.91 0.41 -1.08 1.67 3.38 -1.02 -2.36 115.31 117.22 1up8 h LEU 348 Ca 0.30 -0.33 -0.02 0.00 0.09 0.00 0.00 57.88 57.92 1up8 h LEU 348 Cb 0.03 -0.11 -0.03 0.00 0.09 0.00 0.00 40.66 40.63 1up8 h LEU 348 CO -0.11 0.64 0.34 0.00 0.09 0.00 0.00 178.44 179.39 1up8 h ALA 349 N 0.79 1.28 -0.00 1.53 0.00 -1.26 -1.94 119.26 119.66 1up8 h ALA 349 Ca 0.06 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1up8 h ALA 349 Cb 0.44 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 17.95 1up8 h ALA 349 CO 0.01 0.56 -0.01 0.09 0.00 0.00 0.00 179.25 179.90 1up8 n ASN 350 N -4.34 0.21 -1.30 0.00 3.02 -0.54 -4.66 115.26 107.66 1up8 n ASN 350 Ca 0.07 -0.90 -0.12 0.00 -0.03 0.00 0.00 54.58 53.60 1up8 n ASN 350 Cb 0.13 -0.05 -0.01 0.00 -0.61 0.00 0.00 39.78 39.25 1up8 n ASN 350 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1up8 n GLY 351 N 1.09 -0.03 3.70 7.41 0.00 -0.73 -4.98 105.19 111.65 1up8 n GLY 351 Ca 0.21 -0.40 -0.42 0.00 0.00 0.00 0.00 46.02 45.41 1up8 n GLY 351 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1up8 s VAL 352 N -2.57 2.52 0.62 1.61 1.01 -0.92 -4.96 120.40 117.71 1up8 s VAL 352 Ca 0.00 0.19 -0.18 0.00 0.00 0.00 0.00 61.98 61.99 1up8 s VAL 352 Cb 0.00 -3.12 -0.02 0.00 0.00 0.00 0.00 36.38 33.23 1up8 s VAL 352 CO 0.00 0.01 1.23 -2.16 0.00 0.00 0.00 175.10 174.17 1up8 s PRO 353 N 2.09 2.80 0.79 2.72 0.04 -1.26 -4.85 135.00 137.32 1up8 s PRO 353 Ca 0.76 1.87 -0.11 0.00 0.04 0.00 0.00 61.00 63.55 1up8 s PRO 353 Cb -0.45 -1.90 0.06 0.00 0.04 0.00 0.00 34.50 32.25 1up8 s PRO 353 CO 0.34 -1.35 1.10 -0.06 0.04 0.00 0.00 177.00 177.06 1up8 s PHE 354 N -1.60 2.88 -0.31 0.56 2.99 -1.26 -1.67 117.98 119.58 1up8 s PHE 354 Ca 0.78 1.14 -0.42 0.00 0.00 0.00 0.00 56.93 58.43 1up8 s PHE 354 Cb -0.32 -3.12 -0.17 0.00 0.00 0.00 0.00 43.02 39.42 1up8 s PHE 354 CO 0.36 -1.71 1.69 -3.47 -0.00 0.00 0.00 175.22 172.09 1up8 n ASP 355 N -3.38 2.06 0.00 1.36 -0.08 0.10 -3.77 116.55 112.84 1up8 n ASP 355 Ca 0.07 1.10 0.06 0.00 -1.51 0.00 0.00 54.79 54.51 1up8 n ASP 355 Cb 0.56 -1.08 0.28 0.00 2.34 0.00 0.00 41.12 43.22 1up8 n ASP 355 CO 0.00 0.00 0.00 -0.81 0.12 0.00 0.00 177.20 176.51 1up8 n PRO 356 N 4.90 0.02 -0.04 -0.67 -0.04 -1.26 -2.16 135.00 135.74 1up8 n PRO 356 Ca 0.27 0.27 0.11 0.00 -0.04 0.00 0.00 63.50 64.11 1up8 n PRO 356 Cb 0.09 -1.50 0.48 0.00 -0.04 0.00 0.00 33.50 32.53 1up8 n PRO 356 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1up8 n ASN 357 N -1.48 1.19 -4.89 3.54 3.02 -1.26 -4.85 115.26 110.53 1up8 n ASN 357 Ca 0.03 -1.56 -0.30 0.00 -0.03 0.00 0.00 54.58 52.73 1up8 n ASN 357 Cb 0.14 -0.06 0.04 0.00 -0.61 0.00 0.00 39.78 39.30 1up8 n ASN 357 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1up8 s LEU 358 N -1.69 2.94 0.57 3.41 1.43 -0.92 -2.77 118.68 121.65 1up8 s LEU 358 Ca 0.34 1.07 -0.14 0.00 -1.03 0.00 0.00 54.13 54.37 1up8 s LEU 358 Cb 0.18 -3.87 -0.05 0.00 0.03 0.00 0.00 46.19 42.48 1up8 s LEU 358 CO 0.28 -1.31 1.02 -2.16 0.23 0.00 0.00 176.35 174.40 1up8 s PRO 359 N -5.32 3.66 -0.37 1.29 0.05 -1.26 -4.30 135.00 128.75 1up8 s PRO 359 Ca 0.58 0.94 0.00 0.00 0.05 0.00 0.00 61.00 62.56 1up8 s PRO 359 Cb -0.11 -2.09 0.00 0.00 0.05 0.00 0.00 34.50 32.35 1up8 s PRO 359 CO 0.51 -0.52 0.00 1.19 0.05 0.00 0.00 177.00 178.23 1up8 n PHE 360 N -2.12 0.00 1.78 0.56 0.99 -1.26 -4.89 117.46 112.52 1up8 n PHE 360 Ca 0.07 0.00 0.15 0.00 -0.00 0.00 0.00 57.45 57.67 1up8 n PHE 360 Cb 0.54 -1.02 0.80 0.00 -1.00 0.00 0.00 39.48 38.80 1up8 n PHE 360 CO 0.00 0.00 0.00 1.04 -0.00 0.00 0.00 176.76 177.80 1up8 n GLN 361 N -2.46 1.07 -2.31 -1.08 1.13 -1.26 -4.73 117.38 107.74 1up8 n GLN 361 Ca -0.03 -0.24 -0.27 0.00 -1.94 0.00 0.00 57.00 54.51 1up8 n GLN 361 Cb 0.17 -1.49 0.03 0.00 0.11 0.00 0.00 30.24 29.06 1up8 n GLN 361 CO 0.00 0.00 0.00 -0.65 -1.44 0.00 0.00 177.06 174.97 1up8 s GLN 362 N -2.10 2.95 0.22 -1.09 -0.21 -1.26 -5.02 119.66 113.15 1up8 s GLN 362 Ca 0.42 0.09 -0.31 0.00 0.02 0.00 0.00 55.36 55.59 1up8 s GLN 362 Cb 0.21 -2.23 -0.15 0.00 1.00 0.00 0.00 33.01 31.84 1up8 s GLN 362 CO 0.38 -0.73 1.04 0.39 -2.12 0.00 0.00 175.29 174.25 1up8 n GLU 363 N -2.64 1.11 0.26 2.91 1.02 -1.26 -4.75 120.64 117.29 1up8 n GLU 363 Ca 0.05 0.39 0.15 0.00 -0.02 0.00 0.00 57.16 57.72 1up8 n GLU 363 Cb 0.57 -1.79 0.69 0.00 -0.02 0.00 0.00 31.44 30.89 1up8 n GLU 363 CO 0.00 0.00 0.00 -0.44 1.18 0.00 0.00 177.13 177.87 1up8 h ASP 364 N 2.61 0.00 0.30 1.62 5.19 -1.94 0.05 116.42 124.25 1up8 h ASP 364 Ca -0.40 0.00 -0.02 0.00 -0.62 0.00 0.00 57.03 55.98 1up8 h ASP 364 Cb 1.35 0.00 -0.00 0.00 0.18 0.00 0.00 39.33 40.86 1up8 h ASP 364 CO 0.65 0.10 -0.10 0.07 -3.12 0.00 0.00 179.24 176.84 1up8 h LYS 365 N 0.00 0.00 0.02 3.56 2.10 -1.99 0.19 116.57 120.45 1up8 h LYS 365 Ca -0.00 0.00 -0.15 0.00 -2.00 0.00 0.00 60.65 58.50 1up8 h LYS 365 Cb 0.48 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 31.79 1up8 h LYS 365 CO 0.01 0.10 -0.78 -0.07 -2.00 0.00 0.00 179.45 176.71 1up8 h LEU 366 N 0.00 0.05 -0.90 7.07 3.38 -1.33 -3.41 115.31 120.17 1up8 h LEU 366 Ca -0.00 -0.75 0.00 0.00 0.09 0.00 0.00 57.88 57.22 1up8 h LEU 366 Cb 0.28 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.01 1up8 h LEU 366 CO 0.01 1.32 -0.37 -0.90 0.09 0.00 0.00 178.44 178.59 1up8 n ASP 367 N -4.43 1.70 -2.14 -0.43 5.68 -1.12 -5.00 116.55 110.80 1up8 n ASP 367 Ca -0.22 -1.35 -0.14 0.00 -0.50 0.00 0.00 54.79 52.57 1up8 n ASP 367 Cb 0.63 0.48 -0.02 0.00 -1.14 0.00 0.00 41.12 41.07 1up8 n ASP 367 CO 0.00 0.00 0.00 0.59 -1.33 0.00 0.00 177.20 176.46 1up8 n ASN 368 N -0.12 -4.25 -3.65 -1.12 3.02 0.67 -4.95 115.26 104.87 1up8 n ASN 368 Ca 0.07 0.20 -0.10 0.00 -0.03 0.00 0.00 54.58 54.72 1up8 n ASN 368 Cb 0.37 -3.67 -0.11 0.00 -0.61 0.00 0.00 39.78 35.76 1up8 n ASN 368 CO 0.00 0.00 0.00 -1.58 -2.62 0.00 0.00 177.26 173.06 1up8 s GLN 369 N -4.52 0.26 0.45 3.52 2.00 -1.26 -5.10 119.66 115.01 1up8 s GLN 369 Ca 0.00 0.91 0.04 0.00 -2.00 0.00 0.00 55.36 54.31 1up8 s GLN 369 Cb 0.00 0.16 0.01 0.00 0.80 0.00 0.00 33.01 33.98 1up8 s GLN 369 CO 0.00 -0.28 0.64 0.34 -0.50 0.00 0.00 175.29 175.49 1up8 s ASP 370 N 2.54 5.61 0.03 6.67 -1.08 -1.26 -4.78 116.67 124.40 1up8 s ASP 370 Ca -0.00 -0.12 0.07 0.00 -0.52 0.00 0.00 52.55 51.98 1up8 s ASP 370 Cb -0.12 -0.98 -0.02 0.00 -1.46 0.00 0.00 42.92 40.34 1up8 s ASP 370 CO -0.11 -0.82 -0.21 0.68 0.52 0.00 0.00 175.17 175.23 1up8 s VAL 371 N -2.49 1.68 0.00 1.11 -7.23 -1.26 -5.02 120.40 107.18 1up8 s VAL 371 Ca 0.53 -1.14 0.00 0.00 -1.81 0.00 0.00 61.98 59.56 1up8 s VAL 371 Cb -0.10 -1.45 0.00 0.00 0.56 0.00 0.00 36.38 35.39 1up8 s VAL 371 CO 0.35 0.27 0.00 0.33 -0.31 0.00 0.00 175.10 175.74 1up8 n PHE 372 N 2.00 -1.62 0.09 2.82 7.35 -1.26 -4.50 117.46 122.34 1up8 n PHE 372 Ca -0.17 0.00 -0.13 0.00 -0.76 0.00 0.00 57.45 56.39 1up8 n PHE 372 Cb 0.53 0.39 -0.08 0.00 0.35 0.00 0.00 39.48 40.68 1up8 n PHE 372 CO 0.00 0.00 0.00 0.28 -0.76 0.00 0.00 176.76 176.28 1up8 h VAL 373 N 0.00 0.93 -3.35 -2.13 2.07 -1.94 -2.39 116.25 109.45 1up8 h VAL 373 Ca 0.00 -0.20 -0.65 0.00 0.82 0.00 0.00 66.70 66.66 1up8 h VAL 373 Cb 0.00 1.06 -0.25 0.00 -1.52 0.00 0.00 31.29 30.58 1up8 h VAL 373 CO 0.00 0.05 -0.74 0.20 0.02 0.00 0.00 177.57 177.09 1up8 s ASN 374 N -5.13 4.18 -0.47 0.57 0.01 -1.26 -3.39 114.94 109.44 1up8 s ASN 374 Ca -0.14 -0.28 0.00 0.00 -0.71 0.00 0.00 52.86 51.73 1up8 s ASN 374 Cb 0.05 -1.61 0.00 0.00 0.41 0.00 0.00 41.25 40.10 1up8 s ASN 374 CO 0.65 0.18 0.00 0.49 -1.51 0.00 0.00 177.10 176.90 1up8 n PHE 375 N 3.46 0.00 -3.12 2.20 3.01 -1.26 -4.83 117.46 116.91 1up8 n PHE 375 Ca -0.18 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.28 1up8 n PHE 375 Cb 0.53 -1.31 0.00 0.00 -0.01 0.00 0.00 39.48 38.69 1up8 n PHE 375 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1up8 n GLY 376 N -1.59 5.85 0.21 1.37 0.00 -1.21 -4.71 105.19 105.10 1up8 n GLY 376 Ca -0.04 -1.66 -0.07 0.00 0.00 0.00 0.00 46.02 44.25 1up8 n GLY 376 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1up8 h SER 377 N 0.00 0.55 -0.80 1.61 4.64 -1.79 -1.75 113.55 116.01 1up8 h SER 377 Ca 0.00 -0.01 -0.02 0.00 -0.47 0.00 0.00 61.79 61.29 1up8 h SER 377 Cb 0.00 -0.13 -0.04 0.00 -0.31 0.00 0.00 62.40 61.92 1up8 h SER 377 CO 0.00 0.39 0.41 0.00 -0.87 0.00 0.00 176.83 176.77 1up8 h ALA 378 N 1.19 1.03 0.15 5.18 0.00 -1.77 -1.74 119.26 123.29 1up8 h ALA 378 Ca 0.19 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.96 1up8 h ALA 378 Cb -0.05 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.41 1up8 h ALA 378 CO -0.05 0.56 -0.13 1.25 0.00 0.00 0.00 179.25 180.88 1up8 h HIS 379 N 1.12 -0.35 -0.16 0.00 6.17 -0.90 -2.27 115.15 118.76 1up8 h HIS 379 Ca 0.28 0.00 -0.07 0.00 0.71 0.00 0.00 60.37 61.29 1up8 h HIS 379 Cb 0.07 0.13 -0.01 0.00 2.52 0.00 0.00 27.41 30.12 1up8 h HIS 379 CO 0.01 -0.21 -0.20 -0.24 0.71 0.00 0.00 177.93 178.00 1up8 h VAL 380 N -0.30 1.22 -0.25 5.26 3.04 -1.17 -2.37 116.25 121.68 1up8 h VAL 380 Ca 0.00 -1.01 -0.13 0.00 -1.01 0.00 0.00 66.70 64.54 1up8 h VAL 380 Cb 0.28 1.33 -0.01 0.00 -2.01 0.00 0.00 31.29 30.88 1up8 h VAL 380 CO -0.03 0.31 -0.39 -0.07 -1.01 0.00 0.00 177.57 176.38 1up8 h LEU 381 N 0.25 0.61 -0.05 3.16 3.38 -1.11 -1.20 115.31 120.35 1up8 h LEU 381 Ca 0.04 -0.27 -0.04 0.00 0.09 0.00 0.00 57.88 57.71 1up8 h LEU 381 Cb 0.51 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.09 1up8 h LEU 381 CO 0.03 0.94 -0.12 0.28 0.09 0.00 0.00 178.44 179.67 1up8 h SER 382 N 0.48 0.19 -0.55 -0.43 0.02 -1.29 -3.31 113.55 108.65 1up8 h SER 382 Ca 0.04 -0.59 0.01 0.00 -0.84 0.00 0.00 61.79 60.41 1up8 h SER 382 Cb 0.90 -0.05 -0.03 0.00 0.14 0.00 0.00 62.40 63.35 1up8 h SER 382 CO 0.08 0.74 0.37 0.25 -1.14 0.00 0.00 176.83 177.13 1up8 h LEU 383 N -0.36 0.63 -2.05 5.07 5.85 -1.38 -0.90 115.31 122.17 1up8 h LEU 383 Ca -0.00 -0.02 -0.02 0.00 0.84 0.00 0.00 57.88 58.69 1up8 h LEU 383 Cb 0.72 -0.16 -0.00 0.00 0.37 0.00 0.00 40.66 41.59 1up8 h LEU 383 CO 0.03 0.46 -0.09 1.62 -0.34 0.00 0.00 178.44 180.12 1up8 h VAL 384 N 0.75 0.68 0.06 1.05 3.04 -1.34 -3.15 116.25 117.33 1up8 h VAL 384 Ca 0.20 -0.35 -0.36 0.00 -1.01 0.00 0.00 66.70 65.19 1up8 h VAL 384 Cb -0.08 1.21 -0.04 0.00 -2.01 0.00 0.00 31.29 30.37 1up8 h VAL 384 CO -0.05 0.08 -2.09 0.35 -1.01 0.00 0.00 177.57 174.86 1up8 n THR 385 N -3.88 1.65 0.23 3.17 -2.24 -1.05 -4.41 114.28 107.74 1up8 n THR 385 Ca -0.02 -0.68 0.06 0.00 -2.27 0.00 0.00 64.05 61.13 1up8 n THR 385 Cb 0.18 -1.41 0.52 0.00 -2.10 0.00 0.00 70.33 67.53 1up8 n THR 385 CO 0.00 0.00 0.00 1.05 -0.57 0.00 0.00 175.07 175.55 1up8 h GLU 386 N 0.04 0.00 0.00 -0.78 4.11 -1.13 -2.98 114.58 113.83 1up8 h GLU 386 Ca -0.44 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.99 1up8 h GLU 386 Cb 2.02 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.27 1up8 h GLU 386 CO 0.04 0.17 0.00 -0.39 0.07 0.00 0.00 179.01 178.90 1up8 h VAL 387 N 0.00 0.00 -0.18 -1.06 -1.51 -1.76 -3.36 116.25 108.39 1up8 h VAL 387 Ca -0.00 -0.55 0.01 0.00 -1.23 0.00 0.00 66.70 64.93 1up8 h VAL 387 Cb 0.31 1.50 -0.01 0.00 -2.13 0.00 0.00 31.29 30.95 1up8 h VAL 387 CO 0.02 0.00 0.09 0.00 -1.23 0.00 0.00 177.57 176.45 1up8 h ALA 388 N 2.11 0.21 0.00 5.19 0.00 -1.77 -1.69 119.26 123.31 1up8 h ALA 388 Ca 0.00 0.01 -0.10 0.00 0.00 0.00 0.00 54.91 54.81 1up8 h ALA 388 Cb 0.61 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.36 1up8 h ALA 388 CO 0.00 -0.34 -0.48 1.79 0.00 0.00 0.00 179.25 180.22 1up8 h THR 389 N 0.19 1.24 -0.44 0.00 1.35 -1.80 -1.75 112.91 111.70 1up8 h THR 389 Ca 0.07 -1.71 -0.07 0.00 -0.55 0.00 0.00 66.41 64.15 1up8 h THR 389 Cb 0.02 1.95 -0.02 0.00 -1.73 0.00 0.00 68.15 68.37 1up8 h THR 389 CO -0.05 0.47 -0.00 0.03 -0.25 0.00 0.00 175.52 175.72 1up8 h ARG 390 N 0.00 0.78 -0.66 4.72 -0.00 -1.71 -1.91 114.38 115.60 1up8 h ARG 390 Ca -0.00 -0.25 -0.06 0.00 -0.50 0.00 0.00 59.98 59.16 1up8 h ARG 390 Cb 0.91 -0.07 -0.03 0.00 0.00 0.00 0.00 29.97 30.78 1up8 h ARG 390 CO 0.06 0.84 0.16 0.00 0.00 0.00 0.00 179.97 181.04 1up8 h ALA 391 N 0.90 1.04 -0.68 0.04 0.00 -1.07 -3.07 119.26 116.43 1up8 h ALA 391 Ca 0.12 -0.24 -0.07 0.00 0.00 0.00 0.00 54.91 54.72 1up8 h ALA 391 Cb 0.50 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 18.00 1up8 h ALA 391 CO 0.02 0.63 0.14 -0.07 0.00 0.00 0.00 179.25 179.97 1up8 h LEU 392 N 0.99 1.05 -0.53 0.00 3.38 -1.15 -2.24 115.31 116.81 1up8 h LEU 392 Ca 0.21 -0.24 0.00 0.00 0.09 0.00 0.00 57.88 57.94 1up8 h LEU 392 Cb 0.35 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.79 1up8 h LEU 392 CO 0.00 1.03 0.35 0.11 0.09 0.00 0.00 178.44 180.01 1up8 h LYS 393 N 1.04 0.70 -0.42 1.13 1.57 -1.26 -1.10 116.57 118.24 1up8 h LYS 393 Ca 0.21 -0.04 0.01 0.00 -1.87 0.00 0.00 60.65 58.96 1up8 h LYS 393 Cb 0.41 -0.16 -0.02 0.00 0.08 0.00 0.00 32.23 32.54 1up8 h LYS 393 CO 0.01 0.47 0.26 0.00 -0.57 0.00 0.00 179.45 179.62 1up8 h ALA 394 N 1.19 0.53 0.00 3.86 0.00 -1.48 -2.52 119.26 120.84 1up8 h ALA 394 Ca 0.19 -0.02 -0.08 0.00 0.00 0.00 0.00 54.91 55.01 1up8 h ALA 394 Cb -0.07 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 1up8 h ALA 394 CO -0.04 -0.04 -0.37 -0.24 0.00 0.00 0.00 179.25 178.55 1up8 h VAL 395 N 0.54 0.91 -0.50 0.00 3.04 -1.14 -2.89 116.25 116.21 1up8 h VAL 395 Ca 0.16 -1.48 -0.10 0.00 -1.01 0.00 0.00 66.70 64.27 1up8 h VAL 395 Cb -0.03 1.89 -0.02 0.00 -2.01 0.00 0.00 31.29 31.12 1up8 h VAL 395 CO -0.05 0.36 -0.09 0.03 -1.01 0.00 0.00 177.57 176.81 1up8 h ARG 396 N 0.00 0.92 -0.70 4.17 2.47 -0.97 0.05 114.38 120.32 1up8 h ARG 396 Ca -0.00 -0.32 -0.00 0.00 -1.26 0.00 0.00 59.98 58.40 1up8 h ARG 396 Cb 0.86 -0.07 -0.03 0.00 -1.65 0.00 0.00 29.97 29.08 1up8 h ARG 396 CO 0.05 0.97 0.43 -0.92 0.56 0.00 0.00 179.97 181.06 1up8 h TYR 397 N 0.83 0.90 -0.30 3.04 3.20 -1.25 0.36 116.97 123.75 1up8 h TYR 397 Ca 0.14 0.01 -0.11 0.00 3.14 0.00 0.00 58.73 61.90 1up8 h TYR 397 Cb 0.62 -0.30 -0.01 0.00 1.54 0.00 0.00 36.73 38.58 1up8 h TYR 397 CO 0.04 0.60 -0.23 1.96 -1.64 0.00 0.00 178.16 178.88 1up8 h GLN 398 N 0.95 0.69 0.92 1.82 1.08 -1.37 -0.62 115.11 118.58 1up8 h GLN 398 Ca 0.25 -0.34 -0.04 0.00 -1.45 0.00 0.00 58.65 57.07 1up8 h GLN 398 Cb -0.06 -0.00 0.01 0.00 -0.05 0.00 0.00 27.48 27.38 1up8 h GLN 398 CO -0.05 0.95 -0.45 0.87 -0.95 0.00 0.00 178.83 179.20 1up8 h LYS 399 N 0.44 -1.20 0.01 1.46 1.57 -0.78 0.30 116.57 118.38 1up8 h LYS 399 Ca 0.06 0.08 -0.32 0.00 -1.87 0.00 0.00 60.65 58.60 1up8 h LYS 399 Cb 0.79 0.27 -0.04 0.00 0.08 0.00 0.00 32.23 33.33 1up8 h LYS 399 CO 0.06 -0.80 -1.74 1.19 -0.57 0.00 0.00 179.45 177.59 1up8 n PHE 400 N -5.63 0.73 0.08 -1.35 3.01 0.10 -1.71 117.46 112.70 1up8 n PHE 400 Ca -0.16 0.28 -0.09 0.00 1.01 0.00 0.00 57.45 58.49 1up8 n PHE 400 Cb 0.49 -1.08 -0.07 0.00 -0.01 0.00 0.00 39.48 38.81 1up8 n PHE 400 CO 0.00 0.00 0.00 -0.91 1.01 0.00 0.00 176.76 176.86 1up8 h ASN 401 N -0.83 0.16 0.00 4.37 4.21 -1.24 -3.42 115.58 118.83 1up8 h ASN 401 Ca -0.46 -0.15 0.00 0.00 1.21 0.00 0.00 56.30 56.89 1up8 h ASN 401 Cb 1.50 -0.05 0.00 0.00 -1.12 0.00 0.00 38.32 38.65 1up8 h ASN 401 CO -0.23 1.05 -0.25 -0.38 -1.29 0.00 0.00 177.43 176.33 1up8 n ILE 402 N -3.50 0.41 -0.05 2.81 2.08 -0.75 -4.96 119.36 115.40 1up8 n ILE 402 Ca -0.03 0.37 -0.11 0.00 0.56 0.00 0.00 62.75 63.55 1up8 n ILE 402 Cb 0.90 -1.68 -0.15 0.00 -0.75 0.00 0.00 39.64 37.96 1up8 n ILE 402 CO 0.00 0.00 0.00 1.41 0.56 0.00 0.00 176.55 178.52 1up8 n HIS 403 N -3.02 0.66 -3.86 1.39 8.25 0.09 -4.85 115.22 113.88 1up8 n HIS 403 Ca -0.04 0.22 -0.26 0.00 -0.26 0.00 0.00 57.72 57.39 1up8 n HIS 403 Cb 0.13 -1.11 -0.05 0.00 1.12 0.00 0.00 29.99 30.08 1up8 n HIS 403 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 1up8 n ARG 404 N -3.01 -0.81 -2.71 -0.41 1.74 -0.69 -4.90 116.66 105.87 1up8 n ARG 404 Ca -0.25 0.01 -0.40 0.00 -0.77 0.00 0.00 57.85 56.44 1up8 n ARG 404 Cb 1.08 -2.26 -0.05 0.00 -1.02 0.00 0.00 32.46 30.21 1up8 n ARG 404 CO 0.00 0.00 0.00 0.50 -1.52 0.00 0.00 177.63 176.61 1up8 s ARG 405 N -6.34 4.77 0.42 5.56 3.52 -1.26 -0.72 118.95 124.90 1up8 s ARG 405 Ca 0.10 1.51 -0.25 0.00 -0.13 0.00 0.00 55.73 56.97 1up8 s ARG 405 Cb -0.06 -3.31 -0.08 0.00 -1.56 0.00 0.00 34.95 29.94 1up8 s ARG 405 CO 0.71 0.36 1.21 -0.48 -0.81 0.00 0.00 175.30 176.30 1up8 s LEU 406 N -0.73 4.16 0.72 -0.88 2.34 -1.14 -1.95 118.68 121.19 1up8 s LEU 406 Ca 0.44 2.44 -0.12 0.00 0.06 0.00 0.00 54.13 56.94 1up8 s LEU 406 Cb -0.26 -4.03 0.03 0.00 -0.56 0.00 0.00 46.19 41.37 1up8 s LEU 406 CO 0.32 -0.80 1.10 -0.13 -1.06 0.00 0.00 176.35 175.78 1up8 s ARG 407 N -2.37 2.52 0.35 1.48 1.81 -1.26 -4.68 118.95 116.80 1up8 s ARG 407 Ca 0.59 1.26 0.07 0.00 -1.72 0.00 0.00 55.73 55.92 1up8 s ARG 407 Cb -0.33 -1.92 0.76 0.00 -0.45 0.00 0.00 34.95 33.01 1up8 s ARG 407 CO 0.41 -1.45 1.90 -1.35 -0.68 0.00 0.00 175.30 174.13 1up8 h PRO 408 N -0.61 0.73 -0.97 3.54 0.11 -1.81 -1.60 132.00 131.39 1up8 h PRO 408 Ca -0.45 -0.04 0.14 0.00 0.11 0.00 0.00 66.00 65.76 1up8 h PRO 408 Cb 1.24 -0.16 -0.08 0.00 0.11 0.00 0.00 31.00 32.10 1up8 h PRO 408 CO 0.53 0.48 0.61 1.05 -0.21 0.00 0.00 178.00 180.46 1up8 h GLU 409 N 0.75 0.82 -0.12 1.05 4.11 -1.92 -1.02 114.58 118.25 1up8 h GLU 409 Ca 0.40 -0.05 -0.20 0.00 0.07 0.00 0.00 59.36 59.59 1up8 h GLU 409 Cb 0.53 -0.18 0.00 0.00 0.50 0.00 0.00 28.75 29.60 1up8 h GLU 409 CO -0.17 0.54 -0.73 0.00 0.07 0.00 0.00 179.01 178.72 1up8 h ALA 410 N 1.58 0.50 -0.78 1.06 0.00 -1.66 -1.61 119.26 118.35 1up8 h ALA 410 Ca 0.50 -0.60 0.04 0.00 0.00 0.00 0.00 54.91 54.86 1up8 h ALA 410 Cb 0.66 -0.05 -0.05 0.00 0.00 0.00 0.00 17.79 18.36 1up8 h ALA 410 CO -0.27 0.73 0.48 1.15 0.00 0.00 0.00 179.25 181.34 1up8 h THR 411 N 0.39 1.07 -0.18 0.00 2.02 -1.25 -1.89 112.91 113.07 1up8 h THR 411 Ca -0.04 -0.31 -0.07 0.00 0.77 0.00 0.00 66.41 66.76 1up8 h THR 411 Cb 1.33 0.08 -0.01 0.00 -1.74 0.00 0.00 68.15 67.80 1up8 h THR 411 CO 0.14 0.17 -0.20 1.23 0.37 0.00 0.00 175.52 177.22 1up8 h GLY 412 N 0.91 0.33 1.24 2.16 0.00 -1.00 -1.14 103.07 105.58 1up8 h GLY 412 Ca 0.32 -0.23 -0.10 0.00 0.00 0.00 0.00 47.33 47.32 1up8 h GLY 412 CO -0.14 0.21 -0.11 -1.33 0.00 0.00 0.00 176.54 175.17 1up8 h GLY 413 N 0.91 0.96 0.85 4.60 0.00 -0.97 -0.16 103.07 109.26 1up8 h GLY 413 Ca 0.05 -0.75 -0.04 0.00 0.00 0.00 0.00 47.33 46.58 1up8 h GLY 413 CO 0.03 0.69 -0.01 1.41 0.00 0.00 0.00 176.54 178.66 1up8 h LEU 414 N 0.80 0.44 -0.17 3.11 3.38 -0.96 -1.66 115.31 120.24 1up8 h LEU 414 Ca 0.13 -0.32 0.02 0.00 0.09 0.00 0.00 57.88 57.80 1up8 h LEU 414 Cb 0.63 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 41.24 1up8 h LEU 414 CO 0.04 0.66 0.04 0.40 0.09 0.00 0.00 178.44 179.66 1up8 h ILE 415 N 0.21 0.93 -0.12 1.22 2.04 -1.08 0.93 117.51 121.64 1up8 h ILE 415 Ca 0.07 -0.04 -0.00 0.00 1.00 0.00 0.00 64.86 65.89 1up8 h ILE 415 Cb 0.44 0.81 -0.01 0.00 -0.74 0.00 0.00 36.82 37.32 1up8 h ILE 415 CO 0.02 0.02 0.06 -1.28 0.00 0.00 0.00 178.15 176.97 1up8 h SER 416 N 0.11 0.16 -0.21 1.72 0.87 -1.00 0.95 113.55 116.14 1up8 h SER 416 Ca 0.08 -0.11 0.02 0.00 -1.23 0.00 0.00 61.79 60.54 1up8 h SER 416 Cb 0.07 -0.04 -0.02 0.00 -0.44 0.00 0.00 62.40 61.97 1up8 h SER 416 CO -0.10 0.22 0.10 0.58 -0.53 0.00 0.00 176.83 177.09 1up8 h VAL 417 N 0.08 0.98 -0.30 2.23 2.07 -1.21 -1.14 116.25 118.96 1up8 h VAL 417 Ca 0.04 -0.07 0.06 0.00 0.82 0.00 0.00 66.70 67.55 1up8 h VAL 417 Cb 0.10 0.75 -0.06 0.00 -1.52 0.00 0.00 31.29 30.57 1up8 h VAL 417 CO -0.01 0.04 -0.12 -1.13 0.02 0.00 0.00 177.57 176.37 1up8 h ASN 418 N 0.21 -0.43 -0.34 0.57 -0.73 -0.63 -1.72 115.58 112.50 1up8 h ASN 418 Ca 0.09 0.11 -0.13 0.00 1.87 0.00 0.00 56.30 58.24 1up8 h ASN 418 Cb 0.03 0.24 -0.01 0.00 0.27 0.00 0.00 38.32 38.86 1up8 h ASN 418 CO -0.07 -0.16 -0.28 0.50 -0.37 0.00 0.00 177.43 177.05 1up8 h LYS 419 N -0.07 0.79 -0.39 6.67 3.64 -0.59 -1.66 116.57 124.96 1up8 h LYS 419 Ca 0.15 -0.40 0.01 0.00 -1.27 0.00 0.00 60.65 59.14 1up8 h LYS 419 Cb 0.31 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.11 1up8 h LYS 419 CO -0.35 1.03 0.25 0.82 -2.27 0.00 0.00 179.45 178.93 1up8 h ILE 420 N 0.57 1.09 -0.35 2.00 2.04 -1.12 -2.85 117.51 118.89 1up8 h ILE 420 Ca 0.06 -0.18 -0.10 0.00 1.00 0.00 0.00 64.86 65.64 1up8 h ILE 420 Cb 0.85 0.53 -0.01 0.00 -0.74 0.00 0.00 36.82 37.44 1up8 h ILE 420 CO 0.07 0.09 -0.21 0.00 0.00 0.00 0.00 178.15 178.11 1up8 h ALA 421 N 1.15 0.99 -0.36 1.87 0.00 -1.18 -2.85 119.26 118.87 1up8 h ALA 421 Ca 0.15 -0.35 -0.02 0.00 0.00 0.00 0.00 54.91 54.69 1up8 h ALA 421 Cb -0.05 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.58 1up8 h ALA 421 CO -0.04 0.60 0.15 0.00 0.00 0.00 0.00 179.25 179.96 1up8 h ALA 422 N 1.18 1.58 -0.01 0.00 0.00 -1.14 -1.74 119.26 119.13 1up8 h ALA 422 Ca 0.09 -0.10 -0.06 0.00 0.00 0.00 0.00 54.91 54.84 1up8 h ALA 422 Cb 0.68 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 1up8 h ALA 422 CO 0.05 0.33 -0.29 1.96 0.00 0.00 0.00 179.25 181.31 1up8 h GLN 423 N 0.51 0.02 -0.82 0.00 4.20 -1.28 -2.34 115.11 115.40 1up8 h GLN 423 Ca 0.13 -0.01 -0.15 0.00 0.06 0.00 0.00 58.65 58.68 1up8 h GLN 423 Cb 0.10 -0.00 -0.09 0.00 0.30 0.00 0.00 27.48 27.79 1up8 h GLN 423 CO -0.01 0.30 0.19 1.63 -0.67 0.00 0.00 178.83 180.28 1up8 n LYS 424 N -4.19 3.03 -3.00 1.46 5.02 -0.73 -4.95 118.16 114.80 1up8 n LYS 424 Ca -0.02 -2.23 -0.19 0.00 -2.02 0.00 0.00 58.31 53.86 1up8 n LYS 424 Cb 0.34 -1.97 0.04 0.00 -0.02 0.00 0.00 35.03 33.42 1up8 n LYS 424 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1up8 n GLY 425 N -0.02 -0.29 3.30 0.72 0.00 -0.88 -5.06 105.19 102.97 1up8 n GLY 425 Ca 0.30 -0.01 -0.16 0.00 0.00 0.00 0.00 46.02 46.14 1up8 n GLY 425 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1up8 s GLU 426 N -5.62 1.21 -0.20 1.61 2.02 -0.78 -5.01 118.70 111.93 1up8 s GLU 426 Ca 0.30 -1.54 -0.01 0.00 0.02 0.00 0.00 54.97 53.74 1up8 s GLU 426 Cb -0.13 -0.84 0.01 0.00 0.10 0.00 0.00 34.13 33.27 1up8 s GLU 426 CO 0.37 0.10 -0.13 0.45 0.02 0.00 0.00 175.26 176.08 1up8 s SER 427 N -3.25 3.71 -0.02 -0.19 0.15 -1.26 -3.09 113.70 109.74 1up8 s SER 427 Ca 0.21 -0.62 0.03 0.00 0.70 0.00 0.00 55.95 56.26 1up8 s SER 427 Cb 0.02 -1.59 0.00 0.00 -1.71 0.00 0.00 66.02 62.74 1up8 s SER 427 CO 0.04 -0.03 -0.09 -0.63 1.20 0.00 0.00 173.24 173.73 1up8 s ILE 428 N 1.35 0.78 -1.08 6.45 1.01 -1.26 -4.90 121.20 123.55 1up8 s ILE 428 Ca 0.04 -0.37 -0.09 0.00 0.00 0.00 0.00 60.65 60.23 1up8 s ILE 428 Cb -0.14 -0.69 -0.05 0.00 0.01 0.00 0.00 42.46 41.59 1up8 s ILE 428 CO -0.08 0.24 0.89 0.49 0.00 0.00 0.00 174.94 176.47 1up8 n PHE 429 N 3.25 -2.30 0.31 3.97 0.99 -1.26 -4.14 117.46 118.28 1up8 n PHE 429 Ca -0.18 0.76 0.21 0.00 -0.00 0.00 0.00 57.45 58.24 1up8 n PHE 429 Cb 0.54 -4.00 1.13 0.00 -1.00 0.00 0.00 39.48 36.16 1up8 n PHE 429 CO 0.00 0.00 0.00 -1.00 -0.00 0.00 0.00 176.76 175.76 1up8 h PRO 430 N -1.34 0.00 -0.78 -1.08 0.13 -1.98 -2.63 132.00 124.32 1up8 h PRO 430 Ca -0.62 0.00 0.20 0.00 -0.87 0.00 0.00 66.00 64.70 1up8 h PRO 430 Cb 1.33 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.41 1up8 h PRO 430 CO 0.46 0.00 0.54 0.93 -0.23 0.00 0.00 178.00 179.70 1up8 h GLU 431 N 0.00 0.20 -0.50 0.86 3.07 -1.97 -1.38 114.58 114.86 1up8 h GLU 431 Ca 0.00 -0.01 0.00 0.00 -0.50 0.00 0.00 59.36 58.85 1up8 h GLU 431 Cb 0.01 -0.04 0.00 0.00 -0.84 0.00 0.00 28.75 27.87 1up8 h GLU 431 CO 0.00 0.13 0.00 1.33 -1.40 0.00 0.00 179.01 179.07 1up8 n VAL 432 N -4.41 2.47 -0.28 3.13 0.24 -0.99 -3.96 118.33 114.53 1up8 n VAL 432 Ca 0.16 -1.49 0.01 0.00 -2.04 0.00 0.00 64.34 60.98 1up8 n VAL 432 Cb 0.71 -0.19 0.14 0.00 -1.47 0.00 0.00 33.84 33.03 1up8 n VAL 432 CO 0.00 0.00 0.00 0.44 -2.14 0.00 0.00 176.83 175.13 1up8 h ASP 433 N 3.39 0.69 -0.39 -1.34 3.32 -1.40 -2.08 116.42 118.61 1up8 h ASP 433 Ca 0.00 0.03 -0.01 0.00 0.02 0.00 0.00 57.03 57.07 1up8 h ASP 433 Cb 1.74 -0.10 -0.02 0.00 0.22 0.00 0.00 39.33 41.17 1up8 h ASP 433 CO 0.37 0.42 0.20 0.25 -1.72 0.00 0.00 179.24 178.76 1up8 h LEU 434 N 0.81 0.50 -0.54 1.55 5.85 -1.82 -1.60 115.31 120.06 1up8 h LEU 434 Ca 0.37 -0.11 0.04 0.00 0.84 0.00 0.00 57.88 59.01 1up8 h LEU 434 Cb 0.26 -0.13 -0.04 0.00 0.37 0.00 0.00 40.66 41.12 1up8 h LEU 434 CO -0.21 0.47 0.30 0.00 -0.34 0.00 0.00 178.44 178.66 1up8 h ALA 435 N 1.05 0.70 -0.58 1.25 0.00 -1.82 0.46 119.26 120.31 1up8 h ALA 435 Ca 0.13 0.01 -0.10 0.00 0.00 0.00 0.00 54.91 54.95 1up8 h ALA 435 Cb 0.10 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 1up8 h ALA 435 CO -0.02 -0.02 -0.03 0.28 0.00 0.00 0.00 179.25 179.45 1up8 h VAL 436 N 0.58 1.27 -0.38 0.00 2.07 -1.22 -1.42 116.25 117.15 1up8 h VAL 436 Ca 0.23 -1.18 -0.12 0.00 0.82 0.00 0.00 66.70 66.45 1up8 h VAL 436 Cb 0.10 0.85 -0.01 0.00 -1.52 0.00 0.00 31.29 30.70 1up8 h VAL 436 CO -0.14 0.43 -0.23 -0.08 0.02 0.00 0.00 177.57 177.57 1up8 h GLU 437 N 0.95 0.76 0.00 1.57 4.22 -0.84 -3.27 114.58 117.96 1up8 h GLU 437 Ca 0.16 -0.31 -0.06 0.00 0.08 0.00 0.00 59.36 59.23 1up8 h GLU 437 Cb 0.59 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.80 1up8 h GLU 437 CO 0.04 0.92 -1.10 0.93 -2.18 0.00 0.00 179.01 177.62 1up8 h GLU 438 N 0.66 0.00 -0.49 1.92 5.08 -0.75 -3.38 114.58 117.61 1up8 h GLU 438 Ca 0.09 0.00 -0.11 0.00 -1.00 0.00 0.00 59.36 58.34 1up8 h GLU 438 Cb 0.74 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 29.93 1up8 h GLU 438 CO 0.06 0.11 0.09 1.28 -1.00 0.00 0.00 179.01 179.55 1up8 n LEU 439 N -2.78 5.00 -0.27 1.33 4.77 -0.55 -4.72 117.00 119.77 1up8 n LEU 439 Ca -0.03 -3.19 -0.02 0.00 -0.03 0.00 0.00 56.01 52.74 1up8 n LEU 439 Cb 0.65 -0.65 0.04 0.00 -2.33 0.00 0.00 43.42 41.13 1up8 n LEU 439 CO 0.41 0.80 0.63 1.23 -1.33 0.00 0.00 177.39 179.13 1up8 h GLY 440 N 2.31 0.10 1.06 -0.72 0.00 -1.76 -1.02 103.07 103.04 1up8 h GLY 440 Ca 0.13 0.42 -0.06 0.00 0.00 0.00 0.00 47.33 47.83 1up8 h GLY 440 CO 0.48 -0.23 0.26 -0.55 0.00 0.00 0.00 176.54 176.50 1up8 h ASP 441 N -0.08 1.10 -0.32 0.19 3.32 -1.95 -2.41 116.42 116.27 1up8 h ASP 441 Ca 0.30 -0.20 -0.13 0.00 0.02 0.00 0.00 57.03 57.03 1up8 h ASP 441 Cb 0.58 -0.29 -0.01 0.00 0.22 0.00 0.00 39.33 39.83 1up8 h ASP 441 CO -0.81 1.00 -0.31 0.40 -1.72 0.00 0.00 179.24 177.80 1up8 h ILE 442 N 1.13 1.29 -0.37 0.35 2.04 -1.71 -3.03 117.51 117.21 1up8 h ILE 442 Ca 0.25 -1.48 -0.07 0.00 1.00 0.00 0.00 64.86 64.56 1up8 h ILE 442 Cb 0.28 1.52 -0.02 0.00 -0.74 0.00 0.00 36.82 37.86 1up8 h ILE 442 CO -0.01 0.48 -0.07 -0.07 0.00 0.00 0.00 178.15 178.48 1up8 h LEU 443 N 0.53 0.60 -0.89 1.44 3.38 -1.09 -1.10 115.31 118.19 1up8 h LEU 443 Ca 0.05 -0.15 -0.05 0.00 0.09 0.00 0.00 57.88 57.82 1up8 h LEU 443 Cb 0.88 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 41.44 1up8 h LEU 443 CO 0.08 0.72 0.27 -0.33 0.09 0.00 0.00 178.44 179.26 1up8 h GLU 444 N 0.58 1.08 -0.51 1.13 4.39 -1.44 0.16 114.58 119.96 1up8 h GLU 444 Ca 0.11 -0.20 -0.01 0.00 0.34 0.00 0.00 59.36 59.60 1up8 h GLU 444 Cb 0.47 -0.17 -0.02 0.00 -0.10 0.00 0.00 28.75 28.92 1up8 h GLU 444 CO 0.02 0.89 0.28 0.87 -1.16 0.00 0.00 179.01 179.91 1up8 h LYS 445 N 1.05 0.72 -0.85 2.33 1.57 -1.33 -2.41 116.57 117.65 1up8 h LYS 445 Ca 0.24 -0.08 0.00 0.00 -1.87 0.00 0.00 60.65 58.94 1up8 h LYS 445 Cb 0.23 -0.14 -0.04 0.00 0.08 0.00 0.00 32.23 32.36 1up8 h LYS 445 CO -0.02 0.56 0.54 0.00 -0.57 0.00 0.00 179.45 179.97 1up8 h ALA 446 N 1.12 1.07 -0.46 3.86 0.00 -0.71 -1.02 119.26 123.11 1up8 h ALA 446 Ca 0.18 -0.07 0.02 0.00 0.00 0.00 0.00 54.91 55.04 1up8 h ALA 446 Cb 0.05 -0.34 -0.03 0.00 0.00 0.00 0.00 17.79 17.47 1up8 h ALA 446 CO -0.03 0.50 0.27 1.49 0.00 0.00 0.00 179.25 181.48 1up8 h GLU 447 N 1.15 0.52 -0.05 0.00 4.81 -0.51 0.23 114.58 120.73 1up8 h GLU 447 Ca 0.31 -0.03 -0.00 0.00 -0.13 0.00 0.00 59.36 59.50 1up8 h GLU 447 Cb -0.11 -0.12 -0.00 0.00 0.63 0.00 0.00 28.75 29.15 1up8 h GLU 447 CO -0.06 0.35 0.01 0.82 -0.73 0.00 0.00 179.01 179.40 1up8 h ILE 448 N 0.54 1.19 -0.39 2.32 2.04 -1.24 -0.93 117.51 121.04 1up8 h ILE 448 Ca 0.19 -0.57 0.06 0.00 1.00 0.00 0.00 64.86 65.54 1up8 h ILE 448 Cb 0.03 1.48 -0.05 0.00 -0.74 0.00 0.00 36.82 37.53 1up8 h ILE 448 CO -0.09 0.16 0.07 -1.28 0.00 0.00 0.00 178.15 177.01 1up8 h SER 449 N -0.14 -0.00 -0.43 1.72 0.87 -1.01 -2.76 113.55 111.81 1up8 h SER 449 Ca 0.02 0.07 -0.06 0.00 -1.23 0.00 0.00 61.79 60.59 1up8 h SER 449 Cb 0.24 0.10 -0.02 0.00 -0.44 0.00 0.00 62.40 62.27 1up8 h SER 449 CO 0.00 0.03 0.07 0.78 -0.53 0.00 0.00 176.83 177.18 1up8 h ASN 450 N 0.20 0.74 -0.20 6.23 2.35 -0.44 -2.18 115.58 122.27 1up8 h ASN 450 Ca 0.19 -0.15 0.03 0.00 -0.55 0.00 0.00 56.30 55.82 1up8 h ASN 450 Cb 0.23 -0.19 -0.03 0.00 0.05 0.00 0.00 38.32 38.38 1up8 h ASN 450 CO -0.25 0.76 0.04 -0.09 -1.65 0.00 0.00 177.43 176.23 1up8 h ARG 451 N 0.75 0.11 -0.93 0.81 2.43 -0.92 -1.35 114.38 115.28 1up8 h ARG 451 Ca 0.16 -0.01 0.07 0.00 -0.81 0.00 0.00 59.98 59.39 1up8 h ARG 451 Cb 0.35 -0.03 -0.07 0.00 -0.42 0.00 0.00 29.97 29.81 1up8 h ARG 451 CO 0.01 0.07 0.59 0.87 -1.51 0.00 0.00 179.97 180.00 1up8 h LYS 452 N 0.12 1.03 -0.47 0.20 1.57 -1.30 -1.01 116.57 116.71 1up8 h LYS 452 Ca 0.09 -0.06 -0.13 0.00 -1.87 0.00 0.00 60.65 58.68 1up8 h LYS 452 Cb 0.09 -0.23 -0.01 0.00 0.08 0.00 0.00 32.23 32.15 1up8 h LYS 452 CO -0.12 0.68 -0.21 0.37 -0.57 0.00 0.00 179.45 179.59 1up8 h GLN 453 N 1.06 0.95 -0.11 3.15 5.75 -1.05 -1.68 115.11 123.18 1up8 h GLN 453 Ca 0.41 -0.40 -0.17 0.00 -0.15 0.00 0.00 58.65 58.34 1up8 h GLN 453 Cb 0.19 -0.04 -0.01 0.00 1.07 0.00 0.00 27.48 28.70 1up8 h GLN 453 CO -0.18 1.07 -0.65 -0.91 -2.65 0.00 0.00 178.83 175.51 1up8 h ASN 454 N 0.82 0.50 0.20 -0.69 2.35 -0.92 -1.35 115.58 116.50 1up8 h ASN 454 Ca 0.11 -0.30 -0.01 0.00 -0.55 0.00 0.00 56.30 55.55 1up8 h ASN 454 Cb 0.78 -0.15 0.00 0.00 0.05 0.00 0.00 38.32 39.01 1up8 h ASN 454 CO 0.06 1.01 -0.10 0.40 -1.65 0.00 0.00 177.43 177.16 1up8 h ILE 455 N 0.31 0.85 -0.16 2.81 2.04 -1.17 -2.01 117.51 120.19 1up8 h ILE 455 Ca -0.01 -0.26 0.05 0.00 1.00 0.00 0.00 64.86 65.63 1up8 h ILE 455 Cb 1.20 1.01 -0.01 0.00 -0.74 0.00 0.00 36.82 38.28 1up8 h ILE 455 CO 0.11 0.06 0.12 0.00 0.00 0.00 0.00 178.15 178.45 1up8 h ALA 456 N 0.38 2.02 0.00 1.87 0.00 -1.22 -0.73 119.26 121.57 1up8 h ALA 456 Ca -0.03 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1up8 h ALA 456 Cb 0.30 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.11 1up8 h ALA 456 CO 0.05 -0.20 0.00 -0.25 0.00 0.00 0.00 179.25 178.84 1up8 n ASP 457 N -4.28 0.00 0.00 0.00 10.43 -0.52 -4.88 116.55 117.31 1up8 n ASP 457 Ca 0.01 -0.56 0.00 0.00 2.57 0.00 0.00 54.79 56.81 1up8 n ASP 457 Cb 0.25 -0.13 0.00 0.00 1.84 0.00 0.00 41.12 43.08 1up8 n ASP 457 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 1up8 n GLY 458 N 0.98 1.32 3.11 0.44 0.00 -0.28 -5.06 105.19 105.70 1up8 n GLY 458 Ca 0.18 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.86 1up8 n GLY 458 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1up8 s ASP 459 N -2.00 5.02 0.44 1.61 -1.08 -0.77 -4.99 116.67 114.89 1up8 s ASP 459 Ca 0.00 -1.85 0.18 0.00 -0.52 0.00 0.00 52.55 50.36 1up8 s ASP 459 Cb 0.00 -1.74 1.00 0.00 -1.46 0.00 0.00 42.92 40.72 1up8 s ASP 459 CO 0.00 -0.42 1.94 1.55 0.52 0.00 0.00 175.17 178.76 1up8 h PRO 460 N 7.92 0.00 -2.22 4.34 0.13 -1.84 -3.25 132.00 137.08 1up8 h PRO 460 Ca -0.13 0.00 -0.58 0.00 -0.87 0.00 0.00 66.00 64.42 1up8 h PRO 460 Cb 1.04 0.00 -0.40 0.00 0.13 0.00 0.00 31.00 31.78 1up8 h PRO 460 CO 0.61 0.25 -0.93 -3.47 -0.23 0.00 0.00 178.00 174.22 1up8 n ASP 461 N -3.99 0.92 -4.76 1.44 2.03 -1.26 -4.93 116.55 106.00 1up8 n ASP 461 Ca -0.02 -2.80 -0.40 0.00 0.52 0.00 0.00 54.79 52.10 1up8 n ASP 461 Cb 0.32 -0.63 -0.05 0.00 -0.72 0.00 0.00 41.12 40.03 1up8 n ASP 461 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 1up8 s PRO 462 N -1.14 4.70 0.28 -0.67 0.04 -1.26 -5.01 135.00 131.93 1up8 s PRO 462 Ca 0.35 1.59 -0.27 0.00 0.04 0.00 0.00 61.00 62.70 1up8 s PRO 462 Cb 0.12 -3.14 -0.15 0.00 0.04 0.00 0.00 34.50 31.37 1up8 s PRO 462 CO -0.12 0.33 0.81 -0.25 0.04 0.00 0.00 177.00 177.82 1up8 n ASP 463 N 1.16 0.31 -4.62 6.66 8.00 -1.26 -4.93 116.55 121.87 1up8 n ASP 463 Ca -0.01 1.13 -0.41 0.00 0.71 0.00 0.00 54.79 56.21 1up8 n ASP 463 Cb 0.47 -1.17 0.02 0.00 -0.02 0.00 0.00 41.12 40.41 1up8 n ASP 463 CO 0.00 0.00 0.00 -2.65 -0.39 0.00 0.00 177.20 174.16 1up8 n PRO 464 N 0.78 1.36 -3.70 -0.24 -0.02 -1.26 -4.95 135.00 126.97 1up8 n PRO 464 Ca 0.12 0.49 -0.11 0.00 -2.02 0.00 0.00 63.50 61.98 1up8 n PRO 464 Cb 0.31 -2.08 -0.12 0.00 -0.02 0.00 0.00 33.50 31.59 1up8 n PRO 464 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1up8 s SER 465 N -0.77 -0.25 -0.16 2.55 0.15 -1.26 -5.03 113.70 108.93 1up8 s SER 465 Ca 0.64 0.72 0.16 0.00 0.70 0.00 0.00 55.95 58.17 1up8 s SER 465 Cb -0.54 0.69 0.56 0.00 -1.71 0.00 0.00 66.02 65.03 1up8 s SER 465 CO 0.56 -0.20 1.47 0.49 1.20 0.00 0.00 173.24 176.76 1up8 n PHE 466 N 4.56 1.10 -1.24 3.44 3.01 -1.26 -3.99 117.46 123.08 1up8 n PHE 466 Ca -0.20 -0.80 -0.35 0.00 1.01 0.00 0.00 57.45 57.12 1up8 n PHE 466 Cb 0.53 -0.31 0.11 0.00 -0.01 0.00 0.00 39.48 39.80 1up8 n PHE 466 CO 0.00 0.00 0.00 1.28 1.01 0.00 0.00 176.76 179.05 1up8 n LEU 467 N -0.12 4.20 -4.65 4.37 4.77 -1.26 -4.57 117.00 119.74 1up8 n LEU 467 Ca 0.22 0.63 -0.43 0.00 -0.03 0.00 0.00 56.01 56.40 1up8 n LEU 467 Cb 0.89 -1.48 -0.02 0.00 -2.33 0.00 0.00 43.42 40.48 1up8 n LEU 467 CO 0.18 -1.77 0.93 -0.22 -1.33 0.00 0.00 177.39 175.17 1up8 s LEU 468 N -4.61 4.00 0.21 2.23 2.96 -1.26 -4.95 118.68 117.26 1up8 s LEU 468 Ca 0.74 1.16 -0.30 0.00 -0.22 0.00 0.00 54.13 55.50 1up8 s LEU 468 Cb -0.31 -3.52 -0.09 0.00 0.50 0.00 0.00 46.19 42.76 1up8 s LEU 468 CO 0.50 -0.79 1.40 -2.84 -1.32 0.00 0.00 176.35 173.30 1up8 s PRO 469 N 3.46 4.31 -0.05 0.98 0.02 -1.26 -4.87 135.00 137.59 1up8 s PRO 469 Ca 0.44 2.20 -0.06 0.00 0.02 0.00 0.00 61.00 63.61 1up8 s PRO 469 Cb -0.13 -3.15 -0.04 0.00 0.02 0.00 0.00 34.50 31.19 1up8 s PRO 469 CO 0.12 -0.38 0.20 -1.64 -0.33 0.00 0.00 177.00 174.97 1up8 s MET 470 N -0.04 3.49 0.29 5.54 -1.94 -0.61 -4.82 119.30 121.22 1up8 s MET 470 Ca 0.60 -0.16 0.13 0.00 -1.71 0.00 0.00 55.69 54.55 1up8 s MET 470 Cb -0.40 -3.13 0.41 0.00 2.01 0.00 0.00 34.83 33.72 1up8 s MET 470 CO 0.39 0.71 1.63 0.00 -0.01 0.00 0.00 175.02 177.74 1up8 h ALA 471 N 4.32 0.95 -3.49 3.03 0.00 -1.75 0.66 119.26 122.99 1up8 h ALA 471 Ca -0.52 -0.52 -0.66 0.00 0.00 0.00 0.00 54.91 53.22 1up8 h ALA 471 Cb 1.21 -0.09 -0.15 0.00 0.00 0.00 0.00 17.79 18.76 1up8 h ALA 471 CO 0.64 0.71 -0.70 -0.06 0.00 0.00 0.00 179.25 179.84 1up8 s PHE 472 N -3.56 2.89 0.30 0.00 2.99 -1.26 -4.80 117.98 114.53 1up8 s PHE 472 Ca -0.01 -0.06 0.03 0.00 0.00 0.00 0.00 56.93 56.89 1up8 s PHE 472 Cb 0.12 -1.53 0.46 0.00 0.00 0.00 0.00 43.02 42.07 1up8 s PHE 472 CO 0.74 0.43 1.75 0.00 -0.00 0.00 0.00 175.22 178.15 1up8 h ALA 473 N 3.88 1.16 -0.01 5.36 0.00 -1.87 -2.10 119.26 125.68 1up8 h ALA 473 Ca -0.48 -0.32 0.00 0.00 0.00 0.00 0.00 54.91 54.11 1up8 h ALA 473 Cb 1.17 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.84 1up8 h ALA 473 CO 0.55 0.53 -0.11 -0.85 0.00 0.00 0.00 179.25 179.37 1up8 n GLU 474 N -4.15 0.90 0.00 0.00 0.00 -1.26 -4.76 120.64 111.38 1up8 n GLU 474 Ca -0.00 -0.38 0.00 0.00 0.00 0.00 0.00 57.16 56.78 1up8 n GLU 474 Cb 0.38 -1.49 0.00 0.00 0.00 0.00 0.00 31.44 30.33 1up8 n GLU 474 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1up8 n GLY 475 N 1.25 3.23 3.80 -1.84 0.00 -0.79 -4.82 105.19 106.02 1up8 n GLY 475 Ca 0.16 -0.23 -0.32 0.00 0.00 0.00 0.00 46.02 45.62 1up8 n GLY 475 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1up8 s SER 476 N -4.00 5.53 1.10 1.61 1.04 -1.26 -4.82 113.70 112.90 1up8 s SER 476 Ca 0.00 1.82 -0.13 0.00 0.48 0.00 0.00 55.95 58.13 1up8 s SER 476 Cb 0.00 -2.53 0.22 0.00 0.10 0.00 0.00 66.02 63.81 1up8 s SER 476 CO 0.00 -1.34 0.90 -2.65 0.98 0.00 0.00 173.24 171.13 1up8 n PRO 477 N -2.33 -1.76 -1.56 4.02 -0.02 -1.26 -4.87 135.00 127.21 1up8 n PRO 477 Ca 0.09 -0.47 -0.38 0.00 -2.02 0.00 0.00 63.50 60.71 1up8 n PRO 477 Cb 0.53 -2.15 -0.02 0.00 -0.02 0.00 0.00 33.50 31.83 1up8 n PRO 477 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 1up8 n PHE 478 N -4.67 2.40 -3.50 6.00 7.35 -1.26 -4.84 117.46 118.93 1up8 n PHE 478 Ca 0.05 -2.93 -0.14 0.00 -0.76 0.00 0.00 57.45 53.68 1up8 n PHE 478 Cb 0.54 -2.20 -0.04 0.00 0.35 0.00 0.00 39.48 38.13 1up8 n PHE 478 CO 0.00 0.00 0.00 -3.38 -0.76 0.00 0.00 176.76 172.62 1up8 s HIS 479 N 0.79 -0.54 1.05 -5.13 -3.43 -1.26 -2.61 115.29 104.17 1up8 s HIS 479 Ca 0.64 0.74 -0.14 0.00 -0.80 0.00 0.00 55.06 55.49 1up8 s HIS 479 Cb 0.19 0.47 0.14 0.00 -1.43 0.00 0.00 32.58 31.95 1up8 s HIS 479 CO -0.07 -0.61 0.57 -2.30 -2.00 0.00 0.00 174.74 170.33 1up8 n PRO 480 N 0.43 -1.26 0.17 -0.38 -0.02 -1.26 -4.96 135.00 127.71 1up8 n PRO 480 Ca -0.16 -0.33 0.05 0.00 -2.02 0.00 0.00 63.50 61.05 1up8 n PRO 480 Cb 0.60 -1.98 0.11 0.00 -0.02 0.00 0.00 33.50 32.20 1up8 n PRO 480 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 1up8 h SER 481 N -2.06 0.00 -3.37 2.55 0.87 -1.66 -3.46 113.55 106.42 1up8 h SER 481 Ca -0.51 0.00 -0.56 0.00 -1.23 0.00 0.00 61.79 59.49 1up8 h SER 481 Cb 1.32 0.00 -0.39 0.00 -0.44 0.00 0.00 62.40 62.88 1up8 h SER 481 CO 0.40 0.36 -0.77 -0.47 -0.53 0.00 0.00 176.83 175.82 1up8 s TYR 482 N -3.09 1.61 0.00 2.24 5.04 -1.26 -4.19 117.35 117.69 1up8 s TYR 482 Ca 0.04 -1.33 0.00 0.00 -2.44 0.00 0.00 57.07 53.35 1up8 s TYR 482 Cb 0.07 -1.35 0.00 0.00 0.35 0.00 0.00 41.96 41.03 1up8 s TYR 482 CO 0.72 -0.72 0.00 0.41 -1.34 0.00 0.00 175.55 174.62 1up8 n GLY 483 N 4.89 1.51 3.39 8.97 0.00 -1.26 -3.05 105.19 119.64 1up8 n GLY 483 Ca -0.08 -1.74 -0.33 0.00 0.00 0.00 0.00 46.02 43.87 1up8 n GLY 483 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1up8 s SER 484 N -1.00 3.89 0.08 1.61 0.15 -1.26 -4.86 113.70 112.32 1up8 s SER 484 Ca 0.00 -0.31 -0.22 0.00 0.70 0.00 0.00 55.95 56.12 1up8 s SER 484 Cb 0.00 -1.28 -0.13 0.00 -1.71 0.00 0.00 66.02 62.91 1up8 s SER 484 CO 0.00 0.23 1.68 1.23 1.20 0.00 0.00 173.24 177.58 1up8 h GLY 485 N 6.19 0.11 0.42 9.45 0.00 -1.94 -1.93 103.07 115.37 1up8 h GLY 485 Ca -0.33 -0.05 0.05 0.00 0.00 0.00 0.00 47.33 47.00 1up8 h GLY 485 CO 0.53 0.05 -0.15 0.45 0.00 0.00 0.00 176.54 177.41 1up8 h HIS 486 N 0.03 -0.38 0.00 5.60 3.86 -1.97 -2.71 115.15 119.59 1up8 h HIS 486 Ca 0.03 0.02 -0.10 0.00 -1.16 0.00 0.00 60.37 59.16 1up8 h HIS 486 Cb 0.08 0.19 -0.01 0.00 1.06 0.00 0.00 27.41 28.73 1up8 h HIS 486 CO -0.05 -0.22 -0.48 0.00 0.86 0.00 0.00 177.93 178.04 1up8 h ALA 487 N 0.92 1.10 -0.33 2.45 0.00 -1.91 -1.68 119.26 119.81 1up8 h ALA 487 Ca 0.11 -0.44 -0.17 0.00 0.00 0.00 0.00 54.91 54.40 1up8 h ALA 487 Cb 0.33 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.04 1up8 h ALA 487 CO -0.27 0.61 -0.47 -0.24 0.00 0.00 0.00 179.25 178.88 1up8 h VAL 488 N 0.00 1.27 -0.45 0.00 3.04 -1.29 -1.22 116.25 117.60 1up8 h VAL 488 Ca -0.00 -1.65 -0.13 0.00 -1.01 0.00 0.00 66.70 63.91 1up8 h VAL 488 Cb 0.91 1.53 -0.01 0.00 -2.01 0.00 0.00 31.29 31.71 1up8 h VAL 488 CO 0.06 0.54 -0.23 0.58 -1.01 0.00 0.00 177.57 177.52 1up8 h VAL 489 N 0.70 1.27 0.03 1.51 2.07 -1.36 -2.14 116.25 118.32 1up8 h VAL 489 Ca 0.03 -1.39 0.01 0.00 0.82 0.00 0.00 66.70 66.18 1up8 h VAL 489 Cb 1.07 1.16 -0.02 0.00 -1.52 0.00 0.00 31.29 31.99 1up8 h VAL 489 CO 0.11 0.47 -0.09 0.00 0.02 0.00 0.00 177.57 178.09 1up8 h ALA 490 N 0.92 -0.12 -0.46 1.67 0.00 -1.26 -0.36 119.26 119.67 1up8 h ALA 490 Ca 0.10 -0.00 0.06 0.00 0.00 0.00 0.00 54.91 55.07 1up8 h ALA 490 Cb 0.80 0.14 -0.05 0.00 0.00 0.00 0.00 17.79 18.68 1up8 h ALA 490 CO 0.07 -0.59 0.17 0.78 0.00 0.00 0.00 179.25 179.68 1up8 h GLY 491 N -0.16 0.60 0.88 0.00 0.00 -1.09 -2.00 103.07 101.30 1up8 h GLY 491 Ca 0.02 -0.10 -0.02 0.00 0.00 0.00 0.00 47.33 47.24 1up8 h GLY 491 CO -0.07 0.03 -0.16 0.00 0.00 0.00 0.00 176.54 176.34 1up8 h ALA 492 N 1.29 -0.46 -0.27 3.60 0.00 -1.28 -2.88 119.26 119.27 1up8 h ALA 492 Ca 0.21 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 1up8 h ALA 492 Cb 0.20 0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 1up8 h ALA 492 CO -0.21 -0.69 0.13 0.00 0.00 0.00 0.00 179.25 178.47 1up8 h VAL 494 N 0.30 1.24 -0.38 0.00 -1.51 -1.47 -2.26 116.25 112.18 1up8 h VAL 494 Ca 0.09 -1.87 0.06 0.00 -1.23 0.00 0.00 66.70 63.74 1up8 h VAL 494 Cb 0.12 2.05 -0.05 0.00 -2.13 0.00 0.00 31.29 31.28 1up8 h VAL 494 CO -0.01 0.51 0.08 0.74 -1.23 0.00 0.00 177.57 177.66 1up8 h THR 495 N 0.00 0.82 -0.43 7.19 2.02 -1.35 0.10 112.91 121.25 1up8 h THR 495 Ca -0.01 -0.07 0.05 0.00 0.77 0.00 0.00 66.41 67.15 1up8 h THR 495 Cb 1.01 0.59 -0.04 0.00 -1.74 0.00 0.00 68.15 67.96 1up8 h THR 495 CO 0.07 0.04 0.18 0.40 0.37 0.00 0.00 175.52 176.57 1up8 h ILE 496 N 0.21 0.91 -0.27 3.11 1.08 -1.07 -2.15 117.51 119.34 1up8 h ILE 496 Ca 0.18 -0.12 -0.16 0.00 -0.39 0.00 0.00 64.86 64.36 1up8 h ILE 496 Cb 0.20 0.51 -0.00 0.00 -3.07 0.00 0.00 36.82 34.46 1up8 h ILE 496 CO -0.23 0.07 -0.46 -0.07 -0.69 0.00 0.00 178.15 176.77 1up8 h LEU 497 N 0.36 0.87 -0.74 1.44 3.38 -0.89 -0.20 115.31 119.54 1up8 h LEU 497 Ca 0.20 -0.53 0.07 0.00 0.09 0.00 0.00 57.88 57.70 1up8 h LEU 497 Cb 0.15 -0.25 -0.06 0.00 0.09 0.00 0.00 40.66 40.60 1up8 h LEU 497 CO -0.17 1.23 0.42 0.11 0.09 0.00 0.00 178.44 180.12 1up8 h LYS 498 N 0.54 0.74 -0.30 1.13 1.57 -0.98 -2.06 116.57 117.21 1up8 h LYS 498 Ca 0.02 -0.04 -0.17 0.00 -1.87 0.00 0.00 60.65 58.58 1up8 h LYS 498 Cb 1.07 -0.17 -0.00 0.00 0.08 0.00 0.00 32.23 33.21 1up8 h LYS 498 CO 0.10 0.49 -0.49 0.00 -0.57 0.00 0.00 179.45 178.99 1up8 h ALA 499 N 1.38 0.56 0.08 3.86 0.00 -1.21 -3.35 119.26 120.58 1up8 h ALA 499 Ca 0.33 -0.49 -0.26 0.00 0.00 0.00 0.00 54.91 54.49 1up8 h ALA 499 Cb 0.22 -0.09 0.01 0.00 0.00 0.00 0.00 17.79 17.92 1up8 h ALA 499 CO -0.19 0.68 -1.13 0.35 0.00 0.00 0.00 179.25 178.96 1up8 h PHE 500 N 0.66 0.67 -2.80 0.00 3.57 -0.85 -3.38 116.94 114.80 1up8 h PHE 500 Ca 0.03 -0.42 -0.46 0.00 3.53 0.00 0.00 57.97 60.65 1up8 h PHE 500 Cb 1.08 -0.05 0.03 0.00 2.79 0.00 0.00 35.95 39.80 1up8 h PHE 500 CO 0.06 1.28 -0.07 -0.06 -2.23 0.00 0.00 178.31 177.29 1up8 s PHE 501 N -2.98 3.21 -1.09 0.41 0.40 -0.79 -0.73 117.98 116.41 1up8 s PHE 501 Ca -0.06 0.25 -0.22 0.00 -0.60 0.00 0.00 56.93 56.30 1up8 s PHE 501 Cb 0.07 -2.36 0.01 0.00 0.51 0.00 0.00 43.02 41.25 1up8 s PHE 501 CO 0.89 -0.41 1.73 0.34 0.70 0.00 0.00 175.22 178.47 1up8 s ASP 502 N -4.23 5.99 0.29 1.36 -1.08 -0.67 -3.71 116.67 114.61 1up8 s ASP 502 Ca 0.49 -1.56 0.24 0.00 -0.52 0.00 0.00 52.55 51.20 1up8 s ASP 502 Cb -0.10 -2.57 1.04 0.00 -1.46 0.00 0.00 42.92 39.83 1up8 s ASP 502 CO 0.38 -2.01 1.72 -1.54 0.52 0.00 0.00 175.17 174.24 1up8 n SER 503 N 10.99 0.68 0.00 -0.34 3.41 -1.26 -1.92 113.62 125.18 1up8 n SER 503 Ca 0.41 0.69 0.14 0.00 -0.26 0.00 0.00 58.87 59.85 1up8 n SER 503 Cb 0.48 -0.83 0.73 0.00 -0.26 0.00 0.00 64.21 64.33 1up8 n SER 503 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1up8 n GLY 504 N -0.26 -1.21 3.70 5.00 0.00 -1.26 -1.57 105.19 109.59 1up8 n GLY 504 Ca 0.01 -0.14 -0.44 0.00 0.00 0.00 0.00 46.02 45.46 1up8 n GLY 504 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1up8 n ILE 505 N -1.27 0.95 -3.26 -0.61 2.08 -0.81 -4.80 119.36 111.64 1up8 n ILE 505 Ca 0.14 -0.24 -0.39 0.00 0.56 0.00 0.00 62.75 62.83 1up8 n ILE 505 Cb 0.22 -1.66 -0.06 0.00 -0.75 0.00 0.00 39.64 37.39 1up8 n ILE 505 CO 0.00 0.00 0.00 -1.61 0.56 0.00 0.00 176.55 175.50 1up8 s GLU 506 N -0.40 4.22 0.19 0.38 2.02 -1.26 -1.40 118.70 122.44 1up8 s GLU 506 Ca 0.67 0.75 -0.30 0.00 0.02 0.00 0.00 54.97 56.11 1up8 s GLU 506 Cb -0.59 -3.24 -0.08 0.00 0.10 0.00 0.00 34.13 30.31 1up8 s GLU 506 CO 0.49 0.63 1.28 0.42 0.02 0.00 0.00 175.26 178.10 1up8 s ILE 507 N -1.09 3.33 -0.11 -1.63 1.09 0.38 -4.89 121.20 118.29 1up8 s ILE 507 Ca 0.29 1.10 -0.08 0.00 -1.10 0.00 0.00 60.65 60.86 1up8 s ILE 507 Cb -0.20 -3.70 -0.07 0.00 -1.06 0.00 0.00 42.46 37.43 1up8 s ILE 507 CO 0.19 0.16 0.21 -0.78 -0.10 0.00 0.00 174.94 174.63 1up8 h ASP 508 N 5.40 -0.01 -3.66 3.58 1.82 -1.97 -3.43 116.42 118.15 1up8 h ASP 508 Ca -0.45 -0.26 -0.68 0.00 -0.39 0.00 0.00 57.03 55.25 1up8 h ASP 508 Cb 1.21 0.00 -0.31 0.00 0.68 0.00 0.00 39.33 40.91 1up8 h ASP 508 CO 0.77 0.62 -0.86 -1.58 -1.61 0.00 0.00 179.24 176.57 1up8 s GLN 509 N -1.75 2.85 -0.17 0.28 2.00 -1.26 -5.12 119.66 116.48 1up8 s GLN 509 Ca -0.05 -0.86 -0.08 0.00 -2.00 0.00 0.00 55.36 52.37 1up8 s GLN 509 Cb -0.01 -2.28 -0.04 0.00 0.80 0.00 0.00 33.01 31.48 1up8 s GLN 509 CO 0.18 0.29 0.10 0.08 -0.50 0.00 0.00 175.29 175.44 1up8 s VAL 510 N 0.07 5.12 0.31 1.34 1.01 -1.26 -5.07 120.40 121.92 1up8 s VAL 510 Ca -0.10 0.08 0.11 0.00 0.00 0.00 0.00 61.98 62.07 1up8 s VAL 510 Cb -0.16 -3.29 -0.06 0.00 0.00 0.00 0.00 36.38 32.87 1up8 s VAL 510 CO 0.06 0.50 -0.15 -0.36 0.00 0.00 0.00 175.10 175.14 1up8 s PHE 511 N -0.01 2.34 0.25 5.22 0.40 -1.26 -1.15 117.98 123.76 1up8 s PHE 511 Ca 0.08 -0.41 -0.07 0.00 -0.60 0.00 0.00 56.93 55.93 1up8 s PHE 511 Cb -0.12 -1.17 -0.02 0.00 0.51 0.00 0.00 43.02 42.23 1up8 s PHE 511 CO 0.00 0.66 0.36 -1.83 0.70 0.00 0.00 175.22 175.11 1up8 s GLU 512 N -3.55 1.49 0.13 0.44 -1.05 -0.04 -4.74 118.70 111.37 1up8 s GLU 512 Ca 0.31 -1.46 -0.30 0.00 -0.15 0.00 0.00 54.97 53.37 1up8 s GLU 512 Cb -0.02 0.40 -0.07 0.00 -0.44 0.00 0.00 34.13 34.00 1up8 s GLU 512 CO 0.16 -0.58 1.11 0.08 0.95 0.00 0.00 175.26 176.97 1up8 s VAL 513 N -3.92 4.02 0.37 1.83 1.01 -1.26 -0.46 120.40 121.99 1up8 s VAL 513 Ca 0.29 1.63 -0.28 0.00 0.00 0.00 0.00 61.98 63.63 1up8 s VAL 513 Cb 0.02 -4.04 -0.11 0.00 0.00 0.00 0.00 36.38 32.25 1up8 s VAL 513 CO 0.12 0.23 1.50 -0.62 0.00 0.00 0.00 175.10 176.33 1up8 s ASP 514 N 0.27 6.34 0.45 3.32 2.15 -0.05 -4.77 116.67 124.37 1up8 s ASP 514 Ca 0.52 3.05 0.12 0.00 0.43 0.00 0.00 52.55 56.67 1up8 s ASP 514 Cb -0.28 -2.67 1.00 0.00 -0.30 0.00 0.00 42.92 40.67 1up8 s ASP 514 CO 0.33 -0.88 2.03 0.11 -0.17 0.00 0.00 175.17 176.59 1up8 h LYS 515 N 3.11 0.15 0.00 4.34 1.57 -1.91 -3.34 116.57 120.50 1up8 h LYS 515 Ca -0.51 -0.02 -0.11 0.00 -1.87 0.00 0.00 60.65 58.14 1up8 h LYS 515 Cb 1.24 -0.03 -0.02 0.00 0.08 0.00 0.00 32.23 33.50 1up8 h LYS 515 CO 0.65 0.21 -1.50 -0.25 -0.57 0.00 0.00 179.45 177.98 1up8 n ASP 516 N -4.40 3.05 -4.44 0.86 8.00 -1.26 -5.04 116.55 113.31 1up8 n ASP 516 Ca -0.01 0.00 -0.22 0.00 0.71 0.00 0.00 54.79 55.27 1up8 n ASP 516 Cb 0.17 0.87 -0.10 0.00 -0.02 0.00 0.00 41.12 42.04 1up8 n ASP 516 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 1up8 s GLU 517 N -2.29 1.57 -1.38 -1.24 2.02 -1.26 -5.05 118.70 111.07 1up8 s GLU 517 Ca -0.04 -1.78 -0.14 0.00 0.02 0.00 0.00 54.97 53.03 1up8 s GLU 517 Cb 0.03 -1.29 0.07 0.00 0.10 0.00 0.00 34.13 33.04 1up8 s GLU 517 CO 0.33 0.10 2.01 -3.47 0.02 0.00 0.00 175.26 174.25 1up8 n ASP 518 N -0.59 4.39 -3.89 -0.19 2.03 -1.26 -4.15 116.55 112.89 1up8 n ASP 518 Ca -0.06 -2.90 -0.08 0.00 0.52 0.00 0.00 54.79 52.27 1up8 n ASP 518 Cb 0.63 -1.66 -0.03 0.00 -0.72 0.00 0.00 41.12 39.34 1up8 n ASP 518 CO 0.00 0.00 0.00 -1.59 -1.92 0.00 0.00 177.20 173.69 1up8 s LYS 519 N 3.02 1.65 -0.02 -0.67 -2.85 -1.26 -4.89 119.74 114.73 1up8 s LYS 519 Ca 0.48 -1.06 -0.16 0.00 -1.00 0.00 0.00 55.97 54.23 1up8 s LYS 519 Cb 0.10 0.55 -0.05 0.00 -2.06 0.00 0.00 37.83 36.36 1up8 s LYS 519 CO -0.03 -0.73 0.42 -0.51 0.10 0.00 0.00 175.35 174.61 1up8 s LEU 520 N -2.95 4.44 0.20 2.77 1.43 -1.26 -0.88 118.68 122.43 1up8 s LEU 520 Ca 0.15 0.94 0.09 0.00 -1.03 0.00 0.00 54.13 54.27 1up8 s LEU 520 Cb -0.03 -2.61 -0.04 0.00 0.03 0.00 0.00 46.19 43.53 1up8 s LEU 520 CO 0.06 0.26 -0.17 0.68 0.23 0.00 0.00 176.35 177.41 1up8 s VAL 521 N -0.73 1.89 0.10 -1.59 -7.23 0.39 -4.83 120.40 108.40 1up8 s VAL 521 Ca 0.24 -2.11 -0.31 0.00 -1.81 0.00 0.00 61.98 57.99 1up8 s VAL 521 Cb -0.16 -1.99 -0.09 0.00 0.56 0.00 0.00 36.38 34.70 1up8 s VAL 521 CO 0.13 -0.44 1.55 -0.54 -0.31 0.00 0.00 175.10 175.49 1up8 s LYS 522 N -3.24 4.23 0.53 4.82 1.02 -1.26 -0.86 119.74 124.97 1up8 s LYS 522 Ca 0.21 2.26 -0.19 0.00 0.02 0.00 0.00 55.97 58.26 1up8 s LYS 522 Cb -0.04 -3.38 -0.06 0.00 -0.52 0.00 0.00 37.83 33.83 1up8 s LYS 522 CO 0.08 -0.62 1.09 0.45 -0.92 0.00 0.00 175.35 175.42 1up8 s SER 523 N 1.68 5.96 0.00 2.83 0.15 -0.30 -4.83 113.70 119.18 1up8 s SER 523 Ca 0.70 2.04 0.15 0.00 0.70 0.00 0.00 55.95 59.54 1up8 s SER 523 Cb -0.40 -2.57 0.49 0.00 -1.71 0.00 0.00 66.02 61.83 1up8 s SER 523 CO 0.31 -1.05 1.38 -1.54 1.20 0.00 0.00 173.24 173.54 1up8 n SER 524 N -1.27 1.98 -4.74 5.45 3.41 -1.26 -4.92 113.62 112.27 1up8 n SER 524 Ca 0.10 -1.90 -0.42 0.00 -0.26 0.00 0.00 58.87 56.40 1up8 n SER 524 Cb 0.52 -0.20 -0.02 0.00 -0.26 0.00 0.00 64.21 64.25 1up8 n SER 524 CO 0.00 0.00 0.00 0.33 -0.16 0.00 0.00 175.04 175.21 1up8 n PHE 525 N 0.55 2.85 0.89 7.33 7.35 -1.26 -4.95 117.46 130.23 1up8 n PHE 525 Ca 0.14 0.24 0.09 0.00 -0.76 0.00 0.00 57.45 57.17 1up8 n PHE 525 Cb 0.34 -2.60 -0.11 0.00 0.35 0.00 0.00 39.48 37.45 1up8 n PHE 525 CO 0.00 0.00 0.00 1.63 -0.76 0.00 0.00 176.76 177.63 1up8 n LYS 526 N 2.28 0.52 0.00 -4.13 4.76 -1.26 -5.00 118.16 115.34 1up8 n LYS 526 Ca 0.09 -0.01 0.00 0.00 -2.87 0.00 0.00 58.31 55.52 1up8 n LYS 526 Cb 0.37 -1.43 0.00 0.00 -1.84 0.00 0.00 35.03 32.13 1up8 n LYS 526 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1up8 n GLY 527 N 1.46 1.33 2.96 0.72 0.00 -1.26 -5.12 105.19 105.29 1up8 n GLY 527 Ca 0.03 -1.64 -0.20 0.00 0.00 0.00 0.00 46.02 44.22 1up8 n GLY 527 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1up8 s THR 528 N 1.44 0.68 0.11 2.61 2.01 -1.26 -5.14 115.64 116.10 1up8 s THR 528 Ca 0.00 -0.27 0.06 0.00 0.31 0.00 0.00 61.69 61.79 1up8 s THR 528 Cb 0.00 -0.63 -0.04 0.00 0.01 0.00 0.00 72.50 71.84 1up8 s THR 528 CO 0.00 0.23 -0.06 -0.76 -0.69 0.00 0.00 174.62 173.34 1up8 s LEU 529 N 0.41 3.21 0.27 4.42 1.43 -1.26 -5.04 118.68 122.13 1up8 s LEU 529 Ca -0.06 -0.33 0.11 0.00 -1.03 0.00 0.00 54.13 52.83 1up8 s LEU 529 Cb -0.10 -1.96 -0.05 0.00 0.03 0.00 0.00 46.19 44.11 1up8 s LEU 529 CO 0.01 0.16 -0.16 0.42 0.23 0.00 0.00 176.35 177.01 1up8 s THR 530 N -1.32 2.66 0.15 5.49 -4.23 -1.26 -0.47 115.64 116.66 1up8 s THR 530 Ca 0.24 -2.30 -0.25 0.00 -1.18 0.00 0.00 61.69 58.20 1up8 s THR 530 Cb -0.11 -2.40 0.01 0.00 1.34 0.00 0.00 72.50 71.34 1up8 s THR 530 CO 0.16 -0.38 1.60 0.58 -0.54 0.00 0.00 174.62 176.04 1up8 h VAL 531 N 2.24 0.24 -0.71 2.29 2.07 -1.31 -1.56 116.25 119.51 1up8 h VAL 531 Ca -0.41 0.00 0.15 0.00 0.82 0.00 0.00 66.70 67.26 1up8 h VAL 531 Cb 1.26 0.24 -0.10 0.00 -1.52 0.00 0.00 31.29 31.16 1up8 h VAL 531 CO 0.60 0.00 0.17 0.00 0.02 0.00 0.00 177.57 178.36 1up8 h ALA 532 N 0.53 0.91 -0.67 1.67 0.00 -1.57 0.28 119.26 120.40 1up8 h ALA 532 Ca 0.13 0.16 -0.07 0.00 0.00 0.00 0.00 54.91 55.13 1up8 h ALA 532 Cb 0.55 0.21 -0.03 0.00 0.00 0.00 0.00 17.79 18.53 1up8 h ALA 532 CO -0.45 -0.32 0.15 0.78 0.00 0.00 0.00 179.25 179.41 1up8 h GLY 533 N 0.28 1.15 2.00 0.00 0.00 -1.71 -1.51 103.07 103.27 1up8 h GLY 533 Ca 0.39 -0.72 -0.06 0.00 0.00 0.00 0.00 47.33 46.95 1up8 h GLY 533 CO -0.48 0.67 -0.28 0.83 0.00 0.00 0.00 176.54 177.27 1up8 h GLU 534 N 1.01 0.00 -0.04 4.80 4.39 -0.75 -1.18 114.58 122.81 1up8 h GLU 534 Ca 0.21 0.00 -0.02 0.00 0.34 0.00 0.00 59.36 59.89 1up8 h GLU 534 Cb 0.37 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.02 1up8 h GLU 534 CO 0.00 0.28 -0.07 -0.07 -1.16 0.00 0.00 179.01 178.00 1up8 h LEU 535 N 0.00 0.13 -0.79 1.33 3.38 -0.69 -2.23 115.31 116.44 1up8 h LEU 535 Ca -0.00 -0.55 0.13 0.00 0.09 0.00 0.00 57.88 57.54 1up8 h LEU 535 Cb 0.99 -0.04 -0.09 0.00 0.09 0.00 0.00 40.66 41.62 1up8 h LEU 535 CO 0.04 0.66 0.39 0.78 0.09 0.00 0.00 178.44 180.39 1up8 h ASN 536 N -0.40 0.47 -0.70 -0.43 2.35 -1.24 -1.72 115.58 113.91 1up8 h ASN 536 Ca 0.00 0.08 -0.05 0.00 -0.55 0.00 0.00 56.30 55.79 1up8 h ASN 536 Cb 0.63 0.01 -0.03 0.00 0.05 0.00 0.00 38.32 38.99 1up8 h ASN 536 CO 0.02 0.22 0.24 0.50 -1.65 0.00 0.00 177.43 176.75 1up8 h LYS 537 N 0.59 1.08 -0.48 0.81 3.64 -1.18 -1.20 116.57 119.83 1up8 h LYS 537 Ca 0.42 -0.22 -0.00 0.00 -1.27 0.00 0.00 60.65 59.58 1up8 h LYS 537 Cb 0.56 -0.16 -0.02 0.00 -0.41 0.00 0.00 32.23 32.19 1up8 h LYS 537 CO -0.34 0.92 0.29 1.25 -2.27 0.00 0.00 179.45 179.30 1up8 h LEU 538 N 1.02 0.57 -0.66 5.20 5.85 -0.97 0.26 115.31 126.58 1up8 h LEU 538 Ca 0.23 -0.05 0.02 0.00 0.84 0.00 0.00 57.88 58.92 1up8 h LEU 538 Cb 0.27 -0.14 -0.04 0.00 0.37 0.00 0.00 40.66 41.12 1up8 h LEU 538 CO -0.01 0.45 0.42 0.00 -0.34 0.00 0.00 178.44 178.96 1up8 h ALA 539 N 1.14 0.86 -0.13 1.25 0.00 -0.81 -2.05 119.26 119.53 1up8 h ALA 539 Ca 0.17 -0.03 -0.12 0.00 0.00 0.00 0.00 54.91 54.94 1up8 h ALA 539 Cb -0.02 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.53 1up8 h ALA 539 CO -0.03 0.20 -0.44 -0.44 0.00 0.00 0.00 179.25 178.54 1up8 h ASP 540 N 0.84 0.32 0.37 0.00 3.32 -0.70 -2.00 116.42 118.56 1up8 h ASP 540 Ca 0.26 -0.14 -0.01 0.00 0.02 0.00 0.00 57.03 57.16 1up8 h ASP 540 Cb -0.02 -0.09 -0.02 0.00 0.22 0.00 0.00 39.33 39.43 1up8 h ASP 540 CO -0.09 0.72 -0.30 0.78 -1.72 0.00 0.00 179.24 178.63 1up8 h ASN 541 N 0.24 -0.80 -0.41 6.45 -0.26 0.04 -0.11 115.58 120.74 1up8 h ASN 541 Ca 0.02 0.06 -0.03 0.00 -0.56 0.00 0.00 56.30 55.79 1up8 h ASN 541 Cb 0.88 0.26 -0.02 0.00 -1.06 0.00 0.00 38.32 38.39 1up8 h ASN 541 CO 0.07 -0.45 0.15 0.40 -1.06 0.00 0.00 177.43 176.55 1up8 h ILE 542 N -0.68 1.20 -0.33 2.81 5.03 -1.34 0.58 117.51 124.78 1up8 h ILE 542 Ca -0.03 -0.64 -0.00 0.00 -0.12 0.00 0.00 64.86 64.07 1up8 h ILE 542 Cb 0.59 0.86 -0.02 0.00 -3.03 0.00 0.00 36.82 35.23 1up8 h ILE 542 CO -0.02 0.23 0.19 0.00 -0.68 0.00 0.00 178.15 177.87 1up8 h ALA 543 N 1.00 0.42 0.00 1.87 0.00 -1.37 -2.86 119.26 118.31 1up8 h ALA 543 Ca 0.13 -0.06 -0.09 0.00 0.00 0.00 0.00 54.91 54.90 1up8 h ALA 543 Cb 0.21 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 1up8 h ALA 543 CO -0.01 -0.07 -0.41 0.82 0.00 0.00 0.00 179.25 179.58 1up8 h ILE 544 N 0.42 0.97 -0.88 0.00 1.08 -0.91 -2.92 117.51 115.27 1up8 h ILE 544 Ca 0.12 -1.62 0.18 0.00 -0.39 0.00 0.00 64.86 63.15 1up8 h ILE 544 Cb 0.03 1.97 -0.11 0.00 -3.07 0.00 0.00 36.82 35.64 1up8 h ILE 544 CO -0.02 0.40 0.43 1.23 -0.69 0.00 0.00 178.15 179.51 1up8 h GLY 545 N 2.05 1.46 0.99 5.37 0.00 -0.65 0.98 103.07 113.28 1up8 h GLY 545 Ca -0.00 -0.23 -0.02 0.00 0.00 0.00 0.00 47.33 47.08 1up8 h GLY 545 CO 0.05 -0.13 0.30 3.21 0.00 0.00 0.00 176.54 179.98 1up8 h ARG 546 N 0.55 0.85 -0.59 4.80 2.47 -1.43 -1.86 114.38 119.17 1up8 h ARG 546 Ca 0.51 -0.12 0.03 0.00 -1.26 0.00 0.00 59.98 59.13 1up8 h ARG 546 Cb 0.82 -0.16 -0.04 0.00 -1.65 0.00 0.00 29.97 28.95 1up8 h ARG 546 CO -0.43 0.68 0.36 -0.91 0.56 0.00 0.00 179.97 180.23 1up8 h ASN 547 N 0.82 0.58 0.28 7.04 4.21 -1.23 -2.22 115.58 125.06 1up8 h ASN 547 Ca 0.21 0.00 -0.02 0.00 1.21 0.00 0.00 56.30 57.70 1up8 h ASN 547 Cb 0.09 -0.12 -0.00 0.00 -1.12 0.00 0.00 38.32 37.17 1up8 h ASN 547 CO -0.03 0.41 -0.11 0.24 -1.29 0.00 0.00 177.43 176.65 1up8 h MET 548 N 0.71 0.00 0.00 0.81 2.86 -0.49 -0.17 114.93 118.65 1up8 h MET 548 Ca 0.23 0.00 -0.00 0.00 -2.06 0.00 0.00 59.70 57.87 1up8 h MET 548 Cb 0.02 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 31.68 1up8 h MET 548 CO -0.10 0.11 -0.01 0.00 1.06 0.00 0.00 176.91 177.97 1up8 h ALA 549 N 1.89 0.99 0.00 6.32 0.00 -0.82 -3.42 119.26 124.23 1up8 h ALA 549 Ca -0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1up8 h ALA 549 Cb 0.28 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.07 1up8 h ALA 549 CO 0.01 0.02 0.00 0.41 0.00 0.00 0.00 179.25 179.69 1up8 n GLY 550 N 0.81 0.99 0.11 0.00 0.00 -0.08 -2.14 105.19 104.89 1up8 n GLY 550 Ca 0.03 -0.01 0.03 0.00 0.00 0.00 0.00 46.02 46.07 1up8 n GLY 550 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1up8 n VAL 551 N -2.02 0.00 -4.08 1.61 0.24 -0.88 -4.14 118.33 109.05 1up8 n VAL 551 Ca 0.00 -0.40 -0.08 0.00 -2.04 0.00 0.00 64.34 61.83 1up8 n VAL 551 Cb 0.00 1.06 -0.10 0.00 -1.47 0.00 0.00 33.84 33.33 1up8 n VAL 551 CO 0.00 0.00 0.00 -1.00 -2.14 0.00 0.00 176.83 173.69 1up8 s HIS 552 N -1.29 0.51 0.31 6.34 4.02 -1.24 -4.60 115.29 119.35 1up8 s HIS 552 Ca 0.05 -0.99 0.03 0.00 1.02 0.00 0.00 55.06 55.18 1up8 s HIS 552 Cb 0.06 -0.37 -0.02 0.00 -1.02 0.00 0.00 32.58 31.22 1up8 s HIS 552 CO 0.22 -0.34 0.47 0.71 1.02 0.00 0.00 174.74 176.82 1up8 s TYR 553 N -3.56 3.38 0.20 1.40 1.51 -1.26 -4.28 117.35 114.74 1up8 s TYR 553 Ca 0.04 0.09 -0.17 0.00 -1.01 0.00 0.00 57.07 56.01 1up8 s TYR 553 Cb 0.05 -1.83 0.18 0.00 -0.11 0.00 0.00 41.96 40.25 1up8 s TYR 553 CO -0.08 0.17 1.60 0.35 -1.11 0.00 0.00 175.55 176.47 1up8 h PHE 554 N 0.90 -0.66 -0.75 2.71 3.57 -1.99 -2.74 116.94 117.98 1up8 h PHE 554 Ca -0.49 0.07 0.00 0.00 3.53 0.00 0.00 57.97 61.07 1up8 h PHE 554 Cb 1.23 0.38 -0.04 0.00 2.79 0.00 0.00 35.95 40.32 1up8 h PHE 554 CO 0.46 -0.34 0.48 0.66 -2.23 0.00 0.00 178.31 177.34 1up8 h SER 555 N -0.10 0.87 -0.87 0.41 4.64 -1.98 -1.17 113.55 115.36 1up8 h SER 555 Ca 0.27 -0.04 0.23 0.00 -0.47 0.00 0.00 61.79 61.78 1up8 h SER 555 Cb 0.52 -0.22 -0.14 0.00 -0.31 0.00 0.00 62.40 62.26 1up8 h SER 555 CO -0.67 0.65 0.23 0.44 -0.87 0.00 0.00 176.83 176.61 1up8 h ASP 556 N 1.02 0.01 0.10 4.97 3.32 -1.81 -2.60 116.42 121.42 1up8 h ASP 556 Ca 0.27 0.19 -0.01 0.00 0.02 0.00 0.00 57.03 57.51 1up8 h ASP 556 Cb -0.09 0.26 0.00 0.00 0.22 0.00 0.00 39.33 39.72 1up8 h ASP 556 CO -0.06 -0.14 -0.05 1.56 -1.72 0.00 0.00 179.24 178.83 1up8 h GLN 557 N 0.22 -0.13 -0.42 3.56 1.08 -1.18 -2.81 115.11 115.42 1up8 h GLN 557 Ca 0.54 0.01 0.03 0.00 -1.45 0.00 0.00 58.65 57.78 1up8 h GLN 557 Cb 1.07 0.03 -0.03 0.00 -0.05 0.00 0.00 27.48 28.50 1up8 h GLN 557 CO -0.64 0.34 0.22 0.35 -0.95 0.00 0.00 178.83 178.15 1up8 h PHE 558 N -0.91 0.41 -0.01 2.96 3.57 -1.47 -0.39 116.94 121.11 1up8 h PHE 558 Ca -0.01 0.02 -0.11 0.00 3.53 0.00 0.00 57.97 61.39 1up8 h PHE 558 Cb 0.54 -0.13 -0.01 0.00 2.79 0.00 0.00 35.95 39.14 1up8 h PHE 558 CO 0.11 0.22 -0.50 0.93 -2.23 0.00 0.00 178.31 176.85 1up8 h GLU 559 N 0.45 0.03 -0.28 1.11 4.39 -1.59 -2.70 114.58 115.99 1up8 h GLU 559 Ca 0.17 -0.01 -0.10 0.00 0.34 0.00 0.00 59.36 59.76 1up8 h GLU 559 Cb 0.06 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.70 1up8 h GLU 559 CO -0.11 0.52 -0.20 0.77 -1.16 0.00 0.00 179.01 178.84 1up8 h SER 560 N 0.02 0.65 -0.69 1.42 0.02 -1.18 -2.47 113.55 111.33 1up8 h SER 560 Ca -0.00 -0.44 0.14 0.00 -0.84 0.00 0.00 61.79 60.64 1up8 h SER 560 Cb 0.89 -0.18 -0.10 0.00 0.14 0.00 0.00 62.40 63.15 1up8 h SER 560 CO 0.07 0.96 0.19 -0.07 -1.14 0.00 0.00 176.83 176.83 1up8 h LEU 561 N 0.36 0.08 -1.03 5.07 3.38 -0.82 -1.14 115.31 121.21 1up8 h LEU 561 Ca 0.05 0.12 -0.08 0.00 0.09 0.00 0.00 57.88 58.07 1up8 h LEU 561 Cb 0.74 0.15 -0.02 0.00 0.09 0.00 0.00 40.66 41.62 1up8 h LEU 561 CO 0.05 0.02 -0.12 -0.07 0.09 0.00 0.00 178.44 178.42 1up8 h LEU 562 N 0.31 0.54 -0.38 1.67 3.38 -1.42 -1.98 115.31 117.43 1up8 h LEU 562 Ca 0.37 -0.14 -0.05 0.00 0.09 0.00 0.00 57.88 58.15 1up8 h LEU 562 Cb 0.59 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.18 1up8 h LEU 562 CO -0.44 0.70 0.05 0.25 0.09 0.00 0.00 178.44 179.09 1up8 h LEU 563 N 0.52 0.62 -0.72 1.67 5.85 -0.80 -2.61 115.31 119.83 1up8 h LEU 563 Ca 0.09 -0.27 -0.07 0.00 0.84 0.00 0.00 57.88 58.47 1up8 h LEU 563 Cb 0.51 -0.16 -0.03 0.00 0.37 0.00 0.00 40.66 41.35 1up8 h LEU 563 CO 0.03 0.73 0.15 1.23 -0.34 0.00 0.00 178.44 180.24 1up8 h GLY 564 N 0.48 1.21 0.48 3.75 0.00 -1.06 -2.42 103.07 105.52 1up8 h GLY 564 Ca 0.11 -0.77 0.07 0.00 0.00 0.00 0.00 47.33 46.74 1up8 h GLY 564 CO 0.01 0.72 0.09 -2.09 0.00 0.00 0.00 176.54 175.27 1up8 h GLU 565 N 1.06 0.22 -0.67 4.80 4.81 -1.31 -1.47 114.58 122.02 1up8 h GLU 565 Ca 0.22 -0.01 0.03 0.00 -0.13 0.00 0.00 59.36 59.46 1up8 h GLU 565 Cb 0.40 -0.05 -0.04 0.00 0.63 0.00 0.00 28.75 29.69 1up8 h GLU 565 CO 0.01 0.14 0.42 1.96 -0.73 0.00 0.00 179.01 180.81 1up8 h GLN 566 N 0.22 0.81 -0.28 1.92 4.20 -1.06 -1.68 115.11 119.25 1up8 h GLN 566 Ca 0.21 -0.05 -0.00 0.00 0.06 0.00 0.00 58.65 58.86 1up8 h GLN 566 Cb 0.25 -0.18 -0.01 0.00 0.30 0.00 0.00 27.48 27.84 1up8 h GLN 566 CO -0.27 0.54 0.15 0.28 -0.67 0.00 0.00 178.83 178.86 1up8 h VAL 567 N 0.84 1.12 -0.43 -0.54 2.07 -1.05 -2.14 116.25 116.11 1up8 h VAL 567 Ca 0.27 -0.31 -0.05 0.00 0.82 0.00 0.00 66.70 67.43 1up8 h VAL 567 Cb -0.00 0.82 -0.02 0.00 -1.52 0.00 0.00 31.29 30.58 1up8 h VAL 567 CO -0.10 0.12 0.07 0.00 0.02 0.00 0.00 177.57 177.68 1up8 h ALA 568 N 1.03 0.57 -0.54 1.67 0.00 -1.03 -2.20 119.26 118.78 1up8 h ALA 568 Ca 0.10 -0.22 0.08 0.00 0.00 0.00 0.00 54.91 54.86 1up8 h ALA 568 Cb 0.05 -0.16 -0.06 0.00 0.00 0.00 0.00 17.79 17.62 1up8 h ALA 568 CO -0.02 0.30 0.19 0.82 0.00 0.00 0.00 179.25 180.54 1up8 h ILE 569 N 0.57 0.81 -0.66 0.00 2.04 -1.26 -2.38 117.51 116.65 1up8 h ILE 569 Ca 0.13 -0.13 0.04 0.00 1.00 0.00 0.00 64.86 65.90 1up8 h ILE 569 Cb 0.38 0.40 -0.05 0.00 -0.74 0.00 0.00 36.82 36.82 1up8 h ILE 569 CO 0.01 0.07 0.39 1.23 0.00 0.00 0.00 178.15 179.85 1up8 h GLY 570 N 0.37 0.95 0.98 5.37 0.00 -1.13 -1.68 103.07 107.93 1up8 h GLY 570 Ca 0.26 -0.29 -0.01 0.00 0.00 0.00 0.00 47.33 47.29 1up8 h GLY 570 CO -0.26 0.23 0.25 -2.22 0.00 0.00 0.00 176.54 174.53 1up8 h ILE 571 N 0.76 1.17 -0.94 2.60 2.04 -1.12 -2.14 117.51 119.87 1up8 h ILE 571 Ca 0.27 -0.43 -0.01 0.00 1.00 0.00 0.00 64.86 65.70 1up8 h ILE 571 Cb 0.07 0.60 -0.04 0.00 -0.74 0.00 0.00 36.82 36.71 1up8 h ILE 571 CO -0.13 0.18 0.55 -0.07 0.00 0.00 0.00 178.15 178.68 1up8 h LEU 572 N 0.61 1.14 -0.34 1.44 3.38 -1.21 -0.70 115.31 119.63 1up8 h LEU 572 Ca 0.16 -0.08 -0.04 0.00 0.09 0.00 0.00 57.88 58.02 1up8 h LEU 572 Cb 0.06 -0.29 -0.01 0.00 0.09 0.00 0.00 40.66 40.50 1up8 h LEU 572 CO -0.03 0.88 0.06 -0.33 0.09 0.00 0.00 178.44 179.12 1up8 h GLU 573 N 1.30 0.56 -0.29 1.13 5.08 -1.09 -2.53 114.58 118.74 1up8 h GLU 573 Ca 0.33 -0.15 -0.03 0.00 -1.00 0.00 0.00 59.36 58.52 1up8 h GLU 573 Cb -0.04 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.14 1up8 h GLU 573 CO -0.06 0.63 0.07 0.93 -1.00 0.00 0.00 179.01 179.58 1up8 h GLU 574 N 0.40 0.46 -0.14 2.33 5.08 -1.22 -3.02 114.58 118.47 1up8 h GLU 574 Ca 0.10 -0.11 0.04 0.00 -1.00 0.00 0.00 59.36 58.39 1up8 h GLU 574 Cb 0.34 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.52 1up8 h GLU 574 CO 0.01 0.55 0.12 1.96 -1.00 0.00 0.00 179.01 180.64 1up8 h GLN 575 N 0.30 0.00 0.00 2.33 4.20 -1.12 -2.90 115.11 117.93 1up8 h GLN 575 Ca 0.09 0.00 -0.00 0.00 0.06 0.00 0.00 58.65 58.80 1up8 h GLN 575 Cb 0.29 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.07 1up8 h GLN 575 CO 0.00 0.00 -0.01 0.66 -0.67 0.00 0.00 178.83 178.81 1up8 h SER 576 N 0.00 0.00 0.63 1.46 4.64 -1.31 -0.48 113.55 118.49 1up8 h SER 576 Ca 0.07 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.39 1up8 h SER 576 Cb 0.31 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.40 1up8 h SER 576 CO -0.00 0.01 0.00 -0.07 -0.87 0.00 0.00 176.83 175.90 1up8 h LEU 577 N 0.00 0.00 0.00 5.97 3.38 -1.66 -3.30 115.31 119.70 1up8 h LEU 577 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1up8 h LEU 577 Cb 0.21 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.96 1up8 h LEU 577 CO 0.00 0.00 -0.77 0.35 0.09 0.00 0.00 178.44 178.11 1up8 n THR 578 N -2.30 0.22 -3.65 0.22 -2.24 -0.19 -4.94 114.28 101.40 1up8 n THR 578 Ca 0.01 -0.21 -0.33 0.00 -2.27 0.00 0.00 64.05 61.25 1up8 n THR 578 Cb 0.20 0.09 -0.05 0.00 -2.10 0.00 0.00 70.33 68.47 1up8 n THR 578 CO 0.00 0.00 0.00 -0.31 -0.57 0.00 0.00 175.07 174.19 1up8 s TYR 579 N -3.15 3.54 -0.18 4.78 1.51 -1.24 -5.02 117.35 117.58 1up8 s TYR 579 Ca 0.06 0.66 0.17 0.00 -1.01 0.00 0.00 57.07 56.95 1up8 s TYR 579 Cb 0.14 -2.07 0.03 0.00 -0.11 0.00 0.00 41.96 39.96 1up8 s TYR 579 CO 0.75 0.50 1.25 0.78 -1.11 0.00 0.00 175.55 177.72 1up8 h GLY 580 N 3.41 0.00 -1.28 0.71 0.00 -1.92 -3.49 103.07 100.51 1up8 h GLY 580 Ca -0.48 0.00 -0.51 0.00 0.00 0.00 0.00 47.33 46.34 1up8 h GLY 580 CO 0.69 0.00 0.34 -0.54 0.00 0.00 0.00 176.54 177.03 1up8 s GLU 581 N -3.02 2.51 -0.47 4.80 8.01 -1.26 -5.02 118.70 124.25 1up8 s GLU 581 Ca 0.02 0.98 -0.17 0.00 0.01 0.00 0.00 54.97 55.81 1up8 s GLU 581 Cb 0.08 -1.94 0.05 0.00 -4.31 0.00 0.00 34.13 28.01 1up8 s GLU 581 CO 0.76 -1.41 0.47 1.21 0.01 0.00 0.00 175.26 176.30 1up8 s ASN 582 N -3.65 6.18 0.10 -0.19 2.47 -1.26 -5.03 114.94 113.56 1up8 s ASN 582 Ca 0.60 -1.04 -0.26 0.00 0.42 0.00 0.00 52.86 52.58 1up8 s ASN 582 Cb -0.15 -2.22 0.08 0.00 -1.45 0.00 0.00 41.25 37.51 1up8 s ASN 582 CO 0.55 -0.70 1.09 0.72 -3.72 0.00 0.00 177.10 175.04 1up8 s PHE 583 N 2.06 -0.06 0.11 0.43 -0.12 -1.26 -4.69 117.98 114.45 1up8 s PHE 583 Ca 0.09 -0.20 -0.19 0.00 -0.05 0.00 0.00 56.93 56.59 1up8 s PHE 583 Cb -0.21 0.62 0.04 0.00 -0.63 0.00 0.00 43.02 42.85 1up8 s PHE 583 CO 0.10 -0.66 0.46 -0.59 -0.05 0.00 0.00 175.22 174.48 1up8 s PHE 584 N -2.76 -0.31 -0.07 3.49 -0.12 -1.12 -5.01 117.98 112.09 1up8 s PHE 584 Ca 0.16 0.11 -0.21 0.00 -0.05 0.00 0.00 56.93 56.94 1up8 s PHE 584 Cb 0.00 0.32 -0.04 0.00 -0.63 0.00 0.00 43.02 42.67 1up8 s PHE 584 CO 0.01 -0.70 0.61 -0.06 -0.05 0.00 0.00 175.22 175.03 1up8 s PHE 585 N -3.38 3.58 -0.30 3.49 0.40 -1.26 -4.05 117.98 116.46 1up8 s PHE 585 Ca 0.00 1.13 -0.17 0.00 -0.60 0.00 0.00 56.93 57.29 1up8 s PHE 585 Cb 0.01 -2.69 -0.02 0.00 0.51 0.00 0.00 43.02 40.83 1up8 s PHE 585 CO -0.09 0.17 0.48 1.21 0.70 0.00 0.00 175.22 177.69 1up8 s ASN 586 N 0.53 6.34 -0.27 1.36 3.04 -1.26 -1.39 114.94 123.28 1up8 s ASN 586 Ca 0.33 0.23 -0.01 0.00 0.04 0.00 0.00 52.86 53.45 1up8 s ASN 586 Cb -0.17 -2.26 0.05 0.00 -1.54 0.00 0.00 41.25 37.33 1up8 s ASN 586 CO 0.16 -0.34 -0.05 -0.22 -3.04 0.00 0.00 177.10 173.61 1up8 s LEU 587 N 2.28 3.56 -0.42 3.21 2.96 -0.51 -4.31 118.68 125.44 1up8 s LEU 587 Ca 0.18 -1.18 -0.29 0.00 -0.22 0.00 0.00 54.13 52.63 1up8 s LEU 587 Cb -0.16 -1.65 0.02 0.00 0.50 0.00 0.00 46.19 44.90 1up8 s LEU 587 CO 0.11 -0.20 1.27 -2.16 -1.32 0.00 0.00 176.35 174.05 1up8 s PRO 588 N 1.24 3.71 0.88 0.98 0.04 -1.26 -1.92 135.00 138.66 1up8 s PRO 588 Ca -0.04 0.84 -0.12 0.00 0.04 0.00 0.00 61.00 61.71 1up8 s PRO 588 Cb -0.19 -3.94 0.12 0.00 0.04 0.00 0.00 34.50 30.53 1up8 s PRO 588 CO -0.03 -1.40 1.12 0.15 0.04 0.00 0.00 177.00 176.88 1up8 s LYS 589 N 4.57 1.40 0.50 4.56 1.02 0.03 -4.96 119.74 126.85 1up8 s LYS 589 Ca 0.54 0.43 0.24 0.00 0.02 0.00 0.00 55.97 57.21 1up8 s LYS 589 Cb -0.11 -1.86 1.33 0.00 -0.52 0.00 0.00 37.83 36.67 1up8 s LYS 589 CO 0.30 -2.05 2.04 0.74 -0.92 0.00 0.00 175.35 175.46 1up8 h PHE 590 N -1.39 0.00 -0.06 3.18 0.05 -1.96 -2.05 116.94 114.72 1up8 h PHE 590 Ca -0.50 0.00 0.00 0.00 3.82 0.00 0.00 57.97 61.29 1up8 h PHE 590 Cb 1.31 0.00 0.00 0.00 2.00 0.00 0.00 35.95 39.26 1up8 h PHE 590 CO 0.35 0.14 0.00 -0.40 -0.18 0.00 0.00 178.31 178.22 1up8 n ASP 591 N -3.77 0.46 0.00 2.17 5.75 -1.26 -4.51 116.55 115.39 1up8 n ASP 591 Ca -0.02 -1.61 0.00 0.00 -0.01 0.00 0.00 54.79 53.15 1up8 n ASP 591 Cb 0.25 -0.04 0.00 0.00 -1.03 0.00 0.00 41.12 40.31 1up8 n ASP 591 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1up8 n GLY 592 N 0.83 1.17 4.00 6.12 0.00 -0.77 -5.05 105.19 111.50 1up8 n GLY 592 Ca 0.12 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.96 1up8 n GLY 592 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1up8 s THR 593 N -3.44 3.23 -0.06 2.61 -4.23 -1.26 -4.90 115.64 107.60 1up8 s THR 593 Ca 0.00 -0.99 0.06 0.00 -1.18 0.00 0.00 61.69 59.58 1up8 s THR 593 Cb 0.00 -3.09 -0.01 0.00 1.34 0.00 0.00 72.50 70.74 1up8 s THR 593 CO 0.00 -0.04 -0.23 -0.89 -0.54 0.00 0.00 174.62 172.93 1up8 s THR 594 N -2.32 1.89 -0.06 3.99 2.01 -1.26 -0.79 115.64 119.09 1up8 s THR 594 Ca 0.53 -0.97 0.04 0.00 0.31 0.00 0.00 61.69 61.59 1up8 s THR 594 Cb -0.10 -1.60 -0.02 0.00 0.01 0.00 0.00 72.50 70.78 1up8 s THR 594 CO 0.33 0.53 -0.16 -0.51 -0.69 0.00 0.00 174.62 174.11 1up8 s ILE 595 N -0.09 2.87 -0.25 1.82 2.07 -0.81 -4.97 121.20 121.83 1up8 s ILE 595 Ca -0.04 -0.79 -0.08 0.00 -1.41 0.00 0.00 60.65 58.34 1up8 s ILE 595 Cb -0.13 -2.12 -0.03 0.00 0.13 0.00 0.00 42.46 40.31 1up8 s ILE 595 CO 0.03 0.58 0.09 -1.10 -1.91 0.00 0.00 174.94 172.63 1up8 s GLN 596 N -0.51 3.70 0.00 3.50 -0.21 -1.26 -1.43 119.66 123.46 1up8 s GLN 596 Ca 0.07 -0.45 0.02 0.00 0.02 0.00 0.00 55.36 55.02 1up8 s GLN 596 Cb -0.12 -3.36 0.02 0.00 1.00 0.00 0.00 33.01 30.55 1up8 s GLN 596 CO 0.01 -0.17 0.57 -0.89 -2.12 0.00 0.00 175.29 172.69