#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1noi n LYS 11 N 0.00 2.90 0.00 -0.14 5.02 -1.26 -2.18 118.16 122.49 1noi n LYS 11 Ca 0.00 -1.69 0.00 0.00 -2.02 0.00 0.00 58.31 54.60 1noi n LYS 11 Cb 0.00 -2.48 0.00 0.00 -0.02 0.00 0.00 35.03 32.53 1noi n LYS 11 CO 0.00 0.00 0.00 0.94 -0.52 0.00 0.00 177.40 177.82 1noi n GLN 12 N 3.31 0.00 -2.83 1.97 0.00 -1.26 -4.94 117.38 113.64 1noi n GLN 12 Ca 0.62 0.00 -0.43 0.00 -0.00 0.00 0.00 57.00 57.19 1noi n GLN 12 Cb 0.42 -0.02 -0.03 0.00 0.00 0.00 0.00 30.24 30.61 1noi n GLN 12 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.06 177.48 1noi s ILE 13 N 0.00 4.41 0.03 1.69 1.01 -0.93 -4.93 121.20 122.47 1noi s ILE 13 Ca 0.00 -0.92 0.03 0.00 0.00 0.00 0.00 60.65 59.76 1noi s ILE 13 Cb 0.00 -4.80 -0.02 0.00 0.01 0.00 0.00 42.46 37.66 1noi s ILE 13 CO 0.00 -1.57 -0.10 -0.55 0.00 0.00 0.00 174.94 172.72 1noi s SER 14 N 3.86 1.16 -0.03 3.58 0.15 -1.26 -5.06 113.70 116.10 1noi s SER 14 Ca 0.31 -0.38 -0.25 0.00 0.70 0.00 0.00 55.95 56.33 1noi s SER 14 Cb -0.08 -0.06 -0.19 0.00 -1.71 0.00 0.00 66.02 63.98 1noi s SER 14 CO -0.01 -0.02 1.13 0.58 1.20 0.00 0.00 173.24 176.11 1noi h VAL 15 N 4.65 1.18 0.00 4.45 2.07 -1.93 -3.40 116.25 123.26 1noi h VAL 15 Ca -0.35 -1.14 0.00 0.00 0.82 0.00 0.00 66.70 66.03 1noi h VAL 15 Cb 1.19 1.89 0.00 0.00 -1.52 0.00 0.00 31.29 32.85 1noi h VAL 15 CO 0.45 0.27 0.00 0.54 0.02 0.00 0.00 177.57 178.85 1noi n ARG 16 N -4.90 0.00 0.00 1.57 1.74 -1.25 -4.13 116.66 109.69 1noi n ARG 16 Ca -0.08 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.00 1noi n ARG 16 Cb 0.27 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.71 1noi n ARG 16 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1noi n GLY 17 N -0.31 0.00 3.56 -0.13 0.00 -1.26 -4.59 105.19 102.46 1noi n GLY 17 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 1noi n GLY 17 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1noi s LEU 18 N 0.00 3.35 -0.29 0.99 1.98 -1.26 -4.97 118.68 118.49 1noi s LEU 18 Ca 0.00 -0.16 0.03 0.00 -2.89 0.00 0.00 54.13 51.11 1noi s LEU 18 Cb 0.00 -2.88 0.18 0.00 0.66 0.00 0.00 46.19 44.14 1noi s LEU 18 CO 0.00 -1.63 0.48 0.00 -1.89 0.00 0.00 176.35 173.31 1noi s ALA 19 N 5.26 -1.70 -0.05 5.97 0.00 -1.26 -4.91 121.76 125.08 1noi s ALA 19 Ca 0.39 0.61 0.23 0.00 0.00 0.00 0.00 51.96 53.20 1noi s ALA 19 Cb -0.08 -2.25 0.70 0.00 0.00 0.00 0.00 23.12 21.49 1noi s ALA 19 CO 0.21 -1.76 1.73 0.78 0.00 0.00 0.00 175.76 176.72 1noi h GLY 20 N 8.10 0.00 0.00 0.00 0.00 -1.93 -3.49 103.07 105.74 1noi h GLY 20 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.27 1noi h GLY 20 CO 0.22 0.00 0.00 -0.62 0.00 0.00 0.00 176.54 176.14 1noi n VAL 21 N -3.25 0.00 0.10 4.60 0.31 -1.26 -1.04 118.33 117.79 1noi n VAL 21 Ca 0.01 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.34 1noi n VAL 21 Cb 0.49 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.42 1noi n VAL 21 CO 0.00 0.00 0.00 -1.84 -1.32 0.00 0.00 176.83 173.67 1noi n GLU 22 N 14.00 0.10 -3.72 5.55 0.00 -1.26 -4.69 120.64 130.63 1noi n GLU 22 Ca 0.00 0.00 -0.37 0.00 0.00 0.00 0.00 57.16 56.79 1noi n GLU 22 Cb 0.00 -1.33 -0.12 0.00 0.00 0.00 0.00 31.44 29.99 1noi n GLU 22 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.13 178.34 1noi s ASN 23 N 0.42 5.30 0.13 -1.84 3.84 -0.21 -4.87 114.94 117.71 1noi s ASN 23 Ca 0.00 -0.24 -0.16 0.00 0.21 0.00 0.00 52.86 52.66 1noi s ASN 23 Cb 0.00 -1.96 -0.01 0.00 -0.55 0.00 0.00 41.25 38.73 1noi s ASN 23 CO 0.00 -0.06 1.68 0.58 -2.79 0.00 0.00 177.10 176.50 1noi h VAL 24 N 5.55 1.20 -0.83 -5.21 2.07 -1.86 -3.01 116.25 114.17 1noi h VAL 24 Ca -0.37 -0.60 0.14 0.00 0.82 0.00 0.00 66.70 66.69 1noi h VAL 24 Cb 1.17 0.86 -0.09 0.00 -1.52 0.00 0.00 31.29 31.71 1noi h VAL 24 CO 0.58 0.22 0.42 0.74 0.02 0.00 0.00 177.57 179.55 1noi h THR 25 N 0.49 0.74 0.02 2.57 2.02 -1.96 0.78 112.91 117.57 1noi h THR 25 Ca 0.13 -0.21 -0.05 0.00 0.77 0.00 0.00 66.41 67.05 1noi h THR 25 Cb 0.19 0.08 0.00 0.00 -1.74 0.00 0.00 68.15 66.68 1noi h THR 25 CO -0.01 0.11 -0.20 -0.33 0.37 0.00 0.00 175.52 175.46 1noi h GLU 26 N 0.61 0.10 -1.04 6.66 4.39 -1.93 -2.80 114.58 120.58 1noi h GLU 26 Ca 0.44 -0.14 0.29 0.00 0.34 0.00 0.00 59.36 60.30 1noi h GLU 26 Cb 0.61 0.04 -0.12 0.00 -0.10 0.00 0.00 28.75 29.18 1noi h GLU 26 CO -0.35 0.97 0.63 -0.07 -1.16 0.00 0.00 179.01 179.02 1noi h LEU 27 N -0.69 0.54 -0.46 1.33 3.38 -1.33 0.15 115.31 118.22 1noi h LEU 27 Ca -0.03 0.14 -0.17 0.00 0.09 0.00 0.00 57.88 57.91 1noi h LEU 27 Cb 1.05 0.07 -0.00 0.00 0.09 0.00 0.00 40.66 41.86 1noi h LEU 27 CO 0.04 0.01 -0.53 0.11 0.09 0.00 0.00 178.44 178.15 1noi h LYS 28 N 0.42 0.66 -0.13 1.13 1.57 -0.80 -1.26 116.57 118.16 1noi h LYS 28 Ca 0.67 -0.41 0.00 0.00 -1.87 0.00 0.00 60.65 59.05 1noi h LYS 28 Cb 1.54 0.04 -0.01 0.00 0.08 0.00 0.00 32.23 33.89 1noi h LYS 28 CO -0.46 1.02 0.08 -0.22 -0.57 0.00 0.00 179.45 179.30 1noi h LYS 29 N 0.51 0.17 0.00 3.15 3.64 -0.63 -1.57 116.57 121.84 1noi h LYS 29 Ca 0.01 -0.01 -0.07 0.00 -1.27 0.00 0.00 60.65 59.31 1noi h LYS 29 Cb 1.09 -0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 32.86 1noi h LYS 29 CO 0.11 0.13 -0.34 -0.91 -2.27 0.00 0.00 179.45 176.17 1noi h ASN 30 N 0.16 0.00 -0.25 4.20 2.35 -0.71 -0.79 115.58 120.53 1noi h ASN 30 Ca 0.05 0.00 -0.02 0.00 -0.55 0.00 0.00 56.30 55.78 1noi h ASN 30 Cb 0.00 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.36 1noi h ASN 30 CO -0.01 0.34 0.07 0.15 -1.65 0.00 0.00 177.43 176.33 1noi h PHE 31 N 0.00 0.40 -0.60 1.19 3.04 -0.92 -2.49 116.94 117.56 1noi h PHE 31 Ca -0.00 -0.04 -0.06 0.00 3.98 0.00 0.00 57.97 61.84 1noi h PHE 31 Cb 0.95 -0.12 -0.03 0.00 2.56 0.00 0.00 35.95 39.32 1noi h PHE 31 CO 0.00 0.46 0.13 -0.91 -2.02 0.00 0.00 178.31 175.97 1noi h ASN 32 N 0.23 0.89 0.18 0.41 2.35 -0.27 -0.97 115.58 118.41 1noi h ASN 32 Ca 0.08 -0.18 -0.06 0.00 -0.55 0.00 0.00 56.30 55.59 1noi h ASN 32 Cb 0.25 -0.23 -0.01 0.00 0.05 0.00 0.00 38.32 38.38 1noi h ASN 32 CO -0.00 0.88 -0.23 0.03 -1.65 0.00 0.00 177.43 176.46 1noi h ARG 33 N 0.90 0.09 0.22 0.81 3.08 -1.11 -2.77 114.38 115.60 1noi h ARG 33 Ca 0.19 -0.02 -0.30 0.00 0.07 0.00 0.00 59.98 59.92 1noi h ARG 33 Cb 0.35 -0.01 0.03 0.00 0.08 0.00 0.00 29.97 30.42 1noi h ARG 33 CO 0.00 0.32 -1.33 0.45 -1.07 0.00 0.00 179.97 178.34 1noi h HIS 34 N 0.08 0.83 -0.53 3.04 3.86 -0.88 -0.09 115.15 121.47 1noi h HIS 34 Ca 0.01 -0.60 -0.05 0.00 -1.16 0.00 0.00 60.37 58.57 1noi h HIS 34 Cb 0.45 -0.03 -0.02 0.00 1.06 0.00 0.00 27.41 28.87 1noi h HIS 34 CO 0.00 1.51 0.12 1.25 0.86 0.00 0.00 177.93 181.68 1noi h LEU 35 N -0.01 0.75 0.01 2.43 5.85 -1.19 -0.14 115.31 123.00 1noi h LEU 35 Ca -0.24 -0.13 -0.25 0.00 0.84 0.00 0.00 57.88 58.10 1noi h LEU 35 Cb 2.01 -0.20 -0.03 0.00 0.37 0.00 0.00 40.66 42.81 1noi h LEU 35 CO 0.23 0.74 -1.36 1.41 -0.34 0.00 0.00 178.44 179.12 1noi n HIS 36 N -4.28 1.02 -0.04 1.25 8.25 -1.05 -1.01 115.22 119.37 1noi n HIS 36 Ca 0.04 0.42 -0.02 0.00 -0.26 0.00 0.00 57.72 57.89 1noi n HIS 36 Cb 0.23 -1.10 -0.14 0.00 1.12 0.00 0.00 29.99 30.09 1noi n HIS 36 CO 0.00 0.00 0.00 1.19 0.64 0.00 0.00 176.34 178.17 1noi n PHE 37 N -4.35 0.35 0.01 4.41 3.72 -0.05 -2.28 117.46 119.27 1noi n PHE 37 Ca -0.33 0.12 -0.19 0.00 -0.05 0.00 0.00 57.45 57.00 1noi n PHE 37 Cb 0.72 -0.93 -0.14 0.00 -0.94 0.00 0.00 39.48 38.19 1noi n PHE 37 CO 0.00 0.00 0.00 1.15 -0.05 0.00 0.00 176.76 177.86 1noi h THR 38 N 0.00 0.72 0.00 4.37 2.02 -1.05 -3.40 112.91 115.57 1noi h THR 38 Ca -0.30 -2.44 -0.08 0.00 0.77 0.00 0.00 66.41 64.36 1noi h THR 38 Cb 1.76 2.53 -0.01 0.00 -1.74 0.00 0.00 68.15 70.68 1noi h THR 38 CO 0.03 0.83 -1.34 0.18 0.37 0.00 0.00 175.52 175.58 1noi n LEU 39 N -3.42 0.72 -3.38 2.58 4.32 -0.35 -5.01 117.00 112.47 1noi n LEU 39 Ca -0.28 0.29 -0.19 0.00 -0.02 0.00 0.00 56.01 55.82 1noi n LEU 39 Cb 1.05 0.02 0.05 0.00 -1.62 0.00 0.00 43.42 42.93 1noi n LEU 39 CO 0.45 -0.01 0.02 0.52 -1.22 0.00 0.00 177.39 177.15 1noi n VAL 40 N -2.71 -8.14 -4.45 4.08 0.31 -0.97 -4.99 118.33 101.46 1noi n VAL 40 Ca -0.06 -1.10 -0.24 0.00 -0.01 0.00 0.00 64.34 62.94 1noi n VAL 40 Cb 0.69 -5.82 -0.08 0.00 -0.91 0.00 0.00 33.84 27.72 1noi n VAL 40 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 1noi s LYS 41 N -4.77 1.88 0.34 5.55 -0.14 -0.18 -5.01 119.74 117.41 1noi s LYS 41 Ca 0.41 -2.13 -0.12 0.00 -1.36 0.00 0.00 55.97 52.77 1noi s LYS 41 Cb -0.09 -0.35 0.03 0.00 -1.68 0.00 0.00 37.83 35.74 1noi s LYS 41 CO 0.78 -0.53 0.64 0.16 -0.76 0.00 0.00 175.35 175.64 1noi s ASP 42 N -3.54 0.26 0.57 2.83 1.47 -1.26 -4.04 116.67 112.95 1noi s ASP 42 Ca 0.28 -1.17 0.34 0.00 1.18 0.00 0.00 52.55 53.18 1noi s ASP 42 Cb 0.02 0.74 1.67 0.00 -0.34 0.00 0.00 42.92 45.01 1noi s ASP 42 CO 0.18 -1.45 2.12 0.08 0.68 0.00 0.00 175.17 176.77 1noi h ARG 43 N 2.07 0.00 0.00 2.11 0.11 -1.97 0.26 114.38 116.96 1noi h ARG 43 Ca -0.29 0.00 -0.14 0.00 0.10 0.00 0.00 59.98 59.65 1noi h ARG 43 Cb 1.25 0.00 -0.02 0.00 1.11 0.00 0.00 29.97 32.31 1noi h ARG 43 CO 0.37 0.06 -0.67 -0.91 0.10 0.00 0.00 179.97 178.92 1noi h ASN 44 N 0.00 0.00 0.00 0.08 4.21 -2.05 -3.31 115.58 114.51 1noi h ASN 44 Ca -0.00 0.00 -0.01 0.00 1.21 0.00 0.00 56.30 57.50 1noi h ASN 44 Cb 0.32 0.00 -0.00 0.00 -1.12 0.00 0.00 38.32 37.52 1noi h ASN 44 CO 0.01 0.67 -1.60 0.52 -1.29 0.00 0.00 177.43 175.73 1noi n VAL 45 N -3.41 0.02 -1.55 2.81 0.31 -0.84 -5.05 118.33 110.62 1noi n VAL 45 Ca 0.00 -0.30 -0.33 0.00 -0.01 0.00 0.00 64.34 63.70 1noi n VAL 45 Cb 0.75 0.18 0.07 0.00 -0.91 0.00 0.00 33.84 33.93 1noi n VAL 45 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1noi s ALA 46 N -2.89 2.27 0.24 3.52 0.00 0.86 -4.90 121.76 120.85 1noi s ALA 46 Ca -0.05 0.66 0.07 0.00 0.00 0.00 0.00 51.96 52.64 1noi s ALA 46 Cb 0.08 -3.38 -0.05 0.00 0.00 0.00 0.00 23.12 19.77 1noi s ALA 46 CO 0.54 -1.60 -0.10 -0.08 0.00 0.00 0.00 175.76 174.52 1noi s THR 47 N -2.25 1.63 0.24 0.00 -1.32 -1.26 -4.98 115.64 107.71 1noi s THR 47 Ca 0.69 -2.16 -0.13 0.00 -1.21 0.00 0.00 61.69 58.89 1noi s THR 47 Cb -0.24 -2.23 0.33 0.00 -1.51 0.00 0.00 72.50 68.85 1noi s THR 47 CO 0.44 -0.46 1.50 -2.65 -2.21 0.00 0.00 174.62 171.25 1noi n PRO 48 N -0.46 -0.16 -0.09 7.08 -0.02 -1.26 -0.24 135.00 139.84 1noi n PRO 48 Ca -0.07 1.50 0.07 0.00 -2.02 0.00 0.00 63.50 62.97 1noi n PRO 48 Cb 0.62 -2.23 0.41 0.00 -0.02 0.00 0.00 33.50 32.29 1noi n PRO 48 CO 0.00 0.00 0.00 -0.09 1.98 0.00 0.00 175.50 177.39 1noi h ARG 49 N 0.00 0.58 -0.13 -0.52 2.43 -1.96 -0.75 114.38 114.03 1noi h ARG 49 Ca 0.39 -0.03 -0.21 0.00 -0.81 0.00 0.00 59.98 59.32 1noi h ARG 49 Cb 0.63 -0.13 0.00 0.00 -0.42 0.00 0.00 29.97 30.06 1noi h ARG 49 CO -0.97 0.38 -0.76 -0.44 -1.51 0.00 0.00 179.97 176.67 1noi h ASP 50 N 0.60 0.79 -0.36 -3.80 3.32 -1.00 -0.07 116.42 115.90 1noi h ASP 50 Ca 0.24 -0.51 -0.12 0.00 0.02 0.00 0.00 57.03 56.66 1noi h ASP 50 Cb 0.19 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 39.50 1noi h ASP 50 CO -0.07 1.29 -0.21 1.88 -1.72 0.00 0.00 179.24 180.42 1noi h TYR 51 N 0.45 0.96 -0.66 4.55 0.05 -0.80 -1.55 116.97 119.98 1noi h TYR 51 Ca -0.04 -0.22 -0.02 0.00 0.05 0.00 0.00 58.73 58.50 1noi h TYR 51 Cb 1.37 -0.23 -0.03 0.00 1.01 0.00 0.00 36.73 38.85 1noi h TYR 51 CO 0.07 0.98 0.33 -0.92 -1.05 0.00 0.00 178.16 177.57 1noi h TYR 52 N 0.74 0.93 -0.76 4.88 3.20 -0.97 -0.43 116.97 124.57 1noi h TYR 52 Ca 0.10 -0.04 -0.04 0.00 3.14 0.00 0.00 58.73 61.89 1noi h TYR 52 Cb 0.74 -0.29 -0.03 0.00 1.54 0.00 0.00 36.73 38.68 1noi h TYR 52 CO 0.04 0.69 0.32 0.74 -1.64 0.00 0.00 178.16 178.31 1noi h PHE 53 N 0.91 1.14 -0.36 -3.82 -1.00 -0.54 -0.28 116.94 112.99 1noi h PHE 53 Ca 0.23 -0.07 -0.10 0.00 2.81 0.00 0.00 57.97 60.84 1noi h PHE 53 Cb 0.10 -0.34 -0.02 0.00 3.61 0.00 0.00 35.95 39.29 1noi h PHE 53 CO 0.00 0.85 -0.18 0.00 -1.61 0.00 0.00 178.31 177.38 1noi h ALA 54 N 1.24 1.03 -0.27 2.45 0.00 -1.09 -0.55 119.26 122.07 1noi h ALA 54 Ca 0.26 -0.33 -0.08 0.00 0.00 0.00 0.00 54.91 54.76 1noi h ALA 54 Cb 0.18 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 1noi h ALA 54 CO -0.02 0.58 -0.15 1.25 0.00 0.00 0.00 179.25 180.91 1noi h LEU 55 N 0.59 0.60 -1.59 0.00 5.85 -0.37 -2.31 115.31 118.08 1noi h LEU 55 Ca 0.09 -0.42 0.03 0.00 0.84 0.00 0.00 57.88 58.42 1noi h LEU 55 Cb 0.63 -0.17 -0.03 0.00 0.37 0.00 0.00 40.66 41.47 1noi h LEU 55 CO 0.04 0.89 0.32 0.00 -0.34 0.00 0.00 178.44 179.35 1noi h ALA 56 N 0.73 1.77 0.00 1.25 0.00 -0.89 -0.59 119.26 121.52 1noi h ALA 56 Ca 0.06 -0.02 -0.17 0.00 0.00 0.00 0.00 54.91 54.77 1noi h ALA 56 Cb 0.67 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.28 1noi h ALA 56 CO 0.04 0.18 -0.98 0.45 0.00 0.00 0.00 179.25 178.95 1noi h HIS 57 N 0.55 0.00 0.17 0.00 3.86 -1.07 -1.67 115.15 116.99 1noi h HIS 57 Ca 0.19 0.00 -0.01 0.00 -1.16 0.00 0.00 60.37 59.39 1noi h HIS 57 Cb 0.08 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.55 1noi h HIS 57 CO -0.00 0.74 -0.08 1.15 0.86 0.00 0.00 177.93 180.59 1noi h THR 58 N 0.00 0.94 -0.45 2.45 2.02 -0.65 -2.46 112.91 114.76 1noi h THR 58 Ca -0.07 -0.70 0.06 0.00 0.77 0.00 0.00 66.41 66.47 1noi h THR 58 Cb 1.62 1.36 -0.05 0.00 -1.74 0.00 0.00 68.15 69.34 1noi h THR 58 CO 0.08 0.16 0.15 0.58 0.37 0.00 0.00 175.52 176.86 1noi h VAL 59 N -0.59 0.83 -0.84 3.16 2.07 -1.25 -2.51 116.25 117.12 1noi h VAL 59 Ca -0.02 -0.11 0.16 0.00 0.82 0.00 0.00 66.70 67.55 1noi h VAL 59 Cb 0.44 0.50 -0.06 0.00 -1.52 0.00 0.00 31.29 30.64 1noi h VAL 59 CO 0.04 0.06 0.55 -0.09 0.02 0.00 0.00 177.57 178.15 1noi h ARG 60 N 0.31 0.50 -0.88 1.57 2.43 -1.22 -0.10 114.38 116.99 1noi h ARG 60 Ca 0.22 -0.03 0.03 0.00 -0.81 0.00 0.00 59.98 59.39 1noi h ARG 60 Cb 0.23 -0.11 -0.05 0.00 -0.42 0.00 0.00 29.97 29.61 1noi h ARG 60 CO -0.23 0.33 0.57 -0.44 -1.51 0.00 0.00 179.97 178.68 1noi h ASP 61 N 0.51 0.94 -0.07 -3.80 3.32 -0.97 0.87 116.42 117.23 1noi h ASP 61 Ca 0.42 -0.01 -0.12 0.00 0.02 0.00 0.00 57.03 57.34 1noi h ASP 61 Cb 0.88 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 40.21 1noi h ASP 61 CO -0.17 0.65 -0.35 0.45 -1.72 0.00 0.00 179.24 178.10 1noi h HIS 62 N 1.10 0.66 -0.13 4.55 3.86 -1.09 -2.19 115.15 121.90 1noi h HIS 62 Ca 0.35 -0.17 -0.03 0.00 -1.16 0.00 0.00 60.37 59.36 1noi h HIS 62 Cb 0.01 -0.15 -0.00 0.00 1.06 0.00 0.00 27.41 28.33 1noi h HIS 62 CO -0.02 0.84 -0.03 1.25 0.86 0.00 0.00 177.93 180.83 1noi h LEU 63 N 0.47 0.25 -0.57 2.43 6.46 -1.23 -3.20 115.31 119.93 1noi h LEU 63 Ca 0.05 -0.37 -0.16 0.00 -0.12 0.00 0.00 57.88 57.28 1noi h LEU 63 Cb 0.83 -0.07 -0.01 0.00 -0.73 0.00 0.00 40.66 40.68 1noi h LEU 63 CO 0.07 0.56 -0.67 -0.37 -0.62 0.00 0.00 178.44 177.42 1noi h VAL 64 N -0.06 1.42 -0.94 1.05 -1.51 -0.69 -0.05 116.25 115.46 1noi h VAL 64 Ca 0.03 -2.14 0.01 0.00 -1.23 0.00 0.00 66.70 63.37 1noi h VAL 64 Cb 0.45 2.12 -0.05 0.00 -2.13 0.00 0.00 31.29 31.69 1noi h VAL 64 CO 0.01 0.63 0.62 1.23 -1.23 0.00 0.00 177.57 178.83 1noi h GLY 65 N 1.59 1.33 2.00 5.19 0.00 -1.47 -0.65 103.07 111.06 1noi h GLY 65 Ca -0.01 -0.51 -0.12 0.00 0.00 0.00 0.00 47.33 46.69 1noi h GLY 65 CO 0.10 0.50 -0.58 3.21 0.00 0.00 0.00 176.54 179.77 1noi h ARG 66 N 1.28 0.00 -0.18 4.80 3.08 -1.50 -2.81 114.38 119.05 1noi h ARG 66 Ca 0.34 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.39 1noi h ARG 66 Cb -0.13 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 29.91 1noi h ARG 66 CO -0.07 0.58 0.10 2.35 -1.07 0.00 0.00 179.97 181.86 1noi h TRP 67 N 0.00 0.25 0.61 3.04 7.01 0.41 -1.04 115.95 126.23 1noi h TRP 67 Ca -0.01 -0.00 -0.02 0.00 2.11 0.00 0.00 58.89 60.97 1noi h TRP 67 Cb 1.10 -0.08 -0.01 0.00 -2.10 0.00 0.00 29.16 28.07 1noi h TRP 67 CO 0.00 0.22 -0.44 0.82 -2.79 0.00 0.00 178.44 176.26 1noi h ILE 68 N 0.20 0.13 -0.57 2.65 2.04 -1.20 -1.84 117.51 118.92 1noi h ILE 68 Ca 0.07 0.00 0.05 0.00 1.00 0.00 0.00 64.86 65.97 1noi h ILE 68 Cb 0.05 0.13 -0.05 0.00 -0.74 0.00 0.00 36.82 36.21 1noi h ILE 68 CO -0.01 0.00 0.30 0.03 0.00 0.00 0.00 178.15 178.47 1noi h ARG 69 N -1.01 0.55 -0.04 2.37 3.08 -1.50 -1.28 114.38 116.56 1noi h ARG 69 Ca -0.07 -0.03 0.04 0.00 0.07 0.00 0.00 59.98 59.98 1noi h ARG 69 Cb 0.84 -0.12 -0.05 0.00 0.08 0.00 0.00 29.97 30.71 1noi h ARG 69 CO 0.04 0.37 -0.31 1.15 -1.07 0.00 0.00 179.97 180.15 1noi h THR 70 N 0.57 0.32 -0.31 2.04 2.02 -1.12 -0.07 112.91 116.37 1noi h THR 70 Ca 0.25 0.00 -0.08 0.00 0.77 0.00 0.00 66.41 67.35 1noi h THR 70 Cb 0.15 0.32 -0.02 0.00 -1.74 0.00 0.00 68.15 66.87 1noi h THR 70 CO -0.17 0.00 -0.16 1.56 0.37 0.00 0.00 175.52 177.12 1noi h GLN 71 N -0.43 0.55 -0.50 6.66 1.08 -0.78 0.16 115.11 121.84 1noi h GLN 71 Ca 0.07 -0.18 -0.12 0.00 -1.45 0.00 0.00 58.65 56.98 1noi h GLN 71 Cb 0.54 -0.05 -0.01 0.00 -0.05 0.00 0.00 27.48 27.91 1noi h GLN 71 CO -0.29 0.69 -0.14 1.96 -0.95 0.00 0.00 178.83 180.10 1noi h GLN 72 N 0.50 0.98 -0.63 1.46 4.20 -1.09 -0.69 115.11 119.83 1noi h GLN 72 Ca 0.08 -0.39 0.01 0.00 0.06 0.00 0.00 58.65 58.42 1noi h GLN 72 Cb 0.57 -0.05 -0.03 0.00 0.30 0.00 0.00 27.48 28.27 1noi h GLN 72 CO 0.04 1.06 0.41 1.25 -0.67 0.00 0.00 178.83 180.92 1noi h HIS 73 N 0.84 0.77 0.00 2.96 2.76 0.85 0.15 115.15 123.48 1noi h HIS 73 Ca 0.12 0.02 -0.04 0.00 -2.20 0.00 0.00 60.37 58.27 1noi h HIS 73 Cb 0.71 -0.26 -0.01 0.00 1.55 0.00 0.00 27.41 29.41 1noi h HIS 73 CO 0.05 0.47 -0.21 1.88 -1.30 0.00 0.00 177.93 178.82 1noi h TYR 74 N 0.83 0.00 -0.04 5.26 0.05 -0.33 -1.47 116.97 121.27 1noi h TYR 74 Ca 0.24 0.00 -0.18 0.00 0.05 0.00 0.00 58.73 58.84 1noi h TYR 74 Cb -0.05 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 37.68 1noi h TYR 74 CO -0.04 0.21 -0.77 -0.92 -1.05 0.00 0.00 178.16 175.60 1noi h TYR 75 N 0.00 0.40 0.13 4.88 3.20 0.77 -2.42 116.97 123.93 1noi h TYR 75 Ca -0.00 -0.19 -0.26 0.00 3.14 0.00 0.00 58.73 61.42 1noi h TYR 75 Cb 0.44 -0.06 0.03 0.00 1.54 0.00 0.00 36.73 38.69 1noi h TYR 75 CO 0.00 0.95 -1.11 1.49 -1.64 0.00 0.00 178.16 177.84 1noi h GLU 76 N 0.19 0.52 -0.26 1.82 4.57 -0.57 -3.37 114.58 117.48 1noi h GLU 76 Ca -0.03 -0.74 -0.14 0.00 -1.18 0.00 0.00 59.36 57.27 1noi h GLU 76 Cb 1.35 0.25 -0.00 0.00 -0.16 0.00 0.00 28.75 30.19 1noi h GLU 76 CO 0.12 1.33 -0.39 -0.22 -1.18 0.00 0.00 179.01 178.67 1noi h LYS 77 N 0.07 0.72 -4.90 1.92 3.64 -1.34 -3.49 116.57 113.18 1noi h LYS 77 Ca -0.18 -0.43 -0.20 0.00 -1.27 0.00 0.00 60.65 58.58 1noi h LYS 77 Cb 1.83 0.04 0.15 0.00 -0.41 0.00 0.00 32.23 33.84 1noi h LYS 77 CO 0.21 1.05 -0.67 -3.47 -2.27 0.00 0.00 179.45 174.31 1noi n ASP 78 N -4.19 -5.54 -4.76 4.20 2.03 -0.91 -5.05 116.55 102.33 1noi n ASP 78 Ca -0.05 -0.55 -0.31 0.00 0.52 0.00 0.00 54.79 54.41 1noi n ASP 78 Cb 0.53 -4.16 0.10 0.00 -0.72 0.00 0.00 41.12 36.87 1noi n ASP 78 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 1noi s PRO 79 N -4.10 2.07 0.25 -0.67 0.04 -1.26 -5.01 135.00 126.32 1noi s PRO 79 Ca 0.35 1.03 -0.30 0.00 0.04 0.00 0.00 61.00 62.12 1noi s PRO 79 Cb -0.05 -1.89 -0.09 0.00 0.04 0.00 0.00 34.50 32.52 1noi s PRO 79 CO 0.57 -1.73 1.23 0.21 0.04 0.00 0.00 177.00 177.32 1noi s LYS 80 N -4.94 4.47 -0.08 4.56 2.20 -1.26 -4.90 119.74 119.78 1noi s LYS 80 Ca 0.61 1.98 -0.01 0.00 -0.36 0.00 0.00 55.97 58.19 1noi s LYS 80 Cb -0.17 -3.18 -0.03 0.00 -1.51 0.00 0.00 37.83 32.94 1noi s LYS 80 CO 0.56 -0.08 -0.01 1.03 -0.36 0.00 0.00 175.35 176.49 1noi s ARG 81 N -0.86 2.94 -0.14 4.03 0.52 -0.41 -4.49 118.95 120.55 1noi s ARG 81 Ca 0.51 -0.43 0.02 0.00 -0.52 0.00 0.00 55.73 55.31 1noi s ARG 81 Cb -0.35 -2.76 0.00 0.00 0.52 0.00 0.00 34.95 32.36 1noi s ARG 81 CO 0.42 0.70 -0.20 -1.50 0.02 0.00 0.00 175.30 174.74 1noi s ILE 82 N -0.87 2.29 -0.37 1.52 -1.16 -0.24 -1.07 121.20 121.30 1noi s ILE 82 Ca 0.13 -0.91 -0.13 0.00 -0.51 0.00 0.00 60.65 59.24 1noi s ILE 82 Cb -0.11 -1.93 0.01 0.00 0.61 0.00 0.00 42.46 41.04 1noi s ILE 82 CO 0.02 0.54 0.24 -0.31 -2.81 0.00 0.00 174.94 172.62 1noi s TYR 83 N 0.76 3.23 -0.37 3.50 2.02 -0.22 0.14 117.35 126.41 1noi s TYR 83 Ca -0.08 -0.58 -0.13 0.00 -0.37 0.00 0.00 57.07 55.92 1noi s TYR 83 Cb -0.16 -2.49 0.01 0.00 -0.40 0.00 0.00 41.96 38.93 1noi s TYR 83 CO -0.00 -0.52 0.24 -0.47 -1.57 0.00 0.00 175.55 173.23 1noi s TYR 84 N 1.65 3.23 -0.28 2.71 5.04 0.99 -0.77 117.35 129.91 1noi s TYR 84 Ca 0.04 -0.59 -0.17 0.00 -2.44 0.00 0.00 57.07 53.91 1noi s TYR 84 Cb -0.18 -2.49 -0.02 0.00 0.35 0.00 0.00 41.96 39.62 1noi s TYR 84 CO 0.09 -0.53 0.49 -0.51 -1.34 0.00 0.00 175.55 173.75 1noi s LEU 85 N 1.65 4.12 0.00 6.97 1.43 -0.81 -1.57 118.68 130.47 1noi s LEU 85 Ca 0.04 0.35 -0.05 0.00 -1.03 0.00 0.00 54.13 53.45 1noi s LEU 85 Cb -0.18 -2.61 -0.00 0.00 0.03 0.00 0.00 46.19 43.42 1noi s LEU 85 CO 0.09 -0.32 0.08 -0.55 0.23 0.00 0.00 176.35 175.88 1noi s SER 86 N 1.62 0.08 0.00 2.29 0.15 -0.94 -3.08 113.70 113.81 1noi s SER 86 Ca 0.20 -0.26 0.17 0.00 0.70 0.00 0.00 55.95 56.76 1noi s SER 86 Cb -0.16 0.17 0.60 0.00 -1.71 0.00 0.00 66.02 64.93 1noi s SER 86 CO 0.10 -0.32 1.44 0.18 1.20 0.00 0.00 173.24 175.85 1noi n LEU 87 N 1.64 1.58 -3.85 3.45 4.32 -1.26 -4.34 117.00 118.53 1noi n LEU 87 Ca -0.22 -0.71 -0.12 0.00 -0.02 0.00 0.00 56.01 54.94 1noi n LEU 87 Cb 0.56 -0.14 -0.11 0.00 -1.62 0.00 0.00 43.42 42.11 1noi n LEU 87 CO 0.21 0.36 -0.20 -1.61 -1.22 0.00 0.00 177.39 174.93 1noi s GLU 88 N -1.72 0.33 -0.21 3.23 2.02 -1.26 -4.84 118.70 116.25 1noi s GLU 88 Ca 0.28 -0.14 -0.03 0.00 0.02 0.00 0.00 54.97 55.11 1noi s GLU 88 Cb 0.15 0.14 0.07 0.00 0.10 0.00 0.00 34.13 34.59 1noi s GLU 88 CO 0.22 -0.07 0.05 -0.06 0.02 0.00 0.00 175.26 175.41 1noi s PHE 89 N -0.72 1.05 -0.79 1.61 0.08 -0.57 -4.38 117.98 114.25 1noi s PHE 89 Ca -0.08 -0.93 -0.14 0.00 0.12 0.00 0.00 56.93 55.89 1noi s PHE 89 Cb -0.05 -1.08 0.21 0.00 -0.57 0.00 0.00 43.02 41.53 1noi s PHE 89 CO 0.01 -0.64 0.74 -0.47 -0.10 0.00 0.00 175.22 174.75 1noi s TYR 90 N 1.85 3.70 -0.13 0.36 5.04 0.11 -3.68 117.35 124.61 1noi s TYR 90 Ca 0.01 -1.91 0.17 0.00 -2.44 0.00 0.00 57.07 52.90 1noi s TYR 90 Cb -0.17 -3.82 -0.12 0.00 0.35 0.00 0.00 41.96 38.21 1noi s TYR 90 CO -0.11 -0.99 0.87 0.52 -1.34 0.00 0.00 175.55 174.49 1noi h MET 91 N 7.91 0.00 -5.97 4.97 2.86 -1.84 -3.40 114.93 119.46 1noi h MET 91 Ca 0.06 0.00 -0.35 0.00 -2.06 0.00 0.00 59.70 57.35 1noi h MET 91 Cb 1.05 0.00 0.01 0.00 0.06 0.00 0.00 31.60 32.71 1noi h MET 91 CO 0.79 0.28 -0.90 0.41 1.06 0.00 0.00 176.91 178.54 1noi n GLY 92 N 1.37 -0.46 0.92 8.32 0.00 -1.26 -4.73 105.19 109.35 1noi n GLY 92 Ca -0.08 0.67 0.00 0.00 0.00 0.00 0.00 46.02 46.61 1noi n GLY 92 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1noi n ARG 93 N -1.20 0.00 0.04 1.61 1.74 -1.25 -4.57 116.66 113.03 1noi n ARG 93 Ca -0.17 0.45 0.07 0.00 -0.77 0.00 0.00 57.85 57.44 1noi n ARG 93 Cb 0.54 -0.47 -0.08 0.00 -1.02 0.00 0.00 32.46 31.42 1noi n ARG 93 CO 0.00 0.00 0.00 2.41 -1.52 0.00 0.00 177.63 178.52 1noi n THR 94 N 0.30 0.61 0.40 0.55 -1.04 -1.26 -4.54 114.28 109.30 1noi n THR 94 Ca 0.00 -0.59 -0.16 0.00 -2.04 0.00 0.00 64.05 61.26 1noi n THR 94 Cb 0.00 -0.33 -0.08 0.00 -1.82 0.00 0.00 70.33 68.10 1noi n THR 94 CO 0.00 0.00 0.00 0.25 -0.64 0.00 0.00 175.07 174.68 1noi h LEU 95 N 0.00 -0.88 -0.88 -4.42 6.46 -1.96 -1.37 115.31 112.27 1noi h LEU 95 Ca -0.08 0.03 -0.06 0.00 -0.12 0.00 0.00 57.88 57.66 1noi h LEU 95 Cb 1.22 0.23 -0.03 0.00 -0.73 0.00 0.00 40.66 41.35 1noi h LEU 95 CO 0.01 -0.59 0.17 -0.61 -0.62 0.00 0.00 178.44 176.80 1noi h GLN 96 N -1.11 0.99 -0.24 1.25 4.15 -1.96 -0.87 115.11 117.32 1noi h GLN 96 Ca -0.11 -0.21 -0.02 0.00 0.77 0.00 0.00 58.65 59.08 1noi h GLN 96 Cb 0.79 -0.14 -0.01 0.00 0.21 0.00 0.00 27.48 28.33 1noi h GLN 96 CO 0.17 0.87 0.04 -0.97 -1.93 0.00 0.00 178.83 177.02 1noi h ASN 97 N 0.95 0.30 -0.08 -0.69 -0.73 -1.76 -1.80 115.58 111.78 1noi h ASN 97 Ca 0.21 -0.03 -0.12 0.00 1.87 0.00 0.00 56.30 58.22 1noi h ASN 97 Cb 0.32 -0.08 0.01 0.00 0.27 0.00 0.00 38.32 38.84 1noi h ASN 97 CO -0.00 0.33 -0.42 0.74 -0.37 0.00 0.00 177.43 177.71 1noi h THR 98 N 0.33 1.40 -0.63 -3.57 2.02 -0.02 -2.30 112.91 110.15 1noi h THR 98 Ca 0.08 -1.80 0.03 0.00 0.77 0.00 0.00 66.41 65.50 1noi h THR 98 Cb 0.16 2.29 -0.04 0.00 -1.74 0.00 0.00 68.15 68.81 1noi h THR 98 CO -0.00 0.53 0.38 0.24 0.37 0.00 0.00 175.52 177.03 1noi h MET 99 N -0.03 0.71 0.04 6.66 2.86 -1.04 -1.72 114.93 122.41 1noi h MET 99 Ca -0.03 -0.04 -0.24 0.00 -2.06 0.00 0.00 59.70 57.33 1noi h MET 99 Cb 1.07 -0.16 0.00 0.00 0.06 0.00 0.00 31.60 32.57 1noi h MET 99 CO 0.09 0.47 -1.03 -0.39 1.06 0.00 0.00 176.91 177.11 1noi h VAL 100 N 0.73 1.46 0.00 -2.22 -1.51 -1.34 0.71 116.25 114.08 1noi h VAL 100 Ca 0.26 -2.70 0.00 0.00 -1.23 0.00 0.00 66.70 63.03 1noi h VAL 100 Cb 0.05 2.61 0.00 0.00 -2.13 0.00 0.00 31.29 31.82 1noi h VAL 100 CO -0.12 0.79 0.00 0.59 -1.23 0.00 0.00 177.57 177.61 1noi n ASN 101 N -3.65 0.43 -0.34 4.19 4.13 -0.87 -2.18 115.26 116.97 1noi n ASN 101 Ca -0.07 0.60 0.04 0.00 1.68 0.00 0.00 54.58 56.83 1noi n ASN 101 Cb 0.89 -0.69 0.05 0.00 -1.54 0.00 0.00 39.78 38.49 1noi n ASN 101 CO 0.00 0.00 0.00 0.18 0.28 0.00 0.00 177.26 177.72 1noi n LEU 102 N -1.97 1.87 -3.65 3.41 4.32 -0.67 -0.69 117.00 119.63 1noi n LEU 102 Ca 0.03 -1.23 -0.24 0.00 -0.02 0.00 0.00 56.01 54.54 1noi n LEU 102 Cb 0.22 -0.04 0.07 0.00 -1.62 0.00 0.00 43.42 42.06 1noi n LEU 102 CO 0.18 0.41 0.20 0.00 -1.22 0.00 0.00 177.39 176.96 1noi n ALA 103 N 0.38 -1.41 0.81 -1.18 0.00 -0.25 -4.92 120.51 113.94 1noi n ALA 103 Ca 0.05 0.30 0.09 0.00 0.00 0.00 0.00 53.44 53.88 1noi n ALA 103 Cb 0.23 -4.88 0.03 0.00 0.00 0.00 0.00 19.45 14.83 1noi n ALA 103 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1noi n LEU 104 N -4.83 2.08 -0.08 0.00 4.32 0.08 -4.73 117.00 113.83 1noi n LEU 104 Ca -0.03 -0.85 0.01 0.00 -0.02 0.00 0.00 56.01 55.12 1noi n LEU 104 Cb 0.57 0.00 0.30 0.00 -1.62 0.00 0.00 43.42 42.67 1noi n LEU 104 CO 0.67 0.38 1.08 -0.08 -1.22 0.00 0.00 177.39 178.22 1noi h GLU 105 N 2.68 0.71 0.08 3.23 4.81 -1.91 -0.76 114.58 123.42 1noi h GLU 105 Ca 0.00 -0.09 -0.00 0.00 -0.13 0.00 0.00 59.36 59.14 1noi h GLU 105 Cb 0.69 -0.14 0.00 0.00 0.63 0.00 0.00 28.75 29.93 1noi h GLU 105 CO 0.00 0.56 -0.04 -0.91 -0.73 0.00 0.00 179.01 177.90 1noi h ASN 106 N 0.71 -0.09 -0.66 1.04 2.35 -1.93 0.31 115.58 117.31 1noi h ASN 106 Ca 0.18 -0.46 0.09 0.00 -0.55 0.00 0.00 56.30 55.56 1noi h ASN 106 Cb 0.10 0.02 -0.07 0.00 0.05 0.00 0.00 38.32 38.42 1noi h ASN 106 CO -0.02 0.45 0.29 0.00 -1.65 0.00 0.00 177.43 176.50 1noi h ALA 107 N 0.16 0.88 0.00 -0.83 0.00 -1.84 0.14 119.26 117.77 1noi h ALA 107 Ca -0.01 0.07 -0.09 0.00 0.00 0.00 0.00 54.91 54.88 1noi h ALA 107 Cb 0.55 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 1noi h ALA 107 CO 0.02 -0.12 -0.43 0.00 0.00 0.00 0.00 179.25 178.73 1noi h ASP 109 N 0.00 0.32 -0.00 0.00 1.82 0.11 -0.73 116.42 117.93 1noi h ASP 109 Ca -0.00 -0.45 -0.00 0.00 -0.39 0.00 0.00 57.03 56.18 1noi h ASP 109 Cb 0.95 -0.09 -0.00 0.00 0.68 0.00 0.00 39.33 40.87 1noi h ASP 109 CO 0.06 0.70 0.00 -0.08 -1.61 0.00 0.00 179.24 178.31 1noi h GLU 110 N -0.06 0.01 -0.61 0.28 4.57 -0.65 -0.25 114.58 117.87 1noi h GLU 110 Ca 0.03 -0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.21 1noi h GLU 110 Cb 0.60 -0.00 -0.03 0.00 -0.16 0.00 0.00 28.75 29.16 1noi h GLU 110 CO 0.03 0.27 0.40 0.00 -1.18 0.00 0.00 179.01 178.53 1noi h ALA 111 N 0.73 0.77 -0.22 2.92 0.00 -1.07 0.00 119.26 122.41 1noi h ALA 111 Ca 0.00 -0.05 -0.15 0.00 0.00 0.00 0.00 54.91 54.71 1noi h ALA 111 Cb 0.27 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 1noi h ALA 111 CO 0.00 0.22 -0.49 1.79 0.00 0.00 0.00 179.25 180.77 1noi h THR 112 N 0.83 1.31 -0.55 0.00 1.35 -1.07 -3.02 112.91 111.75 1noi h THR 112 Ca 0.22 -1.70 0.10 0.00 -0.55 0.00 0.00 66.41 64.49 1noi h THR 112 Cb -0.08 1.67 -0.08 0.00 -1.73 0.00 0.00 68.15 67.93 1noi h THR 112 CO -0.05 0.53 0.08 0.22 -0.25 0.00 0.00 175.52 176.05 1noi h TYR 113 N 0.46 0.11 0.00 4.73 3.20 -0.18 -1.20 116.97 124.10 1noi h TYR 113 Ca 0.02 0.04 0.00 0.00 3.14 0.00 0.00 58.73 61.93 1noi h TYR 113 Cb 1.02 0.04 0.00 0.00 1.54 0.00 0.00 36.73 39.32 1noi h TYR 113 CO 0.04 -0.06 0.00 1.96 -1.64 0.00 0.00 178.16 178.46 1noi h GLN 114 N 0.20 0.00 -0.01 1.82 4.20 -0.97 -1.90 115.11 118.46 1noi h GLN 114 Ca 0.29 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.00 1noi h GLN 114 Cb 0.43 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.21 1noi h GLN 114 CO -0.40 0.00 -0.17 1.28 -0.67 0.00 0.00 178.83 178.86 1noi n LEU 115 N -3.02 0.74 0.00 1.46 4.77 -0.52 -4.94 117.00 115.50 1noi n LEU 115 Ca -0.00 -0.12 0.00 0.00 -0.03 0.00 0.00 56.01 55.85 1noi n LEU 115 Cb 0.23 -0.15 0.00 0.00 -2.33 0.00 0.00 43.42 41.17 1noi n LEU 115 CO 0.24 0.14 0.00 0.61 -1.33 0.00 0.00 177.39 177.05 1noi n GLY 116 N 1.31 0.68 3.53 -0.72 0.00 -0.71 -5.09 105.19 104.19 1noi n GLY 116 Ca 0.13 -0.52 -0.25 0.00 0.00 0.00 0.00 46.02 45.38 1noi n GLY 116 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1noi s LEU 117 N 0.00 2.69 -0.31 0.99 1.43 -0.79 -5.03 118.68 117.66 1noi s LEU 117 Ca 0.00 -1.23 0.01 0.00 -1.03 0.00 0.00 54.13 51.88 1noi s LEU 117 Cb 0.00 -0.89 0.07 0.00 0.03 0.00 0.00 46.19 45.40 1noi s LEU 117 CO 0.00 -0.29 0.00 -0.62 0.23 0.00 0.00 176.35 175.67 1noi s ASP 118 N -3.59 4.75 0.45 2.29 2.15 -1.26 -3.53 116.67 117.93 1noi s ASP 118 Ca 0.32 -1.65 0.24 0.00 0.43 0.00 0.00 52.55 51.90 1noi s ASP 118 Cb 0.04 -1.65 1.25 0.00 -0.30 0.00 0.00 42.92 42.26 1noi s ASP 118 CO 0.16 -0.30 1.80 -0.03 -0.17 0.00 0.00 175.17 176.62 1noi h MET 119 N 7.82 0.25 -0.49 4.34 1.85 -1.91 0.23 114.93 127.02 1noi h MET 119 Ca -0.15 -0.02 -0.09 0.00 -0.61 0.00 0.00 59.70 58.84 1noi h MET 119 Cb 1.04 -0.06 -0.02 0.00 0.43 0.00 0.00 31.60 32.99 1noi h MET 119 CO 0.52 0.17 -0.04 0.93 -0.40 0.00 0.00 176.91 178.09 1noi h GLU 120 N 0.26 0.85 0.00 0.39 5.08 -1.99 -1.07 114.58 118.10 1noi h GLU 120 Ca 0.56 -0.26 -0.13 0.00 -1.00 0.00 0.00 59.36 58.54 1noi h GLU 120 Cb 1.68 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 30.83 1noi h GLU 120 CO -0.19 0.88 -0.60 1.49 -1.00 0.00 0.00 179.01 179.59 1noi h GLU 121 N 0.78 0.00 -0.61 2.33 4.22 -1.39 -2.85 114.58 117.06 1noi h GLU 121 Ca 0.14 0.00 -0.09 0.00 0.08 0.00 0.00 59.36 59.49 1noi h GLU 121 Cb 0.53 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.75 1noi h GLU 121 CO 0.03 0.60 0.04 -0.07 -2.18 0.00 0.00 179.01 177.43 1noi h LEU 122 N 0.00 1.02 -1.13 1.64 3.38 -1.14 -2.83 115.31 116.25 1noi h LEU 122 Ca -0.01 -0.29 0.01 0.00 0.09 0.00 0.00 57.88 57.69 1noi h LEU 122 Cb 1.21 -0.27 -0.05 0.00 0.09 0.00 0.00 40.66 41.65 1noi h LEU 122 CO 0.08 1.06 0.59 -0.33 0.09 0.00 0.00 178.44 179.93 1noi h GLU 123 N 0.95 1.16 0.00 1.13 5.08 -1.06 0.43 114.58 122.28 1noi h GLU 123 Ca 0.18 -0.07 0.00 0.00 -1.00 0.00 0.00 59.36 58.47 1noi h GLU 123 Cb 0.51 -0.26 0.00 0.00 0.50 0.00 0.00 28.75 29.50 1noi h GLU 123 CO 0.02 0.76 0.00 0.39 -1.00 0.00 0.00 179.01 179.19 1noi n GLU 124 N -4.41 0.10 0.12 2.33 -0.58 -1.08 -2.84 120.64 114.29 1noi n GLU 124 Ca 0.11 0.17 -0.02 0.00 -0.42 0.00 0.00 57.16 57.00 1noi n GLU 124 Cb 0.04 -1.50 0.10 0.00 -0.57 0.00 0.00 31.44 29.51 1noi n GLU 124 CO 0.00 0.00 0.00 0.82 -0.48 0.00 0.00 177.13 177.47 1noi h ILE 125 N 0.00 1.41 -3.37 -3.67 1.08 -0.82 -3.46 117.51 108.68 1noi h ILE 125 Ca 0.00 -2.42 -0.53 0.00 -0.39 0.00 0.00 64.86 61.53 1noi h ILE 125 Cb 0.24 2.33 0.06 0.00 -3.07 0.00 0.00 36.82 36.38 1noi h ILE 125 CO 0.00 0.67 0.75 -0.70 -0.69 0.00 0.00 178.15 178.19 1noi s GLU 126 N -3.31 4.27 0.50 2.37 2.12 -1.13 -5.01 118.70 118.51 1noi s GLU 126 Ca -0.00 2.29 -0.19 0.00 0.36 0.00 0.00 54.97 57.42 1noi s GLU 126 Cb 0.11 -3.12 -0.08 0.00 0.26 0.00 0.00 34.13 31.31 1noi s GLU 126 CO 0.77 -0.41 1.02 -1.21 -0.54 0.00 0.00 175.26 174.89 1noi s GLU 127 N -0.33 3.80 0.36 4.30 0.41 -1.26 -4.99 118.70 120.99 1noi s GLU 127 Ca 0.59 1.27 -0.25 0.00 -0.41 0.00 0.00 54.97 56.17 1noi s GLU 127 Cb -0.42 -2.10 -0.09 0.00 -1.78 0.00 0.00 34.13 29.74 1noi s GLU 127 CO 0.43 -0.42 1.01 -0.51 -0.49 0.00 0.00 175.26 175.28 1noi s ASP 128 N -2.21 7.06 -0.01 -0.19 1.11 -1.26 -3.97 116.67 117.21 1noi s ASP 128 Ca 0.65 1.97 -0.30 0.00 0.18 0.00 0.00 52.55 55.05 1noi s ASP 128 Cb -0.15 -2.59 -0.06 0.00 1.07 0.00 0.00 42.92 41.19 1noi s ASP 128 CO 0.22 -0.28 1.63 0.00 1.18 0.00 0.00 175.17 177.93 1noi s ALA 129 N -1.60 3.63 -1.16 5.23 0.00 -1.26 -4.82 121.76 121.79 1noi s ALA 129 Ca 0.53 1.03 -0.12 0.00 0.00 0.00 0.00 51.96 53.40 1noi s ALA 129 Cb -0.21 -3.72 -0.07 0.00 0.00 0.00 0.00 23.12 19.12 1noi s ALA 129 CO 0.27 -1.25 2.29 0.41 0.00 0.00 0.00 175.76 177.48 1noi n GLY 130 N 4.04 3.52 0.00 0.00 0.00 -1.26 -4.37 105.19 107.12 1noi n GLY 130 Ca 0.16 -1.25 0.00 0.00 0.00 0.00 0.00 46.02 44.93 1noi n GLY 130 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1noi n LEU 131 N 5.24 0.76 0.00 0.99 7.94 -1.26 -3.53 117.00 127.14 1noi n LEU 131 Ca 0.55 -0.76 -0.03 0.00 -1.11 0.00 0.00 56.01 54.66 1noi n LEU 131 Cb 0.27 0.00 0.01 0.00 0.53 0.00 0.00 43.42 44.24 1noi n LEU 131 CO 0.86 0.19 0.34 0.61 -1.11 0.00 0.00 177.39 178.29 1noi n GLY 132 N -0.01 1.23 0.00 -3.96 0.00 -1.24 -1.51 105.19 99.70 1noi n GLY 132 Ca 0.00 -1.10 0.00 0.00 0.00 0.00 0.00 46.02 44.92 1noi n GLY 132 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1noi n ASN 133 N -1.14 0.00 0.00 1.61 5.15 -1.26 -4.82 115.26 114.80 1noi n ASN 133 Ca -0.03 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 53.95 1noi n ASN 133 Cb 0.31 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.56 1noi n ASN 133 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1noi n GLY 134 N 0.54 4.66 0.34 8.20 0.00 -1.26 -4.99 105.19 112.68 1noi n GLY 134 Ca 0.00 -0.55 -0.04 0.00 0.00 0.00 0.00 46.02 45.44 1noi n GLY 134 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1noi h GLY 135 N 0.00 1.24 0.72 -0.02 0.00 -2.02 -2.12 103.07 100.88 1noi h GLY 135 Ca 0.00 -0.48 0.05 0.00 0.00 0.00 0.00 47.33 46.90 1noi h GLY 135 CO 0.00 0.47 0.39 -2.00 0.00 0.00 0.00 176.54 175.40 1noi h LEU 136 N 1.19 0.59 -0.40 3.11 6.46 -1.96 -2.53 115.31 121.77 1noi h LEU 136 Ca 0.32 0.02 -0.18 0.00 -0.12 0.00 0.00 57.88 57.92 1noi h LEU 136 Cb -0.11 -0.10 -0.00 0.00 -0.73 0.00 0.00 40.66 39.73 1noi h LEU 136 CO -0.07 0.39 -0.66 1.23 -0.62 0.00 0.00 178.44 178.71 1noi h GLY 137 N 0.72 0.61 1.72 3.75 0.00 -1.60 -2.88 103.07 105.39 1noi h GLY 137 Ca 0.30 -0.80 -0.14 0.00 0.00 0.00 0.00 47.33 46.69 1noi h GLY 137 CO -0.16 0.71 -0.54 -0.09 0.00 0.00 0.00 176.54 176.46 1noi h ARG 138 N 0.40 0.30 -0.25 4.80 1.12 -1.32 0.34 114.38 119.76 1noi h ARG 138 Ca -0.02 -0.19 -0.05 0.00 -1.11 0.00 0.00 59.98 58.62 1noi h ARG 138 Cb 1.24 0.02 -0.01 0.00 -0.01 0.00 0.00 29.97 31.21 1noi h ARG 138 CO 0.12 0.77 -0.04 1.25 -3.11 0.00 0.00 179.97 178.96 1noi h LEU 139 N 0.23 0.48 -0.83 3.80 5.85 -1.38 0.03 115.31 123.49 1noi h LEU 139 Ca 0.00 -0.35 0.01 0.00 0.84 0.00 0.00 57.88 58.38 1noi h LEU 139 Cb 1.03 -0.13 -0.04 0.00 0.37 0.00 0.00 40.66 41.89 1noi h LEU 139 CO 0.09 0.71 0.55 0.00 -0.34 0.00 0.00 178.44 179.44 1noi h ALA 140 N 0.78 1.05 -0.60 1.25 0.00 -1.49 0.25 119.26 120.51 1noi h ALA 140 Ca 0.07 -0.06 -0.09 0.00 0.00 0.00 0.00 54.91 54.82 1noi h ALA 140 Cb 0.49 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 1noi h ALA 140 CO 0.02 0.47 0.01 0.00 0.00 0.00 0.00 179.25 179.74 1noi h ALA 141 N 1.30 0.80 -0.63 0.00 0.00 -1.29 -1.09 119.26 118.35 1noi h ALA 141 Ca 0.30 -0.31 -0.04 0.00 0.00 0.00 0.00 54.91 54.87 1noi h ALA 141 Cb -0.12 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.42 1noi h ALA 141 CO -0.06 0.64 0.25 0.00 0.00 0.00 0.00 179.25 180.07 1noi h PHE 143 N 0.88 0.60 -0.38 0.00 -1.00 -0.10 -2.23 116.94 114.70 1noi h PHE 143 Ca 0.21 -0.01 -0.03 0.00 2.81 0.00 0.00 57.97 60.94 1noi h PHE 143 Cb 0.21 -0.19 -0.02 0.00 3.61 0.00 0.00 35.95 39.56 1noi h PHE 143 CO 0.01 0.45 0.11 -0.07 -1.61 0.00 0.00 178.31 177.20 1noi h LEU 144 N 0.57 0.51 -0.47 1.54 3.38 -1.09 0.27 115.31 120.02 1noi h LEU 144 Ca 0.15 -0.07 -0.15 0.00 0.09 0.00 0.00 57.88 57.91 1noi h LEU 144 Cb 0.05 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.66 1noi h LEU 144 CO -0.03 0.50 -0.37 -0.78 0.09 0.00 0.00 178.44 177.86 1noi h ASP 145 N 0.55 0.91 0.17 -0.43 1.82 -1.28 -1.50 116.42 116.66 1noi h ASP 145 Ca 0.13 -0.41 -0.15 0.00 -0.39 0.00 0.00 57.03 56.22 1noi h ASP 145 Cb 0.19 -0.26 -0.01 0.00 0.68 0.00 0.00 39.33 39.93 1noi h ASP 145 CO -0.01 1.18 -0.54 0.28 -1.61 0.00 0.00 179.24 178.54 1noi h SER 146 N 0.71 0.44 -0.37 2.28 0.02 -0.91 -0.61 113.55 115.10 1noi h SER 146 Ca 0.06 -0.23 -0.10 0.00 -0.84 0.00 0.00 61.79 60.68 1noi h SER 146 Cb 0.94 -0.13 -0.01 0.00 0.14 0.00 0.00 62.40 63.34 1noi h SER 146 CO 0.09 0.90 -0.16 0.24 -1.14 0.00 0.00 176.83 176.75 1noi h MET 147 N 0.31 0.77 0.03 3.45 2.86 -0.33 0.81 114.93 122.82 1noi h MET 147 Ca 0.01 -0.33 -0.00 0.00 -2.06 0.00 0.00 59.70 57.32 1noi h MET 147 Cb 1.05 -0.03 0.00 0.00 0.06 0.00 0.00 31.60 32.68 1noi h MET 147 CO 0.09 0.94 -0.01 0.00 1.06 0.00 0.00 176.91 178.99 1noi h ALA 148 N 0.81 -0.03 -0.62 6.32 0.00 -1.18 -1.85 119.26 122.70 1noi h ALA 148 Ca 0.09 -0.16 0.11 0.00 0.00 0.00 0.00 54.91 54.94 1noi h ALA 148 Cb 0.70 0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.47 1noi h ALA 148 CO 0.05 -0.36 0.42 1.15 0.00 0.00 0.00 179.25 180.51 1noi h THR 149 N -0.35 0.88 -0.52 0.00 2.02 -0.99 0.71 112.91 114.66 1noi h THR 149 Ca -0.00 -0.14 -0.03 0.00 0.77 0.00 0.00 66.41 67.01 1noi h THR 149 Cb 0.33 0.43 -0.02 0.00 -1.74 0.00 0.00 68.15 67.16 1noi h THR 149 CO 0.01 0.07 0.03 0.18 0.37 0.00 0.00 175.52 176.18 1noi n LEU 150 N -4.47 5.15 -1.42 2.58 4.77 0.27 -4.64 117.00 119.24 1noi n LEU 150 Ca 0.11 -2.62 -0.13 0.00 -0.03 0.00 0.00 56.01 53.33 1noi n LEU 150 Cb 0.40 -0.67 -0.01 0.00 -2.33 0.00 0.00 43.42 40.81 1noi n LEU 150 CO 0.34 0.60 -0.16 0.61 -1.33 0.00 0.00 177.39 177.44 1noi n GLY 151 N 0.45 0.00 3.84 -0.72 0.00 0.24 -0.45 105.19 108.56 1noi n GLY 151 Ca 0.25 -0.35 -0.36 0.00 0.00 0.00 0.00 46.02 45.56 1noi n GLY 151 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1noi s LEU 152 N -3.64 4.39 -1.32 0.99 1.43 -0.71 -4.73 118.68 115.09 1noi s LEU 152 Ca 0.00 1.01 -0.15 0.00 -1.03 0.00 0.00 54.13 53.96 1noi s LEU 152 Cb 0.00 -3.04 0.10 0.00 0.03 0.00 0.00 46.19 43.28 1noi s LEU 152 CO 0.00 0.18 1.82 0.00 0.23 0.00 0.00 176.35 178.57 1noi n ALA 153 N 1.10 4.39 -2.62 4.21 0.00 -1.26 -4.65 120.51 121.67 1noi n ALA 153 Ca -0.08 -4.01 -0.33 0.00 0.00 0.00 0.00 53.44 49.02 1noi n ALA 153 Cb 0.52 -3.38 -0.10 0.00 0.00 0.00 0.00 19.45 16.49 1noi n ALA 153 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1noi s ALA 154 N 2.82 3.10 -0.03 0.00 0.00 -1.26 -1.07 121.76 125.32 1noi s ALA 154 Ca 0.48 -0.95 0.02 0.00 0.00 0.00 0.00 51.96 51.51 1noi s ALA 154 Cb 0.06 -1.24 0.01 0.00 0.00 0.00 0.00 23.12 21.94 1noi s ALA 154 CO 0.01 0.61 -0.06 0.71 0.00 0.00 0.00 175.76 177.03 1noi s TYR 155 N -0.96 0.73 -0.24 0.00 1.51 0.12 -3.92 117.35 114.58 1noi s TYR 155 Ca 0.16 -0.18 -0.09 0.00 -1.01 0.00 0.00 57.07 55.95 1noi s TYR 155 Cb -0.11 -0.57 -0.04 0.00 -0.11 0.00 0.00 41.96 41.12 1noi s TYR 155 CO 0.06 -0.12 0.13 0.20 -1.11 0.00 0.00 175.55 174.72 1noi s GLY 156 N 0.45 1.90 -0.04 0.71 0.00 -0.87 -0.01 107.32 109.46 1noi s GLY 156 Ca -0.06 -0.98 0.07 0.00 0.00 0.00 0.00 44.72 43.75 1noi s GLY 156 CO 0.00 0.44 -0.24 -0.19 0.00 0.00 0.00 173.10 173.11 1noi s TYR 157 N 1.27 2.41 0.00 1.90 2.02 -0.61 -0.88 117.35 123.47 1noi s TYR 157 Ca 0.06 -0.52 0.00 0.00 -0.37 0.00 0.00 57.07 56.24 1noi s TYR 157 Cb -0.14 -1.55 0.00 0.00 -0.40 0.00 0.00 41.96 39.86 1noi s TYR 157 CO 0.06 -0.09 0.00 0.41 -1.57 0.00 0.00 175.55 174.36 1noi n GLY 158 N 2.63 1.85 3.40 0.71 0.00 -1.14 -2.23 105.19 110.42 1noi n GLY 158 Ca -0.17 -0.65 -0.32 0.00 0.00 0.00 0.00 46.02 44.88 1noi n GLY 158 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1noi s ILE 159 N -2.39 2.61 -0.89 -0.61 1.01 -1.26 -1.20 121.20 118.46 1noi s ILE 159 Ca 0.00 -0.94 -0.17 0.00 0.00 0.00 0.00 60.65 59.53 1noi s ILE 159 Cb 0.00 -1.99 0.16 0.00 0.01 0.00 0.00 42.46 40.64 1noi s ILE 159 CO 0.00 0.56 1.01 -0.60 0.00 0.00 0.00 174.94 175.91 1noi s ARG 160 N -0.77 3.59 -0.14 2.79 3.52 -0.26 -4.77 118.95 122.91 1noi s ARG 160 Ca 0.11 -1.96 -0.29 0.00 -0.13 0.00 0.00 55.73 53.46 1noi s ARG 160 Cb -0.10 -4.76 -0.03 0.00 -1.56 0.00 0.00 34.95 28.50 1noi s ARG 160 CO 0.00 -1.63 1.44 0.71 -0.81 0.00 0.00 175.30 175.01 1noi s TYR 161 N 1.95 2.46 0.36 5.12 2.02 -1.26 -4.82 117.35 123.18 1noi s TYR 161 Ca 0.28 0.67 0.04 0.00 -0.37 0.00 0.00 57.07 57.69 1noi s TYR 161 Cb -0.07 -3.72 0.68 0.00 -0.40 0.00 0.00 41.96 38.45 1noi s TYR 161 CO -0.09 -2.57 1.99 0.93 -1.57 0.00 0.00 175.55 174.25 1noi h GLU 162 N 8.99 0.71 -0.03 -0.62 5.08 -1.19 -3.26 114.58 124.26 1noi h GLU 162 Ca -0.31 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 57.98 1noi h GLU 162 Cb 1.13 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 30.23 1noi h GLU 162 CO 0.97 0.51 0.00 1.19 -1.00 0.00 0.00 179.01 180.68 1noi n PHE 163 N -4.42 0.07 0.00 4.33 3.72 -0.44 -4.46 117.46 116.26 1noi n PHE 163 Ca 0.05 -0.66 0.00 0.00 -0.05 0.00 0.00 57.45 56.78 1noi n PHE 163 Cb 0.09 -0.09 0.00 0.00 -0.94 0.00 0.00 39.48 38.54 1noi n PHE 163 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1noi n GLY 164 N -0.71 2.60 3.57 1.37 0.00 -1.23 -3.50 105.19 107.29 1noi n GLY 164 Ca 0.06 0.29 -0.02 0.00 0.00 0.00 0.00 46.02 46.36 1noi n GLY 164 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1noi s ILE 165 N 0.00 -0.48 0.00 -0.61 2.07 -1.26 -0.07 121.20 120.86 1noi s ILE 165 Ca 0.00 0.00 0.00 0.00 -1.41 0.00 0.00 60.65 59.24 1noi s ILE 165 Cb 0.00 -1.00 0.00 0.00 0.13 0.00 0.00 42.46 41.59 1noi s ILE 165 CO 0.00 0.00 0.00 2.22 -1.91 0.00 0.00 174.94 175.25 1noi n PHE 166 N 4.77 0.00 -3.67 3.50 -1.74 -1.26 -4.76 117.46 114.30 1noi n PHE 166 Ca -0.14 0.00 -0.36 0.00 -0.56 0.00 0.00 57.45 56.40 1noi n PHE 166 Cb 0.54 0.00 -0.08 0.00 1.52 0.00 0.00 39.48 41.46 1noi n PHE 166 CO 0.00 0.00 0.00 -0.80 -0.56 0.00 0.00 176.76 175.40 1noi s ASN 167 N 0.00 6.29 -0.01 5.98 0.02 0.41 -4.85 114.94 122.79 1noi s ASN 167 Ca 0.00 0.34 -0.23 0.00 -1.02 0.00 0.00 52.86 51.94 1noi s ASN 167 Cb 0.00 -2.12 -0.05 0.00 0.02 0.00 0.00 41.25 39.10 1noi s ASN 167 CO 0.00 0.16 0.70 -1.58 0.02 0.00 0.00 177.10 176.41 1noi s GLN 168 N 0.33 4.43 -0.04 -0.60 0.74 -1.26 -0.82 119.66 122.44 1noi s GLN 168 Ca 0.11 0.92 0.02 0.00 0.05 0.00 0.00 55.36 56.46 1noi s GLN 168 Cb -0.12 -3.39 0.01 0.00 1.10 0.00 0.00 33.01 30.61 1noi s GLN 168 CO 0.00 0.22 -0.09 0.21 -0.55 0.00 0.00 175.29 175.09 1noi s LYS 169 N 0.23 1.05 -0.26 1.67 2.20 0.29 -4.22 119.74 120.70 1noi s LYS 169 Ca 0.36 -0.28 -0.11 0.00 -0.36 0.00 0.00 55.97 55.58 1noi s LYS 169 Cb -0.19 -0.97 -0.05 0.00 -1.51 0.00 0.00 37.83 35.12 1noi s LYS 169 CO 0.20 0.06 0.20 0.42 -0.36 0.00 0.00 175.35 175.87 1noi s ILE 170 N 0.43 5.31 -0.12 5.43 -1.09 -1.26 0.74 121.20 130.64 1noi s ILE 170 Ca -0.07 0.24 0.01 0.00 -2.23 0.00 0.00 60.65 58.60 1noi s ILE 170 Cb -0.11 -3.54 0.02 0.00 -1.58 0.00 0.00 42.46 37.25 1noi s ILE 170 CO 0.01 0.29 -0.13 0.00 -1.23 0.00 0.00 174.94 173.87 1noi n GLY 172 N 4.50 0.80 2.38 0.00 0.00 -1.26 -1.33 105.19 110.29 1noi n GLY 172 Ca -0.17 -0.13 0.00 0.00 0.00 0.00 0.00 46.02 45.71 1noi n GLY 172 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1noi n GLY 173 N -0.86 2.26 3.85 -0.02 0.00 -1.26 -5.01 105.19 104.14 1noi n GLY 173 Ca -0.20 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.46 1noi n GLY 173 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1noi s TRP 174 N -2.86 3.66 0.09 1.61 0.52 -0.44 -3.91 118.94 117.61 1noi s TRP 174 Ca 0.00 0.90 -0.31 0.00 0.02 0.00 0.00 56.10 56.71 1noi s TRP 174 Cb 0.00 -2.23 -0.08 0.00 -1.15 0.00 0.00 33.47 30.01 1noi s TRP 174 CO 0.00 0.59 1.46 -1.14 0.02 0.00 0.00 176.95 177.88 1noi s GLN 175 N -1.45 4.28 -0.13 4.98 0.74 -1.26 0.93 119.66 127.75 1noi s GLN 175 Ca 0.28 2.13 0.01 0.00 0.05 0.00 0.00 55.36 57.82 1noi s GLN 175 Cb -0.15 -3.37 0.02 0.00 1.10 0.00 0.00 33.01 30.60 1noi s GLN 175 CO 0.15 -0.54 -0.15 -1.64 -0.55 0.00 0.00 175.29 172.57 1noi s MET 176 N 1.68 2.24 -0.43 1.67 -1.94 0.23 -4.90 119.30 117.85 1noi s MET 176 Ca 0.67 -0.55 -0.15 0.00 -1.71 0.00 0.00 55.69 53.95 1noi s MET 176 Cb -0.37 -1.98 0.04 0.00 2.01 0.00 0.00 34.83 34.53 1noi s MET 176 CO 0.30 -0.15 0.32 -1.83 -0.01 0.00 0.00 175.02 173.65 1noi s GLU 177 N 1.23 2.96 0.50 2.03 1.03 -1.26 -0.55 118.70 124.64 1noi s GLU 177 Ca -0.01 -1.13 -0.03 0.00 0.03 0.00 0.00 54.97 53.83 1noi s GLU 177 Cb -0.14 -4.01 -0.01 0.00 -0.80 0.00 0.00 34.13 29.17 1noi s GLU 177 CO -0.06 -0.84 0.76 -1.21 -1.33 0.00 0.00 175.26 172.59 1noi s GLU 178 N 1.66 3.13 0.36 -4.83 2.02 0.00 -4.90 118.70 116.14 1noi s GLU 178 Ca 0.05 -0.19 -0.26 0.00 0.02 0.00 0.00 54.97 54.59 1noi s GLU 178 Cb -0.21 -2.44 -0.09 0.00 0.10 0.00 0.00 34.13 31.50 1noi s GLU 178 CO 0.09 -0.37 1.06 0.00 0.02 0.00 0.00 175.26 176.05 1noi s ALA 179 N -2.72 3.19 -0.71 5.21 0.00 -1.26 -0.44 121.76 125.02 1noi s ALA 179 Ca 0.49 0.75 -0.11 0.00 0.00 0.00 0.00 51.96 53.10 1noi s ALA 179 Cb -0.10 -3.29 0.19 0.00 0.00 0.00 0.00 23.12 19.92 1noi s ALA 179 CO 0.41 -0.18 0.62 0.34 0.00 0.00 0.00 175.76 176.95 1noi s ASP 180 N -1.36 6.24 -0.92 0.00 2.15 -1.23 -4.59 116.67 116.96 1noi s ASP 180 Ca 0.53 -2.54 -0.06 0.00 0.43 0.00 0.00 52.55 50.91 1noi s ASP 180 Cb -0.25 -2.11 0.23 0.00 -0.30 0.00 0.00 42.92 40.49 1noi s ASP 180 CO 0.32 -0.57 0.85 1.51 -0.17 0.00 0.00 175.17 177.10 1noi s ASP 181 N 2.05 6.45 0.49 -0.34 -4.77 -1.26 -4.04 116.67 115.25 1noi s ASP 181 Ca 0.15 -3.43 0.24 0.00 -3.30 0.00 0.00 52.55 46.21 1noi s ASP 181 Cb -0.16 -2.04 1.26 0.00 -1.09 0.00 0.00 42.92 40.88 1noi s ASP 181 CO -0.05 -0.30 2.00 4.11 0.70 0.00 0.00 175.17 181.63 1noi h TRP 182 N 6.61 0.00 -0.23 2.11 5.08 -1.90 -2.91 115.95 124.70 1noi h TRP 182 Ca 0.14 0.00 0.00 0.00 1.08 0.00 0.00 58.89 60.11 1noi h TRP 182 Cb 0.88 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 27.04 1noi h TRP 182 CO 0.78 0.17 0.00 1.28 -1.28 0.00 0.00 178.44 179.39 1noi n LEU 183 N -3.69 1.68 -0.07 0.11 4.77 -1.26 -4.56 117.00 113.97 1noi n LEU 183 Ca -0.02 -0.84 -0.07 0.00 -0.03 0.00 0.00 56.01 55.05 1noi n LEU 183 Cb 0.29 -0.28 -0.01 0.00 -2.33 0.00 0.00 43.42 41.10 1noi n LEU 183 CO 0.32 0.34 0.84 -0.09 -1.33 0.00 0.00 177.39 177.47 1noi h ARG 184 N 1.42 0.05 -0.72 3.23 2.43 -1.89 -2.26 114.38 116.64 1noi h ARG 184 Ca 0.00 -0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 1noi h ARG 184 Cb 0.52 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 30.06 1noi h ARG 184 CO 0.05 0.03 0.00 0.66 -1.51 0.00 0.00 179.97 179.20 1noi n TYR 185 N -5.19 1.20 0.00 2.20 4.01 -1.26 -5.06 117.16 113.05 1noi n TYR 185 Ca -0.00 -0.54 0.00 0.00 -0.16 0.00 0.00 57.90 57.19 1noi n TYR 185 Cb 0.16 -0.10 0.00 0.00 -0.31 0.00 0.00 39.34 39.09 1noi n TYR 185 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1noi n GLY 186 N 1.49 0.72 2.56 2.72 0.00 -0.85 -4.98 105.19 106.85 1noi n GLY 186 Ca 0.25 -2.08 -0.28 0.00 0.00 0.00 0.00 46.02 43.91 1noi n GLY 186 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1noi s ASN 187 N 0.00 3.32 0.20 1.61 2.47 -1.26 -4.69 114.94 116.59 1noi s ASN 187 Ca 0.00 -1.21 0.19 0.00 0.42 0.00 0.00 52.86 52.27 1noi s ASN 187 Cb 0.00 -0.27 0.86 0.00 -1.45 0.00 0.00 41.25 40.39 1noi s ASN 187 CO 0.00 -0.43 1.59 -0.81 -3.72 0.00 0.00 177.10 173.73 1noi n PRO 188 N 5.26 0.13 0.17 0.43 -0.04 -1.26 -3.02 135.00 136.66 1noi n PRO 188 Ca -0.06 0.43 0.05 0.00 -0.04 0.00 0.00 63.50 63.89 1noi n PRO 188 Cb 0.43 -1.78 0.09 0.00 -0.04 0.00 0.00 33.50 32.20 1noi n PRO 188 CO 0.00 0.00 0.00 -1.49 -0.04 0.00 0.00 175.50 173.97 1noi h TRP 189 N 0.00 0.00 -2.89 0.54 4.06 -1.95 -3.47 115.95 112.23 1noi h TRP 189 Ca 0.00 0.00 -0.54 0.00 2.06 0.00 0.00 58.89 60.41 1noi h TRP 189 Cb 0.24 0.00 -0.02 0.00 -1.00 0.00 0.00 29.16 28.38 1noi h TRP 189 CO 0.00 0.36 -0.32 -1.83 -3.56 0.00 0.00 178.44 173.09 1noi s GLU 190 N -3.07 3.54 -0.32 0.49 -1.05 -1.17 -4.42 118.70 112.71 1noi s GLU 190 Ca 0.05 -0.30 0.01 0.00 -0.15 0.00 0.00 54.97 54.58 1noi s GLU 190 Cb 0.07 -2.83 0.08 0.00 -0.44 0.00 0.00 34.13 31.01 1noi s GLU 190 CO 0.72 0.39 0.01 0.21 0.95 0.00 0.00 175.26 177.54 1noi s LYS 191 N -3.28 2.02 0.47 -4.83 2.36 0.56 -4.90 119.74 112.13 1noi s LYS 191 Ca 0.39 -1.56 -0.24 0.00 -2.55 0.00 0.00 55.97 52.01 1noi s LYS 191 Cb -0.11 -3.16 -0.07 0.00 -1.05 0.00 0.00 37.83 33.44 1noi s LYS 191 CO 0.29 -0.77 1.33 0.00 1.55 0.00 0.00 175.35 177.75 1noi s ALA 192 N 1.08 3.07 -0.56 3.13 0.00 -1.26 -1.40 121.76 125.82 1noi s ALA 192 Ca 0.01 1.28 0.07 0.00 0.00 0.00 0.00 51.96 53.31 1noi s ALA 192 Cb -0.20 -3.52 0.26 0.00 0.00 0.00 0.00 23.12 19.66 1noi s ALA 192 CO -0.05 -1.07 0.71 0.54 0.00 0.00 0.00 175.76 175.89 1noi n ARG 193 N -0.42 2.10 -0.33 0.00 5.12 0.10 -4.92 116.66 118.31 1noi n ARG 193 Ca 0.07 -4.29 0.14 0.00 -1.93 0.00 0.00 57.85 51.83 1noi n ARG 193 Cb 0.44 -1.98 0.33 0.00 -1.16 0.00 0.00 32.46 30.09 1noi n ARG 193 CO 0.00 0.00 0.00 -1.35 -1.93 0.00 0.00 177.63 174.35 1noi h PRO 194 N 3.99 0.55 -0.51 5.56 0.11 -1.94 0.14 132.00 139.89 1noi h PRO 194 Ca 0.16 -0.03 0.15 0.00 0.11 0.00 0.00 66.00 66.38 1noi h PRO 194 Cb 0.71 -0.12 -0.02 0.00 0.11 0.00 0.00 31.00 31.68 1noi h PRO 194 CO 0.73 0.36 0.51 0.93 -0.21 0.00 0.00 178.00 180.33 1noi h GLU 195 N 0.57 0.00 -0.52 1.05 3.07 -1.96 -2.54 114.58 114.25 1noi h GLU 195 Ca 0.58 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.44 1noi h GLU 195 Cb 1.03 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.94 1noi h GLU 195 CO -0.46 0.00 0.00 1.19 -1.40 0.00 0.00 179.01 178.34 1noi n PHE 196 N -3.77 1.56 -1.66 4.33 3.72 0.49 -5.04 117.46 117.08 1noi n PHE 196 Ca 0.10 -0.71 -0.44 0.00 -0.05 0.00 0.00 57.45 56.35 1noi n PHE 196 Cb 0.72 -0.36 -0.01 0.00 -0.94 0.00 0.00 39.48 38.88 1noi n PHE 196 CO 0.00 0.00 0.00 2.41 -0.05 0.00 0.00 176.76 179.12 1noi n THR 197 N 0.52 1.71 -4.26 4.37 -1.04 -0.96 -4.62 114.28 110.00 1noi n THR 197 Ca 0.25 -0.43 -0.22 0.00 -2.04 0.00 0.00 64.05 61.61 1noi n THR 197 Cb 0.99 -1.40 -0.12 0.00 -1.82 0.00 0.00 70.33 67.98 1noi n THR 197 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 1noi s LEU 198 N -0.37 2.30 0.03 -4.42 1.43 0.17 -4.92 118.68 112.91 1noi s LEU 198 Ca 0.60 -0.68 -0.18 0.00 -1.03 0.00 0.00 54.13 52.84 1noi s LEU 198 Cb -0.63 -0.78 -0.06 0.00 0.03 0.00 0.00 46.19 44.75 1noi s LEU 198 CO 0.58 0.01 0.53 -2.16 0.23 0.00 0.00 176.35 175.55 1noi s PRO 199 N -1.91 4.16 -0.06 1.29 0.04 -1.26 -0.48 135.00 136.78 1noi s PRO 199 Ca 0.05 0.64 0.05 0.00 0.04 0.00 0.00 61.00 61.78 1noi s PRO 199 Cb -0.10 -3.26 -0.02 0.00 0.04 0.00 0.00 34.50 31.16 1noi s PRO 199 CO 0.04 0.59 -0.19 0.08 0.04 0.00 0.00 177.00 177.55 1noi s VAL 200 N -0.87 2.62 -0.04 -0.36 1.01 0.79 -4.90 120.40 118.66 1noi s VAL 200 Ca 0.28 -0.87 0.01 0.00 0.00 0.00 0.00 61.98 61.40 1noi s VAL 200 Cb -0.18 -2.00 -0.03 0.00 0.00 0.00 0.00 36.38 34.16 1noi s VAL 200 CO 0.17 0.58 -0.05 -1.00 0.00 0.00 0.00 175.10 174.80 1noi s HIS 201 N -0.44 2.98 0.18 5.22 3.76 -1.26 -1.17 115.29 124.56 1noi s HIS 201 Ca 0.05 0.04 0.03 0.00 -0.15 0.00 0.00 55.06 55.03 1noi s HIS 201 Cb -0.12 -1.69 -0.05 0.00 1.11 0.00 0.00 32.58 31.84 1noi s HIS 201 CO 0.02 0.38 -0.03 -0.06 -0.85 0.00 0.00 174.74 174.19 1noi s PHE 202 N -0.92 1.35 0.00 1.40 0.08 -0.39 -4.93 117.98 114.58 1noi s PHE 202 Ca 0.15 -0.90 0.00 0.00 0.12 0.00 0.00 56.93 56.30 1noi s PHE 202 Cb -0.11 -0.75 0.00 0.00 -0.57 0.00 0.00 43.02 41.59 1noi s PHE 202 CO 0.05 -0.05 0.00 0.66 -0.10 0.00 0.00 175.22 175.78 1noi n TYR 203 N -0.29 0.00 -4.09 0.36 4.01 0.97 -0.20 117.16 117.91 1noi n TYR 203 Ca -0.07 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.67 1noi n TYR 203 Cb 0.63 0.02 0.00 0.00 -0.31 0.00 0.00 39.34 39.68 1noi n TYR 203 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1noi n GLY 204 N 0.00 -1.81 3.45 2.72 0.00 -1.21 -4.63 105.19 103.72 1noi n GLY 204 Ca 0.00 -1.36 -0.10 0.00 0.00 0.00 0.00 46.02 44.57 1noi n GLY 204 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1noi s ARG 205 N 0.00 1.38 -0.22 1.61 1.70 0.18 -4.88 118.95 118.71 1noi s ARG 205 Ca 0.00 -1.27 -0.07 0.00 -0.47 0.00 0.00 55.73 53.92 1noi s ARG 205 Cb 0.00 0.42 -0.03 0.00 -0.57 0.00 0.00 34.95 34.76 1noi s ARG 205 CO 0.00 -0.54 0.05 0.08 -1.08 0.00 0.00 175.30 173.81 1noi s VAL 206 N -4.02 4.32 -0.29 4.99 1.01 -1.26 -1.66 120.40 123.48 1noi s VAL 206 Ca 0.23 -0.18 -0.08 0.00 0.00 0.00 0.00 61.98 61.94 1noi s VAL 206 Cb 0.02 -2.98 -0.01 0.00 0.00 0.00 0.00 36.38 33.41 1noi s VAL 206 CO 0.06 0.39 0.12 -0.70 0.00 0.00 0.00 175.10 174.97 1noi s GLU 207 N 1.13 3.33 0.08 2.72 2.12 -0.00 -4.93 118.70 123.16 1noi s GLU 207 Ca 0.04 -0.71 -0.25 0.00 0.36 0.00 0.00 54.97 54.41 1noi s GLU 207 Cb -0.14 -3.47 -0.06 0.00 0.26 0.00 0.00 34.13 30.72 1noi s GLU 207 CO 0.03 -0.38 0.75 -1.01 -0.54 0.00 0.00 175.26 174.11 1noi s HIS 208 N 1.58 3.79 0.00 5.30 3.76 -1.26 -1.43 115.29 127.04 1noi s HIS 208 Ca 0.04 1.50 0.00 0.00 -0.15 0.00 0.00 55.06 56.46 1noi s HIS 208 Cb -0.17 -2.78 0.00 0.00 1.11 0.00 0.00 32.58 30.75 1noi s HIS 208 CO 0.05 0.37 0.00 0.25 -0.85 0.00 0.00 174.74 174.56 1noi n THR 209 N 2.36 0.00 0.00 1.30 -2.24 -0.30 -4.91 114.28 110.48 1noi n THR 209 Ca -0.04 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.74 1noi n THR 209 Cb 0.50 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.73 1noi n THR 209 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 1noi n SER 210 N 0.00 0.00 -0.09 3.42 3.41 -1.26 -3.18 113.62 115.93 1noi n SER 210 Ca 0.00 0.99 -0.13 0.00 -0.26 0.00 0.00 58.87 59.47 1noi n SER 210 Cb 0.00 -0.49 -0.05 0.00 -0.26 0.00 0.00 64.21 63.42 1noi n SER 210 CO 0.00 0.00 0.00 -0.61 -0.16 0.00 0.00 175.04 174.27 1noi h GLN 211 N 0.00 0.58 0.00 4.33 5.75 -2.01 -3.48 115.11 120.28 1noi h GLN 211 Ca 0.00 -0.28 0.00 0.00 -0.15 0.00 0.00 58.65 58.22 1noi h GLN 211 Cb 0.00 -0.00 0.00 0.00 1.07 0.00 0.00 27.48 28.55 1noi h GLN 211 CO 0.00 0.86 0.00 0.41 -2.65 0.00 0.00 178.83 177.45 1noi n GLY 212 N 0.07 -0.58 3.76 2.39 0.00 -1.19 -5.12 105.19 104.52 1noi n GLY 212 Ca -0.04 -0.71 -0.38 0.00 0.00 0.00 0.00 46.02 44.89 1noi n GLY 212 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1noi s ALA 213 N -1.00 2.91 -0.04 4.61 0.00 -1.26 -1.15 121.76 125.83 1noi s ALA 213 Ca 0.00 1.21 0.03 0.00 0.00 0.00 0.00 51.96 53.19 1noi s ALA 213 Cb 0.00 -3.50 0.01 0.00 0.00 0.00 0.00 23.12 19.62 1noi s ALA 213 CO 0.00 -1.10 -0.12 0.15 0.00 0.00 0.00 175.76 174.69 1noi s LYS 214 N -2.78 1.38 -0.30 0.00 -0.14 -0.51 -4.89 119.74 112.51 1noi s LYS 214 Ca 0.68 -0.41 -0.08 0.00 -1.36 0.00 0.00 55.97 54.80 1noi s LYS 214 Cb -0.37 -1.21 -0.00 0.00 -1.68 0.00 0.00 37.83 34.57 1noi s LYS 214 CO 0.44 0.11 0.11 -0.46 -0.76 0.00 0.00 175.35 174.80 1noi s TRP 215 N 0.32 3.15 0.36 3.18 -0.00 -1.26 -0.82 118.94 123.87 1noi s TRP 215 Ca -0.07 -0.72 0.08 0.00 -0.00 0.00 0.00 56.10 55.39 1noi s TRP 215 Cb -0.12 -2.30 -0.07 0.00 -0.00 0.00 0.00 33.47 30.98 1noi s TRP 215 CO 0.02 -0.49 -0.04 0.14 -0.00 0.00 0.00 176.95 176.57 1noi s VAL 216 N 1.57 2.02 -1.67 5.86 -7.23 -0.67 -4.81 120.40 115.47 1noi s VAL 216 Ca 0.04 -2.11 -0.02 0.00 -1.81 0.00 0.00 61.98 58.08 1noi s VAL 216 Cb -0.17 -2.76 0.00 0.00 0.56 0.00 0.00 36.38 34.02 1noi s VAL 216 CO 0.04 -0.13 0.21 0.47 -0.31 0.00 0.00 175.10 175.38 1noi n ASP 217 N -0.82 -5.87 -4.86 4.85 9.92 -1.26 -0.65 116.55 117.87 1noi n ASP 217 Ca -0.05 -0.10 -0.32 0.00 -0.53 0.00 0.00 54.79 53.79 1noi n ASP 217 Cb 0.65 -4.84 -0.05 0.00 -0.64 0.00 0.00 41.12 36.24 1noi n ASP 217 CO 0.00 0.00 0.00 0.42 0.13 0.00 0.00 177.20 177.75 1noi s THR 218 N -3.07 4.70 0.47 -3.53 -4.23 -1.26 -3.34 115.64 105.38 1noi s THR 218 Ca 0.11 0.87 -0.12 0.00 -1.18 0.00 0.00 61.69 61.36 1noi s THR 218 Cb -0.05 -3.65 -0.06 0.00 1.34 0.00 0.00 72.50 70.08 1noi s THR 218 CO 0.13 -0.31 0.87 -1.58 -0.54 0.00 0.00 174.62 173.19 1noi s GLN 219 N -3.30 3.79 0.04 3.99 0.74 0.71 -4.84 119.66 120.79 1noi s GLN 219 Ca 0.54 0.63 0.05 0.00 0.05 0.00 0.00 55.36 56.63 1noi s GLN 219 Cb -0.10 -2.27 -0.02 0.00 1.10 0.00 0.00 33.01 31.72 1noi s GLN 219 CO 0.22 -0.19 -0.15 0.08 -0.55 0.00 0.00 175.29 174.70 1noi s VAL 220 N -2.59 1.17 0.04 1.34 1.01 -1.26 -1.26 120.40 118.86 1noi s VAL 220 Ca 0.54 -1.02 0.03 0.00 0.00 0.00 0.00 61.98 61.53 1noi s VAL 220 Cb -0.10 -1.06 -0.02 0.00 0.00 0.00 0.00 36.38 35.20 1noi s VAL 220 CO 0.35 0.03 -0.10 -0.69 0.00 0.00 0.00 175.10 174.69 1noi s VAL 221 N -0.85 0.74 -0.10 2.92 1.01 -0.32 -4.54 120.40 119.27 1noi s VAL 221 Ca 0.02 -0.99 -0.02 0.00 0.00 0.00 0.00 61.98 61.00 1noi s VAL 221 Cb -0.08 -0.74 -0.03 0.00 0.00 0.00 0.00 36.38 35.53 1noi s VAL 221 CO 0.01 -0.21 -0.03 -0.76 0.00 0.00 0.00 175.10 174.12 1noi s LEU 222 N -1.32 3.39 -0.30 3.92 1.43 -0.25 -0.14 118.68 125.40 1noi s LEU 222 Ca -0.05 0.03 -0.07 0.00 -1.03 0.00 0.00 54.13 53.02 1noi s LEU 222 Cb -0.08 -1.78 0.01 0.00 0.03 0.00 0.00 46.19 44.37 1noi s LEU 222 CO 0.01 0.32 0.08 0.00 0.23 0.00 0.00 176.35 176.99 1noi s ALA 223 N -0.51 3.06 -0.23 4.21 0.00 0.36 0.69 121.76 129.34 1noi s ALA 223 Ca 0.08 -1.50 -0.10 0.00 0.00 0.00 0.00 51.96 50.44 1noi s ALA 223 Cb -0.12 -2.17 -0.05 0.00 0.00 0.00 0.00 23.12 20.78 1noi s ALA 223 CO 0.02 -0.99 0.15 1.41 0.00 0.00 0.00 175.76 176.35 1noi s MET 224 N 1.48 4.07 0.45 0.00 1.75 -0.11 -0.65 119.30 126.29 1noi s MET 224 Ca 0.02 -0.27 -0.15 0.00 -1.25 0.00 0.00 55.69 54.03 1noi s MET 224 Cb -0.18 -3.50 -0.08 0.00 2.84 0.00 0.00 34.83 33.91 1noi s MET 224 CO 0.02 0.10 0.89 -1.25 -0.65 0.00 0.00 175.02 174.13 1noi s PRO 225 N 0.95 3.96 -0.04 4.11 0.04 -1.26 -1.66 135.00 141.10 1noi s PRO 225 Ca 0.07 0.81 0.05 0.00 0.04 0.00 0.00 61.00 61.98 1noi s PRO 225 Cb -0.13 -2.25 -0.01 0.00 0.04 0.00 0.00 34.50 32.15 1noi s PRO 225 CO 0.03 -0.11 -0.18 0.71 0.04 0.00 0.00 177.00 177.49 1noi s TYR 226 N -2.40 1.74 -0.13 0.56 1.51 0.04 0.02 117.35 118.69 1noi s TYR 226 Ca 0.57 -0.46 -0.00 0.00 -1.01 0.00 0.00 57.07 56.16 1noi s TYR 226 Cb -0.10 -1.16 -0.02 0.00 -0.11 0.00 0.00 41.96 40.57 1noi s TYR 226 CO 0.27 -0.14 -0.12 -0.51 -1.11 0.00 0.00 175.55 173.94 1noi s ASP 227 N -0.08 4.08 -0.10 2.29 1.01 -0.49 -1.10 116.67 122.28 1noi s ASP 227 Ca -0.01 -0.31 0.03 0.00 0.71 0.00 0.00 52.55 52.97 1noi s ASP 227 Cb -0.11 -1.62 0.00 0.00 1.01 0.00 0.00 42.92 42.21 1noi s ASP 227 CO 0.02 0.17 -0.21 -0.89 0.21 0.00 0.00 175.17 174.46 1noi s THR 228 N 0.33 1.86 0.03 -1.27 2.01 -0.17 -0.33 115.64 118.10 1noi s THR 228 Ca -0.10 -0.89 -0.30 0.00 0.31 0.00 0.00 61.69 60.70 1noi s THR 228 Cb -0.16 -1.62 -0.05 0.00 0.01 0.00 0.00 72.50 70.68 1noi s THR 228 CO 0.05 0.51 1.16 -2.84 -0.69 0.00 0.00 174.62 172.82 1noi s PRO 229 N 0.49 4.44 -0.22 4.92 0.02 -1.26 -0.15 135.00 143.24 1noi s PRO 229 Ca -0.16 1.69 -0.01 0.00 0.02 0.00 0.00 61.00 62.54 1noi s PRO 229 Cb -0.17 -3.41 0.02 0.00 0.02 0.00 0.00 34.50 30.96 1noi s PRO 229 CO 0.06 -0.26 -0.12 0.14 -0.33 0.00 0.00 177.00 176.50 1noi s VAL 230 N 1.27 2.57 0.35 3.83 -7.23 -0.49 -4.93 120.40 115.77 1noi s VAL 230 Ca 0.57 -0.95 -0.25 0.00 -1.81 0.00 0.00 61.98 59.55 1noi s VAL 230 Cb -0.27 -2.21 -0.10 0.00 0.56 0.00 0.00 36.38 34.35 1noi s VAL 230 CO 0.28 0.36 0.94 -2.16 -0.31 0.00 0.00 175.10 174.20 1noi s PRO 231 N 1.32 4.49 0.56 4.82 0.04 -1.26 -0.88 135.00 144.09 1noi s PRO 231 Ca 0.02 1.26 -0.08 0.00 0.04 0.00 0.00 61.00 62.24 1noi s PRO 231 Cb -0.15 -2.65 -0.04 0.00 0.04 0.00 0.00 34.50 31.70 1noi s PRO 231 CO -0.08 0.21 0.93 0.20 0.04 0.00 0.00 177.00 178.30 1noi s GLY 232 N -1.76 1.59 -0.43 0.56 0.00 0.98 -4.69 107.32 103.58 1noi s GLY 232 Ca 0.53 -0.29 -0.29 0.00 0.00 0.00 0.00 44.72 44.67 1noi s GLY 232 CO 0.21 -0.06 1.19 -0.47 0.00 0.00 0.00 173.10 173.97 1noi s TYR 233 N -3.00 2.79 0.00 1.90 5.04 -1.26 -4.33 117.35 118.49 1noi s TYR 233 Ca 0.52 0.80 0.00 0.00 -2.44 0.00 0.00 57.07 55.95 1noi s TYR 233 Cb -0.11 -4.25 0.00 0.00 0.35 0.00 0.00 41.96 37.95 1noi s TYR 233 CO 0.50 -1.35 0.00 0.54 -1.34 0.00 0.00 175.55 173.90 1noi n ARG 234 N 7.68 -0.69 -0.05 4.97 3.00 0.14 -4.72 116.66 126.99 1noi n ARG 234 Ca 0.13 0.06 0.10 0.00 -0.01 0.00 0.00 57.85 58.13 1noi n ARG 234 Cb 0.48 -2.70 0.42 0.00 0.00 0.00 0.00 32.46 30.66 1noi n ARG 234 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.63 177.90 1noi n ASN 235 N 0.51 1.12 -0.36 0.55 2.04 -1.26 -4.91 115.26 112.96 1noi n ASN 235 Ca 0.00 -1.62 -0.05 0.00 -0.44 0.00 0.00 54.58 52.47 1noi n ASN 235 Cb 0.06 -0.07 -0.02 0.00 -2.53 0.00 0.00 39.78 37.22 1noi n ASN 235 CO 0.00 0.00 0.00 0.59 -0.44 0.00 0.00 177.26 177.41 1noi n ASN 236 N -0.04 -5.65 -4.84 0.53 3.02 -1.26 -0.28 115.26 106.74 1noi n ASN 236 Ca 0.15 0.12 -0.38 0.00 -0.03 0.00 0.00 54.58 54.44 1noi n ASN 236 Cb 0.24 -3.56 -0.06 0.00 -0.61 0.00 0.00 39.78 35.79 1noi n ASN 236 CO 0.00 0.00 0.00 0.68 -2.62 0.00 0.00 177.26 175.32 1noi s VAL 237 N -1.48 5.04 -0.17 2.41 -7.23 -1.26 -4.81 120.40 112.90 1noi s VAL 237 Ca 0.00 0.78 -0.04 0.00 -1.81 0.00 0.00 61.98 60.91 1noi s VAL 237 Cb 0.00 -3.70 0.06 0.00 0.56 0.00 0.00 36.38 33.30 1noi s VAL 237 CO 0.00 0.54 0.08 -0.69 -0.31 0.00 0.00 175.10 174.72 1noi s VAL 238 N -1.12 0.03 0.40 1.32 1.01 -1.26 -0.01 120.40 120.76 1noi s VAL 238 Ca 0.25 -0.22 -0.01 0.00 0.00 0.00 0.00 61.98 62.00 1noi s VAL 238 Cb -0.16 -0.65 0.08 0.00 0.00 0.00 0.00 36.38 35.65 1noi s VAL 238 CO 0.14 -0.25 0.54 0.59 0.00 0.00 0.00 175.10 176.12 1noi n ASN 239 N 5.24 0.63 -4.26 3.32 3.02 -0.06 -4.60 115.26 118.54 1noi n ASN 239 Ca -0.07 -1.55 -0.31 0.00 -0.03 0.00 0.00 54.58 52.61 1noi n ASN 239 Cb 0.49 -0.36 -0.16 0.00 -0.61 0.00 0.00 39.78 39.13 1noi n ASN 239 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1noi s THR 240 N -1.62 1.99 -0.21 3.41 2.01 -1.25 -1.39 115.64 118.57 1noi s THR 240 Ca 0.35 -1.04 -0.04 0.00 0.31 0.00 0.00 61.69 61.27 1noi s THR 240 Cb -0.02 -1.68 -0.01 0.00 0.01 0.00 0.00 72.50 70.80 1noi s THR 240 CO 0.24 0.56 -0.04 -0.32 -0.69 0.00 0.00 174.62 174.36 1noi s MET 241 N -0.24 3.41 -0.24 4.92 1.75 0.79 -2.06 119.30 127.63 1noi s MET 241 Ca -0.01 -0.61 0.02 0.00 -1.25 0.00 0.00 55.69 53.84 1noi s MET 241 Cb -0.13 -3.00 0.05 0.00 2.84 0.00 0.00 34.83 34.59 1noi s MET 241 CO 0.03 -0.15 -0.13 0.50 -0.65 0.00 0.00 175.02 174.61 1noi s ARG 242 N 1.37 2.39 -0.12 4.11 6.06 -0.06 -1.00 118.95 131.71 1noi s ARG 242 Ca 0.04 -1.19 -0.02 0.00 -2.50 0.00 0.00 55.73 52.06 1noi s ARG 242 Cb -0.14 -2.78 -0.03 0.00 0.06 0.00 0.00 34.95 32.05 1noi s ARG 242 CO -0.02 -0.48 -0.03 -0.51 -2.50 0.00 0.00 175.30 171.76 1noi s LEU 243 N 1.17 3.34 0.07 -0.88 1.02 -0.25 -2.86 118.68 120.27 1noi s LEU 243 Ca -0.05 -0.02 -0.12 0.00 0.02 0.00 0.00 54.13 53.95 1noi s LEU 243 Cb -0.18 -1.78 -0.06 0.00 0.02 0.00 0.00 46.19 44.19 1noi s LEU 243 CO -0.07 0.27 0.43 0.26 0.02 0.00 0.00 176.35 177.27 1noi s TRP 244 N -0.25 3.63 -0.06 0.29 0.52 -0.34 -0.78 118.94 121.95 1noi s TRP 244 Ca 0.05 0.91 0.03 0.00 0.02 0.00 0.00 56.10 57.10 1noi s TRP 244 Cb -0.13 -2.24 0.01 0.00 -1.15 0.00 0.00 33.47 29.96 1noi s TRP 244 CO 0.02 0.54 -0.13 0.45 0.02 0.00 0.00 176.95 177.85 1noi s SER 245 N -1.54 1.87 -0.16 2.95 0.15 -0.66 -1.10 113.70 115.21 1noi s SER 245 Ca 0.31 -0.31 -0.23 0.00 0.70 0.00 0.00 55.95 56.41 1noi s SER 245 Cb -0.15 -0.81 -0.02 0.00 -1.71 0.00 0.00 66.02 63.33 1noi s SER 245 CO 0.17 0.06 0.74 0.00 1.20 0.00 0.00 173.24 175.40 1noi s ALA 246 N 0.54 3.49 -0.11 5.45 0.00 -1.26 -0.94 121.76 128.93 1noi s ALA 246 Ca -0.13 -0.05 0.02 0.00 0.00 0.00 0.00 51.96 51.80 1noi s ALA 246 Cb -0.15 -3.08 0.01 0.00 0.00 0.00 0.00 23.12 19.90 1noi s ALA 246 CO 0.04 -0.50 -0.16 0.15 0.00 0.00 0.00 175.76 175.28 1noi s LYS 247 N 1.78 2.34 0.01 0.00 1.02 0.22 -4.55 119.74 120.56 1noi s LYS 247 Ca 0.35 -0.61 -0.30 0.00 0.02 0.00 0.00 55.97 55.43 1noi s LYS 247 Cb -0.17 -1.96 -0.06 0.00 -0.52 0.00 0.00 37.83 35.12 1noi s LYS 247 CO 0.13 -0.04 1.50 0.00 -0.92 0.00 0.00 175.35 176.02 1noi s ALA 248 N 0.92 3.62 0.34 5.17 0.00 -1.26 -1.09 121.76 129.46 1noi s ALA 248 Ca -0.07 0.98 0.15 0.00 0.00 0.00 0.00 51.96 53.02 1noi s ALA 248 Cb -0.15 -3.64 1.15 0.00 0.00 0.00 0.00 23.12 20.47 1noi s ALA 248 CO -0.01 -1.03 1.50 -0.35 0.00 0.00 0.00 175.76 175.88 1noi n PRO 249 N 5.64 -0.06 -0.61 0.00 -0.04 -1.26 -4.87 135.00 133.79 1noi n PRO 249 Ca 0.14 1.34 0.00 0.00 -0.04 0.00 0.00 63.50 64.95 1noi n PRO 249 Cb 0.43 -2.34 0.00 0.00 -0.04 0.00 0.00 33.50 31.55 1noi n PRO 249 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1noi n ASN 250 N -5.22 0.00 -0.77 3.54 3.02 -1.26 -4.86 115.26 109.71 1noi n ASN 250 Ca 0.33 0.00 0.08 0.00 -0.03 0.00 0.00 54.58 54.96 1noi n ASN 250 Cb 1.10 0.00 0.23 0.00 -0.61 0.00 0.00 39.78 40.51 1noi n ASN 250 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 1noi n ASP 251 N 0.30 2.24 -4.56 6.41 2.03 -1.26 -4.83 116.55 116.87 1noi n ASP 251 Ca 0.00 -1.94 -0.21 0.00 0.52 0.00 0.00 54.79 53.16 1noi n ASP 251 Cb 0.00 -0.25 -0.06 0.00 -0.72 0.00 0.00 41.12 40.09 1noi n ASP 251 CO 0.00 0.00 0.00 -0.36 -1.92 0.00 0.00 177.20 174.92 1noi s PHE 252 N -1.50 1.54 0.00 -0.67 0.08 -1.23 -4.05 117.98 112.15 1noi s PHE 252 Ca 0.30 1.25 0.00 0.00 0.12 0.00 0.00 56.93 58.60 1noi s PHE 252 Cb 0.16 -3.76 0.00 0.00 -0.57 0.00 0.00 43.02 38.85 1noi s PHE 252 CO 0.22 -1.51 0.09 0.09 -0.10 0.00 0.00 175.22 174.01 1noi n ASN 253 N 16.22 0.18 0.00 1.36 3.02 -1.26 -4.96 115.26 129.82 1noi n ASN 253 Ca 0.43 -0.83 0.00 0.00 -0.03 0.00 0.00 54.58 54.15 1noi n ASN 253 Cb 0.46 0.04 0.00 0.00 -0.61 0.00 0.00 39.78 39.67 1noi n ASN 253 CO 0.00 0.00 0.00 -0.11 -2.62 0.00 0.00 177.26 174.53 1noi n LEU 254 N -0.04 0.00 -4.61 3.41 7.94 -1.26 -5.09 117.00 117.35 1noi n LEU 254 Ca 0.00 0.00 -0.43 0.00 -1.11 0.00 0.00 56.01 54.47 1noi n LEU 254 Cb 0.16 0.00 -0.03 0.00 0.53 0.00 0.00 43.42 44.08 1noi n LEU 254 CO 0.00 0.00 1.75 -0.75 -1.11 0.00 0.00 177.39 177.28 1noi s LYS 255 N 0.00 3.27 0.00 1.96 2.36 -1.26 -0.33 119.74 125.74 1noi s LYS 255 Ca 0.00 1.94 0.00 0.00 -2.55 0.00 0.00 55.97 55.36 1noi s LYS 255 Cb 0.00 -4.31 0.00 0.00 -1.05 0.00 0.00 37.83 32.47 1noi s LYS 255 CO 0.00 -1.95 0.00 -0.25 1.55 0.00 0.00 175.35 174.70 1noi n ASP 256 N 10.99 0.00 -2.79 1.43 8.00 -1.26 -3.48 116.55 129.44 1noi n ASP 256 Ca 0.27 0.00 -0.21 0.00 0.71 0.00 0.00 54.79 55.56 1noi n ASP 256 Cb 0.45 0.00 0.01 0.00 -0.02 0.00 0.00 41.12 41.56 1noi n ASP 256 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 1noi n PHE 257 N 0.00 -1.58 0.11 1.24 3.72 0.55 -4.89 117.46 116.60 1noi n PHE 257 Ca 0.00 0.29 -0.22 0.00 -0.05 0.00 0.00 57.45 57.47 1noi n PHE 257 Cb 0.00 -3.95 -0.13 0.00 -0.94 0.00 0.00 39.48 34.46 1noi n PHE 257 CO 0.00 0.00 0.00 -2.95 -0.05 0.00 0.00 176.76 173.76 1noi h ASN 258 N -0.74 0.80 -2.18 4.37 7.08 -1.93 -3.44 115.58 119.55 1noi h ASN 258 Ca -0.48 -0.77 -0.62 0.00 -3.08 0.00 0.00 56.30 51.35 1noi h ASN 258 Cb 1.34 -0.25 0.12 0.00 -2.08 0.00 0.00 38.32 37.44 1noi h ASN 258 CO 0.54 1.59 -0.07 1.33 -2.08 0.00 0.00 177.43 178.74 1noi n VAL 259 N -3.74 1.99 0.00 6.14 0.24 -1.26 -1.48 118.33 120.22 1noi n VAL 259 Ca -0.13 -0.50 0.00 0.00 -2.04 0.00 0.00 64.34 61.67 1noi n VAL 259 Cb 1.01 -0.74 0.00 0.00 -1.47 0.00 0.00 33.84 32.64 1noi n VAL 259 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1noi n GLY 260 N 1.45 1.45 0.33 7.63 0.00 -1.26 -4.56 105.19 110.22 1noi n GLY 260 Ca 0.11 -0.02 0.09 0.00 0.00 0.00 0.00 46.02 46.20 1noi n GLY 260 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1noi h GLY 261 N 0.00 0.93 0.00 -0.02 0.00 -1.55 -3.44 103.07 98.99 1noi h GLY 261 Ca 0.00 0.21 0.00 0.00 0.00 0.00 0.00 47.33 47.54 1noi h GLY 261 CO 0.00 -0.41 0.00 -1.72 0.00 0.00 0.00 176.54 174.41 1noi n TYR 262 N -5.51 0.00 0.75 5.60 4.02 -0.60 -5.03 117.16 116.39 1noi n TYR 262 Ca 0.18 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 58.07 1noi n TYR 262 Cb 0.58 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.90 1noi n TYR 262 CO 0.00 0.00 0.00 0.44 -1.01 0.00 0.00 176.86 176.29 1noi n ILE 263 N -0.74 0.47 0.02 -0.72 -5.35 -1.26 -4.11 119.36 107.67 1noi n ILE 263 Ca 0.00 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.48 1noi n ILE 263 Cb 0.00 -0.69 0.00 0.00 -1.74 0.00 0.00 39.64 37.21 1noi n ILE 263 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1noi n GLN 264 N 0.44 0.00 0.00 6.28 0.00 -1.26 -0.20 117.38 122.64 1noi n GLN 264 Ca 0.00 0.06 0.08 0.00 0.00 0.00 0.00 57.00 57.13 1noi n GLN 264 Cb 0.31 -1.97 0.35 0.00 0.00 0.00 0.00 30.24 28.93 1noi n GLN 264 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1noi n ALA 265 N -1.00 1.76 -0.07 2.61 0.00 -1.26 -3.43 120.51 119.12 1noi n ALA 265 Ca 0.00 -0.06 -0.15 0.00 0.00 0.00 0.00 53.44 53.23 1noi n ALA 265 Cb 0.51 -1.26 -0.05 0.00 0.00 0.00 0.00 19.45 18.65 1noi n ALA 265 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1noi h VAL 266 N 0.00 1.31 -0.16 0.00 2.07 -0.95 -2.61 116.25 115.91 1noi h VAL 266 Ca 0.00 -1.66 -0.06 0.00 0.82 0.00 0.00 66.70 65.80 1noi h VAL 266 Cb 0.25 1.77 -0.00 0.00 -1.52 0.00 0.00 31.29 31.79 1noi h VAL 266 CO 0.00 0.52 -0.13 -0.07 0.02 0.00 0.00 177.57 177.91 1noi h LEU 267 N 0.44 0.39 -0.36 2.57 3.38 -1.78 -1.72 115.31 118.23 1noi h LEU 267 Ca 0.01 -0.46 0.08 0.00 0.09 0.00 0.00 57.88 57.60 1noi h LEU 267 Cb 1.05 -0.11 -0.09 0.00 0.09 0.00 0.00 40.66 41.61 1noi h LEU 267 CO 0.10 0.77 -0.29 -0.78 0.09 0.00 0.00 178.44 178.33 1noi h ASP 268 N 0.02 -0.96 -0.18 -0.43 1.82 -1.70 0.13 116.42 115.11 1noi h ASP 268 Ca 0.03 0.17 0.05 0.00 -0.39 0.00 0.00 57.03 56.90 1noi h ASP 268 Cb 0.65 0.46 -0.07 0.00 0.68 0.00 0.00 39.33 41.05 1noi h ASP 268 CO 0.03 -0.30 -0.31 0.03 -1.61 0.00 0.00 179.24 177.08 1noi h ARG 269 N -0.24 -0.34 -0.23 0.28 3.08 -1.40 0.30 114.38 115.82 1noi h ARG 269 Ca 0.17 0.02 0.06 0.00 0.07 0.00 0.00 59.98 60.30 1noi h ARG 269 Cb 0.51 0.08 -0.06 0.00 0.08 0.00 0.00 29.97 30.58 1noi h ARG 269 CO -0.49 -0.23 -0.18 -0.97 -1.07 0.00 0.00 179.97 177.03 1noi h ASN 270 N -0.35 -0.59 1.44 7.04 -0.73 -0.41 0.63 115.58 122.60 1noi h ASN 270 Ca 0.11 0.12 0.00 0.00 1.87 0.00 0.00 56.30 58.40 1noi h ASN 270 Cb 0.53 0.30 0.00 0.00 0.27 0.00 0.00 38.32 39.42 1noi h ASN 270 CO -0.38 -0.22 0.00 -0.07 -0.37 0.00 0.00 177.43 176.38 1noi h LEU 271 N -0.18 0.00 0.06 0.34 3.38 -0.67 -0.88 115.31 117.36 1noi h LEU 271 Ca 0.13 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.10 1noi h LEU 271 Cb 0.38 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.14 1noi h LEU 271 CO -0.34 0.00 -0.03 0.00 0.09 0.00 0.00 178.44 178.16 1noi h ALA 272 N 2.28 -0.09 0.00 1.53 0.00 -0.29 -3.33 119.26 119.36 1noi h ALA 272 Ca 0.00 -0.29 -0.04 0.00 0.00 0.00 0.00 54.91 54.58 1noi h ALA 272 Cb 0.72 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.54 1noi h ALA 272 CO 0.00 -0.14 -0.18 0.93 0.00 0.00 0.00 179.25 179.85 1noi h GLU 273 N -0.90 0.00 -0.75 0.00 5.08 -0.63 -2.93 114.58 114.46 1noi h GLU 273 Ca -0.01 0.00 -0.07 0.00 -1.00 0.00 0.00 59.36 58.28 1noi h GLU 273 Cb 0.61 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.82 1noi h GLU 273 CO 0.01 0.18 0.09 0.27 -1.00 0.00 0.00 179.01 178.56 1noi n ASN 274 N -3.69 4.35 -0.17 1.42 2.04 -0.36 -3.16 115.26 115.69 1noi n ASN 274 Ca -0.01 -2.78 -0.11 0.00 -0.44 0.00 0.00 54.58 51.24 1noi n ASN 274 Cb 0.30 -0.66 0.00 0.00 -2.53 0.00 0.00 39.78 36.89 1noi n ASN 274 CO 0.00 0.00 0.00 0.40 -0.44 0.00 0.00 177.26 177.22 1noi h ILE 275 N 2.56 1.27 -0.34 1.53 2.04 -1.68 -2.92 117.51 119.97 1noi h ILE 275 Ca 0.08 -1.25 0.00 0.00 1.00 0.00 0.00 64.86 64.69 1noi h ILE 275 Cb 1.74 1.05 0.00 0.00 -0.74 0.00 0.00 36.82 38.88 1noi h ILE 275 CO 0.45 0.44 0.00 -1.20 0.00 0.00 0.00 178.15 177.83 1noi n SER 276 N -4.20 2.66 0.03 1.72 7.64 -1.19 -4.67 113.62 115.61 1noi n SER 276 Ca 0.01 -1.90 -0.21 0.00 1.01 0.00 0.00 58.87 57.78 1noi n SER 276 Cb 0.40 -0.22 -0.14 0.00 -1.01 0.00 0.00 64.21 63.23 1noi n SER 276 CO 0.00 0.00 0.00 0.03 -3.01 0.00 0.00 175.04 172.06 1noi h ARG 277 N 3.33 0.29 -4.07 1.43 3.08 -1.60 -2.38 114.38 114.46 1noi h ARG 277 Ca 0.00 -0.50 -0.12 0.00 0.07 0.00 0.00 59.98 59.43 1noi h ARG 277 Cb 0.74 0.18 -0.14 0.00 0.08 0.00 0.00 29.97 30.84 1noi h ARG 277 CO 0.00 1.20 -0.47 0.08 -1.07 0.00 0.00 179.97 179.71 1noi s VAL 278 N -2.57 0.11 0.36 2.04 1.01 -1.26 -1.33 120.40 118.76 1noi s VAL 278 Ca -0.18 -1.55 -0.14 0.00 0.00 0.00 0.00 61.98 60.11 1noi s VAL 278 Cb 0.06 -1.75 -0.08 0.00 0.00 0.00 0.00 36.38 34.61 1noi s VAL 278 CO 0.81 -0.51 0.76 -0.76 0.00 0.00 0.00 175.10 175.40 1noi s LEU 279 N -2.96 3.96 0.00 3.92 1.43 0.90 -4.99 118.68 120.95 1noi s LEU 279 Ca 0.15 1.25 0.00 0.00 -1.03 0.00 0.00 54.13 54.51 1noi s LEU 279 Cb 0.05 -4.09 0.00 0.00 0.03 0.00 0.00 46.19 42.19 1noi s LEU 279 CO -0.03 -0.29 0.04 -1.22 0.23 0.00 0.00 176.35 175.08 1noi n TYR 280 N -0.75 0.89 -1.78 0.29 4.01 -1.26 -4.84 117.16 113.72 1noi n TYR 280 Ca 0.03 -2.26 0.02 0.00 -0.16 0.00 0.00 57.90 55.54 1noi n TYR 280 Cb 0.53 -0.32 0.03 0.00 -0.31 0.00 0.00 39.34 39.28 1noi n TYR 280 CO 0.00 0.00 0.00 -0.35 -0.46 0.00 0.00 176.86 176.05 1noi n PRO 281 N -1.21 0.32 0.00 -0.72 -0.04 -1.26 -5.12 135.00 126.97 1noi n PRO 281 Ca -0.17 -1.41 0.00 0.00 -0.04 0.00 0.00 63.50 61.88 1noi n PRO 281 Cb 0.58 -0.74 0.00 0.00 -0.04 0.00 0.00 33.50 33.30 1noi n PRO 281 CO 0.00 0.00 0.00 -0.85 -0.04 0.00 0.00 175.50 174.61 1noi n GLU 287 N -0.34 0.00 -3.75 0.54 -0.00 -1.26 -5.15 120.64 110.67 1noi n GLU 287 Ca 0.04 0.00 -0.29 0.00 -0.00 0.00 0.00 57.16 56.91 1noi n GLU 287 Cb 0.69 0.00 -0.13 0.00 -0.00 0.00 0.00 31.44 32.00 1noi n GLU 287 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.13 177.33 1noi s GLY 288 N 0.00 1.94 0.31 -1.84 0.00 -1.26 -4.94 107.32 101.53 1noi s GLY 288 Ca 0.00 -2.87 0.03 0.00 0.00 0.00 0.00 44.72 41.88 1noi s GLY 288 CO 0.00 1.43 0.16 -1.59 0.00 0.00 0.00 173.10 173.10 1noi s LYS 289 N -0.02 1.60 0.26 2.90 -2.85 -1.26 -5.05 119.74 115.32 1noi s LYS 289 Ca 0.20 -1.91 -0.03 0.00 -1.00 0.00 0.00 55.97 53.23 1noi s LYS 289 Cb -0.20 -0.11 0.34 0.00 -2.06 0.00 0.00 37.83 35.80 1noi s LYS 289 CO -0.04 -0.45 1.81 1.49 0.10 0.00 0.00 175.35 178.27 1noi h GLU 290 N 2.21 0.92 -0.79 1.78 4.81 -2.00 -2.57 114.58 118.93 1noi h GLU 290 Ca -0.34 -0.18 -0.05 0.00 -0.13 0.00 0.00 59.36 58.66 1noi h GLU 290 Cb 1.25 -0.14 -0.03 0.00 0.63 0.00 0.00 28.75 30.46 1noi h GLU 290 CO 0.52 0.80 0.30 1.25 -0.73 0.00 0.00 179.01 181.16 1noi h LEU 291 N 0.88 1.10 0.04 1.64 6.46 -1.98 0.17 115.31 123.62 1noi h LEU 291 Ca 0.20 -0.18 0.01 0.00 -0.12 0.00 0.00 57.88 57.79 1noi h LEU 291 Cb 0.28 -0.29 -0.01 0.00 -0.73 0.00 0.00 40.66 39.91 1noi h LEU 291 CO -0.01 0.98 -0.08 0.03 -0.62 0.00 0.00 178.44 178.75 1noi h ARG 292 N 1.16 -0.16 -0.51 1.25 2.47 -1.83 0.18 114.38 116.93 1noi h ARG 292 Ca 0.26 0.01 0.00 0.00 -1.26 0.00 0.00 59.98 58.99 1noi h ARG 292 Cb 0.23 0.04 -0.02 0.00 -1.65 0.00 0.00 29.97 28.56 1noi h ARG 292 CO -0.02 -0.10 0.32 1.25 0.56 0.00 0.00 179.97 181.98 1noi h LEU 293 N -0.16 0.60 -0.95 3.04 5.85 -1.14 -1.79 115.31 120.76 1noi h LEU 293 Ca 0.02 -0.04 0.01 0.00 0.84 0.00 0.00 57.88 58.71 1noi h LEU 293 Cb 0.18 -0.15 -0.05 0.00 0.37 0.00 0.00 40.66 41.01 1noi h LEU 293 CO -0.05 0.46 0.63 0.11 -0.34 0.00 0.00 178.44 179.24 1noi h LYS 294 N 0.69 1.26 -0.58 1.25 1.57 -0.55 0.80 116.57 121.00 1noi h LYS 294 Ca 0.19 -0.08 -0.05 0.00 -1.87 0.00 0.00 60.65 58.83 1noi h LYS 294 Cb -0.04 -0.28 -0.02 0.00 0.08 0.00 0.00 32.23 31.96 1noi h LYS 294 CO -0.04 0.84 0.16 1.96 -0.57 0.00 0.00 179.45 181.80 1noi h GLN 295 N 1.29 0.92 -0.24 3.15 4.20 -0.35 0.08 115.11 124.17 1noi h GLN 295 Ca 0.35 -0.21 -0.04 0.00 0.06 0.00 0.00 58.65 58.81 1noi h GLN 295 Cb -0.14 -0.13 -0.01 0.00 0.30 0.00 0.00 27.48 27.50 1noi h GLN 295 CO -0.07 0.84 -0.00 0.93 -0.67 0.00 0.00 178.83 179.85 1noi h GLU 296 N 0.83 0.43 -0.18 1.46 5.08 -0.78 -2.02 114.58 119.41 1noi h GLU 296 Ca 0.19 -0.14 -0.13 0.00 -1.00 0.00 0.00 59.36 58.27 1noi h GLU 296 Cb 0.32 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.52 1noi h GLU 296 CO -0.00 0.61 -0.46 -0.92 -1.00 0.00 0.00 179.01 177.24 1noi h TYR 297 N 0.21 0.54 -0.24 4.33 3.20 -0.83 -2.99 116.97 121.19 1noi h TYR 297 Ca 0.07 -0.17 0.03 0.00 3.14 0.00 0.00 58.73 61.80 1noi h TYR 297 Cb 0.41 -0.11 -0.03 0.00 1.54 0.00 0.00 36.73 38.54 1noi h TYR 297 CO 0.04 0.83 0.04 0.35 -1.64 0.00 0.00 178.16 177.78 1noi h PHE 298 N 0.36 0.07 0.00 -3.82 3.57 -0.65 -0.71 116.94 115.76 1noi h PHE 298 Ca 0.02 0.01 -0.11 0.00 3.53 0.00 0.00 57.97 61.43 1noi h PHE 298 Cb 0.95 0.01 -0.02 0.00 2.79 0.00 0.00 35.95 39.68 1noi h PHE 298 CO 0.03 0.01 -0.54 -0.24 -2.23 0.00 0.00 178.31 175.35 1noi h VAL 299 N 0.13 1.35 -0.06 1.41 3.04 -1.37 -3.10 116.25 117.65 1noi h VAL 299 Ca 0.11 -1.85 -0.03 0.00 -1.01 0.00 0.00 66.70 63.91 1noi h VAL 299 Cb 0.11 2.01 -0.00 0.00 -2.01 0.00 0.00 31.29 31.40 1noi h VAL 299 CO -0.15 0.52 -0.08 0.58 -1.01 0.00 0.00 177.57 177.43 1noi h VAL 300 N 0.00 1.40 0.14 1.51 2.07 -1.28 -2.37 116.25 117.72 1noi h VAL 300 Ca -0.01 -1.32 -0.01 0.00 0.82 0.00 0.00 66.70 66.19 1noi h VAL 300 Cb 0.97 2.15 0.00 0.00 -1.52 0.00 0.00 31.29 32.89 1noi h VAL 300 CO 0.07 0.36 -0.07 0.00 0.02 0.00 0.00 177.57 177.95 1noi h ALA 301 N 0.51 -0.19 -0.27 1.67 0.00 -1.16 -1.12 119.26 118.70 1noi h ALA 301 Ca 0.01 -0.11 -0.02 0.00 0.00 0.00 0.00 54.91 54.78 1noi h ALA 301 Cb 0.63 0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.48 1noi h ALA 301 CO 0.02 -0.52 0.10 0.00 0.00 0.00 0.00 179.25 178.84 1noi h ALA 302 N 0.47 0.36 -0.44 0.00 0.00 -1.67 -2.52 119.26 115.47 1noi h ALA 302 Ca -0.02 -0.13 0.04 0.00 0.00 0.00 0.00 54.91 54.80 1noi h ALA 302 Cb 0.29 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 17.93 1noi h ALA 302 CO 0.03 -0.03 0.20 1.15 0.00 0.00 0.00 179.25 180.60 1noi h THR 303 N 0.29 0.93 0.00 0.00 2.02 -1.36 -2.10 112.91 112.69 1noi h THR 303 Ca 0.09 -0.14 -0.07 0.00 0.77 0.00 0.00 66.41 67.06 1noi h THR 303 Cb 0.21 0.50 -0.01 0.00 -1.74 0.00 0.00 68.15 67.11 1noi h THR 303 CO -0.01 0.07 -0.33 -0.07 0.37 0.00 0.00 175.52 175.55 1noi h LEU 304 N 0.40 0.00 -0.18 2.58 4.07 -1.13 -0.11 115.31 120.94 1noi h LEU 304 Ca 0.19 0.00 -0.08 0.00 0.08 0.00 0.00 57.88 58.07 1noi h LEU 304 Cb 0.13 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 41.87 1noi h LEU 304 CO -0.16 0.33 -0.20 1.56 -1.08 0.00 0.00 178.44 178.90 1noi h GLN 305 N 0.00 0.46 -0.82 1.13 4.20 -1.25 -1.95 115.11 116.89 1noi h GLN 305 Ca -0.00 -0.25 -0.02 0.00 0.06 0.00 0.00 58.65 58.44 1noi h GLN 305 Cb 0.71 0.01 -0.04 0.00 0.30 0.00 0.00 27.48 28.46 1noi h GLN 305 CO 0.04 0.82 0.43 0.22 -0.67 0.00 0.00 178.83 179.68 1noi h ASP 306 N 0.11 1.02 -0.33 1.46 3.58 -0.65 -0.15 116.42 121.47 1noi h ASP 306 Ca 0.03 -0.09 -0.02 0.00 0.42 0.00 0.00 57.03 57.36 1noi h ASP 306 Cb 0.75 -0.26 -0.01 0.00 1.72 0.00 0.00 39.33 41.52 1noi h ASP 306 CO 0.05 0.83 0.11 0.40 -2.88 0.00 0.00 179.24 177.76 1noi h ILE 307 N 1.14 1.20 -0.23 2.25 2.04 -1.07 -0.05 117.51 122.79 1noi h ILE 307 Ca 0.29 -0.62 -0.13 0.00 1.00 0.00 0.00 64.86 65.40 1noi h ILE 307 Cb 0.05 0.99 -0.01 0.00 -0.74 0.00 0.00 36.82 37.11 1noi h ILE 307 CO -0.04 0.21 -0.39 0.40 0.00 0.00 0.00 178.15 178.33 1noi h ILE 308 N 0.38 1.30 0.02 -0.67 2.04 -0.47 -2.04 117.51 118.06 1noi h ILE 308 Ca 0.11 -1.54 -0.00 0.00 1.00 0.00 0.00 64.86 64.43 1noi h ILE 308 Cb 0.22 1.55 0.00 0.00 -0.74 0.00 0.00 36.82 37.85 1noi h ILE 308 CO -0.01 0.48 -0.01 -0.09 0.00 0.00 0.00 178.15 178.53 1noi h ARG 309 N 0.43 -0.03 -0.49 2.37 2.43 -0.92 -0.89 114.38 117.28 1noi h ARG 309 Ca 0.04 0.00 -0.04 0.00 -0.81 0.00 0.00 59.98 59.17 1noi h ARG 309 Cb 0.87 0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 30.41 1noi h ARG 309 CO 0.07 0.26 0.15 -0.09 -1.51 0.00 0.00 179.97 178.85 1noi h ARG 310 N -0.31 0.73 0.27 0.20 2.43 -0.91 -0.11 114.38 116.68 1noi h ARG 310 Ca -0.00 -0.13 -0.01 0.00 -0.81 0.00 0.00 59.98 59.03 1noi h ARG 310 Cb 0.30 -0.12 0.00 0.00 -0.42 0.00 0.00 29.97 29.73 1noi h ARG 310 CO 0.00 0.64 -0.13 0.35 -1.51 0.00 0.00 179.97 179.32 1noi h PHE 311 N 0.71 -0.34 -0.38 2.20 3.57 -1.03 -0.91 116.94 120.76 1noi h PHE 311 Ca 0.17 -0.01 0.03 0.00 3.53 0.00 0.00 57.97 61.68 1noi h PHE 311 Cb 0.22 0.11 -0.02 0.00 2.79 0.00 0.00 35.95 39.05 1noi h PHE 311 CO 0.01 -0.05 0.26 0.87 -2.23 0.00 0.00 178.31 177.17 1noi h LYS 312 N -0.61 0.40 0.04 1.11 1.57 -0.82 -2.84 116.57 115.42 1noi h LYS 312 Ca -0.04 -0.02 -0.16 0.00 -1.87 0.00 0.00 60.65 58.55 1noi h LYS 312 Cb 0.44 -0.09 0.02 0.00 0.08 0.00 0.00 32.23 32.67 1noi h LYS 312 CO 0.06 0.27 -0.67 0.66 -0.57 0.00 0.00 179.45 179.20 1noi h SER 313 N 0.42 0.51 -1.75 0.86 4.64 -0.82 -3.33 113.55 114.08 1noi h SER 313 Ca 0.15 -0.82 -0.55 0.00 -0.47 0.00 0.00 61.79 60.10 1noi h SER 313 Cb 0.11 -0.16 -0.09 0.00 -0.31 0.00 0.00 62.40 61.95 1noi h SER 313 CO -0.04 1.28 1.25 -0.44 -0.87 0.00 0.00 176.83 178.01 1noi s SER 314 N -6.82 6.22 0.00 4.97 0.01 -0.36 -4.43 113.70 113.29 1noi s SER 314 Ca -0.13 -0.85 0.00 0.00 1.31 0.00 0.00 55.95 56.28 1noi s SER 314 Cb 0.03 -2.56 0.00 0.00 0.21 0.00 0.00 66.02 63.69 1noi s SER 314 CO 0.83 -1.76 0.00 0.29 0.41 0.00 0.00 173.24 173.01 1noi n LYS 315 N 9.14 0.00 0.08 12.44 4.76 -1.26 -4.71 118.16 138.62 1noi n LYS 315 Ca 0.18 0.00 -0.05 0.00 -2.87 0.00 0.00 58.31 55.57 1noi n LYS 315 Cb 0.50 -1.81 0.11 0.00 -1.84 0.00 0.00 35.03 32.00 1noi n LYS 315 CO 0.00 0.00 0.00 0.35 -1.37 0.00 0.00 177.40 176.38 1noi h PHE 316 N 0.00 0.31 0.00 2.13 3.57 -1.75 -3.28 116.94 117.92 1noi h PHE 316 Ca 0.00 -0.12 0.00 0.00 3.53 0.00 0.00 57.97 61.38 1noi h PHE 316 Cb 0.00 -0.05 0.00 0.00 2.79 0.00 0.00 35.95 38.69 1noi h PHE 316 CO 0.00 0.79 0.00 0.41 -2.23 0.00 0.00 178.31 177.28 1noi n GLY 317 N 0.29 0.00 0.00 2.40 0.00 -1.25 -1.27 105.19 105.36 1noi n GLY 317 Ca -0.02 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 45.99 1noi n GLY 317 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1noi s ARG 319 N -2.01 3.44 -0.43 0.00 3.00 -0.40 -4.63 118.95 117.93 1noi s ARG 319 Ca -0.00 -0.87 0.07 0.00 -1.00 0.00 0.00 55.73 53.93 1noi s ARG 319 Cb 0.00 -4.89 0.25 0.00 0.00 0.00 0.00 34.95 30.31 1noi s ARG 319 CO 0.01 -2.14 0.67 -0.40 0.00 0.00 0.00 175.30 173.44 1noi n ASP 320 N 8.82 -1.07 -0.33 -2.12 5.75 -1.26 -3.80 116.55 122.54 1noi n ASP 320 Ca 0.21 -2.94 0.27 0.00 -0.01 0.00 0.00 54.79 52.32 1noi n ASP 320 Cb 0.50 0.36 0.51 0.00 -1.03 0.00 0.00 41.12 41.46 1noi n ASP 320 CO 0.00 0.00 0.00 -0.65 -0.11 0.00 0.00 177.20 176.44 1noi h PRO 321 N 4.01 0.08 -3.30 0.11 0.11 -1.98 -3.44 132.00 127.59 1noi h PRO 321 Ca -0.02 -0.00 -0.15 0.00 0.11 0.00 0.00 66.00 65.94 1noi h PRO 321 Cb 0.94 -0.02 -0.22 0.00 0.11 0.00 0.00 31.00 31.81 1noi h PRO 321 CO 0.41 0.05 -0.43 0.54 -0.21 0.00 0.00 178.00 178.36 1noi s VAL 322 N -5.63 0.05 0.00 3.15 0.11 -1.26 -5.02 120.40 111.79 1noi s VAL 322 Ca -0.10 -0.41 0.00 0.00 -2.93 0.00 0.00 61.98 58.54 1noi s VAL 322 Cb 0.32 -0.43 0.00 0.00 -1.53 0.00 0.00 36.38 34.74 1noi s VAL 322 CO 0.78 -0.22 0.00 -1.14 -3.33 0.00 0.00 175.10 171.19 1noi n ARG 323 N 1.93 -0.03 -3.65 1.54 3.00 -1.26 0.56 116.66 118.75 1noi n ARG 323 Ca -0.19 0.00 -0.23 0.00 -0.00 0.00 0.00 57.85 57.43 1noi n ARG 323 Cb 0.57 0.00 0.06 0.00 0.00 0.00 0.00 32.46 33.09 1noi n ARG 323 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.63 180.04 1noi n THR 324 N 0.00 -3.83 -1.70 5.15 -1.04 -1.25 -4.24 114.28 107.37 1noi n THR 324 Ca 0.00 -0.22 -0.43 0.00 -2.04 0.00 0.00 64.05 61.35 1noi n THR 324 Cb 0.00 -3.95 -0.02 0.00 -1.82 0.00 0.00 70.33 64.53 1noi n THR 324 CO 0.00 0.00 0.00 -3.20 -0.64 0.00 0.00 175.07 171.23 1noi n ASN 325 N -3.01 3.17 0.24 8.00 2.85 0.19 -4.74 115.26 121.96 1noi n ASN 325 Ca -0.12 1.15 0.09 0.00 -0.11 0.00 0.00 54.58 55.59 1noi n ASN 325 Cb 0.60 -1.49 0.48 0.00 1.24 0.00 0.00 39.78 40.61 1noi n ASN 325 CO 0.00 0.00 0.00 -0.26 -2.11 0.00 0.00 177.26 174.89 1noi h PHE 326 N 4.35 0.00 -0.82 1.20 0.04 -1.86 0.87 116.94 120.72 1noi h PHE 326 Ca -0.46 0.00 0.19 0.00 2.80 0.00 0.00 57.97 60.50 1noi h PHE 326 Cb 1.26 0.00 -0.12 0.00 2.20 0.00 0.00 35.95 39.29 1noi h PHE 326 CO 0.57 0.00 0.26 -0.44 -0.60 0.00 0.00 178.31 178.10 1noi h ASP 327 N 0.00 0.12 0.29 2.17 5.19 -1.92 0.39 116.42 122.67 1noi h ASP 327 Ca 0.00 0.16 0.00 0.00 -0.62 0.00 0.00 57.03 56.57 1noi h ASP 327 Cb 0.80 0.18 0.00 0.00 0.18 0.00 0.00 39.33 40.50 1noi h ASP 327 CO 0.00 -0.04 0.00 0.00 -3.12 0.00 0.00 179.24 176.08 1noi n ALA 328 N -2.62 2.49 -0.15 3.45 0.00 0.30 -4.41 120.51 119.57 1noi n ALA 328 Ca 0.18 -0.16 -0.03 0.00 0.00 0.00 0.00 53.44 53.43 1noi n ALA 328 Cb 0.55 -1.47 0.06 0.00 0.00 0.00 0.00 19.45 18.59 1noi n ALA 328 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.50 177.85 1noi h PHE 329 N 0.00 0.16 0.00 0.00 3.57 -0.22 -1.26 116.94 119.19 1noi h PHE 329 Ca 0.00 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.53 1noi h PHE 329 Cb 0.15 -0.00 0.00 0.00 2.79 0.00 0.00 35.95 38.88 1noi h PHE 329 CO 0.00 0.01 0.00 -2.30 -2.23 0.00 0.00 178.31 173.79 1noi n PRO 330 N -5.10 0.11 0.09 6.41 -0.02 -1.26 -1.32 135.00 133.91 1noi n PRO 330 Ca 0.05 0.32 0.12 0.00 -2.02 0.00 0.00 63.50 61.96 1noi n PRO 330 Cb 0.22 -1.69 0.10 0.00 -0.02 0.00 0.00 33.50 32.11 1noi n PRO 330 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 1noi h ASP 331 N 0.00 0.00 -0.01 2.55 3.32 -1.52 -3.37 116.42 117.40 1noi h ASP 331 Ca 0.00 -0.11 0.00 0.00 0.02 0.00 0.00 57.03 56.94 1noi h ASP 331 Cb 0.34 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.89 1noi h ASP 331 CO 0.00 0.05 -0.06 0.29 -1.72 0.00 0.00 179.24 177.81 1noi n LYS 332 N -2.43 0.86 -3.99 3.56 4.76 -0.65 -4.40 118.16 115.86 1noi n LYS 332 Ca 0.02 -0.85 -0.14 0.00 -2.87 0.00 0.00 58.31 54.47 1noi n LYS 332 Cb 0.49 -1.12 -0.14 0.00 -1.84 0.00 0.00 35.03 32.42 1noi n LYS 332 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 1noi s VAL 333 N -0.87 0.18 -0.00 -0.18 1.01 -0.43 -1.28 120.40 118.82 1noi s VAL 333 Ca 0.09 -0.09 0.01 0.00 0.00 0.00 0.00 61.98 61.99 1noi s VAL 333 Cb 0.07 -0.16 -0.00 0.00 0.00 0.00 0.00 36.38 36.29 1noi s VAL 333 CO 0.14 0.05 -0.02 0.00 0.00 0.00 0.00 175.10 175.27 1noi s ALA 334 N -0.02 0.20 -0.14 5.51 0.00 -0.23 -4.52 121.76 122.56 1noi s ALA 334 Ca 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 51.96 51.88 1noi s ALA 334 Cb -0.01 -0.06 0.02 0.00 0.00 0.00 0.00 23.12 23.07 1noi s ALA 334 CO -0.00 0.04 -0.13 0.42 0.00 0.00 0.00 175.76 176.09 1noi s ILE 335 N 0.00 1.45 -0.35 0.00 1.01 -0.67 -1.06 121.20 121.57 1noi s ILE 335 Ca 0.00 -0.56 -0.13 0.00 0.00 0.00 0.00 60.65 59.97 1noi s ILE 335 Cb -0.02 -1.37 -0.01 0.00 0.01 0.00 0.00 42.46 41.08 1noi s ILE 335 CO -0.00 0.44 0.24 -1.58 0.00 0.00 0.00 174.94 174.04 1noi s GLN 336 N 1.48 3.33 -0.67 2.79 2.00 0.05 -1.94 119.66 126.71 1noi s GLN 336 Ca 0.04 -0.76 -0.27 0.00 -2.00 0.00 0.00 55.36 52.38 1noi s GLN 336 Cb -0.13 -3.82 0.03 0.00 0.80 0.00 0.00 33.01 29.90 1noi s GLN 336 CO -0.09 -0.52 1.20 -0.51 -0.50 0.00 0.00 175.29 174.86 1noi s LEU 337 N 1.69 3.44 -1.03 3.68 1.02 -0.44 -1.93 118.68 125.12 1noi s LEU 337 Ca 0.06 -0.33 -0.22 0.00 0.02 0.00 0.00 54.13 53.65 1noi s LEU 337 Cb -0.18 -2.75 0.06 0.00 0.02 0.00 0.00 46.19 43.34 1noi s LEU 337 CO 0.10 -1.65 1.44 0.21 0.02 0.00 0.00 176.35 176.48 1noi s ASN 338 N 3.43 6.54 0.00 2.29 2.47 -1.18 -0.96 114.94 127.54 1noi s ASN 338 Ca 0.36 -1.59 0.00 0.00 0.42 0.00 0.00 52.86 52.05 1noi s ASN 338 Cb -0.09 -2.56 0.00 0.00 -1.45 0.00 0.00 41.25 37.15 1noi s ASN 338 CO 0.18 -1.44 0.00 0.47 -3.72 0.00 0.00 177.10 172.59 1noi n ASP 339 N 8.63 0.00 0.00 -4.21 8.00 -0.74 -4.41 116.55 123.82 1noi n ASP 339 Ca 0.33 0.00 0.12 0.00 0.71 0.00 0.00 54.79 55.95 1noi n ASP 339 Cb 0.50 0.00 0.66 0.00 -0.02 0.00 0.00 41.12 42.26 1noi n ASP 339 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 1noi n THR 340 N -0.55 0.14 -0.36 -3.53 -2.24 -1.26 -3.98 114.28 102.50 1noi n THR 340 Ca 0.00 0.04 -0.01 0.00 -2.27 0.00 0.00 64.05 61.80 1noi n THR 340 Cb 0.00 -0.65 0.13 0.00 -2.10 0.00 0.00 70.33 67.71 1noi n THR 340 CO 0.00 0.00 0.00 0.45 -0.57 0.00 0.00 175.07 174.95 1noi h HIS 341 N 0.00 1.23 -0.42 4.78 3.86 -1.97 -1.08 115.15 121.55 1noi h HIS 341 Ca 0.00 0.03 -0.08 0.00 -1.16 0.00 0.00 60.37 59.16 1noi h HIS 341 Cb 0.12 -0.42 -0.05 0.00 1.06 0.00 0.00 27.41 28.13 1noi h HIS 341 CO 0.00 0.76 0.10 -2.30 0.86 0.00 0.00 177.93 177.36 1noi n PRO 342 N -4.39 3.01 0.29 2.45 -0.02 -1.26 -4.55 135.00 130.52 1noi n PRO 342 Ca 0.12 -1.93 0.17 0.00 -2.02 0.00 0.00 63.50 59.84 1noi n PRO 342 Cb 0.03 -1.91 0.88 0.00 -0.02 0.00 0.00 33.50 32.47 1noi n PRO 342 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1noi h SER 343 N 2.00 0.00 0.23 2.55 4.64 -1.43 0.85 113.55 122.39 1noi h SER 343 Ca 0.10 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.42 1noi h SER 343 Cb 1.61 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.70 1noi h SER 343 CO 0.40 0.05 0.00 0.18 -0.87 0.00 0.00 176.83 176.60 1noi n LEU 344 N -3.43 0.00 -0.05 5.97 4.77 -1.26 -1.54 117.00 121.46 1noi n LEU 344 Ca -0.02 0.42 0.04 0.00 -0.03 0.00 0.00 56.01 56.42 1noi n LEU 344 Cb 0.18 -0.42 0.40 0.00 -2.33 0.00 0.00 43.42 41.26 1noi n LEU 344 CO 0.26 -0.30 1.18 0.00 -1.33 0.00 0.00 177.39 177.20 1noi h ALA 345 N 2.32 1.70 0.40 -1.18 0.00 -1.19 -1.53 119.26 119.77 1noi h ALA 345 Ca 0.00 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.86 1noi h ALA 345 Cb 0.11 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.73 1noi h ALA 345 CO 0.00 0.26 -0.19 0.82 0.00 0.00 0.00 179.25 180.14 1noi h ILE 346 N 0.61 0.00 0.00 0.00 2.04 -1.51 0.41 117.51 119.06 1noi h ILE 346 Ca 0.19 -0.31 -0.01 0.00 1.00 0.00 0.00 64.86 65.73 1noi h ILE 346 Cb 0.00 0.00 -0.00 0.00 -0.74 0.00 0.00 36.82 36.08 1noi h ILE 346 CO -0.04 0.00 -0.03 1.55 0.00 0.00 0.00 178.15 179.63 1noi h PRO 347 N -0.85 0.00 -0.39 2.37 0.13 -1.75 -2.59 132.00 128.92 1noi h PRO 347 Ca -0.05 0.00 -0.10 0.00 -0.87 0.00 0.00 66.00 64.98 1noi h PRO 347 Cb 0.41 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.53 1noi h PRO 347 CO 0.09 0.03 -0.14 1.49 -0.23 0.00 0.00 178.00 179.24 1noi h GLU 348 N 0.00 0.79 -0.27 0.86 4.57 -1.22 0.82 114.58 120.13 1noi h GLU 348 Ca -0.00 -0.32 -0.10 0.00 -1.18 0.00 0.00 59.36 57.76 1noi h GLU 348 Cb 0.06 -0.03 -0.01 0.00 -0.16 0.00 0.00 28.75 28.61 1noi h GLU 348 CO 0.00 0.95 -0.23 1.25 -1.18 0.00 0.00 179.01 179.79 1noi h LEU 349 N 0.60 0.52 -0.66 1.64 5.85 -0.54 0.54 115.31 123.27 1noi h LEU 349 Ca 0.09 -0.17 -0.09 0.00 0.84 0.00 0.00 57.88 58.55 1noi h LEU 349 Cb 0.68 -0.14 -0.02 0.00 0.37 0.00 0.00 40.66 41.54 1noi h LEU 349 CO 0.05 0.75 0.06 0.24 -0.34 0.00 0.00 178.44 179.20 1noi h MET 350 N 0.46 1.11 0.16 1.25 2.86 -1.16 0.75 114.93 120.35 1noi h MET 350 Ca 0.07 -0.32 -0.01 0.00 -2.06 0.00 0.00 59.70 57.38 1noi h MET 350 Cb 0.66 -0.12 0.00 0.00 0.06 0.00 0.00 31.60 32.20 1noi h MET 350 CO 0.05 1.04 -0.08 -0.09 1.06 0.00 0.00 176.91 178.89 1noi h ARG 351 N 1.02 -0.21 -0.62 1.72 2.43 0.17 0.14 114.38 119.04 1noi h ARG 351 Ca 0.19 0.01 -0.00 0.00 -0.81 0.00 0.00 59.98 59.38 1noi h ARG 351 Cb 0.50 0.05 -0.03 0.00 -0.42 0.00 0.00 29.97 30.06 1noi h ARG 351 CO 0.02 0.01 0.38 0.28 -1.51 0.00 0.00 179.97 179.15 1noi h VAL 352 N -0.40 1.18 -0.28 0.20 2.07 -0.79 0.16 116.25 118.39 1noi h VAL 352 Ca -0.02 -0.37 -0.19 0.00 0.82 0.00 0.00 66.70 66.94 1noi h VAL 352 Cb 0.31 0.31 0.00 0.00 -1.52 0.00 0.00 31.29 30.40 1noi h VAL 352 CO 0.04 0.18 -0.56 -0.07 0.02 0.00 0.00 177.57 177.17 1noi h LEU 353 N 0.83 0.97 0.00 2.57 3.38 -0.61 -0.34 115.31 122.12 1noi h LEU 353 Ca 0.22 -0.54 -0.05 0.00 0.09 0.00 0.00 57.88 57.60 1noi h LEU 353 Cb -0.04 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.42 1noi h LEU 353 CO -0.04 1.33 -0.30 0.58 0.09 0.00 0.00 178.44 180.10 1noi h VAL 354 N 0.65 1.24 0.06 1.22 2.07 -0.70 -0.94 116.25 119.85 1noi h VAL 354 Ca 0.01 -2.04 -0.25 0.00 0.82 0.00 0.00 66.70 65.24 1noi h VAL 354 Cb 1.18 2.45 -0.02 0.00 -1.52 0.00 0.00 31.29 33.38 1noi h VAL 354 CO 0.12 0.42 -1.19 0.44 0.02 0.00 0.00 177.57 177.39 1noi h ASP 355 N -1.00 0.21 0.01 0.57 3.32 -0.76 -2.21 116.42 116.56 1noi h ASP 355 Ca -0.08 -0.24 -0.40 0.00 0.02 0.00 0.00 57.03 56.34 1noi h ASP 355 Cb 0.89 -0.07 -0.06 0.00 0.22 0.00 0.00 39.33 40.31 1noi h ASP 355 CO -0.05 1.19 -2.41 0.18 -1.72 0.00 0.00 179.24 176.43 1noi n LEU 356 N -3.42 2.72 0.06 1.55 4.32 -0.65 -4.53 117.00 117.05 1noi n LEU 356 Ca -0.06 0.01 0.11 0.00 -0.02 0.00 0.00 56.01 56.05 1noi n LEU 356 Cb 0.99 -0.92 0.02 0.00 -1.62 0.00 0.00 43.42 41.89 1noi n LEU 356 CO 0.50 0.84 -0.00 -0.62 -1.22 0.00 0.00 177.39 176.89 1noi n GLU 357 N -3.51 0.47 -2.95 3.23 -0.58 -0.23 -4.99 120.64 112.08 1noi n GLU 357 Ca -0.46 0.05 -0.11 0.00 -0.42 0.00 0.00 57.16 56.22 1noi n GLU 357 Cb 0.97 -1.71 0.04 0.00 -0.57 0.00 0.00 31.44 30.17 1noi n GLU 357 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 1noi n ARG 358 N -2.34 -3.89 -2.90 3.49 3.00 -0.69 -4.96 116.66 108.37 1noi n ARG 358 Ca 0.01 0.43 -0.22 0.00 -0.01 0.00 0.00 57.85 58.06 1noi n ARG 358 Cb 0.50 -4.25 0.02 0.00 0.00 0.00 0.00 32.46 28.73 1noi n ARG 358 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.63 177.12 1noi s LEU 359 N -4.26 3.55 0.48 0.55 1.43 -0.44 -4.99 118.68 114.98 1noi s LEU 359 Ca 0.20 0.12 -0.16 0.00 -1.03 0.00 0.00 54.13 53.26 1noi s LEU 359 Cb -0.09 -3.01 -0.08 0.00 0.03 0.00 0.00 46.19 43.04 1noi s LEU 359 CO 0.38 -0.83 0.93 -1.81 0.23 0.00 0.00 176.35 175.25 1noi s ASP 360 N -4.29 6.64 0.21 2.29 1.01 -1.26 -4.41 116.67 116.86 1noi s ASP 360 Ca 0.51 1.49 -0.09 0.00 0.71 0.00 0.00 52.55 55.17 1noi s ASP 360 Cb -0.10 -2.47 0.30 0.00 1.01 0.00 0.00 42.92 41.66 1noi s ASP 360 CO 0.37 -0.51 1.72 -0.25 0.21 0.00 0.00 175.17 176.71 1noi h TRP 361 N 1.14 0.31 0.00 4.23 7.01 -1.97 0.13 115.95 126.80 1noi h TRP 361 Ca -0.47 0.03 -0.03 0.00 2.11 0.00 0.00 58.89 60.53 1noi h TRP 361 Cb 1.18 -0.04 -0.00 0.00 -2.10 0.00 0.00 29.16 28.20 1noi h TRP 361 CO 0.63 0.03 -0.13 -0.44 -2.79 0.00 0.00 178.44 175.74 1noi h ASP 362 N 0.34 0.00 0.00 2.65 3.32 -1.99 -0.32 116.42 120.42 1noi h ASP 362 Ca 0.32 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.37 1noi h ASP 362 Cb 0.44 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.99 1noi h ASP 362 CO -0.36 0.13 -0.00 0.50 -1.72 0.00 0.00 179.24 177.79 1noi h LYS 363 N 0.00 -0.00 -0.07 3.56 1.63 -1.41 -2.72 116.57 117.56 1noi h LYS 363 Ca -0.00 0.00 -0.01 0.00 -0.85 0.00 0.00 60.65 59.79 1noi h LYS 363 Cb 0.79 0.00 -0.00 0.00 -0.60 0.00 0.00 32.23 32.42 1noi h LYS 363 CO 0.02 0.94 -0.00 0.00 -3.45 0.00 0.00 179.45 176.95 1noi h ALA 364 N 0.01 1.87 -0.05 5.00 0.00 -0.81 -0.26 119.26 125.03 1noi h ALA 364 Ca -0.00 -0.05 -0.17 0.00 0.00 0.00 0.00 54.91 54.69 1noi h ALA 364 Cb 0.94 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.69 1noi h ALA 364 CO 0.00 0.10 -0.73 2.35 0.00 0.00 0.00 179.25 180.97 1noi h TRP 365 N 0.09 0.37 0.23 0.00 2.91 -1.07 -0.36 115.95 118.13 1noi h TRP 365 Ca 0.02 -0.17 -0.01 0.00 1.13 0.00 0.00 58.89 59.86 1noi h TRP 365 Cb 0.07 -0.06 0.00 0.00 -0.51 0.00 0.00 29.16 28.67 1noi h TRP 365 CO 0.00 0.91 -0.11 1.49 -1.03 0.00 0.00 178.44 179.70 1noi h GLU 366 N 0.18 -0.30 -0.12 2.65 4.81 -0.98 -0.71 114.58 120.10 1noi h GLU 366 Ca -0.03 0.02 0.02 0.00 -0.13 0.00 0.00 59.36 59.24 1noi h GLU 366 Cb 1.30 0.07 -0.02 0.00 0.63 0.00 0.00 28.75 30.73 1noi h GLU 366 CO 0.12 -0.15 -0.01 0.28 -0.73 0.00 0.00 179.01 178.52 1noi h VAL 367 N -0.39 0.91 -0.04 0.32 2.07 -1.10 -2.66 116.25 115.37 1noi h VAL 367 Ca -0.03 -0.01 0.00 0.00 0.82 0.00 0.00 66.70 67.48 1noi h VAL 367 Cb 0.30 0.87 -0.00 0.00 -1.52 0.00 0.00 31.29 30.94 1noi h VAL 367 CO 0.05 0.01 0.01 0.74 0.02 0.00 0.00 177.57 178.40 1noi h THR 368 N 0.03 0.99 0.00 2.57 2.02 -0.76 -2.48 112.91 115.27 1noi h THR 368 Ca 0.06 -0.01 -0.10 0.00 0.77 0.00 0.00 66.41 67.13 1noi h THR 368 Cb 0.07 0.96 -0.01 0.00 -1.74 0.00 0.00 68.15 67.43 1noi h THR 368 CO -0.10 0.00 -0.45 -0.37 0.37 0.00 0.00 175.52 174.97 1noi h VAL 369 N 0.02 1.07 0.00 3.16 -1.51 -1.15 -1.84 116.25 116.01 1noi h VAL 369 Ca 0.02 -1.72 0.00 0.00 -1.23 0.00 0.00 66.70 63.77 1noi h VAL 369 Cb 0.01 2.00 0.00 0.00 -2.13 0.00 0.00 31.29 31.17 1noi h VAL 369 CO -0.02 0.45 0.00 0.11 -1.23 0.00 0.00 177.57 176.87 1noi h LYS 370 N 0.00 0.00 0.10 5.19 1.57 -1.23 -1.90 116.57 120.30 1noi h LYS 370 Ca -0.00 0.00 -0.36 0.00 -1.87 0.00 0.00 60.65 58.41 1noi h LYS 370 Cb 0.97 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 33.25 1noi h LYS 370 CO 0.06 0.00 -2.04 2.41 -0.57 0.00 0.00 179.45 179.31 1noi n THR 371 N -2.37 1.73 -3.64 -0.16 -1.04 -0.73 -4.89 114.28 103.17 1noi n THR 371 Ca 0.03 -0.66 -0.35 0.00 -2.04 0.00 0.00 64.05 61.03 1noi n THR 371 Cb 0.31 -1.62 -0.06 0.00 -1.82 0.00 0.00 70.33 67.15 1noi n THR 371 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1noi s ALA 373 N -1.28 0.30 -0.13 0.00 0.00 -0.82 -1.66 121.76 118.16 1noi s ALA 373 Ca 0.28 -0.42 0.02 0.00 0.00 0.00 0.00 51.96 51.84 1noi s ALA 373 Cb -0.14 0.02 0.00 0.00 0.00 0.00 0.00 23.12 23.00 1noi s ALA 373 CO 0.16 -0.02 -0.20 -0.47 0.00 0.00 0.00 175.76 175.23 1noi s TYR 374 N -0.79 2.69 -0.16 0.00 5.04 -0.62 -1.32 117.35 122.18 1noi s TYR 374 Ca -0.06 -1.11 -0.05 0.00 -2.44 0.00 0.00 57.07 53.41 1noi s TYR 374 Cb -0.06 -1.81 -0.03 0.00 0.35 0.00 0.00 41.96 40.41 1noi s TYR 374 CO -0.00 -0.48 -0.00 0.99 -1.34 0.00 0.00 175.55 174.72 1noi s THR 375 N 0.64 4.23 -0.09 4.34 2.01 -0.13 -2.05 115.64 124.58 1noi s THR 375 Ca -0.10 -0.24 -0.14 0.00 0.31 0.00 0.00 61.69 61.52 1noi s THR 375 Cb -0.16 -2.87 -0.05 0.00 0.01 0.00 0.00 72.50 69.43 1noi s THR 375 CO 0.02 0.48 0.33 0.21 -0.69 0.00 0.00 174.62 174.98 1noi s ASN 376 N 0.35 6.59 -0.07 3.53 3.84 -0.23 -1.79 114.94 127.16 1noi s ASN 376 Ca -0.01 0.70 0.10 0.00 0.21 0.00 0.00 52.86 53.85 1noi s ASN 376 Cb -0.13 -2.20 0.15 0.00 -0.55 0.00 0.00 41.25 38.51 1noi s ASN 376 CO 0.02 0.21 1.08 1.41 -2.79 0.00 0.00 177.10 177.03 1noi n HIS 377 N 2.75 0.02 -4.47 0.43 8.25 -1.26 -4.25 115.22 116.69 1noi n HIS 377 Ca -0.13 -0.75 -0.23 0.00 -0.26 0.00 0.00 57.72 56.34 1noi n HIS 377 Cb 0.52 -0.10 -0.10 0.00 1.12 0.00 0.00 29.99 31.43 1noi n HIS 377 CO 0.00 0.00 0.00 0.95 0.64 0.00 0.00 176.34 177.93 1noi s THR 378 N -1.94 2.21 0.00 1.59 -4.23 -1.26 -4.64 115.64 107.37 1noi s THR 378 Ca 0.16 -2.29 0.00 0.00 -1.18 0.00 0.00 61.69 58.39 1noi s THR 378 Cb 0.14 -2.39 0.00 0.00 1.34 0.00 0.00 72.50 71.60 1noi s THR 378 CO 0.02 -0.36 0.00 0.55 -0.54 0.00 0.00 174.62 174.29 1noi n VAL 379 N -0.63 0.00 -3.26 2.29 3.14 -1.26 -4.96 118.33 113.64 1noi n VAL 379 Ca -0.05 0.00 -0.40 0.00 -2.96 0.00 0.00 64.34 60.93 1noi n VAL 379 Cb 0.61 -0.18 -0.08 0.00 -1.06 0.00 0.00 33.84 33.13 1noi n VAL 379 CO 0.00 0.00 0.00 -0.51 -6.46 0.00 0.00 176.83 169.86 1noi s ILE 380 N -1.26 5.09 0.57 1.55 1.10 -1.26 -4.93 121.20 122.06 1noi s ILE 380 Ca 0.00 0.85 0.28 0.00 -0.51 0.00 0.00 60.65 61.27 1noi s ILE 380 Cb 0.00 -3.81 0.39 0.00 0.15 0.00 0.00 42.46 39.19 1noi s ILE 380 CO 0.00 0.11 1.96 -0.65 -2.11 0.00 0.00 174.94 174.25 1noi h PRO 381 N 7.95 0.00 -0.52 3.50 0.11 -1.98 -0.96 132.00 140.09 1noi h PRO 381 Ca -0.30 0.00 -0.12 0.00 0.11 0.00 0.00 66.00 65.69 1noi h PRO 381 Cb 1.14 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.24 1noi h PRO 381 CO 0.71 0.00 -0.15 0.93 -0.21 0.00 0.00 178.00 179.28 1noi h GLU 382 N 0.00 1.00 0.00 1.05 3.07 -2.03 -2.78 114.58 114.90 1noi h GLU 382 Ca 0.21 -0.39 0.00 0.00 -0.50 0.00 0.00 59.36 58.68 1noi h GLU 382 Cb 1.03 -0.05 0.00 0.00 -0.84 0.00 0.00 28.75 28.89 1noi h GLU 382 CO -0.00 1.07 0.00 0.00 -1.40 0.00 0.00 179.01 178.68 1noi n ALA 383 N -2.51 2.12 -1.76 3.43 0.00 -0.37 -4.79 120.51 116.64 1noi n ALA 383 Ca 0.01 -0.10 -0.39 0.00 0.00 0.00 0.00 53.44 52.96 1noi n ALA 383 Cb 0.42 -1.27 0.02 0.00 0.00 0.00 0.00 19.45 18.63 1noi n ALA 383 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1noi s LEU 384 N -1.99 3.97 -0.07 0.00 1.02 -1.05 -4.96 118.68 115.59 1noi s LEU 384 Ca 0.25 2.73 -0.25 0.00 0.02 0.00 0.00 54.13 56.88 1noi s LEU 384 Cb 0.11 -4.16 -0.03 0.00 0.02 0.00 0.00 46.19 42.13 1noi s LEU 384 CO 0.19 -1.33 0.78 -0.70 0.02 0.00 0.00 176.35 175.31 1noi s GLU 385 N -2.71 4.44 0.01 1.70 2.12 -1.26 -5.01 118.70 117.99 1noi s GLU 385 Ca 0.67 1.01 0.01 0.00 0.36 0.00 0.00 54.97 57.01 1noi s GLU 385 Cb -0.39 -3.47 -0.01 0.00 0.26 0.00 0.00 34.13 30.51 1noi s GLU 385 CO 0.48 -0.02 -0.03 1.03 -0.54 0.00 0.00 175.26 176.18 1noi s ARG 386 N 1.06 0.27 -0.03 4.30 0.52 -1.26 -1.26 118.95 122.55 1noi s ARG 386 Ca 0.41 -0.38 0.03 0.00 -0.52 0.00 0.00 55.73 55.26 1noi s ARG 386 Cb -0.18 -0.08 0.00 0.00 0.52 0.00 0.00 34.95 35.21 1noi s ARG 386 CO 0.19 0.01 -0.11 -1.58 0.02 0.00 0.00 175.30 173.83 1noi s TRP 387 N -0.78 1.14 0.47 -0.53 0.52 -1.04 -4.95 118.94 113.76 1noi s TRP 387 Ca -0.07 -0.31 -0.24 0.00 0.02 0.00 0.00 56.10 55.50 1noi s TRP 387 Cb -0.06 -0.80 -0.07 0.00 -1.15 0.00 0.00 33.47 31.39 1noi s TRP 387 CO -0.00 -0.13 1.39 -2.14 0.02 0.00 0.00 176.95 176.09 1noi s PRO 388 N 0.21 3.57 0.45 4.98 0.02 -1.26 -0.45 135.00 142.52 1noi s PRO 388 Ca -0.04 2.33 0.25 0.00 0.02 0.00 0.00 61.00 63.56 1noi s PRO 388 Cb -0.10 -2.55 0.61 0.00 0.02 0.00 0.00 34.50 32.48 1noi s PRO 388 CO 0.01 -0.88 1.70 -0.39 -0.33 0.00 0.00 177.00 177.11 1noi h VAL 389 N 2.08 0.13 0.00 3.83 -1.51 -1.46 -2.77 116.25 116.55 1noi h VAL 389 Ca -0.51 -1.02 -0.04 0.00 -1.23 0.00 0.00 66.70 63.91 1noi h VAL 389 Cb 1.27 1.91 -0.01 0.00 -2.13 0.00 0.00 31.29 32.33 1noi h VAL 389 CO 0.60 0.07 -0.19 1.12 -1.23 0.00 0.00 177.57 177.94 1noi h HIS 390 N 0.00 0.00 0.03 5.19 2.07 -1.92 -1.69 115.15 118.83 1noi h HIS 390 Ca -0.00 0.00 -0.27 0.00 -2.85 0.00 0.00 60.37 57.25 1noi h HIS 390 Cb 0.90 0.00 0.02 0.00 2.57 0.00 0.00 27.41 30.90 1noi h HIS 390 CO 0.00 0.19 -1.07 1.25 -3.07 0.00 0.00 177.93 175.23 1noi h LEU 391 N 0.00 0.89 -0.65 6.12 6.46 -1.87 -2.19 115.31 124.07 1noi h LEU 391 Ca -0.00 -0.76 -0.13 0.00 -0.12 0.00 0.00 57.88 56.87 1noi h LEU 391 Cb 0.35 -0.27 -0.01 0.00 -0.73 0.00 0.00 40.66 39.99 1noi h LEU 391 CO 0.03 1.54 -0.31 -0.07 -0.62 0.00 0.00 178.44 179.01 1noi h LEU 392 N 0.34 0.75 -0.30 2.25 4.07 -1.53 -1.92 115.31 118.96 1noi h LEU 392 Ca -0.14 -0.30 -0.01 0.00 0.08 0.00 0.00 57.88 57.51 1noi h LEU 392 Cb 1.74 -0.21 -0.01 0.00 1.08 0.00 0.00 40.66 43.26 1noi h LEU 392 CO 0.21 1.00 0.14 -0.08 -1.08 0.00 0.00 178.44 178.63 1noi h GLU 393 N 0.61 0.43 0.59 1.13 4.81 -1.29 0.14 114.58 121.01 1noi h GLU 393 Ca 0.07 -0.07 -0.03 0.00 -0.13 0.00 0.00 59.36 59.21 1noi h GLU 393 Cb 0.82 -0.08 0.01 0.00 0.63 0.00 0.00 28.75 30.13 1noi h GLU 393 CO 0.07 0.42 -0.28 1.15 -0.73 0.00 0.00 179.01 179.63 1noi h THR 394 N 0.35 0.23 0.00 0.32 2.02 -1.37 -3.25 112.91 111.21 1noi h THR 394 Ca 0.10 -0.36 0.00 0.00 0.77 0.00 0.00 66.41 66.92 1noi h THR 394 Cb 0.13 0.31 0.00 0.00 -1.74 0.00 0.00 68.15 66.85 1noi h THR 394 CO -0.01 0.03 -0.90 0.00 0.37 0.00 0.00 175.52 175.01 1noi n LEU 395 N -5.33 0.64 -3.00 2.58 -0.00 -0.72 -4.23 117.00 106.94 1noi n LEU 395 Ca -0.11 -0.07 -0.15 0.00 -0.00 0.00 0.00 56.01 55.68 1noi n LEU 395 Cb 0.34 -0.12 -0.01 0.00 -0.00 0.00 0.00 43.42 43.63 1noi n LEU 395 CO 0.30 0.08 -0.19 0.18 -0.00 0.00 0.00 177.39 177.76 1noi n LEU 396 N -1.82 1.09 -0.30 1.47 4.32 0.48 -0.02 117.00 122.23 1noi n LEU 396 Ca 0.03 -4.56 0.02 0.00 -0.02 0.00 0.00 56.01 51.49 1noi n LEU 396 Cb 0.40 0.60 0.16 0.00 -1.62 0.00 0.00 43.42 42.96 1noi n LEU 396 CO 0.39 2.03 1.16 1.55 -1.22 0.00 0.00 177.39 181.30 1noi h PRO 397 N 3.00 0.82 -0.47 3.23 0.13 -1.53 -1.80 132.00 135.38 1noi h PRO 397 Ca 0.03 -0.05 -0.05 0.00 -0.87 0.00 0.00 66.00 65.06 1noi h PRO 397 Cb 1.04 -0.18 -0.02 0.00 0.13 0.00 0.00 31.00 31.97 1noi h PRO 397 CO 0.50 0.54 0.09 -0.09 -0.23 0.00 0.00 178.00 178.82 1noi h ARG 398 N 0.84 0.76 -0.84 0.86 9.65 -1.90 -2.76 114.38 120.99 1noi h ARG 398 Ca 0.39 -0.20 0.01 0.00 -1.10 0.00 0.00 59.98 59.09 1noi h ARG 398 Cb 0.31 -0.09 -0.04 0.00 -1.39 0.00 0.00 29.97 28.75 1noi h ARG 398 CO -0.22 0.77 0.56 0.45 2.80 0.00 0.00 179.97 184.32 1noi h HIS 399 N 0.64 1.05 -0.27 2.20 3.86 -1.69 -1.61 115.15 119.33 1noi h HIS 399 Ca 0.14 0.03 0.02 0.00 -1.16 0.00 0.00 60.37 59.39 1noi h HIS 399 Cb 0.36 -0.35 -0.02 0.00 1.06 0.00 0.00 27.41 28.45 1noi h HIS 399 CO 0.02 0.65 0.14 1.25 0.86 0.00 0.00 177.93 180.85 1noi h LEU 400 N 1.13 0.21 -0.59 2.43 6.46 -1.16 -0.27 115.31 123.51 1noi h LEU 400 Ca 0.31 0.01 0.07 0.00 -0.12 0.00 0.00 57.88 58.15 1noi h LEU 400 Cb -0.10 -0.03 -0.06 0.00 -0.73 0.00 0.00 40.66 39.74 1noi h LEU 400 CO -0.07 0.16 0.29 1.56 -0.62 0.00 0.00 178.44 179.75 1noi h GLN 401 N 0.29 0.52 -0.37 1.25 4.20 -1.06 0.27 115.11 120.20 1noi h GLN 401 Ca 0.11 -0.03 -0.09 0.00 0.06 0.00 0.00 58.65 58.70 1noi h GLN 401 Cb 0.02 -0.12 -0.01 0.00 0.30 0.00 0.00 27.48 27.68 1noi h GLN 401 CO -0.07 0.34 -0.10 0.82 -0.67 0.00 0.00 178.83 179.15 1noi h ILE 402 N 0.53 1.28 -0.58 2.54 2.04 -1.04 -2.64 117.51 119.63 1noi h ILE 402 Ca 0.28 -1.19 0.02 0.00 1.00 0.00 0.00 64.86 64.96 1noi h ILE 402 Cb 0.23 1.28 -0.03 0.00 -0.74 0.00 0.00 36.82 37.56 1noi h ILE 402 CO -0.21 0.39 0.37 0.40 0.00 0.00 0.00 178.15 179.10 1noi h ILE 403 N 0.52 1.11 0.00 -0.67 2.04 -0.17 -0.99 117.51 119.36 1noi h ILE 403 Ca 0.09 -0.26 -0.02 0.00 1.00 0.00 0.00 64.86 65.68 1noi h ILE 403 Cb 0.62 0.30 -0.00 0.00 -0.74 0.00 0.00 36.82 36.99 1noi h ILE 403 CO 0.04 0.14 -0.09 1.88 0.00 0.00 0.00 178.15 180.12 1noi h TYR 404 N 0.75 0.00 0.13 1.37 0.05 -0.68 -1.09 116.97 117.50 1noi h TYR 404 Ca 0.22 0.00 -0.34 0.00 0.05 0.00 0.00 58.73 58.66 1noi h TYR 404 Cb -0.04 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 37.69 1noi h TYR 404 CO -0.04 0.09 -1.78 1.49 -1.05 0.00 0.00 178.16 176.86 1noi h GLU 405 N 0.00 0.27 -0.88 4.88 4.57 -0.98 -2.56 114.58 119.89 1noi h GLU 405 Ca -0.00 -0.47 0.04 0.00 -1.18 0.00 0.00 59.36 57.75 1noi h GLU 405 Cb 0.21 0.17 -0.06 0.00 -0.16 0.00 0.00 28.75 28.92 1noi h GLU 405 CO 0.01 1.15 0.56 0.82 -1.18 0.00 0.00 179.01 180.37 1noi h ILE 406 N 0.07 1.11 -0.21 2.32 2.04 -0.94 -1.19 117.51 120.72 1noi h ILE 406 Ca -0.34 -0.37 -0.01 0.00 1.00 0.00 0.00 64.86 65.14 1noi h ILE 406 Cb 2.05 -0.05 -0.01 0.00 -0.74 0.00 0.00 36.82 38.07 1noi h ILE 406 CO 0.13 0.19 0.08 -1.13 0.00 0.00 0.00 178.15 177.43 1noi h ASN 407 N 1.07 0.30 -0.30 1.72 -1.24 -1.17 -0.75 115.58 115.21 1noi h ASN 407 Ca 0.36 -0.18 -0.01 0.00 0.71 0.00 0.00 56.30 57.18 1noi h ASN 407 Cb 0.06 -0.08 -0.01 0.00 0.73 0.00 0.00 38.32 39.02 1noi h ASN 407 CO -0.14 0.40 0.16 -0.61 -1.29 0.00 0.00 177.43 175.95 1noi h GLN 408 N 0.18 0.42 0.00 6.67 4.15 -1.18 -0.40 115.11 124.94 1noi h GLN 408 Ca 0.07 -0.05 -0.08 0.00 0.77 0.00 0.00 58.65 59.36 1noi h GLN 408 Cb 0.20 -0.08 -0.01 0.00 0.21 0.00 0.00 27.48 27.80 1noi h GLN 408 CO -0.00 0.36 -0.37 0.00 -1.93 0.00 0.00 178.83 176.89 1noi h ARG 409 N 0.36 0.00 -0.17 1.69 3.08 -1.06 -2.16 114.38 116.11 1noi h ARG 409 Ca 0.10 0.00 -0.10 0.00 0.07 0.00 0.00 59.98 60.06 1noi h ARG 409 Cb 0.07 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.12 1noi h ARG 409 CO -0.02 0.37 -0.27 0.35 -1.07 0.00 0.00 179.97 179.33 1noi h PHE 410 N 0.00 0.60 -0.47 3.04 3.57 -0.52 -2.74 116.94 120.42 1noi h PHE 410 Ca -0.00 -0.21 -0.02 0.00 3.53 0.00 0.00 57.97 61.27 1noi h PHE 410 Cb 1.01 -0.12 -0.02 0.00 2.79 0.00 0.00 35.95 39.61 1noi h PHE 410 CO 0.00 0.91 0.20 -0.07 -2.23 0.00 0.00 178.31 177.12 1noi h LEU 411 N 0.12 0.60 -1.38 0.59 3.38 -1.08 -0.62 115.31 116.93 1noi h LEU 411 Ca 0.01 -0.06 -0.05 0.00 0.09 0.00 0.00 57.88 57.87 1noi h LEU 411 Cb 0.85 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.44 1noi h LEU 411 CO 0.06 0.54 -0.15 0.78 0.09 0.00 0.00 178.44 179.76 1noi h ASN 412 N 0.67 0.21 -0.12 -0.43 -0.26 -1.27 -1.43 115.58 112.95 1noi h ASN 412 Ca 0.16 -0.05 -0.11 0.00 -0.56 0.00 0.00 56.30 55.75 1noi h ASN 412 Cb 0.12 -0.06 0.00 0.00 -1.06 0.00 0.00 38.32 37.32 1noi h ASN 412 CO -0.02 0.39 -0.35 0.03 -1.06 0.00 0.00 177.43 176.43 1noi h ARG 413 N 0.21 0.44 -0.91 0.81 3.08 -0.94 -3.06 114.38 114.01 1noi h ARG 413 Ca 0.04 -0.32 0.02 0.00 0.07 0.00 0.00 59.98 59.79 1noi h ARG 413 Cb 0.41 0.05 -0.05 0.00 0.08 0.00 0.00 29.97 30.46 1noi h ARG 413 CO 0.03 0.94 0.60 0.28 -1.07 0.00 0.00 179.97 180.74 1noi h VAL 414 N 0.03 1.20 -0.46 2.04 2.07 -0.86 -1.88 116.25 118.39 1noi h VAL 414 Ca -0.01 -0.41 0.00 0.00 0.82 0.00 0.00 66.70 67.10 1noi h VAL 414 Cb 0.97 -0.10 -0.02 0.00 -1.52 0.00 0.00 31.29 30.61 1noi h VAL 414 CO 0.07 0.22 0.29 0.00 0.02 0.00 0.00 177.57 178.17 1noi h ALA 415 N 1.35 0.58 0.00 1.67 0.00 -1.30 0.20 119.26 121.76 1noi h ALA 415 Ca 0.34 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.21 1noi h ALA 415 Cb -0.08 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.52 1noi h ALA 415 CO -0.09 0.05 0.00 0.00 0.00 0.00 0.00 179.25 179.21 1noi h ALA 416 N 1.15 1.00 0.02 0.00 0.00 -1.43 -2.21 119.26 117.79 1noi h ALA 416 Ca 0.17 0.00 -0.33 0.00 0.00 0.00 0.00 54.91 54.75 1noi h ALA 416 Cb -0.04 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 17.70 1noi h ALA 416 CO -0.03 0.00 -1.95 0.00 0.00 0.00 0.00 179.25 177.27 1noi n ALA 417 N -1.90 1.41 -3.59 0.00 0.00 -0.72 -4.68 120.51 111.03 1noi n ALA 417 Ca 0.03 -0.89 -0.28 0.00 0.00 0.00 0.00 53.44 52.30 1noi n ALA 417 Cb 0.33 -0.64 -0.11 0.00 0.00 0.00 0.00 19.45 19.04 1noi n ALA 417 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 1noi s PHE 418 N -2.56 1.82 0.12 0.00 0.08 0.67 -5.08 117.98 113.02 1noi s PHE 418 Ca -0.10 -2.51 -0.31 0.00 0.12 0.00 0.00 56.93 54.13 1noi s PHE 418 Cb 0.07 -1.54 -0.08 0.00 -0.57 0.00 0.00 43.02 40.91 1noi s PHE 418 CO 0.81 -0.75 1.34 -2.14 -0.10 0.00 0.00 175.22 174.37 1noi s PRO 419 N -0.12 4.36 0.00 0.24 0.02 -0.85 -2.27 135.00 136.37 1noi s PRO 419 Ca 0.26 2.01 0.00 0.00 0.02 0.00 0.00 61.00 63.30 1noi s PRO 419 Cb -0.07 -3.25 0.00 0.00 0.02 0.00 0.00 34.50 31.20 1noi s PRO 419 CO -0.13 -0.36 0.00 0.41 -0.33 0.00 0.00 177.00 176.59 1noi n GLY 420 N 3.20 1.10 3.54 0.52 0.00 -1.26 -4.92 105.19 107.37 1noi n GLY 420 Ca 0.10 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.70 1noi n GLY 420 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1noi s ASP 421 N -2.89 6.57 -0.02 1.61 2.15 -0.96 -4.79 116.67 118.34 1noi s ASP 421 Ca 0.00 -1.68 -0.25 0.00 0.43 0.00 0.00 52.55 51.05 1noi s ASP 421 Cb 0.00 -2.54 -0.18 0.00 -0.30 0.00 0.00 42.92 39.90 1noi s ASP 421 CO 0.00 -1.39 1.19 0.58 -0.17 0.00 0.00 175.17 175.39 1noi h VAL 422 N 6.47 1.07 0.00 1.11 2.07 -1.91 -3.14 116.25 121.92 1noi h VAL 422 Ca 0.22 -0.95 0.00 0.00 0.82 0.00 0.00 66.70 66.79 1noi h VAL 422 Cb 0.99 1.66 0.00 0.00 -1.52 0.00 0.00 31.29 32.42 1noi h VAL 422 CO 1.38 0.22 0.01 -0.78 0.02 0.00 0.00 177.57 178.41 1noi h ASP 423 N -0.62 0.00 1.08 0.57 3.58 -2.00 0.24 116.42 119.26 1noi h ASP 423 Ca -0.02 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.43 1noi h ASP 423 Cb 0.49 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.54 1noi h ASP 423 CO 0.03 0.00 -0.83 0.08 -2.88 0.00 0.00 179.24 175.63 1noi h ARG 424 N 0.00 0.00 -0.46 0.28 0.11 -1.95 -1.54 114.38 110.83 1noi h ARG 424 Ca 0.00 0.00 -0.09 0.00 0.10 0.00 0.00 59.98 59.99 1noi h ARG 424 Cb 0.01 0.00 -0.02 0.00 1.11 0.00 0.00 29.97 31.08 1noi h ARG 424 CO 0.00 0.00 -0.06 -0.07 0.10 0.00 0.00 179.97 179.94 1noi h LEU 425 N 0.00 0.85 -0.41 0.08 3.38 -0.92 0.13 115.31 118.42 1noi h LEU 425 Ca 0.00 -0.34 -0.14 0.00 0.09 0.00 0.00 57.88 57.49 1noi h LEU 425 Cb 0.95 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 41.46 1noi h LEU 425 CO 0.00 0.99 -0.65 0.08 0.09 0.00 0.00 178.44 178.94 1noi h ARG 426 N 0.69 0.00 -0.13 1.13 -0.00 -1.45 -2.51 114.38 112.11 1noi h ARG 426 Ca 0.12 0.00 -0.15 0.00 -0.00 0.00 0.00 59.98 59.96 1noi h ARG 426 Cb 0.59 0.00 -0.01 0.00 -0.00 0.00 0.00 29.97 30.55 1noi h ARG 426 CO 0.04 0.65 -0.55 0.00 -0.00 0.00 0.00 179.97 180.11 1noi h ARG 427 N 0.00 0.39 0.00 0.08 3.08 -0.91 -3.29 114.38 113.73 1noi h ARG 427 Ca -0.01 -0.24 0.00 0.00 0.07 0.00 0.00 59.98 59.80 1noi h ARG 427 Cb 1.32 0.03 0.00 0.00 0.08 0.00 0.00 29.97 31.39 1noi h ARG 427 CO 0.08 0.84 -0.68 -1.33 -1.07 0.00 0.00 179.97 177.81 1noi n MET 428 N -3.94 0.25 -1.65 0.04 2.81 0.41 -4.95 117.12 110.10 1noi n MET 428 Ca -0.03 0.06 -0.39 0.00 -1.81 0.00 0.00 57.70 55.53 1noi n MET 428 Cb 0.59 -1.64 0.04 0.00 -0.71 0.00 0.00 33.22 31.50 1noi n MET 428 CO 0.00 0.00 0.00 0.45 1.51 0.00 0.00 175.97 177.93 1noi n SER 429 N -2.00 1.45 0.15 7.83 2.88 -0.95 -4.91 113.62 118.07 1noi n SER 429 Ca 0.03 0.92 0.12 0.00 -1.33 0.00 0.00 58.87 58.62 1noi n SER 429 Cb 0.42 -1.43 0.28 0.00 -0.75 0.00 0.00 64.21 62.73 1noi n SER 429 CO 0.00 0.00 0.00 -0.07 -1.23 0.00 0.00 175.04 173.74 1noi h LEU 430 N 1.07 0.00 -8.87 2.46 3.38 -1.91 -3.43 115.31 108.00 1noi h LEU 430 Ca -0.48 -0.01 -0.64 0.00 0.09 0.00 0.00 57.88 56.83 1noi h LEU 430 Cb 1.34 0.00 -0.17 0.00 0.09 0.00 0.00 40.66 41.92 1noi h LEU 430 CO 0.54 0.01 -0.42 -0.69 0.09 0.00 0.00 178.44 177.97 1noi s VAL 431 N -3.16 5.26 0.15 1.22 1.01 -1.26 -0.50 120.40 123.13 1noi s VAL 431 Ca 0.08 0.22 0.03 0.00 0.00 0.00 0.00 61.98 62.30 1noi s VAL 431 Cb 0.09 -3.63 -0.03 0.00 0.00 0.00 0.00 36.38 32.81 1noi s VAL 431 CO 0.64 0.16 0.29 -1.61 0.00 0.00 0.00 175.10 174.58 1noi s GLU 432 N 1.86 3.44 0.18 2.72 2.02 0.60 -4.94 118.70 124.59 1noi s GLU 432 Ca 0.09 -0.60 0.07 0.00 0.02 0.00 0.00 54.97 54.56 1noi s GLU 432 Cb -0.16 -2.96 -0.04 0.00 0.10 0.00 0.00 34.13 31.07 1noi s GLU 432 CO 0.11 0.51 -0.15 -1.21 0.02 0.00 0.00 175.26 174.54 1noi s GLU 433 N -3.27 1.26 0.00 1.61 0.41 -1.26 -1.67 118.70 115.78 1noi s GLU 433 Ca 0.35 -1.50 0.00 0.00 -0.41 0.00 0.00 54.97 53.41 1noi s GLU 433 Cb -0.11 -1.10 0.00 0.00 -1.78 0.00 0.00 34.13 31.14 1noi s GLU 433 CO 0.29 0.19 0.00 0.41 -0.49 0.00 0.00 175.26 175.66 1noi n GLY 434 N -0.12 -0.26 3.56 -1.39 0.00 -1.26 -4.93 105.19 100.79 1noi n GLY 434 Ca -0.10 -0.91 -0.43 0.00 0.00 0.00 0.00 46.02 44.58 1noi n GLY 434 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1noi s ALA 435 N -1.00 3.26 0.03 4.61 0.00 -1.26 -4.57 121.76 122.83 1noi s ALA 435 Ca 0.00 -0.81 0.00 0.00 0.00 0.00 0.00 51.96 51.15 1noi s ALA 435 Cb 0.00 -3.59 0.00 0.00 0.00 0.00 0.00 23.12 19.53 1noi s ALA 435 CO 0.00 -1.99 0.00 1.55 0.00 0.00 0.00 175.76 175.32 1noi n VAL 436 N 6.32 -2.37 -2.83 0.00 3.14 -1.26 -5.01 118.33 116.32 1noi n VAL 436 Ca 0.05 0.32 -0.41 0.00 -2.96 0.00 0.00 64.34 61.35 1noi n VAL 436 Cb 0.48 -1.82 -0.04 0.00 -1.06 0.00 0.00 33.84 31.41 1noi n VAL 436 CO 0.00 0.00 0.00 -0.75 -6.46 0.00 0.00 176.83 169.62 1noi s LYS 437 N -3.28 4.55 0.05 1.45 2.20 -1.26 -4.60 119.74 118.85 1noi s LYS 437 Ca 0.00 1.25 0.06 0.00 -0.36 0.00 0.00 55.97 56.92 1noi s LYS 437 Cb 0.00 -3.43 -0.03 0.00 -1.51 0.00 0.00 37.83 32.87 1noi s LYS 437 CO 0.00 0.07 -0.17 1.03 -0.36 0.00 0.00 175.35 175.93 1noi s ARG 438 N 0.62 1.05 -0.06 4.03 0.52 -0.67 -1.12 118.95 123.32 1noi s ARG 438 Ca 0.46 -0.89 -0.16 0.00 -0.52 0.00 0.00 55.73 54.61 1noi s ARG 438 Cb -0.21 -1.13 -0.05 0.00 0.52 0.00 0.00 34.95 34.09 1noi s ARG 438 CO 0.25 0.27 0.44 0.42 0.02 0.00 0.00 175.30 176.70 1noi s ILE 439 N -0.95 5.10 -0.45 1.52 -1.09 0.40 -0.29 121.20 125.44 1noi s ILE 439 Ca 0.03 0.88 -0.18 0.00 -2.23 0.00 0.00 60.65 59.16 1noi s ILE 439 Cb -0.09 -3.76 0.04 0.00 -1.58 0.00 0.00 42.46 37.07 1noi s ILE 439 CO 0.02 0.45 0.51 0.21 -1.23 0.00 0.00 174.94 174.90 1noi s ASN 440 N -0.20 6.21 0.51 3.58 3.84 0.35 -2.49 114.94 126.74 1noi s ASN 440 Ca 0.24 -0.75 0.28 0.00 0.21 0.00 0.00 52.86 52.85 1noi s ASN 440 Cb -0.16 -2.25 1.29 0.00 -0.55 0.00 0.00 41.25 39.58 1noi s ASN 440 CO 0.11 -0.69 1.98 0.24 -2.79 0.00 0.00 177.10 175.95 1noi h MET 441 N 8.81 0.00 -0.30 0.43 2.86 -1.49 -2.61 114.93 122.63 1noi h MET 441 Ca -0.27 0.00 -0.12 0.00 -2.06 0.00 0.00 59.70 57.25 1noi h MET 441 Cb 1.10 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.75 1noi h MET 441 CO 0.86 0.13 -0.32 0.00 1.06 0.00 0.00 176.91 178.63 1noi h ALA 442 N 1.87 0.87 -0.25 6.32 0.00 -1.92 -1.55 119.26 124.60 1noi h ALA 442 Ca -0.00 -0.41 -0.17 0.00 0.00 0.00 0.00 54.91 54.33 1noi h ALA 442 Cb 0.51 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.17 1noi h ALA 442 CO 0.02 0.63 -0.53 0.45 0.00 0.00 0.00 179.25 179.82 1noi h HIS 443 N 0.55 0.91 0.00 0.00 3.86 -1.89 -1.06 115.15 117.53 1noi h HIS 443 Ca 0.06 -0.32 -0.00 0.00 -1.16 0.00 0.00 60.37 58.96 1noi h HIS 443 Cb 0.82 -0.17 0.00 0.00 1.06 0.00 0.00 27.41 29.12 1noi h HIS 443 CO 0.04 1.10 -0.00 1.25 0.86 0.00 0.00 177.93 181.18 1noi h LEU 444 N 0.57 -0.00 -0.80 2.43 6.46 -1.31 -0.53 115.31 122.12 1noi h LEU 444 Ca 0.02 -0.08 -0.03 0.00 -0.12 0.00 0.00 57.88 57.66 1noi h LEU 444 Cb 1.10 0.00 -0.04 0.00 -0.73 0.00 0.00 40.66 41.00 1noi h LEU 444 CO 0.11 0.08 0.37 0.00 -0.62 0.00 0.00 178.44 178.38 1noi h ILE 446 N 1.15 1.28 -0.90 0.00 2.04 -1.08 -2.22 117.51 117.77 1noi h ILE 446 Ca 0.27 -1.05 0.06 0.00 1.00 0.00 0.00 64.86 65.14 1noi h ILE 446 Cb 0.15 1.48 -0.06 0.00 -0.74 0.00 0.00 36.82 37.65 1noi h ILE 446 CO -0.03 0.33 0.59 0.00 0.00 0.00 0.00 178.15 179.04 1noi h ALA 447 N 0.76 1.50 -0.36 1.87 0.00 -0.87 -3.27 119.26 118.89 1noi h ALA 447 Ca 0.06 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1noi h ALA 447 Cb 0.52 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 18.03 1noi h ALA 447 CO 0.02 0.37 0.00 0.41 0.00 0.00 0.00 179.25 180.05 1noi n GLY 448 N -1.40 1.75 3.72 0.00 0.00 -0.33 -4.97 105.19 103.97 1noi n GLY 448 Ca 0.13 -0.60 -0.31 0.00 0.00 0.00 0.00 46.02 45.24 1noi n GLY 448 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1noi s SER 449 N -1.24 5.27 0.00 1.61 0.01 -0.84 -3.76 113.70 114.75 1noi s SER 449 Ca 0.33 -0.06 0.27 0.00 1.31 0.00 0.00 55.95 57.79 1noi s SER 449 Cb 0.19 -1.36 0.79 0.00 0.21 0.00 0.00 66.02 65.85 1noi s SER 449 CO 0.26 0.20 1.61 0.00 0.41 0.00 0.00 173.24 175.73 1noi n HIS 450 N 0.76 0.00 -3.74 2.43 -0.00 -0.67 -4.86 115.22 109.14 1noi n HIS 450 Ca -0.11 0.00 -0.13 0.00 -0.00 0.00 0.00 57.72 57.48 1noi n HIS 450 Cb 0.52 -0.32 -0.10 0.00 -0.00 0.00 0.00 29.99 30.09 1noi n HIS 450 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 1noi s ALA 451 N -2.95 -0.91 -0.09 1.59 0.00 -1.26 -4.60 121.76 113.54 1noi s ALA 451 Ca 0.13 0.82 0.01 0.00 0.00 0.00 0.00 51.96 52.93 1noi s ALA 451 Cb 0.18 -0.37 0.02 0.00 0.00 0.00 0.00 23.12 22.95 1noi s ALA 451 CO 0.63 -0.21 -0.11 0.08 0.00 0.00 0.00 175.76 176.14 1noi s VAL 452 N -0.35 1.17 0.14 0.00 1.01 0.11 -1.60 120.40 120.88 1noi s VAL 452 Ca -0.05 -0.45 0.08 0.00 0.00 0.00 0.00 61.98 61.56 1noi s VAL 452 Cb -0.03 -1.11 -0.04 0.00 0.00 0.00 0.00 36.38 35.20 1noi s VAL 452 CO 0.02 0.38 -0.17 0.54 0.00 0.00 0.00 175.10 175.87 1noi s ASN 453 N 1.10 2.42 0.42 3.32 4.22 -0.87 -1.07 114.94 124.47 1noi s ASN 453 Ca -0.06 -0.82 0.06 0.00 -2.14 0.00 0.00 52.86 49.90 1noi s ASN 453 Cb -0.14 -0.12 0.06 0.00 1.28 0.00 0.00 41.25 42.33 1noi s ASN 453 CO -0.02 -0.06 0.53 0.61 -2.04 0.00 0.00 177.10 176.12 1noi n GLY 454 N 0.47 2.12 0.00 0.45 0.00 -1.17 -1.07 105.19 106.00 1noi n GLY 454 Ca -0.15 -2.21 0.00 0.00 0.00 0.00 0.00 46.02 43.66 1noi n GLY 454 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1noi n VAL 455 N -1.83 0.87 -3.61 1.61 0.31 -1.26 -1.37 118.33 113.04 1noi n VAL 455 Ca 0.09 -0.92 -0.07 0.00 -0.01 0.00 0.00 64.34 63.43 1noi n VAL 455 Cb 0.44 0.57 -0.05 0.00 -0.91 0.00 0.00 33.84 33.89 1noi n VAL 455 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1noi s ALA 456 N -0.87 -2.02 0.23 3.52 0.00 -1.26 -1.83 121.76 119.54 1noi s ALA 456 Ca 0.00 1.72 -0.12 0.00 0.00 0.00 0.00 51.96 53.56 1noi s ALA 456 Cb 0.00 -1.15 0.30 0.00 0.00 0.00 0.00 23.12 22.27 1noi s ALA 456 CO 0.00 -0.26 1.60 -0.09 0.00 0.00 0.00 175.76 177.02 1noi h ARG 457 N 2.72 -0.00 -0.32 0.00 2.43 -1.90 0.13 114.38 117.44 1noi h ARG 457 Ca -0.18 0.00 -0.14 0.00 -0.81 0.00 0.00 59.98 58.85 1noi h ARG 457 Cb 1.17 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 30.72 1noi h ARG 457 CO 0.24 -0.00 -0.35 -0.84 -1.51 0.00 0.00 179.97 177.51 1noi h ILE 458 N -0.00 1.29 -0.71 1.20 3.07 -1.90 -1.13 117.51 119.34 1noi h ILE 458 Ca 0.36 -1.53 0.11 0.00 1.55 0.00 0.00 64.86 65.34 1noi h ILE 458 Cb 0.55 1.53 -0.08 0.00 -0.27 0.00 0.00 36.82 38.55 1noi h ILE 458 CO -0.77 0.50 0.32 -0.74 -1.05 0.00 0.00 178.15 176.41 1noi h HIS 459 N 0.57 0.56 0.00 0.16 2.76 -1.56 -1.15 115.15 116.49 1noi h HIS 459 Ca 0.05 0.03 -0.04 0.00 -2.20 0.00 0.00 60.37 58.20 1noi h HIS 459 Cb 0.94 -0.14 -0.01 0.00 1.55 0.00 0.00 27.41 29.75 1noi h HIS 459 CO 0.07 0.16 -0.21 0.77 -1.30 0.00 0.00 177.93 177.42 1noi h SER 460 N 0.52 0.00 -0.00 3.26 0.02 -0.47 -2.79 113.55 114.10 1noi h SER 460 Ca 0.36 0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 61.31 1noi h SER 460 Cb 0.45 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.99 1noi h SER 460 CO -0.31 0.21 -0.00 -0.33 -1.14 0.00 0.00 176.83 175.25 1noi h GLU 461 N 0.00 0.00 0.00 3.45 4.39 -0.04 -3.07 114.58 119.32 1noi h GLU 461 Ca -0.00 -0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.68 1noi h GLU 461 Cb 0.57 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.21 1noi h GLU 461 CO 0.03 0.67 -0.07 -0.84 -1.16 0.00 0.00 179.01 177.64 1noi h ILE 462 N -0.66 0.41 -0.54 3.13 3.07 -1.21 0.20 117.51 121.90 1noi h ILE 462 Ca -0.00 -0.36 -0.06 0.00 1.55 0.00 0.00 64.86 65.99 1noi h ILE 462 Cb 0.67 1.25 -0.02 0.00 -0.27 0.00 0.00 36.82 38.45 1noi h ILE 462 CO 0.00 0.07 0.11 -0.07 -1.05 0.00 0.00 178.15 177.21 1noi h LEU 463 N 0.00 0.85 -0.53 0.16 3.38 -1.50 0.56 115.31 118.23 1noi h LEU 463 Ca -0.00 -0.25 -0.09 0.00 0.09 0.00 0.00 57.88 57.63 1noi h LEU 463 Cb 0.24 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.76 1noi h LEU 463 CO 0.01 0.88 -0.42 0.11 0.09 0.00 0.00 178.44 179.11 1noi h LYS 464 N 0.78 0.00 0.08 1.13 1.57 -0.95 0.10 116.57 119.28 1noi h LYS 464 Ca 0.17 0.00 -0.34 0.00 -1.87 0.00 0.00 60.65 58.61 1noi h LYS 464 Cb 0.38 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.66 1noi h LYS 464 CO 0.01 0.42 -1.87 0.87 -0.57 0.00 0.00 179.45 178.31 1noi h LYS 465 N 0.00 0.17 0.00 3.15 1.57 -0.83 -3.34 116.57 117.29 1noi h LYS 465 Ca -0.00 -0.29 0.00 0.00 -1.87 0.00 0.00 60.65 58.49 1noi h LYS 465 Cb 1.11 0.11 0.00 0.00 0.08 0.00 0.00 32.23 33.53 1noi h LYS 465 CO 0.05 0.94 0.00 0.25 -0.57 0.00 0.00 179.45 180.13 1noi n THR 466 N -3.32 0.00 -0.39 -0.16 -2.24 0.19 -4.75 114.28 103.61 1noi n THR 466 Ca -0.25 0.00 0.34 0.00 -2.27 0.00 0.00 64.05 61.87 1noi n THR 466 Cb 1.05 0.00 0.61 0.00 -2.10 0.00 0.00 70.33 69.89 1noi n THR 466 CO 0.00 0.00 0.00 0.40 -0.57 0.00 0.00 175.07 174.90 1noi h ILE 467 N 0.00 0.06 0.00 2.28 2.04 -1.65 -1.38 117.51 118.86 1noi h ILE 467 Ca 0.00 -0.02 0.00 0.00 1.00 0.00 0.00 64.86 65.84 1noi h ILE 467 Cb 0.00 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 36.08 1noi h ILE 467 CO 0.00 0.01 -0.09 0.49 0.00 0.00 0.00 178.15 178.56 1noi n PHE 468 N -4.97 0.00 0.32 1.37 3.72 0.35 -4.82 117.46 113.43 1noi n PHE 468 Ca 0.38 -0.60 0.20 0.00 -0.05 0.00 0.00 57.45 57.38 1noi n PHE 468 Cb 1.36 -0.09 1.11 0.00 -0.94 0.00 0.00 39.48 40.92 1noi n PHE 468 CO 0.00 0.00 0.00 1.57 -0.05 0.00 0.00 176.76 178.28 1noi h LYS 469 N 0.00 0.00 -0.41 -1.08 2.10 -1.25 0.42 116.57 116.34 1noi h LYS 469 Ca 0.00 0.00 -0.09 0.00 -2.00 0.00 0.00 60.65 58.56 1noi h LYS 469 Cb 0.95 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 32.26 1noi h LYS 469 CO 0.00 0.00 -0.09 -0.44 -2.00 0.00 0.00 179.45 176.92 1noi h ASP 470 N 0.00 0.79 -0.32 7.07 3.32 -1.88 -0.30 116.42 125.10 1noi h ASP 470 Ca 0.00 -0.36 -0.08 0.00 0.02 0.00 0.00 57.03 56.62 1noi h ASP 470 Cb 0.05 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 39.38 1noi h ASP 470 CO -0.00 0.96 -0.10 -0.26 -1.72 0.00 0.00 179.24 178.12 1noi h PHE 471 N 0.60 0.73 -0.67 4.55 0.04 -0.69 -2.08 116.94 119.41 1noi h PHE 471 Ca 0.10 -0.16 0.07 0.00 2.80 0.00 0.00 57.97 60.78 1noi h PHE 471 Cb 0.61 -0.17 -0.06 0.00 2.20 0.00 0.00 35.95 38.53 1noi h PHE 471 CO 0.05 0.83 0.36 -0.92 -0.60 0.00 0.00 178.31 178.03 1noi h TYR 472 N 0.41 0.67 -0.72 -0.55 3.20 -0.60 -0.05 116.97 119.33 1noi h TYR 472 Ca 0.08 0.03 -0.03 0.00 3.14 0.00 0.00 58.73 61.94 1noi h TYR 472 Cb 0.61 -0.20 -0.03 0.00 1.54 0.00 0.00 36.73 38.65 1noi h TYR 472 CO 0.05 0.30 0.32 0.93 -1.64 0.00 0.00 178.16 178.13 1noi h GLU 473 N 0.66 1.03 0.00 1.82 5.08 -0.41 0.12 114.58 122.89 1noi h GLU 473 Ca 0.31 -0.15 -0.13 0.00 -1.00 0.00 0.00 59.36 58.39 1noi h GLU 473 Cb 0.22 -0.19 -0.02 0.00 0.50 0.00 0.00 28.75 29.27 1noi h GLU 473 CO -0.20 0.81 -0.69 1.25 -1.00 0.00 0.00 179.01 179.18 1noi h LEU 474 N 1.02 0.00 -5.34 1.33 6.46 -0.74 -3.41 115.31 114.63 1noi h LEU 474 Ca 0.25 0.00 -0.33 0.00 -0.12 0.00 0.00 57.88 57.68 1noi h LEU 474 Cb 0.14 0.00 -0.23 0.00 -0.73 0.00 0.00 40.66 39.83 1noi h LEU 474 CO -0.03 0.57 -0.70 -0.62 -0.62 0.00 0.00 178.44 177.04 1noi n GLU 475 N -3.19 0.88 -0.29 1.25 1.02 -0.11 -4.98 120.64 115.23 1noi n GLU 475 Ca 0.00 -2.34 0.06 0.00 -0.02 0.00 0.00 57.16 54.86 1noi n GLU 475 Cb 0.77 -1.32 0.27 0.00 -0.02 0.00 0.00 31.44 31.15 1noi n GLU 475 CO 0.00 0.00 0.00 -1.35 1.18 0.00 0.00 177.13 176.96 1noi h PRO 476 N 3.48 0.92 -0.62 3.49 0.11 -0.96 -1.27 132.00 137.15 1noi h PRO 476 Ca -0.05 -0.06 0.18 0.00 0.11 0.00 0.00 66.00 66.18 1noi h PRO 476 Cb 1.02 -0.21 -0.02 0.00 0.11 0.00 0.00 31.00 31.90 1noi h PRO 476 CO 0.31 0.61 0.54 1.12 -0.21 0.00 0.00 178.00 180.37 1noi h HIS 477 N 0.94 0.00 0.00 0.65 2.07 -1.94 -2.02 115.15 114.85 1noi h HIS 477 Ca 0.40 0.00 -0.00 0.00 -2.85 0.00 0.00 60.37 57.92 1noi h HIS 477 Cb 0.30 0.00 -0.00 0.00 2.57 0.00 0.00 27.41 30.28 1noi h HIS 477 CO -0.00 0.00 -0.00 0.87 -3.07 0.00 0.00 177.93 175.72 1noi h LYS 478 N 0.00 0.00 -5.69 5.12 1.57 -1.48 -3.46 116.57 112.64 1noi h LYS 478 Ca 0.29 0.00 -0.60 0.00 -1.87 0.00 0.00 60.65 58.47 1noi h LYS 478 Cb 1.37 0.00 -0.08 0.00 0.08 0.00 0.00 32.23 33.60 1noi h LYS 478 CO -0.00 0.00 -0.28 -0.06 -0.57 0.00 0.00 179.45 178.54 1noi s PHE 479 N -3.43 3.56 0.09 -1.35 0.40 -0.76 0.04 117.98 116.52 1noi s PHE 479 Ca 0.04 0.74 0.01 0.00 -0.60 0.00 0.00 56.93 57.13 1noi s PHE 479 Cb 0.07 -2.31 -0.01 0.00 0.51 0.00 0.00 43.02 41.28 1noi s PHE 479 CO 0.61 0.40 0.05 1.04 0.70 0.00 0.00 175.22 178.02 1noi n GLN 480 N 2.92 0.51 -4.13 0.44 6.02 -0.23 -4.95 117.38 117.96 1noi n GLN 480 Ca -0.13 -0.81 -0.15 0.00 -0.01 0.00 0.00 57.00 55.91 1noi n GLN 480 Cb 0.52 0.54 -0.12 0.00 1.02 0.00 0.00 30.24 32.20 1noi n GLN 480 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 177.06 177.26 1noi s ASN 481 N -1.58 0.97 -0.30 1.08 3.04 -1.26 -3.03 114.94 113.87 1noi s ASN 481 Ca 0.07 -0.44 -0.01 0.00 0.04 0.00 0.00 52.86 52.52 1noi s ASN 481 Cb 0.00 -0.01 0.13 0.00 -1.54 0.00 0.00 41.25 39.83 1noi s ASN 481 CO 0.05 -0.10 0.25 -0.54 -3.04 0.00 0.00 177.10 173.71 1noi s LYS 482 N -1.21 0.32 0.22 0.43 -0.14 -0.47 -4.87 119.74 114.02 1noi s LYS 482 Ca -0.05 -0.39 -0.30 0.00 -1.36 0.00 0.00 55.97 53.87 1noi s LYS 482 Cb -0.08 -0.85 -0.10 0.00 -1.68 0.00 0.00 37.83 35.12 1noi s LYS 482 CO 0.01 -1.05 1.45 0.99 -0.76 0.00 0.00 175.35 175.99 1noi s THR 483 N 2.13 2.74 1.10 2.17 2.01 -1.26 -4.07 115.64 120.46 1noi s THR 483 Ca 0.10 0.59 -0.14 0.00 0.31 0.00 0.00 61.69 62.56 1noi s THR 483 Cb -0.15 -3.38 0.19 0.00 0.01 0.00 0.00 72.50 69.18 1noi s THR 483 CO -0.30 0.08 0.70 0.59 -0.69 0.00 0.00 174.62 175.00 1noi n ASN 484 N 2.79 -1.65 -3.56 3.53 3.02 -0.76 -4.60 115.26 114.02 1noi n ASN 484 Ca 0.08 -0.02 -0.10 0.00 -0.03 0.00 0.00 54.58 54.52 1noi n ASN 484 Cb 0.40 -1.21 -0.03 0.00 -0.61 0.00 0.00 39.78 38.34 1noi n ASN 484 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 1noi s GLY 485 N -2.24 0.65 -0.02 7.41 0.00 -1.26 -4.82 107.32 107.04 1noi s GLY 485 Ca 0.64 -0.93 0.02 0.00 0.00 0.00 0.00 44.72 44.45 1noi s GLY 485 CO 0.65 -0.58 -0.08 -1.50 0.00 0.00 0.00 173.10 171.59 1noi s ILE 486 N -3.40 0.69 -0.12 0.90 1.10 0.98 -4.45 121.20 116.91 1noi s ILE 486 Ca 0.21 -0.33 -0.29 0.00 -0.51 0.00 0.00 60.65 59.74 1noi s ILE 486 Cb -0.02 -0.61 -0.01 0.00 0.15 0.00 0.00 42.46 41.96 1noi s ILE 486 CO 0.12 0.22 0.99 0.28 -2.11 0.00 0.00 174.94 174.44 1noi s THR 487 N 0.11 4.78 -1.10 4.00 -1.32 -1.26 -0.95 115.64 119.90 1noi s THR 487 Ca -0.01 2.00 0.09 0.00 -1.21 0.00 0.00 61.69 62.56 1noi s THR 487 Cb -0.07 -4.30 0.10 0.00 -1.51 0.00 0.00 72.50 66.72 1noi s THR 487 CO 0.00 -0.01 1.28 -0.81 -2.21 0.00 0.00 174.62 172.87 1noi n PRO 488 N 5.15 0.03 0.06 7.08 -0.04 -1.26 -1.99 135.00 144.02 1noi n PRO 488 Ca 0.09 0.31 -0.03 0.00 -0.04 0.00 0.00 63.50 63.82 1noi n PRO 488 Cb 0.48 -1.50 -0.01 0.00 -0.04 0.00 0.00 33.50 32.43 1noi n PRO 488 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1noi h ARG 489 N 0.00 -0.17 -0.43 0.54 -0.00 -1.93 -1.99 114.38 110.40 1noi h ARG 489 Ca 0.00 0.01 -0.12 0.00 -0.50 0.00 0.00 59.98 59.37 1noi h ARG 489 Cb 0.15 0.04 -0.01 0.00 0.00 0.00 0.00 29.97 30.14 1noi h ARG 489 CO 0.00 -0.12 -0.22 -0.09 0.00 0.00 0.00 179.97 179.55 1noi h ARG 490 N -0.45 0.87 -0.38 0.04 2.43 -1.97 -1.11 114.38 113.81 1noi h ARG 490 Ca -0.02 -0.36 0.00 0.00 -0.81 0.00 0.00 59.98 58.79 1noi h ARG 490 Cb 0.14 -0.04 0.00 0.00 -0.42 0.00 0.00 29.97 29.65 1noi h ARG 490 CO 0.03 1.00 0.00 0.91 -1.51 0.00 0.00 179.97 180.40 1noi n TRP 491 N -4.11 0.47 0.10 2.20 7.02 -0.84 -2.54 117.44 119.74 1noi n TRP 491 Ca 0.00 -0.22 0.00 0.00 -1.02 0.00 0.00 57.50 56.26 1noi n TRP 491 Cb 0.44 -0.04 0.00 0.00 -2.42 0.00 0.00 31.31 29.30 1noi n TRP 491 CO 0.00 0.00 0.00 -0.11 -2.02 0.00 0.00 177.69 175.56 1noi n LEU 492 N 0.38 -1.03 -0.28 -0.99 0.00 -1.12 -4.80 117.00 109.16 1noi n LEU 492 Ca 0.10 0.36 0.06 0.00 0.00 0.00 0.00 56.01 56.54 1noi n LEU 492 Cb 0.31 1.13 0.29 0.00 0.00 0.00 0.00 43.42 45.15 1noi n LEU 492 CO 0.08 -0.41 1.24 0.58 0.00 0.00 0.00 177.39 178.88 1noi h VAL 493 N 0.00 1.00 0.00 1.96 2.07 -0.70 0.23 116.25 120.80 1noi h VAL 493 Ca 0.00 -0.31 -0.20 0.00 0.82 0.00 0.00 66.70 67.01 1noi h VAL 493 Cb 0.00 0.01 -0.03 0.00 -1.52 0.00 0.00 31.29 29.75 1noi h VAL 493 CO 0.00 0.17 -1.25 -0.11 0.02 0.00 0.00 177.57 176.39 1noi n LEU 494 N -4.52 1.87 0.23 2.57 0.00 -0.48 -3.86 117.00 112.80 1noi n LEU 494 Ca 0.14 0.46 0.10 0.00 0.00 0.00 0.00 56.01 56.71 1noi n LEU 494 Cb 0.28 -0.91 0.51 0.00 0.00 0.00 0.00 43.42 43.30 1noi n LEU 494 CO 0.32 0.11 0.83 0.00 0.00 0.00 0.00 177.39 178.65 1noi n ASN 496 N -3.48 1.98 -0.17 0.00 2.85 0.80 -4.89 115.26 112.35 1noi n ASN 496 Ca -0.00 -3.17 -0.04 0.00 -0.11 0.00 0.00 54.58 51.25 1noi n ASN 496 Cb 0.39 -0.62 0.02 0.00 1.24 0.00 0.00 39.78 40.81 1noi n ASN 496 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 1noi h PRO 497 N 3.36 -0.13 -0.62 1.20 0.13 -1.67 -2.20 132.00 132.07 1noi h PRO 497 Ca 0.11 0.01 0.11 0.00 -0.87 0.00 0.00 66.00 65.36 1noi h PRO 497 Cb 0.79 0.03 -0.12 0.00 0.13 0.00 0.00 31.00 31.84 1noi h PRO 497 CO 0.61 -0.09 -0.31 0.78 -0.23 0.00 0.00 178.00 178.77 1noi h GLY 498 N -0.13 -0.01 1.36 1.56 0.00 -1.92 0.10 103.07 104.03 1noi h GLY 498 Ca 0.23 0.41 -0.08 0.00 0.00 0.00 0.00 47.33 47.88 1noi h GLY 498 CO -0.59 -0.22 -0.07 -2.00 0.00 0.00 0.00 176.54 173.66 1noi h LEU 499 N -0.13 0.75 -1.39 3.11 5.85 -1.86 -0.17 115.31 121.47 1noi h LEU 499 Ca 0.25 -0.21 -0.06 0.00 0.84 0.00 0.00 57.88 58.70 1noi h LEU 499 Cb 0.55 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 41.37 1noi h LEU 499 CO -0.70 0.86 -0.30 0.00 -0.34 0.00 0.00 178.44 177.96 1noi h ALA 500 N 1.22 1.42 0.01 1.25 0.00 -0.28 -1.98 119.26 120.90 1noi h ALA 500 Ca 0.13 -0.28 -0.12 0.00 0.00 0.00 0.00 54.91 54.64 1noi h ALA 500 Cb 0.53 -0.05 0.01 0.00 0.00 0.00 0.00 17.79 18.28 1noi h ALA 500 CO 0.03 0.38 -0.46 1.49 0.00 0.00 0.00 179.25 180.69 1noi h GLU 501 N 0.00 0.29 0.00 0.00 4.81 0.82 -1.18 114.58 119.33 1noi h GLU 501 Ca -0.00 -0.33 -0.03 0.00 -0.13 0.00 0.00 59.36 58.87 1noi h GLU 501 Cb 0.56 0.10 -0.00 0.00 0.63 0.00 0.00 28.75 30.04 1noi h GLU 501 CO 0.04 1.04 -0.14 -0.84 -0.73 0.00 0.00 179.01 178.39 1noi h ILE 502 N -0.32 0.28 -0.18 2.32 3.07 -1.15 -2.45 117.51 119.08 1noi h ILE 502 Ca -0.06 -1.07 -0.14 0.00 1.55 0.00 0.00 64.86 65.14 1noi h ILE 502 Cb 1.21 1.85 0.00 0.00 -0.27 0.00 0.00 36.82 39.62 1noi h ILE 502 CO 0.09 0.13 -0.43 0.40 -1.05 0.00 0.00 178.15 177.29 1noi h ILE 503 N 0.00 1.33 -0.84 0.16 2.04 -1.32 -3.17 117.51 115.71 1noi h ILE 503 Ca -0.00 -1.68 0.09 0.00 1.00 0.00 0.00 64.86 64.28 1noi h ILE 503 Cb 0.84 1.91 -0.07 0.00 -0.74 0.00 0.00 36.82 38.76 1noi h ILE 503 CO 0.02 0.52 0.49 0.00 0.00 0.00 0.00 178.15 179.18 1noi h ALA 504 N 0.58 1.21 -0.85 1.87 0.00 -0.93 -1.23 119.26 119.91 1noi h ALA 504 Ca -0.00 0.03 0.09 0.00 0.00 0.00 0.00 54.91 55.03 1noi h ALA 504 Cb 1.04 -0.15 -0.07 0.00 0.00 0.00 0.00 17.79 18.61 1noi h ALA 504 CO 0.10 0.13 0.50 0.93 0.00 0.00 0.00 179.25 180.90 1noi h GLU 505 N 0.83 0.82 0.00 0.00 5.08 -1.42 0.40 114.58 120.29 1noi h GLU 505 Ca 0.40 -0.05 -0.06 0.00 -1.00 0.00 0.00 59.36 58.65 1noi h GLU 505 Cb 0.36 -0.19 -0.01 0.00 0.50 0.00 0.00 28.75 29.41 1noi h GLU 505 CO -0.24 0.55 -0.37 0.00 -1.00 0.00 0.00 179.01 177.94 1noi h ARG 506 N 0.85 0.00 -0.10 2.33 2.47 -1.51 -3.42 114.38 115.00 1noi h ARG 506 Ca 0.40 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 59.12 1noi h ARG 506 Cb 0.34 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.66 1noi h ARG 506 CO -0.23 0.79 0.00 0.44 0.56 0.00 0.00 179.97 181.53 1noi n ILE 507 N -4.59 0.57 -1.49 2.04 -5.35 -0.50 -5.12 119.36 104.92 1noi n ILE 507 Ca -0.14 -0.78 0.00 0.00 -0.27 0.00 0.00 62.75 61.55 1noi n ILE 507 Cb 0.45 0.76 0.00 0.00 -1.74 0.00 0.00 39.64 39.11 1noi n ILE 507 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1noi n GLY 508 N 0.11 -2.39 0.04 3.28 0.00 0.14 -4.63 105.19 101.75 1noi n GLY 508 Ca 0.04 -1.71 0.11 0.00 0.00 0.00 0.00 46.02 44.45 1noi n GLY 508 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1noi n GLU 509 N -0.23 0.11 0.03 1.61 1.02 -1.26 -3.99 120.64 117.93 1noi n GLU 509 Ca 0.00 -0.09 0.03 0.00 -0.02 0.00 0.00 57.16 57.08 1noi n GLU 509 Cb 0.00 -1.50 0.14 0.00 -0.02 0.00 0.00 31.44 30.07 1noi n GLU 509 CO 0.00 0.00 0.00 -1.91 1.18 0.00 0.00 177.13 176.40 1noi n GLU 510 N -1.36 0.02 0.15 3.49 2.13 -1.26 -2.00 120.64 121.81 1noi n GLU 510 Ca 0.05 0.48 0.01 0.00 0.66 0.00 0.00 57.16 58.35 1noi n GLU 510 Cb 0.34 -1.57 0.31 0.00 0.27 0.00 0.00 31.44 30.78 1noi n GLU 510 CO 0.00 0.00 0.00 0.10 -0.41 0.00 0.00 177.13 176.82 1noi h TYR 511 N 0.00 0.11 -0.97 4.31 -0.00 -1.77 -3.29 116.97 115.37 1noi h TYR 511 Ca 0.00 -0.03 0.14 0.00 -0.00 0.00 0.00 58.73 58.85 1noi h TYR 511 Cb 0.05 -0.03 -0.08 0.00 -0.00 0.00 0.00 36.73 36.67 1noi h TYR 511 CO 0.00 0.47 0.61 0.82 -0.00 0.00 0.00 178.16 180.06 1noi h ILE 512 N 0.08 0.84 -0.42 -0.90 2.04 -1.76 -0.80 117.51 116.61 1noi h ILE 512 Ca 0.01 -0.29 0.00 0.00 1.00 0.00 0.00 64.86 65.58 1noi h ILE 512 Cb 0.71 -0.06 0.00 0.00 -0.74 0.00 0.00 36.82 36.73 1noi h ILE 512 CO 0.05 0.15 0.00 -1.54 0.00 0.00 0.00 178.15 176.81 1noi n SER 513 N -4.62 4.13 -2.83 1.72 3.41 -1.24 -4.66 113.62 109.52 1noi n SER 513 Ca 0.19 -2.64 -0.07 0.00 -0.26 0.00 0.00 58.87 56.09 1noi n SER 513 Cb 0.45 -0.50 0.00 0.00 -0.26 0.00 0.00 64.21 63.90 1noi n SER 513 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 1noi n ASP 514 N 0.27 -3.03 0.14 4.04 2.03 -0.35 -5.05 116.55 114.59 1noi n ASP 514 Ca 0.21 -2.92 0.13 0.00 0.52 0.00 0.00 54.79 52.72 1noi n ASP 514 Cb 0.83 1.51 0.43 0.00 -0.72 0.00 0.00 41.12 43.16 1noi n ASP 514 CO 0.00 0.00 0.00 0.25 -1.92 0.00 0.00 177.20 175.53 1noi h LEU 515 N 4.88 0.00 -2.39 -2.67 5.85 -1.72 -3.03 115.31 116.23 1noi h LEU 515 Ca 0.05 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.77 1noi h LEU 515 Cb 1.07 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.10 1noi h LEU 515 CO 0.10 0.00 0.04 0.44 -0.34 0.00 0.00 178.44 178.69 1noi h ASP 516 N 0.00 0.00 0.00 1.25 3.32 -1.86 -0.19 116.42 118.94 1noi h ASP 516 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1noi h ASP 516 Cb 0.64 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.19 1noi h ASP 516 CO 0.00 0.00 0.06 1.56 -1.72 0.00 0.00 179.24 179.14 1noi h GLN 517 N 0.00 0.00 0.00 3.56 4.20 -1.86 0.88 115.11 121.89 1noi h GLN 517 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1noi h GLN 517 Cb 0.08 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.86 1noi h GLN 517 CO 0.00 0.00 0.00 -0.07 -0.67 0.00 0.00 178.83 178.09 1noi h LEU 518 N 0.00 0.00 -1.97 1.46 3.38 -1.25 -1.99 115.31 114.93 1noi h LEU 518 Ca 0.00 0.00 0.13 0.00 0.09 0.00 0.00 57.88 58.10 1noi h LEU 518 Cb 0.11 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.84 1noi h LEU 518 CO 0.00 0.00 0.46 0.03 0.09 0.00 0.00 178.44 179.02 1noi h ARG 519 N 0.00 0.00 0.00 1.13 3.08 0.09 -0.96 114.38 117.72 1noi h ARG 519 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1noi h ARG 519 Cb 0.14 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.19 1noi h ARG 519 CO 0.00 0.00 0.00 0.87 -1.07 0.00 0.00 179.97 179.77 1noi h LYS 520 N 0.00 0.00 0.00 0.04 1.57 -1.59 -0.86 116.57 115.73 1noi h LYS 520 Ca 0.21 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.99 1noi h LYS 520 Cb 1.13 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.44 1noi h LYS 520 CO -0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 179.45 178.81 1noi h LEU 521 N 0.00 0.00 -2.15 2.94 4.07 -1.39 -3.25 115.31 115.52 1noi h LEU 521 Ca 0.00 0.00 -0.01 0.00 0.08 0.00 0.00 57.88 57.95 1noi h LEU 521 Cb 0.01 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 41.75 1noi h LEU 521 CO 0.00 0.00 -0.05 0.25 -1.08 0.00 0.00 178.44 177.56 1noi h LEU 522 N 0.00 0.00 0.00 1.67 5.85 -1.33 -0.67 115.31 120.83 1noi h LEU 522 Ca 0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 1noi h LEU 522 Cb 0.88 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.91 1noi h LEU 522 CO 0.00 0.05 0.00 -1.20 -0.34 0.00 0.00 178.44 176.95 1noi n SER 523 N -4.01 0.00 -0.00 1.25 7.64 -1.23 -3.38 113.62 113.89 1noi n SER 523 Ca -0.03 -0.64 0.00 0.00 1.01 0.00 0.00 58.87 59.22 1noi n SER 523 Cb 0.14 0.00 0.01 0.00 -1.01 0.00 0.00 64.21 63.34 1noi n SER 523 CO 0.00 0.00 0.00 -1.22 -3.01 0.00 0.00 175.04 170.81 1noi n TYR 524 N -0.91 0.00 0.28 1.43 4.02 -0.26 -4.72 117.16 117.00 1noi n TYR 524 Ca 0.10 -0.50 0.15 0.00 -0.01 0.00 0.00 57.90 57.65 1noi n TYR 524 Cb 0.05 -0.05 0.79 0.00 -0.02 0.00 0.00 39.34 40.11 1noi n TYR 524 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 176.86 176.13 1noi h VAL 525 N 0.15 0.40 -0.47 -0.72 2.07 -1.67 -1.73 116.25 114.27 1noi h VAL 525 Ca 0.00 -0.45 0.00 0.00 0.82 0.00 0.00 66.70 67.07 1noi h VAL 525 Cb 0.54 1.32 0.00 0.00 -1.52 0.00 0.00 31.29 31.63 1noi h VAL 525 CO 0.00 0.08 0.00 0.47 0.02 0.00 0.00 177.57 178.14 1noi n ASP 526 N -3.48 3.33 -4.69 0.57 8.00 -1.26 -4.80 116.55 114.22 1noi n ASP 526 Ca -0.02 -1.96 -0.38 0.00 0.71 0.00 0.00 54.79 53.14 1noi n ASP 526 Cb 0.22 -0.31 -0.06 0.00 -0.02 0.00 0.00 41.12 40.95 1noi n ASP 526 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1noi s ASP 527 N -1.08 6.60 0.22 -2.24 -1.08 -0.65 -4.95 116.67 113.48 1noi s ASP 527 Ca 0.35 0.71 0.12 0.00 -0.52 0.00 0.00 52.55 53.21 1noi s ASP 527 Cb 0.19 -2.28 0.03 0.00 -1.46 0.00 0.00 42.92 39.40 1noi s ASP 527 CO 0.25 -0.09 1.42 -0.33 0.52 0.00 0.00 175.17 176.94 1noi h GLU 528 N 7.13 0.00 -0.13 4.34 4.39 -1.93 -1.99 114.58 126.39 1noi h GLU 528 Ca -0.37 0.00 -0.06 0.00 0.34 0.00 0.00 59.36 59.26 1noi h GLU 528 Cb 1.17 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.81 1noi h GLU 528 CO 0.74 0.70 -0.17 0.00 -1.16 0.00 0.00 179.01 179.12 1noi h ALA 529 N 1.30 0.19 -0.52 3.43 0.00 -1.94 -2.68 119.26 119.05 1noi h ALA 529 Ca -0.01 -0.34 -0.02 0.00 0.00 0.00 0.00 54.91 54.54 1noi h ALA 529 Cb 1.47 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 19.20 1noi h ALA 529 CO 0.09 0.10 0.24 0.35 0.00 0.00 0.00 179.25 180.03 1noi h PHE 530 N -0.06 0.75 -1.01 0.00 3.57 -1.83 0.42 116.94 118.79 1noi h PHE 530 Ca 0.02 -0.04 0.01 0.00 3.53 0.00 0.00 57.97 61.49 1noi h PHE 530 Cb 0.72 -0.23 -0.05 0.00 2.79 0.00 0.00 35.95 39.18 1noi h PHE 530 CO 0.09 0.60 0.67 0.82 -2.23 0.00 0.00 178.31 178.26 1noi h ILE 531 N 0.69 1.25 0.00 1.41 2.04 -1.42 -1.13 117.51 120.35 1noi h ILE 531 Ca 0.18 -0.47 -0.22 0.00 1.00 0.00 0.00 64.86 65.35 1noi h ILE 531 Cb 0.13 -0.23 -0.03 0.00 -0.74 0.00 0.00 36.82 35.95 1noi h ILE 531 CO -0.02 0.25 -1.22 0.08 0.00 0.00 0.00 178.15 177.23 1noi h ARG 532 N 1.36 0.00 0.36 2.37 0.11 -1.20 -3.06 114.38 114.31 1noi h ARG 532 Ca 0.37 0.00 -0.02 0.00 0.10 0.00 0.00 59.98 60.43 1noi h ARG 532 Cb -0.15 0.00 0.00 0.00 1.11 0.00 0.00 29.97 30.94 1noi h ARG 532 CO -0.08 0.69 -0.17 -0.44 0.10 0.00 0.00 179.97 180.06 1noi h ASP 533 N 0.00 -0.41 -0.74 0.08 3.32 -0.63 0.11 116.42 118.16 1noi h ASP 533 Ca -0.12 -0.06 0.17 0.00 0.02 0.00 0.00 57.03 57.03 1noi h ASP 533 Cb 1.78 0.10 -0.12 0.00 0.22 0.00 0.00 39.33 41.32 1noi h ASP 533 CO 0.10 -0.19 0.09 0.58 -1.72 0.00 0.00 179.24 178.10 1noi h VAL 534 N -0.61 0.43 -0.06 -1.35 2.07 -1.33 0.22 116.25 115.61 1noi h VAL 534 Ca -0.05 -0.06 -0.14 0.00 0.82 0.00 0.00 66.70 67.27 1noi h VAL 534 Cb 0.45 0.23 -0.01 0.00 -1.52 0.00 0.00 31.29 30.44 1noi h VAL 534 CO 0.08 0.03 -0.59 0.00 0.02 0.00 0.00 177.57 177.11 1noi h ALA 535 N 1.65 0.88 0.08 1.67 0.00 -1.45 -1.16 119.26 120.94 1noi h ALA 535 Ca 0.41 -0.54 -0.00 0.00 0.00 0.00 0.00 54.91 54.78 1noi h ALA 535 Cb 0.72 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.43 1noi h ALA 535 CO -0.58 0.72 -0.04 -0.22 0.00 0.00 0.00 179.25 179.13 1noi h LYS 536 N 0.16 -0.10 0.13 0.00 1.63 0.20 -0.67 116.57 117.92 1noi h LYS 536 Ca -0.00 0.01 0.02 0.00 -0.85 0.00 0.00 60.65 59.82 1noi h LYS 536 Cb 1.08 0.02 -0.04 0.00 -0.60 0.00 0.00 32.23 32.70 1noi h LYS 536 CO 0.09 0.03 -0.30 0.28 -3.45 0.00 0.00 179.45 176.11 1noi h VAL 537 N -0.21 0.36 -0.95 2.00 2.07 -0.80 0.14 116.25 118.85 1noi h VAL 537 Ca -0.01 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.58 1noi h VAL 537 Cb 0.18 0.36 -0.07 0.00 -1.52 0.00 0.00 31.29 30.24 1noi h VAL 537 CO 0.02 0.00 0.60 0.50 0.02 0.00 0.00 177.57 178.71 1noi h LYS 538 N -0.52 1.03 -0.35 1.57 1.63 -1.02 -0.03 116.57 118.87 1noi h LYS 538 Ca 0.03 -0.06 -0.08 0.00 -0.85 0.00 0.00 60.65 59.68 1noi h LYS 538 Cb 0.55 -0.23 -0.02 0.00 -0.60 0.00 0.00 32.23 31.93 1noi h LYS 538 CO -0.17 0.68 -0.13 0.37 -3.45 0.00 0.00 179.45 176.76 1noi h GLN 539 N 1.06 0.63 -0.34 1.90 4.15 -0.19 -1.50 115.11 120.82 1noi h GLN 539 Ca 0.43 -0.20 -0.06 0.00 0.77 0.00 0.00 58.65 59.58 1noi h GLN 539 Cb 0.23 -0.06 -0.01 0.00 0.21 0.00 0.00 27.48 27.86 1noi h GLN 539 CO -0.19 0.74 -0.04 0.93 -1.93 0.00 0.00 178.83 178.34 1noi h GLU 540 N 0.57 0.62 -0.66 1.69 5.08 1.00 -2.77 114.58 120.12 1noi h GLU 540 Ca 0.10 -0.22 -0.02 0.00 -1.00 0.00 0.00 59.36 58.22 1noi h GLU 540 Cb 0.56 -0.05 -0.03 0.00 0.50 0.00 0.00 28.75 29.73 1noi h GLU 540 CO 0.04 0.77 0.34 -0.91 -1.00 0.00 0.00 179.01 178.24 1noi h ASN 541 N 0.42 0.85 0.23 1.42 -0.26 -0.54 -1.84 115.58 115.86 1noi h ASN 541 Ca 0.09 -0.11 -0.04 0.00 -0.56 0.00 0.00 56.30 55.68 1noi h ASN 541 Cb 0.51 -0.22 -0.01 0.00 -1.06 0.00 0.00 38.32 37.55 1noi h ASN 541 CO 0.02 0.72 -0.18 0.11 -1.06 0.00 0.00 177.43 177.05 1noi h LYS 542 N 0.91 0.00 0.04 0.81 1.57 -1.25 0.97 116.57 119.62 1noi h LYS 542 Ca 0.23 0.00 -0.14 0.00 -1.87 0.00 0.00 60.65 58.87 1noi h LYS 542 Cb 0.08 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.40 1noi h LYS 542 CO -0.03 0.18 -0.57 1.25 -0.57 0.00 0.00 179.45 179.70 1noi h LEU 543 N 0.00 0.43 -0.20 2.94 7.12 -1.10 0.56 115.31 125.06 1noi h LEU 543 Ca -0.00 -0.83 -0.02 0.00 0.13 0.00 0.00 57.88 57.16 1noi h LEU 543 Cb 0.34 -0.13 -0.01 0.00 -0.53 0.00 0.00 40.66 40.33 1noi h LEU 543 CO 0.02 1.22 0.06 0.50 -0.13 0.00 0.00 178.44 180.11 1noi h LYS 544 N -0.30 0.31 -0.32 1.25 3.64 -1.06 -2.14 116.57 117.96 1noi h LYS 544 Ca -0.08 -0.07 -0.01 0.00 -1.27 0.00 0.00 60.65 59.22 1noi h LYS 544 Cb 1.34 -0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 33.10 1noi h LYS 544 CO 0.11 0.41 0.15 0.35 -2.27 0.00 0.00 179.45 178.21 1noi h PHE 545 N 0.15 0.45 -0.37 1.91 3.57 -0.84 -1.07 116.94 120.75 1noi h PHE 545 Ca 0.06 -0.02 0.11 0.00 3.53 0.00 0.00 57.97 61.65 1noi h PHE 545 Cb 0.23 -0.14 -0.01 0.00 2.79 0.00 0.00 35.95 38.82 1noi h PHE 545 CO 0.00 0.40 0.39 0.00 -2.23 0.00 0.00 178.31 176.87 1noi h ALA 546 N 1.01 2.07 0.10 2.41 0.00 -0.76 -1.76 119.26 122.33 1noi h ALA 546 Ca 0.11 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.00 1noi h ALA 546 Cb 0.12 0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.93 1noi h ALA 546 CO -0.01 -0.58 -0.05 0.00 0.00 0.00 0.00 179.25 178.61 1noi h ALA 547 N 1.57 -0.13 -0.87 0.00 0.00 -0.54 -3.28 119.26 116.01 1noi h ALA 547 Ca 0.17 -0.22 0.20 0.00 0.00 0.00 0.00 54.91 55.07 1noi h ALA 547 Cb 0.95 0.05 -0.12 0.00 0.00 0.00 0.00 17.79 18.67 1noi h ALA 547 CO -0.00 -0.16 0.36 -0.92 0.00 0.00 0.00 179.25 178.52 1noi h TYR 548 N -0.95 0.59 0.00 0.00 3.20 -1.01 0.11 116.97 118.91 1noi h TYR 548 Ca -0.01 0.04 0.00 0.00 3.14 0.00 0.00 58.73 61.90 1noi h TYR 548 Cb 0.49 -0.13 0.00 0.00 1.54 0.00 0.00 36.73 38.63 1noi h TYR 548 CO 0.10 -0.04 0.00 -0.11 -1.64 0.00 0.00 178.16 176.48 1noi n LEU 549 N -5.05 0.84 0.00 2.82 7.94 -0.69 -1.08 117.00 121.78 1noi n LEU 549 Ca 0.20 -0.42 0.00 0.00 -1.11 0.00 0.00 56.01 54.68 1noi n LEU 549 Cb 0.60 -0.36 0.00 0.00 0.53 0.00 0.00 43.42 44.19 1noi n LEU 549 CO 0.13 0.20 0.00 -0.62 -1.11 0.00 0.00 177.39 175.99 1noi n GLU 550 N 0.18 1.64 0.08 1.96 1.02 0.21 -3.87 120.64 121.85 1noi n GLU 550 Ca 0.00 0.00 -0.21 0.00 -0.02 0.00 0.00 57.16 56.93 1noi n GLU 550 Cb 0.20 -0.14 -0.14 0.00 -0.02 0.00 0.00 31.44 31.34 1noi n GLU 550 CO 0.00 0.00 0.00 -0.09 1.18 0.00 0.00 177.13 178.22 1noi h ARG 551 N 0.00 0.44 -5.20 3.49 2.43 0.56 -3.40 114.38 112.71 1noi h ARG 551 Ca 0.00 -0.68 -0.67 0.00 -0.81 0.00 0.00 59.98 57.82 1noi h ARG 551 Cb 0.00 0.24 -0.33 0.00 -0.42 0.00 0.00 29.97 29.46 1noi h ARG 551 CO 0.00 1.31 -0.85 -1.21 -1.51 0.00 0.00 179.97 177.71 1noi s GLU 552 N -2.68 3.08 0.60 0.20 8.01 -0.66 -5.04 118.70 122.21 1noi s GLU 552 Ca -0.12 -0.82 0.00 0.00 0.01 0.00 0.00 54.97 54.04 1noi s GLU 552 Cb 0.03 -2.49 0.00 0.00 -4.31 0.00 0.00 34.13 27.36 1noi s GLU 552 CO 0.88 -0.00 0.00 0.66 0.01 0.00 0.00 175.26 176.81 1noi n TYR 553 N 4.06 -2.06 -3.58 1.61 4.01 -1.26 -4.27 117.16 115.67 1noi n TYR 553 Ca -0.20 0.36 -0.06 0.00 -0.16 0.00 0.00 57.90 57.84 1noi n TYR 553 Cb 0.52 -0.62 -0.03 0.00 -0.31 0.00 0.00 39.34 38.89 1noi n TYR 553 CO 0.00 0.00 0.00 -1.59 -0.46 0.00 0.00 176.86 174.81 1noi s LYS 554 N -0.84 0.42 0.00 -0.72 0.00 -1.25 -3.83 119.74 113.51 1noi s LYS 554 Ca 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 55.97 55.92 1noi s LYS 554 Cb 0.00 0.19 0.00 0.00 0.00 0.00 0.00 37.83 38.02 1noi s LYS 554 CO 0.00 -0.16 0.00 0.28 0.00 0.00 0.00 175.35 175.47 1noi n VAL 555 N 0.23 0.00 0.00 1.79 0.31 -1.26 -4.95 118.33 114.45 1noi n VAL 555 Ca -0.04 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.29 1noi n VAL 555 Cb 0.59 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.52 1noi n VAL 555 CO 0.00 0.00 0.00 1.57 -1.32 0.00 0.00 176.83 177.08 1noi n HIS 556 N 0.00 0.00 -4.28 3.52 -0.00 -1.26 -5.12 115.22 108.07 1noi n HIS 556 Ca 0.00 0.00 -0.34 0.00 0.46 0.00 0.00 57.72 57.84 1noi n HIS 556 Cb 0.00 0.00 -0.12 0.00 -0.12 0.00 0.00 29.99 29.75 1noi n HIS 556 CO 0.00 0.00 0.00 0.42 0.46 0.00 0.00 176.34 177.22 1noi s ILE 557 N 0.00 4.07 -0.57 3.57 1.09 -1.26 -5.01 121.20 123.08 1noi s ILE 557 Ca 0.00 -0.29 -0.27 0.00 -1.10 0.00 0.00 60.65 58.99 1noi s ILE 557 Cb 0.00 -2.80 0.03 0.00 -1.06 0.00 0.00 42.46 38.63 1noi s ILE 557 CO 0.00 0.48 1.14 0.21 -0.10 0.00 0.00 174.94 176.67 1noi s ASN 558 N 0.45 6.42 0.12 3.58 3.84 -1.26 -4.92 114.94 123.17 1noi s ASN 558 Ca -0.02 0.01 0.13 0.00 0.21 0.00 0.00 52.86 53.19 1noi s ASN 558 Cb -0.14 -2.53 0.62 0.00 -0.55 0.00 0.00 41.25 38.65 1noi s ASN 558 CO 0.02 -1.43 1.41 -0.81 -2.79 0.00 0.00 177.10 173.51 1noi n PRO 559 N 8.24 0.07 -0.15 0.43 -0.04 -1.26 -1.87 135.00 140.42 1noi n PRO 559 Ca 0.07 0.44 0.12 0.00 -0.04 0.00 0.00 63.50 64.09 1noi n PRO 559 Cb 0.49 -1.67 0.22 0.00 -0.04 0.00 0.00 33.50 32.49 1noi n PRO 559 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1noi n ASN 560 N -1.81 3.22 -4.89 3.54 4.13 -1.26 -4.86 115.26 113.34 1noi n ASN 560 Ca 0.01 -1.97 -0.30 0.00 1.68 0.00 0.00 54.58 54.01 1noi n ASN 560 Cb 0.10 -0.20 0.06 0.00 -1.54 0.00 0.00 39.78 38.20 1noi n ASN 560 CO 0.00 0.00 0.00 -0.94 0.28 0.00 0.00 177.26 176.60 1noi s SER 561 N -1.58 5.16 -0.18 6.41 1.04 -0.78 -4.94 113.70 118.84 1noi s SER 561 Ca 0.37 1.02 -0.29 0.00 0.48 0.00 0.00 55.95 57.53 1noi s SER 561 Cb 0.22 -1.73 -0.01 0.00 0.10 0.00 0.00 66.02 64.60 1noi s SER 561 CO 0.31 -1.51 1.28 -0.22 0.98 0.00 0.00 173.24 174.08 1noi s LEU 562 N -5.42 4.15 -0.43 2.42 0.20 0.87 -4.84 118.68 115.63 1noi s LEU 562 Ca 0.59 1.65 -0.24 0.00 0.69 0.00 0.00 54.13 56.83 1noi s LEU 562 Cb -0.11 -3.54 0.02 0.00 -0.43 0.00 0.00 46.19 42.13 1noi s LEU 562 CO 0.51 -0.80 0.83 -0.36 -0.29 0.00 0.00 176.35 176.24 1noi s PHE 563 N 3.62 3.00 -0.39 5.38 0.40 -1.26 -1.21 117.98 127.51 1noi s PHE 563 Ca 0.55 0.33 -0.09 0.00 -0.60 0.00 0.00 56.93 57.12 1noi s PHE 563 Cb -0.21 -3.70 0.06 0.00 0.51 0.00 0.00 43.02 39.68 1noi s PHE 563 CO 0.16 -0.96 0.21 0.34 0.70 0.00 0.00 175.22 175.67 1noi s ASP 564 N 2.10 5.59 -0.08 1.36 -1.08 0.15 -0.79 116.67 123.91 1noi s ASP 564 Ca 0.33 -1.30 0.03 0.00 -0.52 0.00 0.00 52.55 51.08 1noi s ASP 564 Cb -0.12 -1.97 0.01 0.00 -1.46 0.00 0.00 42.92 39.38 1noi s ASP 564 CO 0.22 -0.45 -0.16 0.54 0.52 0.00 0.00 175.17 175.84 1noi s VAL 565 N 1.45 1.43 -0.44 1.11 0.11 0.13 -1.32 120.40 122.87 1noi s VAL 565 Ca 0.02 -0.64 -0.07 0.00 -2.93 0.00 0.00 61.98 58.36 1noi s VAL 565 Cb -0.21 -1.28 0.11 0.00 -1.53 0.00 0.00 36.38 33.47 1noi s VAL 565 CO 0.03 0.42 0.29 -1.58 -3.33 0.00 0.00 175.10 170.93 1noi s GLN 566 N 0.66 2.32 -0.12 1.54 0.74 -0.87 -1.79 119.66 122.14 1noi s GLN 566 Ca -0.14 -1.75 0.02 0.00 0.05 0.00 0.00 55.36 53.54 1noi s GLN 566 Cb -0.16 -3.79 0.01 0.00 1.10 0.00 0.00 33.01 30.18 1noi s GLN 566 CO 0.04 -1.13 -0.17 0.14 -0.55 0.00 0.00 175.29 173.63 1noi s VAL 567 N 1.29 1.63 0.00 1.34 -7.23 -1.26 -2.37 120.40 113.80 1noi s VAL 567 Ca 0.06 -0.72 0.00 0.00 -1.81 0.00 0.00 61.98 59.51 1noi s VAL 567 Cb -0.25 -1.48 0.00 0.00 0.56 0.00 0.00 36.38 35.21 1noi s VAL 567 CO -0.02 0.47 0.00 2.29 -0.31 0.00 0.00 175.10 177.53 1noi n LYS 568 N 4.22 -1.25 -2.00 4.82 2.85 -1.00 -4.96 118.16 120.83 1noi n LYS 568 Ca -0.19 0.00 -0.40 0.00 -1.05 0.00 0.00 58.31 56.67 1noi n LYS 568 Cb 0.51 0.00 -0.00 0.00 -0.65 0.00 0.00 35.03 34.89 1noi n LYS 568 CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 177.40 178.38 1noi s ARG 569 N -2.00 3.92 -0.74 -1.58 0.52 -1.26 -3.97 118.95 113.83 1noi s ARG 569 Ca 0.00 2.22 -0.26 0.00 -0.52 0.00 0.00 55.73 57.17 1noi s ARG 569 Cb 0.00 -2.75 -0.01 0.00 0.52 0.00 0.00 34.95 32.71 1noi s ARG 569 CO 0.00 -0.55 1.75 0.42 0.02 0.00 0.00 175.30 176.94 1noi s ILE 570 N -1.24 3.49 0.20 1.52 -1.09 -0.88 -4.89 121.20 118.30 1noi s ILE 570 Ca 0.57 0.00 0.06 0.00 -2.23 0.00 0.00 60.65 59.06 1noi s ILE 570 Cb -0.39 -4.22 -0.05 0.00 -1.58 0.00 0.00 42.46 36.22 1noi s ILE 570 CO 0.51 -1.17 -0.11 -2.28 -1.23 0.00 0.00 174.94 170.66 1noi s HIS 571 N 8.44 1.59 0.21 3.97 2.46 -1.26 -4.70 115.29 126.01 1noi s HIS 571 Ca 0.61 -0.66 -0.03 0.00 0.47 0.00 0.00 55.06 55.45 1noi s HIS 571 Cb -0.09 -0.78 0.19 0.00 -0.13 0.00 0.00 32.58 31.76 1noi s HIS 571 CO 0.11 0.24 1.59 0.93 -2.47 0.00 0.00 174.74 175.15 1noi h GLU 572 N 2.59 0.65 0.00 2.88 5.08 -1.98 -3.04 114.58 120.76 1noi h GLU 572 Ca -0.38 -0.31 0.00 0.00 -1.00 0.00 0.00 59.36 57.67 1noi h GLU 572 Cb 1.21 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.46 1noi h GLU 572 CO 0.63 0.91 0.00 0.10 -1.00 0.00 0.00 179.01 179.65 1noi h TYR 573 N 0.54 0.00 -0.00 4.33 -0.00 -1.97 -2.91 116.97 116.97 1noi h TYR 573 Ca 0.06 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.79 1noi h TYR 573 Cb 0.87 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 37.60 1noi h TYR 573 CO 0.04 0.00 -0.24 1.63 -0.00 0.00 0.00 178.16 179.59 1noi n LYS 574 N -2.94 0.19 -3.94 0.10 5.02 -1.15 -2.93 118.16 112.51 1noi n LYS 574 Ca -0.01 -0.07 -0.27 0.00 -2.02 0.00 0.00 58.31 55.93 1noi n LYS 574 Cb 0.17 -1.50 -0.00 0.00 -0.02 0.00 0.00 35.03 33.69 1noi n LYS 574 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1noi n ARG 575 N -1.34 -4.07 0.26 1.97 1.74 -1.10 -4.26 116.66 109.87 1noi n ARG 575 Ca 0.08 0.48 0.18 0.00 -0.77 0.00 0.00 57.85 57.83 1noi n ARG 575 Cb 0.32 -4.96 0.89 0.00 -1.02 0.00 0.00 32.46 27.70 1noi n ARG 575 CO 0.00 0.00 0.00 1.96 -1.52 0.00 0.00 177.63 178.07 1noi h GLN 576 N -1.84 0.00 -0.29 5.56 7.50 -1.87 -1.82 115.11 122.35 1noi h GLN 576 Ca -0.61 0.00 -0.04 0.00 0.50 0.00 0.00 58.65 58.50 1noi h GLN 576 Cb 1.37 0.00 -0.01 0.00 0.05 0.00 0.00 27.48 28.89 1noi h GLN 576 CO 0.65 0.00 0.02 -0.07 -1.50 0.00 0.00 178.83 177.92 1noi h LEU 577 N 0.00 0.49 -0.19 1.46 3.38 -1.91 -0.58 115.31 117.96 1noi h LEU 577 Ca 0.05 -0.29 0.04 0.00 0.09 0.00 0.00 57.88 57.77 1noi h LEU 577 Cb 0.54 -0.13 -0.04 0.00 0.09 0.00 0.00 40.66 41.12 1noi h LEU 577 CO -0.00 0.67 -0.06 0.25 0.09 0.00 0.00 178.44 179.39 1noi h LEU 578 N 0.31 -0.21 -2.01 1.67 5.85 -1.70 0.63 115.31 119.85 1noi h LEU 578 Ca 0.08 0.06 0.01 0.00 0.84 0.00 0.00 57.88 58.87 1noi h LEU 578 Cb 0.40 0.13 -0.00 0.00 0.37 0.00 0.00 40.66 41.56 1noi h LEU 578 CO 0.01 -0.08 0.02 -1.13 -0.34 0.00 0.00 178.44 176.92 1noi h ASN 579 N -0.02 0.00 0.26 1.25 -0.00 -1.36 0.12 115.58 115.84 1noi h ASN 579 Ca 0.10 0.00 -0.13 0.00 -0.00 0.00 0.00 56.30 56.26 1noi h ASN 579 Cb 0.16 0.00 -0.01 0.00 -0.00 0.00 0.00 38.32 38.47 1noi h ASN 579 CO -0.21 0.00 -0.52 0.00 -0.00 0.00 0.00 177.43 176.70 1noi h LEU 581 N 0.22 0.37 -1.14 0.00 3.38 0.70 -2.03 115.31 116.81 1noi h LEU 581 Ca 0.01 -0.36 0.03 0.00 0.09 0.00 0.00 57.88 57.65 1noi h LEU 581 Cb 0.99 -0.10 -0.05 0.00 0.09 0.00 0.00 40.66 41.59 1noi h LEU 581 CO 0.08 0.65 0.59 -0.74 0.09 0.00 0.00 178.44 179.11 1noi h HIS 582 N 0.09 1.09 -0.10 1.13 2.76 -1.22 0.03 115.15 118.93 1noi h HIS 582 Ca 0.05 0.03 -0.11 0.00 -2.20 0.00 0.00 60.37 58.14 1noi h HIS 582 Cb 0.48 -0.36 -0.01 0.00 1.55 0.00 0.00 27.41 29.07 1noi h HIS 582 CO 0.05 0.64 -0.42 0.28 -1.30 0.00 0.00 177.93 177.17 1noi h VAL 583 N 1.13 1.32 0.08 5.26 2.07 -1.15 -0.80 116.25 124.15 1noi h VAL 583 Ca 0.35 -1.55 -0.26 0.00 0.82 0.00 0.00 66.70 66.06 1noi h VAL 583 Cb -0.00 1.71 0.01 0.00 -1.52 0.00 0.00 31.29 31.49 1noi h VAL 583 CO -0.10 0.46 -1.12 0.40 0.02 0.00 0.00 177.57 177.23 1noi h ILE 584 N 0.19 1.42 -0.07 4.57 2.04 -0.53 -1.55 117.51 123.58 1noi h ILE 584 Ca 0.02 -2.70 0.04 0.00 1.00 0.00 0.00 64.86 63.21 1noi h ILE 584 Cb 0.83 2.68 -0.05 0.00 -0.74 0.00 0.00 36.82 39.54 1noi h ILE 584 CO 0.07 0.80 -0.26 0.74 0.00 0.00 0.00 178.15 179.50 1noi h THR 585 N 0.17 0.40 -0.07 -0.27 2.02 -0.64 0.11 112.91 114.63 1noi h THR 585 Ca -0.12 0.00 0.04 0.00 0.77 0.00 0.00 66.41 67.10 1noi h THR 585 Cb 1.79 0.40 -0.04 0.00 -1.74 0.00 0.00 68.15 68.56 1noi h THR 585 CO 0.19 0.00 -0.17 -0.07 0.37 0.00 0.00 175.52 175.84 1noi h LEU 586 N -0.36 -0.52 -0.57 2.58 4.07 -1.12 -1.65 115.31 117.74 1noi h LEU 586 Ca 0.08 0.09 0.11 0.00 0.08 0.00 0.00 57.88 58.24 1noi h LEU 586 Cb 0.48 0.23 -0.09 0.00 1.08 0.00 0.00 40.66 42.36 1noi h LEU 586 CO -0.28 -0.22 0.06 0.22 -1.08 0.00 0.00 178.44 177.14 1noi h TYR 587 N -0.24 0.08 -0.30 1.13 3.20 -0.73 -2.81 116.97 117.31 1noi h TYR 587 Ca 0.08 0.04 -0.03 0.00 3.14 0.00 0.00 58.73 61.95 1noi h TYR 587 Cb 0.35 0.05 -0.01 0.00 1.54 0.00 0.00 36.73 38.66 1noi h TYR 587 CO -0.26 -0.08 0.07 -0.91 -1.64 0.00 0.00 178.16 175.34 1noi h ASN 588 N 0.18 0.46 -0.92 -2.11 2.35 -0.37 -2.77 115.58 112.40 1noi h ASN 588 Ca 0.29 -0.24 0.20 0.00 -0.55 0.00 0.00 56.30 56.00 1noi h ASN 588 Cb 0.45 -0.12 -0.17 0.00 0.05 0.00 0.00 38.32 38.52 1noi h ASN 588 CO -0.43 0.58 -0.17 0.03 -1.65 0.00 0.00 177.43 175.80 1noi h ARG 589 N 0.32 0.01 -0.35 0.81 -0.00 -1.05 0.50 114.38 114.62 1noi h ARG 589 Ca 0.09 -0.00 -0.14 0.00 -0.50 0.00 0.00 59.98 59.43 1noi h ARG 589 Cb 0.31 -0.00 -0.01 0.00 0.00 0.00 0.00 29.97 30.26 1noi h ARG 589 CO 0.00 0.01 -0.34 0.82 0.00 0.00 0.00 179.97 180.46 1noi h ILE 590 N 0.01 1.28 -0.04 2.04 2.04 -1.56 0.16 117.51 121.44 1noi h ILE 590 Ca 0.47 -1.50 -0.17 0.00 1.00 0.00 0.00 64.86 64.66 1noi h ILE 590 Cb 0.78 1.37 -0.01 0.00 -0.74 0.00 0.00 36.82 38.22 1noi h ILE 590 CO -0.92 0.49 -0.71 0.11 0.00 0.00 0.00 178.15 177.12 1noi h LYS 591 N 0.66 0.23 0.44 2.37 1.79 -1.11 -2.09 116.57 118.85 1noi h LYS 591 Ca 0.07 -0.19 -0.02 0.00 -2.18 0.00 0.00 60.65 58.33 1noi h LYS 591 Cb 0.89 0.04 0.00 0.00 -1.58 0.00 0.00 32.23 31.58 1noi h LYS 591 CO 0.08 0.84 -0.21 -0.22 -1.08 0.00 0.00 179.45 178.86 1noi h LYS 592 N 0.15 -0.56 -2.41 3.15 3.64 -0.48 -3.37 116.57 116.69 1noi h LYS 592 Ca -0.02 0.04 -0.60 0.00 -1.27 0.00 0.00 60.65 58.79 1noi h LYS 592 Cb 1.26 0.13 -0.42 0.00 -0.41 0.00 0.00 32.23 32.79 1noi h LYS 592 CO 0.11 -0.26 -0.61 0.39 -2.27 0.00 0.00 179.45 176.81 1noi n GLU 593 N -5.22 2.25 0.00 1.90 1.02 0.53 -4.97 120.64 116.14 1noi n GLU 593 Ca -0.10 -4.54 0.00 0.00 -0.02 0.00 0.00 57.16 52.49 1noi n GLU 593 Cb 0.30 -2.21 0.00 0.00 -0.02 0.00 0.00 31.44 29.50 1noi n GLU 593 CO 0.00 0.00 0.00 -2.30 1.18 0.00 0.00 177.13 176.01 1noi n PRO 594 N 1.18 0.00 0.00 3.49 -0.02 -0.79 -1.28 135.00 137.57 1noi n PRO 594 Ca 0.27 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.75 1noi n PRO 594 Cb 0.40 -1.41 0.00 0.00 -0.02 0.00 0.00 33.50 32.47 1noi n PRO 594 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1noi n ASN 595 N -0.76 0.63 -4.75 2.55 3.02 -1.26 -5.03 115.26 109.66 1noi n ASN 595 Ca 0.00 -1.18 -0.40 0.00 -0.03 0.00 0.00 54.58 52.97 1noi n ASN 595 Cb 0.00 0.00 -0.06 0.00 -0.61 0.00 0.00 39.78 39.11 1noi n ASN 595 CO 0.00 0.00 0.00 -0.75 -2.62 0.00 0.00 177.26 173.89 1noi s LYS 596 N -0.18 4.84 0.06 3.52 2.36 -0.41 -4.96 119.74 124.97 1noi s LYS 596 Ca 0.00 1.52 -0.30 0.00 -2.55 0.00 0.00 55.97 54.63 1noi s LYS 596 Cb 0.00 -3.28 -0.09 0.00 -1.05 0.00 0.00 37.83 33.42 1noi s LYS 596 CO 0.00 0.49 1.80 0.12 1.55 0.00 0.00 175.35 179.30 1noi s PHE 597 N -1.14 1.95 -0.03 4.03 5.36 -1.26 -5.01 117.98 121.88 1noi s PHE 597 Ca 0.41 -0.03 0.07 0.00 -0.96 0.00 0.00 56.93 56.42 1noi s PHE 597 Cb -0.26 -4.11 -0.02 0.00 -0.34 0.00 0.00 43.02 38.29 1noi s PHE 597 CO 0.33 -4.67 -0.23 0.54 -1.46 0.00 0.00 175.22 169.72 1noi s VAL 598 N 3.38 2.28 -0.28 3.12 0.11 -1.26 -5.09 120.40 122.65 1noi s VAL 598 Ca 0.80 -1.02 -0.29 0.00 -2.93 0.00 0.00 61.98 58.54 1noi s VAL 598 Cb -0.42 -1.81 -0.00 0.00 -1.53 0.00 0.00 36.38 32.62 1noi s VAL 598 CO 0.36 0.58 1.30 -0.69 -3.33 0.00 0.00 175.10 173.32 1noi s VAL 599 N -0.62 4.16 0.27 2.04 1.01 -1.26 -4.99 120.40 121.01 1noi s VAL 599 Ca 0.10 1.32 -0.29 0.00 0.00 0.00 0.00 61.98 63.11 1noi s VAL 599 Cb -0.10 -4.13 -0.09 0.00 0.00 0.00 0.00 36.38 32.05 1noi s VAL 599 CO -0.00 -0.43 1.13 -2.16 0.00 0.00 0.00 175.10 173.64 1noi s PRO 600 N 4.08 4.59 0.17 2.72 0.04 -1.26 -4.90 135.00 140.44 1noi s PRO 600 Ca 0.56 1.86 0.09 0.00 0.04 0.00 0.00 61.00 63.55 1noi s PRO 600 Cb -0.17 -3.18 -0.04 0.00 0.04 0.00 0.00 34.50 31.14 1noi s PRO 600 CO 0.22 0.13 -0.20 1.03 0.04 0.00 0.00 177.00 178.21 1noi s ARG 601 N -1.32 1.33 -0.25 4.56 0.52 -0.34 -0.09 118.95 123.37 1noi s ARG 601 Ca 0.46 -1.42 0.02 0.00 -0.52 0.00 0.00 55.73 54.26 1noi s ARG 601 Cb -0.33 -1.49 0.06 0.00 0.52 0.00 0.00 34.95 33.71 1noi s ARG 601 CO 0.42 0.31 -0.06 0.99 0.02 0.00 0.00 175.30 176.98 1noi s THR 602 N -1.86 1.78 -0.24 0.02 2.01 -0.35 -1.77 115.64 115.23 1noi s THR 602 Ca 0.16 -1.44 -0.08 0.00 0.31 0.00 0.00 61.69 60.64 1noi s THR 602 Cb -0.07 -2.01 -0.04 0.00 0.01 0.00 0.00 72.50 70.39 1noi s THR 602 CO 0.07 -0.12 0.10 0.68 -0.69 0.00 0.00 174.62 174.67 1noi s VAL 603 N 1.27 4.77 -0.14 3.82 -7.23 0.51 -0.68 120.40 122.72 1noi s VAL 603 Ca -0.06 -0.02 0.01 0.00 -1.81 0.00 0.00 61.98 60.10 1noi s VAL 603 Cb -0.19 -3.22 -0.00 0.00 0.56 0.00 0.00 36.38 33.53 1noi s VAL 603 CO -0.06 0.36 -0.16 -0.04 -0.31 0.00 0.00 175.10 174.89 1noi s MET 604 N 1.23 3.24 -0.00 4.82 -1.94 -0.44 -1.39 119.30 124.81 1noi s MET 604 Ca 0.06 -0.75 0.07 0.00 -1.71 0.00 0.00 55.69 53.36 1noi s MET 604 Cb -0.14 -2.60 -0.02 0.00 2.01 0.00 0.00 34.83 34.08 1noi s MET 604 CO 0.04 0.07 -0.23 0.42 -0.01 0.00 0.00 175.02 175.32 1noi s ILE 605 N 0.67 1.80 0.01 2.53 1.01 -0.85 -2.05 121.20 124.31 1noi s ILE 605 Ca -0.08 -1.05 -0.25 0.00 0.00 0.00 0.00 60.65 59.27 1noi s ILE 605 Cb -0.16 -1.51 0.06 0.00 0.01 0.00 0.00 42.46 40.86 1noi s ILE 605 CO 0.02 0.44 0.56 -0.83 0.00 0.00 0.00 174.94 175.14 1noi s GLY 606 N -0.71 -0.47 0.00 6.18 0.00 -1.00 0.41 107.32 111.73 1noi s GLY 606 Ca 0.09 0.85 0.00 0.00 0.00 0.00 0.00 44.72 45.66 1noi s GLY 606 CO -0.00 0.54 0.00 0.61 0.00 0.00 0.00 173.10 174.25 1noi n GLY 607 N 0.67 3.10 3.87 0.20 0.00 -1.25 -2.39 105.19 109.40 1noi n GLY 607 Ca -0.19 -1.09 -0.34 0.00 0.00 0.00 0.00 46.02 44.39 1noi n GLY 607 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1noi s LYS 608 N -2.16 3.38 0.00 1.61 1.02 -1.26 -4.65 119.74 117.67 1noi s LYS 608 Ca 0.00 -0.29 0.00 0.00 0.02 0.00 0.00 55.97 55.70 1noi s LYS 608 Cb 0.00 -3.08 0.00 0.00 -0.52 0.00 0.00 37.83 34.23 1noi s LYS 608 CO 0.00 0.71 0.10 -0.35 -0.92 0.00 0.00 175.35 174.89 1noi n PRO 609 N 1.34 0.00 0.00 -1.68 -0.05 -1.26 -2.06 135.00 131.28 1noi n PRO 609 Ca -0.14 0.00 0.00 0.00 -0.05 0.00 0.00 63.50 63.31 1noi n PRO 609 Cb 0.53 -0.48 0.00 0.00 -0.05 0.00 0.00 33.50 33.50 1noi n PRO 609 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 175.50 175.45 1noi n ALA 610 N -1.44 0.00 -1.70 0.55 0.00 -1.26 -4.42 120.51 112.24 1noi n ALA 610 Ca 0.00 0.00 -0.44 0.00 0.00 0.00 0.00 53.44 53.00 1noi n ALA 610 Cb 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.43 1noi n ALA 610 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1noi n PRO 611 N 0.00 2.27 -1.02 0.00 -0.02 -1.26 -0.44 135.00 134.53 1noi n PRO 611 Ca 0.00 0.81 -0.01 0.00 -2.02 0.00 0.00 63.50 62.28 1noi n PRO 611 Cb 0.00 -2.51 -0.00 0.00 -0.02 0.00 0.00 33.50 30.97 1noi n PRO 611 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1noi n GLY 612 N 2.21 0.45 3.15 -1.23 0.00 -1.26 -4.90 105.19 103.60 1noi n GLY 612 Ca 0.11 -0.13 -0.39 0.00 0.00 0.00 0.00 46.02 45.61 1noi n GLY 612 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1noi s TYR 613 N -1.86 3.49 0.07 1.61 6.14 0.41 -4.94 117.35 122.26 1noi s TYR 613 Ca 0.00 -2.55 -0.23 0.00 0.64 0.00 0.00 57.07 54.93 1noi s TYR 613 Cb 0.00 -3.34 -0.14 0.00 0.42 0.00 0.00 41.96 38.90 1noi s TYR 613 CO 0.00 -0.87 1.59 1.25 0.64 0.00 0.00 175.55 178.16 1noi h HIS 614 N 7.18 0.11 -0.47 4.97 -0.00 -1.91 -0.00 115.15 125.04 1noi h HIS 614 Ca 0.02 -0.01 0.03 0.00 -0.00 0.00 0.00 60.37 60.41 1noi h HIS 614 Cb 0.97 -0.03 -0.04 0.00 -0.00 0.00 0.00 27.41 28.31 1noi h HIS 614 CO 0.79 0.24 0.25 1.98 -0.00 0.00 0.00 177.93 181.19 1noi h MET 615 N -0.05 0.49 -0.15 5.26 -1.53 -1.97 0.25 114.93 117.23 1noi h MET 615 Ca 0.02 -0.03 -0.03 0.00 -3.44 0.00 0.00 59.70 56.23 1noi h MET 615 Cb 0.18 -0.11 -0.01 0.00 -0.55 0.00 0.00 31.60 31.11 1noi h MET 615 CO -0.00 0.32 -0.04 0.00 0.14 0.00 0.00 176.91 177.33 1noi h ALA 616 N 1.24 1.66 0.00 0.39 0.00 -1.81 0.93 119.26 121.67 1noi h ALA 616 Ca 0.20 -0.13 -0.11 0.00 0.00 0.00 0.00 54.91 54.87 1noi h ALA 616 Cb 0.08 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 1noi h ALA 616 CO -0.12 0.26 -0.51 0.87 0.00 0.00 0.00 179.25 179.75 1noi h LYS 617 N 0.22 0.00 -0.13 0.00 1.57 0.38 -3.12 116.57 115.49 1noi h LYS 617 Ca 0.05 0.00 -0.22 0.00 -1.87 0.00 0.00 60.65 58.61 1noi h LYS 617 Cb 0.22 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.54 1noi h LYS 617 CO 0.01 0.51 -0.80 0.52 -0.57 0.00 0.00 179.45 179.12 1noi h MET 618 N 0.00 0.73 -0.76 3.15 2.86 0.11 -2.55 114.93 118.47 1noi h MET 618 Ca -0.01 -0.61 0.10 0.00 -2.06 0.00 0.00 59.70 57.12 1noi h MET 618 Cb 1.23 0.13 -0.07 0.00 0.06 0.00 0.00 31.60 32.95 1noi h MET 618 CO 0.07 1.22 0.41 0.82 1.06 0.00 0.00 176.91 180.48 1noi h ILE 619 N 0.49 0.87 -0.38 -1.22 2.04 -1.24 0.16 117.51 118.24 1noi h ILE 619 Ca -0.06 -0.23 -0.04 0.00 1.00 0.00 0.00 64.86 65.53 1noi h ILE 619 Cb 1.42 0.13 -0.02 0.00 -0.74 0.00 0.00 36.82 37.61 1noi h ILE 619 CO 0.16 0.12 0.09 0.40 0.00 0.00 0.00 178.15 178.93 1noi h ILE 620 N 0.68 1.23 -0.60 -0.67 2.04 -1.46 -1.37 117.51 117.36 1noi h ILE 620 Ca 0.37 -0.77 0.02 0.00 1.00 0.00 0.00 64.86 65.48 1noi h ILE 620 Cb 0.38 1.01 -0.03 0.00 -0.74 0.00 0.00 36.82 37.44 1noi h ILE 620 CO -0.26 0.27 0.40 0.50 0.00 0.00 0.00 178.15 179.05 1noi h LYS 621 N 0.47 0.74 0.75 2.37 1.63 -0.71 -2.33 116.57 119.48 1noi h LYS 621 Ca 0.12 -0.04 -0.04 0.00 -0.85 0.00 0.00 60.65 59.84 1noi h LYS 621 Cb 0.31 -0.17 0.01 0.00 -0.60 0.00 0.00 32.23 31.78 1noi h LYS 621 CO 0.00 0.49 -0.36 1.25 -3.45 0.00 0.00 179.45 177.38 1noi h LEU 622 N 0.76 -0.85 -0.84 5.20 6.46 0.35 -1.60 115.31 124.79 1noi h LEU 622 Ca 0.23 0.01 0.21 0.00 -0.12 0.00 0.00 57.88 58.21 1noi h LEU 622 Cb -0.00 0.22 -0.13 0.00 -0.73 0.00 0.00 40.66 40.02 1noi h LEU 622 CO -0.06 -0.52 0.20 0.40 -0.62 0.00 0.00 178.44 177.85 1noi h ILE 623 N -1.16 0.36 0.02 4.05 2.04 -1.32 0.29 117.51 121.79 1noi h ILE 623 Ca -0.10 -0.08 0.02 0.00 1.00 0.00 0.00 64.86 65.70 1noi h ILE 623 Cb 0.79 0.12 -0.03 0.00 -0.74 0.00 0.00 36.82 36.97 1noi h ILE 623 CO 0.17 0.04 -0.14 0.74 0.00 0.00 0.00 178.15 178.95 1noi h THR 624 N 0.22 0.65 -0.71 -0.27 2.02 -1.26 -1.64 112.91 111.92 1noi h THR 624 Ca 0.51 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.67 1noi h THR 624 Cb 0.99 0.65 -0.03 0.00 -1.74 0.00 0.00 68.15 68.01 1noi h THR 624 CO -0.62 0.00 0.34 0.00 0.37 0.00 0.00 175.52 175.61 1noi h ALA 625 N 0.67 0.91 -0.36 6.16 0.00 0.51 -2.08 119.26 125.08 1noi h ALA 625 Ca 0.04 -0.14 -0.03 0.00 0.00 0.00 0.00 54.91 54.78 1noi h ALA 625 Cb 0.30 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 1noi h ALA 625 CO -0.12 0.47 0.10 0.82 0.00 0.00 0.00 179.25 180.52 1noi h ILE 626 N 0.98 1.22 -0.99 0.00 2.04 -0.88 -2.42 117.51 117.46 1noi h ILE 626 Ca 0.24 -0.72 0.01 0.00 1.00 0.00 0.00 64.86 65.39 1noi h ILE 626 Cb 0.11 1.01 -0.05 0.00 -0.74 0.00 0.00 36.82 37.15 1noi h ILE 626 CO -0.03 0.25 0.66 1.23 0.00 0.00 0.00 178.15 180.25 1noi h GLY 627 N 0.43 1.39 1.27 5.37 0.00 -0.97 0.26 103.07 110.81 1noi h GLY 627 Ca 0.11 -0.52 -0.07 0.00 0.00 0.00 0.00 47.33 46.86 1noi h GLY 627 CO -0.00 0.51 0.09 -0.55 0.00 0.00 0.00 176.54 176.58 1noi h ASP 628 N 1.34 0.85 0.21 0.19 3.32 -1.02 -0.50 116.42 120.82 1noi h ASP 628 Ca 0.36 -0.18 -0.01 0.00 0.02 0.00 0.00 57.03 57.22 1noi h ASP 628 Cb -0.15 -0.22 0.00 0.00 0.22 0.00 0.00 39.33 39.18 1noi h ASP 628 CO -0.08 0.86 -0.10 0.58 -1.72 0.00 0.00 179.24 178.78 1noi h VAL 629 N 0.85 0.02 -0.19 -1.35 2.07 -1.17 -3.28 116.25 113.19 1noi h VAL 629 Ca 0.18 -0.80 -0.06 0.00 0.82 0.00 0.00 66.70 66.84 1noi h VAL 629 Cb 0.38 0.03 -0.01 0.00 -1.52 0.00 0.00 31.29 30.17 1noi h VAL 629 CO 0.01 0.00 -0.15 -0.37 0.02 0.00 0.00 177.57 177.09 1noi h VAL 630 N -1.08 1.20 0.00 2.57 -1.51 -0.94 -1.96 116.25 114.54 1noi h VAL 630 Ca -0.03 -0.91 0.00 0.00 -1.23 0.00 0.00 66.70 64.54 1noi h VAL 630 Cb 0.23 1.22 0.00 0.00 -2.13 0.00 0.00 31.29 30.61 1noi h VAL 630 CO 0.05 0.29 0.00 0.59 -1.23 0.00 0.00 177.57 177.26 1noi n ASN 631 N -4.23 0.00 -0.23 4.19 3.02 -0.20 -2.66 115.26 115.15 1noi n ASN 631 Ca -0.00 0.04 0.04 0.00 -0.03 0.00 0.00 54.58 54.63 1noi n ASN 631 Cb 0.30 -0.33 0.01 0.00 -0.61 0.00 0.00 39.78 39.15 1noi n ASN 631 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 1noi n HIS 632 N -1.33 0.00 -2.77 3.10 8.25 -0.76 -4.99 115.22 116.72 1noi n HIS 632 Ca 0.11 0.00 -0.43 0.00 -0.26 0.00 0.00 57.72 57.14 1noi n HIS 632 Cb 0.23 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.30 1noi n HIS 632 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 1noi s ASP 633 N -0.90 6.72 0.42 0.41 -1.08 -1.08 -4.90 116.67 116.25 1noi s ASP 633 Ca 0.07 0.66 0.16 0.00 -0.52 0.00 0.00 52.55 52.93 1noi s ASP 633 Cb 0.06 -2.48 1.05 0.00 -1.46 0.00 0.00 42.92 40.09 1noi s ASP 633 CO 0.14 -0.88 1.88 -0.65 0.52 0.00 0.00 175.17 176.19 1noi h PRO 634 N 8.44 0.42 -0.56 4.34 0.11 -1.93 0.77 132.00 143.58 1noi h PRO 634 Ca -0.23 -0.03 -0.06 0.00 0.11 0.00 0.00 66.00 65.80 1noi h PRO 634 Cb 1.07 -0.09 -0.02 0.00 0.11 0.00 0.00 31.00 32.07 1noi h PRO 634 CO 1.00 0.28 0.10 0.28 -0.21 0.00 0.00 178.00 179.45 1noi h VAL 635 N 0.43 1.25 -0.11 3.15 2.07 -1.97 -3.18 116.25 117.89 1noi h VAL 635 Ca 0.42 -0.95 -0.10 0.00 0.82 0.00 0.00 66.70 66.90 1noi h VAL 635 Cb 1.00 0.79 -0.01 0.00 -1.52 0.00 0.00 31.29 31.54 1noi h VAL 635 CO -0.15 0.35 -0.39 0.58 0.02 0.00 0.00 177.57 177.97 1noi h VAL 636 N 0.81 1.30 0.00 2.57 2.07 -1.19 -3.47 116.25 118.35 1noi h VAL 636 Ca 0.17 -1.46 0.00 0.00 0.82 0.00 0.00 66.70 66.23 1noi h VAL 636 Cb 0.39 1.65 0.00 0.00 -1.52 0.00 0.00 31.29 31.81 1noi h VAL 636 CO 0.01 0.44 0.00 0.61 0.02 0.00 0.00 177.57 178.64 1noi n GLY 637 N -0.24 1.45 1.06 2.17 0.00 -1.09 -1.26 105.19 107.27 1noi n GLY 637 Ca -0.01 0.23 -0.04 0.00 0.00 0.00 0.00 46.02 46.19 1noi n GLY 637 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1noi n ASP 638 N 5.67 -0.53 0.20 1.61 5.68 -1.26 -4.85 116.55 123.08 1noi n ASP 638 Ca 0.00 -1.94 0.08 0.00 -0.50 0.00 0.00 54.79 52.43 1noi n ASP 638 Cb 0.00 0.15 0.34 0.00 -1.14 0.00 0.00 41.12 40.47 1noi n ASP 638 CO 0.00 0.00 0.00 0.03 -1.33 0.00 0.00 177.20 175.90 1noi h ARG 639 N 0.20 0.00 -3.66 0.11 3.08 -1.51 -3.44 114.38 109.16 1noi h ARG 639 Ca -0.46 0.00 -0.30 0.00 0.07 0.00 0.00 59.98 59.29 1noi h ARG 639 Cb 1.48 0.00 -0.33 0.00 0.08 0.00 0.00 29.97 31.21 1noi h ARG 639 CO -0.19 0.28 -0.73 -1.17 -1.07 0.00 0.00 179.97 177.08 1noi s LEU 640 N -6.69 1.31 -0.05 3.04 0.20 -1.25 -1.20 118.68 114.05 1noi s LEU 640 Ca 0.02 0.01 0.02 0.00 0.69 0.00 0.00 54.13 54.86 1noi s LEU 640 Cb 0.09 -0.11 0.02 0.00 -0.43 0.00 0.00 46.19 45.76 1noi s LEU 640 CO 0.66 -0.09 -0.07 -0.13 -0.29 0.00 0.00 176.35 176.44 1noi s ARG 641 N 0.81 1.02 -0.18 1.98 1.81 -0.73 -4.66 118.95 118.99 1noi s ARG 641 Ca -0.07 -0.19 -0.05 0.00 -1.72 0.00 0.00 55.73 53.69 1noi s ARG 641 Cb -0.10 -0.95 -0.03 0.00 -0.45 0.00 0.00 34.95 33.42 1noi s ARG 641 CO -0.02 -0.03 0.00 0.08 -0.68 0.00 0.00 175.30 174.65 1noi s VAL 642 N 0.75 4.16 -0.04 3.52 1.01 -1.26 -0.36 120.40 128.17 1noi s VAL 642 Ca -0.11 -0.25 0.04 0.00 0.00 0.00 0.00 61.98 61.65 1noi s VAL 642 Cb -0.14 -2.86 -0.00 0.00 0.00 0.00 0.00 36.38 33.38 1noi s VAL 642 CO 0.01 0.46 -0.16 -0.63 0.00 0.00 0.00 175.10 174.78 1noi s ILE 643 N 0.61 1.32 -0.43 2.22 1.01 -0.49 -4.60 121.20 120.85 1noi s ILE 643 Ca -0.00 -0.65 -0.19 0.00 0.00 0.00 0.00 60.65 59.81 1noi s ILE 643 Cb -0.14 -1.15 0.02 0.00 0.01 0.00 0.00 42.46 41.21 1noi s ILE 643 CO 0.02 0.39 0.53 0.12 0.00 0.00 0.00 174.94 176.00 1noi s PHE 644 N 0.10 3.12 -0.37 3.97 5.36 -1.26 -2.01 117.98 126.88 1noi s PHE 644 Ca -0.04 -0.22 -0.28 0.00 -0.96 0.00 0.00 56.93 55.42 1noi s PHE 644 Cb -0.11 -3.11 -0.01 0.00 -0.34 0.00 0.00 43.02 39.45 1noi s PHE 644 CO 0.02 -0.78 1.73 -0.51 -1.46 0.00 0.00 175.22 174.22 1noi s LEU 645 N 2.46 3.50 0.01 6.12 1.43 0.16 -4.94 118.68 127.42 1noi s LEU 645 Ca 0.17 1.11 -0.30 0.00 -1.03 0.00 0.00 54.13 54.08 1noi s LEU 645 Cb -0.16 -3.42 -0.06 0.00 0.03 0.00 0.00 46.19 42.59 1noi s LEU 645 CO 0.16 -1.72 1.49 -0.70 0.23 0.00 0.00 176.35 175.81 1noi s GLU 646 N 5.66 4.25 -0.52 1.70 2.12 -1.26 -4.11 118.70 126.53 1noi s GLU 646 Ca 0.75 2.08 -0.03 0.00 0.36 0.00 0.00 54.97 58.13 1noi s GLU 646 Cb -0.20 -3.62 -0.03 0.00 0.26 0.00 0.00 34.13 30.54 1noi s GLU 646 CO 0.32 -0.65 0.46 -1.71 -0.54 0.00 0.00 175.26 173.14 1noi n ASN 647 N 5.62 -3.97 -4.71 -1.70 5.15 -1.26 -4.97 115.26 109.42 1noi n ASN 647 Ca 0.14 -0.34 -0.42 0.00 -0.60 0.00 0.00 54.58 53.36 1noi n ASN 647 Cb 0.43 -2.80 -0.03 0.00 -0.53 0.00 0.00 39.78 36.84 1noi n ASN 647 CO 0.00 0.00 0.00 -0.47 1.40 0.00 0.00 177.26 178.19 1noi s TYR 648 N -3.19 2.71 0.29 1.20 5.04 -1.26 -4.90 117.35 117.25 1noi s TYR 648 Ca 0.19 0.32 -0.17 0.00 -2.44 0.00 0.00 57.07 54.97 1noi s TYR 648 Cb -0.03 -4.08 0.02 0.00 0.35 0.00 0.00 41.96 38.22 1noi s TYR 648 CO 0.36 -4.19 0.66 -0.98 -1.34 0.00 0.00 175.55 170.06 1noi s ARG 649 N 1.69 1.81 0.26 4.97 1.70 -1.26 -4.71 118.95 123.41 1noi s ARG 649 Ca 0.75 -1.17 -0.03 0.00 -0.47 0.00 0.00 55.73 54.81 1noi s ARG 649 Cb -0.46 0.57 0.52 0.00 -0.57 0.00 0.00 34.95 35.01 1noi s ARG 649 CO 0.33 -0.81 1.69 0.28 -1.08 0.00 0.00 175.30 175.71 1noi h VAL 650 N 2.07 0.53 0.00 4.99 2.07 -1.93 -0.99 116.25 122.98 1noi h VAL 650 Ca -0.23 -0.11 -0.07 0.00 0.82 0.00 0.00 66.70 67.11 1noi h VAL 650 Cb 1.25 0.17 -0.01 0.00 -1.52 0.00 0.00 31.29 31.18 1noi h VAL 650 CO 0.30 0.06 -0.31 0.77 0.02 0.00 0.00 177.57 178.41 1noi h SER 651 N 0.33 0.00 -0.13 0.57 4.64 -1.97 -2.52 113.55 114.48 1noi h SER 651 Ca 0.45 0.00 -0.20 0.00 -0.47 0.00 0.00 61.79 61.57 1noi h SER 651 Cb 0.78 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.87 1noi h SER 651 CO -0.50 0.31 -0.69 0.25 -0.87 0.00 0.00 176.83 175.33 1noi h LEU 652 N 0.00 0.88 -0.89 5.97 6.46 -1.56 -2.49 115.31 123.68 1noi h LEU 652 Ca -0.00 -0.54 0.12 0.00 -0.12 0.00 0.00 57.88 57.33 1noi h LEU 652 Cb 1.00 -0.26 -0.08 0.00 -0.73 0.00 0.00 40.66 40.59 1noi h LEU 652 CO 0.04 1.32 0.52 0.00 -0.62 0.00 0.00 178.44 179.70 1noi h ALA 653 N 0.67 1.31 0.00 1.25 0.00 -0.91 0.29 119.26 121.87 1noi h ALA 653 Ca -0.03 0.04 -0.08 0.00 0.00 0.00 0.00 54.91 54.84 1noi h ALA 653 Cb 1.30 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.95 1noi h ALA 653 CO 0.14 0.10 -0.38 0.93 0.00 0.00 0.00 179.25 180.04 1noi h GLU 654 N 0.82 0.00 0.09 0.00 5.08 -1.13 -2.07 114.58 117.37 1noi h GLU 654 Ca 0.45 0.00 -0.16 0.00 -1.00 0.00 0.00 59.36 58.65 1noi h GLU 654 Cb 0.47 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.74 1noi h GLU 654 CO -0.28 0.38 -0.67 0.87 -1.00 0.00 0.00 179.01 178.31 1noi h LYS 655 N 0.00 0.29 0.20 2.33 1.79 -0.72 -3.40 116.57 117.06 1noi h LYS 655 Ca -0.00 -0.43 -0.33 0.00 -2.18 0.00 0.00 60.65 57.70 1noi h LYS 655 Cb 0.77 0.15 0.02 0.00 -1.58 0.00 0.00 32.23 31.59 1noi h LYS 655 CO 0.05 1.18 -1.58 -0.24 -1.08 0.00 0.00 179.45 177.77 1noi h VAL 656 N -0.38 1.09 -0.98 0.50 3.04 -0.86 -3.32 116.25 115.33 1noi h VAL 656 Ca -0.11 -2.56 0.14 0.00 -1.01 0.00 0.00 66.70 63.16 1noi h VAL 656 Cb 1.48 2.88 -0.09 0.00 -2.01 0.00 0.00 31.29 33.55 1noi h VAL 656 CO 0.13 0.82 0.60 0.40 -1.01 0.00 0.00 177.57 178.51 1noi h ILE 657 N 0.05 0.84 0.00 3.17 2.04 -1.61 0.91 117.51 122.91 1noi h ILE 657 Ca -0.30 -0.31 0.00 0.00 1.00 0.00 0.00 64.86 65.25 1noi h ILE 657 Cb 2.07 -0.13 0.00 0.00 -0.74 0.00 0.00 36.82 38.02 1noi h ILE 657 CO 0.20 0.16 0.00 -0.81 0.00 0.00 0.00 178.15 177.70 1noi n PRO 658 N -4.69 0.04 0.00 2.37 -0.04 -1.25 -2.60 135.00 128.83 1noi n PRO 658 Ca 0.20 0.20 0.13 0.00 -0.04 0.00 0.00 63.50 64.00 1noi n PRO 658 Cb 0.42 -1.57 0.40 0.00 -0.04 0.00 0.00 33.50 32.71 1noi n PRO 658 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1noi n ALA 659 N -1.56 2.66 -2.09 0.55 0.00 0.30 -4.67 120.51 115.70 1noi n ALA 659 Ca 0.04 -0.49 -0.35 0.00 0.00 0.00 0.00 53.44 52.64 1noi n ALA 659 Cb 0.24 -1.08 -0.06 0.00 0.00 0.00 0.00 19.45 18.55 1noi n ALA 659 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1noi s ALA 660 N -2.09 3.37 -0.18 0.00 0.00 -1.07 -4.65 121.76 117.15 1noi s ALA 660 Ca 0.33 0.16 0.04 0.00 0.00 0.00 0.00 51.96 52.49 1noi s ALA 660 Cb 0.20 -2.83 -0.14 0.00 0.00 0.00 0.00 23.12 20.36 1noi s ALA 660 CO 0.36 0.32 -0.11 -0.25 0.00 0.00 0.00 175.76 176.08 1noi n ASP 661 N 0.42 2.23 -4.06 0.00 8.00 0.03 -4.13 116.55 119.04 1noi n ASP 661 Ca -0.00 -0.08 -0.27 0.00 0.71 0.00 0.00 54.79 55.15 1noi n ASP 661 Cb 0.52 -0.01 -0.17 0.00 -0.02 0.00 0.00 41.12 41.44 1noi n ASP 661 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 1noi s LEU 662 N -5.85 1.71 -0.35 0.64 0.20 -0.26 -0.63 118.68 114.14 1noi s LEU 662 Ca -0.21 -0.37 -0.16 0.00 0.69 0.00 0.00 54.13 54.08 1noi s LEU 662 Cb 0.06 -0.98 -0.01 0.00 -0.43 0.00 0.00 46.19 44.84 1noi s LEU 662 CO 0.48 0.04 0.43 -0.55 -0.29 0.00 0.00 176.35 176.46 1noi s SER 663 N 0.73 6.23 -0.36 3.68 0.15 0.76 -0.69 113.70 124.20 1noi s SER 663 Ca -0.13 -0.18 -0.18 0.00 0.70 0.00 0.00 55.95 56.17 1noi s SER 663 Cb -0.16 -2.23 -0.00 0.00 -1.71 0.00 0.00 66.02 61.92 1noi s SER 663 CO 0.03 -0.41 0.49 -1.61 1.20 0.00 0.00 173.24 172.94 1noi s GLU 664 N 2.17 3.53 -0.51 5.44 0.41 -0.74 -1.14 118.70 127.86 1noi s GLU 664 Ca 0.15 -0.29 0.07 0.00 -0.41 0.00 0.00 54.97 54.48 1noi s GLU 664 Cb -0.16 -3.83 0.23 0.00 -1.78 0.00 0.00 34.13 28.59 1noi s GLU 664 CO 0.12 -0.67 0.57 1.04 -0.49 0.00 0.00 175.26 175.84 1noi n GLN 665 N 5.70 1.39 -1.59 1.61 1.13 -0.81 -4.72 117.38 120.09 1noi n GLN 665 Ca -0.06 -3.84 -0.23 0.00 -1.94 0.00 0.00 57.00 50.93 1noi n GLN 665 Cb 0.49 -1.74 0.07 0.00 0.11 0.00 0.00 30.24 29.17 1noi n GLN 665 CO 0.00 0.00 0.00 0.44 -1.44 0.00 0.00 177.06 176.06 1noi n ILE 666 N 1.45 2.82 -1.70 5.09 -5.35 -1.26 -2.90 119.36 117.52 1noi n ILE 666 Ca 0.25 -3.59 -0.34 0.00 -0.27 0.00 0.00 62.75 58.80 1noi n ILE 666 Cb 0.46 -0.98 0.06 0.00 -1.74 0.00 0.00 39.64 37.45 1noi n ILE 666 CO 0.00 0.00 0.00 -0.94 -1.76 0.00 0.00 176.55 173.85 1noi s SER 667 N -2.93 4.79 0.44 7.28 1.04 -1.26 -4.59 113.70 118.46 1noi s SER 667 Ca 0.53 2.21 -0.26 0.00 0.48 0.00 0.00 55.95 58.92 1noi s SER 667 Cb 0.44 -2.58 -0.09 0.00 0.10 0.00 0.00 66.02 63.89 1noi s SER 667 CO 0.02 -1.86 1.42 -0.89 0.98 0.00 0.00 173.24 172.91 1noi s THR 668 N -2.05 2.13 0.35 2.02 2.01 -1.15 -4.71 115.64 114.26 1noi s THR 668 Ca 0.72 0.12 -0.28 0.00 0.31 0.00 0.00 61.69 62.56 1noi s THR 668 Cb -0.26 -3.07 -0.11 0.00 0.01 0.00 0.00 72.50 69.08 1noi s THR 668 CO 0.41 0.02 1.41 0.00 -0.69 0.00 0.00 174.62 175.77 1noi s ALA 669 N -1.20 3.54 0.00 7.40 0.00 -1.26 -2.17 121.76 128.07 1noi s ALA 669 Ca 0.60 1.44 0.00 0.00 0.00 0.00 0.00 51.96 54.00 1noi s ALA 669 Cb -0.43 -3.55 0.00 0.00 0.00 0.00 0.00 23.12 19.13 1noi s ALA 669 CO 0.56 -0.88 0.00 0.41 0.00 0.00 0.00 175.76 175.85 1noi n GLY 670 N 0.65 2.23 0.00 0.00 0.00 -1.26 -4.69 105.19 102.12 1noi n GLY 670 Ca 0.01 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.13 1noi n GLY 670 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1noi n THR 671 N -2.00 0.00 -3.65 2.61 -2.24 -0.92 -4.82 114.28 103.25 1noi n THR 671 Ca 0.00 -0.26 -0.38 0.00 -2.27 0.00 0.00 64.05 61.14 1noi n THR 671 Cb 0.00 0.50 -0.12 0.00 -2.10 0.00 0.00 70.33 68.61 1noi n THR 671 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 1noi s GLU 672 N -3.22 3.40 0.28 -0.78 2.56 -1.26 -4.95 118.70 114.74 1noi s GLU 672 Ca -0.00 -0.67 -0.02 0.00 0.00 0.00 0.00 54.97 54.27 1noi s GLU 672 Cb 0.15 -3.56 0.41 0.00 2.00 0.00 0.00 34.13 33.12 1noi s GLU 672 CO 0.87 -0.39 1.92 0.00 -0.56 0.00 0.00 175.26 177.10 1noi h ALA 673 N 8.35 1.40 0.00 6.30 0.00 -1.88 -3.17 119.26 130.26 1noi h ALA 673 Ca -0.33 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.54 1noi h ALA 673 Cb 1.15 -0.33 0.00 0.00 0.00 0.00 0.00 17.79 18.61 1noi h ALA 673 CO 0.61 0.51 0.00 0.45 0.00 0.00 0.00 179.25 180.82 1noi n SER 674 N -4.44 -1.43 0.00 0.00 2.88 -1.26 -4.18 113.62 105.18 1noi n SER 674 Ca 0.13 0.60 0.00 0.00 -1.33 0.00 0.00 58.87 58.26 1noi n SER 674 Cb 0.10 1.49 0.00 0.00 -0.75 0.00 0.00 64.21 65.05 1noi n SER 674 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1noi n GLY 675 N 0.54 -0.92 0.00 0.46 0.00 -1.26 -0.90 105.19 103.11 1noi n GLY 675 Ca 0.00 -1.61 0.00 0.00 0.00 0.00 0.00 46.02 44.41 1noi n GLY 675 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1noi n THR 676 N -0.65 0.00 0.01 2.61 -1.04 -1.26 -4.79 114.28 109.16 1noi n THR 676 Ca 0.00 0.00 0.09 0.00 -2.04 0.00 0.00 64.05 62.10 1noi n THR 676 Cb 0.00 0.00 0.52 0.00 -1.82 0.00 0.00 70.33 69.03 1noi n THR 676 CO 0.00 0.00 0.00 1.23 -0.64 0.00 0.00 175.07 175.66 1noi h GLY 677 N 0.00 0.43 0.97 3.41 0.00 -1.95 -2.58 103.07 103.34 1noi h GLY 677 Ca 0.00 -0.14 -0.00 0.00 0.00 0.00 0.00 47.33 47.19 1noi h GLY 677 CO 0.00 0.11 0.12 3.45 0.00 0.00 0.00 176.54 180.22 1noi h ASN 678 N 0.35 0.25 -0.34 0.19 -1.07 -1.95 -1.99 115.58 111.02 1noi h ASN 678 Ca 0.18 -0.05 -0.05 0.00 0.07 0.00 0.00 56.30 56.45 1noi h ASN 678 Cb 0.28 -0.06 -0.02 0.00 -2.07 0.00 0.00 38.32 36.45 1noi h ASN 678 CO -0.04 0.23 0.04 0.24 0.07 0.00 0.00 177.43 177.97 1noi h MET 679 N 0.25 0.67 -0.44 4.14 2.86 -1.80 -2.76 114.93 117.85 1noi h MET 679 Ca 0.07 -0.15 -0.08 0.00 -2.06 0.00 0.00 59.70 57.48 1noi h MET 679 Cb 0.03 -0.10 -0.01 0.00 0.06 0.00 0.00 31.60 31.58 1noi h MET 679 CO -0.01 0.66 -0.06 0.87 1.06 0.00 0.00 176.91 179.43 1noi h LYS 680 N 0.64 0.81 -0.78 1.72 1.57 -1.21 -2.61 116.57 116.72 1noi h LYS 680 Ca 0.14 -0.29 -0.05 0.00 -1.87 0.00 0.00 60.65 58.58 1noi h LYS 680 Cb 0.34 -0.06 -0.03 0.00 0.08 0.00 0.00 32.23 32.56 1noi h LYS 680 CO 0.01 0.90 0.30 0.74 -0.57 0.00 0.00 179.45 180.84 1noi h PHE 681 N 0.65 1.19 -0.92 -1.35 0.04 -1.22 -3.02 116.94 112.30 1noi h PHE 681 Ca 0.12 -0.09 -0.01 0.00 2.80 0.00 0.00 57.97 60.79 1noi h PHE 681 Cb 0.57 -0.36 -0.04 0.00 2.20 0.00 0.00 35.95 38.32 1noi h PHE 681 CO 0.04 0.91 0.55 1.98 -0.60 0.00 0.00 178.31 181.19 1noi h MET 682 N 1.13 1.25 0.00 1.51 4.05 -1.36 -2.24 114.93 119.27 1noi h MET 682 Ca 0.26 -0.11 -0.05 0.00 -0.28 0.00 0.00 59.70 59.51 1noi h MET 682 Cb 0.22 -0.26 -0.01 0.00 -0.80 0.00 0.00 31.60 30.75 1noi h MET 682 CO -0.02 0.88 -0.26 -0.07 0.23 0.00 0.00 176.91 177.67 1noi h LEU 683 N 1.27 0.00 -2.99 3.39 3.38 -1.35 -3.21 115.31 115.80 1noi h LEU 683 Ca 0.33 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.30 1noi h LEU 683 Cb -0.05 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.70 1noi h LEU 683 CO -0.06 0.26 0.00 0.59 0.09 0.00 0.00 178.44 179.32 1noi n ASN 684 N -3.65 4.16 -1.08 -0.43 3.02 -0.89 -4.93 115.26 111.47 1noi n ASN 684 Ca -0.01 -2.28 -0.03 0.00 -0.03 0.00 0.00 54.58 52.22 1noi n ASN 684 Cb 0.38 -0.49 0.01 0.00 -0.61 0.00 0.00 39.78 39.07 1noi n ASN 684 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1noi n GLY 685 N 1.06 0.61 3.55 7.41 0.00 -0.99 -4.76 105.19 112.07 1noi n GLY 685 Ca 0.23 -0.50 -0.28 0.00 0.00 0.00 0.00 46.02 45.47 1noi n GLY 685 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1noi s ALA 686 N -3.05 2.89 0.18 4.61 0.00 -0.91 -4.81 121.76 120.67 1noi s ALA 686 Ca 0.06 -1.41 0.01 0.00 0.00 0.00 0.00 51.96 50.62 1noi s ALA 686 Cb -0.03 -0.75 -0.04 0.00 0.00 0.00 0.00 23.12 22.31 1noi s ALA 686 CO 0.11 0.52 0.34 -0.51 0.00 0.00 0.00 175.76 176.22 1noi s LEU 687 N -2.58 4.28 -0.23 0.00 1.43 0.20 -4.36 118.68 117.43 1noi s LEU 687 Ca 0.23 0.28 -0.07 0.00 -1.03 0.00 0.00 54.13 53.54 1noi s LEU 687 Cb -0.10 -3.04 -0.03 0.00 0.03 0.00 0.00 46.19 43.06 1noi s LEU 687 CO 0.14 -0.00 0.05 -0.89 0.23 0.00 0.00 176.35 175.87 1noi s THR 688 N -1.82 4.26 -0.23 5.49 2.01 -1.26 -0.17 115.64 123.91 1noi s THR 688 Ca 0.36 -0.20 -0.10 0.00 0.31 0.00 0.00 61.69 62.07 1noi s THR 688 Cb -0.11 -2.96 -0.05 0.00 0.01 0.00 0.00 72.50 69.39 1noi s THR 688 CO 0.29 0.38 0.14 -0.51 -0.69 0.00 0.00 174.62 174.23 1noi s ILE 689 N 1.27 5.16 0.01 1.82 2.07 -0.29 -1.10 121.20 130.13 1noi s ILE 689 Ca 0.04 0.11 -0.29 0.00 -1.41 0.00 0.00 60.65 59.10 1noi s ILE 689 Cb -0.15 -3.40 0.10 0.00 0.13 0.00 0.00 42.46 39.15 1noi s ILE 689 CO 0.03 0.36 1.12 -0.83 -1.91 0.00 0.00 174.94 173.71 1noi s GLY 690 N 1.01 -0.35 0.65 1.50 0.00 -0.72 -1.92 107.32 107.49 1noi s GLY 690 Ca 0.07 0.72 -0.04 0.00 0.00 0.00 0.00 44.72 45.47 1noi s GLY 690 CO 0.04 0.18 0.93 -0.51 0.00 0.00 0.00 173.10 173.75 1noi s THR 691 N -2.78 2.41 -1.23 0.90 -4.23 -1.14 -2.09 115.64 107.48 1noi s THR 691 Ca 0.12 -0.40 -0.13 0.00 -1.18 0.00 0.00 61.69 60.09 1noi s THR 691 Cb 0.01 -3.00 0.16 0.00 1.34 0.00 0.00 72.50 71.01 1noi s THR 691 CO -0.03 -0.00 1.52 0.23 -0.54 0.00 0.00 174.62 175.80 1noi n MET 692 N -2.73 3.39 -3.93 3.99 2.81 -1.26 -4.67 117.12 114.72 1noi n MET 692 Ca 0.08 -3.76 -0.10 0.00 -1.81 0.00 0.00 57.70 52.11 1noi n MET 692 Cb 0.60 -3.06 -0.10 0.00 -0.71 0.00 0.00 33.22 29.95 1noi n MET 692 CO 0.00 0.00 0.00 0.34 1.51 0.00 0.00 175.97 177.82 1noi s ASP 693 N 2.66 0.14 0.81 7.83 2.15 -1.26 -4.52 116.67 124.49 1noi s ASP 693 Ca 0.43 -0.38 0.00 0.00 0.43 0.00 0.00 52.55 53.03 1noi s ASP 693 Cb -0.01 0.16 0.00 0.00 -0.30 0.00 0.00 42.92 42.77 1noi s ASP 693 CO 0.01 -0.35 0.00 0.61 -0.17 0.00 0.00 175.17 175.26 1noi n GLY 694 N 1.43 2.60 0.00 2.66 0.00 -1.20 -0.83 105.19 109.86 1noi n GLY 694 Ca -0.23 -0.25 0.13 0.00 0.00 0.00 0.00 46.02 45.67 1noi n GLY 694 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1noi n ALA 695 N 8.27 2.29 0.27 4.61 0.00 -0.08 -3.16 120.51 132.71 1noi n ALA 695 Ca 0.00 -0.11 0.11 0.00 0.00 0.00 0.00 53.44 53.45 1noi n ALA 695 Cb 0.00 -1.44 0.76 0.00 0.00 0.00 0.00 19.45 18.76 1noi n ALA 695 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.50 176.59 1noi h ASN 696 N 0.00 0.00 0.13 0.00 2.35 -1.18 0.56 115.58 117.45 1noi h ASN 696 Ca 0.00 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.74 1noi h ASN 696 Cb 0.41 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.78 1noi h ASN 696 CO 0.00 0.02 -0.06 0.58 -1.65 0.00 0.00 177.43 176.31 1noi h VAL 697 N 0.00 0.87 0.00 2.81 2.07 -1.55 -0.47 116.25 119.98 1noi h VAL 697 Ca -0.00 -0.00 -0.08 0.00 0.82 0.00 0.00 66.70 67.44 1noi h VAL 697 Cb 0.04 0.87 -0.01 0.00 -1.52 0.00 0.00 31.29 30.66 1noi h VAL 697 CO 0.00 0.00 -0.39 -0.33 0.02 0.00 0.00 177.57 176.87 1noi h GLU 698 N -0.18 0.00 -0.23 1.57 5.08 -1.16 -1.37 114.58 118.29 1noi h GLU 698 Ca -0.02 0.00 -0.11 0.00 -1.00 0.00 0.00 59.36 58.23 1noi h GLU 698 Cb 0.14 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.39 1noi h GLU 698 CO 0.03 0.39 -0.29 0.52 -1.00 0.00 0.00 179.01 178.66 1noi h MET 699 N 0.00 0.60 -0.12 2.33 2.86 -1.05 -0.44 114.93 119.11 1noi h MET 699 Ca -0.00 -0.34 -0.01 0.00 -2.06 0.00 0.00 59.70 57.28 1noi h MET 699 Cb 1.17 0.02 -0.00 0.00 0.06 0.00 0.00 31.60 32.85 1noi h MET 699 CO 0.05 0.94 0.02 0.00 1.06 0.00 0.00 176.91 178.99 1noi h ALA 700 N 0.65 0.15 -0.91 6.32 0.00 -0.91 -0.71 119.26 123.86 1noi h ALA 700 Ca 0.03 -0.15 0.13 0.00 0.00 0.00 0.00 54.91 54.92 1noi h ALA 700 Cb 0.86 -0.04 -0.07 0.00 0.00 0.00 0.00 17.79 18.53 1noi h ALA 700 CO 0.07 -0.20 0.58 1.49 0.00 0.00 0.00 179.25 181.19 1noi h GLU 701 N -0.03 0.76 0.08 0.00 4.81 -1.19 0.42 114.58 119.43 1noi h GLU 701 Ca 0.04 -0.05 -0.27 0.00 -0.13 0.00 0.00 59.36 58.94 1noi h GLU 701 Cb 0.28 -0.17 0.02 0.00 0.63 0.00 0.00 28.75 29.50 1noi h GLU 701 CO 0.00 0.51 -1.16 0.93 -0.73 0.00 0.00 179.01 178.56 1noi h GLU 702 N 0.79 0.52 0.00 1.92 4.39 -0.53 -3.32 114.58 118.34 1noi h GLU 702 Ca 0.45 -0.67 0.00 0.00 0.34 0.00 0.00 59.36 59.48 1noi h GLU 702 Cb 0.61 0.22 0.00 0.00 -0.10 0.00 0.00 28.75 29.48 1noi h GLU 702 CO -0.21 1.28 -0.50 0.00 -1.16 0.00 0.00 179.01 178.42 1noi h ALA 703 N 0.46 0.74 0.00 3.43 0.00 -0.63 -3.47 119.26 119.79 1noi h ALA 703 Ca -0.15 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.76 1noi h ALA 703 Cb 1.82 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.61 1noi h ALA 703 CO 0.21 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.87 1noi n GLY 704 N 1.17 -0.93 0.38 0.00 0.00 0.14 -4.49 105.19 101.46 1noi n GLY 704 Ca 0.02 -1.21 0.17 0.00 0.00 0.00 0.00 46.02 45.00 1noi n GLY 704 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1noi h GLU 705 N 0.00 0.37 -0.57 1.61 5.08 -1.90 -0.33 114.58 118.84 1noi h GLU 705 Ca 0.00 -0.02 0.16 0.00 -1.00 0.00 0.00 59.36 58.50 1noi h GLU 705 Cb 0.00 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.14 1noi h GLU 705 CO 0.00 0.24 0.41 0.93 -1.00 0.00 0.00 179.01 179.59 1noi h GLU 706 N 0.38 0.00 -0.15 2.33 3.07 -1.92 -0.90 114.58 117.39 1noi h GLU 706 Ca 0.38 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.24 1noi h GLU 706 Cb 0.93 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.84 1noi h GLU 706 CO -0.12 0.00 0.00 0.09 -1.40 0.00 0.00 179.01 177.58 1noi n ASN 707 N -4.36 2.49 -4.44 1.42 3.02 -0.13 -4.93 115.26 108.32 1noi n ASN 707 Ca 0.11 -1.82 -0.28 0.00 -0.03 0.00 0.00 54.58 52.55 1noi n ASN 707 Cb 0.64 -0.09 -0.12 0.00 -0.61 0.00 0.00 39.78 39.60 1noi n ASN 707 CO 0.00 0.00 0.00 0.12 -2.62 0.00 0.00 177.26 174.76 1noi s PHE 708 N -1.82 2.40 -1.05 3.10 5.36 -0.34 -4.80 117.98 120.82 1noi s PHE 708 Ca 0.34 -0.33 -0.04 0.00 -0.96 0.00 0.00 56.93 55.94 1noi s PHE 708 Cb 0.20 -1.25 0.30 0.00 -0.34 0.00 0.00 43.02 41.93 1noi s PHE 708 CO 0.30 0.41 1.36 1.19 -1.46 0.00 0.00 175.22 177.02 1noi n PHE 709 N 0.65 2.83 -2.18 10.12 3.72 -0.26 -4.95 117.46 127.39 1noi n PHE 709 Ca -0.15 -2.92 -0.40 0.00 -0.05 0.00 0.00 57.45 53.93 1noi n PHE 709 Cb 0.54 -1.27 -0.02 0.00 -0.94 0.00 0.00 39.48 37.79 1noi n PHE 709 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 176.76 177.13 1noi s ILE 710 N -2.53 2.87 0.34 4.37 -1.09 -1.25 -1.76 121.20 122.14 1noi s ILE 710 Ca 0.32 0.82 -0.11 0.00 -2.23 0.00 0.00 60.65 59.44 1noi s ILE 710 Cb 0.03 -3.50 0.02 0.00 -1.58 0.00 0.00 42.46 37.44 1noi s ILE 710 CO 0.07 0.15 0.63 0.72 -1.23 0.00 0.00 174.94 175.28 1noi s PHE 711 N -1.24 0.44 0.10 3.97 -0.71 -0.89 -4.90 117.98 114.75 1noi s PHE 711 Ca 0.52 -0.90 0.00 0.00 -1.04 0.00 0.00 56.93 55.52 1noi s PHE 711 Cb -0.36 0.42 0.00 0.00 -1.21 0.00 0.00 43.02 41.86 1noi s PHE 711 CO 0.47 -1.30 0.00 0.41 -1.34 0.00 0.00 175.22 173.46 1noi n GLY 712 N -0.51 -1.58 3.66 1.99 0.00 -1.26 -4.23 105.19 103.26 1noi n GLY 712 Ca -0.04 -1.18 -0.47 0.00 0.00 0.00 0.00 46.02 44.34 1noi n GLY 712 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 1noi n MET 713 N -2.25 2.04 -2.50 1.61 0.00 -1.26 -4.90 117.12 109.86 1noi n MET 713 Ca 0.00 0.74 -0.23 0.00 -0.00 0.00 0.00 57.70 58.21 1noi n MET 713 Cb 0.20 -2.50 0.06 0.00 0.00 0.00 0.00 33.22 30.99 1noi n MET 713 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 175.97 176.47 1noi s ARG 714 N 0.94 2.27 0.36 2.12 3.52 -1.26 -4.52 118.95 122.39 1noi s ARG 714 Ca 0.80 -0.70 0.11 0.00 -0.13 0.00 0.00 55.73 55.81 1noi s ARG 714 Cb -0.71 -2.37 0.88 0.00 -1.56 0.00 0.00 34.95 31.20 1noi s ARG 714 CO 0.39 -1.00 1.85 0.28 -0.81 0.00 0.00 175.30 176.01 1noi h VAL 715 N -0.23 0.76 -0.48 7.11 2.07 -1.83 -0.65 116.25 123.00 1noi h VAL 715 Ca -0.42 -0.21 0.05 0.00 0.82 0.00 0.00 66.70 66.94 1noi h VAL 715 Cb 1.30 0.09 -0.05 0.00 -1.52 0.00 0.00 31.29 31.11 1noi h VAL 715 CO 0.52 0.11 0.21 -0.08 0.02 0.00 0.00 177.57 178.35 1noi h GLU 716 N 0.62 0.40 0.00 1.57 4.81 -1.96 -1.53 114.58 118.49 1noi h GLU 716 Ca 0.48 -0.02 -0.15 0.00 -0.13 0.00 0.00 59.36 59.54 1noi h GLU 716 Cb 0.89 -0.09 -0.02 0.00 0.63 0.00 0.00 28.75 30.16 1noi h GLU 716 CO -0.23 0.27 -0.71 -0.44 -0.73 0.00 0.00 179.01 177.17 1noi h ASP 717 N 0.42 0.00 0.22 1.04 3.32 -1.51 -2.02 116.42 117.89 1noi h ASP 717 Ca 0.22 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.26 1noi h ASP 717 Cb 0.17 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.72 1noi h ASP 717 CO -0.18 0.71 -0.11 0.58 -1.72 0.00 0.00 179.24 178.52 1noi h VAL 718 N 0.00 0.85 -0.31 -1.35 2.07 -0.55 -1.93 116.25 115.03 1noi h VAL 718 Ca -0.01 -0.66 0.07 0.00 0.82 0.00 0.00 66.70 66.92 1noi h VAL 718 Cb 1.33 1.23 -0.07 0.00 -1.52 0.00 0.00 31.29 32.26 1noi h VAL 718 CO 0.09 0.14 -0.15 0.44 0.02 0.00 0.00 177.57 178.11 1noi h ASP 719 N -0.65 -0.52 -0.54 0.57 3.32 -1.36 -0.39 116.42 116.85 1noi h ASP 719 Ca -0.03 0.12 0.09 0.00 0.02 0.00 0.00 57.03 57.23 1noi h ASP 719 Cb 0.46 0.28 -0.07 0.00 0.22 0.00 0.00 39.33 40.22 1noi h ASP 719 CO 0.05 -0.19 0.15 0.03 -1.72 0.00 0.00 179.24 177.56 1noi h ARG 720 N -0.11 0.29 -0.37 3.56 2.47 -1.20 -0.96 114.38 118.06 1noi h ARG 720 Ca 0.16 -0.02 -0.08 0.00 -1.26 0.00 0.00 59.98 58.78 1noi h ARG 720 Cb 0.35 -0.07 -0.02 0.00 -1.65 0.00 0.00 29.97 28.59 1noi h ARG 720 CO -0.38 0.19 -0.10 1.25 0.56 0.00 0.00 179.97 181.49 1noi h LEU 721 N 0.30 0.62 -0.95 3.04 5.85 -0.45 -1.03 115.31 122.69 1noi h LEU 721 Ca 0.27 -0.17 -0.10 0.00 0.84 0.00 0.00 57.88 58.72 1noi h LEU 721 Cb 0.36 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 41.21 1noi h LEU 721 CO -0.32 0.76 -0.39 0.44 -0.34 0.00 0.00 178.44 178.59 1noi h ASP 722 N 0.59 0.28 1.29 1.25 3.32 -0.26 0.70 116.42 123.59 1noi h ASP 722 Ca 0.11 -0.11 0.00 0.00 0.02 0.00 0.00 57.03 57.04 1noi h ASP 722 Cb 0.52 -0.08 0.00 0.00 0.22 0.00 0.00 39.33 39.99 1noi h ASP 722 CO 0.03 0.65 0.00 0.00 -1.72 0.00 0.00 179.24 178.20 1noi n GLN 723 N -4.05 0.20 -0.01 3.56 6.02 -0.43 -3.73 117.38 118.95 1noi n GLN 723 Ca -0.01 0.20 0.04 0.00 -0.01 0.00 0.00 57.00 57.22 1noi n GLN 723 Cb 0.46 -1.75 -0.09 0.00 1.02 0.00 0.00 30.24 29.88 1noi n GLN 723 CO 0.00 0.00 0.00 2.89 -1.01 0.00 0.00 177.06 178.94 1noi n ARG 724 N -2.11 0.60 0.00 -1.09 1.85 -0.94 -5.08 116.66 109.89 1noi n ARG 724 Ca 0.05 -0.09 0.00 0.00 -1.00 0.00 0.00 57.85 56.81 1noi n ARG 724 Cb 0.39 -1.28 0.00 0.00 -1.05 0.00 0.00 32.46 30.52 1noi n ARG 724 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1noi n GLY 725 N 1.90 2.03 3.64 2.89 0.00 0.20 -5.03 105.19 110.81 1noi n GLY 725 Ca -0.04 -1.04 -0.43 0.00 0.00 0.00 0.00 46.02 44.51 1noi n GLY 725 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1noi s TYR 726 N 0.00 3.22 -0.34 1.61 5.04 -1.24 -4.92 117.35 120.72 1noi s TYR 726 Ca 0.00 1.14 0.00 0.00 -2.44 0.00 0.00 57.07 55.78 1noi s TYR 726 Cb 0.00 -3.41 0.11 0.00 0.35 0.00 0.00 41.96 39.00 1noi s TYR 726 CO 0.00 -0.62 0.12 1.21 -1.34 0.00 0.00 175.55 174.93 1noi s ASN 727 N 1.52 4.01 0.54 4.32 3.04 -1.26 -4.96 114.94 122.15 1noi s ASN 727 Ca 0.41 -1.88 0.31 0.00 0.04 0.00 0.00 52.86 51.73 1noi s ASN 727 Cb -0.14 -0.96 1.48 0.00 -1.54 0.00 0.00 41.25 40.09 1noi s ASN 727 CO 0.12 -0.38 1.90 0.00 -3.04 0.00 0.00 177.10 175.69 1noi h ALA 728 N 7.77 2.79 -0.92 1.71 0.00 -1.88 0.25 119.26 128.98 1noi h ALA 728 Ca -0.10 -0.03 0.07 0.00 0.00 0.00 0.00 54.91 54.85 1noi h ALA 728 Cb 1.00 0.06 -0.06 0.00 0.00 0.00 0.00 17.79 18.79 1noi h ALA 728 CO 0.47 -1.05 0.60 0.37 0.00 0.00 0.00 179.25 179.64 1noi h GLN 729 N 0.00 1.00 -0.43 0.00 5.75 -1.92 -0.79 115.11 118.72 1noi h GLN 729 Ca 0.40 -0.06 -0.07 0.00 -0.15 0.00 0.00 58.65 58.77 1noi h GLN 729 Cb 1.63 -0.23 -0.02 0.00 1.07 0.00 0.00 27.48 29.93 1noi h GLN 729 CO -0.00 0.66 -0.03 1.05 -2.65 0.00 0.00 178.83 177.86 1noi h GLU 730 N 1.03 0.73 -0.32 1.69 4.11 -1.36 0.11 114.58 120.58 1noi h GLU 730 Ca 0.40 -0.20 -0.12 0.00 0.07 0.00 0.00 59.36 59.51 1noi h GLU 730 Cb 0.23 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.39 1noi h GLU 730 CO -0.16 0.76 -0.30 1.88 0.07 0.00 0.00 179.01 181.27 1noi h TYR 731 N 0.68 0.76 -0.01 2.06 0.05 -1.63 -1.86 116.97 117.02 1noi h TYR 731 Ca 0.13 -0.19 -0.00 0.00 0.05 0.00 0.00 58.73 58.72 1noi h TYR 731 Cb 0.47 -0.18 -0.00 0.00 1.01 0.00 0.00 36.73 38.03 1noi h TYR 731 CO 0.02 0.88 0.01 -0.92 -1.05 0.00 0.00 178.16 177.10 1noi h TYR 732 N 0.57 0.02 -0.62 4.88 3.20 0.67 -2.68 116.97 123.01 1noi h TYR 732 Ca 0.07 -0.00 -0.06 0.00 3.14 0.00 0.00 58.73 61.88 1noi h TYR 732 Cb 0.79 -0.01 -0.03 0.00 1.54 0.00 0.00 36.73 39.03 1noi h TYR 732 CO 0.04 0.08 0.14 -0.44 -1.64 0.00 0.00 178.16 176.34 1noi h ASP 733 N -0.04 0.95 1.38 -2.11 3.32 -1.07 -3.25 116.42 115.60 1noi h ASP 733 Ca 0.01 -0.24 -0.07 0.00 0.02 0.00 0.00 57.03 56.75 1noi h ASP 733 Cb 0.06 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 39.35 1noi h ASP 733 CO -0.00 0.94 -0.33 0.08 -1.72 0.00 0.00 179.24 178.21 1noi h ARG 734 N 0.91 0.00 -4.42 3.56 0.11 -1.36 -3.44 114.38 109.74 1noi h ARG 734 Ca 0.19 0.00 -0.71 0.00 0.10 0.00 0.00 59.98 59.57 1noi h ARG 734 Cb 0.37 0.00 -0.32 0.00 1.11 0.00 0.00 29.97 31.13 1noi h ARG 734 CO 0.00 0.33 -0.49 0.42 0.10 0.00 0.00 179.97 180.34 1noi s ILE 735 N -3.23 3.71 0.28 0.08 1.01 -1.01 -4.94 121.20 117.09 1noi s ILE 735 Ca 0.03 -1.87 0.01 0.00 0.00 0.00 0.00 60.65 58.82 1noi s ILE 735 Cb 0.08 -3.46 0.10 0.00 0.01 0.00 0.00 42.46 39.19 1noi s ILE 735 CO 0.70 -0.69 1.76 -0.65 0.00 0.00 0.00 174.94 176.07 1noi h PRO 736 N 8.23 0.62 0.00 2.79 0.11 -1.86 0.36 132.00 142.25 1noi h PRO 736 Ca -0.17 -0.19 -0.05 0.00 0.11 0.00 0.00 66.00 65.70 1noi h PRO 736 Cb 1.06 -0.06 -0.01 0.00 0.11 0.00 0.00 31.00 32.10 1noi h PRO 736 CO 0.76 0.71 -0.23 0.93 -0.21 0.00 0.00 178.00 179.96 1noi h GLU 737 N 0.57 0.00 -0.00 1.05 3.07 -1.95 -0.75 114.58 116.57 1noi h GLU 737 Ca 0.10 0.00 -0.00 0.00 -0.50 0.00 0.00 59.36 58.96 1noi h GLU 737 Cb 0.52 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.43 1noi h GLU 737 CO 0.03 0.23 -0.01 1.25 -1.40 0.00 0.00 179.01 179.12 1noi h LEU 738 N 0.00 0.01 -0.86 1.33 5.85 -0.71 -3.06 115.31 117.87 1noi h LEU 738 Ca -0.00 -0.63 0.22 0.00 0.84 0.00 0.00 57.88 58.31 1noi h LEU 738 Cb 0.47 -0.00 -0.14 0.00 0.37 0.00 0.00 40.66 41.36 1noi h LEU 738 CO 0.03 0.64 0.21 -0.09 -0.34 0.00 0.00 178.44 178.88 1noi h ARG 739 N -0.62 0.19 -0.00 1.25 2.43 -0.78 -1.48 114.38 115.38 1noi h ARG 739 Ca -0.00 -0.01 -0.00 0.00 -0.81 0.00 0.00 59.98 59.16 1noi h ARG 739 Cb 0.63 -0.04 -0.00 0.00 -0.42 0.00 0.00 29.97 30.14 1noi h ARG 739 CO 0.00 0.13 0.00 0.37 -1.51 0.00 0.00 179.97 178.96 1noi h GLN 740 N 0.20 0.01 0.29 0.20 4.15 -1.12 -1.02 115.11 117.82 1noi h GLN 740 Ca 0.53 -0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.95 1noi h GLN 740 Cb 1.05 -0.00 -0.03 0.00 0.21 0.00 0.00 27.48 28.71 1noi h GLN 740 CO -0.65 0.29 -0.34 0.82 -1.93 0.00 0.00 178.83 177.02 1noi h ILE 741 N -0.28 0.30 -0.69 2.39 1.08 -1.28 -1.67 117.51 117.37 1noi h ILE 741 Ca 0.00 0.00 0.06 0.00 -0.39 0.00 0.00 64.86 64.54 1noi h ILE 741 Cb 0.29 0.30 -0.06 0.00 -3.07 0.00 0.00 36.82 34.28 1noi h ILE 741 CO 0.00 0.00 0.38 0.40 -0.69 0.00 0.00 178.15 178.24 1noi h ILE 742 N -0.67 0.95 -0.12 -0.67 1.08 -1.26 0.53 117.51 117.34 1noi h ILE 742 Ca -0.01 -0.24 -0.08 0.00 -0.39 0.00 0.00 64.86 64.14 1noi h ILE 742 Cb 0.63 0.20 -0.01 0.00 -3.07 0.00 0.00 36.82 34.57 1noi h ILE 742 CO -0.09 0.13 -0.30 -0.33 -0.69 0.00 0.00 178.15 176.86 1noi h GLU 743 N 0.69 0.24 -0.35 2.37 4.39 -0.97 -2.53 114.58 118.43 1noi h GLU 743 Ca 0.31 -0.09 0.01 0.00 0.34 0.00 0.00 59.36 59.93 1noi h GLU 743 Cb 0.22 -0.02 -0.02 0.00 -0.10 0.00 0.00 28.75 28.83 1noi h GLU 743 CO -0.20 0.52 0.21 1.96 -1.16 0.00 0.00 179.01 180.35 1noi h GLN 744 N 0.21 0.42 0.18 2.33 4.20 -0.02 0.75 115.11 123.18 1noi h GLN 744 Ca 0.03 -0.03 -0.01 0.00 0.06 0.00 0.00 58.65 58.71 1noi h GLN 744 Cb 0.65 -0.10 0.00 0.00 0.30 0.00 0.00 27.48 28.33 1noi h GLN 744 CO 0.05 0.28 -0.09 -0.07 -0.67 0.00 0.00 178.83 178.33 1noi h LEU 745 N 0.43 -0.20 -0.93 1.46 3.38 -0.76 -1.62 115.31 117.07 1noi h LEU 745 Ca 0.13 -0.11 0.09 0.00 0.09 0.00 0.00 57.88 58.08 1noi h LEU 745 Cb -0.02 0.05 -0.07 0.00 0.09 0.00 0.00 40.66 40.71 1noi h LEU 745 CO -0.05 -0.01 0.58 0.28 0.09 0.00 0.00 178.44 179.33 1noi h SER 746 N -0.39 0.88 -0.01 -0.43 0.02 -1.23 -2.89 113.55 109.51 1noi h SER 746 Ca -0.02 0.03 0.00 0.00 -0.84 0.00 0.00 61.79 60.96 1noi h SER 746 Cb 0.30 -0.15 0.00 0.00 0.14 0.00 0.00 62.40 62.69 1noi h SER 746 CO 0.04 0.52 0.00 -1.54 -1.14 0.00 0.00 176.83 174.71 1noi n SER 747 N -4.62 0.09 0.00 3.07 3.41 0.24 -4.58 113.62 111.23 1noi n SER 747 Ca 0.15 -1.49 0.00 0.00 -0.26 0.00 0.00 58.87 57.28 1noi n SER 747 Cb 0.26 -0.01 0.00 0.00 -0.26 0.00 0.00 64.21 64.20 1noi n SER 747 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1noi n GLY 748 N 0.78 0.47 0.19 5.00 0.00 -1.03 -4.91 105.19 105.70 1noi n GLY 748 Ca 0.13 -0.87 -0.11 0.00 0.00 0.00 0.00 46.02 45.17 1noi n GLY 748 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1noi h PHE 749 N 0.00 0.66 -0.05 1.61 3.57 -1.48 0.21 116.94 121.45 1noi h PHE 749 Ca 0.00 -0.14 0.00 0.00 3.53 0.00 0.00 57.97 61.36 1noi h PHE 749 Cb 0.00 -0.16 0.00 0.00 2.79 0.00 0.00 35.95 38.58 1noi h PHE 749 CO 0.00 0.77 0.00 1.19 -2.23 0.00 0.00 178.31 178.04 1noi n PHE 750 N -4.48 0.06 -3.09 0.41 3.72 -1.26 -4.26 117.46 108.57 1noi n PHE 750 Ca -0.03 -0.03 -0.16 0.00 -0.05 0.00 0.00 57.45 57.18 1noi n PHE 750 Cb 0.32 0.00 -0.01 0.00 -0.94 0.00 0.00 39.48 38.85 1noi n PHE 750 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 1noi n SER 751 N 0.21 0.42 -0.32 4.37 3.41 -1.06 -4.73 113.62 115.91 1noi n SER 751 Ca 0.18 -3.08 0.25 0.00 -0.26 0.00 0.00 58.87 55.97 1noi n SER 751 Cb 0.35 -0.25 0.55 0.00 -0.26 0.00 0.00 64.21 64.60 1noi n SER 751 CO 0.00 0.00 0.00 1.55 -0.16 0.00 0.00 175.04 176.43 1noi h PRO 752 N 2.99 0.31 0.00 4.33 0.13 -1.14 -0.31 132.00 138.31 1noi h PRO 752 Ca 0.06 -0.02 -0.14 0.00 -0.87 0.00 0.00 66.00 65.03 1noi h PRO 752 Cb 1.01 -0.07 -0.02 0.00 0.13 0.00 0.00 31.00 32.05 1noi h PRO 752 CO 0.44 0.20 -0.66 -0.22 -0.23 0.00 0.00 178.00 177.54 1noi h LYS 753 N 0.32 0.00 -2.67 0.86 1.63 -1.95 -3.36 116.57 111.41 1noi h LYS 753 Ca 0.59 0.00 -0.60 0.00 -0.85 0.00 0.00 60.65 59.80 1noi h LYS 753 Cb 1.65 0.00 -0.39 0.00 -0.60 0.00 0.00 32.23 32.88 1noi h LYS 753 CO -0.25 0.66 -0.83 -0.65 -3.45 0.00 0.00 179.45 174.92 1noi s GLN 754 N -3.19 1.04 0.35 1.90 1.11 -0.14 -5.03 119.66 115.70 1noi s GLN 754 Ca 0.01 -1.96 0.11 0.00 0.01 0.00 0.00 55.36 53.53 1noi s GLN 754 Cb 0.10 -1.82 0.89 0.00 -1.01 0.00 0.00 33.01 31.17 1noi s GLN 754 CO 0.76 -1.26 1.80 -1.35 0.01 0.00 0.00 175.29 175.24 1noi h PRO 755 N 6.33 0.60 -0.82 2.91 0.11 -1.68 -1.80 132.00 137.65 1noi h PRO 755 Ca 0.12 -0.04 -0.50 0.00 0.11 0.00 0.00 66.00 65.69 1noi h PRO 755 Cb 0.92 -0.13 -0.27 0.00 0.11 0.00 0.00 31.00 31.62 1noi h PRO 755 CO 0.40 0.39 0.36 -0.40 -0.21 0.00 0.00 178.00 178.54 1noi n ASP 756 N -4.68 4.97 -0.20 -2.05 5.68 -1.26 -2.45 116.55 116.56 1noi n ASP 756 Ca 0.23 -3.74 0.01 0.00 -0.50 0.00 0.00 54.79 50.79 1noi n ASP 756 Cb 0.65 -0.77 0.10 0.00 -1.14 0.00 0.00 41.12 39.96 1noi n ASP 756 CO 0.00 0.00 0.00 0.25 -1.33 0.00 0.00 177.20 176.12 1noi h LEU 757 N 1.51 -0.18 -3.42 -2.12 5.85 -1.65 -2.47 115.31 112.82 1noi h LEU 757 Ca 0.50 0.14 -0.37 0.00 0.84 0.00 0.00 57.88 58.98 1noi h LEU 757 Cb 1.71 0.23 -0.21 0.00 0.37 0.00 0.00 40.66 42.75 1noi h LEU 757 CO 1.06 -0.07 0.47 0.49 -0.34 0.00 0.00 178.44 180.05 1noi n PHE 758 N -5.23 2.15 0.02 1.25 3.72 -1.26 -4.48 117.46 113.62 1noi n PHE 758 Ca 0.09 -1.53 -0.15 0.00 -0.05 0.00 0.00 57.45 55.81 1noi n PHE 758 Cb 0.34 -0.78 -0.09 0.00 -0.94 0.00 0.00 39.48 38.01 1noi n PHE 758 CO 0.00 0.00 0.00 -0.22 -0.05 0.00 0.00 176.76 176.49 1noi h LYS 759 N 0.79 -0.58 -0.37 -1.08 3.11 -1.80 -1.47 116.57 115.17 1noi h LYS 759 Ca 0.44 0.04 -0.00 0.00 -2.81 0.00 0.00 60.65 58.32 1noi h LYS 759 Cb 2.16 0.13 -0.02 0.00 -1.00 0.00 0.00 32.23 33.51 1noi h LYS 759 CO 0.80 -0.39 0.21 -0.44 -2.81 0.00 0.00 179.45 176.83 1noi h ASP 760 N -0.60 0.44 0.04 4.20 5.19 -1.85 -0.81 116.42 123.03 1noi h ASP 760 Ca 0.03 -0.02 -0.00 0.00 -0.62 0.00 0.00 57.03 56.42 1noi h ASP 760 Cb 0.69 -0.11 0.00 0.00 0.18 0.00 0.00 39.33 40.09 1noi h ASP 760 CO -0.40 0.35 -0.02 0.40 -3.12 0.00 0.00 179.24 176.45 1noi h ILE 761 N 0.51 1.36 -0.04 0.35 2.04 -1.77 -2.03 117.51 117.94 1noi h ILE 761 Ca 0.13 -1.50 0.03 0.00 1.00 0.00 0.00 64.86 64.53 1noi h ILE 761 Cb 0.00 2.32 -0.04 0.00 -0.74 0.00 0.00 36.82 38.36 1noi h ILE 761 CO -0.02 0.37 -0.19 0.58 0.00 0.00 0.00 178.15 178.88 1noi h VAL 762 N -0.74 0.54 -0.93 1.67 2.07 -0.39 -1.12 116.25 117.36 1noi h VAL 762 Ca -0.01 0.00 0.15 0.00 0.82 0.00 0.00 66.70 67.66 1noi h VAL 762 Cb 0.64 0.54 -0.08 0.00 -1.52 0.00 0.00 31.29 30.87 1noi h VAL 762 CO 0.01 0.00 0.59 0.78 0.02 0.00 0.00 177.57 178.97 1noi h ASN 763 N -0.29 0.71 -0.05 0.57 2.35 -1.27 0.23 115.58 117.83 1noi h ASN 763 Ca 0.07 0.05 -0.08 0.00 -0.55 0.00 0.00 56.30 55.79 1noi h ASN 763 Cb 0.38 -0.09 0.00 0.00 0.05 0.00 0.00 38.32 38.66 1noi h ASN 763 CO -0.20 0.35 -0.28 -0.03 -1.65 0.00 0.00 177.43 175.62 1noi h MET 764 N 0.75 0.28 -0.64 0.81 4.05 -0.58 0.25 114.93 119.85 1noi h MET 764 Ca 0.47 -0.23 0.03 0.00 -0.28 0.00 0.00 59.70 59.69 1noi h MET 764 Cb 0.71 0.05 -0.04 0.00 -0.80 0.00 0.00 31.60 31.52 1noi h MET 764 CO -0.23 0.88 0.39 1.25 0.23 0.00 0.00 176.91 179.43 1noi h LEU 765 N -0.25 0.64 0.14 3.39 5.85 -0.91 0.46 115.31 124.64 1noi h LEU 765 Ca -0.02 0.00 -0.28 0.00 0.84 0.00 0.00 57.88 58.43 1noi h LEU 765 Cb 0.94 -0.14 0.03 0.00 0.37 0.00 0.00 40.66 41.86 1noi h LEU 765 CO 0.06 0.45 -1.17 0.24 -0.34 0.00 0.00 178.44 177.68 1noi h MET 766 N 0.77 0.54 0.00 1.25 2.86 -0.54 -3.40 114.93 116.41 1noi h MET 766 Ca 0.26 -0.77 -0.06 0.00 -2.06 0.00 0.00 59.70 57.07 1noi h MET 766 Cb 0.02 0.26 -0.01 0.00 0.06 0.00 0.00 31.60 31.94 1noi h MET 766 CO -0.11 1.35 -1.34 0.72 1.06 0.00 0.00 176.91 178.59 1noi n HIS 767 N -3.87 0.00 -2.82 -0.22 8.25 0.87 -4.33 115.22 113.10 1noi n HIS 767 Ca -0.14 0.00 -0.11 0.00 -0.26 0.00 0.00 57.72 57.21 1noi n HIS 767 Cb 0.96 -0.22 0.07 0.00 1.12 0.00 0.00 29.99 31.92 1noi n HIS 767 CO 0.00 0.00 0.00 -2.39 0.64 0.00 0.00 176.34 174.59 1noi n HIS 768 N -1.98 -2.14 -3.25 4.41 -0.00 0.12 -5.01 115.22 107.37 1noi n HIS 768 Ca -0.06 -2.48 -0.44 0.00 -0.00 0.00 0.00 57.72 54.75 1noi n HIS 768 Cb 0.44 1.17 -0.06 0.00 -0.00 0.00 0.00 29.99 31.54 1noi n HIS 768 CO 0.00 0.00 0.00 0.34 -0.00 0.00 0.00 176.34 176.68 1noi s ASP 769 N -1.54 6.19 0.54 4.39 2.15 0.12 -4.77 116.67 123.74 1noi s ASP 769 Ca 0.26 -1.19 0.30 0.00 0.43 0.00 0.00 52.55 52.35 1noi s ASP 769 Cb 0.31 -2.25 1.54 0.00 -0.30 0.00 0.00 42.92 42.23 1noi s ASP 769 CO -0.06 -0.82 2.08 0.03 -0.17 0.00 0.00 175.17 176.23 1noi h ARG 770 N 8.92 0.00 -0.69 4.34 3.08 -1.96 -3.17 114.38 124.90 1noi h ARG 770 Ca -0.28 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.77 1noi h ARG 770 Cb 1.10 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.15 1noi h ARG 770 CO 0.95 0.09 0.00 1.19 -1.07 0.00 0.00 179.97 181.13 1noi n PHE 771 N -3.46 1.29 -4.29 3.04 3.72 -1.26 -4.98 117.46 111.52 1noi n PHE 771 Ca -0.01 -0.55 -0.37 0.00 -0.05 0.00 0.00 57.45 56.47 1noi n PHE 771 Cb 0.24 -0.15 -0.04 0.00 -0.94 0.00 0.00 39.48 38.59 1noi n PHE 771 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34 1noi n LYS 772 N 1.32 -2.50 -0.27 -1.08 5.02 -1.20 -4.72 118.16 114.74 1noi n LYS 772 Ca 0.25 0.31 0.08 0.00 -2.02 0.00 0.00 58.31 56.92 1noi n LYS 772 Cb 0.78 -4.89 0.22 0.00 -0.02 0.00 0.00 35.03 31.12 1noi n LYS 772 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 1noi h VAL 773 N -1.39 0.58 -0.37 -0.18 2.07 -1.94 -1.92 116.25 113.10 1noi h VAL 773 Ca -0.60 -0.14 -0.10 0.00 0.82 0.00 0.00 66.70 66.68 1noi h VAL 773 Cb 1.39 0.13 -0.02 0.00 -1.52 0.00 0.00 31.29 31.27 1noi h VAL 773 CO 0.79 0.08 -0.16 -0.26 0.02 0.00 0.00 177.57 178.04 1noi h PHE 774 N 0.42 0.76 -0.70 1.57 0.04 -1.90 -2.75 116.94 114.37 1noi h PHE 774 Ca 0.46 -0.15 0.16 0.00 2.80 0.00 0.00 57.97 61.24 1noi h PHE 774 Cb 0.77 -0.19 -0.04 0.00 2.20 0.00 0.00 35.95 38.68 1noi h PHE 774 CO -0.17 0.80 0.48 0.00 -0.60 0.00 0.00 178.31 178.82 1noi h ALA 775 N 1.21 2.25 -0.01 2.45 0.00 -1.73 -2.82 119.26 120.61 1noi h ALA 775 Ca 0.10 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1noi h ALA 775 Cb 0.62 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.38 1noi h ALA 775 CO 0.04 -0.45 -0.40 -0.25 0.00 0.00 0.00 179.25 178.20 1noi n ASP 776 N -4.44 1.51 -0.17 0.00 8.00 -1.14 -4.71 116.55 115.60 1noi n ASP 776 Ca 0.13 -1.26 -0.07 0.00 0.71 0.00 0.00 54.79 54.31 1noi n ASP 776 Cb 0.57 0.55 -0.01 0.00 -0.02 0.00 0.00 41.12 42.21 1noi n ASP 776 CO 0.00 0.00 0.00 0.22 -0.39 0.00 0.00 177.20 177.03 1noi h TYR 777 N 1.55 -1.03 -0.01 1.24 3.20 -1.22 -1.28 116.97 119.42 1noi h TYR 777 Ca 0.00 0.07 -0.00 0.00 3.14 0.00 0.00 58.73 61.94 1noi h TYR 777 Cb 0.53 0.53 -0.00 0.00 1.54 0.00 0.00 36.73 39.33 1noi h TYR 777 CO 0.00 -0.40 -0.00 1.49 -1.64 0.00 0.00 178.16 177.61 1noi h GLU 778 N -0.22 0.03 -0.53 1.82 4.81 -1.84 0.19 114.58 118.83 1noi h GLU 778 Ca 0.19 -0.01 0.08 0.00 -0.13 0.00 0.00 59.36 59.49 1noi h GLU 778 Cb 0.56 -0.00 -0.06 0.00 0.63 0.00 0.00 28.75 29.87 1noi h GLU 778 CO -0.63 0.39 0.19 0.93 -0.73 0.00 0.00 179.01 179.16 1noi h GLU 779 N -0.34 0.36 -0.04 1.92 5.08 -1.87 -1.86 114.58 117.83 1noi h GLU 779 Ca 0.00 -0.02 0.04 0.00 -1.00 0.00 0.00 59.36 58.38 1noi h GLU 779 Cb 0.38 -0.08 -0.05 0.00 0.50 0.00 0.00 28.75 29.50 1noi h GLU 779 CO 0.00 0.24 -0.25 -0.92 -1.00 0.00 0.00 179.01 177.08 1noi h TYR 780 N 0.37 -0.66 0.00 4.33 3.20 -0.73 -1.02 116.97 122.45 1noi h TYR 780 Ca 0.26 0.02 0.00 0.00 3.14 0.00 0.00 58.73 62.16 1noi h TYR 780 Cb 0.29 0.30 0.00 0.00 1.54 0.00 0.00 36.73 38.86 1noi h TYR 780 CO -0.17 -0.33 0.00 -0.39 -1.64 0.00 0.00 178.16 175.63 1noi h VAL 781 N -0.36 0.00 -0.05 1.81 -1.51 0.14 -1.13 116.25 115.15 1noi h VAL 781 Ca 0.07 -0.44 -0.04 0.00 -1.23 0.00 0.00 66.70 65.06 1noi h VAL 781 Cb 0.46 1.33 0.00 0.00 -2.13 0.00 0.00 31.29 30.96 1noi h VAL 781 CO -0.25 0.00 -0.14 0.11 -1.23 0.00 0.00 177.57 176.07 1noi h LYS 782 N 0.00 0.17 -0.68 5.19 1.79 -0.88 -3.03 116.57 119.13 1noi h LYS 782 Ca 0.00 -0.13 0.01 0.00 -2.18 0.00 0.00 60.65 58.35 1noi h LYS 782 Cb 0.58 0.02 -0.03 0.00 -1.58 0.00 0.00 32.23 31.21 1noi h LYS 782 CO 0.00 0.75 0.45 0.00 -1.08 0.00 0.00 179.45 179.57 1noi h GLN 784 N 0.91 0.00 -0.44 0.00 1.08 -1.19 -1.72 115.11 113.74 1noi h GLN 784 Ca 0.25 0.00 -0.08 0.00 -1.45 0.00 0.00 58.65 57.37 1noi h GLN 784 Cb -0.09 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.33 1noi h GLN 784 CO -0.06 0.27 -0.05 0.93 -0.95 0.00 0.00 178.83 178.97 1noi h GLU 785 N 0.00 0.81 -0.87 1.46 5.08 -1.07 -2.11 114.58 117.87 1noi h GLU 785 Ca -0.00 -0.28 0.05 0.00 -1.00 0.00 0.00 59.36 58.13 1noi h GLU 785 Cb 0.48 -0.06 -0.05 0.00 0.50 0.00 0.00 28.75 29.62 1noi h GLU 785 CO 0.03 0.90 0.57 0.00 -1.00 0.00 0.00 179.01 179.51 1noi h ARG 786 N 0.65 0.98 0.68 2.33 3.08 -0.88 -1.69 114.38 119.53 1noi h ARG 786 Ca 0.12 -0.06 -0.03 0.00 0.07 0.00 0.00 59.98 60.08 1noi h ARG 786 Cb 0.57 -0.22 -0.01 0.00 0.08 0.00 0.00 29.97 30.39 1noi h ARG 786 CO 0.03 0.65 -0.50 0.28 -1.07 0.00 0.00 179.97 179.37 1noi h VAL 787 N 1.01 0.00 -0.97 2.04 2.07 -1.13 -2.81 116.25 116.46 1noi h VAL 787 Ca 0.36 0.00 0.24 0.00 0.82 0.00 0.00 66.70 68.13 1noi h VAL 787 Cb 0.15 0.00 -0.13 0.00 -1.52 0.00 0.00 31.29 29.79 1noi h VAL 787 CO -0.13 0.00 0.52 0.28 0.02 0.00 0.00 177.57 178.26 1noi h SER 788 N -1.13 0.54 -0.60 0.57 0.02 -0.67 -0.97 113.55 111.31 1noi h SER 788 Ca -0.09 0.15 -0.10 0.00 -0.84 0.00 0.00 61.79 60.91 1noi h SER 788 Cb 0.93 0.08 -0.02 0.00 0.14 0.00 0.00 62.40 63.53 1noi h SER 788 CO 0.04 0.04 -0.02 0.00 -1.14 0.00 0.00 176.83 175.76 1noi h ALA 789 N 1.74 0.80 0.00 3.77 0.00 -1.37 -0.81 119.26 123.39 1noi h ALA 789 Ca 0.62 -0.32 -0.15 0.00 0.00 0.00 0.00 54.91 55.07 1noi h ALA 789 Cb 1.21 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.76 1noi h ALA 789 CO -0.51 0.66 -0.71 1.25 0.00 0.00 0.00 179.25 179.94 1noi h LEU 790 N 0.96 0.00 -0.71 0.00 5.85 -0.95 -2.90 115.31 117.55 1noi h LEU 790 Ca 0.17 0.00 -0.10 0.00 0.84 0.00 0.00 57.88 58.78 1noi h LEU 790 Cb 0.58 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.59 1noi h LEU 790 CO 0.03 0.71 -0.14 0.22 -0.34 0.00 0.00 178.44 178.93 1noi h TYR 791 N 0.00 0.94 0.00 1.25 3.20 -0.64 -0.59 116.97 121.14 1noi h TYR 791 Ca -0.01 -0.19 0.00 0.00 3.14 0.00 0.00 58.73 61.67 1noi h TYR 791 Cb 1.29 -0.24 0.00 0.00 1.54 0.00 0.00 36.73 39.33 1noi h TYR 791 CO 0.00 0.93 0.00 1.17 -1.64 0.00 0.00 178.16 178.62 1noi n LYS 792 N -4.14 0.04 -3.89 1.82 4.81 -0.36 -3.89 118.16 112.55 1noi n LYS 792 Ca 0.01 0.47 -0.29 0.00 -0.87 0.00 0.00 58.31 57.63 1noi n LYS 792 Cb 0.39 -1.61 -0.13 0.00 0.02 0.00 0.00 35.03 33.70 1noi n LYS 792 CO 0.00 0.00 0.00 1.21 1.17 0.00 0.00 177.40 179.78 1noi s ASN 793 N -3.27 4.28 0.51 3.14 2.47 -0.23 -4.99 114.94 116.85 1noi s ASN 793 Ca 0.01 -3.19 0.22 0.00 0.42 0.00 0.00 52.86 50.32 1noi s ASN 793 Cb 0.04 -1.52 1.36 0.00 -1.45 0.00 0.00 41.25 39.68 1noi s ASN 793 CO 0.11 -0.20 2.10 -0.65 -3.72 0.00 0.00 177.10 174.75 1noi h PRO 794 N 6.21 0.00 -0.11 0.43 0.11 -1.77 0.14 132.00 137.02 1noi h PRO 794 Ca -0.00 0.00 -0.18 0.00 0.11 0.00 0.00 66.00 65.92 1noi h PRO 794 Cb 0.86 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.97 1noi h PRO 794 CO 0.66 0.09 -0.69 -0.09 -0.21 0.00 0.00 178.00 177.76 1noi h ARG 795 N 0.00 0.49 0.18 1.05 2.43 -1.93 -1.64 114.38 114.95 1noi h ARG 795 Ca -0.00 -0.38 -0.26 0.00 -0.81 0.00 0.00 59.98 58.53 1noi h ARG 795 Cb 0.19 0.07 0.02 0.00 -0.42 0.00 0.00 29.97 29.84 1noi h ARG 795 CO 0.01 1.00 -1.20 0.93 -1.51 0.00 0.00 179.97 179.21 1noi h GLU 796 N 0.34 0.39 -0.04 0.20 4.39 -1.45 -1.73 114.58 116.67 1noi h GLU 796 Ca -0.02 -0.66 0.04 0.00 0.34 0.00 0.00 59.36 59.05 1noi h GLU 796 Cb 1.27 0.25 -0.05 0.00 -0.10 0.00 0.00 28.75 30.11 1noi h GLU 796 CO 0.12 1.32 -0.28 2.35 -1.16 0.00 0.00 179.01 181.36 1noi h TRP 797 N -0.15 -0.75 -0.64 4.33 7.01 -0.81 -1.48 115.95 123.46 1noi h TRP 797 Ca -0.22 0.03 -0.07 0.00 2.11 0.00 0.00 58.89 60.74 1noi h TRP 797 Cb 1.88 0.34 -0.03 0.00 -2.10 0.00 0.00 29.16 29.25 1noi h TRP 797 CO 0.16 -0.37 0.13 1.15 -2.79 0.00 0.00 178.44 176.72 1noi h THR 798 N -0.40 1.25 -0.62 2.65 2.02 -1.39 -1.78 112.91 114.65 1noi h THR 798 Ca 0.07 -0.96 -0.05 0.00 0.77 0.00 0.00 66.41 66.25 1noi h THR 798 Cb 0.50 0.62 -0.03 0.00 -1.74 0.00 0.00 68.15 67.51 1noi h THR 798 CO -0.27 0.36 0.19 0.03 0.37 0.00 0.00 175.52 176.20 1noi h ARG 799 N 0.97 0.94 -0.45 6.66 3.08 -1.00 0.20 114.38 124.78 1noi h ARG 799 Ca 0.20 -0.19 -0.08 0.00 0.07 0.00 0.00 59.98 59.98 1noi h ARG 799 Cb 0.38 -0.15 -0.02 0.00 0.08 0.00 0.00 29.97 30.27 1noi h ARG 799 CO 0.01 0.82 -0.04 1.98 -1.07 0.00 0.00 179.97 181.66 1noi h MET 800 N 0.91 0.82 -0.55 0.04 4.05 -1.06 -2.55 114.93 116.59 1noi h MET 800 Ca 0.20 -0.28 0.08 0.00 -0.28 0.00 0.00 59.70 59.42 1noi h MET 800 Cb 0.27 -0.06 -0.06 0.00 -0.80 0.00 0.00 31.60 30.94 1noi h MET 800 CO -0.01 0.90 0.20 0.28 0.23 0.00 0.00 176.91 178.52 1noi h VAL 801 N 0.66 0.81 -0.54 -5.77 2.07 -0.40 -2.13 116.25 110.95 1noi h VAL 801 Ca 0.12 -0.13 0.01 0.00 0.82 0.00 0.00 66.70 67.52 1noi h VAL 801 Cb 0.56 0.39 -0.03 0.00 -1.52 0.00 0.00 31.29 30.69 1noi h VAL 801 CO 0.03 0.07 0.36 0.40 0.02 0.00 0.00 177.57 178.45 1noi h ILE 802 N 0.39 1.12 -0.02 4.57 2.04 -0.31 0.93 117.51 126.24 1noi h ILE 802 Ca 0.27 -0.24 -0.06 0.00 1.00 0.00 0.00 64.86 65.82 1noi h ILE 802 Cb 0.30 0.35 -0.01 0.00 -0.74 0.00 0.00 36.82 36.73 1noi h ILE 802 CO -0.27 0.13 -0.29 -0.09 0.00 0.00 0.00 178.15 177.63 1noi h ARG 803 N 0.71 0.03 0.03 2.37 9.65 -1.04 -0.95 114.38 125.18 1noi h ARG 803 Ca 0.20 -0.01 -0.00 0.00 -1.10 0.00 0.00 59.98 59.07 1noi h ARG 803 Cb -0.04 -0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.54 1noi h ARG 803 CO -0.05 0.33 -0.02 -0.91 2.80 0.00 0.00 179.97 182.12 1noi h ASN 804 N 0.03 -0.04 -0.05 -3.80 2.35 -0.22 -3.25 115.58 110.60 1noi h ASN 804 Ca 0.00 -0.51 0.03 0.00 -0.55 0.00 0.00 56.30 55.27 1noi h ASN 804 Cb 0.54 0.01 -0.03 0.00 0.05 0.00 0.00 38.32 38.88 1noi h ASN 804 CO 0.04 0.70 -0.14 0.40 -1.65 0.00 0.00 177.43 176.78 1noi h ILE 805 N -0.97 0.65 -1.03 2.81 2.04 -1.29 -2.46 117.51 117.26 1noi h ILE 805 Ca -0.00 0.00 0.31 0.00 1.00 0.00 0.00 64.86 66.16 1noi h ILE 805 Cb 0.55 0.65 -0.14 0.00 -0.74 0.00 0.00 36.82 37.14 1noi h ILE 805 CO 0.01 0.00 0.60 0.00 0.00 0.00 0.00 178.15 178.76 1noi h ALA 806 N 0.79 1.99 -0.65 1.87 0.00 -1.32 -1.31 119.26 120.64 1noi h ALA 806 Ca 0.06 0.16 -0.17 0.00 0.00 0.00 0.00 54.91 54.96 1noi h ALA 806 Cb 0.29 0.11 -0.10 0.00 0.00 0.00 0.00 17.79 18.09 1noi h ALA 806 CO -0.17 -0.55 0.19 -2.37 0.00 0.00 0.00 179.25 176.35 1noi n THR 807 N -4.95 2.83 1.08 0.00 5.66 -0.94 -1.70 114.28 116.27 1noi n THR 807 Ca 0.30 -1.73 0.12 0.00 -3.05 0.00 0.00 64.05 59.70 1noi n THR 807 Cb 0.94 -0.34 0.18 0.00 -1.55 0.00 0.00 70.33 69.57 1noi n THR 807 CO 0.00 0.00 0.00 -1.54 -3.05 0.00 0.00 175.07 170.48 1noi n SER 808 N -0.19 1.07 0.04 1.09 3.41 -0.49 -4.50 113.62 114.04 1noi n SER 808 Ca 0.37 -0.85 0.22 0.00 -0.26 0.00 0.00 58.87 58.35 1noi n SER 808 Cb 1.30 0.39 0.70 0.00 -0.26 0.00 0.00 64.21 66.33 1noi n SER 808 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 1noi h GLY 809 N 4.95 0.00 2.00 5.00 0.00 -1.78 0.43 103.07 113.67 1noi h GLY 809 Ca 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 47.33 47.24 1noi h GLY 809 CO 0.00 0.00 -0.44 1.70 0.00 0.00 0.00 176.54 177.80 1noi h LYS 810 N 0.00 0.00 -0.99 4.80 3.64 -1.91 -3.20 116.57 118.91 1noi h LYS 810 Ca 0.25 0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.60 1noi h LYS 810 Cb 1.40 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 33.21 1noi h LYS 810 CO -0.00 0.44 0.03 1.19 -2.27 0.00 0.00 179.45 178.84 1noi n PHE 811 N -3.95 0.18 -3.89 1.91 3.72 0.14 -4.72 117.46 110.85 1noi n PHE 811 Ca -0.02 -0.45 -0.36 0.00 -0.05 0.00 0.00 57.45 56.57 1noi n PHE 811 Cb 0.47 -0.25 -0.07 0.00 -0.94 0.00 0.00 39.48 38.70 1noi n PHE 811 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 1noi s SER 812 N 0.63 6.27 0.16 4.37 0.15 -1.21 -0.01 113.70 124.06 1noi s SER 812 Ca 0.04 0.40 0.21 0.00 0.70 0.00 0.00 55.95 57.30 1noi s SER 812 Cb 0.03 -2.03 0.86 0.00 -1.71 0.00 0.00 66.02 63.16 1noi s SER 812 CO 0.01 0.37 1.63 -1.54 1.20 0.00 0.00 173.24 174.91 1noi n SER 813 N 2.26 0.43 0.16 5.45 3.41 -0.13 -0.23 113.62 124.99 1noi n SER 813 Ca -0.19 0.60 0.02 0.00 -0.26 0.00 0.00 58.87 59.04 1noi n SER 813 Cb 0.54 -0.70 0.34 0.00 -0.26 0.00 0.00 64.21 64.14 1noi n SER 813 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 1noi h ASP 814 N 0.00 0.07 -0.01 4.04 3.32 -1.92 0.91 116.42 122.83 1noi h ASP 814 Ca 0.00 -0.02 -0.06 0.00 0.02 0.00 0.00 57.03 56.97 1noi h ASP 814 Cb 0.34 -0.02 0.00 0.00 0.22 0.00 0.00 39.33 39.88 1noi h ASP 814 CO 0.00 0.41 -0.21 -0.09 -1.72 0.00 0.00 179.24 177.63 1noi h ARG 815 N 0.06 0.16 -0.33 3.56 1.12 -0.90 -2.22 114.38 115.84 1noi h ARG 815 Ca 0.01 -0.16 0.05 0.00 -1.11 0.00 0.00 59.98 58.77 1noi h ARG 815 Cb 0.64 0.04 -0.05 0.00 -0.01 0.00 0.00 29.97 30.59 1noi h ARG 815 CO 0.05 0.88 0.04 1.15 -3.11 0.00 0.00 179.97 178.98 1noi h THR 816 N -0.51 0.81 -0.53 0.20 2.02 -1.43 -2.94 112.91 110.54 1noi h THR 816 Ca -0.02 -0.05 -0.02 0.00 0.77 0.00 0.00 66.41 67.08 1noi h THR 816 Cb 0.95 0.65 -0.02 0.00 -1.74 0.00 0.00 68.15 67.99 1noi h THR 816 CO 0.04 0.03 0.23 0.40 0.37 0.00 0.00 175.52 176.59 1noi h ILE 817 N 0.15 1.21 -0.37 3.11 1.08 -0.83 -0.46 117.51 121.38 1noi h ILE 817 Ca 0.16 -0.61 0.08 0.00 -0.39 0.00 0.00 64.86 64.10 1noi h ILE 817 Cb 0.19 0.64 -0.02 0.00 -3.07 0.00 0.00 36.82 34.56 1noi h ILE 817 CO -0.23 0.24 0.26 0.00 -0.69 0.00 0.00 178.15 177.73 1noi h ALA 818 N 1.07 2.18 0.20 1.87 0.00 -1.27 -0.51 119.26 122.80 1noi h ALA 818 Ca 0.18 -0.01 -0.33 0.00 0.00 0.00 0.00 54.91 54.75 1noi h ALA 818 Cb 0.16 -0.02 0.02 0.00 0.00 0.00 0.00 17.79 17.95 1noi h ALA 818 CO -0.02 -0.27 -1.54 1.96 0.00 0.00 0.00 179.25 179.38 1noi h GLN 819 N 0.13 0.42 -0.26 0.00 4.20 -1.04 -1.74 115.11 116.82 1noi h GLN 819 Ca 0.17 -0.72 0.04 0.00 0.06 0.00 0.00 58.65 58.20 1noi h GLN 819 Cb 0.51 0.27 -0.04 0.00 0.30 0.00 0.00 27.48 28.53 1noi h GLN 819 CO -0.02 1.33 0.04 1.88 -0.67 0.00 0.00 178.83 181.39 1noi h TYR 820 N 0.12 0.07 -0.12 2.96 0.05 -0.79 0.31 116.97 119.56 1noi h TYR 820 Ca -0.27 0.02 0.04 0.00 0.05 0.00 0.00 58.73 58.57 1noi h TYR 820 Cb 2.10 0.01 -0.04 0.00 1.01 0.00 0.00 36.73 39.81 1noi h TYR 820 CO 0.10 0.01 -0.11 0.00 -1.05 0.00 0.00 178.16 177.11 1noi h ALA 821 N 1.20 -0.02 -0.01 3.88 0.00 -1.10 -0.06 119.26 123.14 1noi h ALA 821 Ca 0.12 0.05 -0.18 0.00 0.00 0.00 0.00 54.91 54.90 1noi h ALA 821 Cb 0.13 0.24 0.01 0.00 0.00 0.00 0.00 17.79 18.17 1noi h ALA 821 CO -0.17 -0.57 -0.68 0.00 0.00 0.00 0.00 179.25 177.84 1noi h ARG 822 N -0.13 0.48 0.00 0.00 3.08 -1.20 0.57 114.38 117.18 1noi h ARG 822 Ca 0.08 -0.50 0.00 0.00 0.07 0.00 0.00 59.98 59.63 1noi h ARG 822 Cb 0.25 0.14 0.00 0.00 0.08 0.00 0.00 29.97 30.44 1noi h ARG 822 CO -0.20 1.14 -1.60 0.39 -1.07 0.00 0.00 179.97 178.64 1noi n GLU 823 N -4.15 0.51 -0.01 0.04 1.02 0.09 -4.22 120.64 113.93 1noi n GLU 823 Ca -0.10 -0.10 -0.02 0.00 -0.02 0.00 0.00 57.16 56.91 1noi n GLU 823 Cb 0.71 -1.57 -0.01 0.00 -0.02 0.00 0.00 31.44 30.55 1noi n GLU 823 CO 0.00 0.00 0.00 -0.89 1.18 0.00 0.00 177.13 177.42 1noi n ILE 824 N -2.17 0.12 0.04 -3.67 5.41 -0.17 -4.89 119.36 114.03 1noi n ILE 824 Ca -0.02 -0.02 0.05 0.00 1.00 0.00 0.00 62.75 63.76 1noi n ILE 824 Cb 0.52 -1.53 -0.07 0.00 -0.71 0.00 0.00 39.64 37.85 1noi n ILE 824 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 176.55 177.34 1noi n TRP 825 N -3.09 0.75 -2.48 1.39 8.01 -0.43 -5.01 117.44 116.58 1noi n TRP 825 Ca -0.04 0.24 -0.00 0.00 -1.31 0.00 0.00 57.50 56.38 1noi n TRP 825 Cb 0.52 -0.94 0.00 0.00 -2.01 0.00 0.00 31.31 28.88 1noi n TRP 825 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1noi n GLY 826 N 1.32 0.89 3.30 6.99 0.00 0.19 -4.99 105.19 112.90 1noi n GLY 826 Ca -0.07 -0.65 -0.16 0.00 0.00 0.00 0.00 46.02 45.14 1noi n GLY 826 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1noi s VAL 827 N -3.01 0.91 -0.12 1.61 -7.23 -0.84 -5.02 120.40 106.71 1noi s VAL 827 Ca 0.01 -2.02 -0.01 0.00 -1.81 0.00 0.00 61.98 58.16 1noi s VAL 827 Cb -0.00 -2.27 -0.02 0.00 0.56 0.00 0.00 36.38 34.64 1noi s VAL 827 CO 0.01 -0.37 -0.10 -1.61 -0.31 0.00 0.00 175.10 172.73 1noi s GLU 828 N -3.88 3.27 0.58 4.82 0.41 -1.26 -4.04 118.70 118.59 1noi s GLU 828 Ca 0.27 -0.62 -0.18 0.00 -0.41 0.00 0.00 54.97 54.04 1noi s GLU 828 Cb 0.06 -2.68 -0.09 0.00 -1.78 0.00 0.00 34.13 29.64 1noi s GLU 828 CO 0.07 0.34 0.46 -2.30 -0.49 0.00 0.00 175.26 173.35 1noi n PRO 829 N 3.17 0.45 -3.80 0.39 -0.02 -1.26 -4.92 135.00 129.00 1noi n PRO 829 Ca -0.18 0.18 -0.13 0.00 -2.02 0.00 0.00 63.50 61.35 1noi n PRO 829 Cb 0.53 -1.65 -0.13 0.00 -0.02 0.00 0.00 33.50 32.23 1noi n PRO 829 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1noi s SER 830 N -1.18 -0.14 -0.04 2.55 0.15 0.40 -5.02 113.70 110.41 1noi s SER 830 Ca 0.67 0.30 0.15 0.00 0.70 0.00 0.00 55.95 57.78 1noi s SER 830 Cb -0.44 0.27 0.50 0.00 -1.71 0.00 0.00 66.02 64.64 1noi s SER 830 CO 0.56 -0.08 1.40 0.54 1.20 0.00 0.00 173.24 176.85 1noi n ARG 831 N 3.39 2.59 -2.57 5.44 1.74 -1.26 -2.85 116.66 123.14 1noi n ARG 831 Ca -0.17 -2.00 -0.35 0.00 -0.77 0.00 0.00 57.85 54.56 1noi n ARG 831 Cb 0.57 -1.56 -0.04 0.00 -1.02 0.00 0.00 32.46 30.41 1noi n ARG 831 CO 0.00 0.00 0.00 1.14 -1.52 0.00 0.00 177.63 177.25 1noi s GLN 832 N -1.51 3.97 -0.09 5.56 -2.07 -1.26 -4.87 119.66 119.39 1noi s GLN 832 Ca 0.37 1.40 -0.30 0.00 -1.82 0.00 0.00 55.36 55.00 1noi s GLN 832 Cb 0.21 -2.26 -0.03 0.00 -1.09 0.00 0.00 33.01 29.83 1noi s GLN 832 CO 0.21 -0.29 1.35 0.50 -1.32 0.00 0.00 175.29 175.74 1noi s ARG 833 N -2.96 4.26 0.42 9.60 6.06 -1.26 -4.78 118.95 130.29 1noi s ARG 833 Ca 0.63 1.82 -0.15 0.00 -2.50 0.00 0.00 55.73 55.53 1noi s ARG 833 Cb -0.18 -3.72 -0.08 0.00 0.06 0.00 0.00 34.95 31.03 1noi s ARG 833 CO 0.22 -0.65 0.85 -1.17 -2.50 0.00 0.00 175.30 172.04 1noi s LEU 834 N 3.10 3.86 -0.00 -0.88 2.96 0.61 -5.03 118.68 123.29 1noi s LEU 834 Ca 0.60 1.38 -0.24 0.00 -0.22 0.00 0.00 54.13 55.64 1noi s LEU 834 Cb -0.26 -4.25 -0.16 0.00 0.50 0.00 0.00 46.19 42.02 1noi s LEU 834 CO 0.21 -0.39 1.17 -0.65 -1.32 0.00 0.00 176.35 175.38 1noi h PRO 835 N 1.54 -0.34 -1.57 0.98 0.11 -1.92 -3.41 132.00 127.39 1noi h PRO 835 Ca -0.48 0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.66 1noi h PRO 835 Cb 1.18 0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.37 1noi h PRO 835 CO 0.63 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 178.42 1noi n ALA 836 N -2.48 -0.94 -1.06 -0.75 0.00 -1.26 -4.89 120.51 109.14 1noi n ALA 836 Ca -0.09 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 53.06 1noi n ALA 836 Cb 0.26 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.66 1noi n ALA 836 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1noi n PRO 837 N 0.15 2.86 0.00 0.00 -0.04 -1.26 -4.98 135.00 131.73 1noi n PRO 837 Ca 0.00 -1.73 0.00 0.00 -0.04 0.00 0.00 63.50 61.73 1noi n PRO 837 Cb 0.00 -2.53 0.00 0.00 -0.04 0.00 0.00 33.50 30.93 1noi n PRO 837 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06